USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 0 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 110 THR OG1 : rot -17:sc= 1.31 USER MOD Set 1.2: A 139 TYR OH : rot 31:sc= 0.171 USER MOD Set 2.1: A 138 HIS : no HE2:sc= -0.767 K(o=-3.7,f=-6.4) USER MOD Set 2.2: A 141 GLN : amide:sc= -2.97! C(o=-3.7!,f=-3!) USER MOD Set 3.1: A 113 SER OG : rot 110:sc= 0.0493 USER MOD Set 3.2: A 116 HIS : no HE2:sc= -6.05! C(o=-7.4!,f=-6.1!) USER MOD Set 3.3: A 119 LYS NZ :NH3+ -139:sc= -1.42! (180deg=0) USER MOD Set 4.1: A 109 ASN : amide:sc= -0.894 K(o=-0.75,f=-1.4) USER MOD Set 4.2: A 111 TYR OH : rot 56:sc= 0.142 USER MOD Set 5.1: A 90 SER OG : rot -83:sc= 1.24 USER MOD Set 5.2: A 97 CYS SG : rot -171:sc= 0.428 USER MOD Set 6.1: A 72 SER OG : rot -81:sc= 1 USER MOD Set 6.2: A 75 THR OG1 : rot 143:sc= 0.431 USER MOD Set 7.1: A 59 GLN : amide:sc= 0.566 K(o=1.8,f=0.94) USER MOD Set 7.2: A 61 SER OG : rot 80:sc= 1.2 USER MOD Set 8.1: A 54 GLN : amide:sc= 1.03 K(o=-5,f=-6) USER MOD Set 8.2: A 55 HIS : no HD1:sc= -6.06! C(o=-5!,f=-7.2!) USER MOD Set 9.1: A 48 THR OG1 : rot 148:sc= 0.799 USER MOD Set 9.2: A 52 SER OG : rot -141:sc= 0.742 USER MOD Set10.1: A 30 CYS SG : rot 102:sc= -0.157! USER MOD Set10.2: A 32 ASN : amide:sc= 0.38 K(o=-1.4,f=-12!) USER MOD Set10.3: A 35 HIS : no HD1:sc= -1.61 X(o=-1.4,f=-1.7) USER MOD Single : A 31 SER OG : rot -127:sc= 0.621 USER MOD Single : A 44 THR OG1 : rot -120:sc= -0.133 USER MOD Single : A 57 GLN : amide:sc= 0.568 K(o=0.57,f=-1.7!) USER MOD Single : A 64 SER OG : rot 180:sc= 0.535 USER MOD Single : A 69 TYR OH : rot 142:sc= 0.102 USER MOD Single : A 71 LYS NZ :NH3+ 166:sc= -0.0244 (180deg=-0.362) USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.767 USER MOD Single : A 77 GLN : amide:sc= -0.466 K(o=-0.47,f=-3.2!) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 169:sc= -3.42! (180deg=-3.69!) USER MOD Single : A 83 THR OG1 : rot -29:sc= 0.383 USER MOD Single : A 88 TYR OH : rot 180:sc= -0.818 USER MOD Single : A 91 GLN : amide:sc= 0.082 K(o=0.082,f=-4!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.35 USER MOD Single : A 94 ASN : amide:sc= -0.436 K(o=-0.44,f=-5.1!) USER MOD Single : A 106 ASN : amide:sc= 0.0851 K(o=0.085,f=-0.87) USER MOD Single : A 107 HIS : no HD1:sc= -0.281 X(o=-0.28,f=-0.72) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -168:sc= -0.309 (180deg=-0.454) USER MOD Single : A 128 ASN : amide:sc= -0.446 X(o=-0.45,f=0) USER MOD Single : A 130 SER OG : rot 80:sc= 1.25 USER MOD Single : A 131 CYS SG : rot -140:sc= -2.31 USER MOD Single : A 132 LYS NZ :NH3+ 149:sc= -0.136 (180deg=-0.689) USER MOD Single : A 137 THR OG1 : rot 130:sc= 1.44 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N CYS A 30 -9.016 4.745 3.077 1.00 0.00 N ATOM 22 CA CYS A 30 -9.374 3.359 2.702 1.00 0.00 C ATOM 23 C CYS A 30 -10.685 2.908 3.335 1.00 0.00 C ATOM 24 O CYS A 30 -10.876 3.051 4.543 1.00 0.00 O ATOM 25 CB CYS A 30 -8.305 2.331 3.112 1.00 0.00 C ATOM 26 SG CYS A 30 -7.689 2.524 4.817 1.00 0.00 S ATOM 0 HA CYS A 30 -9.463 3.391 1.616 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -8.720 1.329 3.000 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -7.463 2.406 2.424 1.00 0.00 H new ATOM 0 HG CYS A 30 -8.246 1.633 5.583 1.00 0.00 H new ATOM 27 N SER A 31 -11.441 2.141 2.552 1.00 0.00 N ATOM 28 CA SER A 31 -12.712 1.575 3.028 1.00 0.00 C ATOM 29 C SER A 31 -12.504 0.207 3.716 1.00 0.00 C ATOM 30 O SER A 31 -12.732 -0.858 3.137 1.00 0.00 O ATOM 31 CB SER A 31 -13.743 1.497 1.893 1.00 0.00 C ATOM 32 OG SER A 31 -13.223 0.670 0.849 1.00 0.00 O ATOM 0 H SER A 31 -11.202 1.896 1.591 1.00 0.00 H new ATOM 0 HA SER A 31 -13.113 2.250 3.784 1.00 0.00 H new ATOM 0 HB2 SER A 31 -14.682 1.088 2.265 1.00 0.00 H new ATOM 0 HB3 SER A 31 -13.959 2.495 1.511 1.00 0.00 H new ATOM 0 HG SER A 31 -13.261 1.155 -0.002 1.00 0.00 H new ATOM 33 N ASN A 32 -11.698 0.296 4.767 1.00 0.00 N ATOM 34 CA ASN A 32 -11.490 -0.827 5.709 1.00 0.00 C ATOM 35 C ASN A 32 -12.041 -0.518 7.113 1.00 0.00 C ATOM 36 O ASN A 32 -12.871 -1.248 7.656 1.00 0.00 O ATOM 37 CB ASN A 32 -10.012 -1.264 5.671 1.00 0.00 C ATOM 38 CG ASN A 32 -8.998 -0.524 6.547 1.00 0.00 C ATOM 39 OD1 ASN A 32 -8.943 0.695 6.659 1.00 0.00 O ATOM 40 ND2 ASN A 32 -8.042 -1.288 6.987 1.00 0.00 N ATOM 0 H ASN A 32 -11.168 1.136 5.000 1.00 0.00 H new ATOM 0 HA ASN A 32 -12.077 -1.688 5.389 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -9.973 -2.319 5.942 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.672 -1.188 4.638 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -7.225 -0.875 7.436 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -8.109 -2.300 6.883 1.00 0.00 H new ATOM 41 N GLY A 33 -11.570 0.609 7.645 1.00 0.00 N ATOM 42 CA GLY A 33 -11.971 1.292 8.885 1.00 0.00 C ATOM 43 C GLY A 33 -11.431 2.711 8.670 1.00 0.00 C ATOM 44 O GLY A 33 -12.171 3.693 8.619 1.00 0.00 O ATOM 0 H GLY A 33 -10.824 1.121 7.175 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.052 1.285 9.021 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -11.536 0.821 9.767 1.00 0.00 H new ATOM 45 N GLY A 34 -10.113 2.741 8.560 1.00 0.00 N ATOM 46 CA GLY A 34 -9.430 3.688 7.671 1.00 0.00 C ATOM 47 C GLY A 34 -8.146 4.294 8.221 1.00 0.00 C ATOM 48 O GLY A 34 -8.125 4.875 9.299 1.00 0.00 O ATOM 0 H GLY A 34 -9.486 2.121 9.074 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.199 3.179 6.735 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.120 4.497 7.432 1.00 0.00 H new ATOM 49 N HIS A 35 -7.079 4.085 7.448 1.00 0.00 N ATOM 50 CA HIS A 35 -5.721 4.553 7.779 1.00 0.00 C ATOM 51 C HIS A 35 -5.019 5.047 6.492 1.00 0.00 C ATOM 52 O HIS A 35 -5.621 5.064 5.413 1.00 0.00 O ATOM 53 CB HIS A 35 -4.912 3.372 8.334 1.00 0.00 C ATOM 54 CG HIS A 35 -5.660 2.388 9.231 1.00 0.00 C ATOM 55 ND1 HIS A 35 -6.429 1.392 8.803 1.00 0.00 N ATOM 56 CD2 HIS A 35 -5.716 2.441 10.551 1.00 0.00 C ATOM 57 CE1 HIS A 35 -6.979 0.822 9.868 1.00 0.00 C ATOM 58 NE2 HIS A 35 -6.553 1.488 10.935 1.00 0.00 N ATOM 0 H HIS A 35 -7.128 3.581 6.563 1.00 0.00 H new ATOM 0 HA HIS A 35 -5.783 5.360 8.510 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -4.498 2.817 7.492 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.069 3.772 8.897 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -5.183 3.128 11.192 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -7.648 -0.026 9.867 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -6.827 1.296 11.899 1.00 0.00 H new ATOM 59 N PHE A 36 -3.691 5.097 6.544 1.00 0.00 N ATOM 60 CA PHE A 36 -2.847 5.434 5.380 1.00 0.00 C ATOM 61 C PHE A 36 -1.736 4.400 5.232 1.00 0.00 C ATOM 62 O PHE A 36 -1.359 3.741 6.189 1.00 0.00 O ATOM 63 CB PHE A 36 -2.264 6.844 5.494 1.00 0.00 C ATOM 64 CG PHE A 36 -3.084 7.845 4.690 1.00 0.00 C ATOM 65 CD1 PHE A 36 -3.252 7.664 3.292 1.00 0.00 C ATOM 66 CD2 PHE A 36 -3.665 8.949 5.345 1.00 0.00 C ATOM 67 CE1 PHE A 36 -4.010 8.592 2.553 1.00 0.00 C ATOM 68 CE2 PHE A 36 -4.431 9.881 4.610 1.00 0.00 C ATOM 69 CZ PHE A 36 -4.588 9.691 3.221 1.00 0.00 C ATOM 0 H PHE A 36 -3.159 4.906 7.393 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.474 5.416 4.488 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -2.240 7.147 6.541 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.234 6.844 5.138 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -2.800 6.817 2.797 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -3.525 9.082 6.408 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -4.147 8.464 1.489 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -4.889 10.725 5.104 1.00 0.00 H new ATOM 0 HZ PHE A 36 -5.166 10.406 2.654 1.00 0.00 H new ATOM 70 N LEU A 37 -1.258 4.269 3.995 1.00 0.00 N ATOM 71 CA LEU A 37 -0.087 3.433 3.663 1.00 0.00 C ATOM 72 C LEU A 37 1.158 3.806 4.487 1.00 0.00 C ATOM 73 O LEU A 37 1.918 2.941 4.908 1.00 0.00 O ATOM 74 CB LEU A 37 0.192 3.543 2.155 1.00 0.00 C ATOM 75 CG LEU A 37 -0.980 2.985 1.334 1.00 0.00 C ATOM 76 CD1 LEU A 37 -0.921 3.494 -0.103 1.00 0.00 C ATOM 77 CD2 LEU A 37 -1.018 1.452 1.365 1.00 0.00 C ATOM 0 H LEU A 37 -1.668 4.738 3.187 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.319 2.400 3.922 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.363 4.586 1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 37 1.104 2.998 1.910 1.00 0.00 H new ATOM 0 HG LEU A 37 -1.901 3.344 1.793 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.760 3.087 -0.668 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.975 4.583 -0.106 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.015 3.176 -0.563 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.861 1.097 0.773 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.091 1.057 0.950 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -1.129 1.112 2.395 1.00 0.00 H new ATOM 78 N ARG A 38 1.247 5.094 4.813 1.00 0.00 N ATOM 79 CA ARG A 38 2.275 5.771 5.630 1.00 0.00 C ATOM 80 C ARG A 38 3.746 5.593 5.238 1.00 0.00 C ATOM 81 O ARG A 38 4.404 6.582 4.956 1.00 0.00 O ATOM 82 CB ARG A 38 1.960 5.644 7.132 1.00 0.00 C ATOM 83 CG ARG A 38 2.919 6.462 8.012 1.00 0.00 C ATOM 84 CD ARG A 38 2.474 6.777 9.457 1.00 0.00 C ATOM 85 NE ARG A 38 2.208 5.546 10.199 1.00 0.00 N ATOM 86 CZ ARG A 38 2.396 5.343 11.500 1.00 0.00 C ATOM 87 NH1 ARG A 38 3.060 6.199 12.269 1.00 0.00 N ATOM 88 NH2 ARG A 38 1.821 4.314 12.098 1.00 0.00 N ATOM 0 H ARG A 38 0.543 5.757 4.488 1.00 0.00 H new ATOM 0 HA ARG A 38 2.180 6.824 5.363 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.937 5.974 7.313 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.013 4.595 7.422 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.867 5.927 8.062 1.00 0.00 H new ATOM 0 HG3 ARG A 38 3.113 7.408 7.507 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.249 7.352 9.964 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.578 7.397 9.439 1.00 0.00 H new ATOM 0 HE ARG A 38 1.840 4.760 9.663 1.00 0.00 H new ATOM 0 HH11 ARG A 38 3.449 7.051 11.866 1.00 0.00 H new ATOM 0 HH12 ARG A 38 3.181 6.004 13.263 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.233 3.676 11.562 1.00 0.00 H new ATOM 0 HH22 ARG A 38 1.965 4.158 13.096 1.00 0.00 H new ATOM 89 N ILE A 39 4.246 4.361 5.157 1.00 0.00 N ATOM 90 CA ILE A 39 5.667 4.035 4.857 1.00 0.00 C ATOM 91 C ILE A 39 6.600 4.844 5.772 1.00 0.00 C ATOM 92 O ILE A 39 7.298 5.798 5.428 1.00 0.00 O ATOM 93 CB ILE A 39 6.013 4.193 3.361 1.00 0.00 C ATOM 94 CG1 ILE A 39 4.902 3.752 2.401 1.00 0.00 C ATOM 95 CG2 ILE A 39 7.222 3.294 3.081 1.00 0.00 C ATOM 96 CD1 ILE A 39 4.344 4.929 1.593 1.00 0.00 C ATOM 0 H ILE A 39 3.671 3.530 5.299 1.00 0.00 H new ATOM 0 HA ILE A 39 5.821 2.978 5.072 1.00 0.00 H new ATOM 0 HB ILE A 39 6.187 5.255 3.187 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.291 2.995 1.719 1.00 0.00 H new ATOM 0 HG13 ILE A 39 4.096 3.286 2.968 1.00 0.00 H new ATOM 0 HG21 ILE A 39 7.501 3.376 2.030 1.00 0.00 H new ATOM 0 HG22 ILE A 39 8.060 3.607 3.704 1.00 0.00 H new ATOM 0 HG23 ILE A 39 6.966 2.259 3.309 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.559 4.573 0.925 1.00 0.00 H new ATOM 0 HD12 ILE A 39 3.931 5.674 2.273 1.00 0.00 H new ATOM 0 HD13 ILE A 39 5.144 5.379 1.005 1.00 0.00 H new ATOM 97 N LEU A 40 6.662 4.255 6.947 1.00 0.00 N ATOM 98 CA LEU A 40 7.259 4.814 8.173 1.00 0.00 C ATOM 99 C LEU A 40 8.782 4.967 8.104 1.00 0.00 C ATOM 100 O LEU A 40 9.425 4.060 7.569 1.00 0.00 O ATOM 101 CB LEU A 40 6.914 3.922 9.373 1.00 0.00 C ATOM 102 CG LEU A 40 5.486 4.115 9.871 1.00 0.00 C ATOM 103 CD1 LEU A 40 4.493 3.554 8.882 1.00 0.00 C ATOM 104 CD2 LEU A 40 5.363 3.444 11.226 1.00 0.00 C ATOM 0 H LEU A 40 6.280 3.321 7.096 1.00 0.00 H new ATOM 0 HA LEU A 40 6.837 5.813 8.283 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.057 2.878 9.095 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.608 4.133 10.187 1.00 0.00 H new ATOM 0 HG LEU A 40 5.263 5.177 9.971 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.481 3.703 9.258 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.603 4.065 7.926 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.677 2.488 8.747 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.348 3.569 11.603 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.585 2.381 11.127 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.067 3.899 11.922 1.00 0.00 H new ATOM 105 N PRO A 41 9.348 5.911 8.876 1.00 0.00 N ATOM 106 CA PRO A 41 10.804 6.140 8.948 1.00 0.00 C ATOM 107 C PRO A 41 11.609 4.938 9.464 1.00 0.00 C ATOM 108 O PRO A 41 12.811 4.845 9.214 1.00 0.00 O ATOM 109 CB PRO A 41 10.970 7.359 9.860 1.00 0.00 C ATOM 110 CG PRO A 41 9.737 7.316 10.755 1.00 0.00 C ATOM 111 CD PRO A 41 8.631 6.772 9.847 1.00 0.00 C ATOM 0 HA PRO A 41 11.205 6.301 7.947 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.889 7.300 10.443 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.015 8.285 9.286 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.895 6.671 11.620 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.488 8.306 11.137 1.00 0.00 H new ATOM 0 HD2 PRO A 41 7.894 6.204 10.414 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.095 7.578 9.345 1.00 0.00 H new ATOM 112 N ASP A 42 10.921 4.022 10.141 1.00 0.00 N ATOM 113 CA ASP A 42 11.475 2.758 10.659 1.00 0.00 C ATOM 114 C ASP A 42 11.696 1.677 9.574 1.00 0.00 C ATOM 115 O ASP A 42 12.066 0.544 9.906 1.00 0.00 O ATOM 116 CB ASP A 42 10.504 2.259 11.732 1.00 0.00 C ATOM 117 CG ASP A 42 11.072 1.104 12.563 1.00 0.00 C ATOM 118 OD1 ASP A 42 12.119 1.333 13.195 1.00 0.00 O ATOM 119 OD2 ASP A 42 10.414 0.036 12.611 1.00 0.00 O ATOM 0 H ASP A 42 9.930 4.136 10.355 1.00 0.00 H new ATOM 0 HA ASP A 42 12.469 2.950 11.062 1.00 0.00 H new ATOM 0 HB2 ASP A 42 10.248 3.085 12.395 1.00 0.00 H new ATOM 0 HB3 ASP A 42 9.579 1.935 11.255 1.00 0.00 H new ATOM 120 N GLY A 43 11.514 2.035 8.294 1.00 0.00 N ATOM 121 CA GLY A 43 11.563 1.088 7.154 1.00 0.00 C ATOM 122 C GLY A 43 10.428 0.048 7.190 1.00 0.00 C ATOM 123 O GLY A 43 10.553 -1.038 6.639 1.00 0.00 O ATOM 0 H GLY A 43 11.327 2.997 8.012 1.00 0.00 H new