USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=33 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+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 100 TYR OH : rot 180:sc= -0.335 USER MOD Set 2.1: A 78 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 89 LYS NZ :NH3+ -177:sc= 0.00555 (180deg=0) USER MOD Set 3.1: A 67 TYR OH : rot 150:sc= -0.0716 USER MOD Set 3.2: A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 22 THR OG1 : rot 170:sc= 0 USER MOD Set 4.2: A 62 TYR OH : rot 180:sc= -2.63! USER MOD Single : A 1 SER OG : rot 18:sc= 0.0493 USER MOD Single : A 5 LYS NZ :NH3+ -112:sc=-0.00526 (180deg=-0.289) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (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 86:sc= 0.878 USER MOD Single : A 29 GLN : amide:sc= -3.81 K(o=-3.8,f=-8.3!) USER MOD Single : A 34 GLN : amide:sc= -0.0364 K(o=-0.036,f=-2.5!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot -56:sc= 1.27 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 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.0174 X(o=-0.017,f=0) USER MOD Single : A 48 GLN : amide:sc= -3.5 K(o=-3.5,f=-2.7!) USER MOD Single : A 53 MET CE :methyl -129:sc= -3.04 (180deg=-6.8!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 HIS : no HE2:sc= -2.08! C(o=-2.1!,f=-6.1!) USER MOD Single : A 57 HIS : no HE2:sc= -2.72 K(o=-2.7,f=-3.3!) USER MOD Single : A 58 GLN : amide:sc= -0.821 K(o=-0.82,f=-1.5) USER MOD Single : A 60 SER OG : rot 26:sc= 0.277 USER MOD Single : A 64 TYR OH : rot 180:sc= -0.246! USER MOD Single : A 65 THR OG1 : rot 102:sc= 0.96 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -157:sc= -0.0104 (180deg=-0.808) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : 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 158:sc= 0.763 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc=-0.000809 X(o=-0.00081,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.126 K(o=-0.13,f=-1.3!) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot 180:sc= -0.0653 USER MOD Single : A 119 THR OG1 : rot 140:sc= -4.42! USER MOD Single : A 128 GLN : amide:sc= -0.245 K(o=-0.25,f=-1.7!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -159:sc=-0.00659 (180deg=-0.575) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.184 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= -0.301 X(o=-0.3,f=-0.016) USER MOD Single : A 144 GLN : amide:sc= -2.65 K(o=-2.6,f=-4.7!) USER MOD Single : A 147 HIS : no HD1:sc= -1.11 X(o=-1.1,f=-0.63) USER MOD Single : A 155 SER OG : rot 150:sc= -0.592 USER MOD Single : A 156 THR OG1 : rot 180:sc= -1.11! USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -21.702 -23.403 -3.400 1.00 0.00 N ATOM 2 CA GLY A -1 -22.885 -22.562 -3.742 1.00 0.00 C ATOM 3 C GLY A -1 -24.081 -22.977 -2.873 1.00 0.00 C ATOM 4 O GLY A -1 -25.018 -23.584 -3.357 1.00 0.00 O ATOM 0 H1 GLY A -1 -20.893 -23.120 -3.989 1.00 0.00 H new ATOM 0 H2 GLY A -1 -21.462 -23.272 -2.397 1.00 0.00 H new ATOM 0 H3 GLY A -1 -21.925 -24.404 -3.575 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -22.654 -21.509 -3.581 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -23.132 -22.677 -4.797 1.00 0.00 H new ATOM 10 N GLY A 0 -24.059 -22.659 -1.594 1.00 0.00 N ATOM 11 CA GLY A 0 -25.199 -23.041 -0.709 1.00 0.00 C ATOM 12 C GLY A 0 -25.643 -21.822 0.112 1.00 0.00 C ATOM 13 O GLY A 0 -25.560 -21.828 1.326 1.00 0.00 O ATOM 0 H GLY A 0 -23.302 -22.154 -1.133 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -26.031 -23.411 -1.309 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -24.901 -23.851 -0.044 1.00 0.00 H new ATOM 17 N SER A 1 -26.113 -20.774 -0.535 1.00 0.00 N ATOM 18 CA SER A 1 -26.557 -19.564 0.220 1.00 0.00 C ATOM 19 C SER A 1 -27.817 -18.967 -0.425 1.00 0.00 C ATOM 20 O SER A 1 -27.721 -18.068 -1.236 1.00 0.00 O ATOM 21 CB SER A 1 -25.388 -18.584 0.119 1.00 0.00 C ATOM 22 OG SER A 1 -24.455 -18.857 1.156 1.00 0.00 O ATOM 0 H SER A 1 -26.206 -20.710 -1.549 1.00 0.00 H new ATOM 0 HA SER A 1 -26.809 -19.793 1.255 1.00 0.00 H new ATOM 0 HB2 SER A 1 -24.905 -18.675 -0.854 1.00 0.00 H new ATOM 0 HB3 SER A 1 -25.750 -17.559 0.200 1.00 0.00 H new ATOM 0 HG SER A 1 -24.610 -19.759 1.506 1.00 0.00 H new ATOM 28 N PRO A 2 -28.969 -19.483 -0.048 1.00 0.00 N ATOM 29 CA PRO A 2 -30.241 -18.971 -0.617 1.00 0.00 C ATOM 30 C PRO A 2 -30.559 -17.578 -0.054 1.00 0.00 C ATOM 31 O PRO A 2 -31.018 -16.708 -0.770 1.00 0.00 O ATOM 32 CB PRO A 2 -31.279 -19.993 -0.162 1.00 0.00 C ATOM 33 CG PRO A 2 -30.700 -20.613 1.069 1.00 0.00 C ATOM 34 CD PRO A 2 -29.201 -20.568 0.922 1.00 0.00 C ATOM 0 HA PRO A 2 -30.210 -18.860 -1.701 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -32.236 -19.516 0.049 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -31.460 -20.742 -0.933 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -31.017 -20.070 1.960 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -31.046 -21.641 1.182 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -28.713 -20.363 1.875 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -28.807 -21.518 0.560 1.00 0.00 H new ATOM 42 N ARG A 3 -30.320 -17.356 1.221 1.00 0.00 N ATOM 43 CA ARG A 3 -30.611 -16.019 1.818 1.00 0.00 C ATOM 44 C ARG A 3 -29.449 -15.576 2.720 1.00 0.00 C ATOM 45 O ARG A 3 -29.664 -15.021 3.782 1.00 0.00 O ATOM 46 CB ARG A 3 -31.883 -16.222 2.643 1.00 0.00 C ATOM 47 CG ARG A 3 -32.585 -14.875 2.838 1.00 0.00 C ATOM 48 CD ARG A 3 -33.539 -14.965 4.030 1.00 0.00 C ATOM 49 NE ARG A 3 -34.875 -15.269 3.434 1.00 0.00 N ATOM 50 CZ ARG A 3 -35.537 -14.363 2.730 1.00 0.00 C ATOM 51 NH1 ARG A 3 -35.048 -13.161 2.529 1.00 0.00 N ATOM 52 NH2 ARG A 3 -36.705 -14.665 2.223 1.00 0.00 N ATOM 0 H ARG A 3 -29.937 -18.045 1.868 1.00 0.00 H new ATOM 0 HA ARG A 3 -30.736 -15.246 1.059 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -32.549 -16.922 2.138 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -31.636 -16.659 3.611 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -31.848 -14.090 3.007 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -33.136 -14.606 1.937 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -33.230 -15.746 4.725 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -33.560 -14.030 4.590 1.00 0.00 H new ATOM 0 HE ARG A 3 -35.285 -16.193 3.572 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -34.140 -12.908 2.918 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -35.576 -12.480 1.983 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -37.101 -15.593 2.371 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -37.220 -13.972 1.680 1.00 0.00 H new ATOM 66 N ILE A 4 -28.219 -15.814 2.312 1.00 0.00 N ATOM 67 CA ILE A 4 -27.055 -15.402 3.155 1.00 0.00 C ATOM 68 C ILE A 4 -26.160 -14.425 2.374 1.00 0.00 C ATOM 69 O ILE A 4 -25.838 -14.664 1.225 1.00 0.00 O ATOM 70 CB ILE A 4 -26.301 -16.700 3.464 1.00 0.00 C ATOM 71 CG1 ILE A 4 -27.227 -17.667 4.207 1.00 0.00 C ATOM 72 CG2 ILE A 4 -25.084 -16.394 4.339 1.00 0.00 C ATOM 73 CD1 ILE A 4 -26.607 -19.066 4.212 1.00 0.00 C ATOM 0 H ILE A 4 -27.977 -16.274 1.435 1.00 0.00 H new ATOM 0 HA ILE A 4 -27.365 -14.891 4.067 1.00 0.00 H new ATOM 0 HB ILE A 4 -25.972 -17.154 2.529 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -27.384 -17.324 5.230 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -28.205 -17.693 3.726 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -24.550 -17.319 4.557 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -24.421 -15.708 3.813 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -25.413 -15.937 5.272 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -27.266 -19.754 4.741 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -26.473 -19.408 3.186 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -25.639 -19.033 4.713 1.00 0.00 H new ATOM 85 N LYS A 5 -25.757 -13.328 2.983 1.00 0.00 N ATOM 86 CA LYS A 5 -24.888 -12.349 2.262 1.00 0.00 C ATOM 87 C LYS A 5 -23.780 -11.834 3.195 1.00 0.00 C ATOM 88 O LYS A 5 -22.608 -11.998 2.914 1.00 0.00 O ATOM 89 CB LYS A 5 -25.825 -11.209 1.859 1.00 0.00 C ATOM 90 CG LYS A 5 -25.465 -10.721 0.454 1.00 0.00 C ATOM 91 CD LYS A 5 -24.114 -10.004 0.492 1.00 0.00 C ATOM 92 CE LYS A 5 -23.683 -9.652 -0.934 1.00 0.00 C ATOM 93 NZ LYS A 5 -23.155 -10.923 -1.501 1.00 0.00 N ATOM 0 H LYS A 5 -25.994 -13.074 3.942 1.00 0.00 H new ATOM 0 HA LYS A 5 -24.393 -12.794 1.398 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -26.860 -11.550 1.882 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -25.744 -10.389 2.572 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -25.422 -11.564 -0.235 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -26.236 -10.046 0.083 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -24.187 -9.099 1.095 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -23.365 -10.641 0.963 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -24.523 -9.278 -1.519 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -22.921 -8.873 -0.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -22.129 -10.838 -1.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -23.348 -11.704 -0.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -23.619 -11.116 -2.411 1.00 0.00 H new ATOM 107 N THR A 6 -24.136 -11.210 4.301 1.00 0.00 N ATOM 108 CA THR A 6 -23.093 -10.692 5.236 1.00 0.00 C ATOM 109 C THR A 6 -23.453 -11.052 6.686 1.00 0.00 C ATOM 110 O THR A 6 -24.592 -11.362 6.984 1.00 0.00 O ATOM 111 CB THR A 6 -23.106 -9.175 5.040 1.00 0.00 C ATOM 112 OG1 THR A 6 -22.948 -8.876 3.660 1.00 0.00 O ATOM 113 CG2 THR A 6 -21.961 -8.546 5.835 1.00 0.00 C ATOM 0 H THR A 6 -25.100 -11.041 4.589 1.00 0.00 H new ATOM 0 HA THR A 6 -22.111 -11.121 5.038 1.00 0.00 H new ATOM 0 HB THR A 6 -24.055 -8.771 5.393 1.00 0.00 H new ATOM 0 HG1 THR A 6 -22.958 -7.904 3.533 1.00 0.00 H new ATOM 0 HG21 THR A 6 -21.971 -7.465 5.695 1.00 0.00 H new ATOM 0 HG22 THR A 6 -22.084 -8.776 6.893 1.00 0.00 H new ATOM 0 HG23 THR A 6 -21.011 -8.948 5.484 1.00 0.00 H new ATOM 121 N ARG A 7 -22.497 -11.013 7.592 1.00 0.00 N ATOM 122 CA ARG A 7 -22.798 -11.355 9.015 1.00 0.00 C ATOM 123 C ARG A 7 -22.500 -10.151 9.922 1.00 0.00 C ATOM 124 O ARG A 7 -21.616 -9.364 9.639 1.00 0.00 O ATOM 125 CB ARG A 7 -21.866 -12.521 9.348 1.00 0.00 C ATOM 126 CG ARG A 7 -22.606 -13.844 9.137 1.00 0.00 C ATOM 127 CD ARG A 7 -22.322 -14.369 7.728 1.00 0.00 C ATOM 128 NE ARG A 7 -22.507 -15.850 7.823 1.00 0.00 N ATOM 129 CZ ARG A 7 -21.637 -16.611 8.471 1.00 0.00 C ATOM 130 NH1 ARG A 7 -20.579 -16.098 9.056 1.00 0.00 N ATOM 131 NH2 ARG A 7 -21.832 -17.904 8.534 1.00 0.00 N ATOM 0 H ARG A 7 -21.527 -10.760 7.403 1.00 0.00 H new ATOM 0 HA ARG A 7 -23.846 -11.616 9.166 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -20.979 -12.483 8.715 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -21.525 -12.444 10.380 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -22.286 -14.574 9.880 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -23.678 -13.699 9.273 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -23.004 -13.932 6.999 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -21.311 -14.117 7.409 1.00 0.00 H new ATOM 0 HE ARG A 7 -23.318 -16.282 7.381 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -20.412 -15.092 9.018 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -19.924 -16.705 9.549 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -22.649 -18.319 8.086 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -21.167 -18.496 9.031 1.00 0.00 H new ATOM 145 N ARG A 8 -23.225 -9.998 11.013 1.00 0.00 N ATOM 146 CA ARG A 8 -22.971 -8.844 11.926 1.00 0.00 C ATOM 147 C ARG A 8 -23.015 -9.305 13.392 1.00 0.00 C ATOM 148 O ARG A 8 -23.706 -8.723 14.206 1.00 0.00 O ATOM 149 CB ARG A 8 -24.103 -7.854 11.639 1.00 0.00 C ATOM 150 CG ARG A 8 -23.671 -6.435 12.041 1.00 0.00 C ATOM 151 CD ARG A 8 -24.725 -5.810 12.962 1.00 0.00 C ATOM 152 NE ARG A 8 -24.185 -5.990 14.344 1.00 0.00 N ATOM 153 CZ ARG A 8 -23.134 -5.301 14.766 1.00 0.00 C ATOM 154 NH1 ARG A 8 -22.526 -4.433 13.991 1.00 0.00 N ATOM 155 NH2 ARG A 8 -22.688 -5.486 15.982 1.00 0.00 N ATOM 0 H ARG A 8 -23.977 -10.623 11.304 1.00 0.00 H new ATOM 0 HA ARG A 8 -21.990 -8.398 11.764 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -24.360 -7.879 10.580 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -24.998 -8.141 12.191 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -22.707 -6.469 12.548 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -23.542 -5.819 11.151 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -24.876 -4.755 12.731 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -25.691 -6.302 12.848 1.00 0.00 H new ATOM 0 HE ARG A 8 -24.633 -6.655 14.974 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -22.860 -4.276 13.040 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -21.719 -3.915 14.340 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -23.148 -6.156 16.598 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -21.880 -4.960 16.314 1.00 0.00 H new ATOM 169 N SER A 9 -22.285 -10.347 13.737 1.00 0.00 N ATOM 170 CA SER A 9 -22.294 -10.833 15.150 1.00 0.00 C ATOM 171 C SER A 9 -20.860 -11.100 15.634 1.00 0.00 C ATOM 172 O SER A 9 -20.610 -12.064 16.331 1.00 0.00 O ATOM 173 CB SER A 9 -23.096 -12.133 15.114 1.00 0.00 C ATOM 174 OG SER A 9 -22.432 -13.071 14.279 1.00 0.00 O ATOM 0 H SER A 9 -21.688 -10.875 13.100 1.00 0.00 H new ATOM 0 HA SER A 9 -22.727 -10.102 15.833 1.00 0.00 H new ATOM 0 HB2 SER A 9 -23.202 -12.536 16.121 1.00 0.00 H new ATOM 0 HB3 SER A 9 -24.102 -11.943 14.739 1.00 0.00 H new ATOM 0 HG SER A 9 -22.943 -13.907 14.255 1.00 0.00 H new ATOM 180 N LYS A 10 -19.914 -10.255 15.272 1.00 0.00 N ATOM 181 CA LYS A 10 -18.506 -10.473 15.720 1.00 0.00 C ATOM 182 C LYS A 10 -17.905 -9.155 16.236 1.00 0.00 C ATOM 183 O LYS A 10 -17.239 -8.455 15.500 1.00 0.00 O ATOM 184 CB LYS A 10 -17.764 -10.961 14.472 1.00 0.00 C ATOM 185 CG LYS A 10 -16.792 -12.082 14.855 1.00 0.00 C ATOM 186 CD LYS A 10 -16.793 -13.158 13.765 1.00 0.00 C ATOM 187 CE LYS A 10 -16.621 -14.537 14.407 1.00 0.00 C ATOM 188 NZ LYS A 10 -16.469 -15.478 13.262 1.00 0.00 N ATOM 0 H LYS A 10 -20.062 -9.431 14.689 1.00 0.00 H new ATOM 0 HA LYS A 10 -18.435 -11.191 16.537 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -18.477 -11.322 13.731 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -17.220 -10.135 14.014 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -15.787 -11.679 14.981 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -17.082 -12.518 15.811 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -17.726 -13.121 13.203 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -15.987 -12.972 13.056 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -15.747 -14.563 15.058 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -17.484 -14.797 15.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -16.346 -16.446 13.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -17.318 -15.436 12.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -15.636 -15.209 12.700 1.00 0.00 H new ATOM 202 N PRO A 11 -18.159 -8.850 17.492 1.00 0.00 N ATOM 203 CA PRO A 11 -17.625 -7.597 18.083 1.00 0.00 C ATOM 204 C PRO A 11 -16.114 -7.711 18.321 1.00 0.00 C ATOM 205 O PRO A 11 -15.577 -8.798 18.421 1.00 0.00 O ATOM 206 CB PRO A 11 -18.374 -7.473 19.408 1.00 0.00 C ATOM 207 CG PRO A 11 -18.772 -8.870 19.761 1.00 0.00 C ATOM 208 CD PRO A 11 -18.949 -9.621 18.468 1.00 0.00 C ATOM 0 HA PRO A 11 -17.765 -6.731 17.436 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.740 -7.036 20.180 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.247 -6.827 19.309 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -18.009 -9.343 20.380 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.697 -8.873 20.338 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -18.589 -10.647 18.551 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -19.998 -9.674 18.178 1.00 0.00 H new ATOM 216 N ALA A 12 -15.425 -6.594 18.422 1.00 0.00 N ATOM 217 CA ALA A 12 -13.942 -6.650 18.664 1.00 0.00 C ATOM 218 C ALA A 12 -13.668 -6.741 20.175 1.00 0.00 C ATOM 219 O ALA A 12 -14.430 -6.221 20.965 1.00 0.00 O ATOM 220 CB ALA A 12 -13.359 -5.352 18.081 1.00 0.00 C ATOM 0 H ALA A 12 -15.819 -5.656 18.348 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.487 -7.522 18.195 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.279 -5.339 18.230 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.579 -5.301 17.015 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.805 -4.494 18.585 1.00 0.00 H new ATOM 226 N PRO A 13 -12.592 -7.407 20.537 1.00 0.00 N ATOM 227 CA PRO A 13 -12.250 -7.558 21.974 1.00 0.00 C ATOM 228 C PRO A 13 -11.798 -6.220 22.573 1.00 0.00 C ATOM 229 O PRO A 13 -11.465 -5.295 21.858 1.00 0.00 O ATOM 230 CB PRO A 13 -11.109 -8.573 21.971 1.00 0.00 C ATOM 231 CG PRO A 13 -10.496 -8.461 20.613 1.00 0.00 C ATOM 232 CD PRO A 13 -11.602 -8.069 19.669 1.00 0.00 C ATOM 0 HA PRO A 13 -13.097 -7.881 22.579 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.382 -8.351 22.752 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.478 -9.582 22.156 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.701 -7.716 20.608 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.048 -9.408 20.312 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.242 -7.398 18.889 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.028 -8.939 19.169 1.00 0.00 H new ATOM 240 N ASP A 14 -11.795 -6.109 23.888 1.00 0.00 N ATOM 241 CA ASP A 14 -11.371 -4.813 24.548 1.00 0.00 C ATOM 242 C ASP A 14 -10.053 -4.277 23.952 1.00 0.00 C ATOM 243 O ASP A 14 -9.850 -3.081 23.878 1.00 0.00 O ATOM 244 CB ASP A 14 -11.174 -5.127 26.039 1.00 0.00 C ATOM 245 CG ASP A 14 -12.538 -5.219 26.726 1.00 0.00 C ATOM 246 OD1 ASP A 14 -13.343 -4.326 26.522 1.00 0.00 O ATOM 247 OD2 ASP A 14 -12.753 -6.181 27.444 1.00 0.00 O ATOM 0 H ASP A 14 -12.065 -6.852 24.532 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.128 -4.045 24.388 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -10.632 -6.066 26.155 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -10.570 -4.350 26.508 1.00 0.00 H new ATOM 252 N GLY A 15 -9.158 -5.147 23.523 1.00 0.00 N ATOM 253 CA GLY A 15 -7.862 -4.675 22.934 1.00 0.00 C ATOM 254 C GLY A 15 -8.120 -3.641 21.818 1.00 0.00 C ATOM 255 O GLY A 15 -7.352 -2.712 21.651 1.00 0.00 O ATOM 0 H GLY A 15 -9.273 -6.160 23.557 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.242 -4.231 23.713 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.309 -5.523 22.531 1.00 0.00 H new ATOM 259 N PHE A 16 -9.190 -3.786 21.057 1.00 0.00 N ATOM 260 CA PHE A 16 -9.469 -2.786 19.959 1.00 0.00 C ATOM 261 C PHE A 16 -9.533 -1.357 20.528 1.00 0.00 C ATOM 262 O PHE A 16 -9.166 -0.409 19.859 1.00 0.00 O ATOM 263 CB PHE A 16 -10.824 -3.167 19.341 1.00 0.00 C ATOM 264 CG PHE A 16 -11.065 -2.334 18.104 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.114 -2.311 17.076 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.241 -1.583 17.985 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.340 -1.539 15.931 1.00 0.00 C ATOM 268 CE2 PHE A 16 -12.467 -0.811 16.839 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.515 -0.789 15.811 1.00 0.00 C ATOM 0 H PHE A 16 -9.872 -4.539 21.145 1.00 0.00 H new ATOM 0 HA PHE A 16 -8.675 -2.806 19.213 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -10.835 -4.227 19.087 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -11.624 -3.005 20.063 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.206 -2.889 17.167 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -12.974 -1.599 18.778 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.606 -1.522 15.139 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.375 -0.233 16.747 1.00 0.00 H new ATOM 0 HZ PHE A 16 -11.688 -0.194 14.927 1.00 0.00 H new ATOM 279 N GLU A 17 -9.990 -1.185 21.756 1.00 0.00 N ATOM 280 CA GLU A 17 -10.059 0.208 22.343 1.00 0.00 C ATOM 281 C GLU A 17 -8.683 0.888 22.256 1.00 0.00 C ATOM 282 O GLU A 17 -8.589 2.070 21.978 1.00 0.00 O ATOM 283 CB GLU A 17 -10.476 0.052 23.814 1.00 0.00 C ATOM 284 CG GLU A 17 -10.887 1.415 24.376 1.00 0.00 C ATOM 285 CD GLU A 17 -10.665 1.432 25.889 1.00 0.00 C ATOM 286 OE1 GLU A 17 -11.560 1.012 26.604 1.00 0.00 O ATOM 287 OE2 GLU A 17 -9.604 1.865 26.308 1.00 0.00 O ATOM 0 H GLU A 17 -10.313 -1.933 22.369 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.772 0.826 21.797 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.305 -0.652 23.895 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -9.651 -0.359 24.395 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.304 2.206 23.904 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.935 1.613 24.149 1.00 0.00 H new ATOM 294 N LYS A 18 -7.613 0.152 22.480 1.00 0.00 N ATOM 295 CA LYS A 18 -6.243 0.778 22.393 1.00 0.00 C ATOM 296 C LYS A 18 -6.024 1.383 20.995 1.00 0.00 C ATOM 297 O LYS A 18 -5.402 2.421 20.860 1.00 0.00 O ATOM 298 CB LYS A 18 -5.223 -0.345 22.648 1.00 0.00 C ATOM 299 CG LYS A 18 -5.014 -0.514 24.155 1.00 0.00 C ATOM 300 CD LYS A 18 -4.205 0.667 24.695 1.00 0.00 C ATOM 301 CE LYS A 18 -2.718 0.303 24.719 1.00 0.00 C ATOM 302 NZ LYS A 18 -2.444 -0.098 26.128 1.00 0.00 N ATOM 0 H LYS A 18 -7.625 -0.840 22.716 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.134 1.580 23.123 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -5.578 -1.279 22.213 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.276 -0.107 22.163 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -5.977 -0.571 24.662 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -4.492 -1.449 24.358 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -4.365 1.546 24.070 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.543 0.924 25.699 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -2.499 -0.510 24.027 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -2.099 1.150 24.