USER MOD reduce.3.24.130724 H: found=0, std=0, add=975, rem=0, adj=34 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 115 LYS NZ :NH3+ 163:sc= -0.197 (180deg=-0.0157) USER MOD Set 1.2: A 116 HIS : no HE2:sc= 0.119 K(o=-0.078,f=-4.4!) USER MOD Set 1.3: A 119 LYS NZ :NH3+ -155:sc= 0 (180deg=0) USER MOD Set 2.1: A 109 ASN : amide:sc= -1.1 K(o=-1.1,f=-7.3!) USER MOD Set 2.2: A 111 TYR OH : rot 15:sc= 0 USER MOD Set 3.1: A 29 TYR OH : rot 159:sc= 0.671 USER MOD Set 3.2: A 31 SER OG : rot -32:sc= 3.21 USER MOD Set 3.3: A 108 TYR OH : rot -8:sc= 1.24 USER MOD Set 4.1: A 106 ASN : amide:sc= -0.0576 K(o=0.77,f=-6.9!) USER MOD Set 4.2: A 139 TYR OH : rot 174:sc= 0.825 USER MOD Set 5.1: A 90 SER OG : rot -66:sc= -0.202 USER MOD Set 5.2: A 92 THR OG1 : rot 36:sc= 0.268 USER MOD Single : A 30 CYS SG : rot 125:sc= 0.255 USER MOD Single : A 32 ASN : amide:sc= 1.04 K(o=1,f=-0.63) USER MOD Single : A 35 HIS : no HD1:sc= 0.871 K(o=0.87,f=-3.4!) USER MOD Single : A 44 THR OG1 : rot 58:sc= 1.01 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.0141 USER MOD Single : A 52 SER OG : rot 180:sc= -0.546 USER MOD Single : A 54 GLN : amide:sc= 0.222 X(o=0.22,f=-0.024) USER MOD Single : A 55 HIS : no HD1:sc=0.000573 X(o=0.00057,f=-0.25) USER MOD Single : A 57 GLN : amide:sc= -0.08 X(o=-0.08,f=0) USER MOD Single : A 59 GLN : amide:sc= -0.0727 X(o=-0.073,f=-0.0054) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 178:sc= 0.177 USER MOD Single : A 69 TYR OH : rot 140:sc= 0.733 USER MOD Single : A 71 LYS NZ :NH3+ -119:sc= -0.0299 (180deg=-1.09) USER MOD Single : A 72 SER OG : rot 80:sc= 0.719 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot -7:sc= 0.179 USER MOD Single : A 77 GLN : amide:sc= -0.285 K(o=-0.28,f=-2.5!) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 148:sc= -2.89 (180deg=-5.54!) USER MOD Single : A 83 THR OG1 : rot -93:sc= 0.1 USER MOD Single : A 88 TYR OH : rot -148:sc= 0.53 USER MOD Single : A 91 GLN : amide:sc= -0.657! C(o=-0.66!,f=-3.7!) USER MOD Single : A 94 ASN : amide:sc= 0.653 K(o=0.65,f=-4.1!) USER MOD Single : A 97 CYS SG : rot 42:sc= -1.37! USER MOD Single : A 107 HIS : no HE2:sc= 0.139 K(o=0.14,f=-0.58) USER MOD Single : A 110 THR OG1 : rot -111:sc= 0.636 USER MOD Single : A 113 SER OG : rot 96:sc= -0.953 USER MOD Single : A 114 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0619) USER MOD Single : A 120 ASN : amide:sc= -0.0553 K(o=-0.055,f=-7!) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 130 SER OG : rot 55:sc= 0.251 USER MOD Single : A 131 CYS SG : rot -110:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 163:sc= 0.413 (180deg=0.284) USER MOD Single : A 137 THR OG1 : rot 136:sc= 1.26 USER MOD Single : A 138 HIS : no HD1:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 141 GLN : amide:sc= 0.912 K(o=0.91,f=-0.015) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 11 N ALA A 26 2.370 -4.458 11.586 1.00 0.00 N ATOM 12 CA ALA A 26 2.617 -4.946 10.213 1.00 0.00 C ATOM 13 C ALA A 26 3.292 -3.869 9.376 1.00 0.00 C ATOM 14 O ALA A 26 3.026 -2.685 9.537 1.00 0.00 O ATOM 15 CB ALA A 26 1.335 -5.449 9.539 1.00 0.00 C ATOM 0 HA ALA A 26 3.290 -5.800 10.286 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.566 -5.797 8.532 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.917 -6.271 10.120 1.00 0.00 H new ATOM 0 HB3 ALA A 26 0.610 -4.637 9.485 1.00 0.00 H new ATOM 16 N LEU A 27 4.253 -4.330 8.583 1.00 0.00 N ATOM 17 CA LEU A 27 5.034 -3.445 7.694 1.00 0.00 C ATOM 18 C LEU A 27 4.846 -3.782 6.227 1.00 0.00 C ATOM 19 O LEU A 27 4.746 -4.945 5.851 1.00 0.00 O ATOM 20 CB LEU A 27 6.539 -3.512 8.014 1.00 0.00 C ATOM 21 CG LEU A 27 6.898 -3.149 9.454 1.00 0.00 C ATOM 22 CD1 LEU A 27 8.379 -3.445 9.690 1.00 0.00 C ATOM 23 CD2 LEU A 27 6.597 -1.686 9.748 1.00 0.00 C ATOM 0 H LEU A 27 4.519 -5.313 8.530 1.00 0.00 H new ATOM 0 HA LEU A 27 4.656 -2.439 7.877 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.897 -4.521 7.807 1.00 0.00 H new ATOM 0 HB3 LEU A 27 7.071 -2.840 7.340 1.00 0.00 H new ATOM 0 HG LEU A 27 6.289 -3.750 10.129 1.00 0.00 H new ATOM 0 HD11 LEU A 27 8.642 -3.188 10.716 1.00 0.00 H new ATOM 0 HD12 LEU A 27 8.570 -4.505 9.521 1.00 0.00 H new ATOM 0 HD13 LEU A 27 8.982 -2.853 9.002 1.00 0.00 H new ATOM 0 HD21 LEU A 27 6.864 -1.460 10.780 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.177 -1.053 9.077 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.534 -1.496 9.598 1.00 0.00 H new ATOM 24 N LEU A 28 4.890 -2.722 5.431 1.00 0.00 N ATOM 25 CA LEU A 28 4.717 -2.819 3.977 1.00 0.00 C ATOM 26 C LEU A 28 5.921 -2.186 3.282 1.00 0.00 C ATOM 27 O LEU A 28 6.108 -0.960 3.280 1.00 0.00 O ATOM 28 CB LEU A 28 3.459 -2.017 3.641 1.00 0.00 C ATOM 29 CG LEU A 28 2.651 -2.625 2.492 1.00 0.00 C ATOM 30 CD1 LEU A 28 2.045 -3.977 2.886 1.00 0.00 C ATOM 31 CD2 LEU A 28 1.506 -1.684 2.118 1.00 0.00 C ATOM 0 H LEU A 28 5.046 -1.772 5.767 1.00 0.00 H new ATOM 0 HA LEU A 28 4.631 -3.856 3.651 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.828 -1.953 4.528 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.744 -0.998 3.378 1.00 0.00 H new ATOM 0 HG LEU A 28 3.330 -2.769 1.652 1.00 0.00 H new ATOM 0 HD11 LEU A 28 1.478 -4.380 2.047 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.843 -4.670 3.151 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.382 -3.843 3.741 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.931 -2.118 1.300 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.856 -1.540 2.981 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.913 -0.722 1.806 1.00 0.00 H new ATOM 32 N TYR A 29 6.798 -3.060 2.822 1.00 0.00 N ATOM 33 CA TYR A 29 8.056 -2.678 2.154 1.00 0.00 C ATOM 34 C TYR A 29 7.895 -2.705 0.631 1.00 0.00 C ATOM 35 O TYR A 29 7.204 -3.553 0.091 1.00 0.00 O ATOM 36 CB TYR A 29 9.108 -3.658 2.666 1.00 0.00 C ATOM 37 CG TYR A 29 10.326 -3.863 1.770 1.00 0.00 C ATOM 38 CD1 TYR A 29 11.338 -2.885 1.736 1.00 0.00 C ATOM 39 CD2 TYR A 29 10.408 -5.076 1.045 1.00 0.00 C ATOM 40 CE1 TYR A 29 12.473 -3.129 0.948 1.00 0.00 C ATOM 41 CE2 TYR A 29 11.554 -5.321 0.267 1.00 0.00 C ATOM 42 CZ TYR A 29 12.557 -4.332 0.213 1.00 0.00 C ATOM 43 OH TYR A 29 13.536 -4.461 -0.715 1.00 0.00 O ATOM 0 H TYR A 29 6.667 -4.069 2.896 1.00 0.00 H new ATOM 0 HA TYR A 29 8.355 -1.655 2.383 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.453 -3.313 3.641 1.00 0.00 H new ATOM 0 HB3 TYR A 29 8.630 -4.625 2.821 1.00 0.00 H new ATOM 0 HD1 TYR A 29 11.243 -1.970 2.302 1.00 0.00 H new ATOM 0 HD2 TYR A 29 9.607 -5.799 1.088 1.00 0.00 H new ATOM 0 HE1 TYR A 29 13.273 -2.405 0.904 1.00 0.00 H new ATOM 0 HE2 TYR A 29 11.663 -6.247 -0.277 1.00 0.00 H new ATOM 0 HH TYR A 29 13.691 -5.411 -0.897 1.00 0.00 H new ATOM 44 N CYS A 30 8.466 -1.708 -0.018 1.00 0.00 N ATOM 45 CA CYS A 30 8.626 -1.673 -1.486 1.00 0.00 C ATOM 46 C CYS A 30 10.101 -1.700 -1.826 1.00 0.00 C ATOM 47 O CYS A 30 10.855 -0.812 -1.425 1.00 0.00 O ATOM 48 CB CYS A 30 7.951 -0.430 -2.059 1.00 0.00 C ATOM 49 SG CYS A 30 7.997 -0.357 -3.878 1.00 0.00 S ATOM 0 H CYS A 30 8.841 -0.883 0.451 1.00 0.00 H new ATOM 0 HA CYS A 30 8.148 -2.546 -1.931 1.00 0.00 H new ATOM 0 HB2 CYS A 30 6.913 -0.404 -1.728 1.00 0.00 H new ATOM 0 HB3 CYS A 30 8.437 0.458 -1.655 1.00 0.00 H new ATOM 0 HG CYS A 30 6.788 -0.225 -4.338 1.00 0.00 H new ATOM 50 N SER A 31 10.432 -2.626 -2.714 1.00 0.00 N ATOM 51 CA SER A 31 11.833 -2.852 -3.118 1.00 0.00 C ATOM 52 C SER A 31 12.429 -1.763 -3.996 1.00 0.00 C ATOM 53 O SER A 31 13.613 -1.481 -3.836 1.00 0.00 O ATOM 54 CB SER A 31 12.021 -4.228 -3.763 1.00 0.00 C ATOM 55 OG SER A 31 11.906 -5.219 -2.737 1.00 0.00 O ATOM 0 H SER A 31 9.758 -3.238 -3.174 1.00 0.00 H new ATOM 0 HA SER A 31 12.393 -2.814 -2.184 1.00 0.00 H new ATOM 0 HB2 SER A 31 11.270 -4.392 -4.536 1.00 0.00 H new ATOM 0 HB3 SER A 31 12.996 -4.292 -4.246 1.00 0.00 H new ATOM 0 HG SER A 31 12.240 -4.854 -1.891 1.00 0.00 H new ATOM 56 N ASN A 32 11.544 -0.965 -4.598 1.00 0.00 N ATOM 57 CA ASN A 32 11.870 0.032 -5.641 1.00 0.00 C ATOM 58 C ASN A 32 13.134 0.860 -5.313 1.00 0.00 C ATOM 59 O ASN A 32 14.114 0.828 -6.050 1.00 0.00 O ATOM 60 CB ASN A 32 10.684 0.952 -5.925 1.00 0.00 C ATOM 61 CG ASN A 32 10.869 1.804 -7.192 1.00 0.00 C ATOM 62 OD1 ASN A 32 11.554 1.452 -8.137 1.00 0.00 O ATOM 63 ND2 ASN A 32 10.155 2.912 -7.297 1.00 0.00 N ATOM 0 H ASN A 32 10.550 -0.989 -4.372 1.00 0.00 H new ATOM 0 HA ASN A 32 12.091 -0.540 -6.542 1.00 0.00 H new ATOM 0 HB2 ASN A 32 9.782 0.350 -6.028 1.00 0.00 H new ATOM 0 HB3 ASN A 32 10.531 1.611 -5.071 1.00 0.00 H new ATOM 0 HD21 ASN A 32 10.183 3.457 -8.159 1.00 0.00 H new ATOM 0 HD22 ASN A 32 9.576 3.222 -6.516 1.00 0.00 H new ATOM 64 N GLY A 33 13.027 1.618 -4.225 1.00 0.00 N ATOM 65 CA GLY A 33 14.154 2.315 -3.560 1.00 0.00 C ATOM 66 C GLY A 33 14.246 1.973 -2.063 1.00 0.00 C ATOM 67 O GLY A 33 14.634 2.825 -1.257 1.00 0.00 O ATOM 0 H GLY A 33 12.134 1.777 -3.759 1.00 0.00 H new ATOM 0 HA2 GLY A 33 15.088 2.043 -4.051 1.00 0.00 H new ATOM 0 HA3 GLY A 33 14.034 3.392 -3.678 1.00 0.00 H new ATOM 68 N GLY A 34 13.904 0.726 -1.734 1.00 0.00 N ATOM 69 CA GLY A 34 13.815 0.210 -0.351 1.00 0.00 C ATOM 70 C GLY A 34 13.001 1.085 0.609 1.00 0.00 C ATOM 71 O GLY A 34 13.485 1.451 1.681 1.00 0.00 O ATOM 0 H GLY A 34 13.674 0.022 -2.435 1.00 0.00 H new ATOM 0 HA2 GLY A 34 13.372 -0.786 -0.377 1.00 0.00 H new ATOM 0 HA3 GLY A 34 14.824 0.100 0.047 1.00 0.00 H new ATOM 72 N HIS A 35 11.729 1.297 0.285 1.00 0.00 N ATOM 73 CA HIS A 35 10.867 2.156 1.114 1.00 0.00 C ATOM 74 C HIS A 35 9.682 1.443 1.759 1.00 0.00 C ATOM 75 O HIS A 35 9.031 0.594 1.169 1.00 0.00 O ATOM 76 CB HIS A 35 10.303 3.368 0.382 1.00 0.00 C ATOM 77 CG HIS A 35 11.382 4.322 -0.151 1.00 0.00 C ATOM 78 ND1 HIS A 35 12.482 4.689 0.498 1.00 0.00 N ATOM 79 CD2 HIS A 35 11.292 5.038 -1.264 1.00 0.00 C ATOM 80 CE1 HIS A 35 13.052 5.666 -0.192 1.00 0.00 C ATOM 81 NE2 HIS A 35 12.331 5.876 -1.279 1.00 0.00 N ATOM 0 H HIS A 35 11.270 0.895 -0.533 1.00 0.00 H new ATOM 0 HA HIS A 35 11.566 2.474 1.887 1.00 0.00 H new ATOM 0 HB2 HIS A 35 9.689 3.025 -0.451 1.00 0.00 H new ATOM 0 HB3 HIS A 35 9.646 3.917 1.057 1.00 0.00 H new ATOM 0 HD2 HIS A 35 10.522 4.958 -2.017 1.00 0.00 H new ATOM 0 HE1 HIS A 35 13.950 6.198 0.086 1.00 0.00 H new ATOM 0 HE2 HIS A 35 12.534 6.562 -2.006 1.00 0.00 H new ATOM 82 N PHE A 36 9.348 1.955 2.931 1.00 0.00 N ATOM 83 CA PHE A 36 8.169 1.570 3.710 1.00 0.00 C ATOM 84 C PHE A 36 7.084 2.626 3.549 1.00 0.00 C ATOM 85 O PHE A 36 7.352 3.822 3.458 1.00 0.00 O ATOM 86 CB PHE A 36 8.579 1.532 5.176 1.00 0.00 C ATOM 87 CG PHE A 36 9.347 0.261 5.500 1.00 0.00 C ATOM 88 CD1 PHE A 36 8.676 -0.949 5.805 1.00 0.00 C ATOM 89 CD2 PHE A 36 10.759 0.330 5.510 1.00 0.00 C ATOM 90 CE1 PHE A 36 9.427 -2.100 6.101 1.00 0.00 C ATOM 91 CE2 PHE A 36 11.519 -0.821 5.805 1.00 0.00 C ATOM 92 CZ PHE A 36 10.839 -2.031 6.101 1.00 0.00 C ATOM 0 H PHE A 36 9.906 2.676 3.388 1.00 0.00 H new ATOM 0 HA PHE A 36 7.794 0.604 3.373 1.00 0.00 H new ATOM 0 HB2 PHE A 36 9.195 2.401 5.406 1.00 0.00 H new ATOM 0 HB3 PHE A 36 7.692 1.594 5.806 1.00 0.00 H new ATOM 0 HD1 PHE A 36 7.597 -0.987 5.810 1.00 0.00 H new ATOM 0 HD2 PHE A 36 11.256 1.264 5.292 1.00 0.00 H new ATOM 0 HE1 PHE A 36 8.928 -3.031 6.327 1.00 0.00 H new ATOM 0 HE2 PHE A 36 12.598 -0.782 5.806 1.00 0.00 H new ATOM 0 HZ PHE A 36 11.412 -2.917 6.331 1.00 0.00 H new ATOM 93 N LEU A 37 5.861 2.112 3.626 1.00 0.00 N ATOM 94 CA LEU A 37 4.652 2.922 3.400 1.00 0.00 C ATOM 95 C LEU A 37 4.201 3.655 4.674 1.00 0.00 C ATOM 96 O LEU A 37 3.557 3.107 5.558 1.00 0.00 O ATOM 97 CB LEU A 37 3.598 1.982 2.824 1.00 0.00 C ATOM 98 CG LEU A 37 2.576 2.775 2.000 1.00 0.00 C ATOM 99 CD1 LEU A 37 1.981 1.903 0.891 1.00 0.00 C ATOM 100 CD2 LEU A 37 1.468 3.388 2.873 1.00 0.00 C ATOM 0 H LEU A 37 5.672 1.134 3.844 1.00 0.00 H new ATOM 0 HA LEU A 37 4.843 3.729 2.693 1.00 0.00 H new ATOM 0 HB2 LEU A 37 4.075 1.229 2.198 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.093 1.452 3.631 1.00 0.00 H new ATOM 0 HG LEU A 37 3.111 3.606 1.540 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.259 2.485 0.319 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.777 1.562 0.230 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.483 1.041 1.334 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.771 3.939 2.242 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.935 2.594 3.395 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.912 4.067 3.601 1.00 0.00 H new ATOM 101 N ARG A 38 4.430 4.961 4.624 1.00 0.00 N ATOM 102 CA ARG A 38 4.126 5.904 5.712 1.00 0.00 C ATOM 103 C ARG A 38 2.710 6.456 5.610 1.00 0.00 C ATOM 104 O ARG A 38 2.357 7.107 4.623 1.00 0.00 O ATOM 105 CB ARG A 38 5.104 7.084 5.630 1.00 0.00 C ATOM 106 CG ARG A 38 6.479 6.736 6.184 1.00 0.00 C ATOM 107 CD ARG A 38 6.386 6.608 7.702 1.00 0.00 C ATOM 108 NE ARG A 38 7.704 6.411 8.327 1.00 0.00 N ATOM 109 CZ ARG A 38 8.112 6.968 9.460 1.00 0.00 C ATOM 110 NH1 ARG A 38 7.361 7.825 10.141 1.00 0.00 N ATOM 111 NH2 ARG A 38 9.341 6.735 9.894 1.00 0.00 N ATOM 0 H ARG A 38 4.843 5.413 3.808 1.00 0.00 H new ATOM 0 HA ARG A 38 4.220 5.366 6.655 1.00 0.00 H new ATOM 0 HB2 ARG A 38 5.203 7.399 4.591 1.00 0.00 H new ATOM 0 HB3 ARG A 38 4.696 7.930 6.183 1.00 0.00 H new ATOM 0 HG2 ARG A 38 6.835 5.802 5.749 1.00 0.00 H new ATOM 0 HG3 ARG A 38 7.200 7.508 5.915 1.00 0.00 H new ATOM 0 HD2 ARG A 38 5.922 7.505 8.112 1.00 0.00 H new ATOM 0 HD3 ARG A 38 5.737 5.769 7.955 1.00 0.00 H new ATOM 0 HE ARG A 38 8.360 5.794 7.848 1.00 0.00 H new ATOM 0 HH11 ARG A 38 6.434 8.076 9.797 1.00 0.00 H new ATOM 0 HH12 ARG A 38 7.711 8.232 11.009 1.00 0.00 H new ATOM 0 HH21 ARG A 38 9.965 6.132 9.358 1.00 0.00 H new ATOM 0 HH22 ARG A 38 9.664 7.159 10.764 1.00 0.00 H new ATOM 112 N ILE A 39 1.949 6.159 6.646 1.00 0.00 N ATOM 113 CA ILE A 39 0.619 6.776 6.846 1.00 0.00 C ATOM 114 C ILE A 39 0.677 7.810 7.980 1.00 0.00 C ATOM 115 O ILE A 39 0.655 7.515 9.176 1.00 0.00 O ATOM 116 CB ILE A 39 -0.496 5.728 7.017 1.00 0.00 C ATOM 117 CG1 ILE A 39 -1.864 6.416 7.178 1.00 0.00 C ATOM 118 CG2 ILE A 39 -0.223 4.736 8.158 1.00 0.00 C ATOM 119 CD1 ILE A 39 -2.404 6.985 5.857 1.00 0.00 C ATOM 0 H ILE A 39 2.215 5.495 7.373 1.00 0.00 H new ATOM 0 HA ILE A 39 0.349 7.315 5.938 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.513 5.131 6.105 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.581 5.700 7.580 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.777 7.222 7.907 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.046 4.024 8.226 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.705 4.200 7.960 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.134 5.279 9.099 