ATOM 0 HA2 GLY A 43 11.507 1.648 6.220 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.523 0.571 7.158 1.00 0.00 H new ATOM 124 N THR A 44 9.243 0.516 7.579 1.00 0.00 N ATOM 125 CA THR A 44 8.085 -0.369 7.870 1.00 0.00 C ATOM 126 C THR A 44 6.836 0.258 7.262 1.00 0.00 C ATOM 127 O THR A 44 6.697 1.482 7.233 1.00 0.00 O ATOM 128 CB THR A 44 7.818 -0.418 9.384 1.00 0.00 C ATOM 129 OG1 THR A 44 9.011 -0.164 10.125 1.00 0.00 O ATOM 130 CG2 THR A 44 7.203 -1.767 9.784 1.00 0.00 C ATOM 0 H THR A 44 9.046 1.509 7.705 1.00 0.00 H new ATOM 0 HA THR A 44 8.303 -1.361 7.474 1.00 0.00 H new ATOM 0 HB THR A 44 7.102 0.368 9.625 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.213 -0.936 10.694 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.022 -1.780 10.859 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.260 -1.908 9.256 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.890 -2.572 9.522 1.00 0.00 H new ATOM 131 N VAL A 45 5.902 -0.574 6.814 1.00 0.00 N ATOM 132 CA VAL A 45 4.619 -0.045 6.330 1.00 0.00 C ATOM 133 C VAL A 45 3.474 -0.482 7.266 1.00 0.00 C ATOM 134 O VAL A 45 3.143 -1.655 7.407 1.00 0.00 O ATOM 135 CB VAL A 45 4.388 -0.426 4.866 1.00 0.00 C ATOM 136 CG1 VAL A 45 3.030 0.057 4.351 1.00 0.00 C ATOM 137 CG2 VAL A 45 5.480 0.155 3.970 1.00 0.00 C ATOM 0 H VAL A 45 5.997 -1.589 6.773 1.00 0.00 H new ATOM 0 HA VAL A 45 4.644 1.044 6.355 1.00 0.00 H new ATOM 0 HB VAL A 45 4.413 -1.515 4.827 1.00 0.00 H new ATOM 0 HG11 VAL A 45 2.911 -0.236 3.308 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.235 -0.391 4.947 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.976 1.143 4.431 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.292 -0.131 2.935 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.478 1.242 4.052 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.450 -0.231 4.282 1.00 0.00 H new ATOM 138 N ASP A 46 2.941 0.556 7.890 1.00 0.00 N ATOM 139 CA ASP A 46 1.841 0.441 8.867 1.00 0.00 C ATOM 140 C ASP A 46 0.839 1.577 8.673 1.00 0.00 C ATOM 141 O ASP A 46 1.234 2.710 8.392 1.00 0.00 O ATOM 142 CB ASP A 46 2.329 0.541 10.315 1.00 0.00 C ATOM 143 CG ASP A 46 3.465 -0.430 10.670 1.00 0.00 C ATOM 144 OD1 ASP A 46 4.628 -0.017 10.492 1.00 0.00 O ATOM 145 OD2 ASP A 46 3.145 -1.541 11.146 1.00 0.00 O ATOM 0 H ASP A 46 3.254 1.515 7.740 1.00 0.00 H new ATOM 0 HA ASP A 46 1.391 -0.537 8.694 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.667 1.560 10.502 1.00 0.00 H new ATOM 0 HB3 ASP A 46 1.488 0.356 10.983 1.00 0.00 H new ATOM 146 N GLY A 47 -0.423 1.204 8.772 1.00 0.00 N ATOM 147 CA GLY A 47 -1.526 2.179 8.926 1.00 0.00 C ATOM 148 C GLY A 47 -1.440 2.867 10.298 1.00 0.00 C ATOM 149 O GLY A 47 -0.493 2.680 11.066 1.00 0.00 O ATOM 0 H GLY A 47 -0.727 0.231 8.750 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.475 2.925 8.133 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.486 1.672 8.825 1.00 0.00 H new ATOM 150 N THR A 48 -2.498 3.618 10.577 1.00 0.00 N ATOM 151 CA THR A 48 -2.530 4.555 11.709 1.00 0.00 C ATOM 152 C THR A 48 -3.958 4.957 12.096 1.00 0.00 C ATOM 153 O THR A 48 -4.724 5.424 11.259 1.00 0.00 O ATOM 154 CB THR A 48 -1.678 5.794 11.374 1.00 0.00 C ATOM 155 OG1 THR A 48 -1.770 6.758 12.422 1.00 0.00 O ATOM 156 CG2 THR A 48 -1.992 6.417 9.998 1.00 0.00 C ATOM 0 H THR A 48 -3.359 3.600 10.031 1.00 0.00 H new ATOM 0 HA THR A 48 -2.109 4.048 12.577 1.00 0.00 H new ATOM 0 HB THR A 48 -0.647 5.448 11.299 1.00 0.00 H new ATOM 0 HG1 THR A 48 -0.926 7.252 12.487 1.00 0.00 H new ATOM 0 HG21 THR A 48 -1.351 7.284 9.836 1.00 0.00 H new ATOM 0 HG22 THR A 48 -1.810 5.681 9.215 1.00 0.00 H new ATOM 0 HG23 THR A 48 -3.036 6.727 9.969 1.00 0.00 H new ATOM 157 N ARG A 49 -4.299 4.684 13.357 1.00 0.00 N ATOM 158 CA ARG A 49 -5.613 5.011 13.953 1.00 0.00 C ATOM 159 C ARG A 49 -6.012 6.486 13.804 1.00 0.00 C ATOM 160 O ARG A 49 -7.194 6.826 13.775 1.00 0.00 O ATOM 161 CB ARG A 49 -5.656 4.722 15.467 1.00 0.00 C ATOM 162 CG ARG A 49 -5.698 3.249 15.881 1.00 0.00 C ATOM 163 CD ARG A 49 -4.384 2.479 15.708 1.00 0.00 C ATOM 164 NE ARG A 49 -3.272 3.182 16.383 1.00 0.00 N ATOM 165 CZ ARG A 49 -2.040 3.361 15.900 1.00 0.00 C ATOM 166 NH1 ARG A 49 -1.635 2.868 14.745 1.00 0.00 N ATOM 167 NH2 ARG A 49 -1.231 4.179 16.551 1.00 0.00 N ATOM 0 H ARG A 49 -3.666 4.222 14.010 1.00 0.00 H new ATOM 0 HA ARG A 49 -6.304 4.376 13.399 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.780 5.181 15.927 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -6.532 5.219 15.884 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -5.998 3.192 16.927 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -6.472 2.748 15.300 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -4.489 1.475 16.119 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -4.159 2.367 14.647 1.00 0.00 H new ATOM 0 HE ARG A 49 -3.465 3.568 17.307 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -2.276 2.319 14.172 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -0.681 3.036 14.425 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -1.554 4.651 17.395 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -0.283 4.338 16.209 1.00 0.00 H new ATOM 168 N ASP A 50 -4.997 7.344 13.909 1.00 0.00 N ATOM 169 CA ASP A 50 -5.101 8.807 13.836 1.00 0.00 C ATOM 170 C ASP A 50 -3.808 9.310 13.182 1.00 0.00 C ATOM 171 O ASP A 50 -2.747 9.286 13.795 1.00 0.00 O ATOM 172 CB ASP A 50 -5.262 9.348 15.267 1.00 0.00 C ATOM 173 CG ASP A 50 -5.581 10.849 15.321 1.00 0.00 C ATOM 174 OD1 ASP A 50 -6.727 11.205 14.970 1.00 0.00 O ATOM 175 OD2 ASP A 50 -4.691 11.598 15.769 1.00 0.00 O ATOM 0 H ASP A 50 -4.038 7.028 14.053 1.00 0.00 H new ATOM 0 HA ASP A 50 -5.957 9.142 13.250 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -6.058 8.797 15.768 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -4.344 9.159 15.824 1.00 0.00 H new ATOM 176 N ARG A 51 -3.936 9.478 11.868 1.00 0.00 N ATOM 177 CA ARG A 51 -2.880 9.985 10.951 1.00 0.00 C ATOM 178 C ARG A 51 -1.727 10.771 11.564 1.00 0.00 C ATOM 179 O ARG A 51 -1.792 11.930 11.944 1.00 0.00 O ATOM 180 CB ARG A 51 -3.596 10.743 9.822 1.00 0.00 C ATOM 181 CG ARG A 51 -4.097 9.832 8.690 1.00 0.00 C ATOM 182 CD ARG A 51 -5.187 8.807 9.056 1.00 0.00 C ATOM 183 NE ARG A 51 -6.396 9.464 9.574 1.00 0.00 N ATOM 184 CZ ARG A 51 -7.147 9.022 10.580 1.00 0.00 C ATOM 185 NH1 ARG A 51 -7.090 7.778 11.025 1.00 0.00 N ATOM 186 NH2 ARG A 51 -8.172 9.756 11.009 1.00 0.00 N ATOM 0 H ARG A 51 -4.805 9.261 11.380 1.00 0.00 H new ATOM 0 HA ARG A 51 -2.335 9.116 10.582 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -4.443 11.287 10.241 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -2.915 11.485 9.405 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -4.480 10.464 7.889 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.242 9.290 8.287 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -5.442 8.216 8.176 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -4.800 8.115 9.804 1.00 0.00 H new ATOM 0 HE ARG A 51 -6.684 10.333 9.124 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -6.450 7.111 10.594 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -7.686 7.486 11.799 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -8.378 10.652 10.567 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -8.751 9.422 11.780 1.00 0.00 H new ATOM 187 N SER A 52 -0.690 9.973 11.762 1.00 0.00 N ATOM 188 CA SER A 52 0.666 10.357 12.191 1.00 0.00 C ATOM 189 C SER A 52 1.357 11.127 11.065 1.00 0.00 C ATOM 190 O SER A 52 1.976 10.592 10.139 1.00 0.00 O ATOM 191 CB SER A 52 1.438 9.103 12.585 1.00 0.00 C ATOM 192 OG SER A 52 0.791 7.907 12.096 1.00 0.00 O ATOM 0 H SER A 52 -0.768 8.966 11.620 1.00 0.00 H new ATOM 0 HA SER A 52 0.623 11.013 13.061 1.00 0.00 H new ATOM 0 HB2 SER A 52 2.451 9.158 12.187 1.00 0.00 H new ATOM 0 HB3 SER A 52 1.524 9.053 13.670 1.00 0.00 H new ATOM 0 HG SER A 52 0.856 7.200 12.772 1.00 0.00 H new ATOM 193 N ASP A 53 0.881 12.357 11.092 1.00 0.00 N ATOM 194 CA ASP A 53 1.133 13.475 10.152 1.00 0.00 C ATOM 195 C ASP A 53 2.574 13.847 9.770 1.00 0.00 C ATOM 196 O ASP A 53 3.108 14.878 10.148 1.00 0.00 O ATOM 197 CB ASP A 53 0.321 14.700 10.581 1.00 0.00 C ATOM 198 CG ASP A 53 -1.103 14.646 10.012 1.00 0.00 C ATOM 199 OD1 ASP A 53 -1.218 14.819 8.776 1.00 0.00 O ATOM 200 OD2 ASP A 53 -2.030 14.397 10.802 1.00 0.00 O ATOM 0 H ASP A 53 0.246 12.644 11.837 1.00 0.00 H new ATOM 0 HA ASP A 53 0.794 13.064 9.201 1.00 0.00 H new ATOM 0 HB2 ASP A 53 0.279 14.750 11.669 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.818 15.608 10.239 1.00 0.00 H new ATOM 201 N GLN A 54 3.193 12.858 9.144 1.00 0.00 N ATOM 202 CA GLN A 54 4.384 13.052 8.303 1.00 0.00 C ATOM 203 C GLN A 54 4.363 12.033 7.150 1.00 0.00 C ATOM 204 O GLN A 54 3.662 12.288 6.166 1.00 0.00 O ATOM 205 CB GLN A 54 5.667 12.981 9.143 1.00 0.00 C ATOM 206 CG GLN A 54 6.904 13.470 8.379 1.00 0.00 C ATOM 207 CD GLN A 54 8.185 12.899 8.993 1.00 0.00 C ATOM 208 OE1 GLN A 54 8.478 13.038 10.174 1.00 0.00 O ATOM 209 NE2 GLN A 54 8.947 12.178 8.202 1.00 0.00 N ATOM 0 H GLN A 54 2.887 11.887 9.200 1.00 0.00 H new ATOM 0 HA GLN A 54 4.369 14.050 7.864 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.540 13.582 10.043 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.828 11.953 9.466 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.832 13.171 7.333 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.941 14.559 8.397 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.699 12.065 7.219 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.787 11.731 8.571 1.00 0.00 H new ATOM 210 N HIS A 55 4.760 10.798 7.443 1.00 0.00 N ATOM 211 CA HIS A 55 5.029 9.720 6.464 1.00 0.00 C ATOM 212 C HIS A 55 3.785 9.385 5.625 1.00 0.00 C ATOM 213 O HIS A 55 3.879 9.220 4.415 1.00 0.00 O ATOM 214 CB HIS A 55 5.539 8.475 7.218 1.00 0.00 C ATOM 215 CG HIS A 55 6.084 8.738 8.625 1.00 0.00 C ATOM 216 ND1 HIS A 55 5.415 8.430 9.738 1.00 0.00 N ATOM 217 CD2 HIS A 55 7.038 9.600 8.972 1.00 0.00 C ATOM 218 CE1 HIS A 55 5.928 9.124 10.749 1.00 0.00 C ATOM 219 NE2 HIS A 55 6.932 9.855 10.268 1.00 0.00 N ATOM 0 H HIS A 55 4.913 10.497 8.405 1.00 0.00 H new ATOM 0 HA HIS A 55 5.792 10.064 5.766 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.723 7.756 7.291 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.324 8.007 6.624 1.00 0.00 H new ATOM 0 HD2 HIS A 55 7.777 10.022 8.307 1.00 0.00 H new ATOM 0 HE1 HIS A 55 5.591 9.100 11.775 1.00 0.00 H new ATOM 0 HE2 HIS A 55 7.516 10.498 10.803 1.00 0.00 H new ATOM 220 N ILE A 56 2.619 9.535 6.271 1.00 0.00 N ATOM 221 CA ILE A 56 1.270 9.342 5.684 1.00 0.00 C ATOM 222 C ILE A 56 1.036 9.897 4.270 1.00 0.00 C ATOM 223 O ILE A 56 0.334 9.249 3.492 1.00 0.00 O ATOM 224 CB ILE A 56 0.120 9.788 6.617 1.00 0.00 C ATOM 225 CG1 ILE A 56 0.302 11.222 7.114 1.00 0.00 C ATOM 226 CG2 ILE A 56 -0.075 8.814 7.789 1.00 0.00 C ATOM 227 CD1 ILE A 56 -1.039 11.938 7.264 1.00 0.00 C ATOM 0 H ILE A 56 2.580 9.804 7.254 1.00 0.00 H new ATOM 0 HA ILE A 56 1.251 8.258 5.574 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.790 9.768 6.017 1.00 0.00 H new ATOM 0 HG12 ILE A 56 0.820 11.213 8.073 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.933 11.772 6.416 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.892 9.163 8.420 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.313 7.823 7.403 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.842 8.764 8.377 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -0.871 12.955 7.619 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.545 11.970 6.299 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.660 11.401 7.981 1.00 0.00 H new ATOM 228 N GLN A 57 1.650 11.035 3.956 1.00 0.00 N ATOM 229 CA GLN A 57 1.659 11.590 2.596 1.00 0.00 C ATOM 230 C GLN A 57 2.505 10.728 1.642 1.00 0.00 C ATOM 231 O GLN A 57 3.728 10.717 1.725 1.00 0.00 O ATOM 232 CB GLN A 57 2.155 13.040 2.575 1.00 0.00 C ATOM 233 CG GLN A 57 1.020 14.062 2.794 1.00 0.00 C ATOM 234 CD GLN A 57 0.273 13.848 4.110 1.00 0.00 C ATOM 235 OE1 GLN A 57 -0.806 13.282 4.168 1.00 0.00 O ATOM 236 NE2 GLN A 57 0.881 14.234 5.209 1.00 0.00 N ATOM 0 H GLN A 57 2.157 11.603 4.635 1.00 0.00 H new ATOM 0 HA GLN A 57 0.626 11.580 2.248 1.00 0.00 H new ATOM 0 HB2 GLN A 57 2.911 13.172 3.349 1.00 0.00 H new ATOM 0 HB3 GLN A 57 2.639 13.240 1.619 1.00 0.00 H new ATOM 0 HG2 GLN A 57 1.437 15.069 2.778 1.00 0.00 H new ATOM 0 HG3 GLN A 57 0.314 13.996 1.966 1.00 0.00 H new ATOM 0 HE21 GLN A 57 1.783 14.707 5.154 1.00 0.00 H new ATOM 0 HE22 GLN A 57 0.451 14.061 6.118 1.00 0.00 H new ATOM 237 N LEU A 58 1.781 9.784 1.062 1.00 0.00 N ATOM 238 CA LEU A 58 2.287 8.915 -0.019 1.00 0.00 C ATOM 239 C LEU A 58 2.288 9.655 -1.373 1.00 0.00 C ATOM 240 O LEU A 58 1.561 10.635 -1.584 1.00 0.00 O ATOM 241 CB LEU A 58 1.471 7.626 -0.117 1.00 0.00 C ATOM 242 CG LEU A 58 0.042 7.907 -0.605 1.00 0.00 C ATOM 243 CD1 LEU A 58 -0.204 7.129 -1.898 1.00 0.00 C ATOM 244 CD2 LEU A 58 -0.996 7.653 0.489 1.00 0.00 C ATOM 0 H LEU A 58 0.814 9.588 1.322 1.00 0.00 H new ATOM 0 HA LEU A 58 3.316 8.651 0.227 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.962 6.933 -0.801 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.436 7.140 0.858 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.070 8.966 -0.836 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.217 7.322 -2.252 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.512 7.447 -2.656 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.083 6.062 -1.709 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.993 7.864 0.101 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.943 6.611 0.806 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.793 8.302 1.341 1.00 0.00 H new ATOM 245 N GLN A 59 3.128 9.157 -2.256 1.00 0.00 N ATOM 246 CA GLN A 59 3.193 9.601 -3.659 1.00 0.00 C ATOM 247 C GLN A 59 3.355 8.429 -4.603 1.00 0.00 C ATOM 248 O GLN A 59 4.088 7.482 -4.334 1.00 0.00 O ATOM 249 CB GLN A 59 4.391 10.555 -3.751 1.00 0.00 C ATOM 250 CG GLN A 59 4.464 11.440 -5.009 1.00 0.00 C ATOM 251 