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -1.443 -0.362 26.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.655 0.698 26.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.043 -0.910 26.380 1.00 0.00 H new ATOM 316 N ILE A 19 -6.535 0.753 19.956 1.00 0.00 N ATOM 317 CA ILE A 19 -6.354 1.313 18.579 1.00 0.00 C ATOM 318 C ILE A 19 -7.718 1.721 17.981 1.00 0.00 C ATOM 319 O ILE A 19 -7.949 1.563 16.797 1.00 0.00 O ATOM 320 CB ILE A 19 -5.700 0.188 17.752 1.00 0.00 C ATOM 321 CG1 ILE A 19 -6.625 -1.040 17.671 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.371 -0.224 18.400 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.556 -1.653 16.268 1.00 0.00 C ATOM 0 H ILE A 19 -7.065 -0.117 20.005 1.00 0.00 H new ATOM 0 HA ILE A 19 -5.734 2.210 18.583 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.523 0.562 16.744 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.329 -1.779 18.415 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.650 -0.750 17.901 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -3.911 -1.019 17.813 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -3.701 0.635 18.434 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -4.555 -0.581 19.413 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.213 -2.521 16.218 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.874 -0.914 15.532 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.532 -1.960 16.055 1.00 0.00 H new ATOM 335 N LYS A 20 -8.628 2.232 18.791 1.00 0.00 N ATOM 336 CA LYS A 20 -9.981 2.627 18.251 1.00 0.00 C ATOM 337 C LYS A 20 -9.999 4.044 17.626 1.00 0.00 C ATOM 338 O LYS A 20 -10.604 4.224 16.588 1.00 0.00 O ATOM 339 CB LYS A 20 -10.953 2.567 19.440 1.00 0.00 C ATOM 340 CG LYS A 20 -12.395 2.581 18.925 1.00 0.00 C ATOM 341 CD LYS A 20 -12.942 4.010 18.967 1.00 0.00 C ATOM 342 CE LYS A 20 -14.103 4.142 17.980 1.00 0.00 C ATOM 343 NZ LYS A 20 -15.097 5.011 18.670 1.00 0.00 N ATOM 0 H LYS A 20 -8.495 2.391 19.790 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.260 1.948 17.446 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -10.774 1.665 20.024 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -10.785 3.415 20.104 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.431 2.197 17.906 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.016 1.925 19.535 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -13.279 4.252 19.975 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -12.154 4.720 18.715 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -13.774 4.587 17.041 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.529 3.168 17.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -15.924 5.148 18.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.397 4.559 19.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -14.665 5.933 18.880 1.00 0.00 H new ATOM 357 N PRO A 21 -9.378 5.020 18.268 1.00 0.00 N ATOM 358 CA PRO A 21 -9.407 6.401 17.719 1.00 0.00 C ATOM 359 C PRO A 21 -8.461 6.553 16.517 1.00 0.00 C ATOM 360 O PRO A 21 -8.772 7.265 15.579 1.00 0.00 O ATOM 361 CB PRO A 21 -8.952 7.268 18.887 1.00 0.00 C ATOM 362 CG PRO A 21 -8.141 6.366 19.761 1.00 0.00 C ATOM 363 CD PRO A 21 -8.607 4.951 19.520 1.00 0.00 C ATOM 0 HA PRO A 21 -10.393 6.677 17.345 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.360 8.115 18.540 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -9.805 7.676 19.429 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.080 6.463 19.531 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.266 6.636 20.810 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -7.764 4.266 19.429 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.222 4.591 20.345 1.00 0.00 H new ATOM 371 N THR A 22 -7.314 5.902 16.523 1.00 0.00 N ATOM 372 CA THR A 22 -6.379 6.047 15.347 1.00 0.00 C ATOM 373 C THR A 22 -7.063 5.534 14.075 1.00 0.00 C ATOM 374 O THR A 22 -7.033 6.186 13.048 1.00 0.00 O ATOM 375 CB THR A 22 -5.125 5.209 15.659 1.00 0.00 C ATOM 376 OG1 THR A 22 -4.536 5.673 16.870 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.114 5.351 14.516 1.00 0.00 C ATOM 0 H THR A 22 -6.989 5.290 17.271 1.00 0.00 H new ATOM 0 HA THR A 22 -6.110 7.091 15.185 1.00 0.00 H new ATOM 0 HB THR A 22 -5.407 4.162 15.766 1.00 0.00 H new ATOM 0 HG1 THR A 22 -3.839 5.046 17.156 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.227 4.757 14.739 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.563 4.999 13.587 1.00 0.00 H new ATOM 0 HG23 THR A 22 -3.832 6.398 14.408 1.00 0.00 H new ATOM 385 N LEU A 23 -7.685 4.378 14.132 1.00 0.00 N ATOM 386 CA LEU A 23 -8.379 3.848 12.904 1.00 0.00 C ATOM 387 C LEU A 23 -9.496 4.816 12.484 1.00 0.00 C ATOM 388 O LEU A 23 -9.700 5.054 11.308 1.00 0.00 O ATOM 389 CB LEU A 23 -8.969 2.481 13.280 1.00 0.00 C ATOM 390 CG LEU A 23 -7.902 1.402 13.092 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.142 0.263 14.087 1.00 0.00 C ATOM 392 CD2 LEU A 23 -7.979 0.859 11.663 1.00 0.00 C ATOM 0 H LEU A 23 -7.744 3.784 14.959 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.687 3.751 12.067 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.313 2.492 14.314 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.837 2.263 12.658 1.00 0.00 H new ATOM 0 HG LEU A 23 -6.915 1.830 13.267 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.381 -0.505 13.951 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.089 0.651 15.104 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.128 -0.169 13.915 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.220 0.089 11.525 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.966 0.430 11.489 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.806 1.670 10.956 1.00 0.00 H new ATOM 404 N THR A 24 -10.220 5.385 13.432 1.00 0.00 N ATOM 405 CA THR A 24 -11.319 6.349 13.056 1.00 0.00 C ATOM 406 C THR A 24 -10.750 7.506 12.218 1.00 0.00 C ATOM 407 O THR A 24 -11.403 7.992 11.312 1.00 0.00 O ATOM 408 CB THR A 24 -11.906 6.889 14.371 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.090 5.815 15.282 1.00 0.00 O ATOM 410 CG2 THR A 24 -13.250 7.562 14.091 1.00 0.00 C ATOM 0 H THR A 24 -10.101 5.227 14.433 1.00 0.00 H new ATOM 0 HA THR A 24 -12.084 5.853 12.459 1.00 0.00 H new ATOM 0 HB THR A 24 -11.221 7.618 14.804 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.255 5.653 15.770 1.00 0.00 H new ATOM 0 HG21 THR A 24 -13.666 7.945 15.023 1.00 0.00 H new ATOM 0 HG22 THR A 24 -13.106 8.386 13.392 1.00 0.00 H new ATOM 0 HG23 THR A 24 -13.938 6.835 13.658 1.00 0.00 H new ATOM 418 N ASP A 25 -9.540 7.953 12.502 1.00 0.00 N ATOM 419 CA ASP A 25 -8.954 9.086 11.693 1.00 0.00 C ATOM 420 C ASP A 25 -8.911 8.709 10.202 1.00 0.00 C ATOM 421 O ASP A 25 -9.148 9.540 9.346 1.00 0.00 O ATOM 422 CB ASP A 25 -7.527 9.316 12.220 1.00 0.00 C ATOM 423 CG ASP A 25 -7.566 10.299 13.390 1.00 0.00 C ATOM 424 OD1 ASP A 25 -8.469 10.188 14.202 1.00 0.00 O ATOM 425 OD2 ASP A 25 -6.691 11.148 13.456 1.00 0.00 O ATOM 0 H ASP A 25 -8.942 7.591 13.245 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.559 9.987 11.790 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.090 8.370 12.541 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -6.893 9.707 11.424 1.00 0.00 H new ATOM 430 N PHE A 26 -8.609 7.464 9.880 1.00 0.00 N ATOM 431 CA PHE A 26 -8.558 7.062 8.427 1.00 0.00 C ATOM 432 C PHE A 26 -9.917 7.310 7.755 1.00 0.00 C ATOM 433 O PHE A 26 -9.974 7.726 6.612 1.00 0.00 O ATOM 434 CB PHE A 26 -8.226 5.564 8.391 1.00 0.00 C ATOM 435 CG PHE A 26 -6.730 5.388 8.367 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.021 5.285 9.569 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.052 5.330 7.145 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.632 5.124 9.550 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.661 5.169 7.125 1.00 0.00 C ATOM 440 CZ PHE A 26 -3.953 5.066 8.329 1.00 0.00 C ATOM 0 H PHE A 26 -8.399 6.721 10.547 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.810 7.646 7.892 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.649 5.065 9.263 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.673 5.101 7.511 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.547 5.330 10.511 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.601 5.409 6.218 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.084 5.045 10.477 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.135 5.124 6.183 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.880 4.942 8.314 1.00 0.00 H new ATOM 450 N GLU A 27 -11.012 7.055 8.444 1.00 0.00 N ATOM 451 CA GLU A 27 -12.359 7.284 7.808 1.00 0.00 C ATOM 452 C GLU A 27 -12.499 8.747 7.370 1.00 0.00 C ATOM 453 O GLU A 27 -13.034 9.026 6.313 1.00 0.00 O ATOM 454 CB GLU A 27 -13.420 6.944 8.866 1.00 0.00 C ATOM 455 CG GLU A 27 -13.312 5.464 9.243 1.00 0.00 C ATOM 456 CD GLU A 27 -14.700 4.921 9.583 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.462 4.679 8.661 1.00 0.00 O ATOM 458 OE2 GLU A 27 -14.979 4.757 10.760 1.00 0.00 O ATOM 0 H GLU A 27 -11.033 6.705 9.402 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.479 6.660 6.922 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.279 7.566 9.750 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.416 7.160 8.479 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.881 4.898 8.417 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.644 5.343 10.096 1.00 0.00 H new ATOM 465 N ILE A 28 -12.014 9.684 8.157 1.00 0.00 N ATOM 466 CA ILE A 28 -12.126 11.125 7.739 1.00 0.00 C ATOM 467 C ILE A 28 -11.223 11.356 6.513 1.00 0.00 C ATOM 468 O ILE A 28 -11.615 12.024 5.574 1.00 0.00 O ATOM 469 CB ILE A 28 -11.686 11.987 8.946 1.00 0.00 C ATOM 470 CG1 ILE A 28 -12.738 11.870 10.061 1.00 0.00 C ATOM 471 CG2 ILE A 28 -11.570 13.458 8.526 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.276 10.856 11.108 1.00 0.00 C ATOM 0 H ILE A 28 -11.554 9.520 9.053 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.144 11.395 7.457 1.00 0.00 H new ATOM 0 HB ILE A 28 -10.718 11.634 9.302 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -12.895 12.842 10.528 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -13.694 11.561 9.640 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -11.260 14.057 9.382 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -10.831 13.552 7.730 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.537 13.811 8.167 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.026 10.778 11.895 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.142 9.882 10.637 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.330 11.184 11.539 1.00 0.00 H new ATOM 484 N GLN A 29 -10.030 10.789 6.498 1.00 0.00 N ATOM 485 CA GLN A 29 -9.144 10.975 5.295 1.00 0.00 C ATOM 486 C GLN A 29 -9.793 10.262 4.103 1.00 0.00 C ATOM 487 O GLN A 29 -9.953 10.841 3.044 1.00 0.00 O ATOM 488 CB GLN A 29 -7.778 10.340 5.624 1.00 0.00 C ATOM 489 CG GLN A 29 -6.651 11.256 5.141 1.00 0.00 C ATOM 490 CD GLN A 29 -6.702 11.379 3.613 1.00 0.00 C ATOM 491 OE1 GLN A 29 -7.679 11.852 3.066 1.00 0.00 O ATOM 492 NE2 GLN A 29 -5.685 10.974 2.890 1.00 0.00 N ATOM 0 H GLN A 29 -9.640 10.219 7.249 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.011 12.028 5.048 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.692 10.177 6.698 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.696 9.364 5.146 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.749 12.241 5.598 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.686 10.855 5.451 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.863 10.576 3.344 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.717 11.057 1.874 1.00 0.00 H new ATOM 501 N LEU A 30 -10.202 9.019 4.275 1.00 0.00 N ATOM 502 CA LEU A 30 -10.880 8.299 3.137 1.00 0.00 C ATOM 503 C LEU A 30 -12.190 9.032 2.792 1.00 0.00 C ATOM 504 O LEU A 30 -12.565 9.120 1.639 1.00 0.00 O ATOM 505 CB LEU A 30 -11.182 6.867 3.621 1.00 0.00 C ATOM 506 CG LEU A 30 -10.883 5.875 2.498 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.383 5.881 2.202 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.310 4.471 2.930 1.00 0.00 C ATOM 0 H LEU A 30 -10.099 8.481 5.135 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.251 8.273 2.247 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.578 6.633 4.497 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.226 6.787 3.923 1.00 0.00 H new ATOM 0 HG LEU A 30 -11.433 6.163 1.602 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.167 5.174 1.401 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -9.077 6.881 1.895 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -8.834 5.592 3.098 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.097 3.763 2.129 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -10.759 4.183 3.825 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.379 4.465 3.144 1.00 0.00 H new ATOM 520 N ARG A 31 -12.890 9.565 3.782 1.00 0.00 N ATOM 521 CA ARG A 31 -14.173 10.298 3.485 1.00 0.00 C ATOM 522 C ARG A 31 -13.912 11.455 2.509 1.00 0.00 C ATOM 523 O ARG A 31 -14.723 11.726 1.644 1.00 0.00 O ATOM 524 CB ARG A 31 -14.686 10.861 4.823 1.00 0.00 C ATOM 525 CG ARG A 31 -15.535 9.810 5.542 1.00 0.00 C ATOM 526 CD ARG A 31 -15.508 10.076 7.053 1.00 0.00 C ATOM 527 NE ARG A 31 -16.937 9.992 7.487 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.795 10.964 7.219 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.428 12.040 6.561 1.00 0.00 N ATOM 530 NH2 ARG A 31 -19.037 10.857 7.616 1.00 0.00 N ATOM 0 H ARG A 31 -12.631 9.524 4.768 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.902 9.628 3.029 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -13.844 11.152 5.451 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.277 11.759 4.646 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.561 9.842 5.175 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.152 8.811 5.331 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -14.894 9.340 7.572 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.086 11.056 7.274 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.257 9.170 7.999 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.464 12.140 6.244 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -18.108 12.775 6.367 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.339 10.028 8.129 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.703 11.602 7.413 1.00 0.00 H new ATOM 544 N ASP A 32 -12.795 12.148 2.638 1.00 0.00 N ATOM 545 CA ASP A 32 -12.526 13.291 1.694 1.00 0.00 C ATOM 546 C ASP A 32 -12.371 12.757 0.266 1.00 0.00 C ATOM 547 O ASP A 32 -13.015 13.238 -0.647 1.00 0.00 O ATOM 548 CB ASP A 32 -11.224 13.964 2.157 1.00 0.00 C ATOM 549 CG ASP A 32 -11.519 14.879 3.348 1.00 0.00 C ATOM 550 OD1 ASP A 32 -11.979 15.986 3.119 1.00 0.00 O ATOM 551 OD2 ASP A 32 -11.279 14.458 4.467 1.00 0.00 O ATOM 0 H ASP A 32 -12.074 11.977 3.339 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.349 14.006 1.698 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.491 13.208 2.438 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.790 14.541 1.340 1.00 0.00 H new ATOM 556 N ALA A 33 -11.540 11.755 0.062 1.00 0.00 N ATOM 557 CA ALA A 33 -11.387 11.199 -1.329 1.00 0.00 C ATOM 558 C ALA A 33 -12.663 10.439 -1.720 1.00 0.00 C ATOM 559 O ALA A 33 -13.088 10.488 -2.861 1.00 0.00 O ATOM 560 CB ALA A 33 -10.182 10.246 -1.301 1.00 0.00 C ATOM 0 H ALA A 33 -10.972 11.306 0.781 1.00 0.00 H new ATOM 0 HA ALA A 33 -11.229 11.992 -2.060 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -10.033 9.818 -2.292 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.289 10.797 -1.006 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.368 9.446 -0.585 1.00 0.00 H new ATOM 566 N GLN A 34 -13.292 9.748 -0.786 1.00 0.00 N ATOM 567 CA GLN A 34 -14.554 9.007 -1.135 1.00 0.00 C ATOM 568 C GLN A 34 -15.713 9.999 -1.353 1.00 0.00 C ATOM 569 O GLN A 34 -16.604 9.738 -2.139 1.00 0.00 O ATOM 570 CB GLN A 34 -14.868 8.082 0.053 1.00 0.00 C ATOM 571 CG GLN A 34 -13.844 6.946 0.101 1.00 0.00 C ATOM 572 CD GLN A 34 -14.340 5.775 -0.756 1.00 0.00 C ATOM 573 OE1 GLN A 34 -14.883 5.980 -1.823 1.00 0.00 O ATOM 574 NE2 GLN A 34 -14.179 4.543 -0.335 1.00 0.00 N ATOM 0 H GLN A 34 -12.991 9.667 0.185 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.429 8.437 -2.055 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.843 8.648 0.984 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.874 7.675 -0.046 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.879 7.296 -0.266 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -13.695 6.620 1.130 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -13.724 4.365 0.560 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -14.509 3.763 -0.903 1.00 0.00 H new ATOM 583 N LYS A 35 -15.717 11.135 -0.671 1.00 0.00 N ATOM 584 CA LYS A 35 -16.838 12.115 -0.869 1.00 0.00 C ATOM 585 C LYS A 35 -16.460 13.188 -1.906 1.00 0.00 C ATOM 586 O LYS A 35 -17.314 13.669 -2.628 1.00 0.00 O ATOM 587 CB LYS A 35 -17.088 12.760 0.500 1.00 0.00 C ATOM 588 CG LYS A 35 -17.517 11.684 1.501 1.00 0.00 C ATOM 589 CD LYS A 35 -19.014 11.411 1.346 1.00 0.00 C ATOM 590 CE LYS A 35 -19.515 10.604 2.546 1.00 0.00 C ATOM 591 NZ LYS A 35 -20.988 10.503 2.353 1.00 0.00 N ATOM 0 H LYS A 35 -15.003 11.417 0.001 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.730 11.615 -1.246 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.184 13.257 0.850 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.861 13.524 0.418 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -16.950 10.768 1.332 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.299 12.011 2.518 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.560 12.352 1.274 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -19.200 10.863 0.423 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -19.053 9.618 2.579 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -19.273 11.101 3.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -21.405 9.962 3.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -21.402 11.457 2.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -21.188 10.019 1.454 1.00 0.00 H new ATOM 605 N ASP A 36 -15.201 13.571 -1.994 1.00 0.00 N ATOM 606 CA ASP A 36 -14.818 14.622 -3.005 1.00 0.00 C ATOM 607 C ASP A 36 -15.132 14.124 -4.426 1.00 0.00 C ATOM 608 O ASP A 36 -15.592 14.881 -5.260 1.00 0.00 O ATOM 609 CB ASP A 36 -13.308 14.865 -2.850 1.00 0.00 C ATOM 610 CG ASP A 36 -12.875 15.996 -3.785 1.00 0.00 C ATOM 611 OD1 ASP A 36 -13.071 15.856 -4.981 1.00 0.00 O ATOM 612 OD2 ASP A 36 -12.354 16.982 -3.290 1.00 0.00 O ATOM 0 H ASP A 36 -14.436 13.211 -1.423 1.00 0.00 H new ATOM 0 HA ASP A 36 -15.378 15.543 -2.842 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -13.074 15.123 -1.817 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.756 13.954 -3.084 1.00 0.00 H new ATOM 617 N LYS A 37 -14.894 12.856 -4.712 1.00 0.00 N ATOM 618 CA LYS A 37 -15.195 12.333 -6.097 1.00 0.00 C ATOM 619 C LYS A 37 -16.674 12.574 -6.448 1.00 0.00 C ATOM 620 O LYS A 37 -16.994 12.917 -7.571 1.00 0.00 O ATOM 621 CB LYS A 37 -14.899 10.825 -6.077 1.00 0.00 C ATOM 622 CG LYS A 37 -15.007 10.264 -7.496 1.00 0.00 C ATOM 623 CD LYS A 37 -14.538 8.808 -7.507 1.00 0.00 C ATOM 624 CE LYS A 37 -14.418 8.321 -8.953 1.00 0.00 C ATOM 625 NZ LYS A 37 -14.481 6.836 -8.864 1.00 0.00 N ATOM 0 H LYS A 37 -14.511 12.171 -4.060 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.588 12.843 -6.845 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -13.900 10.645 -5.679 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -15.602 10.315 -5.418 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -16.037 10.328 -7.846 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -14.401 10.858 -8.180 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -13.576 8.721 -7.002 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -15.244 8.183 -6.959 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -15.225 8.714 -9.571 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -13.482 8.650 -9.