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.370 7.458 6.032 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.704 7.724 5.466 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.521 6.178 5.134 1.00 0.00 H new ATOM 120 N LEU A 40 0.741 9.045 7.527 1.00 0.00 N ATOM 121 CA LEU A 40 0.715 10.234 8.392 1.00 0.00 C ATOM 122 C LEU A 40 -0.735 10.521 8.826 1.00 0.00 C ATOM 123 O LEU A 40 -1.626 10.411 7.982 1.00 0.00 O ATOM 124 CB LEU A 40 1.302 11.442 7.645 1.00 0.00 C ATOM 125 CG LEU A 40 2.802 11.262 7.413 1.00 0.00 C ATOM 126 CD1 LEU A 40 3.086 10.644 6.039 1.00 0.00 C ATOM 127 CD2 LEU A 40 3.471 12.637 7.480 1.00 0.00 C ATOM 0 H LEU A 40 0.814 9.267 6.534 1.00 0.00 H new ATOM 0 HA LEU A 40 1.321 10.051 9.279 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.794 11.565 6.689 1.00 0.00 H new ATOM 0 HB3 LEU A 40 1.125 12.351 8.220 1.00 0.00 H new ATOM 0 HG LEU A 40 3.194 10.592 8.178 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.162 10.530 5.907 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.607 9.667 5.973 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.692 11.295 5.259 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.543 12.528 7.317 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.050 13.284 6.710 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.297 13.079 8.461 1.00 0.00 H new ATOM 128 N PRO A 41 -0.962 10.939 10.088 1.00 0.00 N ATOM 129 CA PRO A 41 -2.296 11.131 10.683 1.00 0.00 C ATOM 130 C PRO A 41 -3.319 11.865 9.808 1.00 0.00 C ATOM 131 O PRO A 41 -4.488 11.470 9.787 1.00 0.00 O ATOM 132 CB PRO A 41 -2.056 11.909 11.966 1.00 0.00 C ATOM 133 CG PRO A 41 -0.693 11.403 12.408 1.00 0.00 C ATOM 134 CD PRO A 41 0.081 11.243 11.097 1.00 0.00 C ATOM 0 HA PRO A 41 -2.748 10.150 10.831 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.053 12.985 11.793 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -2.825 11.708 12.712 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -0.203 12.109 13.078 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -0.772 10.457 12.944 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.626 12.152 10.844 1.00 0.00 H new ATOM 0 HD3 PRO A 41 0.815 10.440 11.164 1.00 0.00 H new ATOM 135 N ASP A 42 -2.867 12.885 9.077 1.00 0.00 N ATOM 136 CA ASP A 42 -3.738 13.666 8.175 1.00 0.00 C ATOM 137 C ASP A 42 -4.015 12.979 6.823 1.00 0.00 C ATOM 138 O ASP A 42 -3.818 13.549 5.752 1.00 0.00 O ATOM 139 CB ASP A 42 -3.204 15.106 8.061 1.00 0.00 C ATOM 140 CG ASP A 42 -1.782 15.283 7.493 1.00 0.00 C ATOM 141 OD1 ASP A 42 -0.925 14.400 7.783 1.00 0.00 O ATOM 142 OD2 ASP A 42 -1.541 16.355 6.909 1.00 0.00 O ATOM 0 H ASP A 42 -1.896 13.197 9.087 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.731 13.718 8.622 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -3.892 15.674 7.434 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -3.231 15.557 9.053 1.00 0.00 H new ATOM 143 N GLY A 43 -4.405 11.716 6.941 1.00 0.00 N ATOM 144 CA GLY A 43 -4.711 10.787 5.835 1.00 0.00 C ATOM 145 C GLY A 43 -3.685 10.790 4.679 1.00 0.00 C ATOM 146 O GLY A 43 -4.065 10.533 3.540 1.00 0.00 O ATOM 0 H GLY A 43 -4.526 11.279 7.855 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.780 9.776 6.237 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.692 11.037 5.431 1.00 0.00 H new ATOM 147 N THR A 44 -2.406 10.917 5.008 1.00 0.00 N ATOM 148 CA THR A 44 -1.357 11.158 3.985 1.00 0.00 C ATOM 149 C THR A 44 -0.401 9.958 3.862 1.00 0.00 C ATOM 150 O THR A 44 0.217 9.532 4.845 1.00 0.00 O ATOM 151 CB THR A 44 -0.572 12.437 4.302 1.00 0.00 C ATOM 152 OG1 THR A 44 -1.471 13.535 4.494 1.00 0.00 O ATOM 153 CG2 THR A 44 0.391 12.831 3.180 1.00 0.00 C ATOM 0 H THR A 44 -2.056 10.860 5.964 1.00 0.00 H new ATOM 0 HA THR A 44 -1.859 11.285 3.026 1.00 0.00 H new ATOM 0 HB THR A 44 -0.000 12.224 5.205 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.097 13.323 5.218 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.920 13.743 3.458 1.00 0.00 H new ATOM 0 HG22 THR A 44 1.111 12.028 3.020 1.00 0.00 H new ATOM 0 HG23 THR A 44 -0.171 13.003 2.262 1.00 0.00 H new ATOM 154 N VAL A 45 -0.204 9.550 2.619 1.00 0.00 N ATOM 155 CA VAL A 45 0.707 8.445 2.268 1.00 0.00 C ATOM 156 C VAL A 45 1.977 8.877 1.520 1.00 0.00 C ATOM 157 O VAL A 45 1.955 9.501 0.458 1.00 0.00 O ATOM 158 CB VAL A 45 -0.007 7.340 1.484 1.00 0.00 C ATOM 159 CG1 VAL A 45 -0.888 6.497 2.411 1.00 0.00 C ATOM 160 CG2 VAL A 45 -0.760 7.853 0.250 1.00 0.00 C ATOM 0 H VAL A 45 -0.668 9.970 1.814 1.00 0.00 H new ATOM 0 HA VAL A 45 1.033 8.053 3.232 1.00 0.00 H new ATOM 0 HB VAL A 45 0.767 6.687 1.080 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -1.385 5.719 1.832 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -0.269 6.037 3.182 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -1.637 7.135 2.880 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.241 7.016 -0.256 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.517 8.574 0.559 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.058 8.334 -0.431 1.00 0.00 H new ATOM 161 N ASP A 46 3.079 8.395 2.069 1.00 0.00 N ATOM 162 CA ASP A 46 4.441 8.622 1.570 1.00 0.00 C ATOM 163 C ASP A 46 5.351 7.408 1.827 1.00 0.00 C ATOM 164 O ASP A 46 4.902 6.401 2.358 1.00 0.00 O ATOM 165 CB ASP A 46 4.981 9.903 2.194 1.00 0.00 C ATOM 166 CG ASP A 46 4.367 11.155 1.542 1.00 0.00 C ATOM 167 OD1 ASP A 46 4.628 11.365 0.338 1.00 0.00 O ATOM 168 OD2 ASP A 46 3.613 11.852 2.271 1.00 0.00 O ATOM 0 H ASP A 46 3.058 7.812 2.906 1.00 0.00 H new ATOM 0 HA ASP A 46 4.420 8.744 0.487 1.00 0.00 H new ATOM 0 HB2 ASP A 46 4.766 9.906 3.263 1.00 0.00 H new ATOM 0 HB3 ASP A 46 6.065 9.931 2.087 1.00 0.00 H new ATOM 169 N GLY A 47 6.590 7.498 1.335 1.00 0.00 N ATOM 170 CA GLY A 47 7.596 6.424 1.445 1.00 0.00 C ATOM 171 C GLY A 47 8.835 6.866 2.257 1.00 0.00 C ATOM 172 O GLY A 47 9.191 8.039 2.287 1.00 0.00 O ATOM 0 H GLY A 47 6.931 8.324 0.844 1.00 0.00 H new ATOM 0 HA2 GLY A 47 7.145 5.553 1.920 1.00 0.00 H new ATOM 0 HA3 GLY A 47 7.908 6.117 0.447 1.00 0.00 H new ATOM 173 N THR A 48 9.506 5.864 2.814 1.00 0.00 N ATOM 174 CA THR A 48 10.689 6.077 3.672 1.00 0.00 C ATOM 175 C THR A 48 11.582 4.837 3.699 1.00 0.00 C ATOM 176 O THR A 48 11.124 3.724 3.918 1.00 0.00 O ATOM 177 CB THR A 48 10.279 6.477 5.102 1.00 0.00 C ATOM 178 OG1 THR A 48 11.434 7.054 5.725 1.00 0.00 O ATOM 179 CG2 THR A 48 9.723 5.358 5.991 1.00 0.00 C ATOM 0 H THR A 48 9.255 4.883 2.691 1.00 0.00 H new ATOM 0 HA THR A 48 11.260 6.899 3.241 1.00 0.00 H new ATOM 0 HB THR A 48 9.443 7.169 5.001 1.00 0.00 H new ATOM 0 HG1 THR A 48 11.211 7.324 6.640 1.00 0.00 H new ATOM 0 HG21 THR A 48 9.471 5.763 6.971 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.828 4.938 5.531 1.00 0.00 H new ATOM 0 HG23 THR A 48 10.474 4.576 6.104 1.00 0.00 H new ATOM 180 N ARG A 49 12.879 5.080 3.589 1.00 0.00 N ATOM 181 CA ARG A 49 13.894 4.025 3.769 1.00 0.00 C ATOM 182 C ARG A 49 14.066 3.642 5.257 1.00 0.00 C ATOM 183 O ARG A 49 14.528 2.557 5.600 1.00 0.00 O ATOM 184 CB ARG A 49 15.204 4.545 3.164 1.00 0.00 C ATOM 185 CG ARG A 49 16.203 3.416 2.903 1.00 0.00 C ATOM 186 CD ARG A 49 17.385 3.901 2.055 1.00 0.00 C ATOM 187 NE ARG A 49 16.930 4.189 0.682 1.00 0.00 N ATOM 188 CZ ARG A 49 17.193 5.303 -0.020 1.00 0.00 C ATOM 189 NH1 ARG A 49 17.849 6.332 0.502 1.00 0.00 N ATOM 190 NH2 ARG A 49 16.752 5.409 -1.265 1.00 0.00 N ATOM 0 H ARG A 49 13.266 5.999 3.375 1.00 0.00 H new ATOM 0 HA ARG A 49 13.580 3.112 3.264 1.00 0.00 H new ATOM 0 HB2 ARG A 49 14.991 5.064 2.229 1.00 0.00 H new ATOM 0 HB3 ARG A 49 15.650 5.275 3.839 1.00 0.00 H new ATOM 0 HG2 ARG A 49 16.570 3.026 3.852 1.00 0.00 H new ATOM 0 HG3 ARG A 49 15.701 2.594 2.393 1.00 0.00 H new ATOM 0 HD2 ARG A 49 17.820 4.796 2.499 1.00 0.00 H new ATOM 0 HD3 ARG A 49 18.167 3.142 2.037 1.00 0.00 H new ATOM 0 HE ARG A 49 16.363 3.476 0.223 1.00 0.00 H new ATOM 0 HH11 ARG A 49 18.172 6.293 1.469 1.00 0.00 H new ATOM 0 HH12 ARG A 49 18.030 7.161 -0.063 1.00 0.00 H new ATOM 0 HH21 ARG A 49 16.217 4.648 -1.683 1.00 0.00 H new ATOM 0 HH22 ARG A 49 16.947 6.252 -1.805 1.00 0.00 H new ATOM 191 N ASP A 50 13.523 4.492 6.131 1.00 0.00 N ATOM 192 CA ASP A 50 13.691 4.350 7.582 1.00 0.00 C ATOM 193 C ASP A 50 12.564 3.536 8.196 1.00 0.00 C ATOM 194 O ASP A 50 11.422 3.989 8.336 1.00 0.00 O ATOM 195 CB ASP A 50 13.771 5.709 8.270 1.00 0.00 C ATOM 196 CG ASP A 50 15.073 6.436 7.917 1.00 0.00 C ATOM 197 OD1 ASP A 50 16.107 6.055 8.496 1.00 0.00 O ATOM 198 OD2 ASP A 50 14.994 7.329 7.047 1.00 0.00 O ATOM 0 H ASP A 50 12.957 5.295 5.857 1.00 0.00 H new ATOM 0 HA ASP A 50 14.631 3.821 7.738 1.00 0.00 H new ATOM 0 HB2 ASP A 50 12.919 6.320 7.973 1.00 0.00 H new ATOM 0 HB3 ASP A 50 13.707 5.577 9.350 1.00 0.00 H new ATOM 199 N ARG A 51 12.972 2.370 8.677 1.00 0.00 N ATOM 200 CA ARG A 51 12.132 1.507 9.524 1.00 0.00 C ATOM 201 C ARG A 51 12.055 2.060 10.971 1.00 0.00 C ATOM 202 O ARG A 51 12.468 1.448 11.949 1.00 0.00 O ATOM 203 CB ARG A 51 12.732 0.104 9.464 1.00 0.00 C ATOM 204 CG ARG A 51 11.732 -0.921 9.998 1.00 0.00 C ATOM 205 CD ARG A 51 12.478 -2.096 10.613 1.00 0.00 C ATOM 206 NE ARG A 51 11.510 -2.915 11.349 1.00 0.00 N ATOM 207 CZ ARG A 51 11.176 -2.784 12.637 1.00 0.00 C ATOM 208 NH1 ARG A 51 11.520 -1.721 13.365 1.00 0.00 N ATOM 209 NH2 ARG A 51 10.359 -3.664 13.195 1.00 0.00 N ATOM 0 H ARG A 51 13.899 1.986 8.495 1.00 0.00 H new ATOM 0 HA ARG A 51 11.103 1.480 9.165 1.00 0.00 H new ATOM 0 HB2 ARG A 51 13.001 -0.141 8.436 1.00 0.00 H new ATOM 0 HB3 ARG A 51 13.650 0.068 10.051 1.00 0.00 H new ATOM 0 HG2 ARG A 51 11.086 -0.458 10.744 1.00 0.00 H new ATOM 0 HG3 ARG A 51 11.088 -1.270 9.191 1.00 0.00 H new ATOM 0 HD2 ARG A 51 12.964 -2.687 9.837 1.00 0.00 H new ATOM 0 HD3 ARG A 51 13.262 -1.741 11.281 1.00 0.00 H new ATOM 0 HE ARG A 51 11.046 -3.658 10.827 1.00 0.00 H new ATOM 0 HH11 ARG A 51 12.060 -0.966 12.942 1.00 0.00 H new ATOM 0 HH12 ARG A 51 11.243 -1.663 14.345 1.00 0.00 H new ATOM 0 HH21 ARG A 51 9.988 -4.437 12.643 1.00 0.00 H new ATOM 0 HH22 ARG A 51 10.101 -3.569 14.177 1.00 0.00 H new ATOM 210 N SER A 52 11.651 3.328 11.051 1.00 0.00 N ATOM 211 CA SER A 52 11.450 4.046 12.328 1.00 0.00 C ATOM 212 C SER A 52 10.065 3.758 12.946 1.00 0.00 C ATOM 213 O SER A 52 9.826 4.048 14.117 1.00 0.00 O ATOM 214 CB SER A 52 11.616 5.556 12.130 1.00 0.00 C ATOM 215 OG SER A 52 12.871 5.827 11.500 1.00 0.00 O ATOM 0 H SER A 52 11.450 3.898 10.229 1.00 0.00 H new ATOM 0 HA SER A 52 12.211 3.681 13.018 1.00 0.00 H new ATOM 0 HB2 SER A 52 10.801 5.944 11.519 1.00 0.00 H new ATOM 0 HB3 SER A 52 11.564 6.066 13.092 1.00 0.00 H new ATOM 0 HG SER A 52 12.972 6.794 11.374 1.00 0.00 H new ATOM 216 N ASP A 53 9.148 3.350 12.068 1.00 0.00 N ATOM 217 CA ASP A 53 7.783 2.875 12.364 1.00 0.00 C ATOM 218 C ASP A 53 6.772 3.758 13.081 1.00 0.00 C ATOM 219 O ASP A 53 5.621 3.351 13.231 1.00 0.00 O ATOM 220 CB ASP A 53 7.844 1.485 13.017 1.00 0.00 C ATOM 221 CG ASP A 53 8.232 0.359 12.047 1.00 0.00 C ATOM 222 OD1 ASP A 53 8.624 0.666 10.896 1.00 0.00 O ATOM 223 OD2 ASP A 53 8.160 -0.796 12.512 1.00 0.00 O ATOM 0 H ASP A 53 9.344 3.339 11.067 1.00 0.00 H new ATOM 0 HA ASP A 53 7.351 2.878 11.363 1.00 0.00 H new ATOM 0 HB2 ASP A 53 8.563 1.510 13.836 1.00 0.00 H new ATOM 0 HB3 ASP A 53 6.872 1.256 13.454 1.00 0.00 H new ATOM 224 N GLN A 54 7.110 5.041 13.132 1.00 0.00 N ATOM 225 CA GLN A 54 6.275 6.101 13.735 1.00 0.00 C ATOM 226 C GLN A 54 4.906 6.210 13.048 1.00 0.00 C ATOM 227 O GLN A 54 3.869 6.295 13.695 1.00 0.00 O ATOM 228 CB GLN A 54 7.006 7.437 13.622 1.00 0.00 C ATOM 229 CG GLN A 54 8.368 7.468 14.321 1.00 0.00 C ATOM 230 CD GLN A 54 8.292 7.200 15.827 1.00 0.00 C ATOM 231 OE1 GLN A 54 7.739 7.962 16.599 1.00 0.00 O ATOM 232 NE2 GLN A 54 8.863 6.102 16.270 1.00 0.00 N ATOM 0 H GLN A 54 7.988 5.392 12.750 1.00 0.00 H new ATOM 0 HA GLN A 54 6.104 5.844 14.780 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.146 7.674 12.567 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.376 8.220 14.044 1.00 0.00 H new ATOM 0 HG2 GLN A 54 9.020 6.725 13.861 1.00 0.00 H new ATOM 0 HG3 GLN A 54 8.829 8.442 14.157 1.00 0.00 H new ATOM 0 HE21 GLN A 54 9.324 5.468 15.618 1.00 0.00 H new ATOM 0 HE22 GLN A 54 8.845 5.884 17.266 1.00 0.00 H new ATOM 233 N HIS A 55 4.953 6.147 11.717 1.00 0.00 N ATOM 234 CA HIS A 55 3.765 6.184 10.841 1.00 0.00 C ATOM 235 C HIS A 55 3.690 4.958 9.904 1.00 0.00 C ATOM 236 O HIS A 55 2.963 4.957 8.914 1.00 0.00 O ATOM 237 CB HIS A 55 3.804 7.475 9.998 1.00 0.00 C ATOM 238 CG HIS A 55 3.892 8.773 10.796 1.00 0.00 C ATOM 239 ND1 HIS A 55 4.709 9.789 10.510 1.00 0.00 N ATOM 240 CD2 HIS A 55 3.244 9.083 11.912 1.00 0.00 C ATOM 241 CE1 HIS A 55 4.576 10.710 11.451 1.00 0.00 C ATOM 242 NE2 HIS A 55 3.665 10.268 12.323 1.00 0.00 N ATOM 0 H HIS A 55 5.829 6.067 11.201 1.00 0.00 H new ATOM 0 HA HIS A 55 2.879 6.163 11.476 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.659 7.423 9.324 1.00 0.00 H new ATOM 0 HB3 HIS A 55 2.910 7.510 9.376 1.00 0.00 H new ATOM 0 HD2 HIS A 55 2.500 8.472 12.401 1.00 0.00 H new ATOM 0 HE1 HIS A 55 5.107 11.649 11.504 1.00 0.00 H new ATOM 0 HE2 HIS A 55 3.349 10.759 13.160 1.00 0.00 H new ATOM 243 N ILE A 56 4.361 3.878 10.300 1.00 0.00 N ATOM 244 CA ILE A 56 4.424 2.646 9.515 1.00 0.00 C ATOM 245 C ILE A 56 4.295 1.397 10.417 1.00 0.00 C ATOM 246 O ILE A 56 5.267 0.938 11.014 1.00 0.00 O ATOM 247 CB ILE A 56 5.549 2.636 8.440 1.00 0.00 C ATOM 248 CG1 ILE A 56 5.747 1.270 7.785 1.00 0.00 C ATOM 249 CG2 ILE A 56 6.905 3.170 8.905 1.00 0.00 C ATOM 250 CD1 ILE A 56 4.463 0.716 7.150 1.00 0.00 C ATOM 0 H ILE A 56 4.878 3.832 11.178 1.00 0.00 H new ATOM 0 HA ILE A 56 3.540 2.604 8.879 1.00 0.00 H new ATOM 0 HB ILE A 56 5.166 3.339 7.701 1.00 0.00 H new ATOM 0 HG12 ILE A 56 6.519 1.349 7.020 1.00 0.00 H new ATOM 0 HG13 ILE A 56 6.110 0.564 8.532 1.00 0.00 H new ATOM 0 HG21 ILE A 56 7.618 3.120 8.082 1.00 0.00 H new ATOM 0 HG22 ILE A 56 6.797 4.205 9.228 1.00 0.00 H new ATOM 0 HG23 ILE A 56 7.268 2.566 9.737 1.00 0.00 H new ATOM 0 HD11 ILE A 56 4.669 -0.256 6.702 1.00 0.00 H new ATOM 0 HD12 ILE A 56 3.696 0.607 7.917 1.00 0.00 H new ATOM 0 HD13 ILE A 56 4.112 1.403 6.381 1.00 0.00 H new ATOM 251 N GLN A 57 3.016 1.220 10.737 1.00 0.00 N ATOM 252 CA GLN A 57 2.382 0.016 11.314 1.00 0.00 C ATOM 253 C GLN A 57 0.936 -0.075 10.803 1.00 0.00 C ATOM 254 O GLN A 57 0.197 0.911 10.845 1.00 0.00 O ATOM 255 CB GLN A 57 2.333 0.067 12.844 1.00 0.00 C ATOM 256 CG GLN A 57 3.634 -0.449 13.455 1.00 0.00 C ATOM 257 CD GLN A 57 3.618 -0.269 14.977 1.00 0.00 C ATOM 258 OE1 GLN A 57 3.119 -1.078 15.740 1.00 0.00 O ATOM 259 NE2 GLN A 57 4.117 0.865 15.419 1.00 0.00 N ATOM 0 H GLN