USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1145 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 Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 149:sc= 1.18 (180deg=0.215) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 31 MET CE :methyl -177:sc= 0 (180deg=-0.0213) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 CYS SG : rot 26:sc= 0.491 USER MOD Single : A 37 GLN : amide:sc= -0.13 K(o=-0.13,f=-1.8) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 56 ASN : amide:sc= 0.673 K(o=0.67,f=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -169:sc= 0.604 (180deg=0.535) USER MOD Single : A 67 THR OG1 : rot -54:sc= 0.603 USER MOD Single : A 68 MET CE :methyl 165:sc=-0.00015 (180deg=-0.0851) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl 140:sc= -0.23 (180deg=-0.584) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot -91:sc= 0.0051 USER MOD Single : A 80 GLN : amide:sc= -0.294 X(o=-0.29,f=0) USER MOD Single : A 81 THR OG1 : rot 110:sc= 0.132 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 MET CE :methyl 161:sc= -0.0852 (180deg=-0.569) USER MOD Single : A 90 LYS NZ :NH3+ 148:sc= 1.3 (180deg=0.623) USER MOD Single : A 91 HIS : no HE2:sc= -3.69! K(o=-3.7!,f=-4.7) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 HIS : no HD1:sc= -0.394 K(o=-0.39,f=-1.8!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.105 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 164:sc= 0.765 (180deg=0.624) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 80:sc= 0.292 USER MOD Single : A 131 HIS : no HD1:sc= -0.052 X(o=-0.052,f=-0.32) USER MOD Single : A 132 HIS : no HE2:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 134 HIS : no HE2:sc= 0.5 K(o=0.5,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 13.830 -48.304 30.716 1.00 0.00 N ATOM 2 CA PRO A 1 12.855 -47.232 30.453 1.00 0.00 C ATOM 3 C PRO A 1 11.422 -47.772 30.502 1.00 0.00 C ATOM 4 O PRO A 1 11.178 -48.893 30.062 1.00 0.00 O ATOM 5 CB PRO A 1 13.196 -46.694 29.056 1.00 0.00 C ATOM 6 CG PRO A 1 13.788 -47.915 28.336 1.00 0.00 C ATOM 7 CD PRO A 1 14.507 -48.667 29.459 1.00 0.00 C ATOM 0 H2 PRO A 1 13.358 -49.119 31.108 1.00 0.00 H new ATOM 0 H3 PRO A 1 14.514 -47.994 31.406 1.00 0.00 H new ATOM 0 HA PRO A 1 12.910 -46.446 31.206 1.00 0.00 H new ATOM 0 HB2 PRO A 1 12.311 -46.317 28.544 1.00 0.00 H new ATOM 0 HB3 PRO A 1 13.910 -45.872 29.106 1.00 0.00 H new ATOM 0 HG2 PRO A 1 13.012 -48.526 27.874 1.00 0.00 H new ATOM 0 HG3 PRO A 1 14.476 -47.621 27.543 1.00 0.00 H new ATOM 0 HD2 PRO A 1 14.463 -49.743 29.293 1.00 0.00 H new ATOM 0 HD3 PRO A 1 15.561 -48.393 29.495 1.00 0.00 H new ATOM 15 N ALA A 2 10.484 -46.994 31.047 1.00 0.00 N ATOM 16 CA ALA A 2 9.074 -47.342 31.162 1.00 0.00 C ATOM 17 C ALA A 2 8.263 -46.054 31.008 1.00 0.00 C ATOM 18 O ALA A 2 8.812 -44.963 31.182 1.00 0.00 O ATOM 19 CB ALA A 2 8.807 -47.989 32.527 1.00 0.00 C ATOM 0 H ALA A 2 10.697 -46.074 31.432 1.00 0.00 H new ATOM 0 HA ALA A 2 8.788 -48.057 30.391 1.00 0.00 H new ATOM 0 HB1 ALA A 2 7.751 -48.247 32.607 1.00 0.00 H new ATOM 0 HB2 ALA A 2 9.410 -48.892 32.626 1.00 0.00 H new ATOM 0 HB3 ALA A 2 9.070 -47.288 33.319 1.00 0.00 H new ATOM 25 N ALA A 3 6.990 -46.180 30.632 1.00 0.00 N ATOM 26 CA ALA A 3 6.106 -45.034 30.467 1.00 0.00 C ATOM 27 C ALA A 3 5.677 -44.528 31.848 1.00 0.00 C ATOM 28 O ALA A 3 5.795 -45.243 32.844 1.00 0.00 O ATOM 29 CB ALA A 3 4.883 -45.448 29.639 1.00 0.00 C ATOM 0 H ALA A 3 6.547 -47.077 30.435 1.00 0.00 H new ATOM 0 HA ALA A 3 6.626 -44.232 29.943 1.00 0.00 H new ATOM 0 HB1 ALA A 3 4.221 -44.591 29.515 1.00 0.00 H new ATOM 0 HB2 ALA A 3 5.209 -45.800 28.660 1.00 0.00 H new ATOM 0 HB3 ALA A 3 4.349 -46.248 30.153 1.00 0.00 H new ATOM 35 N SER A 4 5.170 -43.301 31.917 1.00 0.00 N ATOM 36 CA SER A 4 4.702 -42.675 33.147 1.00 0.00 C ATOM 37 C SER A 4 3.690 -41.582 32.775 1.00 0.00 C ATOM 38 O SER A 4 3.745 -41.068 31.653 1.00 0.00 O ATOM 39 CB SER A 4 5.884 -42.112 33.966 1.00 0.00 C ATOM 40 OG SER A 4 7.082 -41.962 33.220 1.00 0.00 O ATOM 0 H SER A 4 5.071 -42.700 31.098 1.00 0.00 H new ATOM 0 HA SER A 4 4.214 -43.414 33.782 1.00 0.00 H new ATOM 0 HB2 SER A 4 5.600 -41.143 34.377 1.00 0.00 H new ATOM 0 HB3 SER A 4 6.075 -42.773 34.812 1.00 0.00 H new ATOM 0 HG SER A 4 7.785 -41.601 33.799 1.00 0.00 H new ATOM 46 N PRO A 5 2.741 -41.243 33.665 1.00 0.00 N ATOM 47 CA PRO A 5 1.754 -40.208 33.396 1.00 0.00 C ATOM 48 C PRO A 5 2.394 -38.823 33.564 1.00 0.00 C ATOM 49 O PRO A 5 3.486 -38.687 34.116 1.00 0.00 O ATOM 50 CB PRO A 5 0.656 -40.445 34.437 1.00 0.00 C ATOM 51 CG PRO A 5 1.441 -40.959 35.644 1.00 0.00 C ATOM 52 CD PRO A 5 2.564 -41.781 35.007 1.00 0.00 C ATOM 0 HA PRO A 5 1.360 -40.246 32.381 1.00 0.00 H new ATOM 0 HB2 PRO A 5 0.113 -39.529 34.668 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -0.078 -41.173 34.092 1.00 0.00 H new ATOM 0 HG2 PRO A 5 1.834 -40.140 36.247 1.00 0.00 H new ATOM 0 HG3 PRO A 5 0.818 -41.568 36.300 1.00 0.00 H new ATOM 0 HD2 PRO A 5 3.484 -41.699 35.585 1.00 0.00 H new ATOM 0 HD3 PRO A 5 2.303 -42.839 34.972 1.00 0.00 H new ATOM 60 N SER A 6 1.708 -37.782 33.103 1.00 0.00 N ATOM 61 CA SER A 6 2.159 -36.402 33.199 1.00 0.00 C ATOM 62 C SER A 6 0.920 -35.505 33.274 1.00 0.00 C ATOM 63 O SER A 6 -0.183 -35.930 32.920 1.00 0.00 O ATOM 64 CB SER A 6 3.082 -36.067 32.015 1.00 0.00 C ATOM 65 OG SER A 6 2.586 -36.569 30.789 1.00 0.00 O ATOM 0 H SER A 6 0.803 -37.879 32.642 1.00 0.00 H new ATOM 0 HA SER A 6 2.752 -36.236 34.098 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.198 -34.986 31.942 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.073 -36.482 32.201 1.00 0.00 H new ATOM 0 HG SER A 6 3.202 -36.332 30.065 1.00 0.00 H new ATOM 71 N ALA A 7 1.084 -34.272 33.755 1.00 0.00 N ATOM 72 CA ALA A 7 0.016 -33.297 33.892 1.00 0.00 C ATOM 73 C ALA A 7 0.636 -31.927 33.656 1.00 0.00 C ATOM 74 O ALA A 7 1.464 -31.491 34.452 1.00 0.00 O ATOM 75 CB ALA A 7 -0.608 -33.395 35.290 1.00 0.00 C ATOM 0 H ALA A 7 1.989 -33.921 34.067 1.00 0.00 H new ATOM 0 HA ALA A 7 -0.783 -33.476 33.173 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -1.408 -32.660 35.384 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -1.015 -34.395 35.437 1.00 0.00 H new ATOM 0 HB3 ALA A 7 0.155 -33.199 36.043 1.00 0.00 H new ATOM 81 N LEU A 8 0.291 -31.275 32.545 1.00 0.00 N ATOM 82 CA LEU A 8 0.799 -29.955 32.178 1.00 0.00 C ATOM 83 C LEU A 8 -0.346 -29.117 31.612 1.00 0.00 C ATOM 84 O LEU A 8 -1.442 -29.633 31.364 1.00 0.00 O ATOM 85 CB LEU A 8 1.947 -30.082 31.154 1.00 0.00 C ATOM 86 CG LEU A 8 3.254 -30.682 31.715 1.00 0.00 C ATOM 87 CD1 LEU A 8 4.240 -30.919 30.565 1.00 0.00 C ATOM 88 CD2 LEU A 8 3.917 -29.762 32.750 1.00 0.00 C ATOM 0 H LEU A 8 -0.363 -31.658 31.862 1.00 0.00 H new ATOM 0 HA LEU A 8 1.199 -29.461 33.063 1.00 0.00 H new ATOM 0 HB2 LEU A 8 1.607 -30.701 30.324 1.00 0.00 H new ATOM 0 HB3 LEU A 8 2.163 -29.094 30.747 1.00 0.00 H new ATOM 0 HG LEU A 8 2.997 -31.619 32.209 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.164 -31.343 30.959 1.00 0.00 H new ATOM 0 HD12 LEU A 8 3.801 -31.611 29.846 1.00 0.00 H new ATOM 0 HD13 LEU A 8 4.457 -29.972 30.071 1.00 0.00 H new ATOM 0 HD21 LEU A 8 4.833 -30.226 33.116 1.00 0.00 H new ATOM 0 HD22 LEU A 8 4.156 -28.805 32.286 1.00 0.00 H new ATOM 0 HD23 LEU A 8 3.234 -29.600 33.584 1.00 0.00 H new ATOM 100 N LYS A 9 -0.102 -27.814 31.473 1.00 0.00 N ATOM 101 CA LYS A 9 -0.992 -26.779 30.953 1.00 0.00 C ATOM 102 C LYS A 9 -0.110 -25.743 30.249 1.00 0.00 C ATOM 103 O LYS A 9 1.114 -25.773 30.398 1.00 0.00 O ATOM 104 CB LYS A 9 -1.781 -26.094 32.099 1.00 0.00 C ATOM 105 CG LYS A 9 -3.207 -26.626 32.294 1.00 0.00 C ATOM 106 CD LYS A 9 -3.301 -27.799 33.282 1.00 0.00 C ATOM 107 CE LYS A 9 -4.447 -28.753 32.928 1.00 0.00 C ATOM 108 NZ LYS A 9 -4.224 -29.461 31.648 1.00 0.00 N ATOM 0 H LYS A 9 0.800 -27.424 31.745 1.00 0.00 H new ATOM 0 HA LYS A 9 -1.719 -27.219 30.270 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -1.229 -26.221 33.030 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -1.830 -25.023 31.901 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -3.843 -25.814 32.647 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -3.602 -26.943 31.329 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.359 -28.348 33.285 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -3.448 -27.413 34.291 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -4.566 -29.484 33.727 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -5.379 -28.190 32.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -4.671 -30.399 31.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -4.641 -28.911 30.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -3.203 -29.571 31.485 1.00 0.00 H new ATOM 122 N GLY A 10 -0.729 -24.820 29.519 1.00 0.00 N ATOM 123 CA GLY A 10 -0.093 -23.741 28.792 1.00 0.00 C ATOM 124 C GLY A 10 -1.138 -22.648 28.593 1.00 0.00 C ATOM 125 O GLY A 10 -2.341 -22.909 28.715 1.00 0.00 O ATOM 0 H GLY A 10 -1.744 -24.810 29.417 1.00 0.00 H new ATOM 0 HA2 GLY A 10 0.763 -23.357 29.346 1.00 0.00 H new ATOM 0 HA3 GLY A 10 0.281 -24.094 27.831 1.00 0.00 H new ATOM 129 N VAL A 11 -0.693 -21.425 28.324 1.00 0.00 N ATOM 130 CA VAL A 11 -1.518 -20.234 28.099 1.00 0.00 C ATOM 131 C VAL A 11 -0.595 -19.126 27.573 1.00 0.00 C ATOM 132 O VAL A 11 0.587 -19.100 27.933 1.00 0.00 O ATOM 133 CB VAL A 11 -2.256 -19.840 29.410 1.00 0.00 C ATOM 134 CG1 VAL A 11 -1.326 -19.534 30.595 1.00 0.00 C ATOM 135 CG2 VAL A 11 -3.221 -18.666 29.228 1.00 0.00 C ATOM 0 H VAL A 11 0.304 -21.223 28.252 1.00 0.00 H new ATOM 0 HA VAL A 11 -2.298 -20.418 27.360 1.00 0.00 H new ATOM 0 HB VAL A 11 -2.823 -20.739 29.651 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.923 -19.269 31.467 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -0.724 -20.414 30.822 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.670 -18.702 30.338 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -3.704 -18.441 30.179 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -2.669 -17.791 28.885 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -3.979 -18.929 28.490 1.00 0.00 H new ATOM 145 N SER A 12 -1.117 -18.184 26.785 1.00 0.00 N ATOM 146 CA SER A 12 -0.353 -17.075 26.219 1.00 0.00 C ATOM 147 C SER A 12 -0.854 -15.691 26.606 1.00 0.00 C ATOM 148 O SER A 12 -0.202 -14.704 26.288 1.00 0.00 O ATOM 149 CB SER A 12 -0.191 -17.264 24.703 1.00 0.00 C ATOM 150 OG SER A 12 -1.393 -17.685 24.078 1.00 0.00 O ATOM 0 H SER A 12 -2.101 -18.172 26.518 1.00 0.00 H new ATOM 0 HA SER A 12 0.636 -17.111 26.676 1.00 0.00 H new ATOM 0 HB2 SER A 12 0.138 -16.326 24.256 1.00 0.00 H new ATOM 0 HB3 SER A 12 0.591 -17.999 24.513 1.00 0.00 H new ATOM 0 HG SER A 12 -1.242 -17.790 23.115 1.00 0.00 H new ATOM 156 N GLN A 13 -1.915 -15.641 27.401 1.00 0.00 N ATOM 157 CA GLN A 13 -2.574 -14.449 27.924 1.00 0.00 C ATOM 158 C GLN A 13 -1.531 -13.456 28.447 1.00 0.00 C ATOM 159 O GLN A 13 -1.261 -12.420 27.844 1.00 0.00 O ATOM 160 CB GLN A 13 -3.534 -14.914 29.041 1.00 0.00 C ATOM 161 CG GLN A 13 -4.252 -13.810 29.833 1.00 0.00 C ATOM 162 CD GLN A 13 -4.679 -14.338 31.203 1.00 0.00 C ATOM 163 OE1 GLN A 13 -5.467 -15.279 31.305 1.00 0.00 O ATOM 164 NE2 GLN A 13 -4.156 -13.787 32.289 1.00 0.00 N ATOM 0 H GLN A 13 -2.372 -16.495 27.721 1.00 0.00 H new ATOM 0 HA GLN A 13 -3.136 -13.932 27.147 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -4.290 -15.560 28.594 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -2.968 -15.525 29.744 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -3.592 -12.952 29.955 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -5.125 -13.464 29.280 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -3.504 -13.008 32.202 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -4.406 -14.142 33.212 1.00 0.00 H new ATOM 173 N ALA A 14 -0.894 -13.830 29.557 1.00 0.00 N ATOM 174 CA ALA A 14 0.099 -13.004 30.215 1.00 0.00 C ATOM 175 C ALA A 14 1.340 -12.780 29.363 1.00 0.00 C ATOM 176 O ALA A 14 2.014 -11.767 29.540 1.00 0.00 O ATOM 177 CB ALA A 14 0.490 -13.663 31.538 1.00 0.00 C ATOM 0 H ALA A 14 -1.059 -14.723 30.022 1.00 0.00 H new ATOM 0 HA ALA A 14 -0.345 -12.023 30.386 1.00 0.00 H new ATOM 0 HB1 ALA A 14 1.237 -13.051 32.043 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -0.391 -13.756 32.172 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.903 -14.653 31.343 1.00 0.00 H new ATOM 183 N LEU A 15 1.680 -13.735 28.494 1.00 0.00 N ATOM 184 CA LEU A 15 2.849 -13.649 27.628 1.00 0.00 C ATOM 185 C LEU A 15 2.680 -12.536 26.605 1.00 0.00 C ATOM 186 O LEU A 15 3.662 -11.853 26.315 1.00 0.00 O ATOM 187 CB LEU A 15 3.122 -14.983 26.916 1.00 0.00 C ATOM 188 CG LEU A 15 3.349 -16.179 27.852 1.00 0.00 C ATOM 189 CD1 LEU A 15 3.691 -17.409 27.011 1.00 0.00 C ATOM 190 CD2 LEU A 15 4.479 -15.931 28.857 1.00 0.00 C ATOM 0 H LEU A 15 1.145 -14.595 28.374 1.00 0.00 H new ATOM 0 HA LEU A 15 3.707 -13.421 28.260 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.281 -15.207 26.260 1.00 0.00 H new ATOM 0 HB3 LEU A 15 3.999 -14.866 26.280 1.00 0.00 H new ATOM 0 HG LEU A 15 2.432 -16.333 28.420 1.00 0.00 H new ATOM 0 HD11 LEU A 15 3.854 -18.264 27.667 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.867 -17.625 26.331 1.00 0.00 H new ATOM 0 HD13 LEU A 15 4.596 -17.216 26.435 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.598 -16.807 29.494 1.00 0.00 H new ATOM 0 HD22 LEU A 15 5.409 -15.744 28.320 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.235 -15.065 29.472 1.00 0.00 H new ATOM 202 N LEU A 16 1.473 -12.376 26.059 1.00 0.00 N ATOM 203 CA LEU A 16 1.154 -11.350 25.081 1.00 0.00 C ATOM 204 C LEU A 16 1.216 -9.999 25.776 1.00 0.00 C ATOM 205 O LEU A 16 1.926 -9.114 25.315 1.00 0.00 O ATOM 206 CB LEU A 16 -0.230 -11.598 24.459 1.00 0.00 C ATOM 207 CG LEU A 16 -0.239 -12.788 23.480 1.00 0.00 C ATOM 208 CD1 LEU A 16 -1.674 -13.196 23.156 1.00 0.00 C ATOM 209 CD2 LEU A 16 0.511 -12.469 22.178 1.00 0.00 C ATOM 0 H LEU A 16 0.678 -12.971 26.293 1.00 0.00 H new ATOM 0 HA LEU A 16 1.875 -11.374 24.264 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.953 -11.782 25.254 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.554 -10.699 23.934 1.00 0.00 H new ATOM 0 HG LEU A 16 0.277 -13.613 23.971 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.665 -14.038 22.463 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.186 -13.486 24.074 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -2.197 -12.356 22.699 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.479 -13.336 21.518 1.00 0.00 H new ATOM 0 HD22 LEU A 16 0.038 -11.620 21.685 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.548 -12.225 22.406 1.00 0.00 H new ATOM 221 N GLU A 17 0.562 -9.862 26.929 1.00 0.00 N ATOM 222 CA GLU A 17 0.553 -8.615 27.693 1.00 0.00 C ATOM 223 C GLU A 17 1.987 -8.171 28.020 1.00 0.00 C ATOM 224 O GLU A 17 2.336 -6.996 27.883 1.00 0.00 O ATOM 225 CB GLU A 17 -0.232 -8.827 28.990 1.00 0.00 C ATOM 226 CG GLU A 17 -1.717 -9.145 28.773 1.00 0.00 C ATOM 227 CD GLU A 17 -2.341 -9.505 30.115 1.00 0.00 C ATOM 228 OE1 GLU A 17 -2.500 -8.593 30.961 1.00 0.00 O ATOM 229 OE2 GLU A 17 -2.553 -10.701 30.405 1.00 0.00 O ATOM 0 H GLU A 17 0.023 -10.613 27.360 1.00 0.00 H new ATOM 0 HA GLU A 17 0.079 -7.836 27.096 1.00 0.00 H new ATOM 0 HB2 GLU A 17 0.226 -9.642 29.551 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -0.149 -7.931 29.604 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.227 -8.286 28.337 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.828 -9.971 28.071 1.00 0.00 H new ATOM 236 N ARG A 18 2.850 -9.118 28.416 1.00 0.00 N ATOM 237 CA ARG A 18 4.246 -8.840 28.752 1.00 0.00 C ATOM 238 C ARG A 18 5.045 -8.310 27.568 1.00 0.00 C ATOM 239 O ARG A 18 6.161 -7.838 27.795 1.00 0.00 O ATOM 240 CB ARG A 18 4.916 -10.110 29.296 1.00 0.00 C ATOM 241 CG ARG A 18 4.543 -10.391 30.753 1.00 0.00 C ATOM 242 CD ARG A 18 4.820 -11.851 31.124 1.00 0.00 C ATOM 243 NE ARG A 18 6.240 -12.197 30.998 1.00 0.00 N ATOM 244 CZ ARG A 18 7.242 -11.915 31.832 1.00 0.00 C ATOM 245 NH1 ARG A 18 7.028 -11.333 33.005 1.00 0.00 N ATOM 246 NH2 ARG A 18 8.483 -12.212 31.472 1.00 0.00 N ATOM 0 H ARG A 18 2.594 -10.101 28.511 1.00 0.00 H new ATOM 0 HA ARG A 18 4.239 -8.060 29.513 1.00 0.00 H new ATOM 0 HB2 ARG A 18 4.628 -10.962 28.680 1.00 0.00 H new ATOM 0 HB3 ARG A 18 5.998 -10.009 29.214 1.00 0.00 H new ATOM 0 HG2 ARG A 18 5.111 -9.732 31.410 1.00 0.00 H new ATOM 0 HG3 ARG A 18 3.488 -10.167 30.911 1.00 0.00 H new ATOM 0 HD2 ARG A 18 4.494 -12.032 32.148 1.00 0.00 H new ATOM 0 HD3 ARG A 18 4.230 -12.505 30.482 1.00 0.00 H new ATOM 0 HE ARG A 18 6.495 -12.723 30.162 1.00 0.00 H new ATOM 0 HH11 ARG A 18 6.079 -11.090 33.288 1.00 0.00 H new ATOM 0 HH12 ARG A 18 7.813 -11.129 33.624 1.00 0.00 H new ATOM 0 HH21 ARG A 18 8.661 -12.650 30.568 1.00 0.00 H new ATOM 0 HH22 ARG A 18 9.260 -12.002 32.099 1.00 0.00 H new ATOM 260 N ILE A 19 4.576 -8.414 26.322 1.00 0.00 N ATOM 261 CA ILE A 19 5.313 -7.906 25.162 1.00 0.00 C ATOM 262 C ILE A 19 5.571 -6.407 25.349 1.00 0.00 C ATOM 263 O ILE A 19 6.653 -5.947 24.980 1.00 0.00 O ATOM 264 CB ILE A 19 4.608 -8.255 23.826 1.00 0.00 C ATOM 265 CG1 ILE A 19 4.646 -9.789 