USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1314 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 LYS NZ :NH3+ 145:sc= 1.02 (180deg=0.00907) USER MOD Set 1.2: A 100 TYR OH : rot 165:sc= 0.868 USER MOD Set 2.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 62 TYR OH : rot 180:sc= -2.94! USER MOD Single : A 1 SER OG : rot 180:sc= 0.00475 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc=0.000368 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 GLY N :NH3+ -108:sc= 0.0473 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.0731 USER MOD Single : A 29 GLN : amide:sc= -1.58 K(o=-1.6,f=-0.38) USER MOD Single : A 34 GLN : amide:sc= -0.663 X(o=-0.66,f=-0.66) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 174:sc= -0.925 (180deg=-0.949) USER MOD Single : A 38 SER OG : rot 180:sc= 0.0319 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 143:sc= 0.139 USER MOD Single : A 46 ASN : amide:sc= -0.412 K(o=-0.41,f=-4.2!) USER MOD Single : A 48 GLN : amide:sc= -2.16 K(o=-2.2,f=-4.5!) USER MOD Single : A 53 MET CE :methyl 169:sc= -3.44 (180deg=-3.68) USER MOD Single : A 54 GLN : amide:sc= -0.728 K(o=-0.73,f=-2.3!) USER MOD Single : A 56 HIS : no HE2:sc= -2.85! C(o=-2.8!,f=-8.1!) USER MOD Single : A 57 HIS : no HD1:sc= -5.55! C(o=-5.5!,f=-7.1!) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 60 SER OG : rot -38:sc= 0.893 USER MOD Single : A 64 TYR OH : rot 30:sc= -0.435 USER MOD Single : A 65 THR OG1 : rot 64:sc= 0.843 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.3) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 161:sc= 0.691 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.0686 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= -0.641 K(o=-0.64,f=-1.3) USER MOD Single : A 114 THR OG1 : rot 180:sc= -0.0316 USER MOD Single : A 115 ASN : amide:sc= -1.15 K(o=-1.2,f=-3.3!) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=-0.0031) USER MOD Single : A 118 SER OG : rot 19:sc= 0.0742 USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.0796 USER MOD Single : A 128 GLN : amide:sc= -2.21 K(o=-2.2,f=-9.5!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.236 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 144 GLN : amide:sc= -2.83 K(o=-2.8,f=-5.1!) USER MOD Single : A 147 HIS : no HD1:sc= -1.28 K(o=-1.3,f=-0.68) USER MOD Single : A 155 SER OG : rot 151:sc= 0.147 USER MOD Single : A 156 THR OG1 : rot 180:sc= -0.105 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -33.824 -23.978 28.190 1.00 0.00 N ATOM 2 CA GLY A -1 -34.789 -23.007 28.780 1.00 0.00 C ATOM 3 C GLY A -1 -35.875 -22.672 27.748 1.00 0.00 C ATOM 4 O GLY A -1 -35.630 -22.699 26.557 1.00 0.00 O ATOM 0 H1 GLY A -1 -33.960 -24.912 28.627 1.00 0.00 H new ATOM 0 H2 GLY A -1 -33.986 -24.049 27.165 1.00 0.00 H new ATOM 0 H3 GLY A -1 -32.852 -23.652 28.366 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -35.243 -23.429 29.677 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -34.268 -22.099 29.083 1.00 0.00 H new ATOM 10 N GLY A 0 -37.076 -22.354 28.191 1.00 0.00 N ATOM 11 CA GLY A 0 -38.165 -22.020 27.225 1.00 0.00 C ATOM 12 C GLY A 0 -38.623 -20.571 27.450 1.00 0.00 C ATOM 13 O GLY A 0 -39.766 -20.326 27.784 1.00 0.00 O ATOM 0 H GLY A 0 -37.341 -22.313 29.175 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -37.810 -22.146 26.202 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -39.005 -22.703 27.357 1.00 0.00 H new ATOM 17 N SER A 1 -37.741 -19.608 27.271 1.00 0.00 N ATOM 18 CA SER A 1 -38.138 -18.183 27.478 1.00 0.00 C ATOM 19 C SER A 1 -37.926 -17.378 26.186 1.00 0.00 C ATOM 20 O SER A 1 -37.271 -17.846 25.277 1.00 0.00 O ATOM 21 CB SER A 1 -37.214 -17.673 28.583 1.00 0.00 C ATOM 22 OG SER A 1 -35.966 -18.348 28.502 1.00 0.00 O ATOM 0 H SER A 1 -36.771 -19.752 26.992 1.00 0.00 H new ATOM 0 HA SER A 1 -39.190 -18.082 27.745 1.00 0.00 H new ATOM 0 HB2 SER A 1 -37.066 -16.598 28.481 1.00 0.00 H new ATOM 0 HB3 SER A 1 -37.669 -17.841 29.559 1.00 0.00 H new ATOM 0 HG SER A 1 -35.371 -18.021 29.209 1.00 0.00 H new ATOM 28 N PRO A 2 -38.487 -16.188 26.138 1.00 0.00 N ATOM 29 CA PRO A 2 -38.338 -15.337 24.931 1.00 0.00 C ATOM 30 C PRO A 2 -36.910 -14.775 24.845 1.00 0.00 C ATOM 31 O PRO A 2 -36.232 -14.649 25.848 1.00 0.00 O ATOM 32 CB PRO A 2 -39.350 -14.216 25.151 1.00 0.00 C ATOM 33 CG PRO A 2 -39.533 -14.143 26.632 1.00 0.00 C ATOM 34 CD PRO A 2 -39.299 -15.528 27.176 1.00 0.00 C ATOM 0 HA PRO A 2 -38.509 -15.880 24.002 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -38.984 -13.270 24.752 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -40.292 -14.431 24.647 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -38.833 -13.433 27.072 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -40.536 -13.796 26.880 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -38.776 -15.498 28.132 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -40.238 -16.055 27.343 1.00 0.00 H new ATOM 42 N ARG A 3 -36.445 -14.437 23.659 1.00 0.00 N ATOM 43 CA ARG A 3 -35.064 -13.886 23.525 1.00 0.00 C ATOM 44 C ARG A 3 -35.061 -12.689 22.561 1.00 0.00 C ATOM 45 O ARG A 3 -35.748 -12.700 21.557 1.00 0.00 O ATOM 46 CB ARG A 3 -34.233 -15.036 22.956 1.00 0.00 C ATOM 47 CG ARG A 3 -32.758 -14.822 23.303 1.00 0.00 C ATOM 48 CD ARG A 3 -32.473 -15.391 24.694 1.00 0.00 C ATOM 49 NE ARG A 3 -31.308 -14.602 25.201 1.00 0.00 N ATOM 50 CZ ARG A 3 -30.085 -14.806 24.734 1.00 0.00 C ATOM 51 NH1 ARG A 3 -29.846 -15.706 23.808 1.00 0.00 N ATOM 52 NH2 ARG A 3 -29.089 -14.099 25.203 1.00 0.00 N ATOM 0 H ARG A 3 -36.965 -14.521 22.785 1.00 0.00 H new ATOM 0 HA ARG A 3 -34.668 -13.528 24.475 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -34.579 -15.985 23.364 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -34.359 -15.089 21.875 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -32.125 -15.310 22.562 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -32.518 -13.759 23.277 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -33.338 -15.284 25.349 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -32.239 -16.454 24.646 1.00 0.00 H new ATOM 0 HE ARG A 3 -31.458 -13.894 25.920 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -30.611 -16.267 23.432 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -28.896 -15.844 23.465 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -29.257 -13.397 25.923 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -28.145 -14.250 24.848 1.00 0.00 H new ATOM 66 N ILE A 4 -34.295 -11.656 22.854 1.00 0.00 N ATOM 67 CA ILE A 4 -34.259 -10.469 21.946 1.00 0.00 C ATOM 68 C ILE A 4 -32.812 -9.985 21.758 1.00 0.00 C ATOM 69 O ILE A 4 -32.014 -10.041 22.675 1.00 0.00 O ATOM 70 CB ILE A 4 -35.105 -9.399 22.646 1.00 0.00 C ATOM 71 CG1 ILE A 4 -34.522 -9.094 24.031 1.00 0.00 C ATOM 72 CG2 ILE A 4 -36.540 -9.904 22.803 1.00 0.00 C ATOM 73 CD1 ILE A 4 -35.227 -7.872 24.624 1.00 0.00 C ATOM 0 H ILE A 4 -33.699 -11.589 23.679 1.00 0.00 H new ATOM 0 HA ILE A 4 -34.644 -10.700 20.953 1.00 0.00 H new ATOM 0 HB ILE A 4 -35.098 -8.490 22.044 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -34.649 -9.954 24.688 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -33.451 -8.907 23.953 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -37.141 -9.143 23.301 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -36.962 -10.114 21.820 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -36.542 -10.816 23.400 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -34.813 -7.655 25.609 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -35.078 -7.013 23.970 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -36.294 -8.077 24.716 1.00 0.00 H new ATOM 85 N LYS A 5 -32.464 -9.508 20.578 1.00 0.00 N ATOM 86 CA LYS A 5 -31.069 -9.023 20.348 1.00 0.00 C ATOM 87 C LYS A 5 -31.072 -7.821 19.388 1.00 0.00 C ATOM 88 O LYS A 5 -32.119 -7.358 18.979 1.00 0.00 O ATOM 89 CB LYS A 5 -30.324 -10.214 19.729 1.00 0.00 C ATOM 90 CG LYS A 5 -31.014 -10.649 18.432 1.00 0.00 C ATOM 91 CD LYS A 5 -30.282 -11.856 17.844 1.00 0.00 C ATOM 92 CE LYS A 5 -30.617 -13.106 18.662 1.00 0.00 C ATOM 93 NZ LYS A 5 -29.630 -14.130 18.221 1.00 0.00 N ATOM 0 H LYS A 5 -33.086 -9.437 19.773 1.00 0.00 H new ATOM 0 HA LYS A 5 -30.594 -8.686 21.270 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -29.289 -9.940 19.525 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -30.301 -11.045 20.434 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -32.056 -10.903 18.629 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -31.016 -9.827 17.716 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -30.574 -12.000 16.804 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -29.206 -11.681 17.852 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -30.534 -12.912 19.731 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -31.639 -13.437 18.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -29.796 -15.017 18.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -29.737 -14.299 17.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -28.667 -13.790 18.416 1.00 0.00 H new ATOM 107 N THR A 6 -29.911 -7.311 19.026 1.00 0.00 N ATOM 108 CA THR A 6 -29.865 -6.142 18.097 1.00 0.00 C ATOM 109 C THR A 6 -28.909 -6.429 16.927 1.00 0.00 C ATOM 110 O THR A 6 -29.334 -6.527 15.791 1.00 0.00 O ATOM 111 CB THR A 6 -29.342 -4.983 18.946 1.00 0.00 C ATOM 112 OG1 THR A 6 -28.081 -5.333 19.499 1.00 0.00 O ATOM 113 CG2 THR A 6 -30.332 -4.686 20.073 1.00 0.00 C ATOM 0 H THR A 6 -29.002 -7.656 19.335 1.00 0.00 H new ATOM 0 HA THR A 6 -30.840 -5.921 17.662 1.00 0.00 H new ATOM 0 HB THR A 6 -29.231 -4.097 18.321 1.00 0.00 H new ATOM 0 HG1 THR A 6 -27.744 -4.590 20.042 1.00 0.00 H new ATOM 0 HG21 THR A 6 -29.958 -3.860 20.677 1.00 0.00 H new ATOM 0 HG22 THR A 6 -31.298 -4.416 19.647 1.00 0.00 H new ATOM 0 HG23 THR A 6 -30.447 -5.571 20.699 1.00 0.00 H new ATOM 121 N ARG A 7 -27.625 -6.562 17.191 1.00 0.00 N ATOM 122 CA ARG A 7 -26.660 -6.839 16.083 1.00 0.00 C ATOM 123 C ARG A 7 -25.519 -7.742 16.580 1.00 0.00 C ATOM 124 O ARG A 7 -24.873 -7.440 17.567 1.00 0.00 O ATOM 125 CB ARG A 7 -26.118 -5.468 15.677 1.00 0.00 C ATOM 126 CG ARG A 7 -27.184 -4.713 14.880 1.00 0.00 C ATOM 127 CD ARG A 7 -26.614 -3.376 14.404 1.00 0.00 C ATOM 128 NE ARG A 7 -27.811 -2.533 14.098 1.00 0.00 N ATOM 129 CZ ARG A 7 -28.523 -2.724 12.997 1.00 0.00 C ATOM 130 NH1 ARG A 7 -28.209 -3.661 12.131 1.00 0.00 N ATOM 131 NH2 ARG A 7 -29.564 -1.967 12.763 1.00 0.00 N ATOM 0 H ARG A 7 -27.211 -6.490 18.120 1.00 0.00 H new ATOM 0 HA ARG A 7 -27.132 -7.356 15.248 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -25.840 -4.898 16.564 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -25.215 -5.585 15.077 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -27.504 -5.309 14.025 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -28.065 -4.545 15.499 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -25.993 -2.916 15.172 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -25.987 -3.506 13.522 1.00 0.00 H new ATOM 0 HE ARG A 7 -28.084 -1.797 14.749 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -27.401 -4.261 12.299 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -28.773 -3.788 11.291 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -29.822 -1.236 13.426 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -30.117 -2.108 11.918 1.00 0.00 H new ATOM 145 N ARG A 8 -25.261 -8.846 15.907 1.00 0.00 N ATOM 146 CA ARG A 8 -24.161 -9.754 16.351 1.00 0.00 C ATOM 147 C ARG A 8 -23.456 -10.371 15.133 1.00 0.00 C ATOM 148 O ARG A 8 -23.901 -11.370 14.598 1.00 0.00 O ATOM 149 CB ARG A 8 -24.853 -10.840 17.178 1.00 0.00 C ATOM 150 CG ARG A 8 -23.850 -11.448 18.160 1.00 0.00 C ATOM 151 CD ARG A 8 -24.600 -12.040 19.357 1.00 0.00 C ATOM 152 NE ARG A 8 -25.410 -13.160 18.788 1.00 0.00 N ATOM 153 CZ ARG A 8 -24.847 -14.305 18.435 1.00 0.00 C ATOM 154 NH1 ARG A 8 -23.555 -14.504 18.569 1.00 0.00 N ATOM 155 NH2 ARG A 8 -25.587 -15.264 17.941 1.00 0.00 N ATOM 0 H ARG A 8 -25.765 -9.151 15.074 1.00 0.00 H new ATOM 0 HA ARG A 8 -23.398 -9.228 16.925 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -25.698 -10.416 17.720 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -25.251 -11.614 16.522 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -23.265 -12.223 17.665 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -23.148 -10.685 18.498 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -23.908 -12.400 20.118 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -25.237 -11.294 19.833 1.00 0.00 H new ATOM 0 HE ARG A 8 -26.416 -13.040 18.669 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -22.963 -13.767 18.952 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -23.145 -15.395 18.290 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -26.592 -15.127 17.830 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -25.159 -16.149 17.667 1.00 0.00 H new ATOM 169 N SER A 9 -22.361 -9.789 14.688 1.00 0.00 N ATOM 170 CA SER A 9 -21.639 -10.351 13.508 1.00 0.00 C ATOM 171 C SER A 9 -20.121 -10.263 13.724 1.00 0.00 C ATOM 172 O SER A 9 -19.509 -9.254 13.431 1.00 0.00 O ATOM 173 CB SER A 9 -22.064 -9.475 12.331 1.00 0.00 C ATOM 174 OG SER A 9 -21.893 -10.198 11.120 1.00 0.00 O ATOM 0 H SER A 9 -21.942 -8.952 15.094 1.00 0.00 H new ATOM 0 HA SER A 9 -21.875 -11.402 13.341 1.00 0.00 H new ATOM 0 HB2 SER A 9 -23.106 -9.175 12.444 1.00 0.00 H new ATOM 0 HB3 SER A 9 -21.469 -8.562 12.310 1.00 0.00 H new ATOM 0 HG SER A 9 -22.167 -9.638 10.363 1.00 0.00 H new ATOM 180 N LYS A 10 -19.500 -11.312 14.238 1.00 0.00 N ATOM 181 CA LYS A 10 -18.018 -11.282 14.474 1.00 0.00 C ATOM 182 C LYS A 10 -17.625 -10.045 15.304 1.00 0.00 C ATOM 183 O LYS A 10 -17.088 -9.094 14.770 1.00 0.00 O ATOM 184 CB LYS A 10 -17.385 -11.223 13.079 1.00 0.00 C ATOM 185 CG LYS A 10 -17.208 -12.643 12.539 1.00 0.00 C ATOM 186 CD LYS A 10 -16.081 -13.346 13.302 1.00 0.00 C ATOM 187 CE LYS A 10 -16.438 -14.821 13.501 1.00 0.00 C ATOM 188 NZ LYS A 10 -15.132 -15.506 13.721 1.00 0.00 N ATOM 0 H LYS A 10 -19.960 -12.183 14.502 1.00 0.00 H new ATOM 0 HA LYS A 10 -17.679 -12.153 15.035 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -18.016 -10.643 12.406 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -16.420 -10.718 13.127 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -18.137 -13.202 12.646 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -16.976 -12.612 11.474 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -15.145 -13.259 12.750 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -15.927 -12.865 14.268 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -17.103 -14.955 14.354 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -16.953 -15.224 12.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -15.294 -16.523 13.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -14.523 -15.367 12.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -14.668 -15.106 14.561 1.00 0.00 H new ATOM 202 N PRO A 11 -17.906 -10.090 16.589 1.00 0.00 N ATOM 203 CA PRO A 11 -17.567 -8.944 17.471 1.00 0.00 C ATOM 204 C PRO A 11 -16.053 -8.875 17.716 1.00 0.00 C ATOM 205 O PRO A 11 -15.351 -9.859 17.574 1.00 0.00 O ATOM 206 CB PRO A 11 -18.310 -9.254 18.768 1.00 0.00 C ATOM 207 CG PRO A 11 -18.481 -10.738 18.775 1.00 0.00 C ATOM 208 CD PRO A 11 -18.551 -11.184 17.337 1.00 0.00 C ATOM 0 HA PRO A 11 -17.848 -7.982 17.041 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.743 -8.919 19.637 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.274 -8.746 18.801 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -17.648 -11.219 19.287 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.389 -11.018 19.310 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -18.031 -12.130 17.187 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -19.582 -11.333 17.016 1.00 0.00 H new ATOM 216 N ALA A 12 -15.547 -7.721 18.095 1.00 0.00 N ATOM 217 CA ALA A 12 -14.077 -7.596 18.359 1.00 0.00 C ATOM 218 C ALA A 12 -13.814 -7.658 19.872 1.00 0.00 C ATOM 219 O ALA A 12 -14.635 -7.217 20.653 1.00 0.00 O ATOM 220 CB ALA A 12 -13.665 -6.231 17.792 1.00 0.00 C ATOM 0 H ALA A 12 -16.086 -6.866 18.232 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.507 -8.402 17.897 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.598 -6.077 17.953 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.879 -6.201 16.724 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.225 -5.444 18.296 1.00 0.00 H new ATOM 226 N PRO A 13 -12.681 -8.212 20.250 1.00 0.00 N ATOM 227 CA PRO A 13 -12.345 -8.324 21.693 1.00 0.00 C ATOM 228 C PRO A 13 -12.043 -6.944 22.291 1.00 0.00 C ATOM 229 O PRO A 13 -11.793 -5.994 21.575 1.00 0.00 O ATOM 230 CB PRO A 13 -11.099 -9.209 21.706 1.00 0.00 C ATOM 231 CG PRO A 13 -10.486 -9.028 20.356 1.00 0.00 C ATOM 232 CD PRO A 13 -11.619 -8.773 19.397 1.00 0.00 C ATOM 0 HA PRO A 13 -13.161 -8.735 22.288 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.410 -8.910 22.496 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.357 -10.253 21.886 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.785 -8.193 20.358 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -9.924 -9.915 20.064 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.328 -8.077 18.610 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.943 -9.691 18.907 1.00 0.00 H new ATOM 240 N ASP A 14 -12.072 -6.827 23.605 1.00 0.00 N ATOM 241 CA ASP A 14 -11.789 -5.491 24.259 1.00 0.00 C ATOM 242 C ASP A 14 -10.506 -4.849 23.692 1.00 0.00 C ATOM 243 O ASP A 14 -10.402 -3.639 23.614 1.00 0.00 O ATOM 244 CB ASP A 14 -11.613 -5.768 25.760 1.00 0.00 C ATOM 245 CG ASP A 14 -11.568 -4.442 26.522 1.00 0.00 C ATOM 246 OD1 ASP A 14 -12.431 -3.613 26.281 1.00 0.00 O ATOM 247 OD2 ASP A 14 -10.673 -4.279 27.334 1.00 0.00 O ATOM 0 H ASP A 14 -12.277 -7.589 24.251 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.606 -4.795 24.068 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -12.436 -6.382 26.126 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -10.695 -6.330 25.932 1.00 0.00 H new ATOM 252 N GLY A 15 -9.529 -5.641 23.293 1.00 0.00 N ATOM 253 CA GLY A 15 -8.264 -5.064 22.733 1.00 0.00 C ATOM 254 C GLY A 15 -8.577 -4.076 21.591 1.00 0.00 C ATOM 255 O GLY A 15 -7.884 -3.090 21.424 1.00 0.00 O ATOM 0 H GLY A 15 -9.557 -6.660 23.333 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.711 -4.554 23.521 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.625 -5.866 22.363 1.00 0.00 H new ATOM 259 N PHE A 16 -9.612 -4.322 20.804 1.00 0.00 N ATOM 260 CA PHE A 16 -9.940 -3.366 19.682 1.00 0.00 C ATOM 261 C PHE A 16 -10.130 -1.937 20.223 1.00 0.00 C ATOM 262 O PHE A 16 -9.808 -0.975 19.552 1.00 0.00 O ATOM 263 CB PHE A 16 -11.246 -3.860 19.036 1.00 0.00 C ATOM 264 CG PHE A 16 -11.563 -3.014 17.822 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.597 -2.823 16.824 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.824 -2.419 17.695 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.893 -2.039 15.703 1.00 0.00 C ATOM 268 CE2 PHE A 16 -13.119 -1.634 16.573 1.00 0.00 C ATOM 269 CZ PHE A 16 -12.154 -1.445 15.577 1.00 0.00 C ATOM 0 H PHE A 16 -10.232 -5.127 20.888 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.127 -3.338 18.956 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.148 -4.906 18.747 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.063 -3.803 19.755 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.624 -3.281 16.920 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.570 -2.565 18.462 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -10.148 -1.892 14.935 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -14.092 -1.174 16.476 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.382 -0.841 14.711 1.00 0.00 H new ATOM 279 N GLU A 17 -10.647 -1.784 21.429 1.00 0.00 N ATOM 280 CA GLU A 17 -10.842 -0.392 21.990 1.00 0.00 C ATOM 281 C GLU A 17 -9.519 0.391 21.939 1.00 0.00 C ATOM 282 O GLU A 17 -9.509 1.576 21.662 1.00 0.00 O ATOM 283 CB GLU A 17 -11.298 -0.560 23.448 1.00 0.00 C ATOM 284 CG GLU A 17 -11.750 0.793 24.000 1.00 0.00 C ATOM 285 CD GLU A 17 -12.210 0.627 25.449 1.00 0.00 C ATOM 286 OE1 GLU A 17 -11.356 0.465 26.306 1.00 0.00 O ATOM 287 OE2 GLU A 17 -13.408 0.664 25.679 1.00 0.00 O ATOM 0 H GLU A 17 -10.938 -2.546 22.041 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.580 0.162 21.409 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.115 -1.279 23.504 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.482 -0.957 24.052 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.931 1.511 23.948 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.563 1.192 23.393 1.00 0.00 H new ATOM 294 N LYS A 18 -8.403 -0.262 22.192 1.00 0.00 N ATOM 295 CA LYS A 18 -7.083 0.468 22.141 1.00 0.00 C ATOM 296 C LYS A 18 -6.869 1.074 20.745 1.00 0.00 C ATOM 297 O LYS A 18 -6.345 2.164 20.615 1.00 0.00 O ATOM 298 CB LYS A 18 -5.988 -0.568 22.440 1.00 0.00 C ATOM 299 CG LYS A 18 -6.090 -1.016 23.900 1.00 0.00 C ATOM 300 CD LYS A 18 -5.213 -2.251 24.116 1.00 0.00 C ATOM 301 CE LYS A 18 -5.291 -2.684 25.583 1.00 0.00 C ATOM 302 NZ LYS A 18 -4.057 -3.486 25.812 1.00 0.00 N ATOM 0 H LYS A 18 -8.346 -1.253 22.428 1.00 0.00 H new ATOM 0 HA LYS A 18 -7.059 1.282 22.866 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.095 -1.427 21.777 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -5.005 -0.138 22.249 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -5.772 -0.211 24.562 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -7.126 -1.244 24.150 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -5.544 -3.063 23.468 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.181 -2.029 23.846 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.331 -1.821 26.248 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -6.187 -3.275 25.