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.405 6.428 -9.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -13.696 6.490 -8.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -15.386 6.552 -8.437 1.00 0.00 H new ATOM 639 N SER A 38 -17.577 12.405 -5.501 1.00 0.00 N ATOM 640 CA SER A 38 -19.032 12.640 -5.813 1.00 0.00 C ATOM 641 C SER A 38 -19.272 14.136 -6.065 1.00 0.00 C ATOM 642 O SER A 38 -18.362 14.933 -5.963 1.00 0.00 O ATOM 643 CB SER A 38 -19.831 12.174 -4.586 1.00 0.00 C ATOM 644 OG SER A 38 -19.826 13.203 -3.605 1.00 0.00 O ATOM 0 H SER A 38 -17.375 12.120 -4.543 1.00 0.00 H new ATOM 0 HA SER A 38 -19.339 12.094 -6.705 1.00 0.00 H new ATOM 0 HB2 SER A 38 -20.855 11.935 -4.874 1.00 0.00 H new ATOM 0 HB3 SER A 38 -19.394 11.263 -4.177 1.00 0.00 H new ATOM 0 HG SER A 38 -18.901 13.439 -3.384 1.00 0.00 H new ATOM 650 N SER A 39 -20.492 14.528 -6.393 1.00 0.00 N ATOM 651 CA SER A 39 -20.799 15.979 -6.658 1.00 0.00 C ATOM 652 C SER A 39 -20.039 16.474 -7.904 1.00 0.00 C ATOM 653 O SER A 39 -20.638 16.715 -8.935 1.00 0.00 O ATOM 654 CB SER A 39 -20.369 16.755 -5.402 1.00 0.00 C ATOM 655 OG SER A 39 -21.499 17.419 -4.853 1.00 0.00 O ATOM 0 H SER A 39 -21.290 13.900 -6.488 1.00 0.00 H new ATOM 0 HA SER A 39 -21.860 16.128 -6.858 1.00 0.00 H new ATOM 0 HB2 SER A 39 -19.941 16.073 -4.667 1.00 0.00 H new ATOM 0 HB3 SER A 39 -19.594 17.479 -5.655 1.00 0.00 H new ATOM 0 HG SER A 39 -21.230 17.914 -4.051 1.00 0.00 H new ATOM 661 N LYS A 40 -18.732 16.629 -7.827 1.00 0.00 N ATOM 662 CA LYS A 40 -17.962 17.105 -9.015 1.00 0.00 C ATOM 663 C LYS A 40 -16.968 16.022 -9.468 1.00 0.00 C ATOM 664 O LYS A 40 -16.150 15.567 -8.690 1.00 0.00 O ATOM 665 CB LYS A 40 -17.216 18.351 -8.531 1.00 0.00 C ATOM 666 CG LYS A 40 -17.242 19.421 -9.624 1.00 0.00 C ATOM 667 CD LYS A 40 -17.151 20.807 -8.984 1.00 0.00 C ATOM 668 CE LYS A 40 -17.895 21.822 -9.854 1.00 0.00 C ATOM 669 NZ LYS A 40 -19.260 21.907 -9.264 1.00 0.00 N ATOM 0 H LYS A 40 -18.173 16.446 -6.994 1.00 0.00 H new ATOM 0 HA LYS A 40 -18.606 17.323 -9.867 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -17.679 18.734 -7.622 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -16.186 18.097 -8.281 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -16.411 19.272 -10.313 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -18.159 19.338 -10.207 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -17.582 20.786 -7.983 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -16.107 21.101 -8.876 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -17.398 22.792 -9.841 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -17.934 21.497 -10.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -19.831 22.585 -9.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -19.711 20.970 -9.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -19.192 22.225 -8.276 1.00 0.00 H new ATOM 683 N LEU A 41 -17.029 15.604 -10.716 1.00 0.00 N ATOM 684 CA LEU A 41 -16.084 14.551 -11.200 1.00 0.00 C ATOM 685 C LEU A 41 -15.527 14.927 -12.585 1.00 0.00 C ATOM 686 O LEU A 41 -15.774 14.244 -13.563 1.00 0.00 O ATOM 687 CB LEU A 41 -16.916 13.264 -11.277 1.00 0.00 C ATOM 688 CG LEU A 41 -18.117 13.465 -12.210 1.00 0.00 C ATOM 689 CD1 LEU A 41 -18.380 12.178 -12.993 1.00 0.00 C ATOM 690 CD2 LEU A 41 -19.356 13.815 -11.381 1.00 0.00 C ATOM 0 H LEU A 41 -17.690 15.947 -11.413 1.00 0.00 H new ATOM 0 HA LEU A 41 -15.226 14.435 -10.538 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -16.297 12.443 -11.640 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -17.262 12.986 -10.282 1.00 0.00 H new ATOM 0 HG LEU A 41 -17.901 14.276 -12.905 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -19.234 12.323 -13.655 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -17.500 11.926 -13.585 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -18.594 11.366 -12.298 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -20.209 13.958 -12.044 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -19.569 13.004 -10.685 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -19.173 14.733 -10.823 1.00 0.00 H new ATOM 702 N ALA A 42 -14.774 16.005 -12.679 1.00 0.00 N ATOM 703 CA ALA A 42 -14.209 16.409 -14.003 1.00 0.00 C ATOM 704 C ALA A 42 -12.675 16.315 -13.978 1.00 0.00 C ATOM 705 O ALA A 42 -12.083 15.635 -14.794 1.00 0.00 O ATOM 706 CB ALA A 42 -14.655 17.859 -14.200 1.00 0.00 C ATOM 0 H ALA A 42 -14.531 16.615 -11.899 1.00 0.00 H new ATOM 0 HA ALA A 42 -14.553 15.764 -14.812 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -14.278 18.229 -15.153 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -15.744 17.908 -14.196 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -14.261 18.474 -13.391 1.00 0.00 H new ATOM 712 N ALA A 43 -12.025 16.992 -13.052 1.00 0.00 N ATOM 713 CA ALA A 43 -10.534 16.933 -12.990 1.00 0.00 C ATOM 714 C ALA A 43 -10.078 16.427 -11.612 1.00 0.00 C ATOM 715 O ALA A 43 -10.883 16.252 -10.718 1.00 0.00 O ATOM 716 CB ALA A 43 -10.071 18.373 -13.212 1.00 0.00 C ATOM 0 H ALA A 43 -12.466 17.578 -12.343 1.00 0.00 H new ATOM 0 HA ALA A 43 -10.117 16.251 -13.732 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.982 18.414 -13.181 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -10.419 18.721 -14.184 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -10.481 19.012 -12.430 1.00 0.00 H new ATOM 722 N LYS A 44 -8.791 16.192 -11.428 1.00 0.00 N ATOM 723 CA LYS A 44 -8.286 15.697 -10.103 1.00 0.00 C ATOM 724 C LYS A 44 -9.062 14.444 -9.656 1.00 0.00 C ATOM 725 O LYS A 44 -9.731 14.456 -8.638 1.00 0.00 O ATOM 726 CB LYS A 44 -8.515 16.855 -9.125 1.00 0.00 C ATOM 727 CG LYS A 44 -7.953 16.482 -7.752 1.00 0.00 C ATOM 728 CD LYS A 44 -6.514 16.990 -7.634 1.00 0.00 C ATOM 729 CE LYS A 44 -6.008 16.765 -6.208 1.00 0.00 C ATOM 730 NZ LYS A 44 -4.592 17.227 -6.227 1.00 0.00 N ATOM 0 H LYS A 44 -8.072 16.323 -12.140 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.236 15.409 -10.152 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -8.030 17.759 -9.495 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -9.580 17.074 -9.047 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -8.569 16.917 -6.965 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -7.980 15.401 -7.618 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -5.874 16.468 -8.345 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.470 18.050 -7.884 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -6.598 17.329 -5.486 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -6.077 15.715 -5.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -4.174 17.105 -5.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -4.054 16.668 -6.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.558 18.232 -6.493 1.00 0.00 H new ATOM 744 N SER A 45 -8.977 13.362 -10.404 1.00 0.00 N ATOM 745 CA SER A 45 -9.709 12.119 -10.009 1.00 0.00 C ATOM 746 C SER A 45 -8.711 11.009 -9.661 1.00 0.00 C ATOM 747 O SER A 45 -8.734 10.473 -8.568 1.00 0.00 O ATOM 748 CB SER A 45 -10.541 11.736 -11.232 1.00 0.00 C ATOM 749 OG SER A 45 -11.779 11.184 -10.805 1.00 0.00 O ATOM 0 H SER A 45 -8.434 13.291 -11.265 1.00 0.00 H new ATOM 0 HA SER A 45 -10.335 12.270 -9.130 1.00 0.00 H new ATOM 0 HB2 SER A 45 -10.717 12.613 -11.855 1.00 0.00 H new ATOM 0 HB3 SER A 45 -9.999 11.014 -11.843 1.00 0.00 H new ATOM 0 HG SER A 45 -12.315 10.939 -11.588 1.00 0.00 H new ATOM 755 N ASN A 46 -7.831 10.659 -10.574 1.00 0.00 N ATOM 756 CA ASN A 46 -6.827 9.575 -10.268 1.00 0.00 C ATOM 757 C ASN A 46 -5.995 9.974 -9.038 1.00 0.00 C ATOM 758 O ASN A 46 -5.732 9.159 -8.175 1.00 0.00 O ATOM 759 CB ASN A 46 -5.920 9.446 -11.501 1.00 0.00 C ATOM 760 CG ASN A 46 -6.646 8.648 -12.591 1.00 0.00 C ATOM 761 OD1 ASN A 46 -6.943 9.176 -13.644 1.00 0.00 O ATOM 762 ND2 ASN A 46 -6.950 7.389 -12.387 1.00 0.00 N ATOM 0 H ASN A 46 -7.761 11.068 -11.506 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.321 8.628 -10.050 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.655 10.435 -11.875 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.989 8.948 -11.230 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.434 6.857 -13.111 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.703 6.941 -11.505 1.00 0.00 H new ATOM 769 N GLU A 47 -5.589 11.226 -8.945 1.00 0.00 N ATOM 770 CA GLU A 47 -4.784 11.659 -7.748 1.00 0.00 C ATOM 771 C GLU A 47 -5.616 11.490 -6.466 1.00 0.00 C ATOM 772 O GLU A 47 -5.089 11.114 -5.434 1.00 0.00 O ATOM 773 CB GLU A 47 -4.435 13.141 -7.959 1.00 0.00 C ATOM 774 CG GLU A 47 -3.595 13.292 -9.229 1.00 0.00 C ATOM 775 CD GLU A 47 -2.580 14.420 -9.040 1.00 0.00 C ATOM 776 OE1 GLU A 47 -3.004 15.553 -8.883 1.00 0.00 O ATOM 777 OE2 GLU A 47 -1.394 14.133 -9.057 1.00 0.00 O ATOM 0 H GLU A 47 -5.776 11.955 -9.633 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.882 11.056 -7.643 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.347 13.732 -8.041 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.885 13.522 -7.099 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.079 12.358 -9.449 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.240 13.508 -10.081 1.00 0.00 H new ATOM 784 N GLN A 48 -6.909 11.759 -6.514 1.00 0.00 N ATOM 785 CA GLN A 48 -7.745 11.595 -5.268 1.00 0.00 C ATOM 786 C GLN A 48 -7.802 10.111 -4.879 1.00 0.00 C ATOM 787 O GLN A 48 -7.673 9.769 -3.718 1.00 0.00 O ATOM 788 CB GLN A 48 -9.160 12.111 -5.595 1.00 0.00 C ATOM 789 CG GLN A 48 -9.677 12.965 -4.437 1.00 0.00 C ATOM 790 CD GLN A 48 -10.820 13.853 -4.936 1.00 0.00 C ATOM 791 OE1 GLN A 48 -10.652 15.047 -5.079 1.00 0.00 O ATOM 792 NE2 GLN A 48 -11.986 13.322 -5.214 1.00 0.00 N ATOM 0 H GLN A 48 -7.412 12.078 -7.342 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.318 12.152 -4.434 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -9.140 12.699 -6.513 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.833 11.271 -5.769 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -10.025 12.326 -3.625 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -8.872 13.580 -4.035 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -12.131 12.319 -5.095 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -12.748 13.911 -5.549 1.00 0.00 H new ATOM 801 N LEU A 49 -7.989 9.224 -5.837 1.00 0.00 N ATOM 802 CA LEU A 49 -8.046 7.759 -5.491 1.00 0.00 C ATOM 803 C LEU A 49 -6.691 7.288 -4.937 1.00 0.00 C ATOM 804 O LEU A 49 -6.645 6.436 -4.068 1.00 0.00 O ATOM 805 CB LEU A 49 -8.380 7.004 -6.788 1.00 0.00 C ATOM 806 CG LEU A 49 -9.869 7.171 -7.111 1.00 0.00 C ATOM 807 CD1 LEU A 49 -10.182 6.483 -8.440 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.713 6.538 -6.001 1.00 0.00 C ATOM 0 H LEU A 49 -8.103 9.445 -6.826 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.799 7.571 -4.726 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.774 7.386 -7.610 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -8.138 5.947 -6.678 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.104 8.233 -7.183 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.241 6.601 -8.670 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.585 6.934 -9.233 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.943 5.422 -8.366 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.771 6.659 -6.234 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.477 5.477 -5.925 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.493 7.027 -5.052 1.00 0.00 H new ATOM 820 N TRP A 50 -5.583 7.832 -5.416 1.00 0.00 N ATOM 821 CA TRP A 50 -4.245 7.387 -4.876 1.00 0.00 C ATOM 822 C TRP A 50 -4.198 7.612 -3.361 1.00 0.00 C ATOM 823 O TRP A 50 -3.708 6.776 -2.626 1.00 0.00 O ATOM 824 CB TRP A 50 -3.160 8.232 -5.577 1.00 0.00 C ATOM 825 CG TRP A 50 -3.216 8.063 -7.076 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.939 7.130 -7.756 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.519 8.844 -8.090 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.733 7.304 -9.113 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.868 8.346 -9.367 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.629 9.931 -8.026 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -2.355 8.903 -10.534 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -1.107 10.492 -9.203 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.472 9.978 -10.455 1.00 0.00 C ATOM 0 H TRP A 50 -5.547 8.549 -6.141 1.00 0.00 H new ATOM 0 HA TRP A 50 -4.081 6.326 -5.066 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -3.294 9.283 -5.322 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -2.176 7.939 -5.212 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.570 6.377 -7.308 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.168 6.731 -9.836 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.345 10.337 -7.066 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.640 8.504 -11.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.421 11.324 -9.143 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -1.069 10.415 -11.357 1.00 0.00 H new ATOM 844 N GLU A 51 -4.721 8.722 -2.881 1.00 0.00 N ATOM 845 CA GLU A 51 -4.709 8.961 -1.395 1.00 0.00 C ATOM 846 C GLU A 51 -5.478 7.840 -0.677 1.00 0.00 C ATOM 847 O GLU A 51 -5.104 7.435 0.408 1.00 0.00 O ATOM 848 CB GLU A 51 -5.394 10.316 -1.153 1.00 0.00 C ATOM 849 CG GLU A 51 -4.387 11.445 -1.383 1.00 0.00 C ATOM 850 CD GLU A 51 -5.066 12.793 -1.132 1.00 0.00 C ATOM 851 OE1 GLU A 51 -5.184 13.169 0.022 1.00 0.00 O ATOM 852 OE2 GLU A 51 -5.456 13.427 -2.100 1.00 0.00 O ATOM 0 H GLU A 51 -5.148 9.460 -3.441 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.690 8.968 -1.007 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.245 10.431 -1.825 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.783 10.363 -0.136 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.533 11.326 -0.716 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.004 11.403 -2.403 1.00 0.00 H new ATOM 859 N ILE A 52 -6.539 7.319 -1.271 1.00 0.00 N ATOM 860 CA ILE A 52 -7.289 6.211 -0.588 1.00 0.00 C ATOM 861 C ILE A 52 -6.448 4.928 -0.640 1.00 0.00 C ATOM 862 O ILE A 52 -6.129 4.365 0.392 1.00 0.00 O ATOM 863 CB ILE A 52 -8.628 6.036 -1.328 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.413 7.361 -1.246 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.431 4.902 -0.667 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.853 7.180 -1.752 1.00 0.00 C ATOM 0 H ILE A 52 -6.907 7.608 -2.177 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.481 6.440 0.460 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.453 5.780 -2.373 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.428 7.716 -0.216 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.909 8.124 -1.839 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.380 4.776 -1.189 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.861 3.974 -0.720 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.622 5.152 0.377 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.385 8.129 -1.683 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.835 6.848 -2.790 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.362 6.434 -1.142 1.00 0.00 H new ATOM 878 N MET A 53 -6.065 4.462 -1.817 1.00 0.00 N ATOM 879 CA MET A 53 -5.219 3.215 -1.857 1.00 0.00 C ATOM 880 C MET A 53 -3.885 3.457 -1.122 1.00 0.00 C ATOM 881 O MET A 53 -3.311 2.529 -0.582 1.00 0.00 O ATOM 882 CB MET A 53 -4.993 2.820 -3.332 1.00 0.00 C ATOM 883 CG MET A 53 -4.329 3.952 -4.128 1.00 0.00 C ATOM 884 SD MET A 53 -5.077 4.038 -5.781 1.00 0.00 S ATOM 885 CE MET A 53 -4.479 2.443 -6.389 1.00 0.00 C ATOM 0 H MET A 53 -6.293 4.875 -2.721 1.00 0.00 H new ATOM 0 HA MET A 53 -5.726 2.395 -1.348 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.368 1.928 -3.378 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.948 2.564 -3.791 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.456 4.902 -3.608 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.257 3.775 -4.210 1.00 0.00 H new ATOM 0 HE1 MET A 53 -3.996 2.580 -7.356 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.761 2.029 -5.680 1.00 0.00 H new ATOM 0 HE3 MET A 53 -5.319 1.757 -6.497 1.00 0.00 H new ATOM 895 N GLN A 54 -3.397 4.689 -1.052 1.00 0.00 N ATOM 896 CA GLN A 54 -2.118 4.929 -0.293 1.00 0.00 C ATOM 897 C GLN A 54 -2.412 4.829 1.213 1.00 0.00 C ATOM 898 O GLN A 54 -1.636 4.268 1.961 1.00 0.00 O ATOM 899 CB GLN A 54 -1.635 6.345 -0.652 1.00 0.00 C ATOM 900 CG GLN A 54 -0.839 6.297 -1.959 1.00 0.00 C ATOM 901 CD GLN A 54 0.312 7.311 -1.898 1.00 0.00 C ATOM 902 OE1 GLN A 54 1.460 6.948 -2.057 1.00 0.00 O ATOM 903 NE2 GLN A 54 0.057 8.577 -1.671 1.00 0.00 N ATOM 0 H GLN A 54 -3.819 5.515 -1.477 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.353 4.196 -0.548 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.488 7.016 -0.758 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.014 6.743 0.150 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -0.445 5.294 -2.120 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.491 6.522 -2.803 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -0.905 8.887 -1.537 1.00 0.00 H new ATOM 0 HE22 GLN A 54 0.821 9.252 -1.629 1.00 0.00 H new ATOM 912 N LEU A 55 -3.544 5.350 1.666 1.00 0.00 N ATOM 913 CA LEU A 55 -3.883 5.248 3.135 1.00 0.00 C ATOM 914 C LEU A 55 -3.807 3.780 3.601 1.00 0.00 C ATOM 915 O LEU A 55 -3.499 3.509 4.746 1.00 0.00 O ATOM 916 CB LEU A 55 -5.328 5.760 3.297 1.00 0.00 C ATOM 917 CG LEU A 55 -5.326 7.267 3.562 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.745 7.819 3.386 1.00 0.00 C ATOM 919 CD2 LEU A 55 -4.854 7.532 4.996 1.00 0.00 C ATOM 0 H LEU A 55 -4.235 5.833 1.092 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.182 5.831 3.732 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.902 5.542 2.396 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.816 5.239 4.120 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.653 7.758 2.859 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.744 8.893 3.575 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.085 7.630 2.368 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.416 7.328 4.090 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.852 8.605 5.186 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.528 7.040 5.698 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.846 7.139 5.126 1.00 0.00 H new ATOM 931 N HIS A 56 -4.088 2.825 2.727 1.00 0.00 N ATOM 932 CA HIS A 56 -4.027 1.381 3.151 1.00 0.00 C ATOM 933 C HIS A 56 -2.624 1.045 3.683 1.00 0.00 C ATOM 934 O HIS A 56 -2.490 0.340 4.666 1.00 0.00 O ATOM 935 CB HIS A 56 -4.339 0.544 1.903 1.00 0.00 C ATOM 936 CG HIS A 56 -4.946 -0.766 2.320 1.00 0.00 C ATOM 937 ND1 HIS A 56 -6.111 -0.830 3.069 1.00 0.00 N ATOM 938 CD2 HIS A 56 -4.568 -2.065 2.102 1.00 0.00 C ATOM 939 CE1 HIS A 56 -6.390 -2.130 3.273 1.00 0.00 C ATOM 940 NE2 HIS A 56 -5.480 -2.926 2.705 1.00 0.00 N ATOM 0 H HIS A 56 -4.352 2.983 1.755 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.740 1.173 3.949 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.025 1.085 1.251 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.428 0.370 1.331 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.657 -0.036 3.404 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -3.695 -2.374 1.546 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.245 -2.487 3.828 1.00 0.00 H new ATOM 948 N HIS A 57 -1.578 1.553 3.059 1.00 0.00 N ATOM 949 CA HIS A 57 -0.191 1.251 3.574 1.00 0.00 C ATOM 950 C HIS A 57 -0.055 1.772 5.010 1.00 0.00 C ATOM 951 O HIS A 57 0.413 1.068 5.885 1.00 0.00 O ATOM 952 CB HIS A 57 0.805 1.975 2.653 1.00 0.00 C ATOM 953 CG HIS A 57 1.202 1.069 1.520 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.311 1.325 0.730 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.661 -0.099 1.040 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.402 0.334 -0.175 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.420 -0.560 -0.031 1.00 0.00 N ATOM 0 H HIS A 57 -1.620 2.151 2.234 1.00 0.00 H new ATOM 0 HA HIS A 57 0.002 0.178 3.578 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.355 2.887 2.261 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.688 2.273 3.219 1.00 0.00 H new ATOM 0 HD1 HIS A 57 2.943 2.120 0.819 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.219 -0.585 1.434 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.175 0.269 -0.927 1.00 0.00 H new ATOM 965 N GLN A 58 -0.476 2.995 5.267 1.00 0.00 N ATOM 966 CA GLN A 58 -0.376 3.533 6.669 1.00 0.00 C ATOM 967 C GLN A 58 -1.218 2.661 7.617 1.00 0.00 C ATOM 968 O GLN A 58 -0.824 2.410 8.741 1.00 0.00 O ATOM 969 CB GLN A 58 -0.922 4.970 6.634 1.00 0.00 C ATOM 970 CG GLN A 58 -0.536 5.697 7.924 1.00 0.00 C ATOM 971 CD GLN A 58 -1.382 6.968 8.070 1.00 0.00 C ATOM 972 OE1 GLN A 58 -1.804 7.540 7.084 1.00 0.00 O ATOM 973 NE2 GLN A 58 -1.654 7.441 9.262 1.00 0.00 N ATOM 0 H GLN A 58 -0.877 3.633 4.580 1.00 0.00 H new ATOM 0 HA GLN A 58 0.653 3.522 7.028 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.521 5.501 5.771 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.006 4.955 6.523 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.692 5.044 8.782 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.523 5.953 7.906 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -1.302 6.964 10.092 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.218 8.286 9.359 1.00 0.00 H new ATOM 982 N ARG A 59 -2.368 2.181 7.173 1.00 0.00 N ATOM 983 CA ARG A 59 -3.204 1.309 8.073 1.00 0.00 C ATOM 984 C ARG A 59 -2.470 -0.017 8.320 1.00 0.00 C ATOM 985 O ARG A 59 -2.336 -0.451 9.450 1.00 0.00 O ATOM 986 CB ARG A 59 -4.536 1.054 7.346 1.00 0.00 C ATOM 987 CG ARG A 59 -5.673 1.000 8.368 1.00 0.00 C ATOM 988 CD ARG A 59 -6.342 2.373 8.462 1.00 0.00 C ATOM 989 NE ARG A 59 -7.342 2.393 7.349 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.431 1.639 7.390 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.675 0.841 8.403 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.286 1.687 6.400 1.00 0.00 N ATOM 0 H ARG A 59 -2.756 2.352 6.245 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.381 1.786 9.037 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.723 1.845 6.619 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.486 0.117 6.792 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.404 0.247 8.074 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.286 0.705 9.343 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -6.825 2.511 9.429 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.613 3.176 8.352 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.182 2.998 6.544 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -8.019 0.791 9.183 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.521 0.271 8.411 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -9.112 2.302 5.605 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.127 1.110 6.424 1.00 0.00 H new ATOM 1006 N SER A 60 -1.976 -0.662 7.275 1.00 0.00 N ATOM 1007 CA SER A 60 -1.236 -1.954 7.487 1.00 0.00 C ATOM 1008 C SER A 60 0.002 -1.695 8.353 1.00 0.00 C ATOM 1009 O SER A 60 0.331 -2.492 9.201 1.00 0.00 O ATOM 1010 CB SER A 60 -0.821 -2.470 6.101 1.00 0.00 C ATOM 1011 OG SER A 60 -0.357 -1.379 5.314 1.00 0.00 O ATOM 0 H SER A 60 -2.053 -0.354 6.306 1.00 0.00 H new ATOM 0 HA SER A 60 -1.859 -2.690 7.996 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.038 -3.222 6.199 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.667 -2.953 5.612 1.00 0.00 H new ATOM 0 HG SER A 60 -0.015 -0.674 5.902 1.00 0.00 H new ATOM 1017 N ARG A 61 0.685 -0.582 8.160 1.00 0.00 N ATOM 1018 CA ARG A 61 1.894 -0.302 9.015 1.00 0.00 C ATOM 1019 C ARG A 61 1.456 -0.125 10.481 1.00 0.00 C ATOM 1020 O ARG A 61 2.140 -0.561 11.388 1.00 0.00 O ATOM 1021 CB ARG A 61 2.526 0.997 8.480 1.00 0.00 C ATOM 1022 CG ARG A 61 3.769 1.352 9.306 1.00 0.00 C ATOM 1023 CD ARG A 61 3.431 2.476 10.292 1.00 0.00 C ATOM 1024 NE ARG A 61 4.734 3.155 10.566 1.00 0.00 N ATOM 1025 CZ ARG A 61 5.268 3.998 9.696 1.00 0.00 C ATOM 1026 NH1 ARG A 61 4.681 4.266 8.552 1.00 0.00 N ATOM 1027 NH2 ARG A 61 6.406 4.580 9.974 1.00 0.00 N ATOM 0 H ARG A 61 0.464 0.130 7.464 1.00 0.00 H new ATOM 0 HA ARG A 61 2.612 -1.121 8.976 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.798 0.874 7.432 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.802 1.811 8.528 1.00 0.00 H new ATOM 0 HG2 ARG A 61 4.121 0.474 9.848 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.578 1.665 8.646 1.00 0.00 H new ATOM 0 HD2 ARG A 61 2.706 3.170 9.866 1.00 0.00 H new ATOM 0 HD3 ARG A 61 2.992 2.079 11.208 1.00 0.00 H new ATOM 0 HE ARG A 61 5.222 2.965 11.441 1.00 0.00 H new ATOM 0 HH11 ARG A 61 3.794 3.821 8.317 1.00 0.00 H new ATOM 0 HH12 ARG A 61 5.112 4.919 7.898 1.00 0.00 H new ATOM 0 HH21 ARG A 61 6.877 4.383 10.857 1.00 0.00 H new ATOM 0 HH22 ARG A 61 6.822 5.230 9.308 1.00 0.00 H new ATOM 1041 N TYR A 62 0.318 0.501 10.724 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.144 0.681 12.148 1.00 0.00 C ATOM 1043 C TYR A 62 -0.350 -0.698 12.798 1.00 0.00 C ATOM 1044 O TYR A 62 0.141 -0.952 13.885 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.478 1.451 12.083 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.008 1.678 13.478 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -2.742 0.671 14.115 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -1.769 2.892 14.131 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.236 0.877 15.406 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.264 3.099 15.424 1.00 0.00 C ATOM 1051 CZ TYR A 62 -2.998 2.092 16.062 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.487 2.297 17.335 1.00 0.00 O ATOM 0 H TYR A 62 -0.300 0.888 10.011 1.00 0.00 H new ATOM 0 HA TYR A 62 0.588 1.226 12.744 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.332 2.407 11.580 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.204 0.889 11.496 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.927 -0.265 13.609 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.203 3.669 13.638 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.801 0.099 15.898 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.080 4.036 15.929 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.231 3.191 17.644 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.051 -1.599 12.138 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.252 -2.965 12.740 1.00 0.00 C ATOM 1064 C ILE A 63 0.046 -3.774 12.581 1.00 0.00 C ATOM 1065 O ILE A 63 0.488 -4.432 13.503 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.408 -3.624 11.968 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.675 -2.777 12.125 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.664 -5.024 12.531 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.790 -3.351 11.246 1.00 0.00 C ATOM 0 H ILE A 63 -1.485 -1.453 11.227 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.491 -2.915 13.802 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.144 -3.696 10.913 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -3.990 -2.766 13.168 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.471 -1.744 11.843 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.483 -5.492 11.985 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.764 -5.629 12.424 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -2.928 -4.949 13.586 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.690 -2.747 11.359 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.474 -3.339 10.203 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.001 -4.377 11.549 1.00 0.00 H new ATOM 1081 N TYR A 64 0.671 -3.708 11.423 1.00 0.00 N ATOM 1082 CA TYR A 64 1.962 -4.457 11.221 1.00 0.00 C ATOM 1083 C TYR A 64 3.021 -3.982 12.231 1.00 0.00 C ATOM 1084 O TYR A 64 3.933 -4.715 12.552 1.00 0.00 O ATOM 1085 CB TYR A 64 2.428 -4.145 9.788 1.00 0.00 C ATOM 1086 CG TYR A 64 3.591 -5.030 9.416 1.00 0.00 C ATOM 1087 CD1 TYR A 64 3.423 -6.415 9.362 1.00 0.00 C ATOM 1088 CD2 TYR A 64 4.836 -4.465 9.115 1.00 0.00 C ATOM 1089 CE1 TYR A 64 4.493 -7.239 9.008 1.00 0.00 C ATOM 1090 CE2 TYR A 64 5.911 -5.288 8.762 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.740 -6.677 8.708 1.00 0.00 C ATOM 1092 OH TYR A 64 6.798 -7.490 8.359 1.00 0.00 O ATOM 0 H TYR A 64 0.348 -3.174 10.616 1.00 0.00 H new ATOM 0 HA TYR A 64 1.820 -5.527 11.370 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.606 -4.299 9.089 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.720 -3.097 9.712 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.462 -6.850 9.595 1.00 0.00 H new ATOM 0 HD2 TYR A 64 4.967 -3.394 9.155 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.359 -8.310 8.966 1.00 0.00 H new ATOM 0 HE2 TYR A 64 6.872 -4.852 8.531 1.00 0.00 H new ATOM 0 HH TYR A 64 7.589 -6.939 8.182 1.00 0.00 H new ATOM 1102 N THR A 65 2.920 -2.767 12.742 1.00 0.00 N ATOM 1103 CA THR A 65 3.945 -2.297 13.731 1.00 0.00 C ATOM 1104 C THR A 65 3.530 -2.685 15.160 1.00 0.00 C ATOM 1105 O THR A 65 4.374 -2.979 15.984 1.00 0.00 O ATOM 1106 CB THR A 65 4.018 -0.768 13.586 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.370 -0.440 12.249 1.00 0.00 O ATOM 1108 CG2 THR A 65 5.071 -0.205 14.544 1.00 0.00 C ATOM 0 H THR A 65 2.185 -2.096 12.519 1.00 0.00 H new ATOM 0 HA THR A 65 4.915 -2.756 13.543 1.00 0.00 H new ATOM 0 HB THR A 65 3.047 -0.335 13.827 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.570 -0.153 11.761 1.00 0.00 H new ATOM 0 HG21 THR A 65 5.118 0.879 14.437 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.801 -0.457 15.570 1.00 0.00 H new ATOM 0 HG23 THR A 65 6.044 -0.636 14.309 1.00 0.00 H new ATOM 1116 N LEU A 66 2.248 -2.677 15.478 1.00 0.00 N ATOM 1117 CA LEU A 66 1.845 -3.039 16.882 1.00 0.00 C ATOM 1118 C LEU A 66 1.757 -4.572 17.084 1.00 0.00 C ATOM 1119 O LEU A 66 2.025 -5.061 18.165 1.00 0.00 O ATOM 1120 CB LEU A 66 0.487 -2.345 17.154 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.652 -3.008 16.362 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.206 -4.205 17.150 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -1.770 -1.984 16.134 1.00 0.00 C ATOM 0 H LEU A 66 1.484 -2.442 14.845 1.00 0.00 H new ATOM 0 HA LEU A 66 2.599 -2.698 17.592 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.263 -2.386 18.220 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.555 -1.291 16.883 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.271 -3.357 15.402 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.013 -4.671 16.584 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.411 -4.932 17.314 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.588 -3.862 18.112 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.580 -2.449 15.573 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.147 -1.637 17.096 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.378 -1.137 15.571 1.00 0.00 H new ATOM 1135 N TYR A 67 1.374 -5.334 16.075 1.00 0.00 N ATOM 1136 CA TYR A 67 1.271 -6.830 16.270 1.00 0.00 C ATOM 1137 C TYR A 67 2.620 -7.535 16.022 1.00 0.00 C ATOM 1138 O TYR A 67 2.932 -8.506 16.687 1.00 0.00 O ATOM 1139 CB TYR A 67 0.209 -7.335 15.269 1.00 0.00 C ATOM 1140 CG TYR A 67 0.052 -8.842 15.395 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.968 -9.691 14.760 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -0.998 -9.386 16.148 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.834 -11.080 14.878 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.131 -10.777 16.265 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.214 -11.623 15.630 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.344 -12.992 15.745 1.00 0.00 O ATOM 0 H TYR A 67 1.133 -4.996 15.144 1.00 0.00 H new ATOM 0 HA TYR A 67 0.991 -7.055 17.299 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.745 -6.844 15.460 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.503 -7.075 14.252 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.778 -9.274 14.179 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.705 -8.733 16.638 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.541 -11.733 14.388 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.940 -11.195 16.845 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.756 -13.210 16.607 1.00 0.00 H new ATOM 1156 N TYR A 68 3.405 -7.093 15.060 1.00 0.00 N ATOM 1157 CA TYR A 68 4.707 -7.805 14.784 1.00 0.00 C ATOM 1158 C TYR A 68 5.905 -7.192 15.542 1.00 0.00 C ATOM 1159 O TYR A 68 6.919 -7.849 15.694 1.00 0.00 O ATOM 1160 CB TYR A 68 4.927 -7.710 13.268 1.00 0.00 C ATOM 1161 CG TYR A 68 4.206 -8.844 12.574 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.585 -10.167 12.824 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.162 -8.571 11.675 1.00 0.00 C ATOM 1164 CE1 TYR A 68 3.922 -11.219 12.178 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.501 -9.624 11.031 1.00 0.00 C ATOM 1166 CZ TYR A 68 2.882 -10.948 11.283 1.00 0.00 C ATOM 1167 OH TYR A 68 2.230 -11.985 10.647 1.00 0.00 O ATOM 0 H TYR A 68 3.209 -6.288 14.465 1.00 0.00 H new ATOM 0 HA TYR A 68 4.645 -8.836 15.132 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.560 -6.753 12.897 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.993 -7.752 13.042 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.388 -10.378 13.515 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.869 -7.550 11.481 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.215 -12.240 12.372 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.698 -9.415 10.340 1.00 0.00 H new ATOM 0 HH TYR A 68 1.534 -11.623 10.060 1.00 0.00 H new ATOM 1177 N LYS A 69 5.828 -5.960 16.010 1.00 0.00 N ATOM 1178 CA LYS A 69 7.005 -5.374 16.736 1.00 0.00 C ATOM 1179 C LYS A 69 6.650 -5.064 18.200 1.00 0.00 C ATOM 1180 O LYS A 69 7.281 -5.570 19.109 1.00 0.00 O ATOM 1181 CB LYS A 69 7.356 -4.080 15.995 1.00 0.00 C ATOM 1182 CG LYS A 69 7.638 -4.371 14.518 1.00 0.00 C ATOM 1183 CD LYS A 69 7.360 -3.111 13.691 1.00 0.00 C ATOM 1184 CE LYS A 69 8.681 -2.403 13.373 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.290 -1.048 12.890 1.00 0.00 N ATOM 0 H LYS A 69 5.017 -5.348 15.922 1.00 0.00 H new ATOM 0 HA LYS A 69 7.841 -6.073 16.752 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.534 -3.369 16.082 1.00 0.00 H new ATOM 0 HB3 LYS A 69 8.229 -3.616 16.454 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.674 -4.683 14.389 1.00 0.00 H new ATOM 0 HG3 LYS A 69 7.012 -5.193 14.171 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.846 -3.376 12.767 1.00 0.00 H new ATOM 0 HD3 LYS A 69 6.700 -2.441 14.242 1.00 0.00 H new ATOM 0 HE2 LYS A 69 9.316 -2.338 14.257 1.00 0.00 H new ATOM 0 HE3 LYS A 69 9.245 -2.944 12.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 9.054 -0.655 12.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 7.420 -1.119 12.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 8.123 -0.424 13.705 1.00 0.00 H new ATOM 1199 N ARG A 70 5.654 -4.234 18.442 1.00 0.00 N ATOM 1200 CA ARG A 70 5.291 -3.904 19.870 1.00 0.00 C ATOM 1201 C ARG A 70 4.687 -5.130 20.580 1.00 0.00 C ATOM 1202 O ARG A 70 4.808 -5.266 21.783 1.00 0.00 O ATOM 1203 CB ARG A 70 4.259 -2.769 19.819 1.00 0.00 C ATOM 1204 CG ARG A 70 4.849 -1.572 19.067 1.00 0.00 C ATOM 1205 CD ARG A 70 4.346 -0.270 19.698 1.00 0.00 C ATOM 1206 NE ARG A 70 5.522 0.652 19.667 1.00 0.00 N ATOM 1207 CZ ARG A 70 6.564 0.465 20.461 1.00 0.00 C ATOM 1208 NH1 ARG A 70 6.608 -0.536 21.310 1.00 0.00 N ATOM 1209 NH2 ARG A 70 7.575 1.293 20.405 1.00 0.00 N ATOM 0 H ARG A 70 5.085 -3.778 17.729 1.00 0.00 H new ATOM 0 HA ARG A 70 6.179 -3.608 20.428 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.351 -3.111 19.323 1.00 0.00 H new ATOM 0 HB3 ARG A 70 3.978 -2.474 20.830 1.00 0.00 H new ATOM 0 HG2 ARG A 70 5.938 -1.608 19.102 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.563 -1.613 18.016 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.506 0.142 19.138 1.00 0.00 H new ATOM 0 HD3 ARG A 70 3.999 -0.434 20.718 1.00 0.00 H new ATOM 0 HE ARG A 70 5.521 1.441 19.021 1.00 0.00 H new ATOM 0 HH11 ARG A 70 5.828 -1.190 21.368 1.00 0.00 H new ATOM 0 HH12 ARG A 70 7.422 -0.659 21.912 1.00 0.00 H new ATOM 0 HH21 ARG A 70 7.557 2.077 19.752 1.00 0.00 H new ATOM 0 HH22 ARG A 70 8.382 1.155 21.014 1.00 0.00 H new ATOM 1223 N LYS A 71 4.029 -6.024 19.860 1.00 0.00 N ATOM 1224 CA LYS A 71 3.417 -7.227 20.513 1.00 0.00 C ATOM 1225 C LYS A 71 2.412 -6.786 21.587 1.00 0.00 C ATOM 1226 O LYS A 71 2.360 -7.351 22.662 1.00 0.00 O ATOM 1227 CB LYS A 71 4.578 -8.009 21.141 1.00 0.00 C ATOM 1228 CG LYS A 71 4.186 -9.483 21.280 1.00 0.00 C ATOM 1229 CD LYS A 71 5.441 -10.325 21.515 1.00 0.00 C ATOM 1230 CE LYS A 71 5.261 -11.702 20.868 1.00 0.00 C ATOM 1231 NZ LYS A 71 6.584 -12.016 20.259 1.00 0.00 N ATOM 0 H LYS A 71 3.893 -5.967 18.851 1.00 0.00 H new ATOM 0 HA LYS A 71 2.874 -7.844 19.797 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.470 -7.916 20.522 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.824 -7.593 22.118 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.490 -9.609 22.110 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.672 -9.820 20.380 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.312 -9.824 21.093 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.623 -10.435 22.584 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.978 -12.452 21.607 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.474 -11.685 20.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 6.541 -12.946 19.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 6.823 -11.289 19.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.313 -12.032 21.001 1.00 0.00 H new ATOM 1245 N ALA A 72 1.601 -5.791 21.294 1.00 0.00 N ATOM 1246 CA ALA A 72 0.587 -5.331 22.293 1.00 0.00 C ATOM 1247 C ALA A 72 -0.829 -5.693 21.809 1.00 0.00 C ATOM 1248 O ALA A 72 -1.773 -4.964 22.049 1.00 0.00 O ATOM 1249 CB ALA A 72 0.756 -3.812 22.374 1.00 0.00 C ATOM 0 H ALA A 72 1.600 -5.282 20.410 1.00 0.00 H new ATOM 0 HA ALA A 72 0.725 -5.802 23.266 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.042 -3.404 23.090 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.770 -3.575 22.697 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.576 -3.373 21.393 1.00 0.00 H new ATOM 1255 N ILE A 73 -0.987 -6.814 21.129 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.343 -7.213 20.635 1.00 0.00 C ATOM 1257 C ILE A 73 -2.415 -8.746 20.494 1.00 0.00 C ATOM 1258 O ILE A 73 -1.395 -9.409 20.458 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.493 -6.519 19.273 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -3.851 -6.877 18.659 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.374 -6.967 18.324 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.068 -6.066 17.379 1.00 0.00 C ATOM 0 H ILE A 73 -0.235 -7.463 20.899 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.143 -6.923 21.316 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.428 -5.441 19.419 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.891 -7.943 18.437 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.649 -6.670 19.372 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.491 -6.468 17.362 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.407 -6.705 18.753 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.428 -8.046 18.182 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.034 -6.323 16.945 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.047 -5.002 17.615 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.277 -6.295 16.665 1.00 0.00 H new ATOM 1274 N SER A 74 -3.598 -9.316 20.416 1.00 0.00 N ATOM 1275 CA SER A 74 -3.695 -10.803 20.280 1.00 0.00 C ATOM 1276 C SER A 74 -4.141 -11.183 18.860 1.00 0.00 C ATOM 1277 O SER A 74 -4.880 -10.454 18.227 1.00 0.00 O ATOM 1278 CB SER A 74 -4.741 -11.242 21.307 1.00 0.00 C ATOM 1279 OG SER A 74 -4.319 -10.847 22.606 1.00 0.00 O ATOM 0 H SER A 74 -4.489 -8.820 20.441 1.00 0.00 H new ATOM 0 HA SER A 74 -2.734 -11.289 20.452 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.707 -10.794 21.074 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.874 -12.323 21.268 1.00 0.00 H new ATOM 0 HG SER A 74 -4.988 -11.125 23.266 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.698 -12.321 18.351 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.104 -12.751 16.957 1.00 0.00 C ATOM 1287 C LYS A 75 -5.624 -12.594 16.739 1.00 0.00 C ATOM 1288 O LYS A 75 -6.059 -12.309 15.641 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.712 -14.230 16.824 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.681 -14.620 15.344 1.00 0.00 C ATOM 1291 CD LYS A 75 -3.159 -16.051 15.204 1.00 0.00 C ATOM 1292 CE LYS A 75 -1.637 -16.057 15.365 1.00 0.00 C ATOM 1293 NZ LYS A 75 -1.105 -15.859 13.988 1.00 0.00 N ATOM 0 H LYS A 75 -3.076 -12.968 18.836 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.608 -12.130 16.212 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.735 -14.400 17.276 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.425 -14.856 17.361 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.680 -14.543 14.916 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -3.042 -13.933 14.789 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -3.618 -16.692 15.957 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.434 -16.456 14.230 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.307 -15.262 16.034 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.289 -16.998 15.