USER MOD reduce.3.24.130724 H: found=0, std=0, add=975, rem=0, adj=36 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 126 LYS NZ :NH3+ -147:sc= 0.388 (180deg=0) USER MOD Set 1.2: A 127 LYS NZ :NH3+ -143:sc= 0.187 (180deg=-0.0617) USER MOD Set 1.3: A 128 ASN : amide:sc= -1.23! C(o=-0.6!,f=-11!) USER MOD Set 1.4: A 130 SER OG : rot -159:sc= 0.055 USER MOD Set 2.1: A 81 MET CE :methyl -170:sc= -0.459 (180deg=-0.534) USER MOD Set 2.2: A 113 SER OG : rot -58:sc= 1.67 USER MOD Set 2.3: A 115 LYS NZ :NH3+ -108:sc= -0.287 (180deg=-0.334) USER MOD Set 2.4: A 116 HIS : no HE2:sc= 0.392 K(o=1.3,f=-6.3!) USER MOD Set 3.1: A 109 ASN : amide:sc= 0.134 K(o=0.13,f=-2) USER MOD Set 3.2: A 111 TYR OH : rot 150:sc= 0 USER MOD Set 4.1: A 29 TYR OH : rot 158:sc= -0.67 USER MOD Set 4.2: A 31 SER OG : rot -19:sc= 1.87 USER MOD Set 4.3: A 108 TYR OH : rot -30:sc= 1.19 USER MOD Set 5.1: A 92 THR OG1 : rot 78:sc= 1.31 USER MOD Set 5.2: A 94 ASN : amide:sc= 1.07 K(o=2.4,f=-0.08) USER MOD Set 6.1: A 72 SER OG : rot 96:sc= -0.856! USER MOD Set 6.2: A 75 THR OG1 : rot 138:sc= 2.22 USER MOD Set 6.3: A 77 GLN : amide:sc= 0.736 K(o=2.1,f=1.3) USER MOD Set 7.1: A 59 GLN : amide:sc= 0 X(o=0.66,f=0.46) USER MOD Set 7.2: A 73 THR OG1 : rot -11:sc= 0.664 USER MOD Set 8.1: A 52 SER OG : rot 117:sc= 1.21 USER MOD Set 8.2: A 54 GLN : amide:sc= 0.66 K(o=1.7,f=-5.1!) USER MOD Set 8.3: A 55 HIS : no HD1:sc= -0.17 K(o=1.7,f=-6.5!) USER MOD Single : A 30 CYS SG : rot 28:sc= 0.104 USER MOD Single : A 32 ASN : amide:sc= -2.71! C(o=-2.7!,f=-7!) USER MOD Single : A 35 HIS :FLIP no HE2:sc= -5.69! C(o=-6.6!,f=-5.7!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.113 USER MOD Single : A 48 THR OG1 : rot -136:sc= 1.32 USER MOD Single : A 57 GLN : amide:sc= 0.742 K(o=0.74,f=-0.36) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 26:sc= 1.06 USER MOD Single : A 69 TYR OH : rot 153:sc= 0.409 USER MOD Single : A 71 LYS NZ :NH3+ -167:sc=-0.00203 (180deg=-0.275) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0583 USER MOD Single : A 88 TYR OH : rot 10:sc= 0.202 USER MOD Single : A 90 SER OG : rot -115:sc= 0.277 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 CYS SG : rot 166:sc= -0.263 USER MOD Single : A 106 ASN : amide:sc= -0.64 K(o=-0.64,f=-4.3!) USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot -89:sc= 0.793 USER MOD Single : A 114 LYS NZ :NH3+ 155:sc=-0.00872 (180deg=-0.54) USER MOD Single : A 119 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 131 CYS SG : rot -87:sc= -0.96 USER MOD Single : A 132 LYS NZ :NH3+ -175:sc= 0.0616 (180deg=0.0298) USER MOD Single : A 137 THR OG1 : rot -164:sc= 1.23 USER MOD Single : A 138 HIS : no HD1:sc= -0.259 K(o=-0.26,f=-0.92) USER MOD Single : A 139 TYR OH : rot 30:sc= 0.029 USER MOD Single : A 141 GLN : amide:sc= -0.28 X(o=-0.28,f=-0.28) USER MOD Single : A 142 LYS NZ :NH3+ -116:sc= 0 (180deg=-0.0214) USER MOD ----------------------------------------------------------------- ATOM 11 N ALA A 26 2.087 -4.798 11.489 1.00 0.00 N ATOM 12 CA ALA A 26 2.630 -5.230 10.185 1.00 0.00 C ATOM 13 C ALA A 26 3.363 -4.118 9.439 1.00 0.00 C ATOM 14 O ALA A 26 3.016 -2.947 9.531 1.00 0.00 O ATOM 15 CB ALA A 26 1.534 -5.841 9.314 1.00 0.00 C ATOM 0 HA ALA A 26 3.375 -5.995 10.402 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.959 -6.151 8.359 1.00 0.00 H new ATOM 0 HB2 ALA A 26 1.108 -6.707 9.820 1.00 0.00 H new ATOM 0 HB3 ALA A 26 0.753 -5.101 9.140 1.00 0.00 H new ATOM 16 N LEU A 27 4.404 -4.540 8.724 1.00 0.00 N ATOM 17 CA LEU A 27 5.220 -3.626 7.886 1.00 0.00 C ATOM 18 C LEU A 27 5.381 -4.043 6.439 1.00 0.00 C ATOM 19 O LEU A 27 5.470 -5.217 6.086 1.00 0.00 O ATOM 20 CB LEU A 27 6.596 -3.410 8.539 1.00 0.00 C ATOM 21 CG LEU A 27 6.638 -2.199 9.486 1.00 0.00 C ATOM 22 CD1 LEU A 27 8.023 -2.127 10.139 1.00 0.00 C ATOM 23 CD2 LEU A 27 6.401 -0.910 8.710 1.00 0.00 C ATOM 0 H LEU A 27 4.714 -5.512 8.700 1.00 0.00 H new ATOM 0 HA LEU A 27 4.659 -2.692 7.844 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.871 -4.306 9.095 1.00 0.00 H new ATOM 0 HB3 LEU A 27 7.344 -3.277 7.758 1.00 0.00 H new ATOM 0 HG LEU A 27 5.860 -2.313 10.241 1.00 0.00 H new ATOM 0 HD11 LEU A 27 8.064 -1.271 10.813 1.00 0.00 H new ATOM 0 HD12 LEU A 27 8.208 -3.042 10.702 1.00 0.00 H new ATOM 0 HD13 LEU A 27 8.784 -2.017 9.367 1.00 0.00 H new ATOM 0 HD21 LEU A 27 6.434 -0.062 9.394 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.175 -0.794 7.952 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.424 -0.950 8.228 1.00 0.00 H new ATOM 24 N LEU A 28 5.196 -3.029 5.613 1.00 0.00 N ATOM 25 CA LEU A 28 5.353 -3.132 4.157 1.00 0.00 C ATOM 26 C LEU A 28 6.547 -2.325 3.659 1.00 0.00 C ATOM 27 O LEU A 28 6.616 -1.111 3.830 1.00 0.00 O ATOM 28 CB LEU A 28 4.098 -2.602 3.486 1.00 0.00 C ATOM 29 CG LEU A 28 3.016 -3.668 3.262 1.00 0.00 C ATOM 30 CD1 LEU A 28 1.715 -2.990 2.856 1.00 0.00 C ATOM 31 CD2 LEU A 28 3.424 -4.703 2.204 1.00 0.00 C ATOM 0 H LEU A 28 4.929 -2.097 5.929 1.00 0.00 H new ATOM 0 HA LEU A 28 5.519 -4.181 3.910 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.683 -1.799 4.096 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.368 -2.165 2.525 1.00 0.00 H new ATOM 0 HG LEU A 28 2.882 -4.207 4.200 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.945 -3.745 2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 28 1.397 -2.310 3.646 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.869 -2.429 1.934 1.00 0.00 H new ATOM 0 HD21 LEU A 28 2.625 -5.434 2.083 1.00 0.00 H new ATOM 0 HD22 LEU A 28 3.603 -4.201 1.253 1.00 0.00 H new ATOM 0 HD23 LEU A 28 4.335 -5.210 2.523 1.00 0.00 H new ATOM 32 N TYR A 29 7.466 -3.079 3.062 1.00 0.00 N ATOM 33 CA TYR A 29 8.663 -2.542 2.403 1.00 0.00 C ATOM 34 C TYR A 29 8.536 -2.693 0.880 1.00 0.00 C ATOM 35 O TYR A 29 8.026 -3.700 0.398 1.00 0.00 O ATOM 36 CB TYR A 29 9.823 -3.336 2.997 1.00 0.00 C ATOM 37 CG TYR A 29 11.107 -3.333 2.178 1.00 0.00 C ATOM 38 CD1 TYR A 29 11.845 -2.152 1.988 1.00 0.00 C ATOM 39 CD2 TYR A 29 11.422 -4.541 1.509 1.00 0.00 C ATOM 40 CE1 TYR A 29 12.924 -2.162 1.083 1.00 0.00 C ATOM 41 CE2 TYR A 29 12.501 -4.551 0.604 1.00 0.00 C ATOM 42 CZ TYR A 29 13.226 -3.365 0.409 1.00 0.00 C ATOM 43 OH TYR A 29 14.152 -3.323 -0.589 1.00 0.00 O ATOM 0 H TYR A 29 7.403 -4.096 3.019 1.00 0.00 H new ATOM 0 HA TYR A 29 8.812 -1.475 2.569 1.00 0.00 H new ATOM 0 HB2 TYR A 29 10.043 -2.938 3.987 1.00 0.00 H new ATOM 0 HB3 TYR A 29 9.502 -4.369 3.133 1.00 0.00 H new ATOM 0 HD1 TYR A 29 11.589 -1.252 2.527 1.00 0.00 H new ATOM 0 HD2 TYR A 29 10.846 -5.437 1.689 1.00 0.00 H new ATOM 0 HE1 TYR A 29 13.507 -1.270 0.909 1.00 0.00 H new ATOM 0 HE2 TYR A 29 12.765 -5.452 0.071 1.00 0.00 H new ATOM 0 HH TYR A 29 14.525 -4.219 -0.727 1.00 0.00 H new ATOM 44 N CYS A 30 9.024 -1.712 0.128 1.00 0.00 N ATOM 45 CA CYS A 30 9.028 -1.741 -1.342 1.00 0.00 C ATOM 46 C CYS A 30 10.460 -1.628 -1.848 1.00 0.00 C ATOM 47 O CYS A 30 11.102 -0.569 -1.749 1.00 0.00 O ATOM 48 CB CYS A 30 8.151 -0.638 -1.933 1.00 0.00 C ATOM 49 SG CYS A 30 8.072 -0.684 -3.765 1.00 0.00 S ATOM 0 H CYS A 30 9.433 -0.864 0.519 1.00 0.00 H new ATOM 0 HA CYS A 30 8.605 -2.691 -1.669 1.00 0.00 H new ATOM 0 HB2 CYS A 30 7.142 -0.729 -1.530 1.00 0.00 H new ATOM 0 HB3 CYS A 30 8.535 0.332 -1.616 1.00 0.00 H new ATOM 0 HG CYS A 30 8.246 -1.905 -4.176 1.00 0.00 H new ATOM 50 N SER A 31 10.800 -2.679 -2.568 1.00 0.00 N ATOM 51 CA SER A 31 12.142 -2.889 -3.140 1.00 0.00 C ATOM 52 C SER A 31 12.566 -1.902 -4.219 1.00 0.00 C ATOM 53 O SER A 31 13.763 -1.666 -4.362 1.00 0.00 O ATOM 54 CB SER A 31 12.330 -4.318 -3.636 1.00 0.00 C ATOM 55 OG SER A 31 12.543 -5.149 -2.493 1.00 0.00 O ATOM 0 H SER A 31 10.148 -3.433 -2.784 1.00 0.00 H new ATOM 0 HA SER A 31 12.806 -2.697 -2.297 1.00 0.00 H new ATOM 0 HB2 SER A 31 11.452 -4.649 -4.191 1.00 0.00 H new ATOM 0 HB3 SER A 31 13.179 -4.378 -4.317 1.00 0.00 H new ATOM 0 HG SER A 31 12.825 -4.596 -1.734 1.00 0.00 H new ATOM 56 N ASN A 32 11.592 -1.182 -4.781 1.00 0.00 N ATOM 57 CA ASN A 32 11.811 -0.208 -5.867 1.00 0.00 C ATOM 58 C ASN A 32 13.045 0.704 -5.626 1.00 0.00 C ATOM 59 O ASN A 32 13.916 0.816 -6.486 1.00 0.00 O ATOM 60 CB ASN A 32 10.546 0.635 -6.050 1.00 0.00 C ATOM 61 CG ASN A 32 10.633 1.648 -7.194 1.00 0.00 C ATOM 62 OD1 ASN A 32 10.878 1.343 -8.352 1.00 0.00 O ATOM 63 ND2 ASN A 32 10.311 2.888 -6.905 1.00 0.00 N ATOM 0 H ASN A 32 10.616 -1.256 -4.495 1.00 0.00 H new ATOM 0 HA ASN A 32 12.023 -0.770 -6.776 1.00 0.00 H new ATOM 0 HB2 ASN A 32 9.702 -0.030 -6.231 1.00 0.00 H new ATOM 0 HB3 ASN A 32 10.339 1.168 -5.122 1.00 0.00 H new ATOM 0 HD21 ASN A 32 10.267 3.589 -7.645 1.00 0.00 H new ATOM 0 HD22 ASN A 32 10.105 3.150 -5.941 1.00 0.00 H new ATOM 64 N GLY A 33 13.056 1.348 -4.453 1.00 0.00 N ATOM 65 CA GLY A 33 14.212 2.117 -3.966 1.00 0.00 C ATOM 66 C GLY A 33 14.310 2.172 -2.425 1.00 0.00 C ATOM 67 O GLY A 33 14.301 3.273 -1.862 1.00 0.00 O ATOM 0 H GLY A 33 12.263 1.352 -3.812 1.00 0.00 H new ATOM 0 HA2 GLY A 33 15.126 1.676 -4.365 1.00 0.00 H new ATOM 0 HA3 GLY A 33 14.152 3.133 -4.355 1.00 0.00 H new ATOM 68 N GLY A 34 14.273 1.004 -1.795 1.00 0.00 N ATOM 69 CA GLY A 34 14.446 0.836 -0.329 1.00 0.00 C ATOM 70 C GLY A 34 13.525 1.633 0.605 1.00 0.00 C ATOM 71 O GLY A 34 13.908 1.940 1.724 1.00 0.00 O ATOM 0 H GLY A 34 14.120 0.122 -2.284 1.00 0.00 H new ATOM 0 HA2 GLY A 34 14.320 -0.222 -0.098 1.00 0.00 H new ATOM 0 HA3 GLY A 34 15.476 1.096 -0.083 1.00 0.00 H new ATOM 72 N HIS A 35 12.249 1.738 0.228 1.00 0.00 N ATOM 73 CA HIS A 35 11.265 2.480 1.027 1.00 0.00 C ATOM 74 C HIS A 35 10.120 1.637 1.568 1.00 0.00 C ATOM 75 O HIS A 35 9.584 0.772 0.893 1.00 0.00 O ATOM 76 CB HIS A 35 10.580 3.668 0.347 1.00 0.00 C ATOM 77 CG HIS A 35 10.480 3.560 -1.180 1.00 0.00 C ATOM 78 ND1 HIS A 35 10.835 4.510 -2.032 1.00 0.00 N flip ATOM 79 CD2 HIS A 35 10.197 2.465 -1.875 1.00 0.00 C flip ATOM 80 CE1 HIS A 35 10.809 3.991 -3.246 1.00 0.00 C flip ATOM 81 NE2 HIS A 35 10.410 2.733 -3.158 1.00 0.00 N flip ATOM 0 H HIS A 35 11.871 1.321 -0.623 1.00 0.00 H new ATOM 0 HA HIS A 35 11.927 2.834 1.817 1.00 0.00 H new ATOM 0 HB2 HIS A 35 9.576 3.775 0.757 1.00 0.00 H new ATOM 0 HB3 HIS A 35 11.125 4.578 0.599 1.00 0.00 H new ATOM 0 HD1 HIS A 35 11.084 5.470 -1.793 1.00 0.00 H new ATOM 0 HD2 HIS A 35 9.855 1.524 -1.469 1.00 0.00 H new ATOM 0 HE1 HIS A 35 11.070 4.507 -4.158 1.00 0.00 H new ATOM 82 N PHE A 36 9.741 2.023 2.768 1.00 0.00 N ATOM 83 CA PHE A 36 8.514 1.601 3.449 1.00 0.00 C ATOM 84 C PHE A 36 7.369 2.539 3.090 1.00 0.00 C ATOM 85 O PHE A 36 7.548 3.554 2.426 1.00 0.00 O ATOM 86 CB PHE A 36 8.802 1.720 4.948 1.00 0.00 C ATOM 87 CG PHE A 36 9.495 0.463 5.447 1.00 0.00 C ATOM 88 CD1 PHE A 36 10.843 0.194 5.075 1.00 0.00 C ATOM 89 CD2 PHE A 36 8.763 -0.440 6.230 1.00 0.00 C ATOM 90 CE1 PHE A 36 11.445 -1.005 5.495 1.00 0.00 C ATOM 91 CE2 PHE A 36 9.370 -1.639 6.658 1.00 0.00 C ATOM 92 CZ PHE A 36 10.706 -1.912 6.293 1.00 0.00 C ATOM 0 H PHE A 36 10.298 2.668 3.329 1.00 0.00 H new ATOM 0 HA PHE A 36 8.232 0.588 3.162 1.00 0.00 H new ATOM 0 HB2 PHE A 36 9.430 2.591 5.138 1.00 0.00 H new ATOM 0 HB3 PHE A 36 7.871 1.873 5.494 1.00 0.00 H new ATOM 0 HD1 PHE A 36 11.396 0.903 4.477 1.00 0.00 H new ATOM 0 HD2 PHE A 36 7.742 -0.219 6.504 1.00 0.00 H new ATOM 0 HE1 PHE A 36 12.462 -1.232 5.212 1.00 0.00 H new ATOM 0 HE2 PHE A 36 8.816 -2.344 7.261 1.00 0.00 H new ATOM 0 HZ PHE A 36 11.172 -2.827 6.628 1.00 0.00 H new ATOM 93 N LEU A 37 6.178 2.081 3.440 1.00 0.00 N ATOM 94 CA LEU A 37 4.954 2.893 3.382 1.00 0.00 C ATOM 95 C LEU A 37 4.904 3.783 4.656 1.00 0.00 C ATOM 96 O LEU A 37 5.672 3.557 5.587 1.00 0.00 O ATOM 97 CB LEU A 37 3.821 1.871 3.340 1.00 0.00 C ATOM 98 CG LEU A 37 2.523 2.394 2.724 1.00 0.00 C ATOM 99 CD1 LEU A 37 2.654 2.625 1.214 1.00 0.00 C ATOM 100 CD2 LEU A 37 1.463 1.335 2.961 1.00 0.00 C ATOM 0 H LEU A 37 6.023 1.130 3.776 1.00 0.00 H new ATOM 0 HA LEU A 37 4.894 3.563 2.524 1.00 0.00 H new ATOM 0 HB2 LEU A 37 4.153 1.001 2.774 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.616 1.531 4.355 1.00 0.00 H new ATOM 0 HG LEU A 37 2.270 3.350 3.182 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.708 2.996 0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 37 3.439 3.357 1.025 1.00 0.00 H new ATOM 0 HD13 LEU A 37 2.908 1.686 0.723 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.516 1.667 2.536 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.767 0.403 2.485 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.343 1.173 4.032 1.00 0.00 H new ATOM 101 N ARG A 38 4.260 4.939 4.529 1.00 0.00 N ATOM 102 CA ARG A 38 4.062 5.880 5.640 1.00 0.00 C ATOM 103 C ARG A 38 2.651 6.470 5.685 1.00 0.00 C ATOM 104 O ARG A 38 2.276 7.253 4.806 1.00 0.00 O ATOM 105 CB ARG A 38 5.078 7.022 5.491 1.00 0.00 C ATOM 106 CG ARG A 38 6.193 6.865 6.512 1.00 0.00 C ATOM 107 CD ARG A 38 5.801 7.265 7.931 1.00 0.00 C ATOM 108 NE ARG A 38 5.421 8.678 7.919 1.00 0.00 N ATOM 109 CZ ARG A 38 6.126 9.684 8.459 1.00 0.00 C ATOM 110 NH1 ARG A 38 7.353 9.502 8.920 1.00 0.00 N ATOM 111 NH2 ARG A 38 5.670 10.921 8.424 1.00 0.00 N ATOM 0 H ARG A 38 3.856 5.257 3.648 1.00 0.00 H new ATOM 0 HA ARG A 38 4.204 5.329 6.569 1.00 0.00 H new ATOM 0 HB2 ARG A 38 5.494 7.020 4.483 1.00 0.00 H new ATOM 0 HB3 ARG A 38 4.581 7.982 5.629 1.00 0.00 H new ATOM 0 HG2 ARG A 38 6.522 5.826 6.517 1.00 0.00 H new ATOM 0 HG3 ARG A 38 7.045 7.468 6.199 1.00 0.00 H new ATOM 0 HD2 ARG A 38 4.972 6.651 8.284 1.00 0.00 H new ATOM 0 HD3 ARG A 38 6.633 7.101 8.616 1.00 0.00 H new ATOM 0 HE ARG A 38 4.543 8.920 7.460 1.00 0.00 H new ATOM 0 HH11 ARG A 38 7.785 8.579 8.870 1.00 0.00 H new ATOM 0 HH12 ARG A 38 7.867 10.284 9.326 1.00 0.00 H new ATOM 0 HH21 ARG A 38 4.772 11.121 7.983 1.00 0.00 H new ATOM 0 HH22 ARG A 38 6.215 11.677 8.838 1.00 0.00 H new ATOM 112 N ILE A 39 1.970 6.243 6.801 1.00 0.00 N ATOM 113 CA ILE A 39 0.580 6.731 6.973 1.00 0.00 C ATOM 114 C ILE A 39 0.499 7.838 8.020 1.00 0.00 C ATOM 115 O ILE A 39 0.822 7.658 9.197 1.00 0.00 O ATOM 116 CB ILE A 39 -0.411 5.571 7.223 1.00 0.00 C ATOM 117 CG1 ILE A 39 -1.835 6.100 7.433 1.00 0.00 C ATOM 118 CG2 ILE A 39 -0.049 4.663 8.405 1.00 0.00 C ATOM 119 CD1 ILE A 39 -2.810 5.462 6.446 1.00 0.00 C ATOM 0 H ILE A 39 2.340 5.731 7.601 1.00 0.00 H new ATOM 0 HA ILE A 39 0.268 7.186 6.033 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.349 4.962 6.321 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.157 5.891 8.453 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.846 7.183 7.311 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.799 3.879 8.504 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.927 4.211 8.231 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.017 