CD GLN A 59 4.856 10.700 -6.308 1.00 0.00 C ATOM 252 OE1 GLN A 59 5.505 9.660 -6.338 1.00 0.00 O ATOM 253 NE2 GLN A 59 4.420 11.238 -7.418 1.00 0.00 N ATOM 0 H GLN A 59 3.799 8.423 -2.031 1.00 0.00 H new ATOM 0 HA GLN A 59 2.269 10.098 -3.953 1.00 0.00 H new ATOM 0 HB2 GLN A 59 4.379 11.205 -2.876 1.00 0.00 H new ATOM 0 HB3 GLN A 59 5.305 9.963 -3.696 1.00 0.00 H new ATOM 0 HG2 GLN A 59 3.494 11.914 -5.158 1.00 0.00 H new ATOM 0 HG3 GLN A 59 5.185 12.238 -4.832 1.00 0.00 H new ATOM 0 HE21 GLN A 59 3.881 12.103 -7.388 1.00 0.00 H new ATOM 0 HE22 GLN A 59 4.619 10.792 -8.314 1.00 0.00 H new ATOM 254 N LEU A 60 2.574 8.491 -5.670 1.00 0.00 N ATOM 255 CA LEU A 60 2.604 7.384 -6.606 1.00 0.00 C ATOM 256 C LEU A 60 3.019 7.713 -8.041 1.00 0.00 C ATOM 257 O LEU A 60 2.463 8.567 -8.731 1.00 0.00 O ATOM 258 CB LEU A 60 1.389 6.497 -6.467 1.00 0.00 C ATOM 259 CG LEU A 60 0.047 7.065 -6.913 1.00 0.00 C ATOM 260 CD1 LEU A 60 -0.817 5.830 -6.799 1.00 0.00 C ATOM 261 CD2 LEU A 60 -0.538 8.196 -6.051 1.00 0.00 C ATOM 0 H LEU A 60 1.941 9.257 -5.902 1.00 0.00 H new ATOM 0 HA LEU A 60 3.457 6.781 -6.297 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.573 5.584 -7.034 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.301 6.209 -5.419 1.00 0.00 H new ATOM 0 HG LEU A 60 0.122 7.543 -7.890 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.839 6.073 -7.091 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.427 5.052 -7.455 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.809 5.474 -5.769 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.493 8.516 -6.469 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.690 7.836 -5.033 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.153 9.039 -6.039 1.00 0.00 H new ATOM 262 N SER A 61 4.063 6.986 -8.408 1.00 0.00 N ATOM 263 CA SER A 61 4.844 7.176 -9.648 1.00 0.00 C ATOM 264 C SER A 61 4.885 5.939 -10.537 1.00 0.00 C ATOM 265 O SER A 61 5.439 4.889 -10.221 1.00 0.00 O ATOM 266 CB SER A 61 6.288 7.566 -9.330 1.00 0.00 C ATOM 267 OG SER A 61 6.341 8.885 -8.765 1.00 0.00 O ATOM 0 H SER A 61 4.413 6.216 -7.838 1.00 0.00 H new ATOM 0 HA SER A 61 4.330 7.972 -10.187 1.00 0.00 H new ATOM 0 HB2 SER A 61 6.719 6.848 -8.633 1.00 0.00 H new ATOM 0 HB3 SER A 61 6.889 7.529 -10.238 1.00 0.00 H new ATOM 0 HG SER A 61 6.097 8.845 -7.817 1.00 0.00 H new ATOM 268 N ALA A 62 4.076 6.037 -11.575 1.00 0.00 N ATOM 269 CA ALA A 62 3.917 5.011 -12.621 1.00 0.00 C ATOM 270 C ALA A 62 5.038 4.924 -13.668 1.00 0.00 C ATOM 271 O ALA A 62 5.155 5.714 -14.600 1.00 0.00 O ATOM 272 CB ALA A 62 2.548 5.161 -13.284 1.00 0.00 C ATOM 0 H ALA A 62 3.487 6.855 -11.730 1.00 0.00 H new ATOM 0 HA ALA A 62 3.992 4.058 -12.097 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.433 4.401 -14.057 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.766 5.038 -12.535 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.468 6.151 -13.733 1.00 0.00 H new ATOM 273 N GLU A 63 5.687 3.770 -13.588 1.00 0.00 N ATOM 274 CA GLU A 63 6.697 3.282 -14.537 1.00 0.00 C ATOM 275 C GLU A 63 5.941 2.333 -15.486 1.00 0.00 C ATOM 276 O GLU A 63 5.863 1.127 -15.283 1.00 0.00 O ATOM 277 CB GLU A 63 7.795 2.590 -13.726 1.00 0.00 C ATOM 278 CG GLU A 63 8.887 1.960 -14.596 1.00 0.00 C ATOM 279 CD GLU A 63 10.076 1.558 -13.736 1.00 0.00 C ATOM 280 OE1 GLU A 63 9.979 0.536 -13.026 1.00 0.00 O ATOM 281 OE2 GLU A 63 11.071 2.324 -13.756 1.00 0.00 O ATOM 0 H GLU A 63 5.521 3.113 -12.826 1.00 0.00 H new ATOM 0 HA GLU A 63 7.183 4.059 -15.128 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.251 3.315 -13.052 1.00 0.00 H new ATOM 0 HB3 GLU A 63 7.345 1.816 -13.104 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.491 1.086 -15.114 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.205 2.667 -15.362 1.00 0.00 H new ATOM 282 N SER A 64 5.232 2.999 -16.404 1.00 0.00 N ATOM 283 CA SER A 64 4.407 2.396 -17.486 1.00 0.00 C ATOM 284 C SER A 64 3.029 1.898 -17.005 1.00 0.00 C ATOM 285 O SER A 64 2.578 2.262 -15.906 1.00 0.00 O ATOM 286 CB SER A 64 5.284 1.373 -18.231 1.00 0.00 C ATOM 287 OG SER A 64 4.622 0.538 -19.187 1.00 0.00 O ATOM 0 H SER A 64 5.209 4.019 -16.424 1.00 0.00 H new ATOM 0 HA SER A 64 4.107 3.154 -18.209 1.00 0.00 H new ATOM 0 HB2 SER A 64 6.079 1.915 -18.744 1.00 0.00 H new ATOM 0 HB3 SER A 64 5.762 0.731 -17.491 1.00 0.00 H new ATOM 0 HG SER A 64 5.273 -0.069 -19.598 1.00 0.00 H new ATOM 288 N VAL A 65 2.351 1.108 -17.831 1.00 0.00 N ATOM 289 CA VAL A 65 0.929 0.682 -17.755 1.00 0.00 C ATOM 290 C VAL A 65 0.442 0.197 -16.374 1.00 0.00 C ATOM 291 O VAL A 65 0.606 -0.964 -15.982 1.00 0.00 O ATOM 292 CB VAL A 65 0.664 -0.317 -18.907 1.00 0.00 C ATOM 293 CG1 VAL A 65 1.468 -1.621 -18.766 1.00 0.00 C ATOM 294 CG2 VAL A 65 -0.837 -0.607 -19.062 1.00 0.00 C ATOM 0 H VAL A 65 2.809 0.706 -18.648 1.00 0.00 H new ATOM 0 HA VAL A 65 0.310 1.569 -17.887 1.00 0.00 H new ATOM 0 HB VAL A 65 1.015 0.168 -19.818 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.240 -2.281 -19.603 1.00 0.00 H new ATOM 0 HG12 VAL A 65 2.534 -1.393 -18.764 1.00 0.00 H new ATOM 0 HG13 VAL A 65 1.200 -2.114 -17.831 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.989 -1.312 -19.879 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.222 -1.036 -18.137 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.366 0.321 -19.280 1.00 0.00 H new ATOM 295 N GLY A 66 -0.076 1.160 -15.627 1.00 0.00 N ATOM 296 CA GLY A 66 -0.592 0.973 -14.259 1.00 0.00 C ATOM 297 C GLY A 66 0.486 0.720 -13.197 1.00 0.00 C ATOM 298 O GLY A 66 0.252 0.912 -12.007 1.00 0.00 O ATOM 0 H GLY A 66 -0.156 2.123 -15.955 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.161 1.858 -13.976 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.287 0.133 -14.259 1.00 0.00 H new ATOM 299 N GLU A 67 1.673 0.363 -13.659 1.00 0.00 N ATOM 300 CA GLU A 67 2.801 -0.104 -12.858 1.00 0.00 C ATOM 301 C GLU A 67 3.439 1.020 -12.030 1.00 0.00 C ATOM 302 O GLU A 67 4.356 1.727 -12.430 1.00 0.00 O ATOM 303 CB GLU A 67 3.844 -0.715 -13.779 1.00 0.00 C ATOM 304 CG GLU A 67 3.322 -1.874 -14.632 1.00 0.00 C ATOM 305 CD GLU A 67 4.253 -2.103 -15.825 1.00 0.00 C ATOM 306 OE1 GLU A 67 4.093 -1.380 -16.838 1.00 0.00 O ATOM 307 OE2 GLU A 67 5.113 -3.009 -15.732 1.00 0.00 O ATOM 0 H GLU A 67 1.891 0.391 -14.655 1.00 0.00 H new ATOM 0 HA GLU A 67 2.424 -0.847 -12.155 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.231 0.062 -14.438 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.682 -1.069 -13.178 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.258 -2.780 -14.030 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.314 -1.653 -14.983 1.00 0.00 H new ATOM 308 N VAL A 68 3.058 0.987 -10.764 1.00 0.00 N ATOM 309 CA VAL A 68 3.269 2.095 -9.836 1.00 0.00 C ATOM 310 C VAL A 68 4.096 1.841 -8.569 1.00 0.00 C ATOM 311 O VAL A 68 3.760 1.080 -7.669 1.00 0.00 O ATOM 312 CB VAL A 68 1.924 2.723 -9.533 1.00 0.00 C ATOM 313 CG1 VAL A 68 0.945 1.767 -8.837 1.00 0.00 C ATOM 314 CG2 VAL A 68 1.949 3.977 -8.707 1.00 0.00 C ATOM 0 H VAL A 68 2.589 0.185 -10.344 1.00 0.00 H new ATOM 0 HA VAL A 68 3.933 2.781 -10.362 1.00 0.00 H new ATOM 0 HB VAL A 68 1.590 2.976 -10.539 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.003 2.283 -8.650 1.00 0.00 H new ATOM 0 HG12 VAL A 68 0.765 0.902 -9.476 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.371 1.436 -7.890 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.930 4.333 -8.556 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.407 3.767 -7.740 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.528 4.742 -9.224 1.00 0.00 H new ATOM 315 N TYR A 69 4.972 2.820 -8.485 1.00 0.00 N ATOM 316 CA TYR A 69 5.921 3.004 -7.389 1.00 0.00 C ATOM 317 C TYR A 69 5.366 3.951 -6.320 1.00 0.00 C ATOM 318 O TYR A 69 5.061 5.111 -6.617 1.00 0.00 O ATOM 319 CB TYR A 69 7.197 3.636 -7.933 1.00 0.00 C ATOM 320 CG TYR A 69 8.203 2.651 -8.512 1.00 0.00 C ATOM 321 CD1 TYR A 69 8.508 1.461 -7.822 1.00 0.00 C ATOM 322 CD2 TYR A 69 8.834 2.977 -9.733 1.00 0.00 C ATOM 323 CE1 TYR A 69 9.426 0.546 -8.384 1.00 0.00 C ATOM 324 CE2 TYR A 69 9.780 2.084 -10.285 1.00 0.00 C ATOM 325 CZ TYR A 69 10.056 0.872 -9.605 1.00 0.00 C ATOM 326 OH TYR A 69 10.990 0.026 -10.104 1.00 0.00 O ATOM 0 H TYR A 69 5.052 3.541 -9.202 1.00 0.00 H new ATOM 0 HA TYR A 69 6.109 2.025 -6.947 1.00 0.00 H new ATOM 0 HB2 TYR A 69 6.928 4.355 -8.707 1.00 0.00 H new ATOM 0 HB3 TYR A 69 7.678 4.196 -7.131 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.043 1.250 -6.870 1.00 0.00 H new ATOM 0 HD2 TYR A 69 8.596 3.900 -10.240 1.00 0.00 H new ATOM 0 HE1 TYR A 69 9.643 -0.388 -7.887 1.00 0.00 H new ATOM 0 HE2 TYR A 69 10.284 2.321 -11.210 1.00 0.00 H new ATOM 0 HH TYR A 69 10.904 -0.017 -11.079 1.00 0.00 H new ATOM 327 N ILE A 70 5.216 3.424 -5.118 1.00 0.00 N ATOM 328 CA ILE A 70 4.586 4.203 -4.045 1.00 0.00 C ATOM 329 C ILE A 70 5.610 4.660 -2.997 1.00 0.00 C ATOM 330 O ILE A 70 5.793 4.103 -1.915 1.00 0.00 O ATOM 331 CB ILE A 70 3.317 3.527 -3.513 1.00 0.00 C ATOM 332 CG1 ILE A 70 2.404 3.270 -4.717 1.00 0.00 C ATOM 333 CG2 ILE A 70 2.584 4.402 -2.487 1.00 0.00 C ATOM 334 CD1 ILE A 70 1.354 2.187 -4.492 1.00 0.00 C ATOM 0 H ILE A 70 5.511 2.484 -4.855 1.00 0.00 H new ATOM 0 HA ILE A 70 4.213 5.139 -4.460 1.00 0.00 H new ATOM 0 HB ILE A 70 3.586 2.602 -3.004 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.899 4.200 -4.979 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.020 2.990 -5.571 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.691 3.883 -2.138 1.00 0.00 H new ATOM 0 HG22 ILE A 70 3.243 4.601 -1.641 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.297 5.345 -2.952 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.752 2.071 -5.393 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.848 1.243 -4.261 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.710 2.472 -3.660 1.00 0.00 H new ATOM 335 N LYS A 71 6.067 5.848 -3.340 1.00 0.00 N ATOM 336 CA LYS A 71 7.040 6.651 -2.577 1.00 0.00 C ATOM 337 C LYS A 71 6.268 7.382 -1.491 1.00 0.00 C ATOM 338 O LYS A 71 5.044 7.469 -1.504 1.00 0.00 O ATOM 339 CB LYS A 71 7.628 7.627 -3.605 1.00 0.00 C ATOM 340 CG LYS A 71 8.883 8.345 -3.120 1.00 0.00 C ATOM 341 CD LYS A 71 9.237 9.521 -4.037 1.00 0.00 C ATOM 342 CE LYS A 71 8.413 10.774 -3.726 1.00 0.00 C ATOM 343 NZ LYS A 71 8.944 11.447 -2.540 1.00 0.00 N ATOM 0 H LYS A 71 5.765 6.313 -4.196 1.00 0.00 H new ATOM 0 HA LYS A 71 7.832 6.074 -2.100 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.863 7.081 -4.519 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.872 8.369 -3.862 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.729 8.707 -2.103 1.00 0.00 H new ATOM 0 HG3 LYS A 71 9.716 7.643 -3.086 1.00 0.00 H new ATOM 0 HD2 LYS A 71 10.297 9.752 -3.934 1.00 0.00 H new ATOM 0 HD3 LYS A 71 9.074 9.231 -5.075 1.00 0.00 H new ATOM 0 HE2 LYS A 71 8.434 11.453 -4.578 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.371 10.501 -3.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 8.541 12.404 -2.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 8.689 10.905 -1.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 9.980 11.511 -2.612 1.00 0.00 H new ATOM 344 N SER A 72 7.006 7.673 -0.452 1.00 0.00 N ATOM 345 CA SER A 72 6.481 8.502 0.633 1.00 0.00 C ATOM 346 C SER A 72 7.001 9.929 0.504 1.00 0.00 C ATOM 347 O SER A 72 8.179 10.222 0.695 1.00 0.00 O ATOM 348 CB SER A 72 6.818 7.856 1.979 1.00 0.00 C ATOM 349 OG SER A 72 8.154 7.348 2.037 1.00 0.00 O ATOM 0 H SER A 72 7.967 7.357 -0.322 1.00 0.00 H new ATOM 0 HA SER A 72 5.395 8.564 0.570 1.00 0.00 H new ATOM 0 HB2 SER A 72 6.680 8.590 2.773 1.00 0.00 H new ATOM 0 HB3 SER A 72 6.118 7.043 2.171 1.00 0.00 H new ATOM 0 HG SER A 72 8.190 6.471 1.601 1.00 0.00 H new ATOM 350 N THR A 73 6.106 10.829 0.120 1.00 0.00 N ATOM 351 CA THR A 73 6.388 12.274 -0.049 1.00 0.00 C ATOM 352 C THR A 73 7.076 12.862 1.207 1.00 0.00 C ATOM 353 O THR A 73 7.859 13.802 1.102 1.00 0.00 O ATOM 354 CB THR A 73 5.088 13.028 -0.321 1.00 0.00 C ATOM 355 OG1 THR A 73 4.114 12.122 -0.852 1.00 0.00 O ATOM 356 CG2 THR A 73 5.331 14.175 -1.317 1.00 0.00 C ATOM 0 H THR A 73 5.139 10.584 -0.091 1.00 0.00 H new ATOM 0 HA THR A 73 7.065 12.389 -0.896 1.00 0.00 H new ATOM 0 HB THR A 73 4.722 13.452 0.614 1.00 0.00 H new ATOM 0 HG1 THR A 73 3.279 12.604 -1.025 1.00 0.00 H new ATOM 0 HG21 THR A 73 4.395 14.702 -1.500 1.00 0.00 H new ATOM 0 HG22 THR A 73 6.063 14.868 -0.902 1.00 0.00 H new ATOM 0 HG23 THR A 73 5.708 13.768 -2.255 1.00 0.00 H new ATOM 357 N GLU A 74 6.728 12.317 2.368 1.00 0.00 N ATOM 358 CA GLU A 74 7.360 12.710 3.652 1.00 0.00 C ATOM 359 C GLU A 74 8.326 11.724 4.328 1.00 0.00 C ATOM 360 O GLU A 74 8.734 11.981 5.460 1.00 0.00 O ATOM 361 CB GLU A 74 6.267 13.183 4.598 1.00 0.00 C ATOM 362 CG GLU A 74 5.944 14.647 4.303 1.00 0.00 C ATOM 363 CD GLU A 74 4.934 15.234 5.300 1.00 0.00 C ATOM 364 OE1 GLU A 74 3.732 14.955 5.120 1.00 0.00 O ATOM 365 OE2 GLU A 74 5.377 15.999 6.176 1.00 0.00 O ATOM 0 H GLU A 74 6.010 11.598 2.461 1.00 0.00 H new ATOM 0 HA GLU A 74 8.053 13.509 3.388 1.00 0.00 H new ATOM 0 HB2 GLU A 74 5.374 12.570 4.476 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.592 13.071 5.632 1.00 0.00 H new ATOM 0 HG2 GLU A 74 6.863 15.233 4.333 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.545 14.732 3.292 1.00 0.00 H new ATOM 366 N THR A 75 8.732 10.653 3.648 1.00 0.00 N ATOM 367 CA THR A 75 9.773 9.724 4.150 1.00 0.00 C ATOM 368 C THR A 75 10.679 9.052 3.104 1.00 0.00 C ATOM 369 O THR A 75 11.617 8.335 3.474 1.00 0.00 O ATOM 370 CB THR A 75 9.252 8.639 5.103 1.00 0.00 C ATOM 371 OG1 THR A 75 7.843 8.442 4.988 1.00 0.00 O ATOM 372 CG2 THR A 75 9.652 8.970 6.540 1.00 0.00 C ATOM 0 H THR A 75 8.357 10.395 2.735 1.00 0.00 H new ATOM 0 HA THR A 75 10.394 10.434 4.696 1.00 0.00 H new ATOM 0 HB THR A 75 9.716 7.695 4.816 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.636 7.490 5.094 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.278 8.195 7.209 1.00 0.00 H new ATOM 0 HG22 THR A 75 10.738 9.020 6.613 1.00 0.00 H new ATOM 0 