A 57 2.335 1.966 10.592 1.00 0.00 H new ATOM 0 HA GLN A 57 2.977 -0.846 11.012 1.00 0.00 H new ATOM 0 HB2 GLN A 57 2.156 1.092 13.171 1.00 0.00 H new ATOM 0 HB3 GLN A 57 1.496 -0.532 13.204 1.00 0.00 H new ATOM 0 HG2 GLN A 57 3.766 -1.502 13.208 1.00 0.00 H new ATOM 0 HG3 GLN A 57 4.482 0.087 13.028 1.00 0.00 H new ATOM 0 HE21 GLN A 57 4.531 1.530 14.765 1.00 0.00 H new ATOM 0 HE22 GLN A 57 4.090 1.080 16.416 1.00 0.00 H new ATOM 260 N LEU A 58 0.649 -1.221 10.194 1.00 0.00 N ATOM 261 CA LEU A 58 -0.659 -1.495 9.553 1.00 0.00 C ATOM 262 C LEU A 58 -1.284 -2.876 9.887 1.00 0.00 C ATOM 263 O LEU A 58 -0.761 -3.599 10.734 1.00 0.00 O ATOM 264 CB LEU A 58 -0.524 -1.268 8.047 1.00 0.00 C ATOM 265 CG LEU A 58 0.566 -2.133 7.401 1.00 0.00 C ATOM 266 CD1 LEU A 58 -0.049 -3.290 6.607 1.00 0.00 C ATOM 267 CD2 LEU A 58 1.388 -1.249 6.473 1.00 0.00 C ATOM 0 H LEU A 58 1.309 -1.995 10.124 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.376 -0.793 9.979 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.479 -1.480 7.567 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.301 -0.217 7.863 1.00 0.00 H new ATOM 0 HG LEU A 58 1.196 -2.562 8.180 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.746 -3.887 6.160 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.641 -3.916 7.275 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.690 -2.891 5.821 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.170 -1.844 6.002 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.740 -0.827 5.704 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.842 -0.442 7.047 1.00 0.00 H new ATOM 268 N GLN A 59 -2.443 -3.153 9.287 1.00 0.00 N ATOM 269 CA GLN A 59 -3.153 -4.439 9.431 1.00 0.00 C ATOM 270 C GLN A 59 -3.745 -4.859 8.077 1.00 0.00 C ATOM 271 O GLN A 59 -4.561 -4.133 7.496 1.00 0.00 O ATOM 272 CB GLN A 59 -4.323 -4.267 10.408 1.00 0.00 C ATOM 273 CG GLN A 59 -4.551 -5.454 11.339 1.00 0.00 C ATOM 274 CD GLN A 59 -5.000 -6.735 10.627 1.00 0.00 C ATOM 275 OE1 GLN A 59 -4.214 -7.598 10.266 1.00 0.00 O ATOM 276 NE2 GLN A 59 -6.291 -6.875 10.438 1.00 0.00 N ATOM 0 H GLN A 59 -2.925 -2.489 8.681 1.00 0.00 H new ATOM 0 HA GLN A 59 -2.449 -5.189 9.792 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -4.147 -3.377 11.012 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -5.234 -4.090 9.836 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -3.628 -5.658 11.882 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -5.303 -5.181 12.080 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -6.934 -6.145 10.745 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -6.652 -7.714 9.984 1.00 0.00 H new ATOM 277 N LEU A 60 -3.437 -6.091 7.696 1.00 0.00 N ATOM 278 CA LEU A 60 -3.933 -6.674 6.441 1.00 0.00 C ATOM 279 C LEU A 60 -5.204 -7.499 6.634 1.00 0.00 C ATOM 280 O LEU A 60 -5.250 -8.727 6.547 1.00 0.00 O ATOM 281 CB LEU A 60 -2.813 -7.520 5.796 1.00 0.00 C ATOM 282 CG LEU A 60 -1.705 -6.617 5.252 1.00 0.00 C ATOM 283 CD1 LEU A 60 -0.352 -7.064 5.815 1.00 0.00 C ATOM 284 CD2 LEU A 60 -1.705 -6.637 3.721 1.00 0.00 C ATOM 0 H LEU A 60 -2.841 -6.717 8.238 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.206 -5.856 5.775 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.400 -8.209 6.533 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -3.226 -8.126 4.989 1.00 0.00 H new ATOM 0 HG LEU A 60 -1.887 -5.590 5.569 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.435 -6.419 5.425 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.371 -6.998 6.903 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.157 -8.094 5.518 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.911 -5.990 3.349 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -1.537 -7.655 3.370 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.667 -6.280 3.352 1.00 0.00 H new ATOM 285 N SER A 61 -6.287 -6.744 6.569 1.00 0.00 N ATOM 286 CA SER A 61 -7.604 -7.201 7.025 1.00 0.00 C ATOM 287 C SER A 61 -8.469 -7.687 5.857 1.00 0.00 C ATOM 288 O SER A 61 -9.378 -7.011 5.373 1.00 0.00 O ATOM 289 CB SER A 61 -8.239 -6.047 7.811 1.00 0.00 C ATOM 290 OG SER A 61 -9.350 -6.533 8.560 1.00 0.00 O ATOM 0 H SER A 61 -6.286 -5.793 6.199 1.00 0.00 H new ATOM 0 HA SER A 61 -7.510 -8.069 7.677 1.00 0.00 H new ATOM 0 HB2 SER A 61 -7.503 -5.601 8.480 1.00 0.00 H new ATOM 0 HB3 SER A 61 -8.564 -5.263 7.127 1.00 0.00 H new ATOM 0 HG SER A 61 -9.754 -5.795 9.063 1.00 0.00 H new ATOM 291 N ALA A 62 -7.996 -8.781 5.289 1.00 0.00 N ATOM 292 CA ALA A 62 -8.689 -9.562 4.260 1.00 0.00 C ATOM 293 C ALA A 62 -10.179 -9.813 4.516 1.00 0.00 C ATOM 294 O ALA A 62 -10.602 -10.198 5.606 1.00 0.00 O ATOM 295 CB ALA A 62 -7.966 -10.896 4.062 1.00 0.00 C ATOM 0 H ALA A 62 -7.086 -9.171 5.535 1.00 0.00 H new ATOM 0 HA ALA A 62 -8.656 -8.949 3.359 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -8.480 -11.478 3.297 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -6.939 -10.710 3.748 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -7.963 -11.451 5.000 1.00 0.00 H new ATOM 296 N GLU A 63 -10.936 -9.343 3.532 1.00 0.00 N ATOM 297 CA GLU A 63 -12.361 -9.650 3.359 1.00 0.00 C ATOM 298 C GLU A 63 -12.569 -10.956 2.579 1.00 0.00 C ATOM 299 O GLU A 63 -13.642 -11.552 2.537 1.00 0.00 O ATOM 300 CB GLU A 63 -12.934 -8.447 2.606 1.00 0.00 C ATOM 301 CG GLU A 63 -14.453 -8.472 2.445 1.00 0.00 C ATOM 302 CD GLU A 63 -14.906 -7.222 1.705 1.00 0.00 C ATOM 303 OE1 GLU A 63 -14.648 -7.161 0.479 1.00 0.00 O ATOM 304 OE2 GLU A 63 -15.415 -6.310 2.400 1.00 0.00 O ATOM 0 H GLU A 63 -10.571 -8.721 2.810 1.00 0.00 H new ATOM 0 HA GLU A 63 -12.861 -9.807 4.315 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -12.651 -7.535 3.132 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.476 -8.400 1.618 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -14.756 -9.363 1.895 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -14.932 -8.522 3.423 1.00 0.00 H new ATOM 305 N SER A 64 -11.506 -11.289 1.849 1.00 0.00 N ATOM 306 CA SER A 64 -11.341 -12.482 1.006 1.00 0.00 C ATOM 307 C SER A 64 -9.834 -12.713 0.853 1.00 0.00 C ATOM 308 O SER A 64 -9.039 -11.825 1.195 1.00 0.00 O ATOM 309 CB SER A 64 -11.958 -12.221 -0.380 1.00 0.00 C ATOM 310 OG SER A 64 -11.216 -11.217 -1.067 1.00 0.00 O ATOM 0 H SER A 64 -10.678 -10.694 1.826 1.00 0.00 H new ATOM 0 HA SER A 64 -11.832 -13.348 1.451 1.00 0.00 H new ATOM 0 HB2 SER A 64 -11.964 -13.142 -0.963 1.00 0.00 H new ATOM 0 HB3 SER A 64 -12.996 -11.906 -0.271 1.00 0.00 H new ATOM 0 HG SER A 64 -11.592 -11.088 -1.963 1.00 0.00 H new ATOM 311 N VAL A 65 -9.469 -13.803 0.184 1.00 0.00 N ATOM 312 CA VAL A 65 -8.053 -14.150 -0.092 1.00 0.00 C ATOM 313 C VAL A 65 -7.367 -13.142 -1.049 1.00 0.00 C ATOM 314 O VAL A 65 -6.155 -13.157 -1.213 1.00 0.00 O ATOM 315 CB VAL A 65 -7.948 -15.606 -0.619 1.00 0.00 C ATOM 316 CG1 VAL A 65 -6.498 -16.098 -0.636 1.00 0.00 C ATOM 317 CG2 VAL A 65 -8.721 -16.601 0.258 1.00 0.00 C ATOM 0 H VAL A 65 -10.136 -14.479 -0.188 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.510 -14.084 0.851 1.00 0.00 H new ATOM 0 HB VAL A 65 -8.368 -15.571 -1.624 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.465 -17.121 -1.011 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.903 -15.455 -1.284 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -6.092 -16.069 0.375 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.617 -17.605 -0.152 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.321 -16.580 1.272 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.775 -16.325 0.278 1.00 0.00 H new ATOM 318 N GLY A 66 -8.170 -12.257 -1.649 1.00 0.00 N ATOM 319 CA GLY A 66 -7.695 -11.205 -2.569 1.00 0.00 C ATOM 320 C GLY A 66 -7.614 -9.845 -1.871 1.00 0.00 C ATOM 321 O GLY A 66 -6.569 -9.374 -1.420 1.00 0.00 O ATOM 0 H GLY A 66 -9.181 -12.247 -1.511 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.713 -11.475 -2.957 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -8.368 -11.137 -3.424 1.00 0.00 H new ATOM 322 N GLU A 67 -8.760 -9.190 -1.858 1.00 0.00 N ATOM 323 CA GLU A 67 -8.957 -7.822 -1.333 1.00 0.00 C ATOM 324 C GLU A 67 -8.866 -7.754 0.200 1.00 0.00 C ATOM 325 O GLU A 67 -9.707 -8.246 0.952 1.00 0.00 O ATOM 326 CB GLU A 67 -10.185 -7.157 -1.941 1.00 0.00 C ATOM 327 CG GLU A 67 -11.523 -7.910 -1.819 1.00 0.00 C ATOM 328 CD GLU A 67 -11.913 -8.665 -3.094 1.00 0.00 C ATOM 329 OE1 GLU A 67 -11.148 -9.577 -3.475 1.00 0.00 O ATOM 330 OE2 GLU A 67 -13.063 -8.454 -3.547 1.00 0.00 O ATOM 0 H GLU A 67 -9.621 -9.598 -2.223 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.116 -7.213 -1.666 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -10.304 -6.178 -1.477 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -9.988 -6.986 -2.999 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -11.460 -8.617 -0.992 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -12.311 -7.199 -1.571 1.00 0.00 H new ATOM 331 N VAL A 68 -7.737 -7.164 0.583 1.00 0.00 N ATOM 332 CA VAL A 68 -7.359 -6.840 1.982 1.00 0.00 C ATOM 333 C VAL A 68 -7.680 -5.377 2.267 1.00 0.00 C ATOM 334 O VAL A 68 -7.410 -4.482 1.472 1.00 0.00 O ATOM 335 CB VAL A 68 -5.879 -7.127 2.328 1.00 0.00 C ATOM 336 CG1 VAL A 68 -5.541 -8.615 2.284 1.00 0.00 C ATOM 337 CG2 VAL A 68 -4.860 -6.348 1.482 1.00 0.00 C ATOM 0 H VAL A 68 -7.023 -6.882 -0.089 1.00 0.00 H new ATOM 0 HA VAL A 68 -7.946 -7.504 2.617 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.787 -6.767 3.353 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.490 -8.757 2.535 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.161 -9.150 3.003 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.730 -9.002 1.283 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.850 -6.613 1.794 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.992 -6.600 0.430 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.014 -5.278 1.621 1.00 0.00 H new ATOM 338 N TYR A 69 -8.341 -5.177 3.400 1.00 0.00 N ATOM 339 CA TYR A 69 -8.520 -3.840 3.995 1.00 0.00 C ATOM 340 C TYR A 69 -7.252 -3.508 4.767 1.00 0.00 C ATOM 341 O TYR A 69 -6.820 -4.279 5.613 1.00 0.00 O ATOM 342 CB TYR A 69 -9.653 -3.829 5.010 1.00 0.00 C ATOM 343 CG TYR A 69 -11.027 -3.900 4.361 1.00 0.00 C ATOM 344 CD1 TYR A 69 -11.472 -2.751 3.679 1.00 0.00 C ATOM 345 CD2 TYR A 69 -11.875 -4.986 4.665 1.00 0.00 C ATOM 346 CE1 TYR A 69 -12.827 -2.687 3.302 1.00 0.00 C ATOM 347 CE2 TYR A 69 -13.239 -4.902 4.298 1.00 0.00 C ATOM 348 CZ TYR A 69 -13.684 -3.753 3.616 1.00 0.00 C ATOM 349 OH TYR A 69 -15.008 -3.620 3.320 1.00 0.00 O ATOM 0 H TYR A 69 -8.771 -5.929 3.939 1.00 0.00 H new ATOM 0 HA TYR A 69 -8.738 -3.133 3.195 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.534 -4.672 5.690 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -9.587 -2.922 5.612 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -10.793 -1.942 3.452 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -11.491 -5.862 5.167 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -13.204 -1.823 2.775 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -13.924 -5.702 4.536 1.00 0.00 H new ATOM 0 HH TYR A 69 -15.353 -4.469 2.974 1.00 0.00 H new ATOM 350 N ILE A 70 -6.613 -2.407 4.419 1.00 0.00 N ATOM 351 CA ILE A 70 -5.445 -2.023 5.220 1.00 0.00 C ATOM 352 C ILE A 70 -5.805 -0.958 6.239 1.00 0.00 C ATOM 353 O ILE A 70 -5.835 0.246 5.994 1.00 0.00 O ATOM 354 CB ILE A 70 -4.217 -1.738 4.341 1.00 0.00 C ATOM 355 CG1 ILE A 70 -3.951 -2.963 3.438 1.00 0.00 C ATOM 356 CG2 ILE A 70 -3.000 -1.376 5.202 1.00 0.00 C ATOM 357 CD1 ILE A 70 -2.785 -2.855 2.435 1.00 0.00 C ATOM 0 H ILE A 70 -6.853 -1.792 3.642 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.127 -2.872 5.825 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.410 -0.875 3.703 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.766 -3.824 4.081 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.861 -3.174 2.877 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.144 -1.179 4.557 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -3.223 -0.487 5.791 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.767 -2.205 5.870 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -2.708 -3.781 1.865 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.967 -2.024 1.754 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.854 -2.683 2.976 1.00 0.00 H new ATOM 358 N LYS A 71 -6.192 -1.485 7.388 1.00 0.00 N ATOM 359 CA LYS A 71 -6.401 -0.706 8.615 1.00 0.00 C ATOM 360 C LYS A 71 -4.999 -0.333 9.079 1.00 0.00 C ATOM 361 O LYS A 71 -4.223 -1.166 9.539 1.00 0.00 O ATOM 362 CB LYS A 71 -7.055 -1.616 9.645 1.00 0.00 C ATOM 363 CG LYS A 71 -7.258 -0.929 11.001 1.00 0.00 C ATOM 364 CD LYS A 71 -8.334 0.155 10.980 1.00 0.00 C ATOM 365 CE LYS A 71 -9.010 0.282 12.353 1.00 0.00 C ATOM 366 NZ LYS A 71 -8.044 0.697 13.372 1.00 0.00 N ATOM 0 H LYS A 71 -6.375 -2.482 7.505 1.00 0.00 H new ATOM 0 HA LYS A 71 -7.030 0.172 8.470 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -8.020 -1.953 9.265 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.439 -2.505 9.782 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -7.525 -1.681 11.744 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.314 -0.487 11.320 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -7.889 1.110 10.700 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -9.081 -0.083 10.223 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -9.822 1.008 12.298 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.454 -0.673 12.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -7.978 -0.036 14.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -7.111 0.831 12.