23.626 1.00 0.00 C ATOM 266 CG2 ILE A 19 5.271 -7.557 22.623 1.00 0.00 C ATOM 267 CD1 ILE A 19 3.765 -10.311 22.488 1.00 0.00 C ATOM 0 H ILE A 19 3.683 -8.849 26.090 1.00 0.00 H new ATOM 0 HA ILE A 19 6.280 -8.404 25.098 1.00 0.00 H new ATOM 0 HB ILE A 19 3.579 -7.901 23.881 1.00 0.00 H new ATOM 0 HG12 ILE A 19 5.676 -10.091 23.437 1.00 0.00 H new ATOM 0 HG13 ILE A 19 4.338 -10.270 24.555 1.00 0.00 H new ATOM 0 HG21 ILE A 19 4.745 -7.830 21.708 1.00 0.00 H new ATOM 0 HG22 ILE A 19 5.226 -6.476 22.759 1.00 0.00 H new ATOM 0 HG23 ILE A 19 6.312 -7.870 22.549 1.00 0.00 H new ATOM 0 HD11 ILE A 19 3.857 -11.395 22.425 1.00 0.00 H new ATOM 0 HD12 ILE A 19 2.726 -10.046 22.682 1.00 0.00 H new ATOM 0 HD13 ILE A 19 4.084 -9.864 21.546 1.00 0.00 H new ATOM 279 N ARG A 20 4.674 -5.658 26.013 1.00 0.00 N ATOM 280 CA ARG A 20 4.862 -4.220 26.232 1.00 0.00 C ATOM 281 C ARG A 20 6.208 -3.895 26.884 1.00 0.00 C ATOM 282 O ARG A 20 6.804 -2.850 26.630 1.00 0.00 O ATOM 283 CB ARG A 20 3.666 -3.611 26.992 1.00 0.00 C ATOM 284 CG ARG A 20 3.547 -4.000 28.480 1.00 0.00 C ATOM 285 CD ARG A 20 4.141 -2.942 29.425 1.00 0.00 C ATOM 286 NE ARG A 20 3.216 -1.815 29.652 1.00 0.00 N ATOM 287 CZ ARG A 20 3.520 -0.554 29.989 1.00 0.00 C ATOM 288 NH1 ARG A 20 4.782 -0.145 30.077 1.00 0.00 N ATOM 289 NH2 ARG A 20 2.533 0.288 30.253 1.00 0.00 N ATOM 0 H ARG A 20 3.810 -6.030 26.407 1.00 0.00 H new ATOM 0 HA ARG A 20 4.893 -3.744 25.252 1.00 0.00 H new ATOM 0 HB2 ARG A 20 3.732 -2.525 26.924 1.00 0.00 H new ATOM 0 HB3 ARG A 20 2.748 -3.907 26.484 1.00 0.00 H new ATOM 0 HG2 ARG A 20 2.496 -4.152 28.728 1.00 0.00 H new ATOM 0 HG3 ARG A 20 4.054 -4.951 28.643 1.00 0.00 H new ATOM 0 HD2 ARG A 20 4.386 -3.407 30.380 1.00 0.00 H new ATOM 0 HD3 ARG A 20 5.074 -2.565 29.005 1.00 0.00 H new ATOM 0 HE ARG A 20 2.223 -2.021 29.539 1.00 0.00 H new ATOM 0 HH11 ARG A 20 5.544 -0.796 29.886 1.00 0.00 H new ATOM 0 HH12 ARG A 20 4.989 0.820 30.335 1.00 0.00 H new ATOM 0 HH21 ARG A 20 1.565 -0.028 30.198 1.00 0.00 H new ATOM 0 HH22 ARG A 20 2.741 1.253 30.512 1.00 0.00 H new ATOM 303 N ALA A 21 6.725 -4.799 27.716 1.00 0.00 N ATOM 304 CA ALA A 21 7.988 -4.595 28.400 1.00 0.00 C ATOM 305 C ALA A 21 9.208 -4.693 27.485 1.00 0.00 C ATOM 306 O ALA A 21 10.261 -4.155 27.824 1.00 0.00 O ATOM 307 CB ALA A 21 8.085 -5.613 29.534 1.00 0.00 C ATOM 0 H ALA A 21 6.276 -5.689 27.930 1.00 0.00 H new ATOM 0 HA ALA A 21 7.998 -3.575 28.784 1.00 0.00 H new ATOM 0 HB1 ALA A 21 9.028 -5.479 30.064 1.00 0.00 H new ATOM 0 HB2 ALA A 21 7.256 -5.467 30.226 1.00 0.00 H new ATOM 0 HB3 ALA A 21 8.040 -6.621 29.123 1.00 0.00 H new ATOM 313 N LYS A 22 9.110 -5.403 26.363 1.00 0.00 N ATOM 314 CA LYS A 22 10.204 -5.551 25.405 1.00 0.00 C ATOM 315 C LYS A 22 9.985 -4.562 24.270 1.00 0.00 C ATOM 316 O LYS A 22 10.945 -3.960 23.780 1.00 0.00 O ATOM 317 CB LYS A 22 10.256 -6.987 24.862 1.00 0.00 C ATOM 318 CG LYS A 22 10.937 -7.993 25.803 1.00 0.00 C ATOM 319 CD LYS A 22 10.224 -8.219 27.144 1.00 0.00 C ATOM 320 CE LYS A 22 10.726 -9.528 27.767 1.00 0.00 C ATOM 321 NZ LYS A 22 9.777 -10.096 28.747 1.00 0.00 N ATOM 0 H LYS A 22 8.260 -5.897 26.090 1.00 0.00 H new ATOM 0 HA LYS A 22 11.155 -5.348 25.897 1.00 0.00 H new ATOM 0 HB2 LYS A 22 9.239 -7.325 24.662 1.00 0.00 H new ATOM 0 HB3 LYS A 22 10.784 -6.984 23.908 1.00 0.00 H new ATOM 0 HG2 LYS A 22 11.020 -8.950 25.288 1.00 0.00 H new ATOM 0 HG3 LYS A 22 11.952 -7.650 26.003 1.00 0.00 H new ATOM 0 HD2 LYS A 22 10.417 -7.384 27.818 1.00 0.00 H new ATOM 0 HD3 LYS A 22 9.145 -8.264 26.993 1.00 0.00 H new ATOM 0 HE2 LYS A 22 10.904 -10.257 26.976 1.00 0.00 H new ATOM 0 HE3 LYS A 22 11.683 -9.349 28.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 10.166 -10.978 29.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 9.625 -9.415 29.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 8.871 -10.295 28.277 1.00 0.00 H new ATOM 335 N GLU A 23 8.727 -4.346 23.875 1.00 0.00 N ATOM 336 CA GLU A 23 8.398 -3.424 22.798 1.00 0.00 C ATOM 337 C GLU A 23 8.873 -2.017 23.157 1.00 0.00 C ATOM 338 O GLU A 23 9.429 -1.341 22.294 1.00 0.00 O ATOM 339 CB GLU A 23 6.904 -3.474 22.417 1.00 0.00 C ATOM 340 CG GLU A 23 6.048 -2.382 23.078 1.00 0.00 C ATOM 341 CD GLU A 23 4.593 -2.421 22.628 1.00 0.00 C ATOM 342 OE1 GLU A 23 3.817 -3.246 23.149 1.00 0.00 O ATOM 343 OE2 GLU A 23 4.226 -1.567 21.786 1.00 0.00 O ATOM 0 H GLU A 23 7.917 -4.804 24.293 1.00 0.00 H new ATOM 0 HA GLU A 23 8.930 -3.739 21.900 1.00 0.00 H new ATOM 0 HB2 GLU A 23 6.814 -3.385 21.334 1.00 0.00 H new ATOM 0 HB3 GLU A 23 6.503 -4.450 22.691 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.092 -2.498 24.161 1.00 0.00 H new ATOM 0 HG3 GLU A 23 6.470 -1.405 22.844 1.00 0.00 H new ATOM 350 N VAL A 24 8.753 -1.607 24.429 1.00 0.00 N ATOM 351 CA VAL A 24 9.164 -0.277 24.858 1.00 0.00 C ATOM 352 C VAL A 24 10.640 -0.010 24.524 1.00 0.00 C ATOM 353 O VAL A 24 11.018 1.114 24.204 1.00 0.00 O ATOM 354 CB VAL A 24 8.778 -0.083 26.343 1.00 0.00 C ATOM 355 CG1 VAL A 24 9.740 -0.775 27.316 1.00 0.00 C ATOM 356 CG2 VAL A 24 8.666 1.395 26.710 1.00 0.00 C ATOM 0 H VAL A 24 8.372 -2.187 25.176 1.00 0.00 H new ATOM 0 HA VAL A 24 8.628 0.490 24.298 1.00 0.00 H new ATOM 0 HB VAL A 24 7.802 -0.558 26.447 1.00 0.00 H new ATOM 0 HG11 VAL A 24 9.411 -0.599 28.340 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.750 -1.847 27.117 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.744 -0.372 27.183 1.00 0.00 H new ATOM 0 HG21 VAL A 24 8.393 1.489 27.761 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.624 1.886 26.538 1.00 0.00 H new ATOM 0 HG23 VAL A 24 7.901 1.866 26.093 1.00 0.00 H new ATOM 366 N GLN A 25 11.484 -1.041 24.568 1.00 0.00 N ATOM 367 CA GLN A 25 12.909 -0.944 24.285 1.00 0.00 C ATOM 368 C GLN A 25 13.178 -1.134 22.789 1.00 0.00 C ATOM 369 O GLN A 25 14.079 -0.517 22.229 1.00 0.00 O ATOM 370 CB GLN A 25 13.630 -2.022 25.105 1.00 0.00 C ATOM 371 CG GLN A 25 13.354 -1.900 26.613 1.00 0.00 C ATOM 372 CD GLN A 25 14.002 -3.037 27.388 1.00 0.00 C ATOM 373 OE1 GLN A 25 13.667 -4.205 27.191 1.00 0.00 O ATOM 374 NE2 GLN A 25 14.917 -2.738 28.292 1.00 0.00 N ATOM 0 H GLN A 25 11.185 -1.987 24.807 1.00 0.00 H new ATOM 0 HA GLN A 25 13.278 0.044 24.559 1.00 0.00 H new ATOM 0 HB2 GLN A 25 13.315 -3.007 24.760 1.00 0.00 H new ATOM 0 HB3 GLN A 25 14.703 -1.950 24.929 1.00 0.00 H new ATOM 0 HG2 GLN A 25 13.734 -0.946 26.978 1.00 0.00 H new ATOM 0 HG3 GLN A 25 12.278 -1.904 26.789 1.00 0.00 H new ATOM 0 HE21 GLN A 25 15.185 -1.766 28.444 1.00 0.00 H new ATOM 0 HE22 GLN A 25 15.356 -3.479 28.838 1.00 0.00 H new ATOM 383 N LYS A 26 12.393 -1.981 22.119 1.00 0.00 N ATOM 384 CA LYS A 26 12.550 -2.255 20.694 1.00 0.00 C ATOM 385 C LYS A 26 12.125 -1.070 19.829 1.00 0.00 C ATOM 386 O LYS A 26 12.724 -0.829 18.786 1.00 0.00 O ATOM 387 CB LYS A 26 11.735 -3.504 20.349 1.00 0.00 C ATOM 388 CG LYS A 26 11.998 -3.959 18.910 1.00 0.00 C ATOM 389 CD LYS A 26 11.364 -5.318 18.631 1.00 0.00 C ATOM 390 CE LYS A 26 9.834 -5.333 18.683 1.00 0.00 C ATOM 391 NZ LYS A 26 9.171 -4.642 17.561 1.00 0.00 N ATOM 0 H LYS A 26 11.628 -2.497 22.554 1.00 0.00 H new ATOM 0 HA LYS A 26 13.606 -2.425 20.482 1.00 0.00 H new ATOM 0 HB2 LYS A 26 11.988 -4.309 21.039 1.00 0.00 H new ATOM 0 HB3 LYS A 26 10.673 -3.295 20.479 1.00 0.00 H new ATOM 0 HG2 LYS A 26 11.599 -3.220 18.215 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.072 -4.014 18.735 1.00 0.00 H new ATOM 0 HD2 LYS A 26 11.684 -5.658 17.646 1.00 0.00 H new ATOM 0 HD3 LYS A 26 11.746 -6.037 19.356 1.00 0.00 H new ATOM 0 HE2 LYS A 26 9.495 -6.369 18.705 1.00 0.00 H new ATOM 0 HE3 LYS A 26 9.511 -4.872 19.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 8.139 -4.702 17.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 9.461 -3.643 17.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 9.445 -5.093 16.665 1.00 0.00 H new ATOM 405 N GLN A 27 11.077 -0.352 20.222 1.00 0.00 N ATOM 406 CA GLN A 27 10.574 0.795 19.478 1.00 0.00 C ATOM 407 C GLN A 27 11.464 2.028 19.660 1.00 0.00 C ATOM 408 O GLN A 27 11.373 2.953 18.853 1.00 0.00 O ATOM 409 CB GLN A 27 9.138 1.100 19.951 1.00 0.00 C ATOM 410 CG GLN A 27 9.096 1.850 21.298 1.00 0.00 C ATOM 411 CD GLN A 27 7.727 1.915 21.962 1.00 0.00 C ATOM 412 OE1 GLN A 27 6.763 1.262 21.560 1.00 0.00 O ATOM 413 NE2 GLN A 27 7.618 2.693 23.022 1.00 0.00 N ATOM 0 H GLN A 27 10.550 -0.552 21.072 1.00 0.00 H new ATOM 0 HA GLN A 27 10.579 0.551 18.416 1.00 0.00 H new ATOM 0 HB2 GLN A 27 8.630 1.696 19.193 1.00 0.00 H new ATOM 0 HB3 GLN A 27 8.585 0.165 20.044 1.00 0.00 H new ATOM 0 HG2 GLN A 27 9.793 1.370 21.985 1.00 0.00 H new ATOM 0 HG3 GLN A 27 9.454 2.867 21.140 1.00 0.00 H new ATOM 0 HE21 GLN A 27 8.423 3.229 23.346 1.00 0.00 H new ATOM 0 HE22 GLN A 27 6.729 2.758 23.517 1.00 0.00 H new ATOM 422 N LEU A 28 12.307 2.035 20.703 1.00 0.00 N ATOM 423 CA LEU A 28 13.199 3.122 21.086 1.00 0.00 C ATOM 424 C LEU A 28 13.869 3.802 19.896 1.00 0.00 C ATOM 425 O LEU A 28 13.543 4.965 19.660 1.00 0.00 O ATOM 426 CB LEU A 28 14.198 2.604 22.131 1.00 0.00 C ATOM 427 CG LEU A 28 15.055 3.678 22.818 1.00 0.00 C ATOM 428 CD1 LEU A 28 14.195 4.655 23.625 1.00 0.00 C ATOM 429 CD2 LEU A 28 16.022 2.969 23.770 1.00 0.00 C ATOM 0 H LEU A 28 12.383 1.235 21.332 1.00 0.00 H new ATOM 0 HA LEU A 28 12.604 3.916 21.537 1.00 0.00 H new ATOM 0 HB2 LEU A 28 13.646 2.060 22.897 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.863 1.888 21.648 1.00 0.00 H new ATOM 0 HG LEU A 28 15.585 4.248 22.055 1.00 0.00 H new ATOM 0 HD11 LEU A 28 14.836 5.400 24.096 1.00 0.00 H new ATOM 0 HD12 LEU A 28 13.489 5.152 22.960 1.00 0.00 H new ATOM 0 HD13 LEU A 28 13.648 4.109 24.393 1.00 0.00 H new ATOM 0 HD21 LEU A 28 16.645 3.709 24.273 1.00 0.00 H new ATOM 0 HD22 LEU A 28 15.455 2.407 24.512 1.00 0.00 H new ATOM 0 HD23 LEU A 28 16.655 2.286 23.203 1.00 0.00 H new ATOM 441 N ALA A 29 14.705 3.089 19.131 1.00 0.00 N ATOM 442 CA ALA A 29 15.407 3.615 17.961 1.00 0.00 C ATOM 443 C ALA A 29 16.276 2.513 17.344 1.00 0.00 C ATOM 444 O ALA A 29 17.403 2.282 17.794 1.00 0.00 O ATOM 445 CB ALA A 29 16.280 4.817 18.348 1.00 0.00 C ATOM 0 H ALA A 29 14.915 2.108 19.315 1.00 0.00 H new ATOM 0 HA ALA A 29 14.670 3.947 17.230 1.00 0.00 H new ATOM 0 HB1 ALA A 29 16.794 5.193 17.463 1.00 0.00 H new ATOM 0 HB2 ALA A 29 15.652 5.604 18.765 1.00 0.00 H new ATOM 0 HB3 ALA A 29 17.016 4.508 19.091 1.00 0.00 H new ATOM 451 N ARG A 30 15.775 1.837 16.304 1.00 0.00 N ATOM 452 CA ARG A 30 16.481 0.750 15.598 1.00 0.00 C ATOM 453 C ARG A 30 16.305 0.799 14.076 1.00 0.00 C ATOM 454 O ARG A 30 16.486 -0.208 13.380 1.00 0.00 O ATOM 455 CB ARG A 30 16.002 -0.596 16.163 1.00 0.00 C ATOM 456 CG ARG A 30 14.526 -0.870 15.845 1.00 0.00 C ATOM 457 CD ARG A 30 14.127 -2.315 16.162 1.00 0.00 C ATOM 458 NE ARG A 30 12.952 -2.706 15.369 1.00 0.00 N ATOM 459 CZ ARG A 30 11.738 -2.150 15.410 1.00 0.00 C ATOM 460 NH1 ARG A 30 11.396 -1.296 16.365 1.00 0.00 N ATOM 461 NH2 ARG A 30 10.869 -2.475 14.469 1.00 0.00 N ATOM 0 H ARG A 30 14.851 2.030 15.919 1.00 0.00 H new ATOM 0 HA ARG A 30 17.550 0.877 15.771 1.00 0.00 H new ATOM 0 HB2 ARG A 30 16.615 -1.398 15.752 1.00 0.00 H new ATOM 0 HB3 ARG A 30 16.146 -0.606 17.243 1.00 0.00 H new ATOM 0 HG2 ARG A 30 13.899 -0.187 16.418 1.00 0.00 H new ATOM 0 HG3 ARG A 30 14.339 -0.666 14.791 1.00 0.00 H new ATOM 0 HD2 ARG A 30 14.959 -2.985 15.946 1.00 0.00 H new ATOM 0 HD3 ARG A 30 13.906 -2.414 17.225 1.00 0.00 H new ATOM 0 HE ARG A 30 13.077 -3.483 14.720 1.00 0.00 H new ATOM 0 HH11 ARG A 30 12.067 -1.049 17.092 1.00 0.00 H new ATOM 0 HH12 ARG A 30 10.462 -0.886 16.372 1.00 0.00 H new ATOM 0 HH21 ARG A 30 11.133 -3.135 13.737 1.00 0.00 H new ATOM 0 HH22 ARG A 30 9.934 -2.066 14.475 1.00 0.00 H new ATOM 475 N MET A 31 15.844 1.924 13.548 1.00 0.00 N ATOM 476 CA MET A 31 15.598 2.072 12.129 1.00 0.00 C ATOM 477 C MET A 31 16.834 2.632 11.448 1.00 0.00 C ATOM 478 O MET A 31 17.210 3.777 11.671 1.00 0.00 O ATOM 479 CB MET A 31 14.340 2.913 11.893 1.00 0.00 C ATOM 480 CG MET A 31 13.138 2.384 12.700 1.00 0.00 C ATOM 481 SD MET A 31 12.640 0.662 12.389 1.00 0.00 S ATOM 482 CE MET A 31 12.124 0.752 10.654 1.00 0.00 C ATOM 0 H MET A 31 15.631 2.758 14.096 1.00 0.00 H new ATOM 0 HA MET A 31 15.404 1.099 11.679 1.00 0.00 H new ATOM 0 HB2 MET A 31 14.537 3.948 12.171 1.00 0.00 H new ATOM 0 HB3 MET A 31 14.095 2.910 10.831 1.00 0.00 H new ATOM 0 HG2 MET A 31 13.369 2.485 13.760 1.00 0.00 H new ATOM 0 HG3 MET A 31 12.282 3.028 12.497 1.00 0.00 H new ATOM 0 HE1 MET A 31 11.742 -0.218 10.337 1.00 0.00 H new ATOM 0 HE2 MET A 31 11.342 1.503 10.546 1.00 0.00 H new ATOM 0 HE3 MET A 31 12.978 1.025 10.034 1.00 0.00 H new ATOM 492 N THR A 32 17.458 1.806 10.616 1.00 0.00 N ATOM 493 CA THR A 32 18.655 2.106 9.828 1.00 0.00 C ATOM 494 C THR A 32 18.454 1.598 8.381 1.00 0.00 C ATOM 495 O THR A 32 19.398 1.363 7.630 1.00 0.00 O ATOM 496 CB THR A 32 19.873 1.530 10.580 1.00 0.00 C ATOM 497 OG1 THR A 32 21.102 2.074 10.142 1.00 0.00 O ATOM 498 CG2 THR A 32 19.944 0.000 10.491 1.00 0.00 C ATOM 0 H THR A 32 17.126 0.854 10.462 1.00 0.00 H new ATOM 0 HA THR A 32 18.841 3.175 9.722 1.00 0.00 H new ATOM 0 HB THR A 32 19.719 1.821 11.619 1.00 0.00 H new ATOM 0 HG1 THR A 32 21.837 1.675 10.653 1.00 0.00 H new ATOM 0 HG21 THR A 32 20.818 -0.356 11.036 1.00 0.00 H new ATOM 0 HG22 THR A 32 19.044 -0.432 10.928 1.00 0.00 H new ATOM 0 HG23 THR A 32 20.021 -0.301 9.446 1.00 0.00 H new ATOM 506 N ARG A 33 17.204 1.274 8.029 1.00 0.00 N ATOM 507 CA ARG A 33 16.811 0.786 6.714 1.00 0.00 C ATOM 508 C ARG A 33 16.928 1.952 5.738 1.00 0.00 C ATOM 509 O ARG A 33 16.780 3.102 6.162 1.00 0.00 O ATOM 510 CB ARG A 33 15.384 0.224 6.779 1.00 0.00 C ATOM 511 CG ARG A 33 15.324 -1.205 7.337 1.00 0.00 C ATOM 512 CD ARG A 33 15.825 -1.402 8.772 1.00 0.00 C ATOM 513 NE ARG A 33 15.580 -2.786 9.187 1.00 0.00 N ATOM 514 CZ ARG A 33 15.512 -3.282 10.424 1.00 0.00 C ATOM 515 NH1 ARG A 33 15.698 -2.525 11.503 1.00 0.00 N ATOM 516 NH2 ARG A 33 15.250 -4.574 10.555 1.00 0.00 N ATOM 0 H ARG A 33 16.419 1.349 8.676 1.00 0.00 H new ATOM 0 HA ARG A 33 17.456 -0.025 6.376 1.00 0.00 H new ATOM 0 HB2 ARG A 33 14.771 0.876 7.401 1.00 0.00 H new ATOM 0 HB3 ARG A 33 14.949 0.236 5.779 1.00 0.00 H new ATOM 0 HG2 ARG A 33 14.290 -1.547 7.287 1.00 0.00 H new ATOM 0 HG3 ARG A 33 15.906 -1.852 6.681 1.00 0.00 H new ATOM 0 HD2 ARG A 33 16.890 -1.176 8.832 1.00 0.00 H new ATOM 0 HD3 ARG A 33 15.315 -0.713 9.445 1.00 0.00 H new ATOM 0 HE ARG A 33 15.444 -3.458 8.432 1.00 0.00 H new ATOM 0 HH11 ARG A 33 15.900 -1.531 11.400 1.00 0.00 H new ATOM 0 HH12 ARG A 33 15.638 -2.939 12.433 1.00 0.00 H new ATOM 0 HH21 ARG A 33 15.108 -5.152 9.727 1.00 0.00 H new ATOM 0 HH22 ARG A 33 15.190 -4.991 11.484 1.00 0.00 H new ATOM 530 N CYS A 34 17.190 1.654 4.462 1.00 0.00 N ATOM 531 CA CYS A 34 17.359 2.657 3.415 1.00 0.00 C ATOM 532 C CYS A 34 16.851 2.113 2.076 1.00 0.00 C ATOM 533 O CYS A 34 15.786 2.561 1.653 1.00 0.00 O ATOM 534 CB CYS A 34 18.818 3.154 3.347 1.00 0.00 C ATOM 535 SG CYS A 34 19.146 4.421 4.603 1.00 0.00 S ATOM 0 H CYS A 34 17.291 0.696 4.126 1.00 0.00 H new ATOM 0 HA CYS A 34 16.754 3.531 3.659 1.00 0.00 H new ATOM 0 HB2 CYS A 34 19.497 2.314 3.490 1.00 0.00 H new ATOM 0 HB3 CYS A 34 19.019 3.561 2.356 1.00 0.00 H new ATOM 0 HG CYS A 34 18.325 4.267 5.599 1.00 0.00 H new ATOM 541 N PRO A 35 17.509 1.138 1.415 1.00 0.00 N ATOM 542 CA PRO A 35 17.060 0.616 0.128 1.00 0.00 C ATOM 543 C PRO A 35 15.712 -0.078 0.219 1.00 0.00 C ATOM 544 O PRO A 35 15.027 -0.197 -0.800 1.00 0.00 O ATOM 545 CB PRO A 35 18.149 -0.323 -0.372 1.00 0.00 C ATOM 546 CG PRO A 35 18.788 -0.788 0.927 1.00 0.00 C ATOM 547 CD PRO A 35 18.747 0.482 1.775 1.00 0.00 C ATOM 0 HA PRO A 35 16.905 1.435 -0.574 1.00 0.00 H new ATOM 0 HB2 PRO A 35 17.739 -1.154 -0.945 1.00 0.00 H new ATOM 0 HB3 PRO A 35 18.863 0.188 -1.018 1.00 0.00 H new ATOM 0 HG2 PRO A 35 18.230 -1.604 1.387 1.00 0.00 H new ATOM 0 HG3 PRO A 35 19.807 -1.145 0.776 1.00 0.00 H new ATOM 0 HD2 PRO A 35 18.773 0.246 2.839 1.00 0.00 H new ATOM 0 HD3 PRO A 35 19.606 1.121 1.569 1.00 0.00 H new ATOM 555 N GLU A 36 15.287 -0.451 1.434 1.00 0.00 N ATOM 556 CA GLU A 36 13.999 -1.083 1.648 1.00 0.00 C ATOM 557 C GLU A 36 12.866 -0.154 1.210 1.00 0.00 C ATOM 558 O GLU A 36 11.727 -0.607 1.107 1.00 0.00 O ATOM 559 CB GLU A 36 13.787 -1.474 3.099 1.00 0.00 C ATOM 560 CG GLU A 36 14.641 -2.664 3.524 1.00 0.00 C ATOM 561 CD GLU A 36 14.165 -3.252 4.847 1.00 0.00 C ATOM 562 OE1 GLU A 36 13.180 -2.762 5.446 1.00 0.00 O ATOM 563 OE2 GLU A 36 14.745 -4.273 5.278 1.00 0.00 O ATOM 0 H GLU A 36 15.832 -0.319 2.286 1.00 0.00 H new ATOM 0 HA GLU A 36 13.991 -1.991 1.045 1.00 0.00 H new ATOM 0 HB2 GLU A 36 14.018 -0.621 3.737 1.00 0.00 H new ATOM 0 HB3 GLU A 36 12.735 -1.714 3.255 1.00 0.00 H new ATOM 0 HG2 GLU A 36 14.607 -3.432 2.751 1.00 0.00 H new ATOM 0 HG3 GLU A 36 15.681 -2.351 3.617 1.00 0.00 H new ATOM 570 N GLN A 37 13.171 1.127 0.950 1.00 0.00 N ATOM 571 CA GLN A 37 12.226 2.124 0.469 1.00 0.00 C ATOM 572 C GLN A 37 11.466 1.553 -0.741 1.00 0.00 C ATOM 573 O GLN A 37 10.295 1.871 -0.912 1.00 0.00 O ATOM 574 CB GLN A 37 12.995 3.406 0.098 1.00 0.00 C ATOM 575 CG GLN A 37 12.111 4.585 -0.346 1.00 0.00 C ATOM 576 CD GLN A 37 11.257 