HG23 THR A 75 9.225 9.932 6.824 1.00 0.00 H new ATOM 373 N GLY A 76 10.381 9.261 1.823 1.00 0.00 N ATOM 374 CA GLY A 76 11.067 8.669 0.649 1.00 0.00 C ATOM 375 C GLY A 76 10.637 7.219 0.436 1.00 0.00 C ATOM 376 O GLY A 76 9.824 6.941 -0.433 1.00 0.00 O ATOM 0 H GLY A 76 9.617 9.878 1.549 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.840 9.254 -0.242 1.00 0.00 H new ATOM 0 HA3 GLY A 76 12.146 8.714 0.793 1.00 0.00 H new ATOM 377 N GLN A 77 11.093 6.415 1.388 1.00 0.00 N ATOM 378 CA GLN A 77 10.833 4.963 1.533 1.00 0.00 C ATOM 379 C GLN A 77 9.580 4.478 0.798 1.00 0.00 C ATOM 380 O GLN A 77 8.483 5.024 0.934 1.00 0.00 O ATOM 381 CB GLN A 77 10.742 4.609 3.016 1.00 0.00 C ATOM 382 CG GLN A 77 12.110 4.615 3.680 1.00 0.00 C ATOM 383 CD GLN A 77 12.008 4.992 5.164 1.00 0.00 C ATOM 384 OE1 GLN A 77 11.897 4.171 6.067 1.00 0.00 O ATOM 385 NE2 GLN A 77 12.041 6.272 5.430 1.00 0.00 N ATOM 0 H GLN A 77 11.693 6.768 2.133 1.00 0.00 H new ATOM 0 HA GLN A 77 11.671 4.448 1.064 1.00 0.00 H new ATOM 0 HB2 GLN A 77 10.089 5.321 3.521 1.00 0.00 H new ATOM 0 HB3 GLN A 77 10.287 3.625 3.128 1.00 0.00 H new ATOM 0 HG2 GLN A 77 12.568 3.631 3.583 1.00 0.00 H new ATOM 0 HG3 GLN A 77 12.762 5.322 3.167 1.00 0.00 H new ATOM 0 HE21 GLN A 77 12.134 6.948 4.672 1.00 0.00 H new ATOM 0 HE22 GLN A 77 11.974 6.594 6.395 1.00 0.00 H new ATOM 386 N TYR A 78 9.809 3.461 -0.014 1.00 0.00 N ATOM 387 CA TYR A 78 8.800 2.915 -0.922 1.00 0.00 C ATOM 388 C TYR A 78 7.960 1.817 -0.260 1.00 0.00 C ATOM 389 O TYR A 78 8.454 1.041 0.553 1.00 0.00 O ATOM 390 CB TYR A 78 9.523 2.375 -2.154 1.00 0.00 C ATOM 391 CG TYR A 78 10.037 3.509 -3.046 1.00 0.00 C ATOM 392 CD1 TYR A 78 11.241 4.172 -2.720 1.00 0.00 C ATOM 393 CD2 TYR A 78 9.303 3.833 -4.213 1.00 0.00 C ATOM 394 CE1 TYR A 78 11.717 5.200 -3.568 1.00 0.00 C ATOM 395 CE2 TYR A 78 9.777 4.852 -5.057 1.00 0.00 C ATOM 396 CZ TYR A 78 10.980 5.515 -4.730 1.00 0.00 C ATOM 397 OH TYR A 78 11.507 6.372 -5.643 1.00 0.00 O ATOM 0 H TYR A 78 10.708 2.982 -0.067 1.00 0.00 H new ATOM 0 HA TYR A 78 8.103 3.705 -1.201 1.00 0.00 H new ATOM 0 HB2 TYR A 78 10.359 1.749 -1.841 1.00 0.00 H new ATOM 0 HB3 TYR A 78 8.846 1.740 -2.725 1.00 0.00 H new ATOM 0 HD1 TYR A 78 11.792 3.897 -1.833 1.00 0.00 H new ATOM 0 HD2 TYR A 78 8.392 3.304 -4.451 1.00 0.00 H new ATOM 0 HE1 TYR A 78 12.626 5.733 -3.331 1.00 0.00 H new ATOM 0 HE2 TYR A 78 9.227 5.125 -5.946 1.00 0.00 H new ATOM 0 HH TYR A 78 10.878 6.485 -6.386 1.00 0.00 H new ATOM 398 N LEU A 79 6.658 1.896 -0.547 1.00 0.00 N ATOM 399 CA LEU A 79 5.704 0.820 -0.224 1.00 0.00 C ATOM 400 C LEU A 79 6.147 -0.409 -1.014 1.00 0.00 C ATOM 401 O LEU A 79 6.189 -0.381 -2.244 1.00 0.00 O ATOM 402 CB LEU A 79 4.304 1.234 -0.696 1.00 0.00 C ATOM 403 CG LEU A 79 3.208 0.290 -0.194 1.00 0.00 C ATOM 404 CD1 LEU A 79 2.794 0.701 1.204 1.00 0.00 C ATOM 405 CD2 LEU A 79 1.966 0.502 -1.055 1.00 0.00 C ATOM 0 H LEU A 79 6.233 2.701 -1.007 1.00 0.00 H new ATOM 0 HA LEU A 79 5.678 0.620 0.847 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.093 2.246 -0.350 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.285 1.259 -1.786 1.00 0.00 H new ATOM 0 HG LEU A 79 3.579 -0.735 -0.225 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.014 0.031 1.564 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.655 0.646 1.870 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.415 1.723 1.186 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.170 -0.161 -0.715 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.637 1.538 -0.970 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.203 0.281 -2.096 1.00 0.00 H new ATOM 406 N ALA A 80 6.718 -1.345 -0.275 1.00 0.00 N ATOM 407 CA ALA A 80 7.275 -2.571 -0.864 1.00 0.00 C ATOM 408 C ALA A 80 6.683 -3.823 -0.228 1.00 0.00 C ATOM 409 O ALA A 80 6.429 -3.819 0.978 1.00 0.00 O ATOM 410 CB ALA A 80 8.783 -2.593 -0.649 1.00 0.00 C ATOM 0 H ALA A 80 6.813 -1.287 0.739 1.00 0.00 H new ATOM 0 HA ALA A 80 7.029 -2.569 -1.926 1.00 0.00 H new ATOM 0 HB1 ALA A 80 9.199 -3.501 -1.085 1.00 0.00 H new ATOM 0 HB2 ALA A 80 9.231 -1.722 -1.127 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.999 -2.571 0.419 1.00 0.00 H new ATOM 411 N MET A 81 6.737 -4.907 -0.972 1.00 0.00 N ATOM 412 CA MET A 81 6.210 -6.190 -0.480 1.00 0.00 C ATOM 413 C MET A 81 7.235 -7.330 -0.666 1.00 0.00 C ATOM 414 O MET A 81 7.860 -7.459 -1.710 1.00 0.00 O ATOM 415 CB MET A 81 4.885 -6.568 -1.147 1.00 0.00 C ATOM 416 CG MET A 81 4.192 -7.589 -0.246 1.00 0.00 C ATOM 417 SD MET A 81 2.558 -8.209 -0.800 1.00 0.00 S ATOM 418 CE MET A 81 1.613 -6.740 -1.130 1.00 0.00 C ATOM 0 H MET A 81 7.133 -4.940 -1.911 1.00 0.00 H new ATOM 0 HA MET A 81 6.023 -6.054 0.585 1.00 0.00 H new ATOM 0 HB2 MET A 81 4.258 -5.687 -1.281 1.00 0.00 H new ATOM 0 HB3 MET A 81 5.060 -6.988 -2.138 1.00 0.00 H new ATOM 0 HG2 MET A 81 4.857 -8.444 -0.128 1.00 0.00 H new ATOM 0 HG3 MET A 81 4.069 -7.143 0.741 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.693 -7.008 -1.649 1.00 0.00 H new ATOM 0 HE2 MET A 81 1.368 -6.246 -0.190 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.198 -6.064 -1.753 1.00 0.00 H new ATOM 419 N ASP A 82 7.380 -8.110 0.405 1.00 0.00 N ATOM 420 CA ASP A 82 8.229 -9.320 0.401 1.00 0.00 C ATOM 421 C ASP A 82 7.388 -10.598 0.454 1.00 0.00 C ATOM 422 O ASP A 82 6.358 -10.618 1.117 1.00 0.00 O ATOM 423 CB ASP A 82 9.172 -9.294 1.591 1.00 0.00 C ATOM 424 CG ASP A 82 10.609 -9.489 1.114 1.00 0.00 C ATOM 425 OD1 ASP A 82 10.859 -10.607 0.607 1.00 0.00 O ATOM 426 OD2 ASP A 82 11.406 -8.552 1.293 1.00 0.00 O ATOM 0 H ASP A 82 6.920 -7.930 1.297 1.00 0.00 H new ATOM 0 HA ASP A 82 8.798 -9.321 -0.529 1.00 0.00 H new ATOM 0 HB2 ASP A 82 9.080 -8.345 2.119 1.00 0.00 H new ATOM 0 HB3 ASP A 82 8.903 -10.080 2.297 1.00 0.00 H new ATOM 427 N THR A 83 8.047 -11.680 0.055 1.00 0.00 N ATOM 428 CA THR A 83 7.452 -13.031 -0.127 1.00 0.00 C ATOM 429 C THR A 83 6.695 -13.622 1.071 1.00 0.00 C ATOM 430 O THR A 83 5.952 -14.593 0.920 1.00 0.00 O ATOM 431 CB THR A 83 8.469 -14.050 -0.699 1.00 0.00 C ATOM 432 OG1 THR A 83 7.753 -15.217 -1.130 1.00 0.00 O ATOM 433 CG2 THR A 83 9.584 -14.418 0.284 1.00 0.00 C ATOM 0 H THR A 83 9.043 -11.657 -0.162 1.00 0.00 H new ATOM 0 HA THR A 83 6.672 -12.845 -0.865 1.00 0.00 H new ATOM 0 HB THR A 83 8.976 -13.581 -1.542 1.00 0.00 H new ATOM 0 HG1 THR A 83 6.941 -15.320 -0.592 1.00 0.00 H new ATOM 0 HG21 THR A 83 10.259 -15.135 -0.183 1.00 0.00 H new ATOM 0 HG22 THR A 83 10.140 -13.521 0.556 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.148 -14.861 1.180 1.00 0.00 H new ATOM 434 N ASP A 84 6.995 -13.111 2.259 1.00 0.00 N ATOM 435 CA ASP A 84 6.266 -13.384 3.524 1.00 0.00 C ATOM 436 C ASP A 84 4.822 -12.857 3.529 1.00 0.00 C ATOM 437 O ASP A 84 4.033 -13.246 4.386 1.00 0.00 O ATOM 438 CB ASP A 84 7.088 -12.769 4.667 1.00 0.00 C ATOM 439 CG ASP A 84 8.509 -13.345 4.749 1.00 0.00 C ATOM 440 OD1 ASP A 84 8.671 -14.412 5.381 1.00 0.00 O ATOM 441 OD2 ASP A 84 9.383 -12.722 4.106 1.00 0.00 O ATOM 0 H ASP A 84 7.778 -12.470 2.389 1.00 0.00 H new ATOM 0 HA ASP A 84 6.165 -14.463 3.646 1.00 0.00 H new ATOM 0 HB2 ASP A 84 7.145 -11.689 4.528 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.575 -12.942 5.613 1.00 0.00 H new ATOM 442 N GLY A 85 4.530 -11.951 2.604 1.00 0.00 N ATOM 443 CA GLY A 85 3.234 -11.230 2.520 1.00 0.00 C ATOM 444 C GLY A 85 3.360 -9.742 2.880 1.00 0.00 C ATOM 445 O GLY A 85 2.575 -8.906 2.437 1.00 0.00 O ATOM 0 H GLY A 85 5.187 -11.681 1.872 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.836 -11.323 1.510 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.516 -11.702 3.190 1.00 0.00 H new ATOM 446 N LEU A 86 4.488 -9.400 3.477 1.00 0.00 N ATOM 447 CA LEU A 86 4.595 -8.187 4.291 1.00 0.00 C ATOM 448 C LEU A 86 5.124 -6.976 3.535 1.00 0.00 C ATOM 449 O LEU A 86 6.093 -7.065 2.779 1.00 0.00 O ATOM 450 CB LEU A 86 5.429 -8.470 5.552 1.00 0.00 C ATOM 451 CG LEU A 86 5.129 -9.799 6.255 1.00 0.00 C ATOM 452 CD1 LEU A 86 5.654 -9.630 7.676 1.00 0.00 C ATOM 453 CD2 LEU A 86 3.662 -10.252 6.346 1.00 0.00 C ATOM 0 H LEU A 86 5.350 -9.943 3.417 1.00 0.00 H new ATOM 0 HA LEU A 86 3.579 -7.917 4.580 1.00 0.00 H new ATOM 0 HB2 LEU A 86 6.484 -8.452 5.280 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.269 -7.659 6.262 1.00 0.00 H new ATOM 0 HG LEU A 86 5.599 -10.575 5.650 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.474 -10.544 8.242 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.724 -9.426 7.647 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.140 -8.798 8.157 1.00 0.00 H new ATOM 0 HD21 LEU A 86 3.608 -11.207 6.869 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.084 -9.506 6.892 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.253 -10.364 5.342 1.00 0.00 H new ATOM 454 N LEU A 87 4.678 -5.845 4.077 1.00 0.00 N ATOM 455 CA LEU A 87 4.943 -4.511 3.509 1.00 0.00 C ATOM 456 C LEU A 87 5.986 -3.769 4.340 1.00 0.00 C ATOM 457 O LEU A 87 5.824 -3.512 5.532 1.00 0.00 O ATOM 458 CB LEU A 87 3.690 -3.626 3.380 1.00 0.00 C ATOM 459 CG LEU A 87 2.549 -4.223 2.567 1.00 0.00 C ATOM 460 CD1 LEU A 87 1.329 -3.321 2.765 1.00 0.00 C ATOM 461 CD2 LEU A 87 2.946 -4.312 1.100 1.00 0.00 C ATOM 0 H LEU A 87 4.118 -5.821 4.929 1.00 0.00 H new ATOM 0 HA LEU A 87 5.313 -4.697 2.501 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.321 -3.400 4.380 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.980 -2.679 2.926 1.00 0.00 H new ATOM 0 HG LEU A 87 2.316 -5.235 2.896 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.488 -3.717 2.196 1.00 0.00 H new ATOM 0 HD12 LEU A 87 1.069 -3.288 3.823 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.561 -2.314 2.417 1.00 0.00 H new ATOM 0 HD21 LEU A 87 2.124 -4.740 0.526 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.171 -3.314 0.723 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.827 -4.945 0.999 1.00 0.00 H new ATOM 462 N TYR A 88 7.041 -3.407 3.621 1.00 0.00 N ATOM 463 CA TYR A 88 8.229 -2.743 4.186 1.00 0.00 C ATOM 464 C TYR A 88 8.600 -1.462 3.455 1.00 0.00 C ATOM 465 O TYR A 88 8.399 -1.334 2.244 1.00 0.00 O ATOM 466 CB TYR A 88 9.442 -3.697 4.280 1.00 0.00 C ATOM 467 CG TYR A 88 9.939 -4.333 2.983 1.00 0.00 C ATOM 468 CD1 TYR A 88 9.102 -5.197 2.243 1.00 0.00 C ATOM 469 CD2 TYR A 88 11.252 -4.032 2.563 1.00 0.00 C ATOM 470 CE1 TYR A 88 9.584 -5.736 1.043 1.00 0.00 C ATOM 471 CE2 TYR A 88 11.735 -4.602 1.374 1.00 0.00 C ATOM 472 CZ TYR A 88 10.872 -5.425 0.609 1.00 0.00 C ATOM 473 OH TYR A 88 11.267 -5.805 -0.624 1.00 0.00 O ATOM 0 H TYR A 88 7.105 -3.564 2.615 1.00 0.00 H new ATOM 0 HA TYR A 88 7.948 -2.459 5.200 1.00 0.00 H new ATOM 0 HB2 TYR A 88 10.271 -3.145 4.724 1.00 0.00 H new ATOM 0 HB3 TYR A 88 9.187 -4.499 4.972 1.00 0.00 H new ATOM 0 HD1 TYR A 88 8.110 -5.437 2.595 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.877 -3.373 3.148 1.00 0.00 H new ATOM 0 HE1 TYR A 88 8.959 -6.391 0.455 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.748 -4.416 1.048 1.00 0.00 H new ATOM 0 HH TYR A 88 12.190 -5.513 -0.776 1.00 0.00 H new ATOM 474 N GLY A 89 9.184 -0.556 4.232 1.00 0.00 N ATOM 475 CA GLY A 89 9.612 0.779 3.783 1.00 0.00 C ATOM 476 C GLY A 89 10.976 0.696 3.118 1.00 0.00 C ATOM 477 O GLY A 89 11.989 1.105 3.674 1.00 0.00 O ATOM 0 H GLY A 89 9.381 -0.727 5.218 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.882 1.187 3.083 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.654 1.460 4.633 1.00 0.00 H new ATOM 478 N SER A 90 10.962 0.024 1.971 1.00 0.00 N ATOM 479 CA SER A 90 12.155 -0.188 1.129 1.00 0.00 C ATOM 480 C SER A 90 12.675 1.112 0.520 1.00 0.00 C ATOM 481 O SER A 90 12.018 1.775 -0.278 1.00 0.00 O ATOM 482 CB SER A 90 11.894 -1.255 0.066 1.00 0.00 C ATOM 483 OG SER A 90 12.999 -1.350 -0.840 1.00 0.00 O ATOM 0 H SER A 90 10.116 -0.397 1.587 1.00 0.00 H new ATOM 0 HA SER A 90 12.948 -0.557 1.779 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.727 -2.219 0.546 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.986 -1.011 -0.485 1.00 0.00 H new ATOM 0 HG SER A 90 12.917 -0.659 -1.530 1.00 0.00 H new ATOM 484 N GLN A 91 13.855 1.482 1.007 1.00 0.00 N ATOM 485 CA GLN A 91 14.633 2.654 0.584 1.00 0.00 C ATOM 486 C GLN A 91 14.756 2.783 -0.942 1.00 0.00 C ATOM 487 O GLN A 91 14.527 3.849 -1.505 1.00 0.00 O ATOM 488 CB GLN A 91 16.024 2.510 1.206 1.00 0.00 C ATOM 489 CG GLN A 91 16.098 2.784 2.717 1.00 0.00 C ATOM 490 CD GLN A 91 15.376 1.754 3.590 1.00 0.00 C ATOM 491 OE1 GLN A 91 15.225 0.585 3.255 1.00 0.00 O ATOM 492 NE2 GLN A 91 14.915 2.159 4.754 1.00 0.00 N ATOM 0 H GLN A 91 14.322 0.951 1.742 1.00 0.00 H new ATOM 0 HA GLN A 91 14.120 3.556 0.918 1.00 0.00 H new ATOM 0 HB2 GLN A 91 16.385 1.499 1.018 1.00 0.00 H new ATOM 0 HB3 GLN A 91 16.705 3.191 0.696 1.00 0.00 H new ATOM 0 HG2 GLN A 91 17.146 2.822 3.015 1.00 0.00 H new ATOM 0 HG3 GLN A 91 15.675 3.769 2.915 1.00 0.00 H new ATOM 0 HE21 GLN A 91 15.036 3.130 5.041 1.00 0.00 H new ATOM 0 HE22 GLN A 91 14.436 1.502 5.370 1.00 0.00 H new ATOM 493 N THR A 92 14.893 1.624 -1.572 1.00 0.00 N ATOM 494 CA THR A 92 15.069 1.503 -3.033 1.00 0.00 C ATOM 495 C THR A 92 13.809 0.942 -3.718 1.00 0.00 C ATOM 496 O THR A 92 13.102 0.119 -3.117 1.00 0.00 O ATOM 497 CB THR A 92 16.312 0.640 -3.337 1.00 0.00 C ATOM 498 OG1 THR A 92 16.595 0.763 -4.739 1.00 0.00 O ATOM 499 CG2 THR A 92 16.150 -0.838 -2.968 1.00 0.00 C ATOM 0 H THR A 92 14.887 0.726 -1.088 1.00 0.00 H new ATOM 0 HA THR A 92 15.225 2.500 -3.445 1.00 0.00 H new ATOM 0 HB THR A 92 17.131 1.007 -2.719 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.383 0.225 -4.962 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.066 -1.376 -3.212 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.951 -0.927 -1.900 1.00 0.00 H new ATOM 0 HG23 THR A 92 15.318 -1.264 -3.529 1.00 0.00 H new ATOM 500 N PRO A 93 13.530 1.336 -4.961 1.00 0.00 N ATOM 501 CA PRO A 93 12.497 0.712 -5.771 1.00 0.00 C ATOM 502 C PRO A 93 12.995 -0.561 -6.467 1.00 0.00 C ATOM 503 O PRO A 93 14.173 -0.718 -6.776 1.00 0.00 O ATOM 504 CB PRO A 93 12.067 1.772 -6.781 1.00 0.00 C