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -8.355 1.591 13.802 1.00 0.00 H new ATOM 367 N SER A 72 -4.689 0.932 8.959 1.00 0.00 N ATOM 368 CA SER A 72 -3.341 1.459 9.254 1.00 0.00 C ATOM 369 C SER A 72 -3.274 1.788 10.760 1.00 0.00 C ATOM 370 O SER A 72 -3.474 2.917 11.182 1.00 0.00 O ATOM 371 CB SER A 72 -3.032 2.674 8.384 1.00 0.00 C ATOM 372 OG SER A 72 -3.340 2.409 7.006 1.00 0.00 O ATOM 0 H SER A 72 -5.352 1.645 8.654 1.00 0.00 H new ATOM 0 HA SER A 72 -2.580 0.714 9.019 1.00 0.00 H new ATOM 0 HB2 SER A 72 -3.609 3.531 8.731 1.00 0.00 H new ATOM 0 HB3 SER A 72 -1.979 2.938 8.481 1.00 0.00 H new ATOM 0 HG SER A 72 -4.304 2.511 6.861 1.00 0.00 H new ATOM 373 N THR A 73 -3.487 0.683 11.473 1.00 0.00 N ATOM 374 CA THR A 73 -3.531 0.514 12.940 1.00 0.00 C ATOM 375 C THR A 73 -3.046 1.683 13.802 1.00 0.00 C ATOM 376 O THR A 73 -3.834 2.250 14.559 1.00 0.00 O ATOM 377 CB THR A 73 -2.774 -0.748 13.374 1.00 0.00 C ATOM 378 OG1 THR A 73 -1.426 -0.701 12.893 1.00 0.00 O ATOM 379 CG2 THR A 73 -3.485 -2.006 12.868 1.00 0.00 C ATOM 0 H THR A 73 -3.650 -0.206 11.001 1.00 0.00 H new ATOM 0 HA THR A 73 -4.602 0.443 13.128 1.00 0.00 H new ATOM 0 HB THR A 73 -2.755 -0.787 14.463 1.00 0.00 H new ATOM 0 HG1 THR A 73 -0.949 -1.509 13.176 1.00 0.00 H new ATOM 0 HG21 THR A 73 -2.932 -2.890 13.187 1.00 0.00 H new ATOM 0 HG22 THR A 73 -4.495 -2.043 13.277 1.00 0.00 H new ATOM 0 HG23 THR A 73 -3.535 -1.983 11.779 1.00 0.00 H new ATOM 380 N GLU A 74 -1.870 2.192 13.444 1.00 0.00 N ATOM 381 CA GLU A 74 -1.156 3.257 14.168 1.00 0.00 C ATOM 382 C GLU A 74 -1.927 4.584 14.214 1.00 0.00 C ATOM 383 O GLU A 74 -2.057 5.213 15.261 1.00 0.00 O ATOM 384 CB GLU A 74 0.178 3.447 13.458 1.00 0.00 C ATOM 385 CG GLU A 74 1.218 3.992 14.429 1.00 0.00 C ATOM 386 CD GLU A 74 2.658 3.706 13.995 1.00 0.00 C ATOM 387 OE1 GLU A 74 2.889 3.487 12.775 1.00 0.00 O ATOM 388 OE2 GLU A 74 3.494 3.606 14.915 1.00 0.00 O ATOM 0 H GLU A 74 -1.367 1.869 12.618 1.00 0.00 H new ATOM 0 HA GLU A 74 -1.031 2.959 15.209 1.00 0.00 H new ATOM 0 HB2 GLU A 74 0.517 2.497 13.046 1.00 0.00 H new ATOM 0 HB3 GLU A 74 0.058 4.133 12.620 1.00 0.00 H new ATOM 0 HG2 GLU A 74 1.083 5.069 14.529 1.00 0.00 H new ATOM 0 HG3 GLU A 74 1.049 3.557 15.414 1.00 0.00 H new ATOM 389 N THR A 75 -2.475 4.931 13.061 1.00 0.00 N ATOM 390 CA THR A 75 -3.306 6.142 12.865 1.00 0.00 C ATOM 391 C THR A 75 -4.804 5.814 12.951 1.00 0.00 C ATOM 392 O THR A 75 -5.644 6.713 12.901 1.00 0.00 O ATOM 393 CB THR A 75 -3.033 6.794 11.507 1.00 0.00 C ATOM 394 OG1 THR A 75 -3.289 5.874 10.442 1.00 0.00 O ATOM 395 CG2 THR A 75 -1.619 7.375 11.424 1.00 0.00 C ATOM 0 H THR A 75 -2.362 4.379 12.210 1.00 0.00 H new ATOM 0 HA THR A 75 -3.036 6.833 13.663 1.00 0.00 H new ATOM 0 HB THR A 75 -3.721 7.632 11.400 1.00 0.00 H new ATOM 0 HG1 THR A 75 -3.483 4.988 10.814 1.00 0.00 H new ATOM 0 HG21 THR A 75 -1.469 7.828 10.444 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.491 8.133 12.197 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.889 6.579 11.572 1.00 0.00 H new ATOM 396 N GLY A 76 -5.082 4.511 12.861 1.00 0.00 N ATOM 397 CA GLY A 76 -6.407 3.879 12.914 1.00 0.00 C ATOM 398 C GLY A 76 -7.226 4.074 11.616 1.00 0.00 C ATOM 399 O GLY A 76 -8.447 4.050 11.649 1.00 0.00 O ATOM 0 H GLY A 76 -4.340 3.822 12.741 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.287 2.812 13.104 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.966 4.291 13.754 1.00 0.00 H new ATOM 400 N GLN A 77 -6.521 4.043 10.485 1.00 0.00 N ATOM 401 CA GLN A 77 -7.085 4.483 9.192 1.00 0.00 C ATOM 402 C GLN A 77 -7.052 3.457 8.049 1.00 0.00 C ATOM 403 O GLN A 77 -5.998 2.938 7.687 1.00 0.00 O ATOM 404 CB GLN A 77 -6.361 5.743 8.758 1.00 0.00 C ATOM 405 CG GLN A 77 -6.815 6.963 9.568 1.00 0.00 C ATOM 406 CD GLN A 77 -5.847 8.143 9.476 1.00 0.00 C ATOM 407 OE1 GLN A 77 -5.100 8.359 8.529 1.00 0.00 O ATOM 408 NE2 GLN A 77 -5.747 8.846 10.587 1.00 0.00 N ATOM 0 H GLN A 77 -5.556 3.718 10.430 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.146 4.646 9.379 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -5.286 5.605 8.878 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -6.543 5.921 7.698 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -7.797 7.279 9.216 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -6.928 6.675 10.613 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -6.375 8.657 11.368 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -5.042 9.579 10.665 1.00 0.00 H new ATOM 409 N TYR A 78 -8.176 3.340 7.363 1.00 0.00 N ATOM 410 CA TYR A 78 -8.339 2.479 6.179 1.00 0.00 C ATOM 411 C TYR A 78 -7.679 3.081 4.936 1.00 0.00 C ATOM 412 O TYR A 78 -8.140 4.079 4.382 1.00 0.00 O ATOM 413 CB TYR A 78 -9.822 2.205 5.896 1.00 0.00 C ATOM 414 CG TYR A 78 -10.436 1.344 6.996 1.00 0.00 C ATOM 415 CD1 TYR A 78 -10.226 -0.051 6.961 1.00 0.00 C ATOM 416 CD2 TYR A 78 -11.076 1.984 8.076 1.00 0.00 C ATOM 417 CE1 TYR A 78 -10.658 -0.826 8.056 1.00 0.00 C ATOM 418 CE2 TYR A 78 -11.508 1.209 9.171 1.00 0.00 C ATOM 419 CZ TYR A 78 -11.288 -0.186 9.146 1.00 0.00 C ATOM 420 OH TYR A 78 -11.709 -0.941 10.190 1.00 0.00 O ATOM 0 H TYR A 78 -9.026 3.847 7.610 1.00 0.00 H new ATOM 0 HA TYR A 78 -7.839 1.538 6.406 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -10.363 3.149 5.823 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -9.926 1.702 4.934 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -9.744 -0.515 6.113 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -11.233 3.052 8.065 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -10.509 -1.896 8.062 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -11.998 1.673 10.014 1.00 0.00 H new ATOM 0 HH TYR A 78 -12.122 -0.364 10.866 1.00 0.00 H new ATOM 421 N LEU A 79 -6.599 2.412 4.542 1.00 0.00 N ATOM 422 CA LEU A 79 -5.745 2.779 3.398 1.00 0.00 C ATOM 423 C LEU A 79 -6.522 2.593 2.095 1.00 0.00 C ATOM 424 O LEU A 79 -6.882 1.485 1.725 1.00 0.00 O ATOM 425 CB LEU A 79 -4.526 1.851 3.462 1.00 0.00 C ATOM 426 CG LEU A 79 -3.294 2.433 2.776 1.00 0.00 C ATOM 427 CD1 LEU A 79 -2.720 3.570 3.629 1.00 0.00 C ATOM 428 CD2 LEU A 79 -2.205 1.371 2.627 1.00 0.00 C ATOM 0 H LEU A 79 -6.277 1.571 5.021 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.432 3.822 3.435 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.289 1.643 4.506 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.778 0.898 2.997 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.596 2.795 1.793 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.840 3.985 3.138 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -3.471 4.351 3.748 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.440 3.184 4.609 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.336 1.808 2.135 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.918 1.003 3.612 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.583 0.543 2.027 1.00 0.00 H new ATOM 429 N ALA A 80 -6.829 3.738 1.495 1.00 0.00 N ATOM 430 CA ALA A 80 -7.945 3.825 0.541 1.00 0.00 C ATOM 431 C ALA A 80 -7.698 4.775 -0.634 1.00 0.00 C ATOM 432 O ALA A 80 -7.414 5.957 -0.465 1.00 0.00 O ATOM 433 CB ALA A 80 -9.196 4.232 1.309 1.00 0.00 C ATOM 0 H ALA A 80 -6.330 4.615 1.646 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.062 2.842 0.084 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -10.038 4.303 0.621 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -9.413 3.485 2.073 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -9.033 5.199 1.784 1.00 0.00 H new ATOM 434 N MET A 81 -7.954 4.246 -1.824 1.00 0.00 N ATOM 435 CA MET A 81 -7.612 4.945 -3.071 1.00 0.00 C ATOM 436 C MET A 81 -8.674 5.916 -3.623 1.00 0.00 C ATOM 437 O MET A 81 -9.880 5.721 -3.512 1.00 0.00 O ATOM 438 CB MET A 81 -7.242 3.881 -4.120 1.00 0.00 C ATOM 439 CG MET A 81 -6.552 4.502 -5.323 1.00 0.00 C ATOM 440 SD MET A 81 -6.891 3.619 -6.879 1.00 0.00 S ATOM 441 CE MET A 81 -5.389 2.698 -7.000 1.00 0.00 C ATOM 0 H MET A 81 -8.396 3.337 -1.959 1.00 0.00 H new ATOM 0 HA MET A 81 -6.776 5.604 -2.836 1.00 0.00 H new ATOM 0 HB2 MET A 81 -6.587 3.135 -3.668 1.00 0.00 H new ATOM 0 HB3 MET A 81 -8.143 3.360 -4.445 1.00 0.00 H new ATOM 0 HG2 MET A 81 -6.874 5.539 -5.423 1.00 0.00 H new ATOM 0 HG3 MET A 81 -5.476 4.518 -5.149 1.00 0.00 H new ATOM 0 HE1 MET A 81 -5.586 1.744 -7.488 1.00 0.00 H new ATOM 0 HE2 MET A 81 -4.662 3.262 -7.585 1.00 0.00 H new ATOM 0 HE3 MET A 81 -4.990 2.519 -6.001 1.00 0.00 H new ATOM 442 N ASP A 82 -8.124 7.069 -3.971 1.00 0.00 N ATOM 443 CA ASP A 82 -8.730 8.104 -4.826 1.00 0.00 C ATOM 444 C ASP A 82 -8.377 7.785 -6.295 1.00 0.00 C ATOM 445 O ASP A 82 -7.315 7.246 -6.588 1.00 0.00 O ATOM 446 CB ASP A 82 -8.116 9.435 -4.350 1.00 0.00 C ATOM 447 CG ASP A 82 -8.691 10.676 -5.012 1.00 0.00 C ATOM 448 OD1 ASP A 82 -9.868 10.978 -4.714 1.00 0.00 O ATOM 449 OD2 ASP A 82 -7.977 11.212 -5.886 1.00 0.00 O ATOM 0 H ASP A 82 -7.191 7.332 -3.652 1.00 0.00 H new ATOM 0 HA ASP A 82 -9.817 8.152 -4.761 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -8.255 9.518 -3.272 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -7.042 9.409 -4.531 1.00 0.00 H new ATOM 450 N THR A 83 -9.111 8.453 -7.167 1.00 0.00 N ATOM 451 CA THR A 83 -9.014 8.350 -8.647 1.00 0.00 C ATOM 452 C THR A 83 -7.887 9.145 -9.302 1.00 0.00 C ATOM 453 O THR A 83 -7.943 9.561 -10.457 1.00 0.00 O ATOM 454 CB THR A 83 -10.347 8.768 -9.250 1.00 0.00 C ATOM 455 OG1 THR A 83 -10.842 9.909 -8.532 1.00 0.00 O ATOM 456 CG2 THR A 83 -11.353 7.619 -9.238 1.00 0.00 C ATOM 0 H THR A 83 -9.827 9.116 -6.870 1.00 0.00 H new ATOM 0 HA THR A 83 -8.769 7.308 -8.852 1.00 0.00 H new ATOM 0 HB THR A 83 -10.200 9.037 -10.296 1.00 0.00 H new ATOM 0 HG1 THR A 83 -11.436 9.610 -7.812 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.293 7.954 -9.676 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.959 6.785 -9.818 1.00 0.00 H new ATOM 0 HG23 THR A 83 -11.526 7.297 -8.211 1.00 0.00 H new ATOM 457 N ASP A 84 -6.873 9.372 -8.485 1.00 0.00 N ATOM 458 CA ASP A 84 -5.527 9.798 -8.901 1.00 0.00 C ATOM 459 C ASP A 84 -4.424 8.847 -8.419 1.00 0.00 C ATOM 460 O ASP A 84 -3.236 9.103 -8.559 1.00 0.00 O ATOM 461 CB ASP A 84 -5.253 11.206 -8.380 1.00 0.00 C ATOM 462 CG ASP A 84 -6.060 12.234 -9.157 1.00 0.00 C ATOM 463 OD1 ASP A 84 -5.587 12.638 -10.246 1.00 0.00 O ATOM 464 OD2 ASP A 84 -7.139 12.601 -8.647 1.00 0.00 O ATOM 0 H ASP A 84 -6.957 9.264 -7.474 1.00 0.00 H new ATOM 0 HA ASP A 84 -5.508 9.783 -9.991 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -5.506 11.263 -7.321 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -4.190 11.430 -8.466 1.00 0.00 H new ATOM 465 N GLY A 85 -4.886 7.661 -8.000 1.00 0.00 N ATOM 466 CA GLY A 85 -4.138 6.684 -7.192 1.00 0.00 C ATOM 467 C GLY A 85 -3.449 7.344 -5.994 1.00 0.00 C ATOM 468 O GLY A 85 -2.245 7.174 -5.780 1.00 0.00 O ATOM 0 H GLY A 85 -5.829 7.342 -8.223 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -4.818 5.909 -6.838 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -3.391 6.193 -7.816 1.00 0.00 H new ATOM 469 N LEU A 86 -4.263 8.082 -5.266 1.00 0.00 N ATOM 470 CA LEU A 86 -3.813 8.787 -4.060 1.00 0.00 C ATOM 471 C LEU A 86 -4.534 8.097 -2.909 1.00 0.00 C ATOM 472 O LEU A 86 -5.757 7.954 -2.937 1.00 0.00 O ATOM 473 CB LEU A 86 -4.210 10.266 -4.107 1.00 0.00 C ATOM 474 CG LEU A 86 -3.437 11.056 -3.046 1.00 0.00 C ATOM 475 CD1 LEU A 86 -3.059 12.435 -3.583 1.00 0.00 C ATOM 476 CD2 LEU A 86 -4.222 11.166 -1.725 1.00 0.00 C ATOM 0 H LEU A 86 -5.251 8.216 -5.483 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.728 8.754 -3.959 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.004 10.674 -5.096 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.282 10.368 -3.937 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.521 10.508 -2.823 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.510 12.985 -2.819 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -2.433 12.322 -4.468 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.963 12.984 -3.846 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.638 11.734 -1.001 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.169 11.675 -1.906 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.416 10.168 -1.333 1.00 0.00 H new ATOM 477 N LEU A 87 -3.747 7.597 -1.974 1.00 0.00 N ATOM 478 CA LEU A 87 -4.347 6.925 -0.811 1.00 0.00 C ATOM 479 C LEU A 87 -4.581 7.916 0.319 1.00 0.00 C ATOM 480 O LEU A 87 -3.691 8.610 0.800 1.00 0.00 O ATOM 481 CB LEU A 87 -3.540 5.769 -0.225 1.00 0.00 C ATOM 482 CG LEU A 87 -3.029 4.761 -1.261 1.00 0.00 C ATOM 483 CD1 LEU A 87 -2.048 3.791 -0.610 1.00 0.00 C ATOM 484 CD2 LEU A 87 -4.197 4.025 -1.886 1.00 0.00 C ATOM 0 H LEU A 87 -2.728 7.634 -1.983 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.273 6.510 -1.209 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.687 6.176 0.318 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.159 5.242 0.502 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.501 5.293 -2.052 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.691 3.080 -1.355 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -1.202 4.346 -0.204 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.548 3.253 0.195 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.826 3.311 -2.621 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.749 3.494 -1.111 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.857 4.740 -2.377 1.00 0.00 H new ATOM 485 N TYR A 88 -5.837 7.868 0.711 1.00 0.00 N ATOM 486 CA TYR A 88 -6.307 8.593 1.904 1.00 0.00 C ATOM 487 C TYR A 88 -6.694 7.606 3.007 1.00 0.00 C ATOM 488 O TYR A 88 -7.264 6.541 2.775 1.00 0.00 O ATOM 489 CB TYR A 88 -7.421 9.611 1.612 1.00 0.00 C ATOM 490 CG TYR A 88 -8.635 9.027 0.898 1.00 0.00 C ATOM 491 CD1 TYR A 88 -9.640 8.369 1.656 1.00 0.00 C ATOM 492 CD2 TYR A 88 -8.617 8.995 -0.512 1.00 0.00 C ATOM 493 CE1 TYR A 88 -10.608 7.599 0.973 1.00 0.00 C ATOM 494 CE2 TYR A 88 -9.586 8.225 -1.175 1.00 0.00 C ATOM 495 CZ TYR A 88 -10.542 7.515 -0.427 1.00 0.00 C ATOM 496 OH TYR A 88 -11.352 6.652 -1.099 1.00 0.00 O ATOM 0 H TYR A 88 -6.563 7.337 0.229 1.00 0.00 H new ATOM 0 HA TYR A 88 -5.471 9.196 2.258 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -7.747 10.055 2.553 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -7.010 10.417 1.004 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -9.664 8.455 2.732 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -7.876 9.549 -1.068 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -11.385 7.084 1.518 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -9.597 8.178 -2.254 1.00 0.00 H new ATOM 0 HH TYR A 88 -10.894 6.333 -1.905 1.00 0.00 H new ATOM 497 N GLY A 89 -6.162 7.940 4.168 1.00 0.00 N ATOM 498 CA GLY A 89 -6.463 7.269 5.436 1.00 0.00 C ATOM 499 C GLY A 89 -7.922 7.566 5.820 1.00 0.00 C ATOM 500 O GLY A 89 -8.260 8.721 6.070 1.00 0.00 O ATOM 0 H GLY A 89 -5.492 8.702 4.267 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -6.309 6.194 5.340 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.788 7.619 6.217 1.00 0.00 H new ATOM 501 N SER A 90 -8.771 6.578 5.586 1.00 0.00 N ATOM 502 CA SER A 90 -10.222 6.726 5.818 1.00 0.00 C ATOM 503 C SER A 90 -10.774 6.012 7.042 1.00 0.00 C ATOM 504 O SER A 90 -10.191 5.111 7.638 1.00 0.00 O ATOM 505 CB SER A 90 -10.965 6.279 4.552 1.00 0.00 C ATOM 506 OG SER A 90 -11.005 4.851 4.433 1.00 0.00 O ATOM 0 H SER A 90 -8.493 5.661 5.236 1.00 0.00 H new ATOM 0 HA SER A 90 -10.388 7.781 6.035 1.00 0.00 H new ATOM 0 HB2 SER A 90 -11.982 6.671 4.570 1.00 0.00 H new ATOM 0 HB3 SER A 90 -10.476 6.703 3.675 1.00 0.00 H new ATOM 0 HG SER A 90 -10.097 4.509 4.294 1.00 0.00 H new ATOM 507 N GLN A 91 -11.917 6.542 7.413 1.00 0.00 N ATOM 