5.253 9.321 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.812 5.856 6.618 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.499 5.693 5.427 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.816 4.381 6.587 1.00 0.00 H new ATOM 120 N LEU A 40 0.044 8.996 7.561 1.00 0.00 N ATOM 121 CA LEU A 40 -0.127 10.169 8.438 1.00 0.00 C ATOM 122 C LEU A 40 -1.589 10.276 8.929 1.00 0.00 C ATOM 123 O LEU A 40 -2.496 10.254 8.099 1.00 0.00 O ATOM 124 CB LEU A 40 0.285 11.456 7.726 1.00 0.00 C ATOM 125 CG LEU A 40 1.796 11.497 7.430 1.00 0.00 C ATOM 126 CD1 LEU A 40 2.129 10.866 6.071 1.00 0.00 C ATOM 127 CD2 LEU A 40 2.253 12.944 7.419 1.00 0.00 C ATOM 0 H LEU A 40 -0.216 9.158 6.588 1.00 0.00 H new ATOM 0 HA LEU A 40 0.524 10.034 9.302 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.269 11.546 6.792 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.013 12.313 8.342 1.00 0.00 H new ATOM 0 HG LEU A 40 2.308 10.926 8.205 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.204 10.915 5.901 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.808 9.824 6.065 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.611 11.410 5.281 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.322 12.986 7.210 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.711 13.491 6.648 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.055 13.396 8.391 1.00 0.00 H new ATOM 128 N PRO A 41 -1.803 10.495 10.242 1.00 0.00 N ATOM 129 CA PRO A 41 -3.141 10.665 10.847 1.00 0.00 C ATOM 130 C PRO A 41 -3.989 11.703 10.086 1.00 0.00 C ATOM 131 O PRO A 41 -5.199 11.549 9.931 1.00 0.00 O ATOM 132 CB PRO A 41 -2.894 11.146 12.276 1.00 0.00 C ATOM 133 CG PRO A 41 -1.546 10.514 12.612 1.00 0.00 C ATOM 134 CD PRO A 41 -0.764 10.572 11.294 1.00 0.00 C ATOM 0 HA PRO A 41 -3.696 9.727 10.812 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.858 12.234 12.337 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.678 10.814 12.957 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -1.035 11.063 13.403 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -1.663 9.488 12.961 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -0.187 11.493 11.215 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -0.057 9.746 11.215 1.00 0.00 H new ATOM 135 N ASP A 42 -3.331 12.748 9.572 1.00 0.00 N ATOM 136 CA ASP A 42 -3.999 13.755 8.743 1.00 0.00 C ATOM 137 C ASP A 42 -4.020 13.341 7.265 1.00 0.00 C ATOM 138 O ASP A 42 -3.210 13.791 6.458 1.00 0.00 O ATOM 139 CB ASP A 42 -3.342 15.127 8.981 1.00 0.00 C ATOM 140 CG ASP A 42 -4.193 16.265 8.398 1.00 0.00 C ATOM 141 OD1 ASP A 42 -5.434 16.137 8.437 1.00 0.00 O ATOM 142 OD2 ASP A 42 -3.571 17.258 7.960 1.00 0.00 O ATOM 0 H ASP A 42 -2.336 12.918 9.716 1.00 0.00 H new ATOM 0 HA ASP A 42 -5.046 13.834 9.035 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -3.204 15.285 10.051 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -2.352 15.142 8.526 1.00 0.00 H new ATOM 143 N GLY A 43 -4.944 12.425 7.002 1.00 0.00 N ATOM 144 CA GLY A 43 -5.299 11.903 5.674 1.00 0.00 C ATOM 145 C GLY A 43 -4.168 11.191 4.923 1.00 0.00 C ATOM 146 O GLY A 43 -4.061 9.975 4.931 1.00 0.00 O ATOM 0 H GLY A 43 -5.499 11.999 7.744 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -6.131 11.208 5.786 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.655 12.731 5.060 1.00 0.00 H new ATOM 147 N THR A 44 -3.352 12.022 4.279 1.00 0.00 N ATOM 148 CA THR A 44 -2.286 11.665 3.313 1.00 0.00 C ATOM 149 C THR A 44 -1.394 10.506 3.741 1.00 0.00 C ATOM 150 O THR A 44 -0.926 10.401 4.876 1.00 0.00 O ATOM 151 CB THR A 44 -1.404 12.898 3.082 1.00 0.00 C ATOM 152 OG1 THR A 44 -2.234 14.071 3.082 1.00 0.00 O ATOM 153 CG2 THR A 44 -0.646 12.835 1.747 1.00 0.00 C ATOM 0 H THR A 44 -3.412 13.031 4.419 1.00 0.00 H new ATOM 0 HA THR A 44 -2.797 11.336 2.408 1.00 0.00 H new ATOM 0 HB THR A 44 -0.667 12.930 3.885 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.678 14.865 2.937 1.00 0.00 H new ATOM 0 HG21 THR A 44 -0.036 13.731 1.632 1.00 0.00 H new ATOM 0 HG22 THR A 44 -0.003 11.955 1.735 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.360 12.774 0.926 1.00 0.00 H new ATOM 154 N VAL A 45 -1.078 9.716 2.722 1.00 0.00 N ATOM 155 CA VAL A 45 -0.138 8.590 2.833 1.00 0.00 C ATOM 156 C VAL A 45 0.984 8.813 1.807 1.00 0.00 C ATOM 157 O VAL A 45 0.795 9.346 0.719 1.00 0.00 O ATOM 158 CB VAL A 45 -0.824 7.244 2.553 1.00 0.00 C ATOM 159 CG1 VAL A 45 0.052 6.015 2.834 1.00 0.00 C ATOM 160 CG2 VAL A 45 -2.113 7.079 3.369 1.00 0.00 C ATOM 0 H VAL A 45 -1.466 9.833 1.786 1.00 0.00 H new ATOM 0 HA VAL A 45 0.253 8.552 3.850 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.035 7.282 1.484 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -0.510 5.109 2.610 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.944 6.053 2.208 1.00 0.00 H new ATOM 0 HG13 VAL A 45 0.345 6.010 3.884 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -2.567 6.114 3.142 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.879 7.128 4.432 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -2.810 7.877 3.113 1.00 0.00 H new ATOM 161 N ASP A 46 2.157 8.361 2.204 1.00 0.00 N ATOM 162 CA ASP A 46 3.412 8.446 1.453 1.00 0.00 C ATOM 163 C ASP A 46 4.310 7.228 1.734 1.00 0.00 C ATOM 164 O ASP A 46 3.805 6.151 2.049 1.00 0.00 O ATOM 165 CB ASP A 46 4.074 9.776 1.835 1.00 0.00 C ATOM 166 CG ASP A 46 3.635 10.933 0.931 1.00 0.00 C ATOM 167 OD1 ASP A 46 3.674 10.746 -0.306 1.00 0.00 O ATOM 168 OD2 ASP A 46 3.362 12.008 1.493 1.00 0.00 O ATOM 0 H ASP A 46 2.276 7.899 3.105 1.00 0.00 H new ATOM 0 HA ASP A 46 3.232 8.426 0.378 1.00 0.00 H new ATOM 0 HB2 ASP A 46 3.830 10.015 2.870 1.00 0.00 H new ATOM 0 HB3 ASP A 46 5.157 9.668 1.780 1.00 0.00 H new ATOM 169 N GLY A 47 5.609 7.404 1.563 1.00 0.00 N ATOM 170 CA GLY A 47 6.629 6.389 1.876 1.00 0.00 C ATOM 171 C GLY A 47 7.767 6.936 2.762 1.00 0.00 C ATOM 172 O GLY A 47 7.800 8.111 3.098 1.00 0.00 O ATOM 0 H GLY A 47 6.003 8.270 1.196 1.00 0.00 H new ATOM 0 HA2 GLY A 47 6.154 5.548 2.381 1.00 0.00 H new ATOM 0 HA3 GLY A 47 7.051 6.006 0.947 1.00 0.00 H new ATOM 173 N THR A 48 8.667 6.013 3.099 1.00 0.00 N ATOM 174 CA THR A 48 9.912 6.283 3.862 1.00 0.00 C ATOM 175 C THR A 48 11.049 5.306 3.565 1.00 0.00 C ATOM 176 O THR A 48 11.009 4.138 3.950 1.00 0.00 O ATOM 177 CB THR A 48 9.668 6.389 5.372 1.00 0.00 C ATOM 178 OG1 THR A 48 10.918 6.731 5.995 1.00 0.00 O ATOM 179 CG2 THR A 48 9.113 5.135 6.066 1.00 0.00 C ATOM 0 H THR A 48 8.560 5.030 2.849 1.00 0.00 H new ATOM 0 HA THR A 48 10.241 7.258 3.503 1.00 0.00 H new ATOM 0 HB THR A 48 8.890 7.143 5.489 1.00 0.00 H new ATOM 0 HG1 THR A 48 11.047 6.178 6.794 1.00 0.00 H new ATOM 0 HG21 THR A 48 8.984 5.335 7.130 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.151 4.872 5.627 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.810 4.308 5.934 1.00 0.00 H new ATOM 180 N ARG A 49 12.139 5.888 3.104 1.00 0.00 N ATOM 181 CA ARG A 49 13.424 5.184 2.847 1.00 0.00 C ATOM 182 C ARG A 49 14.133 4.645 4.110 1.00 0.00 C ATOM 183 O ARG A 49 15.114 3.910 4.041 1.00 0.00 O ATOM 184 CB ARG A 49 14.370 6.087 2.079 1.00 0.00 C ATOM 185 CG ARG A 49 14.071 5.987 0.585 1.00 0.00 C ATOM 186 CD ARG A 49 15.052 6.861 -0.177 1.00 0.00 C ATOM 187 NE ARG A 49 15.268 6.203 -1.476 1.00 0.00 N ATOM 188 CZ ARG A 49 15.864 6.720 -2.547 1.00 0.00 C ATOM 189 NH1 ARG A 49 16.373 7.943 -2.599 1.00 0.00 N ATOM 190 NH2 ARG A 49 15.968 5.987 -3.629 1.00 0.00 N ATOM 0 H ARG A 49 12.178 6.884 2.886 1.00 0.00 H new ATOM 0 HA ARG A 49 13.157 4.307 2.258 1.00 0.00 H new ATOM 0 HB2 ARG A 49 14.258 7.118 2.415 1.00 0.00 H new ATOM 0 HB3 ARG A 49 15.403 5.799 2.274 1.00 0.00 H new ATOM 0 HG2 ARG A 49 14.153 4.952 0.253 1.00 0.00 H new ATOM 0 HG3 ARG A 49 13.048 6.306 0.384 1.00 0.00 H new ATOM 0 HD2 ARG A 49 14.653 7.867 -0.312 1.00 0.00 H new ATOM 0 HD3 ARG A 49 15.990 6.960 0.369 1.00 0.00 H new ATOM 0 HE ARG A 49 14.923 5.247 -1.564 1.00 0.00 H new ATOM 0 HH11 ARG A 49 16.321 8.552 -1.783 1.00 0.00 H new ATOM 0 HH12 ARG A 49 16.817 8.275 -3.455 1.00 0.00 H new ATOM 0 HH21 ARG A 49 15.595 5.038 -3.640 1.00 0.00 H new ATOM 0 HH22 ARG A 49 16.422 6.366 -4.460 1.00 0.00 H new ATOM 191 N ASP A 50 13.615 5.075 5.255 1.00 0.00 N ATOM 192 CA ASP A 50 14.078 4.632 6.572 1.00 0.00 C ATOM 193 C ASP A 50 12.881 4.070 7.344 1.00 0.00 C ATOM 194 O ASP A 50 11.858 4.747 7.458 1.00 0.00 O ATOM 195 CB ASP A 50 14.668 5.798 7.378 1.00 0.00 C ATOM 196 CG ASP A 50 16.025 6.282 6.853 1.00 0.00 C ATOM 197 OD1 ASP A 50 16.970 5.470 6.895 1.00 0.00 O ATOM 198 OD2 ASP A 50 16.094 7.489 6.530 1.00 0.00 O ATOM 0 H ASP A 50 12.852 5.750 5.299 1.00 0.00 H new ATOM 0 HA ASP A 50 14.852 3.878 6.431 1.00 0.00 H new ATOM 0 HB2 ASP A 50 13.965 6.631 7.365 1.00 0.00 H new ATOM 0 HB3 ASP A 50 14.779 5.491 8.418 1.00 0.00 H new ATOM 199 N ARG A 51 12.977 2.790 7.708 1.00 0.00 N ATOM 200 CA ARG A 51 11.942 2.152 8.546 1.00 0.00 C ATOM 201 C ARG A 51 11.802 2.776 9.942 1.00 0.00 C ATOM 202 O ARG A 51 12.439 2.425 10.932 1.00 0.00 O ATOM 203 CB ARG A 51 12.039 0.616 8.594 1.00 0.00 C ATOM 204 CG ARG A 51 13.275 -0.060 9.212 1.00 0.00 C ATOM 205 CD ARG A 51 14.631 0.223 8.560 1.00 0.00 C ATOM 206 NE ARG A 51 14.586 0.013 7.099 1.00 0.00 N ATOM 207 CZ ARG A 51 15.040 0.883 6.189 1.00 0.00 C ATOM 208 NH1 ARG A 51 15.943 1.794 6.519 1.00 0.00 N ATOM 209 NH2 ARG A 51 14.827 0.683 4.901 1.00 0.00 N ATOM 0 H ARG A 51 13.747 2.176 7.444 1.00 0.00 H new ATOM 0 HA ARG A 51 11.008 2.373 8.029 1.00 0.00 H new ATOM 0 HB2 ARG A 51 11.166 0.253 9.137 1.00 0.00 H new ATOM 0 HB3 ARG A 51 11.950 0.254 7.570 1.00 0.00 H new ATOM 0 HG2 ARG A 51 13.335 0.239 10.258 1.00 0.00 H new ATOM 0 HG3 ARG A 51 13.112 -1.138 9.198 1.00 0.00 H new ATOM 0 HD2 ARG A 51 14.930 1.250 8.772 1.00 0.00 H new ATOM 0 HD3 ARG A 51 15.389 -0.426 8.998 1.00 0.00 H new ATOM 0 HE ARG A 51 14.179 -0.858 6.759 1.00 0.00 H new ATOM 0 HH11 ARG A 51 16.299 1.837 7.474 1.00 0.00 H new ATOM 0 HH12 ARG A 51 16.283 2.453 5.818 1.00 0.00 H new ATOM 0 HH21 ARG A 51 14.312 -0.141 4.591 1.00 0.00 H new ATOM 0 HH22 ARG A 51 15.178 1.353 4.216 1.00 0.00 H new ATOM 210 N SER A 52 10.943 3.788 9.940 1.00 0.00 N ATOM 211 CA SER A 52 10.641 4.626 11.108 1.00 0.00 C ATOM 212 C SER A 52 9.592 4.026 12.052 1.00 0.00 C ATOM 213 O SER A 52 9.656 4.255 13.257 1.00 0.00 O ATOM 214 CB SER A 52 10.173 5.991 10.581 1.00 0.00 C ATOM 215 OG SER A 52 9.096 5.784 9.653 1.00 0.00 O ATOM 0 H SER A 52 10.420 4.061 9.108 1.00 0.00 H new ATOM 0 HA SER A 52 11.545 4.711 11.711 1.00 0.00 H new ATOM 0 HB2 SER A 52 9.844 6.622 11.407 1.00 0.00 H new ATOM 0 HB3 SER A 52 10.998 6.510 10.093 1.00 0.00 H new ATOM 0 HG SER A 52 8.281 6.205 9.999 1.00 0.00 H new ATOM 216 N ASP A 53 8.554 3.411 11.466 1.00 0.00 N ATOM 217 CA ASP A 53 7.435 2.700 12.147 1.00 0.00 C ATOM 218 C ASP A 53 6.512 3.483 13.071 1.00 0.00 C ATOM 219 O ASP A 53 5.352 3.088 13.213 1.00 0.00 O ATOM 220 CB ASP A 53 7.975 1.412 12.826 1.00 0.00 C ATOM 221 CG ASP A 53 6.908 0.443 13.354 1.00 0.00 C ATOM 222 OD1 ASP A 53 6.277 0.769 14.381 1.00 0.00 O ATOM 223 OD2 ASP A 53 6.819 -0.659 12.775 1.00 0.00 O ATOM 0 H ASP A 53 8.457 3.389 10.451 1.00 0.00 H new ATOM 0 HA ASP A 53 6.750 2.475 11.330 1.00 0.00 H new ATOM 0 HB2 ASP A 53 8.600 0.880 12.109 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.619 1.703 13.656 1.00 0.00 H new ATOM 224 N GLN A 54 6.941 4.677 13.453 1.00 0.00 N ATOM 225 CA GLN A 54 6.153 5.627 14.269 1.00 0.00 C ATOM 226 C GLN A 54 4.752 5.929 13.712 1.00 0.00 C ATOM 227 O GLN A 54 3.817 6.252 14.434 1.00 0.00 O ATOM 228 CB GLN A 54 6.906 6.949 14.504 1.00 0.00 C ATOM 229 CG GLN A 54 7.902 7.445 13.433 1.00 0.00 C ATOM 230 CD GLN A 54 7.247 7.821 12.104 1.00 0.00 C ATOM 231 OE1 GLN A 54 7.194 7.045 11.158 1.00 0.00 O ATOM 232 NE2 GLN A 54 6.807 9.047 11.983 1.00 0.00 N ATOM 0 H GLN A 54 7.865 5.033 13.206 1.00 0.00 H new ATOM 0 HA GLN A 54 6.015 5.111 15.219 1.00 0.00 H new ATOM 0 HB2 GLN A 54 6.160 7.731 14.647 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.452 6.854 15.442 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.436 8.312 13.822 1.00 0.00 H new ATOM 0 HG3 GLN A 54 8.644 6.667 13.254 1.00 0.00 H new ATOM 0 HE21 GLN A 54 6.855 9.687 12.776 1.00 0.00 H new ATOM 0 HE22 GLN A 54 6.416 9.363 11.096 1.00 0.00 H new ATOM 233 N HIS A 55 4.749 6.008 12.399 1.00 0.00 N ATOM 234 CA HIS A 55 3.515 6.117 11.597 1.00 0.00 C ATOM 235 C HIS A 55 3.198 4.873 10.767 1.00 0.00 C ATOM 236 O HIS A 55 2.072 4.753 10.288 1.00 0.00 O ATOM 237 CB HIS A 55 3.576 7.319 10.650 1.00 0.00 C ATOM 238 CG HIS A 55 3.541 8.672 11.351 1.00 0.00 C ATOM 239 ND1 HIS A 55 4.172 9.753 10.917 1.00 0.00 N ATOM 240 CD2 HIS A 55 2.780 9.017 12.376 1.00 0.00 C ATOM 241 CE1 HIS A 55 3.798 10.772 11.666 1.00 0.00 C ATOM 242 NE2 HIS A 55 2.927 10.322 12.560 1.00 0.00 N ATOM 0 H HIS A 55 5.601 6.000 11.839 1.00 0.00 H new ATOM 0 HA HIS A 55 2.719 6.239 12.332 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.488 7.254 10.057 1.00 0.00 H new ATOM 0 HB3 HIS A 55 2.739 7.262 9.954 1.00 0.00 H new ATOM 0 HD2 HIS A 55 2.153 8.357 12.957 1.00 0.00 H new ATOM 0 HE1 HIS A 55 4.140 11.792 11.569 1.00 0.00 H new ATOM 0 HE2 HIS A 55 2.452 10.883 13.267 1.00 0.00 H new ATOM 243 N ILE A 56 4.108 3.911 10.675 1.00 0.00 N ATOM 244 CA ILE A 56 3.872 2.755 9.813 1.00 0.00 C ATOM 245 C ILE A 56 3.781 1.404 10.555 1.00 0.00 C ATOM 246 O ILE A 56 4.781 0.763 10.877 1.00 0.00 O ATOM 247 CB ILE A 56 4.739 2.770 8.543 1.00 0.00 C ATOM 248 CG1 ILE A 56 4.297 1.643 7.616 1.00 0.00 C ATOM 249 CG2 ILE A 56 6.252 2.788 8.762 1.00 0.00 C ATOM 250 CD1 ILE A 56 2.907 1.927 7.055 1.00 0.00 C ATOM 0 H ILE A 56 4.998 3.904 11.174 1.00 0.00 H new ATOM 0 HA ILE A 56 2.854 2.868 9.439 1.00 0.00 H new ATOM 0 HB ILE A 56 4.561 3.736 8.070 1.00 0.00 H new ATOM 0 HG12 ILE A 56 5.010 1.535 6.799 1.00 0.00 H new ATOM 0 HG13 ILE A 56 4.290 0.698 8.160 1.00 0.00 H new ATOM 0 HG21 ILE A 56 6.759 2.797 7.797 1.00 0.00 H new ATOM 0 HG22 ILE A 56 6.527 3.679 9.326 1.00 0.00 H new ATOM 0 HG23 ILE A 56 6.550 1.900 9.320 1.00 0.00 H new ATOM 0 HD11 ILE A 56 2.607 1.112 6.396 1.00 0.00 H new ATOM 0 HD12 ILE A 56 2.194 2.011 7.875 1.00 0.00 H new ATOM 0 HD13 ILE A 56 2.925 2.861 6.493 1.00 0.00 H new ATOM 251 N GLN A 57 2.549 1.194 10.963 1.00 0.00 N ATOM 252 CA GLN A 57 1.992 -0.103 11.389 1.00 0.00 C ATOM 253 C GLN A 57 0.625 -0.293 10.720 1.00 0.00 C ATOM 254 O GLN A 57 -0.267 0.556 10.819 1.00 0.00 O ATOM 255 CB GLN A 57 1.811 -0.201 12.909 1.00 0.00 C ATOM 256 CG GLN A 57 3.134 -0.371 13.657 1.00 0.00 C ATOM 257 CD GLN A 57 2.935 -0.365 15.183 1.00 0.00 C ATOM 258 OE1 GLN A 57 1.845 -0.480 15.728 1.00 0.00 O ATOM 259 NE2 GLN