USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1149 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 131 LYS NZ :NH3+ 158:sc= 1.29 (180deg=0) USER MOD Set 1.2: A 156 GLN : amide:sc= 1.43 K(o=2.7,f=-7.1!) USER MOD Set 2.1: A 116 ASN : amide:sc= 1.11 K(o=0.38,f=-1.6) USER MOD Set 2.2: A 117 GLN : amide:sc= -0.736 K(o=0.38,f=-1.6) USER MOD Set 3.1: A 41 SER OG : rot -42:sc= 1.06 USER MOD Set 3.2: A 76 LYS NZ :NH3+ -138:sc= 2.99 (180deg=0.595) USER MOD Set 4.1: A 40 THR OG1 : rot 99:sc= -0.0216 USER MOD Set 4.2: A 53 TYR OH : rot 24:sc= 0.0916 USER MOD Set 4.3: A 106 HIS : no HE2:sc= -0.132 K(o=-0.062,f=-4!) USER MOD Set 5.1: A 20 HIS : no HE2:sc= 1.08 K(o=1.9,f=-4.2!) USER MOD Set 5.2: A 21 SER OG : rot -65:sc= 0.769 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -112:sc= 0.161 (180deg=0.00106) USER MOD Single : A 2 GLN : amide:sc= -0.801 X(o=-0.8,f=-0.91) USER MOD Single : A 3 SER OG : rot 42:sc= 1.21 USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 SER OG : rot 44:sc= 0.696 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.0496 USER MOD Single : A 14 GLN : amide:sc= -0.222 K(o=-0.22,f=-1.3) USER MOD Single : A 16 GLN : amide:sc= 0.644 K(o=0.64,f=-0.51) USER MOD Single : A 18 SER OG : rot 84:sc= 1.29 USER MOD Single : A 23 LYS NZ :NH3+ 156:sc= 2.28 (180deg=1.48) USER MOD Single : A 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 2.05 K(o=2,f=-0.75) USER MOD Single : A 39 HIS : no HE2:sc= 0.458 K(o=0.46,f=-4.3!) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot -50:sc= 0.181 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0.0463 USER MOD Single : A 66 LYS NZ :NH3+ -127:sc= 0.87 (180deg=-0.76) USER MOD Single : A 68 THR OG1 : rot 82:sc= 0.975 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.423 USER MOD Single : A 77 GLN : amide:sc= -3.42! K(o=-3.4!,f=-1.1) USER MOD Single : A 79 ASN : amide:sc= 0.0632 K(o=0.063,f=-5.4!) USER MOD Single : A 81 LYS NZ :NH3+ -175:sc= 1.16 (180deg=1.02) USER MOD Single : A 84 HIS : no HD1:sc= -0.295 X(o=-0.3,f=-0.3) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= 2.09 K(o=2.1,f=-8.2!) USER MOD Single : A 100 LYS NZ :NH3+ -175:sc= -0.0545 (180deg=-0.223) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 45:sc= 0.654 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot -15:sc= -0.0601 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 142:sc= 1.26 USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -0.615 X(o=-0.61,f=-0.38) USER MOD Single : A 138 SER OG : rot -4:sc= 0.407 USER MOD Single : A 142 LYS NZ :NH3+ -114:sc= -0.111 (180deg=-1.24) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0.309 USER MOD Single : A 145 ASN : amide:sc= 0.991 K(o=0.99,f=-0.073) USER MOD Single : A 149 HIS : no HE2:sc= 0.487 K(o=0.49,f=-7.3!) USER MOD Single : A 155 LYS NZ :NH3+ -153:sc= 1.24 (180deg=1.08) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -35.426 5.130 3.119 1.00 62.28 N ATOM 2 CA MET A 1 -35.975 3.981 3.857 1.00 62.04 C ATOM 3 C MET A 1 -35.963 2.807 2.890 1.00 60.25 C ATOM 4 O MET A 1 -36.051 3.063 1.690 1.00 59.91 O ATOM 5 CB MET A 1 -37.403 4.257 4.353 1.00 63.50 C ATOM 6 CG MET A 1 -37.477 5.300 5.475 1.00 64.95 C ATOM 7 SD MET A 1 -36.603 4.837 6.990 1.00 65.65 S ATOM 8 CE MET A 1 -36.995 6.254 8.037 1.00 67.55 C ATOM 0 H1 MET A 1 -34.503 5.392 3.521 1.00 62.28 H new ATOM 0 H2 MET A 1 -35.308 4.875 2.118 1.00 62.28 H new ATOM 0 H3 MET A 1 -36.078 5.936 3.197 1.00 62.28 H new ATOM 0 HA MET A 1 -35.377 3.776 4.745 1.00 62.04 H new ATOM 0 HB2 MET A 1 -38.010 4.596 3.514 1.00 63.50 H new ATOM 0 HB3 MET A 1 -37.841 3.324 4.707 1.00 63.50 H new ATOM 0 HG2 MET A 1 -37.067 6.240 5.107 1.00 64.95 H new ATOM 0 HG3 MET A 1 -38.524 5.482 5.716 1.00 64.95 H new ATOM 0 HE1 MET A 1 -36.529 6.125 9.014 1.00 67.55 H new ATOM 0 HE2 MET A 1 -36.618 7.165 7.572 1.00 67.55 H new ATOM 0 HE3 MET A 1 -38.076 6.329 8.158 1.00 67.55 H new ATOM 20 N GLN A 2 -35.805 1.577 3.395 1.00 59.15 N ATOM 21 CA GLN A 2 -35.567 0.381 2.592 1.00 57.29 C ATOM 22 C GLN A 2 -34.283 0.525 1.755 1.00 55.52 C ATOM 23 O GLN A 2 -33.622 1.564 1.779 1.00 55.87 O ATOM 24 CB GLN A 2 -36.797 0.019 1.734 1.00 57.64 C ATOM 25 CG GLN A 2 -38.026 -0.390 2.559 1.00 58.28 C ATOM 26 CD GLN A 2 -38.631 0.757 3.364 1.00 59.80 C ATOM 27 OE1 GLN A 2 -38.962 1.803 2.816 1.00 60.53 O ATOM 28 NE2 GLN A 2 -38.768 0.589 4.676 1.00 60.38 N ATOM 0 H GLN A 2 -35.841 1.386 4.396 1.00 59.15 H new ATOM 0 HA GLN A 2 -35.411 -0.457 3.272 1.00 57.29 H new ATOM 0 HB2 GLN A 2 -37.058 0.873 1.109 1.00 57.64 H new ATOM 0 HB3 GLN A 2 -36.533 -0.798 1.062 1.00 57.64 H new ATOM 0 HG2 GLN A 2 -38.785 -0.793 1.889 1.00 58.28 H new ATOM 0 HG3 GLN A 2 -37.745 -1.193 3.241 1.00 58.28 H new ATOM 0 HE21 GLN A 2 -38.486 -0.290 5.110 1.00 60.38 H new ATOM 0 HE22 GLN A 2 -39.155 1.339 5.249 1.00 60.38 H new ATOM 37 N SER A 3 -33.907 -0.544 1.050 1.00 53.67 N ATOM 38 CA SER A 3 -32.798 -0.632 0.110 1.00 51.84 C ATOM 39 C SER A 3 -32.954 -1.975 -0.602 1.00 49.94 C ATOM 40 O SER A 3 -33.619 -2.863 -0.070 1.00 50.08 O ATOM 41 CB SER A 3 -31.444 -0.584 0.837 1.00 51.46 C ATOM 42 OG SER A 3 -31.102 0.738 1.200 1.00 52.43 O ATOM 0 H SER A 3 -34.407 -1.430 1.130 1.00 53.67 H new ATOM 0 HA SER A 3 -32.816 0.207 -0.585 1.00 51.84 H new ATOM 0 HB2 SER A 3 -31.486 -1.209 1.729 1.00 51.46 H new ATOM 0 HB3 SER A 3 -30.668 -0.999 0.193 1.00 51.46 H new ATOM 0 HG SER A 3 -31.896 1.198 1.544 1.00 52.43 H new ATOM 48 N HIS A 4 -32.350 -2.126 -1.782 1.00 48.26 N ATOM 49 CA HIS A 4 -32.234 -3.391 -2.491 1.00 46.27 C ATOM 50 C HIS A 4 -31.138 -3.219 -3.539 1.00 44.57 C ATOM 51 O HIS A 4 -30.887 -2.096 -3.975 1.00 45.20 O ATOM 52 CB HIS A 4 -33.570 -3.796 -3.132 1.00 46.62 C ATOM 53 CG HIS A 4 -34.116 -2.782 -4.107 1.00 47.38 C ATOM 54 ND1 HIS A 4 -34.933 -1.718 -3.795 1.00 48.98 N ATOM 55 CD2 HIS A 4 -33.891 -2.751 -5.457 1.00 46.72 C ATOM 56 CE1 HIS A 4 -35.192 -1.061 -4.938 1.00 49.27 C ATOM 57 NE2 HIS A 4 -34.582 -1.653 -5.979 1.00 47.95 N ATOM 0 H HIS A 4 -31.918 -1.348 -2.280 1.00 48.26 H new ATOM 0 HA HIS A 4 -31.975 -4.195 -1.801 1.00 46.27 H new ATOM 0 HB2 HIS A 4 -33.440 -4.747 -3.648 1.00 46.62 H new ATOM 0 HB3 HIS A 4 -34.305 -3.959 -2.344 1.00 46.62 H new ATOM 0 HD2 HIS A 4 -33.288 -3.449 -6.018 1.00 46.72 H new ATOM 0 HE1 HIS A 4 -35.807 -0.176 -5.010 1.00 49.27 H new ATOM 0 HE2 HIS A 4 -34.616 -1.360 -6.955 1.00 47.95 H new ATOM 65 N SER A 5 -30.481 -4.315 -3.923 1.00 42.50 N ATOM 66 CA SER A 5 -29.388 -4.315 -4.883 1.00 40.73 C ATOM 67 C SER A 5 -29.002 -5.769 -5.147 1.00 38.82 C ATOM 68 O SER A 5 -28.358 -6.380 -4.296 1.00 38.65 O ATOM 69 CB SER A 5 -28.188 -3.532 -4.322 1.00 40.63 C ATOM 70 OG SER A 5 -27.841 -4.016 -3.037 1.00 40.50 O ATOM 0 H SER A 5 -30.702 -5.244 -3.565 1.00 42.50 H new ATOM 0 HA SER A 5 -29.694 -3.832 -5.811 1.00 40.73 H new ATOM 0 HB2 SER A 5 -27.336 -3.627 -4.996 1.00 40.63 H new ATOM 0 HB3 SER A 5 -28.432 -2.471 -4.265 1.00 40.63 H new ATOM 0 HG SER A 5 -27.855 -4.996 -3.042 1.00 40.50 H new ATOM 76 N ALA A 6 -29.403 -6.328 -6.290 1.00 37.51 N ATOM 77 CA ALA A 6 -29.097 -7.699 -6.666 1.00 35.65 C ATOM 78 C ALA A 6 -29.146 -7.802 -8.188 1.00 34.37 C ATOM 79 O ALA A 6 -29.684 -6.914 -8.847 1.00 35.13 O ATOM 80 CB ALA A 6 -30.101 -8.656 -6.016 1.00 35.88 C ATOM 0 H ALA A 6 -29.957 -5.830 -6.987 1.00 37.51 H new ATOM 0 HA ALA A 6 -28.102 -7.977 -6.318 1.00 35.65 H new ATOM 0 HB1 ALA A 6 -29.865 -9.681 -6.303 1.00 35.88 H new ATOM 0 HB2 ALA A 6 -30.045 -8.560 -4.932 1.00 35.88 H new ATOM 0 HB3 ALA A 6 -31.108 -8.409 -6.351 1.00 35.88 H new ATOM 86 N LEU A 7 -28.571 -8.874 -8.731 1.00 32.54 N ATOM 87 CA LEU A 7 -28.503 -9.189 -10.137 1.00 31.22 C ATOM 88 C LEU A 7 -28.464 -10.712 -10.266 1.00 29.51 C ATOM 89 O LEU A 7 -28.526 -11.410 -9.255 1.00 29.43 O ATOM 90 CB LEU A 7 -27.263 -8.503 -10.721 1.00 30.79 C ATOM 91 CG LEU A 7 -25.921 -8.701 -9.985 1.00 30.05 C ATOM 92 CD1 LEU A 7 -25.393 -10.141 -10.040 1.00 28.56 C ATOM 93 CD2 LEU A 7 -24.878 -7.781 -10.632 1.00 30.42 C ATOM 0 H LEU A 7 -28.115 -9.583 -8.156 1.00 32.54 H new ATOM 0 HA LEU A 7 -29.366 -8.827 -10.695 1.00 31.22 H new ATOM 0 HB2 LEU A 7 -27.138 -8.852 -11.746 1.00 30.79 H new ATOM 0 HB3 LEU A 7 -27.464 -7.433 -10.771 1.00 30.79 H new ATOM 0 HG LEU A 7 -26.095 -8.465 -8.935 1.00 30.05 H new ATOM 0 HD11 LEU A 7 -24.447 -10.203 -9.502 1.00 28.56 H new ATOM 0 HD12 LEU A 7 -26.118 -10.812 -9.579 1.00 28.56 H new ATOM 0 HD13 LEU A 7 -25.239 -10.433 -11.079 1.00 28.56 H new ATOM 0 HD21 LEU A 7 -23.920 -7.905 -10.127 1.00 30.42 H new ATOM 0 HD22 LEU A 7 -24.769 -8.039 -11.685 1.00 30.42 H new ATOM 0 HD23 LEU A 7 -25.203 -6.744 -10.545 1.00 30.42 H new ATOM 105 N THR A 8 -28.314 -11.228 -11.486 1.00 28.27 N ATOM 106 CA THR A 8 -27.982 -12.621 -11.732 1.00 26.53 C ATOM 107 C THR A 8 -26.882 -12.625 -12.793 1.00 25.05 C ATOM 108 O THR A 8 -26.942 -11.832 -13.731 1.00 25.64 O ATOM 109 CB THR A 8 -29.236 -13.416 -12.122 1.00 27.01 C ATOM 110 OG1 THR A 8 -28.918 -14.784 -12.271 1.00 25.59 O ATOM 111 CG2 THR A 8 -29.905 -12.918 -13.407 1.00 27.95 C ATOM 0 H THR A 8 -28.422 -10.679 -12.339 1.00 28.27 H new ATOM 0 HA THR A 8 -27.609 -13.123 -10.839 1.00 26.53 H new ATOM 0 HB THR A 8 -29.948 -13.268 -11.310 1.00 27.01 H new ATOM 0 HG1 THR A 8 -29.725 -15.282 -12.518 1.00 25.59 H new ATOM 0 HG21 THR A 8 -30.784 -13.527 -13.619 1.00 27.95 H new ATOM 0 HG22 THR A 8 -30.206 -11.878 -13.281 1.00 27.95 H new ATOM 0 HG23 THR A 8 -29.202 -12.994 -14.236 1.00 27.95 H new ATOM 119 N ALA A 9 -25.850 -13.445 -12.592 1.00 23.29 N ATOM 120 CA ALA A 9 -24.643 -13.528 -13.400 1.00 21.80 C ATOM 121 C ALA A 9 -23.775 -14.614 -12.764 1.00 20.05 C ATOM 122 O ALA A 9 -24.185 -15.225 -11.774 1.00 20.21 O ATOM 123 CB ALA A 9 -23.896 -12.184 -13.402 1.00 21.91 C ATOM 0 H ALA A 9 -25.838 -14.105 -11.815 1.00 23.29 H new ATOM 0 HA ALA A 9 -24.882 -13.764 -14.437 1.00 21.80 H new ATOM 0 HB1 ALA A 9 -22.997 -12.268 -14.012 1.00 21.91 H new ATOM 0 HB2 ALA A 9 -24.542 -11.409 -13.814 1.00 21.91 H new ATOM 0 HB3 ALA A 9 -23.619 -11.920 -12.381 1.00 21.91 H new ATOM 129 N PHE A 10 -22.560 -14.812 -13.280 1.00 18.55 N ATOM 130 CA PHE A 10 -21.550 -15.621 -12.619 1.00 16.84 C ATOM 131 C PHE A 10 -21.127 -14.951 -11.310 1.00 15.92 C ATOM 132 O PHE A 10 -20.086 -14.299 -11.253 1.00 15.80 O ATOM 133 CB PHE A 10 -20.332 -15.805 -13.532 1.00 16.37 C ATOM 134 CG PHE A 10 -20.598 -16.581 -14.807 1.00 16.55 C ATOM 135 CD1 PHE A 10 -20.796 -15.903 -16.024 1.00 17.52 C ATOM 136 CD2 PHE A 10 -20.559 -17.988 -14.788 1.00 16.07 C ATOM 137 CE1 PHE A 10 -20.965 -16.631 -17.216 1.00 17.99 C ATOM 138 CE2 PHE A 10 -20.722 -18.714 -15.980 1.00 16.62 C ATOM 139 CZ PHE A 10 -20.927 -18.036 -17.194 1.00 17.57 C ATOM 0 H PHE A 10 -22.255 -14.413 -14.168 1.00 18.55 H new ATOM 0 HA PHE A 10 -21.972 -16.602 -12.400 1.00 16.84 H new ATOM 0 HB2 PHE A 10 -19.944 -14.822 -13.797 1.00 16.37 H new ATOM 0 HB3 PHE A 10 -19.550 -16.315 -12.970 1.00 16.37 H new ATOM 0 HD1 PHE A 10 -20.818 -14.823 -16.043 1.00 17.52 H new ATOM 0 HD2 PHE A 10 -20.404 -18.510 -13.856 1.00 16.07 H new ATOM 0 HE1 PHE A 10 -21.124 -16.110 -18.149 1.00 17.99 H new ATOM 0 HE2 PHE A 10 -20.690 -19.793 -15.963 1.00 16.62 H new ATOM 0 HZ PHE A 10 -21.055 -18.594 -18.110 1.00 17.57 H new ATOM 149 N GLN A 11 -21.926 -15.118 -10.255 1.00 15.51 N ATOM 150 CA GLN A 11 -21.603 -14.648 -8.916 1.00 14.64 C ATOM 151 C GLN A 11 -20.497 -15.527 -8.319 1.00 12.74 C ATOM 152 O GLN A 11 -20.732 -16.255 -7.357 1.00 12.82 O ATOM 153 CB GLN A 11 -22.883 -14.632 -8.066 1.00 15.58 C ATOM 154 CG GLN A 11 -22.679 -13.891 -6.736 1.00 16.06 C ATOM 155 CD GLN A 11 -23.948 -13.899 -5.894 1.00 17.13 C ATOM 156 OE1 GLN A 11 -24.596 -12.872 -5.726 1.00 18.09 O ATOM 157 NE2 GLN A 11 -24.315 -15.060 -5.357 1.00 17.21 N ATOM 0 H GLN A 11 -22.828 -15.591 -10.312 1.00 15.51 H new ATOM 0 HA GLN A 11 -21.219 -13.628 -8.942 1.00 14.64 H new ATOM 0 HB2 GLN A 11 -23.686 -14.155 -8.628 1.00 15.58 H new ATOM 0 HB3 GLN A 11 -23.199 -15.656 -7.866 1.00 15.58 H new ATOM 0 HG2 GLN A 11 -21.868 -14.359 -6.178 1.00 16.06 H new ATOM 0 HG3 GLN A 11 -22.378 -12.862 -6.934 1.00 16.06 H new ATOM 0 HE21 GLN A 11 -23.753 -15.896 -5.517 1.00 17.21 H new ATOM 0 HE22 GLN A 11 -25.158 -15.114 -4.786 1.00 17.21 H new ATOM 166 N THR A 12 -19.302 -15.491 -8.913 1.00 11.30 N ATOM 167 CA THR A 12 -18.169 -16.313 -8.525 1.00 9.49 C ATOM 168 C THR A 12 -16.922 -15.842 -9.272 1.00 8.08 C ATOM 169 O THR A 12 -16.998 -15.150 -10.291 1.00 8.78 O ATOM 170 CB THR A 12 -18.466 -17.809 -8.772 1.00 9.82 C ATOM 171 OG1 THR A 12 -17.354 -18.622 -8.450 1.00 9.15 O ATOM 172 CG2 THR A 12 -18.877 -18.104 -10.219 1.00 10.53 C ATOM 0 H THR A 12 -19.097 -14.871 -9.697 1.00 11.30 H new ATOM 0 HA THR A 12 -17.987 -16.203 -7.456 1.00 9.49 H new ATOM 0 HB THR A 12 -19.303 -18.046 -8.116 1.00 9.82 H new ATOM 0 HG1 THR A 12 -17.577 -19.562 -8.616 1.00 9.15 H new ATOM 0 HG21 THR A 12 -19.073 -19.170 -10.331 1.00 10.53 H new ATOM 0 HG22 THR A 12 -19.778 -17.542 -10.463 1.00 10.53 H new ATOM 0 HG23 THR A 12 -18.072 -17.810 -10.893 1.00 10.53 H new ATOM 180 N GLU A 13 -15.772 -16.236 -8.741 1.00 6.48 N ATOM 181 CA GLU A 13 -14.438 -16.014 -9.253 1.00 5.40 C ATOM 182 C GLU A 13 -14.288 -16.690 -10.611 1.00 6.05 C ATOM 183 O GLU A 13 -13.867 -17.845 -10.663 1.00 6.08 O ATOM 184 CB GLU A 13 -13.446 -16.628 -8.271 1.00 4.01 C ATOM 185 CG GLU A 13 -13.282 -15.802 -6.988 1.00 3.59 C ATOM 186 CD GLU A 13 -14.590 -15.491 -6.265 1.00 4.94 C ATOM 187 OE1 GLU A 13 -15.391 -16.442 -6.127 1.00 5.86 O ATOM 188 OE2 GLU A 13 -14.802 -14.301 -5.939 1.00 5.79 O ATOM 0 H GLU A 13 -15.754 -16.763 -7.868 1.00 6.48 H new ATOM 0 HA GLU A 13 -14.253 -14.946 -9.367 1.00 5.40 H new ATOM 0 HB2 GLU A 13 -13.777 -17.633 -8.009 1.00 4.01 H new ATOM 0 HB3 GLU A 13 -12.476 -16.729 -8.758 1.00 4.01 H new ATOM 0 HG2 GLU A 13 -12.623 -16.340 -6.306 1.00 3.59 H new ATOM 0 HG3 GLU A 13 -12.786 -14.863 -7.236 1.00 3.59 H new ATOM 195 N GLN A 14 -14.609 -15.986 -11.699 1.00 7.44 N ATOM 196 CA GLN A 14 -14.373 -16.485 -13.047 1.00 8.59 C ATOM 197 C GLN A 14 -12.878 -16.769 -13.238 1.00 9.04 C ATOM 198 O GLN A 14 -12.461 -17.912 -13.060 1.00 8.85 O ATOM 199 CB GLN A 14 -14.946 -15.510 -14.088 1.00 9.95 C ATOM 200 CG GLN A 14 -16.475 -15.417 -14.008 1.00 10.71 C ATOM 201 CD GLN A 14 -17.159 -16.725 -14.400 1.00 11.45 C ATOM 202 OE1 GLN A 14 -17.477 -17.548 -13.549 1.00 11.50 O ATOM 203 NE2 GLN A 14 -17.413 -16.920 -15.690 1.00 12.45 N ATOM 0 H GLN A 14 -15.037 -15.061 -11.667 1.00 7.44 H new ATOM 0 HA GLN A 14 -14.898 -17.429 -13.194 1.00 8.59 H new ATOM 0 HB2 GLN A 14 -14.514 -14.521 -13.935 1.00 9.95 H new ATOM 0 HB3 GLN A 14 -14.654 -15.834 -15.087 1.00 9.95 H new ATOM 0 HG2 GLN A 14 -16.767 -15.147 -12.993 1.00 10.71 H new ATOM 0 HG3 GLN A 14 -16.822 -14.618 -14.663 1.00 10.71 H new ATOM 0 HE21 GLN A 14 -17.137 -16.218 -16.376 1.00 12.45 H new ATOM 0 HE22 GLN A 14 -17.884 -17.772 -15.994 1.00 12.45 H new ATOM 212 N ILE A 15 -12.074 -15.740 -13.552 1.00 10.19 N ATOM 213 CA ILE A 15 -10.624 -15.885 -13.724 1.00 11.42 C ATOM 214 C ILE A 15 -10.366 -16.827 -14.933 1.00 11.95 C ATOM 215 O ILE A 15 -11.326 -17.287 -15.553 1.00 11.73 O ATOM 216 CB ILE A 15 -10.003 -16.248 -12.349 1.00 11.56 C ATOM 217 CG1 ILE A 15 -10.436 -15.207 -11.287 1.00 11.51 C ATOM 218 CG2 ILE A 15 -8.476 -16.306 -12.393 1.00 13.16 C ATOM 219 CD1 ILE A 15 -9.928 -15.488 -9.866 1.00 12.29 C ATOM 0 H ILE A 15 -12.412 -14.788 -13.693 1.00 10.19 H new ATOM 0 HA ILE A 15 -10.103 -14.969 -14.003 1.00 11.42 H new ATOM 0 HB ILE A 15 -10.368 -17.241 -12.087 1.00 11.56 H new ATOM 0 HG12 ILE A 15 -10.082 -14.224 -11.597 1.00 11.51 H new ATOM 0 HG13 ILE A 15 -11.525 -15.161 -11.266 1.00 11.51 H new ATOM 0 HG21 ILE A 15 -8.093 -16.564 -11.406 1.00 13.16 H new ATOM 0 HG22 ILE A 15 -8.161 -17.061 -13.113 1.00 13.16 H new ATOM 0 HG23 ILE A 15 -8.083 -15.334 -12.692 1.00 13.16 H new ATOM 0 HD11 ILE A 15 -10.281 -14.707 -9.192 1.00 12.29 H new ATOM 0 HD12 ILE A 15 -10.304 -16.454 -9.530 1.00 12.29 H new ATOM 0 HD13 ILE A 15 -8.838 -15.502 -9.865 1.00 12.29 H new ATOM 231 N GLN A 16 -9.119 -17.046 -15.368 1.00 13.02 N ATOM 232 CA GLN A 16 -8.805 -17.943 -16.482 1.00 13.86 C ATOM 233 C GLN A 16 -7.961 -19.120 -16.006 1.00 13.56 C ATOM 234 O GLN A 16 -8.281 -20.260 -16.342 1.00 13.32 O ATOM 235 CB GLN A 16 -8.114 -17.173 -17.620 1.00 15.67 C ATOM 236 CG GLN A 16 -7.848 -18.037 -18.870 1.00 16.86 C ATOM 237 CD GLN A 16 -6.470 -18.708 -18.873 1.00 17.97 C ATOM 238 OE1 GLN A 16 -5.509 -18.124 -19.360 1.00 19.43 O ATOM 239 NE2 GLN A 16 -6.370 -19.928 -18.355 1.00 17.54 N ATOM 0 H GLN A 16 -8.298 -16.604 -14.954 1.00 13.02 H new ATOM 0 HA GLN A 16 -9.738 -18.347 -16.876 1.00 13.86 H new ATOM 0 HB2 GLN A 16 -8.733 -16.321 -17.901 1.00 15.67 H new ATOM 0 HB3 GLN A 16 -7.168 -16.773 -17.256 1.00 15.67 H new ATOM 0 HG2 GLN A 16 -8.617 -18.806 -18.940 1.00 16.86 H new ATOM 0 HG3 GLN A 16 -7.940 -17.413 -19.759 1.00 16.86 H new ATOM 0 HE21 GLN A 16 -7.192 -20.383 -17.958 1.00 17.54 H new ATOM 0 HE22 GLN A 16 -5.471 -20.410 -18.354 1.00 17.54 H new ATOM 248 N ASP A 17 -6.849 -18.848 -15.321 1.00 13.98 N ATOM 249 CA ASP A 17 -5.846 -19.856 -14.973 1.00 14.31 C ATOM 250 C ASP A 17 -5.713 -19.909 -13.457 1.00 13.23 C ATOM 251 O ASP A 17 -5.949 -20.937 -12.819 1.00 12.49 O ATOM 252 CB ASP A 17 -4.512 -19.521 -15.660 1.00 16.26 C ATOM 253 CG ASP A 17 -3.863 -20.777 -16.214 1.00 16.93 C ATOM 254 OD1 ASP A 17 -3.164 -21.453 -15.430 1.00 17.31 O ATOM 255 OD2 ASP A 17 -4.105 -21.046 -17.413 1.00 17.28 O ATOM 0 H ASP A 17 -6.617 -17.912 -14.989 1.00 13.98 H new ATOM 0 HA ASP A 17 -6.151 -20.842 -15.325 1.00 14.31 H new ATOM 0 HB2 ASP A 17 -4.682 -18.807 -16.466 1.00 16.26 H new ATOM 0 HB3 ASP A 17 -3.840 -19.043 -14.947 1.00 16.26 H new ATOM 260 N SER A 18 -5.444 -18.744 -12.868 1.00 13.37 N ATOM 261 CA SER A 18 -5.408 -18.496 -11.434 1.00 12.65 C ATOM 262 C SER A 18 -6.690 -18.892 -10.691 1.00 10.74 C ATOM 263 O SER A 18 -6.703 -18.802 -9.467 1.00 10.32 O ATOM 264 CB SER A 18 -5.111 -17.011 -11.190 1.00 13.49 C ATOM 265 OG SER A 18 -3.834 -16.681 -11.696 1.00 15.03 O ATOM 0 H SER A 18 -5.235 -17.906 -13.411 1.00 13.37 H new ATOM 0 HA SER A 18 -4.621 -19.133 -11.031 1.00 12.65 H new ATOM 0 HB2 SER A 18 -5.871 -16.396 -11.672 1.00 13.49 H new ATOM 0 HB3 SER A 18 -5.155 -16.794 -10.123 1.00 13.49 H new ATOM 0 HG SER A 18 -3.903 -16.481 -12.653 1.00 15.03 H new ATOM 271 N GLU A 19 -7.783 -19.261 -11.374 1.00 9.92 N ATOM 272 CA GLU A 19 -9.079 -19.477 -10.742 1.00 8.45 C ATOM 273 C GLU A 19 -8.963 -20.378 -9.513 1.00 8.08 C ATOM 274 O GLU A 19 -9.471 -20.048 -8.440 1.00 7.32 O ATOM 275 CB GLU A 19 -10.122 -19.975 -11.760 1.00 8.56 C ATOM 276 CG GLU A 19 -9.988 -21.435 -12.227 1.00 9.44 C ATOM 277 CD GLU A 19 -11.204 -21.876 -13.034 1.00 9.46 C ATOM 278 OE1 GLU A 19 -11.006 -22.405 -14.144 1.00 10.07 O ATOM 279 OE2 GLU A 19 -12.319 -21.704 -12.490 1.00 9.26 O ATOM 0 H GLU A 19 -7.786 -19.417 -12.382 1.00 9.92 H new ATOM 0 HA GLU A 19 -9.441 -18.516 -10.377 1.00 8.45 H new ATOM 0 HB2 GLU A 19 -11.112 -19.847 -11.323 1.00 8.56 H new ATOM 0 HB3 GLU A 19 -10.075 -19.331 -12.638 1.00 8.56 H new ATOM 0 HG2 GLU A 19 -9.089 -21.543 -12.833 1.00 9.44 H new ATOM 0 HG3 GLU A 19 -9.869 -22.086 -11.361 1.00 9.44 H new ATOM 286 N HIS A 20 -8.248 -21.491 -9.689 1.00 9.10 N ATOM 287 CA HIS A 20 -7.997 -22.491 -8.667 1.00 9.55 C ATOM 288 C HIS A 20 -7.342 -21.858 -7.437 1.00 9.71 C ATOM 289 O HIS A 20 -7.685 -22.196 -6.307 1.00 9.63 O ATOM 290 CB HIS A 20 -7.141 -23.618 -9.266 1.00 11.06 C ATOM 291 CG HIS A 20 -5.714 -23.227 -9.570 1.00 12.51 C ATOM 292 ND1 HIS A 20 -5.257 -22.534 -10.672 1.00 13.03 N ATOM 293 CD2 HIS A 20 -4.651 -23.397 -8.722 1.00 13.84 C ATOM 294 CE1 HIS A 20 -3.947 -22.302 -10.489 1.00 14.53 C ATOM 295 NE2 HIS A 20 -3.536 -22.788 -9.302 1.00 15.06 N ATOM 0 H HIS A 20 -7.815 -21.723 -10.583 1.00 9.10 H new ATOM 0 HA HIS A 20 -8.941 -22.920 -8.330 1.00 9.55 H new ATOM 0 HB2 HIS A 20 -7.134 -24.459 -8.573 1.00 11.06 H new ATOM 0 HB3 HIS A 20 -7.613 -23.966 -10.185 1.00 11.06 H new ATOM 0 HD1 HIS A 20 -5.813 -22.250 -11.479 1.00 13.03 H new ATOM 0 HD2 HIS A 20 -4.672 -23.911 -7.773 1.00 13.84 H new ATOM 0 HE1 HIS A 20 -3.309 -21.794 -11.198 1.00 14.53 H new ATOM 303 N SER A 21 -6.389 -20.951 -7.665 1.00 10.43 N ATOM 304 CA SER A 21 -5.676 -20.235 -6.627 1.00 11.11 C ATOM 305 C SER A 21 -6.620 -19.247 -5.947 1.00 9.89 C ATOM 306 O SER A 21 -6.626 -19.131 -4.727 1.00 10.26 O ATOM 307 CB SER A 21 -4.482 -19.501 -7.254 1.00 12.53 C ATOM 308 OG SER A 21 -4.064 -20.118 -8.461 1.00 13.04 O ATOM 0 H SER A 21 -6.090 -20.694 -8.606 1.00 10.43 H new ATOM 0 HA SER A 21 -5.308 -20.933 -5.875 1.00 11.11 H new ATOM 0 HB2 SER A 21 -4.754 -18.464 -7.450 1.00 12.53 H new ATOM 0 HB3 SER A 21 -3.652 -19.484 -6.547 1.00 12.53 H new ATOM 0 HG SER A 21 -3.725 -21.017 -8.268 1.00 13.04 H new ATOM 314 N GLY A 22 -7.377 -18.508 -6.764 1.00 8.79 N ATOM 315 CA GLY A 22 -8.200 -17.391 -6.344 1.00 7.88 C ATOM 316 C GLY A 22 -9.352 -17.837 -5.454 1.00 6.87 C ATOM 317 O GLY A 22 -9.391 -17.479 -4.281 1.00 7.49 O ATOM 0 H GLY A 22 -7.429 -18.684 -7.767 1.00 8.79 H new ATOM 0 HA2 GLY A 22 -7.585 -16.669 -5.807 1.00 7.88 H new ATOM 0 HA3 GLY A 22 -8.596 -16.882 -7.222 1.00 7.88 H new ATOM 321 N LYS A 23 -10.320 -18.566 -6.021 1.00 5.87 N ATOM 322 CA LYS A 23 -11.481 -19.005 -5.249 1.00 5.74 C ATOM 323 C LYS A 23 -11.101 -20.111 -4.270 1.00 7.14 C ATOM 324 O LYS A 23 -10.720 -19.862 -3.130 1.00 8.19 O ATOM 325 CB LYS A 23 -12.694 -19.342 -6.142 1.00 5.33 C ATOM 326 CG LYS A 23 -12.367 -19.958 -7.517 1.00 5.83 C ATOM 327 CD LYS A 23 -13.601 -20.642 -8.127 1.00 6.78 C ATOM 328 CE LYS A 23 -13.281 -21.277 -9.493 1.00 7.99 C ATOM 329 NZ LYS A 23 -13.654 -20.426 -10.643 1.00 8.62 N ATOM 0 H LYS A 23 -10.321 -18.860 -6.998 1.00 5.87 H new ATOM 0 HA LYS A 23 -11.817 -18.165 -4.642 1.00 5.74 H new ATOM 0 HB2 LYS A 23 -13.339 -20.033 -5.600 1.00 5.33 H new ATOM 0 HB3 LYS A 23 -13.268 -18.429 -6.302 1.00 5.33 H new ATOM 0 HG2 LYS A 23 -12.009 -19.180 -8.191 1.00 5.83 H new ATOM 0 HG3 LYS A 23 -11.561 -20.684 -7.411 1.00 5.83 H new ATOM 0 HD2 LYS A 23 -13.966 -21.410 -7.445 1.00 6.78 H new ATOM 0 HD3 LYS A 23 -14.402 -19.912 -8.243 1.00 6.78 H new ATOM 0 HE2 LYS A 23 -12.214 -21.493 -9.543 1.00 7.99 H new ATOM 0 HE3 LYS A 23 -13.803 -22.230 -9.573 1.00 7.99 H new ATOM 0 HZ1 LYS A 23 -13.078 -20.687 -11.469 1.00 8.62 H new ATOM 0 HZ2 LYS A 23 -14.661 -20.564 -10.865 1.00 8.62 H new ATOM 0 HZ3 LYS A 23 -13.486 -19.428 -10.405 1.00 8.62 H new ATOM 343 N MET A 24 -11.230 -21.348 -4.733 1.00 7.51 N ATOM 344 CA MET A 24 -10.958 -22.537 -3.959 1.00 9.08 C ATOM 345 C MET A 24 -10.936 -23.732 -4.892 1.00 9.72 C ATOM 346 O MET A 24 -11.572 -23.747 -5.947 1.00 9.48 O ATOM 347 CB MET A 24 -11.991 -22.730 -2.836 1.00 9.62 C ATOM 348 CG MET A 24 -13.442 -22.751 -3.333 1.00 9.19 C ATOM 349 SD MET A 24 -14.674 -23.037 -2.036 1.00 10.88 S ATOM 350 CE MET A 24 -16.171 -23.081 -3.042 1.00 11.47 C ATOM 0 H MET A 24 -11.536 -21.550 -5.685 1.00 7.51 H new ATOM 0 HA MET A 24 -9.987 -22.433 -3.475 1.00 9.08 H new ATOM 0 HB2 MET A 24 -11.780 -23.665 -2.317 1.00 9.62 H new ATOM 0 HB3 MET A 24 -11.877 -21.928 -2.107 1.00 9.62 H new ATOM 0 HG2 MET A 24 -13.660 -21.801 -3.821 1.00 9.19 H new ATOM 0 HG3 MET A 24 -13.543 -23.528 -4.090 1.00 9.19 H new ATOM 0 HE1 MET A 24 -17.036 -23.250 -2.400 1.00 11.47 H new ATOM 0 HE2 MET A 24 -16.287 -22.131 -3.564 1.00 11.47 H new ATOM 0 HE3 MET A 24 -16.096 -23.888 -3.770 1.00 11.47 H new ATOM 360 N VAL A 25 -10.190 -24.734 -4.453 1.00 10.96 N ATOM 361 CA VAL A 25 -10.084 -26.038 -5.066 1.00 12.08 C ATOM 362 C VAL A 25 -11.219 -26.897 -4.499 1.00 12.74 C ATOM 363 O VAL A 25 -11.140 -27.362 -3.364 1.00 13.84 O ATOM 364 CB VAL A 25 -8.685 -26.591 -4.760 1.00 13.57 C ATOM 365 CG1 VAL A 25 -8.535 -28.058 -5.187 1.00 15.00 C ATOM 366 CG2 VAL A 25 -7.618 -25.760 -5.487 1.00 13.41 C ATOM 0 H VAL A 25 -9.614 -24.649 -3.615 1.00 10.96 H new ATOM 0 HA VAL A 25 -10.190 -26.018 -6.151 1.00 12.08 H new ATOM 0 HB VAL A 25 -8.550 -26.530 -3.680 1.00 13.57 H new ATOM 0 HG11 VAL A 25 -7.529 -28.405 -4.950 1.00 15.00 H new ATOM 0 HG12 VAL A 25 -9.264 -28.668 -4.654 1.00 15.00 H new ATOM 0 HG13 VAL A 25 -8.705 -28.144 -6.260 1.00 15.00 H new ATOM 0 HG21 VAL A 25 -6.629 -26.161 -5.263 1.00 13.41 H new ATOM 0 HG22 VAL A 25 -7.792 -25.804 -6.562 1.00 13.41 H new ATOM 0 HG23 VAL A 25 -7.674 -24.724 -5.153 1.00 13.41 H new ATOM 376 N ALA A 26 -12.272 -27.095 -5.299 1.00 12.43 N ATOM 377 CA ALA A 26 -13.459 -27.861 -4.933 1.00 13.34 C ATOM 378 C ALA A 26 -14.243 -27.179 -3.803 1.00 13.28 C ATOM 379 O ALA A 26 -13.991 -26.025 -3.465 1.00 12.92 O ATOM 380 CB ALA A 26 -13.086 -29.319 -4.616 1.00 14.77 C ATOM 0 H ALA A 26 -12.319 -26.715 -6.244 1.00 12.43 H new ATOM 0 HA ALA A 26 -14.134 -27.887 -5.789 1.00 13.34 H new ATOM 0 HB1 ALA A 26 -13.984 -29.874 -4.345 1.00 14.77 H new ATOM 0 HB2 ALA A 26 -12.628 -29.776 -5.493 1.00 14.77 H new ATOM 0 HB3 ALA A 26 -12.381 -29.342 -3.785 1.00 14.77 H new ATOM 386 N LYS A 27 -15.231 -27.879 -3.234 1.00 14.00 N ATOM 387 CA LYS A 27 -16.050 -27.351 -2.152 1.00 14.46 C ATOM 388 C LYS A 27 -15.238 -27.323 -0.855 1.00 14.98 C ATOM 389 O LYS A 27 -15.407 -28.192 -0.002 1.00 15.68 O ATOM 390 CB LYS A 27 -17.318 -28.201 -1.982 1.00 15.08 C ATOM 391 CG LYS A 27 -18.261 -28.103 -3.188 1.00 15.13 C ATOM 392 CD LYS A 27 -19.552 -28.872 -2.876 1.00 16.15 C ATOM 393 CE LYS A 27 -20.549 -28.769 -4.040 1.00 16.40 C ATOM 394 NZ LYS A 27 -21.818 -29.468 -3.746 1.00 17.90 N ATOM 0 H LYS A 27 -15.480 -28.827 -3.515 1.00 14.00 H new ATOM 0 HA LYS A 27 -16.353 -26.333 -2.396 1.00 14.46 H new ATOM 0 HB2 LYS A 27 -17.035 -29.243 -1.831 1.00 15.08 H new ATOM 0 HB3 LYS A 27 -17.848 -27.881 -1.085 1.00 15.08 H new ATOM 0 HG2 LYS A 27 -18.488 -27.059 -3.405 1.00 15.13 H new ATOM 0 HG3 LYS A 27 -17.782 -28.516 -4.075 1.00 15.13 H new ATOM 0 HD2 LYS A 27 -19.318 -29.919 -2.684 1.00 16.15 H new ATOM 0 HD3 LYS A 27 -20.006 -28.475 -1.968 1.00 16.15 H new ATOM 0 HE2 LYS A 27 -20.754 -27.719 -4.250 1.00 16.40 H new ATOM 0 HE3 LYS A 27 -20.102 -29.193 -4.939 1.00 16.40 H new ATOM 0 HZ1 LYS A 27 -22.462 -29.374 -4.557 1.00 17.90 H new ATOM 0 HZ2 LYS A 27 -21.627 -30.475 -3.571 1.00 17.90 H new ATOM 0 HZ3 LYS A 27 -22.259 -29.047 -2.903 1.00 17.90 H new ATOM 408 N ARG A 28 -14.360 -26.332 -0.705 1.00 14.90 N ATOM 409 CA ARG A 28 -13.547 -26.176 0.487 1.00 15.63 C ATOM 410 C ARG A 28 -13.331 -24.695 0.783 1.00 15.36 C ATOM 411 O ARG A 28 -12.530 -24.055 0.111 1.00 15.08 O ATOM 412 CB ARG A 28 -12.211 -26.903 0.283 1.00 16.26 C ATOM 413 CG ARG A 28 -11.463 -26.994 1.614 1.00 17.52 C ATOM 414 CD ARG A 28 -10.068 -27.589 1.411 1.00 18.47 C ATOM 415 NE ARG A 28 -9.458 -27.929 2.703 1.00 19.97 N ATOM 416 CZ ARG A 28 -9.740 -29.038 3.406 1.00 21.31 C ATOM 417 NH1 ARG A 28 -10.648 -29.904 2.938 1.00 21.35 N ATOM 418 NH2 ARG A 28 -9.129 -29.279 4.571 1.00 22.79 N ATOM 0 H ARG A 28 -14.197 -25.616 -1.413 1.00 14.90 H new ATOM 0 HA ARG A 28 -14.057 -26.615 1.344 1.00 15.63 H new ATOM 0 HB2 ARG A 28 -12.387 -27.902 -0.115 1.00 16.26 H new ATOM 0 HB3 ARG A 28 -11.605 -26.371 -0.450 1.00 16.26 H new ATOM 0 HG2 ARG A 28 -11.380 -26.002 2.058 1.00 17.52 H new ATOM 0 HG3 ARG A 28 -12.028 -27.610 2.313 1.00 17.52 H new ATOM 0 HD2 ARG A 28 -10.134 -28.481 0.788 1.00 18.47 H new ATOM 0 HD3 ARG A 28 -9.436 -26.876 0.881 1.00 18.47 H new ATOM 0 HE ARG A 28 -8.775 -27.280 3.092 1.00 19.97 H new ATOM 0 HH11 ARG A 28 -11.120 -29.719 2.053 1.00 21.35 H new ATOM 0 HH12 ARG A 28 -10.867 -30.748 3.467 1.00 21.35 H new ATOM 0 HH21 ARG A 28 -8.442 -28.618 4.933 1.00 22.79 H new ATOM 0 HH22 ARG A 28 -9.350 -30.124 5.098 1.00 22.79 H new ATOM 432 N GLN A 29 -14.009 -24.159 1.802 1.00 15.79 N ATOM 433 CA GLN A 29 -13.689 -22.854 2.356 1.00 16.06 C ATOM 434 C GLN A 29 -14.093 -22.817 3.823 1.00 16.80 C ATOM 435 O GLN A 29 -15.030 -23.511 4.214 1.00 17.60 O ATOM 436 CB GLN A 29 -14.356 -21.717 1.558 1.00 16.03 C ATOM 437 CG GLN A 29 -13.265 -20.897 0.862 1.00 15.89 C ATOM 438 CD GLN A 29 -13.761 -19.625 0.185 1.00 16.32 C ATOM 439 OE1 GLN A 29 -14.946 -19.307 0.219 1.00 16.67 O ATOM 440 NE2 GLN A 29 -12.826 -18.881 -0.390 1.00 16.64 N ATOM 0 H GLN A 29 -14.793 -24.622 2.261 1.00 15.79 H new ATOM 0 HA GLN A 29 -12.613 -22.695 2.280 1.00 16.06 H new ATOM 0 HB2 GLN A 29 -15.047 -22.128 0.822 1.00 16.03 H new ATOM 0 HB3 GLN A 29 -14.940 -21.081 2.223 1.00 16.03 H new ATOM 0 HG2 GLN A 29 -12.506 -20.629 1.597 1.00 15.89 H new ATOM 0 HG3 GLN A 29 -12.778 -21.524 0.115 1.00 15.89 H new ATOM 0 HE21 GLN A 29 -11.855 -19.193 -0.390 1.00 16.64 H new ATOM 0 HE22 GLN A 29 -13.078 -17.997 -0.832 1.00 16.64 H new ATOM 449 N PHE A 30 -13.381 -22.007 4.614 1.00 16.76 N ATOM 450 CA PHE A 30 -13.653 -21.794 6.030 1.00 17.65 C ATOM 451 C PHE A 30 -13.314 -20.363 6.442 1.00 17.47 C ATOM 452 O PHE A 30 -14.170 -19.693 7.013 1.00 18.10 O ATOM 453 CB PHE A 30 -12.880 -22.798 6.895 1.00 17.90 C ATOM 454 CG PHE A 30 -13.467 -24.195 6.899 1.00 18.59 C ATOM 455 CD1 PHE A 30 -14.622 -24.459 7.660 1.00 19.85 C ATOM 456 CD2 PHE A 30 -12.896 -25.216 6.117 1.00 18.18 C ATOM 457 CE1 PHE A 30 -15.195 -25.741 7.651 1.00 20.66 C ATOM 458 CE2 PHE A 30 -13.471 -26.499 6.109 1.00 19.08 C ATOM 459 CZ PHE A 30 -14.617 -26.763 6.880 1.00 20.29 C ATOM 0 H PHE A 30 -12.582 -21.471 4.274 1.00 16.76 H new ATOM 0 HA PHE A 30 -14.719 -21.953 6.191 1.00 17.65 H new ATOM 0 HB2 PHE A 30 -11.851 -22.849 6.540 1.00 17.90 H new ATOM 0 HB3 PHE A 30 -12.846 -22.427 7.919 1.00 17.90 H new ATOM 0 HD1 PHE A 30 -15.068 -23.674 8.252 1.00 19.85 H new ATOM 0 HD2 PHE A 30 -12.017 -25.014 5.523 1.00 18.18 H new ATOM 0 HE1 PHE A 30 -16.080 -25.941 8.237 1.00 20.66 H new ATOM 0 HE2 PHE A 30 -13.032 -27.283 5.510 1.00 19.08 H new ATOM 0 HZ PHE A 30 -15.053 -27.751 6.879 1.00 20.29 H new ATOM 469 N ARG A 31 -12.067 -19.931 6.188 1.00 16.85 N ATOM 470 CA ARG A 31 -11.461 -18.631 6.513 1.00 16.78 C ATOM 471 C ARG A 31 -10.023 -18.831 6.984 1.00 15.86 C ATOM 472 O ARG A 31 -9.149 -18.026 6.676 1.00 15.39 O ATOM 473 CB ARG A 31 -12.262 -17.804 7.539 1.00 18.26 C ATOM 474 CG ARG A 31 -11.561 -16.500 7.953 1.00 18.63 C ATOM 475 CD ARG A 31 -12.494 -15.625 8.800 1.00 20.38 C ATOM 476 NE ARG A 31 -12.845 -16.279 10.072 1.00 21.20 N ATOM 477 CZ ARG A 31 -13.785 -15.849 10.931 1.00 22.66 C ATOM 478 NH1 ARG A 31 -14.491 -14.747 10.651 1.00 23.47 N ATOM 479 NH2 ARG A 31 -14.013 -16.519 12.067 1.00 23.47 N ATOM 0 H ARG A 31 -11.401 -20.536 5.708 1.00 16.85 H new ATOM 0 HA ARG A 31 -11.474 -18.046 5.593 1.00 16.78 H new ATOM 0 HB2 ARG A 31 -13.239 -17.565 7.119 1.00 18.26 H new ATOM 0 HB3 ARG A 31 -12.437 -18.411 8.427 1.00 18.26 H new ATOM 0 HG2 ARG A 31 -10.658 -16.731 8.519 1.00 18.63 H new ATOM 0 HG3 ARG A 31 -11.248 -15.952 7.064 1.00 18.63 H new ATOM 0 HD2 ARG A 31 -12.012 -14.669 9.003 1.00 20.38 H new ATOM 0 HD3 ARG A 31 -13.403 -15.411 8.238 1.00 20.38 H new ATOM 0 HE ARG A 31 -12.334 -17.126 10.321 1.00 21.20 H new ATOM 0 HH11 ARG A 31 -14.315 -14.235 9.787 1.00 23.47 H new ATOM 0 HH12 ARG A 31 -15.205 -14.419 11.302 1.00 23.47 H new ATOM 0 HH21 ARG A 31 -13.473 -17.357 12.282 1.00 23.47 H new ATOM 0 HH22 ARG A 31 -14.727 -16.191 12.718 1.00 23.47 H new ATOM 493 N ILE A 32 -9.789 -19.908 7.738 1.00 15.93 N ATOM 494 CA ILE A 32 -8.467 -20.327 8.194 1.00 15.39 C ATOM 495 C ILE A 32 -7.472 -20.325 7.028 1.00 14.04 C ATOM 496 O ILE A 32 -6.341 -19.868 7.165 1.00 14.62 O ATOM 497 CB ILE A 32 -8.593 -21.733 8.808 1.00 15.93 C ATOM 498 CG1 ILE A 32 -9.522 -21.783 10.037 1.00 17.51 C ATOM 499 CG2 ILE A 32 -7.220 -22.332 9.152 1.00 15.70 C ATOM 500 CD1 ILE A 32 -9.061 -20.922 11.219 1.00 18.71 C ATOM 0 H ILE A 32 -10.535 -20.527 8.055 1.00 15.93 H new ATOM 0 HA ILE A 32 -8.091 -19.632 8.944 1.00 15.39 H new ATOM 0 HB ILE A 32 -9.057 -22.344 8.034 1.00 15.93 H new ATOM 0 HG12 ILE A 32 -10.519 -21.461 9.736 1.00 17.51 H new ATOM 0 HG13 ILE A 32 -9.608 -22.817 10.369 1.00 17.51 H new ATOM 0 HG21 ILE A 32 -7.354 -23.324 9.583 1.00 15.70 H new ATOM 0 HG22 ILE A 32 -6.619 -22.408 8.246 1.00 15.70 H new ATOM 0 HG23 ILE A 32 -6.713 -21.689 9.872 1.00 15.70 H new ATOM 0 HD11 ILE A 32 -9.773 -21.018 12.038 1.00 18.71 H new ATOM 0 HD12 ILE A 32 -8.078 -21.257 11.551 1.00 18.71 H new ATOM 0 HD13 ILE A 32 -9.003 -19.879 10.908 1.00 18.71 H new ATOM 512 N GLY A 33 -7.912 -20.850 5.884 1.00 12.53 N ATOM 513 CA GLY A 33 -7.204 -20.812 4.625 1.00 11.31 C ATOM 514 C GLY A 33 -8.257 -20.922 3.528 1.00 9.84 C ATOM 515 O GLY A 33 -9.431 -20.640 3.787 1.00 10.17 O ATOM 0 H GLY A 33 -8.809 -21.331 5.817 1.00 12.53 H new ATOM 0 HA2 GLY A 33 -6.638 -19.886 4.527 1.00 11.31 H new ATOM 0 HA3 GLY A 33 -6.488 -21.631 4.558 1.00 11.31 H new ATOM 519 N ASP A 34 -7.827 -21.356 2.341 1.00 8.68 N ATOM 520 CA ASP A 34 -8.669 -21.589 1.173 1.00 7.70 C ATOM 521 C ASP A 34 -9.292 -20.268 0.686 1.00 6.61 C ATOM 522 O ASP A 34 -10.468 -20.217 0.339 1.00 6.67 O ATOM 523 CB ASP A 34 -9.729 -22.671 1.468 1.00 9.10 C ATOM 524 CG ASP A 34 -9.185 -23.965 2.068 1.00 9.87 C ATOM 525 OD1 ASP A 34 -8.301 -24.576 1.430 1.00 9.55 O ATOM 526 OD2 ASP A 34 -9.668 -24.346 3.159 1.00 11.14 O ATOM 0 H ASP A 34 -6.844 -21.562 2.164 1.00 8.68 H