5.174 0.780 1.00 0.00 C ATOM 577 OE1 GLN A 37 11.274 4.720 1.922 1.00 0.00 O ATOM 578 NE2 GLN A 37 10.500 6.216 0.500 1.00 0.00 N ATOM 0 H GLN A 37 14.112 1.500 1.075 1.00 0.00 H new ATOM 0 HA GLN A 37 11.499 2.372 1.242 1.00 0.00 H new ATOM 0 HB2 GLN A 37 13.588 3.719 0.958 1.00 0.00 H new ATOM 0 HB3 GLN A 37 13.695 3.173 -0.704 1.00 0.00 H new ATOM 0 HG2 GLN A 37 12.747 5.370 -0.756 1.00 0.00 H new ATOM 0 HG3 GLN A 37 11.456 4.253 -1.151 1.00 0.00 H new ATOM 0 HE21 GLN A 37 10.484 6.595 -0.447 1.00 0.00 H new ATOM 0 HE22 GLN A 37 9.930 6.643 1.230 1.00 0.00 H new ATOM 587 N GLU A 38 12.095 0.689 -1.548 1.00 0.00 N ATOM 588 CA GLU A 38 11.493 0.044 -2.714 1.00 0.00 C ATOM 589 C GLU A 38 10.180 -0.652 -2.318 1.00 0.00 C ATOM 590 O GLU A 38 9.168 -0.560 -3.003 1.00 0.00 O ATOM 591 CB GLU A 38 12.508 -0.949 -3.326 1.00 0.00 C ATOM 592 CG GLU A 38 12.776 -2.189 -2.446 1.00 0.00 C ATOM 593 CD GLU A 38 13.930 -3.078 -2.908 1.00 0.00 C ATOM 594 OE1 GLU A 38 14.291 -3.076 -4.101 1.00 0.00 O ATOM 595 OE2 GLU A 38 14.423 -3.867 -2.062 1.00 0.00 O ATOM 0 H GLU A 38 13.066 0.414 -1.400 1.00 0.00 H new ATOM 0 HA GLU A 38 11.248 0.792 -3.468 1.00 0.00 H new ATOM 0 HB2 GLU A 38 12.140 -1.278 -4.298 1.00 0.00 H new ATOM 0 HB3 GLU A 38 13.450 -0.429 -3.501 1.00 0.00 H new ATOM 0 HG2 GLU A 38 12.980 -1.855 -1.429 1.00 0.00 H new ATOM 0 HG3 GLU A 38 11.868 -2.791 -2.408 1.00 0.00 H new ATOM 602 N LEU A 39 10.155 -1.313 -1.159 1.00 0.00 N ATOM 603 CA LEU A 39 8.990 -2.023 -0.660 1.00 0.00 C ATOM 604 C LEU A 39 7.874 -1.038 -0.321 1.00 0.00 C ATOM 605 O LEU A 39 6.702 -1.397 -0.414 1.00 0.00 O ATOM 606 CB LEU A 39 9.362 -2.851 0.584 1.00 0.00 C ATOM 607 CG LEU A 39 10.521 -3.847 0.407 1.00 0.00 C ATOM 608 CD1 LEU A 39 10.854 -4.510 1.749 1.00 0.00 C ATOM 609 CD2 LEU A 39 10.182 -4.924 -0.626 1.00 0.00 C ATOM 0 H LEU A 39 10.960 -1.367 -0.535 1.00 0.00 H new ATOM 0 HA LEU A 39 8.636 -2.699 -1.438 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.619 -2.164 1.390 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.479 -3.404 0.906 1.00 0.00 H new ATOM 0 HG LEU A 39 11.386 -3.289 0.047 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.676 -5.213 1.613 1.00 0.00 H new ATOM 0 HD12 LEU A 39 11.145 -3.746 2.470 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.978 -5.043 2.119 1.00 0.00 H new ATOM 0 HD21 LEU A 39 11.023 -5.610 -0.726 1.00 0.00 H new ATOM 0 HD22 LEU A 39 9.300 -5.476 -0.300 1.00 0.00 H new ATOM 0 HD23 LEU A 39 9.981 -4.454 -1.589 1.00 0.00 H new ATOM 621 N ARG A 40 8.218 0.177 0.130 1.00 0.00 N ATOM 622 CA ARG A 40 7.261 1.224 0.494 1.00 0.00 C ATOM 623 C ARG A 40 6.612 1.684 -0.805 1.00 0.00 C ATOM 624 O ARG A 40 5.389 1.801 -0.857 1.00 0.00 O ATOM 625 CB ARG A 40 7.916 2.409 1.250 1.00 0.00 C ATOM 626 CG ARG A 40 8.421 2.140 2.685 1.00 0.00 C ATOM 627 CD ARG A 40 9.207 0.831 2.813 1.00 0.00 C ATOM 628 NE ARG A 40 9.971 0.680 4.061 1.00 0.00 N ATOM 629 CZ ARG A 40 10.518 -0.484 4.440 1.00 0.00 C ATOM 630 NH1 ARG A 40 10.051 -1.637 3.974 1.00 0.00 N ATOM 631 NH2 ARG A 40 11.542 -0.515 5.280 1.00 0.00 N ATOM 0 H ARG A 40 9.190 0.462 0.253 1.00 0.00 H new ATOM 0 HA ARG A 40 6.524 0.825 1.191 1.00 0.00 H new ATOM 0 HB2 ARG A 40 8.759 2.764 0.657 1.00 0.00 H new ATOM 0 HB3 ARG A 40 7.192 3.223 1.294 1.00 0.00 H new ATOM 0 HG2 ARG A 40 9.054 2.969 3.002 1.00 0.00 H new ATOM 0 HG3 ARG A 40 7.569 2.112 3.364 1.00 0.00 H new ATOM 0 HD2 ARG A 40 8.510 -0.003 2.729 1.00 0.00 H new ATOM 0 HD3 ARG A 40 9.896 0.756 1.972 1.00 0.00 H new ATOM 0 HE ARG A 40 10.090 1.495 4.663 1.00 0.00 H new ATOM 0 HH11 ARG A 40 9.268 -1.643 3.320 1.00 0.00 H new ATOM 0 HH12 ARG A 40 10.476 -2.516 4.270 1.00 0.00 H new ATOM 0 HH21 ARG A 40 11.926 0.355 5.648 1.00 0.00 H new ATOM 0 HH22 ARG A 40 11.946 -1.409 5.558 1.00 0.00 H new ATOM 645 N LEU A 41 7.428 1.918 -1.838 1.00 0.00 N ATOM 646 CA LEU A 41 6.972 2.346 -3.152 1.00 0.00 C ATOM 647 C LEU A 41 6.049 1.277 -3.729 1.00 0.00 C ATOM 648 O LEU A 41 4.929 1.576 -4.129 1.00 0.00 O ATOM 649 CB LEU A 41 8.155 2.618 -4.098 1.00 0.00 C ATOM 650 CG LEU A 41 9.142 3.693 -3.609 1.00 0.00 C ATOM 651 CD1 LEU A 41 10.234 3.918 -4.658 1.00 0.00 C ATOM 652 CD2 LEU A 41 8.452 5.012 -3.241 1.00 0.00 C ATOM 0 H LEU A 41 8.441 1.812 -1.777 1.00 0.00 H new ATOM 0 HA LEU A 41 6.425 3.283 -3.049 1.00 0.00 H new ATOM 0 HB2 LEU A 41 8.701 1.687 -4.251 1.00 0.00 H new ATOM 0 HB3 LEU A 41 7.763 2.920 -5.069 1.00 0.00 H new ATOM 0 HG LEU A 41 9.597 3.321 -2.691 1.00 0.00 H new ATOM 0 HD11 LEU A 41 10.928 4.680 -4.303 1.00 0.00 H new ATOM 0 HD12 LEU A 41 10.774 2.986 -4.827 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.779 4.248 -5.592 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.198 5.731 -2.903 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.935 5.409 -4.115 1.00 0.00 H new ATOM 0 HD23 LEU A 41 7.731 4.835 -2.443 1.00 0.00 H new ATOM 664 N GLN A 42 6.488 0.020 -3.725 1.00 0.00 N ATOM 665 CA GLN A 42 5.724 -1.100 -4.247 1.00 0.00 C ATOM 666 C GLN A 42 4.396 -1.263 -3.495 1.00 0.00 C ATOM 667 O GLN A 42 3.367 -1.464 -4.136 1.00 0.00 O ATOM 668 CB GLN A 42 6.607 -2.356 -4.282 1.00 0.00 C ATOM 669 CG GLN A 42 7.667 -2.198 -5.391 1.00 0.00 C ATOM 670 CD GLN A 42 8.684 -3.332 -5.488 1.00 0.00 C ATOM 671 OE1 GLN A 42 8.683 -4.286 -4.708 1.00 0.00 O ATOM 672 NE2 GLN A 42 9.564 -3.265 -6.477 1.00 0.00 N ATOM 0 H GLN A 42 7.399 -0.248 -3.352 1.00 0.00 H new ATOM 0 HA GLN A 42 5.430 -0.909 -5.279 1.00 0.00 H new ATOM 0 HB2 GLN A 42 7.092 -2.502 -3.317 1.00 0.00 H new ATOM 0 HB3 GLN A 42 5.997 -3.240 -4.469 1.00 0.00 H new ATOM 0 HG2 GLN A 42 7.156 -2.108 -6.349 1.00 0.00 H new ATOM 0 HG3 GLN A 42 8.204 -1.264 -5.227 1.00 0.00 H new ATOM 0 HE21 GLN A 42 9.554 -2.470 -7.116 1.00 0.00 H new ATOM 0 HE22 GLN A 42 10.251 -4.009 -6.599 1.00 0.00 H new ATOM 681 N ARG A 43 4.343 -1.153 -2.160 1.00 0.00 N ATOM 682 CA ARG A 43 3.043 -1.291 -1.491 1.00 0.00 C ATOM 683 C ARG A 43 2.149 -0.075 -1.769 1.00 0.00 C ATOM 684 O ARG A 43 0.943 -0.252 -1.949 1.00 0.00 O ATOM 685 CB ARG A 43 3.166 -1.598 0.013 1.00 0.00 C ATOM 686 CG ARG A 43 3.721 -0.442 0.848 1.00 0.00 C ATOM 687 CD ARG A 43 3.630 -0.714 2.352 1.00 0.00 C ATOM 688 NE ARG A 43 4.213 0.388 3.135 1.00 0.00 N ATOM 689 CZ ARG A 43 3.758 1.645 3.223 1.00 0.00 C ATOM 690 NH1 ARG A 43 2.617 2.008 2.648 1.00 0.00 N ATOM 691 NH2 ARG A 43 4.476 2.533 3.895 1.00 0.00 N ATOM 0 H ARG A 43 5.141 -0.978 -1.549 1.00 0.00 H new ATOM 0 HA ARG A 43 2.556 -2.165 -1.924 1.00 0.00 H new ATOM 0 HB2 ARG A 43 2.183 -1.870 0.398 1.00 0.00 H new ATOM 0 HB3 ARG A 43 3.811 -2.467 0.143 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.762 -0.267 0.575 1.00 0.00 H new ATOM 0 HG3 ARG A 43 3.172 0.470 0.612 1.00 0.00 H new ATOM 0 HD2 ARG A 43 2.587 -0.851 2.636 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.149 -1.643 2.587 1.00 0.00 H new ATOM 0 HE ARG A 43 5.055 0.171 3.668 1.00 0.00 H new ATOM 0 HH11 ARG A 43 2.068 1.324 2.127 1.00 0.00 H new ATOM 0 HH12 ARG A 43 2.289 2.971 2.728 1.00 0.00 H new ATOM 0 HH21 ARG A 43 5.354 2.253 4.331 1.00 0.00 H new ATOM 0 HH22 ARG A 43 4.150 3.496 3.976 1.00 0.00 H new ATOM 705 N LEU A 44 2.698 1.146 -1.847 1.00 0.00 N ATOM 706 CA LEU A 44 1.883 2.337 -2.089 1.00 0.00 C ATOM 707 C LEU A 44 1.378 2.454 -3.523 1.00 0.00 C ATOM 708 O LEU A 44 0.438 3.211 -3.738 1.00 0.00 O ATOM 709 CB LEU A 44 2.545 3.631 -1.571 1.00 0.00 C ATOM 710 CG LEU A 44 3.694 4.239 -2.400 1.00 0.00 C ATOM 711 CD1 LEU A 44 3.247 5.090 -3.599 1.00 0.00 C ATOM 712 CD2 LEU A 44 4.556 5.134 -1.502 1.00 0.00 C ATOM 0 H LEU A 44 3.696 1.330 -1.746 1.00 0.00 H new ATOM 0 HA LEU A 44 0.985 2.198 -1.487 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.767 4.388 -1.474 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.925 3.433 -0.569 1.00 0.00 H new ATOM 0 HG LEU A 44 4.240 3.383 -2.796 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.124 5.474 -4.120 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.659 4.476 -4.282 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.640 5.924 -3.247 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.368 5.564 -2.089 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.942 5.935 -1.090 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.971 4.540 -0.688 1.00 0.00 H new ATOM 724 N GLU A 45 1.966 1.751 -4.495 1.00 0.00 N ATOM 725 CA GLU A 45 1.562 1.762 -5.896 1.00 0.00 C ATOM 726 C GLU A 45 0.658 0.560 -6.192 1.00 0.00 C ATOM 727 O GLU A 45 0.017 0.531 -7.244 1.00 0.00 O ATOM 728 CB GLU A 45 2.783 1.889 -6.829 1.00 0.00 C ATOM 729 CG GLU A 45 3.709 0.667 -6.872 1.00 0.00 C ATOM 730 CD GLU A 45 3.362 -0.338 -7.967 1.00 0.00 C ATOM 731 OE1 GLU A 45 2.572 -1.272 -7.722 1.00 0.00 O ATOM 732 OE2 GLU A 45 3.926 -0.200 -9.077 1.00 0.00 O ATOM 0 H GLU A 45 2.763 1.139 -4.318 1.00 0.00 H new ATOM 0 HA GLU A 45 0.963 2.649 -6.099 1.00 0.00 H new ATOM 0 HB2 GLU A 45 2.427 2.090 -7.840 1.00 0.00 H new ATOM 0 HB3 GLU A 45 3.367 2.755 -6.519 1.00 0.00 H new ATOM 0 HG2 GLU A 45 4.735 1.006 -7.017 1.00 0.00 H new ATOM 0 HG3 GLU A 45 3.673 0.163 -5.906 1.00 0.00 H new ATOM 739 N ARG A 46 0.544 -0.401 -5.263 1.00 0.00 N ATOM 740 CA ARG A 46 -0.291 -1.597 -5.387 1.00 0.00 C ATOM 741 C ARG A 46 -1.770 -1.290 -5.144 1.00 0.00 C ATOM 742 O ARG A 46 -2.572 -2.211 -5.230 1.00 0.00 O ATOM 743 CB ARG A 46 0.214 -2.705 -4.436 1.00 0.00 C ATOM 744 CG ARG A 46 1.221 -3.627 -5.139 1.00 0.00 C ATOM 745 CD ARG A 46 1.993 -4.521 -4.160 1.00 0.00 C ATOM 746 NE ARG A 46 1.133 -5.445 -3.395 1.00 0.00 N ATOM 747 CZ ARG A 46 1.538 -6.585 -2.816 1.00 0.00 C ATOM 748 NH1 ARG A 46 2.816 -6.953 -2.801 1.00 0.00 N ATOM 749 NH2 ARG A 46 0.656 -7.362 -2.218 1.00 0.00 N ATOM 0 H ARG A 46 1.048 -0.362 -4.377 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.208 -1.956 -6.413 1.00 0.00 H new ATOM 0 HB2 ARG A 46 0.681 -2.252 -3.562 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.631 -3.292 -4.077 1.00 0.00 H new ATOM 0 HG2 ARG A 46 0.693 -4.254 -5.857 1.00 0.00 H new ATOM 0 HG3 ARG A 46 1.928 -3.021 -5.705 1.00 0.00 H new ATOM 0 HD2 ARG A 46 2.730 -5.101 -4.715 1.00 0.00 H new ATOM 0 HD3 ARG A 46 2.544 -3.890 -3.462 1.00 0.00 H new ATOM 0 HE ARG A 46 0.149 -5.196 -3.299 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.522 -6.361 -3.239 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.090 -7.827 -2.352 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -0.328 -7.095 -2.198 1.00 0.00 H new ATOM 0 HH22 ARG A 46 0.958 -8.230 -1.776 1.00 0.00 H new ATOM 763 N LEU A 47 -2.160 -0.035 -4.875 1.00 0.00 N ATOM 764 CA LEU A 47 -3.557 0.359 -4.640 1.00 0.00 C ATOM 765 C LEU A 47 -4.549 -0.269 -5.636 1.00 0.00 C ATOM 766 O LEU A 47 -5.554 -0.831 -5.193 1.00 0.00 O ATOM 767 CB LEU A 47 -3.807 1.889 -4.548 1.00 0.00 C ATOM 768 CG LEU A 47 -2.595 2.820 -4.369 1.00 0.00 C ATOM 769 CD1 LEU A 47 -2.030 3.225 -5.739 1.00 0.00 C ATOM 770 CD2 LEU A 47 -2.956 4.094 -3.600 1.00 0.00 C ATOM 0 H LEU A 47 -1.505 0.745 -4.814 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.749 -0.051 -3.649 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -4.329 2.195 -5.454 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.486 2.065 -3.714 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.853 2.264 -3.796 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.173 3.884 -5.599 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.717 2.333 -6.282 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.799 3.746 -6.310 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.070 4.721 -3.498 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.727 4.641 -4.143 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.329 3.829 -2.611 1.00 0.00 H new ATOM 782 N PRO A 48 -4.312 -0.229 -6.967 1.00 0.00 N ATOM 783 CA PRO A 48 -5.255 -0.829 -7.899 1.00 0.00 C ATOM 784 C PRO A 48 -5.363 -2.348 -7.702 1.00 0.00 C ATOM 785 O PRO A 48 -6.440 -2.916 -7.894 1.00 0.00 O ATOM 786 CB PRO A 48 -4.769 -0.456 -9.304 1.00 0.00 C ATOM 787 CG PRO A 48 -3.280 -0.178 -9.115 1.00 0.00 C ATOM 788 CD PRO A 48 -3.204 0.380 -7.695 1.00 0.00 C ATOM 0 HA PRO A 48 -6.264 -0.453 -7.732 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -4.937 -1.266 -10.013 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -5.293 0.419 -9.689 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -2.685 -1.085 -9.223 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -2.908 0.537 -9.849 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.249 0.135 -7.230 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -3.288 1.467 -7.697 1.00 0.00 H new ATOM 796 N GLU A 49 -4.266 -3.009 -7.335 1.00 0.00 N ATOM 797 CA GLU A 49 -4.207 -4.441 -7.099 1.00 0.00 C ATOM 798 C GLU A 49 -5.020 -4.792 -5.848 1.00 0.00 C ATOM 799 O GLU A 49 -5.751 -5.780 -5.866 1.00 0.00 O ATOM 800 CB GLU A 49 -2.737 -4.875 -6.948 1.00 0.00 C ATOM 801 CG GLU A 49 -2.484 -6.290 -7.484 1.00 0.00 C ATOM 802 CD GLU A 49 -2.367 -6.325 -9.013 1.00 0.00 C ATOM 803 OE1 GLU A 49 -3.408 -6.292 -9.711 1.00 0.00 O ATOM 804 OE2 GLU A 49 -1.231 -6.356 -9.537 1.00 0.00 O ATOM 0 H GLU A 49 -3.370 -2.544 -7.191 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.639 -4.976 -7.945 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -2.097 -4.169 -7.478 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.455 -4.833 -5.896 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.568 -6.684 -7.043 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.296 -6.945 -7.170 1.00 0.00 H new ATOM 811 N LEU A 50 -4.918 -3.988 -4.779 1.00 0.00 N ATOM 812 CA LEU A 50 -5.645 -4.194 -3.522 1.00 0.00 C ATOM 813 C LEU A 50 -7.143 -4.233 -3.825 1.00 0.00 C ATOM 814 O LEU A 50 -7.842 -5.176 -3.451 1.00 0.00 O ATOM 815 CB LEU A 50 -5.370 -3.059 -2.501 1.00 0.00 C ATOM 816 CG LEU A 50 -4.236 -3.202 -1.467 1.00 0.00 C ATOM 817 CD1 LEU A 50 -4.442 -4.434 -0.586 1.00 0.00 C ATOM 818 CD2 LEU A 50 -2.862 -3.227 -2.141 1.00 0.00 C ATOM 0 H LEU A 50 -4.318 -3.164 -4.766 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.305 -5.132 -3.082 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.174 -2.152 -3.072 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.294 -2.893 -1.946 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.269 -2.323 -0.823 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.626 -4.508 0.133 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.389 -4.346 -0.053 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.458 -5.328 -1.209 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.086 -3.329 -1.382 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.810 -4.071 -2.829 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -2.710 -2.299 -2.693 1.00 0.00 H new ATOM 830 N ALA A 51 -7.637 -3.197 -4.510 1.00 0.00 N ATOM 831 CA ALA A 51 -9.042 -3.080 -4.872 1.00 0.00 C ATOM 832 C ALA A 51 -9.507 -4.263 -5.723 1.00 0.00 C ATOM 833 O ALA A 51 -10.567 -4.837 -5.456 1.00 0.00 O ATOM 834 CB ALA A 51 -9.248 -1.773 -5.630 1.00 0.00 C ATOM 0 H ALA A 51 -7.065 -2.415 -4.828 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.638 -3.084 -3.960 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.298 -1.674 -5.907 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -8.960 -0.935 -4.995 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.634 -1.774 -6.531 1.00 0.00 H new ATOM 840 N ARG A 52 -8.733 -4.631 -6.748 1.00 0.00 N ATOM 841 CA ARG A 52 -9.085 -5.745 -7.626 1.00 0.00 C ATOM 842 C ARG A 52 -9.158 -7.040 -6.820 1.00 0.00 C ATOM 843 O ARG A 52 -10.106 -7.804 -7.010 1.00 0.00 O ATOM 844 CB ARG A 52 -8.103 -5.824 -8.802 1.00 0.00 C ATOM 845 CG ARG A 52 -8.356 -4.679 -9.800 1.00 0.00 C ATOM 846 CD ARG A 52 -7.168 -4.429 -10.729 1.00 0.00 C ATOM 847 NE ARG A 52 -6.945 -5.537 -11.671 1.00 0.00 N ATOM 848 CZ ARG A 52 -7.044 -5.481 -13.003 1.00 0.00 C ATOM 849 NH1 ARG A 52 -7.611 -4.447 -13.614 1.00 0.00 N ATOM 850 NH2 ARG A 52 -6.563 -6.476 -13.737 1.00 0.00 N ATOM 0 H ARG A 52 -7.856 -4.170 -6.989 1.00 0.00 H new ATOM 0 HA ARG A 52 -10.073 -5.582 -8.056 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -7.079 -5.771 -8.432 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -8.210 -6.784 -9.307 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -9.236 -4.913 -10.399 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.579 -3.765 -9.249 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -7.336 -3.509 -11.289 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.269 -4.278 -10.131 1.00 0.00 H new ATOM 0 HE ARG A 52 -6.689 -6.438 -11.267 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -7.983 -3.672 -13.065 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -7.674 -4.428 -14.632 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -6.121 -7.276 -13.284 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -6.635 -6.441 -14.754 1.00 0.00 H new ATOM 864 N VAL A 53 -8.211 -7.312 -5.914 1.00 0.00 N ATOM 865 CA VAL A 53 -8.269 -8.532 -5.111 1.00 0.00 C ATOM 866 C VAL A 53 -9.532 -8.466 -4.250 1.00 0.00 C ATOM 867 O VAL A 53 -10.296 -9.421 -4.279 1.00 0.00 O ATOM 868 CB VAL A 53 -6.982 -8.765 -4.298 1.00 0.00 C ATOM 869 CG1 VAL A 53 -7.146 -9.943 -3.324 1.00 0.00 C ATOM 870 CG2 VAL A 53 -5.812 -9.107 -5.232 1.00 0.00 C ATOM 0 H VAL A 53 -7.409 -6.712 -5.723 