A 57 4.003 -0.142 15.912 1.00 0.00 N ATOM 0 H GLN A 57 1.864 1.948 11.015 1.00 0.00 H new ATOM 0 HA GLN A 57 2.699 -0.877 11.091 1.00 0.00 H new ATOM 0 HB2 GLN A 57 1.309 0.697 13.269 1.00 0.00 H new ATOM 0 HB3 GLN A 57 1.159 -1.044 13.138 1.00 0.00 H new ATOM 0 HG2 GLN A 57 3.604 -1.307 13.356 1.00 0.00 H new ATOM 0 HG3 GLN A 57 3.815 0.432 13.377 1.00 0.00 H new ATOM 0 HE21 GLN A 57 4.915 -0.045 15.465 1.00 0.00 H new ATOM 0 HE22 GLN A 57 3.922 -0.066 16.926 1.00 0.00 H new ATOM 260 N LEU A 58 0.565 -1.347 9.923 1.00 0.00 N ATOM 261 CA LEU A 58 -0.640 -1.708 9.155 1.00 0.00 C ATOM 262 C LEU A 58 -1.211 -3.084 9.525 1.00 0.00 C ATOM 263 O LEU A 58 -0.599 -3.842 10.272 1.00 0.00 O ATOM 264 CB LEU A 58 -0.326 -1.602 7.658 1.00 0.00 C ATOM 265 CG LEU A 58 0.860 -2.468 7.231 1.00 0.00 C ATOM 266 CD1 LEU A 58 0.402 -3.648 6.370 1.00 0.00 C ATOM 267 CD2 LEU A 58 1.854 -1.598 6.474 1.00 0.00 C ATOM 0 H LEU A 58 1.348 -1.986 9.782 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.429 -1.002 9.415 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.207 -1.895 7.087 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.117 -0.562 7.410 1.00 0.00 H new ATOM 0 HG LEU A 58 1.339 -2.885 8.117 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.267 -4.245 6.082 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.292 -4.266 6.939 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.095 -3.274 5.475 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.705 -2.204 6.164 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.370 -1.174 5.594 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.199 -0.792 7.122 1.00 0.00 H new ATOM 268 N GLN A 59 -2.468 -3.295 9.137 1.00 0.00 N ATOM 269 CA GLN A 59 -3.149 -4.580 9.346 1.00 0.00 C ATOM 270 C GLN A 59 -3.845 -4.999 8.053 1.00 0.00 C ATOM 271 O GLN A 59 -4.678 -4.276 7.509 1.00 0.00 O ATOM 272 CB GLN A 59 -4.198 -4.413 10.444 1.00 0.00 C ATOM 273 CG GLN A 59 -4.034 -5.484 11.519 1.00 0.00 C ATOM 274 CD GLN A 59 -5.073 -5.277 12.611 1.00 0.00 C ATOM 275 OE1 GLN A 59 -6.229 -5.678 12.504 1.00 0.00 O ATOM 276 NE2 GLN A 59 -4.714 -4.590 13.673 1.00 0.00 N ATOM 0 H GLN A 59 -3.041 -2.590 8.673 1.00 0.00 H new ATOM 0 HA GLN A 59 -2.422 -5.339 9.635 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -4.106 -3.424 10.893 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -5.197 -4.476 10.012 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -4.147 -6.475 11.079 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -3.031 -5.436 11.944 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -3.755 -4.256 13.764 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -5.395 -4.391 14.406 1.00 0.00 H new ATOM 277 N LEU A 60 -3.491 -6.196 7.611 1.00 0.00 N ATOM 278 CA LEU A 60 -4.021 -6.768 6.362 1.00 0.00 C ATOM 279 C LEU A 60 -5.298 -7.561 6.644 1.00 0.00 C ATOM 280 O LEU A 60 -5.310 -8.793 6.747 1.00 0.00 O ATOM 281 CB LEU A 60 -2.953 -7.664 5.705 1.00 0.00 C ATOM 282 CG LEU A 60 -1.639 -6.915 5.452 1.00 0.00 C ATOM 283 CD1 LEU A 60 -0.489 -7.915 5.373 1.00 0.00 C ATOM 284 CD2 LEU A 60 -1.709 -6.053 4.190 1.00 0.00 C ATOM 0 H LEU A 60 -2.832 -6.803 8.098 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.269 -5.960 5.673 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.760 -8.525 6.345 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -3.337 -8.049 4.760 1.00 0.00 H new ATOM 0 HG LEU A 60 -1.464 -6.235 6.286 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.445 -7.382 5.193 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.419 -8.464 6.312 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.671 -8.615 4.557 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.758 -5.539 4.047 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -1.912 -6.687 3.327 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.506 -5.317 4.296 1.00 0.00 H new ATOM 285 N SER A 61 -6.386 -6.813 6.688 1.00 0.00 N ATOM 286 CA SER A 61 -7.663 -7.367 7.152 1.00 0.00 C ATOM 287 C SER A 61 -8.611 -7.751 6.008 1.00 0.00 C ATOM 288 O SER A 61 -9.343 -6.935 5.443 1.00 0.00 O ATOM 289 CB SER A 61 -8.328 -6.410 8.130 1.00 0.00 C ATOM 290 OG SER A 61 -9.485 -7.112 8.616 1.00 0.00 O ATOM 0 H SER A 61 -6.421 -5.831 6.414 1.00 0.00 H new ATOM 0 HA SER A 61 -7.435 -8.300 7.668 1.00 0.00 H new ATOM 0 HB2 SER A 61 -7.654 -6.149 8.946 1.00 0.00 H new ATOM 0 HB3 SER A 61 -8.610 -5.478 7.639 1.00 0.00 H new ATOM 0 HG SER A 61 -9.964 -6.548 9.258 1.00 0.00 H new ATOM 291 N ALA A 62 -8.218 -8.876 5.443 1.00 0.00 N ATOM 292 CA ALA A 62 -8.984 -9.573 4.385 1.00 0.00 C ATOM 293 C ALA A 62 -10.475 -9.777 4.677 1.00 0.00 C ATOM 294 O ALA A 62 -10.879 -10.529 5.558 1.00 0.00 O ATOM 295 CB ALA A 62 -8.305 -10.905 4.052 1.00 0.00 C ATOM 0 H ALA A 62 -7.351 -9.350 5.696 1.00 0.00 H new ATOM 0 HA ALA A 62 -8.969 -8.906 3.523 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -8.870 -11.417 3.273 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.290 -10.718 3.701 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -8.271 -11.529 4.945 1.00 0.00 H new ATOM 296 N GLU A 63 -11.246 -9.053 3.888 1.00 0.00 N ATOM 297 CA GLU A 63 -12.719 -9.148 3.830 1.00 0.00 C ATOM 298 C GLU A 63 -13.186 -10.346 2.975 1.00 0.00 C ATOM 299 O GLU A 63 -14.340 -10.769 3.035 1.00 0.00 O ATOM 300 CB GLU A 63 -13.217 -7.836 3.231 1.00 0.00 C ATOM 301 CG GLU A 63 -14.749 -7.701 3.218 1.00 0.00 C ATOM 302 CD GLU A 63 -15.194 -6.686 2.175 1.00 0.00 C ATOM 303 OE1 GLU A 63 -14.830 -6.887 0.988 1.00 0.00 O ATOM 304 OE2 GLU A 63 -15.834 -5.687 2.589 1.00 0.00 O ATOM 0 H GLU A 63 -10.868 -8.358 3.245 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.124 -9.311 4.829 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -12.793 -7.006 3.796 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.845 -7.749 2.210 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -15.202 -8.669 3.006 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -15.100 -7.394 4.203 1.00 0.00 H new ATOM 305 N SER A 64 -12.304 -10.762 2.082 1.00 0.00 N ATOM 306 CA SER A 64 -12.522 -11.837 1.095 1.00 0.00 C ATOM 307 C SER A 64 -11.192 -12.380 0.552 1.00 0.00 C ATOM 308 O SER A 64 -10.126 -12.022 1.065 1.00 0.00 O ATOM 309 CB SER A 64 -13.435 -11.329 -0.040 1.00 0.00 C ATOM 310 OG SER A 64 -14.794 -11.324 0.401 1.00 0.00 O ATOM 0 H SER A 64 -11.373 -10.350 2.012 1.00 0.00 H new ATOM 0 HA SER A 64 -13.021 -12.669 1.592 1.00 0.00 H new ATOM 0 HB2 SER A 64 -13.136 -10.324 -0.338 1.00 0.00 H new ATOM 0 HB3 SER A 64 -13.330 -11.967 -0.918 1.00 0.00 H new ATOM 0 HG SER A 64 -14.821 -11.231 1.376 1.00 0.00 H new ATOM 311 N VAL A 65 -11.261 -13.077 -0.590 1.00 0.00 N ATOM 312 CA VAL A 65 -10.151 -13.803 -1.229 1.00 0.00 C ATOM 313 C VAL A 65 -9.231 -12.841 -1.997 1.00 0.00 C ATOM 314 O VAL A 65 -9.469 -12.476 -3.145 1.00 0.00 O ATOM 315 CB VAL A 65 -10.698 -14.937 -2.125 1.00 0.00 C ATOM 316 CG1 VAL A 65 -9.581 -15.746 -2.798 1.00 0.00 C ATOM 317 CG2 VAL A 65 -11.560 -15.918 -1.318 1.00 0.00 C ATOM 0 H VAL A 65 -12.130 -13.155 -1.119 1.00 0.00 H new ATOM 0 HA VAL A 65 -9.540 -14.265 -0.454 1.00 0.00 H new ATOM 0 HB VAL A 65 -11.295 -14.441 -2.890 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -10.021 -16.529 -3.416 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.980 -15.086 -3.423 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.948 -16.198 -2.034 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -11.930 -16.704 -1.976 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -10.959 -16.362 -0.524 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -12.404 -15.385 -0.879 1.00 0.00 H new ATOM 318 N GLY A 66 -8.453 -12.180 -1.158 1.00 0.00 N ATOM 319 CA GLY A 66 -7.322 -11.329 -1.580 1.00 0.00 C ATOM 320 C GLY A 66 -7.447 -9.860 -1.196 1.00 0.00 C ATOM 321 O GLY A 66 -6.474 -9.222 -0.802 1.00 0.00 O ATOM 0 H GLY A 66 -8.580 -12.211 -0.146 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.405 -11.727 -1.145 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -7.218 -11.399 -2.663 1.00 0.00 H new ATOM 322 N GLU A 67 -8.624 -9.304 -1.448 1.00 0.00 N ATOM 323 CA GLU A 67 -8.956 -7.895 -1.115 1.00 0.00 C ATOM 324 C GLU A 67 -8.959 -7.666 0.405 1.00 0.00 C ATOM 325 O GLU A 67 -9.828 -8.103 1.152 1.00 0.00 O ATOM 326 CB GLU A 67 -10.208 -7.354 -1.822 1.00 0.00 C ATOM 327 CG GLU A 67 -11.535 -8.087 -1.539 1.00 0.00 C ATOM 328 CD GLU A 67 -11.760 -9.253 -2.496 1.00 0.00 C ATOM 329 OE1 GLU A 67 -11.222 -10.334 -2.183 1.00 0.00 O ATOM 330 OE2 GLU A 67 -12.422 -9.030 -3.525 1.00 0.00 O ATOM 0 H GLU A 67 -9.392 -9.808 -1.892 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.151 -7.288 -1.528 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -10.331 -6.308 -1.543 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -10.029 -7.378 -2.897 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -11.534 -8.455 -0.513 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -12.363 -7.383 -1.624 1.00 0.00 H new ATOM 331 N VAL A 68 -7.831 -7.099 0.790 1.00 0.00 N ATOM 332 CA VAL A 68 -7.515 -6.745 2.188 1.00 0.00 C ATOM 333 C VAL A 68 -7.784 -5.263 2.443 1.00 0.00 C ATOM 334 O VAL A 68 -7.657 -4.416 1.553 1.00 0.00 O ATOM 335 CB VAL A 68 -6.074 -7.106 2.613 1.00 0.00 C ATOM 336 CG1 VAL A 68 -5.845 -8.618 2.661 1.00 0.00 C ATOM 337 CG2 VAL A 68 -4.975 -6.439 1.787 1.00 0.00 C ATOM 0 H VAL A 68 -7.084 -6.861 0.137 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.178 -7.352 2.805 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.992 -6.697 3.620 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.818 -8.821 2.965 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.531 -9.067 3.379 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.022 -9.044 1.674 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.999 -6.752 2.159 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -5.076 -6.732 0.742 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.064 -5.356 1.870 1.00 0.00 H new ATOM 338 N TYR A 69 -8.298 -5.041 3.638 1.00 0.00 N ATOM 339 CA TYR A 69 -8.416 -3.698 4.236 1.00 0.00 C ATOM 340 C TYR A 69 -7.154 -3.428 5.034 1.00 0.00 C ATOM 341 O TYR A 69 -6.864 -4.130 5.999 1.00 0.00 O ATOM 342 CB TYR A 69 -9.599 -3.617 5.203 1.00 0.00 C ATOM 343 CG TYR A 69 -10.926 -3.522 4.470 1.00 0.00 C ATOM 344 CD1 TYR A 69 -11.206 -2.330 3.764 1.00 0.00 C ATOM 345 CD2 TYR A 69 -11.902 -4.514 4.684 1.00 0.00 C ATOM 346 CE1 TYR A 69 -12.508 -2.132 3.262 1.00 0.00 C ATOM 347 CE2 TYR A 69 -13.202 -4.303 4.192 1.00 0.00 C ATOM 348 CZ TYR A 69 -13.487 -3.119 3.489 1.00 0.00 C ATOM 349 OH TYR A 69 -14.745 -2.900 3.020 1.00 0.00 O ATOM 0 H TYR A 69 -8.653 -5.786 4.237 1.00 0.00 H new ATOM 0 HA TYR A 69 -8.564 -2.974 3.435 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.602 -4.497 5.847 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -9.479 -2.749 5.851 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -10.438 -1.586 3.612 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -11.656 -5.421 5.217 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -12.752 -1.236 2.711 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -13.973 -5.042 4.352 1.00 0.00 H new ATOM 0 HH TYR A 69 -15.184 -3.759 2.848 1.00 0.00 H new ATOM 350 N ILE A 70 -6.334 -2.538 4.476 1.00 0.00 N ATOM 351 CA ILE A 70 -5.091 -2.168 5.179 1.00 0.00 C ATOM 352 C ILE A 70 -5.354 -1.067 6.206 1.00 0.00 C ATOM 353 O ILE A 70 -5.048 0.115 6.056 1.00 0.00 O ATOM 354 CB ILE A 70 -3.962 -1.836 4.180 1.00 0.00 C ATOM 355 CG1 ILE A 70 -3.775 -2.986 3.171 1.00 0.00 C ATOM 356 CG2 ILE A 70 -2.654 -1.513 4.920 1.00 0.00 C ATOM 357 CD1 ILE A 70 -2.782 -2.718 2.030 1.00 0.00 C ATOM 0 H ILE A 70 -6.489 -2.074 3.581 1.00 0.00 H new ATOM 0 HA ILE A 70 -4.735 -3.028 5.746 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.247 -0.946 3.619 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.445 -3.871 3.715 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.745 -3.223 2.735 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.873 -1.282 4.195 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.808 -0.654 5.573 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.352 -2.373 5.517 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -2.729 -3.592 1.381 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.116 -1.857 1.452 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.795 -2.515 2.446 1.00 0.00 H new ATOM 358 N LYS A 71 -5.866 -1.581 7.313 1.00 0.00 N ATOM 359 CA LYS A 71 -6.200 -0.803 8.499 1.00 0.00 C ATOM 360 C LYS A 71 -4.876 -0.418 9.161 1.00 0.00 C ATOM 361 O LYS A 71 -4.124 -1.252 9.661 1.00 0.00 O ATOM 362 CB LYS A 71 -6.986 -1.737 9.400 1.00 0.00 C ATOM 363 CG LYS A 71 -7.950 -0.979 10.324 1.00 0.00 C ATOM 364 CD LYS A 71 -7.321 -0.406 11.590 1.00 0.00 C ATOM 365 CE LYS A 71 -8.394 0.165 12.518 1.00 0.00 C ATOM 366 NZ LYS A 71 -9.099 1.298 11.895 1.00 0.00 N ATOM 0 H LYS A 71 -6.066 -2.576 7.416 1.00 0.00 H new ATOM 0 HA LYS A 71 -6.778 0.096 8.286 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -7.550 -2.440 8.787 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.294 -2.324 10.003 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -8.402 -0.163 9.760 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -8.757 -1.653 10.611 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -6.762 -1.185 12.109 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.608 0.376 11.326 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -9.111 -0.616 12.771 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -7.934 0.490 13.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -9.657 1.798 12.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -8.406 1.952 11.