new ATOM 0 HA ASP A 34 -8.050 -21.970 0.360 1.00 7.70 H new ATOM 0 HB2 ASP A 34 -10.469 -22.255 2.151 1.00 9.10 H new ATOM 0 HB3 ASP A 34 -10.250 -22.910 0.541 1.00 9.10 H new ATOM 531 N ILE A 35 -8.505 -19.188 0.679 1.00 6.15 N ATOM 532 CA ILE A 35 -8.939 -17.837 0.334 1.00 5.52 C ATOM 533 C ILE A 35 -7.811 -17.143 -0.432 1.00 4.28 C ATOM 534 O ILE A 35 -6.654 -17.520 -0.243 1.00 4.63 O ATOM 535 CB ILE A 35 -9.296 -17.050 1.613 1.00 6.90 C ATOM 536 CG1 ILE A 35 -8.191 -17.140 2.685 1.00 8.54 C ATOM 537 CG2 ILE A 35 -10.645 -17.518 2.172 1.00 7.33 C ATOM 538 CD1 ILE A 35 -8.376 -16.138 3.829 1.00 10.28 C ATOM 0 H ILE A 35 -7.515 -19.235 0.922 1.00 6.15 H new ATOM 0 HA ILE A 35 -9.830 -17.880 -0.292 1.00 5.52 H new ATOM 0 HB ILE A 35 -9.378 -15.999 1.335 1.00 6.90 H new ATOM 0 HG12 ILE A 35 -8.173 -18.150 3.095 1.00 8.54 H new ATOM 0 HG13 ILE A 35 -7.223 -16.969 2.214 1.00 8.54 H new ATOM 0 HG21 ILE A 35 -10.881 -16.953 3.074 1.00 7.33 H new ATOM 0 HG22 ILE A 35 -11.424 -17.355 1.427 1.00 7.33 H new ATOM 0 HG23 ILE A 35 -10.590 -18.580 2.413 1.00 7.33 H new ATOM 0 HD11 ILE A 35 -7.566 -16.254 4.549 1.00 10.28 H new ATOM 0 HD12 ILE A 35 -8.365 -15.124 3.430 1.00 10.28 H new ATOM 0 HD13 ILE A 35 -9.330 -16.323 4.324 1.00 10.28 H new ATOM 550 N ALA A 36 -8.139 -16.147 -1.265 1.00 3.64 N ATOM 551 CA ALA A 36 -7.190 -15.358 -2.048 1.00 3.31 C ATOM 552 C ALA A 36 -7.928 -14.336 -2.922 1.00 2.53 C ATOM 553 O ALA A 36 -8.185 -14.574 -4.104 1.00 2.52 O ATOM 554 CB ALA A 36 -6.313 -16.260 -2.927 1.00 3.69 C ATOM 0 H ALA A 36 -9.107 -15.862 -1.415 1.00 3.64 H new ATOM 0 HA ALA A 36 -6.545 -14.826 -1.348 1.00 3.31 H new ATOM 0 HB1 ALA A 36 -5.617 -15.646 -3.498 1.00 3.69 H new ATOM 0 HB2 ALA A 36 -5.754 -16.951 -2.296 1.00 3.69 H new ATOM 0 HB3 ALA A 36 -6.945 -16.825 -3.612 1.00 3.69 H new ATOM 560 N GLY A 37 -8.224 -13.152 -2.381 1.00 2.98 N ATOM 561 CA GLY A 37 -8.763 -12.045 -3.153 1.00 2.46 C ATOM 562 C GLY A 37 -10.248 -12.206 -3.418 1.00 2.19 C ATOM 563 O GLY A 37 -11.060 -11.431 -2.910 1.00 2.80 O ATOM 0 H GLY A 37 -8.094 -12.940 -1.392 1.00 2.98 H new ATOM 0 HA2 GLY A 37 -8.590 -11.111 -2.618 1.00 2.46 H new ATOM 0 HA3 GLY A 37 -8.231 -11.972 -4.102 1.00 2.46 H new ATOM 567 N GLU A 38 -10.584 -13.166 -4.276 1.00 1.93 N ATOM 568 CA GLU A 38 -11.941 -13.507 -4.657 1.00 1.86 C ATOM 569 C GLU A 38 -12.699 -12.305 -5.242 1.00 1.44 C ATOM 570 O GLU A 38 -12.707 -12.085 -6.458 1.00 1.37 O ATOM 571 CB GLU A 38 -12.645 -14.170 -3.461 1.00 2.23 C ATOM 572 CG GLU A 38 -12.005 -15.534 -3.163 1.00 2.87 C ATOM 573 CD GLU A 38 -11.864 -15.798 -1.673 1.00 4.11 C ATOM 574 OE1 GLU A 38 -12.855 -16.282 -1.083 1.00 4.56 O ATOM 575 OE2 GLU A 38 -10.770 -15.496 -1.147 1.00 5.35 O ATOM 0 H GLU A 38 -9.886 -13.747 -4.740 1.00 1.93 H new ATOM 0 HA GLU A 38 -11.922 -14.231 -5.472 1.00 1.86 H new ATOM 0 HB2 GLU A 38 -12.573 -13.526 -2.584 1.00 2.23 H new ATOM 0 HB3 GLU A 38 -13.706 -14.297 -3.678 1.00 2.23 H new ATOM 0 HG2 GLU A 38 -12.610 -16.321 -3.613 1.00 2.87 H new ATOM 0 HG3 GLU A 38 -11.022 -15.581 -3.632 1.00 2.87 H new ATOM 582 N HIS A 39 -13.286 -11.486 -4.363 1.00 1.38 N ATOM 583 CA HIS A 39 -14.240 -10.436 -4.687 1.00 1.34 C ATOM 584 C HIS A 39 -13.634 -9.481 -5.708 1.00 1.11 C ATOM 585 O HIS A 39 -14.279 -9.078 -6.675 1.00 1.39 O ATOM 586 CB HIS A 39 -14.622 -9.660 -3.420 1.00 1.64 C ATOM 587 CG HIS A 39 -15.072 -10.500 -2.252 1.00 2.61 C ATOM 588 ND1 HIS A 39 -15.281 -11.863 -2.229 1.00 3.25 N ATOM 589 CD2 HIS A 39 -15.257 -10.032 -0.980 1.00 3.91 C ATOM 590 CE1 HIS A 39 -15.579 -12.200 -0.961 1.00 4.27 C ATOM 591 NE2 HIS A 39 -15.565 -11.118 -0.161 1.00 4.75 N ATOM 0 H HIS A 39 -13.096 -11.545 -3.363 1.00 1.38 H new ATOM 0 HA HIS A 39 -15.135 -10.893 -5.108 1.00 1.34 H new ATOM 0 HB2 HIS A 39 -13.764 -9.065 -3.107 1.00 1.64 H new ATOM 0 HB3 HIS A 39 -15.420 -8.961 -3.671 1.00 1.64 H new ATOM 0 HD1 HIS A 39 -15.221 -12.498 -3.025 1.00 3.25 H new ATOM 0 HD2 HIS A 39 -15.178 -9.002 -0.665 1.00 3.91 H new ATOM 0 HE1 HIS A 39 -15.800 -13.204 -0.630 1.00 4.27 H new ATOM 599 N THR A 40 -12.374 -9.124 -5.459 1.00 1.00 N ATOM 600 CA THR A 40 -11.594 -8.264 -6.324 1.00 1.14 C ATOM 601 C THR A 40 -11.596 -8.787 -7.759 1.00 1.10 C ATOM 602 O THR A 40 -11.961 -8.067 -8.684 1.00 1.49 O ATOM 603 CB THR A 40 -10.185 -8.081 -5.736 1.00 1.40 C ATOM 604 OG1 THR A 40 -9.423 -7.231 -6.563 1.00 2.75 O ATOM 605 CG2 THR A 40 -9.415 -9.381 -5.499 1.00 2.00 C ATOM 0 H THR A 40 -11.865 -9.435 -4.632 1.00 1.00 H new ATOM 0 HA THR A 40 -12.049 -7.275 -6.373 1.00 1.14 H new ATOM 0 HB THR A 40 -10.339 -7.639 -4.752 1.00 1.40 H new ATOM 0 HG1 THR A 40 -9.427 -6.324 -6.192 1.00 2.75 H new ATOM 0 HG21 THR A 40 -8.434 -9.152 -5.083 1.00 2.00 H new ATOM 0 HG22 THR A 40 -9.968 -10.009 -4.800 1.00 2.00 H new ATOM 0 HG23 THR A 40 -9.294 -9.910 -6.444 1.00 2.00 H new ATOM 613 N SER A 41 -11.217 -10.051 -7.952 1.00 0.89 N ATOM 614 CA SER A 41 -11.210 -10.625 -9.292 1.00 0.93 C ATOM 615 C SER A 41 -12.636 -10.638 -9.844 1.00 1.10 C ATOM 616 O SER A 41 -12.864 -10.162 -10.954 1.00 1.30 O ATOM 617 CB SER A 41 -10.593 -12.027 -9.335 1.00 0.99 C ATOM 618 OG SER A 41 -9.373 -11.972 -10.041 1.00 1.87 O ATOM 0 H SER A 41 -10.917 -10.684 -7.211 1.00 0.89 H new ATOM 0 HA SER A 41 -10.577 -9.998 -9.920 1.00 0.93 H new ATOM 0 HB2 SER A 41 -10.426 -12.396 -8.323 1.00 0.99 H new ATOM 0 HB3 SER A 41 -11.277 -12.724 -9.819 1.00 0.99 H new ATOM 0 HG SER A 41 -9.477 -11.398 -10.829 1.00 1.87 H new ATOM 624 N PHE A 42 -13.572 -11.177 -9.052 1.00 1.21 N ATOM 625 CA PHE A 42 -14.992 -11.275 -9.374 1.00 1.54 C ATOM 626 C PHE A 42 -15.555 -9.957 -9.923 1.00 1.67 C ATOM 627 O PHE A 42 -16.355 -9.986 -10.859 1.00 1.94 O ATOM 628 CB PHE A 42 -15.760 -11.788 -8.144 1.00 1.81 C ATOM 629 CG PHE A 42 -17.264 -11.567 -8.132 1.00 2.04 C ATOM 630 CD1 PHE A 42 -18.043 -11.886 -9.259 1.00 2.71 C ATOM 631 CD2 PHE A 42 -17.897 -11.101 -6.962 1.00 2.72 C ATOM 632 CE1 PHE A 42 -19.427 -11.643 -9.252 1.00 2.96 C ATOM 633 CE2 PHE A 42 -19.295 -10.961 -6.920 1.00 3.03 C ATOM 634 CZ PHE A 42 -20.058 -11.201 -8.076 1.00 2.74 C ATOM 0 H PHE A 42 -13.348 -11.569 -8.138 1.00 1.21 H new ATOM 0 HA PHE A 42 -15.122 -11.996 -10.181 1.00 1.54 H new ATOM 0 HB2 PHE A 42 -15.573 -12.858 -8.049 1.00 1.81 H new ATOM 0 HB3 PHE A 42 -15.340 -11.311 -7.258 1.00 1.81 H new ATOM 0 HD1 PHE A 42 -17.576 -12.319 -10.132 1.00 2.71 H new ATOM 0 HD2 PHE A 42 -17.305 -10.850 -6.094 1.00 2.72 H new ATOM 0 HE1 PHE A 42 -20.006 -11.796 -10.151 1.00 2.96 H new ATOM 0 HE2 PHE A 42 -19.782 -10.670 -6.001 1.00 3.03 H new ATOM 0 HZ PHE A 42 -21.127 -11.046 -8.061 1.00 2.74 H new ATOM 644 N ASP A 43 -15.138 -8.802 -9.384 1.00 1.56 N ATOM 645 CA ASP A 43 -15.542 -7.508 -9.938 1.00 1.74 C ATOM 646 C ASP A 43 -15.362 -7.420 -11.447 1.00 1.83 C ATOM 647 O ASP A 43 -16.225 -6.857 -12.113 1.00 2.31 O ATOM 648 CB ASP A 43 -14.796 -6.346 -9.290 1.00 1.76 C ATOM 649 CG ASP A 43 -15.341 -5.019 -9.806 1.00 2.01 C ATOM 650 OD1 ASP A 43 -16.448 -4.649 -9.355 1.00 2.71 O ATOM 651 OD2 ASP A 43 -14.663 -4.417 -10.663 1.00 2.60 O ATOM 0 H ASP A 43 -14.525 -8.740 -8.571 1.00 1.56 H new ATOM 0 HA ASP A 43 -16.605 -7.431 -9.711 1.00 1.74 H new ATOM 0 HB2 ASP A 43 -14.902 -6.395 -8.206 1.00 1.76 H new ATOM 0 HB3 ASP A 43 -13.731 -6.420 -9.509 1.00 1.76 H new ATOM 656 N LYS A 44 -14.262 -8.005 -11.934 1.00 1.61 N ATOM 657 CA LYS A 44 -13.751 -8.130 -13.296 1.00 1.67 C ATOM 658 C LYS A 44 -12.349 -7.537 -13.314 1.00 1.56 C ATOM 659 O LYS A 44 -12.036 -6.653 -14.110 1.00 1.84 O ATOM 660 CB LYS A 44 -14.669 -7.558 -14.384 1.00 2.11 C ATOM 661 CG LYS A 44 -15.903 -8.460 -14.525 1.00 3.34 C ATOM 662 CD LYS A 44 -17.148 -7.653 -14.915 1.00 3.74 C ATOM 663 CE LYS A 44 -17.010 -7.021 -16.307 1.00 4.08 C ATOM 664 NZ LYS A 44 -18.162 -6.153 -16.626 1.00 4.67 N ATOM 0 H LYS A 44 -13.623 -8.465 -11.285 1.00 1.61 H new ATOM 0 HA LYS A 44 -13.717 -9.187 -13.560 1.00 1.67 H new ATOM 0 HB2 LYS A 44 -14.972 -6.544 -14.125 1.00 2.11 H new ATOM 0 HB3 LYS A 44 -14.136 -7.499 -15.333 1.00 2.11 H new ATOM 0 HG2 LYS A 44 -15.712 -9.224 -15.279 1.00 3.34 H new ATOM 0 HG3 LYS A 44 -16.085 -8.979 -13.584 1.00 3.34 H new ATOM 0 HD2 LYS A 44 -18.022 -8.304 -14.897 1.00 3.74 H new ATOM 0 HD3 LYS A 44 -17.319 -6.870 -14.176 1.00 3.74 H new ATOM 0 HE2 LYS A 44 -16.090 -6.438 -16.353 1.00 4.08 H new ATOM 0 HE3 LYS A 44 -16.927 -7.807 -17.058 1.00 4.08 H new ATOM 0 HZ1 LYS A 44 -18.036 -5.743 -17.573 1.00 4.67 H new ATOM 0 HZ2 LYS A 44 -19.037 -6.716 -16.606 1.00 4.67 H new ATOM 0 HZ3 LYS A 44 -18.226 -5.389 -15.923 1.00 4.67 H new ATOM 678 N LEU A 45 -11.504 -8.078 -12.434 1.00 1.42 N ATOM 679 CA LEU A 45 -10.076 -7.803 -12.405 1.00 1.48 C ATOM 680 C LEU A 45 -9.341 -9.103 -12.751 1.00 1.48 C ATOM 681 O LEU A 45 -9.670 -10.156 -12.196 1.00 2.12 O ATOM 682 CB LEU A 45 -9.633 -7.231 -11.051 1.00 1.62 C ATOM 683 CG LEU A 45 -10.108 -5.784 -10.824 1.00 1.47 C ATOM 684 CD1 LEU A 45 -9.892 -5.391 -9.359 1.00 1.61 C ATOM 685 CD2 LEU A 45 -9.338 -4.798 -11.713 1.00 2.17 C ATOM 0 H LEU A 45 -11.804 -8.731 -11.710 1.00 1.42 H new ATOM 0 HA LEU A 45 -9.829 -7.036 -13.139 1.00 1.48 H new ATOM 0 HB2 LEU A 45 -10.019 -7.864 -10.252 1.00 1.62 H new ATOM 0 HB3 LEU A 45 -8.545 -7.265 -10.987 1.00 1.62 H new ATOM 0 HG LEU A 45 -11.167 -5.739 -11.079 1.00 1.47 H new ATOM 0 HD11 LEU A 45 -10.230 -4.366 -9.204 1.00 1.61 H new ATOM 0 HD12 LEU A 45 -10.460 -6.062 -8.715 1.00 1.61 H new ATOM 0 HD13 LEU A 45 -8.832 -5.465 -9.115 1.00 1.61 H new ATOM 0 HD21 LEU A 45 -9.697 -3.785 -11.529 1.00 2.17 H new ATOM 0 HD22 LEU A 45 -8.274 -4.854 -11.482 1.00 2.17 H new ATOM 0 HD23 LEU A 45 -9.495 -5.054 -12.761 1.00 2.17 H new ATOM 697 N PRO A 46 -8.370 -9.043 -13.676 1.00 1.12 N ATOM 698 CA PRO A 46 -7.716 -10.209 -14.251 1.00 1.25 C ATOM 699 C PRO A 46 -6.756 -10.851 -13.244 1.00 1.36 C ATOM 700 O PRO A 46 -6.895 -10.656 -12.033 1.00 1.63 O ATOM 701 CB PRO A 46 -7.011 -9.661 -15.504 1.00 1.55 C ATOM 702 CG PRO A 46 -6.651 -8.233 -15.105 1.00 1.68 C ATOM 703 CD PRO A 46 -7.877 -7.822 -14.295 1.00 1.34 C ATOM 0 HA PRO A 46 -8.407 -11.012 -14.510 1.00 1.25 H new ATOM 0 HB2 PRO A 46 -6.125 -10.244 -15.755 1.00 1.55 H new ATOM 0 HB3 PRO A 46 -7.665 -9.683 -16.376 1.00 1.55 H new ATOM 0 HG2 PRO A 46 -5.736 -8.191 -14.514 1.00 1.68 H new ATOM 0 HG3 PRO A 46 -6.499 -7.591 -15.973 1.00 1.68 H new ATOM 0 HD2 PRO A 46 -7.617 -7.079 -13.541 1.00 1.34 H new ATOM 0 HD3 PRO A 46 -8.637 -7.374 -14.935 1.00 1.34 H new ATOM 711 N GLU A 47 -5.778 -11.599 -13.763 1.00 1.87 N ATOM 712 CA GLU A 47 -4.709 -12.268 -13.039 1.00 2.41 C ATOM 713 C GLU A 47 -3.328 -11.809 -13.547 1.00 1.97 C ATOM 714 O GLU A 47 -2.341 -12.533 -13.465 1.00 2.65 O ATOM 715 CB GLU A 47 -4.930 -13.783 -13.140 1.00 3.36 C ATOM 716 CG GLU A 47 -5.233 -14.283 -14.563 1.00 3.62 C ATOM 717 CD GLU A 47 -5.509 -15.777 -14.546 1.00 4.86 C ATOM 718 OE1 GLU A 47 -4.582 -16.534 -14.195 1.00 5.76 O ATOM 719 OE2 GLU A 47 -6.665 -16.163 -14.811 1.00 5.55 O ATOM 0 H GLU A 47 -5.714 -11.760 -14.768 1.00 1.87 H new ATOM 0 HA GLU A 47 -4.729 -11.997 -11.983 1.00 2.41 H new ATOM 0 HB2 GLU A 47 -4.041 -14.294 -12.769 1.00 3.36 H new ATOM 0 HB3 GLU A 47 -5.755 -14.063 -12.485 1.00 3.36 H new ATOM 0 HG2 GLU A 47 -6.094 -13.751 -14.968 1.00 3.62 H new ATOM 0 HG3 GLU A 47 -4.389 -14.069 -15.219 1.00 3.62 H new ATOM 726 N GLY A 48 -3.253 -10.579 -14.067 1.00 1.44 N ATOM 727 CA GLY A 48 -2.024 -9.969 -14.539 1.00 1.73 C ATOM 728 C GLY A 48 -1.057 -9.635 -13.399 1.00 1.16 C ATOM 729 O GLY A 48 -1.450 -9.096 -12.369 1.00 2.13 O ATOM 0 H GLY A 48 -4.068 -9.974 -14.170 1.00 1.44 H new ATOM 0 HA2 GLY A 48 -1.534 -10.644 -15.240 1.00 1.73 H new ATOM 0 HA3 GLY A 48 -2.262 -9.058 -15.087 1.00 1.73 H new ATOM 733 N GLY A 49 0.231 -9.897 -13.613 1.00 1.19 N ATOM 734 CA GLY A 49 1.257 -9.843 -12.574 1.00 1.05 C ATOM 735 C GLY A 49 1.579 -8.456 -11.996 1.00 1.06 C ATOM 736 O GLY A 49 2.476 -8.344 -11.162 1.00 1.75 O ATOM 0 H GLY A 49 0.597 -10.157 -14.529 1.00 1.19 H new ATOM 0 HA2 GLY A 49 0.946 -10.490 -11.754 1.00 1.05 H new ATOM 0 HA3 GLY A 49 2.176 -10.264 -12.981 1.00 1.05 H new ATOM 740 N ARG A 50 0.921 -7.383 -12.447 1.00 0.68 N ATOM 741 CA ARG A 50 1.091 -6.046 -11.889 1.00 0.68 C ATOM 742 C ARG A 50 -0.144 -5.198 -12.198 1.00 0.74 C ATOM 743 O ARG A 50 -0.471 -5.012 -13.370 1.00 1.07 O ATOM 744 CB ARG A 50 2.394 -5.378 -12.373 1.00 0.80 C ATOM 745 CG ARG A 50 2.662 -5.351 -13.889 1.00 2.00 C ATOM 746 CD ARG A 50 3.289 -6.650 -14.421 1.00 2.66 C ATOM 747 NE ARG A 50 3.730 -6.516 -15.820 1.00 3.94 N ATOM 748 CZ ARG A 50 4.881 -5.956 -16.229 1.00 4.86 C ATOM 749 NH1 ARG A 50 5.710 -5.407 -15.334 1.00 4.72 N ATOM 750 NH2 ARG A 50 5.195 -5.947 -17.530 1.00 6.48 N ATOM 0 H ARG A 50 0.251 -7.423 -13.215 1.00 0.68 H new ATOM 0 HA ARG A 50 1.186 -6.132 -10.807 1.00 0.68 H new ATOM 0 HB2 ARG A 50 2.398 -4.349 -12.013 1.00 0.80 H new ATOM 0 HB3 ARG A 50 3.230 -5.886 -11.893 1.00 0.80 H new ATOM 0 HG2 ARG A 50 1.724 -5.168 -14.413 1.00 2.00 H new ATOM 0 HG3 ARG A 50 3.324 -4.516 -14.119 1.00 2.00 H new ATOM 0 HD2 ARG A 50 4.140 -6.924 -13.797 1.00 2.66 H new ATOM 0 HD3 ARG A 50 2.564 -7.460 -14.345 1.00 2.66 H new ATOM 0 HE ARG A 50 3.107 -6.880 -16.541 1.00 3.94 H new ATOM 0 HH11 ARG A 50 5.468 -5.414 -14.343 1.00 4.72 H new ATOM 0 HH12 ARG A 50 6.584 -4.981 -15.642 1.00 4.72 H new ATOM 0 HH21 ARG A 50 4.561 -6.365 -18.211 1.00 6.48 H new ATOM 0 HH22 ARG A 50 6.069 -5.522 -17.841 1.00 6.48 H new ATOM 764 N ALA A 51 -0.803 -4.650 -11.173 1.00 0.85 N ATOM 765 CA ALA A 51 -1.716 -3.528 -11.386 1.00 0.82 C ATOM 766 C ALA A 51 -0.931 -2.230 -11.533 1.00 0.63 C ATOM 767 O ALA A 51 0.285 -2.195 -11.354 1.00 0.95 O ATOM 768 CB ALA A 51 -2.716 -3.355 -10.242 1.00 1.26 C ATOM 0 H ALA A 51 -0.723 -4.959 -10.204 1.00 0.85 H new ATOM 0 HA ALA A 51 -2.271 -3.754 -12.297 1.00 0.82 H new ATOM 0 HB1 ALA A 51 -3.368 -2.508 -10.454 1.00 1.26 H new ATOM 0 HB2 ALA A 51 -3.316 -4.259 -10.144 1.00 1.26 H new ATOM 0 HB3 ALA A 51 -2.177 -3.174 -9.312 1.00 1.26 H new ATOM 774 N THR A 52 -1.659 -1.149 -11.809 1.00 0.65 N ATOM 775 CA THR A 52 -1.146 0.206 -11.907 1.00 0.80 C ATOM 776 C THR A 52 -1.573 0.986 -10.649 1.00 1.02 C ATOM 777 O THR A 52 -2.209 2.034 -10.715 1.00 1.28 O ATOM 778 CB THR A 52 -1.640 0.796 -13.247 1.00 0.99 C ATOM 779 OG1 THR A 52 -1.287 2.153 -13.406 1.00 1.41 O ATOM 780 CG2 THR A 52 -3.148 0.606 -13.458 1.00 1.02 C ATOM 0 H THR A 52 -2.664 -1.202 -11.977 1.00 0.65 H new ATOM 0 HA THR A 52 -0.057 0.258 -11.926 1.00 0.80 H new ATOM 0 HB THR A 52 -1.123 0.226 -14.019 1.00 0.99 H new ATOM 0 HG1 THR A 52 -1.548 2.655 -12.606 1.00 1.41 H new ATOM 0 HG21 THR A 52 -3.439 1.040 -14.415 1.00 1.02 H new ATOM 0 HG22 THR A 52 -3.385 -0.458 -13.455 1.00 1.02 H new ATOM 0 HG23 THR A 52 -3.693 1.101 -12.654 1.00 1.02 H new ATOM 788 N TYR A 53 -1.176 0.498 -9.468 1.00 1.48 N ATOM 789 CA TYR A 53 -1.394 1.201 -8.202 1.00 1.89 C ATOM 790 C TYR A 53 -0.324 2.289 -8.061 1.00 1.83 C ATOM 791 O TYR A 53 0.507 2.267 -7.158 1.00 2.38 O ATOM 792 CB TYR A 53 -1.353 0.215 -7.026 1.00 2.17 C ATOM 793 CG TYR A 53 -2.558 -0.686 -6.816 1.00 2.04 C ATOM 794 CD1 TYR A 53 -2.725 -1.279 -5.554 1.00 2.94 C ATOM 795 CD2 TYR A 53 -3.465 -0.997 -7.849 1.00 2.65 C ATOM 796 CE1 TYR A 53 -3.666 -2.306 -5.374 1.00 3.11 C ATOM 797 CE2 TYR A 53 -4.432 -1.998 -7.655 1.00 3.19 C ATOM 798 CZ TYR A 53 -4.537 -2.652 -6.417 1.00 2.91 C ATOM 799 OH TYR A 53 -5.389 -3.703 -6.268 1.00 3.60 O ATOM 0 H TYR A 53 -0.695 -0.395 -9.365 1.00 1.48 H new ATOM 0 HA TYR A 53 -2.380 1.666 -8.195 1.00 1.89 H new ATOM 0 HB2 TYR A 53 -0.477 -0.421 -7.152 1.00 2.17 H new ATOM 0 HB3 TYR A 53 -1.201 0.789 -6.112 1.00 2.17 H new ATOM 0 HD1 TYR A 53 -2.128 -0.944 -4.719 1.00 2.94 H new ATOM 0 HD2 TYR A 53 -3.417 -0.467 -8.789 1.00 2.65 H new ATOM 0 HE1 TYR A 53 -3.719 -2.830 -4.431 1.00 3.11 H new ATOM 0 HE2 TYR A 53 -5.098 -2.266 -8.462 1.00 3.19 H new ATOM 0 HH TYR A 53 -5.556 -3.856 -5.315 1.00 3.60 H new ATOM 809 N ARG A 54 -0.314 3.213 -9.016 1.00 1.45 N ATOM 810 CA ARG A 54 0.713 4.224 -9.186 1.00 1.36 C ATOM 811 C ARG A 54 0.310 5.432 -8.342 1.00 1.01 C ATOM 812 O ARG A 54 -0.660 6.105 -8.694 1.00 1.19 O ATOM 813 CB ARG A 54 0.774 4.504 -10.696 1.00 2.00 C ATOM 814 CG ARG A 54 1.888 5.458 -11.143 1.00 1.33 C ATOM 815 CD ARG A 54 1.556 6.944 -10.968 1.00 2.27 C ATOM 816 NE ARG A 54 0.293 7.300 -11.656 1.00 3.38 N ATOM 817 CZ ARG A 54 0.073 8.366 -12.438 1.00 4.37 C ATOM 818 NH1 ARG A 54 0.923 9.399 -12.416 1.00 4.60 N ATOM 819 NH2 ARG A 54 -0.992 8.403 -13.244 1.00 5.53 N ATOM 0 H ARG A 54 -1.051 3.277 -9.718 1.00 1.45 H new ATOM 0 HA ARG A 54 1.708 3.929 -8.852 