508 CA GLN A 91 -12.783 6.067 8.516 1.00 0.00 C ATOM 509 C GLN A 91 -13.771 4.974 8.058 1.00 0.00 C ATOM 510 O GLN A 91 -14.553 4.450 8.841 1.00 0.00 O ATOM 511 CB GLN A 91 -13.443 7.294 9.082 1.00 0.00 C ATOM 512 CG GLN A 91 -14.355 7.987 8.089 1.00 0.00 C ATOM 513 CD GLN A 91 -13.611 9.022 7.232 1.00 0.00 C ATOM 514 OE1 GLN A 91 -13.122 8.746 6.145 1.00 0.00 O ATOM 515 NE2 GLN A 91 -13.304 10.158 7.821 1.00 0.00 N ATOM 0 H GLN A 91 -12.305 7.359 6.942 1.00 0.00 H new ATOM 0 HA GLN A 91 -12.206 5.567 9.293 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -14.020 7.016 9.964 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -12.675 7.994 9.411 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -14.812 7.241 7.438 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -15.165 8.480 8.627 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -13.711 10.389 8.727 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -12.659 10.808 7.371 1.00 0.00 H new ATOM 516 N THR A 92 -13.701 4.649 6.765 1.00 0.00 N ATOM 517 CA THR A 92 -14.652 3.759 6.090 1.00 0.00 C ATOM 518 C THR A 92 -13.959 2.562 5.414 1.00 0.00 C ATOM 519 O THR A 92 -13.153 2.756 4.497 1.00 0.00 O ATOM 520 CB THR A 92 -15.472 4.501 5.028 1.00 0.00 C ATOM 521 OG1 THR A 92 -14.594 5.213 4.149 1.00 0.00 O ATOM 522 CG2 THR A 92 -16.510 5.425 5.656 1.00 0.00 C ATOM 0 H THR A 92 -12.971 5.002 6.147 1.00 0.00 H new ATOM 0 HA THR A 92 -15.312 3.392 6.876 1.00 0.00 H new ATOM 0 HB THR A 92 -16.027 3.766 4.445 1.00 0.00 H new ATOM 0 HG1 THR A 92 -13.773 4.695 4.016 1.00 0.00 H new ATOM 0 HG21 THR A 92 -17.069 5.932 4.870 1.00 0.00 H new ATOM 0 HG22 THR A 92 -17.195 4.839 6.269 1.00 0.00 H new ATOM 0 HG23 THR A 92 -16.008 6.165 6.279 1.00 0.00 H new ATOM 523 N PRO A 93 -14.262 1.352 5.885 1.00 0.00 N ATOM 524 CA PRO A 93 -13.870 0.122 5.164 1.00 0.00 C ATOM 525 C PRO A 93 -14.820 -0.111 3.988 1.00 0.00 C ATOM 526 O PRO A 93 -15.980 -0.488 4.147 1.00 0.00 O ATOM 527 CB PRO A 93 -13.908 -0.971 6.220 1.00 0.00 C ATOM 528 CG PRO A 93 -14.941 -0.492 7.242 1.00 0.00 C ATOM 529 CD PRO A 93 -14.807 1.036 7.213 1.00 0.00 C ATOM 0 HA PRO A 93 -12.878 0.165 4.714 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -14.195 -1.929 5.787 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.930 -1.110 6.681 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -15.948 -0.810 6.972 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -14.736 -0.892 8.235 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -15.772 1.519 7.367 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -14.145 1.388 8.004 1.00 0.00 H new ATOM 530 N ASN A 94 -14.325 0.293 2.820 1.00 0.00 N ATOM 531 CA ASN A 94 -15.109 0.297 1.569 1.00 0.00 C ATOM 532 C ASN A 94 -14.277 -0.337 0.442 1.00 0.00 C ATOM 533 O ASN A 94 -13.050 -0.405 0.537 1.00 0.00 O ATOM 534 CB ASN A 94 -15.412 1.768 1.283 1.00 0.00 C ATOM 535 CG ASN A 94 -16.605 1.996 0.350 1.00 0.00 C ATOM 536 OD1 ASN A 94 -17.198 1.096 -0.240 1.00 0.00 O ATOM 537 ND2 ASN A 94 -16.885 3.256 0.112 1.00 0.00 N ATOM 0 H ASN A 94 -13.369 0.629 2.705 1.00 0.00 H new ATOM 0 HA ASN A 94 -16.031 -0.280 1.646 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -15.602 2.278 2.227 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -14.528 2.230 0.843 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -17.603 3.499 -0.570 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -16.384 3.992 0.609 1.00 0.00 H new ATOM 538 N GLU A 95 -14.924 -0.427 -0.718 1.00 0.00 N ATOM 539 CA GLU A 95 -14.417 -0.912 -2.018 1.00 0.00 C ATOM 540 C GLU A 95 -13.001 -0.418 -2.393 1.00 0.00 C ATOM 541 O GLU A 95 -12.152 -1.181 -2.831 1.00 0.00 O ATOM 542 CB GLU A 95 -15.454 -0.465 -3.057 1.00 0.00 C ATOM 543 CG GLU A 95 -15.175 -0.933 -4.489 1.00 0.00 C ATOM 544 CD GLU A 95 -16.272 -0.416 -5.417 1.00 0.00 C ATOM 545 OE1 GLU A 95 -16.110 0.717 -5.921 1.00 0.00 O ATOM 546 OE2 GLU A 95 -17.277 -1.153 -5.570 1.00 0.00 O ATOM 0 H GLU A 95 -15.900 -0.140 -0.788 1.00 0.00 H new ATOM 0 HA GLU A 95 -14.298 -1.995 -1.972 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -16.433 -0.835 -2.754 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -15.508 0.624 -3.050 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -14.203 -0.568 -4.819 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -15.136 -2.022 -4.526 1.00 0.00 H new ATOM 547 N GLU A 96 -12.720 0.801 -1.953 1.00 0.00 N ATOM 548 CA GLU A 96 -11.489 1.548 -2.267 1.00 0.00 C ATOM 549 C GLU A 96 -10.279 1.121 -1.456 1.00 0.00 C ATOM 550 O GLU A 96 -9.139 1.252 -1.909 1.00 0.00 O ATOM 551 CB GLU A 96 -11.689 3.050 -2.040 1.00 0.00 C ATOM 552 CG GLU A 96 -12.642 3.695 -3.055 1.00 0.00 C ATOM 553 CD GLU A 96 -14.104 3.294 -2.860 1.00 0.00 C ATOM 554 OE1 GLU A 96 -14.613 3.550 -1.743 1.00 0.00 O ATOM 555 OE2 GLU A 96 -14.656 2.638 -3.776 1.00 0.00 O ATOM 0 H GLU A 96 -13.356 1.321 -1.349 1.00 0.00 H new ATOM 0 HA GLU A 96 -11.292 1.323 -3.315 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -12.078 3.210 -1.034 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -10.722 3.550 -2.091 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -12.558 4.779 -2.982 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.329 3.418 -4.062 1.00 0.00 H new ATOM 556 N CYS A 97 -10.572 0.841 -0.193 1.00 0.00 N ATOM 557 CA CYS A 97 -9.616 0.287 0.763 1.00 0.00 C ATOM 558 C CYS A 97 -9.285 -1.197 0.508 1.00 0.00 C ATOM 559 O CYS A 97 -8.252 -1.705 0.926 1.00 0.00 O ATOM 560 CB CYS A 97 -10.103 0.399 2.218 1.00 0.00 C ATOM 561 SG CYS A 97 -8.881 -0.115 3.478 1.00 0.00 S ATOM 0 H CYS A 97 -11.498 0.995 0.206 1.00 0.00 H new ATOM 0 HA CYS A 97 -8.721 0.891 0.614 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -10.391 1.432 2.411 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -11.001 -0.209 2.334 1.00 0.00 H new ATOM 0 HG CYS A 97 -7.708 0.343 3.157 1.00 0.00 H new ATOM 562 N LEU A 98 -10.211 -1.848 -0.183 1.00 0.00 N ATOM 563 CA LEU A 98 -10.056 -3.246 -0.619 1.00 0.00 C ATOM 564 C LEU A 98 -8.994 -3.345 -1.696 1.00 0.00 C ATOM 565 O LEU A 98 -9.087 -2.769 -2.770 1.00 0.00 O ATOM 566 CB LEU A 98 -11.422 -3.760 -1.074 1.00 0.00 C ATOM 567 CG LEU A 98 -12.236 -4.119 0.161 1.00 0.00 C ATOM 568 CD1 LEU A 98 -13.733 -4.152 -0.170 1.00 0.00 C ATOM 569 CD2 LEU A 98 -11.804 -5.418 0.850 1.00 0.00 C ATOM 0 H LEU A 98 -11.097 -1.428 -0.462 1.00 0.00 H new ATOM 0 HA LEU A 98 -9.713 -3.877 0.201 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -11.938 -2.999 -1.660 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -11.304 -4.632 -1.717 1.00 0.00 H new ATOM 0 HG LEU A 98 -12.037 -3.327 0.883 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -14.298 -4.410 0.726 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -14.048 -3.172 -0.528 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.918 -4.897 -0.944 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -12.437 -5.597 1.719 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -11.902 -6.250 0.153 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.765 -5.333 1.169 1.00 0.00 H new ATOM 570 N PHE A 99 -7.891 -3.856 -1.187 1.00 0.00 N ATOM 571 CA PHE A 99 -6.633 -3.964 -1.952 1.00 0.00 C ATOM 572 C PHE A 99 -6.301 -5.428 -2.236 1.00 0.00 C ATOM 573 O PHE A 99 -6.041 -6.245 -1.353 1.00 0.00 O ATOM 574 CB PHE A 99 -5.469 -3.339 -1.208 1.00 0.00 C ATOM 575 CG PHE A 99 -5.540 -1.831 -0.899 1.00 0.00 C ATOM 576 CD1 PHE A 99 -6.401 -0.972 -1.640 1.00 0.00 C ATOM 577 CD2 PHE A 99 -4.508 -1.283 -0.108 1.00 0.00 C ATOM 578 CE1 PHE A 99 -6.201 0.414 -1.610 1.00 0.00 C ATOM 579 CE2 PHE A 99 -4.297 0.102 -0.078 1.00 0.00 C ATOM 580 CZ PHE A 99 -5.149 0.941 -0.829 1.00 0.00 C ATOM 0 H PHE A 99 -7.826 -4.212 -0.233 1.00 0.00 H new ATOM 0 HA PHE A 99 -6.784 -3.426 -2.888 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -5.352 -3.869 -0.263 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.565 -3.520 -1.789 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.208 -1.389 -2.225 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.877 -1.935 0.478 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -6.843 1.071 -2.177 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -3.495 0.521 0.511 1.00 0.00 H new ATOM 0 HZ PHE A 99 -4.993 2.009 -0.806 1.00 0.00 H new ATOM 581 N LEU A 100 -6.481 -5.737 -3.503 1.00 0.00 N ATOM 582 CA LEU A 100 -6.234 -7.076 -4.047 1.00 0.00 C ATOM 583 C LEU A 100 -4.793 -7.537 -4.063 1.00 0.00 C ATOM 584 O LEU A 100 -3.972 -7.085 -4.866 1.00 0.00 O ATOM 585 CB LEU A 100 -6.839 -7.254 -5.448 1.00 0.00 C ATOM 586 CG LEU A 100 -8.216 -7.858 -5.204 1.00 0.00 C ATOM 587 CD1 LEU A 100 -9.329 -6.946 -5.737 1.00 0.00 C ATOM 588 CD2 LEU A 100 -8.359 -9.247 -5.824 1.00 0.00 C ATOM 0 H LEU A 100 -6.806 -5.066 -4.199 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.743 -7.718 -3.328 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -6.912 -6.301 -5.971 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -6.223 -7.909 -6.064 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.317 -7.955 -4.123 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -10.299 -7.406 -5.547 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.281 -5.981 -5.233 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -9.199 -6.803 -6.810 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -9.358 -9.634 -5.622 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -8.206 -9.182 -6.901 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -7.616 -9.917 -5.391 1.00 0.00 H new ATOM 589 N GLU A 101 -4.555 -8.435 -3.111 1.00 0.00 N ATOM 590 CA GLU A 101 -3.252 -9.106 -2.952 1.00 0.00 C ATOM 591 C GLU A 101 -2.898 -10.069 -4.090 1.00 0.00 C ATOM 592 O GLU A 101 -3.164 -11.273 -4.119 1.00 0.00 O ATOM 593 CB GLU A 101 -3.064 -9.719 -1.557 1.00 0.00 C ATOM 594 CG GLU A 101 -3.955 -10.904 -1.195 1.00 0.00 C ATOM 595 CD GLU A 101 -3.547 -11.561 0.133 1.00 0.00 C ATOM 596 OE1 GLU A 101 -2.323 -11.711 0.347 1.00 0.00 O ATOM 597 OE2 GLU A 101 -4.464 -11.831 0.927 1.00 0.00 O ATOM 0 H GLU A 101 -5.253 -8.723 -2.425 1.00 0.00 H new ATOM 0 HA GLU A 101 -2.513 -8.309 -3.033 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -2.025 -10.035 -1.463 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.226 -8.935 -0.818 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -4.990 -10.569 -1.128 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -3.910 -11.645 -1.993 1.00 0.00 H new ATOM 598 N ARG A 102 -2.172 -9.463 -5.013 1.00 0.00 N ATOM 599 CA ARG A 102 -1.539 -10.061 -6.192 1.00 0.00 C ATOM 600 C ARG A 102 -0.145 -10.548 -5.759 1.00 0.00 C ATOM 601 O ARG A 102 0.892 -9.917 -5.967 1.00 0.00 O ATOM 602 CB ARG A 102 -1.481 -8.929 -7.207 1.00 0.00 C ATOM 603 CG ARG A 102 -0.911 -9.314 -8.564 1.00 0.00 C ATOM 604 CD ARG A 102 -1.851 -10.223 -9.339 1.00 0.00 C ATOM 605 NE ARG A 102 -1.451 -10.124 -10.742 1.00 0.00 N ATOM 606 CZ ARG A 102 -0.971 -11.094 -11.518 1.00 0.00 C ATOM 607 NH1 ARG A 102 -0.654 -12.297 -11.070 1.00 0.00 N ATOM 608 NH2 ARG A 102 -0.708 -10.813 -12.792 1.00 0.00 N ATOM 0 H ARG A 102 -1.991 -8.461 -4.960 1.00 0.00 H new ATOM 0 HA ARG A 102 -2.063 -10.916 -6.620 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -2.488 -8.537 -7.350 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.880 -8.120 -6.793 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -0.718 -8.412 -9.145 1.00 0.00 H new ATOM 0 HG3 ARG A 102 0.047 -9.816 -8.426 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -1.778 -11.251 -8.985 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -2.888 -9.914 -9.207 1.00 0.00 H new ATOM 0 HE ARG A 102 -1.551 -9.206 -11.176 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -0.773 -12.521 -10.082 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -0.290 -13.001 -11.712 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -0.875 -9.873 -13.152 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -0.340 -11.537 -13.408 1.00 0.00 H new ATOM 609 N LEU A 103 -0.238 -11.468 -4.812 1.00 0.00 N ATOM 610 CA LEU A 103 0.909 -12.250 -4.337 1.00 0.00 C ATOM 611 C LEU A 103 1.402 -13.197 -5.432 1.00 0.00 C ATOM 612 O LEU A 103 0.719 -14.096 -5.923 1.00 0.00 O ATOM 613 CB LEU A 103 0.566 -12.920 -3.010 1.00 0.00 C ATOM 614 CG LEU A 103 1.648 -13.891 -2.477 1.00 0.00 C ATOM 615 CD1 LEU A 103 3.051 -13.283 -2.391 1.00 0.00 C ATOM 616 CD2 LEU A 103 1.209 -14.400 -1.110 1.00 0.00 C ATOM 0 H LEU A 103 -1.114 -11.700 -4.344 1.00 0.00 H new ATOM 0 HA LEU A 103 1.757 -11.599 -4.126 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.391 -12.146 -2.262 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.369 -13.468 -3.126 1.00 0.00 H new ATOM 0 HG LEU A 103 1.732 -14.706 -3.196 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.748 -14.029 -2.009 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.370 -12.963 -3.383 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.035 -12.424 -1.720 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.960 -15.086 -0.719 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.096 -13.558 -0.427 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.256 -14.921 -1.204 1.00 0.00 H new ATOM 617 N GLU A 104 2.501 -12.704 -5.961 1.00 0.00 N ATOM 618 CA GLU A 104 3.224 -13.254 -7.109 1.00 0.00 C ATOM 619 C GLU A 104 4.471 -14.057 -6.692 1.00 0.00 C ATOM 620 O GLU A 104 5.197 -13.705 -5.768 1.00 0.00 O ATOM 621 CB GLU A 104 3.612 -12.061 -7.978 1.00 0.00 C ATOM 622 CG GLU A 104 2.968 -12.139 -9.368 1.00 0.00 C ATOM 623 CD GLU A 104 3.941 -12.666 -10.422 1.00 0.00 C ATOM 624 OE1 GLU A 104 4.363 -13.848 -10.281 1.00 0.00 O ATOM 625 OE2 GLU A 104 4.200 -11.899 -11.369 1.00 0.00 O ATOM 0 H GLU A 104 2.945 -11.865 -5.589 1.00 0.00 H new ATOM 0 HA GLU A 104 2.592 -13.960 -7.648 1.00 0.00 H new ATOM 0 HB2 GLU A 104 3.306 -11.138 -7.486 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.696 -12.023 -8.081 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.093 -12.788 -9.326 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.617 -11.149 -9.661 1.00 0.00 H new ATOM 626 N GLU A 105 4.667 -15.142 -7.443 1.00 0.00 N ATOM 627 CA GLU A 105 5.774 -16.119 -7.301 1.00 0.00 C ATOM 628 C GLU A 105 7.195 -15.532 -7.114 1.00 0.00 C ATOM 629 O GLU A 105 8.013 -16.149 -6.441 1.00 0.00 O ATOM 630 CB GLU A 105 5.690 -17.041 -8.514 1.00 0.00 C ATOM 631 CG GLU A 105 6.439 -18.370 -8.341 1.00 0.00 C ATOM 632 CD GLU A 105 7.925 -18.298 -8.680 1.00 0.00 C ATOM 633 OE1 GLU A 105 8.241 -17.781 -9.769 1.00 0.00 O ATOM 634 OE2 GLU A 105 8.723 -18.846 -7.886 1.00 0.00 O ATOM 0 H GLU A 105 4.035 -15.385 -8.206 1.00 0.00 H new ATOM 0 HA GLU A 105 5.632 -16.649 -6.359 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.642 -17.251 -8.726 1.00 0.00 H new ATOM 0 HB3 GLU A 105 6.092 -16.519 -9.383 1.00 0.00 H new ATOM 0 HG2 GLU A 105 6.329 -18.705 -7.310 1.00 0.00 H new ATOM 0 HG3 GLU A 105 5.970 -19.124 -8.973 1.00 0.00 H new ATOM 635 N ASN A 106 7.488 -14.400 -7.746 1.00 0.00 N ATOM 636 CA ASN A 106 8.763 -13.659 -7.609 1.00 0.00 C ATOM 637 C ASN A 106 8.842 -12.898 -6.268 1.00 0.00 C ATOM 638 O ASN A 106 9.287 -11.758 -6.217 1.00 0.00 O ATOM 639 CB ASN A 106 8.891 -12.686 -8.805 1.00 0.00 C ATOM 640 CG ASN A 106 7.663 -11.796 -9.000 1.00 0.00 C ATOM 641 OD1 ASN A 106 6.555 -12.259 -9.261 1.00 0.00 O ATOM 642 ND2 ASN A 106 7.766 -10.532 -8.682 1.00 0.00 N ATOM 0 H ASN A 106 6.835 -13.950 -8.388 1.00 0.00 H new ATOM 0 HA ASN A 106 9.592 -14.367 -7.612 1.00 0.00 H new ATOM 0 HB2 ASN A 106 9.768 -12.055 -8.658 1.00 0.00 H new ATOM 0 HB3 ASN A 106 9.061 -13.261 -9.715 1.00 0.00 H new ATOM 0 HD21 ASN A 106 6.933 -9.944 -8.653 1.00 0.00 H new ATOM 0 HD22 ASN A 106 8.679 -10.134 -8.463 1.00 0.00 H new ATOM 643 N HIS A 107 8.542 -13.616 -5.191 1.00 0.00 N ATOM 644 CA HIS A 107 8.256 -13.097 -3.838 1.00 0.00 C ATOM 645 C HIS A 107 8.156 -11.587 -3.630 1.00 0.00 C ATOM 646 O HIS A 107 8.954 -10.882 -3.030 1.00 0.00 O ATOM 647 CB HIS A 107 9.107 -13.800 -2.785 1.00 0.00 C ATOM 648 CG HIS A 107 10.612 -13.720 -3.034 1.00 0.00 C ATOM 649 ND1 HIS A 107 11.339 -12.613 -3.200 1.00 0.00 N ATOM 650 CD2 HIS A 107 11.412 -14.765 -3.257 1.00 0.00 C ATOM 651 CE1 HIS A 107 12.566 -12.965 -3.558 1.00 0.00 C ATOM 652 NE2 HIS A 107 12.607 -14.296 -3.594 1.00 0.00 N ATOM 0 H HIS A 107 8.486 -14.634 -5.230 1.00 0.00 H new ATOM 0 HA HIS A 107 7.209 -13.366 -3.701 1.00 0.00 H new ATOM 0 HB2 HIS A 107 8.889 -13.365 -1.810 1.00 0.00 H new ATOM 0 HB3 HIS A 107 8.814 -14.849 -2.739 1.00 0.00 H new ATOM 0 HD1 HIS A 107 11.007 -11.657 -3.073 1.00 0.00 H new ATOM 0 HD2 HIS A 107 11.136 -15.806 -3.177 1.00 0.00 H new ATOM 0 HE1 HIS A 107 13.383 -12.295 -3.780 1.00 0.00 H new ATOM 653 N TYR A 108 6.970 -11.235 -4.092 1.00 0.00 N ATOM 654 CA TYR A 108 6.328 -9.912 -4.023 1.00 0.00 C ATOM 655 C TYR A 108 4.813 -10.030 -3.935 1.00 0.00 C ATOM 656 O TYR A 108 4.149 -10.695 -4.733 1.00 0.00 O ATOM 657 CB TYR A 108 6.744 -8.995 -5.196 1.00 0.00 C ATOM 658 CG TYR A 108 8.134 -8.408 -4.980 1.00 0.00 C ATOM 659 CD1 TYR A 108 8.365 -7.658 -3.817 1.00 0.00 C ATOM 660 CD2 TYR A 108 9.212 -8.952 -5.722 1.00 0.00 C ATOM 661 CE1 TYR A 108 9.673 -7.483 -3.337 1.00 0.00 C ATOM 662 CE2 TYR A 108 10.530 -8.807 -5.242 1.00 0.00 C ATOM 663 CZ TYR A 108 10.730 -8.077 -4.060 1.00 0.00 C ATOM 664 OH TYR A 108 11.986 -7.648 -3.778 1.00 0.00 O ATOM 0 H TYR A 108 6.374 -11.914 -4.565 1.00 0.00 H new ATOM 0 HA TYR A 108 6.684 -9.442 -3.106 1.00 0.00 H new ATOM 0 HB2 TYR A 108 6.728 -9.563 -6.126 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.019 -8.188 -5.303 1.00 0.00 H new ATOM 0 HD1 TYR A 108 7.534 -7.214 -3.289 1.00 0.00 H new ATOM 0 HD2 TYR A 108 9.025 -9.474 -6.649 1.00 0.00 H new ATOM 0 HE1 TYR A 108 9.865 -6.911 -2.441 1.00 0.00 H new ATOM 0 HE2 TYR A 108 11.364 -9.246 -5.770 1.00 0.00 H new ATOM 0 HH TYR A 108 11.940 -6.874 -3.178 1.00 0.00 H new ATOM 665 N ASN A 109 4.317 -9.291 -2.962 1.00 0.00 N ATOM 666 CA ASN A 109 2.874 -9.214 -2.671 1.00 0.00 C ATOM 667 C ASN A 109 2.428 -7.781 -2.888 1.00 0.00 C ATOM 668 O ASN A 109 2.789 -6.858 -2.172 1.00 0.00 O ATOM 669 CB ASN A 109 2.536 -9.605 -1.230 1.00 0.00 C ATOM 670 CG ASN A 109 1.037 -9.856 -1.004 1.00 0.00 C ATOM 671 OD1 ASN A 109 0.156 -9.446 -1.750 1.00 0.00 O ATOM 672 ND2 ASN A 109 0.738 -10.504 0.094 1.00 0.00 N ATOM 0 H ASN A 109 4.893 -8.721 -2.342 1.00 0.00 H new ATOM 0 HA ASN A 109 2.364 -9.915 -3.332 1.00 0.00 H new ATOM 0 HB2 ASN A 109 3.092 -10.504 -0.965 1.00 0.00 H new ATOM 0 HB3 ASN A 109 2.870 -8.814 -0.558 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -0.238 -10.673 0.337 1.00 0.00 H new ATOM 0 HD22 ASN A 109 1.481 -10.840 0.706 1.00 0.00 H new ATOM 673 N THR A 110 1.655 -7.660 -3.958 1.00 0.00 N ATOM 674 CA THR A 110 1.230 -6.334 -4.426 1.00 0.00 C ATOM 675 C THR A 110 -0.285 -6.169 -4.545 1.00 0.00 C ATOM 676 O THR A 110 -1.027 -7.134 -4.517 1.00 0.00 O ATOM 677 CB THR A 110 2.017 -5.865 -5.670 1.00 0.00 C ATOM 678 OG1 THR A 110 1.621 -4.560 -6.089 1.00 0.00 O ATOM 679 CG2 THR A 110 2.119 -6.923 -6.772 1.00 0.00 C ATOM 0 H THR A 110 1.311 -8.443 -4.514 1.00 0.00 H new ATOM 0 HA THR A 110 1.501 -5.641 -3.630 1.00 0.00 H new ATOM 0 HB THR A 110 3.058 -5.750 -5.369 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.146 -4.621 -6.944 1.00 0.00 H new ATOM 0 HG21 THR A 110 2.685 -6.520 -7.612 1.00 0.00 H new ATOM 0 HG22 THR A 110 2.626 -7.806 -6.383 1.00 0.00 H new ATOM 0 HG23 THR A 110 1.119 -7.197 -7.107 1.00 0.00 H new ATOM 680 N TYR A 111 -0.707 -4.919 -4.614 1.00 0.00 N ATOM 681 CA TYR A 111 -2.113 -4.551 -4.359 1.00 0.00 C ATOM 682 C TYR A 111 -2.720 -3.723 -5.476 1.00 0.00 C ATOM 683 O TYR A 111 -2.202 -2.669 -5.826 1.00 0.00 O ATOM 684 CB TYR A 111 -2.254 -3.805 -3.031 1.00 0.00 C ATOM 685 CG TYR A 111 -1.707 -4.623 -1.854 1.00 0.00 C ATOM 686 CD1 TYR A 111 -2.478 -5.693 -1.358 1.00 0.00 C ATOM 687 CD2 TYR A 111 -0.397 -4.367 -1.403 1.00 0.00 C ATOM 688 CE1 TYR A 111 -1.899 -6.548 -0.411 1.00 0.00 C ATOM 689 CE2 TYR A 111 0.182 -5.223 -0.446 1.00 0.00 C ATOM 690 CZ TYR A 111 -0.579 -6.323 0.030 1.00 0.00 C ATOM 691 OH TYR A 111 0.020 -7.276 0.776 1.00 0.00 O ATOM 0 H TYR A 111 -0.104 -4.130 -4.844 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.665 -5.490 -4.310 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.723 -2.855 -3.090 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -3.304 -3.573 -2.855 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -3.490 -5.850 -1.699 1.00 0.00 H new ATOM 0 HD2 TYR A 111 0.157 -3.523 -1.787 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.464 -7.380 -0.018 1.00 0.00 H new ATOM 0 HE2 TYR A 111 1.183 -5.046 -0.082 1.00 0.00 H new ATOM 0 HH TYR A 111 -0.487 -8.112 0.708 1.00 0.00 H new ATOM 692 N ILE A 112 -3.765 -4.293 -6.048 1.00 0.00 N ATOM 693 CA ILE A 112 -4.637 -3.581 -7.011 1.00 0.00 C ATOM 694 C ILE A 112 -5.878 -3.154 -6.222 1.00 0.00 C ATOM 695 O ILE A 112 -6.594 -3.996 -5.672 1.00 0.00 O ATOM 696 CB ILE A 112 -5.070 -4.446 -8.208 1.00 0.00 C ATOM 697 CG1 ILE A 112 -3.888 -5.204 -8.832 1.00 0.00 C ATOM 698 CG2 ILE A 112 -5.717 -3.548 -9.265 1.00 0.00 C ATOM 699 CD1 ILE A 112 -4.313 -6.403 -9.693 1.00 0.00 C ATOM 0 H ILE A 112 -4.046 -5.257 -5.870 1.00 0.00 H new ATOM 0 HA ILE A 112 -4.085 -2.743 -7.436 1.00 0.00 H new ATOM 0 HB ILE A 112 -5.781 -5.189 -7.847 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.308 -4.514 -9.445 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.230 -5.554 -8.036 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -6.027 -4.154 -10.117 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -6.588 -3.052 -8.837 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -4.998 -2.798 -9.595 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.427 -6.890 -10.101 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -4.868 -7.113 -9.080 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -4.946 -6.058 -10.510 1.00 0.00 H new ATOM 700 N SER A 113 -6.051 -1.841 -6.117 1.00 0.00 N ATOM 701 CA SER A 113 -7.268 -1.293 -5.457 1.00 0.00 C ATOM 702 C SER A 113 -8.506 -1.695 -6.269 1.00 0.00 C ATOM 703 O SER A 113 -8.673 -1.336 -7.437 1.00 0.00 O ATOM 704 CB SER A 113 -7.267 0.225 -5.297 1.00 0.00 C ATOM 705 OG SER A 113 -8.505 0.655 -4.728 1.00 0.00 O ATOM 0 H SER A 113 -5.395 -1.141 -6.463 1.00 0.00 H new ATOM 0 HA SER A 113 -7.281 -1.715 -4.452 1.00 0.00 H new ATOM 0 HB2 SER A 113 -6.438 0.532 -4.659 1.00 0.00 H new ATOM 0 HB3 SER A 113 -7.117 0.701 -6.266 1.00 0.00 H new ATOM 0 HG SER A 113 -8.403 0.753 -3.758 1.00 0.00 H new ATOM 706 N LYS A 114 -9.294 -2.537 -5.600 1.00 0.00 N ATOM 707 CA LYS A 114 -10.492 -3.194 -6.135 1.00 0.00 C ATOM 708 C LYS A 114 -11.361 -2.313 -7.056 1.00 0.00 C ATOM 709 O LYS A 114 -11.756 -2.750 -8.137 1.00 0.00 O ATOM 710 CB LYS A 114 -11.319 -3.702 -4.942 1.00 0.00 C ATOM 711 CG LYS A 114 -12.571 -4.459 -5.369 1.00 0.00 C ATOM 712 CD LYS A 114 -13.309 -4.989 -4.136 1.00 0.00 C ATOM 713 CE LYS A 114 -14.781 -5.263 -4.459 1.00 0.00 C ATOM 714 NZ LYS A 114 -14.910 -6.277 -5.504 1.00 0.00 N ATOM 0 H LYS A 114 -9.109 -2.792 -4.630 1.00 0.00 H new ATOM 0 HA LYS A 114 -10.156 -4.008 -6.777 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -10.698 -4.354 -4.327 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -11.607 -2.855 -4.319 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -13.226 -3.802 -5.940 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -12.300 -5.287 -6.024 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -12.832 -5.905 -3.787 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -13.239 -4.264 -3.325 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -15.298 -5.596 -3.559 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -15.264 -4.340 -4.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -15.903 -6.579 -5.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -14.604 -5.878 -6.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -14.315 -7.096 -5.268 1.00 0.00 H new ATOM 715 N LYS A 115 -11.559 -1.064 -6.632 1.00 0.00 N ATOM 716 CA LYS A 115 -12.336 -0.036 -7.380 1.00 0.00 C ATOM 717 C LYS A 115 -11.944 0.105 -8.863 1.00 0.00 C ATOM 718 O LYS A 115 -12.795 -0.035 -9.736 1.00 0.00 O ATOM 719 CB LYS A 115 -12.276 1.323 -6.671 1.00 0.00 C ATOM 720 CG LYS A 115 -10.846 1.870 -6.505 1.00 0.00 C ATOM 721 CD LYS A 115 -10.800 3.313 -6.006 1.00 0.00 C ATOM 722 CE LYS A 115 -11.133 4.374 -7.057 1.00 0.00 C ATOM 723 NZ LYS A 115 -10.008 4.502 -7.990 1.00 0.00 N ATOM 0 H LYS A 115 -11.185 -0.719 -5.748 1.00 0.00 H new ATOM 0 HA LYS A 115 -13.364 -0.399 -7.382 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -12.868 2.044 -7.235 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -12.737 1.231 -5.688 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -10.301 1.235 -5.807 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -10.328 1.808 -7.462 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -11.497 3.416 -5.175 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -9.803 3.514 -5.613 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -12.038 4.096 -7.597 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -11.331 5.331 -6.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -10.325 4.990 -8.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -9.246 5.050 -7.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -9.654 3.556 -8.239 1.00 0.00 H new ATOM 724 N HIS A 116 -10.640 0.099 -9.115 1.00 0.00 N ATOM 725 CA HIS A 116 -10.067 0.315 -10.465 1.00 0.00 C ATOM 726 C HIS A 116 -9.466 -0.940 -11.123 1.00 0.00 C ATOM 727 O HIS A 116 -8.388 -0.956 -11.719 1.00 0.00 O ATOM 728 CB HIS A 116 -9.082 1.483 -10.417 1.00 0.00 C ATOM 729 CG HIS A 116 -9.737 2.793 -10.849 1.00 0.00 C ATOM 730 ND1 HIS A 116 -9.107 3.798 -11.447 1.00 0.00 N ATOM 731 CD2 HIS A 116 -11.012 3.149 -10.701 1.00 0.00 C ATOM 732 CE1 HIS A 116 -9.973 4.780 -11.646 1.00 0.00 C ATOM 733 NE2 HIS A 116 -11.158 4.369 -11.198 1.00 0.00 N ATOM 0 H HIS A 116 -9.936 -0.056 -8.394 1.00 0.00 H new ATOM 0 HA HIS A 116 -10.898 0.567 -11.124 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -8.691 1.588 -9.405 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -8.233 1.270 -11.066 1.00 0.00 H new ATOM 0 HD1 HIS A 116 -8.121 3.811 -11.709 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -11.791 2.549 -10.254 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -9.757 5.740 -12.091 1.00 0.00 H new ATOM 734 N ALA A 117 -10.300 -1.973 -11.048 1.00 0.00 N ATOM 735 CA ALA A 117 -10.069 -3.250 -11.741 1.00 0.00 C ATOM 736 C ALA A 117 -10.184 -3.057 -13.260 1.00 0.00 C ATOM 737 O ALA A 117 -10.797 -2.097 -13.746 1.00 0.00 O ATOM 738 CB ALA A 117 -11.098 -4.274 -11.248 1.00 0.00 C ATOM 0 H ALA A 117 -11.162 -1.954 -10.503 1.00 0.00 H new ATOM 0 HA ALA A 117 -9.065 -3.612 -11.522 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -10.936 -5.225 -11.755 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -10.987 -4.413 -10.173 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -12.103 -3.913 -11.465 1.00 0.00 H new ATOM 739 N GLU A 118 -9.361 -3.816 -13.969 1.00 0.00 N ATOM 740 CA GLU A 118 -9.203 -3.870 -15.448 1.00 0.00 C ATOM 741 C GLU A 118 -8.311 -2.762 -16.032 1.00 0.00 C ATOM 742 O GLU A 118 -7.582 -2.945 -16.994 1.00 0.00 O ATOM 743 CB GLU A 118 -10.535 -3.931 -16.207 1.00 0.00 C ATOM 744 CG GLU A 118 -11.258 -5.221 -15.823 1.00 0.00 C ATOM 745 CD GLU A 118 -12.461 -5.413 -16.732 1.00 0.00 C ATOM 746 OE1 GLU A 118 -12.227 -5.903 -17.855 1.00 0.00 O ATOM 747 OE2 GLU A 118 -13.580 -5.094 -16.283 1.00 0.00 O ATOM 0 H GLU A 118 -8.728 -4.468 -13.505 1.00 0.00 H new ATOM 0 HA GLU A 118 -8.683 -4.815 -15.605 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -11.150 -3.065 -15.961 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -10.359 -3.902 -17.282 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -10.581 -6.071 -15.912 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -11.578 -5.176 -14.782 1.00 0.00 H new ATOM 748 N LYS A 119 -8.376 -1.659 -15.308 1.00 0.00 N ATOM 749 CA LYS A 119 -7.420 -0.539 -15.351 1.00 0.00 C ATOM 750 C LYS A 119 -6.157 -0.818 -14.517 1.00 0.00 C ATOM 751 O LYS A 119 -5.169 -0.098 -14.635 1.00 0.00 O ATOM 752 CB LYS A 119 -8.234 0.580 -14.717 1.00 0.00 C ATOM 753 CG LYS A 119 -7.946 1.894 -15.417 1.00 0.00 C ATOM 754 CD LYS A 119 -8.831 2.965 -14.805 1.00 0.00 C ATOM 755 CE LYS A 119 -8.662 4.302 -15.536 1.00 0.00 C ATOM 756 NZ LYS A 119 -9.540 5.252 -14.855 1.00 0.00 N ATOM 0 H LYS A 119 -9.129 -1.501 -14.638 1.00 0.00 H new ATOM 0 HA LYS A 119 -7.051 -0.329 -16.355 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -9.297 0.349 -14.783 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -7.991 0.662 -13.658 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -6.895 2.161 -15.306 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -8.141 1.805 -16.486 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -9.874 2.650 -14.851 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -8.582 3.089 -13.751 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -7.625 4.636 -15.502 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -8.932 4.208 -16.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.801 6.016 -15.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -10.400 4.762 -14.