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.065 -15.852 14.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -1.430 -16.634 13.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -1.448 -14.953 13.610 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.435 -12.770 17.767 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.921 -12.609 17.570 1.00 0.00 C ATOM 1309 C ASP A 76 -8.222 -11.168 17.143 1.00 0.00 C ATOM 1310 O ASP A 76 -8.889 -10.944 16.149 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.590 -12.919 18.919 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.361 -14.388 19.278 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -9.028 -15.230 18.698 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -7.523 -14.647 20.124 1.00 0.00 O ATOM 0 H ASP A 76 -6.141 -13.013 18.713 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.296 -13.279 16.796 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.179 -12.275 19.697 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.658 -12.710 18.864 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.723 -10.185 17.867 1.00 0.00 N ATOM 1320 CA LEU A 77 -7.984 -8.761 17.452 1.00 0.00 C ATOM 1321 C LEU A 77 -7.281 -8.507 16.113 1.00 0.00 C ATOM 1322 O LEU A 77 -7.849 -7.922 15.213 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.400 -7.850 18.547 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.659 -6.382 18.187 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.151 -6.074 18.347 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -6.840 -5.466 19.109 1.00 0.00 C ATOM 0 H LEU A 77 -7.159 -10.302 18.709 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.049 -8.563 17.332 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.854 -8.084 19.510 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.329 -8.027 18.648 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.360 -6.206 17.154 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.337 -5.031 18.091 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.729 -6.718 17.684 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.451 -6.254 19.379 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.028 -4.425 18.848 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.131 -5.639 20.145 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.779 -5.684 18.989 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.049 -8.961 15.966 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.329 -8.751 14.659 1.00 0.00 C ATOM 1340 C TYR A 78 -6.112 -9.445 13.528 1.00 0.00 C ATOM 1341 O TYR A 78 -6.249 -8.903 12.446 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.925 -9.372 14.827 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.140 -9.266 13.535 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.108 -8.059 12.824 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.439 -10.378 13.053 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.379 -7.965 11.632 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.710 -10.284 11.862 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.681 -9.078 11.151 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.961 -8.986 9.977 1.00 0.00 O ATOM 0 H TYR A 78 -5.520 -9.459 16.682 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.247 -7.695 14.401 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.389 -8.863 15.628 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -4.016 -10.418 15.119 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.646 -7.200 13.196 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.461 -11.309 13.600 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.356 -7.034 11.085 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -1.169 -11.142 11.491 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.535 -9.848 9.786 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.651 -10.627 13.773 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.447 -11.316 12.696 1.00 0.00 C ATOM 1361 C ASP A 79 -8.779 -10.573 12.512 1.00 0.00 C ATOM 1362 O ASP A 79 -9.216 -10.344 11.400 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.695 -12.756 13.174 1.00 0.00 C ATOM 1364 CG ASP A 79 -8.277 -13.581 12.025 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -9.452 -13.420 11.741 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -7.536 -14.361 11.449 1.00 0.00 O ATOM 0 H ASP A 79 -6.576 -11.134 14.655 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.921 -11.321 11.742 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.762 -13.202 13.520 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.382 -12.756 14.021 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.420 -10.175 13.597 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.722 -9.421 13.466 1.00 0.00 C ATOM 1373 C TRP A 80 -10.508 -8.161 12.604 1.00 0.00 C ATOM 1374 O TRP A 80 -11.364 -7.795 11.820 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.143 -9.031 14.898 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.434 -8.274 14.874 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.661 -8.829 14.757 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.643 -6.835 14.975 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.611 -7.823 14.779 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.032 -6.576 14.912 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.772 -5.740 15.114 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.538 -5.277 14.982 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.276 -4.432 15.184 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.657 -4.201 15.119 1.00 0.00 C ATOM 0 H TRP A 80 -9.104 -10.336 14.553 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.491 -10.024 12.984 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.251 -9.927 15.509 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.366 -8.422 15.359 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.866 -9.885 14.662 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.616 -7.983 14.706 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.706 -5.907 15.167 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.603 -5.105 14.931 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.596 -3.599 15.288 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.040 -3.193 15.175 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.369 -7.504 12.730 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.123 -6.281 11.888 1.00 0.00 C ATOM 1397 C LEU A 81 -8.958 -6.705 10.421 1.00 0.00 C ATOM 1398 O LEU A 81 -9.562 -6.131 9.535 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.822 -5.640 12.399 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.005 -5.180 13.846 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.637 -4.903 14.469 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.841 -3.903 13.871 1.00 0.00 C ATOM 0 H LEU A 81 -8.614 -7.757 13.367 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.952 -5.576 11.954 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.003 -6.357 12.336 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.552 -4.792 11.770 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.513 -5.960 14.414 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.767 -4.575 15.500 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.038 -5.813 14.450 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.130 -4.123 13.901 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.972 -3.574 14.902 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.332 -3.124 13.303 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.817 -4.098 13.425 1.00 0.00 H new ATOM 1414 N ILE A 82 -8.155 -7.719 10.157 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.973 -8.177 8.730 1.00 0.00 C ATOM 1416 C ILE A 82 -9.340 -8.566 8.120 1.00 0.00 C ATOM 1417 O ILE A 82 -9.559 -8.385 6.937 1.00 0.00 O ATOM 1418 CB ILE A 82 -7.025 -9.401 8.768 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.627 -8.978 9.260 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.896 -10.018 7.368 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -5.034 -7.906 8.337 1.00 0.00 C ATOM 0 H ILE A 82 -7.626 -8.242 10.854 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.552 -7.384 8.112 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.446 -10.137 9.453 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.694 -8.593 10.278 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.968 -9.846 9.290 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -6.227 -10.877 7.409 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.878 -10.339 7.020 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.492 -9.276 6.679 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -4.047 -7.619 8.700 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.948 -8.304 7.326 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.685 -7.032 8.329 1.00 0.00 H new ATOM 1433 N LYS A 83 -10.258 -9.100 8.908 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.596 -9.489 8.334 1.00 0.00 C ATOM 1435 C LYS A 83 -12.621 -8.333 8.388 1.00 0.00 C ATOM 1436 O LYS A 83 -13.668 -8.426 7.775 1.00 0.00 O ATOM 1437 CB LYS A 83 -12.091 -10.674 9.177 1.00 0.00 C ATOM 1438 CG LYS A 83 -12.848 -11.657 8.284 1.00 0.00 C ATOM 1439 CD LYS A 83 -14.341 -11.325 8.307 1.00 0.00 C ATOM 1440 CE LYS A 83 -15.145 -12.553 7.872 1.00 0.00 C ATOM 1441 NZ LYS A 83 -16.506 -12.032 7.564 1.00 0.00 N ATOM 0 H LYS A 83 -10.141 -9.280 9.905 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.490 -9.745 7.280 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.247 -11.174 9.651 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.741 -10.318 9.976 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -12.469 -11.603 7.264 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -12.687 -12.678 8.631 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -14.640 -11.018 9.309 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -14.548 -10.487 7.641 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -14.698 -13.029 6.999 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -15.179 -13.303 8.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -17.117 -12.816 7.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -16.909 -11.590 8.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -16.443 -11.325 6.804 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.355 -7.250 9.103 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.358 -6.131 9.153 1.00 0.00 C ATOM 1457 C GLU A 84 -12.887 -4.888 8.362 1.00 0.00 C ATOM 1458 O GLU A 84 -13.349 -3.792 8.611 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.494 -5.787 10.629 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.126 -6.955 11.384 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.548 -7.199 10.870 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.340 -6.273 10.912 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.819 -8.308 10.440 1.00 0.00 O ATOM 0 H GLU A 84 -11.503 -7.099 9.642 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.301 -6.436 8.699 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.514 -5.560 11.049 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.107 -4.893 10.747 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.523 -7.853 11.252 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.148 -6.740 12.452 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.985 -5.049 7.406 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.478 -3.898 6.566 1.00 0.00 C ATOM 1472 C LYS A 85 -10.502 -3.011 7.346 1.00 0.00 C ATOM 1473 O LYS A 85 -10.830 -1.907 7.739 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.701 -3.093 6.095 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.377 -2.397 4.771 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.411 -1.302 4.503 1.00 0.00 C ATOM 1477 CE LYS A 85 -12.748 -0.144 3.754 1.00 0.00 C ATOM 1478 NZ LYS A 85 -13.729 0.975 3.833 1.00 0.00 N ATOM 0 H LYS A 85 -11.571 -5.950 7.169 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.922 -4.283 5.711 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.558 -3.754 5.970 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.975 -2.355 6.848 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.377 -1.966 4.810 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -12.380 -3.122 3.957 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -14.237 -1.703 3.916 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.832 -0.947 5.444 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -11.798 0.130 4.212 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -12.537 -0.412 2.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -13.346 1.808 3.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -14.621 0.687 3.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -13.905 1.213 4.830 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.291 -3.486 7.561 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.278 -2.680 8.299 1.00 0.00 C ATOM 1494 C TYR A 86 -6.939 -2.746 7.552 1.00 0.00 C ATOM 1495 O TYR A 86 -6.437 -1.747 7.073 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.164 -3.347 9.670 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.346 -2.956 10.521 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.616 -3.499 10.266 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.169 -2.049 11.571 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.703 -3.124 11.070 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.254 -1.680 12.372 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.521 -2.217 12.121 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.592 -1.852 12.910 1.00 0.00 O ATOM 0 H TYR A 86 -8.968 -4.403 7.252 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.553 -1.629 8.387 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.127 -4.430 9.557 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.237 -3.045 10.157 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.755 -4.200 9.457 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.191 -1.632 11.764 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.683 -3.536 10.878 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.114 -0.981 13.183 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.265 -1.520 13.772 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.368 -3.925 7.432 1.00 0.00 N ATOM 1514 CA ALA A 87 -5.076 -4.069 6.700 1.00 0.00 C ATOM 1515 C ALA A 87 -5.177 -5.249 5.721 1.00 0.00 C ATOM 1516 O ALA A 87 -6.038 -6.098 5.867 1.00 0.00 O ATOM 1517 CB ALA A 87 -4.032 -4.351 7.781 1.00 0.00 C ATOM 0 H ALA A 87 -6.746 -4.792 7.812 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.818 -3.183 6.120 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -3.052 -4.469 7.318 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -4.003 -3.519 8.485 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.296 -5.266 8.312 1.00 0.00 H new ATOM 1523 N ASP A 88 -4.318 -5.317 4.725 1.00 0.00 N ATOM 1524 CA ASP A 88 -4.396 -6.455 3.754 1.00 0.00 C ATOM 1525 C ASP A 88 -3.258 -7.454 4.007 1.00 0.00 C ATOM 1526 O ASP A 88 -2.095 -7.110 3.902 1.00 0.00 O ATOM 1527 CB ASP A 88 -4.257 -5.826 2.363 1.00 0.00 C ATOM 1528 CG ASP A 88 -4.398 -6.911 1.293 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.499 -7.729 1.184 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -5.403 -6.906 0.601 1.00 0.00 O ATOM 0 H ASP A 88 -3.576 -4.641 4.546 1.00 0.00 H new ATOM 0 HA ASP A 88 -5.332 -7.005 3.854 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -5.019 -5.060 2.221 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -3.289 -5.333 2.271 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.580 -8.692 4.331 1.00 0.00 N ATOM 1536 CA LYS A 89 -2.490 -9.701 4.576 1.00 0.00 C ATOM 1537 C LYS A 89 -1.645 -9.874 3.305 1.00 0.00 C ATOM 1538 O LYS A 89 -0.441 -10.016 3.381 1.00 0.00 O ATOM 1539 CB LYS A 89 -3.179 -11.026 4.941 1.00 0.00 C ATOM 1540 CG LYS A 89 -3.595 -10.995 6.413 1.00 0.00 C ATOM 1541 CD LYS A 89 -2.439 -11.496 7.281 1.00 0.00 C ATOM 1542 CE LYS A 89 -2.997 -12.234 8.500 1.00 0.00 C ATOM 1543 NZ LYS A 89 -1.801 -12.604 9.306 1.00 0.00 N ATOM 0 H LYS A 89 -4.532 -9.042 4.435 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.827 -9.377 5.378 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.053 -11.180 4.308 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -2.503 -11.862 4.760 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -3.869 -9.981 6.703 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -4.476 -11.619 6.566 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -1.798 -12.161 6.702 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -1.821 -10.657 7.602 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -3.676 -11.599 9.069 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -3.561 -13.118 8.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -2.098 -13.158 10.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -1.152 -13.172 8.