ATOM 505 CG PRO A 93 13.361 2.543 -7.039 1.00 0.00 C ATOM 506 CD PRO A 93 14.111 2.464 -5.692 1.00 0.00 C ATOM 0 HA PRO A 93 11.661 0.386 -5.152 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.675 1.324 -7.694 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.285 2.418 -6.381 1.00 0.00 H new ATOM 0 HG2 PRO A 93 13.940 2.094 -7.846 1.00 0.00 H new ATOM 0 HG3 PRO A 93 13.161 3.575 -7.326 1.00 0.00 H new ATOM 0 HD2 PRO A 93 15.179 2.315 -5.850 1.00 0.00 H new ATOM 0 HD3 PRO A 93 13.998 3.391 -5.130 1.00 0.00 H new ATOM 507 N ASN A 94 12.128 -1.557 -6.373 1.00 0.00 N ATOM 508 CA ASN A 94 12.253 -2.859 -7.051 1.00 0.00 C ATOM 509 C ASN A 94 10.840 -3.222 -7.551 1.00 0.00 C ATOM 510 O ASN A 94 9.874 -2.553 -7.186 1.00 0.00 O ATOM 511 CB ASN A 94 12.766 -3.862 -6.005 1.00 0.00 C ATOM 512 CG ASN A 94 13.162 -5.244 -6.551 1.00 0.00 C ATOM 513 OD1 ASN A 94 12.342 -6.102 -6.848 1.00 0.00 O ATOM 514 ND2 ASN A 94 14.449 -5.493 -6.641 1.00 0.00 N ATOM 0 H ASN A 94 11.284 -1.489 -5.804 1.00 0.00 H new ATOM 0 HA ASN A 94 12.943 -2.855 -7.895 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.631 -3.427 -5.504 1.00 0.00 H new ATOM 0 HB3 ASN A 94 11.994 -3.998 -5.248 1.00 0.00 H new ATOM 0 HD21 ASN A 94 14.771 -6.407 -6.960 1.00 0.00 H new ATOM 0 HD22 ASN A 94 15.127 -4.772 -6.392 1.00 0.00 H new ATOM 515 N GLU A 95 10.690 -4.369 -8.212 1.00 0.00 N ATOM 516 CA GLU A 95 9.377 -4.986 -8.511 1.00 0.00 C ATOM 517 C GLU A 95 8.519 -5.075 -7.236 1.00 0.00 C ATOM 518 O GLU A 95 7.296 -4.933 -7.258 1.00 0.00 O ATOM 519 CB GLU A 95 9.540 -6.467 -8.887 1.00 0.00 C ATOM 520 CG GLU A 95 10.522 -6.814 -10.015 1.00 0.00 C ATOM 521 CD GLU A 95 10.098 -6.200 -11.354 1.00 0.00 C ATOM 522 OE1 GLU A 95 9.319 -6.868 -12.060 1.00 0.00 O ATOM 523 OE2 GLU A 95 10.566 -5.069 -11.605 1.00 0.00 O ATOM 0 H GLU A 95 11.480 -4.911 -8.564 1.00 0.00 H new ATOM 0 HA GLU A 95 8.939 -4.377 -9.302 1.00 0.00 H new ATOM 0 HB2 GLU A 95 9.852 -7.007 -7.993 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.559 -6.852 -9.166 1.00 0.00 H new ATOM 0 HG2 GLU A 95 11.518 -6.457 -9.752 1.00 0.00 H new ATOM 0 HG3 GLU A 95 10.588 -7.897 -10.118 1.00 0.00 H new ATOM 524 N GLU A 96 9.203 -5.406 -6.147 1.00 0.00 N ATOM 525 CA GLU A 96 8.655 -5.428 -4.776 1.00 0.00 C ATOM 526 C GLU A 96 7.902 -4.155 -4.380 1.00 0.00 C ATOM 527 O GLU A 96 6.796 -4.218 -3.864 1.00 0.00 O ATOM 528 CB GLU A 96 9.822 -5.634 -3.817 1.00 0.00 C ATOM 529 CG GLU A 96 10.247 -7.108 -3.938 1.00 0.00 C ATOM 530 CD GLU A 96 11.168 -7.593 -2.816 1.00 0.00 C ATOM 531 OE1 GLU A 96 12.361 -7.234 -2.890 1.00 0.00 O ATOM 532 OE2 GLU A 96 10.692 -8.402 -1.982 1.00 0.00 O ATOM 0 H GLU A 96 10.186 -5.677 -6.184 1.00 0.00 H new ATOM 0 HA GLU A 96 7.924 -6.235 -4.730 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.650 -4.972 -4.069 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.527 -5.400 -2.794 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.353 -7.731 -3.953 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.752 -7.251 -4.894 1.00 0.00 H new ATOM 533 N CYS A 97 8.464 -3.041 -4.839 1.00 0.00 N ATOM 534 CA CYS A 97 7.996 -1.678 -4.542 1.00 0.00 C ATOM 535 C CYS A 97 7.075 -1.137 -5.649 1.00 0.00 C ATOM 536 O CYS A 97 6.463 -0.069 -5.516 1.00 0.00 O ATOM 537 CB CYS A 97 9.246 -0.801 -4.397 1.00 0.00 C ATOM 538 SG CYS A 97 10.621 -1.526 -3.414 1.00 0.00 S ATOM 0 H CYS A 97 9.283 -3.055 -5.447 1.00 0.00 H new ATOM 0 HA CYS A 97 7.404 -1.675 -3.626 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.621 -0.567 -5.394 1.00 0.00 H new ATOM 0 HB3 CYS A 97 8.954 0.143 -3.937 1.00 0.00 H new ATOM 0 HG CYS A 97 11.529 -0.620 -3.203 1.00 0.00 H new ATOM 539 N LEU A 98 6.962 -1.918 -6.724 1.00 0.00 N ATOM 540 CA LEU A 98 6.137 -1.605 -7.890 1.00 0.00 C ATOM 541 C LEU A 98 4.864 -2.439 -7.810 1.00 0.00 C ATOM 542 O LEU A 98 4.848 -3.594 -7.391 1.00 0.00 O ATOM 543 CB LEU A 98 6.906 -1.919 -9.182 1.00 0.00 C ATOM 544 CG LEU A 98 6.266 -1.178 -10.366 1.00 0.00 C ATOM 545 CD1 LEU A 98 6.364 0.307 -10.227 1.00 0.00 C ATOM 546 CD2 LEU A 98 7.095 -1.466 -11.606 1.00 0.00 C ATOM 0 H LEU A 98 7.454 -2.807 -6.809 1.00 0.00 H new ATOM 0 HA LEU A 98 5.885 -0.545 -7.900 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.949 -1.621 -9.076 1.00 0.00 H new ATOM 0 HB3 LEU A 98 6.899 -2.993 -9.368 1.00 0.00 H new ATOM 0 HG LEU A 98 5.227 -1.503 -10.414 1.00 0.00 H new ATOM 0 HD11 LEU A 98 5.897 0.785 -11.089 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.853 0.622 -9.317 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.413 0.599 -10.174 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.660 -0.950 -12.462 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.115 -1.116 -11.451 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.105 -2.539 -11.796 1.00 0.00 H new ATOM 547 N PHE A 99 3.795 -1.698 -8.039 1.00 0.00 N ATOM 548 CA PHE A 99 2.442 -2.234 -7.976 1.00 0.00 C ATOM 549 C PHE A 99 1.646 -2.022 -9.259 1.00 0.00 C ATOM 550 O PHE A 99 2.130 -1.364 -10.165 1.00 0.00 O ATOM 551 CB PHE A 99 1.685 -1.546 -6.833 1.00 0.00 C ATOM 552 CG PHE A 99 2.247 -1.921 -5.468 1.00 0.00 C ATOM 553 CD1 PHE A 99 1.751 -3.092 -4.852 1.00 0.00 C ATOM 554 CD2 PHE A 99 3.293 -1.180 -4.879 1.00 0.00 C ATOM 555 CE1 PHE A 99 2.330 -3.547 -3.656 1.00 0.00 C ATOM 556 CE2 PHE A 99 3.870 -1.627 -3.672 1.00 0.00 C ATOM 557 CZ PHE A 99 3.376 -2.805 -3.067 1.00 0.00 C ATOM 0 H PHE A 99 3.838 -0.706 -8.274 1.00 0.00 H new ATOM 0 HA PHE A 99 2.540 -3.308 -7.819 1.00 0.00 H new ATOM 0 HB2 PHE A 99 1.738 -0.465 -6.962 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.631 -1.821 -6.879 1.00 0.00 H new ATOM 0 HD1 PHE A 99 0.931 -3.634 -5.299 1.00 0.00 H new ATOM 0 HD2 PHE A 99 3.650 -0.276 -5.349 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.978 -4.456 -3.191 1.00 0.00 H new ATOM 0 HE2 PHE A 99 4.679 -1.076 -3.216 1.00 0.00 H new ATOM 0 HZ PHE A 99 3.807 -3.144 -2.136 1.00 0.00 H new ATOM 558 N LEU A 100 0.560 -2.748 -9.436 1.00 0.00 N ATOM 559 CA LEU A 100 -0.401 -2.360 -10.478 1.00 0.00 C ATOM 560 C LEU A 100 -1.529 -1.492 -9.949 1.00 0.00 C ATOM 561 O LEU A 100 -2.108 -1.780 -8.904 1.00 0.00 O ATOM 562 CB LEU A 100 -1.026 -3.595 -11.144 1.00 0.00 C ATOM 563 CG LEU A 100 -0.319 -3.970 -12.446 1.00 0.00 C ATOM 564 CD1 LEU A 100 1.098 -4.468 -12.191 1.00 0.00 C ATOM 565 CD2 LEU A 100 -1.129 -5.054 -13.164 1.00 0.00 C ATOM 0 H LEU A 100 0.316 -3.581 -8.900 1.00 0.00 H new ATOM 0 HA LEU A 100 0.175 -1.784 -11.202 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.984 -4.438 -10.454 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -2.079 -3.402 -11.347 1.00 0.00 H new ATOM 0 HG LEU A 100 -0.250 -3.078 -13.068 1.00 0.00 H new ATOM 0 HD11 LEU A 100 1.569 -4.725 -13.140 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.676 -3.685 -11.699 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.064 -5.350 -11.552 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.629 -5.326 -14.094 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.208 -5.933 -12.524 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.127 -4.676 -13.385 1.00 0.00 H new ATOM 566 N GLU A 101 -1.759 -0.395 -10.662 1.00 0.00 N ATOM 567 CA GLU A 101 -2.916 0.471 -10.416 1.00 0.00 C ATOM 568 C GLU A 101 -4.209 -0.196 -10.910 1.00 0.00 C ATOM 569 O GLU A 101 -4.634 -0.070 -12.048 1.00 0.00 O ATOM 570 CB GLU A 101 -2.790 1.851 -11.050 1.00 0.00 C ATOM 571 CG GLU A 101 -2.470 2.911 -10.011 1.00 0.00 C ATOM 572 CD GLU A 101 -2.405 4.335 -10.560 1.00 0.00 C ATOM 573 OE1 GLU A 101 -1.781 4.523 -11.631 1.00 0.00 O ATOM 574 OE2 GLU A 101 -2.902 5.233 -9.851 1.00 0.00 O ATOM 0 H GLU A 101 -1.156 -0.079 -11.422 1.00 0.00 H new ATOM 0 HA GLU A 101 -2.952 0.613 -9.336 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -2.007 1.835 -11.808 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.720 2.106 -11.558 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -3.225 2.872 -9.226 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -1.514 2.670 -9.547 1.00 0.00 H new ATOM 575 N ARG A 102 -4.678 -1.069 -10.040 1.00 0.00 N ATOM 576 CA ARG A 102 -5.955 -1.780 -10.198 1.00 0.00 C ATOM 577 C ARG A 102 -7.050 -0.845 -9.704 1.00 0.00 C ATOM 578 O ARG A 102 -7.056 -0.432 -8.539 1.00 0.00 O ATOM 579 CB ARG A 102 -5.941 -2.980 -9.274 1.00 0.00 C ATOM 580 CG ARG A 102 -5.043 -4.163 -9.612 1.00 0.00 C ATOM 581 CD ARG A 102 -5.411 -4.882 -10.924 1.00 0.00 C ATOM 582 NE ARG A 102 -6.871 -5.030 -11.102 1.00 0.00 N ATOM 583 CZ ARG A 102 -7.514 -4.874 -12.247 1.00 0.00 C ATOM 584 NH1 ARG A 102 -6.871 -4.523 -13.360 1.00 0.00 N ATOM 585 NH2 ARG A 102 -8.829 -5.020 -12.294 1.00 0.00 N ATOM 0 H ARG A 102 -4.181 -1.316 -9.184 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.112 -2.083 -11.233 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.661 -2.627 -8.281 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -6.963 -3.353 -9.203 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -4.012 -3.815 -9.679 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -5.084 -4.881 -8.793 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -5.001 -4.325 -11.766 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -4.946 -5.868 -10.937 1.00 0.00 H new ATOM 0 HE ARG A 102 -7.424 -5.271 -10.280 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -5.863 -4.369 -13.340 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -7.387 -4.408 -14.232 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -9.347 -5.253 -11.447 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -9.324 -4.899 -13.178 1.00 0.00 H new ATOM 586 N LEU A 103 -8.076 -0.670 -10.529 1.00 0.00 N ATOM 587 CA LEU A 103 -9.161 0.257 -10.165 1.00 0.00 C ATOM 588 C LEU A 103 -10.539 -0.397 -10.152 1.00 0.00 C ATOM 589 O LEU A 103 -10.997 -0.947 -11.157 1.00 0.00 O ATOM 590 CB LEU A 103 -9.173 1.481 -11.088 1.00 0.00 C ATOM 591 CG LEU A 103 -8.615 2.762 -10.435 1.00 0.00 C ATOM 592 CD1 LEU A 103 -9.447 3.180 -9.219 1.00 0.00 C ATOM 593 CD2 LEU A 103 -7.119 2.652 -10.112 1.00 0.00 C ATOM 0 H LEU A 103 -8.187 -1.138 -11.429 1.00 0.00 H new ATOM 0 HA LEU A 103 -8.949 0.573 -9.143 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -8.589 1.256 -11.981 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -10.196 1.667 -11.415 1.00 0.00 H new ATOM 0 HG LEU A 103 -8.704 3.560 -11.172 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.025 4.086 -8.784 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -10.474 3.371 -9.529 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.434 2.381 -8.477 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -6.776 3.580 -9.654 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -6.956 1.825 -9.421 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -6.561 2.473 -11.031 1.00 0.00 H new ATOM 594 N GLU A 104 -11.260 -0.030 -9.091 1.00 0.00 N ATOM 595 CA GLU A 104 -12.701 -0.340 -8.949 1.00 0.00 C ATOM 596 C GLU A 104 -13.573 0.636 -9.759 1.00 0.00 C ATOM 597 O GLU A 104 -14.772 0.778 -9.506 1.00 0.00 O ATOM 598 CB GLU A 104 -13.072 -0.237 -7.467 1.00 0.00 C ATOM 599 CG GLU A 104 -12.403 -1.319 -6.606 1.00 0.00 C ATOM 600 CD GLU A 104 -12.995 -2.718 -6.808 1.00 0.00 C ATOM 601 OE1 GLU A 104 -12.791 -3.305 -7.893 1.00 0.00 O ATOM 602 OE2 GLU A 104 -13.572 -3.224 -5.827 1.00 0.00 O ATOM 0 H GLU A 104 -10.872 0.489 -8.303 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.882 -1.345 -9.330 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.785 0.746 -7.093 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -14.154 -0.314 -7.362 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.338 -1.348 -6.837 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -12.494 -1.043 -5.555 1.00 0.00 H new ATOM 603 N GLU A 105 -12.974 1.183 -10.822 1.00 0.00 N ATOM 604 CA GLU A 105 -13.448 2.330 -11.623 1.00 0.00 C ATOM 605 C GLU A 105 -13.711 3.624 -10.863 1.00 0.00 C ATOM 606 O GLU A 105 -13.465 4.712 -11.370 1.00 0.00 O ATOM 607 CB GLU A 105 -14.662 1.983 -12.490 1.00 0.00 C ATOM 608 CG GLU A 105 -14.262 1.203 -13.753 1.00 0.00 C ATOM 609 CD GLU A 105 -15.292 1.459 -14.848 1.00 0.00 C ATOM 610 OE1 GLU A 105 -15.160 2.520 -15.495 1.00 0.00 O ATOM 611 OE2 GLU A 105 -16.193 0.609 -15.007 1.00 0.00 O ATOM 0 H GLU A 105 -12.089 0.818 -11.173 1.00 0.00 H new ATOM 0 HA GLU A 105 -12.586 2.536 -12.258 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -15.367 1.391 -11.906 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -15.176 2.900 -12.778 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -13.272 1.513 -14.088 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -14.204 0.137 -13.533 1.00 0.00 H new ATOM 612 N ASN A 106 -14.380 3.442 -9.739 1.00 0.00 N ATOM 613 CA ASN A 106 -14.500 4.413 -8.651 1.00 0.00 C ATOM 614 C ASN A 106 -13.120 4.504 -7.979 1.00 0.00 C ATOM 615 O ASN A 106 -12.333 3.561 -8.063 1.00 0.00 O ATOM 616 CB ASN A 106 -15.538 3.800 -7.702 1.00 0.00 C ATOM 617 CG ASN A 106 -16.258 4.900 -6.916 1.00 0.00 C ATOM 618 OD1 ASN A 106 -15.805 5.342 -5.875 1.00 0.00 O ATOM 619 ND2 ASN A 106 -17.319 5.456 -7.454 1.00 0.00 N ATOM 0 H ASN A 106 -14.880 2.575 -9.545 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.802 5.413 -8.962 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.262 3.218 -8.272 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.048 3.112 -7.012 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -17.761 6.255 -7.000 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.701 5.088 -8.326 1.00 0.00 H new ATOM 620 N HIS A 107 -13.020 5.465 -7.070 1.00 0.00 N ATOM 621 CA HIS A 107 -11.766 5.991 -6.467 1.00 0.00 C ATOM 622 C HIS A 107 -10.894 5.015 -5.657 1.00 0.00 C ATOM 623 O HIS A 107 -9.743 5.308 -5.335 1.00 0.00 O ATOM 624 CB HIS A 107 -12.113 7.188 -5.587 1.00 0.00 C ATOM 625 CG HIS A 107 -13.039 8.208 -6.266 1.00 0.00 C ATOM 626 ND1 HIS A 107 -13.253 8.344 -7.573 1.00 0.00 N ATOM 627 CD2 HIS A 107 -13.927 8.956 -5.630 1.00 0.00 C ATOM 628 CE1 HIS A 107 -14.299 9.148 -7.742 1.00 0.00 C ATOM 629 NE2 HIS A 107 -14.705 9.536 -6.543 1.00 0.00 N ATOM 0 H HIS A 107 -13.847 