USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 738 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 160 SER OG : rot -164:sc= 1.07 USER MOD Set 1.2: A 163 SER OG : rot 73:sc= 0.584 USER MOD Set 2.1: A 128 HIS : no HE2:sc= 0.382 K(o=0.79,f=-2.9!) USER MOD Set 2.2: A 157 ASN : amide:sc= 0.412 K(o=0.79,f=-1.2) USER MOD Set 3.1: A 107 CYS SG : rot -140:sc= 0.642 USER MOD Set 3.2: A 138 SER OG : rot 155:sc= 0.738 USER MOD Set 4.1: A 104 THR OG1 : rot -65:sc= 0.00818 USER MOD Set 4.2: A 118 SER OG : rot 180:sc= 0.00963 USER MOD Set 5.1: A 85 HIS : no HE2:sc= 0.0783 K(o=0.15,f=-0.84) USER MOD Set 5.2: A 87 HIS : no HD1:sc= 0.0734 X(o=0.15,f=-0.0085) USER MOD Single : A 80 MET CE :methyl 179:sc= 0 (180deg=-0.00135) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 HIS : no HE2:sc= 0.196 K(o=0.2,f=-0.74) USER MOD Single : A 84 HIS : no HE2:sc= -0.278 K(o=-0.28,f=-2.7!) USER MOD Single : A 86 HIS : no HE2:sc= 0.713 K(o=0.71,f=-2.3!) USER MOD Single : A 88 HIS : no HD1:sc=-0.00813 X(o=-0.0081,f=-0.0081) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 HIS : no HD1:sc= -0.111 X(o=-0.11,f=0.011) USER MOD Single : A 91 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 100 HIS : no HE2:sc= 0.315 K(o=0.31,f=-1.2) USER MOD Single : A 101 MET CE :methyl -165:sc= -0.182 (180deg=-0.334) USER MOD Single : A 106 TYR OH : rot -12:sc= 1.3 USER MOD Single : A 113 SER OG : rot 180:sc= -0.144 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= -0.0682 X(o=-0.068,f=-0.082) USER MOD Single : A 129 ASN : amide:sc= -0.0132 K(o=-0.013,f=-1.2) USER MOD Single : A 134 CYS SG : rot -13:sc= -0.624 USER MOD Single : A 145 SER OG : rot -87:sc= 0.181 USER MOD Single : A 146 GLN : amide:sc= -0.0389 X(o=-0.039,f=-0.042) USER MOD Single : A 149 TYR OH : rot 149:sc= 0.0456 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 HIS : no HE2:sc= -0.138 K(o=-0.14,f=-0.72) USER MOD Single : A 164 TYR OH : rot -172:sc= -0.178 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= -0.188 K(o=-0.19,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 80 1.493 -5.889 -9.082 1.00 25.00 N ATOM 2 CA MET A 80 2.610 -6.743 -8.608 1.00 25.00 C ATOM 3 C MET A 80 3.863 -6.645 -9.469 1.00 25.00 C ATOM 4 O MET A 80 3.822 -6.496 -10.668 1.00 25.00 O ATOM 5 CB MET A 80 2.169 -8.217 -8.550 1.00 25.00 C ATOM 6 CG MET A 80 1.059 -8.448 -7.501 1.00 25.00 C ATOM 7 SD MET A 80 -0.622 -8.185 -8.156 1.00 25.00 S ATOM 8 CE MET A 80 -0.862 -9.720 -9.101 1.00 25.00 C ATOM 0 HA MET A 80 2.864 -6.371 -7.615 1.00 25.00 H new ATOM 0 HB2 MET A 80 1.810 -8.527 -9.532 1.00 25.00 H new ATOM 0 HB3 MET A 80 3.029 -8.844 -8.312 1.00 25.00 H new ATOM 0 HG2 MET A 80 1.137 -9.466 -7.119 1.00 25.00 H new ATOM 0 HG3 MET A 80 1.221 -7.777 -6.657 1.00 25.00 H new ATOM 0 HE1 MET A 80 -1.855 -9.719 -9.550 1.00 25.00 H new ATOM 0 HE2 MET A 80 -0.109 -9.785 -9.886 1.00 25.00 H new ATOM 0 HE3 MET A 80 -0.766 -10.577 -8.434 1.00 25.00 H new ATOM 18 N GLY A 81 5.023 -6.764 -8.819 1.00 25.00 N ATOM 19 CA GLY A 81 6.303 -6.727 -9.501 1.00 25.00 C ATOM 20 C GLY A 81 7.402 -7.114 -8.537 1.00 25.00 C ATOM 21 O GLY A 81 7.140 -7.292 -7.347 1.00 25.00 O ATOM 0 H GLY A 81 5.093 -6.888 -7.809 1.00 25.00 H new ATOM 0 HA2 GLY A 81 6.294 -7.410 -10.351 1.00 25.00 H new ATOM 0 HA3 GLY A 81 6.487 -5.728 -9.896 1.00 25.00 H new ATOM 25 N HIS A 82 8.619 -7.236 -9.042 1.00 25.00 N ATOM 26 CA HIS A 82 9.780 -7.601 -8.235 1.00 25.00 C ATOM 27 C HIS A 82 10.966 -6.861 -8.825 1.00 25.00 C ATOM 28 O HIS A 82 11.044 -6.707 -10.043 1.00 25.00 O ATOM 29 CB HIS A 82 10.011 -9.111 -8.302 1.00 25.00 C ATOM 30 CG HIS A 82 11.130 -9.587 -7.432 1.00 25.00 C ATOM 31 ND1 HIS A 82 11.006 -9.862 -6.095 1.00 25.00 N ATOM 32 CD2 HIS A 82 12.436 -9.849 -7.725 1.00 25.00 C ATOM 33 CE1 HIS A 82 12.193 -10.268 -5.641 1.00 25.00 C ATOM 34 NE2 HIS A 82 13.102 -10.270 -6.592 1.00 25.00 N ATOM 0 H HIS A 82 8.834 -7.085 -10.028 1.00 25.00 H new ATOM 0 HA HIS A 82 9.634 -7.335 -7.188 1.00 25.00 H new ATOM 0 HB2 HIS A 82 9.094 -9.623 -8.012 1.00 25.00 H new ATOM 0 HB3 HIS A 82 10.220 -9.392 -9.334 1.00 25.00 H new ATOM 0 HD2 HIS A 82 12.884 -9.742 -8.702 1.00 25.00 H new ATOM 0 HE1 HIS A 82 12.384 -10.559 -4.619 1.00 25.00 H new ATOM 0 HE2 HIS A 82 14.086 -10.527 -6.510 1.00 25.00 H new ATOM 42 N HIS A 83 11.850 -6.363 -7.971 1.00 25.00 N ATOM 43 CA HIS A 83 13.001 -5.589 -8.421 1.00 25.00 C ATOM 44 C HIS A 83 14.083 -5.634 -7.359 1.00 25.00 C ATOM 45 O HIS A 83 13.833 -6.082 -6.242 1.00 25.00 O ATOM 46 CB HIS A 83 12.592 -4.140 -8.682 1.00 25.00 C ATOM 47 CG HIS A 83 12.897 -3.682 -10.073 1.00 25.00 C ATOM 48 ND1 HIS A 83 12.372 -4.250 -11.204 1.00 25.00 N ATOM 49 CD2 HIS A 83 13.702 -2.685 -10.525 1.00 25.00 C ATOM 50 CE1 HIS A 83 12.857 -3.608 -12.259 1.00 25.00 C ATOM 51 NE2 HIS A 83 13.673 -2.645 -11.904 1.00 25.00 N ATOM 0 H HIS A 83 11.792 -6.481 -6.960 1.00 25.00 H new ATOM 0 HA HIS A 83 13.381 -6.018 -9.348 1.00 25.00 H new ATOM 0 HB2 HIS A 83 11.523 -4.032 -8.497 1.00 25.00 H new ATOM 0 HB3 HIS A 83 13.105 -3.491 -7.972 1.00 25.00 H new ATOM 0 HD1 HIS A 83 11.719 -5.033 -11.230 1.00 25.00 H new ATOM 0 HD2 HIS A 83 14.279 -2.022 -9.898 1.00 25.00 H new ATOM 0 HE1 HIS A 83 12.610 -3.849 -13.283 1.00 25.00 H new ATOM 59 N HIS A 84 15.261 -5.137 -7.702 1.00 25.00 N ATOM 60 CA HIS A 84 16.385 -5.075 -6.775 1.00 25.00 C ATOM 61 C HIS A 84 17.106 -3.739 -6.941 1.00 25.00 C ATOM 62 O HIS A 84 16.975 -3.085 -7.982 1.00 25.00 O ATOM 63 CB HIS A 84 17.353 -6.243 -7.036 1.00 25.00 C ATOM 64 CG HIS A 84 17.772 -6.396 -8.471 1.00 25.00 C ATOM 65 ND1 HIS A 84 18.013 -5.358 -9.343 1.00 25.00 N ATOM 66 CD2 HIS A 84 18.001 -7.525 -9.202 1.00 25.00 C ATOM 67 CE1 HIS A 84 18.370 -5.869 -10.512 1.00 25.00 C ATOM 68 NE2 HIS A 84 18.383 -7.184 -10.488 1.00 25.00 N ATOM 0 H HIS A 84 15.467 -4.765 -8.629 1.00 25.00 H new ATOM 0 HA HIS A 84 16.016 -5.157 -5.753 1.00 25.00 H new ATOM 0 HB2 HIS A 84 18.244 -6.104 -6.423 1.00 25.00 H new ATOM 0 HB3 HIS A 84 16.882 -7.169 -6.708 1.00 25.00 H new ATOM 0 HD1 HIS A 84 17.931 -4.365 -9.126 1.00 25.00 H new ATOM 0 HD2 HIS A 84 17.899 -8.535 -8.832 1.00 25.00 H new ATOM 0 HE1 HIS A 84 18.620 -5.277 -11.380 1.00 25.00 H new ATOM 76 N HIS A 85 17.906 -3.362 -5.955 1.00 25.00 N ATOM 77 CA HIS A 85 18.741 -2.165 -6.050 1.00 25.00 C ATOM 78 C HIS A 85 20.153 -2.639 -6.389 1.00 25.00 C ATOM 79 O HIS A 85 20.896 -3.093 -5.518 1.00 25.00 O ATOM 80 CB HIS A 85 18.722 -1.376 -4.743 1.00 25.00 C ATOM 81 CG HIS A 85 19.543 -0.124 -4.792 1.00 25.00 C ATOM 82 ND1 HIS A 85 20.890 -0.074 -4.531 1.00 25.00 N ATOM 83 CD2 HIS A 85 19.195 1.156 -5.091 1.00 25.00 C ATOM 84 CE1 HIS A 85 21.296 1.183 -4.677 1.00 25.00 C ATOM 85 NE2 HIS A 85 20.303 1.978 -5.015 1.00 25.00 N ATOM 0 H HIS A 85 17.998 -3.868 -5.074 1.00 25.00 H new ATOM 0 HA HIS A 85 18.365 -1.491 -6.820 1.00 25.00 H new ATOM 0 HB2 HIS A 85 17.692 -1.117 -4.499 1.00 25.00 H new ATOM 0 HB3 HIS A 85 19.090 -2.012 -3.938 1.00 25.00 H new ATOM 0 HD1 HIS A 85 21.478 -0.866 -4.270 1.00 25.00 H new ATOM 0 HD2 HIS A 85 18.199 1.482 -5.350 1.00 25.00 H new ATOM 0 HE1 HIS A 85 22.315 1.512 -4.536 1.00 25.00 H new ATOM 93 N HIS A 86 20.478 -2.637 -7.676 1.00 25.00 N ATOM 94 CA HIS A 86 21.749 -3.183 -8.132 1.00 25.00 C ATOM 95 C HIS A 86 22.879 -2.171 -7.935 1.00 25.00 C ATOM 96 O HIS A 86 22.881 -1.096 -8.536 1.00 25.00 O ATOM 97 CB HIS A 86 21.657 -3.589 -9.609 1.00 25.00 C ATOM 98 CG HIS A 86 22.552 -4.735 -9.967 1.00 25.00 C ATOM 99 ND1 HIS A 86 23.921 -4.715 -9.885 1.00 25.00 N ATOM 100 CD2 HIS A 86 22.247 -5.986 -10.416 1.00 25.00 C ATOM 101 CE1 HIS A 86 24.383 -5.895 -10.272 1.00 25.00 C ATOM 102 NE2 HIS A 86 23.408 -6.710 -10.611 1.00 25.00 N ATOM 0 H HIS A 86 19.884 -2.266 -8.417 1.00 25.00 H new ATOM 0 HA HIS A 86 21.971 -4.068 -7.535 1.00 25.00 H new ATOM 0 HB2 HIS A 86 20.626 -3.856 -9.841 1.00 25.00 H new ATOM 0 HB3 HIS A 86 21.912 -2.731 -10.231 1.00 25.00 H new ATOM 0 HD1 HIS A 86 24.488 -3.925 -9.578 1.00 25.00 H new ATOM 0 HD2 HIS A 86 21.248 -6.356 -10.593 1.00 25.00 H new ATOM 0 HE1 HIS A 86 25.431 -6.155 -10.305 1.00 25.00 H new ATOM 110 N HIS A 87 23.851 -2.532 -7.117 1.00 25.00 N ATOM 111 CA HIS A 87 25.044 -1.711 -6.940 1.00 25.00 C ATOM 112 C HIS A 87 26.014 -2.070 -8.055 1.00 25.00 C ATOM 113 O HIS A 87 25.970 -3.185 -8.578 1.00 25.00 O ATOM 114 CB HIS A 87 25.667 -1.978 -5.569 1.00 25.00 C ATOM 115 CG HIS A 87 24.813 -1.524 -4.429 1.00 25.00 C ATOM 116 ND1 HIS A 87 24.906 -0.288 -3.842 1.00 25.00 N ATOM 117 CD2 HIS A 87 23.816 -2.160 -3.754 1.00 25.00 C ATOM 118 CE1 HIS A 87 23.994 -0.215 -2.872 1.00 25.00 C ATOM 119 NE2 HIS A 87 23.297 -1.328 -2.780 1.00 25.00 N ATOM 0 H HIS A 87 23.841 -3.388 -6.563 1.00 25.00 H new ATOM 0 HA HIS A 87 24.796 -0.651 -6.986 1.00 25.00 H new ATOM 0 HB2 HIS A 87 25.858 -3.046 -5.467 1.00 25.00 H new ATOM 0 HB3 HIS A 87 26.632 -1.475 -5.513 1.00 25.00 H new ATOM 0 HD2 HIS A 87 23.480 -3.167 -3.951 1.00 25.00 H new ATOM 0 HE1 HIS A 87 23.846 0.649 -2.241 1.00 25.00 H new ATOM 0 HE2 HIS A 87 22.538 -1.532 -2.130 1.00 25.00 H new ATOM 127 N HIS A 88 26.888 -1.145 -8.421 1.00 25.00 N ATOM 128 CA HIS A 88 27.844 -1.369 -9.499 1.00 25.00 C ATOM 129 C HIS A 88 29.222 -0.887 -9.059 1.00 25.00 C ATOM 130 O HIS A 88 29.343 -0.158 -8.074 1.00 25.00 O ATOM 131 CB HIS A 88 27.396 -0.622 -10.761 1.00 25.00 C ATOM 132 CG HIS A 88 26.057 -1.050 -11.268 1.00 25.00 C ATOM 133 ND1 HIS A 88 25.768 -2.303 -11.750 1.00 25.00 N ATOM 134 CD2 HIS A 88 24.893 -0.354 -11.384 1.00 25.00 C ATOM 135 CE1 HIS A 88 24.497 -2.323 -12.125 1.00 25.00 C ATOM 136 NE2 HIS A 88 23.911 -1.159 -11.922 1.00 25.00 N ATOM 0 H HIS A 88 26.956 -0.225 -7.985 1.00 25.00 H new ATOM 0 HA HIS A 88 27.893 -2.434 -9.727 1.00 25.00 H new ATOM 0 HB2 HIS A 88 27.370 0.447 -10.550 1.00 25.00 H new ATOM 0 HB3 HIS A 88 28.137 -0.774 -11.545 1.00 25.00 H new ATOM 0 HD2 HIS A 88 24.758 0.678 -11.097 1.00 25.00 H new ATOM 0 HE1 HIS A 88 24.002 -3.186 -12.545 1.00 25.00 H new ATOM 0 HE2 HIS A 88 22.942 -0.909 -12.120 1.00 25.00 H new ATOM 144 N HIS A 89 30.245 -1.291 -9.798 1.00 25.00 N ATOM 145 CA HIS A 89 31.621 -0.895 -9.513 1.00 25.00 C ATOM 146 C HIS A 89 32.149 -0.092 -10.691 1.00 25.00 C ATOM 147 O HIS A 89 31.602 -0.164 -11.787 1.00 25.00 O ATOM 148 CB HIS A 89 32.488 -2.136 -9.309 1.00 25.00 C ATOM 149 CG HIS A 89 32.079 -2.975 -8.138 1.00 25.00 C ATOM 150 ND1 HIS A 89 32.503 -2.757 -6.852 1.00 25.00 N ATOM 151 CD2 HIS A 89 31.268 -4.070 -8.067 1.00 25.00 C ATOM 152 CE1 HIS A 89 31.962 -3.689 -6.072 1.00 25.00 C ATOM 153 NE2 HIS A 89 31.197 -4.515 -6.762 1.00 25.00 N ATOM 0 H HIS A 89 30.148 -1.901 -10.610 1.00 25.00 H new ATOM 0 HA HIS A 89 31.651 -0.292 -8.605 1.00 25.00 H new ATOM 0 HB2 HIS A 89 32.450 -2.746 -10.212 1.00 25.00 H new ATOM 0 HB3 HIS A 89 33.524 -1.826 -9.177 1.00 25.00 H new ATOM 0 HD2 HIS A 89 30.758 -4.521 -8.906 1.00 25.00 H new ATOM 0 HE1 HIS A 89 32.128 -3.761 -5.007 1.00 25.00 H new ATOM 0 HE2 HIS A 89 30.667 -5.311 -6.407 1.00 25.00 H new ATOM 161 N HIS A 90 33.222 0.646 -10.459 1.00 25.00 N ATOM 162 CA HIS A 90 33.895 1.422 -11.489 1.00 25.00 C ATOM 163 C HIS A 90 35.347 1.418 -11.047 1.00 25.00 C ATOM 164 O HIS A 90 35.629 1.035 -9.910 1.00 25.00 O ATOM 165 CB HIS A 90 33.346 2.853 -11.567 1.00 0.00 C ATOM 166 CG HIS A 90 33.492 3.627 -10.291 1.00 25.00 C ATOM 167 ND1 HIS A 90 32.583 3.601 -9.260 1.00 25.00 N ATOM 168 CD2 HIS A 90 34.478 4.469 -9.868 1.00 25.00 C ATOM 169 CE1 HIS A 90 33.027 4.397 -8.295 1.00 25.00 C ATOM 170 NE2 HIS A 90 34.183 4.947 -8.608 1.00 25.00 N ATOM 0 H HIS A 90 33.656 0.724 -9.539 1.00 25.00 H new ATOM 0 HA HIS A 90 33.752 1.005 -12.486 1.00 25.00 