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -9.045 5.655 -14.034 1.00 0.00 H new ATOM 757 N ASN A 120 -6.131 -2.026 -13.962 1.00 0.00 N ATOM 758 CA ASN A 120 -5.266 -2.510 -12.877 1.00 0.00 C ATOM 759 C ASN A 120 -4.342 -1.498 -12.211 1.00 0.00 C ATOM 760 O ASN A 120 -3.112 -1.554 -12.285 1.00 0.00 O ATOM 761 CB ASN A 120 -4.587 -3.788 -13.364 1.00 0.00 C ATOM 762 CG ASN A 120 -5.603 -4.946 -13.383 1.00 0.00 C ATOM 763 OD1 ASN A 120 -6.776 -4.807 -13.677 1.00 0.00 O ATOM 764 ND2 ASN A 120 -5.184 -6.102 -12.952 1.00 0.00 N ATOM 0 H ASN A 120 -6.766 -2.757 -14.283 1.00 0.00 H new ATOM 0 HA ASN A 120 -5.905 -2.726 -12.021 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -4.178 -3.635 -14.363 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -3.750 -4.037 -12.711 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -5.837 -6.881 -12.864 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -4.203 -6.228 -12.703 1.00 0.00 H new ATOM 765 N TRP A 121 -5.024 -0.653 -11.449 1.00 0.00 N ATOM 766 CA TRP A 121 -4.421 0.393 -10.618 1.00 0.00 C ATOM 767 C TRP A 121 -3.830 -0.157 -9.326 1.00 0.00 C ATOM 768 O TRP A 121 -4.479 -0.356 -8.297 1.00 0.00 O ATOM 769 CB TRP A 121 -5.452 1.473 -10.348 1.00 0.00 C ATOM 770 CG TRP A 121 -5.594 2.491 -11.477 1.00 0.00 C ATOM 771 CD1 TRP A 121 -5.350 2.342 -12.775 1.00 0.00 C ATOM 772 CD2 TRP A 121 -5.878 3.825 -11.253 1.00 0.00 C ATOM 773 NE1 TRP A 121 -5.446 3.513 -13.392 1.00 0.00 N ATOM 774 CE2 TRP A 121 -5.778 4.449 -12.504 1.00 0.00 C ATOM 775 CE3 TRP A 121 -6.187 4.556 -10.098 1.00 0.00 C ATOM 776 CZ2 TRP A 121 -5.986 5.826 -12.629 1.00 0.00 C ATOM 777 CZ3 TRP A 121 -6.485 5.925 -10.234 1.00 0.00 C ATOM 778 CH2 TRP A 121 -6.395 6.560 -11.495 1.00 0.00 C ATOM 0 H TRP A 121 -6.042 -0.673 -11.387 1.00 0.00 H new ATOM 0 HA TRP A 121 -3.583 0.825 -11.165 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -6.419 1.002 -10.173 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -5.182 1.997 -9.431 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -5.109 1.406 -13.257 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -5.290 3.671 -14.388 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -6.196 4.081 -9.128 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -5.836 6.320 -13.578 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -6.785 6.496 -9.368 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -6.640 7.608 -11.590 1.00 0.00 H new ATOM 779 N PHE A 122 -2.511 -0.274 -9.420 1.00 0.00 N ATOM 780 CA PHE A 122 -1.689 -0.916 -8.387 1.00 0.00 C ATOM 781 C PHE A 122 -1.120 0.099 -7.386 1.00 0.00 C ATOM 782 O PHE A 122 -1.281 1.304 -7.533 1.00 0.00 O ATOM 783 CB PHE A 122 -0.515 -1.613 -9.080 1.00 0.00 C ATOM 784 CG PHE A 122 -0.752 -3.074 -9.432 1.00 0.00 C ATOM 785 CD1 PHE A 122 -0.306 -4.046 -8.508 1.00 0.00 C ATOM 786 CD2 PHE A 122 -1.032 -3.420 -10.771 1.00 0.00 C ATOM 787 CE1 PHE A 122 -0.099 -5.375 -8.943 1.00 0.00 C ATOM 788 CE2 PHE A 122 -0.806 -4.750 -11.215 1.00 0.00 C ATOM 789 CZ PHE A 122 -0.329 -5.713 -10.290 1.00 0.00 C ATOM 0 H PHE A 122 -1.974 0.073 -10.215 1.00 0.00 H new ATOM 0 HA PHE A 122 -2.318 -1.617 -7.838 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -0.277 -1.069 -9.994 1.00 0.00 H new ATOM 0 HB3 PHE A 122 0.360 -1.548 -8.433 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -0.125 -3.776 -7.478 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -1.416 -2.677 -11.455 1.00 0.00 H new ATOM 0 HE1 PHE A 122 0.234 -6.128 -8.244 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -0.995 -5.024 -12.242 1.00 0.00 H new ATOM 0 HZ PHE A 122 -0.139 -6.722 -10.624 1.00 0.00 H new ATOM 790 N VAL A 123 -0.465 -0.449 -6.374 1.00 0.00 N ATOM 791 CA VAL A 123 0.300 0.342 -5.403 1.00 0.00 C ATOM 792 C VAL A 123 1.787 0.434 -5.772 1.00 0.00 C ATOM 793 O VAL A 123 2.354 -0.512 -6.307 1.00 0.00 O ATOM 794 CB VAL A 123 0.019 -0.221 -3.994 1.00 0.00 C ATOM 795 CG1 VAL A 123 0.635 -1.608 -3.744 1.00 0.00 C ATOM 796 CG2 VAL A 123 0.426 0.766 -2.896 1.00 0.00 C ATOM 0 H VAL A 123 -0.444 -1.453 -6.197 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.027 1.382 -5.417 1.00 0.00 H new ATOM 0 HB VAL A 123 -1.062 -0.358 -3.951 1.00 0.00 H new ATOM 0 HG11 VAL A 123 0.394 -1.936 -2.733 1.00 0.00 H new ATOM 0 HG12 VAL A 123 0.231 -2.321 -4.463 1.00 0.00 H new ATOM 0 HG13 VAL A 123 1.717 -1.551 -3.859 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.212 0.332 -1.919 1.00 0.00 H new ATOM 0 HG22 VAL A 123 1.493 0.977 -2.974 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -0.137 1.692 -3.013 1.00 0.00 H new ATOM 797 N GLY A 124 2.303 1.651 -5.639 1.00 0.00 N ATOM 798 CA GLY A 124 3.704 1.975 -5.936 1.00 0.00 C ATOM 799 C GLY A 124 4.277 3.091 -5.074 1.00 0.00 C ATOM 800 O GLY A 124 3.647 4.122 -4.839 1.00 0.00 O ATOM 0 H GLY A 124 1.759 2.452 -5.319 1.00 0.00 H new ATOM 0 HA2 GLY A 124 4.310 1.079 -5.802 1.00 0.00 H new ATOM 0 HA3 GLY A 124 3.786 2.261 -6.985 1.00 0.00 H new ATOM 801 N LEU A 125 5.486 2.818 -4.601 1.00 0.00 N ATOM 802 CA LEU A 125 6.309 3.832 -3.927 1.00 0.00 C ATOM 803 C LEU A 125 7.355 4.461 -4.835 1.00 0.00 C ATOM 804 O LEU A 125 8.229 3.820 -5.421 1.00 0.00 O ATOM 805 CB LEU A 125 6.961 3.311 -2.635 1.00 0.00 C ATOM 806 CG LEU A 125 5.962 3.157 -1.470 1.00 0.00 C ATOM 807 CD1 LEU A 125 6.641 2.476 -0.289 1.00 0.00 C ATOM 808 CD2 LEU A 125 5.405 4.503 -1.000 1.00 0.00 C ATOM 0 H LEU A 125 5.926 1.900 -4.669 1.00 0.00 H new ATOM 0 HA LEU A 125 5.605 4.617 -3.652 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.428 2.347 -2.835 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.756 3.994 -2.336 1.00 0.00 H new ATOM 0 HG LEU A 125 5.134 2.553 -1.841 1.00 0.00 H new ATOM 0 HD11 LEU A 125 5.929 2.371 0.529 1.00 0.00 H new ATOM 0 HD12 LEU A 125 6.994 1.490 -0.591 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.487 3.079 0.041 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.707 4.341 -0.179 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.224 5.137 -0.660 1.00 0.00 H new ATOM 0 HD23 LEU A 125 4.887 4.991 -1.826 1.00 0.00 H new ATOM 809 N LYS A 126 7.136 5.758 -4.961 1.00 0.00 N ATOM 810 CA LYS A 126 7.987 6.709 -5.698 1.00 0.00 C ATOM 811 C LYS A 126 9.302 6.921 -4.927 1.00 0.00 C ATOM 812 O LYS A 126 9.292 7.195 -3.723 1.00 0.00 O ATOM 813 CB LYS A 126 7.187 8.009 -5.822 1.00 0.00 C ATOM 814 CG LYS A 126 8.000 9.091 -6.547 1.00 0.00 C ATOM 815 CD LYS A 126 7.339 10.455 -6.468 1.00 0.00 C ATOM 816 CE LYS A 126 8.280 11.463 -7.133 1.00 0.00 C ATOM 817 NZ LYS A 126 7.698 12.804 -6.974 1.00 0.00 N ATOM 0 H LYS A 126 6.326 6.209 -4.537 1.00 0.00 H new ATOM 0 HA LYS A 126 8.251 6.341 -6.689 1.00 0.00 H new ATOM 0 HB2 LYS A 126 6.261 7.820 -6.366 1.00 0.00 H new ATOM 0 HB3 LYS A 126 6.907 8.364 -4.830 1.00 0.00 H new ATOM 0 HG2 LYS A 126 8.997 9.147 -6.111 1.00 0.00 H new ATOM 0 HG3 LYS A 126 8.125 8.810 -7.593 1.00 0.00 H new ATOM 0 HD2 LYS A 126 6.373 10.442 -6.972 1.00 0.00 H new ATOM 0 HD3 LYS A 126 7.153 10.731 -5.430 1.00 0.00 H new ATOM 0 HE2 LYS A 126 9.268 11.420 -6.676 1.00 0.00 H new ATOM 0 HE3 LYS A 126 8.407 11.226 -8.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 8.321 13.508 -7.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 6.763 12.833 -7.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 7.598 13.021 -5.962 1.00 0.00 H new ATOM 818 N LYS A 127 10.364 7.008 -5.722 1.00 0.00 N ATOM 819 CA LYS A 127 11.762 7.161 -5.261 1.00 0.00 C ATOM 820 C LYS A 127 12.023 8.252 -4.233 1.00 0.00 C ATOM 821 O LYS A 127 12.634 8.015 -3.198 1.00 0.00 O ATOM 822 CB LYS A 127 12.634 7.428 -6.476 1.00 0.00 C ATOM 823 CG LYS A 127 12.696 6.127 -7.242 1.00 0.00 C ATOM 824 CD LYS A 127 13.051 6.388 -8.684 1.00 0.00 C ATOM 825 CE LYS A 127 12.910 5.040 -9.393 1.00 0.00 C ATOM 826 NZ LYS A 127 13.275 5.320 -10.775 1.00 0.00 N ATOM 0 H LYS A 127 10.285 6.974 -6.738 1.00 0.00 H new ATOM 0 HA LYS A 127 11.997 6.229 -4.747 1.00 0.00 H new ATOM 0 HB2 LYS A 127 12.212 8.223 -7.091 1.00 0.00 H new ATOM 0 HB3 LYS A 127 13.631 7.752 -6.177 1.00 0.00 H new ATOM 0 HG2 LYS A 127 13.437 5.466 -6.791 1.00 0.00 H new ATOM 0 HG3 LYS A 127 11.735 5.616 -7.183 1.00 0.00 H new ATOM 0 HD2 LYS A 127 12.387 7.133 -9.123 1.00 0.00 H new ATOM 0 HD3 LYS A 127 14.066 6.774 -8.774 1.00 0.00 H new ATOM 0 HE2 LYS A 127 13.566 4.289 -8.953 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.892 4.657 -9.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 13.206 4.447 -11.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 12.629 6.035 -11.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 14.251 5.678 -10.811 1.00 0.00 H new ATOM 827 N ASN A 128 11.360 9.361 -4.488 1.00 0.00 N ATOM 828 CA ASN A 128 11.397 10.600 -3.691 1.00 0.00 C ATOM 829 C ASN A 128 10.459 10.544 -2.474 1.00 0.00 C ATOM 830 O ASN A 128 9.866 11.552 -2.069 1.00 0.00 O ATOM 831 CB ASN A 128 11.014 11.721 -4.652 1.00 0.00 C ATOM 832 CG ASN A 128 12.013 11.874 -5.797 1.00 0.00 C ATOM 833 OD1 ASN A 128 12.030 11.137 -6.766 1.00 0.00 O ATOM 834 ND2 ASN A 128 12.922 12.813 -5.632 1.00 0.00 N ATOM 0 H ASN A 128 10.744 9.441 -5.297 1.00 0.00 H new ATOM 0 HA ASN A 128 12.388 10.759 -3.267 1.00 0.00 H new ATOM 0 HB2 ASN A 128 10.024 11.522 -5.062 1.00 0.00 H new ATOM 0 HB3 ASN A 128 10.949 12.660 -4.103 1.00 0.00 H new ATOM 0 HD21 ASN A 128 13.661 12.935 -6.324 1.00 0.00 H new ATOM 0 HD22 ASN A 128 12.887 13.418 -4.812 1.00 0.00 H new ATOM 835 N GLY A 129 10.355 9.339 -1.921 1.00 0.00 N ATOM 836 CA GLY A 129 9.502 8.992 -0.767 1.00 0.00 C ATOM 837 C GLY A 129 8.022 9.396 -0.862 1.00 0.00 C ATOM 838 O GLY A 129 7.471 9.936 0.098 1.00 0.00 O ATOM 0 H GLY A 129 10.880 8.538 -2.272 1.00 0.00 H new ATOM 0 HA2 GLY A 129 9.552 7.913 -0.618 1.00 0.00 H new ATOM 0 HA3 GLY A 129 9.926 9.457 0.123 1.00 0.00 H new ATOM 839 N SER A 130 7.313 8.865 -1.868 1.00 0.00 N ATOM 840 CA SER A 130 5.871 9.148 -2.034 1.00 0.00 C ATOM 841 C SER A 130 5.110 7.901 -2.501 1.00 0.00 C ATOM 842 O SER A 130 5.697 6.985 -3.055 1.00 0.00 O ATOM 843 CB SER A 130 5.629 10.277 -3.033 1.00 0.00 C ATOM 844 OG SER A 130 4.367 10.861 -2.703 1.00 0.00 O ATOM 0 H SER A 130 7.705 8.243 -2.575 1.00 0.00 H new ATOM 0 HA SER A 130 5.501 9.454 -1.056 1.00 0.00 H new ATOM 0 HB2 SER A 130 6.425 11.020 -2.976 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.622 9.894 -4.054 1.00 0.00 H new ATOM 0 HG SER A 130 4.370 11.136 -1.762 1.00 0.00 H new ATOM 845 N CYS A 131 3.815 7.876 -2.249 1.00 0.00 N ATOM 846 CA CYS A 131 2.927 6.791 -2.705 1.00 0.00 C ATOM 847 C CYS A 131 2.144 7.284 -3.929 1.00 0.00 C ATOM 848 O CYS A 131 1.066 7.877 -3.856 1.00 0.00 O ATOM 849 CB CYS A 131 1.982 6.297 -1.623 1.00 0.00 C ATOM 850 SG CYS A 131 1.221 4.678 -1.995 1.00 0.00 S ATOM 0 H CYS A 131 3.335 8.605 -1.721 1.00 0.00 H new ATOM 0 HA CYS A 131 3.548 5.934 -2.967 1.00 0.00 H new ATOM 0 HB2 CYS A 131 2.527 6.224 -0.682 1.00 0.00 H new ATOM 0 HB3 CYS A 131 1.193 7.035 -1.478 1.00 0.00 H new ATOM 0 HG CYS A 131 -0.045 4.840 -2.240 1.00 0.00 H new ATOM 851 N LYS A 132 2.833 7.043 -5.023 1.00 0.00 N ATOM 852 CA LYS A 132 2.502 7.528 -6.371 1.00 0.00 C ATOM 853 C LYS A 132 1.966 6.341 -7.194 1.00 0.00 C ATOM 854 O LYS A 132 2.711 5.429 -7.546 1.00 0.00 O ATOM 855 CB LYS A 132 3.744 8.150 -7.017 1.00 0.00 C ATOM 856 CG LYS A 132 3.533 8.574 -8.474 1.00 0.00 C ATOM 857 CD LYS A 132 4.854 8.585 -9.257 1.00 0.00 C ATOM 858 CE LYS A 132 5.604 7.248 -9.204 1.00 0.00 C ATOM 859 NZ LYS A 132 4.786 6.132 -9.719 1.00 0.00 N ATOM 0 H LYS A 132 3.682 6.478 -5.010 1.00 0.00 H new ATOM 0 HA LYS A 132 1.735 8.302 -6.327 1.00 0.00 H new ATOM 0 HB2 LYS A 132 4.048 9.020 -6.435 1.00 0.00 H new ATOM 0 HB3 LYS A 132 4.564 7.433 -6.971 1.00 0.00 H new ATOM 0 HG2 LYS A 132 2.831 7.892 -8.954 1.00 0.00 H new ATOM 0 HG3 LYS A 132 3.084 9.567 -8.503 1.00 0.00 H new ATOM 0 HD2 LYS A 132 4.649 8.837 -10.297 1.00 0.00 H new ATOM 0 HD3 LYS A 132 5.497 9.370 -8.859 1.00 0.00 H new ATOM 0 HE2 LYS A 132 6.521 7.324 -9.788 1.00 0.00 H new ATOM 0 HE3 LYS A 132 5.897 7.038 -8.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 5.401 5.322 -9.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 4.087 5.853 -9.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 4.292 6.433 -10.583 1.00 0.00 H new ATOM 860 N ARG A 133 0.635 6.270 -7.233 1.00 0.00 N ATOM 861 CA ARG A 133 -0.068 5.225 -7.996 1.00 0.00 C ATOM 862 C ARG A 133 -0.670 5.716 -9.328 1.00 0.00 C ATOM 863 O ARG A 133 0.018 5.904 -10.337 1.00 0.00 O ATOM 864 CB ARG A 133 -1.097 4.486 -7.119 1.00 0.00 C ATOM 865 CG ARG A 133 -0.654 4.088 -5.708 1.00 0.00 C ATOM 866 CD ARG A 133 -1.864 3.693 -4.840 1.00 0.00 C ATOM 867 NE ARG A 133 -2.506 2.452 -5.294 1.00 0.00 N ATOM 868 CZ ARG A 133 -3.126 1.536 -4.544 1.00 0.00 C ATOM 869 NH1 ARG A 133 -2.965 1.465 -3.233 1.00 0.00 N ATOM 870 NH2 ARG A 133 -3.702 0.496 -5.135 1.00 0.00 N ATOM 0 H ARG A 133 0.018 6.921 -6.747 1.00 0.00 H new ATOM 0 HA ARG A 133 0.695 4.504 -8.290 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.981 5.117 -7.030 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -1.402 3.582 -7.645 1.00 0.00 H new ATOM 0 HG2 ARG A 133 0.045 3.254 -5.764 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -0.123 4.918 -5.242 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -1.541 3.573 -3.806 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -2.595 4.501 -4.853 1.00 0.00 H new ATOM 0 HE ARG A 133 -2.475 2.268 -6.297 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -2.349 2.125 -2.758 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -3.457 0.750 -2.697 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -3.668 0.403 -6.150 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -4.178 -0.210 -4.574 1.00 0.00 H new ATOM 871 N GLY A 134 -1.987 5.865 -9.314 1.00 0.00 N ATOM 872 CA GLY A 134 -2.886 6.149 -10.443 1.00 0.00 C ATOM 873 C GLY A 134 -2.642 5.199 -11.612 1.00 0.00 C ATOM 874 O GLY A 134 -2.531 3.993 -11.396 1.00 0.00 O ATOM 0 H GLY A 134 -2.507 5.785 -8.440 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -3.922 6.063 -10.114 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.741 7.178 -10.774 1.00 0.00 H new ATOM 875 N PRO A 135 -2.574 5.734 -12.834 1.00 0.00 N ATOM 876 CA PRO A 135 -2.596 4.900 -14.036 1.00 0.00 C ATOM 877 C PRO A 135 -1.212 4.355 -14.474 1.00 0.00 C ATOM 878 O PRO A 135 -1.105 3.635 -15.462 1.00 0.00 O ATOM 879 CB PRO A 135 -3.223 5.778 -15.123 1.00 0.00 C ATOM 880 CG PRO A 135 -3.330 7.173 -14.516 1.00 0.00 C ATOM 881 CD PRO A 135 -2.527 7.158 -13.215 1.00 0.00 C ATOM 0 HA PRO A 135 -3.167 3.992 -13.840 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.606 5.788 -16.022 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -4.204 5.401 -15.413 