1.00 1.36 H new ATOM 0 HB2 ARG A 54 0.899 3.556 -11.219 1.00 2.00 H new ATOM 0 HB3 ARG A 54 -0.184 4.918 -11.011 1.00 2.00 H new ATOM 0 HG2 ARG A 54 2.792 5.231 -10.578 1.00 1.33 H new ATOM 0 HG3 ARG A 54 2.112 5.269 -12.193 1.00 1.33 H new ATOM 0 HD2 ARG A 54 1.472 7.177 -9.907 1.00 2.27 H new ATOM 0 HD3 ARG A 54 2.371 7.550 -11.364 1.00 2.27 H new ATOM 0 HE ARG A 54 -0.494 6.665 -11.520 1.00 3.38 H new ATOM 0 HH11 ARG A 54 1.739 9.375 -11.804 1.00 4.60 H new ATOM 0 HH12 ARG A 54 0.755 10.210 -13.011 1.00 4.60 H new ATOM 0 HH21 ARG A 54 -1.642 7.618 -13.266 1.00 5.53 H new ATOM 0 HH22 ARG A 54 -1.155 9.217 -13.837 1.00 5.53 H new ATOM 833 N GLY A 55 0.981 5.701 -7.212 1.00 0.79 N ATOM 834 CA GLY A 55 0.429 6.641 -6.252 1.00 0.76 C ATOM 835 C GLY A 55 1.458 7.276 -5.339 1.00 0.71 C ATOM 836 O GLY A 55 2.664 7.167 -5.557 1.00 0.76 O ATOM 0 H GLY A 55 1.878 5.291 -6.954 1.00 0.79 H new ATOM 0 HA2 GLY A 55 -0.095 7.429 -6.793 1.00 0.76 H new ATOM 0 HA3 GLY A 55 -0.313 6.126 -5.642 1.00 0.76 H new ATOM 840 N THR A 56 0.967 7.959 -4.307 1.00 0.70 N ATOM 841 CA THR A 56 1.797 8.682 -3.368 1.00 0.81 C ATOM 842 C THR A 56 1.166 8.632 -1.981 1.00 0.82 C ATOM 843 O THR A 56 -0.056 8.532 -1.846 1.00 0.95 O ATOM 844 CB THR A 56 2.061 10.109 -3.876 1.00 1.32 C ATOM 845 OG1 THR A 56 3.077 10.705 -3.097 1.00 2.92 O ATOM 846 CG2 THR A 56 0.806 10.986 -3.856 1.00 1.77 C ATOM 0 H THR A 56 -0.031 8.022 -4.104 1.00 0.70 H new ATOM 0 HA THR A 56 2.775 8.208 -3.285 1.00 0.81 H new ATOM 0 HB THR A 56 2.377 10.031 -4.916 1.00 1.32 H new ATOM 0 HG1 THR A 56 3.247 11.614 -3.421 1.00 2.92 H new ATOM 0 HG21 THR A 56 1.052 11.982 -4.225 1.00 1.77 H new ATOM 0 HG22 THR A 56 0.041 10.542 -4.493 1.00 1.77 H new ATOM 0 HG23 THR A 56 0.430 11.060 -2.836 1.00 1.77 H new ATOM 854 N ALA A 57 2.036 8.663 -0.973 1.00 0.98 N ATOM 855 CA ALA A 57 1.726 8.635 0.442 1.00 1.20 C ATOM 856 C ALA A 57 2.191 9.944 1.077 1.00 1.37 C ATOM 857 O ALA A 57 3.299 10.397 0.808 1.00 2.17 O ATOM 858 CB ALA A 57 2.406 7.419 1.076 1.00 1.23 C ATOM 0 H ALA A 57 3.041 8.712 -1.142 1.00 0.98 H new ATOM 0 HA ALA A 57 0.652 8.544 0.606 1.00 1.20 H new ATOM 0 HB1 ALA A 57 2.178 7.389 2.142 1.00 1.23 H new ATOM 0 HB2 ALA A 57 2.040 6.509 0.601 1.00 1.23 H new ATOM 0 HB3 ALA A 57 3.485 7.492 0.937 1.00 1.23 H new ATOM 864 N PHE A 58 1.356 10.554 1.916 1.00 0.95 N ATOM 865 CA PHE A 58 1.698 11.753 2.666 1.00 1.04 C ATOM 866 C PHE A 58 1.699 11.412 4.144 1.00 0.77 C ATOM 867 O PHE A 58 0.792 10.743 4.638 1.00 0.66 O ATOM 868 CB PHE A 58 0.772 12.918 2.325 1.00 1.37 C ATOM 869 CG PHE A 58 -0.653 12.742 2.809 1.00 1.37 C ATOM 870 CD1 PHE A 58 -1.579 12.014 2.041 1.00 1.92 C ATOM 871 CD2 PHE A 58 -0.993 13.159 4.110 1.00 2.44 C ATOM 872 CE1 PHE A 58 -2.849 11.718 2.566 1.00 2.23 C ATOM 873 CE2 PHE A 58 -2.249 12.835 4.646 1.00 2.57 C ATOM 874 CZ PHE A 58 -3.185 12.128 3.869 1.00 1.95 C ATOM 0 H PHE A 58 0.409 10.221 2.094 1.00 0.95 H new ATOM 0 HA PHE A 58 2.696 12.092 2.387 1.00 1.04 H new ATOM 0 HB2 PHE A 58 1.181 13.831 2.758 1.00 1.37 H new ATOM 0 HB3 PHE A 58 0.762 13.055 1.244 1.00 1.37 H new ATOM 0 HD1 PHE A 58 -1.315 11.682 1.048 1.00 1.92 H new ATOM 0 HD2 PHE A 58 -0.287 13.729 4.696 1.00 2.44 H new ATOM 0 HE1 PHE A 58 -3.567 11.176 1.969 1.00 2.23 H new ATOM 0 HE2 PHE A 58 -2.497 13.128 5.655 1.00 2.57 H new ATOM 0 HZ PHE A 58 -4.161 11.900 4.273 1.00 1.95 H new ATOM 884 N GLY A 59 2.748 11.851 4.834 1.00 0.77 N ATOM 885 CA GLY A 59 2.896 11.638 6.264 1.00 0.72 C ATOM 886 C GLY A 59 2.017 12.621 7.032 1.00 0.90 C ATOM 887 O GLY A 59 1.606 13.649 6.496 1.00 1.08 O ATOM 0 H GLY A 59 3.521 12.366 4.412 1.00 0.77 H new ATOM 0 HA2 GLY A 59 2.619 10.615 6.518 1.00 0.72 H new ATOM 0 HA3 GLY A 59 3.939 11.767 6.553 1.00 0.72 H new ATOM 891 N SER A 60 1.776 12.352 8.315 1.00 1.01 N ATOM 892 CA SER A 60 1.116 13.301 9.198 1.00 1.26 C ATOM 893 C SER A 60 1.856 14.642 9.194 1.00 1.27 C ATOM 894 O SER A 60 1.234 15.698 9.233 1.00 1.49 O ATOM 895 CB SER A 60 1.066 12.692 10.600 1.00 1.43 C ATOM 896 OG SER A 60 2.274 12.008 10.892 1.00 3.14 O ATOM 0 H SER A 60 2.033 11.474 8.765 1.00 1.01 H new ATOM 0 HA SER A 60 0.101 13.498 8.853 1.00 1.26 H new ATOM 0 HB2 SER A 60 0.899 13.477 11.337 1.00 1.43 H new ATOM 0 HB3 SER A 60 0.225 12.003 10.673 1.00 1.43 H new ATOM 0 HG SER A 60 2.224 11.627 11.793 1.00 3.14 H new ATOM 902 N ASP A 61 3.189 14.566 9.138 1.00 1.17 N ATOM 903 CA ASP A 61 4.098 15.701 9.068 1.00 1.30 C ATOM 904 C ASP A 61 4.568 15.924 7.619 1.00 1.22 C ATOM 905 O ASP A 61 5.661 16.434 7.396 1.00 1.26 O ATOM 906 CB ASP A 61 5.281 15.365 9.993 1.00 1.50 C ATOM 907 CG ASP A 61 6.193 16.556 10.264 1.00 1.86 C ATOM 908 OD1 ASP A 61 7.422 16.326 10.290 1.00 2.08 O ATOM 909 OD2 ASP A 61 5.645 17.652 10.505 1.00 2.88 O ATOM 0 H ASP A 61 3.679 13.672 9.141 1.00 1.17 H new ATOM 0 HA ASP A 61 3.612 16.624 9.384 1.00 1.30 H new ATOM 0 HB2 ASP A 61 4.896 14.988 10.941 1.00 1.50 H new ATOM 0 HB3 ASP A 61 5.867 14.562 9.545 1.00 1.50 H new ATOM 914 N ASP A 62 3.789 15.453 6.630 1.00 1.21 N ATOM 915 CA ASP A 62 4.269 15.017 5.336 1.00 1.22 C ATOM 916 C ASP A 62 5.774 14.861 5.130 1.00 1.17 C ATOM 917 O ASP A 62 6.430 15.662 4.465 1.00 1.52 O ATOM 918 CB ASP A 62 3.549 15.628 4.135 1.00 1.41 C ATOM 919 CG ASP A 62 3.772 14.735 2.917 1.00 1.68 C ATOM 920 OD1 ASP A 62 4.294 13.611 3.120 1.00 2.65 O ATOM 921 OD2 ASP A 62 3.355 15.149 1.817 1.00 2.20 O ATOM 0 H ASP A 62 2.777 15.368 6.727 1.00 1.21 H new ATOM 0 HA ASP A 62 3.951 13.975 5.383 1.00 1.22 H new ATOM 0 HB2 ASP A 62 2.483 15.723 4.343 1.00 1.41 H new ATOM 0 HB3 ASP A 62 3.926 16.632 3.940 1.00 1.41 H new ATOM 926 N ALA A 63 6.268 13.721 5.608 1.00 0.91 N ATOM 927 CA ALA A 63 7.453 13.087 5.070 1.00 0.90 C ATOM 928 C ALA A 63 7.036 11.705 4.570 1.00 0.79 C ATOM 929 O ALA A 63 7.597 10.691 4.982 1.00 0.86 O ATOM 930 CB ALA A 63 8.463 12.992 6.206 1.00 1.02 C ATOM 0 H ALA A 63 5.848 13.213 6.386 1.00 0.91 H new ATOM 0 HA ALA A 63 7.901 13.640 4.244 1.00 0.90 H new ATOM 0 HB1 ALA A 63 9.375 12.518 5.843 1.00 1.02 H new ATOM 0 HB2 ALA A 63 8.694 13.992 6.572 1.00 1.02 H new ATOM 0 HB3 ALA A 63 8.043 12.397 7.017 1.00 1.02 H new ATOM 936 N GLY A 64 6.045 11.657 3.680 1.00 0.86 N ATOM 937 CA GLY A 64 5.449 10.410 3.243 1.00 0.82 C ATOM 938 C GLY A 64 6.105 9.898 1.956 1.00 0.76 C ATOM 939 O GLY A 64 6.829 10.609 1.251 1.00 1.03 O ATOM 0 H GLY A 64 5.638 12.485 3.246 1.00 0.86 H new ATOM 0 HA2 GLY A 64 5.551 9.661 4.028 1.00 0.82 H new ATOM 0 HA3 GLY A 64 4.381 10.554 3.077 1.00 0.82 H new ATOM 943 N GLY A 65 5.896 8.618 1.657 1.00 0.77 N ATOM 944 CA GLY A 65 6.489 7.930 0.537 1.00 0.82 C ATOM 945 C GLY A 65 5.810 8.175 -0.797 1.00 0.61 C ATOM 946 O GLY A 65 4.817 8.879 -0.909 1.00 0.91 O ATOM 0 H GLY A 65 5.286 8.020 2.214 1.00 0.77 H new ATOM 0 HA2 GLY A 65 7.534 8.231 0.457 1.00 0.82 H new ATOM 0 HA3 GLY A 65 6.480 6.859 0.741 1.00 0.82 H new ATOM 950 N LYS A 66 6.393 7.593 -1.837 1.00 0.59 N ATOM 951 CA LYS A 66 5.899 7.643 -3.196 1.00 0.81 C ATOM 952 C LYS A 66 5.697 6.176 -3.575 1.00 1.01 C ATOM 953 O LYS A 66 6.624 5.384 -3.413 1.00 1.44 O ATOM 954 CB LYS A 66 6.937 8.414 -4.017 1.00 1.45 C ATOM 955 CG LYS A 66 6.927 9.898 -3.589 1.00 1.74 C ATOM 956 CD LYS A 66 8.341 10.405 -3.288 1.00 2.83 C ATOM 957 CE LYS A 66 8.912 9.969 -1.923 1.00 3.55 C ATOM 958 NZ LYS A 66 8.421 10.789 -0.789 1.00 5.72 N ATOM 0 H LYS A 66 7.255 7.055 -1.748 1.00 0.59 H new ATOM 0 HA LYS A 66 4.956 8.165 -3.361 1.00 0.81 H new ATOM 0 HB2 LYS A 66 7.928 7.987 -3.865 1.00 1.45 H new ATOM 0 HB3 LYS A 66 6.713 8.329 -5.080 1.00 1.45 H new ATOM 0 HG2 LYS A 66 6.483 10.503 -4.380 1.00 1.74 H new ATOM 0 HG3 LYS A 66 6.300 10.019 -2.705 1.00 1.74 H new ATOM 0 HD2 LYS A 66 9.011 10.056 -4.074 1.00 2.83 H new ATOM 0 HD3 LYS A 66 8.338 11.494 -3.333 1.00 2.83 H new ATOM 0 HE2 LYS A 66 8.653 8.925 -1.746 1.00 3.55 H new ATOM 0 HE3 LYS A 66 10.000 10.025 -1.958 1.00 3.55 H new ATOM 0 HZ1 LYS A 66 9.231 11.149 -0.245 1.00 5.72 H new ATOM 0 HZ2 LYS A 66 7.866 11.589 -1.154 1.00 5.72 H new ATOM 0 HZ3 LYS A 66 7.822 10.204 -0.172 1.00 5.72 H new ATOM 972 N LEU A 67 4.461 5.790 -3.912 1.00 0.84 N ATOM 973 CA LEU A 67 4.027 4.401 -3.880 1.00 0.81 C ATOM 974 C LEU A 67 4.270 3.753 -5.238 1.00 0.73 C ATOM 975 O LEU A 67 3.654 4.144 -6.233 1.00 0.92 O ATOM 976 CB LEU A 67 2.539 4.305 -3.503 1.00 0.82 C ATOM 977 CG LEU A 67 2.134 2.847 -3.209 1.00 0.89 C ATOM 978 CD1 LEU A 67 2.380 2.499 -1.736 1.00 1.07 C ATOM 979 CD2 LEU A 67 0.667 2.592 -3.566 1.00 0.91 C ATOM 0 H LEU A 67 3.736 6.440 -4.215 1.00 0.84 H new ATOM 0 HA LEU A 67 4.605 3.872 -3.123 1.00 0.81 H new ATOM 0 HB2 LEU A 67 2.342 4.924 -2.628 1.00 0.82 H new ATOM 0 HB3 LEU A 67 1.929 4.698 -4.316 1.00 0.82 H new ATOM 0 HG LEU A 67 2.756 2.205 -3.833 1.00 0.89 H new ATOM 0 HD11 LEU A 67 2.087 1.465 -1.552 1.00 1.07 H new ATOM 0 HD12 LEU A 67 3.438 2.623 -1.505 1.00 1.07 H new ATOM 0 HD13 LEU A 67 1.790 3.161 -1.102 1.00 1.07 H new ATOM 0 HD21 LEU A 67 0.414 1.555 -3.347 1.00 0.91 H new ATOM 0 HD22 LEU A 67 0.029 3.253 -2.979 1.00 0.91 H new ATOM 0 HD23 LEU A 67 0.512 2.787 -4.627 1.00 0.91 H new ATOM 991 N THR A 68 5.129 2.732 -5.262 1.00 0.65 N ATOM 992 CA THR A 68 5.362 1.961 -6.468 1.00 0.64 C ATOM 993 C THR A 68 4.211 0.968 -6.664 1.00 0.66 C ATOM 994 O THR A 68 3.725 0.387 -5.699 1.00 0.87 O ATOM 995 CB THR A 68 6.717 1.240 -6.396 1.00 0.87 C ATOM 996 OG1 THR A 68 7.680 1.993 -5.675 1.00 1.85 O ATOM 997 CG2 THR A 68 7.236 1.044 -7.824 1.00 1.62 C ATOM 0 H THR A 68 5.672 2.426 -4.455 1.00 0.65 H new ATOM 0 HA THR A 68 5.396 2.631 -7.327 1.00 0.64 H new ATOM 0 HB THR A 68 6.569 0.290 -5.883 1.00 0.87 H new ATOM 0 HG1 THR A 68 7.551 1.853 -4.714 1.00 1.85 H new ATOM 0 HG21 THR A 68 8.198 0.533 -7.794 1.00 1.62 H new ATOM 0 HG22 THR A 68 6.524 0.444 -8.391 1.00 1.62 H new ATOM 0 HG23 THR A 68 7.355 2.015 -8.304 1.00 1.62 H new ATOM 1005 N TYR A 69 3.781 0.765 -7.910 1.00 0.62 N ATOM 1006 CA TYR A 69 2.693 -0.147 -8.232 1.00 0.66 C ATOM 1007 C TYR A 69 3.226 -1.580 -8.217 1.00 0.62 C ATOM 1008 O TYR A 69 4.152 -1.895 -8.964 1.00 0.69 O ATOM 1009 CB TYR A 69 2.087 0.227 -9.592 1.00 0.68 C ATOM 1010 CG TYR A 69 3.050 0.400 -10.753 1.00 0.69 C ATOM 1011 CD1 TYR A 69 3.605 1.667 -11.020 1.00 2.14 C ATOM 1012 CD2 TYR A 69 3.319 -0.675 -11.621 1.00 1.73 C ATOM 1013 CE1 TYR A 69 4.460 1.845 -12.120 1.00 2.30 C ATOM 1014 CE2 TYR A 69 4.169 -0.493 -12.726 1.00 1.68 C ATOM 1015 CZ TYR A 69 4.745 0.765 -12.971 1.00 1.01 C ATOM 1016 OH TYR A 69 5.572 0.949 -14.037 1.00 1.30 O ATOM 0 H TYR A 69 4.181 1.232 -8.724 1.00 0.62 H new ATOM 0 HA TYR A 69 1.898 -0.071 -7.490 1.00 0.66 H new ATOM 0 HB2 TYR A 69 1.364 -0.542 -9.864 1.00 0.68 H new ATOM 0 HB3 TYR A 69 1.532 1.157 -9.471 1.00 0.68 H new ATOM 0 HD1 TYR A 69 3.373 2.503 -10.377 1.00 2.14 H new ATOM 0 HD2 TYR A 69 2.872 -1.641 -11.438 1.00 1.73 H new ATOM 0 HE1 TYR A 69 4.899 2.813 -12.311 1.00 2.30 H new ATOM 0 HE2 TYR A 69 4.379 -1.321 -13.387 1.00 1.68 H new ATOM 0 HH TYR A 69 5.669 0.105 -14.526 1.00 1.30 H new ATOM 1026 N THR A 70 2.721 -2.445 -7.328 1.00 0.59 N ATOM 1027 CA THR A 70 3.284 -3.782 -7.158 1.00 0.69 C ATOM 1028 C THR A 70 2.262 -4.767 -6.590 1.00 0.74 C ATOM 1029 O THR A 70 2.411 -5.239 -5.466 1.00 1.02 O ATOM 1030 CB THR A 70 4.511 -3.706 -6.238 1.00 0.88 C ATOM 1031 OG1 THR A 70 5.383 -2.666 -6.639 1.00 1.33 O ATOM 1032 CG2 THR A 70 5.285 -5.023 -6.296 1.00 1.05 C ATOM 0 H THR A 70 1.928 -2.240 -6.720 1.00 0.59 H new ATOM 0 HA THR A 70 3.577 -4.151 -8.141 1.00 0.69 H new ATOM 0 HB THR A 70 4.155 -3.512 -5.226 1.00 0.88 H new ATOM 0 HG1 THR A 70 6.156 -2.637 -6.037 1.00 1.33 H new ATOM 0 HG21 THR A 70 6.154 -4.963 -5.641 1.00 1.05 H new ATOM 0 HG22 THR A 70 4.640 -5.839 -5.969 1.00 1.05 H new ATOM 0 HG23 THR A 70 5.613 -5.207 -7.319 1.00 1.05 H new ATOM 1040 N ILE A 71 1.224 -5.098 -7.357 1.00 0.70 N ATOM 1041 CA ILE A 71 0.173 -5.993 -6.888 1.00 0.71 C ATOM 1042 C ILE A 71 -0.065 -7.025 -7.988 1.00 0.71 C ATOM 1043 O ILE A 71 -0.483 -6.676 -9.091 1.00 0.97 O ATOM 1044 CB ILE A 71 -1.054 -5.198 -6.407 1.00 0.88 C ATOM 1045 CG1 ILE A 71 -2.060 -4.826 -7.487 1.00 1.17 C ATOM 1046 CG2 ILE A 71 -0.571 -3.885 -5.771 1.00 1.23 C ATOM 1047 CD1 ILE A 71 -3.218 -5.821 -7.559 1.00 1.23 C ATOM 0 H ILE A 71 1.090 -4.757 -8.309 1.00 0.70 H new ATOM 0 HA ILE A 71 0.457 -6.549 -5.995 1.00 0.71 H new ATOM 0 HB ILE A 71 -1.568 -5.863 -5.713 1.00 0.88 H new ATOM 0 HG12 ILE A 71 -2.451 -3.828 -7.289 1.00 1.17 H new ATOM 0 HG13 ILE A 71 -1.556 -4.785 -8.453 1.00 1.17 H new ATOM 0 HG21 ILE A 71 -1.430 -3.311 -5.425 1.00 1.23 H new ATOM 0 HG22 ILE A 71 0.080 -4.108 -4.926 1.00 1.23 H new ATOM 0 HG23 ILE A 71 -0.020 -3.304 -6.510 1.00 1.23 H new ATOM 0 HD11 ILE A 71 -3.911 -5.516 -8.343 1.00 1.23 H new ATOM 0 HD12 ILE A 71 -2.830 -6.815 -7.783 1.00 1.23 H new ATOM 0 HD13 ILE A 71 -3.739 -5.842 -6.602 1.00 1.23 H new ATOM 1059 N ASP A 72 0.280 -8.285 -7.721 1.00 0.74 N ATOM 1060 CA ASP A 72 0.051 -9.356 -8.670 1.00 0.81 C ATOM 1061 C ASP A 72 -1.433 -9.685 -8.626 1.00 0.80 C ATOM 1062 O ASP A 72 -1.922 -10.165 -7.599 1.00 0.93 O ATOM 1063 CB ASP A 72 0.919 -10.570 -8.325 1.00 0.94 C ATOM 1064 CG ASP A 72 0.818 -11.639 -9.400 1.00 2.03 C ATOM 1065 OD1 ASP A 72 -0.316 -11.847 -9.880 1.00 3.03 O ATOM 1066 OD2 ASP A 72 1.874 -12.211 -9.737 1.00 3.14 O ATOM 0 H ASP A 72 0.720 -8.582 -6.850 1.00 0.74 H new ATOM 0 HA ASP A 72 0.330 -9.056 -9.680 1.00 0.81 H new ATOM 0 HB2 ASP A 72 1.958 -10.258 -8.214 1.00 0.94 H new ATOM 0 HB3 ASP A 72 0.606 -10.984 -7.366 1.00 0.94 H new ATOM 1071 N PHE A 73 -2.165 -9.404 -9.707 1.00 0.87 N ATOM 1072 CA PHE A 73 -3.592 -9.656 -9.759 1.00 0.92 C ATOM 1073 C PHE A 73 -3.935 -11.146 -9.620 1.00 1.18 C ATOM 1074 O PHE A 73 -5.119 -11.450 -9.511 1.00 1.45 O ATOM 1075 CB PHE A 73 -4.259 -9.100 -11.027 1.00 0.88 C ATOM 1076 CG PHE A 73 -4.244 -7.601 -11.273 1.00 0.92 C ATOM 1077 CD1 PHE A 73 -4.937 -6.764 -10.387 1.00 2.26 C ATOM 1078 CD2 PHE A 73 -3.888 -7.102 -12.540 1.00 1.73 C ATOM 1079 CE1 PHE A 73 -5.377 -5.496 -10.791 1.00 2.68 C ATOM 1080 CE2 PHE A 73 -4.263 -5.803 -12.925 1.00 1.61 C ATOM 1081 CZ PHE A 73 -5.045 -5.013 -12.067 1.00 1.58 C ATOM 0 H PHE A 73 -1.781 -8.999 -10.561 1.00 0.87 H new ATOM 0 HA PHE A 73 -3.994 -9.121 -8.899 1.00 0.92 H new ATOM 0 HB2 PHE A 73 -3.785 -9.578 -11.884 1.00 0.88 H new ATOM 0 HB3 PHE A 73 -5.301 -9.421 -11.018 1.00 0.88 H new ATOM 0 HD1 PHE A 73 -5.134 -7.101 -9.380 1.00 2.26 H new ATOM 0 HD2 PHE A 73 -3.323 -7.721 -13.221 1.00 1.73 H new ATOM 0 HE1 PHE A 73 -5.971 -4.891 -10.122 1.00 2.68 H new ATOM 0 HE2 PHE A 73 -3.949 -5.412 -13.882 1.00 1.61 H new ATOM 0 HZ PHE A 73 -5.389 -4.040 -12.386 1.00 1.58 H new ATOM 1091 N ALA A 74 -2.989 -12.088 -9.601 1.00 1.30 N ATOM 1092 CA ALA A 74 -3.321 -13.488 -9.347 1.00 1.47 C ATOM 1093 C ALA A 74 -4.108 -13.609 -8.038 1.00 1.28 C ATOM 1094 O ALA A 74 -5.046 -14.397 -7.942 1.00 1.46 O ATOM 1095 CB ALA A 74 -2.046 -14.332 -9.310 1.00 1.63 C ATOM 0 H ALA A 74 -1.997 -11.908 -9.757 1.00 1.30 H new ATOM 0 HA ALA A 74 -3.949 -13.864 -10.155 1.00 1.47 H new ATOM 0 HB1 ALA A 74 -2.305 -15.374 -9.120 1.00 1.63 H new ATOM 0 HB2 ALA A 74 -1.531 -14.255 -10.267 1.00 1.63 H new ATOM 0 HB3 ALA A 74 -1.393 -13.970 -8.516 1.00 1.63 H new ATOM 1101 N ALA A 75 -3.745 -12.781 -7.050 1.00 1.00 N ATOM 1102 CA ALA A 75 -4.433 -12.709 -5.760 1.00 0.91 C ATOM 1103 C ALA A 75 -4.394 -11.317 -5.114 1.00 0.83 C ATOM 1104 O ALA A 75 -4.788 -11.166 -3.962 1.00 1.01 O ATOM 1105 CB ALA A 75 -3.818 -13.755 -4.834 1.00 0.93 C ATOM 0 H ALA A 75 -2.958 -12.137 -7.127 1.00 1.00 H new ATOM 0 HA ALA A 75 -5.490 -12.912 -5.932 1.00 0.91 H new ATOM 0 HB1 ALA A 75 -4.315 -13.720 -3.865 1.00 0.93 H new ATOM 0 HB2 ALA A 75 -3.943 -14.746 -5.271 1.00 0.93 H new ATOM 0 HB3 ALA A 75 -2.756 -13.547 -4.704 1.00 0.93 H new ATOM 1111 N LYS A 76 -3.925 -10.299 -5.842 1.00 0.74 N ATOM 1112 CA LYS A 76 -3.866 -8.914 -5.429 1.00 0.71 C ATOM 1113 C LYS A 76 -2.973 -8.699 -4.200 1.00 0.75 C ATOM 1114 O LYS A 76 -3.449 -8.450 -3.097 1.00 0.95 O ATOM 1115 CB LYS A 76 -5.269 -8.312 -5.315 1.00 0.79 C ATOM 1116 CG LYS A 76 -6.035 -8.120 -6.637 1.00 1.90 C ATOM 1117 CD LYS A 76 -6.476 -9.419 -7.338 1.00 3.79 C ATOM 1118 CE LYS A 76 -7.341 -9.150 -8.589 1.00 4.95 C ATOM 1119 NZ LYS A 76 -7.492 -10.351 -9.438 1.00 6.60 N ATOM 0 H LYS A 76 -3.559 -10.438 -6.784 1.00 0.74 H new ATOM 0 HA LYS A 76 -3.366 -8.349 -6.215 1.00 0.71 H new ATOM 0 HB2 LYS A 76 -5.865 -8.952 -4.664 1.00 0.79 H new ATOM 0 HB3 LYS A 76 -5.187 -7.343 -4.822 1.00 0.79 H new ATOM 0 HG2 LYS A 76 -6.920 -7.515 -6.440 1.00 1.90 H new ATOM 0 HG3 LYS A 76 -5.406 -7.552 -7.323 1.00 1.90 H new ATOM 0 HD2 LYS A 76 -5.594 -9.990 -7.626 1.00 3.79 H new ATOM 0 HD3 LYS A 76 -7.039 -10.034 -6.636 1.00 3.79 H new ATOM 0 HE2 LYS A 76 -8.326 -8.802 -8.278 1.00 4.95 H new ATOM 0 HE3 LYS A 76 -6.890 -8.349 -9.174 1.00 4.95 H new ATOM 0 HZ1 LYS A 76 -7.400 -10.083 -10.439 1.00 6.60 H new ATOM 0 HZ2 LYS A 76 -6.754 -11.042 -9.196 1.00 6.60 H new ATOM 0 HZ3 LYS A 76 -8.428 -10.774 -9.278 1.00 6.60 H new ATOM 1133 N GLN A 77 -1.653 -8.732 -4.416 1.00 0.77 N ATOM 1134 CA GLN A 77 -0.651 -8.500 -3.381 1.00 0.84 C ATOM 1135 C GLN A 77 -0.567 -6.993 -3.166 1.00 0.91 C ATOM 1136 O GLN A 77 0.409 -6.359 -3.553 1.00 1.71 O ATOM 1137 CB GLN A 77 0.729 -9.072 -3.757 1.00 1.33 C ATOM 1138 CG GLN A 77 0.767 -10.542 -4.190 1.00 1.04 C ATOM 1139 CD GLN A 77 -0.349 -11.387 -3.605 1.00 1.16 C ATOM 1140 OE1 GLN A 77 -0.222 -11.914 -2.507 1.00 2.08 O ATOM 1141 NE2 GLN A 77 -1.455 -11.512 -4.336 1.00 1.13 N ATOM 0 H GLN A 77 -1.249 -8.924 -5.333 1.00 0.77 H new ATOM 0 HA GLN A 77 -0.948 -9.015 -2.468 1.00 0.84 H new ATOM 0 HB2 GLN A 77 1.140 -8.468 -4.566 1.00 1.33 H new ATOM 0 HB3 GLN A 77 1.393 -8.952 -2.901 1.00 1.33 H new ATOM 0 HG2 GLN A 77 0.714 -10.591 -5.278 1.00 1.04 H new ATOM 0 HG3 GLN A 77 1.725 -10.971 -3.898 1.00 1.04 H new ATOM 0 HE21 GLN A 77 -1.519 -11.056 -5.246 1.00 1.13 H new ATOM 0 HE22 GLN A 77 -2.238 -12.064 -3.986 1.00 1.13 H new ATOM 1150 N GLY A 78 -1.649 -6.423 -2.651 1.00 1.09 N ATOM 1151 CA GLY A 78 -1.956 -5.006 -2.729 1.00 1.51 C ATOM 1152 C GLY A 78 -0.998 -4.096 -1.956 1.00 1.29 C ATOM 1153 O GLY A 78 -1.388 -3.475 -0.970 1.00 1.45 O ATOM 0 H GLY A 78 -2.360 -6.956 -2.150 1.00 1.09 H new ATOM 0 HA2 GLY A 78 -1.953 -4.706 -3.777 1.00 1.51 H new ATOM 0 HA3 GLY A 78 -2.967 -4.847 -2.354 1.00 1.51 H new ATOM 1157 N ASN A 79 0.255 -4.005 -2.404 1.00 1.11 N ATOM 1158 CA ASN A 79 1.375 -3.465 -1.662 1.00 0.99 C ATOM 1159 C ASN A 79 2.212 -2.634 -2.631 1.00 1.13 C ATOM 1160 O ASN A 79 2.107 -2.792 -3.847 1.00 1.86 O ATOM 1161 CB ASN A 79 2.174 -4.650 -1.092 1.00 0.97 C ATOM 1162 CG ASN A 79 1.285 -5.597 -0.289 1.00 1.40 C ATOM 1163 OD1 ASN A 79 1.134 -6.760 -0.642 1.00 2.72 O ATOM 1164 ND2 ASN A 79 0.634 -5.107 0.761 1.00 1.03 N ATOM 0 H ASN A 79 0.519 -4.322 -3.337 1.00 1.11 H new ATOM 0 HA ASN A 79 1.062 -2.828 -0.835 1.00 0.99 H new ATOM 0 HB2 ASN A 79 2.645 -5.198 -1.908 1.00 0.97 H new ATOM 0 HB3 ASN A 79 2.976 -4.276 -0.455 1.00 0.97 H new ATOM 0 HD21 ASN A 79 -0.005 -5.702 1.288 1.00 1.03 H new ATOM 0 HD22 ASN A 79 0.773 -4.136 1.039 1.00 1.03 H new ATOM 1171 N GLY A 80 3.012 -1.709 -2.107 1.00 0.74 N ATOM 1172 CA GLY A 80 3.887 -0.888 -2.917 1.00 0.77 C ATOM 1173 C GLY A 80 5.015 -0.371 -2.048 1.00 0.70 C ATOM 1174 O GLY A 80 4.742 0.251 -1.025 1.00 0.79 O ATOM 0 H GLY A 80 3.067 -1.513 -1.108 1.00 0.74 H new ATOM 0 HA2 GLY A 80 4.287 -1.469 -3.748 1.00 0.77 H new ATOM 0 HA3 GLY A 80 3.331 -0.056 -3.348 1.00 0.77 H new ATOM 1178 N LYS A 81 6.270 -0.603 -2.434 1.00 0.79 N ATOM 1179 CA LYS A 81 7.377 -0.166 -1.598 1.00 0.75 C ATOM 1180 C LYS A 81 7.559 1.341 -1.764 1.00 0.82 C ATOM 1181 O LYS A 81 7.376 1.869 -2.868 1.00 1.04 O ATOM 1182 CB LYS A 81 8.657 -0.952 -1.915 1.00 0.90 C ATOM 1183 CG LYS A 81 9.349 -0.605 -3.241 1.00 1.18 C ATOM 1184 CD LYS A 81 10.642 -1.429 -3.331 1.00 1.73 C ATOM 1185 CE LYS A 81 11.445 -1.153 -4.610 1.00 2.75 C ATOM 1186 NZ LYS A 81 11.975 0.225 -4.659 1.00 4.14 N ATOM 0 H LYS A 81 6.537 -1.078 -3.296 1.00 0.79 H new ATOM 0 HA LYS A 81 7.151 -0.371 -0.552 1.00 0.75 H new ATOM 0 HB2 LYS A 81 9.368 -0.792 -1.104 1.00 0.90 H new ATOM 0 HB3 LYS A 81 8.415 -2.015 -1.922 1.00 0.90 H new ATOM 0 HG2 LYS A 81 8.694 -0.830 -4.083 1.00 1.18 H new ATOM 0 HG3 LYS A 81 9.572 0.461 -3.287 1.00 1.18 H new ATOM 0 HD2 LYS A 81 11.265 -1.211 -2.464 1.00 1.73 H new ATOM 0 HD3 LYS A 81 10.394 -2.489 -3.287 1.00 1.73 H new ATOM 0 HE2 LYS A 81 12.272 -1.860 -4.675 1.00 2.75 H new ATOM 0 HE3 LYS A 81 10.809 -1.325 -5.479 1.00 2.75 H new ATOM 0 HZ1 LYS A 81 12.436 0.387 -5.577 1.00 4.14 H new ATOM 0 HZ2 LYS A 81 11.194 0.902 -4.539 1.00 4.14 H new ATOM 0 HZ3 LYS A 81 12.668 0.358 -3.895 1.00 4.14 H new ATOM 1200 N ILE A 82 7.898 2.020 -0.666 1.00 0.80 N ATOM 1201 CA ILE A 82 8.149 3.447 -0.632 1.00 1.00 C ATOM 1202 C ILE A 82 9.657 3.633 -0.579 1.00 1.05 C ATOM 1203 O ILE A 82 10.328 3.052 0.272 1.00 1.61 O ATOM 1204 CB ILE A 82 7.432 4.026 0.593 1.00 1.08 C ATOM 1205 CG1 ILE A 82 5.960 4.271 0.211 1.00 1.75 C ATOM 1206 CG2 ILE A 82 8.178 5.238 1.178 1.00 1.68 C ATOM 1207 CD1 ILE A 82 5.034 4.486 1.413 1.00 2.11 C ATOM 0 H ILE A 82 8.006 1.573 0.244 1.00 0.80 H new ATOM 0 HA ILE A 82 7.769 3.971 -1.509 1.00 1.00 H new ATOM 0 HB ILE A 82 7.436 3.319 1.422 1.00 1.08 H new ATOM 0 HG12 ILE A 82 5.904 5.144 -0.439 1.00 1.75 H new ATOM 0 HG13 ILE A 82 5.598 3.420 -0.366 1.00 1.75 H new ATOM 0 HG21 ILE A 82 7.635 5.616 2.044 1.00 1.68 H new ATOM 0 HG22 ILE A 82 9.180 4.936 1.482 1.00 1.68 H new ATOM 0 HG23 ILE A 82 8.248 6.021 0.423 1.00 1.68 H new ATOM 0 HD11 ILE A 82 4.015 4.652 1.062 1.00 2.11 H new ATOM 0 HD12 ILE A 82 5.058 3.604 2.053 1.00 2.11 H new ATOM 0 HD13 ILE A 82 5.369 5.355 1.979 1.00 2.11 H new ATOM 1219 N GLU A 83 10.192 4.420 -1.510 1.00 0.83 N ATOM 1220 CA GLU A 83 11.614 4.614 -1.643 1.00 0.85 C ATOM 1221 C GLU A 83 11.937 5.915 -2.377 1.00 1.17 C ATOM 1222 O GLU A 83 12.265 5.890 -3.561 1.00 1.88 O ATOM 1223 CB GLU A 83 12.213 3.396 -2.345 1.00 0.95 C ATOM 1224 CG GLU A 83 13.720 3.477 -2.149 1.00 0.95 C ATOM 1225 CD GLU A 83 14.456 2.325 -2.821 1.00 1.41 C ATOM 1226 OE1 GLU A 83 15.692 2.430 -2.946 1.00 2.52 O ATOM 1227 OE2 GLU A 83 13.761 1.364 -3.228 1.00 2.16 O ATOM 0 H GLU A 83 9.639 4.939 -2.192 1.00 0.83 H new ATOM 0 HA GLU A 83 12.062 4.708 -0.654 1.00 0.85 H new ATOM 0 HB2 GLU A 83 11.817 2.472 -1.923 1.00 0.95 H new ATOM 0 HB3 GLU A 83 11.960 3.397 -3.405 1.00 0.95 H new ATOM 0 HG2 GLU A 83 14.086 4.422 -2.551 1.00 0.95 H new ATOM 0 HG3 GLU A 83 13.946 3.476 -1.083 1.00 0.95 H new ATOM 1234 N HIS A 84 11.834 7.056 -1.697 1.00 0.97 N ATOM 1235 CA HIS A 84 12.609 8.236 -2.062 1.00 0.87 C ATOM 1236 C HIS A 84 12.644 9.183 -0.857 1.00 0.96 C ATOM 1237 O HIS A 84 12.113 10.291 -0.919 1.00 1.63 O ATOM 1238 CB HIS A 84 12.107 8.846 -3.387 1.00 1.60 C ATOM 1239 CG HIS A 84 12.643 10.216 -3.709 1.00 2.47 C ATOM 1240 ND1 HIS A 84 13.968 10.566 -3.842 1.00 3.44 N ATOM 1241 CD2 HIS A 84 11.894 11.349 -3.878 1.00 3.40 C ATOM 1242 CE1 HIS A 84 14.009 11.888 -4.084 1.00 4.75 C ATOM 1243 NE2 HIS A 84 12.771 12.409 -4.116 1.00 4.79 N ATOM 0 H HIS A 84 11.222 7.186 -0.892 1.00 0.97 H new ATOM 0 HA HIS A 84 13.646 7.982 -2.283 1.00 0.87 H new ATOM 0 HB2 HIS A 84 12.370 8.171 -4.201 1.00 1.60 H new ATOM 0 HB3 HIS A 84 11.019 8.898 -3.355 1.00 1.60 H new ATOM 0 HD2 HIS A 84 10.817 11.412 -3.835 1.00 3.40 H new ATOM 0 HE1 HIS A 84 14.916 12.455 -4.233 1.00 4.75 H new ATOM 0 HE2 HIS A 84 12.522 13.384 -4.281 1.00 4.79 H new ATOM 1251 N LEU A 85 13.201 8.736 0.272 1.00 0.79 N ATOM 1252 CA LEU A 85 13.273 9.539 1.489 1.00 0.81 C ATOM 1253 C LEU A 85 14.705 9.586 2.000 1.00 0.95 C ATOM 1254 O LEU A 85 15.415 8.582 2.005 1.00 1.33 O ATOM 1255 CB LEU A 85 12.301 9.010 2.552 1.00 0.96 C ATOM 1256 CG LEU A 85 10.872 9.467 2.250 1.00 1.12 C ATOM 1257 CD1 LEU A 85 9.780 8.461 2.623 1.00 1.63 C ATOM 1258 CD2 LEU A 85 10.562 10.837 2.865 1.00 1.78 C ATOM 0 H LEU A 85 13.613 7.808 0.365 1.00 0.79 H new ATOM 0 HA LEU A 85 12.967 10.560 1.259 1.00 0.81 H new ATOM 0 HB2 LEU A 85 12.342 7.921 2.580 1.00 0.96 H new ATOM 0 HB3 LEU A 85 12.602 9.366 3.537 1.00 0.96 H new ATOM 0 HG LEU A 85 10.848 9.547 1.163 1.00 1.12 H new ATOM 0 HD11 LEU A 85 8.803 8.874 2.372 1.00 1.63 H new ATOM 0 HD12 LEU A 85 9.935 7.534 2.071 1.00 1.63 H new ATOM 0 HD13 LEU A 85 9.823 8.257 3.693 1.00 1.63 H new ATOM 0 HD21 LEU A 85 9.537 11.120 2.625 1.00 1.78 H new ATOM 0 HD22 LEU A 85 10.680 10.785 3.947 1.00 1.78 H new ATOM 0 HD23 LEU A 85 11.248 11.581 2.461 1.00 1.78 H new ATOM 1270 N LYS A 86 15.110 10.784 2.432 1.00 1.05 N ATOM 1271 CA LYS A 86 16.471 11.097 2.841 1.00 1.29 C ATOM 1272 C LYS A 86 16.898 10.330 4.092 1.00 1.16 C ATOM 1273 O LYS A 86 18.090 10.169 4.339 1.00 1.49 O ATOM 1274 CB LYS A 86 16.658 12.614 3.007 1.00 1.72 C ATOM 1275 CG LYS A 86 15.521 13.396 3.686 1.00 1.94 C ATOM 1276 CD LYS A 86 15.060 12.820 5.032 1.00 2.01 C ATOM 1277 CE LYS A 86 14.252 13.807 5.887 1.00 2.50 C ATOM 1278 NZ LYS A 86 15.112 14.791 6.577 1.00 3.70 N ATOM 0 H LYS A 86 14.478 11.581 2.507 1.00 1.05 H new ATOM 0 HA LYS A 86 17.133 10.763 2.042 1.00 1.29 H new ATOM 0 HB2 LYS A 86 17.570 12.780 3.580 1.00 1.72 H new ATOM 0 HB3 LYS A 86 16.819 13.044 2.018 1.00 1.72 H new ATOM 0 HG2 LYS A 86 15.847 14.425 3.839 1.00 1.94 H new ATOM 0 HG3 LYS A 86 14.667 13.430 3.009 1.00 1.94 H new ATOM 0 HD2 LYS A 86 14.454 11.933 4.848 1.00 2.01 H new ATOM 0 HD3 LYS A 86 15.935 12.497 5.597 1.00 2.01 H new ATOM 0 HE2 LYS A 86 13.539 14.334 5.253 1.00 2.50 H new ATOM 0 HE3 LYS A 86 13.673 13.253 6.626 1.00 2.50 H new ATOM 0 HZ1 LYS A 86 14.520 15.434 7.141 1.00 3.70 H new ATOM 0 HZ2 LYS A 86 15.776 14.293 7.204 1.00 3.70 H new ATOM 0 HZ3 LYS A 86 15.646 15.339 5.873 1.00 3.70 H new ATOM 1292 N SER A 87 15.929 9.890 4.896 1.00 1.11 N ATOM 1293 CA SER A 87 16.202 9.131 6.104 1.00 1.49 C ATOM 1294 C SER A 87 16.085 7.660 5.713 1.00 1.36 C ATOM 1295 O SER A 87 15.153 7.326 4.990 1.00 1.09 O ATOM 1296 CB SER A 87 15.189 9.507 7.189 1.00 1.97 C ATOM 1297 OG SER A 87 15.258 10.888 7.497 1.00 2.24 O ATOM 0 H SER A 87 14.937 10.052 4.723 1.00 1.11 H new ATOM 0 HA SER A 87 17.192 9.340 6.509 1.00 1.49 H new ATOM 0 HB2 SER A 87 14.183 9.256 6.853 1.00 1.97 H new ATOM 0 HB3 SER A 87 15.380 8.921 8.088 1.00 1.97 H new ATOM 0 HG SER A 87 14.600 11.102 8.191 1.00 2.24 H new ATOM 1303 N PRO A 88 16.993 6.777 6.150 1.00 1.76 N ATOM 1304 CA PRO A 88 17.011 5.396 5.698 1.00 1.69 C ATOM 1305 C PRO A 88 15.685 4.706 6.022 1.00 1.65 C ATOM 1306 O PRO A 88 14.969 4.291 5.109 1.00 1.69 O ATOM 1307 CB PRO A 88 18.223 4.748 6.377 1.00 2.33 C ATOM 1308 CG PRO A 88 18.551 5.678 7.548 1.00 2.76 C ATOM 1309 CD PRO A 88 18.074 7.048 7.077 1.00 2.41 C ATOM 0 HA PRO A 88 17.110 5.310 4.616 1.00 1.69 H new ATOM 0 HB2 PRO A 88 17.992 3.741 6.723 1.00 2.33 H new ATOM 0 HB3 PRO A 88 19.065 4.664 5.690 1.00 2.33 H new ATOM 0 HG2 PRO A 88 18.039 5.369 8.459 1.00 2.76 H new ATOM 0 HG3 PRO A 88 19.619 5.681 7.768 1.00 2.76 H new ATOM 0 HD2 PRO A 88 17.731 7.655 7.915 1.00 2.41 H new ATOM 0 HD3 PRO A 88 18.879 7.600 6.592 1.00 2.41 H new ATOM 1317 N GLU A 89 15.353 4.632 7.317 1.00 1.94 N ATOM 1318 CA GLU A 89 14.179 3.948 7.843 1.00 2.14 C ATOM 1319 C GLU A 89 12.892 4.340 7.107 1.00 1.97 C ATOM 1320 O GLU A 89 12.036 3.497 6.855 1.00 2.31 O ATOM 1321 CB GLU A 89 14.102 4.165 9.364 1.00 2.63 C ATOM 1322 CG GLU A 89 13.925 5.624 9.810 1.00 3.92 C ATOM 1323 CD GLU A 89 13.938 5.749 11.331 1.00 4.65 C ATOM 1324 OE1 GLU A 89 14.842 5.147 11.941 1.00 4.56 O ATOM 1325 OE2 GLU A 89 13.063 6.472 11.863 1.00 6.05 O ATOM 0 H GLU A 89 15.918 5.064 8.048 1.00 1.94 H new ATOM 0 HA GLU A 89 14.282 2.878 7.660 1.00 2.14 H new ATOM 0 HB2 GLU A 89 13.271 3.579 9.757 1.00 2.63 H new ATOM 0 HB3 GLU A 89 15.012 3.771 9.817 1.00 2.63 H new ATOM 0 HG2 GLU A 89 14.723 6.234 9.387 1.00 3.92 H new ATOM 0 HG3 GLU A 89 12.985 6.013 9.420 1.00 3.92 H new ATOM 1332 N LEU A 90 12.773 5.616 6.734 1.00 1.74 N ATOM 1333 CA LEU A 90 11.629 6.160 6.015 1.00 1.66 C ATOM 1334 C LEU A 90 11.331 5.426 4.701 1.00 1.41 C ATOM 1335 O LEU A 90 10.190 5.474 4.237 1.00 1.57 O ATOM 1336 CB LEU A 90 11.852 7.655 5.739 1.00 1.56 C ATOM 1337 CG LEU A 90 11.361 8.637 6.813 1.00 1.85 C ATOM 1338 CD1 LEU A 90 9.836 8.773 6.794 1.00 2.43 C ATOM 1339 CD2 LEU A 90 11.838 8.283 8.219 1.00 2.09 C ATOM 0 H LEU A 90 13.490 6.314 6.931 1.00 1.74 H new ATOM 0 HA LEU A 90 10.759 6.017 6.656 1.00 1.66 H new ATOM 0 HB2 LEU A 90 12.920 7.818 5.592 1.00 1.56 H new ATOM 0 HB3 LEU A 90 11.359 7.904 4.799 1.00 1.56 H new ATOM 0 HG LEU A 90 11.808 9.598 6.556 1.00 1.85 H new ATOM 0 HD11 LEU A 90 9.524 9.475 7.567 1.00 2.43 H new ATOM 0 HD12 LEU A 90 9.516 9.140 5.819 1.00 2.43 H new ATOM 0 HD13 LEU A 90 9.382 7.800 6.983 1.00 2.43 H new ATOM 0 HD21 LEU A 90 11.456 9.017 8.928 1.00 2.09 H new ATOM 0 HD22 LEU A 90 11.472 7.292 8.489 1.00 2.09 H new ATOM 0 HD23 LEU A 90 12.928 8.287 8.245 1.00 2.09 H new ATOM 1351 N ASN A 91 12.315 4.776 4.069 1.00 1.15 N ATOM 1352 CA ASN A 91 12.111 4.103 2.792 1.00 0.99 C ATOM 1353 C ASN A 91 11.435 2.762 3.065 1.00 0.98 C ATOM 1354 O ASN A 91 12.055 1.704 2.986 1.00 1.31 O ATOM 1355 CB ASN A 91 13.437 3.969 2.039 1.00 0.98 C ATOM 1356 CG ASN A 91 14.020 5.347 1.733 1.00 1.14 C ATOM 1357 OD1 ASN A 91 13.692 5.978 0.729 1.00 2.08 O ATOM 1358 ND2 ASN A 91 14.847 5.858 2.636 1.00 0.88 N ATOM 0 H ASN A 91 13.267 4.705 4.429 1.00 1.15 H new ATOM 0 HA ASN A 91 11.460 4.686 2.141 1.00 0.99 H new ATOM 0 HB2 ASN A 91 14.144 3.393 2.636 1.00 0.98 H new ATOM 0 HB3 ASN A 91 13.281 3.419 1.111 1.00 0.98 H new ATOM 0 HD21 ASN A 91 15.227 6.796 2.507 1.00 0.88 H new ATOM 0 HD22 ASN A 91 15.103 5.313 3.460 1.00 0.88 H new ATOM 1365 N VAL A 92 10.166 2.836 3.463 1.00 0.84 N ATOM 1366 CA VAL A 92 9.412 1.705 3.959 1.00 0.73 C ATOM 1367 C VAL A 92 9.131 0.699 2.851 1.00 0.68 C ATOM 1368 O VAL A 92 8.372 0.988 1.926 1.00 0.99 O ATOM 1369 CB VAL A 92 8.156 2.195 4.694 1.00 0.73 C ATOM 1370 CG1 VAL A 92 7.163 3.052 3.914 1.00 1.94 C ATOM 1371 CG2 VAL A 92 7.369 1.043 5.313 1.00 2.48 C ATOM 0 H VAL A 92 9.630 3.704 3.446 1.00 0.84 H new ATOM 0 HA VAL A 92 10.008 1.160 4.691 1.00 0.73 H new ATOM 0 HB VAL A 92 8.602 2.851 5.442 1.00 0.73 H new ATOM 0 HG11 VAL A 92 6.329 3.322 4.561 1.00 1.94 H new ATOM 0 HG12 VAL A 92 7.660 3.957 3.565 1.00 1.94 H new ATOM 0 HG13 VAL A 92 6.790 2.489 3.058 1.00 1.94 H new ATOM 0 HG21 VAL A 92 6.489 1.436 5.823 1.00 2.48 H new ATOM 0 HG22 VAL A 92 7.057 0.353 4.529 1.00 2.48 H new ATOM 0 HG23 VAL A 92 7.999 0.516 6.030 1.00 2.48 H new ATOM 1381 N ASP A 93 9.715 -0.496 2.963 1.00 0.53 N ATOM 1382 CA ASP A 93 9.347 -1.596 2.090 1.00 0.54 C ATOM 1383 C ASP A 93 8.147 -2.320 2.701 1.00 0.63 C ATOM 1384 O ASP A 93 7.880 -2.214 3.902 1.00 0.66 O ATOM 1385 CB ASP A 93 10.546 -2.512 1.813 1.00 0.64 C ATOM 1386 CG ASP A 93 10.233 -3.579 0.769 1.00 1.11 C ATOM 1387 OD1 ASP A 93 10.983 -4.576 0.738 1.00 2.20 O ATOM 1388 OD2 ASP A 93 9.253 -3.378 0.017 1.00 1.87 O ATOM 0 H ASP A 93 10.439 -0.719 3.646 1.00 0.53 H new ATOM 0 HA ASP A 93 9.048 -1.222 1.111 1.00 0.54 H new ATOM 0 HB2 ASP A 93 11.389 -1.910 1.472 1.00 0.64 H new ATOM 0 HB3 ASP A 93 10.853 -2.994 2.741 1.00 0.64 H new ATOM 1393 N LEU A 94 7.382 -2.990 1.846 1.00 0.89 N ATOM 1394 CA LEU A 94 6.044 -3.464 2.104 1.00 0.98 C ATOM 1395 C LEU A 94 5.951 -4.946 1.760 1.00 0.97 C ATOM 1396 O LEU A 94 6.296 -5.343 0.649 1.00 1.06 O ATOM 1397 CB LEU A 94 5.082 -2.595 1.275 1.00 1.33 C ATOM 1398 CG LEU A 94 4.010 -2.038 2.204 1.00 1.25 C ATOM 1399 CD1 LEU A 94 3.240 -0.866 1.604 1.00 1.13 C ATOM 1400 CD2 LEU A 94 3.042 -3.152 2.613 1.00 2.96 C ATOM 0 H LEU A 94 7.704 -3.225 0.907 1.00 0.89 H new ATOM 0 HA LEU A 94 5.775 -3.376 3.157 1.00 0.98 H new ATOM 0 HB2 LEU A 94 5.626 -1.782 0.794 1.00 1.33 H new ATOM 0 HB3 LEU A 94 4.625 -3.187 0.482 1.00 1.33 H new ATOM 0 HG LEU A 94 4.527 -1.651 3.082 1.00 1.25 H new ATOM 0 HD11 LEU A 94 2.493 -0.518 2.317 1.00 1.13 H new ATOM 0 HD12 LEU A 94 3.931 -0.054 1.378 1.00 1.13 H new ATOM 0 HD13 LEU A 94 2.745 -1.187 0.688 1.00 1.13 H new ATOM 0 HD21 LEU A 94 2.279 -2.745 3.277 1.00 2.96 H new ATOM 0 HD22 LEU A 94 2.566 -3.565 1.724 1.00 2.96 H new ATOM 0 HD23 LEU A 94 3.591 -3.939 3.130 1.00 2.96 H new ATOM 1412 N ALA A 95 5.479 -5.772 2.699 1.00 0.96 N ATOM 1413 CA ALA A 95 5.466 -7.208 2.481 1.00 1.03 C ATOM 1414 C ALA A 95 4.304 -7.564 1.557 1.00 1.00 C ATOM 1415 O ALA A 95 3.277 -6.887 1.556 1.00 1.01 O ATOM 1416 CB ALA A 95 5.334 -7.934 3.823 1.00 1.15 C ATOM 0 H ALA A 95 5.108 -5.471 3.600 1.00 0.96 H new ATOM 0 HA ALA A 95 6.399 -7.521 2.012 1.00 1.03 H new ATOM 0 HB1 ALA A 95 5.325 -9.011 3.655 1.00 1.15 H new ATOM 0 HB2 ALA A 95 6.178 -7.674 4.462 1.00 1.15 H new ATOM 0 HB3 ALA A 95 4.405 -7.635 4.309 1.00 1.15 H new ATOM 1422 N ALA A 96 4.465 -8.639 0.785 1.00 1.04 N ATOM 1423 CA ALA A 96 3.451 -9.100 -0.145 1.00 1.05 C ATOM 1424 C ALA A 96 2.365 -9.818 0.657 1.00 1.02 C ATOM 1425 O ALA A 96 2.577 -10.933 1.130 1.00 1.50 O ATOM 1426 CB ALA A 96 4.078 -10.025 -1.190 1.00 1.19 C ATOM 0 H ALA A 96 5.309 -9.212 0.792 1.00 1.04 H new ATOM 0 HA ALA A 96 3.009 -8.260 -0.681 1.00 1.05 H new ATOM 0 