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.329 -9.405 -5.761 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.784 -7.846 -3.747 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.221 -10.084 -2.764 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.961 -9.732 -2.632 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.372 -10.850 -3.885 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.910 -9.269 -4.641 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -6.046 -10.012 -5.792 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -5.648 -8.283 -5.927 1.00 0.00 H new ATOM 880 N LEU A 54 -9.816 -7.365 -3.545 1.00 0.00 N ATOM 881 CA LEU A 54 -11.019 -7.224 -2.714 1.00 0.00 C ATOM 882 C LEU A 54 -12.269 -7.595 -3.529 1.00 0.00 C ATOM 883 O LEU A 54 -13.087 -8.413 -3.101 1.00 0.00 O ATOM 884 CB LEU A 54 -11.073 -5.788 -2.146 1.00 0.00 C ATOM 885 CG LEU A 54 -12.467 -5.259 -1.746 1.00 0.00 C ATOM 886 CD1 LEU A 54 -13.155 -6.097 -0.665 1.00 0.00 C ATOM 887 CD2 LEU A 54 -12.335 -3.819 -1.245 1.00 0.00 C ATOM 0 H LEU A 54 -9.214 -6.541 -3.534 1.00 0.00 H new ATOM 0 HA LEU A 54 -10.985 -7.911 -1.869 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.426 -5.743 -1.270 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -10.651 -5.111 -2.889 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.090 -5.318 -2.639 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -14.129 -5.665 -0.435 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -13.286 -7.118 -1.024 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -12.540 -6.105 0.235 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -13.317 -3.441 -0.961 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -11.673 -3.794 -0.380 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -11.921 -3.195 -2.037 1.00 0.00 H new ATOM 899 N ARG A 55 -12.412 -7.040 -4.734 1.00 0.00 N ATOM 900 CA ARG A 55 -13.556 -7.317 -5.602 1.00 0.00 C ATOM 901 C ARG A 55 -13.646 -8.812 -5.940 1.00 0.00 C ATOM 902 O ARG A 55 -14.754 -9.356 -6.050 1.00 0.00 O ATOM 903 CB ARG A 55 -13.450 -6.412 -6.839 1.00 0.00 C ATOM 904 CG ARG A 55 -14.767 -6.334 -7.624 1.00 0.00 C ATOM 905 CD ARG A 55 -14.688 -5.228 -8.682 1.00 0.00 C ATOM 906 NE ARG A 55 -15.776 -5.308 -9.667 1.00 0.00 N ATOM 907 CZ ARG A 55 -15.794 -6.068 -10.766 1.00 0.00 C ATOM 908 NH1 ARG A 55 -14.859 -6.982 -10.989 1.00 0.00 N ATOM 909 NH2 ARG A 55 -16.778 -5.920 -11.634 1.00 0.00 N ATOM 0 H ARG A 55 -11.739 -6.387 -5.134 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.492 -7.087 -5.092 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.156 -5.410 -6.528 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.662 -6.786 -7.493 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -14.970 -7.292 -8.103 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -15.594 -6.137 -6.942 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.720 -4.256 -8.189 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -13.730 -5.292 -9.198 1.00 0.00 H new ATOM 0 HE ARG A 55 -16.597 -4.727 -9.495 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.106 -7.116 -10.314 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -14.893 -7.551 -11.835 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -17.511 -5.232 -11.461 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -16.805 -6.493 -12.477 1.00 0.00 H new ATOM 923 N ASN A 56 -12.509 -9.485 -6.126 1.00 0.00 N ATOM 924 CA ASN A 56 -12.432 -10.913 -6.429 1.00 0.00 C ATOM 925 C ASN A 56 -12.833 -11.723 -5.192 1.00 0.00 C ATOM 926 O ASN A 56 -13.697 -12.595 -5.258 1.00 0.00 O ATOM 927 CB ASN A 56 -11.034 -11.298 -6.937 1.00 0.00 C ATOM 928 CG ASN A 56 -10.904 -11.024 -8.427 1.00 0.00 C ATOM 929 OD1 ASN A 56 -11.461 -11.753 -9.241 1.00 0.00 O ATOM 930 ND2 ASN A 56 -10.240 -9.954 -8.824 1.00 0.00 N ATOM 0 H ASN A 56 -11.593 -9.039 -6.068 1.00 0.00 H new ATOM 0 HA ASN A 56 -13.131 -11.145 -7.232 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -10.277 -10.734 -6.392 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.849 -12.354 -6.740 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -10.186 -9.726 -9.817 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -9.781 -9.355 -8.138 1.00 0.00 H new ATOM 937 N VAL A 57 -12.251 -11.416 -4.038 1.00 0.00 N ATOM 938 CA VAL A 57 -12.517 -12.072 -2.764 1.00 0.00 C ATOM 939 C VAL A 57 -14.029 -11.984 -2.457 1.00 0.00 C ATOM 940 O VAL A 57 -14.643 -12.992 -2.092 1.00 0.00 O ATOM 941 CB VAL A 57 -11.566 -11.447 -1.721 1.00 0.00 C ATOM 942 CG1 VAL A 57 -11.814 -12.015 -0.333 1.00 0.00 C ATOM 943 CG2 VAL A 57 -10.088 -11.741 -2.037 1.00 0.00 C ATOM 0 H VAL A 57 -11.554 -10.675 -3.962 1.00 0.00 H new ATOM 0 HA VAL A 57 -12.306 -13.141 -2.764 1.00 0.00 H new ATOM 0 HB VAL A 57 -11.766 -10.376 -1.757 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -11.128 -11.554 0.377 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.841 -11.807 -0.033 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.652 -13.093 -0.347 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.455 -11.282 -1.277 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.925 -12.819 -2.043 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.836 -11.331 -3.015 1.00 0.00 H new ATOM 953 N PHE A 58 -14.671 -10.827 -2.680 1.00 0.00 N ATOM 954 CA PHE A 58 -16.106 -10.648 -2.431 1.00 0.00 C ATOM 955 C PHE A 58 -16.954 -11.464 -3.414 1.00 0.00 C ATOM 956 O PHE A 58 -17.993 -11.994 -3.018 1.00 0.00 O ATOM 957 CB PHE A 58 -16.518 -9.163 -2.513 1.00 0.00 C ATOM 958 CG PHE A 58 -16.668 -8.437 -1.184 1.00 0.00 C ATOM 959 CD1 PHE A 58 -15.620 -8.417 -0.244 1.00 0.00 C ATOM 960 CD2 PHE A 58 -17.860 -7.738 -0.897 1.00 0.00 C ATOM 961 CE1 PHE A 58 -15.759 -7.692 0.956 1.00 0.00 C ATOM 962 CE2 PHE A 58 -17.995 -7.014 0.302 1.00 0.00 C ATOM 963 CZ PHE A 58 -16.943 -6.984 1.231 1.00 0.00 C ATOM 0 H PHE A 58 -14.209 -9.991 -3.038 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.291 -11.009 -1.419 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -15.777 -8.634 -3.112 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.465 -9.099 -3.048 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.707 -8.959 -0.443 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.676 -7.759 -1.604 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.950 -7.680 1.671 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -18.911 -6.480 0.508 1.00 0.00 H new ATOM 0 HZ PHE A 58 -17.042 -6.423 2.148 1.00 0.00 H new ATOM 973 N VAL A 59 -16.584 -11.544 -4.701 1.00 0.00 N ATOM 974 CA VAL A 59 -17.390 -12.328 -5.655 1.00 0.00 C ATOM 975 C VAL A 59 -17.342 -13.819 -5.309 1.00 0.00 C ATOM 976 O VAL A 59 -18.325 -14.538 -5.504 1.00 0.00 O ATOM 977 CB VAL A 59 -17.011 -12.033 -7.128 1.00 0.00 C ATOM 978 CG1 VAL A 59 -15.786 -12.759 -7.697 1.00 0.00 C ATOM 979 CG2 VAL A 59 -18.175 -12.346 -8.072 1.00 0.00 C ATOM 0 H VAL A 59 -15.760 -11.093 -5.098 1.00 0.00 H new ATOM 0 HA VAL A 59 -18.428 -12.011 -5.557 1.00 0.00 H new ATOM 0 HB VAL A 59 -16.760 -10.973 -7.083 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -15.636 -12.461 -8.734 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -14.904 -12.497 -7.113 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -15.947 -13.836 -7.649 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -17.879 -12.129 -9.098 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -18.440 -13.400 -7.986 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -19.035 -11.732 -7.805 1.00 0.00 H new ATOM 989 N SER A 60 -16.213 -14.272 -4.764 1.00 0.00 N ATOM 990 CA SER A 60 -16.016 -15.656 -4.393 1.00 0.00 C ATOM 991 C SER A 60 -16.774 -15.989 -3.106 1.00 0.00 C ATOM 992 O SER A 60 -17.223 -17.121 -2.943 1.00 0.00 O ATOM 993 CB SER A 60 -14.505 -15.891 -4.255 1.00 0.00 C ATOM 994 OG SER A 60 -14.167 -17.193 -4.682 1.00 0.00 O ATOM 0 H SER A 60 -15.408 -13.676 -4.570 1.00 0.00 H new ATOM 0 HA SER A 60 -16.416 -16.321 -5.158 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.961 -15.155 -4.847 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.203 -15.752 -3.217 1.00 0.00 H new ATOM 0 HG SER A 60 -13.201 -17.327 -4.590 1.00 0.00 H new ATOM 1000 N GLU A 61 -16.999 -15.006 -2.229 1.00 0.00 N ATOM 1001 CA GLU A 61 -17.684 -15.220 -0.962 1.00 0.00 C ATOM 1002 C GLU A 61 -19.171 -15.535 -1.076 1.00 0.00 C ATOM 1003 O GLU A 61 -19.747 -16.044 -0.113 1.00 0.00 O ATOM 1004 CB GLU A 61 -17.531 -13.972 -0.077 1.00 0.00 C ATOM 1005 CG GLU A 61 -17.680 -14.306 1.419 1.00 0.00 C ATOM 1006 CD GLU A 61 -16.837 -15.499 1.870 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -15.641 -15.582 1.521 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -17.383 -16.388 2.558 1.00 0.00 O ATOM 0 H GLU A 61 -16.709 -14.040 -2.383 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.209 -16.101 -0.530 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.555 -13.520 -0.252 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.280 -13.232 -0.360 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.400 -13.432 2.007 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.729 -14.512 1.633 1.00 0.00 H new ATOM 1015 N ARG A 62 -19.806 -15.229 -2.212 1.00 0.00 N ATOM 1016 CA ARG A 62 -21.231 -15.454 -2.473 1.00 0.00 C ATOM 1017 C ARG A 62 -22.144 -14.433 -1.786 1.00 0.00 C ATOM 1018 O ARG A 62 -23.359 -14.470 -2.014 1.00 0.00 O ATOM 1019 CB ARG A 62 -21.659 -16.881 -2.064 1.00 0.00 C ATOM 1020 CG ARG A 62 -22.604 -17.534 -3.063 1.00 0.00 C ATOM 1021 CD ARG A 62 -21.771 -18.072 -4.231 1.00 0.00 C ATOM 1022 NE ARG A 62 -22.445 -19.144 -4.965 1.00 0.00 N ATOM 1023 CZ ARG A 62 -21.853 -19.889 -5.904 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -20.569 -19.716 -6.212 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -22.552 -20.809 -6.542 1.00 0.00 N ATOM 0 H ARG A 62 -19.324 -14.802 -3.003 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.351 -15.329 -3.549 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.770 -17.503 -1.955 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -22.143 -16.842 -1.088 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -23.159 -18.343 -2.588 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -23.337 -16.811 -3.421 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -21.546 -17.255 -4.917 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -20.818 -18.442 -3.851 1.00 0.00 H new ATOM 0 HE ARG A 62 -23.423 -19.334 -4.747 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -20.020 -19.005 -5.728 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -20.135 -20.294 -6.931 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -23.537 -20.948 -6.317 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -22.107 -21.381 -7.260 1.00 0.00 H new ATOM 1039 N LYS A 63 -21.618 -13.498 -0.986 1.00 0.00 N ATOM 1040 CA LYS A 63 -22.399 -12.498 -0.268 1.00 0.00 C ATOM 1041 C LYS A 63 -21.846 -11.120 -0.576 1.00 0.00 C ATOM 1042 O LYS A 63 -20.632 -10.944 -0.526 1.00 0.00 O ATOM 1043 CB LYS A 63 -22.505 -12.843 1.232 1.00 0.00 C ATOM 1044 CG LYS A 63 -21.165 -12.954 1.977 1.00 0.00 C ATOM 1045 CD LYS A 63 -21.171 -13.981 3.122 1.00 0.00 C ATOM 1046 CE LYS A 63 -22.144 -13.667 4.268 1.00 0.00 C ATOM 1047 NZ LYS A 63 -21.658 -12.562 5.121 1.00 0.00 N ATOM 0 H LYS A 63 -20.615 -13.418 -0.820 1.00 0.00 H new ATOM 0 HA LYS A 63 -23.433 -12.497 -0.612 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -23.112 -12.081 1.721 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -23.038 -13.788 1.334 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.386 -13.224 1.264 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -20.903 -11.976 2.381 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -21.420 -14.960 2.711 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -20.163 -14.054 3.530 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -23.118 -13.404 3.855 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -22.286 -14.560 4.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -22.241 -12.505 5.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -20.668 -12.737 5.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -21.723 -11.665 4.598 1.00 0.00 H new ATOM 1061 N PRO A 64 -22.699 -10.136 -0.913 1.00 0.00 N ATOM 1062 CA PRO A 64 -22.231 -8.798 -1.228 1.00 0.00 C ATOM 1063 C PRO A 64 -21.906 -7.976 0.026 1.00 0.00 C ATOM 1064 O PRO A 64 -21.441 -6.841 -0.104 1.00 0.00 O ATOM 1065 CB PRO A 64 -23.391 -8.154 -1.996 1.00 0.00 C ATOM 1066 CG PRO A 64 -24.620 -8.778 -1.332 1.00 0.00 C ATOM 1067 CD PRO A 64 -24.154 -10.201 -1.020 1.00 0.00 C ATOM 0 HA PRO A 64 -21.303 -8.835 -1.799 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -23.387 -7.068 -1.901 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -23.347 -8.381 -3.061 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -24.908 -8.240 -0.429 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -25.485 -8.772 -1.996 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -24.597 -10.562 -0.092 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -24.456 -10.892 -1.807 1.00 0.00 H new ATOM 1075 N ALA A 65 -22.195 -8.506 1.221 1.00 0.00 N ATOM 1076 CA ALA A 65 -21.957 -7.836 2.492 1.00 0.00 C ATOM 1077 C ALA A 65 -21.329 -8.838 3.461 1.00 0.00 C ATOM 1078 O ALA A 65 -21.830 -9.959 3.614 1.00 0.00 O ATOM 1079 CB ALA A 65 -23.274 -7.236 2.989 1.00 0.00 C ATOM 0 H ALA A 65 -22.609 -9.432 1.326 1.00 0.00 H new ATOM 0 HA ALA A 65 -21.255 -7.008 2.394 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -23.108 -6.731 3.941 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -23.646 -6.518 2.258 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -24.008 -8.030 3.123 1.00 0.00 H new ATOM 1085 N LEU A 66 -20.219 -8.460 4.091 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.439 -9.280 5.021 1.00 0.00 C ATOM 1087 C LEU A 66 -19.288 -8.567 6.359 1.00 0.00 C ATOM 1088 O LEU A 66 -19.367 -7.339 6.413 1.00 0.00 O ATOM 1089 CB LEU A 66 -18.036 -9.513 4.430 1.00 0.00 C ATOM 1090 CG LEU A 66 -17.868 -10.645 3.396 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -18.516 -10.370 2.032 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -16.369 -10.849 3.155 1.00 0.00 C ATOM 0 H LEU A 66 -19.819 -7.531 3.962 1.00 0.00 H new ATOM 0 HA LEU A 66 -19.955 -10.228 5.173 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.711 -8.583 3.964 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.353 -9.711 5.257 1.00 0.00 H new ATOM 0 HG LEU A 66 -18.368 -11.517 3.816 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -18.347 -11.220 1.371 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -19.588 -10.219 2.162 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -18.074 -9.475 1.593 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -16.223 -11.646 2.426 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -15.933 -9.925 2.775 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.884 -11.121 4.092 1.00 0.00 H new ATOM 1104 N THR A 67 -19.094 -9.332 7.435 1.00 0.00 N ATOM 1105 CA THR A 67 -18.906 -8.764 8.760 1.00 0.00 C ATOM 1106 C THR A 67 -17.530 -8.096 8.778 1.00 0.00 C ATOM 1107 O THR A 67 -16.611 -8.563 8.103 1.00 0.00 O ATOM 1108 CB THR A 67 -18.985 -9.853 9.848 1.00 0.00 C ATOM 1109 OG1 THR A 67 -19.893 -10.892 9.493 1.00 0.00 O ATOM 1110 CG2 THR A 67 -19.409 -9.234 11.184 1.00 0.00 C ATOM 0 H THR A 67 -19.064 -10.351 7.408 1.00 0.00 H new ATOM 0 HA THR A 67 -19.693 -8.041 8.972 1.00 0.00 H new ATOM 0 HB THR A 67 -17.992 -10.292 9.944 1.00 0.00 H new ATOM 0 HG1 THR A 67 -20.765 -10.503 9.271 1.00 0.00 H new ATOM 0 HG21 THR A 67 -19.462 -10.012 11.945 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.680 -8.482 11.484 1.00 0.00 H new ATOM 0 HG23 THR A 67 -20.388 -8.767 11.074 1.00 0.00 H new ATOM 1118 N MET A 68 -17.381 -7.040 9.578 1.00 0.00 N ATOM 1119 CA MET A 68 -16.153 -6.279 9.744 1.00 0.00 C ATOM 1120 C MET A 68 -14.992 -7.234 10.013 1.00 0.00 C ATOM 1121 O MET A 68 -13.994 -7.212 9.308 1.00 0.00 O ATOM 1122 CB MET A 68 -16.370 -5.288 10.904 1.00 0.00 C ATOM 1123 CG MET A 68 -15.135 -4.468 11.288 1.00 0.00 C ATOM 1124 SD MET A 68 -14.442 -3.429 9.977 1.00 0.00 S ATOM 1125 CE MET A 68 -15.805 -2.280 9.654 1.00 0.00 C ATOM 0 H MET A 68 -18.146 -6.681 10.149 1.00 0.00 H new ATOM 0 HA MET A 68 -15.904 -5.719 8.842 1.00 0.00 H new ATOM 0 HB2 MET A 68 -17.173 -4.603 10.633 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.707 -5.843 11.779 1.00 0.00 H new ATOM 0 HG2 MET A 68 -15.394 -3.830 12.133 1.00 0.00 H new ATOM 0 HG3 MET A 68 -14.360 -5.153 11.631 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.437 -1.433 9.075 1.00 0.00 H new ATOM 0 HE2 MET A 68 -16.587 -2.791 9.092 1.00 0.00 H new ATOM 0 HE3 MET A 68 -16.212 -1.924 10.600 1.00 0.00 H new ATOM 1135 N GLU A 69 -15.165 -8.113 10.997 1.00 0.00 N ATOM 1136 CA GLU A 69 -14.179 -9.093 11.423 1.00 0.00 C ATOM 1137 C GLU A 69 -13.778 -10.066 10.310 1.00 0.00 C ATOM 1138 O GLU A 69 -12.618 -10.469 10.233 1.00 0.00 O ATOM 1139 CB GLU A 69 -14.805 -9.829 12.608 1.00 0.00 C ATOM 1140 CG GLU A 69 -13.927 -10.944 13.170 1.00 0.00 C ATOM 1141 CD GLU A 69 -14.620 -11.567 14.371 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -15.626 -12.286 14.159 