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -4.037 -3.819 26.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -4.050 -4.304 25.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.220 -2.896 25.629 1.00 0.00 H new ATOM 316 N ILE A 19 -7.274 0.383 19.697 1.00 0.00 N ATOM 317 CA ILE A 19 -7.092 0.938 18.318 1.00 0.00 C ATOM 318 C ILE A 19 -8.462 1.179 17.645 1.00 0.00 C ATOM 319 O ILE A 19 -8.604 1.003 16.450 1.00 0.00 O ATOM 320 CB ILE A 19 -6.273 -0.119 17.550 1.00 0.00 C ATOM 321 CG1 ILE A 19 -7.057 -1.441 17.439 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.945 -0.378 18.278 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.874 -2.033 16.039 1.00 0.00 C ATOM 0 H ILE A 19 -7.719 -0.534 19.741 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.582 1.901 18.332 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.077 0.261 16.547 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.707 -2.147 18.192 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.115 -1.265 17.635 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.370 -1.126 17.731 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.374 0.549 18.334 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.147 -0.741 19.286 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.430 -2.968 15.964 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.246 -1.329 15.295 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.816 -2.224 15.860 1.00 0.00 H new ATOM 335 N LYS A 20 -9.474 1.565 18.401 1.00 0.00 N ATOM 336 CA LYS A 20 -10.832 1.794 17.782 1.00 0.00 C ATOM 337 C LYS A 20 -10.971 3.194 17.138 1.00 0.00 C ATOM 338 O LYS A 20 -11.513 3.297 16.054 1.00 0.00 O ATOM 339 CB LYS A 20 -11.858 1.630 18.913 1.00 0.00 C ATOM 340 CG LYS A 20 -13.237 1.343 18.315 1.00 0.00 C ATOM 341 CD LYS A 20 -14.021 2.650 18.182 1.00 0.00 C ATOM 342 CE LYS A 20 -14.967 2.562 16.983 1.00 0.00 C ATOM 343 NZ LYS A 20 -16.200 1.916 17.514 1.00 0.00 N ATOM 0 H LYS A 20 -9.421 1.730 19.406 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.989 1.079 16.974 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.560 0.816 19.573 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.894 2.535 19.519 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.130 0.870 17.339 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.781 0.644 18.950 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.589 2.839 19.093 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.334 3.487 18.055 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -15.182 3.550 16.576 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.529 1.974 16.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.899 1.820 16.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.965 0.975 17.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -16.598 2.502 18.276 1.00 0.00 H new ATOM 357 N PRO A 21 -10.516 4.238 17.810 1.00 0.00 N ATOM 358 CA PRO A 21 -10.661 5.604 17.242 1.00 0.00 C ATOM 359 C PRO A 21 -9.630 5.862 16.130 1.00 0.00 C ATOM 360 O PRO A 21 -9.928 6.534 15.160 1.00 0.00 O ATOM 361 CB PRO A 21 -10.420 6.522 18.434 1.00 0.00 C ATOM 362 CG PRO A 21 -9.586 5.728 19.388 1.00 0.00 C ATOM 363 CD PRO A 21 -9.839 4.266 19.116 1.00 0.00 C ATOM 0 HA PRO A 21 -11.635 5.760 16.778 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.907 7.434 18.129 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -11.361 6.824 18.893 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -8.530 5.963 19.259 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.844 5.975 20.418 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.907 3.701 19.091 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.460 3.821 19.893 1.00 0.00 H new ATOM 371 N THR A 22 -8.421 5.346 16.254 1.00 0.00 N ATOM 372 CA THR A 22 -7.395 5.594 15.173 1.00 0.00 C ATOM 373 C THR A 22 -7.914 5.068 13.827 1.00 0.00 C ATOM 374 O THR A 22 -7.763 5.714 12.807 1.00 0.00 O ATOM 375 CB THR A 22 -6.118 4.841 15.587 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.677 5.321 16.854 1.00 0.00 O ATOM 377 CG2 THR A 22 -5.020 5.074 14.546 1.00 0.00 C ATOM 0 H THR A 22 -8.104 4.776 17.038 1.00 0.00 H new ATOM 0 HA THR A 22 -7.195 6.659 15.058 1.00 0.00 H new ATOM 0 HB THR A 22 -6.333 3.774 15.652 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.865 4.842 17.121 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.118 4.539 14.843 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.355 4.709 13.575 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.804 6.140 14.478 1.00 0.00 H new ATOM 385 N LEU A 23 -8.535 3.908 13.815 1.00 0.00 N ATOM 386 CA LEU A 23 -9.068 3.366 12.515 1.00 0.00 C ATOM 387 C LEU A 23 -10.213 4.262 12.020 1.00 0.00 C ATOM 388 O LEU A 23 -10.305 4.557 10.843 1.00 0.00 O ATOM 389 CB LEU A 23 -9.583 1.947 12.802 1.00 0.00 C ATOM 390 CG LEU A 23 -8.421 0.953 12.709 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.597 -0.155 13.756 1.00 0.00 C ATOM 392 CD2 LEU A 23 -8.391 0.336 11.306 1.00 0.00 C ATOM 0 H LEU A 23 -8.695 3.320 14.633 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.298 3.345 11.744 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.032 1.906 13.794 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.362 1.680 12.088 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.483 1.476 12.898 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.767 -0.858 13.684 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.614 0.286 14.753 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.535 -0.680 13.576 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.565 -0.372 11.237 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.330 -0.183 11.117 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.256 1.124 10.565 1.00 0.00 H new ATOM 404 N THR A 24 -11.080 4.713 12.908 1.00 0.00 N ATOM 405 CA THR A 24 -12.207 5.607 12.459 1.00 0.00 C ATOM 406 C THR A 24 -11.643 6.878 11.801 1.00 0.00 C ATOM 407 O THR A 24 -12.213 7.391 10.857 1.00 0.00 O ATOM 408 CB THR A 24 -13.014 5.975 13.715 1.00 0.00 C ATOM 409 OG1 THR A 24 -13.146 4.829 14.544 1.00 0.00 O ATOM 410 CG2 THR A 24 -14.401 6.473 13.305 1.00 0.00 C ATOM 0 H THR A 24 -11.057 4.505 13.906 1.00 0.00 H new ATOM 0 HA THR A 24 -12.836 5.103 11.726 1.00 0.00 H new ATOM 0 HB THR A 24 -12.495 6.762 14.263 1.00 0.00 H new ATOM 0 HG1 THR A 24 -13.659 5.063 15.346 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.972 6.734 14.196 1.00 0.00 H new ATOM 0 HG22 THR A 24 -14.299 7.353 12.670 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.922 5.688 12.757 1.00 0.00 H new ATOM 418 N ASP A 25 -10.524 7.391 12.282 1.00 0.00 N ATOM 419 CA ASP A 25 -9.941 8.635 11.654 1.00 0.00 C ATOM 420 C ASP A 25 -9.685 8.405 10.153 1.00 0.00 C ATOM 421 O ASP A 25 -9.870 9.301 9.350 1.00 0.00 O ATOM 422 CB ASP A 25 -8.612 8.913 12.376 1.00 0.00 C ATOM 423 CG ASP A 25 -8.877 9.745 13.633 1.00 0.00 C ATOM 424 OD1 ASP A 25 -9.668 10.671 13.550 1.00 0.00 O ATOM 425 OD2 ASP A 25 -8.286 9.442 14.656 1.00 0.00 O ATOM 0 H ASP A 25 -9.997 7.011 13.068 1.00 0.00 H new ATOM 0 HA ASP A 25 -10.626 9.477 11.749 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.128 7.974 12.644 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.930 9.445 11.712 1.00 0.00 H new ATOM 430 N PHE A 26 -9.262 7.216 9.764 1.00 0.00 N ATOM 431 CA PHE A 26 -9.002 6.960 8.299 1.00 0.00 C ATOM 432 C PHE A 26 -10.275 7.216 7.473 1.00 0.00 C ATOM 433 O PHE A 26 -10.205 7.723 6.368 1.00 0.00 O ATOM 434 CB PHE A 26 -8.594 5.484 8.175 1.00 0.00 C ATOM 435 CG PHE A 26 -7.098 5.359 8.326 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.517 5.423 9.597 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.295 5.176 7.195 1.00 0.00 C ATOM 438 CE1 PHE A 26 -5.130 5.306 9.739 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.906 5.059 7.337 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.324 5.125 8.609 1.00 0.00 C ATOM 0 H PHE A 26 -9.088 6.425 10.384 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.223 7.624 7.924 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.098 4.891 8.939 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.906 5.090 7.208 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.139 5.563 10.469 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.745 5.125 6.214 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.681 5.355 10.720 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.284 4.918 6.465 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.253 5.036 8.718 1.00 0.00 H new ATOM 450 N GLU A 27 -11.436 6.860 7.988 1.00 0.00 N ATOM 451 CA GLU A 27 -12.701 7.082 7.198 1.00 0.00 C ATOM 452 C GLU A 27 -12.899 8.575 6.904 1.00 0.00 C ATOM 453 O GLU A 27 -13.313 8.940 5.819 1.00 0.00 O ATOM 454 CB GLU A 27 -13.863 6.554 8.053 1.00 0.00 C ATOM 455 CG GLU A 27 -13.783 5.028 8.137 1.00 0.00 C ATOM 456 CD GLU A 27 -14.563 4.412 6.973 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.614 4.940 6.644 1.00 0.00 O ATOM 458 OE2 GLU A 27 -14.096 3.425 6.430 1.00 0.00 O ATOM 0 H GLU A 27 -11.563 6.432 8.905 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.651 6.563 6.241 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.819 6.987 9.053 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.815 6.855 7.617 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.742 4.705 8.103 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -14.193 4.683 9.086 1.00 0.00 H new ATOM 465 N ILE A 28 -12.607 9.444 7.848 1.00 0.00 N ATOM 466 CA ILE A 28 -12.792 10.915 7.577 1.00 0.00 C ATOM 467 C ILE A 28 -11.800 11.353 6.484 1.00 0.00 C ATOM 468 O ILE A 28 -12.158 12.098 5.590 1.00 0.00 O ATOM 469 CB ILE A 28 -12.546 11.657 8.912 1.00 0.00 C ATOM 470 CG1 ILE A 28 -13.709 11.365 9.875 1.00 0.00 C ATOM 471 CG2 ILE A 28 -12.474 13.173 8.670 1.00 0.00 C ATOM 472 CD1 ILE A 28 -13.307 10.267 10.860 1.00 0.00 C ATOM 0 H ILE A 28 -12.256 9.208 8.776 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.795 11.144 7.217 1.00 0.00 H new ATOM 0 HB ILE A 28 -11.604 11.313 9.340 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -13.979 12.271 10.418 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -14.590 11.056 9.312 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -12.301 13.685 9.617 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.657 13.393 7.983 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -13.414 13.518 8.238 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -14.136 10.066 11.539 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -13.059 9.359 10.311 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -12.439 10.593 11.434 1.00 0.00 H new ATOM 484 N GLN A 29 -10.567 10.886 6.531 1.00 0.00 N ATOM 485 CA GLN A 29 -9.590 11.281 5.456 1.00 0.00 C ATOM 486 C GLN A 29 -10.036 10.649 4.132 1.00 0.00 C ATOM 487 O GLN A 29 -10.126 11.320 3.122 1.00 0.00 O ATOM 488 CB GLN A 29 -8.214 10.742 5.877 1.00 0.00 C ATOM 489 CG GLN A 29 -7.119 11.451 5.076 1.00 0.00 C ATOM 490 CD GLN A 29 -5.877 11.638 5.958 1.00 0.00 C ATOM 491 OE1 GLN A 29 -5.331 12.722 6.029 1.00 0.00 O ATOM 492 NE2 GLN A 29 -5.400 10.625 6.640 1.00 0.00 N ATOM 0 H GLN A 29 -10.201 10.262 7.251 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.543 12.362 5.325 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -8.060 10.903 6.944 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -8.165 9.667 5.706 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.865 10.867 4.192 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.479 12.419 4.726 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.854 9.713 6.584 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -4.575 10.748 7.227 1.00 0.00 H new ATOM 501 N LEU A 30 -10.347 9.366 4.135 1.00 0.00 N ATOM 502 CA LEU A 30 -10.826 8.718 2.859 1.00 0.00 C ATOM 503 C LEU A 30 -12.148 9.380 2.428 1.00 0.00 C ATOM 504 O LEU A 30 -12.392 9.568 1.251 1.00 0.00 O ATOM 505 CB LEU A 30 -11.046 7.221 3.162 1.00 0.00 C ATOM 506 CG LEU A 30 -10.463 6.370 2.024 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.672 5.196 2.609 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.600 5.832 1.150 1.00 0.00 C ATOM 0 H LEU A 30 -10.292 8.750 4.947 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.102 8.835 2.052 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.570 6.958 4.106 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.111 7.016 3.274 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.799 6.988 1.419 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.260 4.595 1.798 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.859 5.577 3.227 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.333 4.580 3.218 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.184 5.228 0.343 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.266 5.218 1.756 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.160 6.666 0.728 1.00 0.00 H new ATOM 520 N ARG A 31 -13.003 9.749 3.371 1.00 0.00 N ATOM 521 CA ARG A 31 -14.303 10.414 2.989 1.00 0.00 C ATOM 522 C ARG A 31 -14.020 11.680 2.165 1.00 0.00 C ATOM 523 O ARG A 31 -14.696 11.950 1.190 1.00 0.00 O ATOM 524 CB ARG A 31 -15.004 10.808 4.301 1.00 0.00 C ATOM 525 CG ARG A 31 -15.784 9.616 4.857 1.00 0.00 C ATOM 526 CD ARG A 31 -15.996 9.800 6.373 1.00 0.00 C ATOM 527 NE ARG A 31 -17.468 9.589 6.620 1.00 0.00 N ATOM 528 CZ ARG A 31 -18.099 10.217 7.604 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.462 10.996 8.448 1.00 0.00 N ATOM 530 NH2 ARG A 31 -19.386 10.039 7.760 1.00 0.00 N ATOM 0 H ARG A 31 -12.858 9.620 4.372 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.921 9.744 2.392 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.266 11.142 5.031 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.680 11.645 4.125 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.746 9.531 4.352 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.240 8.691 4.665 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.400 9.084 6.939 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.687 10.795 6.691 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.989 8.951 6.019 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.455 11.131 8.357 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -17.974 11.466 9.195 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.896 9.422 7.128 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.879 10.518 8.514 1.00 0.00 H new ATOM 544 N ASP A 32 -13.029 12.463 2.551 1.00 0.00 N ATOM 545 CA ASP A 32 -12.728 13.714 1.769 1.00 0.00 C ATOM 546 C ASP A 32 -12.326 13.348 0.335 1.00 0.00 C ATOM 547 O ASP A 32 -12.795 13.950 -0.610 1.00 0.00 O ATOM 548 CB ASP A 32 -11.565 14.423 2.483 1.00 0.00 C ATOM 549 CG ASP A 32 -12.026 14.900 3.862 1.00 0.00 C ATOM 550 OD1 ASP A 32 -12.903 15.746 3.913 1.00 0.00 O ATOM 551 OD2 ASP A 32 -11.493 14.410 4.844 1.00 0.00 O ATOM 0 H ASP A 32 -12.427 12.294 3.357 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.602 14.364 1.717 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.719 13.743 2.586 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.223 15.271 1.889 1.00 0.00 H new ATOM 556 N ALA A 33 -11.470 12.364 0.160 1.00 0.00 N ATOM 557 CA ALA A 33 -11.067 11.976 -1.239 1.00 0.00 C ATOM 558 C ALA A 33 -12.261 11.339 -1.962 1.00 0.00 C ATOM 559 O ALA A 33 -12.480 11.587 -3.134 1.00 0.00 O ATOM 560 CB ALA A 33 -9.926 10.957 -1.106 1.00 0.00 C ATOM 0 H ALA A 33 -11.039 11.821 0.908 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.747 12.845 -1.814 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.599 10.645 -2.098 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.090 11.414 -0.576 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.277 10.088 -0.550 1.00 0.00 H new ATOM 566 N GLN A 34 -13.040 10.524 -1.279 1.00 0.00 N ATOM 567 CA GLN A 34 -14.224 9.886 -1.956 1.00 0.00 C ATOM 568 C GLN A 34 -15.301 10.942 -2.277 1.00 0.00 C ATOM 569 O GLN A 34 -16.024 10.804 -3.245 1.00 0.00 O ATOM 570 CB GLN A 34 -14.785 8.842 -0.977 1.00 0.00 C ATOM 571 CG GLN A 34 -13.801 7.678 -0.851 1.00 0.00 C ATOM 572 CD GLN A 34 -14.524 6.457 -0.272 1.00 0.00 C ATOM 573 OE1 GLN A 34 -15.082 6.528 0.806 1.00 0.00 O ATOM 574 NE2 GLN A 34 -14.541 5.328 -0.939 1.00 0.00 N ATOM 0 H GLN A 34 -12.911 10.276 -0.298 1.00 0.00 H new ATOM 0 HA GLN A 34 -13.927 9.425 -2.898 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.953 9.297 -0.001 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.750 8.479 -1.330 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.381 7.436 -1.827 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -12.968 7.960 -0.207 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -14.074 5.263 -1.844 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.021 4.515 -0.553 1.00 0.00 H new ATOM 583 N LYS A 35 -15.428 11.989 -1.476 1.00 0.00 N ATOM 584 CA LYS A 35 -16.480 13.024 -1.767 1.00 0.00 C ATOM 585 C LYS A 35 -15.898 14.241 -2.510 1.00 0.00 C ATOM 586 O LYS A 35 -16.600 14.888 -3.266 1.00 0.00 O ATOM 587 CB LYS A 35 -17.036 13.449 -0.402 1.00 0.00 C ATOM 588 CG LYS A 35 -17.890 12.319 0.177 1.00 0.00 C ATOM 589 CD LYS A 35 -18.942 12.904 1.122 1.00 0.00 C ATOM 590 CE LYS A 35 -20.252 13.118 0.361 1.00 0.00 C ATOM 591 NZ LYS A 35 -21.299 13.211 1.417 1.00 0.00 N ATOM 0 H LYS A 35 -14.858 12.166 -0.649 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.253 12.614 -2.417 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.218 13.685 0.278 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.635 14.354 -0.507 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -18.376 11.768 -0.628 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.259 11.610 0.713 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.104 12.231 1.964 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -18.590 13.850 1.534 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -20.216 14.027 -0.240 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -20.452 12.292 -0.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -22.228 13.358 0.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -21.315 12.330 1.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -21.086 14.010 2.047 1.00 0.00 H new ATOM 605 N ASP A 36 -14.634 14.571 -2.313 1.00 0.00 N ATOM 606 CA ASP A 36 -14.058 15.766 -3.036 1.00 0.00 C ATOM 607 C ASP A 36 -14.186 15.583 -4.558 1.00 0.00 C ATOM 608 O ASP A 36 -14.432 16.535 -5.276 1.00 0.00 O ATOM 609 CB ASP A 36 -12.576 15.860 -2.638 1.00 0.00 C ATOM 610 CG ASP A 36 -12.454 16.579 -1.293 1.00 0.00 C ATOM 611 OD1 ASP A 36 -13.227 17.494 -1.060 1.00 0.00 O ATOM 612 OD2 ASP A 36 -11.589 16.204 -0.519 1.00 0.00 O ATOM 0 H ASP A 36 -13.988 14.077 -1.697 1.00 0.00 H new ATOM 0 HA ASP A 36 -14.594 16.676 -2.766 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.143 14.862 -2.570 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.016 16.399 -3.403 1.00 0.00 H new ATOM 617 N LYS A 37 -14.024 14.372 -5.064 1.00 0.00 N ATOM 618 CA LYS A 37 -14.144 14.160 -6.555 1.00 0.00 C ATOM 619 C LYS A 37 -15.496 14.694 -7.066 1.00 0.00 C ATOM 620 O LYS A 37 -15.573 15.273 -8.131 1.00 0.00 O ATOM 621 CB LYS A 37 -14.054 12.645 -6.795 1.00 0.00 C ATOM 622 CG LYS A 37 -13.777 12.378 -8.276 1.00 0.00 C ATOM 623 CD LYS A 37 -13.353 10.920 -8.462 1.00 0.00 C ATOM 624 CE LYS A 37 -11.827 10.822 -8.417 1.00 0.00 C ATOM 625 NZ LYS A 37 -11.394 10.882 -9.841 1.00 0.00 N ATOM 0 H LYS A 37 -13.817 13.535 -4.520 1.00 0.00 H new ATOM 0 HA LYS A 37 -13.356 14.692 -7.087 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -13.261 12.216 -6.183 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -14.985 12.163 -6.495 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -14.669 12.586 -8.867 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.993 13.044 -8.636 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -13.791 10.300 -7.680 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -13.724 10.541 -9.414 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -11.396 11.639 -7.839 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -11.505 9.894 -7.