H new ATOM 0 HB2 HIS A 90 33.861 3.387 -12.366 1.00 0.00 H new ATOM 0 HB3 HIS A 90 32.291 2.813 -11.838 1.00 0.00 H new ATOM 0 HD2 HIS A 90 35.360 4.724 -10.436 1.00 25.00 H new ATOM 0 HE1 HIS A 90 32.504 4.573 -7.366 1.00 25.00 H new ATOM 0 HE2 HIS A 90 34.739 5.587 -8.041 1.00 25.00 H new ATOM 178 N HIS A 91 36.260 1.807 -11.926 1.00 25.00 N ATOM 179 CA HIS A 91 37.673 1.853 -11.569 1.00 25.00 C ATOM 180 C HIS A 91 37.999 3.265 -11.110 1.00 25.00 C ATOM 181 O HIS A 91 37.323 4.220 -11.498 1.00 25.00 O ATOM 182 CB HIS A 91 38.566 1.456 -12.758 1.00 25.00 C ATOM 183 CG HIS A 91 38.682 2.518 -13.808 1.00 25.00 C ATOM 184 ND1 HIS A 91 39.698 3.445 -13.866 1.00 25.00 N ATOM 185 CD2 HIS A 91 37.881 2.805 -14.873 1.00 25.00 C ATOM 186 CE1 HIS A 91 39.476 4.237 -14.915 1.00 25.00 C ATOM 187 NE2 HIS A 91 38.382 3.892 -15.563 1.00 25.00 N ATOM 0 H HIS A 91 36.052 2.093 -12.883 1.00 25.00 H new ATOM 0 HA HIS A 91 37.868 1.138 -10.769 1.00 25.00 H new ATOM 0 HB2 HIS A 91 39.562 1.214 -12.387 1.00 25.00 H new ATOM 0 HB3 HIS A 91 38.167 0.550 -13.214 1.00 25.00 H new ATOM 0 HD2 HIS A 91 36.986 2.262 -15.138 1.00 25.00 H new ATOM 0 HE1 HIS A 91 40.115 5.060 -15.199 1.00 25.00 H new ATOM 0 HE2 HIS A 91 37.989 4.333 -16.395 1.00 25.00 H new ATOM 195 N SER A 92 39.036 3.398 -10.304 1.00 25.00 N ATOM 196 CA SER A 92 39.510 4.695 -9.850 1.00 25.00 C ATOM 197 C SER A 92 40.998 4.506 -9.646 1.00 25.00 C ATOM 198 O SER A 92 41.453 3.362 -9.553 1.00 25.00 O ATOM 199 CB SER A 92 38.818 5.104 -8.549 1.00 25.00 C ATOM 200 OG SER A 92 39.033 4.139 -7.533 1.00 25.00 O ATOM 0 H SER A 92 39.575 2.610 -9.945 1.00 25.00 H new ATOM 0 HA SER A 92 39.293 5.490 -10.564 1.00 25.00 H new ATOM 0 HB2 SER A 92 39.196 6.072 -8.221 1.00 25.00 H new ATOM 0 HB3 SER A 92 37.748 5.221 -8.723 1.00 25.00 H new ATOM 0 HG SER A 92 38.582 4.424 -6.711 1.00 25.00 H new ATOM 206 N SER A 93 41.740 5.606 -9.606 1.00 25.00 N ATOM 207 CA SER A 93 43.199 5.571 -9.470 1.00 25.00 C ATOM 208 C SER A 93 43.862 4.648 -10.516 1.00 25.00 C ATOM 209 O SER A 93 43.308 4.406 -11.598 1.00 25.00 O ATOM 210 CB SER A 93 43.567 5.152 -8.041 1.00 25.00 C ATOM 211 OG SER A 93 42.855 5.934 -7.098 1.00 25.00 O ATOM 0 H SER A 93 41.353 6.548 -9.666 1.00 25.00 H new ATOM 0 HA SER A 93 43.585 6.572 -9.661 1.00 25.00 H new ATOM 0 HB2 SER A 93 43.338 4.096 -7.894 1.00 25.00 H new ATOM 0 HB3 SER A 93 44.639 5.270 -7.885 1.00 25.00 H new ATOM 0 HG SER A 93 43.098 5.654 -6.191 1.00 25.00 H new ATOM 217 N GLY A 94 45.059 4.169 -10.214 1.00 25.00 N ATOM 218 CA GLY A 94 45.783 3.309 -11.128 1.00 25.00 C ATOM 219 C GLY A 94 47.173 3.138 -10.566 1.00 25.00 C ATOM 220 O GLY A 94 47.458 3.681 -9.502 1.00 25.00 O ATOM 0 H GLY A 94 45.548 4.364 -9.340 1.00 25.00 H new ATOM 0 HA2 GLY A 94 45.285 2.344 -11.226 1.00 25.00 H new ATOM 0 HA3 GLY A 94 45.821 3.750 -12.124 1.00 25.00 H new ATOM 224 N HIS A 95 48.035 2.427 -11.276 1.00 25.00 N ATOM 225 CA HIS A 95 49.425 2.254 -10.851 1.00 25.00 C ATOM 226 C HIS A 95 50.320 2.926 -11.884 1.00 25.00 C ATOM 227 O HIS A 95 50.531 2.393 -12.967 1.00 25.00 O ATOM 228 CB HIS A 95 49.771 0.767 -10.736 1.00 25.00 C ATOM 229 CG HIS A 95 48.934 0.025 -9.739 1.00 25.00 C ATOM 230 ND1 HIS A 95 48.727 -1.331 -9.765 1.00 25.00 N ATOM 231 CD2 HIS A 95 48.231 0.467 -8.655 1.00 25.00 C ATOM 232 CE1 HIS A 95 47.937 -1.653 -8.746 1.00 25.00 C ATOM 233 NE2 HIS A 95 47.603 -0.596 -8.034 1.00 25.00 N ATOM 0 H HIS A 95 47.801 1.958 -12.151 1.00 25.00 H new ATOM 0 HA HIS A 95 49.574 2.706 -9.870 1.00 25.00 H new ATOM 0 HB2 HIS A 95 49.654 0.300 -11.714 1.00 25.00 H new ATOM 0 HB3 HIS A 95 50.821 0.668 -10.460 1.00 25.00 H new ATOM 0 HD2 HIS A 95 48.174 1.496 -8.331 1.00 25.00 H new ATOM 0 HE1 HIS A 95 47.609 -2.659 -8.528 1.00 25.00 H new ATOM 0 HE2 HIS A 95 47.010 -0.568 -7.205 1.00 25.00 H new ATOM 241 N ILE A 96 50.793 4.120 -11.563 1.00 25.00 N ATOM 242 CA ILE A 96 51.694 4.854 -12.449 1.00 25.00 C ATOM 243 C ILE A 96 53.098 4.670 -11.870 1.00 25.00 C ATOM 244 O ILE A 96 53.288 4.709 -10.659 1.00 25.00 O ATOM 245 CB ILE A 96 51.286 6.366 -12.575 1.00 25.00 C ATOM 246 CG1 ILE A 96 52.179 7.064 -13.617 1.00 25.00 C ATOM 247 CG2 ILE A 96 51.329 7.094 -11.198 1.00 25.00 C ATOM 248 CD1 ILE A 96 51.708 8.465 -14.034 1.00 25.00 C ATOM 0 H ILE A 96 50.570 4.606 -10.694 1.00 25.00 H new ATOM 0 HA ILE A 96 51.647 4.471 -13.468 1.00 25.00 H new ATOM 0 HB ILE A 96 50.252 6.416 -12.917 1.00 25.00 H new ATOM 0 HG12 ILE A 96 53.190 7.140 -13.216 1.00 25.00 H new ATOM 0 HG13 ILE A 96 52.235 6.436 -14.506 1.00 25.00 H new ATOM 0 HG21 ILE A 96 51.040 8.137 -11.329 1.00 25.00 H new ATOM 0 HG22 ILE A 96 50.637 6.610 -10.509 1.00 25.00 H new ATOM 0 HG23 ILE A 96 52.339 7.045 -10.792 1.00 25.00 H new ATOM 0 HD11 ILE A 96 52.399 8.877 -14.770 1.00 25.00 H new ATOM 0 HD12 ILE A 96 50.711 8.399 -14.469 1.00 25.00 H new ATOM 0 HD13 ILE A 96 51.680 9.115 -13.159 1.00 25.00 H new ATOM 260 N GLU A 97 54.063 4.409 -12.736 1.00 25.00 N ATOM 261 CA GLU A 97 55.432 4.159 -12.316 1.00 25.00 C ATOM 262 C GLU A 97 56.341 4.838 -13.336 1.00 25.00 C ATOM 263 O GLU A 97 56.004 4.907 -14.519 1.00 25.00 O ATOM 264 CB GLU A 97 55.687 2.648 -12.267 1.00 25.00 C ATOM 265 CG GLU A 97 57.015 2.263 -11.627 1.00 25.00 C ATOM 266 CD GLU A 97 57.254 0.758 -11.646 1.00 25.00 C ATOM 267 OE1 GLU A 97 56.389 0.004 -11.151 1.00 25.00 O ATOM 268 OE2 GLU A 97 58.320 0.335 -12.145 1.00 25.00 O1- ATOM 0 H GLU A 97 53.921 4.365 -13.745 1.00 25.00 H new ATOM 0 HA GLU A 97 55.625 4.556 -11.319 1.00 25.00 H new ATOM 0 HB2 GLU A 97 54.878 2.171 -11.714 1.00 25.00 H new ATOM 0 HB3 GLU A 97 55.656 2.252 -13.282 1.00 25.00 H new ATOM 0 HG2 GLU A 97 57.828 2.764 -12.153 1.00 25.00 H new ATOM 0 HG3 GLU A 97 57.035 2.618 -10.597 1.00 25.00 H new ATOM 275 N GLY A 98 57.472 5.355 -12.881 1.00 25.00 N ATOM 276 CA GLY A 98 58.423 5.985 -13.780 1.00 25.00 C ATOM 277 C GLY A 98 59.689 6.272 -13.013 1.00 25.00 C ATOM 278 O GLY A 98 59.667 6.301 -11.779 1.00 25.00 O ATOM 0 H GLY A 98 57.752 5.350 -11.900 1.00 25.00 H new ATOM 0 HA2 GLY A 98 58.633 5.332 -14.627 1.00 25.00 H new ATOM 0 HA3 GLY A 98 58.008 6.908 -14.184 1.00 25.00 H new ATOM 282 N ARG A 99 60.799 6.451 -13.712 1.00 25.00 N ATOM 283 CA ARG A 99 62.070 6.713 -13.045 1.00 25.00 C ATOM 284 C ARG A 99 62.103 8.176 -12.623 1.00 25.00 C ATOM 285 O ARG A 99 61.724 9.049 -13.379 1.00 25.00 O ATOM 286 CB ARG A 99 63.254 6.401 -13.975 1.00 25.00 C ATOM 287 CG ARG A 99 64.617 6.387 -13.262 1.00 25.00 C ATOM 288 CD ARG A 99 64.774 5.144 -12.381 1.00 25.00 C ATOM 289 NE ARG A 99 65.971 5.210 -11.521 1.00 25.00 N ATOM 290 CZ ARG A 99 66.369 4.254 -10.686 1.00 25.00 C ATOM 291 NH1 ARG A 99 65.727 3.117 -10.568 1.00 25.00 N1+ ATOM 292 NH2 ARG A 99 67.436 4.448 -9.957 1.00 25.00 N ATOM 0 H ARG A 99 60.849 6.421 -14.730 1.00 25.00 H new ATOM 0 HA ARG A 99 62.158 6.069 -12.170 1.00 25.00 H new ATOM 0 HB2 ARG A 99 63.090 5.431 -14.444 1.00 25.00 H new ATOM 0 HB3 ARG A 99 63.280 7.141 -14.775 1.00 25.00 H new ATOM 0 HG2 ARG A 99 65.417 6.414 -14.002 1.00 25.00 H new ATOM 0 HG3 ARG A 99 64.719 7.284 -12.650 1.00 25.00 H new ATOM 0 HD2 ARG A 99 63.888 5.030 -11.757 1.00 25.00 H new ATOM 0 HD3 ARG A 99 64.834 4.259 -13.014 1.00 25.00 H new ATOM 0 HE ARG A 99 66.539 6.056 -11.571 1.00 25.00 H new ATOM 0 HH11 ARG A 99 64.892 2.942 -11.127 1.00 25.00 H new ATOM 0 HH12 ARG A 99 66.062 2.407 -9.917 1.00 25.00 H new ATOM 0 HH21 ARG A 99 67.953 5.324 -10.032 1.00 25.00 H new ATOM 0 HH22 ARG A 99 67.752 3.723 -9.313 1.00 25.00 H new ATOM 306 N HIS A 100 62.575 8.409 -11.414 1.00 25.00 N ATOM 307 CA HIS A 100 62.728 9.742 -10.850 1.00 25.00 C ATOM 308 C HIS A 100 63.843 9.537 -9.836 1.00 25.00 C ATOM 309 O HIS A 100 64.233 8.385 -9.598 1.00 25.00 O ATOM 310 CB HIS A 100 61.431 10.202 -10.172 1.00 25.00 C ATOM 311 CG HIS A 100 60.933 9.262 -9.121 1.00 25.00 C ATOM 312 ND1 HIS A 100 60.239 8.102 -9.381 1.00 25.00 N ATOM 313 CD2 HIS A 100 61.030 9.319 -7.764 1.00 25.00 C ATOM 314 CE1 HIS A 100 59.956 7.519 -8.220 1.00 25.00 C ATOM 315 NE2 HIS A 100 60.418 8.214 -7.203 1.00 25.00 N ATOM 0 H HIS A 100 62.869 7.665 -10.782 1.00 25.00 H new ATOM 0 HA HIS A 100 62.951 10.512 -11.589 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.595 11.181 -9.722 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.659 10.325 -10.931 1.00 25.00 H new ATOM 0 HD1 HIS A 100 59.986 7.751 -10.304 1.00 25.00 H new ATOM 0 HD2 HIS A 100 61.513 10.110 -7.209 1.00 25.00 H new ATOM 0 HE1 HIS A 100 59.414 6.590 -8.124 1.00 25.00 H new ATOM 323 N MET A 101 64.377 10.604 -9.262 1.00 25.00 N ATOM 324 CA MET A 101 65.453 10.483 -8.278 1.00 25.00 C ATOM 325 C MET A 101 65.273 11.534 -7.186 1.00 25.00 C ATOM 326 O MET A 101 64.529 12.493 -7.363 1.00 25.00 O ATOM 327 CB MET A 101 66.819 10.629 -8.965 1.00 25.00 C ATOM 328 CG MET A 101 67.076 11.990 -9.582 1.00 25.00 C ATOM 329 SD MET A 101 68.632 11.990 -10.472 1.00 25.00 S ATOM 330 CE MET A 101 68.786 13.712 -10.893 1.00 25.00 C ATOM 0 H MET A 101 64.087 11.562 -9.457 1.00 25.00 H new ATOM 0 HA MET A 101 65.412 9.496 -7.817 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.602 10.423 -8.235 1.00 25.00 H new ATOM 0 HB3 MET A 101 66.902 9.871 -9.744 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.262 12.248 -10.260 1.00 25.00 H new ATOM 0 HG3 MET A 101 67.096 12.752 -8.803 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.548 13.832 -11.663 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.831 14.082 -11.267 1.00 25.00 H new ATOM 0 HE3 MET A 101 69.073 14.279 -10.007 1.00 25.00 H new ATOM 340 N LEU A 102 65.917 11.324 -6.047 1.00 25.00 N ATOM 341 CA LEU A 102 65.784 12.219 -4.893 1.00 25.00 C ATOM 342 C LEU A 102 67.147 12.825 -4.589 1.00 25.00 C ATOM 343 O LEU A 102 68.146 12.113 -4.579 1.00 25.00 O ATOM 344 CB LEU A 102 65.302 11.416 -3.673 1.00 25.00 C ATOM 345 CG LEU A 102 64.949 12.216 -2.407 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.559 12.841 -2.533 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.986 11.306 -1.180 1.00 25.00 C ATOM 0 H LEU A 102 66.544 10.535 -5.891 1.00 25.00 H new ATOM 0 HA LEU A 102 65.063 13.006 -5.114 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.422 10.845 -3.969 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.078 10.695 -3.413 1.00 25.00 H new ATOM 0 HG LEU A 102 65.686 13.011 -2.292 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.329 13.402 -1.627 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.539 13.513 -3.391 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.817 12.054 -2.670 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.734 11.884 -0.291 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.265 10.498 -1.304 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.986 10.886 -1.069 1.00 25.00 H new ATOM 359 N LEU A 103 67.181 14.125 -4.346 1.00 25.00 N ATOM 360 CA LEU A 103 68.416 14.831 -4.001 1.00 25.00 C ATOM 361 C LEU A 103 68.174 15.600 -2.719 1.00 25.00 C ATOM 362 O LEU A 103 67.027 15.913 -2.392 1.00 25.00 O ATOM 363 CB LEU A 103 68.807 15.815 -5.115 1.00 25.00 C ATOM 364 CG LEU A 103 69.115 15.219 -6.500 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.448 16.361 -7.452 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.270 14.238 -6.453 1.00 25.00 C ATOM 0 H LEU A 103 66.357 14.725 -4.381 1.00 25.00 H new ATOM 0 HA LEU A 103 69.226 14.112 -3.878 1.00 25.00 H new ATOM 0 HB2 LEU A 103 67.997 16.536 -5.229 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.684 16.371 -4.783 1.00 25.00 H new ATOM 0 HG LEU A 103 68.239 14.669 -6.844 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.670 15.958 -8.440 