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -14.226 -11.298 15.532 1.00 0.00 O ATOM 0 H GLU A 69 -16.029 -8.161 11.537 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.249 -8.595 11.698 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.016 -9.111 13.400 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.761 -10.252 12.298 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -13.746 -11.701 12.407 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.955 -10.546 13.462 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.727 -10.482 9.470 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.457 -11.415 8.385 1.00 0.00 C ATOM 1152 C VAL A 70 -13.510 -10.737 7.395 1.00 0.00 C ATOM 1153 O VAL A 70 -12.430 -11.267 7.128 1.00 0.00 O ATOM 1154 CB VAL A 70 -15.775 -11.917 7.758 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.518 -12.871 6.586 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.632 -12.667 8.793 1.00 0.00 C ATOM 0 H VAL A 70 -15.700 -10.181 9.526 1.00 0.00 H new ATOM 0 HA VAL A 70 -13.960 -12.314 8.751 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.300 -11.030 7.403 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.470 -13.203 6.171 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -14.947 -12.354 5.815 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -14.955 -13.735 6.937 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.554 -13.009 8.323 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -16.077 -13.526 9.171 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -16.873 -11.998 9.619 1.00 0.00 H new ATOM 1166 N VAL A 71 -13.887 -9.565 6.869 1.00 0.00 N ATOM 1167 CA VAL A 71 -13.031 -8.852 5.915 1.00 0.00 C ATOM 1168 C VAL A 71 -11.694 -8.445 6.563 1.00 0.00 C ATOM 1169 O VAL A 71 -10.677 -8.364 5.876 1.00 0.00 O ATOM 1170 CB VAL A 71 -13.737 -7.620 5.305 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -13.028 -7.205 4.010 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -15.203 -7.851 4.941 1.00 0.00 C ATOM 0 H VAL A 71 -14.767 -9.096 7.084 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.823 -9.545 5.100 1.00 0.00 H new ATOM 0 HB VAL A 71 -13.692 -6.856 6.081 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -13.529 -6.336 3.583 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -11.990 -6.955 4.228 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.061 -8.029 3.297 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -15.622 -6.937 4.520 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -15.274 -8.654 4.207 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -15.761 -8.127 5.836 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.685 -8.219 7.877 1.00 0.00 N ATOM 1183 CA CYS A 72 -10.526 -7.815 8.657 1.00 0.00 C ATOM 1184 C CYS A 72 -9.426 -8.857 8.510 1.00 0.00 C ATOM 1185 O CYS A 72 -8.374 -8.561 7.932 1.00 0.00 O ATOM 1186 CB CYS A 72 -10.929 -7.568 10.121 1.00 0.00 C ATOM 1187 SG CYS A 72 -9.617 -6.705 11.011 1.00 0.00 S ATOM 0 H CYS A 72 -12.525 -8.318 8.447 1.00 0.00 H new ATOM 0 HA CYS A 72 -10.130 -6.871 8.282 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.846 -6.980 10.156 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -11.141 -8.519 10.610 1.00 0.00 H new ATOM 0 HG CYS A 72 -9.985 -6.508 12.242 1.00 0.00 H new ATOM 1193 N ALA A 73 -9.687 -10.074 9.001 1.00 0.00 N ATOM 1194 CA ALA A 73 -8.740 -11.175 8.927 1.00 0.00 C ATOM 1195 C ALA A 73 -8.342 -11.409 7.473 1.00 0.00 C ATOM 1196 O ALA A 73 -7.163 -11.512 7.148 1.00 0.00 O ATOM 1197 CB ALA A 73 -9.362 -12.446 9.506 1.00 0.00 C ATOM 0 H ALA A 73 -10.565 -10.316 9.460 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.854 -10.922 9.509 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.643 -13.263 9.445 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.631 -12.277 10.549 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.255 -12.705 8.938 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.336 -11.464 6.586 1.00 0.00 N ATOM 1204 CA ARG A 74 -9.156 -11.693 5.158 1.00 0.00 C ATOM 1205 C ARG A 74 -8.205 -10.707 4.493 1.00 0.00 C ATOM 1206 O ARG A 74 -7.556 -11.097 3.515 1.00 0.00 O ATOM 1207 CB ARG A 74 -10.547 -11.637 4.515 1.00 0.00 C ATOM 1208 CG ARG A 74 -11.285 -12.970 4.700 1.00 0.00 C ATOM 1209 CD ARG A 74 -10.843 -13.991 3.644 1.00 0.00 C ATOM 1210 NE ARG A 74 -11.583 -15.249 3.809 1.00 0.00 N ATOM 1211 CZ ARG A 74 -12.162 -15.907 2.802 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -11.743 -15.754 1.551 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -13.173 -16.725 3.044 1.00 0.00 N ATOM 0 H ARG A 74 -10.314 -11.347 6.851 1.00 0.00 H new ATOM 0 HA ARG A 74 -8.686 -12.666 5.015 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.127 -10.830 4.962 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.453 -11.412 3.453 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -11.088 -13.364 5.697 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.360 -12.808 4.627 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.014 -13.589 2.646 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -9.773 -14.177 3.733 1.00 0.00 H new ATOM 0 HE ARG A 74 -11.659 -15.643 4.747 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -10.966 -15.125 1.347 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -12.198 -16.265 0.795 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -13.509 -16.852 3.999 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -13.617 -17.229 2.276 1.00 0.00 H new ATOM 1227 N MET A 75 -8.123 -9.465 4.964 1.00 0.00 N ATOM 1228 CA MET A 75 -7.238 -8.479 4.377 1.00 0.00 C ATOM 1229 C MET A 75 -5.867 -8.525 5.043 1.00 0.00 C ATOM 1230 O MET A 75 -4.857 -8.586 4.342 1.00 0.00 O ATOM 1231 CB MET A 75 -7.852 -7.073 4.473 1.00 0.00 C ATOM 1232 CG MET A 75 -7.449 -6.239 3.251 1.00 0.00 C ATOM 1233 SD MET A 75 -8.240 -6.669 1.666 1.00 0.00 S ATOM 1234 CE MET A 75 -10.007 -6.578 2.078 1.00 0.00 C ATOM 0 H MET A 75 -8.666 -9.122 5.757 1.00 0.00 H new ATOM 0 HA MET A 75 -7.108 -8.717 3.321 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.938 -7.145 4.532 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.515 -6.582 5.386 1.00 0.00 H new ATOM 0 HG2 MET A 75 -7.667 -5.193 3.467 1.00 0.00 H new ATOM 0 HG3 MET A 75 -6.369 -6.320 3.125 1.00 0.00 H new ATOM 0 HE1 MET A 75 -10.550 -6.120 1.251 1.00 0.00 H new ATOM 0 HE2 MET A 75 -10.392 -7.583 2.253 1.00 0.00 H new ATOM 0 HE3 MET A 75 -10.140 -5.976 2.977 1.00 0.00 H new ATOM 1244 N VAL A 76 -5.806 -8.498 6.379 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.539 -8.501 7.101 1.00 0.00 C ATOM 1246 C VAL A 76 -3.728 -9.782 6.887 1.00 0.00 C ATOM 1247 O VAL A 76 -2.507 -9.699 6.800 1.00 0.00 O ATOM 1248 CB VAL A 76 -4.772 -8.123 8.577 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -5.303 -9.271 9.441 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -3.490 -7.542 9.182 1.00 0.00 C ATOM 0 H VAL A 76 -6.629 -8.474 6.981 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.896 -7.729 6.678 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.558 -7.368 8.575 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.440 -8.923 10.465 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.258 -9.614 9.044 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.589 -10.095 9.430 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.667 -7.279 10.225 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.693 -8.283 9.125 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.197 -6.651 8.627 1.00 0.00 H new ATOM 1260 N ASP A 77 -4.364 -10.945 6.716 1.00 0.00 N ATOM 1261 CA ASP A 77 -3.665 -12.222 6.493 1.00 0.00 C ATOM 1262 C ASP A 77 -2.844 -12.183 5.202 1.00 0.00 C ATOM 1263 O ASP A 77 -1.894 -12.945 5.024 1.00 0.00 O ATOM 1264 CB ASP A 77 -4.689 -13.348 6.382 1.00 0.00 C ATOM 1265 CG ASP A 77 -4.082 -14.745 6.477 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -3.740 -15.164 7.609 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -4.150 -15.482 5.465 1.00 0.00 O ATOM 0 H ASP A 77 -5.380 -11.031 6.728 1.00 0.00 H new ATOM 0 HA ASP A 77 -2.994 -12.392 7.335 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.431 -13.230 7.171 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.216 -13.255 5.432 1.00 0.00 H new ATOM 1272 N SER A 78 -3.215 -11.278 4.288 1.00 0.00 N ATOM 1273 CA SER A 78 -2.566 -11.066 3.008 1.00 0.00 C ATOM 1274 C SER A 78 -1.207 -10.389 3.216 1.00 0.00 C ATOM 1275 O SER A 78 -0.506 -10.121 2.242 1.00 0.00 O ATOM 1276 CB SER A 78 -3.486 -10.226 2.108 1.00 0.00 C ATOM 1277 OG SER A 78 -3.239 -10.435 0.725 1.00 0.00 O ATOM 0 H SER A 78 -4.008 -10.654 4.435 1.00 0.00 H new ATOM 0 HA SER A 78 -2.385 -12.022 2.517 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.525 -10.471 2.328 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.351 -9.170 2.342 1.00 0.00 H new ATOM 0 HG SER A 78 -3.850 -9.880 0.196 1.00 0.00 H new ATOM 1283 N CYS A 79 -0.803 -10.084 4.456 1.00 0.00 N ATOM 1284 CA CYS A 79 0.469 -9.456 4.759 1.00 0.00 C ATOM 1285 C CYS A 79 1.656 -10.349 4.412 1.00 0.00 C ATOM 1286 O CYS A 79 2.788 -9.862 4.445 1.00 0.00 O ATOM 1287 CB CYS A 79 0.525 -9.058 6.233 1.00 0.00 C ATOM 1288 SG CYS A 79 0.579 -10.508 7.331 1.00 0.00 S ATOM 0 H CYS A 79 -1.368 -10.274 5.284 1.00 0.00 H new ATOM 0 HA CYS A 79 0.542 -8.564 4.137 1.00 0.00 H new ATOM 0 HB2 CYS A 79 1.405 -8.438 6.408 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -0.346 -8.451 6.478 1.00 0.00 H new ATOM 0 HG CYS A 79 -0.632 -10.853 7.654 1.00 0.00 H new ATOM 1294 N GLN A 80 1.414 -11.623 4.083 1.00 0.00 N ATOM 1295 CA GLN A 80 2.396 -12.635 3.713 1.00 0.00 C ATOM 1296 C GLN A 80 3.112 -12.348 2.372 1.00 0.00 C ATOM 1297 O GLN A 80 3.217 -13.220 1.508 1.00 0.00 O ATOM 1298 CB GLN A 80 1.725 -14.020 3.783 1.00 0.00 C ATOM 1299 CG GLN A 80 0.513 -14.238 2.851 1.00 0.00 C ATOM 1300 CD GLN A 80 -0.207 -15.572 3.076 1.00 0.00 C ATOM 1301 OE1 GLN A 80 -1.376 -15.729 2.729 1.00 0.00 O ATOM 1302 NE2 GLN A 80 0.449 -16.598 3.597 1.00 0.00 N ATOM 0 H GLN A 80 0.464 -11.993 4.069 1.00 0.00 H new ATOM 0 HA GLN A 80 3.215 -12.611 4.432 1.00 0.00 H new ATOM 0 HB2 GLN A 80 2.475 -14.776 3.552 1.00 0.00 H new ATOM 0 HB3 GLN A 80 1.403 -14.193 4.810 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -0.197 -13.424 2.996 1.00 0.00 H new ATOM 0 HG3 GLN A 80 0.849 -14.187 1.815 1.00 0.00 H new ATOM 0 HE21 GLN A 80 1.419 -16.487 3.891 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -0.016 -17.499 3.705 1.00 0.00 H new ATOM 1311 N THR A 81 3.600 -11.124 2.177 1.00 0.00 N ATOM 1312 CA THR A 81 4.315 -10.667 1.004 1.00 0.00 C ATOM 1313 C THR A 81 5.585 -9.945 1.486 1.00 0.00 C ATOM 1314 O THR A 81 6.603 -10.611 1.703 1.00 0.00 O ATOM 1315 CB THR A 81 3.380 -9.897 0.040 1.00 0.00 C ATOM 1316 OG1 THR A 81 4.107 -9.120 -0.893 1.00 0.00 O ATOM 1317 CG2 THR A 81 2.381 -8.981 0.751 1.00 0.00 C ATOM 0 H THR A 81 3.497 -10.390 2.877 1.00 0.00 H new ATOM 0 HA THR A 81 4.658 -11.487 0.373 1.00 0.00 H new ATOM 0 HB THR A 81 2.821 -10.679 -0.475 1.00 0.00 H new ATOM 0 HG1 THR A 81 4.018 -9.514 -1.786 1.00 0.00 H new ATOM 0 HG21 THR A 81 1.761 -8.475 0.011 1.00 0.00 H new ATOM 0 HG22 THR A 81 1.748 -9.575 1.410 1.00 0.00 H new ATOM 0 HG23 THR A 81 2.922 -8.239 1.339 1.00 0.00 H new ATOM 1325 N ALA A 82 5.545 -8.624 1.712 1.00 0.00 N ATOM 1326 CA ALA A 82 6.688 -7.814 2.150 1.00 0.00 C ATOM 1327 C ALA A 82 6.237 -6.440 2.677 1.00 0.00 C ATOM 1328 O ALA A 82 6.870 -5.419 2.401 1.00 0.00 O ATOM 1329 CB ALA A 82 7.674 -7.649 0.980 1.00 0.00 C ATOM 0 H ALA A 82 4.693 -8.076 1.592 1.00 0.00 H new ATOM 0 HA ALA A 82 7.183 -8.329 2.973 1.00 0.00 H new ATOM 0 HB1 ALA A 82 8.524 -7.048 1.303 1.00 0.00 H new ATOM 0 HB2 ALA A 82 8.024 -8.630 0.658 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.173 -7.152 0.149 1.00 0.00 H new ATOM 1335 N LEU A 83 5.094 -6.384 3.363 1.00 0.00 N ATOM 1336 CA LEU A 83 4.517 -5.171 3.940 1.00 0.00 C ATOM 1337 C LEU A 83 4.020 -5.478 5.357 1.00 0.00 C ATOM 1338 O LEU A 83 3.805 -6.639 5.716 1.00 0.00 O ATOM 1339 CB LEU A 83 3.462 -4.552 2.990 1.00 0.00 C ATOM 1340 CG LEU A 83 2.470 -5.523 2.328 1.00 0.00 C ATOM 1341 CD1 LEU A 83 1.505 -6.104 3.349 1.00 0.00 C ATOM 1342 CD2 LEU A 83 1.639 -4.830 1.254 1.00 0.00 C ATOM 0 H LEU A 83 4.525 -7.212 3.538 1.00 0.00 H new ATOM 0 HA LEU A 83 5.272 -4.392 4.043 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.890 -3.813 3.552 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.989 -4.015 2.201 1.00 0.00 H new ATOM 0 HG LEU A 83 3.071 -6.314 1.881 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.816 -6.787 2.851 1.00 0.00 H new ATOM 0 HD12 LEU A 83 2.065 -6.645 4.112 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.941 -5.297 3.817 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.950 -5.547 0.808 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.073 -4.013 1.702 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.299 -4.434 0.482 1.00 0.00 H new ATOM 1354 N SER A 84 3.822 -4.447 6.171 1.00 0.00 N ATOM 1355 CA SER A 84 3.382 -4.586 7.554 1.00 0.00 C ATOM 1356 C SER A 84 1.844 -4.548 7.663 1.00 0.00 C ATOM 1357 O SER A 84 1.193 -3.971 6.786 1.00 0.00 O ATOM 1358 CB SER A 84 4.102 -3.500 8.359 1.00 0.00 C ATOM 1359 OG SER A 84 5.507 -3.588 8.142 1.00 0.00 O ATOM 0 H SER A 84 3.965 -3.478 5.885 1.00 0.00 H new ATOM 0 HA SER A 84 3.646 -5.559 7.968 1.00 0.00 H new ATOM 0 HB2 SER A 84 3.740 -2.515 8.063 1.00 0.00 H new ATOM 0 HB3 SER A 84 3.881 -3.615 9.420 1.00 0.00 H new ATOM 0 HG SER A 84 5.962 -2.890 8.658 1.00 0.00 H new ATOM 1365 N PRO A 85 1.240 -5.105 8.732 1.00 0.00 N ATOM 1366 CA PRO A 85 -0.214 -5.161 8.923 1.00 0.00 C ATOM 1367 C PRO A 85 -0.942 -3.819 8.962 1.00 0.00 C ATOM 1368 O PRO A 85 -2.088 -3.740 8.518 1.00 0.00 O ATOM 1369 CB PRO A 85 -0.438 -5.965 10.204 1.00 0.00 C ATOM 1370 CG PRO A 85 0.884 -5.869 10.947 1.00 0.00 C ATOM 1371 CD PRO A 85 1.908 -5.803 9.820 1.00 0.00 C ATOM 0 HA PRO A 85 -0.655 -5.630 8.043 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -1.256 -5.552 10.794 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -0.695 -7.001 9.983 1.00 0.00 H new ATOM 0 HG2 PRO A 85 0.926 -4.985 11.583 1.00 0.00 H new ATOM 0 HG3 PRO A 85 1.048 -6.733 11.591 1.00 0.00 H new ATOM 0 HD2 PRO A 85 2.806 -5.271 10.135 1.00 0.00 H new ATOM 0 HD3 PRO A 85 2.220 -6.801 9.513 1.00 0.00 H new ATOM 1379 N GLY A 86 -0.311 -2.753 9.456 1.00 0.00 N ATOM 1380 CA GLY A 86 -0.978 -1.461 9.519 1.00 0.00 C ATOM 1381 C GLY A 86 -1.173 -0.818 8.153 1.00 0.00 C ATOM 1382 O GLY A 86 -2.145 -0.089 7.967 1.00 0.00 O ATOM 0 H GLY A 86 0.645 -2.761 9.812 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.950 -1.584 9.997 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.395 -0.789 10.149 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.279 -1.082 7.198 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.337 -0.522 5.845 1.00 0.00 C ATOM 1388 C GLU A 87 -1.632 -0.971 5.156 1.00 0.00 C ATOM 1389 O GLU A 87 -2.303 -0.197 4.469 1.00 0.00 O ATOM 1390 CB GLU A 87 0.913 -0.927 5.048 1.00 0.00 C ATOM 1391 CG GLU A 87 2.244 -0.874 5.822 1.00 0.00 C ATOM 1392 CD GLU A 87 2.734 0.518 6.236 1.00 0.00 C ATOM 1393 OE1 GLU A 87 1.947 1.449 6.528 1.00 0.00 O ATOM 1394 OE2 GLU A 87 3.975 0.670 6.306 1.00 0.00 O ATOM 0 H GLU A 87 0.519 -1.701 7.345 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.347 0.567 5.897 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.771 -1.941 4.675 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.994 -0.276 4.178 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.141 -1.482 6.721 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.015 -1.340 5.209 1.00 0.00 H new ATOM 1401 N MET A 88 -2.015 -2.229 5.395 1.00 0.00 N ATOM 1402 CA MET A 88 -3.234 -2.812 4.861 1.00 0.00 C ATOM 1403 C MET A 88 -4.408 -1.939 5.312 1.00 0.00 C ATOM 1404 O MET A 88 -5.231 -1.509 4.509 1.00 0.00 O ATOM 1405 CB MET A 88 -3.374 -4.244 5.399 1.00 0.00 C ATOM 1406 CG MET A 88 -4.321 -5.086 4.548 1.00 0.00 C ATOM 1407 SD MET A 88 -3.667 -5.572 2.926 1.00 0.00 S ATOM 1408 CE MET A 88 -2.267 -6.609 3.429 1.00 0.00 C ATOM 0 H MET A 88 -1.475 -2.873 5.973 1.00 0.00 H new ATOM 0 HA MET A 88 -3.214 -2.854 3.772 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.393 -4.718 5.426 1.00 0.00 H new ATOM 0 HB3 MET A 88 -3.741 -4.211 6.425 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.580 -5.987 5.103 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.245 -4.527 4.398 1.00 0.00 H new ATOM 0 HE1 MET A 88 -1.969 -7.247 2.597 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.429 -5.974 3.718 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.560 -7.230 4.275 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.451 -1.629 6.610 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.492 -0.811 7.209 1.00 0.00 C ATOM 1420 C GLU A 89 -5.477 0.601 6.641 1.00 0.00 C ATOM 1421 O GLU A 89 -6.542 1.204 6.510 1.00 0.00 O ATOM 1422 CB GLU A 89 -5.389 -0.848 8.733 1.00 0.00 C ATOM 1423 CG GLU A 89 -5.573 -2.295 9.193 1.00 0.00 C ATOM 1424 CD GLU A 89 -5.724 -2.432 10.704 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -4.739 -2.223 11.446 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -6.800 -2.896 11.146 1.00 0.00 O ATOM 0 H GLU A 89 -3.750 -1.947 7.279 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.465 -1.228 6.949 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -4.421 -0.467 9.057 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -6.149 -0.208 9.180 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.454 -2.714 8.707 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -4.717 -2.885 8.865 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.310 1.160 6.301 1.00 0.00 N ATOM 1434 CA LYS A 90 -4.256 2.487 5.697 1.00 0.00 C ATOM 1435 C LYS A 90 -5.019 2.469 4.372 1.00 0.00 C ATOM 1436 O LYS A 90 -5.688 3.439 4.033 1.00 0.00 O ATOM 1437 CB LYS A 90 -2.813 2.926 5.448 1.00 0.00 C ATOM 1438 CG LYS A 90 -2.062 3.125 6.760 1.00 0.00 C ATOM 1439 CD LYS A 90 -0.805 3.961 6.562 1.00 0.00 C ATOM 1440 CE LYS A 90 -0.173 4.177 7.934 1.00 0.00 C ATOM 1441 NZ LYS A 90 0.673 3.047 8.365 1.00 0.00 N ATOM 0 H LYS A 90 -3.401 0.716 6.434 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.713 3.197 6.386 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.302 2.177 4.843 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.806 3.855 4.878 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.715 3.613 7.484 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.793 2.155 7.177 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.108 3.453 5.895 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.050 4.917 6.099 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.428 5.086 7.912 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.961 4.335 8.