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -10.356 10.923 -9.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -11.730 10.035 -10.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -11.794 11.731 -10.290 1.00 0.00 H new ATOM 639 N SER A 38 -16.566 14.506 -6.313 1.00 0.00 N ATOM 640 CA SER A 38 -17.910 15.008 -6.758 1.00 0.00 C ATOM 641 C SER A 38 -18.238 14.513 -8.179 1.00 0.00 C ATOM 642 O SER A 38 -17.586 13.625 -8.694 1.00 0.00 O ATOM 643 CB SER A 38 -17.800 16.535 -6.733 1.00 0.00 C ATOM 644 OG SER A 38 -19.076 17.101 -7.000 1.00 0.00 O ATOM 0 H SER A 38 -16.562 14.027 -5.412 1.00 0.00 H new ATOM 0 HA SER A 38 -18.709 14.646 -6.111 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.437 16.869 -5.761 1.00 0.00 H new ATOM 0 HB3 SER A 38 -17.077 16.871 -7.476 1.00 0.00 H new ATOM 0 HG SER A 38 -19.010 18.079 -6.983 1.00 0.00 H new ATOM 650 N SER A 39 -19.243 15.081 -8.818 1.00 0.00 N ATOM 651 CA SER A 39 -19.596 14.629 -10.208 1.00 0.00 C ATOM 652 C SER A 39 -18.948 15.551 -11.254 1.00 0.00 C ATOM 653 O SER A 39 -18.480 15.091 -12.278 1.00 0.00 O ATOM 654 CB SER A 39 -21.124 14.704 -10.301 1.00 0.00 C ATOM 655 OG SER A 39 -21.553 14.077 -11.503 1.00 0.00 O ATOM 0 H SER A 39 -19.826 15.828 -8.442 1.00 0.00 H new ATOM 0 HA SER A 39 -19.234 13.620 -10.403 1.00 0.00 H new ATOM 0 HB2 SER A 39 -21.577 14.213 -9.440 1.00 0.00 H new ATOM 0 HB3 SER A 39 -21.450 15.744 -10.283 1.00 0.00 H new ATOM 0 HG SER A 39 -22.530 14.122 -11.565 1.00 0.00 H new ATOM 661 N LYS A 40 -18.907 16.847 -11.009 1.00 0.00 N ATOM 662 CA LYS A 40 -18.278 17.776 -12.002 1.00 0.00 C ATOM 663 C LYS A 40 -16.917 18.258 -11.478 1.00 0.00 C ATOM 664 O LYS A 40 -16.811 19.334 -10.920 1.00 0.00 O ATOM 665 CB LYS A 40 -19.249 18.953 -12.140 1.00 0.00 C ATOM 666 CG LYS A 40 -19.105 19.575 -13.531 1.00 0.00 C ATOM 667 CD LYS A 40 -20.123 18.943 -14.481 1.00 0.00 C ATOM 668 CE LYS A 40 -19.561 17.633 -15.035 1.00 0.00 C ATOM 669 NZ LYS A 40 -20.101 17.537 -16.419 1.00 0.00 N ATOM 0 H LYS A 40 -19.279 17.294 -10.171 1.00 0.00 H new ATOM 0 HA LYS A 40 -18.102 17.291 -12.962 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -20.273 18.613 -11.987 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -19.043 19.700 -11.373 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -19.262 20.652 -13.477 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -18.094 19.419 -13.908 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -21.059 18.756 -13.955 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -20.348 19.629 -15.298 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -18.471 17.640 -15.036 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -19.873 16.782 -14.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -19.759 16.662 -16.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -21.140 17.525 -16.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -19.782 18.357 -16.974 1.00 0.00 H new ATOM 683 N LEU A 41 -15.872 17.471 -11.648 1.00 0.00 N ATOM 684 CA LEU A 41 -14.525 17.894 -11.151 1.00 0.00 C ATOM 685 C LEU A 41 -13.411 17.197 -11.954 1.00 0.00 C ATOM 686 O LEU A 41 -12.947 16.137 -11.578 1.00 0.00 O ATOM 687 CB LEU A 41 -14.488 17.452 -9.688 1.00 0.00 C ATOM 688 CG LEU A 41 -13.335 18.156 -8.971 1.00 0.00 C ATOM 689 CD1 LEU A 41 -13.617 19.658 -8.903 1.00 0.00 C ATOM 690 CD2 LEU A 41 -13.201 17.598 -7.553 1.00 0.00 C ATOM 0 H LEU A 41 -15.898 16.561 -12.107 1.00 0.00 H new ATOM 0 HA LEU A 41 -14.365 18.967 -11.259 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -15.433 17.691 -9.201 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -14.362 16.371 -9.627 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.408 17.985 -9.519 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.795 20.160 -8.392 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -13.713 20.056 -9.913 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.544 19.830 -8.355 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -12.379 18.099 -7.041 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -14.128 17.769 -7.006 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -13.000 16.528 -7.601 1.00 0.00 H new ATOM 702 N ALA A 42 -12.977 17.782 -13.051 1.00 0.00 N ATOM 703 CA ALA A 42 -11.890 17.139 -13.862 1.00 0.00 C ATOM 704 C ALA A 42 -10.544 17.844 -13.621 1.00 0.00 C ATOM 705 O ALA A 42 -9.741 17.969 -14.526 1.00 0.00 O ATOM 706 CB ALA A 42 -12.315 17.302 -15.318 1.00 0.00 C ATOM 0 H ALA A 42 -13.326 18.668 -13.416 1.00 0.00 H new ATOM 0 HA ALA A 42 -11.755 16.092 -13.591 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -11.564 16.853 -15.969 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -13.273 16.807 -15.475 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.411 18.362 -15.552 1.00 0.00 H new ATOM 712 N ALA A 43 -10.289 18.301 -12.414 1.00 0.00 N ATOM 713 CA ALA A 43 -8.993 18.990 -12.130 1.00 0.00 C ATOM 714 C ALA A 43 -8.310 18.340 -10.917 1.00 0.00 C ATOM 715 O ALA A 43 -8.867 18.303 -9.836 1.00 0.00 O ATOM 716 CB ALA A 43 -9.374 20.438 -11.822 1.00 0.00 C ATOM 0 H ALA A 43 -10.923 18.225 -11.618 1.00 0.00 H new ATOM 0 HA ALA A 43 -8.294 18.924 -12.964 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.474 21.012 -11.602 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.880 20.872 -12.684 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -10.040 20.463 -10.960 1.00 0.00 H new ATOM 722 N LYS A 44 -7.105 17.819 -11.081 1.00 0.00 N ATOM 723 CA LYS A 44 -6.392 17.168 -9.931 1.00 0.00 C ATOM 724 C LYS A 44 -7.284 16.094 -9.280 1.00 0.00 C ATOM 725 O LYS A 44 -7.578 16.159 -8.100 1.00 0.00 O ATOM 726 CB LYS A 44 -6.094 18.300 -8.941 1.00 0.00 C ATOM 727 CG LYS A 44 -5.153 19.315 -9.592 1.00 0.00 C ATOM 728 CD LYS A 44 -5.973 20.448 -10.212 1.00 0.00 C ATOM 729 CE LYS A 44 -5.047 21.616 -10.563 1.00 0.00 C ATOM 730 NZ LYS A 44 -5.905 22.829 -10.465 1.00 0.00 N ATOM 0 H LYS A 44 -6.590 17.819 -11.962 1.00 0.00 H new ATOM 0 HA LYS A 44 -5.480 16.664 -10.252 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.021 18.788 -8.641 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.640 17.896 -8.036 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.463 19.716 -8.849 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -4.549 18.828 -10.358 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -6.484 20.094 -11.107 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.743 20.778 -9.515 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -4.204 21.672 -9.875 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -4.633 21.505 -11.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -5.341 23.673 -10.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -6.695 22.750 -11.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -6.279 22.913 -9.498 1.00 0.00 H new ATOM 744 N SER A 45 -7.720 15.106 -10.037 1.00 0.00 N ATOM 745 CA SER A 45 -8.594 14.039 -9.446 1.00 0.00 C ATOM 746 C SER A 45 -7.786 12.760 -9.169 1.00 0.00 C ATOM 747 O SER A 45 -7.927 12.152 -8.124 1.00 0.00 O ATOM 748 CB SER A 45 -9.685 13.768 -10.488 1.00 0.00 C ATOM 749 OG SER A 45 -10.830 14.554 -10.184 1.00 0.00 O ATOM 0 H SER A 45 -7.509 14.995 -11.029 1.00 0.00 H new ATOM 0 HA SER A 45 -9.017 14.356 -8.493 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.319 14.009 -11.486 1.00 0.00 H new ATOM 0 HB3 SER A 45 -9.946 12.710 -10.491 1.00 0.00 H new ATOM 0 HG SER A 45 -11.244 14.864 -11.016 1.00 0.00 H new ATOM 755 N ASN A 46 -6.943 12.342 -10.091 1.00 0.00 N ATOM 756 CA ASN A 46 -6.135 11.088 -9.854 1.00 0.00 C ATOM 757 C ASN A 46 -5.295 11.233 -8.574 1.00 0.00 C ATOM 758 O ASN A 46 -5.174 10.300 -7.803 1.00 0.00 O ATOM 759 CB ASN A 46 -5.213 10.917 -11.072 1.00 0.00 C ATOM 760 CG ASN A 46 -6.054 10.580 -12.309 1.00 0.00 C ATOM 761 OD1 ASN A 46 -7.113 11.142 -12.503 1.00 0.00 O ATOM 762 ND2 ASN A 46 -5.630 9.681 -13.163 1.00 0.00 N ATOM 0 H ASN A 46 -6.779 12.804 -10.985 1.00 0.00 H new ATOM 0 HA ASN A 46 -6.786 10.222 -9.730 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.646 11.832 -11.243 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.489 10.124 -10.885 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -6.189 9.456 -13.986 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -4.741 9.206 -13.005 1.00 0.00 H new ATOM 769 N GLU A 47 -4.717 12.396 -8.338 1.00 0.00 N ATOM 770 CA GLU A 47 -3.890 12.574 -7.089 1.00 0.00 C ATOM 771 C GLU A 47 -4.758 12.332 -5.843 1.00 0.00 C ATOM 772 O GLU A 47 -4.309 11.736 -4.881 1.00 0.00 O ATOM 773 CB GLU A 47 -3.376 14.023 -7.099 1.00 0.00 C ATOM 774 CG GLU A 47 -2.437 14.224 -8.291 1.00 0.00 C ATOM 775 CD GLU A 47 -1.438 15.337 -7.971 1.00 0.00 C ATOM 776 OE1 GLU A 47 -1.760 16.487 -8.225 1.00 0.00 O ATOM 777 OE2 GLU A 47 -0.367 15.022 -7.479 1.00 0.00 O ATOM 0 H GLU A 47 -4.779 13.215 -8.943 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.063 11.865 -7.063 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.214 14.717 -7.162 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.851 14.240 -6.169 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -1.907 13.297 -8.510 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.012 14.481 -9.181 1.00 0.00 H new ATOM 784 N GLN A 48 -5.999 12.784 -5.849 1.00 0.00 N ATOM 785 CA GLN A 48 -6.877 12.559 -4.643 1.00 0.00 C ATOM 786 C GLN A 48 -7.077 11.053 -4.421 1.00 0.00 C ATOM 787 O GLN A 48 -6.965 10.568 -3.310 1.00 0.00 O ATOM 788 CB GLN A 48 -8.232 13.229 -4.937 1.00 0.00 C ATOM 789 CG GLN A 48 -8.769 13.880 -3.663 1.00 0.00 C ATOM 790 CD GLN A 48 -9.867 14.883 -4.034 1.00 0.00 C ATOM 791 OE1 GLN A 48 -9.844 16.013 -3.587 1.00 0.00 O ATOM 792 NE2 GLN A 48 -10.836 14.522 -4.841 1.00 0.00 N ATOM 0 H GLN A 48 -6.435 13.289 -6.620 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.423 12.980 -3.746 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.116 13.979 -5.720 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -8.942 12.489 -5.307 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.167 13.119 -2.991 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -7.963 14.385 -3.131 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -10.859 13.575 -5.218 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -11.566 15.189 -5.091 1.00 0.00 H new ATOM 801 N LEU A 49 -7.373 10.304 -5.467 1.00 0.00 N ATOM 802 CA LEU A 49 -7.577 8.820 -5.288 1.00 0.00 C ATOM 803 C LEU A 49 -6.309 8.173 -4.707 1.00 0.00 C ATOM 804 O LEU A 49 -6.394 7.262 -3.904 1.00 0.00 O ATOM 805 CB LEU A 49 -7.877 8.240 -6.680 1.00 0.00 C ATOM 806 CG LEU A 49 -9.353 8.461 -7.018 1.00 0.00 C ATOM 807 CD1 LEU A 49 -9.625 7.995 -8.449 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.224 7.656 -6.049 1.00 0.00 C ATOM 0 H LEU A 49 -7.481 10.648 -6.421 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.396 8.621 -4.596 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.246 8.719 -7.429 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.644 7.175 -6.700 1.00 0.00 H new ATOM 0 HG LEU A 49 -9.590 9.521 -6.929 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -10.676 8.153 -8.689 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.005 8.565 -9.141 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.387 6.935 -8.538 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.276 7.813 -6.289 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.985 6.596 -6.140 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.032 7.985 -5.028 1.00 0.00 H new ATOM 820 N TRP A 50 -5.132 8.628 -5.099 1.00 0.00 N ATOM 821 CA TRP A 50 -3.873 8.010 -4.539 1.00 0.00 C ATOM 822 C TRP A 50 -3.858 8.141 -3.011 1.00 0.00 C ATOM 823 O TRP A 50 -3.447 7.227 -2.319 1.00 0.00 O ATOM 824 CB TRP A 50 -2.681 8.754 -5.178 1.00 0.00 C ATOM 825 CG TRP A 50 -2.715 8.620 -6.683 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.527 7.787 -7.394 1.00 0.00 C ATOM 827 CD2 TRP A 50 -1.907 9.326 -7.672 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.275 7.955 -8.741 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.287 8.888 -8.963 1.00 0.00 C ATOM 830 CE3 TRP A 50 -0.895 10.298 -7.576 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -1.690 9.394 -10.112 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -0.287 10.807 -8.737 1.00 0.00 C ATOM 833 CH2 TRP A 50 -0.688 10.354 -10.003 1.00 0.00 C ATOM 0 H TRP A 50 -4.989 9.384 -5.768 1.00 0.00 H new ATOM 0 HA TRP A 50 -3.817 6.946 -4.769 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -2.712 9.808 -4.901 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.745 8.350 -4.793 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.251 7.106 -6.972 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -3.761 7.450 -9.481 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -0.583 10.655 -6.606 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.002 9.044 -11.085 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 0.492 11.550 -8.654 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -0.220 10.750 -10.892 1.00 0.00 H new ATOM 844 N GLU A 51 -4.330 9.247 -2.469 1.00 0.00 N ATOM 845 CA GLU A 51 -4.357 9.375 -0.969 1.00 0.00 C ATOM 846 C GLU A 51 -5.252 8.274 -0.370 1.00 0.00 C ATOM 847 O GLU A 51 -4.983 7.782 0.710 1.00 0.00 O ATOM 848 CB GLU A 51 -4.931 10.764 -0.648 1.00 0.00 C ATOM 849 CG GLU A 51 -4.555 11.154 0.783 1.00 0.00 C ATOM 850 CD GLU A 51 -4.789 12.653 0.983 1.00 0.00 C ATOM 851 OE1 GLU A 51 -5.794 13.145 0.498 1.00 0.00 O ATOM 852 OE2 GLU A 51 -3.959 13.281 1.619 1.00 0.00 O ATOM 0 H GLU A 51 -4.690 10.049 -2.986 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.359 9.264 -0.545 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.543 11.501 -1.351 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -6.015 10.756 -0.761 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -5.152 10.584 1.495 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.510 10.910 0.975 1.00 0.00 H new ATOM 859 N ILE A 52 -6.304 7.867 -1.064 1.00 0.00 N ATOM 860 CA ILE A 52 -7.179 6.778 -0.505 1.00 0.00 C ATOM 861 C ILE A 52 -6.415 5.448 -0.563 1.00 0.00 C ATOM 862 O ILE A 52 -6.170 4.838 0.461 1.00 0.00 O ATOM 863 CB ILE A 52 -8.454 6.740 -1.370 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.188 8.075 -1.212 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.361 5.596 -0.905 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.443 8.109 -2.091 1.00 0.00 C ATOM 0 H ILE A 52 -6.586 8.235 -1.973 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.449 6.957 0.536 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.191 6.578 -2.415 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.465 8.222 -0.168 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.524 8.895 -1.485 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.261 5.573 -1.519 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.831 4.649 -1.002 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.637 5.752 0.138 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -10.950 9.066 -1.964 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.159 7.984 -3.136 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.114 7.301 -1.799 1.00 0.00 H new ATOM 878 N MET A 53 -6.008 4.999 -1.738 1.00 0.00 N ATOM 879 CA MET A 53 -5.228 3.706 -1.786 1.00 0.00 C ATOM 880 C MET A 53 -3.924 3.854 -0.978 1.00 0.00 C ATOM 881 O MET A 53 -3.444 2.890 -0.410 1.00 0.00 O ATOM 882 CB MET A 53 -4.934 3.354 -3.261 1.00 0.00 C ATOM 883 CG MET A 53 -4.235 4.508 -3.994 1.00 0.00 C ATOM 884 SD MET A 53 -5.070 4.809 -5.580 1.00 0.00 S ATOM 885 CE MET A 53 -4.687 3.214 -6.338 1.00 0.00 C ATOM 0 H MET A 53 -6.174 5.453 -2.636 1.00 0.00 H new ATOM 0 HA MET A 53 -5.809 2.898 -1.341 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.307 2.463 -3.304 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.867 3.112 -3.770 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.258 5.409 -3.382 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.186 4.264 -4.163 1.00 0.00 H new ATOM 0 HE1 MET A 53 -5.269 3.096 -7.252 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.624 3.170 -6.576 1.00 0.00 H new ATOM 0 HE3 MET A 53 -4.936 2.412 -5.643 1.00 0.00 H new ATOM 895 N GLN A 54 -3.357 5.049 -0.884 1.00 0.00 N ATOM 896 CA GLN A 54 -2.105 5.206 -0.062 1.00 0.00 C ATOM 897 C GLN A 54 -2.456 5.034 1.426 1.00 0.00 C ATOM 898 O GLN A 54 -1.695 4.454 2.178 1.00 0.00 O ATOM 899 CB GLN A 54 -1.566 6.622 -0.326 1.00 0.00 C ATOM 900 CG GLN A 54 -0.845 6.650 -1.676 1.00 0.00 C ATOM 901 CD GLN A 54 0.509 5.940 -1.549 1.00 0.00 C ATOM 902 OE1 GLN A 54 0.568 4.727 -1.533 1.00 0.00 O ATOM 903 NE2 GLN A 54 1.611 6.645 -1.456 1.00 0.00 N ATOM 0 H GLN A 54 -3.700 5.899 -1.330 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.355 4.461 -0.326 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.385 7.341 -0.324 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.882 6.917 0.470 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.454 6.160 -2.436 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.698 7.680 -2.000 1.00 0.00 H new ATOM 0 HE21 GLN A 54 1.567 7.664 -1.469 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.512 6.174 -1.371 1.00 0.00 H new ATOM 912 N LEU A 55 -3.612 5.517 1.863 1.00 0.00 N ATOM 913 CA LEU A 55 -3.999 5.347 3.314 1.00 0.00 C ATOM 914 C LEU A 55 -3.911 3.863 3.717 1.00 0.00 C ATOM 915 O LEU A 55 -3.575 3.546 4.843 1.00 0.00 O ATOM 916 CB LEU A 55 -5.452 5.836 3.452 1.00 0.00 C ATOM 917 CG LEU A 55 -5.468 7.330 3.782 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.880 7.886 3.576 1.00 0.00 C ATOM 919 CD2 LEU A 55 -5.051 7.532 5.242 1.00 0.00 C ATOM 0 H LEU A 55 -4.292 6.013 1.287 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.329 5.914 3.961 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.996 5.653 2.525 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.961 5.276 4.236 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.773 7.854 3.126 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.890 8.950 3.811 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.180 7.741 2.538 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.576 7.363 4.232 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.062 8.596 5.480 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.748 7.007 5.895 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.046 7.137 5.391 1.00 0.00 H new ATOM 931 N HIS A 56 -4.204 2.944 2.809 1.00 0.00 N ATOM 932 CA HIS A 56 -4.123 1.480 3.171 1.00 0.00 C ATOM 933 C HIS A 56 -2.729 1.152 3.735 1.00 0.00 C ATOM 934 O HIS A 56 -2.605 0.381 4.668 1.00 0.00 O ATOM 935 CB HIS A 56 -4.366 0.689 1.875 1.00 0.00 C ATOM 936 CG HIS A 56 -4.408 -0.781 2.188 1.00 0.00 C ATOM 937 ND1 HIS A 56 -5.553 -1.402 2.664 1.00 0.00 N ATOM 938 CD2 HIS A 56 -3.457 -1.766 2.100 1.00 0.00 C ATOM 939 CE1 HIS A 56 -5.263 -2.703 2.844 1.00 0.00 C ATOM 940 NE2 HIS A 56 -3.997 -2.979 2.515 1.00 0.00 N ATOM 0 H HIS A 56 -4.491 3.141 1.850 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.860 1.223 3.932 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.304 1.001 1.416 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.574 0.896 1.155 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.451 -0.954 2.845 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -2.442 -1.621 1.760 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -5.967 -3.436 3.210 1.00 0.00 H new ATOM 948 N HIS A 57 -1.679 1.739 3.188 1.00 0.00 N ATOM 949 CA HIS A 57 -0.303 1.447 3.730 1.00 0.00 C ATOM 950 C HIS A 57 -0.233 1.880 5.199 1.00 0.00 C ATOM 951 O HIS A 57 0.207 1.130 6.049 1.00 0.00 O ATOM 952 CB HIS A 57 0.694 2.262 2.889 1.00 0.00 C ATOM 953 CG HIS A 57 1.138 1.446 1.707 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.298 1.732 1.004 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.589 0.349 1.093 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.408 0.824 0.019 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.392 -0.043 0.028 1.00 0.00 N ATOM 0 H HIS A 57 -1.713 2.394 2.407 1.00 0.00 H new ATOM 0 HA HIS A 57 -0.072 0.383 3.675 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.229 