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.597 17.039 -7.519 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.316 16.904 -7.079 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.452 13.842 -7.452 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.165 14.747 -6.095 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.024 13.419 -5.778 1.00 25.00 H new ATOM 378 N THR A 104 69.236 15.929 -2.001 1.00 25.00 N ATOM 379 CA THR A 104 69.123 16.681 -0.747 1.00 25.00 C ATOM 380 C THR A 104 69.711 18.069 -0.943 1.00 25.00 C ATOM 381 O THR A 104 70.664 18.242 -1.682 1.00 25.00 O ATOM 382 CB THR A 104 69.849 15.927 0.387 1.00 25.00 C ATOM 383 OG1 THR A 104 69.381 14.573 0.408 1.00 25.00 O ATOM 384 CG2 THR A 104 69.576 16.534 1.754 1.00 25.00 C ATOM 0 H THR A 104 70.193 15.689 -2.261 1.00 25.00 H new ATOM 0 HA THR A 104 68.074 16.780 -0.467 1.00 25.00 H new ATOM 0 HB THR A 104 70.919 15.990 0.191 1.00 25.00 H new ATOM 0 HG1 THR A 104 68.432 14.559 0.651 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.110 15.967 2.517 1.00 25.00 H new ATOM 0 HG22 THR A 104 69.916 17.569 1.767 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.506 16.501 1.960 1.00 25.00 H new ATOM 392 N VAL A 105 69.114 19.064 -0.313 1.00 25.00 N ATOM 393 CA VAL A 105 69.582 20.441 -0.404 1.00 25.00 C ATOM 394 C VAL A 105 69.815 20.946 1.012 1.00 25.00 C ATOM 395 O VAL A 105 68.886 20.999 1.827 1.00 25.00 O ATOM 396 CB VAL A 105 68.520 21.348 -1.086 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.025 22.802 -1.202 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.137 20.812 -2.482 1.00 25.00 C ATOM 0 H VAL A 105 68.291 18.944 0.277 1.00 25.00 H new ATOM 0 HA VAL A 105 70.495 20.473 -0.999 1.00 25.00 H new ATOM 0 HB VAL A 105 67.631 21.335 -0.455 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.262 23.415 -1.683 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.233 23.196 -0.207 1.00 25.00 H new ATOM 0 HG13 VAL A 105 69.937 22.824 -1.798 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.393 21.469 -2.932 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.024 20.780 -3.115 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.724 19.808 -2.385 1.00 25.00 H new ATOM 408 N TYR A 106 71.045 21.322 1.310 1.00 25.00 N ATOM 409 CA TYR A 106 71.380 21.905 2.601 1.00 25.00 C ATOM 410 C TYR A 106 71.479 23.410 2.394 1.00 25.00 C ATOM 411 O TYR A 106 72.401 23.892 1.744 1.00 25.00 O ATOM 412 CB TYR A 106 72.710 21.327 3.110 1.00 25.00 C ATOM 413 CG TYR A 106 72.961 21.528 4.598 1.00 25.00 C ATOM 414 CD1 TYR A 106 72.936 22.814 5.183 1.00 25.00 C ATOM 415 CD2 TYR A 106 73.247 20.425 5.431 1.00 25.00 C ATOM 416 CE1 TYR A 106 73.188 22.989 6.578 1.00 25.00 C ATOM 417 CE2 TYR A 106 73.502 20.602 6.824 1.00 25.00 C ATOM 418 CZ TYR A 106 73.474 21.879 7.377 1.00 25.00 C ATOM 419 OH TYR A 106 73.743 22.036 8.713 1.00 25.00 O ATOM 0 H TYR A 106 71.836 21.234 0.672 1.00 25.00 H new ATOM 0 HA TYR A 106 70.622 21.676 3.350 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.734 20.259 2.892 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.527 21.785 2.552 1.00 25.00 H new ATOM 0 HD1 TYR A 106 72.724 23.676 4.567 1.00 25.00 H new ATOM 0 HD2 TYR A 106 73.273 19.432 5.008 1.00 25.00 H new ATOM 0 HE1 TYR A 106 73.158 23.977 7.014 1.00 25.00 H new ATOM 0 HE2 TYR A 106 73.716 19.747 7.448 1.00 25.00 H new ATOM 0 HH TYR A 106 73.885 22.986 8.909 1.00 25.00 H new ATOM 429 N CYS A 107 70.524 24.157 2.913 1.00 25.00 N ATOM 430 CA CYS A 107 70.510 25.600 2.750 1.00 25.00 C ATOM 431 C CYS A 107 71.183 26.234 3.955 1.00 25.00 C ATOM 432 O CYS A 107 70.821 25.955 5.086 1.00 25.00 O ATOM 433 CB CYS A 107 69.069 26.108 2.623 1.00 25.00 C ATOM 434 SG CYS A 107 68.992 27.885 2.307 1.00 25.00 S ATOM 0 H CYS A 107 69.743 23.787 3.454 1.00 25.00 H new ATOM 0 HA CYS A 107 71.048 25.870 1.841 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.569 25.576 1.814 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.524 25.880 3.539 1.00 25.00 H new ATOM 0 HG CYS A 107 68.014 28.405 2.988 1.00 25.00 H new ATOM 440 N VAL A 108 72.192 27.053 3.703 1.00 25.00 N ATOM 441 CA VAL A 108 72.992 27.675 4.754 1.00 25.00 C ATOM 442 C VAL A 108 72.839 29.187 4.727 1.00 25.00 C ATOM 443 O VAL A 108 73.091 29.843 3.708 1.00 25.00 O ATOM 444 CB VAL A 108 74.507 27.328 4.597 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.323 27.924 5.766 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.714 25.813 4.559 1.00 25.00 C ATOM 0 H VAL A 108 72.483 27.308 2.759 1.00 25.00 H new ATOM 0 HA VAL A 108 72.628 27.282 5.703 1.00 25.00 H new ATOM 0 HB VAL A 108 74.853 27.760 3.658 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.376 27.672 5.640 1.00 25.00 H new ATOM 0 HG12 VAL A 108 75.207 29.008 5.775 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.962 27.513 6.709 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.776 25.594 4.449 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.346 25.372 5.486 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.167 25.392 3.715 1.00 25.00 H new ATOM 456 N ARG A 109 72.498 29.747 5.875 1.00 25.00 N ATOM 457 CA ARG A 109 72.454 31.194 6.056 1.00 25.00 C ATOM 458 C ARG A 109 73.597 31.552 6.981 1.00 25.00 C ATOM 459 O ARG A 109 73.849 30.859 7.946 1.00 25.00 O ATOM 460 CB ARG A 109 71.137 31.603 6.715 1.00 25.00 C ATOM 461 CG ARG A 109 69.988 31.814 5.755 1.00 25.00 C ATOM 462 CD ARG A 109 69.538 33.265 5.810 1.00 25.00 C ATOM 463 NE ARG A 109 70.503 34.140 5.123 1.00 25.00 N ATOM 464 CZ ARG A 109 70.643 35.444 5.327 1.00 25.00 C ATOM 465 NH1 ARG A 109 69.949 36.097 6.225 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 71.511 36.096 4.605 1.00 25.00 N ATOM 0 H ARG A 109 72.244 29.216 6.708 1.00 25.00 H new ATOM 0 HA ARG A 109 72.534 31.704 5.096 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.854 30.836 7.436 1.00 25.00 H new ATOM 0 HB3 ARG A 109 71.298 32.524 7.276 1.00 25.00 H new ATOM 0 HG2 ARG A 109 70.296 31.556 4.742 1.00 25.00 H new ATOM 0 HG3 ARG A 109 69.159 31.155 6.014 1.00 25.00 H new ATOM 0 HD2 ARG A 109 68.557 33.364 5.346 1.00 25.00 H new ATOM 0 HD3 ARG A 109 69.432 33.578 6.849 1.00 25.00 H new ATOM 0 HE ARG A 109 71.116 33.707 4.432 1.00 25.00 H new ATOM 0 HH11 ARG A 109 69.268 35.603 6.802 1.00 25.00 H new ATOM 0 HH12 ARG A 109 70.089 37.100 6.348 1.00 25.00 H new ATOM 0 HH21 ARG A 109 72.063 35.603 3.903 1.00 25.00 H new ATOM 0 HH22 ARG A 109 71.638 37.099 4.742 1.00 25.00 H new ATOM 480 N ARG A 110 74.239 32.687 6.739 1.00 25.00 N ATOM 481 CA ARG A 110 75.286 33.176 7.650 1.00 25.00 C ATOM 482 C ARG A 110 74.682 33.640 8.973 1.00 25.00 C ATOM 483 O ARG A 110 75.384 33.983 9.897 1.00 25.00 O ATOM 484 CB ARG A 110 76.120 34.301 7.021 1.00 25.00 C ATOM 485 CG ARG A 110 75.387 35.633 6.812 1.00 25.00 C ATOM 486 CD ARG A 110 76.384 36.742 6.498 1.00 25.00 C ATOM 487 NE ARG A 110 75.740 38.071 6.431 1.00 25.00 N ATOM 488 CZ ARG A 110 75.433 38.725 5.315 1.00 25.00 C ATOM 489 NH1 ARG A 110 75.667 38.245 4.120 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 74.875 39.897 5.404 1.00 25.00 N ATOM 0 H ARG A 110 74.062 33.286 5.932 1.00 25.00 H new ATOM 0 HA ARG A 110 75.956 32.338 7.843 1.00 25.00 H new ATOM 0 HB2 ARG A 110 76.990 34.481 7.653 1.00 25.00 H new ATOM 0 HB3 ARG A 110 76.493 33.957 6.056 1.00 25.00 H new ATOM 0 HG2 ARG A 110 74.670 35.537 5.996 1.00 25.00 H new ATOM 0 HG3 ARG A 110 74.819 35.888 7.707 1.00 25.00 H new ATOM 0 HD2 ARG A 110 77.162 36.755 7.261 1.00 25.00 H new ATOM 0 HD3 ARG A 110 76.874 36.529 5.548 1.00 25.00 H new ATOM 0 HE ARG A 110 75.512 38.524 7.316 1.00 25.00 H new ATOM 0 HH11 ARG A 110 76.104 37.329 4.015 1.00 25.00 H new ATOM 0 HH12 ARG A 110 75.412 38.787 3.294 1.00 25.00 H new ATOM 0 HH21 ARG A 110 74.680 40.301 6.320 1.00 25.00 H new ATOM 0 HH22 ARG A 110 74.633 40.412 4.558 1.00 25.00 H new ATOM 504 N ASP A 111 73.363 33.684 9.001 1.00 25.00 N ATOM 505 CA ASP A 111 72.588 34.122 10.158 1.00 25.00 C ATOM 506 C ASP A 111 72.081 32.891 10.939 1.00 25.00 C ATOM 507 O ASP A 111 71.150 32.980 11.726 1.00 25.00 O ATOM 508 CB ASP A 111 71.417 34.956 9.641 1.00 25.00 C ATOM 509 CG ASP A 111 70.869 35.918 10.678 1.00 25.00 C ATOM 510 OD1 ASP A 111 71.654 36.432 11.501 1.00 25.00 O ATOM 511 OD2 ASP A 111 69.688 36.286 10.542 1.00 25.00 O1- ATOM 0 H ASP A 111 72.784 33.412 8.206 1.00 25.00 H new ATOM 0 HA ASP A 111 73.199 34.719 10.835 1.00 25.00 H new ATOM 0 HB2 ASP A 111 71.739 35.520 8.765 1.00 25.00 H new ATOM 0 HB3 ASP A 111 70.619 34.289 9.315 1.00 25.00 H new ATOM 516 N LEU A 112 72.685 31.738 10.648 1.00 25.00 N ATOM 517 CA LEU A 112 72.367 30.434 11.278 1.00 25.00 C ATOM 518 C LEU A 112 70.903 30.002 11.140 1.00 25.00 C ATOM 519 O LEU A 112 70.399 29.190 11.900 1.00 25.00 O ATOM 520 CB LEU A 112 72.784 30.422 12.752 1.00 25.00 C ATOM 521 CG LEU A 112 74.268 30.710 13.048 1.00 25.00 C ATOM 522 CD1 LEU A 112 74.473 30.737 14.561 1.00 25.00 C ATOM 523 CD2 LEU A 112 75.198 29.661 12.426 1.00 25.00 C ATOM 0 H LEU A 112 73.428 31.672 9.952 1.00 25.00 H new ATOM 0 HA LEU A 112 72.950 29.700 10.721 1.00 25.00 H new ATOM 0 HB2 LEU A 112 72.181 31.158 13.283 1.00 25.00 H new ATOM 0 HB3 LEU A 112 72.536 29.446 13.169 1.00 25.00 H new ATOM 0 HG LEU A 112 74.519 31.673 12.604 1.00 25.00 H new ATOM 0 HD11 LEU A 112 75.521 30.940 14.783 1.00 25.00 H new ATOM 0 HD12 LEU A 112 73.851 31.518 14.999 1.00 25.00 H new ATOM 0 HD13 LEU A 112 74.193 29.772 14.983 1.00 25.00 H new ATOM 0 HD21 LEU A 112 76.233 29.907 12.662 1.00 25.00 H new ATOM 0 HD22 LEU A 112 74.958 28.677 12.829 1.00 25.00 H new ATOM 0 HD23 LEU A 112 75.065 29.652 11.344 1.00 25.00 H new ATOM 535 N SER A 113 70.254 30.507 10.107 1.00 25.00 N ATOM 536 CA SER A 113 68.870 30.149 9.772 1.00 25.00 C ATOM 537 C SER A 113 68.846 28.936 8.840 1.00 25.00 C ATOM 538 O SER A 113 67.987 28.807 7.970 1.00 25.00 O ATOM 539 CB SER A 113 68.198 31.336 9.097 1.00 25.00 C ATOM 540 OG SER A 113 68.961 32.517 9.301 1.00 25.00 O ATOM 0 H SER A 113 70.668 31.184 9.466 1.00 25.00 H new ATOM 0 HA SER A 113 68.333 29.893 10.685 1.00 25.00 H new ATOM 0 HB2 SER A 113 68.092 31.144 8.029 1.00 25.00 H new ATOM 0 HB3 SER A 113 67.193 31.470 9.498 1.00 25.00 H new ATOM 0 HG SER A 113 68.519 33.272 8.861 1.00 25.00 H new ATOM 546 N GLU A 114 69.893 28.141 8.938 1.00 25.00 N ATOM 547 CA GLU A 114 70.125 27.032 8.022 1.00 25.00 C ATOM 548 C GLU A 114 69.168 25.856 8.243 1.00 25.00 C ATOM 549 O GLU A 114 68.671 25.641 9.346 1.00 25.00 O ATOM 550 CB GLU A 114 71.584 26.581 8.144 1.00 25.00 C ATOM 551 CG GLU A 114 71.992 26.033 9.499 1.00 25.00 C ATOM 552 CD GLU A 114 73.490 25.811 9.563 1.00 25.00 C ATOM 553 OE1 GLU A 114 74.228 26.821 9.647 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 73.938 24.645 9.448 1.00 25.00 O1- ATOM 0 H GLU A 114 70.611 28.243 9.655 1.00 25.00 H new ATOM 0 HA GLU A 114 69.925 27.388 7.011 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.773 25.816 7.391 1.00 25.00 H new ATOM 0 HB3 GLU A 114 72.228 27.428 7.906 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.689 26.727 10.283 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.473 25.093 9.687 1.00 25.00 H new ATOM 561 N VAL A 115 68.889 25.130 7.167 1.00 25.00 N ATOM 562 CA VAL A 115 67.928 24.024 7.174 1.00 25.00 C ATOM 563 C VAL A 115 68.350 23.059 6.067 1.00 25.00 C ATOM 564 O VAL A 115 68.985 23.473 5.102 1.00 25.00 O ATOM 565 CB VAL A 115 66.464 24.569 6.930 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.315 25.193 5.526 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.405 23.470 7.148 1.00 25.00 C ATOM 0 H VAL A 115 69.323 25.290 6.258 1.00 25.00 H new ATOM 0 