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.455 3.403 8.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.102 2.378 8.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 1.059 2.563 7.529 1.00 0.00 H new ATOM 1455 N HIS A 91 -4.932 1.366 3.623 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.634 1.251 2.354 1.00 0.00 C ATOM 1457 C HIS A 91 -7.140 1.139 2.589 1.00 0.00 C ATOM 1458 O HIS A 91 -7.931 1.663 1.805 1.00 0.00 O ATOM 1459 CB HIS A 91 -5.120 0.033 1.582 1.00 0.00 C ATOM 1460 CG HIS A 91 -5.574 0.033 0.150 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -6.786 -0.416 -0.336 1.00 0.00 N ATOM 1462 CD2 HIS A 91 -4.847 0.512 -0.904 1.00 0.00 C ATOM 1463 CE1 HIS A 91 -6.768 -0.229 -1.664 1.00 0.00 C ATOM 1464 NE2 HIS A 91 -5.618 0.339 -2.050 1.00 0.00 N ATOM 0 H HIS A 91 -4.382 0.545 3.878 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.445 2.147 1.762 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -4.031 0.017 1.616 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.467 -0.877 2.071 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -7.550 -0.814 0.211 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -3.858 0.944 -0.856 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -7.572 -0.500 -2.332 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.545 0.476 3.676 1.00 0.00 N ATOM 1473 CA LEU A 92 -8.956 0.302 3.989 1.00 0.00 C ATOM 1474 C LEU A 92 -9.651 1.635 4.232 1.00 0.00 C ATOM 1475 O LEU A 92 -10.740 1.864 3.688 1.00 0.00 O ATOM 1476 CB LEU A 92 -9.163 -0.643 5.178 1.00 0.00 C ATOM 1477 CG LEU A 92 -8.648 -2.064 4.908 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -8.897 -2.941 6.132 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -9.269 -2.676 3.646 1.00 0.00 C ATOM 0 H LEU A 92 -6.910 0.052 4.352 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.415 -0.158 3.114 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.653 -0.237 6.052 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.225 -0.687 5.420 1.00 0.00 H new ATOM 0 HG LEU A 92 -7.575 -2.007 4.724 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -8.531 -3.949 5.938 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -8.373 -2.524 6.992 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -9.966 -2.978 6.342 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -8.874 -3.681 3.497 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.352 -2.725 3.760 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -9.023 -2.058 2.783 1.00 0.00 H new ATOM 1491 N VAL A 93 -9.048 2.497 5.054 1.00 0.00 N ATOM 1492 CA VAL A 93 -9.611 3.807 5.355 1.00 0.00 C ATOM 1493 C VAL A 93 -9.628 4.644 4.074 1.00 0.00 C ATOM 1494 O VAL A 93 -10.672 5.198 3.722 1.00 0.00 O ATOM 1495 CB VAL A 93 -8.889 4.456 6.556 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -7.376 4.643 6.392 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -9.535 5.790 6.943 1.00 0.00 C ATOM 0 H VAL A 93 -8.163 2.305 5.524 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.647 3.723 5.682 1.00 0.00 H new ATOM 0 HB VAL A 93 -9.013 3.729 7.359 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -6.967 5.106 7.290 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -6.904 3.673 6.237 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -7.180 5.283 5.532 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -9.002 6.220 7.791 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.486 6.477 6.098 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -10.577 5.624 7.215 1.00 0.00 H new ATOM 1507 N LEU A 94 -8.494 4.662 3.362 1.00 0.00 N ATOM 1508 CA LEU A 94 -8.261 5.385 2.122 1.00 0.00 C ATOM 1509 C LEU A 94 -9.381 5.158 1.121 1.00 0.00 C ATOM 1510 O LEU A 94 -10.073 6.095 0.742 1.00 0.00 O ATOM 1511 CB LEU A 94 -6.894 4.936 1.559 1.00 0.00 C ATOM 1512 CG LEU A 94 -6.612 5.291 0.090 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -6.290 6.780 -0.062 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -5.432 4.466 -0.433 1.00 0.00 C ATOM 0 H LEU A 94 -7.671 4.139 3.661 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.246 6.457 2.317 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.109 5.377 2.174 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.817 3.854 1.670 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.507 5.063 -0.488 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.094 7.005 -1.110 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.137 7.373 0.284 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.409 7.024 0.532 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.240 4.725 -1.474 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.545 4.681 0.163 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.670 3.405 -0.361 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.570 3.919 0.677 1.00 0.00 N ATOM 1527 CA LEU A 95 -10.586 3.621 -0.318 1.00 0.00 C ATOM 1528 C LEU A 95 -12.007 3.857 0.154 1.00 0.00 C ATOM 1529 O LEU A 95 -12.791 4.403 -0.621 1.00 0.00 O ATOM 1530 CB LEU A 95 -10.402 2.197 -0.833 1.00 0.00 C ATOM 1531 CG LEU A 95 -9.754 2.204 -2.221 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -8.280 2.605 -2.098 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -9.931 0.836 -2.870 1.00 0.00 C ATOM 0 H LEU A 95 -9.034 3.110 0.991 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.440 4.330 -1.133 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -9.781 1.631 -0.139 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.368 1.694 -0.879 1.00 0.00 H new ATOM 0 HG LEU A 95 -10.239 2.938 -2.864 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.820 2.609 -3.086 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -8.209 3.601 -1.660 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -7.761 1.890 -1.460 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -9.470 0.840 -3.858 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -9.456 0.075 -2.251 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -10.994 0.614 -2.966 1.00 0.00 H new ATOM 1545 N ALA A 96 -12.354 3.474 1.385 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.718 3.690 1.852 1.00 0.00 C ATOM 1547 C ALA A 96 -14.077 5.178 1.893 1.00 0.00 C ATOM 1548 O ALA A 96 -15.260 5.508 1.805 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.911 3.049 3.221 1.00 0.00 C ATOM 0 H ALA A 96 -11.729 3.027 2.056 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.394 3.216 1.140 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.933 3.216 3.560 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.723 1.978 3.151 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -13.215 3.494 3.932 1.00 0.00 H new ATOM 1555 N GLU A 97 -13.076 6.059 1.991 1.00 0.00 N ATOM 1556 CA GLU A 97 -13.265 7.497 2.033 1.00 0.00 C ATOM 1557 C GLU A 97 -13.111 8.143 0.653 1.00 0.00 C ATOM 1558 O GLU A 97 -13.825 9.096 0.334 1.00 0.00 O ATOM 1559 CB GLU A 97 -12.243 8.076 3.018 1.00 0.00 C ATOM 1560 CG GLU A 97 -12.578 9.517 3.428 1.00 0.00 C ATOM 1561 CD GLU A 97 -14.032 9.695 3.892 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -14.405 9.193 4.981 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -14.824 10.380 3.198 1.00 0.00 O ATOM 0 H GLU A 97 -12.097 5.779 2.044 1.00 0.00 H new ATOM 0 HA GLU A 97 -14.282 7.714 2.359 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -12.203 7.448 3.908 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -11.252 8.051 2.566 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -11.908 9.824 4.231 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -12.390 10.181 2.584 1.00 0.00 H new ATOM 1570 N LEU A 98 -12.201 7.654 -0.196 1.00 0.00 N ATOM 1571 CA LEU A 98 -12.016 8.227 -1.524 1.00 0.00 C ATOM 1572 C LEU A 98 -13.181 7.850 -2.432 1.00 0.00 C ATOM 1573 O LEU A 98 -13.469 8.603 -3.366 1.00 0.00 O ATOM 1574 CB LEU A 98 -10.700 7.784 -2.192 1.00 0.00 C ATOM 1575 CG LEU A 98 -9.397 8.377 -1.612 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -8.270 8.200 -2.636 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -9.483 9.861 -1.249 1.00 0.00 C ATOM 0 H LEU A 98 -11.587 6.868 0.015 1.00 0.00 H new ATOM 0 HA LEU A 98 -11.973 9.307 -1.386 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.636 6.698 -2.132 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.751 8.042 -3.250 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.208 7.836 -0.685 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.346 8.616 -2.235 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -8.131 7.139 -2.844 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.531 8.719 -3.558 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.525 10.194 -0.850 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.726 10.440 -2.140 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.260 10.008 -0.498 1.00 0.00 H new ATOM 1589 N LEU A 99 -13.865 6.737 -2.154 1.00 0.00 N ATOM 1590 CA LEU A 99 -14.981 6.226 -2.944 1.00 0.00 C ATOM 1591 C LEU A 99 -16.024 5.534 -2.043 1.00 0.00 C ATOM 1592 O LEU A 99 -16.172 4.309 -2.075 1.00 0.00 O ATOM 1593 CB LEU A 99 -14.443 5.375 -4.122 1.00 0.00 C ATOM 1594 CG LEU A 99 -13.180 4.497 -3.889 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -13.514 3.045 -3.553 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -12.247 4.540 -5.104 1.00 0.00 C ATOM 0 H LEU A 99 -13.648 6.151 -1.348 1.00 0.00 H new ATOM 0 HA LEU A 99 -15.532 7.045 -3.406 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -15.248 4.717 -4.450 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -14.228 6.052 -4.949 1.00 0.00 H new ATOM 0 HG LEU A 99 -12.675 4.926 -3.024 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -12.591 2.485 -3.402 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -14.112 3.011 -2.643 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -14.077 2.602 -4.374 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -11.373 3.918 -4.914 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -12.775 4.166 -5.981 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -11.929 5.567 -5.283 1.00 0.00 H new ATOM 1608 N PRO A 100 -16.797 6.313 -1.260 1.00 0.00 N ATOM 1609 CA PRO A 100 -17.820 5.795 -0.348 1.00 0.00 C ATOM 1610 C PRO A 100 -19.034 5.189 -1.063 1.00 0.00 C ATOM 1611 O PRO A 100 -19.903 4.596 -0.419 1.00 0.00 O ATOM 1612 CB PRO A 100 -18.209 6.980 0.537 1.00 0.00 C ATOM 1613 CG PRO A 100 -17.980 8.173 -0.379 1.00 0.00 C ATOM 1614 CD PRO A 100 -16.727 7.762 -1.142 1.00 0.00 C ATOM 0 HA PRO A 100 -17.425 4.961 0.232 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -19.246 6.916 0.866 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -17.592 7.035 1.434 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -18.825 8.341 -1.046 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -17.829 9.094 0.184 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -16.694 8.234 -2.124 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -15.826 8.069 -0.610 1.00 0.00 H new ATOM 1622 N ASP A 101 -19.151 5.361 -2.380 1.00 0.00 N ATOM 1623 CA ASP A 101 -20.248 4.784 -3.154 1.00 0.00 C ATOM 1624 C ASP A 101 -19.963 3.307 -3.430 1.00 0.00 C ATOM 1625 O ASP A 101 -20.886 2.556 -3.749 1.00 0.00 O ATOM 1626 CB ASP A 101 -20.445 5.515 -4.481 1.00 0.00 C ATOM 1627 CG ASP A 101 -19.227 5.406 -5.393 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -18.272 6.185 -5.164 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -19.254 4.627 -6.366 1.00 0.00 O ATOM 0 H ASP A 101 -18.490 5.902 -2.938 1.00 0.00 H new ATOM 0 HA ASP A 101 -21.161 4.888 -2.567 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -21.316 5.105 -4.992 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -20.656 6.566 -4.285 1.00 0.00 H new ATOM 1634 N TRP A 102 -18.703 2.874 -3.297 1.00 0.00 N ATOM 1635 CA TRP A 102 -18.327 1.493 -3.530 1.00 0.00 C ATOM 1636 C TRP A 102 -18.306 0.691 -2.232 1.00 0.00 C ATOM 1637 O TRP A 102 -18.682 -0.481 -2.241 1.00 0.00 O ATOM 1638 CB TRP A 102 -16.951 1.439 -4.198 1.00 0.00 C ATOM 1639 CG TRP A 102 -16.563 0.087 -4.709 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -17.380 -0.730 -5.405 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -15.310 -0.647 -4.563 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.698 -1.854 -5.799 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -15.412 -1.861 -5.305 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -14.116 -0.439 -3.842 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -14.364 -2.790 -5.369 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -13.064 -1.373 -3.885 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -13.183 -2.544 -4.653 1.00 0.00 C ATOM 0 H TRP A 102 -17.926 3.476 -3.026 1.00 0.00 H new ATOM 0 HA TRP A 102 -19.073 1.046 -4.187 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -16.936 2.145 -5.028 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -16.200 1.772 -3.482 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -18.419 -0.529 -5.621 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -17.093 -2.591 -6.383 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -14.007 0.454 -3.245 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -14.465 -3.686 -5.