3.188 2.551 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.555 2.541 3.496 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.328 -0.137 1.392 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.219 0.799 -0.693 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.238 -0.824 -0.609 1.00 0.00 H new ATOM 965 N GLN A 58 -0.682 3.081 5.511 1.00 0.00 N ATOM 966 CA GLN A 58 -0.651 3.535 6.947 1.00 0.00 C ATOM 967 C GLN A 58 -1.485 2.573 7.813 1.00 0.00 C ATOM 968 O GLN A 58 -1.126 2.285 8.939 1.00 0.00 O ATOM 969 CB GLN A 58 -1.260 4.946 6.979 1.00 0.00 C ATOM 970 CG GLN A 58 -0.811 5.669 8.251 1.00 0.00 C ATOM 971 CD GLN A 58 -1.167 7.156 8.148 1.00 0.00 C ATOM 972 OE1 GLN A 58 -0.688 7.844 7.269 1.00 0.00 O ATOM 973 NE2 GLN A 58 -1.995 7.692 9.014 1.00 0.00 N ATOM 0 H GLN A 58 -1.062 3.755 4.847 1.00 0.00 H new ATOM 0 HA GLN A 58 0.366 3.544 7.340 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.947 5.508 6.099 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.348 4.885 6.948 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.295 5.228 9.122 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.264 5.550 8.389 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -2.400 7.119 9.754 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.233 8.682 8.947 1.00 0.00 H new ATOM 982 N ARG A 59 -2.590 2.062 7.296 1.00 0.00 N ATOM 983 CA ARG A 59 -3.420 1.107 8.113 1.00 0.00 C ATOM 984 C ARG A 59 -2.603 -0.160 8.406 1.00 0.00 C ATOM 985 O ARG A 59 -2.513 -0.587 9.544 1.00 0.00 O ATOM 986 CB ARG A 59 -4.661 0.761 7.273 1.00 0.00 C ATOM 987 CG ARG A 59 -5.763 1.796 7.532 1.00 0.00 C ATOM 988 CD ARG A 59 -6.435 2.177 6.210 1.00 0.00 C ATOM 989 NE ARG A 59 -7.127 0.932 5.755 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.246 0.518 6.330 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.793 1.183 7.322 1.00 0.00 N ATOM 992 NH2 ARG A 59 -8.824 -0.575 5.904 1.00 0.00 N ATOM 0 H ARG A 59 -2.946 2.262 6.361 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.713 1.548 9.066 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.403 0.747 6.214 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.018 -0.237 7.528 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.502 1.389 8.223 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.339 2.682 8.004 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -7.143 2.994 6.348 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.702 2.512 5.476 1.00 0.00 H new ATOM 0 HE ARG A 59 -6.730 0.391 4.987 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -8.356 2.038 7.665 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.655 0.844 7.749 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -8.413 -1.102 5.134 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -9.686 -0.900 6.342 1.00 0.00 H new ATOM 1006 N SER A 60 -1.993 -0.761 7.400 1.00 0.00 N ATOM 1007 CA SER A 60 -1.172 -1.993 7.667 1.00 0.00 C ATOM 1008 C SER A 60 0.009 -1.623 8.571 1.00 0.00 C ATOM 1009 O SER A 60 0.340 -2.353 9.482 1.00 0.00 O ATOM 1010 CB SER A 60 -0.668 -2.502 6.308 1.00 0.00 C ATOM 1011 OG SER A 60 0.185 -1.523 5.727 1.00 0.00 O ATOM 0 H SER A 60 -2.028 -0.458 6.427 1.00 0.00 H new ATOM 0 HA SER A 60 -1.757 -2.765 8.167 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.129 -3.441 6.435 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.511 -2.705 5.647 1.00 0.00 H new ATOM 0 HG SER A 60 -0.165 -0.628 5.921 1.00 0.00 H new ATOM 1017 N ARG A 61 0.640 -0.486 8.342 1.00 0.00 N ATOM 1018 CA ARG A 61 1.789 -0.087 9.228 1.00 0.00 C ATOM 1019 C ARG A 61 1.285 0.089 10.670 1.00 0.00 C ATOM 1020 O ARG A 61 1.956 -0.286 11.610 1.00 0.00 O ATOM 1021 CB ARG A 61 2.331 1.246 8.686 1.00 0.00 C ATOM 1022 CG ARG A 61 3.592 1.636 9.462 1.00 0.00 C ATOM 1023 CD ARG A 61 3.862 3.134 9.285 1.00 0.00 C ATOM 1024 NE ARG A 61 4.212 3.627 10.652 1.00 0.00 N ATOM 1025 CZ ARG A 61 5.356 3.296 11.232 1.00 0.00 C ATOM 1026 NH1 ARG A 61 6.230 2.522 10.631 1.00 0.00 N ATOM 1027 NH2 ARG A 61 5.627 3.747 12.429 1.00 0.00 N ATOM 0 H ARG A 61 0.414 0.170 7.595 1.00 0.00 H new ATOM 0 HA ARG A 61 2.572 -0.846 9.232 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.558 1.154 7.624 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.575 2.025 8.784 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.468 1.401 10.519 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.444 1.058 9.105 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.677 3.308 8.582 1.00 0.00 H new ATOM 0 HD3 ARG A 61 2.986 3.649 8.892 1.00 0.00 H new ATOM 0 HE ARG A 61 3.557 4.231 11.148 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.035 2.162 9.697 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.104 2.281 11.098 1.00 0.00 H new ATOM 0 HH21 ARG A 61 4.959 4.350 12.910 1.00 0.00 H new ATOM 0 HH22 ARG A 61 6.506 3.496 12.882 1.00 0.00 H new ATOM 1041 N TYR A 62 0.101 0.646 10.856 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.427 0.823 12.257 1.00 0.00 C ATOM 1043 C TYR A 62 -0.614 -0.557 12.909 1.00 0.00 C ATOM 1044 O TYR A 62 -0.122 -0.802 13.997 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.782 1.547 12.126 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.412 1.718 13.490 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -3.148 0.668 14.054 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -2.261 2.922 14.187 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.732 0.823 15.315 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.846 3.077 15.450 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.582 2.027 16.014 1.00 0.00 C ATOM 1052 OH TYR A 62 -4.158 2.181 17.258 1.00 0.00 O ATOM 0 H TYR A 62 -0.512 0.980 10.112 1.00 0.00 H new ATOM 0 HA TYR A 62 0.259 1.398 12.879 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.639 2.521 11.658 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.447 0.976 11.478 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.264 -0.261 13.515 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.694 3.731 13.751 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.299 0.013 15.750 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.730 4.006 15.989 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.956 3.075 17.604 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.308 -1.465 12.251 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.497 -2.831 12.857 1.00 0.00 C ATOM 1064 C ILE A 63 -0.154 -3.581 12.851 1.00 0.00 C ATOM 1065 O ILE A 63 0.168 -4.283 13.790 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.544 -3.561 11.994 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.877 -2.809 12.070 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.742 -4.987 12.516 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.882 -3.439 11.102 1.00 0.00 C ATOM 0 H ILE A 63 -1.744 -1.324 11.339 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.838 -2.773 13.891 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.197 -3.597 10.961 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.267 -2.843 13.087 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.727 -1.758 11.821 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.483 -5.499 11.903 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.796 -5.527 12.468 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.088 -4.952 13.549 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.828 -2.901 11.159 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.493 -3.382 10.085 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.041 -4.483 11.371 1.00 0.00 H new ATOM 1081 N TYR A 64 0.642 -3.427 11.810 1.00 0.00 N ATOM 1082 CA TYR A 64 1.972 -4.127 11.786 1.00 0.00 C ATOM 1083 C TYR A 64 2.863 -3.545 12.890 1.00 0.00 C ATOM 1084 O TYR A 64 3.542 -4.271 13.588 1.00 0.00 O ATOM 1085 CB TYR A 64 2.596 -3.848 10.407 1.00 0.00 C ATOM 1086 CG TYR A 64 3.754 -4.788 10.171 1.00 0.00 C ATOM 1087 CD1 TYR A 64 4.928 -4.666 10.926 1.00 0.00 C ATOM 1088 CD2 TYR A 64 3.651 -5.782 9.195 1.00 0.00 C ATOM 1089 CE1 TYR A 64 5.996 -5.542 10.703 1.00 0.00 C ATOM 1090 CE2 TYR A 64 4.717 -6.657 8.970 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.891 -6.539 9.724 1.00 0.00 C ATOM 1092 OH TYR A 64 6.944 -7.403 9.502 1.00 0.00 O ATOM 0 H TYR A 64 0.432 -2.857 10.991 1.00 0.00 H new ATOM 0 HA TYR A 64 1.866 -5.199 11.953 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.847 -3.976 9.626 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.938 -2.814 10.355 1.00 0.00 H new ATOM 0 HD1 TYR A 64 5.008 -3.896 11.679 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.746 -5.874 8.613 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.901 -5.450 11.285 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.635 -7.424 8.214 1.00 0.00 H new ATOM 0 HH TYR A 64 7.444 -7.530 10.335 1.00 0.00 H new ATOM 1102 N THR A 65 2.868 -2.239 13.057 1.00 0.00 N ATOM 1103 CA THR A 65 3.735 -1.636 14.126 1.00 0.00 C ATOM 1104 C THR A 65 3.325 -2.164 15.508 1.00 0.00 C ATOM 1105 O THR A 65 4.171 -2.435 16.338 1.00 0.00 O ATOM 1106 CB THR A 65 3.543 -0.108 14.056 1.00 0.00 C ATOM 1107 OG1 THR A 65 3.926 0.355 12.770 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.411 0.575 15.118 1.00 0.00 C ATOM 0 H THR A 65 2.320 -1.575 12.510 1.00 0.00 H new ATOM 0 HA THR A 65 4.781 -1.902 13.971 1.00 0.00 H new ATOM 0 HB THR A 65 2.495 0.131 14.239 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.334 -0.034 12.093 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.271 1.655 15.063 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.121 0.221 16.107 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.459 0.336 14.940 1.00 0.00 H new ATOM 1116 N LEU A 66 2.042 -2.296 15.783 1.00 0.00 N ATOM 1117 CA LEU A 66 1.639 -2.790 17.144 1.00 0.00 C ATOM 1118 C LEU A 66 1.681 -4.333 17.248 1.00 0.00 C ATOM 1119 O LEU A 66 2.008 -4.863 18.295 1.00 0.00 O ATOM 1120 CB LEU A 66 0.227 -2.229 17.433 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.840 -2.906 16.560 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.296 -4.216 17.218 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -2.041 -1.961 16.413 1.00 0.00 C ATOM 0 H LEU A 66 1.276 -2.089 15.142 1.00 0.00 H new ATOM 0 HA LEU A 66 2.349 -2.438 17.893 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.016 -2.377 18.485 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.218 -1.154 17.252 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.421 -3.127 15.578 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.053 -4.692 16.595 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.442 -4.885 17.327 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.717 -4.002 18.200 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.803 -2.435 15.794 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.456 -1.744 17.397 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.718 -1.032 15.943 1.00 0.00 H new ATOM 1135 N TYR A 67 1.347 -5.065 16.199 1.00 0.00 N ATOM 1136 CA TYR A 67 1.374 -6.574 16.309 1.00 0.00 C ATOM 1137 C TYR A 67 2.772 -7.152 16.006 1.00 0.00 C ATOM 1138 O TYR A 67 3.143 -8.169 16.562 1.00 0.00 O ATOM 1139 CB TYR A 67 0.343 -7.116 15.302 1.00 0.00 C ATOM 1140 CG TYR A 67 0.254 -8.627 15.432 1.00 0.00 C ATOM 1141 CD1 TYR A 67 1.235 -9.437 14.844 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -0.800 -9.218 16.146 1.00 0.00 C ATOM 1143 CE1 TYR A 67 1.165 -10.830 14.971 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -0.870 -10.614 16.273 1.00 0.00 C ATOM 1145 CZ TYR A 67 0.114 -11.417 15.686 1.00 0.00 C ATOM 1146 OH TYR A 67 0.047 -12.790 15.811 1.00 0.00 O ATOM 0 H TYR A 67 1.063 -4.696 15.292 1.00 0.00 H new ATOM 0 HA TYR A 67 1.132 -6.873 17.329 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.633 -6.666 15.487 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.632 -6.844 14.287 1.00 0.00 H new ATOM 0 HD1 TYR A 67 2.046 -8.986 14.292 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.559 -8.597 16.599 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.922 -11.452 14.517 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.682 -11.067 16.823 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.743 -13.032 16.338 1.00 0.00 H new ATOM 1156 N TYR A 68 3.540 -6.548 15.120 1.00 0.00 N ATOM 1157 CA TYR A 68 4.892 -7.133 14.798 1.00 0.00 C ATOM 1158 C TYR A 68 6.051 -6.443 15.560 1.00 0.00 C ATOM 1159 O TYR A 68 7.176 -6.904 15.485 1.00 0.00 O ATOM 1160 CB TYR A 68 5.073 -6.969 13.279 1.00 0.00 C ATOM 1161 CG TYR A 68 4.513 -8.180 12.564 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.970 -9.460 12.900 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.537 -8.024 11.566 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.456 -10.583 12.242 1.00 0.00 C ATOM 1165 CE2 TYR A 68 3.026 -9.150 10.908 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.485 -10.429 11.246 1.00 0.00 C ATOM 1167 OH TYR A 68 2.980 -11.537 10.597 1.00 0.00 O ATOM 0 H TYR A 68 3.298 -5.695 14.616 1.00 0.00 H new ATOM 0 HA TYR A 68 4.926 -8.177 15.111 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.565 -6.067 12.938 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.130 -6.850 13.040 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.720 -9.581 13.668 1.00 0.00 H new ATOM 0 HD2 TYR A 68 3.181 -7.038 11.307 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.809 -11.570 12.503 1.00 0.00 H new ATOM 0 HE2 TYR A 68 2.277 -9.032 10.139 1.00 0.00 H new ATOM 0 HH TYR A 68 2.315 -11.254 9.936 1.00 0.00 H new ATOM 1177 N LYS A 69 5.816 -5.369 16.296 1.00 0.00 N ATOM 1178 CA LYS A 69 6.951 -4.721 17.037 1.00 0.00 C ATOM 1179 C LYS A 69 6.575 -4.498 18.512 1.00 0.00 C ATOM 1180 O LYS A 69 7.248 -4.984 19.402 1.00 0.00 O ATOM 1181 CB LYS A 69 7.197 -3.371 16.355 1.00 0.00 C ATOM 1182 CG LYS A 69 7.452 -3.563 14.857 1.00 0.00 C ATOM 1183 CD LYS A 69 7.217 -2.234 14.135 1.00 0.00 C ATOM 1184 CE LYS A 69 8.553 -1.515 13.935 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.408 -0.786 12.644 1.00 0.00 N ATOM 0 H LYS A 69 4.905 -4.924 16.412 1.00 0.00 H new ATOM 0 HA LYS A 69 7.840 -5.351 17.015 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.335 -2.720 16.502 1.00 0.00 H new ATOM 0 HB3 LYS A 69 8.052 -2.876 16.815 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.473 -3.906 14.690 1.00 0.00 H new ATOM 0 HG3 LYS A 69 6.789 -4.330 14.458 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.740 -2.412 13.171 1.00 0.00 H new ATOM 0 HD3 LYS A 69 6.539 -1.608 14.715 1.00 0.00 H new ATOM 0 HE2 LYS A 69 8.758 -0.828 14.756 1.00 0.00 H new ATOM 0 HE3 LYS A 69 9.381 -2.223 13.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 9.286 -0.268 12.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.220 -1.466 11.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.617 -0.114 12.712 1.00 0.00 H new ATOM 1199 N ARG A 70 5.510 -3.767 18.783 1.00 0.00 N ATOM 1200 CA ARG A 70 5.118 -3.528 20.220 1.00 0.00 C ATOM 1201 C ARG A 70 4.544 -4.809 20.851 1.00 0.00 C ATOM 1202 O ARG A 70 4.647 -5.006 22.047 1.00 0.00 O ATOM 1203 CB ARG A 70 4.048 -2.425 20.210 1.00 0.00 C ATOM 1204 CG ARG A 70 4.639 -1.145 19.615 1.00 0.00 C ATOM 1205 CD ARG A 70 3.518 -0.300 18.999 1.00 0.00 C ATOM 1206 NE ARG A 70 3.785 1.095 19.465 1.00 0.00 N ATOM 1207 CZ ARG A 70 4.749 1.827 18.929 1.00 0.00 C ATOM 1208 NH1 ARG A 70 5.511 1.357 17.967 1.00 0.00 N ATOM 1209 NH2 ARG A 70 4.954 3.043 19.363 1.00 0.00 N ATOM 0 H ARG A 70 4.905 -3.333 18.086 1.00 0.00 H new ATOM 0 HA ARG A 70 5.987 -3.235 20.809 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.186 -2.746 19.626 1.00 0.00 H new ATOM 0 HB3 ARG A 70 3.694 -2.238 21.224 1.00 0.00 H new ATOM 0 HG2 ARG A 70 5.154 -0.576 20.389 1.00 0.00 H new ATOM 0 HG3 ARG A 70 5.380 -1.393 18.856 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.530 -0.362 17.911 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.538 -0.645 19.327 1.00 0.00 H new ATOM 0 HE ARG A 70 3.213 1.491 20.211 1.00 0.00 H new ATOM 0 HH11 ARG A 70 5.366 0.410 17.618 1.00 0.00 H new ATOM 0 HH12 ARG A 70 6.248 1.940 17.569 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.373 3.423 20.110 1.00 0.00 H new ATOM 0 HH22 ARG A 70 5.695 3.612 18.954 1.00 0.00 H new ATOM 1223 N LYS A 71 3.929 -5.684 20.071 1.00 0.00 N ATOM 1224 CA LYS A 71 3.346 -6.939 20.647 1.00 0.00 C ATOM 1225 C LYS A 71 2.307 -6.591 21.722 1.00 0.00 C ATOM 1226 O LYS A 71 2.264 -7.206 22.772 1.00 0.00 O ATOM 1227 CB LYS A 71 4.520 -7.720 21.256 1.00 0.00 C ATOM 1228 CG LYS A 71 4.130 -9.191 21.409 1.00 0.00 C ATOM 1229 CD LYS A 71 5.382 -10.026 21.683 1.00 0.00 C ATOM 1230 CE LYS A 71 5.010 -11.242 22.535 1.00 0.00 C ATOM 1231 NZ LYS A 71 4.122 -12.063 21.665 1.00 0.00 N ATOM 0 H LYS A 71 3.810 -5.577 19.064 1.00 0.00 H new ATOM 0 HA LYS A 71 2.838 -7.532 19.887 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.400 -7.630 20.619 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.785 -7.300 22.226 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.418 -9.306 22.226 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.636 -9.543 20.503 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.828 -10.350 20.743 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.129 -9.422 22.199 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.897 -11.801 22.834 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.499 -10.942 23.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 4.070 -13.032 22.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.169 -11.647 21.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.506 -12.084 20.699 1.00 0.00 H new ATOM 1245 N ALA A 72 1.456 -5.619 21.461 1.00 0.00 N ATOM 1246 CA ALA A 72 0.410 -5.250 22.462 1.00 0.00 C ATOM 1247 C ALA A 72 -0.980 -5.671 21.948 1.00 0.00 C ATOM 1248 O ALA A 72 -1.966 -5.005 22.203 1.00 0.00 O ATOM 1249 CB ALA A 72 0.495 -3.728 22.598 1.00 0.00 C ATOM 0 H ALA A 72 1.445 -5.071 20.601 1.00 0.00 H new ATOM 0 HA ALA A 72 0.564 -5.747 23.420 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.247 -3.385 23.319 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.491 -3.448 22.941 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.301 -3.265 21.630 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.067 -6.773 21.227 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.393 -7.232 20.702 1.00 0.00 C ATOM 1257 C ILE A 73 -2.392 -8.765 20.562 1.00 0.00 C ATOM 1258 O ILE A 73 -1.342 -9.381 20.552 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.539 -6.549 19.332 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -3.865 -6.967 18.686 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.378 -6.955 18.417 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.075 -6.190 17.383 1.00 0.00 C ATOM 0 H ILE A 73 -0.276 -7.369 20.983 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.221 -6.975 21.363 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.525 -5.468 19.472 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.860 -8.038 18.485 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.690 -6.775 19.372 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.490 -6.467 17.449 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.434 -6.651 18.870 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.383 -8.036 18.280 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.019 -6.491 16.928 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.099 -5.121 17.597 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.256 -6.404 16.696 1.00 0.00 H new ATOM 1274 N SER A 74 -3.545 -9.386 20.453 1.00 0.00 N ATOM 1275 CA SER A 74 -3.571 -10.876 20.314 1.00 0.00 C ATOM 1276 C SER A 74 -3.962 -11.272 18.882 1.00 0.00 C ATOM 1277 O SER A 74 -4.770 -10.615 18.256 1.00 0.00 O ATOM 1278 CB SER A 74 -4.622 -11.362 21.313 1.00 0.00 C ATOM 1279 OG SER A 74 -4.577 -12.780 21.390 1.00 0.00 O ATOM 0 H SER A 74 -4.458 -8.931 20.454 1.00 0.00 H new ATOM 0 HA SER A 74 -2.595 -11.319 20.510 1.00 0.00 H new ATOM 0 HB2 SER A 74 -4.436 -10.927 22.295 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.614 -11.035 21.003 1.00 0.00 H new ATOM 0 HG SER A 74 -5.248 -13.094 22.031 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.390 -12.345 18.355 1.00 0.00 N ATOM 1286 CA LYS A 75 -3.733 -12.792 16.949 1.00 0.00 C ATOM 1287 C LYS A 75 -5.254 -12.764 16.696 1.00 0.00 C ATOM 1288 O LYS A 75 -5.685 -12.505 15.591 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.214 -14.231 16.811 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.082 -14.589 15.330 1.00 0.00 C ATOM 1291 CD LYS A 75 -2.671 -16.056 15.192 1.00 0.00 C ATOM 1292 CE LYS A 75 -1.942 -16.260 13.863 1.00 0.00 C ATOM 1293 NZ LYS A 75 -1.524 -17.690 13.869 1.00 0.00 N ATOM 0 H LYS A 75 -2.704 -12.928 18.835 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.278 -12.120 16.222 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.248 -14.329 17.307 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -3.897 -14.923 17.303 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.029 -14.416 14.818 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.341 -13.947 14.855 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -2.024 -16.343 16.021 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.551 -16.697 15.238 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.595 -16.043 13.017 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.081 -15.597 13.