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.733 0.945 11.150 1.00 0.00 H new ATOM 367 N SER A 72 -4.631 0.875 9.162 1.00 0.00 N ATOM 368 CA SER A 72 -3.394 1.416 9.728 1.00 0.00 C ATOM 369 C SER A 72 -3.552 1.586 11.249 1.00 0.00 C ATOM 370 O SER A 72 -3.901 2.636 11.794 1.00 0.00 O ATOM 371 CB SER A 72 -2.957 2.668 8.981 1.00 0.00 C ATOM 372 OG SER A 72 -3.871 3.750 9.196 1.00 0.00 O ATOM 0 H SER A 72 -5.265 1.577 8.780 1.00 0.00 H new ATOM 0 HA SER A 72 -2.571 0.714 9.590 1.00 0.00 H new ATOM 0 HB2 SER A 72 -1.960 2.961 9.310 1.00 0.00 H new ATOM 0 HB3 SER A 72 -2.890 2.453 7.915 1.00 0.00 H new ATOM 0 HG SER A 72 -3.539 4.319 9.922 1.00 0.00 H new ATOM 373 N THR A 73 -3.614 0.389 11.815 1.00 0.00 N ATOM 374 CA THR A 73 -3.765 0.014 13.238 1.00 0.00 C ATOM 375 C THR A 73 -3.060 0.855 14.322 1.00 0.00 C ATOM 376 O THR A 73 -3.382 0.717 15.499 1.00 0.00 O ATOM 377 CB THR A 73 -3.461 -1.489 13.404 1.00 0.00 C ATOM 378 OG1 THR A 73 -3.603 -1.886 14.768 1.00 0.00 O ATOM 379 CG2 THR A 73 -2.111 -1.929 12.813 1.00 0.00 C ATOM 0 H THR A 73 -3.554 -0.446 11.233 1.00 0.00 H new ATOM 0 HA THR A 73 -4.807 0.256 13.447 1.00 0.00 H new ATOM 0 HB THR A 73 -4.207 -2.016 12.809 1.00 0.00 H new ATOM 0 HG1 THR A 73 -3.689 -1.090 15.333 1.00 0.00 H new ATOM 0 HG21 THR A 73 -1.975 -2.999 12.972 1.00 0.00 H new ATOM 0 HG22 THR A 73 -2.095 -1.716 11.744 1.00 0.00 H new ATOM 0 HG23 THR A 73 -1.304 -1.384 13.303 1.00 0.00 H new ATOM 380 N GLU A 74 -2.111 1.684 13.903 1.00 0.00 N ATOM 381 CA GLU A 74 -1.390 2.620 14.784 1.00 0.00 C ATOM 382 C GLU A 74 -2.094 3.980 14.894 1.00 0.00 C ATOM 383 O GLU A 74 -2.210 4.565 15.965 1.00 0.00 O ATOM 384 CB GLU A 74 -0.006 2.846 14.187 1.00 0.00 C ATOM 385 CG GLU A 74 1.041 3.135 15.262 1.00 0.00 C ATOM 386 CD GLU A 74 2.480 3.260 14.730 1.00 0.00 C ATOM 387 OE1 GLU A 74 2.676 3.088 13.503 1.00 0.00 O ATOM 388 OE2 GLU A 74 3.362 3.477 15.588 1.00 0.00 O ATOM 0 H GLU A 74 -1.810 1.732 12.930 1.00 0.00 H new ATOM 0 HA GLU A 74 -1.347 2.186 15.783 1.00 0.00 H new ATOM 0 HB2 GLU A 74 0.292 1.965 13.618 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -0.045 3.680 13.486 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.774 4.060 15.773 1.00 0.00 H new ATOM 0 HG3 GLU A 74 1.009 2.339 16.006 1.00 0.00 H new ATOM 389 N THR A 75 -2.637 4.389 13.753 1.00 0.00 N ATOM 390 CA THR A 75 -3.252 5.712 13.538 1.00 0.00 C ATOM 391 C THR A 75 -4.794 5.671 13.502 1.00 0.00 C ATOM 392 O THR A 75 -5.448 6.704 13.496 1.00 0.00 O ATOM 393 CB THR A 75 -2.733 6.354 12.243 1.00 0.00 C ATOM 394 OG1 THR A 75 -3.025 5.569 11.083 1.00 0.00 O ATOM 395 CG2 THR A 75 -1.235 6.673 12.315 1.00 0.00 C ATOM 0 H THR A 75 -2.667 3.798 12.922 1.00 0.00 H new ATOM 0 HA THR A 75 -2.960 6.315 14.398 1.00 0.00 H new ATOM 0 HB THR A 75 -3.273 7.296 12.144 1.00 0.00 H new ATOM 0 HG1 THR A 75 -3.319 6.157 10.356 1.00 0.00 H new ATOM 0 HG21 THR A 75 -0.914 7.125 11.377 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.050 7.367 13.135 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.675 5.753 12.485 1.00 0.00 H new ATOM 396 N GLY A 76 -5.299 4.459 13.283 1.00 0.00 N ATOM 397 CA GLY A 76 -6.735 4.116 13.316 1.00 0.00 C ATOM 398 C GLY A 76 -7.479 4.417 12.012 1.00 0.00 C ATOM 399 O GLY A 76 -8.703 4.510 12.001 1.00 0.00 O ATOM 0 H GLY A 76 -4.707 3.656 13.070 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.839 3.055 13.545 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -7.210 4.666 14.128 1.00 0.00 H new ATOM 400 N GLN A 77 -6.741 4.328 10.911 1.00 0.00 N ATOM 401 CA GLN A 77 -7.239 4.614 9.550 1.00 0.00 C ATOM 402 C GLN A 77 -7.256 3.318 8.716 1.00 0.00 C ATOM 403 O GLN A 77 -7.008 2.223 9.222 1.00 0.00 O ATOM 404 CB GLN A 77 -6.303 5.630 8.873 1.00 0.00 C ATOM 405 CG GLN A 77 -6.278 7.025 9.509 1.00 0.00 C ATOM 406 CD GLN A 77 -5.055 7.809 9.020 1.00 0.00 C ATOM 407 OE1 GLN A 77 -3.913 7.555 9.403 1.00 0.00 O ATOM 408 NE2 GLN A 77 -5.247 8.715 8.088 1.00 0.00 N ATOM 0 H GLN A 77 -5.760 4.051 10.929 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.249 5.018 9.615 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -5.290 5.227 8.881 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -6.598 5.730 7.828 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -7.190 7.565 9.255 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -6.252 6.937 10.595 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -6.193 8.927 7.770 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -4.450 9.207 7.683 1.00 0.00 H new ATOM 409 N TYR A 78 -7.800 3.440 7.508 1.00 0.00 N ATOM 410 CA TYR A 78 -7.764 2.433 6.446 1.00 0.00 C ATOM 411 C TYR A 78 -7.048 3.020 5.233 1.00 0.00 C ATOM 412 O TYR A 78 -7.424 4.077 4.727 1.00 0.00 O ATOM 413 CB TYR A 78 -9.182 2.095 5.977 1.00 0.00 C ATOM 414 CG TYR A 78 -9.981 1.328 7.024 1.00 0.00 C ATOM 415 CD1 TYR A 78 -10.738 2.037 7.990 1.00 0.00 C ATOM 416 CD2 TYR A 78 -9.905 -0.077 7.011 1.00 0.00 C ATOM 417 CE1 TYR A 78 -11.439 1.314 8.964 1.00 0.00 C ATOM 418 CE2 TYR A 78 -10.616 -0.809 7.979 1.00 0.00 C ATOM 419 CZ TYR A 78 -11.356 -0.095 8.947 1.00 0.00 C ATOM 420 OH TYR A 78 -12.080 -0.803 9.854 1.00 0.00 O ATOM 0 H TYR A 78 -8.302 4.283 7.228 1.00 0.00 H new ATOM 0 HA TYR A 78 -7.263 1.547 6.837 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -9.708 3.017 5.729 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -9.127 1.504 5.063 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -10.774 3.116 7.975 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -9.309 -0.586 6.268 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -12.030 1.823 9.711 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -10.597 -1.889 7.982 1.00 0.00 H new ATOM 0 HH TYR A 78 -11.924 -1.761 9.721 1.00 0.00 H new ATOM 421 N LEU A 79 -6.045 2.299 4.738 1.00 0.00 N ATOM 422 CA LEU A 79 -5.376 2.653 3.479 1.00 0.00 C ATOM 423 C LEU A 79 -6.407 2.562 2.355 1.00 0.00 C ATOM 424 O LEU A 79 -7.171 1.607 2.315 1.00 0.00 O ATOM 425 CB LEU A 79 -4.260 1.631 3.306 1.00 0.00 C ATOM 426 CG LEU A 79 -3.144 2.149 2.398 1.00 0.00 C ATOM 427 CD1 LEU A 79 -2.223 3.066 3.212 1.00 0.00 C ATOM 428 CD2 LEU A 79 -2.319 0.972 1.862 1.00 0.00 C ATOM 0 H LEU A 79 -5.673 1.462 5.188 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.963 3.662 3.471 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.845 1.378 4.282 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.671 0.713 2.887 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.584 2.696 1.564 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.424 3.440 2.572 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.798 3.906 3.603 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -1.791 2.505 4.041 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.526 1.348 1.216 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.879 0.426 2.697 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.965 0.304 1.292 1.00 0.00 H new ATOM 429 N ALA A 80 -6.471 3.636 1.589 1.00 0.00 N ATOM 430 CA ALA A 80 -7.559 3.868 0.629 1.00 0.00 C ATOM 431 C ALA A 80 -7.102 4.712 -0.561 1.00 0.00 C ATOM 432 O ALA A 80 -6.506 5.776 -0.406 1.00 0.00 O ATOM 433 CB ALA A 80 -8.686 4.582 1.357 1.00 0.00 C ATOM 0 H ALA A 80 -5.773 4.380 1.608 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.890 2.907 0.235 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -9.507 4.766 0.665 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -9.038 3.961 2.181 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.322 5.532 1.749 1.00 0.00 H new ATOM 434 N MET A 81 -7.454 4.198 -1.734 1.00 0.00 N ATOM 435 CA MET A 81 -6.969 4.785 -2.998 1.00 0.00 C ATOM 436 C MET A 81 -7.995 5.659 -3.719 1.00 0.00 C ATOM 437 O MET A 81 -9.204 5.444 -3.682 1.00 0.00 O ATOM 438 CB MET A 81 -6.506 3.590 -3.832 1.00 0.00 C ATOM 439 CG MET A 81 -5.550 3.937 -4.968 1.00 0.00 C ATOM 440 SD MET A 81 -4.438 2.520 -5.304 1.00 0.00 S ATOM 441 CE MET A 81 -4.352 2.581 -7.077 1.00 0.00 C ATOM 0 H MET A 81 -8.064 3.388 -1.846 1.00 0.00 H new ATOM 0 HA MET A 81 -6.159 5.491 -2.812 1.00 0.00 H new ATOM 0 HB2 MET A 81 -6.019 2.871 -3.173 1.00 0.00 H new ATOM 0 HB3 MET A 81 -7.382 3.096 -4.251 1.00 0.00 H new ATOM 0 HG2 MET A 81 -6.115 4.188 -5.866 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.963 4.817 -4.705 1.00 0.00 H new ATOM 0 HE1 MET A 81 -3.860 1.682 -7.449 1.00 0.00 H new ATOM 0 HE2 MET A 81 -5.360 2.640 -7.488 1.00 0.00 H new ATOM 0 HE3 MET A 81 -3.783 3.459 -7.384 1.00 0.00 H new ATOM 442 N ASP A 82 -7.480 6.832 -4.087 1.00 0.00 N ATOM 443 CA ASP A 82 -8.170 7.813 -4.925 1.00 0.00 C ATOM 444 C ASP A 82 -7.899 7.491 -6.409 1.00 0.00 C ATOM 445 O ASP A 82 -6.874 6.908 -6.752 1.00 0.00 O ATOM 446 CB ASP A 82 -7.644 9.196 -4.521 1.00 0.00 C ATOM 447 CG ASP A 82 -8.408 10.334 -5.192 1.00 0.00 C ATOM 448 OD1 ASP A 82 -9.600 10.491 -4.852 1.00 0.00 O ATOM 449 OD2 ASP A 82 -7.839 10.872 -6.161 1.00 0.00 O ATOM 0 H ASP A 82 -6.548 7.134 -3.804 1.00 0.00 H new ATOM 0 HA ASP A 82 -9.251 7.789 -4.788 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.714 9.305 -3.439 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -6.588 9.269 -4.781 1.00 0.00 H new ATOM 450 N THR A 83 -8.756 8.045 -7.250 1.00 0.00 N ATOM 451 CA THR A 83 -8.744 7.939 -8.733 1.00 0.00 C ATOM 452 C THR A 83 -7.678 8.757 -9.458 1.00 0.00 C ATOM 453 O THR A 83 -7.814 9.198 -10.604 1.00 0.00 O ATOM 454 CB THR A 83 -10.115 8.343 -9.285 1.00 0.00 C ATOM 455 OG1 THR A 83 -10.540 9.555 -8.639 1.00 0.00 O ATOM 456 CG2 THR A 83 -11.140 7.225 -9.109 1.00 0.00 C ATOM 0 H THR A 83 -9.531 8.618 -6.915 1.00 0.00 H new ATOM 0 HA THR A 83 -8.499 6.895 -8.928 1.00 0.00 H new ATOM 0 HB THR A 83 -10.031 8.520 -10.357 1.00 0.00 H new ATOM 0 HG1 THR A 83 -11.416 9.822 -8.988 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.101 7.546 -9.511 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.803 6.335 -9.641 1.00 0.00 H new ATOM 0 HG23 THR A 83 -11.249 6.995 -8.049 1.00 0.00 H new ATOM 457 N ASP A 84 -6.631 9.001 -8.695 1.00 0.00 N ATOM 458 CA ASP A 84 -5.329 9.504 -9.171 1.00 0.00 C ATOM 459 C ASP A 84 -4.172 8.681 -8.597 1.00 0.00 C ATOM 460 O ASP A 84 -3.005 9.088 -8.608 1.00 0.00 O ATOM 461 CB ASP A 84 -5.195 10.966 -8.749 1.00 0.00 C ATOM 462 CG ASP A 84 -6.182 11.854 -9.513 1.00 0.00 C ATOM 463 OD1 ASP A 84 -5.798 12.322 -10.609 1.00 0.00 O ATOM 464 OD2 ASP A 84 -7.306 12.040 -8.994 1.00 0.00 O ATOM 0 H ASP A 84 -6.650 8.853 -7.686 1.00 0.00 H new ATOM 0 HA ASP A 84 -5.285 9.416 -10.257 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -5.374 11.056 -7.678 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -4.176 11.308 -8.932 1.00 0.00 H new ATOM 465 N GLY A 85 -4.531 7.482 -8.161 1.00 0.00 N ATOM 466 CA GLY A 85 -3.707 6.565 -7.348 1.00 0.00 C ATOM 467 C GLY A 85 -3.002 7.275 -6.192 1.00 0.00 C ATOM 468 O GLY A 85 -1.787 7.260 -6.090 1.00 0.00 O ATOM 0 H GLY A 85 -5.450 7.092 -8.369 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -4.339 5.771 -6.950 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -2.962 6.090 -7.986 1.00 0.00 H new ATOM 469 N LEU A 86 -3.839 7.930 -5.397 1.00 0.00 N ATOM 470 CA LEU A 86 -3.355 8.613 -4.208 1.00 0.00 C ATOM 471 C LEU A 86 -4.012 7.973 -2.989 1.00 0.00 C ATOM 472 O LEU A 86 -5.219 7.795 -2.944 1.00 0.00 O ATOM 473 CB LEU A 86 -3.649 10.115 -4.244 1.00 0.00 C ATOM 474 CG LEU A 86 -2.826 10.793 -3.147 1.00 0.00 C ATOM 475 CD1 LEU A 86 -1.875 11.822 -3.754 1.00 0.00 C ATOM 476 CD2 LEU A 86 -3.726 11.431 -2.085 1.00 0.00 C ATOM 0 H LEU A 86 -4.845 8.002 -5.553 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.271 8.509 -4.160 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.394 10.528 -5.220 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.712 10.297 -4.088 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.231 10.027 -2.649 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -1.297 12.295 -2.961 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.198 11.326 -4.450 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -2.450 12.580 -4.286 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.109 11.904 -1.321 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -4.364 12.182 -2.552 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.347 10.662 -1.625 1.00 0.00 H new ATOM 477 N LEU A 87 -3.138 7.454 -2.159 1.00 0.00 N ATOM 478 CA LEU A 87 -3.587 6.911 -0.881 1.00 0.00 C ATOM 479 C LEU A 87 -3.771 7.992 0.174 1.00 0.00 C ATOM 480 O LEU A 87 -2.981 8.918 0.359 1.00 0.00 O ATOM 481 CB LEU A 87 -2.663 5.849 -0.304 1.00 0.00 C ATOM 482 CG LEU A 87 -2.368 4.675 -1.244 1.00 0.00 C ATOM 483 CD1 LEU A 87 -1.305 3.819 -0.554 1.00 0.00 C ATOM 484 CD2 LEU A 87 -3.612 3.820 -1.504 1.00 0.00 C ATOM 0 H LEU A 87 -2.134 7.392 -2.331 1.00 0.00 H new ATOM 0 HA LEU A 87 -4.545 6.447 -1.118 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.720 6.320 -0.026 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.107 5.460 0.612 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.034 5.055 -2.210 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.059 2.966 -1.186 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.409 4.417 -0.386 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.688 3.464 0.402 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.356 3.000 -2.175 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.979 3.416 -0.561 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.387 4.435 -1.962 1.00 0.00 H new ATOM 485 N TYR A 88 -4.948 7.839 0.753 1.00 0.00 N ATOM 486 CA TYR A 88 -5.427 8.591 1.913 1.00 0.00 C ATOM 487 C TYR A 88 -6.018 7.614 2.930 1.00 0.00 C ATOM 488 O TYR A 88 -6.667 6.634 2.574 1.00 0.00 O ATOM 489 CB TYR A 88 -6.434 9.696 1.534 1.00 0.00 C ATOM 490 CG TYR A 88 -7.666 9.188 0.774 1.00 0.00 C ATOM 491 CD1 TYR A 88 -7.516 8.893 -0.594 1.00 0.00 C ATOM 492 CD2 TYR A 88 -8.808 8.774 1.513 1.00 0.00 C ATOM 493 CE1 TYR A 88 -8.484 8.079 -1.219 1.00 0.00 C ATOM 494 CE2 TYR A 88 -9.769 7.963 0.872 1.00 0.00 C ATOM 495 CZ TYR A 88 -9.572 7.604 -0.473 1.00 0.00 C ATOM 496 OH TYR A 88 -10.369 6.660 -1.046 1.00 0.00 O ATOM 0 H TYR A 88 -5.631 7.159 0.418 1.00 0.00 H new ATOM 0 HA TYR A 88 -4.579 9.111 2.358 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -6.763 10.200 2.443 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -5.926 10.442 0.923 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -6.678 9.281 -1.153 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -8.937 9.074 2.543 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -8.388 7.824 -2.264 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -10.643 7.623 1.407 1.00 0.00 H new ATOM 0 HH TYR A 88 -9.948 6.332 -1.868 1.00 0.00 H new ATOM 497 N GLY A 89 -5.605 7.837 4.171 1.00 0.00 N ATOM 498 CA GLY A 89 -5.998 7.047 5.339 1.00 0.00 C ATOM 499 C GLY A 89 -7.429 7.417 5.749 1.00 0.00 C ATOM 500 O GLY A 89 -7.659 8.369 6.485 1.00 0.00 O ATOM 0 H GLY A 89 -4.966 8.597 4.404 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.938 5.983 5.109 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.312 7.234 6.165 1.00 0.00 H new ATOM 501 N SER A 90 -8.335 6.626 5.192 1.00 0.00 N ATOM 502 CA SER A 90 -9.786 6.814 5.383 1.00 0.00 C ATOM 503 C SER A 90 -10.329 6.190 6.655 1.00 0.00 C ATOM 504 O SER A 90 -9.790 5.274 7.254 1.00 0.00 O ATOM 505 CB SER A 90 -10.518 6.288 4.134 1.00 0.00 C ATOM 506 OG SER A 90 -11.934 6.336 4.267 1.00 0.00 O ATOM 0 H SER A 90 -8.097 5.834 4.594 1.00 0.00 H new ATOM 0 HA SER A 90 -9.968 7.882 5.507 1.00 0.00 H new ATOM 0 HB2 SER A 90 -10.218 6.877 3.267 1.00 0.00 H new ATOM 0 HB3 SER A 90 -10.210 5.260 3.943 1.00 0.00 H new ATOM 0 HG SER A 90 -12.294 5.425 4.261 1.00 0.00 H new