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -12.160 -1.189 -3.324 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -12.368 -3.252 -4.692 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.836 1.296 -1.137 1.00 0.00 N ATOM 1659 CA LEU A 103 -17.740 0.680 0.181 1.00 0.00 C ATOM 1660 C LEU A 103 -18.682 1.410 1.111 1.00 0.00 C ATOM 1661 O LEU A 103 -18.550 2.624 1.287 1.00 0.00 O ATOM 1662 CB LEU A 103 -16.329 0.810 0.755 1.00 0.00 C ATOM 1663 CG LEU A 103 -15.321 -0.151 0.108 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -13.942 0.500 0.003 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -15.251 -1.447 0.927 1.00 0.00 C ATOM 0 H LEU A 103 -17.502 2.260 -1.149 1.00 0.00 H new ATOM 0 HA LEU A 103 -17.990 -0.377 0.088 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -15.982 1.835 0.620 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -16.362 0.623 1.828 1.00 0.00 H new ATOM 0 HG LEU A 103 -15.653 -0.387 -0.903 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -13.244 -0.199 -0.458 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -14.010 1.401 -0.607 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -13.587 0.763 0.999 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -14.536 -2.129 0.468 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -14.933 -1.218 1.944 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -16.235 -1.916 0.952 1.00 0.00 H new ATOM 1677 N SER A 104 -19.569 0.655 1.746 1.00 0.00 N ATOM 1678 CA SER A 104 -20.556 1.202 2.662 1.00 0.00 C ATOM 1679 C SER A 104 -20.471 0.481 4.000 1.00 0.00 C ATOM 1680 O SER A 104 -20.464 -0.751 4.044 1.00 0.00 O ATOM 1681 CB SER A 104 -21.941 1.040 2.056 1.00 0.00 C ATOM 1682 OG SER A 104 -21.978 1.326 0.665 1.00 0.00 O ATOM 0 H SER A 104 -19.623 -0.358 1.638 1.00 0.00 H new ATOM 0 HA SER A 104 -20.361 2.262 2.828 1.00 0.00 H new ATOM 0 HB2 SER A 104 -22.286 0.019 2.220 1.00 0.00 H new ATOM 0 HB3 SER A 104 -22.637 1.699 2.575 1.00 0.00 H new ATOM 0 HG SER A 104 -22.891 1.204 0.330 1.00 0.00 H new ATOM 1688 N LEU A 105 -20.386 1.231 5.093 1.00 0.00 N ATOM 1689 CA LEU A 105 -20.284 0.697 6.449 1.00 0.00 C ATOM 1690 C LEU A 105 -21.670 0.646 7.076 1.00 0.00 C ATOM 1691 O LEU A 105 -22.364 1.665 7.104 1.00 0.00 O ATOM 1692 CB LEU A 105 -19.369 1.604 7.281 1.00 0.00 C ATOM 1693 CG LEU A 105 -17.883 1.447 6.905 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -17.150 2.791 6.935 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -17.209 0.477 7.880 1.00 0.00 C ATOM 0 H LEU A 105 -20.386 2.251 5.062 1.00 0.00 H new ATOM 0 HA LEU A 105 -19.866 -0.309 6.420 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -19.668 2.643 7.141 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -19.499 1.374 8.339 1.00 0.00 H new ATOM 0 HG LEU A 105 -17.831 1.056 5.889 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -16.105 2.641 6.665 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -17.614 3.475 6.224 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -17.208 3.215 7.937 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -16.158 0.366 7.614 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -17.287 0.868 8.895 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -17.702 -0.494 7.826 1.00 0.00 H new ATOM 1707 N HIS A 106 -22.083 -0.512 7.591 1.00 0.00 N ATOM 1708 CA HIS A 106 -23.384 -0.695 8.226 1.00 0.00 C ATOM 1709 C HIS A 106 -23.198 -1.365 9.586 1.00 0.00 C ATOM 1710 O HIS A 106 -22.687 -2.482 9.692 1.00 0.00 O ATOM 1711 CB HIS A 106 -24.390 -1.396 7.297 1.00 0.00 C ATOM 1712 CG HIS A 106 -24.008 -2.719 6.677 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -24.777 -3.863 6.715 1.00 0.00 N ATOM 1714 CD2 HIS A 106 -22.987 -2.944 5.792 1.00 0.00 C ATOM 1715 CE1 HIS A 106 -24.217 -4.767 5.898 1.00 0.00 C ATOM 1716 NE2 HIS A 106 -23.134 -4.247 5.306 1.00 0.00 N ATOM 0 H HIS A 106 -21.515 -1.359 7.578 1.00 0.00 H new ATOM 0 HA HIS A 106 -23.839 0.278 8.414 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -25.309 -1.550 7.862 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -24.626 -0.707 6.486 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -22.211 -2.244 5.520 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -24.586 -5.770 5.740 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -22.530 -4.713 4.629 1.00 0.00 H new ATOM 1724 N ARG A 107 -23.513 -0.633 10.654 1.00 0.00 N ATOM 1725 CA ARG A 107 -23.408 -1.097 12.032 1.00 0.00 C ATOM 1726 C ARG A 107 -24.690 -1.849 12.362 1.00 0.00 C ATOM 1727 O ARG A 107 -25.786 -1.301 12.190 1.00 0.00 O ATOM 1728 CB ARG A 107 -23.211 0.111 12.959 1.00 0.00 C ATOM 1729 CG ARG A 107 -22.249 -0.139 14.126 1.00 0.00 C ATOM 1730 CD ARG A 107 -22.703 -1.217 15.111 1.00 0.00 C ATOM 1731 NE ARG A 107 -22.038 -1.045 16.414 1.00 0.00 N ATOM 1732 CZ ARG A 107 -21.148 -1.866 16.985 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -20.594 -2.850 16.290 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -20.825 -1.696 18.261 1.00 0.00 N ATOM 0 H ARG A 107 -23.857 0.324 10.580 1.00 0.00 H new ATOM 0 HA ARG A 107 -22.554 -1.761 12.168 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -22.839 0.949 12.370 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -24.180 0.408 13.360 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -21.276 -0.421 13.723 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -22.109 0.795 14.670 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -23.784 -1.167 15.240 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -22.475 -2.204 14.708 1.00 0.00 H new ATOM 0 HE ARG A 107 -22.283 -0.206 16.940 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -20.845 -2.987 15.311 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -19.917 -3.470 16.735 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -21.254 -0.944 18.800 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -20.148 -2.318 18.703 1.00 0.00 H new ATOM 1748 N ILE A 108 -24.579 -3.087 12.824 1.00 0.00 N ATOM 1749 CA ILE A 108 -25.721 -3.924 13.175 1.00 0.00 C ATOM 1750 C ILE A 108 -25.629 -4.205 14.671 1.00 0.00 C ATOM 1751 O ILE A 108 -24.533 -4.321 15.224 1.00 0.00 O ATOM 1752 CB ILE A 108 -25.755 -5.240 12.344 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -25.355 -5.089 10.859 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -27.126 -5.940 12.431 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.271 -4.193 10.020 1.00 0.00 C ATOM 0 H ILE A 108 -23.680 -3.546 12.968 1.00 0.00 H new ATOM 0 HA ILE A 108 -26.652 -3.407 12.941 1.00 0.00 H new ATOM 0 HB ILE A 108 -24.988 -5.857 12.812 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -24.342 -4.690 10.812 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -25.329 -6.080 10.405 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -27.106 -6.854 11.837 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -27.343 -6.187 13.470 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -27.899 -5.274 12.047 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -25.903 -4.154 8.995 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -27.283 -4.599 10.027 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -26.281 -3.187 10.440 1.00 0.00 H new ATOM 1767 N ARG A 109 -26.781 -4.406 15.314 1.00 0.00 N ATOM 1768 CA ARG A 109 -26.908 -4.704 16.743 1.00 0.00 C ATOM 1769 C ARG A 109 -26.065 -5.903 17.186 1.00 0.00 C ATOM 1770 O ARG A 109 -25.805 -6.051 18.378 1.00 0.00 O ATOM 1771 CB ARG A 109 -28.389 -4.886 17.114 1.00 0.00 C ATOM 1772 CG ARG A 109 -29.104 -6.029 16.372 1.00 0.00 C ATOM 1773 CD ARG A 109 -30.602 -5.983 16.677 1.00 0.00 C ATOM 1774 NE ARG A 109 -31.355 -6.990 15.907 1.00 0.00 N ATOM 1775 CZ ARG A 109 -32.191 -7.906 16.412 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -32.161 -8.220 17.700 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -33.064 -8.512 15.619 1.00 0.00 N ATOM 0 H ARG A 109 -27.682 -4.364 14.838 1.00 0.00 H new ATOM 0 HA ARG A 109 -26.509 -3.849 17.288 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -28.461 -5.067 18.186 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -28.917 -3.954 16.912 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -28.939 -5.938 15.298 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -28.690 -6.990 16.678 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -30.760 -6.149 17.743 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -30.988 -4.989 16.449 1.00 0.00 H new ATOM 0 HE ARG A 109 -31.227 -6.989 14.895 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -31.494 -7.762 18.321 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -32.804 -8.920 18.069 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -33.098 -8.280 14.626 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -33.702 -9.210 16.002 1.00 0.00 H new ATOM 1791 N THR A 110 -25.663 -6.764 16.252 1.00 0.00 N ATOM 1792 CA THR A 110 -24.855 -7.938 16.513 1.00 0.00 C ATOM 1793 C THR A 110 -23.367 -7.656 16.259 1.00 0.00 C ATOM 1794 O THR A 110 -22.538 -8.209 16.981 1.00 0.00 O ATOM 1795 CB THR A 110 -25.423 -9.104 15.678 1.00 0.00 C ATOM 1796 OG1 THR A 110 -24.867 -10.330 16.084 1.00 0.00 O ATOM 1797 CG2 THR A 110 -25.235 -8.968 14.162 1.00 0.00 C ATOM 0 H THR A 110 -25.901 -6.654 15.266 1.00 0.00 H new ATOM 0 HA THR A 110 -24.906 -8.220 17.565 1.00 0.00 H new ATOM 0 HB THR A 110 -26.495 -9.071 15.870 1.00 0.00 H new ATOM 0 HG1 THR A 110 -25.243 -11.055 15.542 1.00 0.00 H new ATOM 0 HG21 THR A 110 -25.667 -9.835 13.663 1.00 0.00 H new ATOM 0 HG22 THR A 110 -25.733 -8.063 13.813 1.00 0.00 H new ATOM 0 HG23 THR A 110 -24.171 -8.909 13.931 1.00 0.00 H new ATOM 1805 N ASP A 111 -23.016 -6.841 15.251 1.00 0.00 N ATOM 1806 CA ASP A 111 -21.636 -6.499 14.872 1.00 0.00 C ATOM 1807 C ASP A 111 -21.660 -5.514 13.693 1.00 0.00 C ATOM 1808 O ASP A 111 -22.723 -5.215 13.150 1.00 0.00 O ATOM 1809 CB ASP A 111 -20.847 -7.757 14.429 1.00 0.00 C ATOM 1810 CG ASP A 111 -19.326 -7.627 14.597 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -18.801 -6.507 14.793 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -18.644 -8.674 14.568 1.00 0.00 O ATOM 0 H ASP A 111 -23.710 -6.386 14.657 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.150 -6.058 15.742 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -21.195 -8.614 15.006 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -21.071 -7.965 13.383 1.00 0.00 H new ATOM 1817 N THR A 112 -20.520 -4.968 13.287 1.00 0.00 N ATOM 1818 CA THR A 112 -20.394 -4.045 12.163 1.00 0.00 C ATOM 1819 C THR A 112 -20.140 -4.879 10.903 1.00 0.00 C ATOM 1820 O THR A 112 -19.563 -5.963 10.980 1.00 0.00 O ATOM 1821 CB THR A 112 -19.267 -3.047 12.462 1.00 0.00 C ATOM 1822 OG1 THR A 112 -19.574 -2.398 13.680 1.00 0.00 O ATOM 1823 CG2 THR A 112 -19.136 -1.961 11.391 1.00 0.00 C ATOM 0 H THR A 112 -19.629 -5.161 13.745 1.00 0.00 H new ATOM 0 HA THR A 112 -21.300 -3.459 12.005 1.00 0.00 H new ATOM 0 HB THR A 112 -18.332 -3.606 12.498 1.00 0.00 H new ATOM 0 HG1 THR A 112 -18.867 -1.755 13.895 1.00 0.00 H new ATOM 0 HG21 THR A 112 -18.323 -1.285 11.656 1.00 0.00 H new ATOM 0 HG22 THR A 112 -18.923 -2.424 10.427 1.00 0.00 H new ATOM 0 HG23 THR A 112 -20.068 -1.400 11.326 1.00 0.00 H new ATOM 1831 N TYR A 113 -20.559 -4.389 9.737 1.00 0.00 N ATOM 1832 CA TYR A 113 -20.411 -5.054 8.450 1.00 0.00 C ATOM 1833 C TYR A 113 -20.094 -4.007 7.380 1.00 0.00 C ATOM 1834 O TYR A 113 -20.238 -2.800 7.614 1.00 0.00 O ATOM 1835 CB TYR A 113 -21.733 -5.755 8.073 1.00 0.00 C ATOM 1836 CG TYR A 113 -22.163 -6.991 8.852 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -22.548 -6.927 10.205 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -22.270 -8.217 8.177 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -23.000 -8.068 10.896 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -22.765 -9.350 8.839 1.00 0.00 C ATOM 1841 CZ TYR A 113 -23.119 -9.298 10.205 1.00 0.00 C ATOM 1842 OH TYR A 113 -23.631 -10.422 10.786 1.00 0.00 O ATOM 0 H TYR A 113 -21.027 -3.486 9.664 1.00 0.00 H new ATOM 0 HA TYR A 113 -19.608 -5.788 8.514 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -22.532 -5.018 8.158 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -21.669 -6.035 7.022 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -22.495 -5.982 10.725 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -21.969 -8.288 7.142 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -23.254 -8.005 11.944 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -22.877 -10.277 8.296 1.00 0.00 H new ATOM 0 HH TYR A 113 -23.625 -11.157 10.138 1.00 0.00 H new ATOM 1852 N VAL A 114 -19.665 -4.470 6.206 1.00 0.00 N ATOM 1853 CA VAL A 114 -19.350 -3.643 5.055 1.00 0.00 C ATOM 1854 C VAL A 114 -20.045 -4.273 3.854 1.00 0.00 C ATOM 1855 O VAL A 114 -19.972 -5.487 3.629 1.00 0.00 O ATOM 1856 CB VAL A 114 -17.834 -3.446 4.849 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -17.501 -2.908 3.445 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -17.296 -2.420 5.852 1.00 0.00 C ATOM 0 H VAL A 114 -19.525 -5.465 6.030 1.00 0.00 H new ATOM 0 HA VAL A 114 -19.717 -2.628 5.208 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.377 -4.426 4.985 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -16.422 -2.786 3.349 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -17.855 -3.612 2.692 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -17.989 -1.945 3.299 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -16.225 -2.288 5.698 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -17.804 -1.467 5.705 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -17.476 -2.774 6.867 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.762 -3.427 3.122 1.00 0.00 N ATOM 1869 CA LYS A 115 -21.513 -3.710 1.919 1.00 0.00 C ATOM 1870 C LYS A 115 -20.652 -3.202 0.774 1.00 0.00 C ATOM 1871 O LYS A 115 -19.999 -2.165 0.910 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.833 -2.909 1.952 1.00 0.00 C ATOM 1873 CG LYS A 115 -24.077 -3.762 1.701 1.00 0.00 C ATOM 1874 CD LYS A 115 -24.129 -4.474 0.336 1.00 0.00 C ATOM 1875 CE LYS A 115 -24.182 -3.436 -0.783 1.00 0.00 C ATOM 1876 NZ LYS A 115 -24.387 -4.001 -2.137 1.00 0.00 N ATOM 0 H LYS A 115 -20.834 -2.444 3.384 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.747 -4.770 1.818 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.927 -2.422 2.922 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -22.787 -2.120 1.202 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -24.145 -4.515 2.486 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -24.957 -3.126 1.793 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -23.253 -5.111 0.213 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -25.004 -5.122 0.286 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -24.987 -2.733 -0.571 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -23.252 -2.867 -0.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -24.679 -3.245 -2.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -23.499 -4.425 -2.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -25.127 -4.731 -2.100 1.00 0.00 H new ATOM 1890 N LEU A 116 -20.681 -3.901 -0.354 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.924 -3.515 -1.531 1.00 0.00 C ATOM 1892 C LEU A 116 -20.762 -3.813 -2.756 1.00 0.00 C ATOM 1893 O LEU A 116 -21.621 -4.705 -2.703 1.00 0.00 O ATOM 1894 CB LEU A 116 -18.614 -4.308 -1.601 1.00 0.00 C ATOM 1895 CG LEU A 116 -17.617 -3.700 -2.610 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -16.473 -3.034 -1.858 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -17.127 -4.753 -3.610 1.00 0.00 C ATOM 0 H LEU A 116 -21.231 -4.751 -0.475 1.00 0.00 H new ATOM 0 HA LEU A 116 -19.685 -2.453 -1.483 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -18.156 -4.337 -0.612 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.830 -5.339 -1.882 1.00 0.00 H new ATOM 0 HG LEU A 116 -18.123 -2.935 -3.199 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -15.770 -2.605 -2.572 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -16.868 -2.245 -1.219 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -15.961 -3.775 -1.244 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -16.426 -4.294 -4.307 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.629 -5.560 -3.073 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.977 -5.155 -4.161 1.00 0.00 H new ATOM 1909 N ASP A 117 -20.500 -3.113 -3.855 1.00 0.00 N ATOM 1910 CA ASP A 117 -21.192 -3.295 -5.120 1.00 0.00 C ATOM 1911 C ASP A 117 -20.166 -3.619 -6.192 1.00 0.00 C ATOM 1912 O ASP A 117 -19.354 -2.790 -6.592 1.00 0.00 O ATOM 1913 CB ASP A 117 -22.135 -2.124 -5.441 1.00 0.00 C ATOM 1914 CG ASP A 117 -23.577 -2.617 -5.623 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -24.014 -3.578 -4.941 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -24.301 -2.097 -6.491 1.00 0.00 O ATOM 0 H ASP A 117 -19.784 -2.388 -3.889 1.00 0.00 H new ATOM 0 HA ASP A 117 -21.872 -4.145 -5.064 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -22.096 -1.389 -4.637 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -21.801 -1.621 -6.348 1.00 0.00 H new ATOM 1921 N LYS A 118 -20.132 -4.873 -6.640 1.00 0.00 N ATOM 1922 CA LYS A 118 -19.165 -5.272 -7.663 1.00 0.00 C ATOM 1923 C LYS A 118 -19.446 -4.618 -9.019 1.00 0.00 C ATOM 1924 O LYS A 118 -18.545 -4.602 -9.855 1.00 0.00 O ATOM 1925 CB LYS A 118 -19.146 -6.799 -7.802 1.00 0.00 C ATOM 1926 CG LYS A 118 -18.583 -7.482 -6.545 1.00 0.00 C ATOM 1927 CD LYS A 118 -18.731 -9.004 -6.621 1.00 0.00 C ATOM 1928 CE LYS A 118 -20.175 -9.499 -6.452 1.00 0.00 C ATOM 1929 NZ LYS A 118 -20.655 -9.411 -5.060 1.00 0.00 N ATOM 0 H LYS A 118 -20.750 -5.618 -6.319 1.00 0.00 H new ATOM 0 HA LYS A 118 -18.185 -4.923 -7.337 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.158 -7.159 -7.989 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -18.544 -7.077 -8.667 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -17.531 -7.223 -6.429 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -19.102 -7.108 -5.663 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -18.350 -9.349 -7.582 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -18.109 -9.458 -5.850 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -20.832 -8.913 -7.095 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -20.240 -10.534 -6.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -21.634 -9.758 -5.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -20.048 -9.991 -4.