HA VAL A 115 67.921 23.514 8.137 1.00 25.00 H new ATOM 0 HB VAL A 115 66.293 25.354 7.667 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.296 25.556 5.396 1.00 25.00 H new ATOM 0 HG12 VAL A 115 67.012 26.024 5.421 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.532 24.440 4.768 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.411 23.882 6.971 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.586 22.648 6.455 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.468 23.102 8.172 1.00 25.00 H new ATOM 577 N THR A 116 68.001 21.787 6.179 1.00 25.00 N ATOM 578 CA THR A 116 68.293 20.822 5.124 1.00 25.00 C ATOM 579 C THR A 116 66.996 20.075 4.828 1.00 25.00 C ATOM 580 O THR A 116 66.186 19.848 5.729 1.00 25.00 O ATOM 581 CB THR A 116 69.458 19.861 5.518 1.00 25.00 C ATOM 582 OG1 THR A 116 69.722 18.953 4.443 1.00 25.00 O ATOM 583 CG2 THR A 116 69.143 19.046 6.770 1.00 25.00 C ATOM 0 H THR A 116 67.516 21.397 6.987 1.00 25.00 H new ATOM 0 HA THR A 116 68.642 21.332 4.226 1.00 25.00 H new ATOM 0 HB THR A 116 70.327 20.486 5.725 1.00 25.00 H new ATOM 0 HG1 THR A 116 70.455 18.353 4.694 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.985 18.394 7.001 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.966 19.720 7.608 1.00 25.00 H new ATOM 0 HG23 THR A 116 68.253 18.441 6.596 1.00 25.00 H new ATOM 591 N PHE A 117 66.765 19.782 3.559 1.00 25.00 N ATOM 592 CA PHE A 117 65.526 19.152 3.111 1.00 25.00 C ATOM 593 C PHE A 117 65.831 18.391 1.832 1.00 25.00 C ATOM 594 O PHE A 117 66.918 18.540 1.286 1.00 25.00 O ATOM 595 CB PHE A 117 64.438 20.211 2.872 1.00 25.00 C ATOM 596 CG PHE A 117 64.822 21.269 1.862 1.00 25.00 C ATOM 597 CD1 PHE A 117 65.468 22.457 2.271 1.00 25.00 C ATOM 598 CD2 PHE A 117 64.519 21.099 0.499 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.805 23.462 1.321 1.00 25.00 C ATOM 600 CE2 PHE A 117 64.849 22.099 -0.455 1.00 25.00 C ATOM 601 CZ PHE A 117 65.488 23.278 -0.042 1.00 25.00 C ATOM 0 H PHE A 117 67.428 19.973 2.808 1.00 25.00 H new ATOM 0 HA PHE A 117 65.150 18.469 3.873 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.529 19.713 2.534 1.00 25.00 H new ATOM 0 HB3 PHE A 117 64.203 20.696 3.819 1.00 25.00 H new ATOM 0 HD1 PHE A 117 65.708 22.604 3.314 1.00 25.00 H new ATOM 0 HD2 PHE A 117 64.028 20.194 0.172 1.00 25.00 H new ATOM 0 HE1 PHE A 117 66.303 24.365 1.643 1.00 25.00 H new ATOM 0 HE2 PHE A 117 64.608 21.952 -1.497 1.00 25.00 H new ATOM 0 HZ PHE A 117 65.736 24.042 -0.764 1.00 25.00 H new ATOM 611 N SER A 118 64.897 17.585 1.343 1.00 25.00 N ATOM 612 CA SER A 118 65.127 16.798 0.124 1.00 25.00 C ATOM 613 C SER A 118 64.027 17.052 -0.896 1.00 25.00 C ATOM 614 O SER A 118 62.903 17.381 -0.530 1.00 25.00 O ATOM 615 CB SER A 118 65.186 15.309 0.460 1.00 25.00 C ATOM 616 OG SER A 118 66.249 15.046 1.361 1.00 25.00 O ATOM 0 H SER A 118 63.977 17.455 1.764 1.00 25.00 H new ATOM 0 HA SER A 118 66.080 17.106 -0.306 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.241 14.992 0.901 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.323 14.729 -0.453 1.00 25.00 H new ATOM 0 HG SER A 118 66.273 14.088 1.568 1.00 25.00 H new ATOM 622 N LEU A 119 64.369 16.905 -2.171 1.00 25.00 N ATOM 623 CA LEU A 119 63.446 17.156 -3.273 1.00 25.00 C ATOM 624 C LEU A 119 63.571 16.044 -4.295 1.00 25.00 C ATOM 625 O LEU A 119 64.664 15.511 -4.494 1.00 25.00 O ATOM 626 CB LEU A 119 63.809 18.473 -3.958 1.00 25.00 C ATOM 627 CG LEU A 119 63.076 19.725 -3.465 1.00 25.00 C ATOM 628 CD1 LEU A 119 63.740 20.952 -4.086 1.00 25.00 C ATOM 629 CD2 LEU A 119 61.589 19.655 -3.850 1.00 25.00 C ATOM 0 H LEU A 119 65.297 16.607 -2.471 1.00 25.00 H new ATOM 0 HA LEU A 119 62.430 17.203 -2.881 1.00 25.00 H new ATOM 0 HB2 LEU A 119 64.880 18.636 -3.839 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.620 18.365 -5.026 1.00 25.00 H new ATOM 0 HG LEU A 119 63.136 19.791 -2.379 1.00 25.00 H new ATOM 0 HD11 LEU A 119 63.230 21.853 -3.745 1.00 25.00 H new ATOM 0 HD12 LEU A 119 64.787 20.991 -3.784 1.00 25.00 H new ATOM 0 HD13 LEU A 119 63.678 20.889 -5.172 1.00 25.00 H new ATOM 0 HD21 LEU A 119 61.079 20.550 -3.494 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.496 19.591 -4.934 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.136 18.774 -3.395 1.00 25.00 H new ATOM 641 N GLN A 120 62.480 15.724 -4.975 1.00 25.00 N ATOM 642 CA GLN A 120 62.516 14.723 -6.036 1.00 25.00 C ATOM 643 C GLN A 120 62.522 15.442 -7.379 1.00 25.00 C ATOM 644 O GLN A 120 61.872 16.478 -7.542 1.00 25.00 O ATOM 645 CB GLN A 120 61.352 13.721 -5.914 1.00 25.00 C ATOM 646 CG GLN A 120 59.977 14.229 -6.368 1.00 25.00 C ATOM 647 CD GLN A 120 59.667 13.842 -7.805 1.00 25.00 C ATOM 648 OE1 GLN A 120 59.439 12.689 -8.102 1.00 25.00 O ATOM 649 NE2 GLN A 120 59.665 14.806 -8.691 1.00 25.00 N ATOM 0 H GLN A 120 61.562 16.139 -4.814 1.00 25.00 H new ATOM 0 HA GLN A 120 63.425 14.128 -5.948 1.00 25.00 H new ATOM 0 HB2 GLN A 120 61.600 12.834 -6.497 1.00 25.00 H new ATOM 0 HB3 GLN A 120 61.276 13.408 -4.873 1.00 25.00 H new ATOM 0 HG2 GLN A 120 59.207 13.825 -5.711 1.00 25.00 H new ATOM 0 HG3 GLN A 120 59.942 15.314 -6.270 1.00 25.00 H new ATOM 0 HE21 GLN A 120 59.862 15.764 -8.402 1.00 25.00 H new ATOM 0 HE22 GLN A 120 59.467 14.599 -9.670 1.00 25.00 H new ATOM 658 N VAL A 121 63.314 14.928 -8.305 1.00 25.00 N ATOM 659 CA VAL A 121 63.511 15.545 -9.612 1.00 25.00 C ATOM 660 C VAL A 121 63.640 14.445 -10.662 1.00 25.00 C ATOM 661 O VAL A 121 63.840 13.272 -10.336 1.00 25.00 O ATOM 662 CB VAL A 121 64.823 16.409 -9.643 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.697 17.643 -8.745 1.00 25.00 C ATOM 664 CG2 VAL A 121 66.035 15.579 -9.196 1.00 25.00 C ATOM 0 H VAL A 121 63.843 14.066 -8.173 1.00 25.00 H new ATOM 0 HA VAL A 121 62.657 16.191 -9.817 1.00 25.00 H new ATOM 0 HB VAL A 121 64.970 16.736 -10.673 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.621 18.220 -8.788 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.867 18.260 -9.089 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.513 17.328 -7.718 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.931 16.199 -9.226 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.875 15.220 -8.179 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.160 14.728 -9.865 1.00 25.00 H new ATOM 674 N ASP A 122 63.563 14.831 -11.922 1.00 25.00 N ATOM 675 CA ASP A 122 63.812 13.913 -13.029 1.00 25.00 C ATOM 676 C ASP A 122 65.317 13.844 -13.264 1.00 25.00 C ATOM 677 O ASP A 122 66.052 14.729 -12.831 1.00 25.00 O ATOM 678 CB ASP A 122 63.120 14.396 -14.300 1.00 25.00 C ATOM 679 CG ASP A 122 63.280 13.418 -15.437 1.00 25.00 C ATOM 680 OD1 ASP A 122 62.793 12.279 -15.306 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 64.043 13.717 -16.368 1.00 25.00 O1- ATOM 0 H ASP A 122 63.328 15.781 -12.210 1.00 25.00 H new ATOM 0 HA ASP A 122 63.415 12.929 -12.779 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.060 14.549 -14.100 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.532 15.362 -14.592 1.00 25.00 H new ATOM 686 N ALA A 123 65.783 12.823 -13.968 1.00 25.00 N ATOM 687 CA ALA A 123 67.202 12.706 -14.276 1.00 25.00 C ATOM 688 C ALA A 123 67.679 13.867 -15.168 1.00 25.00 C ATOM 689 O ALA A 123 68.772 14.397 -14.968 1.00 25.00 O ATOM 690 CB ALA A 123 67.471 11.366 -14.973 1.00 25.00 C ATOM 0 H ALA A 123 65.204 12.068 -14.335 1.00 25.00 H new ATOM 0 HA ALA A 123 67.759 12.751 -13.340 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.533 11.282 -15.202 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.176 10.548 -14.316 1.00 25.00 H new ATOM 0 HB3 ALA A 123 66.895 11.315 -15.897 1.00 25.00 H new ATOM 696 N ASP A 124 66.871 14.250 -16.147 1.00 25.00 N ATOM 697 CA ASP A 124 67.259 15.301 -17.102 1.00 25.00 C ATOM 698 C ASP A 124 66.699 16.668 -16.687 1.00 25.00 C ATOM 699 O ASP A 124 66.627 17.603 -17.482 1.00 25.00 O ATOM 700 CB ASP A 124 66.795 14.935 -18.515 1.00 25.00 C ATOM 701 CG ASP A 124 67.696 15.536 -19.604 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.928 15.662 -19.370 1.00 25.00 O ATOM 703 OD2 ASP A 124 67.188 15.810 -20.711 1.00 25.00 O1- ATOM 0 H ASP A 124 65.944 13.856 -16.308 1.00 25.00 H new ATOM 0 HA ASP A 124 68.347 15.373 -17.098 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.779 13.850 -18.619 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.773 15.284 -18.660 1.00 25.00 H new ATOM 708 N PHE A 125 66.310 16.784 -15.424 1.00 25.00 N ATOM 709 CA PHE A 125 65.781 18.041 -14.897 1.00 25.00 C ATOM 710 C PHE A 125 66.861 19.119 -15.001 1.00 25.00 C ATOM 711 O PHE A 125 67.994 18.921 -14.554 1.00 25.00 O ATOM 712 CB PHE A 125 65.383 17.846 -13.441 1.00 25.00 C ATOM 713 CG PHE A 125 64.320 18.789 -12.952 1.00 25.00 C ATOM 714 CD1 PHE A 125 63.015 18.731 -13.481 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.594 19.700 -11.916 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.996 19.578 -12.977 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.578 20.547 -11.402 1.00 25.00 C ATOM 718 CZ PHE A 125 62.280 20.483 -11.934 1.00 25.00 C ATOM 0 H PHE A 125 66.350 16.025 -14.744 1.00 25.00 H new ATOM 0 HA PHE A 125 64.906 18.348 -15.470 1.00 25.00 H new ATOM 0 HB2 PHE A 125 65.032 16.823 -13.308 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.269 17.963 -12.817 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.790 18.036 -14.276 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.592 19.756 -11.506 1.00 25.00 H new ATOM 0 HE1 PHE A 125 61.000 19.530 -13.393 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.802 21.239 -10.604 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.503 21.124 -11.546 1.00 25.00 H new ATOM 728 N GLU A 126 66.522 20.240 -15.619 1.00 25.00 N ATOM 729 CA GLU A 126 67.489 21.315 -15.826 1.00 25.00 C ATOM 730 C GLU A 126 67.854 21.975 -14.512 1.00 25.00 C ATOM 731 O GLU A 126 67.000 22.126 -13.629 1.00 25.00 O ATOM 732 CB GLU A 126 66.928 22.414 -16.727 1.00 25.00 C ATOM 733 CG GLU A 126 66.744 22.029 -18.182 1.00 25.00 C ATOM 734 CD GLU A 126 66.518 23.257 -19.067 1.00 25.00 C ATOM 735 OE1 GLU A 126 66.312 24.358 -18.509 1.00 25.00 O ATOM 736 OE2 GLU A 126 66.629 23.149 -20.306 1.00 25.00 O1- ATOM 0 H GLU A 126 65.590 20.432 -15.986 1.00 25.00 H new ATOM 0 HA GLU A 126 68.360 20.852 -16.289 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.965 22.732 -16.328 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.593 23.276 -16.678 1.00 25.00 H new ATOM 0 HG2 GLU A 126 67.624 21.487 -18.529 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.895 21.352 -18.275 1.00 25.00 H new ATOM 743 N LEU A 127 69.081 22.464 -14.408 1.00 25.00 N ATOM 744 CA LEU A 127 69.485 23.230 -13.235 1.00 25.00 C ATOM 745 C LEU A 127 68.637 24.490 -13.112 1.00 25.00 C ATOM 746 O LEU A 127 68.380 24.959 -12.006 1.00 25.00 O ATOM 747 CB LEU A 127 70.950 23.642 -13.341 1.00 25.00 C ATOM 748 CG LEU A 127 71.924 22.975 -12.365 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.328 23.477 -12.669 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.564 23.289 -10.903 1.00 25.00 C ATOM 0 H LEU A 127 69.809 22.347 -15.113 1.00 25.00 H new ATOM 0 HA LEU A 127 69.345 22.598 -12.358 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.289 23.434 -14.356 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.011 24.721 -13.199 1.00 25.00 H new ATOM 0 HG LEU A 127 71.865 21.894 -12.492 1.00 25.00 H new ATOM 0 HD11 LEU A 127 74.037 23.013 -11.983 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.593 23.219 -13.694 1.00 25.00 H new ATOM 0 HD13 LEU A 127 73.362 24.560 -12.547 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.277 