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -2.938 7.923 -15.203 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -4.371 7.431 -14.323 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -1.505 7.506 -13.364 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -2.974 7.798 -12.454 1.00 0.00 H new ATOM 882 N ARG A 136 -0.183 4.733 -13.715 1.00 0.00 N ATOM 883 CA ARG A 136 1.181 4.266 -14.003 1.00 0.00 C ATOM 884 C ARG A 136 1.694 3.123 -13.130 1.00 0.00 C ATOM 885 O ARG A 136 2.726 2.545 -13.434 1.00 0.00 O ATOM 886 CB ARG A 136 2.167 5.446 -14.024 1.00 0.00 C ATOM 887 CG ARG A 136 2.405 6.143 -12.672 1.00 0.00 C ATOM 888 CD ARG A 136 3.245 7.407 -12.864 1.00 0.00 C ATOM 889 NE ARG A 136 4.613 7.043 -13.270 1.00 0.00 N ATOM 890 CZ ARG A 136 5.246 7.414 -14.387 1.00 0.00 C ATOM 891 NH1 ARG A 136 4.778 8.355 -15.192 1.00 0.00 N ATOM 892 NH2 ARG A 136 6.439 6.911 -14.658 1.00 0.00 N ATOM 0 H ARG A 136 -0.261 5.351 -12.908 1.00 0.00 H new ATOM 0 HA ARG A 136 1.116 3.823 -14.997 1.00 0.00 H new ATOM 0 HB2 ARG A 136 3.125 5.088 -14.401 1.00 0.00 H new ATOM 0 HB3 ARG A 136 1.802 6.188 -14.735 1.00 0.00 H new ATOM 0 HG2 ARG A 136 1.449 6.400 -12.215 1.00 0.00 H new ATOM 0 HG3 ARG A 136 2.912 5.462 -11.989 1.00 0.00 H new ATOM 0 HD2 ARG A 136 2.789 8.045 -13.621 1.00 0.00 H new ATOM 0 HD3 ARG A 136 3.272 7.981 -11.937 1.00 0.00 H new ATOM 0 HE ARG A 136 5.133 6.443 -12.630 1.00 0.00 H new ATOM 0 HH11 ARG A 136 3.902 8.827 -14.969 1.00 0.00 H new ATOM 0 HH12 ARG A 136 5.294 8.608 -16.035 1.00 0.00 H new ATOM 0 HH21 ARG A 136 6.869 6.245 -14.016 1.00 0.00 H new ATOM 0 HH22 ARG A 136 6.929 7.189 -15.509 1.00 0.00 H new ATOM 893 N THR A 137 0.993 2.814 -12.043 1.00 0.00 N ATOM 894 CA THR A 137 1.356 1.665 -11.203 1.00 0.00 C ATOM 895 C THR A 137 0.794 0.344 -11.728 1.00 0.00 C ATOM 896 O THR A 137 -0.404 0.069 -11.647 1.00 0.00 O ATOM 897 CB THR A 137 0.941 1.855 -9.756 1.00 0.00 C ATOM 898 OG1 THR A 137 -0.357 2.443 -9.696 1.00 0.00 O ATOM 899 CG2 THR A 137 1.987 2.602 -8.942 1.00 0.00 C ATOM 0 H THR A 137 0.177 3.334 -11.721 1.00 0.00 H new ATOM 0 HA THR A 137 2.444 1.612 -11.250 1.00 0.00 H new ATOM 0 HB THR A 137 0.877 0.876 -9.282 1.00 0.00 H new ATOM 0 HG1 THR A 137 -0.892 1.986 -9.014 1.00 0.00 H new ATOM 0 HG21 THR A 137 1.639 2.710 -7.915 1.00 0.00 H new ATOM 0 HG22 THR A 137 2.923 2.043 -8.951 1.00 0.00 H new ATOM 0 HG23 THR A 137 2.149 3.589 -9.376 1.00 0.00 H new ATOM 900 N HIS A 138 1.706 -0.378 -12.345 1.00 0.00 N ATOM 901 CA HIS A 138 1.513 -1.758 -12.845 1.00 0.00 C ATOM 902 C HIS A 138 2.830 -2.494 -13.057 1.00 0.00 C ATOM 903 O HIS A 138 3.932 -1.938 -13.065 1.00 0.00 O ATOM 904 CB HIS A 138 0.608 -1.782 -14.078 1.00 0.00 C ATOM 905 CG HIS A 138 1.055 -0.787 -15.159 1.00 0.00 C ATOM 906 ND1 HIS A 138 2.223 -0.784 -15.794 1.00 0.00 N ATOM 907 CD2 HIS A 138 0.393 0.312 -15.504 1.00 0.00 C ATOM 908 CE1 HIS A 138 2.297 0.334 -16.508 1.00 0.00 C ATOM 909 NE2 HIS A 138 1.170 1.006 -16.325 1.00 0.00 N ATOM 0 H HIS A 138 2.644 -0.022 -12.528 1.00 0.00 H new ATOM 0 HA HIS A 138 0.995 -2.315 -12.064 1.00 0.00 H new ATOM 0 HB2 HIS A 138 0.598 -2.788 -14.497 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -0.414 -1.552 -13.778 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -0.598 0.590 -15.176 1.00 0.00 H new ATOM 0 HE1 HIS A 138 3.127 0.640 -17.127 1.00 0.00 H new ATOM 0 HE2 HIS A 138 0.939 1.906 -16.745 1.00 0.00 H new ATOM 910 N TYR A 139 2.639 -3.792 -12.936 1.00 0.00 N ATOM 911 CA TYR A 139 3.658 -4.833 -13.056 1.00 0.00 C ATOM 912 C TYR A 139 4.678 -4.631 -14.179 1.00 0.00 C ATOM 913 O TYR A 139 4.425 -4.031 -15.225 1.00 0.00 O ATOM 914 CB TYR A 139 2.920 -6.166 -13.173 1.00 0.00 C ATOM 915 CG TYR A 139 3.495 -7.231 -12.229 1.00 0.00 C ATOM 916 CD1 TYR A 139 4.858 -7.580 -12.305 1.00 0.00 C ATOM 917 CD2 TYR A 139 2.690 -7.678 -11.155 1.00 0.00 C ATOM 918 CE1 TYR A 139 5.448 -8.327 -11.266 1.00 0.00 C ATOM 919 CE2 TYR A 139 3.270 -8.434 -10.117 1.00 0.00 C ATOM 920 CZ TYR A 139 4.645 -8.724 -10.182 1.00 0.00 C ATOM 921 OH TYR A 139 5.227 -9.380 -9.142 1.00 0.00 O ATOM 0 H TYR A 139 1.716 -4.179 -12.740 1.00 0.00 H new ATOM 0 HA TYR A 139 4.286 -4.799 -12.166 1.00 0.00 H new ATOM 0 HB2 TYR A 139 1.864 -6.016 -12.949 1.00 0.00 H new ATOM 0 HB3 TYR A 139 2.980 -6.524 -14.201 1.00 0.00 H new ATOM 0 HD1 TYR A 139 5.448 -7.276 -13.157 1.00 0.00 H new ATOM 0 HD2 TYR A 139 1.637 -7.441 -11.131 1.00 0.00 H new ATOM 0 HE1 TYR A 139 6.495 -8.589 -11.301 1.00 0.00 H new ATOM 0 HE2 TYR A 139 2.671 -8.784 -9.289 1.00 0.00 H new ATOM 0 HH TYR A 139 4.570 -9.506 -8.426 1.00 0.00 H new ATOM 922 N GLY A 140 5.874 -5.052 -13.779 1.00 0.00 N ATOM 923 CA GLY A 140 7.148 -4.851 -14.489 1.00 0.00 C ATOM 924 C GLY A 140 8.030 -3.860 -13.714 1.00 0.00 C ATOM 925 O GLY A 140 9.169 -4.159 -13.373 1.00 0.00 O ATOM 0 H GLY A 140 5.995 -5.569 -12.908 1.00 0.00 H new ATOM 0 HA2 GLY A 140 7.667 -5.803 -14.599 1.00 0.00 H new ATOM 0 HA3 GLY A 140 6.958 -4.473 -15.494 1.00 0.00 H new ATOM 926 N GLN A 141 7.397 -2.792 -13.239 1.00 0.00 N ATOM 927 CA GLN A 141 8.071 -1.716 -12.496 1.00 0.00 C ATOM 928 C GLN A 141 8.243 -2.119 -11.028 1.00 0.00 C ATOM 929 O GLN A 141 7.296 -2.468 -10.336 1.00 0.00 O ATOM 930 CB GLN A 141 7.178 -0.485 -12.532 1.00 0.00 C ATOM 931 CG GLN A 141 7.182 0.233 -13.893 1.00 0.00 C ATOM 932 CD GLN A 141 6.307 1.470 -13.749 1.00 0.00 C ATOM 933 OE1 GLN A 141 6.672 2.475 -13.141 1.00 0.00 O ATOM 934 NE2 GLN A 141 5.091 1.373 -14.217 1.00 0.00 N ATOM 0 H GLN A 141 6.395 -2.641 -13.356 1.00 0.00 H new ATOM 0 HA GLN A 141 9.045 -1.522 -12.945 1.00 0.00 H new ATOM 0 HB2 GLN A 141 6.157 -0.778 -12.287 1.00 0.00 H new ATOM 0 HB3 GLN A 141 7.503 0.213 -11.760 1.00 0.00 H new ATOM 0 HG2 GLN A 141 8.197 0.510 -14.179 1.00 0.00 H new ATOM 0 HG3 GLN A 141 6.798 -0.422 -14.675 1.00 0.00 H new ATOM 0 HE21 GLN A 141 4.803 0.533 -14.719 1.00 0.00 H new ATOM 0 HE22 GLN A 141 4.429 2.137 -14.080 1.00 0.00 H new ATOM 935 N LYS A 142 9.480 -1.962 -10.560 1.00 0.00 N ATOM 936 CA LYS A 142 9.809 -2.078 -9.116 1.00 0.00 C ATOM 937 C LYS A 142 9.007 -1.133 -8.205 1.00 0.00 C ATOM 938 O LYS A 142 8.805 -1.444 -7.031 1.00 0.00 O ATOM 939 CB LYS A 142 11.310 -1.915 -8.854 1.00 0.00 C ATOM 940 CG LYS A 142 12.171 -3.077 -9.377 1.00 0.00 C ATOM 941 CD LYS A 142 12.412 -3.032 -10.884 1.00 0.00 C ATOM 942 CE LYS A 142 13.264 -1.815 -11.277 1.00 0.00 C ATOM 943 NZ LYS A 142 13.247 -1.676 -12.735 1.00 0.00 N ATOM 0 H LYS A 142 10.283 -1.753 -11.153 1.00 0.00 H new ATOM 0 HA LYS A 142 9.509 -3.092 -8.851 1.00 0.00 H new ATOM 0 HB2 LYS A 142 11.650 -0.989 -9.317 1.00 0.00 H new ATOM 0 HB3 LYS A 142 11.471 -1.813 -7.781 1.00 0.00 H new ATOM 0 HG2 LYS A 142 13.132 -3.065 -8.864 1.00 0.00 H new ATOM 0 HG3 LYS A 142 11.686 -4.020 -9.123 1.00 0.00 H new ATOM 0 HD2 LYS A 142 12.912 -3.947 -11.202 1.00 0.00 H new ATOM 0 HD3 LYS A 142 11.456 -2.993 -11.406 1.00 0.00 H new ATOM 0 HE2 LYS A 142 12.872 -0.913 -10.808 1.00 0.00 H new ATOM 0 HE3 LYS A 142 14.287 -1.940 -10.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 13.821 -0.854 -13.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 13.639 -2.535 -13.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 12.268 -1.540 -13.059 1.00 0.00 H new ATOM 944 N ALA A 143 8.448 -0.092 -8.819 1.00 0.00 N ATOM 945 CA ALA A 143 7.369 0.755 -8.263 1.00 0.00 C ATOM 946 C ALA A 143 6.321 -0.063 -7.497 1.00 0.00 C ATOM 947 O ALA A 143 6.130 0.166 -6.307 1.00 0.00 O ATOM 948 CB ALA A 143 6.681 1.505 -9.413 1.00 0.00 C ATOM 0 H ALA A 143 8.737 0.204 -9.751 1.00 0.00 H new ATOM 0 HA ALA A 143 7.823 1.451 -7.558 1.00 0.00 H new ATOM 0 HB1 ALA A 143 5.884 2.132 -9.013 1.00 0.00 H new ATOM 0 HB2 ALA A 143 7.411 2.130 -9.928 1.00 0.00 H new ATOM 0 HB3 ALA A 143 6.259 0.786 -10.115 1.00 0.00 H new ATOM 949 N ILE A 144 5.914 -1.176 -8.107 1.00 0.00 N ATOM 950 CA ILE A 144 4.828 -2.030 -7.573 1.00 0.00 C ATOM 951 C ILE A 144 5.301 -3.221 -6.742 1.00 0.00 C ATOM 952 O ILE A 144 4.487 -3.941 -6.162 1.00 0.00 O ATOM 953 CB ILE A 144 3.852 -2.474 -8.682 1.00 0.00 C ATOM 954 CG1 ILE A 144 4.475 -3.435 -9.696 1.00 0.00 C ATOM 955 CG2 ILE A 144 3.248 -1.271 -9.405 1.00 0.00 C ATOM 956 CD1 ILE A 144 4.178 -4.893 -9.339 1.00 0.00 C ATOM 0 H ILE A 144 6.318 -1.518 -8.979 1.00 0.00 H new ATOM 0 HA ILE A 144 4.292 -1.388 -6.874 1.00 0.00 H new ATOM 0 HB ILE A 144 3.061 -3.022 -8.170 1.00 0.00 H new ATOM 0 HG12 ILE A 144 4.089 -3.217 -10.692 1.00 0.00 H new ATOM 0 HG13 ILE A 144 5.553 -3.280 -9.732 1.00 0.00 H new ATOM 0 HG21 ILE A 144 2.565 -1.618 -10.180 1.00 0.00 H new ATOM 0 HG22 ILE A 144 2.703 -0.653 -8.691 1.00 0.00 H new ATOM 0 HG23 ILE A 144 4.045 -0.682 -9.860 1.00 0.00 H new ATOM 0 HD11 ILE A 144 4.635 -5.549 -10.080 1.00 0.00 H new ATOM 0 HD12 ILE A 144 4.587 -5.117 -8.354 1.00 0.00 H new ATOM 0 HD13 ILE A 144 3.100 -5.053 -9.329 1.00 0.00 H new ATOM 957 N LEU A 145 6.606 -3.430 -6.727 1.00 0.00 N ATOM 958 CA LEU A 145 7.252 -4.593 -6.083 1.00 0.00 C ATOM 959 C LEU A 145 7.316 -4.414 -4.569 1.00 0.00 C ATOM 960 O LEU A 145 8.280 -3.903 -4.000 1.00 0.00 O ATOM 961 CB LEU A 145 8.647 -4.796 -6.697 1.00 0.00 C ATOM 962 CG LEU A 145 8.647 -5.882 -7.781 1.00 0.00 C ATOM 963 CD1 LEU A 145 7.862 -5.498 -9.037 1.00 0.00 C ATOM 964 CD2 LEU A 145 10.095 -6.208 -8.165 1.00 0.00 C ATOM 0 H LEU A 145 7.271 -2.793 -7.166 1.00 0.00 H new ATOM 0 HA LEU A 145 6.658 -5.489 -6.265 1.00 0.00 H new ATOM 0 HB2 LEU A 145 8.994 -3.856 -7.126 1.00 0.00 H new ATOM 0 HB3 LEU A 145 9.352 -5.068 -5.912 1.00 0.00 H new ATOM 0 HG LEU A 145 8.145 -6.751 -7.356 1.00 0.00 H new ATOM 0 HD11 LEU A 145 7.907 -6.314 -9.758 1.00 0.00 H new ATOM 0 HD12 LEU A 145 6.823 -5.305 -8.772 1.00 0.00 H new ATOM 0 HD13 LEU A 145 8.297 -4.601 -9.477 1.00 0.00 H new ATOM 0 HD21 LEU A 145 10.102 -6.979 -8.935 1.00 0.00 H new ATOM 0 HD22 LEU A 145 10.581 -5.310 -8.546 1.00 0.00 H new ATOM 0 HD23 LEU A 145 10.632 -6.567 -7.287 1.00 0.00 H new ATOM 965 N PHE A 146 6.237 -4.879 -3.940 1.00 0.00 N ATOM 966 CA PHE A 146 6.051 -4.764 -2.501 1.00 0.00 C ATOM 967 C PHE A 146 6.182 -6.116 -1.846 1.00 0.00 C ATOM 968 O PHE A 146 5.747 -7.140 -2.365 1.00 0.00 O ATOM 969 CB PHE A 146 4.636 -4.287 -2.164 1.00 0.00 C ATOM 970 CG PHE A 146 4.391 -2.790 -2.298 1.00 0.00 C ATOM 971 CD1 PHE A 146 4.402 -2.163 -3.560 1.00 0.00 C ATOM 972 CD2 PHE A 146 4.262 -2.032 -1.109 1.00 0.00 C ATOM 973 CE1 PHE A 146 4.294 -0.759 -3.643 1.00 0.00 C ATOM 974 CE2 PHE A 146 4.144 -0.628 -1.193 1.00 0.00 C ATOM 975 CZ PHE A 146 4.165 -0.002 -2.455 1.00 0.00 C ATOM 0 H PHE A 146 5.467 -5.347 -4.419 1.00 0.00 H new ATOM 0 HA PHE A 146 6.804 -4.060 -2.147 1.00 0.00 H new ATOM 0 HB2 PHE A 146 3.933 -4.810 -2.812 1.00 0.00 H new ATOM 0 HB3 PHE A 146 4.407 -4.583 -1.140 1.00 0.00 H new ATOM 0 HD1 PHE A 146 4.493 -2.754 -4.459 1.00 0.00 H new ATOM 0 HD2 PHE A 146 4.254 -2.523 -0.147 1.00 0.00 H new ATOM 0 HE1 PHE A 146 4.310 -0.267 -4.604 1.00 0.00 H new ATOM 0 HE2 PHE A 146 4.038 -0.037 -0.295 1.00 0.00 H new ATOM 0 HZ PHE A 146 4.081 1.073 -2.516 1.00 0.00 H new ATOM 976 N LEU A 147 6.779 -6.054 -0.687 1.00 0.00 N ATOM 977 CA LEU A 147 6.951 -7.220 0.191 1.00 0.00 C ATOM 978 C LEU A 147 6.551 -6.840 1.620 1.00 0.00 C ATOM 979 O LEU A 147 7.162 -5.961 2.230 1.00 0.00 O ATOM 980 CB LEU A 147 8.392 -7.700 0.104 1.00 0.00 C ATOM 981 CG LEU A 147 8.554 -9.102 0.688 1.00 0.00 C ATOM 982 CD1 LEU A 147 7.922 -10.157 -0.224 1.00 0.00 C ATOM 983 CD2 LEU A 147 10.035 -9.427 0.884 1.00 0.00 C ATOM 0 H LEU A 147 7.170 -5.192 -0.306 1.00 0.00 H new ATOM 0 HA LEU A 147 6.307 -8.041 -0.124 1.00 0.00 H new ATOM 0 HB2 LEU A 147 8.714 -7.700 -0.937 1.00 0.00 H new ATOM 0 HB3 LEU A 147 9.040 -7.006 0.638 1.00 0.00 H new ATOM 0 HG LEU A 147 8.044 -9.120 1.651 1.00 0.00 H new ATOM 0 HD11 LEU A 147 8.053 -11.145 0.217 1.00 0.00 H new ATOM 0 HD12 LEU A 147 6.858 -9.949 -0.339 1.00 0.00 H new ATOM 0 HD13 LEU A 147 8.404 -10.129 -1.201 1.00 0.00 H new ATOM 0 HD21 LEU A 147 10.136 -10.429 1.301 1.00 0.00 H new ATOM 0 HD22 LEU A 147 10.548 -9.380 -0.077 1.00 0.00 H new ATOM 0 HD23 LEU A 147 10.479 -8.703 1.568 1.00 0.00 H new ATOM 984 N PRO A 148 5.346 -7.259 2.019 1.00 0.00 N ATOM 985 CA PRO A 148 4.928 -7.228 3.424 1.00 0.00 C ATOM 986 C PRO A 148 5.971 -7.913 4.319 1.00 0.00 C ATOM 987 O PRO A 148 6.482 -8.980 4.002 1.00 0.00 O ATOM 988 CB PRO A 148 3.620 -8.010 3.416 1.00 0.00 C ATOM 989 CG PRO A 148 2.997 -7.559 2.103 1.00 0.00 C ATOM 990 CD PRO A 148 4.192 -7.502 1.150 1.00 0.00 C ATOM 0 HA PRO A 148 4.819 -6.217 3.817 1.00 0.00 H new ATOM 0 HB2 PRO A 148 3.787 -9.087 3.441 1.00 0.00 H new ATOM 0 HB3 PRO A 148 2.992 -7.765 4.272 1.00 0.00 H new ATOM 0 HG2 PRO A 148 2.238 -8.260 1.756 1.00 0.00 H new ATOM 0 HG3 PRO A 148 2.513 -6.587 2.200 1.00 0.00 H new ATOM 0 HD2 PRO A 148 4.302 -8.434 0.596 1.00 0.00 H new ATOM 0 HD3 PRO A 148 4.075 -6.706 0.414 1.00 0.00 H new ATOM 991 N LEU A 149 6.416 -7.125 5.285 1.00 0.00 N ATOM 992 CA LEU A 149 7.271 -7.608 6.401 1.00 0.00 C ATOM 993 C LEU A 149 6.516 -7.449 7.733 1.00 0.00 C ATOM 994 O LEU A 149 6.698 -6.472 8.448 1.00 0.00 O ATOM 995 CB LEU A 149 8.627 -6.888 6.389 1.00 0.00 C ATOM 996 CG LEU A 149 9.475 -7.270 5.165 1.00 0.00 C ATOM 997 CD1 LEU A 149 10.792 -6.499 5.193 1.00 0.00 C ATOM 998 CD2 LEU A 149 9.783 -8.777 5.110 1.00 0.00 C ATOM 0 H LEU A 149 6.204 -6.128 5.333 1.00 0.00 H new ATOM 0 HA LEU A 149 7.487 -8.669 6.275 1.00 0.00 H new ATOM 0 HB2 LEU A 149 8.464 -5.810 6.395 1.00 0.00 H new ATOM 0 HB3 LEU A 149 9.175 -7.132 7.299 1.00 0.00 H new ATOM 0 HG LEU A 149 8.894 -7.014 4.279 1.00 0.00 H new ATOM 0 HD11 LEU A 149 11.392 -6.771 4.324 1.00 0.00 H new ATOM 0 HD12 LEU A 149 10.587 -5.429 5.172 1.00 0.00 H new ATOM 0 HD13 LEU A 149 11.339 -6.746 6.103 1.00 0.00 H new ATOM 0 HD21 LEU A 149 10.384 -8.994 4.227 1.00 0.00 H new ATOM 0 HD22 LEU A 149 10.334 -9.069 6.004 1.00 0.00 H new ATOM 0 HD23 LEU A 149 8.850 -9.338 5.060 1.00 0.00 H new ATOM 999 N PRO A 150 5.572 -8.363 8.009 1.00 0.00 N ATOM 1000 CA PRO A 150 4.710 -8.179 9.179 1.00 0.00 C ATOM 1001 C PRO A 150 5.290 -8.809 10.439 1.00 0.00 C ATOM 1002 O PRO A 150 5.573 -9.996 10.538 1.00 0.00 O ATOM 1003 CB PRO A 150 3.355 -8.674 8.745 1.00 0.00 C ATOM 1004 CG PRO A 150 3.626 -9.716 7.655 1.00 0.00 C ATOM 1005 CD PRO A 150 5.049 -9.450 7.157 1.00 0.00 C ATOM 0 HA PRO A 150 4.626 -7.138 9.491 1.00 0.00 H new ATOM 0 HB2 PRO A 150 2.812 -9.114 9.582 1.00 0.00 H new ATOM 0 HB3 PRO A 150 2.743 -7.857 8.363 1.00 0.00 H new ATOM 0 HG2 PRO A 150 3.535 -10.727 8.051 1.00 0.00 H new ATOM 0 HG3 PRO A 150 2.905 -9.626 6.842 1.00 0.00 H new ATOM 0 HD2 PRO A 150 5.667 -10.344 7.240 1.00 0.00 H new ATOM 0 HD3 PRO A 150 5.049 -9.159 6.107 1.00 0.00 H new