5.935 -6.702 1.00 0.00 H new ATOM 0 HA HIS A 107 -11.145 6.241 -7.327 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -12.589 6.830 -4.674 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -11.191 7.689 -5.291 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -14.007 9.075 -4.560 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -14.738 9.433 -8.687 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -15.480 10.170 -6.351 1.00 0.00 H new ATOM 630 N TYR A 108 -11.430 3.804 -5.492 1.00 0.00 N ATOM 631 CA TYR A 108 -10.802 2.670 -4.798 1.00 0.00 C ATOM 632 C TYR A 108 -9.684 2.070 -5.646 1.00 0.00 C ATOM 633 O TYR A 108 -9.894 1.290 -6.582 1.00 0.00 O ATOM 634 CB TYR A 108 -11.850 1.605 -4.481 1.00 0.00 C ATOM 635 CG TYR A 108 -13.001 2.142 -3.635 1.00 0.00 C ATOM 636 CD1 TYR A 108 -12.806 2.264 -2.244 1.00 0.00 C ATOM 637 CD2 TYR A 108 -14.174 2.597 -4.275 1.00 0.00 C ATOM 638 CE1 TYR A 108 -13.801 2.883 -1.471 1.00 0.00 C ATOM 639 CE2 TYR A 108 -15.172 3.223 -3.491 1.00 0.00 C ATOM 640 CZ TYR A 108 -14.959 3.361 -2.105 1.00 0.00 C ATOM 641 OH TYR A 108 -15.874 4.051 -1.377 1.00 0.00 O ATOM 0 H TYR A 108 -12.355 3.573 -5.854 1.00 0.00 H new ATOM 0 HA TYR A 108 -10.369 3.033 -3.866 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -12.247 1.203 -5.413 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -11.373 0.778 -3.955 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -11.906 1.887 -1.781 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -14.307 2.470 -5.339 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -13.677 2.990 -0.403 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -16.080 3.588 -3.947 1.00 0.00 H new ATOM 0 HH TYR A 108 -16.619 4.317 -1.955 1.00 0.00 H new ATOM 642 N ASN A 109 -8.513 2.619 -5.366 1.00 0.00 N ATOM 643 CA ASN A 109 -7.219 2.268 -5.951 1.00 0.00 C ATOM 644 C ASN A 109 -6.632 1.094 -5.163 1.00 0.00 C ATOM 645 O ASN A 109 -6.429 1.154 -3.954 1.00 0.00 O ATOM 646 CB ASN A 109 -6.303 3.481 -5.836 1.00 0.00 C ATOM 647 CG ASN A 109 -6.208 4.269 -7.145 1.00 0.00 C ATOM 648 OD1 ASN A 109 -5.236 4.175 -7.888 1.00 0.00 O ATOM 649 ND2 ASN A 109 -7.233 5.029 -7.462 1.00 0.00 N ATOM 0 H ASN A 109 -8.430 3.370 -4.681 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.324 1.984 -6.998 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -6.671 4.137 -5.047 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -5.307 3.153 -5.540 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -7.228 5.552 -8.338 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -8.033 5.095 -6.832 1.00 0.00 H new ATOM 650 N THR A 110 -6.673 -0.029 -5.854 1.00 0.00 N ATOM 651 CA THR A 110 -6.154 -1.318 -5.354 1.00 0.00 C ATOM 652 C THR A 110 -4.809 -1.611 -6.060 1.00 0.00 C ATOM 653 O THR A 110 -4.586 -1.151 -7.180 1.00 0.00 O ATOM 654 CB THR A 110 -7.209 -2.415 -5.539 1.00 0.00 C ATOM 655 OG1 THR A 110 -7.593 -2.551 -6.900 1.00 0.00 O ATOM 656 CG2 THR A 110 -8.463 -2.153 -4.702 1.00 0.00 C ATOM 0 H THR A 110 -7.070 -0.088 -6.792 1.00 0.00 H new ATOM 0 HA THR A 110 -5.955 -1.281 -4.283 1.00 0.00 H new ATOM 0 HB THR A 110 -6.740 -3.339 -5.200 1.00 0.00 H new ATOM 0 HG1 THR A 110 -7.326 -1.750 -7.397 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.183 -2.955 -4.864 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.194 -2.115 -3.646 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.906 -1.202 -4.998 1.00 0.00 H new ATOM 657 N TYR A 111 -3.934 -2.419 -5.447 1.00 0.00 N ATOM 658 CA TYR A 111 -2.518 -2.453 -5.863 1.00 0.00 C ATOM 659 C TYR A 111 -1.816 -3.816 -5.769 1.00 0.00 C ATOM 660 O TYR A 111 -1.225 -4.134 -4.739 1.00 0.00 O ATOM 661 CB TYR A 111 -1.686 -1.423 -5.086 1.00 0.00 C ATOM 662 CG TYR A 111 -2.094 0.024 -5.306 1.00 0.00 C ATOM 663 CD1 TYR A 111 -1.849 0.631 -6.552 1.00 0.00 C ATOM 664 CD2 TYR A 111 -2.689 0.727 -4.225 1.00 0.00 C ATOM 665 CE1 TYR A 111 -2.221 1.975 -6.728 1.00 0.00 C ATOM 666 CE2 TYR A 111 -3.052 2.067 -4.405 1.00 0.00 C ATOM 667 CZ TYR A 111 -2.825 2.671 -5.663 1.00 0.00 C ATOM 668 OH TYR A 111 -3.140 3.989 -5.817 1.00 0.00 O ATOM 0 H TYR A 111 -4.170 -3.046 -4.678 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.568 -2.211 -6.925 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.757 -1.648 -4.022 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.639 -1.537 -5.366 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -1.386 0.077 -7.355 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.859 0.235 -3.279 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.045 2.470 -7.672 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.497 2.629 -3.598 1.00 0.00 H new ATOM 0 HH TYR A 111 -3.726 4.097 -6.595 1.00 0.00 H new ATOM 669 N ILE A 112 -1.788 -4.550 -6.881 1.00 0.00 N ATOM 670 CA ILE A 112 -1.092 -5.857 -6.896 1.00 0.00 C ATOM 671 C ILE A 112 0.421 -5.648 -7.057 1.00 0.00 C ATOM 672 O ILE A 112 0.862 -5.099 -8.067 1.00 0.00 O ATOM 673 CB ILE A 112 -1.517 -6.898 -7.950 1.00 0.00 C ATOM 674 CG1 ILE A 112 -2.989 -6.738 -8.360 1.00 0.00 C ATOM 675 CG2 ILE A 112 -1.110 -8.302 -7.455 1.00 0.00 C ATOM 676 CD1 ILE A 112 -3.793 -7.952 -8.852 1.00 0.00 C ATOM 0 H ILE A 112 -2.222 -4.282 -7.764 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.387 -6.280 -5.936 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.985 -6.733 -8.887 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.520 -6.325 -7.502 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.025 -5.986 -9.149 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -1.406 -9.048 -8.193 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -0.030 -8.339 -7.314 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -1.607 -8.512 -6.508 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.809 -7.641 -9.094 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -3.319 -8.366 -9.742 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.822 -8.711 -8.070 1.00 0.00 H new ATOM 677 N SER A 113 1.156 -6.246 -6.133 1.00 0.00 N ATOM 678 CA SER A 113 2.632 -6.234 -6.139 1.00 0.00 C ATOM 679 C SER A 113 3.161 -6.922 -7.386 1.00 0.00 C ATOM 680 O SER A 113 2.792 -8.055 -7.679 1.00 0.00 O ATOM 681 CB SER A 113 3.197 -6.902 -4.885 1.00 0.00 C ATOM 682 OG SER A 113 4.633 -6.811 -4.857 1.00 0.00 O ATOM 0 H SER A 113 0.755 -6.759 -5.348 1.00 0.00 H new ATOM 0 HA SER A 113 2.959 -5.194 -6.143 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.781 -6.427 -3.996 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.894 -7.949 -4.858 1.00 0.00 H new ATOM 0 HG SER A 113 4.908 -6.191 -4.150 1.00 0.00 H new ATOM 683 N LYS A 114 4.007 -6.188 -8.117 1.00 0.00 N ATOM 684 CA LYS A 114 4.603 -6.649 -9.374 1.00 0.00 C ATOM 685 C LYS A 114 5.242 -8.042 -9.278 1.00 0.00 C ATOM 686 O LYS A 114 4.864 -8.951 -10.025 1.00 0.00 O ATOM 687 CB LYS A 114 5.665 -5.654 -9.824 1.00 0.00 C ATOM 688 CG LYS A 114 5.209 -4.920 -11.076 1.00 0.00 C ATOM 689 CD LYS A 114 5.292 -5.864 -12.278 1.00 0.00 C ATOM 690 CE LYS A 114 4.603 -5.226 -13.476 1.00 0.00 C ATOM 691 NZ LYS A 114 4.895 -6.041 -14.666 1.00 0.00 N ATOM 0 H LYS A 114 4.300 -5.248 -7.849 1.00 0.00 H new ATOM 0 HA LYS A 114 3.788 -6.719 -10.095 1.00 0.00 H new ATOM 0 HB2 LYS A 114 5.862 -4.938 -9.026 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.601 -6.176 -10.022 1.00 0.00 H new ATOM 0 HG2 LYS A 114 4.187 -4.563 -10.950 1.00 0.00 H new ATOM 0 HG3 LYS A 114 5.834 -4.043 -11.245 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.334 -6.076 -12.516 1.00 0.00 H new ATOM 0 HD3 LYS A 114 4.819 -6.817 -12.039 1.00 0.00 H new ATOM 0 HE2 LYS A 114 3.527 -5.169 -13.309 1.00 0.00 H new ATOM 0 HE3 LYS A 114 4.958 -4.205 -13.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 4.432 -5.621 -15.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 5.923 -6.073 -14.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 4.537 -7.007 -14.522 1.00 0.00 H new ATOM 692 N LYS A 115 6.071 -8.226 -8.256 1.00 0.00 N ATOM 693 CA LYS A 115 6.740 -9.522 -8.043 1.00 0.00 C ATOM 694 C LYS A 115 5.764 -10.618 -7.582 1.00 0.00 C ATOM 695 O LYS A 115 5.790 -11.746 -8.089 1.00 0.00 O ATOM 696 CB LYS A 115 7.937 -9.326 -7.115 1.00 0.00 C ATOM 697 CG LYS A 115 7.602 -9.259 -5.617 1.00 0.00 C ATOM 698 CD LYS A 115 8.429 -10.276 -4.836 1.00 0.00 C ATOM 699 CE LYS A 115 8.079 -11.721 -5.205 1.00 0.00 C ATOM 700 NZ LYS A 115 9.332 -12.464 -5.300 1.00 0.00 N ATOM 0 H LYS A 115 6.299 -7.510 -7.566 1.00 0.00 H new ATOM 0 HA LYS A 115 7.120 -9.891 -8.996 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.639 -10.144 -7.277 1.00 0.00 H new ATOM 0 HB3 LYS A 115 8.448 -8.406 -7.398 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.798 -8.256 -5.239 1.00 0.00 H new ATOM 0 HG3 LYS A 115 6.540 -9.454 -5.467 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.488 -10.102 -5.026 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.268 -10.128 -3.768 1.00 0.00 H new ATOM 0 HE2 LYS A 115 7.427 -12.162 -4.451 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.540 -11.755 -6.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 9.131 -13.453 -5.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.934 -12.037 -6.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 9.825 -12.432 -4.385 1.00 0.00 H new ATOM 701 N HIS A 116 4.765 -10.211 -6.785 1.00 0.00 N ATOM 702 CA HIS A 116 3.731 -11.105 -6.230 1.00 0.00 C ATOM 703 C HIS A 116 2.475 -11.181 -7.104 1.00 0.00 C ATOM 704 O HIS A 116 1.430 -11.645 -6.654 1.00 0.00 O ATOM 705 CB HIS A 116 3.326 -10.619 -4.844 1.00 0.00 C ATOM 706 CG HIS A 116 4.498 -10.572 -3.877 1.00 0.00 C ATOM 707 ND1 HIS A 116 4.915 -9.483 -3.230 1.00 0.00 N ATOM 708 CD2 HIS A 116 5.201 -11.603 -3.440 1.00 0.00 C ATOM 709 CE1 HIS A 116 5.857 -9.859 -2.382 1.00 0.00 C ATOM 710 NE2 HIS A 116 6.028 -11.170 -2.504 1.00 0.00 N ATOM 0 H HIS A 116 4.649 -9.238 -6.502 1.00 0.00 H new ATOM 0 HA HIS A 116 4.169 -12.102 -6.188 1.00 0.00 H new ATOM 0 HB2 HIS A 116 2.886 -9.625 -4.925 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.555 -11.277 -4.443 1.00 0.00 H new ATOM 0 HD1 HIS A 116 4.570 -8.533 -3.365 1.00 0.00 H new ATOM 0 HD2 HIS A 116 5.115 -12.622 -3.787 1.00 0.00 H new ATOM 0 HE1 HIS A 116 6.395 -9.211 -1.706 1.00 0.00 H new ATOM 711 N ALA A 117 2.653 -10.916 -8.394 1.00 0.00 N ATOM 712 CA ALA A 117 1.556 -11.057 -9.384 1.00 0.00 C ATOM 713 C ALA A 117 1.076 -12.509 -9.461 1.00 0.00 C ATOM 714 O ALA A 117 -0.124 -12.783 -9.367 1.00 0.00 O ATOM 715 CB ALA A 117 2.036 -10.557 -10.741 1.00 0.00 C ATOM 0 H ALA A 117 3.538 -10.602 -8.792 1.00 0.00 H new ATOM 0 HA ALA A 117 0.705 -10.453 -9.069 1.00 0.00 H new ATOM 0 HB1 ALA A 117 1.233 -10.659 -11.471 1.00 0.00 H new ATOM 0 HB2 ALA A 117 2.323 -9.509 -10.662 1.00 0.00 H new ATOM 0 HB3 ALA A 117 2.895 -11.145 -11.062 1.00 0.00 H new ATOM 716 N GLU A 118 2.032 -13.401 -9.197 1.00 0.00 N ATOM 717 CA GLU A 118 1.866 -14.876 -9.168 1.00 0.00 C ATOM 718 C GLU A 118 1.080 -15.417 -7.959 1.00 0.00 C ATOM 719 O GLU A 118 0.748 -16.597 -7.891 1.00 0.00 O ATOM 720 CB GLU A 118 3.208 -15.622 -9.307 1.00 0.00 C ATOM 721 CG GLU A 118 4.490 -14.850 -8.963 1.00 0.00 C ATOM 722 CD GLU A 118 5.010 -14.048 -10.154 1.00 0.00 C ATOM 723 OE1 GLU A 118 4.541 -12.907 -10.335 1.00 0.00 O ATOM 724 OE2 GLU A 118 5.843 -14.613 -10.891 1.00 0.00 O ATOM 0 H GLU A 118 2.988 -13.115 -8.987 1.00 0.00 H new ATOM 0 HA GLU A 118 1.253 -15.082 -10.045 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.168 -16.507 -8.671 1.00 0.00 H new ATOM 0 HB3 GLU A 118 3.293 -15.972 -10.336 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.295 -14.176 -8.129 1.00 0.00 H new ATOM 0 HG3 GLU A 118 5.258 -15.550 -8.634 1.00 0.00 H new ATOM 725 N LYS A 119 0.861 -14.521 -7.003 1.00 0.00 N ATOM 726 CA LYS A 119 0.061 -14.753 -5.784 1.00 0.00 C ATOM 727 C LYS A 119 -1.151 -13.809 -5.673 1.00 0.00 C ATOM 728 O LYS A 119 -2.006 -14.026 -4.816 1.00 0.00 O ATOM 729 CB LYS A 119 1.008 -14.530 -4.602 1.00 0.00 C ATOM 730 CG LYS A 119 1.875 -15.757 -4.382 1.00 0.00 C ATOM 731 CD LYS A 119 3.303 -15.369 -4.015 1.00 0.00 C ATOM 732 CE LYS A 119 4.079 -14.833 -5.215 1.00 0.00 C ATOM 733 NZ LYS A 119 5.423 -14.475 -4.755 1.00 0.00 N ATOM 0 H LYS A 119 1.245 -13.577 -7.048 1.00 0.00 H new ATOM 0 HA LYS A 119 -0.351 -15.762 -5.804 1.00 0.00 H new ATOM 0 HB2 LYS A 119 1.638 -13.661 -4.791 1.00 0.00 H new ATOM 0 HB3 LYS A 119 0.432 -14.317 -3.701 1.00 0.00 H new ATOM 0 HG2 LYS A 119 1.447 -16.369 -3.588 1.00 0.00 H new ATOM 0 HG3 LYS A 119 1.882 -16.366 -5.286 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.282 -14.613 -3.230 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.821 -16.237 -3.608 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.132 -15.585 -6.002 1.00 0.00 H new ATOM 0 HE3 LYS A 119 3.576 -13.964 -5.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 5.715 -13.580 -5.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.418 -14.364 -3.