22.799 -10.240 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.600 24.367 -10.743 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.559 22.924 -10.689 1.00 25.00 H new ATOM 762 N HIS A 128 68.180 25.020 -14.236 1.00 25.00 N ATOM 763 CA HIS A 128 67.329 26.202 -14.240 1.00 25.00 C ATOM 764 C HIS A 128 66.054 25.940 -13.447 1.00 25.00 C ATOM 765 O HIS A 128 65.628 26.764 -12.640 1.00 25.00 O ATOM 766 CB HIS A 128 66.962 26.589 -15.675 1.00 25.00 C ATOM 767 CG HIS A 128 66.427 27.981 -15.800 1.00 25.00 C ATOM 768 ND1 HIS A 128 67.078 28.998 -16.453 1.00 25.00 N ATOM 769 CD2 HIS A 128 65.273 28.540 -15.332 1.00 25.00 C ATOM 770 CE1 HIS A 128 66.332 30.094 -16.360 1.00 25.00 C ATOM 771 NE2 HIS A 128 65.224 29.877 -15.682 1.00 25.00 N ATOM 0 H HIS A 128 68.385 24.648 -15.163 1.00 25.00 H new ATOM 0 HA HIS A 128 67.880 27.020 -13.776 1.00 25.00 H new ATOM 0 HB2 HIS A 128 67.845 26.490 -16.307 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.219 25.887 -16.053 1.00 25.00 H new ATOM 0 HD1 HIS A 128 67.978 28.925 -16.927 1.00 25.00 H new ATOM 0 HD2 HIS A 128 64.512 28.017 -14.772 1.00 25.00 H new ATOM 0 HE1 HIS A 128 66.602 31.048 -16.789 1.00 25.00 H new ATOM 779 N ASN A 129 65.458 24.780 -13.655 1.00 25.00 N ATOM 780 CA ASN A 129 64.246 24.426 -12.935 1.00 25.00 C ATOM 781 C ASN A 129 64.582 23.984 -11.518 1.00 25.00 C ATOM 782 O ASN A 129 63.829 24.247 -10.597 1.00 25.00 O ATOM 783 CB ASN A 129 63.486 23.314 -13.665 1.00 25.00 C ATOM 784 CG ASN A 129 62.894 23.787 -14.968 1.00 25.00 C ATOM 785 OD1 ASN A 129 62.577 24.954 -15.123 1.00 25.00 O ATOM 786 ND2 ASN A 129 62.729 22.890 -15.899 1.00 25.00 N ATOM 0 H ASN A 129 65.789 24.072 -14.310 1.00 25.00 H new ATOM 0 HA ASN A 129 63.608 25.309 -12.888 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.162 22.480 -13.857 1.00 25.00 H new ATOM 0 HB3 ASN A 129 62.690 22.938 -13.022 1.00 25.00 H new ATOM 0 HD21 ASN A 129 62.322 23.155 -16.796 1.00 25.00 H new ATOM 0 HD22 ASN A 129 63.007 21.923 -15.731 1.00 25.00 H new ATOM 793 N PHE A 130 65.718 23.331 -11.333 1.00 25.00 N ATOM 794 CA PHE A 130 66.115 22.872 -10.001 1.00 25.00 C ATOM 795 C PHE A 130 66.367 24.029 -9.043 1.00 25.00 C ATOM 796 O PHE A 130 65.931 23.985 -7.901 1.00 25.00 O ATOM 797 CB PHE A 130 67.367 21.999 -10.085 1.00 25.00 C ATOM 798 CG PHE A 130 67.727 21.335 -8.778 1.00 25.00 C ATOM 799 CD1 PHE A 130 66.764 20.586 -8.064 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.029 21.444 -8.252 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.102 19.947 -6.841 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.377 20.803 -7.035 1.00 25.00 C ATOM 803 CZ PHE A 130 68.406 20.054 -6.329 1.00 25.00 C ATOM 0 H PHE A 130 66.379 23.106 -12.076 1.00 25.00 H new ATOM 0 HA PHE A 130 65.283 22.286 -9.609 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.215 21.231 -10.844 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.206 22.612 -10.415 1.00 25.00 H new ATOM 0 HD1 PHE A 130 65.760 20.499 -8.453 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.772 22.023 -8.781 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.356 19.379 -6.305 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.382 20.887 -6.648 1.00 25.00 H new ATOM 0 HZ PHE A 130 68.666 19.567 -5.401 1.00 25.00 H new ATOM 813 N ARG A 131 67.028 25.084 -9.511 1.00 25.00 N ATOM 814 CA ARG A 131 67.272 26.246 -8.655 1.00 25.00 C ATOM 815 C ARG A 131 65.966 26.970 -8.344 1.00 25.00 C ATOM 816 O ARG A 131 65.851 27.580 -7.303 1.00 25.00 O ATOM 817 CB ARG A 131 68.324 27.203 -9.247 1.00 25.00 C ATOM 818 CG ARG A 131 67.910 27.943 -10.520 1.00 25.00 C ATOM 819 CD ARG A 131 67.827 29.463 -10.323 1.00 25.00 C ATOM 820 NE ARG A 131 66.468 29.930 -9.984 1.00 25.00 N ATOM 821 CZ ARG A 131 65.513 30.225 -10.860 1.00 25.00 C ATOM 822 NH1 ARG A 131 65.676 30.068 -12.153 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 64.376 30.696 -10.432 1.00 25.00 N ATOM 0 H ARG A 131 67.399 25.161 -10.458 1.00 25.00 H new ATOM 0 HA ARG A 131 67.688 25.876 -7.718 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.584 27.941 -8.488 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.228 26.632 -9.459 1.00 25.00 H new ATOM 0 HG2 ARG A 131 68.625 27.722 -11.312 1.00 25.00 H new ATOM 0 HG3 ARG A 131 66.941 27.571 -10.853 1.00 25.00 H new ATOM 0 HD2 ARG A 131 68.514 29.759 -9.530 1.00 25.00 H new ATOM 0 HD3 ARG A 131 68.159 29.960 -11.235 1.00 25.00 H new ATOM 0 HE ARG A 131 66.243 30.035 -8.995 1.00 25.00 H new ATOM 0 HH11 ARG A 131 66.559 29.709 -12.516 1.00 25.00 H new ATOM 0 HH12 ARG A 131 64.920 30.305 -12.795 1.00 25.00 H new ATOM 0 HH21 ARG A 131 64.225 30.835 -9.433 1.00 25.00 H new ATOM 0 HH22 ARG A 131 63.637 30.926 -11.096 1.00 25.00 H new ATOM 837 N ALA A 132 64.981 26.873 -9.227 1.00 25.00 N ATOM 838 CA ALA A 132 63.673 27.467 -8.970 1.00 25.00 C ATOM 839 C ALA A 132 62.937 26.618 -7.930 1.00 25.00 C ATOM 840 O ALA A 132 62.218 27.134 -7.083 1.00 25.00 O ATOM 841 CB ALA A 132 62.859 27.543 -10.267 1.00 25.00 C ATOM 0 H ALA A 132 65.060 26.392 -10.123 1.00 25.00 H new ATOM 0 HA ALA A 132 63.801 28.480 -8.589 1.00 25.00 H new ATOM 0 HB1 ALA A 132 61.886 27.988 -10.060 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.391 28.156 -10.995 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.721 26.539 -10.669 1.00 25.00 H new ATOM 847 N LEU A 133 63.114 25.312 -8.025 1.00 25.00 N ATOM 848 CA LEU A 133 62.442 24.377 -7.131 1.00 25.00 C ATOM 849 C LEU A 133 62.963 24.506 -5.695 1.00 25.00 C ATOM 850 O LEU A 133 62.185 24.540 -4.758 1.00 25.00 O ATOM 851 CB LEU A 133 62.646 22.948 -7.662 1.00 25.00 C ATOM 852 CG LEU A 133 61.696 21.848 -7.169 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.266 22.118 -7.624 1.00 25.00 C ATOM 854 CD2 LEU A 133 62.170 20.494 -7.721 1.00 25.00 C ATOM 0 H LEU A 133 63.721 24.870 -8.716 1.00 25.00 H new ATOM 0 HA LEU A 133 61.377 24.609 -7.106 1.00 25.00 H new ATOM 0 HB2 LEU A 133 62.578 22.984 -8.749 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.663 22.644 -7.416 1.00 25.00 H new ATOM 0 HG LEU A 133 61.708 21.834 -6.079 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.613 21.324 -7.262 1.00 25.00 H new ATOM 0 HD12 LEU A 133 59.931 23.075 -7.223 1.00 25.00 H new ATOM 0 HD13 LEU A 133 60.230 22.148 -8.713 1.00 25.00 H new ATOM 0 HD21 LEU A 133 61.501 19.706 -7.376 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.165 20.523 -8.811 1.00 25.00 H new ATOM 0 HD23 LEU A 133 63.181 20.291 -7.369 1.00 25.00 H new ATOM 866 N CYS A 134 64.275 24.616 -5.520 1.00 25.00 N ATOM 867 CA CYS A 134 64.826 24.765 -4.174 1.00 25.00 C ATOM 868 C CYS A 134 64.592 26.178 -3.632 1.00 25.00 C ATOM 869 O CYS A 134 64.509 26.369 -2.425 1.00 25.00 O ATOM 870 CB CYS A 134 66.312 24.402 -4.135 1.00 25.00 C ATOM 871 SG CYS A 134 67.391 25.495 -5.089 1.00 25.00 S ATOM 0 H CYS A 134 64.964 24.606 -6.272 1.00 25.00 H new ATOM 0 HA CYS A 134 64.297 24.066 -3.526 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.644 24.404 -3.097 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.432 23.384 -4.506 1.00 25.00 H new ATOM 0 HG CYS A 134 66.670 26.241 -5.872 1.00 25.00 H new ATOM 877 N GLU A 135 64.447 27.145 -4.525 1.00 25.00 N ATOM 878 CA GLU A 135 64.112 28.519 -4.143 1.00 25.00 C ATOM 879 C GLU A 135 62.709 28.539 -3.536 1.00 25.00 C ATOM 880 O GLU A 135 62.484 29.171 -2.509 1.00 25.00 O ATOM 881 CB GLU A 135 64.209 29.412 -5.389 1.00 25.00 C ATOM 882 CG GLU A 135 63.507 30.755 -5.352 1.00 25.00 C ATOM 883 CD GLU A 135 63.940 31.644 -6.522 1.00 25.00 C ATOM 884 OE1 GLU A 135 64.102 31.121 -7.660 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 64.213 32.848 -6.297 1.00 25.00 O1- ATOM 0 H GLU A 135 64.556 27.007 -5.530 1.00 25.00 H new ATOM 0 HA GLU A 135 64.806 28.900 -3.394 1.00 25.00 H new ATOM 0 HB2 GLU A 135 65.265 29.591 -5.591 1.00 25.00 H new ATOM 0 HB3 GLU A 135 63.813 28.850 -6.235 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.428 30.604 -5.387 1.00 25.00 H new ATOM 0 HG3 GLU A 135 63.728 31.257 -4.410 1.00 25.00 H new ATOM 892 N LEU A 136 61.791 27.794 -4.138 1.00 25.00 N ATOM 893 CA LEU A 136 60.425 27.704 -3.641 1.00 25.00 C ATOM 894 C LEU A 136 60.373 27.068 -2.250 1.00 25.00 C ATOM 895 O LEU A 136 59.721 27.586 -1.355 1.00 25.00 O ATOM 896 CB LEU A 136 59.575 26.877 -4.620 1.00 25.00 C ATOM 897 CG LEU A 136 58.085 26.721 -4.268 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.334 28.056 -4.356 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.446 25.710 -5.216 1.00 25.00 C ATOM 0 H LEU A 136 61.970 27.241 -4.976 1.00 25.00 H new ATOM 0 HA LEU A 136 60.027 28.716 -3.563 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.647 27.335 -5.606 1.00 25.00 H new ATOM 0 HB3 LEU A 136 60.014 25.882 -4.698 1.00 25.00 H new ATOM 0 HG LEU A 136 58.017 26.370 -3.238 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.286 27.901 -4.100 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.776 28.769 -3.660 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.406 28.448 -5.371 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.390 25.597 -4.970 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.543 26.062 -6.243 1.00 25.00 H new ATOM 0 HD23 LEU A 136 57.948 24.748 -5.114 1.00 25.00 H new ATOM 911 N GLU A 137 61.058 25.944 -2.077 1.00 25.00 N ATOM 912 CA GLU A 137 61.033 25.225 -0.800 1.00 25.00 C ATOM 913 C GLU A 137 61.739 26.002 0.308 1.00 25.00 C ATOM 914 O GLU A 137 61.307 25.999 1.462 1.00 25.00 O ATOM 915 CB GLU A 137 61.715 23.863 -0.946 1.00 25.00 C ATOM 916 CG GLU A 137 61.014 22.898 -1.887 1.00 25.00 C ATOM 917 CD GLU A 137 59.592 22.564 -1.451 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.404 22.129 -0.297 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.666 22.697 -2.286 1.00 25.00 O1- ATOM 0 H GLU A 137 61.635 25.509 -2.797 1.00 25.00 H new ATOM 0 HA GLU A 137 59.985 25.101 -0.527 1.00 25.00 H new ATOM 0 HB2 GLU A 137 62.734 24.019 -1.300 1.00 25.00 H new ATOM 0 HB3 GLU A 137 61.787 23.401 0.039 1.00 25.00 H new ATOM 0 HG2 GLU A 137 60.989 23.329 -2.888 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.594 21.977 -1.951 1.00 25.00 H new ATOM 926 N SER A 138 62.848 26.651 -0.027 1.00 25.00 N ATOM 927 CA SER A 138 63.624 27.373 0.979 1.00 25.00 C ATOM 928 C SER A 138 63.053 28.761 1.265 1.00 25.00 C ATOM 929 O SER A 138 63.331 29.344 2.311 1.00 25.00 O ATOM 930 CB SER A 138 65.074 27.509 0.529 1.00 25.00 C ATOM 931 OG SER A 138 65.878 28.046 1.569 1.00 25.00 O ATOM 0 H SER A 138 63.228 26.694 -0.973 1.00 25.00 H new ATOM 0 HA SER A 138 63.570 26.791 1.899 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.460 26.534 0.232 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.128 28.154 -0.348 1.00 25.00 H new ATOM 0 HG SER A 138 66.807 27.761 1.444 1.00 25.00 H new ATOM 937 N GLY A 139 62.277 29.300 0.330 1.00 25.00 N ATOM 938 CA GLY A 139 61.643 30.590 0.536 1.00 25.00 C ATOM 939 C GLY A 139 62.609 31.763 0.546 1.00 25.00 C ATOM 940 O GLY A 139 62.347 32.787 1.175 1.00 25.00 O ATOM 0 H GLY A 139 62.075 28.865 -0.570 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.904 30.749 -0.249 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.103 30.570 1.483 1.00 25.00 H new ATOM 944 N ILE A 140 63.732 31.625 -0.150 1.00 25.00 N ATOM 945 CA ILE A 140 64.732 32.689 -0.217 1.00 25.00 C ATOM 946 C ILE A 140 65.036 33.000 -1.679 1.00 25.00 C ATOM 947 O ILE A 140 64.981 32.111 -2.525 1.00 25.00 O ATOM 948 CB ILE A 140 66.057 32.310 0.529 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.697 31.034 -0.065 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.778 32.133 2.045 1.00 