HB1 ALA A 96 3.309 -10.365 -1.883 1.00 1.19 H new ATOM 0 HB2 ALA A 96 4.848 -9.484 -1.740 1.00 1.19 H new ATOM 0 HB3 ALA A 96 4.525 -10.886 -0.693 1.00 1.19 H new ATOM 1432 N ALA A 97 1.228 -9.148 0.838 1.00 0.71 N ATOM 1433 CA ALA A 97 0.067 -9.626 1.567 1.00 0.69 C ATOM 1434 C ALA A 97 -1.114 -9.589 0.607 1.00 0.73 C ATOM 1435 O ALA A 97 -1.344 -8.569 -0.044 1.00 1.00 O ATOM 1436 CB ALA A 97 -0.194 -8.723 2.776 1.00 0.86 C ATOM 0 H ALA A 97 1.091 -8.211 0.459 1.00 0.71 H new ATOM 0 HA ALA A 97 0.224 -10.640 1.936 1.00 0.69 H new ATOM 0 HB1 ALA A 97 -1.066 -9.086 3.320 1.00 0.86 H new ATOM 0 HB2 ALA A 97 0.675 -8.736 3.434 1.00 0.86 H new ATOM 0 HB3 ALA A 97 -0.377 -7.704 2.436 1.00 0.86 H new ATOM 1442 N ASP A 98 -1.850 -10.694 0.516 1.00 0.95 N ATOM 1443 CA ASP A 98 -3.016 -10.803 -0.338 1.00 1.01 C ATOM 1444 C ASP A 98 -4.201 -10.120 0.339 1.00 0.93 C ATOM 1445 O ASP A 98 -4.114 -9.635 1.469 1.00 1.21 O ATOM 1446 CB ASP A 98 -3.326 -12.283 -0.587 1.00 1.43 C ATOM 1447 CG ASP A 98 -3.805 -12.932 0.700 1.00 1.94 C ATOM 1448 OD1 ASP A 98 -2.946 -13.062 1.601 1.00 2.71 O ATOM 1449 OD2 ASP A 98 -5.018 -13.223 0.774 1.00 2.99 O ATOM 0 H ASP A 98 -1.646 -11.544 1.041 1.00 0.95 H new ATOM 0 HA ASP A 98 -2.824 -10.316 -1.294 1.00 1.01 H new ATOM 0 HB2 ASP A 98 -4.089 -12.379 -1.359 1.00 1.43 H new ATOM 0 HB3 ASP A 98 -2.436 -12.794 -0.953 1.00 1.43 H new ATOM 1454 N ILE A 99 -5.320 -10.077 -0.377 1.00 0.82 N ATOM 1455 CA ILE A 99 -6.569 -9.549 0.115 1.00 0.83 C ATOM 1456 C ILE A 99 -7.470 -10.709 0.534 1.00 1.07 C ATOM 1457 O ILE A 99 -8.026 -11.420 -0.295 1.00 1.47 O ATOM 1458 CB ILE A 99 -7.160 -8.596 -0.933 1.00 0.76 C ATOM 1459 CG1 ILE A 99 -8.645 -8.304 -0.729 1.00 0.84 C ATOM 1460 CG2 ILE A 99 -6.821 -8.899 -2.387 1.00 1.17 C ATOM 1461 CD1 ILE A 99 -8.806 -6.797 -0.643 1.00 1.18 C ATOM 0 H ILE A 99 -5.375 -10.418 -1.337 1.00 0.82 H new ATOM 0 HA ILE A 99 -6.438 -8.945 1.013 1.00 0.83 H new ATOM 0 HB ILE A 99 -6.622 -7.670 -0.730 1.00 0.76 H new ATOM 0 HG12 ILE A 99 -9.232 -8.706 -1.555 1.00 0.84 H new ATOM 0 HG13 ILE A 99 -9.008 -8.781 0.181 1.00 0.84 H new ATOM 0 HG21 ILE A 99 -7.294 -8.159 -3.033 1.00 1.17 H new ATOM 0 HG22 ILE A 99 -5.740 -8.862 -2.524 1.00 1.17 H new ATOM 0 HG23 ILE A 99 -7.186 -9.893 -2.646 1.00 1.17 H new ATOM 0 HD11 ILE A 99 -9.858 -6.551 -0.497 1.00 1.18 H new ATOM 0 HD12 ILE A 99 -8.224 -6.416 0.197 1.00 1.18 H new ATOM 0 HD13 ILE A 99 -8.452 -6.340 -1.567 1.00 1.18 H new ATOM 1473 N LYS A 100 -7.658 -10.865 1.843 1.00 1.55 N ATOM 1474 CA LYS A 100 -8.666 -11.762 2.383 1.00 1.93 C ATOM 1475 C LYS A 100 -10.069 -11.320 1.920 1.00 1.51 C ATOM 1476 O LYS A 100 -10.319 -10.117 1.828 1.00 2.58 O ATOM 1477 CB LYS A 100 -8.517 -11.855 3.916 1.00 3.04 C ATOM 1478 CG LYS A 100 -8.537 -10.532 4.712 1.00 4.78 C ATOM 1479 CD LYS A 100 -9.936 -10.042 5.108 1.00 5.62 C ATOM 1480 CE LYS A 100 -10.558 -10.867 6.245 1.00 6.70 C ATOM 1481 NZ LYS A 100 -12.029 -10.763 6.244 1.00 7.66 N ATOM 0 H LYS A 100 -7.116 -10.373 2.553 1.00 1.55 H new ATOM 0 HA LYS A 100 -8.523 -12.772 1.998 1.00 1.93 H new ATOM 0 HB2 LYS A 100 -9.319 -12.488 4.295 1.00 3.04 H new ATOM 0 HB3 LYS A 100 -7.578 -12.365 4.133 1.00 3.04 H new ATOM 0 HG2 LYS A 100 -7.942 -10.659 5.616 1.00 4.78 H new ATOM 0 HG3 LYS A 100 -8.051 -9.759 4.117 1.00 4.78 H new ATOM 0 HD2 LYS A 100 -9.877 -8.998 5.414 1.00 5.62 H new ATOM 0 HD3 LYS A 100 -10.590 -10.082 4.237 1.00 5.62 H new ATOM 0 HE2 LYS A 100 -10.266 -11.912 6.140 1.00 6.70 H new ATOM 0 HE3 LYS A 100 -10.168 -10.521 7.202 1.00 6.70 H new ATOM 0 HZ1 LYS A 100 -12.413 -11.261 7.072 1.00 7.66 H new ATOM 0 HZ2 LYS A 100 -12.306 -9.761 6.283 1.00 7.66 H new ATOM 0 HZ3 LYS A 100 -12.407 -11.193 5.376 1.00 7.66 H new ATOM 1495 N PRO A 101 -10.998 -12.248 1.638 1.00 1.42 N ATOM 1496 CA PRO A 101 -12.381 -11.916 1.317 1.00 2.06 C ATOM 1497 C PRO A 101 -13.032 -11.252 2.532 1.00 1.50 C ATOM 1498 O PRO A 101 -12.612 -11.544 3.661 1.00 2.47 O ATOM 1499 CB PRO A 101 -13.050 -13.246 0.963 1.00 3.62 C ATOM 1500 CG PRO A 101 -12.231 -14.273 1.740 1.00 3.84 C ATOM 1501 CD PRO A 101 -10.821 -13.686 1.704 1.00 2.52 C ATOM 0 HA PRO A 101 -12.472 -11.214 0.488 1.00 2.06 H new ATOM 0 HB2 PRO A 101 -14.098 -13.260 1.261 1.00 3.62 H new ATOM 0 HB3 PRO A 101 -13.021 -13.437 -0.110 1.00 3.62 H new ATOM 0 HG2 PRO A 101 -12.594 -14.389 2.761 1.00 3.84 H new ATOM 0 HG3 PRO A 101 -12.270 -15.257 1.273 1.00 3.84 H new ATOM 0 HD2 PRO A 101 -10.255 -13.971 2.591 1.00 2.52 H new ATOM 0 HD3 PRO A 101 -10.266 -14.053 0.841 1.00 2.52 H new ATOM 1509 N ASP A 102 -14.009 -10.359 2.276 1.00 1.51 N ATOM 1510 CA ASP A 102 -14.522 -9.269 3.129 1.00 1.68 C ATOM 1511 C ASP A 102 -14.255 -7.941 2.407 1.00 2.02 C ATOM 1512 O ASP A 102 -13.912 -7.928 1.223 1.00 3.04 O ATOM 1513 CB ASP A 102 -13.874 -9.358 4.512 1.00 3.33 C ATOM 1514 CG ASP A 102 -14.248 -8.431 5.642 1.00 4.69 C ATOM 1515 OD1 ASP A 102 -13.534 -8.611 6.657 1.00 5.82 O ATOM 1516 OD2 ASP A 102 -15.186 -7.623 5.491 1.00 5.24 O ATOM 0 H ASP A 102 -14.504 -10.385 1.385 1.00 1.51 H new ATOM 0 HA ASP A 102 -15.597 -9.347 3.293 1.00 1.68 H new ATOM 0 HB2 ASP A 102 -14.044 -10.373 4.872 1.00 3.33 H new ATOM 0 HB3 ASP A 102 -12.800 -9.249 4.361 1.00 3.33 H new ATOM 1521 N GLY A 103 -14.438 -6.809 3.082 1.00 3.32 N ATOM 1522 CA GLY A 103 -14.141 -5.492 2.553 1.00 4.96 C ATOM 1523 C GLY A 103 -15.273 -4.995 1.658 1.00 4.10 C ATOM 1524 O GLY A 103 -15.864 -3.962 1.960 1.00 4.83 O ATOM 0 H GLY A 103 -14.806 -6.788 4.033 1.00 3.32 H new ATOM 0 HA2 GLY A 103 -13.988 -4.792 3.374 1.00 4.96 H new ATOM 0 HA3 GLY A 103 -13.211 -5.525 1.985 1.00 4.96 H new ATOM 1528 N LYS A 104 -15.542 -5.732 0.570 1.00 2.89 N ATOM 1529 CA LYS A 104 -16.493 -5.453 -0.510 1.00 2.26 C ATOM 1530 C LYS A 104 -15.716 -4.992 -1.747 1.00 2.36 C ATOM 1531 O LYS A 104 -15.564 -3.797 -1.977 1.00 3.21 O ATOM 1532 CB LYS A 104 -17.604 -4.461 -0.108 1.00 2.13 C ATOM 1533 CG LYS A 104 -18.756 -4.383 -1.119 1.00 2.82 C ATOM 1534 CD LYS A 104 -19.714 -3.264 -0.675 1.00 3.67 C ATOM 1535 CE LYS A 104 -20.934 -3.102 -1.594 1.00 5.46 C ATOM 1536 NZ LYS A 104 -21.887 -4.226 -1.477 1.00 6.37 N ATOM 0 H LYS A 104 -15.056 -6.615 0.412 1.00 2.89 H new ATOM 0 HA LYS A 104 -17.026 -6.375 -0.742 1.00 2.26 H new ATOM 0 HB2 LYS A 104 -18.004 -4.751 0.864 1.00 2.13 H new ATOM 0 HB3 LYS A 104 -17.168 -3.469 0.010 1.00 2.13 H new ATOM 0 HG2 LYS A 104 -18.371 -4.179 -2.118 1.00 2.82 H new ATOM 0 HG3 LYS A 104 -19.283 -5.336 -1.169 1.00 2.82 H new ATOM 0 HD2 LYS A 104 -20.057 -3.471 0.338 1.00 3.67 H new ATOM 0 HD3 LYS A 104 -19.168 -2.321 -0.640 1.00 3.67 H new ATOM 0 HE2 LYS A 104 -21.445 -2.170 -1.352 1.00 5.46 H new ATOM 0 HE3 LYS A 104 -20.598 -3.022 -2.628 1.00 5.46 H new ATOM 0 HZ1 LYS A 104 -22.691 -4.067 -2.117 1.00 6.37 H new ATOM 0 HZ2 LYS A 104 -21.410 -5.114 -1.734 1.00 6.37 H new ATOM 0 HZ3 LYS A 104 -22.231 -4.289 -0.498 1.00 6.37 H new ATOM 1550 N ARG A 105 -15.234 -5.950 -2.546 1.00 2.21 N ATOM 1551 CA ARG A 105 -14.531 -5.692 -3.802 1.00 2.31 C ATOM 1552 C ARG A 105 -13.305 -4.804 -3.586 1.00 2.28 C ATOM 1553 O ARG A 105 -13.186 -3.716 -4.140 1.00 2.83 O ATOM 1554 CB ARG A 105 -15.480 -5.166 -4.892 1.00 2.35 C ATOM 1555 CG ARG A 105 -16.505 -6.259 -5.237 1.00 3.36 C ATOM 1556 CD ARG A 105 -17.370 -5.864 -6.435 1.00 4.00 C ATOM 1557 NE ARG A 105 -17.989 -7.049 -7.058 1.00 5.44 N ATOM 1558 CZ ARG A 105 -18.596 -7.071 -8.258 1.00 6.34 C ATOM 1559 NH1 ARG A 105 -18.662 -5.970 -9.011 1.00 6.19 N ATOM 1560 NH2 ARG A 105 -19.106 -8.217 -8.722 1.00 7.81 N ATOM 0 H ARG A 105 -15.324 -6.943 -2.332 1.00 2.21 H new ATOM 0 HA ARG A 105 -14.153 -6.644 -4.174 1.00 2.31 H new ATOM 0 HB2 ARG A 105 -15.991 -4.268 -4.545 1.00 2.35 H new ATOM 0 HB3 ARG A 105 -14.914 -4.887 -5.781 1.00 2.35 H new ATOM 0 HG2 ARG A 105 -15.984 -7.191 -5.456 1.00 3.36 H new ATOM 0 HG3 ARG A 105 -17.143 -6.446 -4.373 1.00 3.36 H new ATOM 0 HD2 ARG A 105 -18.147 -5.171 -6.113 1.00 4.00 H new ATOM 0 HD3 ARG A 105 -16.760 -5.340 -7.171 1.00 4.00 H new ATOM 0 HE ARG A 105 -17.954 -7.924 -6.535 1.00 5.44 H new ATOM 0 HH11 ARG A 105 -18.249 -5.099 -8.678 1.00 6.19 H new ATOM 0 HH12 ARG A 105 -19.125 -6.000 -9.919 1.00 6.19 H new ATOM 0 HH21 ARG A 105 -19.034 -9.069 -8.166 1.00 7.81 H new ATOM 0 HH22 ARG A 105 -19.567 -8.239 -9.631 1.00 7.81 H new ATOM 1574 N HIS A 106 -12.370 -5.332 -2.797 1.00 2.40 N ATOM 1575 CA HIS A 106 -11.069 -4.743 -2.533 1.00 2.61 C ATOM 1576 C HIS A 106 -11.159 -3.428 -1.759 1.00 2.63 C ATOM 1577 O HIS A 106 -10.338 -2.531 -1.945 1.00 3.83 O ATOM 1578 CB HIS A 106 -10.213 -4.674 -3.809 1.00 2.87 C ATOM 1579 CG HIS A 106 -8.719 -4.615 -3.558 1.00 4.08 C ATOM 1580 ND1 HIS A 106 -8.086 -3.827 -2.624 1.00 4.99 N ATOM 1581 CD2 HIS A 106 -7.758 -5.411 -4.123 1.00 5.26 C ATOM 1582 CE1 HIS A 106 -6.779 -4.135 -2.632 1.00 6.17 C ATOM 1583 NE2 HIS A 106 -6.531 -5.101 -3.528 1.00 6.41 N ATOM 0 H HIS A 106 -12.509 -6.216 -2.308 1.00 2.40 H new ATOM 0 HA HIS A 106 -10.536 -5.412 -1.857 1.00 2.61 H new ATOM 0 HB2 HIS A 106 -10.431 -5.546 -4.426 1.00 2.87 H new ATOM 0 HB3 HIS A 106 -10.508 -3.795 -4.383 1.00 2.87 H new ATOM 0 HD1 HIS A 106 -8.532 -3.130 -2.029 1.00 4.99 H new ATOM 0 HD2 HIS A 106 -7.920 -6.150 -4.894 1.00 5.26 H new ATOM 0 HE1 HIS A 106 -6.033 -3.670 -2.005 1.00 6.17 H new ATOM 1591 N ALA A 107 -12.105 -3.340 -0.820 1.00 1.92 N ATOM 1592 CA ALA A 107 -12.200 -2.178 0.050 1.00 2.49 C ATOM 1593 C ALA A 107 -10.906 -1.970 0.840 1.00 2.07 C ATOM 1594 O ALA A 107 -10.487 -0.829 0.990 1.00 2.38 O ATOM 1595 CB ALA A 107 -13.402 -2.292 0.983 1.00 3.44 C ATOM 0 H ALA A 107 -12.809 -4.058 -0.648 1.00 1.92 H new ATOM 0 HA ALA A 107 -12.346 -1.301 -0.580 1.00 2.49 H new ATOM 0 HB1 ALA A 107 -13.451 -1.411 1.623 1.00 3.44 H new ATOM 0 HB2 ALA A 107 -14.316 -2.362 0.393 1.00 3.44 H new ATOM 0 HB3 ALA A 107 -13.300 -3.184 1.601 1.00 3.44 H new ATOM 1601 N VAL A 108 -10.273 -3.048 1.331 1.00 1.63 N ATOM 1602 CA VAL A 108 -8.985 -2.984 2.019 1.00 1.27 C ATOM 1603 C VAL A 108 -8.280 -4.347 2.036 1.00 1.12 C ATOM 1604 O VAL A 108 -8.964 -5.364 2.140 1.00 1.38 O ATOM 1605 CB VAL A 108 -9.143 -2.531 3.478 1.00 1.17 C ATOM 1606 CG1 VAL A 108 -9.354 -1.030 3.658 1.00 1.50 C ATOM 1607 CG2 VAL A 108 -10.218 -3.314 4.255 1.00 1.20 C ATOM 0 H VAL A 108 -10.649 -3.993 1.258 1.00 1.63 H new ATOM 0 HA VAL A 108 -8.389 -2.261 1.462 1.00 1.27 H new ATOM 0 HB VAL A 108 -8.172 -2.769 3.912 1.00 1.17 H new ATOM 0 HG11 VAL A 108 -9.456 -0.801 4.719 1.00 1.50 H new ATOM 0 HG12 VAL A 108 -8.499 -0.491 3.251 1.00 1.50 H new ATOM 0 HG13 VAL A 108 -10.259 -0.724 3.133 1.00 1.50 H new ATOM 0 HG21 VAL A 108 -10.273 -2.939 5.277 1.00 1.20 H new ATOM 0 HG22 VAL A 108 -11.185 -3.185 3.768 1.00 1.20 H new ATOM 0 HG23 VAL A 108 -9.958 -4.372 4.270 1.00 1.20 H new ATOM 1617 N ILE A 109 -6.937 -4.370 2.020 1.00 0.93 N ATOM 1618 CA ILE A 109 -6.135 -5.459 2.565 1.00 1.02 C ATOM 1619 C ILE A 109 -5.854 -5.202 4.051 1.00 1.10 C ATOM 1620 O ILE A 109 -6.142 -4.121 4.563 1.00 1.28 O ATOM 1621 CB ILE A 109 -4.783 -5.573 1.827 1.00 1.14 C ATOM 1622 CG1 ILE A 109 -3.989 -4.273 1.864 1.00 2.23 C ATOM 1623 CG2 ILE A 109 -4.915 -6.075 0.391 1.00 1.94 C ATOM 1624 CD1 ILE A 109 -2.495 -4.537 1.762 1.00 2.85 C ATOM 0 H ILE A 109 -6.377 -3.617 1.620 1.00 0.93 H new ATOM 0 HA ILE A 109 -6.695 -6.385 2.436 1.00 1.02 H new ATOM 0 HB ILE A 109 -4.226 -6.329 2.381 1.00 1.14 H new ATOM 0 HG12 ILE A 109 -4.304 -3.628 1.043 1.00 2.23 H new ATOM 0 HG13 ILE A 109 -4.204 -3.739 2.789 1.00 2.23 H new ATOM 0 HG21 ILE A 109 -3.928 -6.131 -0.067 1.00 1.94 H new ATOM 0 HG22 ILE A 109 -5.371 -7.065 0.392 1.00 1.94 H new ATOM 0 HG23 ILE A 109 -5.541 -5.388 -0.179 1.00 1.94 H new ATOM 0 HD11 ILE A 109 -1.955 -3.590 1.791 1.00 2.85 H new ATOM 0 HD12 ILE A 109 -2.178 -5.161 2.597 1.00 2.85 H new ATOM 0 HD13 ILE A 109 -2.279 -5.049 0.824 1.00 2.85 H new ATOM 1636 N SER A 110 -5.202 -6.164 4.707 1.00 1.05 N ATOM 1637 CA SER A 110 -4.540 -5.993 5.991 1.00 1.01 C ATOM 1638 C SER A 110 -3.100 -6.496 5.838 1.00 0.94 C ATOM 1639 O SER A 110 -2.869 -7.696 5.987 1.00 1.15 O ATOM 1640 CB SER A 110 -5.312 -6.794 7.047 1.00 1.11 C ATOM 1641 OG SER A 110 -5.484 -8.131 6.610 1.00 2.60 O ATOM 0 H SER A 110 -5.121 -7.113 4.342 1.00 1.05 H new ATOM 0 HA SER A 110 -4.519 -4.950 6.308 1.00 1.01 H new ATOM 0 HB2 SER A 110 -4.772 -6.779 7.994 1.00 1.11 H new ATOM 0 HB3 SER A 110 -6.283 -6.333 7.227 1.00 1.11 H new ATOM 0 HG SER A 110 -4.642 -8.463 6.235 1.00 2.60 H new ATOM 1647 N GLY A 111 -2.157 -5.612 5.495 1.00 0.85 N ATOM 1648 CA GLY A 111 -0.755 -5.954 5.259 1.00 0.84 C ATOM 1649 C GLY A 111 0.162 -5.396 6.351 1.00 0.75 C ATOM 1650 O GLY A 111 -0.295 -4.677 7.241 1.00 0.99 O ATOM 0 H GLY A 111 -2.354 -4.619 5.372 1.00 0.85 H new ATOM 0 HA2 GLY A 111 -0.649 -7.038 5.215 1.00 0.84 H new ATOM 0 HA3 GLY A 111 -0.444 -5.563 4.290 1.00 0.84 H new ATOM 1654 N SER A 112 1.457 -5.723 6.268 1.00 0.78 N ATOM 1655 CA SER A 112 2.491 -5.289 7.204 1.00 0.79 C ATOM 1656 C SER A 112 3.720 -4.816 6.421 1.00 0.86 C ATOM 1657 O SER A 112 3.941 -5.255 5.290 1.00 1.00 O ATOM 1658 CB SER A 112 2.866 -6.439 8.143 1.00 0.98 C ATOM 1659 OG SER A 112 1.712 -6.911 8.815 1.00 1.51 O ATOM 0 H SER A 112 1.822 -6.316 5.522 1.00 0.78 H new ATOM 0 HA SER A 112 2.112 -4.463 7.806 1.00 0.79 H new ATOM 0 HB2 SER A 112 3.323 -7.249 7.575 1.00 0.98 H new ATOM 0 HB3 SER A 112 3.606 -6.101 8.868 1.00 0.98 H new ATOM 0 HG SER A 112 1.960 -7.647 9.412 1.00 1.51 H new ATOM 1665 N VAL A 113 4.496 -3.902 7.008 1.00 0.87 N ATOM 1666 CA VAL A 113 5.576 -3.185 6.340 1.00 0.90 C ATOM 1667 C VAL A 113 6.803 -3.154 7.249 1.00 0.84 C ATOM 1668 O VAL A 113 6.683 -3.483 8.429 1.00 1.14 O ATOM 1669 CB VAL A 113 5.106 -1.755 5.997 1.00 0.94 C ATOM 1670 CG1 VAL A 113 3.603 -1.675 5.705 1.00 1.08 C ATOM 1671 CG2 VAL A 113 5.338 -0.754 7.128 1.00 1.00 C ATOM 0 H VAL A 113 4.385 -3.636 7.986 1.00 0.87 H new ATOM 0 HA VAL A 113 5.845 -3.692 5.414 1.00 0.90 H new ATOM 0 HB VAL A 113 5.702 -1.506 5.119 1.00 0.94 H new ATOM 0 HG11 VAL A 113 3.332 -0.646 5.471 1.00 1.08 H new ATOM 0 HG12 VAL A 113 3.363 -2.316 4.857 1.00 1.08 H new ATOM 0 HG13 VAL A 113 3.044 -2.007 6.580 1.00 1.08 H new ATOM 0 HG21 VAL A 113 4.985 0.230 6.821 1.00 1.00 H new ATOM 0 HG22 VAL A 113 4.792 -1.074 8.015 1.00 1.00 H new ATOM 0 HG23 VAL A 113 6.403 -0.703 7.356 1.00 1.00 H new ATOM 1681 N LEU A 114 7.951 -2.683 6.743 1.00 0.59 N ATOM 1682 CA LEU A 114 9.078 -2.363 7.612 1.00 0.66 C ATOM 1683 C LEU A 114 9.782 -1.072 7.208 1.00 0.70 C ATOM 1684 O LEU A 114 10.101 -0.855 6.039 1.00 0.75 O ATOM 1685 CB LEU A 114 10.031 -3.556 7.775 1.00 1.03 C ATOM 1686 CG LEU A 114 11.153 -3.701 6.734 1.00 0.76 C ATOM 1687 CD1 LEU A 114 12.065 -4.859 7.147 1.00 1.32 C ATOM 1688 CD2 LEU A 114 10.619 -3.958 5.325 1.00 2.12 C ATOM 0 H LEU A 114 8.117 -2.519 5.750 1.00 0.59 H new ATOM 0 HA LEU A 114 8.671 -2.166 8.604 1.00 0.66 H new ATOM 0 HB2 LEU A 114 10.491 -3.490 8.761 1.00 1.03 H new ATOM 0 HB3 LEU A 114 9.436 -4.469 7.761 1.00 1.03 H new ATOM 0 HG LEU A 114 11.701 -2.759 6.705 1.00 0.76 H new ATOM 0 HD11 LEU A 114 12.865 -4.971 6.415 1.00 1.32 H new ATOM 0 HD12 LEU A 114 12.496 -4.651 8.127 1.00 1.32 H new ATOM 0 HD13 LEU A 114 11.485 -5.780 7.194 1.00 1.32 H new ATOM 0 HD21 LEU A 114 11.454 -4.052 4.631 1.00 2.12 H new ATOM 0 HD22 LEU A 114 10.037 -4.879 5.319 1.00 2.12 H new ATOM 0 HD23 LEU A 114 9.985 -3.126 5.019 1.00 2.12 H new ATOM 1700 N TYR A 115 10.056 -0.219 8.199 1.00 0.93 N ATOM 1701 CA TYR A 115 10.808 1.011 8.017 1.00 1.17 C ATOM 1702 C TYR A 115 12.289 0.627 7.941 1.00 1.12 C ATOM 1703 O TYR A 115 13.058 0.843 8.880 1.00 1.32 O ATOM 1704 CB TYR A 115 10.470 1.997 9.152 1.00 1.56 C ATOM 1705 CG TYR A 115 9.513 3.103 8.765 1.00 2.73 C ATOM 1706 CD1 TYR A 115 8.273 2.791 8.179 1.00 4.27 C ATOM 1707 CD2 TYR A 115 9.872 4.451 8.955 1.00 3.21 C ATOM 1708 CE1 TYR A 115 7.459 3.819 7.676 1.00 5.82 C ATOM 1709 CE2 TYR A 115 8.999 5.471 8.554 1.00 4.63 C ATOM 1710 CZ TYR A 115 7.818 5.161 7.870 1.00 5.85 C ATOM 1711 OH TYR A 115 7.013 6.168 7.431 1.00 7.40 O ATOM 0 H TYR A 115 9.754 -0.372 9.161 1.00 0.93 H new ATOM 0 HA TYR A 115 10.547 1.530 7.095 1.00 1.17 H new ATOM 0 HB2 TYR A 115 10.041 1.439 9.984 1.00 1.56 H new ATOM 0 HB3 TYR A 115 11.396 2.446 9.513 1.00 1.56 H new ATOM 0 HD1 TYR A 115 7.948 1.763 8.116 1.00 4.27 H new ATOM 0 HD2 TYR A 115 10.820 4.699 9.410 1.00 3.21 H new ATOM 0 HE1 TYR A 115 6.554 3.576 7.139 1.00 5.82 H new ATOM 0 HE2 TYR A 115 9.239 6.501 8.774 1.00 4.63 H new ATOM 0 HH TYR A 115 6.355 5.809 6.800 1.00 7.40 H new ATOM 1721 N ASN A 116 12.641 -0.020 6.823 1.00 0.98 N ATOM 1722 CA ASN A 