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -1.016 -17.907 12.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.898 -17.865 14.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -2.365 -18.297 13.943 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.073 -13.023 17.701 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.562 -12.987 17.466 1.00 0.00 C ATOM 1309 C ASP A 76 -7.973 -11.574 17.026 1.00 0.00 C ATOM 1310 O ASP A 76 -8.652 -11.411 16.029 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.238 -13.352 18.797 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.105 -14.855 19.044 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -6.985 -15.338 19.041 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -9.125 -15.499 19.230 1.00 0.00 O ATOM 0 H ASP A 76 -5.783 -13.252 18.652 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.859 -13.687 16.685 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -7.778 -12.797 19.614 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.290 -13.069 18.772 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.551 -10.549 17.743 1.00 0.00 N ATOM 1320 CA LEU A 77 -7.919 -9.155 17.313 1.00 0.00 C ATOM 1321 C LEU A 77 -7.210 -8.853 15.987 1.00 0.00 C ATOM 1322 O LEU A 77 -7.820 -8.377 15.048 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.437 -8.191 18.413 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.787 -6.750 18.021 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.299 -6.539 18.138 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -7.058 -5.769 18.949 1.00 0.00 C ATOM 0 H LEU A 77 -6.982 -10.615 18.587 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.994 -9.046 17.170 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.906 -8.444 19.364 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.360 -8.290 18.552 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.475 -6.572 16.992 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.546 -5.515 17.859 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.815 -7.231 17.473 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.613 -6.721 19.166 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.309 -4.746 18.667 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.365 -5.947 19.980 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.982 -5.916 18.860 1.00 0.00 H new ATOM 1338 N TYR A 78 -5.926 -9.149 15.892 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.192 -8.892 14.600 1.00 0.00 C ATOM 1340 C TYR A 78 -5.879 -9.667 13.458 1.00 0.00 C ATOM 1341 O TYR A 78 -6.015 -9.158 12.358 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.741 -9.379 14.809 1.00 0.00 C ATOM 1343 CG TYR A 78 -2.943 -9.220 13.530 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.006 -8.027 12.800 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.133 -10.271 13.080 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.265 -7.885 11.622 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.392 -10.129 11.901 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.458 -8.936 11.172 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.727 -8.797 10.009 1.00 0.00 O ATOM 0 H TYR A 78 -5.363 -9.551 16.641 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.199 -7.836 14.331 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.271 -8.810 15.612 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.742 -10.424 15.117 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.628 -7.215 13.147 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.080 -11.191 13.643 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.316 -6.964 11.060 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.769 -10.940 11.554 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.220 -9.619 9.841 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.342 -10.880 13.710 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.046 -11.645 12.622 1.00 0.00 C ATOM 1361 C ASP A 79 -8.417 -10.998 12.383 1.00 0.00 C ATOM 1362 O ASP A 79 -8.826 -10.804 11.254 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.212 -13.089 13.123 1.00 0.00 C ATOM 1364 CG ASP A 79 -7.483 -14.012 11.934 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -8.639 -14.150 11.568 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -6.531 -14.565 11.409 1.00 0.00 O ATOM 0 H ASP A 79 -6.264 -11.363 14.605 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.487 -11.635 11.686 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.312 -13.409 13.648 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.034 -13.146 13.836 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.125 -10.640 13.440 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.467 -9.973 13.258 1.00 0.00 C ATOM 1373 C TRP A 80 -10.302 -8.710 12.391 1.00 0.00 C ATOM 1374 O TRP A 80 -11.142 -8.411 11.564 1.00 0.00 O ATOM 1375 CB TRP A 80 -10.963 -9.596 14.667 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.312 -8.956 14.583 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.476 -9.616 14.381 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.659 -7.545 14.704 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.513 -8.700 14.368 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.059 -7.410 14.563 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.900 -6.379 14.918 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.685 -6.165 14.631 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.528 -5.125 14.987 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.918 -5.018 14.845 1.00 0.00 C ATOM 0 H TRP A 80 -8.836 -10.779 14.408 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.179 -10.631 12.759 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.013 -10.486 15.294 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.257 -8.913 15.139 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.579 -10.683 14.251 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.493 -8.947 14.231 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.828 -6.449 15.030 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.756 -6.089 14.519 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.936 -4.237 15.151 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.395 -4.051 14.901 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.218 -7.975 12.562 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.016 -6.745 11.719 1.00 0.00 C ATOM 1397 C LEU A 81 -8.810 -7.165 10.256 1.00 0.00 C ATOM 1398 O LEU A 81 -9.464 -6.660 9.362 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.750 -6.043 12.245 1.00 0.00 C ATOM 1400 CG LEU A 81 -7.949 -5.630 13.706 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.602 -5.660 14.440 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.524 -4.215 13.755 1.00 0.00 C ATOM 0 H LEU A 81 -8.478 -8.170 13.236 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.877 -6.079 11.772 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.892 -6.711 12.161 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.532 -5.165 11.637 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.637 -6.324 14.189 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.747 -5.366 15.479 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.190 -6.668 14.403 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.911 -4.967 13.960 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.668 -3.916 14.793 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.833 -3.525 13.271 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.482 -4.193 13.236 1.00 0.00 H new ATOM 1414 N ILE A 82 -7.911 -8.099 10.002 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.678 -8.550 8.580 1.00 0.00 C ATOM 1416 C ILE A 82 -8.994 -9.079 7.966 1.00 0.00 C ATOM 1417 O ILE A 82 -9.220 -8.933 6.779 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.612 -9.674 8.637 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.267 -9.106 9.129 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.416 -10.293 7.246 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.779 -7.994 8.191 1.00 0.00 C ATOM 0 H ILE A 82 -7.336 -8.563 10.706 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.336 -7.724 7.956 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.960 -10.441 9.329 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.379 -8.714 10.140 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.524 -9.902 9.176 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.665 -11.081 7.301 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.359 -10.715 6.899 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.085 -9.524 6.549 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.828 -7.604 8.553 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.647 -8.397 7.187 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.515 -7.190 8.166 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.861 -9.693 8.751 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.149 -10.220 8.170 1.00 0.00 C ATOM 1435 C LYS A 83 -12.283 -9.169 8.200 1.00 0.00 C ATOM 1436 O LYS A 83 -13.349 -9.414 7.667 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.534 -11.435 9.025 1.00 0.00 C ATOM 1438 CG LYS A 83 -10.509 -12.552 8.818 1.00 0.00 C ATOM 1439 CD LYS A 83 -10.974 -13.473 7.686 1.00 0.00 C ATOM 1440 CE LYS A 83 -10.296 -13.060 6.377 1.00 0.00 C ATOM 1441 NZ LYS A 83 -10.120 -14.329 5.619 1.00 0.00 N ATOM 0 H LYS A 83 -9.736 -9.850 9.751 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.007 -10.479 7.121 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.574 -11.154 10.077 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.529 -11.785 8.751 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -9.535 -12.126 8.577 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.388 -13.123 9.738 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -10.730 -14.509 7.923 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.057 -13.417 7.580 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -10.909 -12.350 5.822 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -9.338 -12.576 6.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -9.661 -14.128 4.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -9.527 -14.983 6.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -11.049 -14.764 5.450 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.089 -8.009 8.808 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.192 -6.991 8.837 1.00 0.00 C ATOM 1457 C GLU A 84 -12.821 -5.711 8.050 1.00 0.00 C ATOM 1458 O GLU A 84 -13.381 -4.660 8.290 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.372 -6.663 10.308 1.00 0.00 C ATOM 1460 CG GLU A 84 -13.858 -7.897 11.059 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.304 -8.201 10.665 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.196 -7.618 11.260 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.496 -9.011 9.773 1.00 0.00 O ATOM 0 H GLU A 84 -11.227 -7.732 9.277 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.098 -7.377 8.370 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.429 -6.318 10.731 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.089 -5.850 10.423 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.220 -8.750 10.828 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.791 -7.731 12.134 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.887 -5.791 7.112 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.465 -4.599 6.284 1.00 0.00 C ATOM 1472 C LYS A 85 -10.584 -3.635 7.087 1.00 0.00 C ATOM 1473 O LYS A 85 -11.007 -2.558 7.461 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.743 -3.899 5.791 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.513 -3.350 4.381 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.857 -3.209 3.664 1.00 0.00 C ATOM 1477 CE LYS A 85 -14.326 -4.583 3.182 1.00 0.00 C ATOM 1478 NZ LYS A 85 -15.006 -4.323 1.882 1.00 0.00 N ATOM 0 H LYS A 85 -11.391 -6.652 6.883 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.862 -4.931 5.439 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.577 -4.601 5.788 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -13.011 -3.089 6.469 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -12.013 -2.383 4.433 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -11.858 -4.018 3.821 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -14.597 -2.776 4.338 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.760 -2.529 2.818 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -13.486 -5.266 3.058 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -15.007 -5.042 3.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -15.356 -5.220 1.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -15.806 -3.675 2.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -14.332 -3.893 1.217 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.349 -4.016 7.346 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.425 -3.132 8.113 1.00 0.00 C ATOM 1494 C TYR A 86 -7.068 -3.074 7.399 1.00 0.00 C ATOM 1495 O TYR A 86 -6.639 -2.028 6.950 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.282 -3.800 9.481 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.511 -3.519 10.309 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.729 -4.147 10.008 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.429 -2.624 11.379 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.863 -3.869 10.787 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.560 -2.348 12.154 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.776 -2.970 11.857 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.894 -2.699 12.621 1.00 0.00 O ATOM 0 H TYR A 86 -8.947 -4.907 7.054 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.794 -2.110 8.201 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.150 -4.875 9.360 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.394 -3.425 9.990 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.794 -4.840 9.182 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.489 -2.144 11.608 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.804 -4.349 10.561 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.494 -1.656 12.980 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.618 -2.316 13.480 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.396 -4.198 7.282 1.00 0.00 N ATOM 1514 CA ALA A 87 -5.077 -4.221 6.587 1.00 0.00 C ATOM 1515 C ALA A 87 -5.044 -5.383 5.583 1.00 0.00 C ATOM 1516 O ALA A 87 -5.899 -6.249 5.612 1.00 0.00 O ATOM 1517 CB ALA A 87 -4.048 -4.443 7.696 1.00 0.00 C ATOM 0 H ALA A 87 -6.710 -5.100 7.641 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.880 -3.304 6.031 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -3.048 -4.472 7.264 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -4.108 -3.628 8.417 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.253 -5.388 8.199 1.00 0.00 H new ATOM 1523 N ASP A 88 -4.070 -5.416 4.696 1.00 0.00 N ATOM 1524 CA ASP A 88 -4.008 -6.533 3.703 1.00 0.00 C ATOM 1525 C ASP A 88 -2.823 -7.459 4.018 1.00 0.00 C ATOM 1526 O ASP A 88 -1.681 -7.100 3.799 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.817 -5.860 2.343 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.854 -6.917 1.237 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.074 -7.852 1.314 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.662 -6.775 0.336 1.00 0.00 O ATOM 0 H ASP A 88 -3.325 -4.723 4.621 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.908 -7.148 3.724 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.600 -5.120 2.179 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.866 -5.328 2.320 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.081 -8.648 4.528 1.00 0.00 N ATOM 1536 CA LYS A 89 -1.942 -9.587 4.845 1.00 0.00 C ATOM 1537 C LYS A 89 -1.118 -9.864 3.575 1.00 0.00 C ATOM 1538 O LYS A 89 0.094 -9.958 3.633 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.573 -10.892 5.359 1.00 0.00 C ATOM 1540 CG LYS A 89 -2.795 -10.789 6.869 1.00 0.00 C ATOM 1541 CD LYS A 89 -1.574 -11.347 7.604 1.00 0.00 C ATOM 1542 CE LYS A 89 -2.018 -11.985 8.921 1.00 0.00 C ATOM 1543 NZ LYS A 89 -0.888 -12.870 9.319 1.00 0.00 N ATOM 0 H LYS A 89 -4.013 -9.006 4.736 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.273 -9.155 5.590 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.521 -11.075 4.853 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.923 -11.737 5.133 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -2.960 -9.750 7.153 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.689 -11.343 7.154 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -1.068 -12.086 6.982 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -0.857 -10.549 7.798 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -2.213 -11.228 9.681 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -2.939 -12.554 8.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -1.118 -13.344 10.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -0.730 -13.585 8.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -0.026 -12.300 9.440 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.760 -9.993 2.429 1.00 0.00 N ATOM 1558 CA LEU A 90 -0.983 -10.259 1.165 1.00 0.00 C ATOM 1559 C LEU A 90 0.029 -9.128 0.917 1.00 0.00 C ATOM 1560 O LEU A 90 1.139 -9.377 0.485 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.003 -10.317 0.017 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.372 -11.010 -1.191 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.244 -12.508 -0.912 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.257 -10.796 -2.422 1.00 0.00 C ATOM 0 H LEU A 90 -2.771 -9.927 2.315 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.426 -11.193 1.240 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -2.894 -10.858 0.335 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.320 -9.310 -0.253 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.384 -10.589 -1.375 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.794 -13.001 -1.774 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.614 -12.662 -0.036 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.232 -12.929 -0.728 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.808 -11.290 -3.284 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.245 -11.217 -2.237 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.349 -9.729 -2.623 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.334 -7.888 1.194 1.00 0.00 N ATOM 1577 CA LEU A 91 0.646 -6.767 0.972 1.00 0.00 C ATOM 1578 C LEU A 91 1.750 -6.857 2.033 1.00 0.00 C ATOM 1579 O LEU A 91 2.923 -6.768 1.717 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.138 -5.449 1.103 1.00 0.00 C ATOM 1581 CG LEU A 91 0.802 -4.252 0.904 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.462 -4.320 -0.480 1.00 0.00 C ATOM 1583 CD2 LEU A 91 -0.007 -2.958 1.016 1.00 0.00 C ATOM 0 H LEU A 91 -1.246 -7.610 1.556 1.00 0.00 H new ATOM 0 HA LEU A 91 1.114 -6.823 -0.011 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.939 -5.419 0.364 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.608 -5.393 2.085 1.00 0.00 H new ATOM 0 HG LEU A 91 1.579 -4.276 1.668 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.126 -3.465 -0.609 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.037 -5.242 -0.564 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.692 -4.301 -1.252 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.654 -2.103 0.876 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.783 -2.947 0.251 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.469 -2.902 2.002 1.00 0.00 H new ATOM 1595 N ILE A 92 1.392 -7.067 3.288 1.00 0.00 N ATOM 1596 CA ILE A 92 2.455 -7.201 4.348 1.00 0.00 C ATOM 1597 C ILE A 92 3.366 -8.395 3.982 1.00 0.00 C ATOM 1598 O ILE A 92 4.568 -8.331 4.155 1.00 0.00 O ATOM 1599 CB ILE A 92 1.712 -7.415 5.696 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.191 -6.055 6.188 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.654 -8.007 6.757 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.363 -6.231 7.467 1.00 0.00 C ATOM 0 H ILE A 92 0.430 -7.150 3.618 1.00 0.00 H new ATOM 0 HA ILE A 92 3.092 -6.320 4.426 1.00 0.00 H new ATOM 0 HB ILE A 92 0.889 -8.113 5.540 1.00 0.00 H new ATOM 0 HG12 ILE A 92 2.029 -5.385 6.379 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.581 -5.590 5.413 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.109 -8.147 7.690 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.033 -8.969 6.411 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.489 -7.326 6.923 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.001 -5.259 7.803 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.486 -6.884 7.264 1.00 0.00 H new ATOM 0 HD13 ILE A 92 0.984 -6.675 8.245 1.00 0.00 H new ATOM 1614 N ALA A 93 2.807 -9.469 3.448 1.00 0.00 N ATOM 1615 CA ALA A 93 3.676 -10.632 3.050 1.00 0.00 C ATOM 1616 C ALA A 93 4.580 -10.208 1.880 1.00 0.00 C ATOM 1617 O ALA A 93 5.738 -10.575 1.829 1.00 0.00 O ATOM 1618 CB ALA A 93 2.736 -11.767 2.613 1.00 0.00 C ATOM 0 H ALA A 93 1.809 -9.587 3.275 1.00 0.00 H new ATOM 0 HA ALA A 93 4.310 -10.959 3.874 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.326 -12.634 2.315 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.084 -12.040 3.443 1.00 0.00 H new ATOM 0 HB3 ALA A 93 2.130 -11.434 1.771 1.00 0.00 H new ATOM 1624 N LYS A 94 4.070 -9.428 0.940 1.00 0.00 N ATOM 1625 CA LYS A 94 4.934 -8.981 -0.214 1.00 0.00 C ATOM 1626 C LYS A 94 6.166 -8.232 0.319 1.00 0.00 C ATOM 1627 O LYS A 94 7.266 -8.421 -0.165 1.00 0.00 O ATOM 1628 CB LYS A 94 4.080 -8.031 -1.076 1.00 0.00 C ATOM 1629 CG LYS A 94 3.331 -8.829 -2.147 1.00 0.00 C ATOM 1630 CD LYS A 94 4.333 -9.480 -3.102 1.00 0.00 C ATOM 1631 CE LYS A 94 3.634 -9.827 -4.421 1.00 0.00 C ATOM 1632 NZ LYS A 94 3.402 -11.298 -4.358 1.00 0.00 N ATOM 0 H LYS A 94 3.109 -9.087 0.922 1.00 0.00 H new ATOM 0 HA LYS A 94 5.278 -9.835 -0.798 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.370 -7.495 -0.447 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.717 -7.282 -1.547 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.712 -9.594 -1.678 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.660 -8.172 -2.701 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.167 -8.803 -3.288 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.748 -10.381 -2.651 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.695 -9.283 -4.525 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.253 -9.561 -5.