25.00 C ATOM 951 CD1 ILE A 140 68.128 30.789 0.375 1.00 25.00 C ATOM 0 H ILE A 140 63.975 30.786 -0.677 1.00 25.00 H new ATOM 0 HA ILE A 140 64.319 33.565 0.283 1.00 25.00 H new ATOM 0 HB ILE A 140 66.770 33.123 0.393 1.00 25.00 H new ATOM 0 HG12 ILE A 140 66.091 30.173 0.216 1.00 25.00 H new ATOM 0 HG13 ILE A 140 66.670 31.101 -1.153 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.704 31.870 2.557 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.389 33.065 2.455 1.00 25.00 H new ATOM 0 HG23 ILE A 140 65.045 31.340 2.190 1.00 25.00 H new ATOM 0 HD11 ILE A 140 68.499 29.875 -0.088 1.00 25.00 H new ATOM 0 HD12 ILE A 140 68.751 31.629 0.070 1.00 25.00 H new ATOM 0 HD13 ILE A 140 68.163 30.687 1.460 1.00 25.00 H new ATOM 963 N PRO A 141 65.340 34.274 -2.007 1.00 25.00 N ATOM 964 CA PRO A 141 65.610 34.524 -3.430 1.00 25.00 C ATOM 965 C PRO A 141 66.864 33.801 -3.932 1.00 25.00 C ATOM 966 O PRO A 141 67.940 33.889 -3.322 1.00 25.00 O ATOM 967 CB PRO A 141 65.825 36.044 -3.481 1.00 25.00 C ATOM 968 CG PRO A 141 65.144 36.559 -2.254 1.00 25.00 C ATOM 969 CD PRO A 141 65.429 35.519 -1.225 1.00 25.00 C ATOM 0 HA PRO A 141 64.801 34.161 -4.064 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.886 36.295 -3.481 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.395 36.476 -4.385 1.00 25.00 H new ATOM 0 HG2 PRO A 141 65.536 37.532 -1.958 1.00 25.00 H new ATOM 0 HG3 PRO A 141 64.073 36.681 -2.413 1.00 25.00 H new ATOM 0 HD2 PRO A 141 66.414 35.649 -0.777 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.704 35.542 -0.412 1.00 25.00 H new ATOM 977 N ALA A 142 66.741 33.143 -5.075 1.00 25.00 N ATOM 978 CA ALA A 142 67.874 32.463 -5.706 1.00 25.00 C ATOM 979 C ALA A 142 68.929 33.485 -6.118 1.00 25.00 C ATOM 980 O ALA A 142 70.106 33.182 -6.178 1.00 25.00 O ATOM 981 CB ALA A 142 67.398 31.672 -6.929 1.00 25.00 C ATOM 0 H ALA A 142 65.865 33.063 -5.591 1.00 25.00 H new ATOM 0 HA ALA A 142 68.315 31.769 -4.990 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.248 31.170 -7.391 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.663 30.929 -6.619 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.944 32.353 -7.649 1.00 25.00 H new ATOM 987 N ALA A 143 68.491 34.704 -6.402 1.00 25.00 N ATOM 988 CA ALA A 143 69.391 35.777 -6.824 1.00 25.00 C ATOM 989 C ALA A 143 70.356 36.198 -5.698 1.00 25.00 C ATOM 990 O ALA A 143 71.433 36.721 -5.957 1.00 25.00 O ATOM 991 CB ALA A 143 68.568 36.986 -7.280 1.00 25.00 C ATOM 0 H ALA A 143 67.510 34.979 -6.348 1.00 25.00 H new ATOM 0 HA ALA A 143 69.994 35.401 -7.650 1.00 25.00 H new ATOM 0 HB1 ALA A 143 69.239 37.785 -7.594 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.930 36.698 -8.116 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.948 37.336 -6.455 1.00 25.00 H new ATOM 997 N GLU A 144 69.944 35.973 -4.456 1.00 25.00 N ATOM 998 CA GLU A 144 70.726 36.377 -3.284 1.00 25.00 C ATOM 999 C GLU A 144 71.551 35.204 -2.751 1.00 25.00 C ATOM 1000 O GLU A 144 72.077 35.245 -1.632 1.00 25.00 O ATOM 1001 CB GLU A 144 69.780 36.868 -2.183 1.00 25.00 C ATOM 1002 CG GLU A 144 69.091 38.189 -2.500 1.00 25.00 C ATOM 1003 CD GLU A 144 70.080 39.345 -2.608 1.00 25.00 C ATOM 1004 OE1 GLU A 144 70.882 39.541 -1.664 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 70.048 40.062 -3.628 1.00 25.00 O1- ATOM 0 H GLU A 144 69.065 35.509 -4.229 1.00 25.00 H new ATOM 0 HA GLU A 144 71.404 37.177 -3.580 1.00 25.00 H new ATOM 0 HB2 GLU A 144 69.020 36.107 -2.006 1.00 25.00 H new ATOM 0 HB3 GLU A 144 70.344 36.977 -1.256 1.00 25.00 H new ATOM 0 HG2 GLU A 144 68.542 38.094 -3.437 1.00 25.00 H new ATOM 0 HG3 GLU A 144 68.360 38.411 -1.723 1.00 25.00 H new ATOM 1012 N SER A 145 71.626 34.133 -3.527 1.00 25.00 N ATOM 1013 CA SER A 145 72.288 32.920 -3.076 1.00 25.00 C ATOM 1014 C SER A 145 72.986 32.162 -4.207 1.00 25.00 C ATOM 1015 O SER A 145 72.888 32.525 -5.366 1.00 25.00 O ATOM 1016 CB SER A 145 71.245 32.025 -2.413 1.00 25.00 C ATOM 1017 OG SER A 145 70.192 31.715 -3.306 1.00 25.00 O ATOM 0 H SER A 145 71.238 34.080 -4.469 1.00 25.00 H new ATOM 0 HA SER A 145 73.070 33.203 -2.372 1.00 25.00 H new ATOM 0 HB2 SER A 145 71.717 31.104 -2.071 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.842 32.524 -1.531 1.00 25.00 H new ATOM 0 HG SER A 145 69.508 32.415 -3.261 1.00 25.00 H new ATOM 1023 N GLN A 146 73.724 31.117 -3.852 1.00 25.00 N ATOM 1024 CA GLN A 146 74.447 30.306 -4.830 1.00 25.00 C ATOM 1025 C GLN A 146 74.332 28.825 -4.493 1.00 25.00 C ATOM 1026 O GLN A 146 74.329 28.451 -3.328 1.00 25.00 O ATOM 1027 CB GLN A 146 75.924 30.719 -4.856 1.00 25.00 C ATOM 1028 CG GLN A 146 76.726 30.020 -5.940 1.00 25.00 C ATOM 1029 CD GLN A 146 78.079 30.632 -6.140 1.00 25.00 C ATOM 1030 OE1 GLN A 146 78.939 30.577 -5.281 1.00 25.00 O ATOM 1031 NE2 GLN A 146 78.277 31.206 -7.292 1.00 25.00 N ATOM 0 H GLN A 146 73.839 30.808 -2.887 1.00 25.00 H new ATOM 0 HA GLN A 146 74.005 30.473 -5.812 1.00 25.00 H new ATOM 0 HB2 GLN A 146 75.990 31.797 -5.004 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.372 30.502 -3.886 1.00 25.00 H new ATOM 0 HG2 GLN A 146 76.842 28.968 -5.680 1.00 25.00 H new ATOM 0 HG3 GLN A 146 76.172 30.057 -6.878 1.00 25.00 H new ATOM 0 HE21 GLN A 146 77.529 31.230 -7.985 1.00 25.00 H new ATOM 0 HE22 GLN A 146 79.180 31.631 -7.501 1.00 25.00 H new ATOM 1040 N ILE A 147 74.265 27.994 -5.522 1.00 25.00 N ATOM 1041 CA ILE A 147 74.193 26.542 -5.358 1.00 25.00 C ATOM 1042 C ILE A 147 75.596 25.945 -5.589 1.00 25.00 C ATOM 1043 O ILE A 147 76.317 26.315 -6.524 1.00 25.00 O ATOM 1044 CB ILE A 147 73.120 25.915 -6.320 1.00 25.00 C ATOM 1045 CG1 ILE A 147 73.088 24.385 -6.130 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.393 26.326 -7.793 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.946 23.657 -6.861 1.00 25.00 C ATOM 0 H ILE A 147 74.259 28.302 -6.494 1.00 25.00 H new ATOM 0 HA ILE A 147 73.873 26.303 -4.344 1.00 25.00 H new ATOM 0 HB ILE A 147 72.133 26.302 -6.069 1.00 25.00 H new ATOM 0 HG12 ILE A 147 74.037 23.973 -6.472 1.00 25.00 H new ATOM 0 HG13 ILE A 147 73.012 24.169 -5.064 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.638 25.881 -8.441 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.352 27.412 -7.881 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.381 25.975 -8.092 1.00 25.00 H new ATOM 0 HD11 ILE A 147 72.012 22.587 -6.664 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.987 24.034 -6.504 1.00 25.00 H new ATOM 0 HD13 ILE A 147 72.029 23.834 -7.933 1.00 25.00 H new ATOM 1059 N VAL A 148 75.986 25.064 -4.683 1.00 25.00 N ATOM 1060 CA VAL A 148 77.309 24.449 -4.665 1.00 25.00 C ATOM 1061 C VAL A 148 77.142 22.924 -4.640 1.00 25.00 C ATOM 1062 O VAL A 148 76.348 22.400 -3.871 1.00 25.00 O ATOM 1063 CB VAL A 148 78.086 24.930 -3.390 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.464 24.259 -3.269 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.265 26.461 -3.424 1.00 25.00 C ATOM 0 H VAL A 148 75.383 24.748 -3.924 1.00 25.00 H new ATOM 0 HA VAL A 148 77.874 24.738 -5.552 1.00 25.00 H new ATOM 0 HB VAL A 148 77.492 24.643 -2.522 1.00 25.00 H new ATOM 0 HG11 VAL A 148 79.967 24.621 -2.372 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.338 23.178 -3.203 1.00 25.00 H new ATOM 0 HG13 VAL A 148 80.065 24.501 -4.145 1.00 25.00 H new ATOM 0 HG21 VAL A 148 78.806 26.784 -2.534 1.00 25.00 H new ATOM 0 HG22 VAL A 148 78.829 26.742 -4.313 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.287 26.941 -3.448 1.00 25.00 H new ATOM 1075 N TYR A 149 77.897 22.224 -5.477 1.00 25.00 N ATOM 1076 CA TYR A 149 77.868 20.758 -5.548 1.00 25.00 C ATOM 1077 C TYR A 149 79.311 20.292 -5.692 1.00 25.00 C ATOM 1078 O TYR A 149 80.104 20.964 -6.343 1.00 25.00 O ATOM 1079 CB TYR A 149 77.048 20.310 -6.762 1.00 25.00 C ATOM 1080 CG TYR A 149 77.310 18.879 -7.182 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.881 17.787 -6.397 1.00 25.00 C ATOM 1082 CD2 TYR A 149 78.007 18.612 -8.380 1.00 25.00 C ATOM 1083 CE1 TYR A 149 77.140 16.448 -6.811 1.00 25.00 C ATOM 1084 CE2 TYR A 149 78.256 17.279 -8.796 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.821 16.213 -8.010 1.00 25.00 C ATOM 1086 OH TYR A 149 78.060 14.938 -8.429 1.00 25.00 O ATOM 0 H TYR A 149 78.551 22.653 -6.131 1.00 25.00 H new ATOM 0 HA TYR A 149 77.409 20.332 -4.656 1.00 25.00 H new ATOM 0 HB2 TYR A 149 75.988 20.424 -6.535 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.267 20.971 -7.601 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.351 17.968 -5.473 1.00 25.00 H new ATOM 0 HD2 TYR A 149 78.355 19.434 -8.988 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.812 15.619 -6.202 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.782 17.090 -9.720 1.00 25.00 H new ATOM 0 HH TYR A 149 78.068 14.912 -9.409 1.00 25.00 H new ATOM 1096 N ALA A 150 79.654 19.189 -5.037 1.00 25.00 N ATOM 1097 CA ALA A 150 81.033 18.681 -5.004 1.00 25.00 C ATOM 1098 C ALA A 150 81.997 19.806 -4.583 1.00 25.00 C ATOM 1099 O ALA A 150 83.061 19.987 -5.172 1.00 25.00 O ATOM 1100 CB ALA A 150 81.424 18.081 -6.374 1.00 25.00 C ATOM 0 H ALA A 150 78.991 18.618 -4.513 1.00 25.00 H new ATOM 0 HA ALA A 150 81.102 17.882 -4.266 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.448 17.710 -6.330 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.751 17.259 -6.617 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.349 18.850 -7.143 1.00 25.00 H new ATOM 1106 N GLU A 151 81.552 20.574 -3.594 1.00 25.00 N ATOM 1107 CA GLU A 151 82.279 21.728 -3.027 1.00 25.00 C ATOM 1108 C GLU A 151 82.609 22.862 -4.025 1.00 25.00 C ATOM 1109 O GLU A 151 83.328 23.804 -3.687 1.00 25.00 O ATOM 1110 CB GLU A 151 83.548 21.262 -2.302 1.00 25.00 C ATOM 1111 CG GLU A 151 83.257 20.275 -1.176 1.00 25.00 C ATOM 1112 CD GLU A 151 84.461 20.051 -0.280 1.00 25.00 C ATOM 1113 OE1 GLU A 151 85.267 19.144 -0.573 1.00 25.00 O ATOM 1114 OE2 GLU A 151 84.604 20.799 0.712 1.00 25.00 O1- ATOM 0 H GLU A 151 80.650 20.415 -3.145 1.00 25.00 H new ATOM 0 HA GLU A 151 81.581 22.175 -2.319 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.222 20.797 -3.021 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.067 22.129 -1.894 1.00 25.00 H new ATOM 0 HG2 GLU A 151 82.425 20.646 -0.577 1.00 25.00 H new ATOM 0 HG3 GLU A 151 82.943 19.323 -1.603 1.00 25.00 H new ATOM 1121 N ARG A 152 82.030 22.825 -5.219 1.00 25.00 N ATOM 1122 CA ARG A 152 82.238 23.885 -6.210 1.00 25.00 C ATOM 1123 C ARG A 152 80.914 24.485 -6.677 1.00 25.00 C ATOM 1124 O ARG A 152 79.909 23.788 -6.755 1.00 25.00 O ATOM 1125 CB ARG A 152 82.989 23.326 -7.412 1.00 25.00 C ATOM 1126 CG ARG A 152 84.391 22.815 -7.079 1.00 25.00 C ATOM 1127 CD ARG A 152 85.184 22.564 -8.349 1.00 25.00 C ATOM 1128 NE ARG A 152 85.477 23.829 -9.052 1.00 25.00 N ATOM 1129 CZ ARG A 152 85.925 23.928 -10.297 1.00 25.00 C ATOM 1130 NH1 ARG A 152 86.157 22.876 -11.041 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 86.142 25.113 -10.804 1.00 25.00 N ATOM 0 H ARG A 152 81.412 22.075 -5.529 1.00 25.00 H new ATOM 0 HA ARG A 152 82.822 24.674 -5.736 1.00 25.00 H new ATOM 0 HB2 ARG A 152 82.409 22.511 -7.845 1.00 25.00 H new ATOM 0 HB3 ARG A 152 83.066 24.102 -8.174 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.911 23.543 -6.457 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.320 21.894 -6.500 1.00 25.00 H new ATOM 0 HD2 ARG A 152 86.117 22.056 -8.104 1.00 25.00 H new ATOM 0 HD3 ARG A 152 84.623 21.900 -9.007 1.00 25.00 H new ATOM 0 HE ARG A 152 85.323 24.697 -8.539 1.00 25.00 H new ATOM 0 HH11 ARG A 152 85.993 21.941 -10.667 1.00 25.00 H new ATOM 0 HH12 ARG A 152 86.501 22.991 -11.994 