116 13.918 -0.631 6.463 1.00 1.01 C ATOM 1723 C ASN A 116 14.417 -1.657 7.487 1.00 0.81 C ATOM 1724 O ASN A 116 14.519 -2.839 7.176 1.00 1.01 O ATOM 1725 CB ASN A 116 14.973 0.418 6.094 1.00 1.45 C ATOM 1726 CG ASN A 116 16.077 -0.220 5.252 1.00 2.20 C ATOM 1727 OD1 ASN A 116 15.850 -0.588 4.105 1.00 3.37 O ATOM 1728 ND2 ASN A 116 17.282 -0.366 5.790 1.00 2.83 N ATOM 0 H ASN A 116 11.962 -0.138 6.071 1.00 0.98 H new ATOM 0 HA ASN A 116 13.731 -1.212 5.560 1.00 1.01 H new ATOM 0 HB2 ASN A 116 14.508 1.233 5.540 1.00 1.45 H new ATOM 0 HB3 ASN A 116 15.399 0.850 6.999 1.00 1.45 H new ATOM 0 HD21 ASN A 116 18.035 -0.790 5.248 1.00 2.83 H new ATOM 0 HD22 ASN A 116 17.455 -0.055 6.746 1.00 2.83 H new ATOM 1735 N GLN A 117 14.702 -1.219 8.715 1.00 0.90 N ATOM 1736 CA GLN A 117 14.933 -2.089 9.860 1.00 1.14 C ATOM 1737 C GLN A 117 13.608 -2.370 10.575 1.00 1.30 C ATOM 1738 O GLN A 117 13.345 -3.487 11.015 1.00 1.61 O ATOM 1739 CB GLN A 117 15.891 -1.433 10.871 1.00 1.65 C ATOM 1740 CG GLN A 117 17.224 -0.934 10.293 1.00 1.62 C ATOM 1741 CD GLN A 117 17.111 0.342 9.461 1.00 1.59 C ATOM 1742 OE1 GLN A 117 17.741 0.460 8.417 1.00 2.39 O ATOM 1743 NE2 GLN A 117 16.311 1.315 9.887 1.00 2.27 N ATOM 0 H GLN A 117 14.779 -0.227 8.941 1.00 0.90 H new ATOM 0 HA GLN A 117 15.375 -3.014 9.489 1.00 1.14 H new ATOM 0 HB2 GLN A 117 15.379 -0.591 11.336 1.00 1.65 H new ATOM 0 HB3 GLN A 117 16.105 -2.152 11.662 1.00 1.65 H new ATOM 0 HG2 GLN A 117 17.919 -0.758 11.114 1.00 1.62 H new ATOM 0 HG3 GLN A 117 17.655 -1.721 9.674 1.00 1.62 H new ATOM 0 HE21 GLN A 117 15.792 1.204 10.758 1.00 2.27 H new ATOM 0 HE22 GLN A 117 16.216 2.172 9.343 1.00 2.27 H new ATOM 1752 N ALA A 118 12.813 -1.318 10.790 1.00 1.42 N ATOM 1753 CA ALA A 118 11.811 -1.315 11.843 1.00 1.67 C ATOM 1754 C ALA A 118 10.484 -1.886 11.351 1.00 1.16 C ATOM 1755 O ALA A 118 9.625 -1.153 10.858 1.00 1.46 O ATOM 1756 CB ALA A 118 11.659 0.096 12.413 1.00 2.26 C ATOM 0 H ALA A 118 12.849 -0.458 10.243 1.00 1.42 H new ATOM 0 HA ALA A 118 12.145 -1.968 12.649 1.00 1.67 H new ATOM 0 HB1 ALA A 118 10.907 0.091 13.202 1.00 2.26 H new ATOM 0 HB2 ALA A 118 12.613 0.427 12.824 1.00 2.26 H new ATOM 0 HB3 ALA A 118 11.349 0.777 11.620 1.00 2.26 H new ATOM 1762 N GLU A 119 10.290 -3.191 11.546 1.00 0.90 N ATOM 1763 CA GLU A 119 9.030 -3.861 11.259 1.00 0.96 C ATOM 1764 C GLU A 119 8.043 -3.568 12.393 1.00 0.98 C ATOM 1765 O GLU A 119 7.647 -4.464 13.134 1.00 1.47 O ATOM 1766 CB GLU A 119 9.270 -5.365 11.049 1.00 1.55 C ATOM 1767 CG GLU A 119 8.049 -6.043 10.406 1.00 2.05 C ATOM 1768 CD GLU A 119 8.179 -7.559 10.340 1.00 2.92 C ATOM 1769 OE1 GLU A 119 7.128 -8.200 10.119 1.00 3.06 O ATOM 1770 OE2 GLU A 119 9.314 -8.050 10.518 1.00 4.25 O ATOM 0 H GLU A 119 11.011 -3.814 11.910 1.00 0.90 H new ATOM 0 HA GLU A 119 8.594 -3.484 10.334 1.00 0.96 H new ATOM 0 HB2 GLU A 119 10.145 -5.510 10.415 1.00 1.55 H new ATOM 0 HB3 GLU A 119 9.488 -5.837 12.007 1.00 1.55 H new ATOM 0 HG2 GLU A 119 7.155 -5.784 10.974 1.00 2.05 H new ATOM 0 HG3 GLU A 119 7.911 -5.651 9.398 1.00 2.05 H new ATOM 1777 N LYS A 120 7.645 -2.299 12.538 1.00 0.68 N ATOM 1778 CA LYS A 120 6.546 -1.885 13.400 1.00 0.70 C ATOM 1779 C LYS A 120 5.645 -0.952 12.618 1.00 0.73 C ATOM 1780 O LYS A 120 5.513 0.240 12.894 1.00 0.96 O ATOM 1781 CB LYS A 120 7.037 -1.307 14.730 1.00 0.91 C ATOM 1782 CG LYS A 120 7.597 -2.392 15.656 1.00 1.52 C ATOM 1783 CD LYS A 120 6.624 -3.532 15.960 1.00 1.83 C ATOM 1784 CE LYS A 120 5.350 -3.109 16.702 1.00 2.38 C ATOM 1785 NZ LYS A 120 4.463 -4.264 16.950 1.00 3.01 N ATOM 0 H LYS A 120 8.089 -1.522 12.049 1.00 0.68 H new ATOM 0 HA LYS A 120 5.958 -2.754 13.693 1.00 0.70 H new ATOM 0 HB2 LYS A 120 7.808 -0.561 14.538 1.00 0.91 H new ATOM 0 HB3 LYS A 120 6.214 -0.794 15.228 1.00 0.91 H new ATOM 0 HG2 LYS A 120 8.496 -2.810 15.203 1.00 1.52 H new ATOM 0 HG3 LYS A 120 7.899 -1.929 16.595 1.00 1.52 H new ATOM 0 HD2 LYS A 120 6.340 -4.009 15.022 1.00 1.83 H new ATOM 0 HD3 LYS A 120 7.142 -4.284 16.555 1.00 1.83 H new ATOM 0 HE2 LYS A 120 5.617 -2.643 17.650 1.00 2.38 H new ATOM 0 HE3 LYS A 120 4.818 -2.359 16.117 1.00 2.38 H new ATOM 0 HZ1 LYS A 120 3.610 -3.945 17.453 1.00 3.01 H new ATOM 0 HZ2 LYS A 120 4.190 -4.693 16.043 1.00 3.01 H new ATOM 0 HZ3 LYS A 120 4.964 -4.968 17.529 1.00 3.01 H new ATOM 1799 N GLY A 121 5.007 -1.568 11.632 1.00 0.70 N ATOM 1800 CA GLY A 121 3.999 -0.925 10.822 1.00 0.76 C ATOM 1801 C GLY A 121 3.069 -1.947 10.192 1.00 0.71 C ATOM 1802 O GLY A 121 3.495 -2.790 9.403 1.00 0.91 O ATOM 0 H GLY A 121 5.182 -2.539 11.375 1.00 0.70 H new ATOM 0 HA2 GLY A 121 3.422 -0.233 11.436 1.00 0.76 H new ATOM 0 HA3 GLY A 121 4.478 -0.335 10.041 1.00 0.76 H new ATOM 1806 N SER A 122 1.792 -1.846 10.537 1.00 1.02 N ATOM 1807 CA SER A 122 0.697 -2.476 9.823 1.00 0.91 C ATOM 1808 C SER A 122 0.223 -1.492 8.747 1.00 0.79 C ATOM 1809 O SER A 122 0.580 -0.312 8.787 1.00 0.93 O ATOM 1810 CB SER A 122 -0.400 -2.858 10.825 1.00 0.89 C ATOM 1811 OG SER A 122 -0.260 -2.122 12.031 1.00 1.21 O ATOM 0 H SER A 122 1.484 -1.307 11.346 1.00 1.02 H new ATOM 0 HA SER A 122 0.998 -3.399 9.328 1.00 0.91 H new ATOM 0 HB2 SER A 122 -1.380 -2.666 10.388 1.00 0.89 H new ATOM 0 HB3 SER A 122 -0.349 -3.926 11.037 1.00 0.89 H new ATOM 0 HG SER A 122 -1.147 -1.884 12.374 1.00 1.21 H new ATOM 1817 N TYR A 123 -0.542 -1.964 7.759 1.00 0.76 N ATOM 1818 CA TYR A 123 -0.936 -1.150 6.620 1.00 0.72 C ATOM 1819 C TYR A 123 -2.228 -1.669 6.002 1.00 0.55 C ATOM 1820 O TYR A 123 -2.468 -2.874 5.973 1.00 0.59 O ATOM 1821 CB TYR A 123 0.233 -1.103 5.627 1.00 1.12 C ATOM 1822 CG TYR A 123 -0.055 -0.607 4.223 1.00 0.68 C ATOM 1823 CD1 TYR A 123 -0.403 -1.531 3.219 1.00 1.94 C ATOM 1824 CD2 TYR A 123 0.303 0.703 3.862 1.00 2.26 C ATOM 1825 CE1 TYR A 123 -0.345 -1.157 1.865 1.00 2.01 C ATOM 1826 CE2 TYR A 123 0.368 1.074 2.510 1.00 2.78 C ATOM 1827 CZ TYR A 123 0.034 0.146 1.510 1.00 1.83 C ATOM 1828 OH TYR A 123 0.137 0.485 0.194 1.00 2.52 O ATOM 0 H TYR A 123 -0.901 -2.918 7.732 1.00 0.76 H new ATOM 0 HA TYR A 123 -1.153 -0.130 6.936 1.00 0.72 H new ATOM 0 HB2 TYR A 123 1.010 -0.469 6.054 1.00 1.12 H new ATOM 0 HB3 TYR A 123 0.648 -2.108 5.549 1.00 1.12 H new ATOM 0 HD1 TYR A 123 -0.715 -2.529 3.490 1.00 1.94 H new ATOM 0 HD2 TYR A 123 0.529 1.428 4.629 1.00 2.26 H new ATOM 0 HE1 TYR A 123 -0.593 -1.874 1.097 1.00 2.01 H new ATOM 0 HE2 TYR A 123 0.675 2.073 2.239 1.00 2.78 H new ATOM 0 HH TYR A 123 0.408 1.424 0.118 1.00 2.52 H new ATOM 1838 N SER A 124 -3.070 -0.742 5.536 1.00 0.56 N ATOM 1839 CA SER A 124 -4.381 -1.024 4.984 1.00 0.59 C ATOM 1840 C SER A 124 -4.502 -0.216 3.699 1.00 0.64 C ATOM 1841 O SER A 124 -4.424 1.011 3.726 1.00 0.76 O ATOM 1842 CB SER A 124 -5.465 -0.619 5.988 1.00 0.76 C ATOM 1843 OG SER A 124 -5.289 -1.319 7.204 1.00 1.98 O ATOM 0 H SER A 124 -2.843 0.252 5.536 1.00 0.56 H new ATOM 0 HA SER A 124 -4.507 -2.087 4.778 1.00 0.59 H new ATOM 0 HB2 SER A 124 -5.421 0.455 6.168 1.00 0.76 H new ATOM 0 HB3 SER A 124 -6.451 -0.833 5.576 1.00 0.76 H new ATOM 0 HG SER A 124 -5.986 -1.052 7.839 1.00 1.98 H new ATOM 1849 N LEU A 125 -4.654 -0.912 2.576 1.00 0.66 N ATOM 1850 CA LEU A 125 -4.720 -0.332 1.248 1.00 0.69 C ATOM 1851 C LEU A 125 -5.908 -0.949 0.535 1.00 0.70 C ATOM 1852 O LEU A 125 -6.144 -2.147 0.655 1.00 0.77 O ATOM 1853 CB LEU A 125 -3.391 -0.602 0.546 1.00 0.67 C ATOM 1854 CG LEU A 125 -3.345 -0.365 -0.967 1.00 0.71 C ATOM 1855 CD1 LEU A 125 -4.012 -1.466 -1.795 1.00 0.78 C ATOM 1856 CD2 LEU A 125 -3.775 1.032 -1.396 1.00 0.86 C ATOM 0 H LEU A 125 -4.737 -1.929 2.571 1.00 0.66 H new ATOM 0 HA LEU A 125 -4.866 0.748 1.264 1.00 0.69 H new ATOM 0 HB2 LEU A 125 -2.629 0.024 1.011 1.00 0.67 H new ATOM 0 HB3 LEU A 125 -3.112 -1.638 0.736 1.00 0.67 H new ATOM 0 HG LEU A 125 -2.282 -0.426 -1.201 1.00 0.71 H new ATOM 0 HD11 LEU A 125 -3.936 -1.221 -2.854 1.00 0.78 H new ATOM 0 HD12 LEU A 125 -3.513 -2.417 -1.605 1.00 0.78 H new ATOM 0 HD13 LEU A 125 -5.063 -1.545 -1.516 1.00 0.78 H new ATOM 0 HD21 LEU A 125 -3.713 1.115 -2.481 1.00 0.86 H new ATOM 0 HD22 LEU A 125 -4.802 1.211 -1.077 1.00 0.86 H new ATOM 0 HD23 LEU A 125 -3.118 1.772 -0.938 1.00 0.86 H new ATOM 1868 N GLY A 126 -6.660 -0.130 -0.188 1.00 0.75 N ATOM 1869 CA GLY A 126 -7.896 -0.500 -0.848 1.00 0.77 C ATOM 1870 C GLY A 126 -7.920 0.067 -2.256 1.00 0.86 C ATOM 1871 O GLY A 126 -7.257 1.067 -2.532 1.00 1.23 O ATOM 0 H GLY A 126 -6.412 0.849 -0.334 1.00 0.75 H new ATOM 0 HA2 GLY A 126 -7.989 -1.585 -0.882 1.00 0.77 H new ATOM 0 HA3 GLY A 126 -8.748 -0.125 -0.281 1.00 0.77 H new ATOM 1875 N ILE A 127 -8.686 -0.575 -3.137 1.00 0.81 N ATOM 1876 CA ILE A 127 -8.849 -0.169 -4.532 1.00 0.84 C ATOM 1877 C ILE A 127 -10.258 0.358 -4.753 1.00 0.86 C ATOM 1878 O ILE A 127 -11.176 -0.048 -4.040 1.00 1.09 O ATOM 1879 CB ILE A 127 -8.521 -1.337 -5.494 1.00 1.01 C ATOM 1880 CG1 ILE A 127 -7.354 -0.986 -6.425 1.00 1.57 C ATOM 1881 CG2 ILE A 127 -9.698 -1.860 -6.338 1.00 1.89 C ATOM 1882 CD1 ILE A 127 -7.501 0.323 -7.213 1.00 3.01 C ATOM 0 H ILE A 127 -9.222 -1.409 -2.896 1.00 0.81 H new ATOM 0 HA ILE A 127 -8.144 0.632 -4.751 1.00 0.84 H new ATOM 0 HB ILE A 127 -8.249 -2.149 -4.820 1.00 1.01 H new ATOM 0 HG12 ILE A 127 -6.443 -0.930 -5.830 1.00 1.57 H new ATOM 0 HG13 ILE A 127 -7.221 -1.803 -7.135 1.00 1.57 H new ATOM 0 HG21 ILE A 127 -9.355 -2.676 -6.974 1.00 1.89 H new ATOM 0 HG22 ILE A 127 -10.487 -2.221 -5.678 1.00 1.89 H new ATOM 0 HG23 ILE A 127 -10.087 -1.053 -6.960 1.00 1.89 H new ATOM 0 HD11 ILE A 127 -6.621 0.472 -7.838 1.00 3.01 H new ATOM 0 HD12 ILE A 127 -8.389 0.271 -7.843 1.00 3.01 H new ATOM 0 HD13 ILE A 127 -7.598 1.157 -6.518 1.00 3.01 H new ATOM 1894 N PHE A 128 -10.460 1.198 -5.774 1.00 0.74 N ATOM 1895 CA PHE A 128 -11.804 1.432 -6.258 1.00 0.74 C ATOM 1896 C PHE A 128 -11.876 1.826 -7.733 1.00 1.10 C ATOM 1897 O PHE A 128 -10.864 2.061 -8.404 1.00 1.45 O ATOM 1898 CB PHE A 128 -12.510 2.453 -5.350 1.00 1.78 C ATOM 1899 CG PHE A 128 -14.013 2.275 -5.314 1.00 2.59 C ATOM 1900 CD1 PHE A 128 -14.548 1.083 -4.794 1.00 3.80 C ATOM 1901 CD2 PHE A 128 -14.864 3.223 -5.913 1.00 3.41 C ATOM 1902 CE1 PHE A 128 -15.931 0.841 -4.860 1.00 4.86 C ATOM 1903 CE2 PHE A 128 -16.247 2.981 -5.979 1.00 4.40 C ATOM 1904 CZ PHE A 128 -16.780 1.792 -5.452 1.00 4.86 C ATOM 0 H PHE A 128 -9.725 1.710 -6.263 1.00 0.74 H new ATOM 0 HA PHE A 128 -12.333 0.480 -6.208 1.00 0.74 H new ATOM 0 HB2 PHE A 128 -12.115 2.365 -4.338 1.00 1.78 H new ATOM 0 HB3 PHE A 128 -12.277 3.460 -5.696 1.00 1.78 H new ATOM 0 HD1 PHE A 128 -13.894 0.351 -4.343 1.00 3.80 H new ATOM 0 HD2 PHE A 128 -14.455 4.135 -6.321 1.00 3.41 H new ATOM 0 HE1 PHE A 128 -16.340 -0.073 -4.457 1.00 4.86 H new ATOM 0 HE2 PHE A 128 -16.901 3.710 -6.435 1.00 4.40 H new ATOM 0 HZ PHE A 128 -17.843 1.609 -5.502 1.00 4.86 H new ATOM 1914 N GLY A 129 -13.121 1.853 -8.221 1.00 1.79 N ATOM 1915 CA GLY A 129 -13.505 2.338 -9.539 1.00 2.71 C ATOM 1916 C GLY A 129 -13.917 1.199 -10.472 1.00 1.93 C ATOM 1917 O GLY A 129 -14.502 1.445 -11.525 1.00 2.64 O ATOM 0 H GLY A 129 -13.919 1.521 -7.679 1.00 1.79 H new ATOM 0 HA2 GLY A 129 -14.331 3.042 -9.439 1.00 2.71 H new ATOM 0 HA3 GLY A 129 -12.672 2.885 -9.981 1.00 2.71 H new ATOM 1921 N GLY A 130 -13.569 -0.039 -10.115 1.00 1.12 N ATOM 1922 CA GLY A 130 -13.813 -1.225 -10.916 1.00 1.56 C ATOM 1923 C GLY A 130 -12.481 -1.672 -11.498 1.00 1.71 C ATOM 1924 O GLY A 130 -11.751 -2.422 -10.853 1.00 2.86 O ATOM 0 H GLY A 130 -13.097 -0.242 -9.234 1.00 1.12 H new ATOM 0 HA2 GLY A 130 -14.248 -2.016 -10.305 1.00 1.56 H new ATOM 0 HA3 GLY A 130 -14.525 -1.009 -11.712 1.00 1.56 H new ATOM 1928 N LYS A 131 -12.097 -1.135 -12.665 1.00 1.44 N ATOM 1929 CA LYS A 131 -10.826 -1.466 -13.309 1.00 1.42 C ATOM 1930 C LYS A 131 -9.634 -0.747 -12.652 1.00 1.15 C ATOM 1931 O LYS A 131 -8.851 -0.081 -13.335 1.00 1.39 O ATOM 1932 CB LYS A 131 -10.912 -1.250 -14.832 1.00 1.79 C ATOM 1933 CG LYS A 131 -11.221 0.195 -15.259 1.00 1.81 C ATOM 1934 CD LYS A 131 -10.183 0.712 -16.265 1.00 2.18 C ATOM 1935 CE LYS A 131 -10.515 2.142 -16.718 1.00 2.49 C ATOM 1936 NZ LYS A 131 -9.397 2.768 -17.454 1.00 3.38 N ATOM 0 H LYS A 131 -12.660 -0.461 -13.185 1.00 1.44 H new ATOM 0 HA LYS A 131 -10.634 -2.528 -13.154 1.00 1.42 H new ATOM 0 HB2 LYS A 131 -9.967 -1.553 -15.282 1.00 1.79 H new ATOM 0 HB3 LYS A 131 -11.683 -1.907 -15.236 1.00 1.79 H new ATOM 0 HG2 LYS A 131 -12.215 0.241 -15.703 1.00 1.81 H new ATOM 0 HG3 LYS A 131 -11.234 0.841 -14.381 1.00 1.81 H new ATOM 0 HD2 LYS A 131 -9.192 0.692 -15.812 1.00 2.18 H new ATOM 0 HD3 LYS A 131 -10.151 0.051 -17.131 1.00 2.18 H new ATOM 0 HE2 LYS A 131 -11.401 2.124 -17.353 1.00 2.49 H new ATOM 0 HE3 LYS A 131 -10.760 2.750 -15.847 1.00 2.49 H new ATOM 0 HZ1 LYS A 131 -9.761 3.541 -18.047 1.00 3.38 H new ATOM 0 HZ2 LYS A 131 -8.705 3.148 -16.777 1.00 3.38 H new ATOM 0 HZ3 LYS A 131 -8.936 2.056 -18.057 1.00 3.38 H new ATOM 1950 N ALA A 132 -9.503 -0.903 -11.328 1.00 1.00 N ATOM 1951 CA ALA A 132 -8.387 -0.477 -10.497 1.00 0.90 C ATOM 1952 C ALA A 132 -7.872 0.917 -10.860 1.00 0.97 C ATOM 1953 O ALA A 132 -6.742 1.067 -11.327 1.00 1.39 O ATOM 1954 CB ALA A 132 -7.286 -1.539 -10.535 1.00 1.11 C ATOM 0 H ALA A 132 -10.229 -1.363 -10.778 1.00 1.00 H new ATOM 0 HA ALA A 132 -8.743 -0.384 -9.471 1.00 0.90 H new ATOM 0 HB1 ALA A 132 -6.450 -1.219 -9.912 1.00 1.11 H new ATOM 0 HB2 ALA A 132 -7.678 -2.484 -10.158 1.00 1.11 H new ATOM 0 HB3 ALA A 132 -6.944 -1.672 -11.561 1.00 1.11 H new ATOM 1960 N GLN A 133 -8.709 1.938 -10.658 1.00 0.79 N ATOM 1961 CA GLN A 133 -8.440 3.273 -11.170 1.00 0.92 C ATOM 1962 C GLN A 133 -7.691 4.092 -10.142 1.00 0.90 C ATOM 1963 O GLN A 133 -6.631 4.642 -10.448 1.00 1.15 O ATOM 1964 CB GLN A 133 -9.739 3.944 -11.622 1.00 1.04 C ATOM 1965 CG GLN A 133 -10.082 3.462 -13.038 1.00 1.57 C ATOM 1966 CD GLN A 133 -11.583 3.371 -13.257 1.00 1.67 C ATOM 1967 OE1 GLN A 133 -12.161 4.122 -14.034 1.00 1.97 O ATOM 1968 NE2 GLN A 133 -12.199 2.399 -12.600 1.00 2.49 N ATOM 0 H GLN A 133 -9.583 1.858 -10.139 1.00 0.79 H new ATOM 0 HA GLN A 133 -7.798 3.199 -12.048 1.00 0.92 H new ATOM 0 HB2 GLN A 133 -10.549 3.699 -10.934 1.00 1.04 H new ATOM 0 HB3 GLN A 133 -9.627 5.028 -11.610 1.00 1.04 H new ATOM 0 HG2 GLN A 133 -9.649 4.145 -13.769 1.00 1.57 H new ATOM 0 HG3 GLN A 133 -9.630 2.485 -13.208 1.00 1.57 H new ATOM 0 HE21 GLN A 133 -11.673 1.800 -11.964 1.00 2.49 H new ATOM 0 HE22 GLN A 133 -13.200 2.250 -12.731 1.00 2.49 H new ATOM 1977 N GLU A 134 -8.260 4.159 -8.939 1.00 0.76 N ATOM 1978 CA GLU A 134 -7.719 4.920 -7.836 1.00 0.85 C ATOM 1979 C GLU A 134 -7.671 3.989 -6.632 1.00 0.75 C ATOM 1980 O GLU A 134 -8.646 3.286 -6.359 1.00 1.05 O ATOM 1981 CB GLU A 134 -8.585 6.163 -7.591 1.00 1.18 C ATOM 1982 CG GLU A 134 -8.758 6.967 -8.890 1.00 1.41 C ATOM 1983 CD GLU A 134 -9.426 8.318 -8.677 1.00 1.94 C ATOM 1984 OE1 GLU A 134 -10.020 8.517 -7.599 1.00 1.97 O ATOM 1985 OE2 GLU A 134 -9.334 9.132 -9.625 1.00 3.11 O ATOM 0 H GLU A 134 -9.127 3.673 -8.709 1.00 0.76 H new ATOM 0 HA GLU A 134 -6.713 5.284 -8.044 1.00 0.85 H new ATOM 0 HB2 GLU A 134 -9.561 5.863 -7.210 1.00 1.18 H new ATOM 0 HB3 GLU A 134 -8.123 6.790 -6.828 1.00 1.18 H new ATOM 0 HG2 GLU A 134 -7.780 7.121 -9.347 1.00 1.41 H new ATOM 0 HG3 GLU A 134 -9.351 6.383 -9.594 1.00 1.41 H new ATOM 1992 N VAL A 135 -6.523 3.951 -5.952 1.00 0.66 N ATOM 1993 CA VAL A 135 -6.362 3.242 -4.691 1.00 0.67 C ATOM 1994 C VAL A 135 -6.439 4.303 -3.600 1.00 0.91 C ATOM 1995 O VAL A 135 -6.110 5.464 -3.856 1.00 1.54 O ATOM 1996 CB VAL A 135 -5.056 2.404 -4.627 1.00 0.71 C ATOM 1997 CG1 VAL A 135 -4.626 1.777 -5.965 1.00 1.07 C ATOM 1998 CG2 VAL A 135 -3.891 3.170 -3.995 1.00 1.05 C ATOM 0 H VAL A 135 -5.673 4.418 -6.269 1.00 0.66 H new ATOM 0 HA VAL A 135 -7.148 2.498 -4.565 1.00 0.67 H new ATOM 0 HB VAL A 135 -5.318 1.573 -3.973 1.00 0.71 H new ATOM 0 HG11 VAL A 135 -3.705 1.211 -5.822 1.00 1.07 H new ATOM 0 HG12 VAL A 135 -5.410 1.110 -6.323 1.00 1.07 H new ATOM 0 HG13 VAL A 135 -4.458 2.565 -6.699 1.00 1.07 H new ATOM 0 HG21 VAL A 135 -3.005 2.535 -3.977 1.00 1.05 H new ATOM 0 HG22 VAL A 135 -3.684 4.065 -4.581 1.00 1.05 H new ATOM 0 HG23 VAL A 135 -4.153 3.456 -2.976 1.00 1.05 H new ATOM 2008 N ALA A 136 -6.839 3.896 -2.396 1.00 0.76 N ATOM 2009 CA ALA A 136 -6.801 4.713 -1.195 1.00 0.94 C ATOM 2010 C ALA A 136 -6.187 3.841 -0.109 1.00 1.02 C ATOM 2011 O ALA A 136 -6.467 2.643 -0.069 1.00 1.09 O ATOM 2012 CB ALA A 136 -8.218 5.154 -0.823 1.00 1.08 C ATOM 0 H ALA A 136 -7.209 2.960 -2.230 1.00 0.76 H new ATOM 0 HA ALA A 136 -6.213 5.620 -1.334 1.00 0.94 H new ATOM 0 HB1 ALA A 136 -8.184 5.766 0.078 1.00 1.08 H new