ATOM 507 N GLN A 91 -11.430 6.805 7.013 1.00 0.00 N ATOM 508 CA GLN A 91 -12.223 6.494 8.200 1.00 0.00 C ATOM 509 C GLN A 91 -13.326 5.456 7.919 1.00 0.00 C ATOM 510 O GLN A 91 -13.908 4.876 8.839 1.00 0.00 O ATOM 511 CB GLN A 91 -12.758 7.813 8.740 1.00 0.00 C ATOM 512 CG GLN A 91 -13.619 8.514 7.718 1.00 0.00 C ATOM 513 CD GLN A 91 -14.204 9.822 8.251 1.00 0.00 C ATOM 514 OE1 GLN A 91 -13.545 10.827 8.432 1.00 0.00 O ATOM 515 NE2 GLN A 91 -15.496 9.794 8.502 1.00 0.00 N ATOM 0 H GLN A 91 -11.824 7.572 6.467 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.603 6.014 8.957 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -13.339 7.630 9.644 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.925 8.458 9.021 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.026 8.720 6.827 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -14.431 7.853 7.415 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -16.028 8.939 8.342 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -15.965 10.628 8.856 1.00 0.00 H new ATOM 516 N THR A 92 -13.675 5.317 6.642 1.00 0.00 N ATOM 517 CA THR A 92 -14.707 4.386 6.177 1.00 0.00 C ATOM 518 C THR A 92 -14.099 3.268 5.300 1.00 0.00 C ATOM 519 O THR A 92 -13.459 3.570 4.292 1.00 0.00 O ATOM 520 CB THR A 92 -15.816 5.120 5.424 1.00 0.00 C ATOM 521 OG1 THR A 92 -15.250 5.857 4.338 1.00 0.00 O ATOM 522 CG2 THR A 92 -16.642 6.020 6.362 1.00 0.00 C ATOM 0 H THR A 92 -13.245 5.854 5.889 1.00 0.00 H new ATOM 0 HA THR A 92 -15.148 3.921 7.058 1.00 0.00 H new ATOM 0 HB THR A 92 -16.511 4.385 5.018 1.00 0.00 H new ATOM 0 HG1 THR A 92 -15.056 5.248 3.595 1.00 0.00 H new ATOM 0 HG21 THR A 92 -17.420 6.525 5.790 1.00 0.00 H new ATOM 0 HG22 THR A 92 -17.101 5.410 7.140 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.990 6.763 6.821 1.00 0.00 H new ATOM 523 N PRO A 93 -14.227 2.013 5.755 1.00 0.00 N ATOM 524 CA PRO A 93 -13.755 0.828 5.006 1.00 0.00 C ATOM 525 C PRO A 93 -14.633 0.566 3.766 1.00 0.00 C ATOM 526 O PRO A 93 -15.801 0.209 3.866 1.00 0.00 O ATOM 527 CB PRO A 93 -13.797 -0.302 6.030 1.00 0.00 C ATOM 528 CG PRO A 93 -14.884 0.107 7.016 1.00 0.00 C ATOM 529 CD PRO A 93 -14.726 1.629 7.087 1.00 0.00 C ATOM 0 HA PRO A 93 -12.752 0.948 4.597 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -14.030 -1.256 5.557 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.835 -0.420 6.528 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -15.876 -0.180 6.666 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -14.742 -0.360 7.991 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -15.675 2.116 7.310 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -14.027 1.919 7.871 1.00 0.00 H new ATOM 530 N ASN A 94 -14.042 0.834 2.594 1.00 0.00 N ATOM 531 CA ASN A 94 -14.770 0.809 1.315 1.00 0.00 C ATOM 532 C ASN A 94 -14.014 0.037 0.218 1.00 0.00 C ATOM 533 O ASN A 94 -12.832 -0.252 0.357 1.00 0.00 O ATOM 534 CB ASN A 94 -14.960 2.257 0.847 1.00 0.00 C ATOM 535 CG ASN A 94 -15.787 3.127 1.797 1.00 0.00 C ATOM 536 OD1 ASN A 94 -15.349 4.169 2.269 1.00 0.00 O ATOM 537 ND2 ASN A 94 -16.990 2.691 2.119 1.00 0.00 N ATOM 0 H ASN A 94 -13.054 1.072 2.504 1.00 0.00 H new ATOM 0 HA ASN A 94 -15.721 0.302 1.479 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -13.980 2.715 0.716 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -15.442 2.249 -0.131 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -17.568 3.223 2.769 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -17.342 1.822 1.718 1.00 0.00 H new ATOM 538 N GLU A 95 -14.623 0.011 -0.976 1.00 0.00 N ATOM 539 CA GLU A 95 -14.053 -0.581 -2.221 1.00 0.00 C ATOM 540 C GLU A 95 -12.662 -0.061 -2.641 1.00 0.00 C ATOM 541 O GLU A 95 -11.881 -0.774 -3.259 1.00 0.00 O ATOM 542 CB GLU A 95 -15.005 -0.370 -3.405 1.00 0.00 C ATOM 543 CG GLU A 95 -16.197 -1.331 -3.386 1.00 0.00 C ATOM 544 CD GLU A 95 -17.119 -1.018 -4.566 1.00 0.00 C ATOM 545 OE1 GLU A 95 -17.813 0.018 -4.474 1.00 0.00 O ATOM 546 OE2 GLU A 95 -17.137 -1.836 -5.517 1.00 0.00 O ATOM 0 H GLU A 95 -15.551 0.409 -1.119 1.00 0.00 H new ATOM 0 HA GLU A 95 -13.930 -1.634 -1.968 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -15.371 0.656 -3.392 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -14.454 -0.500 -4.336 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -15.848 -2.362 -3.446 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -16.743 -1.233 -2.448 1.00 0.00 H new ATOM 547 N GLU A 96 -12.326 1.122 -2.144 1.00 0.00 N ATOM 548 CA GLU A 96 -11.068 1.859 -2.414 1.00 0.00 C ATOM 549 C GLU A 96 -9.961 1.379 -1.478 1.00 0.00 C ATOM 550 O GLU A 96 -8.771 1.417 -1.792 1.00 0.00 O ATOM 551 CB GLU A 96 -11.236 3.353 -2.099 1.00 0.00 C ATOM 552 CG GLU A 96 -12.127 4.129 -3.075 1.00 0.00 C ATOM 553 CD GLU A 96 -13.622 4.181 -2.712 1.00 0.00 C ATOM 554 OE1 GLU A 96 -14.117 3.270 -2.015 1.00 0.00 O ATOM 555 OE2 GLU A 96 -14.261 5.161 -3.150 1.00 0.00 O ATOM 0 H GLU A 96 -12.943 1.630 -1.510 1.00 0.00 H new ATOM 0 HA GLU A 96 -10.824 1.690 -3.463 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.651 3.452 -1.096 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -10.250 3.818 -2.084 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -11.753 5.150 -3.147 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.027 3.682 -4.064 1.00 0.00 H new ATOM 556 N CYS A 97 -10.418 1.196 -0.254 1.00 0.00 N ATOM 557 CA CYS A 97 -9.660 0.687 0.882 1.00 0.00 C ATOM 558 C CYS A 97 -9.318 -0.807 0.793 1.00 0.00 C ATOM 559 O CYS A 97 -8.609 -1.367 1.630 1.00 0.00 O ATOM 560 CB CYS A 97 -10.474 0.903 2.162 1.00 0.00 C ATOM 561 SG CYS A 97 -11.206 2.576 2.376 1.00 0.00 S ATOM 0 H CYS A 97 -11.384 1.410 -0.008 1.00 0.00 H new ATOM 0 HA CYS A 97 -8.718 1.236 0.884 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -11.280 0.169 2.185 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -9.831 0.697 3.018 1.00 0.00 H new ATOM 0 HG CYS A 97 -12.098 2.542 3.321 1.00 0.00 H new ATOM 562 N LEU A 98 -9.889 -1.431 -0.231 1.00 0.00 N ATOM 563 CA LEU A 98 -9.707 -2.852 -0.590 1.00 0.00 C ATOM 564 C LEU A 98 -8.587 -2.987 -1.613 1.00 0.00 C ATOM 565 O LEU A 98 -8.600 -2.432 -2.713 1.00 0.00 O ATOM 566 CB LEU A 98 -11.054 -3.352 -1.090 1.00 0.00 C ATOM 567 CG LEU A 98 -11.957 -3.653 0.095 1.00 0.00 C ATOM 568 CD1 LEU A 98 -13.437 -3.661 -0.309 1.00 0.00 C ATOM 569 CD2 LEU A 98 -11.612 -4.956 0.817 1.00 0.00 C ATOM 0 H LEU A 98 -10.522 -0.948 -0.869 1.00 0.00 H new ATOM 0 HA LEU A 98 -9.401 -3.463 0.259 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -11.517 -2.602 -1.731 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.919 -4.249 -1.694 1.00 0.00 H new ATOM 0 HG LEU A 98 -11.778 -2.840 0.799 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -14.051 -3.880 0.564 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -13.710 -2.685 -0.710 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.602 -4.424 -1.069 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -12.299 -5.103 1.651 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -11.700 -5.791 0.122 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.590 -4.904 1.194 1.00 0.00 H new ATOM 570 N PHE A 99 -7.624 -3.752 -1.144 1.00 0.00 N ATOM 571 CA PHE A 99 -6.364 -4.014 -1.841 1.00 0.00 C ATOM 572 C PHE A 99 -6.171 -5.512 -2.046 1.00 0.00 C ATOM 573 O PHE A 99 -5.944 -6.284 -1.114 1.00 0.00 O ATOM 574 CB PHE A 99 -5.175 -3.489 -1.060 1.00 0.00 C ATOM 575 CG PHE A 99 -5.149 -1.970 -0.911 1.00 0.00 C ATOM 576 CD1 PHE A 99 -4.755 -1.205 -2.045 1.00 0.00 C ATOM 577 CD2 PHE A 99 -5.719 -1.354 0.221 1.00 0.00 C ATOM 578 CE1 PHE A 99 -4.973 0.182 -2.060 1.00 0.00 C ATOM 579 CE2 PHE A 99 -5.924 0.037 0.199 1.00 0.00 C ATOM 580 CZ PHE A 99 -5.572 0.799 -0.936 1.00 0.00 C ATOM 0 H PHE A 99 -7.689 -4.226 -0.243 1.00 0.00 H new ATOM 0 HA PHE A 99 -6.420 -3.501 -2.801 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -5.177 -3.941 -0.068 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.258 -3.811 -1.554 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -4.290 -1.690 -2.891 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -5.993 -1.938 1.087 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.687 0.771 -2.919 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -6.355 0.527 1.059 1.00 0.00 H new ATOM 0 HZ PHE A 99 -5.761 1.862 -0.947 1.00 0.00 H new ATOM 581 N LEU A 100 -6.428 -5.895 -3.282 1.00 0.00 N ATOM 582 CA LEU A 100 -6.396 -7.295 -3.711 1.00 0.00 C ATOM 583 C LEU A 100 -4.974 -7.812 -3.887 1.00 0.00 C ATOM 584 O LEU A 100 -4.237 -7.353 -4.748 1.00 0.00 O ATOM 585 CB LEU A 100 -7.243 -7.439 -4.971 1.00 0.00 C ATOM 586 CG LEU A 100 -7.785 -8.855 -4.962 1.00 0.00 C ATOM 587 CD1 LEU A 100 -9.210 -8.946 -5.515 1.00 0.00 C ATOM 588 CD2 LEU A 100 -6.907 -9.885 -5.698 1.00 0.00 C ATOM 0 H LEU A 100 -6.668 -5.243 -4.029 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.825 -7.923 -2.930 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -8.055 -6.712 -4.978 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -6.645 -7.258 -5.864 1.00 0.00 H new ATOM 0 HG LEU A 100 -7.781 -9.113 -3.903 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.547 -9.982 -5.485 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.875 -8.330 -4.910 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -9.224 -8.590 -6.545 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -7.373 -10.869 -5.639 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.804 -9.594 -6.743 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.922 -9.922 -5.233 1.00 0.00 H new ATOM 589 N GLU A 101 -4.596 -8.625 -2.908 1.00 0.00 N ATOM 590 CA GLU A 101 -3.275 -9.287 -2.882 1.00 0.00 C ATOM 591 C GLU A 101 -2.935 -9.970 -4.209 1.00 0.00 C ATOM 592 O GLU A 101 -3.634 -10.839 -4.711 1.00 0.00 O ATOM 593 CB GLU A 101 -3.122 -10.313 -1.758 1.00 0.00 C ATOM 594 CG GLU A 101 -3.387 -9.711 -0.377 1.00 0.00 C ATOM 595 CD GLU A 101 -2.956 -10.663 0.738 1.00 0.00 C ATOM 596 OE1 GLU A 101 -3.797 -11.499 1.125 1.00 0.00 O ATOM 597 OE2 GLU A 101 -1.791 -10.521 1.164 1.00 0.00 O ATOM 0 H GLU A 101 -5.186 -8.851 -2.107 1.00 0.00 H new ATOM 0 HA GLU A 101 -2.577 -8.470 -2.699 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.811 -11.140 -1.929 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -2.114 -10.727 -1.783 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.849 -8.768 -0.280 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -4.448 -9.485 -0.274 1.00 0.00 H new ATOM 598 N ARG A 102 -1.879 -9.410 -4.763 1.00 0.00 N ATOM 599 CA ARG A 102 -1.308 -9.777 -6.072 1.00 0.00 C ATOM 600 C ARG A 102 0.148 -10.219 -5.932 1.00 0.00 C ATOM 601 O ARG A 102 1.094 -9.624 -6.442 1.00 0.00 O ATOM 602 CB ARG A 102 -1.489 -8.590 -7.019 1.00 0.00 C ATOM 603 CG ARG A 102 -2.915 -8.617 -7.551 1.00 0.00 C ATOM 604 CD ARG A 102 -3.039 -9.501 -8.793 1.00 0.00 C ATOM 605 NE ARG A 102 -2.939 -8.559 -9.919 1.00 0.00 N ATOM 606 CZ ARG A 102 -3.030 -8.838 -11.221 1.00 0.00 C ATOM 607 NH1 ARG A 102 -2.904 -10.049 -11.715 1.00 0.00 N ATOM 608 NH2 ARG A 102 -3.117 -7.901 -12.139 1.00 0.00 N ATOM 0 H ARG A 102 -1.365 -8.656 -4.308 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.830 -10.636 -6.493 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -1.297 -7.654 -6.495 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.776 -8.648 -7.841 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -3.586 -8.984 -6.775 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -3.232 -7.603 -7.793 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -2.248 -10.250 -8.829 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -3.987 -10.038 -8.806 1.00 0.00 H new ATOM 0 HE ARG A 102 -2.782 -7.581 -9.677 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -2.727 -10.838 -11.093 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -2.984 -10.200 -12.721 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -3.117 -6.918 -11.866 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -3.185 -8.157 -13.124 1.00 0.00 H new ATOM 609 N LEU A 103 0.271 -11.248 -5.107 1.00 0.00 N ATOM 610 CA LEU A 103 1.527 -11.963 -4.822 1.00 0.00 C ATOM 611 C LEU A 103 2.042 -12.638 -6.093 1.00 0.00 C ATOM 612 O LEU A 103 1.388 -13.430 -6.766 1.00 0.00 O ATOM 613 CB LEU A 103 1.327 -12.905 -3.635 1.00 0.00 C ATOM 614 CG LEU A 103 2.536 -13.814 -3.342 1.00 0.00 C ATOM 615 CD1 LEU A 103 3.759 -13.055 -2.810 1.00 0.00 C ATOM 616 CD2 LEU A 103 2.124 -14.853 -2.302 1.00 0.00 C ATOM 0 H LEU A 103 -0.524 -11.629 -4.594 1.00 0.00 H new ATOM 0 HA LEU A 103 2.311 -11.269 -4.521 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.109 -12.312 -2.747 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.454 -13.530 -3.824 1.00 0.00 H new ATOM 0 HG LEU A 103 2.827 -14.270 -4.288 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.572 -13.758 -2.626 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.077 -12.317 -3.546 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.498 -12.551 -1.880 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.970 -15.505 -2.084 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.810 -14.348 -1.388 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.298 -15.449 -2.690 1.00 0.00 H new ATOM 617 N GLU A 104 3.126 -11.998 -6.484 1.00 0.00 N ATOM 618 CA GLU A 104 3.824 -12.154 -7.764 1.00 0.00 C ATOM 619 C GLU A 104 4.624 -13.451 -7.845 1.00 0.00 C ATOM 620 O GLU A 104 5.149 -13.966 -6.860 1.00 0.00 O ATOM 621 CB GLU A 104 4.801 -10.987 -7.895 1.00 0.00 C ATOM 622 CG GLU A 104 4.150 -9.603 -7.813 1.00 0.00 C ATOM 623 CD GLU A 104 5.201 -8.520 -8.023 1.00 0.00 C ATOM 624 OE1 GLU A 104 5.641 -8.383 -9.193 1.00 0.00 O ATOM 625 OE2 GLU A 104 5.556 -7.851 -7.026 1.00 0.00 O ATOM 0 H GLU A 104 3.579 -11.309 -5.884 1.00 0.00 H new ATOM 0 HA GLU A 104 3.079 -12.176 -8.559 1.00 0.00 H new ATOM 0 HB2 GLU A 104 5.552 -11.068 -7.110 1.00 0.00 H new ATOM 0 HB3 GLU A 104 5.325 -11.073 -8.847 1.00 0.00 H new ATOM 0 HG2 GLU A 104 3.369 -9.514 -8.568 1.00 0.00 H new ATOM 0 HG3 GLU A 104 3.672 -9.474 -6.842 1.00 0.00 H new ATOM 626 N GLU A 105 4.925 -13.778 -9.097 1.00 0.00 N ATOM 627 CA GLU A 105 5.849 -14.865 -9.472 1.00 0.00 C ATOM 628 C GLU A 105 7.337 -14.499 -9.297 1.00 0.00 C ATOM 629 O GLU A 105 8.209 -14.899 -10.074 1.00 0.00 O ATOM 630 CB GLU A 105 5.556 -15.260 -10.926 1.00 0.00 C ATOM 631 CG GLU A 105 4.160 -15.848 -11.062 1.00 0.00 C ATOM 632 CD GLU A 105 3.883 -16.083 -12.540 1.00 0.00 C ATOM 633 OE1 GLU A 105 3.708 -15.062 -13.249 1.00 0.00 O ATOM 634 OE2 GLU A 105 3.940 -17.267 -12.944 1.00 0.00 O ATOM 0 H GLU A 105 4.531 -13.291 -9.902 1.00 0.00 H new ATOM 0 HA GLU A 105 5.677 -15.702 -8.795 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.650 -14.386 -11.570 1.00 0.00 H new ATOM 0 HB3 GLU A 105 6.295 -15.986 -11.265 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.087 -16.784 -10.508 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.419 -15.169 -10.640 1.00 0.00 H new ATOM 635 N ASN A 106 7.590 -13.736 -8.240 1.00 0.00 N ATOM 636 CA ASN A 106 8.916 -13.249 -7.818 1.00 0.00 C ATOM 637 C ASN A 106 8.973 -12.871 -6.323 1.00 0.00 C ATOM 638 O ASN A 106 9.683 -11.946 -5.929 1.00 0.00 O ATOM 639 CB ASN A 106 9.368 -12.068 -8.704 1.00 0.00 C ATOM 640 CG ASN A 106 8.349 -10.935 -8.775 1.00 0.00 C ATOM 641 OD1 ASN A 106 7.892 -10.374 -7.788 1.00 0.00 O ATOM 642 ND2 ASN A 106 7.891 -10.647 -9.977 1.00 0.00 N ATOM 0 H ASN A 106 6.846 -13.420 -7.618 1.00 0.00 H new ATOM 0 HA ASN A 106 9.611 -14.078 -7.951 1.00 0.00 H new ATOM 0 HB2 ASN A 106 10.310 -11.676 -8.320 1.00 0.00 H new ATOM 0 HB3 ASN A 106 9.563 -12.434 -9.712 1.00 0.00 H new ATOM 0 HD21 ASN A 106 7.152 -9.953 -10.088 1.00 0.00 H new ATOM 0 HD22 ASN A 106 8.276 -11.118 -10.796 1.00 0.00 H new ATOM 643 N HIS A 107 8.392 -13.743 -5.483 1.00 0.00 N ATOM 644 CA HIS A 107 8.281 -13.637 -4.017 1.00 0.00 C ATOM 645 C HIS A 107 7.568 -12.425 -3.405 1.00 0.00 C ATOM 646 O HIS A 107 7.097 -12.487 -2.267 1.00 0.00 O ATOM 647 CB HIS A 107 9.673 -13.787 -3.394 1.00 0.00 C ATOM 648 CG HIS A 107 10.237 -15.182 -3.667 1.00 0.00 C ATOM 649 ND1 HIS A 107 11.007 -15.510 -4.696 1.00 0.00 N ATOM 650 CD2 HIS A 107 9.841 -16.302 -3.069 1.00 0.00 C ATOM 651 CE1 HIS A 107 11.085 -16.837 -4.759 1.00 0.00 C ATOM 652 NE2 HIS A 107 10.361 -17.320 -3.758 1.00 0.00 N ATOM 0 H HIS A 107 7.958 -14.598 -5.832 1.00 0.00 H new ATOM 0 HA HIS A 107 7.600 -14.451 -3.769 1.00 0.00 H new ATOM 0 HB2 HIS A 107 10.344 -13.031 -3.803 1.00 0.00 H new ATOM 0 HB3 HIS A 107 9.617 -13.615 -2.319 1.00 0.00 H new ATOM 0 HD2 HIS A 107 9.216 -16.374 -2.191 1.00 0.00 H new ATOM 0 HE1 HIS A 107 11.635 -17.413 -5.489 1.00 0.00 H new ATOM 0 HE2 HIS A 107 10.224 -18.309 -3.549 1.00 0.00 H new ATOM 653 N TYR A 108 7.706 -11.302 -4.085 1.00 0.00 N ATOM 654 CA TYR A 108 7.039 -10.038 -3.767 1.00 0.00 C ATOM 655 C TYR A 108 5.524 -10.158 -3.825 1.00 0.00 C ATOM 656 O TYR A 108 4.925 -10.703 -4.748 1.00 0.00 O ATOM 657 CB TYR A 108 7.460 -8.957 -4.768 1.00 0.00 C ATOM 658 CG TYR A 108 8.863 -8.438 -4.499 1.00 0.00 C ATOM 659 CD1 TYR A 108 9.074 -7.710 -3.318 1.00 0.00 C ATOM 660 CD2 TYR A 108 9.934 -8.920 -5.284 1.00 0.00 C ATOM 661 CE1 TYR A 108 10.388 -7.468 -2.882 1.00 0.00 C ATOM 662 CE2 TYR A 108 11.256 -8.682 -4.851 1.00 0.00 C ATOM 663 CZ TYR A 108 11.444 -7.962 -3.658 1.00 0.00 C ATOM 664 OH TYR A 108 12.713 -7.667 -3.280 1.00 0.00 O ATOM 0 H TYR A 108 8.307 -11.235 -4.906 1.00 0.00 H new ATOM 0 HA TYR A 108 7.336 -9.774 -2.752 1.00 0.00 H new ATOM 0 HB2 TYR A 108 7.412 -9.362 -5.779 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.753 -8.128 -4.723 1.00 0.00 H new ATOM 0 HD1 TYR A 108 8.234 -7.339 -2.749 1.00 0.00 H new ATOM 0 HD2 TYR A 108 9.745 -9.461 -6.199 1.00 0.00 H new ATOM 0 HE1 TYR A 108 10.578 -6.916 -1.973 1.00 0.00 H new ATOM 0 HE2 TYR A 108 12.100 -9.043 -5.420 1.00 0.00 H new ATOM 0 HH TYR A 108 12.725 -6.799 -2.825 1.00 0.00 H new ATOM 665 N ASN A 109 4.952 -9.368 -2.934 1.00 0.00 N ATOM 666 CA ASN A 109 3.500 -9.217 -2.830 1.00 0.00 C ATOM 667 C ASN A 109 3.133 -7.790 -3.208 1.00 0.00 C ATOM 668 O ASN A 109 3.647 -6.815 -2.672 1.00 0.00 O ATOM 669 CB ASN A 109 3.009 -9.520 -1.405 1.00 0.00 C ATOM 670 CG ASN A 109 1.494 -9.770 -1.313 1.00 0.00 C ATOM 671 OD1 ASN A 109 0.738 -9.758 -2.276 1.00 0.00 O ATOM 672 ND2 ASN A 109 1.040 -10.045 -0.119 1.00 0.00 N ATOM 0 H ASN A 109 5.475 -8.810 -2.259 1.00 0.00 H new ATOM 0 HA ASN A 109 3.020 -9.926 -3.505 1.00 0.00 H new ATOM 0 HB2 ASN A 109 3.536 -10.396 -1.027 1.00 0.00 H new ATOM 0 HB3 ASN A 109 3.271 -8.685 -0.755 1.00 0.00 H new ATOM 0 HD21 ASN A 109 0.050 -10.251 0.015 1.00 0.00 H new ATOM 0 HD22 ASN A 109 1.675 -10.053 0.679 1.00 0.00 H new ATOM 673 N THR A 110 2.108 -7.724 -4.026 1.00 0.00 N ATOM 674 CA THR A 110 1.558 -6.444 -4.474 1.00 0.00 C ATOM 675 C THR A 110 0.061 -6.420 -4.131 1.00 0.00 C ATOM 676 O THR A 110 -0.464 -7.353 -3.520 1.00 0.00 O ATOM 677 CB THR A 110 1.770 -6.222 -5.991 1.00 0.00 C ATOM 678 OG1 THR A 110 3.024 -6.742 -6.430 1.00 0.00 O ATOM 679 CG2 THR A 110 1.755 -4.718 -6.281 1.00 0.00 C ATOM 0 H THR A 110 1.628 -8.542 -4.403 1.00 0.00 H new ATOM 0 HA THR A 110 2.080 -5.635 -3.964 1.00 0.00 H new ATOM 0 HB THR A 110 0.970 -6.740 -6.519 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.714 -6.052 -6.338 1.00 0.00 H new ATOM 0 HG21 THR A 110 1.904 -4.552 -7.348 1.00 0.00 H new ATOM 0 HG22 THR A 110 0.795 -4.299 -5.979 1.00 0.00 H new ATOM 0 HG23 THR A 110 2.555 -4.232 -5.723 1.00 0.00 H new ATOM 680 N TYR A 111 -0.605 -5.331 -4.481 1.00 0.00 N ATOM 681 CA TYR A 111 -2.033 -5.150 -4.234 1.00 0.00 C ATOM 682 C TYR A 111 -2.625 -4.350 -5.397 1.00 0.00 C ATOM 683 O TYR A 111 -2.093 -3.311 -5.791 1.00 0.00 O ATOM 684 CB TYR A 111 -2.293 -4.379 -2.940 1.00 0.00 C ATOM 685 CG TYR A 111 -1.651 -5.006 -1.696 1.00 0.00 C ATOM 686 CD1 TYR A 111 -2.295 -6.074 -1.042 1.00 0.00 C ATOM 687 CD2 TYR A 111 -0.368 -4.540 -1.308 1.00 0.00 C ATOM 688 CE1 TYR A 111 -1.607 -6.737 0.000 1.00 0.00 C ATOM 689 CE2 TYR A 111 0.307 -5.213 -0.281 1.00 0.00 C ATOM 690 CZ TYR A 111 -0.308 -6.316 0.348 1.00 0.00 C ATOM 691 OH TYR A 111 0.392 -7.023 1.262 1.00 0.00 O ATOM 0 H TYR A 111 -0.168 -4.538 -4.950 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.492 -6.135 -4.144 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.919 -3.362 -3.055 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -3.369 -4.307 -2.783 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -3.290 -6.379 -1.329 1.00 0.00 H new ATOM 0 HD2 TYR A 111 0.079 -3.685 -1.794 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.073 -7.558 0.524 1.00 0.00 H new ATOM 0 HE2 TYR A 111 1.291 -4.890 0.027 1.00 0.00 H new ATOM 0 HH TYR A 111 1.350 -6.949 1.069 1.00 0.00 H new ATOM 692 N ILE A 112 -3.647 -4.953 -5.992 1.00 0.00 N ATOM 693 CA ILE A 112 -4.452 -4.283 -7.019 1.00 0.00 C ATOM 694 C ILE A 112 -5.682 -3.677 -6.327 1.00 0.00 C ATOM 695 O ILE A 112 -6.401 -4.361 -5.602 1.00 0.00 O ATOM 696 CB ILE A 112 -4.781 -5.198 -8.212 1.00 0.00 C ATOM 697 CG1 ILE A 112 -5.232 -4.348 -9.392 1.00 0.00 C ATOM 698 CG2 ILE A 112 -5.822 -6.297 -7.961 1.00 0.00 C ATOM 699 CD1 ILE A 112 -4.226 -4.546 -10.512 1.00 0.00 C ATOM 0 H ILE A 112 -3.942 -5.907 -5.784 1.00 0.00 H new ATOM 0 HA ILE A 112 -3.881 -3.477 -7.480 1.00 0.00 H new ATOM 0 HB ILE A 112 -3.852 -5.731 -8.412 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -6.230 -4.643 -9.717 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -5.287 -3.297 -9.108 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -5.969 -6.875 -8.874 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -5.471 -6.956 -7.167 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -6.767 -5.842 -7.664 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.520 -3.949 -11.375 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -3.238 -4.232 -10.174 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -4.196 -5.599 -10.792 1.00 0.00 H new ATOM 700 N SER A 113 -5.706 -2.362 -6.325 1.00 0.00 N ATOM 701 CA SER A 113 -6.847 -1.623 -5.738 1.00 0.00 C ATOM 702 C SER A 113 -8.160 -2.058 -6.392 1.00 0.00 C ATOM 703 O SER A 113 -8.443 -1.826 -7.558 1.00 0.00 O ATOM 704 CB SER A 113 -6.680 -0.108 -5.828 1.00 0.00 C ATOM 705 OG SER A 113 -6.693 0.360 -7.184 1.00 0.00 O ATOM 0 H SER A 113 -4.969 -1.773 -6.713 1.00 0.00 H new ATOM 0 HA SER A 113 -6.873 -1.874 -4.678 1.00 0.00 H new ATOM 0 HB2 SER A 113 -7.481 0.378 -5.270 1.00 0.00 H new ATOM 0 HB3 SER A 113 -5.741 0.181 -5.355 1.00 0.00 H new ATOM 0 HG SER A 113 -5.972 -0.074 -7.687 1.00 0.00 H new ATOM 706 N LYS A 114 -8.904 -2.765 -5.554 1.00 0.00 N ATOM 707 CA LYS A 114 -10.130 -3.488 -5.928 1.00 0.00 C ATOM 708 C LYS A 114 -11.124 -2.620 -6.733 1.00 0.00 C ATOM 709 O LYS A 114 -11.571 -3.020 -7.805 1.00 0.00 O ATOM 710 CB LYS A 114 -10.760 -4.045 -4.659 1.00 0.00 C ATOM 711 CG LYS A 114 -12.013 -4.844 -4.984 1.00 0.00 C ATOM 712 CD LYS A 114 -12.818 -5.151 -3.725 1.00 0.00 C ATOM 713 CE LYS A 114 -14.322 -5.087 -4.008 1.00 0.00 C ATOM 714 NZ LYS A 114 -14.612 -5.922 -5.178 1.00 0.00 N ATOM 0 H LYS A 114 -8.672 -2.860 -4.565 1.00 0.00 H new ATOM 0 HA LYS A 114 -9.864 -4.303 -6.601 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -10.042 -4.680 -4.140 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -11.010 -3.228 -3.982 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -12.631 -4.285 -5.686 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -11.735 -5.776 -5.476 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -12.556 -6.142 -3.354 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -12.561 -4.438 -2.941 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -14.885 -5.438 -3.143 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -14.629 -4.058 -4.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -15.602 -6.237 -5.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -14.455 -5.370 -6.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -13.984 -6.751 -5.177 1.00 0.00 H new ATOM 715 N LYS A 115 -11.405 -1.418 -6.227 1.00 0.00 N ATOM 716 CA LYS A 115 -12.314 -0.461 -6.897 1.00 0.00 C ATOM 717 C LYS A 115 -11.898 -0.151 -8.353 1.00 0.00 C ATOM 718 O LYS A 115 -12.738 -0.149 -9.262 1.00 0.00 O ATOM 719 CB LYS A 115 -12.389 0.845 -6.108 1.00 0.00 C ATOM 720 CG LYS A 115 -13.508 1.740 -6.647 1.00 0.00 C ATOM 721 CD LYS A 115 -13.145 3.218 -6.522 1.00 0.00 C ATOM 722 CE LYS A 115 -13.647 4.001 -7.741 1.00 0.00 C ATOM 723 NZ LYS A 115 -12.849 3.635 -8.929 1.00 0.00 N ATOM 0 H LYS A 115 -11.017 -1.074 -5.349 1.00 0.00 H new ATOM 0 HA LYS A 115 -13.292 -0.941 -6.929 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -12.565 0.629 -5.054 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -11.435 1.369 -6.171 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -13.699 1.497 -7.692 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -14.430 1.542 -6.100 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -13.583 3.630 -5.613 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -12.064 3.326 -6.433 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -14.700 3.783 -7.917 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -13.570 5.072 -7.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -12.224 4.426 -9.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -12.275 2.794 -8.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -13.486 3.427 -9.724 1.00 0.00 H new ATOM 724 N HIS A 116 -10.600 0.049 -8.558 1.00 0.00 N ATOM 725 CA HIS A 116 -10.026 0.364 -9.880 1.00 0.00 C ATOM 726 C HIS A 116 -9.356 -0.879 -10.514 1.00 0.00 C ATOM 727 O HIS A 116 -8.540 -0.754 -11.426 1.00 0.00 O ATOM 728 CB HIS A 116 -8.984 1.483 -9.784 1.00 0.00 C ATOM 729 CG HIS A 116 -9.120 2.456 -8.615 1.00 0.00 C ATOM 730 ND1 HIS A 116 -8.632 2.262 -7.398 1.00 0.00 N ATOM 731 CD2 HIS A 116 -9.745 3.627 -8.618 1.00 0.00 C ATOM 732 CE1 HIS A 116 -8.985 3.284 -6.637 1.00 0.00 C ATOM 733 NE2 HIS A 116 -9.662 4.130 -7.398 1.00 0.00 N ATOM 0 H HIS A 116 -9.905 -0.001 -7.813 1.00 0.00 H new ATOM 0 HA HIS A 116 -10.854 0.691 -10.508 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -7.997 1.024 -9.730 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -9.018 2.058 -10.709 1.00 0.00 H new ATOM 0 HD1 HIS A 116 -8.078 1.460 -7.099 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -10.233 4.086 -9.465 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -8.762 3.406 -5.587 1.00 0.00 H new ATOM 734 N ALA A 117 -9.832 -2.062 -10.154 1.00 0.00 N ATOM 735 CA ALA A 117 -9.269 -3.333 -10.678 1.00 0.00 C ATOM 736 C ALA A 117 -9.547 -3.582 -12.166 1.00 0.00 C ATOM 737 O ALA A 117 -8.767 -4.245 -12.853 1.00 0.00 O ATOM 738 CB ALA A 117 -9.728 -4.534 -9.832 1.00 0.00 C ATOM 0 H ALA A 117 -10.607 -2.186 -9.502 1.00 0.00 H new ATOM 0 HA ALA A 117 -8.188 -3.223 -10.593 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -9.301 -5.450 -10.239 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -9.393 -4.403 -8.803 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -10.816 -4.600 -9.854 1.00 0.00 H new ATOM 739 N GLU A 118 -10.457 -2.769 -12.696 1.00 0.00 N ATOM 740 CA GLU A 118 -10.817 -2.751 -14.130 1.00 0.00 C ATOM 741 C GLU A 118 -9.870 -1.898 -14.986 1.00 0.00 C ATOM 742 O GLU A 118 -9.571 -2.214 -16.126 1.00 0.00 O ATOM 743 CB GLU A 118 -12.309 -2.425 -14.372 1.00 0.00 C ATOM 744 CG GLU A 118 -13.002 -1.428 -13.426 1.00 0.00 C ATOM 745 CD GLU A 118 -12.551 0.030 -13.569 1.00 0.00 C ATOM 746 OE1 GLU A 118 -11.583 0.369 -12.859 1.00 0.00 O ATOM 747 OE2 GLU A 118 -13.168 0.749 -14.380 1.00 0.00 O ATOM 0 H GLU A 118 -10.979 -2.090 -12.142 1.00 0.00 H new ATOM 0 HA GLU A 118 -10.675 -3.774 -14.477 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -12.405 -2.041 -15.388 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -12.865 -3.362 -14.332 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -14.077 -1.477 -13.597 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -12.828 -1.746 -12.398 1.00 0.00 H new ATOM 748 N LYS A 119 -9.351 -0.867 -14.331 1.00 0.00 N ATOM 749 CA LYS A 119 -8.212 -0.055 -14.790 1.00 0.00 C ATOM 750 C LYS A 119 -6.863 -0.694 -14.443 1.00 0.00 C ATOM 751 O LYS A 119 -5.821 -0.193 -14.865 1.00 0.00 O ATOM 752 CB LYS A 119 -8.409 1.308 -14.142 1.00 0.00 C ATOM 753 CG LYS A 119 -9.559 2.086 -14.774 1.00 0.00 C ATOM 754 CD LYS A 119 -9.835 3.392 -14.027 1.00 0.00 C ATOM 755 CE LYS A 119 -9.169 4.592 -14.708 1.00 0.00 C ATOM 756 NZ LYS A 119 -9.516 5.798 -13.945 1.00 0.00 N ATOM 0 H LYS A 119 -9.719 -0.555 -13.432 1.00 0.00 H new ATOM 0 HA LYS A 119 -8.186 0.027 -15.877 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -8.603 1.178 -13.077 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -7.489 1.887 -14.230 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -9.322 2.305 -15.815 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -10.458 1.470 -14.775 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -10.911 3.558 -13.971 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -9.472 3.308 -13.003 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -8.088 4.460 -14.740 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -9.510 4.682 -15.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.074 6.629 -14.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -10.549 5.918 -13.