1.00 25.00 H new ATOM 0 HH21 ARG A 152 85.967 25.947 -10.244 1.00 25.00 H new ATOM 0 HH22 ARG A 152 86.486 25.204 -11.760 1.00 25.00 H new ATOM 1145 N PRO A 153 80.890 25.795 -6.989 1.00 25.00 N ATOM 1146 CA PRO A 153 79.604 26.314 -7.463 1.00 25.00 C ATOM 1147 C PRO A 153 79.246 25.806 -8.859 1.00 25.00 C ATOM 1148 O PRO A 153 80.122 25.540 -9.686 1.00 25.00 O ATOM 1149 CB PRO A 153 79.826 27.825 -7.459 1.00 25.00 C ATOM 1150 CG PRO A 153 81.266 27.980 -7.735 1.00 25.00 C ATOM 1151 CD PRO A 153 81.917 26.854 -6.964 1.00 25.00 C ATOM 0 HA PRO A 153 78.769 25.993 -6.841 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.220 28.319 -8.218 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.555 28.265 -6.499 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.477 27.906 -8.802 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.632 28.952 -7.405 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.845 26.527 -7.434 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.164 27.153 -5.945 1.00 25.00 H new ATOM 1159 N LEU A 154 77.953 25.692 -9.113 1.00 25.00 N ATOM 1160 CA LEU A 154 77.453 25.270 -10.427 1.00 25.00 C ATOM 1161 C LEU A 154 77.204 26.536 -11.235 1.00 0.00 C ATOM 1162 O LEU A 154 76.725 27.525 -10.688 1.00 25.00 O ATOM 1163 CB LEU A 154 76.156 24.471 -10.267 1.00 25.00 C ATOM 1164 CG LEU A 154 76.281 23.144 -9.493 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.915 22.584 -9.134 1.00 25.00 C ATOM 1166 CD2 LEU A 154 77.042 22.111 -10.311 1.00 25.00 C ATOM 0 H LEU A 154 77.222 25.885 -8.429 1.00 25.00 H new ATOM 0 HA LEU A 154 78.174 24.627 -10.932 1.00 25.00 H new ATOM 0 HB2 LEU A 154 75.424 25.099 -9.759 1.00 25.00 H new ATOM 0 HB3 LEU A 154 75.758 24.256 -11.259 1.00 25.00 H new ATOM 0 HG LEU A 154 76.829 23.357 -8.575 1.00 25.00 H new ATOM 0 HD11 LEU A 154 75.037 21.648 -8.589 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.381 23.300 -8.510 1.00 25.00 H new ATOM 0 HD13 LEU A 154 74.346 22.401 -10.045 1.00 25.00 H new ATOM 0 HD21 LEU A 154 77.118 21.183 -9.745 1.00 25.00 H new ATOM 0 HD22 LEU A 154 76.512 21.924 -11.245 1.00 25.00 H new ATOM 0 HD23 LEU A 154 78.042 22.485 -10.530 1.00 25.00 H new ATOM 1178 N THR A 155 77.594 26.537 -12.504 1.00 25.00 N ATOM 1179 CA THR A 155 77.580 27.766 -13.312 1.00 25.00 C ATOM 1180 C THR A 155 76.820 27.706 -14.649 1.00 25.00 C ATOM 1181 O THR A 155 76.669 28.726 -15.309 1.00 25.00 O ATOM 1182 CB THR A 155 79.031 28.185 -13.653 1.00 25.00 C ATOM 1183 OG1 THR A 155 79.655 27.138 -14.402 1.00 25.00 O ATOM 1184 CG2 THR A 155 79.856 28.407 -12.380 1.00 25.00 C ATOM 0 H THR A 155 77.923 25.709 -13.000 1.00 25.00 H new ATOM 0 HA THR A 155 77.048 28.475 -12.678 1.00 25.00 H new ATOM 0 HB THR A 155 78.991 29.113 -14.223 1.00 25.00 H new ATOM 0 HG1 THR A 155 80.574 27.397 -14.623 1.00 25.00 H new ATOM 0 HG21 THR A 155 80.870 28.700 -12.650 1.00 25.00 H new ATOM 0 HG22 THR A 155 79.398 29.195 -11.782 1.00 25.00 H new ATOM 0 HG23 THR A 155 79.887 27.484 -11.801 1.00 25.00 H new ATOM 1192 N ASP A 156 76.343 26.538 -15.055 1.00 25.00 N ATOM 1193 CA ASP A 156 75.614 26.406 -16.331 1.00 25.00 C ATOM 1194 C ASP A 156 74.226 25.839 -16.054 1.00 25.00 C ATOM 1195 O ASP A 156 74.049 24.653 -15.826 1.00 25.00 O ATOM 1196 CB ASP A 156 76.387 25.517 -17.314 1.00 25.00 C ATOM 1197 CG ASP A 156 75.708 25.401 -18.674 1.00 25.00 C ATOM 1198 OD1 ASP A 156 74.526 25.800 -18.818 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 76.369 24.871 -19.600 1.00 25.00 O1- ATOM 0 H ASP A 156 76.441 25.668 -14.532 1.00 25.00 H new ATOM 0 HA ASP A 156 75.514 27.388 -16.793 1.00 25.00 H new ATOM 0 HB2 ASP A 156 77.390 25.921 -17.448 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.499 24.522 -16.884 1.00 25.00 H new ATOM 1204 N ASN A 157 73.249 26.725 -16.021 1.00 25.00 N ATOM 1205 CA ASN A 157 71.893 26.347 -15.629 1.00 25.00 C ATOM 1206 C ASN A 157 71.115 25.584 -16.704 1.00 25.00 C ATOM 1207 O ASN A 157 70.071 25.014 -16.413 1.00 25.00 O ATOM 1208 CB ASN A 157 71.096 27.595 -15.199 1.00 25.00 C ATOM 1209 CG ASN A 157 70.812 28.539 -16.345 1.00 25.00 C ATOM 1210 OD1 ASN A 157 69.903 28.328 -17.128 1.00 25.00 O ATOM 1211 ND2 ASN A 157 71.578 29.594 -16.436 1.00 25.00 N ATOM 0 H ASN A 157 73.362 27.710 -16.259 1.00 25.00 H new ATOM 0 HA ASN A 157 72.011 25.658 -14.792 1.00 25.00 H new ATOM 0 HB2 ASN A 157 70.153 27.281 -14.752 1.00 25.00 H new ATOM 0 HB3 ASN A 157 71.653 28.127 -14.427 1.00 25.00 H new ATOM 0 HD21 ASN A 157 71.424 30.273 -17.181 1.00 25.00 H new ATOM 0 HD22 ASN A 157 72.330 29.738 -15.762 1.00 25.00 H new ATOM 1218 N HIS A 158 71.611 25.545 -17.936 1.00 25.00 N ATOM 1219 CA HIS A 158 70.890 24.846 -19.006 1.00 25.00 C ATOM 1220 C HIS A 158 71.265 23.360 -19.035 1.00 25.00 C ATOM 1221 O HIS A 158 70.673 22.576 -19.766 1.00 25.00 O ATOM 1222 CB HIS A 158 71.170 25.508 -20.359 1.00 25.00 C ATOM 1223 CG HIS A 158 70.296 25.003 -21.471 1.00 25.00 C ATOM 1224 ND1 HIS A 158 68.974 24.570 -21.294 1.00 25.00 N ATOM 1225 CD2 HIS A 158 70.536 24.828 -22.799 1.00 25.00 C ATOM 1226 CE1 HIS A 158 68.498 24.163 -22.461 1.00 25.00 C ATOM 1227 NE2 HIS A 158 69.414 24.314 -23.377 1.00 25.00 N ATOM 0 H HIS A 158 72.490 25.978 -18.220 1.00 25.00 H new ATOM 0 HA HIS A 158 69.821 24.917 -18.805 1.00 25.00 H new ATOM 0 HB2 HIS A 158 71.033 26.585 -20.262 1.00 25.00 H new ATOM 0 HB3 HIS A 158 72.214 25.342 -20.625 1.00 25.00 H new ATOM 0 HD1 HIS A 158 68.463 24.569 -20.411 1.00 25.00 H new ATOM 0 HD2 HIS A 158 71.460 25.058 -23.309 1.00 25.00 H new ATOM 0 HE1 HIS A 158 67.507 23.768 -22.628 1.00 25.00 H new ATOM 1235 N ARG A 159 72.228 22.963 -18.220 1.00 25.00 N ATOM 1236 CA ARG A 159 72.590 21.553 -18.133 1.00 25.00 C ATOM 1237 C ARG A 159 71.703 20.871 -17.126 1.00 25.00 C ATOM 1238 O ARG A 159 71.263 21.484 -16.155 1.00 25.00 O ATOM 1239 CB ARG A 159 74.057 21.397 -17.745 1.00 25.00 C ATOM 1240 CG ARG A 159 74.966 21.735 -18.885 1.00 25.00 C ATOM 1241 CD ARG A 159 76.414 21.683 -18.486 1.00 25.00 C ATOM 1242 NE ARG A 159 77.226 22.117 -19.629 1.00 25.00 N ATOM 1243 CZ ARG A 159 77.804 21.313 -20.515 1.00 25.00 C ATOM 1244 NH1 ARG A 159 77.745 20.000 -20.429 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 78.457 21.838 -21.513 1.00 25.00 N ATOM 0 H ARG A 159 72.768 23.584 -17.617 1.00 25.00 H new ATOM 0 HA ARG A 159 72.450 21.088 -19.109 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.280 22.044 -16.896 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.242 20.372 -17.423 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.791 21.040 -19.706 1.00 25.00 H new ATOM 0 HG3 ARG A 159 74.728 22.732 -19.255 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.594 22.329 -17.626 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.689 20.671 -18.188 1.00 25.00 H new ATOM 0 HE ARG A 159 77.358 23.121 -19.754 1.00 25.00 H new ATOM 0 HH11 ARG A 159 77.240 19.562 -19.659 1.00 25.00 H new ATOM 0 HH12 ARG A 159 78.204 19.422 -21.133 1.00 25.00 H new ATOM 0 HH21 ARG A 159 78.519 22.852 -21.605 1.00 25.00 H new ATOM 0 HH22 ARG A 159 78.907 21.235 -22.202 1.00 25.00 H new ATOM 1259 N SER A 160 71.443 19.601 -17.370 1.00 25.00 N ATOM 1260 CA SER A 160 70.639 18.804 -16.471 1.00 25.00 C ATOM 1261 C SER A 160 71.488 18.302 -15.317 1.00 25.00 C ATOM 1262 O SER A 160 72.720 18.305 -15.384 1.00 25.00 O ATOM 1263 CB SER A 160 70.046 17.624 -17.220 1.00 25.00 C ATOM 1264 OG SER A 160 71.050 16.852 -17.861 1.00 25.00 O ATOM 0 H SER A 160 71.781 19.098 -18.191 1.00 25.00 H new ATOM 0 HA SER A 160 69.833 19.423 -16.076 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.490 16.994 -16.525 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.334 17.985 -17.963 1.00 25.00 H new ATOM 0 HG SER A 160 70.636 16.270 -18.532 1.00 25.00 H new ATOM 1270 N LEU A 161 70.835 17.877 -14.250 1.00 25.00 N ATOM 1271 CA LEU A 161 71.524 17.397 -13.052 1.00 25.00 C ATOM 1272 C LEU A 161 72.341 16.122 -13.339 1.00 25.00 C ATOM 1273 O LEU A 161 73.466 15.949 -12.827 1.00 25.00 O ATOM 1274 CB LEU A 161 70.476 17.163 -11.959 1.00 25.00 C ATOM 1275 CG LEU A 161 69.730 18.449 -11.541 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.502 18.103 -10.738 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.639 19.389 -10.732 1.00 25.00 C ATOM 0 H LEU A 161 69.817 17.852 -14.183 1.00 25.00 H new ATOM 0 HA LEU A 161 72.242 18.146 -12.717 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.751 16.429 -12.312 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.964 16.734 -11.084 1.00 25.00 H new ATOM 0 HG LEU A 161 69.430 18.969 -12.451 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.986 19.019 -10.450 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.836 17.485 -11.340 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.795 17.555 -9.843 1.00 25.00 H new ATOM 0 HD21 LEU A 161 70.082 20.284 -10.454 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.979 18.879 -9.831 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.501 19.671 -11.337 1.00 25.00 H new ATOM 1289 N ALA A 162 71.829 15.277 -14.226 1.00 25.00 N ATOM 1290 CA ALA A 162 72.559 14.077 -14.650 1.00 25.00 C ATOM 1291 C ALA A 162 73.880 14.442 -15.337 1.00 25.00 C ATOM 1292 O ALA A 162 74.849 13.694 -15.255 1.00 25.00 O ATOM 1293 CB ALA A 162 71.693 13.230 -15.591 1.00 25.00 C ATOM 0 H ALA A 162 70.917 15.395 -14.667 1.00 25.00 H new ATOM 0 HA ALA A 162 72.790 13.495 -13.758 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.248 12.343 -15.897 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.782 12.927 -15.074 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.432 13.817 -16.472 1.00 25.00 H new ATOM 1299 N SER A 163 73.930 15.599 -15.990 1.00 25.00 N ATOM 1300 CA SER A 163 75.155 16.039 -16.668 1.00 25.00 C ATOM 1301 C SER A 163 76.261 16.379 -15.667 1.00 25.00 C ATOM 1302 O SER A 163 77.432 16.441 -16.031 1.00 25.00 O ATOM 1303 CB SER A 163 74.888 17.269 -17.542 1.00 25.00 C ATOM 1304 OG SER A 163 73.895 17.014 -18.522 1.00 25.00 O ATOM 0 H SER A 163 73.146 16.247 -16.067 1.00 25.00 H new ATOM 0 HA SER A 163 75.483 15.208 -17.293 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.572 18.101 -16.912 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.813 17.574 -18.032 1.00 25.00 H new ATOM 0 HG SER A 163 73.016 16.966 -18.092 1.00 25.00 H new ATOM 1310 N TYR A 164 75.892 16.601 -14.408 1.00 25.00 N ATOM 1311 CA TYR A 164 76.871 16.861 -13.351 1.00 25.00 C ATOM 1312 C TYR A 164 77.085 15.617 -12.501 1.00 25.00 C ATOM 1313 O TYR A 164 77.900 15.607 -11.580 1.00 25.00 O ATOM 1314 CB TYR A 164 76.399 18.010 -12.470 1.00 25.00 C ATOM 1315 CG TYR A 164 76.462 19.347 -13.151 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.686 20.036 -13.256 1.00 25.00 C ATOM 1317 CD2 TYR A 164 75.301 19.941 -13.689 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.753 21.303 -13.874 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.365 21.212 -14.307 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.593 21.884 -14.384 1.00 25.00 C ATOM 1321 OH TYR A 164 76.692 23.117 -14.961 1.00 25.00 O ATOM 0 H TYR A 164 74.922 16.606 -14.093 1.00 25.00 H new ATOM 0 HA TYR A 164 77.817 17.133 -13.820 1.00 25.00 H new ATOM 0 HB2 TYR A 164 75.373 17.819 -12.155 1.00 25.00 H new ATOM 0 HB3 TYR A 164 77.009 18.041 -11.567 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.585 19.589 -12.858 1.00 25.00 H new ATOM 0 HD2 TYR A 164 74.356 19.421 -13.629 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.698 21.820 -13.951 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.473 21.662 -14.717 1.00 25.00 H new ATOM 0 HH TYR A 164 75.795 23.461 -15.154 1.00 25.00 H new