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.502 -11.528 -4.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 4.179 -11.793 -4.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.362 -11.601 -3.364 1.00 0.00 H new ATOM 1646 N TRP A 95 5.994 -7.390 1.321 1.00 0.00 N ATOM 1647 CA TRP A 95 7.181 -6.644 1.877 1.00 0.00 C ATOM 1648 C TRP A 95 8.139 -7.617 2.589 1.00 0.00 C ATOM 1649 O TRP A 95 9.343 -7.447 2.540 1.00 0.00 O ATOM 1650 CB TRP A 95 6.633 -5.615 2.884 1.00 0.00 C ATOM 1651 CG TRP A 95 6.280 -4.335 2.186 1.00 0.00 C ATOM 1652 CD1 TRP A 95 6.993 -3.763 1.185 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.143 -3.455 2.426 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.365 -2.593 0.798 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.222 -2.359 1.534 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.061 -3.500 3.325 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.264 -1.347 1.531 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.094 -2.481 3.324 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.196 -1.406 2.429 1.00 0.00 C ATOM 0 H TRP A 95 5.101 -7.189 1.771 1.00 0.00 H new ATOM 0 HA TRP A 95 7.738 -6.154 1.078 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.752 -6.019 3.383 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.377 -5.422 3.657 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.904 -4.157 0.759 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.705 -1.978 0.059 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.974 -4.322 4.019 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.347 -0.522 0.839 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.267 -2.526 4.017 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.450 -0.625 2.434 1.00 0.00 H new ATOM 1670 N ARG A 96 7.622 -8.637 3.245 1.00 0.00 N ATOM 1671 CA ARG A 96 8.529 -9.612 3.951 1.00 0.00 C ATOM 1672 C ARG A 96 9.059 -10.677 2.972 1.00 0.00 C ATOM 1673 O ARG A 96 10.159 -11.171 3.136 1.00 0.00 O ATOM 1674 CB ARG A 96 7.686 -10.270 5.053 1.00 0.00 C ATOM 1675 CG ARG A 96 7.627 -9.346 6.277 1.00 0.00 C ATOM 1676 CD ARG A 96 6.203 -9.323 6.839 1.00 0.00 C ATOM 1677 NE ARG A 96 5.928 -10.734 7.250 1.00 0.00 N ATOM 1678 CZ ARG A 96 6.479 -11.255 8.335 1.00 0.00 C ATOM 1679 NH1 ARG A 96 7.290 -10.555 9.095 1.00 0.00 N ATOM 1680 NH2 ARG A 96 6.215 -12.493 8.663 1.00 0.00 N ATOM 0 H ARG A 96 6.625 -8.836 3.322 1.00 0.00 H new ATOM 0 HA ARG A 96 9.398 -9.103 4.367 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.679 -10.468 4.685 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.119 -11.231 5.331 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.324 -9.693 7.040 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.935 -8.338 5.999 1.00 0.00 H new ATOM 0 HD2 ARG A 96 6.124 -8.642 7.687 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.488 -8.983 6.090 1.00 0.00 H new ATOM 0 HE ARG A 96 5.303 -11.307 6.683 1.00 0.00 H new ATOM 0 HH11 ARG A 96 7.507 -9.588 8.854 1.00 0.00 H new ATOM 0 HH12 ARG A 96 7.702 -10.978 9.926 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.588 -13.051 8.084 1.00 0.00 H new ATOM 0 HH22 ARG A 96 6.636 -12.900 9.498 1.00 0.00 H new ATOM 1694 N LYS A 97 8.295 -11.044 1.957 1.00 0.00 N ATOM 1695 CA LYS A 97 8.788 -12.089 0.979 1.00 0.00 C ATOM 1696 C LYS A 97 10.186 -11.723 0.448 1.00 0.00 C ATOM 1697 O LYS A 97 10.718 -10.675 0.767 1.00 0.00 O ATOM 1698 CB LYS A 97 7.790 -12.104 -0.191 1.00 0.00 C ATOM 1699 CG LYS A 97 6.673 -13.112 0.082 1.00 0.00 C ATOM 1700 CD LYS A 97 7.252 -14.534 0.132 1.00 0.00 C ATOM 1701 CE LYS A 97 6.744 -15.257 1.383 1.00 0.00 C ATOM 1702 NZ LYS A 97 7.754 -16.319 1.650 1.00 0.00 N ATOM 0 H LYS A 97 7.365 -10.672 1.764 1.00 0.00 H new ATOM 0 HA LYS A 97 8.859 -13.062 1.466 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.366 -11.109 -0.330 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.306 -12.363 -1.116 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.182 -12.877 1.026 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.914 -13.046 -0.697 1.00 0.00 H new ATOM 0 HD2 LYS A 97 6.962 -15.086 -0.762 1.00 0.00 H new ATOM 0 HD3 LYS A 97 8.341 -14.493 0.142 1.00 0.00 H new ATOM 0 HE2 LYS A 97 6.658 -14.573 2.227 1.00 0.00 H new ATOM 0 HE3 LYS A 97 5.755 -15.685 1.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 7.475 -16.859 2.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 7.809 -16.959 0.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 8.684 -15.881 1.810 1.00 0.00 H new ATOM 1716 N THR A 98 10.778 -12.567 -0.373 1.00 0.00 N ATOM 1717 CA THR A 98 12.130 -12.245 -0.929 1.00 0.00 C ATOM 1718 C THR A 98 11.988 -11.786 -2.385 1.00 0.00 C ATOM 1719 O THR A 98 11.182 -12.318 -3.125 1.00 0.00 O ATOM 1720 CB THR A 98 12.941 -13.545 -0.847 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.055 -14.656 -0.784 1.00 0.00 O ATOM 1722 CG2 THR A 98 13.821 -13.521 0.404 1.00 0.00 C ATOM 0 H THR A 98 10.384 -13.457 -0.678 1.00 0.00 H new ATOM 0 HA THR A 98 12.621 -11.443 -0.378 1.00 0.00 H new ATOM 0 HB THR A 98 13.571 -13.635 -1.732 1.00 0.00 H new ATOM 0 HG1 THR A 98 12.574 -15.486 -0.733 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.397 -14.445 0.462 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.502 -12.671 0.354 1.00 0.00 H new ATOM 0 HG23 THR A 98 13.192 -13.430 1.290 1.00 0.00 H new ATOM 1730 N GLY A 99 12.747 -10.793 -2.804 1.00 0.00 N ATOM 1731 CA GLY A 99 12.623 -10.306 -4.210 1.00 0.00 C ATOM 1732 C GLY A 99 11.785 -9.011 -4.259 1.00 0.00 C ATOM 1733 O GLY A 99 11.915 -8.234 -5.185 1.00 0.00 O ATOM 0 H GLY A 99 13.439 -10.307 -2.234 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.613 -10.122 -4.626 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.155 -11.073 -4.827 1.00 0.00 H new ATOM 1737 N TYR A 100 10.930 -8.759 -3.278 1.00 0.00 N ATOM 1738 CA TYR A 100 10.108 -7.500 -3.310 1.00 0.00 C ATOM 1739 C TYR A 100 10.836 -6.374 -2.550 1.00 0.00 C ATOM 1740 O TYR A 100 10.306 -5.818 -1.605 1.00 0.00 O ATOM 1741 CB TYR A 100 8.782 -7.833 -2.612 1.00 0.00 C ATOM 1742 CG TYR A 100 7.993 -8.821 -3.435 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.501 -8.455 -4.693 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.744 -10.102 -2.931 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.759 -9.371 -5.447 1.00 0.00 C ATOM 1746 CE2 TYR A 100 7.004 -11.021 -3.682 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.510 -10.655 -4.942 1.00 0.00 C ATOM 1748 OH TYR A 100 5.778 -11.558 -5.685 1.00 0.00 O ATOM 0 H TYR A 100 10.771 -9.363 -2.472 1.00 0.00 H new ATOM 0 HA TYR A 100 9.944 -7.159 -4.332 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.977 -8.247 -1.623 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.200 -6.923 -2.467 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.694 -7.466 -5.082 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.124 -10.382 -1.960 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.378 -9.089 -6.418 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.814 -12.010 -3.292 1.00 0.00 H new ATOM 0 HH TYR A 100 5.896 -12.458 -5.315 1.00 0.00 H new ATOM 1758 N GLU A 101 12.041 -6.031 -2.953 1.00 0.00 N ATOM 1759 CA GLU A 101 12.779 -4.929 -2.233 1.00 0.00 C ATOM 1760 C GLU A 101 12.074 -3.576 -2.449 1.00 0.00 C ATOM 1761 O GLU A 101 12.094 -2.726 -1.578 1.00 0.00 O ATOM 1762 CB GLU A 101 14.199 -4.884 -2.823 1.00 0.00 C ATOM 1763 CG GLU A 101 15.194 -4.496 -1.728 1.00 0.00 C ATOM 1764 CD GLU A 101 15.451 -5.702 -0.821 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.246 -6.545 -1.202 1.00 0.00 O ATOM 1766 OE2 GLU A 101 14.849 -5.761 0.238 1.00 0.00 O ATOM 0 H GLU A 101 12.541 -6.455 -3.734 1.00 0.00 H new ATOM 0 HA GLU A 101 12.804 -5.119 -1.160 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.462 -5.856 -3.240 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.242 -4.164 -3.640 1.00 0.00 H new ATOM 0 HG2 GLU A 101 16.129 -4.158 -2.175 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.801 -3.665 -1.143 1.00 0.00 H new ATOM 1773 N LYS A 102 11.459 -3.359 -3.597 1.00 0.00 N ATOM 1774 CA LYS A 102 10.774 -2.054 -3.842 1.00 0.00 C ATOM 1775 C LYS A 102 9.367 -2.284 -4.418 1.00 0.00 C ATOM 1776 O LYS A 102 9.218 -2.563 -5.594 1.00 0.00 O ATOM 1777 CB LYS A 102 11.660 -1.339 -4.868 1.00 0.00 C ATOM 1778 CG LYS A 102 12.944 -0.834 -4.192 1.00 0.00 C ATOM 1779 CD LYS A 102 13.039 0.689 -4.322 1.00 0.00 C ATOM 1780 CE LYS A 102 13.832 1.046 -5.581 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.556 2.301 -5.236 1.00 0.00 N ATOM 0 H LYS A 102 11.406 -4.028 -4.365 1.00 0.00 H new ATOM 0 HA LYS A 102 10.648 -1.475 -2.927 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.911 -2.020 -5.681 1.00 0.00 H new ATOM 0 HB3 LYS A 102 11.118 -0.502 -5.309 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.947 -1.118 -3.140 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.815 -1.302 -4.651 1.00 0.00 H new ATOM 0 HD2 LYS A 102 12.040 1.123 -4.373 1.00 0.00 H new ATOM 0 HD3 LYS A 102 13.525 1.110 -3.442 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.527 0.250 -5.849 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.171 1.193 -6.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.123 2.610 -6.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.869 3.042 -4.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 15.182 2.128 -4.424 1.00 0.00 H new ATOM 1795 N LEU A 103 8.330 -2.164 -3.609 1.00 0.00 N ATOM 1796 CA LEU A 103 6.947 -2.372 -4.137 1.00 0.00 C ATOM 1797 C LEU A 103 5.970 -1.348 -3.517 1.00 0.00 C ATOM 1798 O LEU A 103 6.208 -0.837 -2.439 1.00 0.00 O ATOM 1799 CB LEU A 103 6.580 -3.824 -3.761 1.00 0.00 C ATOM 1800 CG LEU A 103 6.150 -3.929 -2.289 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.641 -3.673 -2.181 1.00 0.00 C ATOM 1802 CD2 LEU A 103 6.469 -5.328 -1.760 1.00 0.00 C ATOM 0 H LEU A 103 8.387 -1.933 -2.617 1.00 0.00 H new ATOM 0 HA LEU A 103 6.887 -2.222 -5.215 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.773 -4.175 -4.404 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.436 -4.475 -3.939 1.00 0.00 H new ATOM 0 HG LEU A 103 6.690 -3.188 -1.699 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.333 -3.747 -1.138 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.413 -2.675 -2.557 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.103 -4.415 -2.771 1.00 0.00 H new ATOM 0 HD21 LEU A 103 6.164 -5.401 -0.716 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.931 -6.071 -2.348 1.00 0.00 H new ATOM 0 HD23 LEU A 103 7.541 -5.511 -1.838 1.00 0.00 H new ATOM 1814 N CYS A 104 4.880 -1.044 -4.193 1.00 0.00 N ATOM 1815 CA CYS A 104 3.908 -0.050 -3.631 1.00 0.00 C ATOM 1816 C CYS A 104 2.500 -0.645 -3.385 1.00 0.00 C ATOM 1817 O CYS A 104 1.856 -0.275 -2.424 1.00 0.00 O ATOM 1818 CB CYS A 104 3.873 1.109 -4.635 1.00 0.00 C ATOM 1819 SG CYS A 104 3.296 0.567 -6.265 1.00 0.00 S ATOM 0 H CYS A 104 4.626 -1.438 -5.099 1.00 0.00 H new ATOM 0 HA CYS A 104 4.230 0.281 -2.644 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.218 1.895 -4.260 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.870 1.541 -4.727 1.00 0.00 H new ATOM 1824 N CYS A 105 2.005 -1.551 -4.209 1.00 0.00 N ATOM 1825 CA CYS A 105 0.636 -2.122 -3.943 1.00 0.00 C ATOM 1826 C CYS A 105 0.599 -3.617 -4.306 1.00 0.00 C ATOM 1827 O CYS A 105 1.616 -4.216 -4.600 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.358 -1.387 -4.859 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.075 0.406 -4.911 1.00 0.00 S ATOM 0 H CYS A 105 2.479 -1.913 -5.037 1.00 0.00 H new ATOM 0 HA CYS A 105 0.387 -2.002 -2.889 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.282 -1.791 -5.868 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.374 -1.580 -4.514 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.578 -4.220 -4.308 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.684 -5.672 -4.682 1.00 0.00 C ATOM 1836 C LEU A 106 -1.116 -5.816 -6.159 1.00 0.00 C ATOM 1837 O LEU A 106 -0.651 -6.700 -6.853 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.746 -6.271 -3.752 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.139 -6.583 -2.382 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.232 -7.133 -1.467 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.018 -7.624 -2.527 1.00 0.00 C ATOM 0 H LEU A 106 -1.461 -3.770 -4.068 1.00 0.00 H new ATOM 0 HA LEU A 106 0.273 -6.184 -4.576 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.575 -5.573 -3.639 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.153 -7.181 -4.193 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.721 -5.672 -1.955 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.808 -7.358 -0.488 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.023 -6.391 -1.358 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.646 -8.043 -1.901 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.408 -7.839 -1.547 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.425 -8.540 -2.955 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.760 -7.232 -3.182 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.976 -4.939 -6.661 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.391 -5.027 -8.104 1.00 0.00 C ATOM 1855 C ARG A 107 -1.658 -3.938 -8.920 1.00 0.00 C ATOM 1856 O ARG A 107 -2.200 -3.372 -9.850 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.904 -4.784 -8.118 1.00 0.00 C ATOM 1858 CG ARG A 107 -4.463 -5.125 -9.502 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.869 -5.710 -9.357 1.00 0.00 C ATOM 1860 NE ARG A 107 -6.662 -5.089 -10.462 1.00 0.00 N ATOM 1861 CZ ARG A 107 -7.091 -3.839 -10.382 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -6.831 -3.090 -9.335 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -7.788 -3.331 -11.366 1.00 0.00 N ATOM 0 H ARG A 107 -2.401 -4.176 -6.134 1.00 0.00 H new ATOM 0 HA ARG A 107 -2.143 -5.992 -8.546 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.388 -5.396 -7.357 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -4.118 -3.744 -7.874 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -4.493 -4.230 -10.124 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.810 -5.840 -10.003 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.855 -6.796 -9.443 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -6.297 -5.473 -8.383 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.877 -5.639 -11.294 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -6.287 -3.469 -8.560 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -7.173 -2.130 -9.297 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -7.998 -3.897 -12.188 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -8.122 -2.369 -11.311 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.426 -3.642 -8.566 1.00 0.00 N ATOM 1878 CA CYS A 108 0.372 -2.598 -9.282 1.00 0.00 C ATOM 1879 C CYS A 108 1.699 -3.288 -9.682 1.00 0.00 C ATOM 1880 O CYS A 108 1.999 -3.435 -10.849 1.00 0.00 O ATOM 1881 CB CYS A 108 0.557 -1.530 -8.189 1.00 0.00 C ATOM 1882 SG CYS A 108 0.661 0.174 -8.804 1.00 0.00 S ATOM 0 H CYS A 108 0.067 -4.092 -7.794 1.00 0.00 H new ATOM 0 HA CYS A 108 -0.058 -2.162 -10.184 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.275 -1.599 -7.488 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.465 -1.756 -7.629 1.00 0.00 H new ATOM 1887 N ILE A 109 2.462 -3.781 -8.715 1.00 0.00 N ATOM 1888 CA ILE A 109 3.732 -4.524 -9.054 1.00 0.00 C ATOM 1889 C ILE A 109 3.414 -5.878 -9.729 1.00 0.00 C ATOM 1890 O ILE A 109 4.229 -6.403 -10.464 1.00 0.00 O ATOM 1891 CB ILE A 109 4.489 -4.772 -7.722 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.631 -5.629 -6.766 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.807 -3.434 -7.050 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.525 -6.328 -5.743 1.00 0.00 C ATOM 0 H ILE A 109 2.261 -3.701 -7.718 1.00 0.00 H new ATOM 0 HA ILE A 109 4.334 -3.939 -9.749 1.00 0.00 H new ATOM 0 HB ILE A 109 5.415 -5.303 -7.943 1.00 0.00 H new ATOM 0 HG12 ILE A 109 2.903 -4.999 -6.254 1.00 0.00 H new ATOM 0 HG13 ILE A 109 3.068 -6.369 -7.335 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.338 -3.613 -6.115 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.430 -2.833 -7.712 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.879 -2.901 -6.843 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.910 -6.930 -5.074 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.235 -6.972 -6.261 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.068 -5.581 -5.164 1.00 0.00 H new ATOM 1906 N GLN A 110 2.254 -6.459 -9.474 1.00 0.00 N ATOM 1907 CA GLN A 110 1.919 -7.776 -10.094 1.00 0.00 C ATOM 1908 C GLN A 110 0.573 -7.688 -10.827 1.00 0.00 C ATOM 1909 O GLN A 110 -0.259 -6.864 -10.498 1.00 0.00 O ATOM 1910 CB GLN A 110 1.824 -8.747 -8.916 1.00 0.00 C ATOM 1911 CG GLN A 110 1.560 -10.160 -9.439 1.00 0.00 C ATOM 1912 CD GLN A 110 1.767 -11.172 -8.305 1.00 0.00 C ATOM 1913 OE1 GLN A 110 1.145 -11.066 -7.266 1.00 0.00 O ATOM 1914 NE2 GLN A 110 2.618 -12.158 -8.454 1.00 0.00 N ATOM 0 H GLN A 110 1.533 -6.073 -8.864 1.00 0.00 H new ATOM 0 HA GLN A 110 2.660 -8.092 -10.828 1.00 0.00 H new ATOM 0 HB2 GLN A 110 2.749 -8.728 -8.340 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.023 -8.441 -8.243 1.00 0.00 H new ATOM 0 HG2 GLN A 110 0.543 -10.233 -9.824 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.232 -10.384 -10.268 1.00 0.00 H new ATOM 0 HE21 GLN A 110 3.143 -12.252 -9.324 1.00 0.00 H new ATOM 0 HE22 GLN A 110 2.755 -12.831 -7.700 1.00 0.00 H new ATOM 1923 N LYS A 111 0.346 -8.530 -11.815 1.00 0.00 N ATOM 1924 CA LYS A 111 -0.952 -8.481 -12.553 1.00 0.00 C ATOM 1925 C LYS A 111 -1.710 -9.808 -12.381 1.00 0.00 C ATOM 1926 O LYS A 111 -2.835 -9.824 -11.921 1.00 0.00 O ATOM 1927 CB LYS A 111 -0.569 -8.264 -14.019 1.00 0.00 C ATOM 1928 CG LYS A 111 -1.812 -7.869 -14.828 1.00 0.00 C ATOM 1929 CD LYS A 111 -1.775 -6.369 -15.136 1.00 0.00 C ATOM 1930 CE LYS A 111 -1.881 -5.575 -13.831 1.00 0.00 C ATOM 1931 NZ LYS A 111 -1.714 -4.151 -14.235 1.00 0.00 N ATOM 0 H LYS A 111 1.002 -9.242 -12.136 1.00 0.00 H new ATOM 0 HA LYS A 111 -1.607 -7.692 -12.185 1.00 0.00 H new ATOM 0 HB2 LYS A 111 0.189 -7.484 -14.095 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -0.131 -9.174 -14.429 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -1.850 -8.439 -15.756 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.715 -8.112 -14.267 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -0.849 -6.116 -15.653 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.596 -6.104 -15.803 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -2.844 -5.738 -13.346 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -1.111 -5.877 -13.