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -1.316 -11.741 9.624 1.00 0.00 H new ATOM 1557 N LEU A 90 -2.257 -9.855 2.135 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.447 -10.010 0.872 1.00 0.00 C ATOM 1559 C LEU A 90 -0.419 -8.868 0.771 1.00 0.00 C ATOM 1560 O LEU A 90 0.701 -9.081 0.345 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.432 -9.950 -0.306 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.912 -10.821 -1.450 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.921 -12.288 -1.020 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.814 -10.643 -2.674 1.00 0.00 C ATOM 0 H LEU A 90 -3.262 -9.741 2.001 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.902 -10.954 0.866 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.416 -10.296 0.011 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.550 -8.920 -0.643 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.894 -10.523 -1.700 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.550 -12.909 -1.836 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -1.280 -12.415 -0.147 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.939 -12.588 -0.770 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.445 -11.263 -3.491 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.832 -10.942 -2.423 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.808 -9.597 -2.981 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.780 -7.659 1.170 1.00 0.00 N ATOM 1577 CA LEU A 91 0.211 -6.528 1.099 1.00 0.00 C ATOM 1578 C LEU A 91 1.358 -6.809 2.082 1.00 0.00 C ATOM 1579 O LEU A 91 2.514 -6.861 1.697 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.545 -5.249 1.512 1.00 0.00 C ATOM 1581 CG LEU A 91 0.074 -4.006 0.849 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.571 -3.918 1.160 1.00 0.00 C ATOM 1583 CD2 LEU A 91 -0.130 -4.076 -0.667 1.00 0.00 C ATOM 0 H LEU A 91 -1.700 -7.413 1.534 1.00 0.00 H new ATOM 0 HA LEU A 91 0.632 -6.418 0.100 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -1.594 -5.334 1.227 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.517 -5.140 2.596 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.419 -3.118 1.246 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.990 -3.033 0.682 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.715 -3.851 2.238 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.074 -4.807 0.781 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.309 -3.195 -1.134 1.00 0.00 H new ATOM 0 HD22 LEU A 91 0.352 -4.972 -1.058 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -1.196 -4.111 -0.889 1.00 0.00 H new ATOM 1595 N ILE A 92 1.046 -7.018 3.350 1.00 0.00 N ATOM 1596 CA ILE A 92 2.142 -7.325 4.340 1.00 0.00 C ATOM 1597 C ILE A 92 2.840 -8.638 3.922 1.00 0.00 C ATOM 1598 O ILE A 92 4.043 -8.769 4.061 1.00 0.00 O ATOM 1599 CB ILE A 92 1.466 -7.439 5.729 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.050 -6.030 6.185 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.436 -8.045 6.756 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.388 -6.082 7.569 1.00 0.00 C ATOM 0 H ILE A 92 0.102 -6.990 3.735 1.00 0.00 H new ATOM 0 HA ILE A 92 2.908 -6.550 4.372 1.00 0.00 H new ATOM 0 HB ILE A 92 0.595 -8.090 5.655 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.924 -5.380 6.219 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.359 -5.597 5.462 1.00 0.00 H new ATOM 0 HG21 ILE A 92 1.942 -8.117 7.725 1.00 0.00 H new ATOM 0 HG22 ILE A 92 2.738 -9.040 6.428 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.317 -7.409 6.844 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.101 -5.075 7.873 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.499 -6.714 7.525 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.091 -6.493 8.293 1.00 0.00 H new ATOM 1614 N ALA A 93 2.105 -9.601 3.392 1.00 0.00 N ATOM 1615 CA ALA A 93 2.765 -10.881 2.952 1.00 0.00 C ATOM 1616 C ALA A 93 3.708 -10.589 1.773 1.00 0.00 C ATOM 1617 O ALA A 93 4.798 -11.127 1.706 1.00 0.00 O ATOM 1618 CB ALA A 93 1.642 -11.835 2.513 1.00 0.00 C ATOM 0 H ALA A 93 1.096 -9.556 3.248 1.00 0.00 H new ATOM 0 HA ALA A 93 3.352 -11.325 3.756 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.075 -12.780 2.184 1.00 0.00 H new ATOM 0 HB2 ALA A 93 0.970 -12.016 3.352 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.084 -11.386 1.691 1.00 0.00 H new ATOM 1624 N LYS A 94 3.310 -9.729 0.847 1.00 0.00 N ATOM 1625 CA LYS A 94 4.223 -9.410 -0.313 1.00 0.00 C ATOM 1626 C LYS A 94 5.548 -8.845 0.218 1.00 0.00 C ATOM 1627 O LYS A 94 6.612 -9.230 -0.229 1.00 0.00 O ATOM 1628 CB LYS A 94 3.510 -8.356 -1.181 1.00 0.00 C ATOM 1629 CG LYS A 94 2.656 -9.042 -2.253 1.00 0.00 C ATOM 1630 CD LYS A 94 3.553 -9.859 -3.187 1.00 0.00 C ATOM 1631 CE LYS A 94 2.854 -10.041 -4.536 1.00 0.00 C ATOM 1632 NZ LYS A 94 2.208 -11.381 -4.455 1.00 0.00 N ATOM 0 H LYS A 94 2.412 -9.245 0.844 1.00 0.00 H new ATOM 0 HA LYS A 94 4.440 -10.304 -0.898 1.00 0.00 H new ATOM 0 HB2 LYS A 94 2.881 -7.724 -0.554 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.246 -7.705 -1.653 1.00 0.00 H new ATOM 0 HG2 LYS A 94 1.918 -9.692 -1.782 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.105 -8.295 -2.825 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.508 -9.353 -3.326 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.769 -10.831 -2.743 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.117 -9.257 -4.708 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.566 -9.995 -5.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.707 -11.579 -5.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.935 -12.108 -4.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.530 -11.393 -3.666 1.00 0.00 H new ATOM 1646 N TRP A 95 5.497 -7.943 1.180 1.00 0.00 N ATOM 1647 CA TRP A 95 6.781 -7.378 1.734 1.00 0.00 C ATOM 1648 C TRP A 95 7.614 -8.496 2.388 1.00 0.00 C ATOM 1649 O TRP A 95 8.829 -8.481 2.324 1.00 0.00 O ATOM 1650 CB TRP A 95 6.396 -6.319 2.786 1.00 0.00 C ATOM 1651 CG TRP A 95 6.263 -4.972 2.140 1.00 0.00 C ATOM 1652 CD1 TRP A 95 7.094 -4.469 1.195 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.258 -3.943 2.385 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.658 -3.205 0.842 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.532 -2.836 1.547 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.146 -3.867 3.243 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.731 -1.693 1.561 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.338 -2.718 3.258 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.631 -1.633 2.418 1.00 0.00 C ATOM 0 H TRP A 95 4.641 -7.579 1.599 1.00 0.00 H new ATOM 0 HA TRP A 95 7.382 -6.934 0.940 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.456 -6.596 3.264 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.153 -6.282 3.569 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.956 -4.973 0.784 1.00 0.00 H new ATOM 0 HE1 TRP A 95 7.114 -2.617 0.145 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.912 -4.697 3.894 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.961 -0.860 0.913 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.486 -2.669 3.920 1.00 0.00 H new ATOM 0 HH2 TRP A 95 3.006 -0.752 2.435 1.00 0.00 H new ATOM 1670 N ARG A 96 6.978 -9.469 3.012 1.00 0.00 N ATOM 1671 CA ARG A 96 7.762 -10.583 3.659 1.00 0.00 C ATOM 1672 C ARG A 96 8.179 -11.636 2.615 1.00 0.00 C ATOM 1673 O ARG A 96 9.220 -12.253 2.745 1.00 0.00 O ATOM 1674 CB ARG A 96 6.836 -11.212 4.713 1.00 0.00 C ATOM 1675 CG ARG A 96 6.737 -10.285 5.934 1.00 0.00 C ATOM 1676 CD ARG A 96 5.273 -10.141 6.359 1.00 0.00 C ATOM 1677 NE ARG A 96 5.088 -11.143 7.453 1.00 0.00 N ATOM 1678 CZ ARG A 96 5.658 -10.983 8.639 1.00 0.00 C ATOM 1679 NH1 ARG A 96 6.413 -9.941 8.899 1.00 0.00 N ATOM 1680 NH2 ARG A 96 5.469 -11.879 9.573 1.00 0.00 N ATOM 0 H ARG A 96 5.964 -9.541 3.101 1.00 0.00 H new ATOM 0 HA ARG A 96 8.677 -10.202 4.112 1.00 0.00 H new ATOM 0 HB2 ARG A 96 5.846 -11.378 4.289 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.221 -12.186 5.014 1.00 0.00 H new ATOM 0 HG2 ARG A 96 7.326 -10.689 6.757 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.153 -9.307 5.694 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.061 -9.131 6.709 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.599 -10.338 5.525 1.00 0.00 H new ATOM 0 HE ARG A 96 4.511 -11.967 7.283 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.571 -9.234 8.181 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.842 -9.839 9.819 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.886 -12.695 9.387 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.905 -11.762 10.488 1.00 0.00 H new ATOM 1694 N LYS A 97 7.385 -11.855 1.582 1.00 0.00 N ATOM 1695 CA LYS A 97 7.766 -12.881 0.537 1.00 0.00 C ATOM 1696 C LYS A 97 9.176 -12.595 -0.014 1.00 0.00 C ATOM 1697 O LYS A 97 9.840 -11.674 0.424 1.00 0.00 O ATOM 1698 CB LYS A 97 6.745 -12.745 -0.604 1.00 0.00 C ATOM 1699 CG LYS A 97 5.549 -13.662 -0.368 1.00 0.00 C ATOM 1700 CD LYS A 97 6.005 -15.123 -0.361 1.00 0.00 C ATOM 1701 CE LYS A 97 4.872 -16.014 -0.873 1.00 0.00 C ATOM 1702 NZ LYS A 97 5.369 -17.407 -0.695 1.00 0.00 N ATOM 0 H LYS A 97 6.500 -11.375 1.417 1.00 0.00 H new ATOM 0 HA LYS A 97 7.767 -13.882 0.968 1.00 0.00 H new ATOM 0 HB2 LYS A 97 6.408 -11.711 -0.676 1.00 0.00 H new ATOM 0 HB3 LYS A 97 7.218 -12.993 -1.554 1.00 0.00 H new ATOM 0 HG2 LYS A 97 5.073 -13.416 0.581 1.00 0.00 H new ATOM 0 HG3 LYS A 97 4.803 -13.509 -1.148 1.00 0.00 H new ATOM 0 HD2 LYS A 97 6.888 -15.242 -0.989 1.00 0.00 H new ATOM 0 HD3 LYS A 97 6.289 -15.422 0.648 1.00 0.00 H new ATOM 0 HE2 LYS A 97 3.953 -15.847 -0.310 1.00 0.00 H new ATOM 0 HE3 LYS A 97 4.647 -15.805 -1.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.646 -18.078 -1.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 6.240 -17.538 -1.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.568 -17.579 0.311 1.00 0.00 H new ATOM 1716 N THR A 98 9.630 -13.365 -0.985 1.00 0.00 N ATOM 1717 CA THR A 98 10.988 -13.113 -1.564 1.00 0.00 C ATOM 1718 C THR A 98 10.852 -12.417 -2.926 1.00 0.00 C ATOM 1719 O THR A 98 10.040 -12.806 -3.744 1.00 0.00 O ATOM 1720 CB THR A 98 11.638 -14.497 -1.724 1.00 0.00 C ATOM 1721 OG1 THR A 98 11.147 -15.391 -0.718 1.00 0.00 O ATOM 1722 CG2 THR A 98 13.163 -14.363 -1.614 1.00 0.00 C ATOM 0 H THR A 98 9.121 -14.148 -1.395 1.00 0.00 H new ATOM 0 HA THR A 98 11.591 -12.465 -0.928 1.00 0.00 H new ATOM 0 HB THR A 98 11.384 -14.902 -2.703 1.00 0.00 H new ATOM 0 HG1 THR A 98 11.565 -16.270 -0.829 1.00 0.00 H new ATOM 0 HG21 THR A 98 13.624 -15.344 -1.727 1.00 0.00 H new ATOM 0 HG22 THR A 98 13.527 -13.698 -2.397 1.00 0.00 H new ATOM 0 HG23 THR A 98 13.423 -13.951 -0.639 1.00 0.00 H new ATOM 1730 N GLY A 99 11.632 -11.385 -3.174 1.00 0.00 N ATOM 1731 CA GLY A 99 11.532 -10.664 -4.478 1.00 0.00 C ATOM 1732 C GLY A 99 10.628 -9.419 -4.350 1.00 0.00 C ATOM 1733 O GLY A 99 10.223 -8.855 -5.351 1.00 0.00 O ATOM 0 H GLY A 99 12.330 -11.016 -2.528 1.00 0.00 H new ATOM 0 HA2 GLY A 99 12.526 -10.364 -4.810 1.00 0.00 H new ATOM 0 HA3 GLY A 99 11.130 -11.334 -5.239 1.00 0.00 H new ATOM 1737 N TYR A 100 10.303 -8.972 -3.147 1.00 0.00 N ATOM 1738 CA TYR A 100 9.434 -7.767 -3.004 1.00 0.00 C ATOM 1739 C TYR A 100 10.154 -6.696 -2.167 1.00 0.00 C ATOM 1740 O TYR A 100 9.801 -6.456 -1.026 1.00 0.00 O ATOM 1741 CB TYR A 100 8.186 -8.265 -2.277 1.00 0.00 C ATOM 1742 CG TYR A 100 7.386 -9.153 -3.194 1.00 0.00 C ATOM 1743 CD1 TYR A 100 6.853 -8.641 -4.382 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.177 -10.490 -2.853 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.107 -9.470 -5.228 1.00 0.00 C ATOM 1746 CE2 TYR A 100 6.434 -11.322 -3.694 1.00 0.00 C ATOM 1747 CZ TYR A 100 5.898 -10.812 -4.884 1.00 0.00 C ATOM 1748 OH TYR A 100 5.163 -11.633 -5.717 1.00 0.00 O ATOM 0 H TYR A 100 10.605 -9.394 -2.269 1.00 0.00 H new ATOM 0 HA TYR A 100 9.191 -7.313 -3.965 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.471 -8.815 -1.380 1.00 0.00 H new ATOM 0 HB3 TYR A 100 7.580 -7.419 -1.954 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.017 -7.607 -4.646 1.00 0.00 H new ATOM 0 HD2 TYR A 100 7.591 -10.883 -1.936 1.00 0.00 H new ATOM 0 HE1 TYR A 100 5.693 -9.076 -6.144 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.273 -12.356 -3.428 1.00 0.00 H new ATOM 0 HH TYR A 100 5.115 -12.532 -5.331 1.00 0.00 H new ATOM 1758 N GLU A 101 11.159 -6.050 -2.719 1.00 0.00 N ATOM 1759 CA GLU A 101 11.888 -4.996 -1.934 1.00 0.00 C ATOM 1760 C GLU A 101 11.284 -3.608 -2.207 1.00 0.00 C ATOM 1761 O GLU A 101 11.208 -2.782 -1.317 1.00 0.00 O ATOM 1762 CB GLU A 101 13.349 -5.047 -2.405 1.00 0.00 C ATOM 1763 CG GLU A 101 14.282 -4.891 -1.202 1.00 0.00 C ATOM 1764 CD GLU A 101 14.606 -6.270 -0.625 1.00 0.00 C ATOM 1765 OE1 GLU A 101 13.695 -7.071 -0.508 1.00 0.00 O ATOM 1766 OE2 GLU A 101 15.762 -6.501 -0.309 1.00 0.00 O ATOM 0 H GLU A 101 11.503 -6.204 -3.667 1.00 0.00 H new ATOM 0 HA GLU A 101 11.810 -5.175 -0.862 1.00 0.00 H new ATOM 0 HB2 GLU A 101 13.546 -5.992 -2.910 1.00 0.00 H new ATOM 0 HB3 GLU A 101 13.536 -4.254 -3.129 1.00 0.00 H new ATOM 0 HG2 GLU A 101 15.200 -4.386 -1.503 1.00 0.00 H new ATOM 0 HG3 GLU A 101 13.811 -4.268 -0.441 1.00 0.00 H new ATOM 1773 N LYS A 102 10.855 -3.336 -3.426 1.00 0.00 N ATOM 1774 CA LYS A 102 10.266 -1.997 -3.729 1.00 0.00 C ATOM 1775 C LYS A 102 8.891 -2.151 -4.399 1.00 0.00 C ATOM 1776 O LYS A 102 8.764 -1.985 -5.598 1.00 0.00 O ATOM 1777 CB LYS A 102 11.258 -1.340 -4.691 1.00 0.00 C ATOM 1778 CG LYS A 102 12.429 -0.742 -3.902 1.00 0.00 C ATOM 1779 CD LYS A 102 12.247 0.774 -3.770 1.00 0.00 C ATOM 1780 CE LYS A 102 13.084 1.489 -4.837 1.00 0.00 C ATOM 1781 NZ LYS A 102 13.736 2.622 -4.122 1.00 0.00 N ATOM 0 H LYS A 102 10.890 -3.983 -4.214 1.00 0.00 H new ATOM 0 HA LYS A 102 10.111 -1.404 -2.828 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.627 -2.076 -5.406 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.759 -0.560 -5.266 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.484 -1.198 -2.914 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.370 -0.962 -4.407 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.195 1.035 -3.884 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.551 1.101 -2.776 1.00 0.00 H new ATOM 0 HE2 LYS A 102 13.825 0.818 -5.272 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.458 1.846 -5.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.327 3.159 -4.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.006 3.247 -3.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.331 2.251 -3.353 1.00 0.00 H new ATOM 1795 N LEU A 103 7.855 -2.458 -3.641 1.00 0.00 N ATOM 1796 CA LEU A 103 6.504 -2.607 -4.258 1.00 0.00 C ATOM 1797 C LEU A 103 5.516 -1.605 -3.619 1.00 0.00 C ATOM 1798 O LEU A 103 5.667 -1.233 -2.470 1.00 0.00 O ATOM 1799 CB LEU A 103 6.105 -4.080 -4.012 1.00 0.00 C ATOM 1800 CG LEU A 103 5.468 -4.274 -2.627 1.00 0.00 C ATOM 1801 CD1 LEU A 103 3.944 -4.159 -2.751 1.00 0.00 C ATOM 1802 CD2 LEU A 103 5.836 -5.656 -2.083 1.00 0.00 C ATOM 0 H LEU A 103 7.893 -2.609 -2.633 1.00 0.00 H new ATOM 0 HA LEU A 103 6.496 -2.385 -5.325 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.404 -4.400 -4.783 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.987 -4.715 -4.099 1.00 0.00 H new ATOM 0 HG LEU A 103 5.837 -3.509 -1.944 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.488 -4.296 -1.771 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.684 -3.174 -3.138 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.576 -4.925 -3.433 1.00 0.00 H new ATOM 0 HD21 LEU A 103 5.384 -5.793 -1.101 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.467 -6.424 -2.762 1.00 0.00 H new ATOM 0 HD23 LEU A 103 6.920 -5.737 -1.998 1.00 0.00 H new ATOM 1814 N CYS A 104 4.518 -1.160 -4.354 1.00 0.00 N ATOM 1815 CA CYS A 104 3.547 -0.174 -3.771 1.00 0.00 C ATOM 1816 C CYS A 104 2.132 -0.766 -3.571 1.00 0.00 C ATOM 1817 O CYS A 104 1.451 -0.391 -2.634 1.00 0.00 O ATOM 1818 CB CYS A 104 3.544 1.039 -4.719 1.00 0.00 C ATOM 1819 SG CYS A 104 3.053 0.593 -6.406 1.00 0.00 S ATOM 0 H CYS A 104 4.336 -1.433 -5.320 1.00 0.00 H new ATOM 0 HA CYS A 104 3.857 0.115 -2.767 1.00 0.00 H new ATOM 0 HB2 CYS A 104 2.862 1.797 -4.333 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.539 1.485 -4.738 1.00 0.00 H new ATOM 1824 N CYS A 105 1.670 -1.681 -4.404 1.00 0.00 N ATOM 1825 CA CYS A 105 0.295 -2.258 -4.185 1.00 0.00 C ATOM 1826 C CYS A 105 0.291 -3.761 -4.519 1.00 0.00 C ATOM 1827 O CYS A 105 1.333 -4.358 -4.715 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.664 -1.540 -5.149 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.391 0.256 -5.201 1.00 0.00 S ATOM 0 H CYS A 105 2.175 -2.047 -5.211 1.00 0.00 H new ATOM 0 HA CYS A 105 -0.006 -2.125 -3.146 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.541 -1.951 -6.151 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.692 -1.739 -4.847 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.878 -4.374 -4.606 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.935 -5.836 -4.952 1.00 0.00 C ATOM 1836 C LEU A 106 -1.195 -6.014 -6.460 1.00 0.00 C ATOM 1837 O LEU A 106 -0.613 -6.877 -7.088 1.00 0.00 O ATOM 1838 CB LEU A 106 -2.081 -6.425 -4.123 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.646 -6.506 -2.660 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.870 -6.743 -1.775 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.653 -7.660 -2.486 1.00 0.00 C ATOM 0 H LEU A 106 -1.782 -3.928 -4.454 1.00 0.00 H new ATOM 0 HA LEU A 106 0.005 -6.341 -4.730 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.972 -5.804 -4.217 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.343 -7.416 -4.493 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.168 -5.570 -2.370 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.559 -6.801 -0.732 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.574 -5.920 -1.899 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -3.351 -7.678 -2.062 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.342 -7.718 -1.443 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.129 -8.597 -2.776 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.220 -7.487 -3.115 1.00 0.00 H new ATOM 1853 N ARG A 107 -2.034 -5.184 -7.060 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.277 -5.302 -8.541 1.00 0.00 C ATOM 1855 C ARG A 107 -1.469 -4.218 -9.297 1.00 0.00 C ATOM 1856 O ARG A 107 -1.863 -3.768 -10.355 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.782 -5.085 -8.735 1.00 0.00 C ATOM 1858 CG ARG A 107 -4.244 -5.810 -10.000 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.772 -5.794 -10.069 1.00 0.00 C ATOM 1860 NE ARG A 107 -6.132 -6.943 -10.955 1.00 0.00 N ATOM 1861 CZ ARG A 107 -5.990 -6.871 -12.269 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -5.523 -5.788 -12.849 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -6.320 -7.895 -13.012 1.00 0.00 N ATOM 0 H ARG A 107 -2.553 -4.441 -6.592 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.962 -6.271 -8.930 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.328 -5.459 -7.869 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.999 -4.020 -8.814 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.825 -5.327 -10.882 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.880 -6.838 -9.996 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -6.213 -5.906 -9.078 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -6.139 -4.852 -10.476 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.495 -7.800 -10.538 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -5.261 -4.980 -12.285 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -5.422 -5.756 -13.864 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -6.685 -8.743 -12.578 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -6.213 -7.846 -14.025 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.343 -3.796 -8.755 1.00 0.00 N ATOM 1878 CA CYS A 108 0.503 -2.748 -9.410 1.00 0.00 C ATOM 1879 C CYS A 108 1.957 -3.289 -9.534 1.00 0.00 C ATOM 1880 O CYS A 108 2.886 -2.526 -9.711 1.00 0.00 O ATOM 1881 CB CYS A 108 0.426 -1.619 -8.371 1.00 0.00 C ATOM 1882 SG CYS A 108 0.540 0.057 -9.041 1.00 0.00 S ATOM 0 H CYS A 108 0.027 -4.143 -7.870 1.00 0.00 H new ATOM 0 HA CYS A 108 0.194 -2.446 -10.411 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.514 -1.712 -7.827 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.229 -1.759 -7.647 1.00 0.00 H new ATOM 1887 N ILE A 109 2.165 -4.605 -9.411 1.00 0.00 N ATOM 1888 CA ILE A 109 3.550 -5.177 -9.484 1.00 0.00 C ATOM 1889 C ILE A 109 3.515 -6.666 -9.904 1.00 0.00 C ATOM 1890 O ILE A 109 4.323 -7.449 -9.440 1.00 0.00 O ATOM 1891 CB ILE A 109 4.094 -5.088 -8.042 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.132 -5.811 -7.076 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.233 -3.626 -7.612 1.00 0.00 C ATOM 1894 CD1 ILE A 109 3.927 -6.633 -6.056 1.00 0.00 C ATOM 0 H ILE A 109 1.426 -5.293 -9.264 1.00 0.00 H new ATOM 0 HA ILE A 109 4.158 -4.641 -10.213 1.00 0.00 H new ATOM 0 HB ILE A 109 5.074 -5.564 -8.012 1.00 0.00 H new ATOM 0 HG12 ILE A 109 2.508 -5.082 -6.559 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.463 -6.463 -7.637 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.618 -3.581 -6.593 1.00 0.00 H new ATOM 0 HG22 ILE A 109 4.922 -3.113 -8.283 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.258 -3.140 -7.653 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.238 -7.139 -5.380 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.532 -7.374 -6.578 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.577 -5.972 -5.483 1.00 0.00 H new ATOM 1906 N GLN A 110 2.591 -7.075 -10.754 1.00 0.00 N ATOM 1907 CA GLN A 110 2.537 -8.521 -11.147 1.00 0.00 C ATOM 1908 C GLN A 110 1.934 -8.692 -12.550 1.00 0.00 C ATOM 1909 O GLN A 110 1.105 -7.908 -12.972 1.00 0.00 O ATOM 1910 CB GLN A 110 1.638 -9.180 -10.099 1.00 0.00 C ATOM 1911 CG GLN A 110 2.487 -9.638 -8.908 1.00 0.00 C ATOM 1912 CD GLN A 110 1.952 -10.976 -8.379 1.00 0.00 C ATOM 1913 OE1 GLN A 110 2.712 -11.902 -8.170 1.00 0.00 O ATOM 1914 NE2 GLN A 110 0.670 -11.123 -8.151 1.00 0.00 N ATOM 0 H GLN A 110 1.885 -6.478 -11.184 1.00 0.00 H new ATOM 0 HA GLN A 110 3.531 -8.966 -11.183 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.875 -8.477 -9.766 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.117 -10.032 -10.536 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.529 -9.745 -9.211 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.460 -8.886 -8.119 1.00 0.00 H new ATOM 0 HE21 GLN A 110 0.029 -10.349 -8.325 1.00 0.00 H new ATOM 0 HE22 GLN A 110 0.313 -12.012 -7.800 1.00 0.00 H new ATOM 1923 N LYS A 111 2.336 -9.718 -13.273 1.00 0.00 N ATOM 1924 CA LYS A 111 1.776 -9.933 -14.648 1.00 0.00 C ATOM 1925 C LYS A 111 0.700 -11.031 -14.621 1.00 0.00 C ATOM 1926 O LYS A 111 0.394 -11.578 -13.579 1.00 0.00 O ATOM 1927 CB LYS A 111 2.968 -10.372 -15.511 1.00 0.00 C ATOM 1928 CG LYS A 111 2.982 -9.581 -16.821 1.00 0.00 C ATOM 1929 CD LYS A 111 4.242 -9.934 -17.616 1.00 0.00 C ATOM 1930 CE LYS A 111 5.484 -9.420 -16.875 1.00 0.00 C ATOM 1931 NZ LYS A 111 6.380 -10.604 -16.750 1.00 0.00 N ATOM 0 H LYS A 111 3.022 -10.409 -12.971 1.00 0.00 H new ATOM 0 HA LYS A 111 1.303 -9.032 -15.039 1.00 0.00 H new ATOM 0 HB2 LYS A 111 3.900 -10.211 -14.969 1.00 0.00 H new ATOM 0 HB3 LYS A 111 2.902 -11.439 -15.721 1.00 0.00 H new ATOM 0 HG2 LYS A 111 2.092 -9.812 -17.407 1.00 0.00 H new ATOM 0 HG3 LYS A 111 2.958 -8.511 -16.613 1.00 0.00 H new ATOM 0 HD2 LYS A 111 4.308 -11.014 -17.750 1.00 0.00 H new ATOM 0 HD3 LYS A 111 4.191 -9.492 -18.611 1.00 0.00 H new ATOM 0 HE2 LYS A 111 5.969 -8.616 -17.429 1.00 0.00 H new ATOM 0 HE3 LYS A 111 5.221 -9.020 -15.