ATOM 1331 N GLY A 165 76.341 14.566 -12.815 1.00 25.00 N ATOM 1332 CA GLY A 165 76.438 13.334 -12.061 1.00 25.00 C ATOM 1333 C GLY A 165 75.658 13.351 -10.762 1.00 25.00 C ATOM 1334 O GLY A 165 75.975 12.577 -9.864 1.00 25.00 O ATOM 0 H GLY A 165 75.669 14.545 -13.582 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.079 12.511 -12.679 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.487 13.134 -11.842 1.00 25.00 H new ATOM 1338 N LEU A 166 74.634 14.199 -10.654 1.00 25.00 N ATOM 1339 CA LEU A 166 73.816 14.232 -9.435 1.00 25.00 C ATOM 1340 C LEU A 166 72.970 12.963 -9.344 1.00 25.00 C ATOM 1341 O LEU A 166 71.833 12.917 -9.808 1.00 25.00 O ATOM 1342 CB LEU A 166 72.887 15.454 -9.419 1.00 25.00 C ATOM 1343 CG LEU A 166 73.332 16.755 -8.744 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.604 16.539 -7.259 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.530 17.369 -9.420 1.00 25.00 C ATOM 0 H LEU A 166 74.353 14.860 -11.378 1.00 25.00 H new ATOM 0 HA LEU A 166 74.491 14.296 -8.582 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.651 15.693 -10.456 1.00 25.00 H new ATOM 0 HB3 LEU A 166 71.956 15.145 -8.943 1.00 25.00 H new ATOM 0 HG LEU A 166 72.507 17.460 -8.846 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.918 17.479 -6.806 1.00 25.00 H new ATOM 0 HD12 LEU A 166 72.696 16.186 -6.770 1.00 25.00 H new ATOM 0 HD13 LEU A 166 74.393 15.797 -7.138 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.807 18.289 -8.905 1.00 25.00 H new ATOM 0 HD22 LEU A 166 75.365 16.669 -9.387 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.286 17.594 -10.458 1.00 25.00 H new ATOM 1357 N LYS A 167 73.554 11.919 -8.782 1.00 25.00 N ATOM 1358 CA LYS A 167 72.864 10.650 -8.612 1.00 25.00 C ATOM 1359 C LYS A 167 71.952 10.688 -7.386 1.00 25.00 C ATOM 1360 O LYS A 167 72.073 11.547 -6.520 1.00 25.00 O ATOM 1361 CB LYS A 167 73.868 9.499 -8.507 1.00 25.00 C ATOM 1362 CG LYS A 167 74.861 9.620 -7.345 1.00 25.00 C ATOM 1363 CD LYS A 167 75.211 8.265 -6.763 1.00 25.00 C ATOM 1364 CE LYS A 167 74.069 7.779 -5.885 1.00 25.00 C ATOM 1365 NZ LYS A 167 74.249 6.427 -5.299 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.512 11.925 -8.433 1.00 25.00 H new ATOM 0 HA LYS A 167 72.242 10.480 -9.491 1.00 25.00 H new ATOM 0 HB2 LYS A 167 73.318 8.564 -8.402 1.00 25.00 H new ATOM 0 HB3 LYS A 167 74.427 9.436 -9.440 1.00 25.00 H new ATOM 0 HG2 LYS A 167 75.769 10.112 -7.692 1.00 25.00 H new ATOM 0 HG3 LYS A 167 74.434 10.251 -6.566 1.00 25.00 H new ATOM 0 HD2 LYS A 167 75.397 7.550 -7.565 1.00 25.00 H new ATOM 0 HD3 LYS A 167 76.129 8.334 -6.179 1.00 25.00 H new ATOM 0 HE2 LYS A 167 73.928 8.493 -5.073 1.00 25.00 H new ATOM 0 HE3 LYS A 167 73.153 7.782 -6.475 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 73.420 6.187 -4.719 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 74.351 5.728 -6.063 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 75.102 6.417 -4.704 1.00 25.00 H new ATOM 1379 N ASP A 168 71.036 9.736 -7.322 1.00 25.00 N ATOM 1380 CA ASP A 168 70.073 9.645 -6.224 1.00 25.00 C ATOM 1381 C ASP A 168 70.760 9.572 -4.860 1.00 25.00 C ATOM 1382 O ASP A 168 71.572 8.691 -4.594 1.00 25.00 O ATOM 1383 CB ASP A 168 69.159 8.416 -6.418 1.00 25.00 C ATOM 1384 CG ASP A 168 69.934 7.099 -6.545 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.749 6.961 -7.499 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.651 6.164 -5.773 1.00 25.00 O1- ATOM 0 H ASP A 168 70.935 9.004 -8.025 1.00 25.00 H new ATOM 0 HA ASP A 168 69.473 10.555 -6.243 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.472 8.346 -5.575 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.552 8.560 -7.312 1.00 25.00 H new ATOM 1391 N GLY A 169 70.427 10.524 -4.002 1.00 25.00 N ATOM 1392 CA GLY A 169 71.009 10.587 -2.673 1.00 25.00 C ATOM 1393 C GLY A 169 72.111 11.625 -2.544 1.00 25.00 C ATOM 1394 O GLY A 169 72.572 11.887 -1.430 1.00 25.00 O ATOM 0 H GLY A 169 69.755 11.264 -4.204 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.224 10.810 -1.951 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.411 9.607 -2.414 1.00 25.00 H new ATOM 1398 N ASP A 170 72.530 12.238 -3.650 1.00 25.00 N ATOM 1399 CA ASP A 170 73.544 13.293 -3.574 1.00 25.00 C ATOM 1400 C ASP A 170 72.942 14.528 -2.902 1.00 25.00 C ATOM 1401 O ASP A 170 71.719 14.721 -2.870 1.00 25.00 O ATOM 1402 CB ASP A 170 74.060 13.683 -4.965 1.00 25.00 C ATOM 1403 CG ASP A 170 75.090 12.702 -5.509 1.00 25.00 C ATOM 1404 OD1 ASP A 170 75.603 11.856 -4.741 1.00 25.00 O ATOM 1405 OD2 ASP A 170 75.434 12.828 -6.698 1.00 25.00 O1- ATOM 0 H ASP A 170 72.193 12.030 -4.590 1.00 25.00 H new ATOM 0 HA ASP A 170 74.383 12.910 -2.993 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.219 13.741 -5.656 1.00 25.00 H new ATOM 0 HB3 ASP A 170 74.502 14.678 -4.918 1.00 25.00 H new ATOM 1410 N VAL A 171 73.814 15.373 -2.364 1.00 25.00 N ATOM 1411 CA VAL A 171 73.398 16.574 -1.643 1.00 25.00 C ATOM 1412 C VAL A 171 74.097 17.807 -2.228 1.00 25.00 C ATOM 1413 O VAL A 171 75.275 17.748 -2.610 1.00 25.00 O ATOM 1414 CB VAL A 171 73.686 16.408 -0.101 1.00 25.00 C ATOM 1415 CG1 VAL A 171 75.159 16.069 0.163 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.279 17.670 0.691 1.00 25.00 C ATOM 0 H VAL A 171 74.825 15.247 -2.414 1.00 25.00 H new ATOM 0 HA VAL A 171 72.324 16.717 -1.762 1.00 25.00 H new ATOM 0 HB VAL A 171 73.075 15.575 0.247 1.00 25.00 H new ATOM 0 HG11 VAL A 171 75.321 15.962 1.236 1.00 25.00 H new ATOM 0 HG12 VAL A 171 75.413 15.134 -0.337 1.00 25.00 H new ATOM 0 HG13 VAL A 171 75.791 16.870 -0.221 1.00 25.00 H new ATOM 0 HG21 VAL A 171 73.492 17.520 1.749 1.00 25.00 H new ATOM 0 HG22 VAL A 171 73.845 18.527 0.325 1.00 25.00 H new ATOM 0 HG23 VAL A 171 72.213 17.855 0.558 1.00 25.00 H new ATOM 1426 N VAL A 172 73.375 18.920 -2.304 1.00 25.00 N ATOM 1427 CA VAL A 172 73.953 20.178 -2.765 1.00 25.00 C ATOM 1428 C VAL A 172 73.863 21.165 -1.613 1.00 25.00 C ATOM 1429 O VAL A 172 73.068 20.974 -0.687 1.00 25.00 O ATOM 1430 CB VAL A 172 73.225 20.740 -4.030 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.336 19.748 -5.187 1.00 25.00 C ATOM 1432 CG2 VAL A 172 71.748 21.027 -3.750 1.00 25.00 C ATOM 0 H VAL A 172 72.388 18.977 -2.052 1.00 25.00 H new ATOM 0 HA VAL A 172 74.988 20.013 -3.063 1.00 25.00 H new ATOM 0 HB VAL A 172 73.712 21.677 -4.298 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.825 20.151 -6.062 1.00 25.00 H new ATOM 0 HG12 VAL A 172 74.387 19.582 -5.425 1.00 25.00 H new ATOM 0 HG13 VAL A 172 72.875 18.803 -4.901 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.276 21.416 -4.652 1.00 25.00 H new ATOM 0 HG22 VAL A 172 71.249 20.106 -3.448 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.666 21.764 -2.951 1.00 25.00 H new ATOM 1442 N ILE A 173 74.677 22.204 -1.644 1.00 25.00 N ATOM 1443 CA ILE A 173 74.684 23.207 -0.590 1.00 25.00 C ATOM 1444 C ILE A 173 74.228 24.525 -1.193 1.00 25.00 C ATOM 1445 O ILE A 173 74.835 25.030 -2.128 1.00 25.00 O ATOM 1446 CB ILE A 173 76.100 23.379 0.056 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.656 22.006 0.514 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.010 24.351 1.261 1.00 25.00 C ATOM 1449 CD1 ILE A 173 78.132 22.034 0.966 1.00 25.00 C ATOM 0 H ILE A 173 75.347 22.378 -2.393 1.00 25.00 H new ATOM 0 HA ILE A 173 74.012 22.884 0.205 1.00 25.00 H new ATOM 0 HB ILE A 173 76.780 23.794 -0.688 1.00 25.00 H new ATOM 0 HG12 ILE A 173 76.044 21.636 1.336 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.553 21.294 -0.305 1.00 25.00 H new ATOM 0 HG21 ILE A 173 76.997 24.468 1.708 1.00 25.00 H new ATOM 0 HG22 ILE A 173 75.648 25.321 0.920 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.321 23.948 2.003 1.00 25.00 H new ATOM 0 HD11 ILE A 173 78.439 21.033 1.269 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.759 22.371 0.141 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.242 22.718 1.808 1.00 25.00 H new ATOM 1461 N LEU A 174 73.156 25.074 -0.664 1.00 25.00 N ATOM 1462 CA LEU A 174 72.634 26.353 -1.113 1.00 25.00 C ATOM 1463 C LEU A 174 73.166 27.367 -0.104 1.00 25.00 C ATOM 1464 O LEU A 174 72.975 27.195 1.081 1.00 25.00 O ATOM 1465 CB LEU A 174 71.098 26.297 -1.102 1.00 25.00 C ATOM 1466 CG LEU A 174 70.322 27.117 -2.141 1.00 25.00 C ATOM 1467 CD1 LEU A 174 68.820 26.898 -1.940 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.640 28.584 -2.015 1.00 25.00 C ATOM 0 H LEU A 174 72.619 24.648 0.091 1.00 25.00 H new ATOM 0 HA LEU A 174 72.936 26.615 -2.127 1.00 25.00 H new ATOM 0 HB2 LEU A 174 70.805 25.254 -1.219 1.00 25.00 H new ATOM 0 HB3 LEU A 174 70.763 26.614 -0.114 1.00 25.00 H new ATOM 0 HG LEU A 174 70.617 26.786 -3.137 1.00 25.00 H new ATOM 0 HD11 LEU A 174 68.266 27.479 -2.677 1.00 25.00 H new ATOM 0 HD12 LEU A 174 68.587 25.840 -2.062 1.00 25.00 H new ATOM 0 HD13 LEU A 174 68.537 27.218 -0.937 1.00 25.00 H new ATOM 0 HD21 LEU A 174 70.078 29.144 -2.762 1.00 25.00 H new ATOM 0 HD22 LEU A 174 70.366 28.932 -1.019 1.00 25.00 H new ATOM 0 HD23 LEU A 174 71.707 28.740 -2.172 1.00 25.00 H new ATOM 1480 N ARG A 175 73.884 28.388 -0.545 1.00 25.00 N ATOM 1481 CA ARG A 175 74.481 29.360 0.382 1.00 25.00 C ATOM 1482 C ARG A 175 73.933 30.750 0.150 1.00 25.00 C ATOM 1483 O ARG A 175 74.134 31.327 -0.909 1.00 25.00 O ATOM 1484 CB ARG A 175 76.006 29.378 0.231 1.00 25.00 C ATOM 1485 CG ARG A 175 76.670 28.083 0.666 1.00 25.00 C ATOM 1486 CD ARG A 175 78.187 28.198 0.609 1.00 25.00 C ATOM 1487 NE ARG A 175 78.841 26.990 1.138 1.00 25.00 N ATOM 1488 CZ ARG A 175 80.155 26.803 1.225 1.00 25.00 C ATOM 1489 NH1 ARG A 175 81.026 27.699 0.825 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.604 25.687 1.730 1.00 25.00 N ATOM 0 H ARG A 175 74.072 28.572 -1.531 1.00 25.00 H new ATOM 0 HA ARG A 175 74.221 29.051 1.394 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.258 29.575 -0.811 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.412 30.201 0.819 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.359 27.834 1.681 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.340 27.268 0.023 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.502 28.361 -0.422 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.509 29.068 1.182 1.00 25.00 H new ATOM 0 HE ARG A 175 78.238 26.235 1.464 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.704 28.582 0.428 1.00 25.00 H new ATOM 0 HH12 ARG A 175 82.025 27.513 0.911 1.00 25.00 H new ATOM 0 HH21 ARG A 175 79.950 24.973 2.051 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.609 25.528 1.804 1.00 25.00 H new ATOM 1504 N GLN A 176 73.258 31.299 1.162 1.00 25.00 N ATOM 1505 CA GLN A 176 72.725 32.670 1.113 1.00 25.00 C ATOM 1506 C GLN A 176 73.615 33.645 1.907 1.00 25.00 C ATOM 1507 O GLN A 176 73.427 34.034 3.054 1.00 25.00 O ATOM 1508 CB GLN A 176 71.248 32.737 1.557 1.00 25.00 C ATOM 1509 CG GLN A 176 70.631 34.080 1.092 1.00 25.00 C ATOM 1510 CD GLN A 176 69.242 34.285 1.610 1.00 25.00 C ATOM 1511 OE1 GLN A 176 68.848 33.841 2.656 1.00 25.00 O ATOM 1512 NE2 GLN A 176 68.454 35.034 0.859 1.00 25.00 N ATOM 1513 OXT GLN A 176 74.581 33.996 1.288 1.00 25.00 O ATOM 0 H GLN A 176 73.064 30.812 2.037 1.00 25.00 H new ATOM 0 HA GLN A 176 72.746 32.988 0.071 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.691 31.902 1.132 1.00 25.00 H new ATOM 0 HB3 GLN A 176 71.178 32.648 2.641 1.00 25.00 H new ATOM 0 HG2 GLN A 176 71.264 34.902 1.426 1.00 25.00 H new ATOM 0 HG3 GLN A 176 70.617 34.111 0.003 1.00 25.00 H new ATOM 0 HE21 GLN A 176 68.797 35.406 -0.027 1.00 25.00 H new ATOM 0 HE22 GLN A 176 67.503 35.240 1.165 1.00 25.00 H new TER 1523 GLN A 176