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -1.775 -3.542 -13.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -0.786 -4.025 -14.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -2.465 -3.890 -14.906 1.00 0.00 H new ATOM 1945 N ASN A 112 -1.106 -10.923 -12.747 1.00 0.00 N ATOM 1946 CA ASN A 112 -1.804 -12.238 -12.598 1.00 0.00 C ATOM 1947 C ASN A 112 -0.784 -13.359 -12.337 1.00 0.00 C ATOM 1948 O ASN A 112 0.390 -13.098 -12.148 1.00 0.00 O ATOM 1949 CB ASN A 112 -2.515 -12.462 -13.935 1.00 0.00 C ATOM 1950 CG ASN A 112 -3.999 -12.098 -13.799 1.00 0.00 C ATOM 1951 OD1 ASN A 112 -4.337 -10.940 -13.652 1.00 0.00 O ATOM 1952 ND2 ASN A 112 -4.911 -13.041 -13.842 1.00 0.00 N ATOM 0 H ASN A 112 -0.166 -10.973 -13.139 1.00 0.00 H new ATOM 0 HA ASN A 112 -2.499 -12.242 -11.759 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -2.051 -11.853 -14.711 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -2.413 -13.503 -14.242 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -5.898 -12.800 -13.752 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -4.633 -14.015 -13.965 1.00 0.00 H new ATOM 1959 N GLU A 113 -1.216 -14.604 -12.327 1.00 0.00 N ATOM 1960 CA GLU A 113 -0.261 -15.725 -12.081 1.00 0.00 C ATOM 1961 C GLU A 113 -0.194 -16.641 -13.315 1.00 0.00 C ATOM 1962 O GLU A 113 -0.720 -17.739 -13.305 1.00 0.00 O ATOM 1963 CB GLU A 113 -0.831 -16.478 -10.877 1.00 0.00 C ATOM 1964 CG GLU A 113 0.317 -17.034 -10.034 1.00 0.00 C ATOM 1965 CD GLU A 113 -0.236 -17.595 -8.722 1.00 0.00 C ATOM 1966 OE1 GLU A 113 -1.013 -16.903 -8.086 1.00 0.00 O ATOM 1967 OE2 GLU A 113 0.129 -18.707 -8.375 1.00 0.00 O ATOM 0 H GLU A 113 -2.185 -14.885 -12.478 1.00 0.00 H new ATOM 0 HA GLU A 113 0.753 -15.372 -11.892 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -1.448 -15.810 -10.276 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -1.475 -17.290 -11.214 1.00 0.00 H new ATOM 0 HG2 GLU A 113 0.840 -17.816 -10.584 1.00 0.00 H new ATOM 0 HG3 GLU A 113 1.044 -16.249 -9.828 1.00 0.00 H new ATOM 1974 N THR A 114 0.446 -16.200 -14.379 1.00 0.00 N ATOM 1975 CA THR A 114 0.537 -17.050 -15.606 1.00 0.00 C ATOM 1976 C THR A 114 1.936 -16.922 -16.233 1.00 0.00 C ATOM 1977 O THR A 114 2.857 -16.443 -15.597 1.00 0.00 O ATOM 1978 CB THR A 114 -0.536 -16.503 -16.555 1.00 0.00 C ATOM 1979 OG1 THR A 114 -1.502 -15.766 -15.817 1.00 0.00 O ATOM 1980 CG2 THR A 114 -1.224 -17.663 -17.276 1.00 0.00 C ATOM 0 H THR A 114 0.906 -15.292 -14.446 1.00 0.00 H new ATOM 0 HA THR A 114 0.381 -18.107 -15.390 1.00 0.00 H new ATOM 0 HB THR A 114 -0.064 -15.848 -17.287 1.00 0.00 H new ATOM 0 HG1 THR A 114 -2.184 -15.417 -16.428 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.986 -17.272 -17.950 1.00 0.00 H new ATOM 0 HG22 THR A 114 -0.486 -18.224 -17.849 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.691 -18.321 -16.543 1.00 0.00 H new ATOM 1988 N ASN A 115 2.108 -17.339 -17.472 1.00 0.00 N ATOM 1989 CA ASN A 115 3.461 -17.226 -18.118 1.00 0.00 C ATOM 1990 C ASN A 115 3.553 -15.930 -18.942 1.00 0.00 C ATOM 1991 O ASN A 115 4.582 -15.280 -18.958 1.00 0.00 O ATOM 1992 CB ASN A 115 3.599 -18.455 -19.030 1.00 0.00 C ATOM 1993 CG ASN A 115 5.002 -18.482 -19.652 1.00 0.00 C ATOM 1994 OD1 ASN A 115 5.491 -17.469 -20.112 1.00 0.00 O ATOM 1995 ND2 ASN A 115 5.679 -19.604 -19.689 1.00 0.00 N ATOM 0 H ASN A 115 1.379 -17.748 -18.057 1.00 0.00 H new ATOM 0 HA ASN A 115 4.258 -17.191 -17.375 1.00 0.00 H new ATOM 0 HB2 ASN A 115 3.427 -19.366 -18.457 1.00 0.00 H new ATOM 0 HB3 ASN A 115 2.843 -18.424 -19.815 1.00 0.00 H new ATOM 0 HD21 ASN A 115 6.611 -19.624 -20.102 1.00 0.00 H new ATOM 0 HD22 ASN A 115 5.273 -20.457 -19.304 1.00 0.00 H new ATOM 2002 N ASN A 116 2.493 -15.546 -19.626 1.00 0.00 N ATOM 2003 CA ASN A 116 2.544 -14.291 -20.439 1.00 0.00 C ATOM 2004 C ASN A 116 1.618 -13.226 -19.831 1.00 0.00 C ATOM 2005 O ASN A 116 0.757 -13.537 -19.029 1.00 0.00 O ATOM 2006 CB ASN A 116 2.056 -14.694 -21.833 1.00 0.00 C ATOM 2007 CG ASN A 116 3.109 -15.583 -22.506 1.00 0.00 C ATOM 2008 OD1 ASN A 116 4.218 -15.149 -22.743 1.00 0.00 O ATOM 2009 ND2 ASN A 116 2.812 -16.819 -22.828 1.00 0.00 N ATOM 0 H ASN A 116 1.604 -16.046 -19.653 1.00 0.00 H new ATOM 0 HA ASN A 116 3.546 -13.862 -20.469 1.00 0.00 H new ATOM 0 HB2 ASN A 116 1.108 -15.227 -21.758 1.00 0.00 H new ATOM 0 HB3 ASN A 116 1.875 -13.805 -22.438 1.00 0.00 H new ATOM 0 HD21 ASN A 116 3.511 -17.412 -23.276 1.00 0.00 H new ATOM 0 HD22 ASN A 116 1.882 -17.188 -22.631 1.00 0.00 H new ATOM 2016 N GLY A 117 1.785 -11.972 -20.203 1.00 0.00 N ATOM 2017 CA GLY A 117 0.909 -10.901 -19.640 1.00 0.00 C ATOM 2018 C GLY A 117 1.749 -9.648 -19.354 1.00 0.00 C ATOM 2019 O GLY A 117 2.888 -9.555 -19.775 1.00 0.00 O ATOM 0 H GLY A 117 2.488 -11.652 -20.869 1.00 0.00 H new ATOM 0 HA2 GLY A 117 0.110 -10.663 -20.343 1.00 0.00 H new ATOM 0 HA3 GLY A 117 0.434 -11.250 -18.723 1.00 0.00 H new ATOM 2023 N SER A 118 1.203 -8.681 -18.644 1.00 0.00 N ATOM 2024 CA SER A 118 1.981 -7.443 -18.342 1.00 0.00 C ATOM 2025 C SER A 118 1.670 -6.953 -16.919 1.00 0.00 C ATOM 2026 O SER A 118 0.819 -7.501 -16.247 1.00 0.00 O ATOM 2027 CB SER A 118 1.514 -6.419 -19.376 1.00 0.00 C ATOM 2028 OG SER A 118 2.260 -6.587 -20.575 1.00 0.00 O ATOM 0 H SER A 118 0.256 -8.701 -18.265 1.00 0.00 H new ATOM 0 HA SER A 118 3.057 -7.610 -18.391 1.00 0.00 H new ATOM 0 HB2 SER A 118 0.450 -6.546 -19.575 1.00 0.00 H new ATOM 0 HB3 SER A 118 1.647 -5.408 -18.990 1.00 0.00 H new ATOM 0 HG SER A 118 2.670 -7.477 -20.583 1.00 0.00 H new ATOM 2034 N THR A 119 2.352 -5.925 -16.453 1.00 0.00 N ATOM 2035 CA THR A 119 2.089 -5.409 -15.075 1.00 0.00 C ATOM 2036 C THR A 119 2.153 -3.876 -15.073 1.00 0.00 C ATOM 2037 O THR A 119 2.498 -3.272 -16.073 1.00 0.00 O ATOM 2038 CB THR A 119 3.216 -5.990 -14.218 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.521 -7.301 -14.671 1.00 0.00 O ATOM 2040 CG2 THR A 119 2.785 -6.044 -12.751 1.00 0.00 C ATOM 0 H THR A 119 3.076 -5.427 -16.970 1.00 0.00 H new ATOM 0 HA THR A 119 1.104 -5.692 -14.703 1.00 0.00 H new ATOM 0 HB THR A 119 4.098 -5.355 -14.306 1.00 0.00 H new ATOM 0 HG1 THR A 119 4.244 -7.676 -14.125 1.00 0.00 H new ATOM 0 HG21 THR A 119 3.594 -6.459 -12.149 1.00 0.00 H new ATOM 0 HG22 THR A 119 2.553 -5.038 -12.403 1.00 0.00 H new ATOM 0 HG23 THR A 119 1.901 -6.674 -12.654 1.00 0.00 H new ATOM 2048 N CYS A 120 1.834 -3.229 -13.964 1.00 0.00 N ATOM 2049 CA CYS A 120 1.898 -1.720 -13.936 1.00 0.00 C ATOM 2050 C CYS A 120 3.289 -1.248 -14.400 1.00 0.00 C ATOM 2051 O CYS A 120 4.258 -1.978 -14.289 1.00 0.00 O ATOM 2052 CB CYS A 120 1.644 -1.286 -12.487 1.00 0.00 C ATOM 2053 SG CYS A 120 1.436 0.501 -12.442 1.00 0.00 S ATOM 0 H CYS A 120 1.538 -3.670 -13.094 1.00 0.00 H new ATOM 0 HA CYS A 120 1.156 -1.283 -14.604 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.754 -1.779 -12.096 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.478 -1.585 -11.852 1.00 0.00 H new ATOM 2058 N ILE A 121 3.398 -0.051 -14.936 1.00 0.00 N ATOM 2059 CA ILE A 121 4.743 0.428 -15.421 1.00 0.00 C ATOM 2060 C ILE A 121 5.663 0.791 -14.240 1.00 0.00 C ATOM 2061 O ILE A 121 6.863 0.595 -14.316 1.00 0.00 O ATOM 2062 CB ILE A 121 4.465 1.651 -16.329 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.737 2.017 -17.131 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.977 2.852 -15.504 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.832 2.628 -16.237 1.00 0.00 C ATOM 0 H ILE A 121 2.629 0.608 -15.059 1.00 0.00 H new ATOM 0 HA ILE A 121 5.266 -0.352 -15.974 1.00 0.00 H new ATOM 0 HB ILE A 121 3.673 1.387 -17.030 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.126 1.124 -17.620 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.477 2.724 -17.919 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.790 3.697 -16.167 1.00 0.00 H new ATOM 0 HG22 ILE A 121 3.056 2.587 -14.985 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.739 3.126 -14.774 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.705 2.869 -16.844 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.454 3.537 -15.768 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.113 1.912 -15.465 1.00 0.00 H new ATOM 2077 N CYS A 122 5.135 1.333 -13.158 1.00 0.00 N ATOM 2078 CA CYS A 122 6.039 1.714 -12.010 1.00 0.00 C ATOM 2079 C CYS A 122 6.893 0.514 -11.550 1.00 0.00 C ATOM 2080 O CYS A 122 8.032 0.687 -11.156 1.00 0.00 O ATOM 2081 CB CYS A 122 5.134 2.282 -10.885 1.00 0.00 C ATOM 2082 SG CYS A 122 4.283 0.966 -9.957 1.00 0.00 S ATOM 0 H CYS A 122 4.143 1.525 -13.020 1.00 0.00 H new ATOM 0 HA CYS A 122 6.759 2.475 -12.311 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.739 2.875 -10.199 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.394 2.954 -11.320 1.00 0.00 H new ATOM 2087 N ARG A 123 6.377 -0.698 -11.620 1.00 0.00 N ATOM 2088 CA ARG A 123 7.216 -1.884 -11.206 1.00 0.00 C ATOM 2089 C ARG A 123 8.501 -1.932 -12.057 1.00 0.00 C ATOM 2090 O ARG A 123 9.548 -2.324 -11.578 1.00 0.00 O ATOM 2091 CB ARG A 123 6.376 -3.142 -11.467 1.00 0.00 C ATOM 2092 CG ARG A 123 6.790 -4.244 -10.490 1.00 0.00 C ATOM 2093 CD ARG A 123 7.969 -5.026 -11.073 1.00 0.00 C ATOM 2094 NE ARG A 123 8.828 -5.362 -9.897 1.00 0.00 N ATOM 2095 CZ ARG A 123 8.478 -6.306 -9.037 1.00 0.00 C ATOM 2096 NH1 ARG A 123 7.362 -6.987 -9.183 1.00 0.00 N ATOM 2097 NH2 ARG A 123 9.254 -6.574 -8.018 1.00 0.00 N ATOM 0 H ARG A 123 5.433 -0.917 -11.938 1.00 0.00 H new ATOM 0 HA ARG A 123 7.500 -1.815 -10.156 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.316 -2.916 -11.349 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.517 -3.480 -12.494 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.068 -3.808 -9.530 1.00 0.00 H new ATOM 0 HG3 ARG A 123 5.951 -4.915 -10.305 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.631 -5.927 -11.585 1.00 0.00 H new ATOM 0 HD3 ARG A 123 8.516 -4.430 -11.804 1.00 0.00 H new ATOM 0 HE ARG A 123 9.701 -4.854 -9.754 1.00 0.00 H new ATOM 0 HH11 ARG A 123 6.745 -6.792 -9.972 1.00 0.00 H new ATOM 0 HH12 ARG A 123 7.113 -7.710 -8.507 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.124 -6.057 -7.889 1.00 0.00 H new ATOM 0 HH22 ARG A 123 8.989 -7.300 -7.352 1.00 0.00 H new ATOM 2111 N VAL A 124 8.433 -1.530 -13.315 1.00 0.00 N ATOM 2112 CA VAL A 124 9.666 -1.555 -14.177 1.00 0.00 C ATOM 2113 C VAL A 124 10.520 -0.300 -13.903 1.00 0.00 C ATOM 2114 O VAL A 124 10.029 0.804 -14.021 1.00 0.00 O ATOM 2115 CB VAL A 124 9.175 -1.550 -15.635 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.374 -1.630 -16.582 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.260 -2.753 -15.873 1.00 0.00 C ATOM 0 H VAL A 124 7.588 -1.191 -13.774 1.00 0.00 H new ATOM 0 HA VAL A 124 10.281 -2.431 -13.970 1.00 0.00 H new ATOM 0 HB VAL A 124 8.623 -0.629 -15.824 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.023 -1.626 -17.614 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.026 -0.772 -16.417 1.00 0.00 H new ATOM 0 HG13 VAL A 124 10.928 -2.549 -16.390 1.00 0.00 H new ATOM 0 HG21 VAL A 124 7.913 -2.748 -16.906 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.811 -3.673 -15.680 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.403 -2.696 -15.202 1.00 0.00 H new ATOM 2127 N PRO A 125 11.776 -0.498 -13.552 1.00 0.00 N ATOM 2128 CA PRO A 125 12.671 0.660 -13.278 1.00 0.00 C ATOM 2129 C PRO A 125 12.919 1.469 -14.562 1.00 0.00 C ATOM 2130 O PRO A 125 12.428 1.123 -15.620 1.00 0.00 O ATOM 2131 CB PRO A 125 13.961 0.010 -12.778 1.00 0.00 C ATOM 2132 CG PRO A 125 13.931 -1.371 -13.343 1.00 0.00 C ATOM 2133 CD PRO A 125 12.483 -1.777 -13.379 1.00 0.00 C ATOM 0 HA PRO A 125 12.251 1.363 -12.559 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.839 0.559 -13.119 1.00 0.00 H new ATOM 0 HB3 PRO A 125 13.999 -0.008 -11.689 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.367 -1.393 -14.342 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.513 -2.057 -12.727 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.278 -2.464 -14.200 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.184 -2.281 -12.460 1.00 0.00 H new ATOM 2141 N ARG A 126 13.677 2.546 -14.480 1.00 0.00 N ATOM 2142 CA ARG A 126 13.944 3.367 -15.716 1.00 0.00 C ATOM 2143 C ARG A 126 14.957 2.653 -16.626 1.00 0.00 C ATOM 2144 O ARG A 126 14.828 2.682 -17.836 1.00 0.00 O ATOM 2145 CB ARG A 126 14.515 4.712 -15.240 1.00 0.00 C ATOM 2146 CG ARG A 126 14.634 5.666 -16.430 1.00 0.00 C ATOM 2147 CD ARG A 126 13.265 6.283 -16.728 1.00 0.00 C ATOM 2148 NE ARG A 126 13.566 7.573 -17.422 1.00 0.00 N ATOM 2149 CZ ARG A 126 14.030 8.619 -16.756 1.00 0.00 C ATOM 2150 NH1 ARG A 126 14.245 8.567 -15.461 1.00 0.00 N ATOM 2151 NH2 ARG A 126 14.282 9.732 -17.395 1.00 0.00 N ATOM 0 H ARG A 126 14.116 2.888 -13.625 1.00 0.00 H new ATOM 0 HA ARG A 126 13.030 3.510 -16.292 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.868 5.144 -14.477 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.492 4.562 -14.781 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.358 6.450 -16.210 1.00 0.00 H new ATOM 0 HG3 ARG A 126 15.001 5.129 -17.305 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.665 5.626 -17.358 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.699 6.450 -15.811 1.00 0.00 H new ATOM 0 HE ARG A 126 13.411 7.648 -18.427 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.054 7.707 -14.946 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.603 9.386 -14.970 1.00 0.00 H new ATOM 0 HH21 ARG A 126 14.121 9.790 -18.400 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.640 10.542 -16.888 1.00 0.00 H new ATOM 2165 N ALA A 127 15.964 2.010 -16.063 1.00 0.00 N ATOM 2166 CA ALA A 127 16.973 1.301 -16.934 1.00 0.00 C ATOM 2167 C ALA A 127 16.267 0.240 -17.790 1.00 0.00 C ATOM 2168 O ALA A 127 16.536 0.117 -18.971 1.00 0.00 O ATOM 2169 CB ALA A 127 17.988 0.635 -15.992 1.00 0.00 C ATOM 0 H ALA A 127 16.130 1.945 -15.059 1.00 0.00 H new ATOM 0 HA ALA A 127 17.471 1.998 -17.607 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.739 0.109 -16.580 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.473 1.397 -15.382 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.472 -0.074 -15.344 1.00 0.00 H new ATOM 2175 N GLN A 128 15.356 -0.519 -17.213 1.00 0.00 N ATOM 2176 CA GLN A 128 14.635 -1.557 -18.030 1.00 0.00 C ATOM 2177 C GLN A 128 13.742 -0.856 -19.065 1.00 0.00 C ATOM 2178 O GLN A 128 13.672 -1.271 -20.206 1.00 0.00 O ATOM 2179 CB GLN A 128 13.780 -2.381 -17.055 1.00 0.00 C ATOM 2180 CG GLN A 128 13.529 -3.772 -17.642 1.00 0.00 C ATOM 2181 CD GLN A 128 12.570 -3.659 -18.834 1.00 0.00 C ATOM 2182 OE1 GLN A 128 11.483 -3.133 -18.701 1.00 0.00 O ATOM 2183 NE2 GLN A 128 12.923 -4.133 -20.005 1.00 0.00 N ATOM 0 H GLN A 128 15.085 -0.467 -16.231 1.00 0.00 H new ATOM 0 HA GLN A 128 15.333 -2.203 -18.563 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.287 -2.467 -16.094 1.00 0.00 H new ATOM 0 HB3 GLN A 128 12.832 -1.876 -16.871 1.00 0.00 H new ATOM 0 HG2 GLN A 128 14.471 -4.219 -17.960 1.00 0.00 H new ATOM 0 HG3 GLN A 128 13.105 -4.428 -16.882 1.00 0.00 H new ATOM 0 HE21 GLN A 128 13.834 -4.576 -20.122 1.00 0.00 H new ATOM 0 HE22 GLN A 128 12.286 -4.059 -20.798 1.00 0.00 H new ATOM 2192 N LEU A 129 13.070 0.213 -18.682 1.00 0.00 N ATOM 2193 CA LEU A 129 12.198 0.936 -19.675 1.00 0.00 C ATOM 2194 C LEU A 129 13.072 1.516 -20.798 1.00 0.00 C ATOM 2195 O LEU A 129 12.699 1.477 -21.956 1.00 0.00 O ATOM 2196 CB LEU A 129 11.496 2.071 -18.911 1.00 0.00 C ATOM 2197 CG LEU A 129 10.423 1.486 -17.994 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.929 2.567 -17.032 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.250 0.979 -18.839 1.00 0.00 C ATOM 0 H LEU A 129 13.086 0.610 -17.743 1.00 0.00 H new ATOM 0 HA LEU A 129 11.467 0.264 -20.125 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.223 2.632 -18.324 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.045 2.771 -19.614 1.00 0.00 H new ATOM 0 HG LEU A 129 10.845 0.658 -17.424 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.163 2.150 -16.378 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.763 2.927 -16.430 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.507 3.396 -17.601 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.484 0.562 -18.185 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.828 1.806 -19.410 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.602 0.208 -19.524 1.00 0.00 H new ATOM 2211 N GLU A 130 14.237 2.050 -20.473 1.00 0.00 N ATOM 2212 CA GLU A 130 15.121 2.623 -21.553 1.00 0.00 C ATOM 2213 C GLU A 130 15.471 1.532 -22.579 1.00 0.00 C ATOM 2214 O GLU A 130 15.528 1.795 -23.766 1.00 0.00 O ATOM 2215 CB GLU A 130 16.398 3.126 -20.862 1.00 0.00 C ATOM 2216 CG GLU A 130 16.138 4.503 -20.247 1.00 0.00 C ATOM 2217 CD GLU A 130 17.414 5.342 -20.314 1.00 0.00 C ATOM 2218 OE1 GLU A 130 18.074 5.302 -21.339 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.713 6.011 -19.337 1.00 0.00 O ATOM 0 H GLU A 130 14.608 2.113 -19.525 1.00 0.00 H new ATOM 0 HA GLU A 130 14.619 3.433 -22.083 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.706 2.423 -20.088 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.214 3.186 -21.582 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.332 5.005 -20.782 1.00 0.00 H new ATOM 0 HG3 GLU A 130 15.815 4.395 -19.211 1.00 0.00 H new ATOM 2226 N GLU A 131 15.704 0.308 -22.139 1.00 0.00 N ATOM 2227 CA GLU A 131 16.046 -0.786 -23.121 1.00 0.00 C ATOM 2228 C GLU A 131 14.929 -0.935 -24.168 1.00 0.00 C ATOM 2229 O GLU A 131 15.199 -1.202 -25.325 1.00 0.00 O ATOM 2230 CB GLU A 131 16.186 -2.084 -22.310 1.00 0.00 C ATOM 2231 CG GLU A 131 16.834 -3.162 -23.180 1.00 0.00 C ATOM 2232 CD GLU A 131 18.356 -3.037 -23.100 1.00 0.00 C ATOM 2233 OE1 GLU A 131 18.899 -2.196 -23.799 1.00 0.00 O ATOM 2234 OE2 GLU A 131 18.954 -3.784 -22.342 1.00 0.00 O ATOM 0 H GLU A 131 15.673 0.023 -21.160 1.00 0.00 H new ATOM 0 HA GLU A 131 16.968 -0.554 -23.654 1.00 0.00 H new ATOM 0 HB2 GLU A 131 16.792 -1.906 -21.421 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.207 -2.418 -21.967 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.522 -4.151 -22.845 1.00 0.00 H new ATOM 0 HG3 GLU A 131 16.504 -3.057 -24.213 1.00 0.00 H new ATOM 2241 N GLU A 132 13.681 -0.769 -23.779 1.00 0.00 N ATOM 2242 CA GLU A 132 12.565 -0.909 -24.784 1.00 0.00 C ATOM 2243 C GLU A 132 12.701 0.169 -25.866 1.00 0.00 C ATOM 2244 O GLU A 132 12.645 -0.127 -27.045 1.00 0.00 O ATOM 2245 CB GLU A 132 11.246 -0.730 -24.015 1.00 0.00 C ATOM 2246 CG GLU A 132 11.052 -1.905 -23.053 1.00 0.00 C ATOM 2247 CD GLU A 132 9.566 -2.257 -22.966 1.00 0.00 C ATOM 2248 OE1 GLU A 132 8.925 -2.295 -24.004 1.00 0.00 O ATOM 2249 OE2 GLU A 132 9.094 -2.483 -21.864 1.00 0.00 O ATOM 0 H GLU A 132 13.388 -0.547 -22.827 1.00 0.00 H new ATOM 0 HA GLU A 132 12.596 -1.881 -25.275 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.260 0.209 -23.461 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.410 -0.676 -24.713 1.00 0.00 H new ATOM 0 HG2 GLU A 132 11.621 -2.768 -23.398 1.00 0.00 H new ATOM 0 HG3 GLU A 132 11.433 -1.646 -22.065 1.00 0.00 H new ATOM 2256 N ALA A 133 12.884 1.420 -25.485 1.00 0.00 N ATOM 2257 CA ALA A 133 13.028 2.500 -26.531 1.00 0.00 C ATOM 2258 C ALA A 133 14.229 2.188 -27.442 1.00 0.00 C ATOM 2259 O ALA A 133 14.174 2.410 -28.637 1.00 0.00 O ATOM 2260 CB ALA A 133 13.257 3.825 -25.785 1.00 0.00 C ATOM 0 H ALA A 133 12.939 1.736 -24.517 1.00 0.00 H new ATOM 0 HA ALA A 133 12.138 2.560 -27.157 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.367 4.635 -26.507 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.405 4.030 -25.137 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.162 3.751 -25.182 1.00 0.00 H new ATOM 2266 N ARG A 134 15.314 1.674 -26.892 1.00 0.00 N ATOM 2267 CA ARG A 134 16.508 1.354 -27.756 1.00 0.00 C ATOM 2268 C ARG A 134 16.122 0.331 -28.838 1.00 0.00 C ATOM 2269 O ARG A 134 16.569 0.427 -29.967 1.00 0.00 O ATOM 2270 CB ARG A 134 17.583 0.758 -26.831 1.00 0.00 C ATOM 2271 CG ARG A 134 18.481 1.880 -26.302 1.00 0.00 C ATOM 2272 CD ARG A 134 19.604 2.150 -27.305 1.00 0.00 C ATOM 2273 NE ARG A 134 19.106 3.278 -28.149 1.00 0.00 N ATOM 2274 CZ ARG A 134 19.108 4.525 -27.701 1.00 0.00 C ATOM 2275 NH1 ARG A 134 19.543 4.820 -26.497 1.00 0.00 N ATOM 2276 NH2 ARG A 134 18.665 5.487 -28.469 1.00 0.00 N ATOM 0 H ARG A 134 15.424 1.465 -25.900 1.00 0.00 H new ATOM 0 HA ARG A 134 16.874 2.250 -28.258 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.112 0.232 -26.000 1.00 0.00 H new ATOM 0 HB3 ARG A 134 18.180 0.026 -27.374 1.00 0.00 H new ATOM 0 HG2 ARG A 134 17.895 2.785 -26.144 1.00 0.00 H new ATOM 0 HG3 ARG A 134 18.901 1.599 -25.336 1.00 0.00 H new ATOM 0 HD2 ARG A 134 20.531 2.416 -26.797 1.00 0.00 H new ATOM 0 HD3 ARG A 134 19.814 1.268 -27.909 1.00 0.00 H new ATOM 0 HE ARG A 134 18.758 3.084 -29.088 1.00 0.00 H new ATOM 0 HH11 ARG A 134 19.889 4.081 -25.885 1.00 0.00 H new ATOM 0 HH12 ARG A 134 19.535 5.788 -26.175 1.00 0.00 H new ATOM 0 HH21 ARG A 134 18.321 5.275 -29.406 1.00 0.00 H new ATOM 0 HH22 ARG A 134 18.663 6.449 -28.131 1.00 0.00 H new ATOM 2290 N LYS A 135 15.294 -0.644 -28.514 1.00 0.00 N ATOM 2291 CA LYS A 135 14.894 -1.657 -29.553 1.00 0.00 C ATOM 2292 C LYS A 135 13.675 -1.149 -30.339 1.00 0.00 C ATOM 2293 O LYS A 135 13.616 -1.280 -31.547 1.00 0.00 O ATOM 2294 CB LYS A 135 14.543 -2.945 -28.794 1.00 0.00 C ATOM 2295 CG LYS A 135 15.830 -3.656 -28.373 1.00 0.00 C ATOM 2296 CD LYS A 135 15.547 -4.551 -27.163 1.00 0.00 C ATOM 2297 CE LYS A 135 16.741 -5.477 -26.923 1.00 0.00 C ATOM 2298 NZ LYS A 135 16.265 -6.463 -25.914 1.00 0.00 N ATOM 0 H LYS A 135 14.884 -0.780 -27.590 1.00 0.00 H new ATOM 0 HA LYS A 135 15.698 -1.832 -30.268 1.00 0.00 H new ATOM 0 HB2 LYS A 135 13.941 -2.710 -27.916 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.943 -3.600 -29.426 1.00 0.00 H new ATOM 0 HG2 LYS A 135 16.214 -4.254 -29.199 1.00 0.00 H new ATOM 0 HG3 LYS A 135 16.598 -2.924 -28.125 1.00 0.00 H new ATOM 0 HD2 LYS A 135 15.364 -3.939 -26.280 1.00 0.00 H new ATOM 0 HD3 LYS A 135 14.646 -5.139 -27.335 1.00 0.00 H new ATOM 0 HE2 LYS A 135 17.049 -5.972 -27.844 1.00 0.00 H new ATOM 0 HE3 LYS A 135 17.604 -4.922 -26.