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.092 -15.226 -5.019 1.00 0.00 H new ATOM 734 N ASN A 120 -1.252 -12.846 -6.594 1.00 0.00 N ATOM 735 CA ASN A 120 -2.278 -11.768 -6.635 1.00 0.00 C ATOM 736 C ASN A 120 -2.349 -10.912 -5.355 1.00 0.00 C ATOM 737 O ASN A 120 -3.406 -10.380 -5.001 1.00 0.00 O ATOM 738 CB ASN A 120 -3.654 -12.363 -6.965 1.00 0.00 C ATOM 739 CG ASN A 120 -3.657 -12.998 -8.350 1.00 0.00 C ATOM 740 OD1 ASN A 120 -3.675 -12.352 -9.387 1.00 0.00 O ATOM 741 ND2 ASN A 120 -3.650 -14.315 -8.398 1.00 0.00 N ATOM 0 H ASN A 120 -0.596 -12.783 -7.373 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.967 -11.084 -7.425 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.919 -13.111 -6.218 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -4.413 -11.582 -6.918 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -3.660 -14.793 -9.299 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -3.635 -14.857 -7.534 1.00 0.00 H new ATOM 742 N TRP A 121 -1.188 -10.606 -4.804 1.00 0.00 N ATOM 743 CA TRP A 121 -1.134 -9.843 -3.543 1.00 0.00 C ATOM 744 C TRP A 121 -1.243 -8.339 -3.731 1.00 0.00 C ATOM 745 O TRP A 121 -0.378 -7.690 -4.315 1.00 0.00 O ATOM 746 CB TRP A 121 0.100 -10.123 -2.699 1.00 0.00 C ATOM 747 CG TRP A 121 0.210 -11.574 -2.217 1.00 0.00 C ATOM 748 CD1 TRP A 121 -0.758 -12.482 -2.182 1.00 0.00 C ATOM 749 CD2 TRP A 121 1.341 -12.143 -1.668 1.00 0.00 C ATOM 750 NE1 TRP A 121 -0.288 -13.605 -1.666 1.00 0.00 N ATOM 751 CE2 TRP A 121 0.984 -13.446 -1.293 1.00 0.00 C ATOM 752 CE3 TRP A 121 2.600 -11.627 -1.343 1.00 0.00 C ATOM 753 CZ2 TRP A 121 1.862 -14.246 -0.545 1.00 0.00 C ATOM 754 CZ3 TRP A 121 3.515 -12.431 -0.645 1.00 0.00 C ATOM 755 CH2 TRP A 121 3.123 -13.719 -0.201 1.00 0.00 C ATOM 0 H TRP A 121 -0.280 -10.862 -5.191 1.00 0.00 H new ATOM 0 HA TRP A 121 -2.015 -10.204 -3.012 1.00 0.00 H new ATOM 0 HB2 TRP A 121 0.989 -9.876 -3.280 1.00 0.00 H new ATOM 0 HB3 TRP A 121 0.092 -9.463 -1.832 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -1.771 -12.327 -2.522 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -0.821 -14.469 -1.567 1.00 0.00 H new ATOM 0 HE3 TRP A 121 2.866 -10.619 -1.626 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 1.578 -15.242 -0.240 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.513 -12.070 -0.447 1.00 0.00 H new ATOM 0 HH2 TRP A 121 3.798 -14.303 0.407 1.00 0.00 H new ATOM 756 N PHE A 122 -2.309 -7.818 -3.137 1.00 0.00 N ATOM 757 CA PHE A 122 -2.541 -6.371 -3.094 1.00 0.00 C ATOM 758 C PHE A 122 -2.139 -5.842 -1.727 1.00 0.00 C ATOM 759 O PHE A 122 -2.206 -6.571 -0.727 1.00 0.00 O ATOM 760 CB PHE A 122 -4.013 -6.012 -3.307 1.00 0.00 C ATOM 761 CG PHE A 122 -4.655 -6.481 -4.603 1.00 0.00 C ATOM 762 CD1 PHE A 122 -5.000 -7.847 -4.754 1.00 0.00 C ATOM 763 CD2 PHE A 122 -5.171 -5.510 -5.481 1.00 0.00 C ATOM 764 CE1 PHE A 122 -5.899 -8.241 -5.759 1.00 0.00 C ATOM 765 CE2 PHE A 122 -6.090 -5.891 -6.492 1.00 0.00 C ATOM 766 CZ PHE A 122 -6.443 -7.250 -6.615 1.00 0.00 C ATOM 0 H PHE A 122 -3.030 -8.373 -2.676 1.00 0.00 H new ATOM 0 HA PHE A 122 -1.950 -5.928 -3.895 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.586 -6.424 -2.476 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -4.109 -4.928 -3.254 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.571 -8.587 -4.095 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.868 -4.478 -5.385 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.171 -9.280 -5.877 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -6.512 -5.152 -7.157 1.00 0.00 H new ATOM 0 HZ PHE A 122 -7.146 -7.544 -7.381 1.00 0.00 H new ATOM 767 N VAL A 123 -1.661 -4.600 -1.702 1.00 0.00 N ATOM 768 CA VAL A 123 -1.489 -3.911 -0.413 1.00 0.00 C ATOM 769 C VAL A 123 -2.848 -3.768 0.275 1.00 0.00 C ATOM 770 O VAL A 123 -3.866 -3.580 -0.383 1.00 0.00 O ATOM 771 CB VAL A 123 -0.750 -2.562 -0.452 1.00 0.00 C ATOM 772 CG1 VAL A 123 0.679 -2.780 -0.890 1.00 0.00 C ATOM 773 CG2 VAL A 123 -1.365 -1.490 -1.345 1.00 0.00 C ATOM 0 H VAL A 123 -1.392 -4.060 -2.525 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.820 -4.551 0.162 1.00 0.00 H new ATOM 0 HB VAL A 123 -0.825 -2.181 0.567 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.201 -1.824 -0.917 1.00 0.00 H new ATOM 0 HG12 VAL A 123 1.178 -3.446 -0.186 1.00 0.00 H new ATOM 0 HG13 VAL A 123 0.691 -3.228 -1.884 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.761 -0.584 -1.294 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -1.397 -1.848 -2.374 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -2.377 -1.271 -1.006 1.00 0.00 H new ATOM 774 N GLY A 124 -2.826 -4.026 1.569 1.00 0.00 N ATOM 775 CA GLY A 124 -4.057 -4.039 2.375 1.00 0.00 C ATOM 776 C GLY A 124 -3.798 -3.556 3.780 1.00 0.00 C ATOM 777 O GLY A 124 -2.769 -3.797 4.414 1.00 0.00 O ATOM 0 H GLY A 124 -1.976 -4.231 2.095 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -4.809 -3.406 1.904 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -4.464 -5.050 2.405 1.00 0.00 H new ATOM 778 N LEU A 125 -4.688 -2.631 4.091 1.00 0.00 N ATOM 779 CA LEU A 125 -4.695 -1.993 5.393 1.00 0.00 C ATOM 780 C LEU A 125 -5.373 -2.869 6.427 1.00 0.00 C ATOM 781 O LEU A 125 -6.440 -3.433 6.210 1.00 0.00 O ATOM 782 CB LEU A 125 -5.228 -0.569 5.278 1.00 0.00 C ATOM 783 CG LEU A 125 -4.016 0.356 5.365 1.00 0.00 C ATOM 784 CD1 LEU A 125 -2.934 0.119 4.329 1.00 0.00 C ATOM 785 CD2 LEU A 125 -4.457 1.812 5.226 1.00 0.00 C ATOM 0 H LEU A 125 -5.417 -2.305 3.457 1.00 0.00 H new ATOM 0 HA LEU A 125 -3.677 -1.885 5.767 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -5.757 -0.428 4.335 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -5.938 -0.355 6.077 1.00 0.00 H new ATOM 0 HG LEU A 125 -3.583 0.132 6.340 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -2.122 0.830 4.482 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.551 -0.897 4.428 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -3.350 0.254 3.331 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -3.586 2.464 5.289 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -4.947 1.953 4.262 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -5.154 2.059 6.027 1.00 0.00 H new ATOM 786 N LYS A 126 -4.452 -3.326 7.271 1.00 0.00 N ATOM 787 CA LYS A 126 -4.797 -4.153 8.420 1.00 0.00 C ATOM 788 C LYS A 126 -5.660 -3.333 9.414 1.00 0.00 C ATOM 789 O LYS A 126 -5.195 -2.353 9.999 1.00 0.00 O ATOM 790 CB LYS A 126 -3.505 -4.661 9.065 1.00 0.00 C ATOM 791 CG LYS A 126 -3.601 -6.001 9.802 1.00 0.00 C ATOM 792 CD LYS A 126 -4.394 -5.908 11.112 1.00 0.00 C ATOM 793 CE LYS A 126 -3.751 -4.944 12.117 1.00 0.00 C ATOM 794 NZ LYS A 126 -2.623 -5.604 12.793 1.00 0.00 N ATOM 0 H LYS A 126 -3.454 -3.135 7.178 1.00 0.00 H new ATOM 0 HA LYS A 126 -5.388 -5.015 8.111 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -2.746 -4.750 8.288 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -3.153 -3.907 9.769 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -4.073 -6.736 9.149 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -2.596 -6.364 10.017 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -5.410 -5.579 10.896 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -4.469 -6.899 11.560 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -3.404 -4.047 11.603 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -4.490 -4.625 12.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -2.192 -4.945 13.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -2.965 -6.447 13.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -1.913 -5.887 12.088 1.00 0.00 H new ATOM 795 N LYS A 127 -6.901 -3.805 9.516 1.00 0.00 N ATOM 796 CA LYS A 127 -8.085 -3.213 10.196 1.00 0.00 C ATOM 797 C LYS A 127 -8.020 -2.744 11.671 1.00 0.00 C ATOM 798 O LYS A 127 -9.048 -2.521 12.323 1.00 0.00 O ATOM 799 CB LYS A 127 -9.274 -4.178 10.072 1.00 0.00 C ATOM 800 CG LYS A 127 -9.956 -4.250 8.703 1.00 0.00 C ATOM 801 CD LYS A 127 -9.155 -4.961 7.603 1.00 0.00 C ATOM 802 CE LYS A 127 -8.811 -6.407 7.979 1.00 0.00 C ATOM 803 NZ LYS A 127 -8.048 -7.033 6.882 1.00 0.00 N ATOM 0 H LYS A 127 -7.142 -4.699 9.087 1.00 0.00 H new ATOM 0 HA LYS A 127 -8.168 -2.270 9.656 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.930 -5.178 10.335 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.023 -3.894 10.811 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -10.912 -4.760 8.819 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.174 -3.235 8.371 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -9.729 -4.955 6.677 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -8.235 -4.409 7.411 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -8.227 -6.426 8.899 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -9.724 -6.971 8.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -7.990 -8.059 7.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -8.527 -6.849 5.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -7.089 -6.632 6.854 1.00 0.00 H new ATOM 804 N ASN A 128 -6.823 -2.468 12.148 1.00 0.00 N ATOM 805 CA ASN A 128 -6.586 -1.969 13.510 1.00 0.00 C ATOM 806 C ASN A 128 -5.806 -0.645 13.428 1.00 0.00 C ATOM 807 O ASN A 128 -6.343 0.414 13.743 1.00 0.00 O ATOM 808 CB ASN A 128 -5.790 -3.017 14.285 1.00 0.00 C ATOM 809 CG ASN A 128 -6.546 -4.254 14.810 1.00 0.00 C ATOM 810 OD1 ASN A 128 -5.940 -5.213 15.244 1.00 0.00 O ATOM 811 ND2 ASN A 128 -7.860 -4.256 14.868 1.00 0.00 N ATOM 0 H ASN A 128 -5.969 -2.582 11.602 1.00 0.00 H new ATOM 0 HA ASN A 128 -7.530 -1.789 14.025 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -4.982 -3.367 13.642 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.326 -2.521 15.138 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -8.351 -5.053 15.272 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -8.388 -3.460 14.509 1.00 0.00 H new ATOM 812 N GLY A 129 -4.544 -0.772 13.026 1.00 0.00 N ATOM 813 CA GLY A 129 -3.657 0.368 12.721 1.00 0.00 C ATOM 814 C GLY A 129 -2.306 -0.078 12.162 1.00 0.00 C ATOM 815 O GLY A 129 -1.265 0.294 12.690 1.00 0.00 O ATOM 0 H GLY A 129 -4.094 -1.679 12.898 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -4.147 1.023 12.001 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -3.497 0.953 13.627 1.00 0.00 H new ATOM 816 N SER A 130 -2.363 -1.023 11.219 1.00 0.00 N ATOM 817 CA SER A 130 -1.175 -1.530 10.501 1.00 0.00 C ATOM 818 C SER A 130 -1.482 -1.915 9.037 1.00 0.00 C ATOM 819 O SER A 130 -2.472 -1.445 8.487 1.00 0.00 O ATOM 820 CB SER A 130 -0.497 -2.653 11.297 1.00 0.00 C ATOM 821 OG SER A 130 0.791 -2.919 10.732 1.00 0.00 O ATOM 0 H SER A 130 -3.235 -1.464 10.926 1.00 0.00 H new ATOM 0 HA SER A 130 -0.457 -0.713 10.428 1.00 0.00 H new ATOM 0 HB2 SER A 130 -0.396 -2.364 12.343 1.00 0.00 H new ATOM 0 HB3 SER A 130 -1.111 -3.553 11.273 1.00 0.00 H new ATOM 0 HG SER A 130 1.432 -2.250 11.050 1.00 0.00 H new ATOM 822 N CYS A 131 -0.563 -2.606 8.370 1.00 0.00 N ATOM 823 CA CYS A 131 -0.718 -3.024 6.959 1.00 0.00 C ATOM 824 C CYS A 131 -0.452 -4.522 6.725 1.00 0.00 C ATOM 825 O CYS A 131 -1.391 -5.301 6.587 1.00 0.00 O ATOM 826 CB CYS A 131 0.212 -2.215 6.052 1.00 0.00 C ATOM 827 SG CYS A 131 -0.166 -0.431 5.991 1.00 0.00 S ATOM 0 H CYS A 131 0.321 -2.899 8.786 1.00 0.00 H new ATOM 0 HA CYS A 131 -1.762 -2.833 6.713 1.00 0.00 H new ATOM 0 HB2 CYS A 131 1.239 -2.346 6.394 1.00 0.00 H new ATOM 0 HB3 CYS A 131 0.159 -2.621 5.042 1.00 0.00 H new ATOM 0 HG CYS A 131 -0.026 0.001 4.773 1.00 0.00 H new ATOM 828 N LYS A 132 0.791 -4.908 6.947 1.00 0.00 N ATOM 829 CA LYS A 132 1.428 -6.180 6.539 1.00 0.00 C ATOM 830 C LYS A 132 0.649 -7.505 6.620 1.00 0.00 C ATOM 831 O LYS A 132 0.345 -8.014 7.701 1.00 0.00 O ATOM 832 CB LYS A 132 2.807 -6.238 7.221 1.00 0.00 C ATOM 833 CG LYS A 132 2.892 -6.571 8.720 1.00 0.00 C ATOM 834 CD LYS A 132 2.182 -5.612 9.697 1.00 0.00 C ATOM 835 CE LYS A 132 0.895 -6.188 10.288 1.00 0.00 C ATOM 836 NZ LYS A 132 1.204 -7.408 11.052 1.00 0.00 N ATOM 0 H LYS A 132 1.443 -4.308 7.453 1.00 0.00 H new ATOM 0 HA LYS A 132 1.486 -6.125 5.452 1.00 0.00 H new ATOM 0 HB2 LYS A 132 3.406 -6.976 6.687 1.00 0.00 H new ATOM 0 HB3 LYS A 132 3.287 -5.271 7.073 1.00 0.00 H new ATOM 0 HG2 LYS A 132 2.480 -7.569 8.868 1.00 0.00 H new ATOM 0 HG3 LYS A 132 3.945 -6.616 8.997 1.00 0.00 H new ATOM 0 HD2 LYS A 132 2.865 -5.361 10.509 1.00 0.00 H new ATOM 0 HD3 LYS A 132 1.950 -4.682 9.177 1.00 0.00 H new ATOM 0 HE2 LYS A 132 0.419 -5.452 10.936 1.00 0.00 H new ATOM 0 HE3 LYS A 132 0.187 -6.416 9.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 0.530 -7.506 11.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 1.130 -8.237 10.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 2.170 -7.345 11.431 1.00 0.00 H new ATOM 837 N ARG A 133 0.241 -8.002 5.446 1.00 0.00 N ATOM 838 CA ARG A 133 -0.378 -9.347 5.366 1.00 0.00 C ATOM 839 C ARG A 133 0.007 -10.267 4.184 1.00 0.00 C ATOM 840 O ARG A 133 0.504 -11.365 4.430 1.00 0.00 O ATOM 841 CB ARG A 133 -1.898 -9.323 5.614 1.00 0.00 C ATOM 842 CG ARG A 133 -2.754 -8.772 4.474 1.00 0.00 C ATOM 843 CD ARG A 133 -2.668 -7.259 4.330 1.00 0.00 C ATOM 844 NE ARG A 133 -2.000 -7.063 3.049 1.00 0.00 N ATOM 845 CZ ARG A 133 -0.849 -6.433 2.829 1.00 0.00 C ATOM 846 NH1 ARG A 133 -0.257 -5.762 3.797 1.00 0.00 N ATOM 847 NH2 ARG A 133 -0.258 -6.543 1.660 1.00 0.00 N ATOM 0 H ARG A 133 0.321 -7.514 4.554 1.00 0.00 H new ATOM 0 HA ARG A 133 0.110 -9.846 6.203 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -2.227 -10.339 5.830 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.091 -8.729 6.507 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -2.443 -9.237 3.538 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -3.793 -9.055 4.640 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -3.657 -6.801 4.339 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -2.102 -6.812 5.147 1.00 0.00 H new ATOM 0 HE ARG A 133 -2.467 -7.452 2.230 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -0.681 -5.723 4.724 1.00 0.00 H new ATOM 0 HH12 ARG A 133 0.625 -5.282 3.619 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -0.682 -7.110 0.926 1.00 0.00 H new ATOM 0 HH22 ARG A 133 0.625 -6.062 1.487 1.00 0.00 H new ATOM 848 N GLY A 134 -0.298 -9.844 2.959 1.00 0.00 N ATOM 849 CA GLY A 134 -0.052 -10.593 1.697 1.00 0.00 C ATOM 850 C GLY A 134 -1.167 -11.571 1.263 1.00 0.00 C ATOM 851 O GLY A 134 -2.147 -11.099 0.679 1.00 0.00 O ATOM 0 H GLY A 134 -0.740 -8.939 2.796 1.00 0.00 H new ATOM 0 HA2 GLY A 134 0.105 -9.872 0.894 1.00 0.00 H new ATOM 0 HA3 GLY A 134 0.875 -11.155 1.806 1.00 0.00 H new ATOM 852 N PRO A 135 -1.070 -12.875 1.541 1.00 0.00 N ATOM 853 CA PRO A 135 -2.034 -13.882 1.045 1.00 0.00 C ATOM 854 C PRO A 135 -3.457 -13.791 1.594 1.00 0.00 C ATOM 855 O PRO A 135 -4.385 -14.422 1.085 1.00 0.00 O ATOM 856 CB PRO A 135 -1.346 -15.228 1.305 1.00 0.00 C ATOM 857 CG PRO A 135 -0.580 -14.959 2.601 1.00 0.00 C ATOM 858 CD PRO A 135 -0.059 -13.540 2.398 1.00 0.00 C ATOM 0 HA PRO A 135 -2.240 -13.714 -0.012 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.067 -16.038 1.420 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -0.679 -15.508 0.489 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -1.227 -15.031 3.475 1.00 0.00 H new ATOM 0 