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -20.622 -8.421 -4.743 1.00 0.00 H new ATOM 1943 N ALA A 119 -20.655 -4.104 -9.253 1.00 0.00 N ATOM 1944 CA ALA A 119 -21.014 -3.485 -10.521 1.00 0.00 C ATOM 1945 C ALA A 119 -20.425 -2.094 -10.744 1.00 0.00 C ATOM 1946 O ALA A 119 -20.513 -1.613 -11.874 1.00 0.00 O ATOM 1947 CB ALA A 119 -22.536 -3.411 -10.618 1.00 0.00 C ATOM 0 H ALA A 119 -21.409 -4.107 -8.566 1.00 0.00 H new ATOM 0 HA ALA A 119 -20.585 -4.115 -11.300 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -22.818 -2.949 -11.564 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -22.953 -4.417 -10.567 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -22.925 -2.814 -9.793 1.00 0.00 H new ATOM 1953 N VAL A 120 -19.840 -1.455 -9.728 1.00 0.00 N ATOM 1954 CA VAL A 120 -19.277 -0.121 -9.897 1.00 0.00 C ATOM 1955 C VAL A 120 -18.147 -0.192 -10.934 1.00 0.00 C ATOM 1956 O VAL A 120 -17.401 -1.176 -10.992 1.00 0.00 O ATOM 1957 CB VAL A 120 -18.856 0.443 -8.526 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -18.477 1.916 -8.606 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -20.014 0.402 -7.525 1.00 0.00 C ATOM 0 H VAL A 120 -19.746 -1.839 -8.788 1.00 0.00 H new ATOM 0 HA VAL A 120 -20.013 0.582 -10.287 1.00 0.00 H new ATOM 0 HB VAL A 120 -18.015 -0.176 -8.215 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -18.187 2.271 -7.617 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -17.642 2.040 -9.295 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -19.330 2.492 -8.963 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -19.683 0.807 -6.569 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -20.844 0.999 -7.904 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -20.341 -0.629 -7.389 1.00 0.00 H new ATOM 1969 N ASP A 121 -18.046 0.829 -11.785 1.00 0.00 N ATOM 1970 CA ASP A 121 -17.050 0.946 -12.847 1.00 0.00 C ATOM 1971 C ASP A 121 -15.665 1.082 -12.225 1.00 0.00 C ATOM 1972 O ASP A 121 -15.229 2.178 -11.867 1.00 0.00 O ATOM 1973 CB ASP A 121 -17.368 2.135 -13.761 1.00 0.00 C ATOM 1974 CG ASP A 121 -18.354 1.744 -14.855 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -19.575 1.888 -14.646 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -17.912 1.351 -15.962 1.00 0.00 O ATOM 0 H ASP A 121 -18.680 1.627 -11.751 1.00 0.00 H new ATOM 0 HA ASP A 121 -17.072 0.048 -13.464 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -17.783 2.951 -13.169 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -16.448 2.505 -14.213 1.00 0.00 H new ATOM 1981 N LEU A 122 -14.941 -0.034 -12.131 1.00 0.00 N ATOM 1982 CA LEU A 122 -13.612 -0.067 -11.537 1.00 0.00 C ATOM 1983 C LEU A 122 -12.639 0.897 -12.211 1.00 0.00 C ATOM 1984 O LEU A 122 -11.833 1.506 -11.520 1.00 0.00 O ATOM 1985 CB LEU A 122 -13.060 -1.500 -11.506 1.00 0.00 C ATOM 1986 CG LEU A 122 -12.375 -1.876 -10.181 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -11.225 -0.971 -9.778 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -13.364 -1.949 -9.012 1.00 0.00 C ATOM 0 H LEU A 122 -15.264 -0.941 -12.467 1.00 0.00 H new ATOM 0 HA LEU A 122 -13.716 0.279 -10.509 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -13.877 -2.197 -11.692 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -12.346 -1.621 -12.320 1.00 0.00 H new ATOM 0 HG LEU A 122 -11.961 -2.863 -10.388 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -10.806 -1.315 -8.832 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -10.454 -0.998 -10.548 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.588 0.050 -9.664 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -12.830 -2.218 -8.100 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -13.843 -0.979 -8.880 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -14.123 -2.702 -9.224 1.00 0.00 H new ATOM 2000 N ALA A 123 -12.722 1.097 -13.530 1.00 0.00 N ATOM 2001 CA ALA A 123 -11.817 2.022 -14.214 1.00 0.00 C ATOM 2002 C ALA A 123 -11.955 3.442 -13.644 1.00 0.00 C ATOM 2003 O ALA A 123 -10.954 4.156 -13.505 1.00 0.00 O ATOM 2004 CB ALA A 123 -12.080 2.012 -15.719 1.00 0.00 C ATOM 0 H ALA A 123 -13.399 0.636 -14.138 1.00 0.00 H new ATOM 0 HA ALA A 123 -10.793 1.690 -14.043 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -11.399 2.705 -16.212 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -11.921 1.007 -16.110 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -13.109 2.317 -15.911 1.00 0.00 H new ATOM 2010 N GLY A 124 -13.193 3.851 -13.345 1.00 0.00 N ATOM 2011 CA GLY A 124 -13.509 5.152 -12.778 1.00 0.00 C ATOM 2012 C GLY A 124 -13.005 5.182 -11.341 1.00 0.00 C ATOM 2013 O GLY A 124 -12.328 6.132 -10.955 1.00 0.00 O ATOM 0 H GLY A 124 -14.016 3.268 -13.497 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -13.040 5.945 -13.361 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -14.584 5.328 -12.807 1.00 0.00 H new ATOM 2017 N LEU A 125 -13.271 4.113 -10.574 1.00 0.00 N ATOM 2018 CA LEU A 125 -12.840 3.987 -9.184 1.00 0.00 C ATOM 2019 C LEU A 125 -11.325 4.159 -9.123 1.00 0.00 C ATOM 2020 O LEU A 125 -10.860 5.046 -8.413 1.00 0.00 O ATOM 2021 CB LEU A 125 -13.301 2.665 -8.550 1.00 0.00 C ATOM 2022 CG LEU A 125 -14.822 2.562 -8.320 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -15.168 1.168 -7.789 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -15.345 3.613 -7.334 1.00 0.00 C ATOM 0 H LEU A 125 -13.797 3.307 -10.911 1.00 0.00 H new ATOM 0 HA LEU A 125 -13.312 4.771 -8.592 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.987 1.841 -9.190 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -12.792 2.538 -7.594 1.00 0.00 H new ATOM 0 HG LEU A 125 -15.302 2.743 -9.282 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -16.244 1.097 -7.627 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -14.860 0.415 -8.515 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -14.647 0.998 -6.847 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -16.421 3.493 -7.211 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -14.853 3.484 -6.370 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -15.133 4.610 -7.719 1.00 0.00 H new ATOM 2036 N THR A 126 -10.557 3.381 -9.894 1.00 0.00 N ATOM 2037 CA THR A 126 -9.103 3.499 -9.925 1.00 0.00 C ATOM 2038 C THR A 126 -8.676 4.934 -10.245 1.00 0.00 C ATOM 2039 O THR A 126 -7.719 5.414 -9.640 1.00 0.00 O ATOM 2040 CB THR A 126 -8.531 2.530 -10.968 1.00 0.00 C ATOM 2041 OG1 THR A 126 -8.932 1.219 -10.660 1.00 0.00 O ATOM 2042 CG2 THR A 126 -7.000 2.522 -11.016 1.00 0.00 C ATOM 0 H THR A 126 -10.928 2.657 -10.509 1.00 0.00 H new ATOM 0 HA THR A 126 -8.712 3.244 -8.940 1.00 0.00 H new ATOM 0 HB THR A 126 -8.910 2.871 -11.932 1.00 0.00 H new ATOM 0 HG1 THR A 126 -9.854 1.079 -10.963 1.00 0.00 H new ATOM 0 HG21 THR A 126 -6.663 1.815 -11.775 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.639 3.520 -11.264 1.00 0.00 H new ATOM 0 HG23 THR A 126 -6.607 2.225 -10.044 1.00 0.00 H new ATOM 2050 N ALA A 127 -9.354 5.614 -11.179 1.00 0.00 N ATOM 2051 CA ALA A 127 -8.997 6.982 -11.523 1.00 0.00 C ATOM 2052 C ALA A 127 -9.160 7.918 -10.319 1.00 0.00 C ATOM 2053 O ALA A 127 -8.192 8.551 -9.897 1.00 0.00 O ATOM 2054 CB ALA A 127 -9.790 7.453 -12.746 1.00 0.00 C ATOM 0 H ALA A 127 -10.145 5.237 -11.702 1.00 0.00 H new ATOM 0 HA ALA A 127 -7.942 7.009 -11.794 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.510 8.478 -12.989 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.568 6.806 -13.595 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.857 7.411 -12.526 1.00 0.00 H new ATOM 2060 N ARG A 128 -10.360 8.006 -9.730 1.00 0.00 N ATOM 2061 CA ARG A 128 -10.580 8.888 -8.575 1.00 0.00 C ATOM 2062 C ARG A 128 -9.700 8.516 -7.379 1.00 0.00 C ATOM 2063 O ARG A 128 -9.341 9.395 -6.595 1.00 0.00 O ATOM 2064 CB ARG A 128 -12.070 8.975 -8.212 1.00 0.00 C ATOM 2065 CG ARG A 128 -12.722 7.656 -7.775 1.00 0.00 C ATOM 2066 CD ARG A 128 -14.215 7.833 -7.491 1.00 0.00 C ATOM 2067 NE ARG A 128 -14.476 8.558 -6.238 1.00 0.00 N ATOM 2068 CZ ARG A 128 -15.676 8.980 -5.828 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -16.757 8.762 -6.567 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -15.774 9.596 -4.659 1.00 0.00 N ATOM 0 H ARG A 128 -11.184 7.485 -10.029 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.267 9.890 -8.870 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -12.188 9.702 -7.409 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -12.614 9.361 -9.074 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -12.586 6.906 -8.554 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -12.223 7.281 -6.881 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -14.676 8.371 -8.319 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -14.690 6.853 -7.444 1.00 0.00 H new ATOM 0 HE ARG A 128 -13.678 8.754 -5.634 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -16.676 8.269 -7.456 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -17.669 9.088 -6.246 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -14.942 9.741 -4.088 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -16.682 9.925 -4.330 1.00 0.00 H new ATOM 2084 N LEU A 129 -9.349 7.235 -7.241 1.00 0.00 N ATOM 2085 CA LEU A 129 -8.501 6.699 -6.185 1.00 0.00 C ATOM 2086 C LEU A 129 -7.096 7.280 -6.365 1.00 0.00 C ATOM 2087 O LEU A 129 -6.621 8.027 -5.511 1.00 0.00 O ATOM 2088 CB LEU A 129 -8.515 5.157 -6.293 1.00 0.00 C ATOM 2089 CG LEU A 129 -7.821 4.310 -5.211 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -7.800 2.857 -5.721 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -6.389 4.702 -4.842 1.00 0.00 C ATOM 0 H LEU A 129 -9.664 6.516 -7.892 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.857 6.971 -5.191 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -9.558 4.843 -6.333 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -8.066 4.894 -7.251 1.00 0.00 H new ATOM 0 HG LEU A 129 -8.395 4.468 -4.298 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -7.315 2.219 -4.982 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.822 2.513 -5.882 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -7.248 2.809 -6.660 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -6.015 4.029 -4.070 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -5.753 4.631 -5.725 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -6.377 5.726 -4.468 1.00 0.00 H new ATOM 2103 N ALA A 130 -6.441 6.945 -7.482 1.00 0.00 N ATOM 2104 CA ALA A 130 -5.089 7.374 -7.817 1.00 0.00 C ATOM 2105 C ALA A 130 -4.928 8.891 -7.941 1.00 0.00 C ATOM 2106 O ALA A 130 -3.798 9.371 -7.858 1.00 0.00 O ATOM 2107 CB ALA A 130 -4.648 6.658 -9.098 1.00 0.00 C ATOM 0 H ALA A 130 -6.856 6.348 -8.198 1.00 0.00 H new ATOM 0 HA ALA A 130 -4.442 7.096 -6.985 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -3.637 6.970 -9.360 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.664 5.580 -8.936 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -5.329 6.913 -9.910 1.00 0.00 H new ATOM 2113 N HIS A 131 -6.018 9.650 -8.093 1.00 0.00 N ATOM 2114 CA HIS A 131 -5.952 11.102 -8.201 1.00 0.00 C ATOM 2115 C HIS A 131 -5.426 11.727 -6.899 1.00 0.00 C ATOM 2116 O HIS A 131 -4.810 12.790 -6.942 1.00 0.00 O ATOM 2117 CB HIS A 131 -7.343 11.658 -8.549 1.00 0.00 C ATOM 2118 CG HIS A 131 -7.383 13.100 -9.004 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -8.528 13.856 -9.145 1.00 0.00 N ATOM 2120 CD2 HIS A 131 -6.321 13.901 -9.344 1.00 0.00 C ATOM 2121 CE1 HIS A 131 -8.157 15.090 -9.520 1.00 0.00 C ATOM 2122 NE2 HIS A 131 -6.826 15.163 -9.673 1.00 0.00 N ATOM 0 H HIS A 131 -6.964 9.273 -8.144 1.00 0.00 H new ATOM 0 HA HIS A 131 -5.255 11.363 -8.998 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -7.775 11.037 -9.334 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -7.983 11.556 -7.673 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -5.281 13.609 -9.355 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -8.838 15.913 -9.677 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -6.289 15.978 -9.970 1.00 0.00 H new ATOM 2130 N HIS A 132 -5.656 11.072 -5.751 1.00 0.00 N ATOM 2131 CA HIS A 132 -5.245 11.497 -4.417 1.00 0.00 C ATOM 2132 C HIS A 132 -5.549 12.979 -4.135 1.00 0.00 C ATOM 2133 O HIS A 132 -4.637 13.806 -4.028 1.00 0.00 O ATOM 2134 CB HIS A 132 -3.761 11.177 -4.173 1.00 0.00 C ATOM 2135 CG HIS A 132 -3.335 9.753 -4.420 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -2.302 9.382 -5.245 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -3.832 8.617 -3.839 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -2.191 8.046 -5.190 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -3.072 7.540 -4.312 1.00 0.00 N ATOM 0 H HIS A 132 -6.161 10.186 -5.734 1.00 0.00 H new ATOM 0 HA HIS A 132 -5.845 10.924 -3.710 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -3.162 11.828 -4.809 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -3.522 11.431 -3.140 1.00 0.00 H new ATOM 0 HD1 HIS A 132 -1.722 10.010 -5.801 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -4.657 8.562 -3.145 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -1.492 7.461 -5.770 1.00 0.00 H new ATOM 2147 N VAL A 133 -6.829 13.321 -3.961 1.00 0.00 N ATOM 2148 CA VAL A 133 -7.256 14.696 -3.653 1.00 0.00 C ATOM 2149 C VAL A 133 -7.637 14.802 -2.161 1.00 0.00 C ATOM 2150 O VAL A 133 -7.408 15.828 -1.519 1.00 0.00 O ATOM 2151 CB VAL A 133 -8.401 15.129 -4.596 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -8.673 16.635 -4.512 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -8.099 14.799 -6.064 1.00 0.00 C ATOM 0 H VAL A 133 -7.600 12.656 -4.029 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.431 15.387 -3.827 1.00 0.00 H new ATOM 0 HB VAL A 133 -9.274 14.569 -4.261 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -9.485 16.897 -5.191 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -8.954 16.898 -3.492 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -7.774 17.183 -4.793 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -8.932 15.122 -6.688 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -7.191 15.317 -6.374 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -7.959 13.724 -6.174 1.00 0.00 H new ATOM 2163 N HIS A 134 -8.188 13.724 -1.597 1.00 0.00 N ATOM 2164 CA HIS A 134 -8.624 13.585 -0.209 1.00 0.00 C ATOM 2165 C HIS A 134 -7.748 12.543 0.526 1.00 0.00 C ATOM 2166 O HIS A 134 -8.220 11.867 1.438 1.00 0.00 O ATOM 2167 CB HIS A 134 -10.141 13.312 -0.245 1.00 0.00 C ATOM 2168 CG HIS A 134 -10.922 13.436 1.040 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -10.693 12.757 2.211 1.00 0.00 N ATOM 2170 CD2 HIS A 134 -12.099 14.118 1.190 1.00 0.00 C ATOM 2171 CE1 HIS A 134 -11.702 13.031 3.050 1.00 0.00 C ATOM 2172 NE2 HIS A 134 -12.596 13.860 2.475 1.00 0.00 N ATOM 0 H HIS A 134 -8.351 12.872 -2.134 1.00 0.00 H new ATOM 0 HA HIS A 134 -8.481 14.487 0.386 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -10.584 13.994 -0.970 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -10.288 12.302 -0.627 1.00 0.00 H new ATOM 0 HD1 HIS A 134 -9.896 12.151 2.408 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -12.565 14.747 0.446 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -11.787 12.640 4.053 1.00 0.00 H new ATOM 2180 N ALA A 135 -6.545 12.253 0.009 1.00 0.00 N ATOM 2181 CA ALA A 135 -5.611 11.307 0.608 1.00 0.00 C ATOM 2182 C ALA A 135 -4.785 12.115 1.612 1.00 0.00 C ATOM 2183 O ALA A 135 -4.932 12.027 2.807 1.00 0.00 O ATOM 2184 CB ALA A 135 -4.759 10.622 -0.471 1.00 0.00 C ATOM 0 H ALA A 135 -6.195 12.679 -0.849 1.00 0.00 H new ATOM 0 HA ALA A 135 -6.119 10.489 1.120 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -4.070 9.921 0.000 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -5.409 10.084 -1.161 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -4.192 11.375 -1.019 1.00 0.00 H new ATOM 2190 N GLU A 136 -3.910 12.970 1.129 1.00 0.00 N ATOM 2191 CA GLU A 136 -3.002 13.894 1.815 1.00 0.00 C ATOM 2192 C GLU A 136 -2.054 13.163 2.770 1.00 0.00 C ATOM 2193 O GLU A 136 -1.187 13.746 3.425 1.00 0.00 O ATOM 2194 CB GLU A 136 -3.735 15.150 2.357 1.00 0.00 C ATOM 2195 CG GLU A 136 -5.248 15.017 2.656 1.00 0.00 C ATOM 2196 CD GLU A 136 -6.000 16.334 2.826 1.00 0.00 C ATOM 2197 OE1 GLU A 136 -5.383 17.382 3.126 1.00 0.00 O ATOM 2198 OE2 GLU A 136 -7.233 16.354 2.603 1.00 0.00 O ATOM 0 H GLU A 136 -3.797 13.052 0.119 1.00 0.00 H new ATOM 0 HA GLU A 136 -2.318 14.326 1.084 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -3.236 15.461 3.275 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -3.604 15.955 1.634 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -5.713 14.455 1.846 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -5.371 14.428 3.565 1.00 0.00 H new ATOM 2205 N GLY A 137 -2.160 11.840 2.751 1.00 0.00 N ATOM 2206 CA GLY A 137 -1.396 10.911 3.500 1.00 0.00 C ATOM 2207 C GLY A 137 -2.120 9.640 3.939 1.00 0.00 C ATOM 2208 O GLY A 137 -1.447 8.820 4.569 1.00 0.00 O ATOM 0 H GLY A 137 -2.845 11.374 2.156 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -0.529 10.623 2.906 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.020 11.416 4.390 1.00 0.00 H new ATOM 2212 N LEU A 138 -3.417 9.434 3.648 1.00 0.00 N ATOM 2213 CA LEU A 138 -4.105 8.195 4.051 1.00 0.00 C ATOM 2214 C LEU A 138 -3.352 7.034 3.434 1.00 0.00 C ATOM 2215 O LEU A 138 -2.991 6.120 4.197 1.00 0.00 O ATOM 2216 CB LEU A 138 -5.589 8.080 3.631 1.00 0.00 C ATOM 2217 CG LEU A 138 -6.606 8.823 4.514 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -6.522 10.318 4.276 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -8.034 8.394 4.177 1.00 0.00 C ATOM 0 H LEU A 138 -4.003 10.099 3.143 1.00 0.00 H new ATOM 0 HA LEU A 138 -4.110 8.195 5.141 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -5.686 8.451 2.611 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -5.859 7.024 3.613 1.00 0.00 H new ATOM 0 HG LEU A 138 -6.369 8.581 5.550 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -7.248 10.828 4.909 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -5.519 10.669 4.519 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.738 10.533 3.229 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -8.736 8.933 4.814 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -8.245 8.621 3.132 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -8.141 7.322 4.344 1.00 0.00 H new TER 2231 LEU A 138