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 7.251 -10.329 -16.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 5.895 -11.351 -16.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 6.620 -10.960 -17.697 1.00 0.00 H new ATOM 1945 N ASN A 112 0.123 -11.358 -15.761 1.00 0.00 N ATOM 1946 CA ASN A 112 -0.930 -12.420 -15.792 1.00 0.00 C ATOM 1947 C ASN A 112 -0.825 -13.233 -17.092 1.00 0.00 C ATOM 1948 O ASN A 112 -0.626 -14.434 -17.059 1.00 0.00 O ATOM 1949 CB ASN A 112 -2.257 -11.662 -15.736 1.00 0.00 C ATOM 1950 CG ASN A 112 -3.249 -12.431 -14.854 1.00 0.00 C ATOM 1951 OD1 ASN A 112 -3.691 -13.503 -15.216 1.00 0.00 O ATOM 1952 ND2 ASN A 112 -3.623 -11.931 -13.702 1.00 0.00 N ATOM 0 H ASN A 112 0.338 -10.935 -16.664 1.00 0.00 H new ATOM 0 HA ASN A 112 -0.830 -13.127 -14.968 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -2.099 -10.660 -15.336 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -2.663 -11.544 -16.741 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -4.282 -12.442 -13.114 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -3.255 -11.031 -13.393 1.00 0.00 H new ATOM 1959 N GLU A 113 -0.953 -12.594 -18.239 1.00 0.00 N ATOM 1960 CA GLU A 113 -0.856 -13.342 -19.530 1.00 0.00 C ATOM 1961 C GLU A 113 0.371 -12.870 -20.324 1.00 0.00 C ATOM 1962 O GLU A 113 1.171 -12.097 -19.829 1.00 0.00 O ATOM 1963 CB GLU A 113 -2.145 -13.006 -20.283 1.00 0.00 C ATOM 1964 CG GLU A 113 -3.170 -14.122 -20.068 1.00 0.00 C ATOM 1965 CD GLU A 113 -3.005 -15.182 -21.158 1.00 0.00 C ATOM 1966 OE1 GLU A 113 -2.770 -14.805 -22.293 1.00 0.00 O ATOM 1967 OE2 GLU A 113 -3.119 -16.354 -20.839 1.00 0.00 O ATOM 0 H GLU A 113 -1.119 -11.592 -18.330 1.00 0.00 H new ATOM 0 HA GLU A 113 -0.743 -14.415 -19.378 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -2.547 -12.056 -19.931 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -1.937 -12.889 -21.347 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -3.033 -14.572 -19.085 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -4.180 -13.713 -20.094 1.00 0.00 H new ATOM 1974 N THR A 114 0.532 -13.325 -21.551 1.00 0.00 N ATOM 1975 CA THR A 114 1.711 -12.895 -22.361 1.00 0.00 C ATOM 1976 C THR A 114 1.249 -12.293 -23.697 1.00 0.00 C ATOM 1977 O THR A 114 1.760 -12.643 -24.744 1.00 0.00 O ATOM 1978 CB THR A 114 2.519 -14.177 -22.598 1.00 0.00 C ATOM 1979 OG1 THR A 114 2.548 -14.968 -21.403 1.00 0.00 O ATOM 1980 CG2 THR A 114 3.946 -13.811 -23.025 1.00 0.00 C ATOM 0 H THR A 114 -0.102 -13.972 -22.019 1.00 0.00 H new ATOM 0 HA THR A 114 2.300 -12.129 -21.857 1.00 0.00 H new ATOM 0 HB THR A 114 2.047 -14.759 -23.389 1.00 0.00 H new ATOM 0 HG1 THR A 114 3.064 -15.785 -21.564 1.00 0.00 H new ATOM 0 HG21 THR A 114 4.520 -14.722 -23.193 1.00 0.00 H new ATOM 0 HG22 THR A 114 3.912 -13.228 -23.945 1.00 0.00 H new ATOM 0 HG23 THR A 114 4.421 -13.223 -22.240 1.00 0.00 H new ATOM 1988 N ASN A 115 0.288 -11.391 -23.674 1.00 0.00 N ATOM 1989 CA ASN A 115 -0.195 -10.779 -24.951 1.00 0.00 C ATOM 1990 C ASN A 115 -0.590 -9.310 -24.723 1.00 0.00 C ATOM 1991 O ASN A 115 0.033 -8.411 -25.255 1.00 0.00 O ATOM 1992 CB ASN A 115 -1.417 -11.607 -25.349 1.00 0.00 C ATOM 1993 CG ASN A 115 -0.964 -12.841 -26.140 1.00 0.00 C ATOM 1994 OD1 ASN A 115 -0.051 -12.757 -26.937 1.00 0.00 O ATOM 1995 ND2 ASN A 115 -1.564 -13.992 -25.957 1.00 0.00 N ATOM 0 H ASN A 115 -0.177 -11.057 -22.830 1.00 0.00 H new ATOM 0 HA ASN A 115 0.571 -10.784 -25.726 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -1.967 -11.914 -24.459 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -2.097 -11.005 -25.952 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -1.264 -14.813 -26.483 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -2.331 -14.067 -25.289 1.00 0.00 H new ATOM 2002 N ASN A 116 -1.620 -9.058 -23.940 1.00 0.00 N ATOM 2003 CA ASN A 116 -2.043 -7.648 -23.690 1.00 0.00 C ATOM 2004 C ASN A 116 -1.885 -7.303 -22.200 1.00 0.00 C ATOM 2005 O ASN A 116 -2.187 -8.110 -21.341 1.00 0.00 O ATOM 2006 CB ASN A 116 -3.516 -7.595 -24.098 1.00 0.00 C ATOM 2007 CG ASN A 116 -3.813 -6.254 -24.779 1.00 0.00 C ATOM 2008 OD1 ASN A 116 -3.418 -6.038 -25.908 1.00 0.00 O ATOM 2009 ND2 ASN A 116 -4.496 -5.335 -24.143 1.00 0.00 N ATOM 0 H ASN A 116 -2.179 -9.769 -23.468 1.00 0.00 H new ATOM 0 HA ASN A 116 -1.440 -6.932 -24.249 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -3.746 -8.417 -24.776 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -4.151 -7.718 -23.221 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -4.694 -4.443 -24.595 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -4.830 -5.512 -23.195 1.00 0.00 H new ATOM 2016 N GLY A 117 -1.416 -6.113 -21.883 1.00 0.00 N ATOM 2017 CA GLY A 117 -1.246 -5.733 -20.450 1.00 0.00 C ATOM 2018 C GLY A 117 -0.145 -6.596 -19.816 1.00 0.00 C ATOM 2019 O GLY A 117 -0.223 -7.811 -19.835 1.00 0.00 O ATOM 0 H GLY A 117 -1.147 -5.396 -22.557 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -0.985 -4.678 -20.372 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -2.184 -5.870 -19.913 1.00 0.00 H new ATOM 2023 N SER A 118 0.879 -5.985 -19.255 1.00 0.00 N ATOM 2024 CA SER A 118 1.973 -6.784 -18.626 1.00 0.00 C ATOM 2025 C SER A 118 2.489 -6.077 -17.364 1.00 0.00 C ATOM 2026 O SER A 118 3.336 -5.208 -17.440 1.00 0.00 O ATOM 2027 CB SER A 118 3.071 -6.853 -19.687 1.00 0.00 C ATOM 2028 OG SER A 118 2.551 -7.461 -20.862 1.00 0.00 O ATOM 0 H SER A 118 0.999 -4.973 -19.209 1.00 0.00 H new ATOM 0 HA SER A 118 1.637 -7.775 -18.320 1.00 0.00 H new ATOM 0 HB2 SER A 118 3.437 -5.852 -19.913 1.00 0.00 H new ATOM 0 HB3 SER A 118 3.919 -7.426 -19.312 1.00 0.00 H new ATOM 0 HG SER A 118 3.252 -7.505 -21.545 1.00 0.00 H new ATOM 2034 N THR A 119 1.989 -6.444 -16.194 1.00 0.00 N ATOM 2035 CA THR A 119 2.452 -5.789 -14.925 1.00 0.00 C ATOM 2036 C THR A 119 2.242 -4.271 -15.000 1.00 0.00 C ATOM 2037 O THR A 119 1.917 -3.739 -16.046 1.00 0.00 O ATOM 2038 CB THR A 119 3.955 -6.115 -14.795 1.00 0.00 C ATOM 2039 OG1 THR A 119 4.327 -7.082 -15.771 1.00 0.00 O ATOM 2040 CG2 THR A 119 4.249 -6.667 -13.398 1.00 0.00 C ATOM 0 H THR A 119 1.282 -7.168 -16.070 1.00 0.00 H new ATOM 0 HA THR A 119 1.890 -6.152 -14.064 1.00 0.00 H new ATOM 0 HB THR A 119 4.529 -5.202 -14.952 1.00 0.00 H new ATOM 0 HG1 THR A 119 5.205 -6.853 -16.140 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.311 -6.895 -13.313 1.00 0.00 H new ATOM 0 HG22 THR A 119 3.976 -5.924 -12.648 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.669 -7.576 -13.236 1.00 0.00 H new ATOM 2048 N CYS A 120 2.445 -3.560 -13.908 1.00 0.00 N ATOM 2049 CA CYS A 120 2.275 -2.074 -13.958 1.00 0.00 C ATOM 2050 C CYS A 120 3.602 -1.442 -14.408 1.00 0.00 C ATOM 2051 O CYS A 120 4.655 -2.025 -14.223 1.00 0.00 O ATOM 2052 CB CYS A 120 1.891 -1.618 -12.546 1.00 0.00 C ATOM 2053 SG CYS A 120 1.548 0.153 -12.592 1.00 0.00 S ATOM 0 H CYS A 120 2.716 -3.941 -13.001 1.00 0.00 H new ATOM 0 HA CYS A 120 1.501 -1.771 -14.663 1.00 0.00 H new ATOM 0 HB2 CYS A 120 1.015 -2.165 -12.196 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.700 -1.830 -11.846 1.00 0.00 H new ATOM 2058 N ILE A 121 3.569 -0.276 -15.017 1.00 0.00 N ATOM 2059 CA ILE A 121 4.855 0.348 -15.493 1.00 0.00 C ATOM 2060 C ILE A 121 5.700 0.879 -14.315 1.00 0.00 C ATOM 2061 O ILE A 121 6.915 0.891 -14.395 1.00 0.00 O ATOM 2062 CB ILE A 121 4.455 1.470 -16.484 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.690 1.930 -17.291 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.803 2.658 -15.758 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.679 2.722 -16.420 1.00 0.00 C ATOM 0 H ILE A 121 2.724 0.264 -15.204 1.00 0.00 H new ATOM 0 HA ILE A 121 5.490 -0.387 -15.987 1.00 0.00 H new ATOM 0 HB ILE A 121 3.714 1.065 -17.174 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.193 1.060 -17.713 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.367 2.549 -18.128 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.536 3.426 -16.484 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.905 2.320 -15.240 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.505 3.072 -15.034 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.533 3.027 -17.025 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.184 3.606 -16.019 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.023 2.095 -15.597 1.00 0.00 H new ATOM 2077 N CYS A 122 5.093 1.321 -13.227 1.00 0.00 N ATOM 2078 CA CYS A 122 5.931 1.845 -12.085 1.00 0.00 C ATOM 2079 C CYS A 122 6.877 0.744 -11.563 1.00 0.00 C ATOM 2080 O CYS A 122 8.003 1.025 -11.197 1.00 0.00 O ATOM 2081 CB CYS A 122 4.959 2.368 -10.994 1.00 0.00 C ATOM 2082 SG CYS A 122 4.197 1.014 -10.041 1.00 0.00 S ATOM 0 H CYS A 122 4.084 1.342 -13.081 1.00 0.00 H new ATOM 0 HA CYS A 122 6.574 2.664 -12.408 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.499 3.028 -10.315 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.177 2.964 -11.463 1.00 0.00 H new ATOM 2087 N ARG A 123 6.448 -0.504 -11.550 1.00 0.00 N ATOM 2088 CA ARG A 123 7.372 -1.601 -11.073 1.00 0.00 C ATOM 2089 C ARG A 123 8.664 -1.603 -11.915 1.00 0.00 C ATOM 2090 O ARG A 123 9.729 -1.917 -11.415 1.00 0.00 O ATOM 2091 CB ARG A 123 6.623 -2.930 -11.261 1.00 0.00 C ATOM 2092 CG ARG A 123 7.100 -3.937 -10.213 1.00 0.00 C ATOM 2093 CD ARG A 123 6.853 -5.360 -10.724 1.00 0.00 C ATOM 2094 NE ARG A 123 7.774 -6.224 -9.923 1.00 0.00 N ATOM 2095 CZ ARG A 123 9.072 -6.276 -10.186 1.00 0.00 C ATOM 2096 NH1 ARG A 123 9.605 -5.567 -11.155 1.00 0.00 N ATOM 2097 NH2 ARG A 123 9.845 -7.050 -9.469 1.00 0.00 N ATOM 0 H ARG A 123 5.519 -0.808 -11.842 1.00 0.00 H new ATOM 0 HA ARG A 123 7.649 -1.452 -10.029 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.549 -2.771 -11.166 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.800 -3.321 -12.263 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.161 -3.791 -10.009 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.570 -3.779 -9.274 1.00 0.00 H new ATOM 0 HD2 ARG A 123 5.813 -5.655 -10.583 1.00 0.00 H new ATOM 0 HD3 ARG A 123 7.065 -5.439 -11.790 1.00 0.00 H new ATOM 0 HE ARG A 123 7.396 -6.784 -9.159 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.017 -4.959 -11.725 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.607 -5.625 -11.337 1.00 0.00 H new ATOM 0 HH21 ARG A 123 9.448 -7.608 -8.713 1.00 0.00 H new ATOM 0 HH22 ARG A 123 10.845 -7.095 -9.666 1.00 0.00 H new ATOM 2111 N VAL A 124 8.585 -1.251 -13.188 1.00 0.00 N ATOM 2112 CA VAL A 124 9.827 -1.235 -14.039 1.00 0.00 C ATOM 2113 C VAL A 124 10.627 0.056 -13.776 1.00 0.00 C ATOM 2114 O VAL A 124 10.093 1.139 -13.918 1.00 0.00 O ATOM 2115 CB VAL A 124 9.347 -1.272 -15.501 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.555 -1.295 -16.439 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.504 -2.528 -15.730 1.00 0.00 C ATOM 0 H VAL A 124 7.726 -0.978 -13.666 1.00 0.00 H new ATOM 0 HA VAL A 124 10.477 -2.080 -13.814 1.00 0.00 H new ATOM 0 HB VAL A 124 8.746 -0.386 -15.705 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.212 -1.321 -17.473 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.157 -0.401 -16.279 1.00 0.00 H new ATOM 0 HG13 VAL A 124 11.158 -2.180 -16.234 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.164 -2.554 -16.765 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.106 -3.413 -15.523 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.641 -2.513 -15.065 1.00 0.00 H new ATOM 2127 N PRO A 125 11.886 -0.084 -13.407 1.00 0.00 N ATOM 2128 CA PRO A 125 12.730 1.112 -13.142 1.00 0.00 C ATOM 2129 C PRO A 125 12.992 1.896 -14.439 1.00 0.00 C ATOM 2130 O PRO A 125 12.529 1.517 -15.499 1.00 0.00 O ATOM 2131 CB PRO A 125 14.029 0.524 -12.592 1.00 0.00 C ATOM 2132 CG PRO A 125 14.070 -0.870 -13.126 1.00 0.00 C ATOM 2133 CD PRO A 125 12.640 -1.332 -13.202 1.00 0.00 C ATOM 0 HA PRO A 125 12.260 1.816 -12.456 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.894 1.099 -12.920 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.037 0.531 -11.502 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.541 -0.897 -14.109 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.655 -1.519 -12.475 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.488 -2.032 -14.023 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.333 -1.841 -12.288 1.00 0.00 H new ATOM 2141 N ARG A 126 13.733 2.984 -14.367 1.00 0.00 N ATOM 2142 CA ARG A 126 14.016 3.782 -15.614 1.00 0.00 C ATOM 2143 C ARG A 126 15.061 3.064 -16.485 1.00 0.00 C ATOM 2144 O ARG A 126 14.968 3.077 -17.698 1.00 0.00 O ATOM 2145 CB ARG A 126 14.558 5.147 -15.159 1.00 0.00 C ATOM 2146 CG ARG A 126 13.393 6.118 -14.956 1.00 0.00 C ATOM 2147 CD ARG A 126 12.912 6.637 -16.316 1.00 0.00 C ATOM 2148 NE ARG A 126 12.687 8.101 -16.113 1.00 0.00 N ATOM 2149 CZ ARG A 126 13.701 8.950 -16.044 1.00 0.00 C ATOM 2150 NH1 ARG A 126 14.945 8.542 -16.151 1.00 0.00 N ATOM 2151 NH2 ARG A 126 13.465 10.224 -15.866 1.00 0.00 N ATOM 0 H ARG A 126 14.149 3.351 -13.511 1.00 0.00 H new ATOM 0 HA ARG A 126 13.111 3.898 -16.211 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.119 5.036 -14.231 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.249 5.542 -15.904 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.576 5.617 -14.437 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.707 6.952 -14.328 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.655 6.456 -17.093 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.996 6.136 -16.628 1.00 0.00 H new ATOM 0 HE ARG A 126 11.734 8.453 -16.026 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.147 7.552 -16.291 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.709 9.215 -16.095 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.505 10.558 -15.781 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.241 10.884 -15.812 1.00 0.00 H new ATOM 2165 N ALA A 127 16.059 2.439 -15.885 1.00 0.00 N ATOM 2166 CA ALA A 127 17.102 1.731 -16.716 1.00 0.00 C ATOM 2167 C ALA A 127 16.437 0.671 -17.606 1.00 0.00 C ATOM 2168 O ALA A 127 16.790 0.522 -18.761 1.00 0.00 O ATOM 2169 CB ALA A 127 18.075 1.061 -15.732 1.00 0.00 C ATOM 0 H ALA A 127 16.196 2.388 -14.875 1.00 0.00 H new ATOM 0 HA ALA A 127 17.625 2.431 -17.367 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.850 0.534 -16.289 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.535 1.821 -15.100 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.531 0.352 -15.108 1.00 0.00 H new ATOM 2175 N GLN A 128 15.469 -0.058 -17.087 1.00 0.00 N ATOM 2176 CA GLN A 128 14.788 -1.095 -17.940 1.00 0.00 C ATOM 2177 C GLN A 128 13.954 -0.393 -19.020 1.00 0.00 C ATOM 2178 O GLN A 128 13.950 -0.805 -20.166 1.00 0.00 O ATOM 2179 CB GLN A 128 13.881 -1.916 -17.008 1.00 0.00 C ATOM 2180 CG GLN A 128 13.375 -3.156 -17.747 1.00 0.00 C ATOM 2181 CD GLN A 128 14.353 -4.316 -17.531 1.00 0.00 C ATOM 2182 OE1 GLN A 128 14.928 -4.445 -16.468 1.00 0.00 O ATOM 2183 NE2 GLN A 128 14.573 -5.176 -18.496 1.00 0.00 N ATOM 0 H GLN A 128 15.126 0.017 -16.129 1.00 0.00 H new ATOM 0 HA GLN A 128 15.509 -1.744 -18.437 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.432 -2.212 -16.115 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.039 -1.309 -16.676 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.384 -3.430 -17.384 1.00 0.00 H new ATOM 0 HG3 GLN A 128 13.277 -2.943 -18.811 1.00 0.00 H new ATOM 0 HE21 GLN A 128 14.093 -5.073 -19.390 1.00 0.00 H new ATOM 0 HE22 GLN A 128 15.224 -5.948 -18.352 1.00 0.00 H new ATOM 2192 N LEU A 129 13.260 0.674 -18.675 1.00 0.00 N ATOM 2193 CA LEU A 129 12.449 1.399 -19.715 1.00 0.00 C ATOM 2194 C LEU A 129 13.391 2.027 -20.755 1.00 0.00 C ATOM 2195 O LEU A 129 13.099 2.023 -21.936 1.00 0.00 O ATOM 2196 CB LEU A 129 11.660 2.496 -18.980 1.00 0.00 C ATOM 2197 CG LEU A 129 10.396 1.892 -18.367 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.970 2.722 -17.154 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.273 1.898 -19.406 1.00 0.00 C ATOM 0 H LEU A 129 13.220 1.068 -17.735 1.00 0.00 H new ATOM 0 HA LEU A 129 11.773 0.721 -20.236 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.277 2.942 -18.200 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.395 3.294 -19.673 1.00 0.00 H new ATOM 0 HG LEU A 129 10.598 0.868 -18.054 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.069 2.292 -16.717 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.769 2.720 -16.413 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.768 3.746 -17.467 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.372 1.468 -18.970 1.00 0.00 H new ATOM 0 HD22 LEU A 129 9.072 2.923 -19.718 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.575 1.308 -20.271 1.00 0.00 H new ATOM 2211 N GLU A 130 14.525 2.559 -20.332 1.00 0.00 N ATOM 2212 CA GLU A 130 15.474 3.175 -21.328 1.00 0.00 C ATOM 2213 C GLU A 130 15.932 2.112 -22.342 1.00 0.00 C ATOM 2214 O GLU A 130 16.069 2.397 -23.517 1.00 0.00 O ATOM 2215 CB GLU A 130 16.679 3.696 -20.530 1.00 0.00 C ATOM 2216 CG GLU A 130 16.304 5.006 -19.836 1.00 0.00 C ATOM 2217 CD GLU A 130 16.687 6.187 -20.730 1.00 0.00 C ATOM 2218 OE1 GLU A 130 17.863 6.506 -20.786 1.00 0.00 O ATOM 2219 OE2 GLU A 130 15.797 6.752 -21.345 1.00 0.00 O ATOM 0 H GLU A 130 14.829 2.593 -19.359 1.00 0.00 H new ATOM 0 HA GLU A 130 14.994 3.982 -21.881 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.987 2.956 -19.791 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.528 3.855 -21.195 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.234 5.026 -19.628 1.00 0.00 H new ATOM 0 HG3 GLU A 130 16.817 5.081 -18.877 1.00 0.00 H new ATOM 2226 N GLU A 131 16.172 0.889 -21.903 1.00 0.00 N ATOM 2227 CA GLU A 131 16.623 -0.174 -22.875 1.00 0.00 C ATOM 2228 C GLU A 131 15.579 -0.360 -23.987 1.00 0.00 C ATOM 2229 O GLU A 131 15.927 -0.570 -25.135 1.00 0.00 O ATOM 2230 CB GLU A 131 16.775 -1.476 -22.071 1.00 0.00 C ATOM 2231 CG GLU A 131 17.468 -2.532 -22.934 1.00 0.00 C ATOM 2232 CD GLU A 131 16.946 -3.920 -22.560 1.00 0.00 C ATOM 2233 OE1 GLU A 131 17.191 -4.342 -21.442 1.00 0.00 O ATOM 2234 OE2 GLU A 131 16.311 -4.538 -23.399 1.00 0.00 O ATOM 0 H GLU A 131 16.078 0.585 -20.934 1.00 0.00 H new ATOM 0 HA GLU A 131 17.563 0.108 -23.349 1.00 0.00 H new ATOM 0 HB2 GLU A 131 17.356 -1.292 -21.167 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.796 -1.836 -21.753 1.00 0.00 H new ATOM 0 HG2 GLU A 131 17.281 -2.334 -23.989 1.00 0.00 H new ATOM 0 HG3 GLU A 131 18.547 -2.486 -22.787 1.00 0.00 H new ATOM 2241 N GLU A 132 14.302 -0.286 -23.665 1.00 0.00 N ATOM 2242 CA GLU A 132 13.254 -0.463 -24.733 1.00 0.00 C ATOM 2243 C GLU A 132 13.352 0.673 -25.762 1.00 0.00 C ATOM 2244 O GLU A 132 13.225 0.446 -26.951 1.00 0.00 O ATOM 2245 CB GLU A 132 11.888 -0.423 -24.028 1.00 0.00 C ATOM 2246 CG GLU A 132 11.525 -1.826 -23.538 1.00 0.00 C ATOM 2247 CD GLU A 132 10.779 -2.578 -24.641 1.00 0.00 C ATOM 2248 OE1 GLU A 132 11.407 -2.907 -25.635 1.00 0.00 O ATOM 2249 OE2 GLU A 132 9.593 -2.810 -24.477 1.00 0.00 O ATOM 0 H GLU A 132 13.944 -0.114 -22.725 1.00 0.00 H new ATOM 0 HA GLU A 132 13.392 -1.405 -25.264 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.921 0.270 -23.187 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.124 -0.057 -24.713 1.00 0.00 H new ATOM 0 HG2 GLU A 132 12.428 -2.370 -23.260 1.00 0.00 H new ATOM 0 HG3 GLU A 132 10.904 -1.761 -22.645 1.00 0.00 H new ATOM 2256 N ALA A 133 13.583 1.896 -25.323 1.00 0.00 N ATOM 2257 CA ALA A 133 13.690 3.031 -26.310 1.00 0.00 C ATOM 2258 C ALA A 133 14.939 2.841 -27.183 1.00 0.00 C ATOM 2259 O ALA A 133 14.897 3.059 -28.380 1.00 0.00 O ATOM 2260 CB ALA A 133 13.804 4.328 -25.491 1.00 0.00 C ATOM 0 H ALA A 133 13.700 2.155 -24.343 1.00 0.00 H new ATOM 0 HA ALA A 133 12.822 3.066 -26.968 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.884 5.179 -26.167 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.918 4.443 -24.866 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.691 4.282 -24.859 1.00 0.00 H new ATOM 2266 N ARG A 134 16.048 2.429 -26.602 1.00 0.00 N ATOM 2267 CA ARG A 134 17.289 2.221 -27.431 1.00 0.00 C ATOM 2268 C ARG A 134 17.063 1.095 -28.455 1.00 0.00 C ATOM 2269 O ARG A 134 17.577 1.150 -29.558 1.00 0.00 O ATOM 2270 CB ARG A 134 18.414 1.830 -26.457 1.00 0.00 C ATOM 2271 CG ARG A 134 18.775 3.034 -25.583 1.00 0.00 C ATOM 2272 CD ARG A 134 19.709 3.968 -26.356 1.00 0.00 C ATOM 2273 NE ARG A 134 18.825 5.058 -26.870 1.00 0.00 N ATOM 2274 CZ ARG A 134 18.376 6.015 -26.073 1.00 0.00 C ATOM 2275 NH1 ARG A 134 18.690 6.045 -24.797 1.00 0.00 N ATOM 2276 NH2 ARG A 134 17.603 6.951 -26.558 1.00 0.00 N ATOM 0 H ARG A 134 16.148 2.230 -25.607 1.00 0.00 H new ATOM 0 HA ARG A 134 17.544 3.125 -27.983 1.00 0.00 H new ATOM 0 HB2 ARG A 134 18.095 0.996 -25.832 1.00 0.00 H new ATOM 0 HB3 ARG A 134 19.290 1.495 -27.012 1.00 0.00 H new ATOM 0 HG2 ARG A 134 17.871 3.568 -25.290 1.00 0.00 H new ATOM 0 HG3 ARG A 134 19.258 2.698 -24.665 1.00 0.00 H new ATOM 0 HD2 ARG A 134 20.492 4.366 -25.711 1.00 0.00 H new ATOM 0 HD3 ARG A 134 20.205 3.443 -27.173 1.00 0.00 H new ATOM 0 HE ARG A 134 18.562 5.065 -27.856 1.00 0.00 H new ATOM 0 HH11 ARG A 134 19.291 5.321 -24.403 1.00 0.00 H new ATOM 0 HH12 ARG A 134 18.333 6.792 -24.201 1.00 0.00 H new ATOM 0 HH21 ARG A 134 17.349 6.941 -27.546 1.00 0.00 H new ATOM 0 HH22 ARG A 134 17.254 7.691 -25.949 1.00 0.00 H new ATOM 2290 N LYS A 135 16.301 0.071 -28.110 1.00 0.00 N ATOM 2291 CA LYS A 135 16.065 -1.047 -29.093 1.00 0.00 C ATOM 2292 C LYS A 135 15.087 -0.610 -30.200 1.00 0.00 C ATOM 2293 O LYS A 135 15.193 -1.064 -31.325 1.00 0.00 O ATOM 2294 CB LYS A 135 15.468 -2.216 -28.294 1.00 0.00 C ATOM 2295 CG LYS A 135 16.453 -2.646 -27.202 1.00 0.00 C ATOM 2296 CD LYS A 135 17.310 -3.806 -27.712 1.00 0.00 C ATOM 2297 CE LYS A 135 16.678 -5.134 -27.288 1.00 0.00 C ATOM 2298 NZ LYS A 135 17.744 -6.152 -27.505 1.00 0.00 N ATOM 0 H LYS A 135 15.840 -0.037 -27.206 1.00 0.00 H new ATOM 0 HA LYS A 135 16.997 -1.332 -29.581 1.00 0.00 H new ATOM 0 HB2 LYS A 135 14.520 -1.918 -27.846 1.00 0.00 H new ATOM 0 HB3 LYS A 135 15.257 -3.054 -28.958 1.00 0.00 H new ATOM 0 HG2 LYS A 135 17.089 -1.807 -26.921 1.00 0.00 H new ATOM 0 HG3 LYS A 135 15.910 -2.948 -26.307 1.00 0.00 H new ATOM 0 HD2 LYS A 135 17.393 -3.761 -28.798 1.00 0.00 H new ATOM 0 HD3 LYS A 135 18.321 -3.728 -27.312 1.00 0.00 H new ATOM 0 HE2 LYS A 135 16.364 -5.107 -26.245 1.00 0.00 H new ATOM 0 HE3 LYS A 135 15.792 -5.357 -27.