HG3 PRO A 135 0.232 -15.671 2.746 1.00 0.00 H new ATOM 0 HD2 PRO A 135 0.053 -13.021 3.350 1.00 0.00 H new ATOM 0 HD3 PRO A 135 0.921 -13.545 1.920 1.00 0.00 H new ATOM 859 N ARG A 136 -3.595 -13.018 2.661 1.00 0.00 N ATOM 860 CA ARG A 136 -4.897 -12.650 3.232 1.00 0.00 C ATOM 861 C ARG A 136 -5.670 -11.588 2.409 1.00 0.00 C ATOM 862 O ARG A 136 -6.898 -11.526 2.474 1.00 0.00 O ATOM 863 CB ARG A 136 -4.534 -12.106 4.606 1.00 0.00 C ATOM 864 CG ARG A 136 -5.776 -11.938 5.472 1.00 0.00 C ATOM 865 CD ARG A 136 -5.446 -10.860 6.485 1.00 0.00 C ATOM 866 NE ARG A 136 -6.570 -10.748 7.410 1.00 0.00 N ATOM 867 CZ ARG A 136 -6.669 -9.835 8.369 1.00 0.00 C ATOM 868 NH1 ARG A 136 -5.830 -8.803 8.444 1.00 0.00 N ATOM 869 NH2 ARG A 136 -7.693 -9.867 9.198 1.00 0.00 N ATOM 0 H ARG A 136 -2.802 -12.621 3.165 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.573 -13.505 3.250 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.834 -12.783 5.096 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -4.028 -11.146 4.499 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.636 -11.652 4.867 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.033 -12.873 5.969 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -4.533 -11.111 7.024 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -5.269 -9.908 5.984 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.333 -11.418 7.313 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -5.087 -8.699 7.753 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -5.931 -8.117 9.192 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -8.405 -10.591 9.101 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -7.773 -9.168 9.936 1.00 0.00 H new ATOM 870 N THR A 137 -4.935 -10.766 1.677 1.00 0.00 N ATOM 871 CA THR A 137 -5.498 -9.659 0.887 1.00 0.00 C ATOM 872 C THR A 137 -5.594 -9.911 -0.618 1.00 0.00 C ATOM 873 O THR A 137 -4.580 -9.981 -1.322 1.00 0.00 O ATOM 874 CB THR A 137 -4.714 -8.360 1.067 1.00 0.00 C ATOM 875 OG1 THR A 137 -3.305 -8.623 1.130 1.00 0.00 O ATOM 876 CG2 THR A 137 -5.354 -7.542 2.181 1.00 0.00 C ATOM 0 H THR A 137 -3.920 -10.841 1.607 1.00 0.00 H new ATOM 0 HA THR A 137 -6.509 -9.578 1.287 1.00 0.00 H new ATOM 0 HB THR A 137 -4.778 -7.704 0.199 1.00 0.00 H new ATOM 0 HG1 THR A 137 -2.833 -8.029 0.509 1.00 0.00 H new ATOM 0 HG21 THR A 137 -4.799 -6.613 2.315 1.00 0.00 H new ATOM 0 HG22 THR A 137 -6.387 -7.313 1.917 1.00 0.00 H new ATOM 0 HG23 THR A 137 -5.335 -8.113 3.109 1.00 0.00 H new ATOM 877 N HIS A 138 -6.845 -9.941 -1.045 1.00 0.00 N ATOM 878 CA HIS A 138 -7.208 -9.894 -2.471 1.00 0.00 C ATOM 879 C HIS A 138 -8.519 -9.141 -2.710 1.00 0.00 C ATOM 880 O HIS A 138 -9.101 -8.551 -1.794 1.00 0.00 O ATOM 881 CB HIS A 138 -7.226 -11.297 -3.101 1.00 0.00 C ATOM 882 CG HIS A 138 -8.234 -12.283 -2.488 1.00 0.00 C ATOM 883 ND1 HIS A 138 -9.558 -12.188 -2.514 1.00 0.00 N ATOM 884 CD2 HIS A 138 -7.909 -13.466 -1.979 1.00 0.00 C ATOM 885 CE1 HIS A 138 -10.062 -13.312 -2.025 1.00 0.00 C ATOM 886 NE2 HIS A 138 -9.041 -14.105 -1.705 1.00 0.00 N ATOM 0 H HIS A 138 -7.648 -9.999 -0.419 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.427 -9.326 -2.977 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.443 -11.196 -4.164 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -6.228 -11.726 -3.019 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -10.094 -11.389 -2.852 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -6.909 -13.840 -1.818 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -11.110 -13.543 -1.907 1.00 0.00 H new ATOM 887 N TYR A 139 -8.786 -8.918 -3.992 1.00 0.00 N ATOM 888 CA TYR A 139 -10.056 -8.360 -4.482 1.00 0.00 C ATOM 889 C TYR A 139 -11.317 -8.856 -3.763 1.00 0.00 C ATOM 890 O TYR A 139 -11.476 -10.053 -3.561 1.00 0.00 O ATOM 891 CB TYR A 139 -10.197 -8.571 -6.000 1.00 0.00 C ATOM 892 CG TYR A 139 -10.177 -7.266 -6.812 1.00 0.00 C ATOM 893 CD1 TYR A 139 -10.458 -6.019 -6.199 1.00 0.00 C ATOM 894 CD2 TYR A 139 -9.703 -7.329 -8.138 1.00 0.00 C ATOM 895 CE1 TYR A 139 -10.176 -4.830 -6.884 1.00 0.00 C ATOM 896 CE2 TYR A 139 -9.438 -6.134 -8.840 1.00 0.00 C ATOM 897 CZ TYR A 139 -9.662 -4.897 -8.197 1.00 0.00 C ATOM 898 OH TYR A 139 -9.100 -3.789 -8.729 1.00 0.00 O ATOM 0 H TYR A 139 -8.120 -9.121 -4.738 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.992 -7.297 -4.248 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.388 -9.215 -6.345 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -11.130 -9.098 -6.199 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -10.887 -5.986 -5.209 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -9.544 -8.286 -8.613 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -10.350 -3.874 -6.413 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -9.069 -6.165 -9.855 1.00 0.00 H new ATOM 0 HH TYR A 139 -8.690 -3.255 -8.016 1.00 0.00 H new ATOM 899 N GLY A 140 -11.967 -7.881 -3.136 1.00 0.00 N ATOM 900 CA GLY A 140 -13.214 -8.086 -2.381 1.00 0.00 C ATOM 901 C GLY A 140 -13.061 -7.671 -0.916 1.00 0.00 C ATOM 902 O GLY A 140 -13.994 -7.135 -0.316 1.00 0.00 O ATOM 0 H GLY A 140 -11.645 -6.913 -3.133 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -14.017 -7.510 -2.841 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -13.504 -9.135 -2.434 1.00 0.00 H new ATOM 903 N GLN A 141 -11.865 -7.883 -0.379 1.00 0.00 N ATOM 904 CA GLN A 141 -11.492 -7.446 0.982 1.00 0.00 C ATOM 905 C GLN A 141 -11.550 -5.937 1.150 1.00 0.00 C ATOM 906 O GLN A 141 -10.866 -5.164 0.471 1.00 0.00 O ATOM 907 CB GLN A 141 -10.085 -7.898 1.351 1.00 0.00 C ATOM 908 CG GLN A 141 -9.947 -9.398 1.682 1.00 0.00 C ATOM 909 CD GLN A 141 -9.894 -10.370 0.500 1.00 0.00 C ATOM 910 OE1 GLN A 141 -10.764 -10.453 -0.348 1.00 0.00 O ATOM 911 NE2 GLN A 141 -8.890 -11.213 0.484 1.00 0.00 N ATOM 0 H GLN A 141 -11.113 -8.366 -0.871 1.00 0.00 H new ATOM 0 HA GLN A 141 -12.226 -7.910 1.641 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -9.415 -7.661 0.524 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -9.748 -7.319 2.211 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -9.040 -9.532 2.272 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -10.786 -9.683 2.317 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -8.158 -11.148 1.192 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -8.841 -11.934 -0.236 1.00 0.00 H new ATOM 912 N LYS A 142 -12.082 -5.650 2.322 1.00 0.00 N ATOM 913 CA LYS A 142 -12.188 -4.302 2.905 1.00 0.00 C ATOM 914 C LYS A 142 -10.895 -3.998 3.674 1.00 0.00 C ATOM 915 O LYS A 142 -10.787 -4.186 4.883 1.00 0.00 O ATOM 916 CB LYS A 142 -13.422 -4.299 3.796 1.00 0.00 C ATOM 917 CG LYS A 142 -14.661 -4.509 2.927 1.00 0.00 C ATOM 918 CD LYS A 142 -15.186 -3.166 2.434 1.00 0.00 C ATOM 919 CE LYS A 142 -16.312 -3.399 1.437 1.00 0.00 C ATOM 920 NZ LYS A 142 -16.790 -2.081 1.025 1.00 0.00 N ATOM 0 H LYS A 142 -12.472 -6.371 2.929 1.00 0.00 H new ATOM 0 HA LYS A 142 -12.301 -3.522 2.152 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -13.348 -5.088 4.544 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -13.495 -3.354 4.335 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -14.416 -5.147 2.078 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -15.434 -5.023 3.499 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -15.547 -2.573 3.275 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -14.382 -2.599 1.965 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -15.956 -3.967 0.578 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -17.117 -3.978 1.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -17.564 -2.191 0.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -17.135 -1.561 1.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -16.011 -1.551 0.585 1.00 0.00 H new ATOM 921 N ALA A 143 -9.879 -4.059 2.825 1.00 0.00 N ATOM 922 CA ALA A 143 -8.459 -3.869 3.138 1.00 0.00 C ATOM 923 C ALA A 143 -7.689 -3.247 1.958 1.00 0.00 C ATOM 924 O ALA A 143 -6.971 -2.274 2.162 1.00 0.00 O ATOM 925 CB ALA A 143 -7.815 -5.188 3.543 1.00 0.00 C ATOM 0 H ALA A 143 -10.028 -4.255 1.835 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.406 -3.174 3.976 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -6.762 -5.024 3.771 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.320 -5.584 4.424 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -7.902 -5.902 2.724 1.00 0.00 H new ATOM 926 N ILE A 144 -7.984 -3.703 0.743 1.00 0.00 N ATOM 927 CA ILE A 144 -7.212 -3.326 -0.466 1.00 0.00 C ATOM 928 C ILE A 144 -7.699 -2.044 -1.187 1.00 0.00 C ATOM 929 O ILE A 144 -7.036 -1.538 -2.085 1.00 0.00 O ATOM 930 CB ILE A 144 -7.136 -4.497 -1.469 1.00 0.00 C ATOM 931 CG1 ILE A 144 -8.477 -4.809 -2.114 1.00 0.00 C ATOM 932 CG2 ILE A 144 -6.457 -5.702 -0.792 1.00 0.00 C ATOM 933 CD1 ILE A 144 -8.265 -5.520 -3.445 1.00 0.00 C ATOM 0 H ILE A 144 -8.758 -4.341 0.556 1.00 0.00 H new ATOM 0 HA ILE A 144 -6.218 -3.091 -0.086 1.00 0.00 H new ATOM 0 HB ILE A 144 -6.513 -4.206 -2.314 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -9.072 -5.435 -1.449 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -9.037 -3.887 -2.270 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -6.401 -6.532 -1.497 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -5.451 -5.424 -0.479 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -7.038 -6.005 0.079 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -9.232 -5.739 -3.899 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -7.688 -4.879 -4.112 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -7.723 -6.451 -3.278 1.00 0.00 H new ATOM 934 N LEU A 145 -8.810 -1.493 -0.703 1.00 0.00 N ATOM 935 CA LEU A 145 -9.591 -0.456 -1.409 1.00 0.00 C ATOM 936 C LEU A 145 -9.212 0.940 -0.887 1.00 0.00 C ATOM 937 O LEU A 145 -9.784 1.431 0.088 1.00 0.00 O ATOM 938 CB LEU A 145 -11.082 -0.717 -1.165 1.00 0.00 C ATOM 939 CG LEU A 145 -11.544 -2.115 -1.567 1.00 0.00 C ATOM 940 CD1 LEU A 145 -12.769 -2.499 -0.740 1.00 0.00 C ATOM 941 CD2 LEU A 145 -11.828 -2.220 -3.072 1.00 0.00 C ATOM 0 H LEU A 145 -9.206 -1.751 0.201 1.00 0.00 H new ATOM 0 HA LEU A 145 -9.375 -0.495 -2.477 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -11.298 -0.565 -0.108 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -11.664 0.020 -1.719 1.00 0.00 H new ATOM 0 HG LEU A 145 -10.737 -2.818 -1.360 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -13.102 -3.497 -1.025 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -12.510 -2.491 0.319 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -13.571 -1.783 -0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -12.154 -3.232 -3.311 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -12.611 -1.513 -3.345 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -10.921 -1.989 -3.630 1.00 0.00 H new ATOM 942 N PHE A 146 -8.157 1.479 -1.488 1.00 0.00 N ATOM 943 CA PHE A 146 -7.630 2.793 -1.056 1.00 0.00 C ATOM 944 C PHE A 146 -8.184 3.995 -1.802 1.00 0.00 C ATOM 945 O PHE A 146 -8.531 3.934 -2.978 1.00 0.00 O ATOM 946 CB PHE A 146 -6.099 2.829 -1.158 1.00 0.00 C ATOM 947 CG PHE A 146 -5.433 1.688 -0.398 1.00 0.00 C ATOM 948 CD1 PHE A 146 -5.565 1.597 1.006 1.00 0.00 C ATOM 949 CD2 PHE A 146 -4.846 0.648 -1.145 1.00 0.00 C ATOM 950 CE1 PHE A 146 -5.131 0.425 1.666 1.00 0.00 C ATOM 951 CE2 PHE A 146 -4.420 -0.520 -0.482 1.00 0.00 C ATOM 952 CZ PHE A 146 -4.560 -0.623 0.919 1.00 0.00 C ATOM 0 H PHE A 146 -7.650 1.047 -2.261 1.00 0.00 H new ATOM 0 HA PHE A 146 -7.967 2.882 -0.023 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -5.807 2.781 -2.207 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -5.735 3.780 -0.770 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -5.993 2.414 1.568 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -4.724 0.745 -2.214 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -5.237 0.334 2.737 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -3.987 -1.334 -1.044 1.00 0.00 H new ATOM 0 HZ PHE A 146 -4.225 -1.517 1.424 1.00 0.00 H new ATOM 953 N LEU A 147 -8.237 5.093 -1.075 1.00 0.00 N ATOM 954 CA LEU A 147 -8.494 6.425 -1.665 1.00 0.00 C ATOM 955 C LEU A 147 -7.280 7.319 -1.427 1.00 0.00 C ATOM 956 O LEU A 147 -7.053 7.789 -0.300 1.00 0.00 O ATOM 957 CB LEU A 147 -9.770 7.091 -1.144 1.00 0.00 C ATOM 958 CG LEU A 147 -11.021 6.280 -1.480 1.00 0.00 C ATOM 959 CD1 LEU A 147 -11.339 5.308 -0.342 1.00 0.00 C ATOM 960 CD2 LEU A 147 -12.220 7.223 -1.668 1.00 0.00 C ATOM 0 H LEU A 147 -8.106 5.105 -0.063 1.00 0.00 H new ATOM 0 HA LEU A 147 -8.656 6.281 -2.733 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -9.698 7.215 -0.063 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.859 8.089 -1.574 1.00 0.00 H new ATOM 0 HG LEU A 147 -10.836 5.724 -2.399 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -12.232 4.735 -0.592 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -10.500 4.628 -0.199 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -11.512 5.868 0.577 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -13.108 6.639 -1.907 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -12.391 7.783 -0.748 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -12.012 7.918 -2.482 1.00 0.00 H new ATOM 961 N PRO A 148 -6.361 7.318 -2.401 1.00 0.00 N ATOM 962 CA PRO A 148 -5.334 8.368 -2.470 1.00 0.00 C ATOM 963 C PRO A 148 -5.928 9.464 -3.374 1.00 0.00 C ATOM 964 O PRO A 148 -7.090 9.848 -3.218 1.00 0.00 O ATOM 965 CB PRO A 148 -4.121 7.614 -3.028 1.00 0.00 C ATOM 966 CG PRO A 148 -4.717 6.568 -3.967 1.00 0.00 C ATOM 967 CD PRO A 148 -6.036 6.181 -3.291 1.00 0.00 C ATOM 0 HA PRO A 148 -5.036 8.871 -1.550 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -3.447 8.286 -3.559 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.543 7.147 -2.230 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.883 6.974 -4.965 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -4.057 5.708 -4.079 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -6.823 6.019 -4.027 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -5.932 5.255 -2.726 1.00 0.00 H new