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 17.029 -7.134 -25.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 15.985 -5.964 -25.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 15.447 -6.981 -26.294 1.00 0.00 H new ATOM 2312 N LYS A 136 12.704 -0.565 -29.666 1.00 0.00 N ATOM 2313 CA LYS A 136 11.493 -0.047 -30.402 1.00 0.00 C ATOM 2314 C LYS A 136 11.878 1.073 -31.389 1.00 0.00 C ATOM 2315 O LYS A 136 11.184 1.296 -32.364 1.00 0.00 O ATOM 2316 CB LYS A 136 10.529 0.501 -29.337 1.00 0.00 C ATOM 2317 CG LYS A 136 10.067 -0.642 -28.432 1.00 0.00 C ATOM 2318 CD LYS A 136 8.765 -1.232 -28.978 1.00 0.00 C ATOM 2319 CE LYS A 136 7.940 -1.808 -27.825 1.00 0.00 C ATOM 2320 NZ LYS A 136 6.538 -1.826 -28.327 1.00 0.00 N ATOM 0 H LYS A 136 12.694 -0.425 -28.656 1.00 0.00 H new ATOM 0 HA LYS A 136 11.034 -0.845 -30.985 1.00 0.00 H new ATOM 0 HB2 LYS A 136 11.024 1.271 -28.745 1.00 0.00 H new ATOM 0 HB3 LYS A 136 9.670 0.970 -29.816 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.835 -1.414 -28.382 1.00 0.00 H new ATOM 0 HG3 LYS A 136 9.915 -0.277 -27.416 1.00 0.00 H new ATOM 0 HD2 LYS A 136 8.195 -0.462 -29.498 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.985 -2.012 -29.707 1.00 0.00 H new ATOM 0 HE2 LYS A 136 8.277 -2.810 -27.560 1.00 0.00 H new ATOM 0 HE3 LYS A 136 8.031 -1.194 -26.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 5.911 -2.209 -27.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 6.242 -0.858 -28.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 6.481 -2.424 -29.176 1.00 0.00 H new ATOM 2334 N GLY A 137 12.959 1.787 -31.149 1.00 0.00 N ATOM 2335 CA GLY A 137 13.352 2.888 -32.078 1.00 0.00 C ATOM 2336 C GLY A 137 12.692 4.203 -31.627 1.00 0.00 C ATOM 2337 O GLY A 137 12.343 5.032 -32.448 1.00 0.00 O ATOM 0 H GLY A 137 13.580 1.651 -30.351 1.00 0.00 H new ATOM 0 HA2 GLY A 137 14.436 2.999 -32.089 1.00 0.00 H new ATOM 0 HA3 GLY A 137 13.046 2.646 -33.096 1.00 0.00 H new ATOM 2341 N THR A 138 12.513 4.406 -30.335 1.00 0.00 N ATOM 2342 CA THR A 138 11.873 5.669 -29.853 1.00 0.00 C ATOM 2343 C THR A 138 12.488 6.087 -28.503 1.00 0.00 C ATOM 2344 O THR A 138 13.567 5.647 -28.156 1.00 0.00 O ATOM 2345 CB THR A 138 10.385 5.323 -29.700 1.00 0.00 C ATOM 2346 OG1 THR A 138 9.685 6.464 -29.222 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.208 4.165 -28.710 1.00 0.00 C ATOM 0 H THR A 138 12.783 3.751 -29.602 1.00 0.00 H new ATOM 0 HA THR A 138 12.022 6.505 -30.537 1.00 0.00 H new ATOM 0 HB THR A 138 9.988 5.023 -30.670 1.00 0.00 H new ATOM 0 HG1 THR A 138 8.734 6.247 -29.125 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.148 3.930 -28.611 1.00 0.00 H new ATOM 0 HG22 THR A 138 10.742 3.288 -29.077 1.00 0.00 H new ATOM 0 HG23 THR A 138 10.608 4.453 -27.738 1.00 0.00 H new ATOM 2355 N GLN A 139 11.819 6.930 -27.740 1.00 0.00 N ATOM 2356 CA GLN A 139 12.382 7.355 -26.423 1.00 0.00 C ATOM 2357 C GLN A 139 11.317 7.208 -25.325 1.00 0.00 C ATOM 2358 O GLN A 139 10.146 7.437 -25.565 1.00 0.00 O ATOM 2359 CB GLN A 139 12.762 8.824 -26.610 1.00 0.00 C ATOM 2360 CG GLN A 139 14.125 8.912 -27.301 1.00 0.00 C ATOM 2361 CD GLN A 139 14.651 10.350 -27.213 1.00 0.00 C ATOM 2362 OE1 GLN A 139 15.698 10.587 -26.644 1.00 0.00 O ATOM 2363 NE2 GLN A 139 13.970 11.330 -27.754 1.00 0.00 N ATOM 0 H GLN A 139 10.914 7.336 -27.976 1.00 0.00 H new ATOM 0 HA GLN A 139 13.237 6.750 -26.122 1.00 0.00 H new ATOM 0 HB2 GLN A 139 12.006 9.334 -27.207 1.00 0.00 H new ATOM 0 HB3 GLN A 139 12.798 9.328 -25.644 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.829 8.226 -26.829 1.00 0.00 H new ATOM 0 HG3 GLN A 139 14.036 8.609 -28.344 1.00 0.00 H new ATOM 0 HE21 GLN A 139 13.090 11.136 -28.233 1.00 0.00 H new ATOM 0 HE22 GLN A 139 14.319 12.287 -27.696 1.00 0.00 H new ATOM 2372 N VAL A 140 11.706 6.823 -24.125 1.00 0.00 N ATOM 2373 CA VAL A 140 10.699 6.666 -23.032 1.00 0.00 C ATOM 2374 C VAL A 140 11.090 7.510 -21.806 1.00 0.00 C ATOM 2375 O VAL A 140 12.234 7.895 -21.653 1.00 0.00 O ATOM 2376 CB VAL A 140 10.702 5.170 -22.686 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.084 4.742 -22.163 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.641 4.904 -21.614 1.00 0.00 C ATOM 0 H VAL A 140 12.669 6.614 -23.863 1.00 0.00 H new ATOM 0 HA VAL A 140 9.711 7.007 -23.341 1.00 0.00 H new ATOM 0 HB VAL A 140 10.478 4.594 -23.584 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.069 3.679 -21.922 1.00 0.00 H new ATOM 0 HG12 VAL A 140 12.837 4.930 -22.928 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.327 5.313 -21.267 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.636 3.844 -21.362 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.870 5.488 -20.722 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.660 5.191 -21.993 1.00 0.00 H new ATOM 2388 N SER A 141 10.146 7.800 -20.933 1.00 0.00 N ATOM 2389 CA SER A 141 10.472 8.618 -19.722 1.00 0.00 C ATOM 2390 C SER A 141 9.337 8.527 -18.685 1.00 0.00 C ATOM 2391 O SER A 141 8.425 9.333 -18.687 1.00 0.00 O ATOM 2392 CB SER A 141 10.609 10.041 -20.250 1.00 0.00 C ATOM 2393 OG SER A 141 10.882 10.922 -19.168 1.00 0.00 O ATOM 0 H SER A 141 9.172 7.506 -21.009 1.00 0.00 H new ATOM 0 HA SER A 141 11.376 8.275 -19.218 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.411 10.092 -20.986 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.692 10.343 -20.756 1.00 0.00 H new ATOM 0 HG SER A 141 10.972 11.837 -19.506 1.00 0.00 H new ATOM 2399 N PHE A 142 9.377 7.543 -17.810 1.00 0.00 N ATOM 2400 CA PHE A 142 8.288 7.399 -16.792 1.00 0.00 C ATOM 2401 C PHE A 142 8.732 7.961 -15.423 1.00 0.00 C ATOM 2402 O PHE A 142 9.909 8.109 -15.152 1.00 0.00 O ATOM 2403 CB PHE A 142 8.020 5.882 -16.711 1.00 0.00 C ATOM 2404 CG PHE A 142 7.146 5.550 -15.517 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.765 5.782 -15.553 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.731 5.013 -14.367 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.977 5.473 -14.434 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.948 4.709 -13.261 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.572 4.935 -13.285 1.00 0.00 C ATOM 0 H PHE A 142 10.114 6.839 -17.760 1.00 0.00 H new ATOM 0 HA PHE A 142 7.393 7.956 -17.068 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.535 5.545 -17.627 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.966 5.345 -16.635 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.308 6.197 -16.439 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.796 4.834 -14.338 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.912 5.650 -14.458 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.408 4.295 -12.376 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.968 4.697 -12.422 1.00 0.00 H new ATOM 2419 N HIS A 143 7.783 8.251 -14.559 1.00 0.00 N ATOM 2420 CA HIS A 143 8.115 8.778 -13.202 1.00 0.00 C ATOM 2421 C HIS A 143 7.186 8.117 -12.170 1.00 0.00 C ATOM 2422 O HIS A 143 7.632 7.418 -11.279 1.00 0.00 O ATOM 2423 CB HIS A 143 7.854 10.287 -13.282 1.00 0.00 C ATOM 2424 CG HIS A 143 8.991 11.034 -12.637 1.00 0.00 C ATOM 2425 ND1 HIS A 143 9.744 11.971 -13.327 1.00 0.00 N ATOM 2426 CD2 HIS A 143 9.514 10.994 -11.368 1.00 0.00 C ATOM 2427 CE1 HIS A 143 10.670 12.452 -12.477 1.00 0.00 C ATOM 2428 NE2 HIS A 143 10.574 11.890 -11.270 1.00 0.00 N ATOM 0 H HIS A 143 6.786 8.142 -14.743 1.00 0.00 H new ATOM 0 HA HIS A 143 9.142 8.571 -12.903 1.00 0.00 H new ATOM 0 HB2 HIS A 143 7.749 10.593 -14.323 1.00 0.00 H new ATOM 0 HB3 HIS A 143 6.916 10.531 -12.782 1.00 0.00 H new ATOM 0 HD2 HIS A 143 9.157 10.363 -10.568 1.00 0.00 H new ATOM 0 HE1 HIS A 143 11.402 13.202 -12.740 1.00 0.00 H new ATOM 0 HE2 HIS A 143 11.153 12.077 -10.452 1.00 0.00 H new ATOM 2436 N GLN A 144 5.892 8.314 -12.303 1.00 0.00 N ATOM 2437 CA GLN A 144 4.922 7.683 -11.360 1.00 0.00 C ATOM 2438 C GLN A 144 3.761 7.081 -12.167 1.00 0.00 C ATOM 2439 O GLN A 144 3.436 7.570 -13.235 1.00 0.00 O ATOM 2440 CB GLN A 144 4.431 8.820 -10.453 1.00 0.00 C ATOM 2441 CG GLN A 144 3.779 9.926 -11.290 1.00 0.00 C ATOM 2442 CD GLN A 144 3.170 10.980 -10.356 1.00 0.00 C ATOM 2443 OE1 GLN A 144 1.965 11.123 -10.294 1.00 0.00 O ATOM 2444 NE2 GLN A 144 3.952 11.732 -9.621 1.00 0.00 N ATOM 0 H GLN A 144 5.469 8.890 -13.031 1.00 0.00 H new ATOM 0 HA GLN A 144 5.365 6.880 -10.771 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.714 8.433 -9.729 1.00 0.00 H new ATOM 0 HB3 GLN A 144 5.267 9.229 -9.886 1.00 0.00 H new ATOM 0 HG2 GLN A 144 4.520 10.387 -11.943 1.00 0.00 H new ATOM 0 HG3 GLN A 144 3.006 9.504 -11.932 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.964 11.616 -9.670 1.00 0.00 H new ATOM 0 HE22 GLN A 144 3.548 12.434 -9.000 1.00 0.00 H new ATOM 2453 N CYS A 145 3.136 6.027 -11.684 1.00 0.00 N ATOM 2454 CA CYS A 145 2.003 5.421 -12.471 1.00 0.00 C ATOM 2455 C CYS A 145 0.655 6.042 -12.074 1.00 0.00 C ATOM 2456 O CYS A 145 0.484 6.512 -10.965 1.00 0.00 O ATOM 2457 CB CYS A 145 2.013 3.902 -12.213 1.00 0.00 C ATOM 2458 SG CYS A 145 1.644 3.507 -10.474 1.00 0.00 S ATOM 0 H CYS A 145 3.353 5.568 -10.800 1.00 0.00 H new ATOM 0 HA CYS A 145 2.136 5.622 -13.534 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.279 3.419 -12.859 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.989 3.495 -12.479 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.301 6.051 -12.983 1.00 0.00 N ATOM 2464 CA VAL A 146 -1.641 6.654 -12.652 1.00 0.00 C ATOM 2465 C VAL A 146 -2.420 5.774 -11.652 1.00 0.00 C ATOM 2466 O VAL A 146 -3.251 6.276 -10.920 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.419 6.788 -13.979 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -1.607 7.639 -14.957 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -2.667 5.406 -14.602 1.00 0.00 C ATOM 0 H VAL A 146 -0.214 5.673 -13.926 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.510 7.627 -12.178 1.00 0.00 H new ATOM 0 HB VAL A 146 -3.380 7.261 -13.775 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -2.153 7.736 -15.895 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -1.443 8.628 -14.529 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -0.646 7.160 -15.144 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -3.216 5.521 -15.536 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -1.712 4.920 -14.800 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.249 4.795 -13.912 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.173 4.470 -11.610 1.00 0.00 N ATOM 2480 CA HIS A 147 -2.930 3.591 -10.635 1.00 0.00 C ATOM 2481 C HIS A 147 -2.870 4.193 -9.218 1.00 0.00 C ATOM 2482 O HIS A 147 -3.890 4.489 -8.626 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.238 2.213 -10.645 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.355 1.553 -12.005 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.154 2.054 -13.032 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.769 0.416 -12.515 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.022 1.227 -14.086 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.192 0.216 -13.825 1.00 0.00 N ATOM 0 H HIS A 147 -1.494 3.985 -12.197 1.00 0.00 H new ATOM 0 HA HIS A 147 -3.978 3.509 -10.922 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.186 2.329 -10.383 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.687 1.572 -9.886 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -1.084 -0.224 -11.979 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.528 1.366 -15.030 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.924 -0.542 -14.452 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.686 4.380 -8.674 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.569 4.960 -7.306 1.00 0.00 C ATOM 2498 C CYS A 148 -0.593 6.157 -7.309 1.00 0.00 C ATOM 2499 O CYS A 148 -0.208 6.644 -8.355 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.035 3.799 -6.451 1.00 0.00 C ATOM 2501 SG CYS A 148 0.677 3.382 -6.915 1.00 0.00 S ATOM 0 H CYS A 148 -0.799 4.154 -9.124 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.514 5.347 -6.925 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.074 4.071 -5.396 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.674 2.925 -6.578 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.172 6.613 -6.146 1.00 0.00 N ATOM 2507 CA GLY A 149 0.797 7.747 -6.092 1.00 0.00 C ATOM 2508 C GLY A 149 2.197 7.166 -5.853 1.00 0.00 C ATOM 2509 O GLY A 149 2.833 7.452 -4.856 1.00 0.00 O ATOM 0 H GLY A 149 -0.460 6.246 -5.239 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.773 8.313 -7.023 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.530 8.438 -5.293 1.00 0.00 H new ATOM 2513 N CYS A 150 2.678 6.338 -6.758 1.00 0.00 N ATOM 2514 CA CYS A 150 4.034 5.722 -6.577 1.00 0.00 C ATOM 2515 C CYS A 150 5.075 6.500 -7.395 1.00 0.00 C ATOM 2516 O CYS A 150 4.785 6.975 -8.473 1.00 0.00 O ATOM 2517 CB CYS A 150 3.872 4.275 -7.092 1.00 0.00 C ATOM 2518 SG CYS A 150 5.466 3.418 -7.216 1.00 0.00 S ATOM 0 H CYS A 150 2.190 6.064 -7.611 1.00 0.00 H new ATOM 0 HA CYS A 150 4.380 5.743 -5.544 1.00 0.00 H new ATOM 0 HB2 CYS A 150 3.214 3.723 -6.421 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.391 4.290 -8.070 1.00 0.00 H new ATOM 2523 N ARG A 151 6.292 6.616 -6.902 1.00 0.00 N ATOM 2524 CA ARG A 151 7.343 7.351 -7.679 1.00 0.00 C ATOM 2525 C ARG A 151 8.223 6.341 -8.431 1.00 0.00 C ATOM 2526 O ARG A 151 9.437 6.395 -8.358 1.00 0.00 O ATOM 2527 CB ARG A 151 8.172 8.123 -6.645 1.00 0.00 C ATOM 2528 CG ARG A 151 7.465 9.434 -6.296 1.00 0.00 C ATOM 2529 CD ARG A 151 8.326 10.234 -5.316 1.00 0.00 C ATOM 2530 NE ARG A 151 7.350 10.967 -4.452 1.00 0.00 N ATOM 2531 CZ ARG A 151 6.712 12.040 -4.893 1.00 0.00 C ATOM 2532 NH1 ARG A 151 6.909 12.504 -6.107 1.00 0.00 N ATOM 2533 NH2 ARG A 151 5.868 12.658 -4.108 1.00 0.00 N ATOM 0 H ARG A 151 6.597 6.237 -6.006 1.00 0.00 H new ATOM 0 HA ARG A 151 6.910 8.027 -8.416 1.00 0.00 H new ATOM 0 HB2 ARG A 151 8.305 7.520 -5.747 1.00 0.00 H new ATOM 0 HB3 ARG A 151 9.166 8.329 -7.041 1.00 0.00 H new ATOM 0 HG2 ARG A 151 7.289 10.016 -7.200 1.00 0.00 H new ATOM 0 HG3 ARG A 151 6.490 9.227 -5.855 1.00 0.00 H new ATOM 0 HD2 ARG A 151 8.962 9.577 -4.723 1.00 0.00 H new ATOM 0 HD3 ARG A 151 8.984 10.925 -5.842 1.00 0.00 H new ATOM 0 HE ARG A 151 7.172 10.634 -3.504 1.00 0.00 H new ATOM 0 HH11 ARG A 151 7.565 12.036 -6.732 1.00 0.00 H new ATOM 0 HH12 ARG A 151 6.406 13.332 -6.424 1.00 0.00 H new ATOM 0 HH21 ARG A 151 5.705 12.313 -3.162 1.00 0.00 H new ATOM 0 HH22 ARG A 151 5.373 13.485 -4.442 1.00 0.00 H new ATOM 2547 N GLY A 152 7.620 5.416 -9.151 1.00 0.00 N ATOM 2548 CA GLY A 152 8.419 4.407 -9.898 1.00 0.00 C ATOM 2549 C GLY A 152 9.119 3.471 -8.904 1.00 0.00 C ATOM 2550 O GLY A 152 10.170 3.794 -8.380 1.00 0.00 O ATOM 0 H GLY A 152 6.609 5.324 -9.248 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.771 3.833 -10.561 1.00 0.00 H new ATOM 0 HA3 GLY A 152 9.157 4.905 -10.527 1.00 0.00 H new ATOM 2554 N CYS A 153 8.551 2.309 -8.637 1.00 0.00 N ATOM 2555 CA CYS A 153 9.201 1.364 -7.676 1.00 0.00 C ATOM 2556 C CYS A 153 9.753 0.132 -8.420 1.00 0.00 C ATOM 2557 O CYS A 153 9.055 -0.497 -9.193 1.00 0.00 O ATOM 2558 CB CYS A 153 8.106 0.983 -6.656 1.00 0.00 C ATOM 2559 SG CYS A 153 6.800 -0.030 -7.417 1.00 0.00 S ATOM 0 H CYS A 153 7.674 1.982 -9.042 1.00 0.00 H new ATOM 0 HA CYS A 153 10.055 1.815 -7.171 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.555 0.435 -5.828 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.667 1.889 -6.238 1.00 0.00 H new ATOM 2564 N ALA A 154 11.005 -0.211 -8.198 1.00 0.00 N ATOM 2565 CA ALA A 154 11.596 -1.393 -8.896 1.00 0.00 C ATOM 2566 C ALA A 154 12.697 -2.025 -8.029 1.00 0.00 C ATOM 2567 O ALA A 154 13.467 -1.323 -7.400 1.00 0.00 O ATOM 2568 CB ALA A 154 12.186 -0.832 -10.187 1.00 0.00 C ATOM 0 H ALA A 154 11.637 0.278 -7.565 1.00 0.00 H new ATOM 0 HA ALA A 154 10.859 -2.172 -9.089 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.641 -1.640 -10.760 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.395 -0.369 -10.777 1.00 0.00 H new ATOM 0 HB3 ALA A 154 12.943 -0.086 -9.947 1.00 0.00 H new ATOM 2574 N SER A 155 12.780 -3.339 -7.985 1.00 0.00 N ATOM 2575 CA SER A 155 13.835 -3.989 -7.152 1.00 0.00 C ATOM 2576 C SER A 155 14.803 -4.783 -8.043 1.00 0.00 C ATOM 2577 O SER A 155 15.996 -4.546 -8.029 1.00 0.00 O ATOM 2578 CB SER A 155 13.080 -4.926 -6.212 1.00 0.00 C ATOM 2579 OG SER A 155 11.802 -4.371 -5.918 1.00 0.00 O ATOM 0 H SER A 155 12.166 -3.980 -8.488 1.00 0.00 H new ATOM 0 HA SER A 155 14.433 -3.261 -6.605 1.00 0.00 H new ATOM 0 HB2 SER A 155 12.965 -5.907 -6.673 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.647 -5.070 -5.292 1.00 0.00 H new ATOM 0 HG SER A 155 11.165 -5.094 -5.736 1.00 0.00 H new ATOM 2585 N THR A 156 14.302 -5.723 -8.820 1.00 0.00 N ATOM 2586 CA THR A 156 15.202 -6.523 -9.703 1.00 0.00 C ATOM 2587 C THR A 156 14.527 -6.770 -11.062 1.00 0.00 C ATOM 2588 O THR A 156 14.449 -7.895 -11.523 1.00 0.00 O ATOM 2589 CB THR A 156 15.415 -7.843 -8.959 1.00 0.00 C ATOM 2590 OG1 THR A 156 15.680 -7.572 -7.589 1.00 0.00 O ATOM 2591 CG2 THR A 156 16.599 -8.592 -9.571 1.00 0.00 C ATOM 0 H THR A 156 13.313 -5.965 -8.876 1.00 0.00 H new ATOM 0 HA THR A 156 16.144 -6.014 -9.905 1.00 0.00 H new ATOM 0 HB THR A 156 14.519 -8.458 -9.043 1.00 0.00 H new ATOM 0 HG1 THR A 156 15.815 -8.416 -7.109 1.00 0.00 H new ATOM 0 HG21 THR A 156 16.749 -9.532 -9.040 1.00 0.00 H new ATOM 0 HG22 THR A 156 16.395 -8.798 -10.622 1.00 0.00 H new ATOM 0 HG23 THR A 156 17.498 -7.981 -9.488 1.00 0.00 H new ATOM 2599 N ASP A 157 14.038 -5.732 -11.711 1.00 0.00 N ATOM 2600 CA ASP A 157 13.372 -5.921 -13.035 1.00 0.00 C ATOM 2601 C ASP A 157 14.148 -5.180 -14.127 1.00 0.00 C ATOM 2602 O ASP A 157 14.961 -5.813 -14.781 1.00 0.00 O ATOM 2603 CB ASP A 157 11.976 -5.319 -12.867 1.00 0.00 C ATOM 2604 CG ASP A 157 11.029 -6.376 -12.295 1.00 0.00 C ATOM 2605 OD1 ASP A 157 11.043 -6.564 -11.089 1.00 0.00 O ATOM 2606 OD2 ASP A 157 10.308 -6.979 -13.071 1.00 0.00 O ATOM 2607 OXT ASP A 157 13.915 -3.995 -14.291 1.00 0.00 O ATOM 0 H ASP A 157 14.074 -4.769 -11.378 1.00 0.00 H new ATOM 0 HA ASP A 157 13.330 -6.969 -13.330 1.00 0.00 H new ATOM 0 HB2 ASP A 157 12.018 -4.456 -12.203 1.00 0.00 H new ATOM 0 HB3 ASP A 157 11.604 -4.964 -13.828 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 1.119 1.132 -6.755 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 4.917 1.245 -7.754 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 2.024 1.229 -10.348 1.00 0.00 ZN