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 17.387 -7.091 -27.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 18.018 -6.159 -28.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 18.572 -5.917 -26.922 1.00 0.00 H new ATOM 2312 N LYS A 136 14.138 0.262 -29.907 1.00 0.00 N ATOM 2313 CA LYS A 136 13.175 0.696 -30.980 1.00 0.00 C ATOM 2314 C LYS A 136 13.562 2.066 -31.578 1.00 0.00 C ATOM 2315 O LYS A 136 12.727 2.742 -32.148 1.00 0.00 O ATOM 2316 CB LYS A 136 11.805 0.783 -30.297 1.00 0.00 C ATOM 2317 CG LYS A 136 11.399 -0.601 -29.787 1.00 0.00 C ATOM 2318 CD LYS A 136 9.882 -0.765 -29.904 1.00 0.00 C ATOM 2319 CE LYS A 136 9.431 -1.964 -29.067 1.00 0.00 C ATOM 2320 NZ LYS A 136 10.103 -3.140 -29.687 1.00 0.00 N ATOM 0 H LYS A 136 13.992 0.683 -28.990 1.00 0.00 H new ATOM 0 HA LYS A 136 13.179 -0.010 -31.810 1.00 0.00 H new ATOM 0 HB2 LYS A 136 11.844 1.490 -29.468 1.00 0.00 H new ATOM 0 HB3 LYS A 136 11.060 1.156 -31.000 1.00 0.00 H new ATOM 0 HG2 LYS A 136 11.904 -1.375 -30.364 1.00 0.00 H new ATOM 0 HG3 LYS A 136 11.709 -0.723 -28.749 1.00 0.00 H new ATOM 0 HD2 LYS A 136 9.380 0.140 -29.561 1.00 0.00 H new ATOM 0 HD3 LYS A 136 9.601 -0.910 -30.947 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.721 -1.848 -28.023 1.00 0.00 H new ATOM 0 HE3 LYS A 136 8.347 -2.073 -29.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 9.595 -4.009 -29.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 10.100 -3.036 -30.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 11.084 -3.198 -29.348 1.00 0.00 H new ATOM 2334 N GLY A 137 14.814 2.486 -31.475 1.00 0.00 N ATOM 2335 CA GLY A 137 15.223 3.804 -32.061 1.00 0.00 C ATOM 2336 C GLY A 137 14.289 4.929 -31.578 1.00 0.00 C ATOM 2337 O GLY A 137 13.840 5.741 -32.367 1.00 0.00 O ATOM 0 H GLY A 137 15.562 1.970 -31.011 1.00 0.00 H new ATOM 0 HA2 GLY A 137 16.251 4.031 -31.777 1.00 0.00 H new ATOM 0 HA3 GLY A 137 15.199 3.747 -33.149 1.00 0.00 H new ATOM 2341 N THR A 138 13.997 4.992 -30.296 1.00 0.00 N ATOM 2342 CA THR A 138 13.098 6.073 -29.788 1.00 0.00 C ATOM 2343 C THR A 138 13.530 6.508 -28.377 1.00 0.00 C ATOM 2344 O THR A 138 14.633 6.216 -27.951 1.00 0.00 O ATOM 2345 CB THR A 138 11.693 5.455 -29.771 1.00 0.00 C ATOM 2346 OG1 THR A 138 10.760 6.421 -29.309 1.00 0.00 O ATOM 2347 CG2 THR A 138 11.665 4.237 -28.845 1.00 0.00 C ATOM 0 H THR A 138 14.342 4.344 -29.587 1.00 0.00 H new ATOM 0 HA THR A 138 13.133 6.966 -30.412 1.00 0.00 H new ATOM 0 HB THR A 138 11.429 5.140 -30.781 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.862 6.029 -29.299 1.00 0.00 H new ATOM 0 HG21 THR A 138 10.664 3.806 -28.840 1.00 0.00 H new ATOM 0 HG22 THR A 138 12.378 3.493 -29.200 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.933 4.543 -27.834 1.00 0.00 H new ATOM 2355 N GLN A 139 12.680 7.204 -27.648 1.00 0.00 N ATOM 2356 CA GLN A 139 13.063 7.647 -26.273 1.00 0.00 C ATOM 2357 C GLN A 139 11.942 7.315 -25.277 1.00 0.00 C ATOM 2358 O GLN A 139 10.864 6.911 -25.668 1.00 0.00 O ATOM 2359 CB GLN A 139 13.253 9.159 -26.382 1.00 0.00 C ATOM 2360 CG GLN A 139 14.631 9.457 -26.977 1.00 0.00 C ATOM 2361 CD GLN A 139 14.568 10.758 -27.787 1.00 0.00 C ATOM 2362 OE1 GLN A 139 14.168 10.748 -28.935 1.00 0.00 O ATOM 2363 NE2 GLN A 139 14.947 11.888 -27.241 1.00 0.00 N ATOM 0 H GLN A 139 11.745 7.480 -27.949 1.00 0.00 H new ATOM 0 HA GLN A 139 13.964 7.148 -25.915 1.00 0.00 H new ATOM 0 HB2 GLN A 139 12.473 9.590 -27.009 1.00 0.00 H new ATOM 0 HB3 GLN A 139 13.162 9.620 -25.398 1.00 0.00 H new ATOM 0 HG2 GLN A 139 15.371 9.547 -26.181 1.00 0.00 H new ATOM 0 HG3 GLN A 139 14.949 8.633 -27.616 1.00 0.00 H new ATOM 0 HE21 GLN A 139 15.283 11.902 -26.278 1.00 0.00 H new ATOM 0 HE22 GLN A 139 14.905 12.754 -27.779 1.00 0.00 H new ATOM 2372 N VAL A 140 12.184 7.481 -23.992 1.00 0.00 N ATOM 2373 CA VAL A 140 11.120 7.170 -22.984 1.00 0.00 C ATOM 2374 C VAL A 140 11.397 7.895 -21.652 1.00 0.00 C ATOM 2375 O VAL A 140 12.511 8.312 -21.392 1.00 0.00 O ATOM 2376 CB VAL A 140 11.180 5.649 -22.797 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.564 5.242 -22.274 1.00 0.00 C ATOM 2378 CG2 VAL A 140 10.108 5.218 -21.791 1.00 0.00 C ATOM 0 H VAL A 140 13.066 7.816 -23.604 1.00 0.00 H new ATOM 0 HA VAL A 140 10.136 7.502 -23.316 1.00 0.00 H new ATOM 0 HB VAL A 140 11.001 5.162 -23.755 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.600 4.160 -22.143 1.00 0.00 H new ATOM 0 HG12 VAL A 140 13.327 5.547 -22.990 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.749 5.729 -21.317 1.00 0.00 H new ATOM 0 HG21 VAL A 140 10.149 4.137 -21.657 1.00 0.00 H new ATOM 0 HG22 VAL A 140 10.288 5.710 -20.835 1.00 0.00 H new ATOM 0 HG23 VAL A 140 9.124 5.500 -22.165 1.00 0.00 H new ATOM 2388 N SER A 141 10.396 8.043 -20.808 1.00 0.00 N ATOM 2389 CA SER A 141 10.622 8.739 -19.499 1.00 0.00 C ATOM 2390 C SER A 141 9.414 8.554 -18.562 1.00 0.00 C ATOM 2391 O SER A 141 8.438 9.274 -18.657 1.00 0.00 O ATOM 2392 CB SER A 141 10.794 10.207 -19.871 1.00 0.00 C ATOM 2393 OG SER A 141 10.876 10.988 -18.685 1.00 0.00 O ATOM 0 H SER A 141 9.444 7.715 -20.969 1.00 0.00 H new ATOM 0 HA SER A 141 11.485 8.341 -18.965 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.695 10.339 -20.470 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.955 10.540 -20.482 1.00 0.00 H new ATOM 0 HG SER A 141 10.988 11.932 -18.922 1.00 0.00 H new ATOM 2399 N PHE A 142 9.470 7.595 -17.659 1.00 0.00 N ATOM 2400 CA PHE A 142 8.318 7.378 -16.726 1.00 0.00 C ATOM 2401 C PHE A 142 8.576 8.078 -15.377 1.00 0.00 C ATOM 2402 O PHE A 142 9.703 8.360 -15.016 1.00 0.00 O ATOM 2403 CB PHE A 142 8.215 5.852 -16.536 1.00 0.00 C ATOM 2404 CG PHE A 142 7.216 5.525 -15.440 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.842 5.504 -15.712 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.673 5.254 -14.147 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.932 5.208 -14.685 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.766 4.962 -13.131 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.399 4.938 -13.394 1.00 0.00 C ATOM 0 H PHE A 142 10.258 6.960 -17.531 1.00 0.00 H new ATOM 0 HA PHE A 142 7.393 7.794 -17.126 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.907 5.382 -17.470 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.193 5.443 -16.280 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.484 5.715 -16.709 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.732 5.271 -13.935 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.872 5.189 -14.891 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.125 4.753 -12.134 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.700 4.711 -12.603 1.00 0.00 H new ATOM 2419 N HIS A 143 7.528 8.332 -14.625 1.00 0.00 N ATOM 2420 CA HIS A 143 7.683 8.982 -13.291 1.00 0.00 C ATOM 2421 C HIS A 143 6.744 8.288 -12.292 1.00 0.00 C ATOM 2422 O HIS A 143 7.181 7.702 -11.320 1.00 0.00 O ATOM 2423 CB HIS A 143 7.268 10.438 -13.504 1.00 0.00 C ATOM 2424 CG HIS A 143 8.405 11.198 -14.129 1.00 0.00 C ATOM 2425 ND1 HIS A 143 8.200 12.170 -15.097 1.00 0.00 N ATOM 2426 CD2 HIS A 143 9.763 11.141 -13.935 1.00 0.00 C ATOM 2427 CE1 HIS A 143 9.406 12.653 -15.447 1.00 0.00 C ATOM 2428 NE2 HIS A 143 10.394 12.061 -14.769 1.00 0.00 N ATOM 0 H HIS A 143 6.566 8.113 -14.885 1.00 0.00 H new ATOM 0 HA HIS A 143 8.697 8.915 -12.897 1.00 0.00 H new ATOM 0 HB2 HIS A 143 6.388 10.486 -14.146 1.00 0.00 H new ATOM 0 HB3 HIS A 143 6.993 10.892 -12.552 1.00 0.00 H new ATOM 0 HD2 HIS A 143 10.265 10.483 -13.241 1.00 0.00 H new ATOM 0 HE1 HIS A 143 9.557 13.426 -16.186 1.00 0.00 H new ATOM 0 HE2 HIS A 143 11.395 12.244 -14.846 1.00 0.00 H new ATOM 2436 N GLN A 144 5.455 8.335 -12.544 1.00 0.00 N ATOM 2437 CA GLN A 144 4.476 7.665 -11.636 1.00 0.00 C ATOM 2438 C GLN A 144 3.384 6.985 -12.480 1.00 0.00 C ATOM 2439 O GLN A 144 3.085 7.431 -13.574 1.00 0.00 O ATOM 2440 CB GLN A 144 3.879 8.789 -10.777 1.00 0.00 C ATOM 2441 CG GLN A 144 3.268 9.874 -11.671 1.00 0.00 C ATOM 2442 CD GLN A 144 4.291 10.995 -11.891 1.00 0.00 C ATOM 2443 OE1 GLN A 144 4.658 11.281 -13.013 1.00 0.00 O ATOM 2444 NE2 GLN A 144 4.774 11.651 -10.863 1.00 0.00 N ATOM 0 H GLN A 144 5.041 8.812 -13.345 1.00 0.00 H new ATOM 0 HA GLN A 144 4.937 6.897 -11.015 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.116 8.383 -10.113 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.653 9.223 -10.144 1.00 0.00 H new ATOM 0 HG2 GLN A 144 2.971 9.446 -12.628 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.367 10.276 -11.208 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.469 11.415 -9.919 1.00 0.00 H new ATOM 0 HE22 GLN A 144 5.454 12.397 -11.008 1.00 0.00 H new ATOM 2453 N CYS A 145 2.789 5.914 -11.997 1.00 0.00 N ATOM 2454 CA CYS A 145 1.722 5.234 -12.814 1.00 0.00 C ATOM 2455 C CYS A 145 0.326 5.772 -12.456 1.00 0.00 C ATOM 2456 O CYS A 145 0.113 6.281 -11.371 1.00 0.00 O ATOM 2457 CB CYS A 145 1.823 3.718 -12.538 1.00 0.00 C ATOM 2458 SG CYS A 145 1.413 3.319 -10.810 1.00 0.00 S ATOM 0 H CYS A 145 2.989 5.488 -11.092 1.00 0.00 H new ATOM 0 HA CYS A 145 1.871 5.435 -13.875 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.149 3.181 -13.205 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.833 3.374 -12.761 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.624 5.667 -13.365 1.00 0.00 N ATOM 2464 CA VAL A 146 -2.007 6.184 -13.065 1.00 0.00 C ATOM 2465 C VAL A 146 -2.768 5.251 -12.099 1.00 0.00 C ATOM 2466 O VAL A 146 -3.685 5.688 -11.432 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.746 6.292 -14.415 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -2.940 4.901 -15.036 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -4.113 6.946 -14.190 1.00 0.00 C ATOM 0 H VAL A 146 -0.505 5.252 -14.289 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.947 7.153 -12.570 1.00 0.00 H new ATOM 0 HB VAL A 146 -2.150 6.898 -15.097 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.463 4.997 -15.988 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -1.967 4.438 -15.202 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.528 4.280 -14.360 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -4.640 7.025 -15.141 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -4.698 6.338 -13.500 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.975 7.942 -13.768 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.409 3.976 -12.009 1.00 0.00 N ATOM 2480 CA HIS A 147 -3.150 3.055 -11.063 1.00 0.00 C ATOM 2481 C HIS A 147 -3.206 3.680 -9.654 1.00 0.00 C ATOM 2482 O HIS A 147 -4.273 3.888 -9.109 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.364 1.727 -11.024 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.362 1.057 -12.385 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.139 1.498 -13.456 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.671 -0.038 -12.860 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -2.895 0.683 -14.498 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.011 -0.268 -14.189 1.00 0.00 N ATOM 0 H HIS A 147 -1.652 3.543 -12.538 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.175 2.892 -11.397 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.339 1.916 -10.706 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.808 1.059 -10.286 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -0.971 -0.628 -12.287 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.359 0.786 -15.468 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.659 -1.007 -14.798 1.00 0.00 H new ATOM 2496 N CYS A 148 -2.068 3.989 -9.069 1.00 0.00 N ATOM 2497 CA CYS A 148 -2.061 4.605 -7.711 1.00 0.00 C ATOM 2498 C CYS A 148 -1.189 5.880 -7.703 1.00 0.00 C ATOM 2499 O CYS A 148 -0.835 6.397 -8.746 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.465 3.516 -6.804 1.00 0.00 C ATOM 2501 SG CYS A 148 0.293 3.243 -7.191 1.00 0.00 S ATOM 0 H CYS A 148 -1.146 3.838 -9.479 1.00 0.00 H new ATOM 0 HA CYS A 148 -3.053 4.915 -7.381 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.571 3.808 -5.759 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -2.019 2.586 -6.932 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.815 6.366 -6.538 1.00 0.00 N ATOM 2507 CA GLY A 149 0.061 7.573 -6.471 1.00 0.00 C ATOM 2508 C GLY A 149 1.490 7.100 -6.165 1.00 0.00 C ATOM 2509 O GLY A 149 2.049 7.424 -5.135 1.00 0.00 O ATOM 0 H GLY A 149 -1.081 5.975 -5.634 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.033 8.118 -7.414 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -0.289 8.256 -5.697 1.00 0.00 H new ATOM 2513 N CYS A 150 2.080 6.316 -7.049 1.00 0.00 N ATOM 2514 CA CYS A 150 3.468 5.805 -6.796 1.00 0.00 C ATOM 2515 C CYS A 150 4.484 6.655 -7.571 1.00 0.00 C ATOM 2516 O CYS A 150 4.203 7.113 -8.659 1.00 0.00 O ATOM 2517 CB CYS A 150 3.438 4.346 -7.302 1.00 0.00 C ATOM 2518 SG CYS A 150 5.090 3.599 -7.317 1.00 0.00 S ATOM 0 H CYS A 150 1.660 6.012 -7.928 1.00 0.00 H new ATOM 0 HA CYS A 150 3.764 5.858 -5.748 1.00 0.00 H new ATOM 0 HB2 CYS A 150 2.779 3.755 -6.666 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.019 4.320 -8.308 1.00 0.00 H new ATOM 2523 N ARG A 151 5.668 6.859 -7.029 1.00 0.00 N ATOM 2524 CA ARG A 151 6.693 7.671 -7.759 1.00 0.00 C ATOM 2525 C ARG A 151 7.711 6.738 -8.428 1.00 0.00 C ATOM 2526 O ARG A 151 8.903 6.973 -8.372 1.00 0.00 O ATOM 2527 CB ARG A 151 7.376 8.543 -6.699 1.00 0.00 C ATOM 2528 CG ARG A 151 6.336 9.441 -6.025 1.00 0.00 C ATOM 2529 CD ARG A 151 7.037 10.638 -5.379 1.00 0.00 C ATOM 2530 NE ARG A 151 6.216 10.960 -4.172 1.00 0.00 N ATOM 2531 CZ ARG A 151 6.218 10.171 -3.108 1.00 0.00 C ATOM 2532 NH1 ARG A 151 6.935 9.072 -3.071 1.00 0.00 N ATOM 2533 NH2 ARG A 151 5.491 10.490 -2.068 1.00 0.00 N ATOM 0 H ARG A 151 5.963 6.500 -6.121 1.00 0.00 H new ATOM 0 HA ARG A 151 6.246 8.284 -8.542 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.864 7.913 -5.955 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.153 9.152 -7.160 1.00 0.00 H new ATOM 0 HG2 ARG A 151 5.607 9.785 -6.759 1.00 0.00 H new ATOM 0 HG3 ARG A 151 5.787 8.877 -5.271 1.00 0.00 H new ATOM 0 HD2 ARG A 151 8.063 10.394 -5.105 1.00 0.00 H new ATOM 0 HD3 ARG A 151 7.083 11.485 -6.063 1.00 0.00 H new ATOM 0 HE ARG A 151 5.643 11.804 -4.168 1.00 0.00 H new ATOM 0 HH11 ARG A 151 7.507 8.809 -3.873 1.00 0.00 H new ATOM 0 HH12 ARG A 151 6.920 8.481 -2.240 1.00 0.00 H new ATOM 0 HH21 ARG A 151 4.928 11.341 -2.081 1.00 0.00 H new ATOM 0 HH22 ARG A 151 5.487 9.888 -1.245 1.00 0.00 H new ATOM 2547 N GLY A 152 7.250 5.678 -9.063 1.00 0.00 N ATOM 2548 CA GLY A 152 8.187 4.737 -9.731 1.00 0.00 C ATOM 2549 C GLY A 152 8.865 3.844 -8.682 1.00 0.00 C ATOM 2550 O GLY A 152 9.841 4.236 -8.070 1.00 0.00 O ATOM 0 H GLY A 152 6.263 5.433 -9.142 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.647 4.122 -10.451 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.940 5.294 -10.289 1.00 0.00 H new ATOM 2554 N CYS A 153 8.360 2.644 -8.472 1.00 0.00 N ATOM 2555 CA CYS A 153 8.991 1.735 -7.464 1.00 0.00 C ATOM 2556 C CYS A 153 9.678 0.550 -8.172 1.00 0.00 C ATOM 2557 O CYS A 153 9.070 -0.148 -8.960 1.00 0.00 O ATOM 2558 CB CYS A 153 7.847 1.279 -6.533 1.00 0.00 C ATOM 2559 SG CYS A 153 6.652 0.216 -7.399 1.00 0.00 S ATOM 0 H CYS A 153 7.546 2.262 -8.953 1.00 0.00 H new ATOM 0 HA CYS A 153 9.771 2.232 -6.888 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.264 0.739 -5.683 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.333 2.153 -6.134 1.00 0.00 H new ATOM 2564 N ALA A 154 10.948 0.327 -7.904 1.00 0.00 N ATOM 2565 CA ALA A 154 11.673 -0.799 -8.565 1.00 0.00 C ATOM 2566 C ALA A 154 12.642 -1.453 -7.571 1.00 0.00 C ATOM 2567 O ALA A 154 13.329 -0.771 -6.835 1.00 0.00 O ATOM 2568 CB ALA A 154 12.442 -0.149 -9.714 1.00 0.00 C ATOM 0 H ALA A 154 11.509 0.879 -7.255 1.00 0.00 H new ATOM 0 HA ALA A 154 10.999 -1.581 -8.916 1.00 0.00 H new ATOM 0 HB1 ALA A 154 13.004 -0.912 -10.253 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.740 0.334 -10.394 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.131 0.596 -9.315 1.00 0.00 H new ATOM 2574 N SER A 155 12.714 -2.769 -7.545 1.00 0.00 N ATOM 2575 CA SER A 155 13.654 -3.443 -6.595 1.00 0.00 C ATOM 2576 C SER A 155 14.870 -3.980 -7.364 1.00 0.00 C ATOM 2577 O SER A 155 15.328 -5.080 -7.121 1.00 0.00 O ATOM 2578 CB SER A 155 12.860 -4.592 -5.967 1.00 0.00 C ATOM 2579 OG SER A 155 11.497 -4.200 -5.824 1.00 0.00 O ATOM 0 H SER A 155 12.167 -3.396 -8.135 1.00 0.00 H new ATOM 0 HA SER A 155 14.027 -2.760 -5.832 1.00 0.00 H new ATOM 0 HB2 SER A 155 12.931 -5.482 -6.592 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.280 -4.851 -4.995 1.00 0.00 H new ATOM 0 HG SER A 155 10.920 -4.989 -5.894 1.00 0.00 H new ATOM 2585 N THR A 156 15.396 -3.211 -8.297 1.00 0.00 N ATOM 2586 CA THR A 156 16.581 -3.683 -9.081 1.00 0.00 C ATOM 2587 C THR A 156 17.350 -2.489 -9.673 1.00 0.00 C ATOM 2588 O THR A 156 18.534 -2.333 -9.436 1.00 0.00 O ATOM 2589 CB THR A 156 15.997 -4.551 -10.199 1.00 0.00 C ATOM 2590 OG1 THR A 156 14.901 -5.301 -9.692 1.00 0.00 O ATOM 2591 CG2 THR A 156 17.073 -5.506 -10.718 1.00 0.00 C ATOM 0 H THR A 156 15.055 -2.282 -8.545 1.00 0.00 H new ATOM 0 HA THR A 156 17.288 -4.234 -8.460 1.00 0.00 H new ATOM 0 HB THR A 156 15.655 -3.913 -11.014 1.00 0.00 H new ATOM 0 HG1 THR A 156 14.526 -5.856 -10.407 1.00 0.00 H new ATOM 0 HG21 THR A 156 16.658 -6.124 -11.514 1.00 0.00 H new ATOM 0 HG22 THR A 156 17.913 -4.931 -11.106 1.00 0.00 H new ATOM 0 HG23 THR A 156 17.416 -6.145 -9.904 1.00 0.00 H new ATOM 2599 N ASP A 157 16.689 -1.648 -10.437 1.00 0.00 N ATOM 2600 CA ASP A 157 17.388 -0.470 -11.037 1.00 0.00 C ATOM 2601 C ASP A 157 16.543 0.794 -10.858 1.00 0.00 C ATOM 2602 O ASP A 157 15.742 0.822 -9.939 1.00 0.00 O ATOM 2603 CB ASP A 157 17.538 -0.811 -12.520 1.00 0.00 C ATOM 2604 CG ASP A 157 18.696 -1.792 -12.705 1.00 0.00 C ATOM 2605 OD1 ASP A 157 19.825 -1.337 -12.790 1.00 0.00 O ATOM 2606 OD2 ASP A 157 18.434 -2.983 -12.758 1.00 0.00 O ATOM 2607 OXT ASP A 157 16.711 1.711 -11.645 1.00 0.00 O ATOM 0 H ASP A 157 15.699 -1.728 -10.669 1.00 0.00 H new ATOM 0 HA ASP A 157 18.351 -0.276 -10.565 1.00 0.00 H new ATOM 0 HB2 ASP A 157 16.614 -1.248 -12.899 1.00 0.00 H new ATOM 0 HB3 ASP A 157 17.721 0.096 -13.096 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 0.868 1.032 -6.979 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 4.706 1.376 -7.816 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 1.950 1.090 -10.547 1.00 0.00 ZN