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -9.171 5.702 -12.969 1.00 0.00 H new ATOM 757 N ASN A 120 -6.907 -1.890 -13.842 1.00 0.00 N ATOM 758 CA ASN A 120 -5.756 -2.605 -13.268 1.00 0.00 C ATOM 759 C ASN A 120 -4.738 -1.740 -12.501 1.00 0.00 C ATOM 760 O ASN A 120 -3.531 -1.934 -12.546 1.00 0.00 O ATOM 761 CB ASN A 120 -5.099 -3.507 -14.311 1.00 0.00 C ATOM 762 CG ASN A 120 -5.945 -4.768 -14.502 1.00 0.00 C ATOM 763 OD1 ASN A 120 -5.983 -5.668 -13.678 1.00 0.00 O ATOM 764 ND2 ASN A 120 -6.645 -4.816 -15.614 1.00 0.00 N ATOM 0 H ASN A 120 -7.779 -2.408 -13.737 1.00 0.00 H new ATOM 0 HA ASN A 120 -6.179 -3.230 -12.481 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -5.001 -2.975 -15.257 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -4.092 -3.777 -13.992 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -7.241 -5.621 -15.807 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -6.592 -4.048 -16.283 1.00 0.00 H new ATOM 765 N TRP A 121 -5.322 -0.954 -11.603 1.00 0.00 N ATOM 766 CA TRP A 121 -4.550 -0.023 -10.770 1.00 0.00 C ATOM 767 C TRP A 121 -3.888 -0.685 -9.569 1.00 0.00 C ATOM 768 O TRP A 121 -4.513 -1.007 -8.557 1.00 0.00 O ATOM 769 CB TRP A 121 -5.430 1.158 -10.352 1.00 0.00 C ATOM 770 CG TRP A 121 -5.627 2.188 -11.465 1.00 0.00 C ATOM 771 CD1 TRP A 121 -5.354 2.070 -12.766 1.00 0.00 C ATOM 772 CD2 TRP A 121 -5.897 3.525 -11.227 1.00 0.00 C ATOM 773 NE1 TRP A 121 -5.447 3.240 -13.375 1.00 0.00 N ATOM 774 CE2 TRP A 121 -5.752 4.167 -12.466 1.00 0.00 C ATOM 775 CE3 TRP A 121 -6.136 4.262 -10.054 1.00 0.00 C ATOM 776 CZ2 TRP A 121 -5.802 5.558 -12.567 1.00 0.00 C ATOM 777 CZ3 TRP A 121 -6.263 5.657 -10.160 1.00 0.00 C ATOM 778 CH2 TRP A 121 -6.118 6.306 -11.411 1.00 0.00 C ATOM 0 H TRP A 121 -6.327 -0.939 -11.429 1.00 0.00 H new ATOM 0 HA TRP A 121 -3.726 0.345 -11.382 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -6.404 0.783 -10.037 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -4.982 1.648 -9.488 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -5.092 1.144 -13.256 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -5.309 3.406 -14.372 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -6.220 3.769 -9.097 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -5.604 6.051 -13.507 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -6.474 6.242 -9.277 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -6.249 7.376 -11.481 1.00 0.00 H new ATOM 779 N PHE A 122 -2.562 -0.669 -9.681 1.00 0.00 N ATOM 780 CA PHE A 122 -1.638 -1.338 -8.758 1.00 0.00 C ATOM 781 C PHE A 122 -1.020 -0.342 -7.770 1.00 0.00 C ATOM 782 O PHE A 122 -1.039 0.870 -7.992 1.00 0.00 O ATOM 783 CB PHE A 122 -0.515 -1.956 -9.598 1.00 0.00 C ATOM 784 CG PHE A 122 -0.695 -3.438 -9.928 1.00 0.00 C ATOM 785 CD1 PHE A 122 -0.474 -4.394 -8.920 1.00 0.00 C ATOM 786 CD2 PHE A 122 -0.831 -3.825 -11.282 1.00 0.00 C ATOM 787 CE1 PHE A 122 -0.345 -5.757 -9.254 1.00 0.00 C ATOM 788 CE2 PHE A 122 -0.698 -5.194 -11.628 1.00 0.00 C ATOM 789 CZ PHE A 122 -0.456 -6.146 -10.608 1.00 0.00 C ATOM 0 H PHE A 122 -2.084 -0.178 -10.436 1.00 0.00 H new ATOM 0 HA PHE A 122 -2.181 -2.091 -8.187 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -0.431 -1.399 -10.531 1.00 0.00 H new ATOM 0 HB3 PHE A 122 0.428 -1.830 -9.066 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -0.403 -4.083 -7.888 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -1.034 -3.086 -12.043 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -0.164 -6.494 -8.486 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -0.780 -5.507 -12.658 1.00 0.00 H new ATOM 0 HZ PHE A 122 -0.354 -7.189 -10.870 1.00 0.00 H new ATOM 790 N VAL A 123 -0.484 -0.893 -6.689 1.00 0.00 N ATOM 791 CA VAL A 123 0.231 -0.102 -5.676 1.00 0.00 C ATOM 792 C VAL A 123 1.726 0.088 -5.969 1.00 0.00 C ATOM 793 O VAL A 123 2.374 -0.835 -6.468 1.00 0.00 O ATOM 794 CB VAL A 123 -0.010 -0.637 -4.246 1.00 0.00 C ATOM 795 CG1 VAL A 123 -1.479 -0.458 -3.843 1.00 0.00 C ATOM 796 CG2 VAL A 123 0.474 -2.060 -4.006 1.00 0.00 C ATOM 0 H VAL A 123 -0.527 -1.891 -6.483 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.204 0.896 -5.736 1.00 0.00 H new ATOM 0 HB VAL A 123 0.615 -0.027 -3.594 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -1.629 -0.841 -2.833 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -1.738 0.600 -3.872 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -2.116 -1.006 -4.537 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.262 -2.348 -2.976 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -0.041 -2.739 -4.686 1.00 0.00 H new ATOM 0 HG23 VAL A 123 1.548 -2.114 -4.184 1.00 0.00 H new ATOM 797 N GLY A 124 2.224 1.262 -5.577 1.00 0.00 N ATOM 798 CA GLY A 124 3.601 1.675 -5.908 1.00 0.00 C ATOM 799 C GLY A 124 4.089 2.976 -5.257 1.00 0.00 C ATOM 800 O GLY A 124 3.396 3.988 -5.130 1.00 0.00 O ATOM 0 H GLY A 124 1.701 1.946 -5.031 1.00 0.00 H new ATOM 0 HA2 GLY A 124 4.279 0.872 -5.620 1.00 0.00 H new ATOM 0 HA3 GLY A 124 3.676 1.783 -6.990 1.00 0.00 H new ATOM 801 N LEU A 125 5.338 2.854 -4.831 1.00 0.00 N ATOM 802 CA LEU A 125 6.085 3.940 -4.181 1.00 0.00 C ATOM 803 C LEU A 125 7.159 4.583 -5.050 1.00 0.00 C ATOM 804 O LEU A 125 8.175 3.977 -5.410 1.00 0.00 O ATOM 805 CB LEU A 125 6.754 3.468 -2.878 1.00 0.00 C ATOM 806 CG LEU A 125 5.770 3.208 -1.731 1.00 0.00 C ATOM 807 CD1 LEU A 125 6.496 2.439 -0.626 1.00 0.00 C ATOM 808 CD2 LEU A 125 5.194 4.509 -1.169 1.00 0.00 C ATOM 0 H LEU A 125 5.874 1.991 -4.924 1.00 0.00 H new ATOM 0 HA LEU A 125 5.323 4.693 -3.981 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.312 2.553 -3.079 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.477 4.219 -2.560 1.00 0.00 H new ATOM 0 HG LEU A 125 4.935 2.624 -2.117 1.00 0.00 H new ATOM 0 HD11 LEU A 125 5.807 2.247 0.197 1.00 0.00 H new ATOM 0 HD12 LEU A 125 6.861 1.491 -1.022 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.338 3.030 -0.264 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.502 4.280 -0.359 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.004 5.132 -0.789 1.00 0.00 H new ATOM 0 HD23 LEU A 125 4.665 5.043 -1.958 1.00 0.00 H new ATOM 809 N LYS A 126 6.999 5.890 -5.159 1.00 0.00 N ATOM 810 CA LYS A 126 7.961 6.828 -5.779 1.00 0.00 C ATOM 811 C LYS A 126 9.167 6.984 -4.837 1.00 0.00 C ATOM 812 O LYS A 126 9.007 7.264 -3.655 1.00 0.00 O ATOM 813 CB LYS A 126 7.215 8.126 -6.073 1.00 0.00 C ATOM 814 CG LYS A 126 8.149 9.193 -6.660 1.00 0.00 C ATOM 815 CD LYS A 126 7.468 10.286 -7.497 1.00 0.00 C ATOM 816 CE LYS A 126 6.517 11.216 -6.754 1.00 0.00 C ATOM 817 NZ LYS A 126 7.331 12.146 -5.964 1.00 0.00 N ATOM 0 H LYS A 126 6.165 6.362 -4.808 1.00 0.00 H new ATOM 0 HA LYS A 126 8.362 6.468 -6.727 1.00 0.00 H new ATOM 0 HB2 LYS A 126 6.402 7.929 -6.772 1.00 0.00 H new ATOM 0 HB3 LYS A 126 6.763 8.502 -5.155 1.00 0.00 H new ATOM 0 HG2 LYS A 126 8.686 9.670 -5.840 1.00 0.00 H new ATOM 0 HG3 LYS A 126 8.893 8.696 -7.282 1.00 0.00 H new ATOM 0 HD2 LYS A 126 8.244 10.893 -7.963 1.00 0.00 H new ATOM 0 HD3 LYS A 126 6.914 9.804 -8.303 1.00 0.00 H new ATOM 0 HE2 LYS A 126 5.887 11.761 -7.457 1.00 0.00 H new ATOM 0 HE3 LYS A 126 5.851 10.645 -6.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 6.829 12.387 -5.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 8.241 11.699 -5.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 7.501 13.012 -6.514 1.00 0.00 H new ATOM 818 N LYS A 127 10.343 6.946 -5.476 1.00 0.00 N ATOM 819 CA LYS A 127 11.675 6.881 -4.826 1.00 0.00 C ATOM 820 C LYS A 127 11.926 7.767 -3.592 1.00 0.00 C ATOM 821 O LYS A 127 12.255 7.248 -2.530 1.00 0.00 O ATOM 822 CB LYS A 127 12.833 6.996 -5.843 1.00 0.00 C ATOM 823 CG LYS A 127 12.949 8.312 -6.619 1.00 0.00 C ATOM 824 CD LYS A 127 11.936 8.425 -7.770 1.00 0.00 C ATOM 825 CE LYS A 127 12.083 9.721 -8.561 1.00 0.00 C ATOM 826 NZ LYS A 127 11.754 10.890 -7.738 1.00 0.00 N ATOM 0 H LYS A 127 10.405 6.960 -6.494 1.00 0.00 H new ATOM 0 HA LYS A 127 11.654 5.878 -4.400 1.00 0.00 H new ATOM 0 HB2 LYS A 127 13.770 6.834 -5.310 1.00 0.00 H new ATOM 0 HB3 LYS A 127 12.732 6.185 -6.564 1.00 0.00 H new ATOM 0 HG2 LYS A 127 12.804 9.146 -5.932 1.00 0.00 H new ATOM 0 HG3 LYS A 127 13.958 8.402 -7.021 1.00 0.00 H new ATOM 0 HD2 LYS A 127 12.062 7.577 -8.443 1.00 0.00 H new ATOM 0 HD3 LYS A 127 10.925 8.364 -7.366 1.00 0.00 H new ATOM 0 HE2 LYS A 127 13.105 9.810 -8.930 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.430 9.693 -9.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 11.262 11.597 -8.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 11.138 10.599 -6.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 12.629 11.303 -7.357 1.00 0.00 H new ATOM 827 N ASN A 128 11.415 8.986 -3.666 1.00 0.00 N ATOM 828 CA ASN A 128 11.530 10.008 -2.603 1.00 0.00 C ATOM 829 C ASN A 128 10.462 9.885 -1.497 1.00 0.00 C ATOM 830 O ASN A 128 10.034 10.867 -0.887 1.00 0.00 O ATOM 831 CB ASN A 128 11.491 11.362 -3.325 1.00 0.00 C ATOM 832 CG ASN A 128 10.176 11.599 -4.068 1.00 0.00 C ATOM 833 OD1 ASN A 128 10.011 11.155 -5.192 1.00 0.00 O ATOM 834 ND2 ASN A 128 9.209 12.129 -3.371 1.00 0.00 N ATOM 0 H ASN A 128 10.894 9.313 -4.480 1.00 0.00 H new ATOM 0 HA ASN A 128 12.461 9.878 -2.051 1.00 0.00 H new ATOM 0 HB2 ASN A 128 11.642 12.161 -2.599 1.00 0.00 H new ATOM 0 HB3 ASN A 128 12.318 11.415 -4.033 1.00 0.00 H new ATOM 0 HD21 ASN A 128 8.269 12.184 -3.763 1.00 0.00 H new ATOM 0 HD22 ASN A 128 9.393 12.488 -2.434 1.00 0.00 H new ATOM 835 N GLY A 129 10.030 8.642 -1.258 1.00 0.00 N ATOM 836 CA GLY A 129 8.965 8.272 -0.313 1.00 0.00 C ATOM 837 C GLY A 129 7.598 8.902 -0.606 1.00 0.00 C ATOM 838 O GLY A 129 7.001 9.566 0.246 1.00 0.00 O ATOM 0 H GLY A 129 10.427 7.833 -1.735 1.00 0.00 H new ATOM 0 HA2 GLY A 129 8.857 7.187 -0.315 1.00 0.00 H new ATOM 0 HA3 GLY A 129 9.274 8.560 0.692 1.00 0.00 H new ATOM 839 N SER A 130 7.031 8.561 -1.765 1.00 0.00 N ATOM 840 CA SER A 130 5.700 9.057 -2.173 1.00 0.00 C ATOM 841 C SER A 130 4.849 7.923 -2.735 1.00 0.00 C ATOM 842 O SER A 130 5.351 7.032 -3.420 1.00 0.00 O ATOM 843 CB SER A 130 5.792 10.152 -3.232 1.00 0.00 C ATOM 844 OG SER A 130 6.478 11.293 -2.699 1.00 0.00 O ATOM 0 H SER A 130 7.469 7.941 -2.446 1.00 0.00 H new ATOM 0 HA SER A 130 5.240 9.470 -1.275 1.00 0.00 H new ATOM 0 HB2 SER A 130 6.319 9.777 -4.109 1.00 0.00 H new ATOM 0 HB3 SER A 130 4.792 10.438 -3.559 1.00 0.00 H new ATOM 0 HG SER A 130 6.253 12.087 -3.228 1.00 0.00 H new ATOM 845 N CYS A 131 3.550 7.998 -2.505 1.00 0.00 N ATOM 846 CA CYS A 131 2.586 7.007 -3.015 1.00 0.00 C ATOM 847 C CYS A 131 2.045 7.365 -4.402 1.00 0.00 C ATOM 848 O CYS A 131 0.896 7.728 -4.628 1.00 0.00 O ATOM 849 CB CYS A 131 1.435 6.832 -2.033 1.00 0.00 C ATOM 850 SG CYS A 131 1.859 5.792 -0.598 1.00 0.00 S ATOM 0 H CYS A 131 3.121 8.745 -1.959 1.00 0.00 H new ATOM 0 HA CYS A 131 3.127 6.066 -3.116 1.00 0.00 H new ATOM 0 HB2 CYS A 131 1.116 7.813 -1.680 1.00 0.00 H new ATOM 0 HB3 CYS A 131 0.586 6.390 -2.555 1.00 0.00 H new ATOM 0 HG CYS A 131 1.647 4.543 -0.890 1.00 0.00 H new ATOM 851 N LYS A 132 2.946 7.103 -5.332 1.00 0.00 N ATOM 852 CA LYS A 132 2.751 7.373 -6.768 1.00 0.00 C ATOM 853 C LYS A 132 2.415 6.047 -7.473 1.00 0.00 C ATOM 854 O LYS A 132 3.263 5.175 -7.683 1.00 0.00 O ATOM 855 CB LYS A 132 3.979 8.051 -7.369 1.00 0.00 C ATOM 856 CG LYS A 132 3.791 8.349 -8.854 1.00 0.00 C ATOM 857 CD LYS A 132 5.108 8.313 -9.632 1.00 0.00 C ATOM 858 CE LYS A 132 5.893 7.000 -9.481 1.00 0.00 C ATOM 859 NZ LYS A 132 5.168 5.851 -10.028 1.00 0.00 N ATOM 0 H LYS A 132 3.854 6.689 -5.119 1.00 0.00 H new ATOM 0 HA LYS A 132 1.922 8.066 -6.909 1.00 0.00 H new ATOM 0 HB2 LYS A 132 4.180 8.979 -6.834 1.00 0.00 H new ATOM 0 HB3 LYS A 132 4.851 7.410 -7.234 1.00 0.00 H new ATOM 0 HG2 LYS A 132 3.100 7.623 -9.282 1.00 0.00 H new ATOM 0 HG3 LYS A 132 3.332 9.331 -8.969 1.00 0.00 H new ATOM 0 HD2 LYS A 132 4.897 8.478 -10.689 1.00 0.00 H new ATOM 0 HD3 LYS A 132 5.736 9.139 -9.299 1.00 0.00 H new ATOM 0 HE2 LYS A 132 6.854 7.094 -9.987 1.00 0.00 H new ATOM 0 HE3 LYS A 132 6.104 6.825 -8.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 5.698 4.979 -9.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 4.227 5.793 -9.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 5.064 5.964 -11.057 1.00 0.00 H new ATOM 860 N ARG A 133 1.110 5.876 -7.613 1.00 0.00 N ATOM 861 CA ARG A 133 0.535 4.658 -8.211 1.00 0.00 C ATOM 862 C ARG A 133 -0.331 4.780 -9.470 1.00 0.00 C ATOM 863 O ARG A 133 0.090 4.394 -10.556 1.00 0.00 O ATOM 864 CB ARG A 133 -0.018 3.714 -7.136 1.00 0.00 C ATOM 865 CG ARG A 133 -0.793 4.381 -5.992 1.00 0.00 C ATOM 866 CD ARG A 133 -0.757 3.567 -4.704 1.00 0.00 C ATOM 867 NE ARG A 133 0.610 3.541 -4.140 1.00 0.00 N ATOM 868 CZ ARG A 133 1.022 2.824 -3.091 1.00 0.00 C ATOM 869 NH1 ARG A 133 0.234 1.992 -2.439 1.00 0.00 N ATOM 870 NH2 ARG A 133 2.273 2.915 -2.685 1.00 0.00 N ATOM 0 H ARG A 133 0.416 6.564 -7.322 1.00 0.00 H new ATOM 0 HA ARG A 133 1.402 4.187 -8.673 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -0.674 2.989 -7.619 1.00 0.00 H new ATOM 0 HB3 ARG A 133 0.814 3.155 -6.708 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -0.375 5.370 -5.804 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -1.830 4.526 -6.297 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -1.447 3.996 -3.978 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -1.094 2.549 -4.902 1.00 0.00 H new ATOM 0 HE ARG A 133 1.307 4.129 -4.597 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -0.736 1.874 -2.730 1.00 0.00 H new ATOM 0 HH12 ARG A 133 0.595 1.466 -1.643 1.00 0.00 H new ATOM 0 HH21 ARG A 133 2.924 3.532 -3.172 1.00 0.00 H new ATOM 0 HH22 ARG A 133 2.590 2.369 -1.884 1.00 0.00 H new ATOM 871 N GLY A 134 -1.581 5.174 -9.253 1.00 0.00 N ATOM 872 CA GLY A 134 -2.644 5.315 -10.279 1.00 0.00 C ATOM 873 C GLY A 134 -2.515 4.394 -11.479 1.00 0.00 C ATOM 874 O GLY A 134 -2.523 3.171 -11.300 1.00 0.00 O ATOM 0 H GLY A 134 -1.910 5.418 -8.319 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -3.609 5.134 -9.806 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.650 6.346 -10.632 1.00 0.00 H new ATOM 875 N PRO A 135 -2.331 4.968 -12.680 1.00 0.00 N ATOM 876 CA PRO A 135 -2.316 4.168 -13.906 1.00 0.00 C ATOM 877 C PRO A 135 -0.891 3.850 -14.427 1.00 0.00 C ATOM 878 O PRO A 135 -0.708 3.441 -15.571 1.00 0.00 O ATOM 879 CB PRO A 135 -3.063 5.053 -14.892 1.00 0.00 C ATOM 880 CG PRO A 135 -2.635 6.467 -14.517 1.00 0.00 C ATOM 881 CD PRO A 135 -2.380 6.409 -13.007 1.00 0.00 C ATOM 0 HA PRO A 135 -2.761 3.185 -13.750 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.797 4.816 -15.922 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -4.142 4.926 -14.804 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -1.738 