ATOM 0 HB2 ALA A 136 -8.645 5.735 -1.641 1.00 1.08 H new ATOM 0 HB3 ALA A 136 -8.837 4.275 -0.641 1.00 1.08 H new ATOM 2018 N GLY A 137 -5.321 4.396 0.738 1.00 1.05 N ATOM 2019 CA GLY A 137 -4.673 3.598 1.762 1.00 1.11 C ATOM 2020 C GLY A 137 -4.213 4.435 2.940 1.00 1.10 C ATOM 2021 O GLY A 137 -4.223 5.668 2.895 1.00 1.16 O ATOM 0 H GLY A 137 -5.059 5.382 0.732 1.00 1.05 H new ATOM 0 HA2 GLY A 137 -5.363 2.831 2.112 1.00 1.11 H new ATOM 0 HA3 GLY A 137 -3.816 3.082 1.329 1.00 1.11 H new ATOM 2025 N SER A 138 -3.755 3.752 3.987 1.00 1.08 N ATOM 2026 CA SER A 138 -2.946 4.334 5.038 1.00 1.13 C ATOM 2027 C SER A 138 -2.057 3.236 5.611 1.00 0.94 C ATOM 2028 O SER A 138 -2.452 2.068 5.634 1.00 0.87 O ATOM 2029 CB SER A 138 -3.826 4.940 6.140 1.00 1.27 C ATOM 2030 OG SER A 138 -4.725 5.903 5.622 1.00 1.76 O ATOM 0 H SER A 138 -3.944 2.759 4.125 1.00 1.08 H new ATOM 0 HA SER A 138 -2.337 5.141 4.630 1.00 1.13 H new ATOM 0 HB2 SER A 138 -4.387 4.147 6.635 1.00 1.27 H new ATOM 0 HB3 SER A 138 -3.193 5.403 6.897 1.00 1.27 H new ATOM 0 HG SER A 138 -4.552 6.032 4.666 1.00 1.76 H new ATOM 2036 N ALA A 139 -0.868 3.609 6.085 1.00 0.99 N ATOM 2037 CA ALA A 139 -0.128 2.757 7.004 1.00 0.87 C ATOM 2038 C ALA A 139 -0.543 3.101 8.435 1.00 0.94 C ATOM 2039 O ALA A 139 -1.267 4.073 8.646 1.00 1.33 O ATOM 2040 CB ALA A 139 1.383 2.885 6.790 1.00 1.21 C ATOM 0 H ALA A 139 -0.404 4.486 5.849 1.00 0.99 H new ATOM 0 HA ALA A 139 -0.370 1.712 6.812 1.00 0.87 H new ATOM 0 HB1 ALA A 139 1.906 2.236 7.492 1.00 1.21 H new ATOM 0 HB2 ALA A 139 1.632 2.592 5.770 1.00 1.21 H new ATOM 0 HB3 ALA A 139 1.688 3.918 6.955 1.00 1.21 H new ATOM 2046 N GLU A 140 -0.047 2.341 9.413 1.00 0.93 N ATOM 2047 CA GLU A 140 0.093 2.826 10.778 1.00 1.05 C ATOM 2048 C GLU A 140 1.495 2.510 11.307 1.00 1.11 C ATOM 2049 O GLU A 140 1.692 1.841 12.319 1.00 1.81 O ATOM 2050 CB GLU A 140 -1.043 2.355 11.681 1.00 1.27 C ATOM 2051 CG GLU A 140 -1.245 0.842 11.730 1.00 2.43 C ATOM 2052 CD GLU A 140 -1.979 0.409 12.993 1.00 2.97 C ATOM 2053 OE1 GLU A 140 -2.189 1.275 13.881 1.00 2.67 O ATOM 2054 OE2 GLU A 140 -2.313 -0.794 13.047 1.00 4.37 O ATOM 0 H GLU A 140 0.266 1.379 9.278 1.00 0.93 H new ATOM 0 HA GLU A 140 -0.003 3.912 10.779 1.00 1.05 H new ATOM 0 HB2 GLU A 140 -0.855 2.714 12.693 1.00 1.27 H new ATOM 0 HB3 GLU A 140 -1.970 2.819 11.345 1.00 1.27 H new ATOM 0 HG2 GLU A 140 -1.809 0.522 10.854 1.00 2.43 H new ATOM 0 HG3 GLU A 140 -0.276 0.344 11.684 1.00 2.43 H new ATOM 2061 N VAL A 141 2.486 3.042 10.601 1.00 1.01 N ATOM 2062 CA VAL A 141 3.896 2.839 10.882 1.00 0.95 C ATOM 2063 C VAL A 141 4.352 3.667 12.078 1.00 0.95 C ATOM 2064 O VAL A 141 4.083 4.861 12.134 1.00 1.21 O ATOM 2065 CB VAL A 141 4.711 3.180 9.631 1.00 0.99 C ATOM 2066 CG1 VAL A 141 4.428 2.151 8.537 1.00 2.14 C ATOM 2067 CG2 VAL A 141 4.489 4.620 9.131 1.00 1.75 C ATOM 0 H VAL A 141 2.322 3.644 9.794 1.00 1.01 H new ATOM 0 HA VAL A 141 4.057 1.793 11.143 1.00 0.95 H new ATOM 0 HB VAL A 141 5.765 3.132 9.905 1.00 0.99 H new ATOM 0 HG11 VAL A 141 5.009 2.396 7.648 1.00 2.14 H new ATOM 0 HG12 VAL A 141 4.707 1.158 8.890 1.00 2.14 H new ATOM 0 HG13 VAL A 141 3.366 2.164 8.291 1.00 2.14 H new ATOM 0 HG21 VAL A 141 5.096 4.794 8.243 1.00 1.75 H new ATOM 0 HG22 VAL A 141 3.437 4.761 8.885 1.00 1.75 H new ATOM 0 HG23 VAL A 141 4.777 5.325 9.911 1.00 1.75 H new ATOM 2077 N LYS A 142 5.085 3.069 13.019 1.00 0.87 N ATOM 2078 CA LYS A 142 5.770 3.838 14.043 1.00 0.91 C ATOM 2079 C LYS A 142 7.230 3.420 14.086 1.00 1.11 C ATOM 2080 O LYS A 142 7.543 2.232 14.066 1.00 1.50 O ATOM 2081 CB LYS A 142 5.083 3.695 15.406 1.00 1.04 C ATOM 2082 CG LYS A 142 5.463 2.385 16.105 1.00 1.30 C ATOM 2083 CD LYS A 142 4.547 2.017 17.282 1.00 1.92 C ATOM 2084 CE LYS A 142 4.577 3.021 18.446 1.00 3.32 C ATOM 2085 NZ LYS A 142 3.742 4.215 18.203 1.00 3.95 N ATOM 0 H LYS A 142 5.215 2.060 13.088 1.00 0.87 H new ATOM 0 HA LYS A 142 5.721 4.898 13.792 1.00 0.91 H new ATOM 0 HB2 LYS A 142 5.357 4.538 16.041 1.00 1.04 H new ATOM 0 HB3 LYS A 142 4.002 3.735 15.273 1.00 1.04 H new ATOM 0 HG2 LYS A 142 5.442 1.576 15.375 1.00 1.30 H new ATOM 0 HG3 LYS A 142 6.489 2.462 16.466 1.00 1.30 H new ATOM 0 HD2 LYS A 142 3.523 1.932 16.917 1.00 1.92 H new ATOM 0 HD3 LYS A 142 4.834 1.035 17.657 1.00 1.92 H new ATOM 0 HE2 LYS A 142 4.236 2.525 19.355 1.00 3.32 H new ATOM 0 HE3 LYS A 142 5.606 3.334 18.621 1.00 3.32 H new ATOM 0 HZ1 LYS A 142 4.351 5.055 18.127 1.00 3.95 H new ATOM 0 HZ2 LYS A 142 3.210 4.092 17.318 1.00 3.95 H new ATOM 0 HZ3 LYS A 142 3.077 4.340 18.993 1.00 3.95 H new ATOM 2099 N THR A 143 8.117 4.399 14.208 1.00 1.07 N ATOM 2100 CA THR A 143 9.493 4.160 14.612 1.00 1.24 C ATOM 2101 C THR A 143 10.064 5.504 15.036 1.00 1.22 C ATOM 2102 O THR A 143 9.291 6.456 15.186 1.00 1.13 O ATOM 2103 CB THR A 143 10.309 3.420 13.532 1.00 1.51 C ATOM 2104 OG1 THR A 143 11.593 3.107 14.035 1.00 2.90 O ATOM 2105 CG2 THR A 143 10.456 4.195 12.225 1.00 2.00 C ATOM 0 H THR A 143 7.901 5.380 14.029 1.00 1.07 H new ATOM 0 HA THR A 143 9.544 3.473 15.457 1.00 1.24 H new ATOM 0 HB THR A 143 9.748 2.516 13.296 1.00 1.51 H new ATOM 0 HG1 THR A 143 12.108 2.636 13.347 1.00 2.90 H new ATOM 0 HG21 THR A 143 11.042 3.608 11.518 1.00 2.00 H new ATOM 0 HG22 THR A 143 9.469 4.390 11.805 1.00 2.00 H new ATOM 0 HG23 THR A 143 10.962 5.141 12.418 1.00 2.00 H new ATOM 2113 N VAL A 144 11.387 5.578 15.202 1.00 1.40 N ATOM 2114 CA VAL A 144 12.105 6.783 15.604 1.00 1.43 C ATOM 2115 C VAL A 144 11.590 7.978 14.801 1.00 1.21 C ATOM 2116 O VAL A 144 11.369 9.051 15.358 1.00 1.21 O ATOM 2117 CB VAL A 144 13.625 6.585 15.447 1.00 1.70 C ATOM 2118 CG1 VAL A 144 14.391 7.808 15.970 1.00 2.07 C ATOM 2119 CG2 VAL A 144 14.115 5.349 16.217 1.00 2.01 C ATOM 0 H VAL A 144 12.002 4.778 15.056 1.00 1.40 H new ATOM 0 HA VAL A 144 11.921 6.985 16.659 1.00 1.43 H new ATOM 0 HB VAL A 144 13.815 6.449 14.382 1.00 1.70 H new ATOM 0 HG11 VAL A 144 15.462 7.646 15.849 1.00 2.07 H new ATOM 0 HG12 VAL A 144 14.092 8.692 15.407 1.00 2.07 H new ATOM 0 HG13 VAL A 144 14.163 7.956 17.026 1.00 2.07 H new ATOM 0 HG21 VAL A 144 15.191 5.240 16.084 1.00 2.01 H new ATOM 0 HG22 VAL A 144 13.891 5.468 17.277 1.00 2.01 H new ATOM 0 HG23 VAL A 144 13.611 4.460 15.837 1.00 2.01 H new ATOM 2129 N ASN A 145 11.340 7.766 13.506 1.00 1.17 N ATOM 2130 CA ASN A 145 10.681 8.740 12.650 1.00 1.13 C ATOM 2131 C ASN A 145 9.642 8.001 11.806 1.00 1.08 C ATOM 2132 O ASN A 145 9.613 8.145 10.586 1.00 1.31 O ATOM 2133 CB ASN A 145 11.720 9.409 11.731 1.00 1.47 C ATOM 2134 CG ASN A 145 12.997 9.865 12.427 1.00 1.63 C ATOM 2135 OD1 ASN A 145 13.176 11.043 12.719 1.00 2.63 O ATOM 2136 ND2 ASN A 145 13.919 8.932 12.645 1.00 1.55 N ATOM 0 H ASN A 145 11.594 6.904 13.024 1.00 1.17 H new ATOM 0 HA ASN A 145 10.200 9.511 13.251 1.00 1.13 H new ATOM 0 HB2 ASN A 145 11.986 8.709 10.939 1.00 1.47 H new ATOM 0 HB3 ASN A 145 11.257 10.272 11.252 1.00 1.47 H new ATOM 0 HD21 ASN A 145 14.811 9.186 13.069 1.00 1.55 H new ATOM 0 HD22 ASN A 145 13.734 7.962 12.389 1.00 1.55 H new ATOM 2143 N GLY A 146 8.735 7.261 12.452 1.00 1.00 N ATOM 2144 CA GLY A 146 7.671 6.544 11.760 1.00 1.07 C ATOM 2145 C GLY A 146 6.354 7.267 11.960 1.00 0.87 C ATOM 2146 O GLY A 146 5.850 7.344 13.080 1.00 0.95 O ATOM 0 H GLY A 146 8.722 7.145 13.465 1.00 1.00 H new ATOM 0 HA2 GLY A 146 7.900 6.472 10.697 1.00 1.07 H new ATOM 0 HA3 GLY A 146 7.599 5.525 12.140 1.00 1.07 H new ATOM 2150 N ILE A 147 5.822 7.816 10.870 1.00 0.75 N ATOM 2151 CA ILE A 147 4.632 8.641 10.895 1.00 0.79 C ATOM 2152 C ILE A 147 3.372 7.776 10.771 1.00 0.87 C ATOM 2153 O ILE A 147 2.970 7.421 9.666 1.00 1.23 O ATOM 2154 CB ILE A 147 4.698 9.705 9.771 1.00 0.85 C ATOM 2155 CG1 ILE A 147 5.195 9.125 8.435 1.00 1.29 C ATOM 2156 CG2 ILE A 147 5.490 10.936 10.232 1.00 1.39 C ATOM 2157 CD1 ILE A 147 6.670 9.387 8.113 1.00 1.10 C ATOM 0 H ILE A 147 6.215 7.695 9.937 1.00 0.75 H new ATOM 0 HA ILE A 147 4.583 9.160 11.852 1.00 0.79 H new ATOM 0 HB ILE A 147 3.680 10.039 9.569 1.00 0.85 H new ATOM 0 HG12 ILE A 147 5.028 8.048 8.441 1.00 1.29 H new ATOM 0 HG13 ILE A 147 4.586 9.537 7.630 1.00 1.29 H new ATOM 0 HG21 ILE A 147 5.523 11.670 9.427 1.00 1.39 H new ATOM 0 HG22 ILE A 147 5.005 11.375 11.103 1.00 1.39 H new ATOM 0 HG23 ILE A 147 6.505 10.638 10.494 1.00 1.39 H new ATOM 0 HD11 ILE A 147 6.918 8.937 7.152 1.00 1.10 H new ATOM 0 HD12 ILE A 147 6.847 10.462 8.067 1.00 1.10 H new ATOM 0 HD13 ILE A 147 7.296 8.949 8.891 1.00 1.10 H new ATOM 2169 N ARG A 148 2.743 7.454 11.904 1.00 0.92 N ATOM 2170 CA ARG A 148 1.574 6.572 11.953 1.00 1.00 C ATOM 2171 C ARG A 148 0.537 6.976 10.915 1.00 0.90 C ATOM 2172 O ARG A 148 0.214 6.189 10.032 1.00 1.25 O ATOM 2173 CB ARG A 148 0.956 6.463 13.363 1.00 1.30 C ATOM 2174 CG ARG A 148 -0.062 5.305 13.376 1.00 2.17 C ATOM 2175 CD ARG A 148 -0.819 5.087 14.695 1.00 2.39 C ATOM 2176 NE ARG A 148 -1.856 4.034 14.554 1.00 2.92 N ATOM 2177 CZ ARG A 148 -3.190 4.196 14.485 1.00 3.16 C ATOM 2178 NH1 ARG A 148 -3.760 5.405 14.508 1.00 3.16 N ATOM 2179 NH2 ARG A 148 -3.963 3.113 14.387 1.00 3.87 N ATOM 0 H ARG A 148 3.032 7.800 12.819 1.00 0.92 H new ATOM 0 HA ARG A 148 1.930 5.572 11.704 1.00 1.00 H new ATOM 0 HB2 ARG A 148 1.736 6.287 14.104 1.00 1.30 H new ATOM 0 HB3 ARG A 148 0.466 7.398 13.633 1.00 1.30 H new ATOM 0 HG2 ARG A 148 -0.792 5.481 12.586 1.00 2.17 H new ATOM 0 HG3 ARG A 148 0.463 4.383 13.125 1.00 2.17 H new ATOM 0 HD2 ARG A 148 -0.115 4.805 15.478 1.00 2.39 H new ATOM 0 HD3 ARG A 148 -1.286 6.021 15.007 1.00 2.39 H new ATOM 0 HE ARG A 148 -1.517 3.073 14.503 1.00 2.92 H new ATOM 0 HH11 ARG A 148 -3.180 6.241 14.580 1.00 3.16 H new ATOM 0 HH12 ARG A 148 -4.775 5.491 14.454 1.00 3.16 H new ATOM 0 HH21 ARG A 148 -3.540 2.185 14.366 1.00 3.87 H new ATOM 0 HH22 ARG A 148 -4.977 3.213 14.333 1.00 3.87 H new ATOM 2193 N HIS A 149 0.000 8.191 11.014 1.00 0.75 N ATOM 2194 CA HIS A 149 -1.085 8.615 10.141 1.00 0.76 C ATOM 2195 C HIS A 149 -0.524 9.082 8.797 1.00 0.71 C ATOM 2196 O HIS A 149 -0.727 10.224 8.394 1.00 1.08 O ATOM 2197 CB HIS A 149 -1.950 9.659 10.862 1.00 0.99 C ATOM 2198 CG HIS A 149 -2.360 9.216 12.248 1.00 1.14 C ATOM 2199 ND1 HIS A 149 -2.255 9.965 13.399 1.00 2.18 N ATOM 2200 CD2 HIS A 149 -2.722 7.947 12.616 1.00 1.72 C ATOM 2201 CE1 HIS A 149 -2.556 9.161 14.434 1.00 2.06 C ATOM 2202 NE2 HIS A 149 -2.835 7.916 14.011 1.00 1.55 N ATOM 0 H HIS A 149 0.300 8.895 11.689 1.00 0.75 H new ATOM 0 HA HIS A 149 -1.746 7.779 9.912 1.00 0.76 H new ATOM 0 HB2 HIS A 149 -1.398 10.597 10.932 1.00 0.99 H new ATOM 0 HB3 HIS A 149 -2.843 9.858 10.269 1.00 0.99 H new ATOM 0 HD1 HIS A 149 -1.996 10.950 13.456 1.00 2.18 H new ATOM 0 HD2 HIS A 149 -2.891 7.116 11.947 1.00 1.72 H new ATOM 0 HE1 HIS A 149 -2.572 9.474 15.468 1.00 2.06 H new ATOM 2210 N ILE A 150 0.171 8.172 8.109 1.00 0.70 N ATOM 2211 CA ILE A 150 0.567 8.326 6.723 1.00 0.69 C ATOM 2212 C ILE A 150 -0.605 7.836 5.872 1.00 0.82 C ATOM 2213 O ILE A 150 -0.936 6.648 5.895 1.00 1.17 O ATOM 2214 CB ILE A 150 1.901 7.601 6.440 1.00 0.98 C ATOM 2215 CG1 ILE A 150 2.425 7.930 5.034 1.00 1.87 C ATOM 2216 CG2 ILE A 150 1.801 6.082 6.588 1.00 2.37 C ATOM 2217 CD1 ILE A 150 3.735 7.212 4.698 1.00 2.01 C ATOM 0 H ILE A 150 0.477 7.289 8.518 1.00 0.70 H new ATOM 0 HA ILE A 150 0.771 9.367 6.472 1.00 0.69 H new ATOM 0 HB ILE A 150 2.598 7.968 7.193 1.00 0.98 H new ATOM 0 HG12 ILE A 150 1.669 7.657 4.298 1.00 1.87 H new ATOM 0 HG13 ILE A 150 2.576 9.006 4.952 1.00 1.87 H new ATOM 0 HG21 ILE A 150 2.771 5.631 6.376 1.00 2.37 H new ATOM 0 HG22 ILE A 150 1.500 5.835 7.606 1.00 2.37 H new ATOM 0 HG23 ILE A 150 1.061 5.696 5.887 1.00 2.37 H new ATOM 0 HD11 ILE A 150 4.052 7.486 3.692 1.00 2.01 H new ATOM 0 HD12 ILE A 150 4.504 7.504 5.413 1.00 2.01 H new ATOM 0 HD13 ILE A 150 3.583 6.134 4.749 1.00 2.01 H new ATOM 2229 N GLY A 151 -1.260 8.757 5.163 1.00 0.76 N ATOM 2230 CA GLY A 151 -2.364 8.444 4.268 1.00 1.01 C ATOM 2231 C GLY A 151 -1.811 8.332 2.855 1.00 0.64 C ATOM 2232 O GLY A 151 -0.724 8.842 2.594 1.00 0.97 O ATOM 0 H GLY A 151 -1.033 9.751 5.198 1.00 0.76 H new ATOM 0 HA2 GLY A 151 -2.841 7.510 4.565 1.00 1.01 H new ATOM 0 HA3 GLY A 151 -3.126 9.222 4.318 1.00 1.01 H new ATOM 2236 N LEU A 152 -2.510 7.668 1.931 1.00 0.62 N ATOM 2237 CA LEU A 152 -2.023 7.551 0.565 1.00 1.13 C ATOM 2238 C LEU A 152 -3.157 7.353 -0.426 1.00 0.71 C ATOM 2239 O LEU A 152 -4.244 6.910 -0.048 1.00 0.65 O ATOM 2240 CB LEU A 152 -0.986 6.422 0.477 1.00 2.03 C ATOM 2241 CG LEU A 152 -1.582 5.012 0.511 1.00 1.02 C ATOM 2242 CD1 LEU A 152 -1.720 4.438 -0.907 1.00 0.88 C ATOM 2243 CD2 LEU A 152 -0.680 4.115 1.354 1.00 1.12 C ATOM 0 H LEU A 152 -3.404 7.210 2.106 1.00 0.62 H new ATOM 0 HA LEU A 152 -1.538 8.488 0.291 1.00 1.13 H new ATOM 0 HB2 LEU A 152 -0.416 6.540 -0.444 1.00 2.03 H new ATOM 0 HB3 LEU A 152 -0.283 6.526 1.303 1.00 2.03 H new ATOM 0 HG LEU A 152 -2.578 5.057 0.951 1.00 1.02 H new ATOM 0 HD11 LEU A 152 -2.146 3.436 -0.854 1.00 0.88 H new ATOM 0 HD12 LEU A 152 -2.374 5.080 -1.497 1.00 0.88 H new ATOM 0 HD13 LEU A 152 -0.738 4.391 -1.378 1.00 0.88 H new ATOM 0 HD21 LEU A 152 -1.095 3.108 1.385 1.00 1.12 H new ATOM 0 HD22 LEU A 152 0.316 4.083 0.913 1.00 1.12 H new ATOM 0 HD23 LEU A 152 -0.616 4.512 2.367 1.00 1.12 H new ATOM 2255 N ALA A 153 -2.881 7.653 -1.698 1.00 0.81 N ATOM 2256 CA ALA A 153 -3.801 7.403 -2.794 1.00 1.01 C ATOM 2257 C ALA A 153 -3.016 7.161 -4.081 1.00 0.89 C ATOM 2258 O ALA A 153 -1.832 7.502 -4.151 1.00 0.86 O ATOM 2259 CB ALA A 153 -4.774 8.575 -2.945 1.00 1.55 C ATOM 0 H ALA A 153 -2.002 8.080 -1.991 1.00 0.81 H new ATOM 0 HA ALA A 153 -4.388 6.510 -2.580 1.00 1.01 H new ATOM 0 HB1 ALA A 153 -5.458 8.376 -3.770 1.00 1.55 H new ATOM 0 HB2 ALA A 153 -5.342 8.697 -2.023 1.00 1.55 H new ATOM 0 HB3 ALA A 153 -4.215 9.488 -3.150 1.00 1.55 H new ATOM 2265 N ALA A 154 -3.670 6.570 -5.086 1.00 0.98 N ATOM 2266 CA ALA A 154 -3.082 6.306 -6.396 1.00 0.93 C ATOM 2267 C ALA A 154 -4.002 6.754 -7.511 1.00 0.96 C ATOM 2268 O ALA A 154 -5.178 7.027 -7.284 1.00 1.02 O ATOM 2269 CB ALA A 154 -2.782 4.815 -6.592 1.00 1.13 C ATOM 0 H ALA A 154 -4.638 6.258 -5.007 1.00 0.98 H new ATOM 0 HA ALA A 154 -2.151 6.872 -6.433 1.00 0.93 H new ATOM 0 HB1 ALA A 154 -2.345 4.658 -7.578 1.00 1.13 H new ATOM 0 HB2 ALA A 154 -2.080 4.481 -5.827 1.00 1.13 H new ATOM 0 HB3 ALA A 154 -3.707 4.244 -6.510 1.00 1.13 H new ATOM 2275 N LYS A 155 -3.442 6.764 -8.718 1.00 1.09 N ATOM 2276 CA LYS A 155 -4.160 6.949 -9.959 1.00 1.18 C ATOM 2277 C LYS A 155 -3.430 6.162 -11.046 1.00 1.43 C ATOM 2278 O LYS A 155 -2.231 6.382 -11.238 1.00 1.77 O ATOM 2279 CB LYS A 155 -4.192 8.441 -10.312 1.00 1.57 C ATOM 2280 CG LYS A 155 -5.078 8.687 -11.542 1.00 2.56 C ATOM 2281 CD LYS A 155 -6.312 9.505 -11.142 1.00 2.51 C ATOM 2282 CE LYS A 155 -7.324 9.579 -12.293 1.00 3.84 C ATOM 2283 NZ LYS A 155 -8.568 10.250 -11.867 1.00 3.95 N ATOM 0 H LYS A 155 -2.439 6.638 -8.855 1.00 1.09 H new ATOM 0 HA LYS A 155 -5.187 6.594 -9.869 1.00 1.18 H new ATOM 0 HB2 LYS A 155 -4.570 9.013 -9.465 1.00 1.57 H new ATOM 0 HB3 LYS A 155 -3.180 8.795 -10.509 1.00 1.57 H new ATOM 0 HG2 LYS A 155 -4.512 9.217 -12.308 1.00 2.56 H new ATOM 0 HG3 LYS A 155 -5.387 7.735 -11.975 1.00 2.56 H new ATOM 0 HD2 LYS A 155 -6.783 9.054 -10.268 1.00 2.51 H new ATOM 0 HD3 LYS A 155 -6.007 10.512 -10.856 1.00 2.51 H new ATOM 0 HE2 LYS A 155 -6.885 10.119 -13.132 1.00 3.84 H new ATOM 0 HE3 LYS A 155 -7.552 8.573 -12.645 1.00 3.84 H new ATOM 0 HZ1 LYS A 155 -9.363 9.907 -12.443 1.00 3.95 H new ATOM 0 HZ2 LYS A 155 -8.751 10.039 -10.865 1.00 3.95 H new ATOM 0 HZ3 LYS A 155 -8.468 11.278 -11.992 1.00 3.95 H new ATOM 2297 N GLN A 156 -4.139 5.296 -11.776 1.00 1.46 N ATOM 2298 CA GLN A 156 -3.628 4.860 -13.069 1.00 1.68 C ATOM 2299 C GLN A 156 -3.454 6.105 -13.945 1.00 2.03 C ATOM 2300 O GLN A 156 -4.452 6.834 -14.129 1.00 2.47 O ATOM 2301 CB GLN A 156 -4.498 3.756 -13.697 1.00 2.11 C ATOM 2302 CG GLN A 156 -5.927 4.153 -14.081 1.00 3.02 C ATOM 2303 CD GLN A 156 -6.762 2.987 -14.627 1.00 4.39 C ATOM 2304 OE1 GLN A 156 -7.387 3.099 -15.682 1.00 5.93 O ATOM 2305 NE2 GLN A 156 -6.839 1.869 -13.910 1.00 4.22 N ATOM 0 H GLN A 156 -5.037 4.897 -11.503 1.00 1.46 H new ATOM 0 HA GLN A 156 -2.655 4.381 -12.957 1.00 1.68 H new ATOM 0 HB2 GLN A 156 -3.993 3.390 -14.591 1.00 2.11 H new ATOM 0 HB3 GLN A 156 -4.551 2.923 -12.997 1.00 2.11 H new ATOM 0 HG2 GLN A 156 -6.427 4.569 -13.206 1.00 3.02 H new ATOM 0 HG3 GLN A 156 -5.887 4.943 -14.831 1.00 3.02 H new ATOM 0 HE21 GLN A 156 -6.317 1.786 -13.037 1.00 4.22 H new ATOM 0 HE22 GLN A 156 -7.420 1.095 -14.233 1.00 4.22 H new TER 2314 GLN A 156