6.766 -15.059 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -3.411 7.193 -14.760 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -1.445 6.905 -12.746 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.173 6.912 -12.454 1.00 0.00 H new ATOM 882 N ARG A 136 0.093 4.054 -13.553 1.00 0.00 N ATOM 883 CA ARG A 136 1.527 4.001 -13.908 1.00 0.00 C ATOM 884 C ARG A 136 2.395 2.984 -13.158 1.00 0.00 C ATOM 885 O ARG A 136 3.609 2.949 -13.324 1.00 0.00 O ATOM 886 CB ARG A 136 2.119 5.410 -13.773 1.00 0.00 C ATOM 887 CG ARG A 136 2.149 5.947 -12.337 1.00 0.00 C ATOM 888 CD ARG A 136 1.587 7.355 -12.290 1.00 0.00 C ATOM 889 NE ARG A 136 1.395 7.753 -10.883 1.00 0.00 N ATOM 890 CZ ARG A 136 0.255 8.158 -10.319 1.00 0.00 C ATOM 891 NH1 ARG A 136 -0.805 8.478 -11.048 1.00 0.00 N ATOM 892 NH2 ARG A 136 0.223 8.527 -9.047 1.00 0.00 N ATOM 0 H ARG A 136 -0.074 4.263 -12.569 1.00 0.00 H new ATOM 0 HA ARG A 136 1.550 3.636 -14.935 1.00 0.00 H new ATOM 0 HB2 ARG A 136 3.135 5.404 -14.167 1.00 0.00 H new ATOM 0 HB3 ARG A 136 1.541 6.095 -14.393 1.00 0.00 H new ATOM 0 HG2 ARG A 136 1.568 5.294 -11.685 1.00 0.00 H new ATOM 0 HG3 ARG A 136 3.172 5.944 -11.962 1.00 0.00 H new ATOM 0 HD2 ARG A 136 2.266 8.047 -12.787 1.00 0.00 H new ATOM 0 HD3 ARG A 136 0.639 7.399 -12.826 1.00 0.00 H new ATOM 0 HE ARG A 136 2.217 7.715 -10.280 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -0.761 8.418 -12.065 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -1.664 8.785 -10.592 1.00 0.00 H new ATOM 0 HH21 ARG A 136 1.076 8.503 -8.488 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -0.654 8.835 -8.627 1.00 0.00 H new ATOM 893 N THR A 137 1.788 2.286 -12.210 1.00 0.00 N ATOM 894 CA THR A 137 2.473 1.257 -11.424 1.00 0.00 C ATOM 895 C THR A 137 2.799 -0.026 -12.207 1.00 0.00 C ATOM 896 O THR A 137 3.923 -0.187 -12.682 1.00 0.00 O ATOM 897 CB THR A 137 1.678 0.973 -10.147 1.00 0.00 C ATOM 898 OG1 THR A 137 0.273 1.151 -10.383 1.00 0.00 O ATOM 899 CG2 THR A 137 2.225 1.808 -9.006 1.00 0.00 C ATOM 0 H THR A 137 0.807 2.413 -11.960 1.00 0.00 H new ATOM 0 HA THR A 137 3.451 1.657 -11.157 1.00 0.00 H new ATOM 0 HB THR A 137 1.797 -0.069 -9.849 1.00 0.00 H new ATOM 0 HG1 THR A 137 -0.198 1.212 -9.526 1.00 0.00 H new ATOM 0 HG21 THR A 137 1.656 1.602 -8.099 1.00 0.00 H new ATOM 0 HG22 THR A 137 3.273 1.557 -8.841 1.00 0.00 H new ATOM 0 HG23 THR A 137 2.140 2.866 -9.256 1.00 0.00 H new ATOM 900 N HIS A 138 1.803 -0.901 -12.301 1.00 0.00 N ATOM 901 CA HIS A 138 1.794 -2.162 -13.084 1.00 0.00 C ATOM 902 C HIS A 138 2.980 -3.135 -13.046 1.00 0.00 C ATOM 903 O HIS A 138 4.106 -2.879 -12.616 1.00 0.00 O ATOM 904 CB HIS A 138 1.219 -1.907 -14.483 1.00 0.00 C ATOM 905 CG HIS A 138 1.794 -0.696 -15.208 1.00 0.00 C ATOM 906 ND1 HIS A 138 3.076 -0.410 -15.430 1.00 0.00 N ATOM 907 CD2 HIS A 138 1.058 0.289 -15.721 1.00 0.00 C ATOM 908 CE1 HIS A 138 3.132 0.716 -16.125 1.00 0.00 C ATOM 909 NE2 HIS A 138 1.888 1.160 -16.283 1.00 0.00 N ATOM 0 H HIS A 138 0.922 -0.753 -11.809 1.00 0.00 H new ATOM 0 HA HIS A 138 1.129 -2.790 -12.492 1.00 0.00 H new ATOM 0 HB2 HIS A 138 1.389 -2.792 -15.096 1.00 0.00 H new ATOM 0 HB3 HIS A 138 0.140 -1.781 -14.398 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -0.019 0.365 -15.686 1.00 0.00 H new ATOM 0 HE1 HIS A 138 4.028 1.190 -16.497 1.00 0.00 H new ATOM 0 HE2 HIS A 138 1.618 2.023 -16.755 1.00 0.00 H new ATOM 910 N TYR A 139 2.569 -4.353 -13.358 1.00 0.00 N ATOM 911 CA TYR A 139 3.395 -5.559 -13.321 1.00 0.00 C ATOM 912 C TYR A 139 4.581 -5.509 -14.272 1.00 0.00 C ATOM 913 O TYR A 139 4.578 -4.890 -15.334 1.00 0.00 O ATOM 914 CB TYR A 139 2.488 -6.746 -13.606 1.00 0.00 C ATOM 915 CG TYR A 139 3.012 -8.071 -13.042 1.00 0.00 C ATOM 916 CD1 TYR A 139 3.870 -8.874 -13.831 1.00 0.00 C ATOM 917 CD2 TYR A 139 2.608 -8.480 -11.747 1.00 0.00 C ATOM 918 CE1 TYR A 139 4.341 -10.091 -13.311 1.00 0.00 C ATOM 919 CE2 TYR A 139 3.075 -9.698 -11.235 1.00 0.00 C ATOM 920 CZ TYR A 139 3.946 -10.492 -12.009 1.00 0.00 C ATOM 921 OH TYR A 139 4.508 -11.615 -11.483 1.00 0.00 O ATOM 0 H TYR A 139 1.612 -4.541 -13.657 1.00 0.00 H new ATOM 0 HA TYR A 139 3.845 -5.650 -12.332 1.00 0.00 H new ATOM 0 HB2 TYR A 139 1.502 -6.547 -13.186 1.00 0.00 H new ATOM 0 HB3 TYR A 139 2.362 -6.845 -14.684 1.00 0.00 H new ATOM 0 HD1 TYR A 139 4.159 -8.555 -14.821 1.00 0.00 H new ATOM 0 HD2 TYR A 139 1.947 -7.859 -11.160 1.00 0.00 H new ATOM 0 HE1 TYR A 139 4.998 -10.716 -13.897 1.00 0.00 H new ATOM 0 HE2 TYR A 139 2.769 -10.027 -10.253 1.00 0.00 H new ATOM 0 HH TYR A 139 5.412 -11.728 -11.843 1.00 0.00 H new ATOM 922 N GLY A 140 5.645 -5.923 -13.619 1.00 0.00 N ATOM 923 CA GLY A 140 7.019 -5.944 -14.169 1.00 0.00 C ATOM 924 C GLY A 140 7.862 -4.772 -13.649 1.00 0.00 C ATOM 925 O GLY A 140 9.089 -4.861 -13.662 1.00 0.00 O ATOM 0 H GLY A 140 5.596 -6.268 -12.661 1.00 0.00 H new ATOM 0 HA2 GLY A 140 7.502 -6.884 -13.903 1.00 0.00 H new ATOM 0 HA3 GLY A 140 6.975 -5.905 -15.257 1.00 0.00 H new ATOM 926 N GLN A 141 7.213 -3.676 -13.278 1.00 0.00 N ATOM 927 CA GLN A 141 7.887 -2.522 -12.683 1.00 0.00 C ATOM 928 C GLN A 141 8.203 -2.774 -11.209 1.00 0.00 C ATOM 929 O GLN A 141 7.342 -3.126 -10.401 1.00 0.00 O ATOM 930 CB GLN A 141 7.023 -1.266 -12.815 1.00 0.00 C ATOM 931 CG GLN A 141 6.977 -0.726 -14.257 1.00 0.00 C ATOM 932 CD GLN A 141 8.367 -0.413 -14.826 1.00 0.00 C ATOM 933 OE1 GLN A 141 9.234 0.203 -14.221 1.00 0.00 O ATOM 934 NE2 GLN A 141 8.605 -0.891 -16.030 1.00 0.00 N ATOM 0 H GLN A 141 6.205 -3.559 -13.380 1.00 0.00 H new ATOM 0 HA GLN A 141 8.822 -2.370 -13.222 1.00 0.00 H new ATOM 0 HB2 GLN A 141 6.009 -1.490 -12.483 1.00 0.00 H new ATOM 0 HB3 GLN A 141 7.411 -0.492 -12.153 1.00 0.00 H new ATOM 0 HG2 GLN A 141 6.485 -1.458 -14.897 1.00 0.00 H new ATOM 0 HG3 GLN A 141 6.369 0.178 -14.281 1.00 0.00 H new ATOM 0 HE21 GLN A 141 7.877 -1.404 -16.528 1.00 0.00 H new ATOM 0 HE22 GLN A 141 9.517 -0.749 -16.464 1.00 0.00 H new ATOM 935 N LYS A 142 9.443 -2.453 -10.872 1.00 0.00 N ATOM 936 CA LYS A 142 9.947 -2.499 -9.477 1.00 0.00 C ATOM 937 C LYS A 142 9.190 -1.586 -8.496 1.00 0.00 C ATOM 938 O LYS A 142 9.071 -1.909 -7.315 1.00 0.00 O ATOM 939 CB LYS A 142 11.472 -2.339 -9.426 1.00 0.00 C ATOM 940 CG LYS A 142 12.041 -0.997 -9.916 1.00 0.00 C ATOM 941 CD LYS A 142 12.028 -0.836 -11.441 1.00 0.00 C ATOM 942 CE LYS A 142 13.127 -1.672 -12.116 1.00 0.00 C ATOM 943 NZ LYS A 142 14.376 -0.912 -12.011 1.00 0.00 N ATOM 0 H LYS A 142 10.143 -2.150 -11.549 1.00 0.00 H new ATOM 0 HA LYS A 142 9.724 -3.500 -9.107 1.00 0.00 H new ATOM 0 HB2 LYS A 142 11.796 -2.491 -8.396 1.00 0.00 H new ATOM 0 HB3 LYS A 142 11.918 -3.136 -10.021 1.00 0.00 H new ATOM 0 HG2 LYS A 142 11.466 -0.185 -9.470 1.00 0.00 H new ATOM 0 HG3 LYS A 142 13.066 -0.896 -9.559 1.00 0.00 H new ATOM 0 HD2 LYS A 142 11.054 -1.135 -11.829 1.00 0.00 H new ATOM 0 HD3 LYS A 142 12.163 0.215 -11.696 1.00 0.00 H new ATOM 0 HE2 LYS A 142 13.225 -2.643 -11.630 1.00 0.00 H new ATOM 0 HE3 LYS A 142 12.879 -1.862 -13.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 14.706 -0.653 -12.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 14.211 -0.049 -11.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 15.098 -1.494 -11.541 1.00 0.00 H new ATOM 944 N ALA A 143 8.471 -0.639 -9.106 1.00 0.00 N ATOM 945 CA ALA A 143 7.409 0.182 -8.494 1.00 0.00 C ATOM 946 C ALA A 143 6.387 -0.640 -7.702 1.00 0.00 C ATOM 947 O ALA A 143 6.005 -0.254 -6.590 1.00 0.00 O ATOM 948 CB ALA A 143 6.692 0.913 -9.636 1.00 0.00 C ATOM 0 H ALA A 143 8.617 -0.409 -10.089 1.00 0.00 H new ATOM 0 HA ALA A 143 7.869 0.866 -7.781 1.00 0.00 H new ATOM 0 HB1 ALA A 143 5.895 1.534 -9.227 1.00 0.00 H new ATOM 0 HB2 ALA A 143 7.405 1.542 -10.170 1.00 0.00 H new ATOM 0 HB3 ALA A 143 6.266 0.183 -10.324 1.00 0.00 H new ATOM 949 N ILE A 144 6.063 -1.842 -8.203 1.00 0.00 N ATOM 950 CA ILE A 144 5.063 -2.723 -7.577 1.00 0.00 C ATOM 951 C ILE A 144 5.642 -3.838 -6.678 1.00 0.00 C ATOM 952 O ILE A 144 4.906 -4.637 -6.098 1.00 0.00 O ATOM 953 CB ILE A 144 4.067 -3.342 -8.577 1.00 0.00 C ATOM 954 CG1 ILE A 144 4.684 -4.355 -9.551 1.00 0.00 C ATOM 955 CG2 ILE A 144 3.264 -2.259 -9.305 1.00 0.00 C ATOM 956 CD1 ILE A 144 3.783 -5.585 -9.658 1.00 0.00 C ATOM 0 H ILE A 144 6.483 -2.229 -9.048 1.00 0.00 H new ATOM 0 HA ILE A 144 4.526 -2.031 -6.928 1.00 0.00 H new ATOM 0 HB ILE A 144 3.378 -3.931 -7.971 1.00 0.00 H new ATOM 0 HG12 ILE A 144 4.810 -3.899 -10.533 1.00 0.00 H new ATOM 0 HG13 ILE A 144 5.675 -4.648 -9.206 1.00 0.00 H new ATOM 0 HG21 ILE A 144 2.571 -2.728 -10.003 1.00 0.00 H new ATOM 0 HG22 ILE A 144 2.705 -1.670 -8.578 1.00 0.00 H new ATOM 0 HG23 ILE A 144 3.945 -1.607 -9.852 1.00 0.00 H new ATOM 0 HD11 ILE A 144 4.225 -6.301 -10.351 1.00 0.00 H new ATOM 0 HD12 ILE A 144 3.679 -6.047 -8.676 1.00 0.00 H new ATOM 0 HD13 ILE A 144 2.801 -5.286 -10.024 1.00 0.00 H new ATOM 957 N LEU A 145 6.969 -3.857 -6.553 1.00 0.00 N ATOM 958 CA LEU A 145 7.680 -4.912 -5.812 1.00 0.00 C ATOM 959 C LEU A 145 7.710 -4.645 -4.300 1.00 0.00 C ATOM 960 O LEU A 145 8.666 -4.082 -3.760 1.00 0.00 O ATOM 961 CB LEU A 145 9.096 -5.103 -6.389 1.00 0.00 C ATOM 962 CG LEU A 145 9.126 -5.700 -7.809 1.00 0.00 C ATOM 963 CD1 LEU A 145 10.586 -6.032 -8.156 1.00 0.00 C ATOM 964 CD2 LEU A 145 8.305 -6.970 -7.989 1.00 0.00 C ATOM 0 H LEU A 145 7.582 -3.149 -6.957 1.00 0.00 H new ATOM 0 HA LEU A 145 7.127 -5.842 -5.942 1.00 0.00 H new ATOM 0 HB2 LEU A 145 9.604 -4.139 -6.402 1.00 0.00 H new ATOM 0 HB3 LEU A 145 9.663 -5.753 -5.722 1.00 0.00 H new ATOM 0 HG LEU A 145 8.683 -4.950 -8.463 1.00 0.00 H new ATOM 0 HD11 LEU A 145 10.634 -6.457 -9.159 1.00 0.00 H new ATOM 0 HD12 LEU A 145 11.185 -5.122 -8.118 1.00 0.00 H new ATOM 0 HD13 LEU A 145 10.976 -6.753 -7.437 1.00 0.00 H new ATOM 0 HD21 LEU A 145 8.388 -7.314 -9.020 1.00 0.00 H new ATOM 0 HD22 LEU A 145 8.678 -7.743 -7.317 1.00 0.00 H new ATOM 0 HD23 LEU A 145 7.260 -6.763 -7.759 1.00 0.00 H new ATOM 965 N PHE A 146 6.680 -5.144 -3.615 1.00 0.00 N ATOM 966 CA PHE A 146 6.544 -4.971 -2.161 1.00 0.00 C ATOM 967 C PHE A 146 6.724 -6.291 -1.434 1.00 0.00 C ATOM 968 O PHE A 146 6.154 -7.327 -1.761 1.00 0.00 O ATOM 969 CB PHE A 146 5.165 -4.447 -1.772 1.00 0.00 C ATOM 970 CG PHE A 146 4.840 -3.026 -2.215 1.00 0.00 C ATOM 971 CD1 PHE A 146 4.510 -2.753 -3.560 1.00 0.00 C ATOM 972 CD2 PHE A 146 4.762 -2.031 -1.223 1.00 0.00 C ATOM 973 CE1 PHE A 146 4.129 -1.441 -3.916 1.00 0.00 C ATOM 974 CE2 PHE A 146 4.370 -0.722 -1.572 1.00 0.00 C ATOM 975 CZ PHE A 146 4.056 -0.436 -2.926 1.00 0.00 C ATOM 0 H PHE A 146 5.922 -5.675 -4.043 1.00 0.00 H new ATOM 0 HA PHE A 146 7.315 -4.254 -1.878 1.00 0.00 H new ATOM 0 HB2 PHE A 146 4.413 -5.117 -2.189 1.00 0.00 H new ATOM 0 HB3 PHE A 146 5.072 -4.498 -0.687 1.00 0.00 H new ATOM 0 HD1 PHE A 146 4.548 -3.535 -4.304 1.00 0.00 H new ATOM 0 HD2 PHE A 146 5.002 -2.269 -0.197 1.00 0.00 H new ATOM 0 HE1 PHE A 146 3.894 -1.206 -4.944 1.00 0.00 H new ATOM 0 HE2 PHE A 146 4.310 0.051 -0.820 1.00 0.00 H new ATOM 0 HZ PHE A 146 3.757 0.564 -3.203 1.00 0.00 H new ATOM 976 N LEU A 147 7.384 -6.151 -0.315 1.00 0.00 N ATOM 977 CA LEU A 147 7.697 -7.271 0.573 1.00 0.00 C ATOM 978 C LEU A 147 7.078 -7.032 1.956 1.00 0.00 C ATOM 979 O LEU A 147 7.370 -6.026 2.604 1.00 0.00 O ATOM 980 CB LEU A 147 9.223 -7.378 0.667 1.00 0.00 C ATOM 981 CG LEU A 147 9.634 -8.752 1.223 1.00 0.00 C ATOM 982 CD1 LEU A 147 9.388 -9.867 0.207 1.00 0.00 C ATOM 983 CD2 LEU A 147 11.115 -8.705 1.604 1.00 0.00 C ATOM 0 H LEU A 147 7.729 -5.252 0.021 1.00 0.00 H new ATOM 0 HA LEU A 147 7.284 -8.202 0.184 1.00 0.00 H new ATOM 0 HB2 LEU A 147 9.665 -7.231 -0.318 1.00 0.00 H new ATOM 0 HB3 LEU A 147 9.610 -6.588 1.311 1.00 0.00 H new ATOM 0 HG LEU A 147 9.025 -8.971 2.100 1.00 0.00 H new ATOM 0 HD11 LEU A 147 9.690 -10.823 0.635 1.00 0.00 H new ATOM 0 HD12 LEU A 147 8.328 -9.902 -0.046 1.00 0.00 H new ATOM 0 HD13 LEU A 147 9.970 -9.673 -0.694 1.00 0.00 H new ATOM 0 HD21 LEU A 147 11.420 -9.674 2.000 1.00 0.00 H new ATOM 0 HD22 LEU A 147 11.710 -8.470 0.722 1.00 0.00 H new ATOM 0 HD23 LEU A 147 11.271 -7.938 2.362 1.00 0.00 H new ATOM 984 N PRO A 148 6.088 -7.872 2.307 1.00 0.00 N ATOM 985 CA PRO A 148 5.429 -7.775 3.613 1.00 0.00 C ATOM 986 C PRO A 148 6.273 -8.407 4.721 1.00 0.00 C ATOM 987 O PRO A 148 6.493 -9.613 4.762 1.00 0.00 O ATOM 988 CB PRO A 148 4.084 -8.474 3.388 1.00 0.00 C ATOM 989 CG PRO A 148 4.376 -9.529 2.333 1.00 0.00 C ATOM 990 CD PRO A 148 5.418 -8.854 1.434 1.00 0.00 C ATOM 0 HA PRO A 148 5.293 -6.749 3.956 1.00 0.00 H new ATOM 0 HB2 PRO A 148 3.712 -8.925 4.308 1.00 0.00 H new ATOM 0 HB3 PRO A 148 3.324 -7.771 3.047 1.00 0.00 H new ATOM 0 HG2 PRO A 148 4.763 -10.446 2.778 1.00 0.00 H new ATOM 0 HG3 PRO A 148 3.479 -9.799 1.776 1.00 0.00 H new ATOM 0 HD2 PRO A 148 6.128 -9.580 1.037 1.00 0.00 H new ATOM 0 HD3 PRO A 148 4.948 -8.368 0.579 1.00 0.00 H new ATOM 991 N LEU A 149 6.844 -7.530 5.535 1.00 0.00 N ATOM 992 CA LEU A 149 7.545 -7.959 6.764 1.00 0.00 C ATOM 993 C LEU A 149 6.824 -7.538 8.035 1.00 0.00 C ATOM 994 O LEU A 149 7.008 -6.420 8.521 1.00 0.00 O ATOM 995 CB LEU A 149 9.074 -7.733 6.733 1.00 0.00 C ATOM 996 CG LEU A 149 9.565 -6.586 5.840 1.00 0.00 C ATOM 997 CD1 LEU A 149 9.485 -5.247 6.575 1.00 0.00 C ATOM 998 CD2 LEU A 149 11.027 -6.857 5.467 1.00 0.00 C ATOM 0 H LEU A 149 6.843 -6.522 5.379 1.00 0.00 H new ATOM 0 HA LEU A 149 7.483 -9.047 6.788 1.00 0.00 H new ATOM 0 HB2 LEU A 149 9.415 -7.546 7.751 1.00 0.00 H new ATOM 0 HB3 LEU A 149 9.551 -8.655 6.402 1.00 0.00 H new ATOM 0 HG LEU A 149 8.935 -6.533 4.952 1.00 0.00 H new ATOM 0 HD11 LEU A 149 9.839 -4.451 5.920 1.00 0.00 H new ATOM 0 HD12 LEU A 149 8.452 -5.050 6.861 1.00 0.00 H new ATOM 0 HD13 LEU A 149 10.107 -5.285 7.469 1.00 0.00 H new ATOM 0 HD21 LEU A 149 11.396 -6.052 4.831 1.00 0.00 H new ATOM 0 HD22 LEU A 149 11.630 -6.909 6.373 1.00 0.00 H new ATOM 0 HD23 LEU A 149 11.096 -7.803 4.931 1.00 0.00 H new ATOM 999 N PRO A 150 5.867 -8.370 8.470 1.00 0.00 N ATOM 1000 CA PRO A 150 5.090 -8.080 9.673 1.00 0.00 C ATOM 1001 C PRO A 150 5.895 -8.283 10.943 1.00 0.00 C ATOM 1002 O PRO A 150 6.652 -9.234 11.130 1.00 0.00 O ATOM 1003 CB PRO A 150 3.825 -8.916 9.557 1.00 0.00 C ATOM 1004 CG PRO A 150 4.272 -10.139 8.755 1.00 0.00 C ATOM 1005 CD PRO A 150 5.354 -9.590 7.818 1.00 0.00 C ATOM 0 HA PRO A 150 4.815 -7.028 9.748 1.00 0.00 H new ATOM 0 HB2 PRO A 150 3.440 -9.198 10.537 1.00 0.00 H new ATOM 0 HB3 PRO A 150 3.030 -8.371 9.047 1.00 0.00 H new ATOM 0 HG2 PRO A 150 4.665 -10.921 9.405 1.00 0.00 H new ATOM 0 HG3 PRO A 150 3.444 -10.575 8.197 1.00 0.00 H new ATOM 0 HD2 PRO A 150 6.151 -10.319 7.670 1.00 0.00 H new ATOM 0 HD3 PRO A 150 4.942 -9.364 6.834 1.00 0.00 H new