USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 751 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 82 THR OG1 : rot 180:sc= -0.679 USER MOD Set 1.2: A 83 HIS : no HE2:sc= -4.52! C(o=-5.2!,f=-5.2!) USER MOD Set 2.1: A 2 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 1 GLY N :NH3+ -120:sc= 0.127 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=-0.037) USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=-0.084) USER MOD Single : A 11 GLN : amide:sc= -0.405 K(o=-0.41,f=-3.1!) USER MOD Single : A 12 THR OG1 : rot -67:sc= 1.13 USER MOD Single : A 13 GLN : amide:sc= -1.2 K(o=-1.2,f=-5.1!) USER MOD Single : A 14 HIS : no HD1:sc= -0.393 X(o=-0.39,f=-0.42) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= -1.15 X(o=-1.2,f=-0.93!) USER MOD Single : A 19 GLN : amide:sc= -0.182 K(o=-0.18,f=-1.4!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -0.0191 X(o=-0.019,f=-0.07) USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= -0.674 K(o=-0.67,f=0.086) USER MOD Single : A 35 ASN : amide:sc= -4.42! C(o=-4.4!,f=-3.5!) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc=-0.00216 X(o=-0.0022,f=-0.0022) USER MOD Single : A 50 THR OG1 : rot -84:sc= 1.09! USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.013 X(o=-0.013,f=-0.071) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 57 CYS SG : rot 64:sc= 0.0154 USER MOD Single : A 62 HIS : no HD1:sc= -1.36! K(o=-1.4!,f=-0.38) USER MOD Single : A 64 CYS SG : rot 152:sc= -5.8! USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0.26) USER MOD Single : A 69 ASN : amide:sc= 0.683 K(o=0.68,f=-4.2!) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 148:sc= -1.45 (180deg=-2.93!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= -0.105 K(o=-0.1,f=-0.84) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -25.447 9.711 -40.685 1.00 0.00 N ATOM 2 CA GLY A 1 -24.006 9.791 -40.854 1.00 0.00 C ATOM 3 C GLY A 1 -23.300 8.677 -40.079 1.00 0.00 C ATOM 4 O GLY A 1 -23.952 7.832 -39.468 1.00 0.00 O ATOM 0 H1 GLY A 1 -25.899 9.579 -41.613 1.00 0.00 H new ATOM 0 H2 GLY A 1 -25.680 8.906 -40.069 1.00 0.00 H new ATOM 0 H3 GLY A 1 -25.795 10.590 -40.253 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -23.756 9.717 -41.912 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.649 10.761 -40.509 1.00 0.00 H new ATOM 8 N SER A 2 -21.976 8.712 -40.129 1.00 0.00 N ATOM 9 CA SER A 2 -21.175 7.716 -39.439 1.00 0.00 C ATOM 10 C SER A 2 -21.494 6.321 -39.980 1.00 0.00 C ATOM 11 O SER A 2 -22.473 5.701 -39.568 1.00 0.00 O ATOM 12 CB SER A 2 -21.413 7.767 -37.928 1.00 0.00 C ATOM 13 OG SER A 2 -20.356 8.433 -37.243 1.00 0.00 O ATOM 0 H SER A 2 -21.439 9.415 -40.637 1.00 0.00 H new ATOM 0 HA SER A 2 -20.123 7.937 -39.621 1.00 0.00 H new ATOM 0 HB2 SER A 2 -22.354 8.278 -37.726 1.00 0.00 H new ATOM 0 HB3 SER A 2 -21.512 6.752 -37.542 1.00 0.00 H new ATOM 0 HG SER A 2 -20.546 8.446 -36.282 1.00 0.00 H new ATOM 19 N SER A 3 -20.650 5.868 -40.895 1.00 0.00 N ATOM 20 CA SER A 3 -20.830 4.558 -41.496 1.00 0.00 C ATOM 21 C SER A 3 -19.513 4.079 -42.111 1.00 0.00 C ATOM 22 O SER A 3 -18.791 4.861 -42.727 1.00 0.00 O ATOM 23 CB SER A 3 -21.931 4.586 -42.558 1.00 0.00 C ATOM 24 OG SER A 3 -21.628 5.488 -43.618 1.00 0.00 O ATOM 0 H SER A 3 -19.839 6.385 -41.235 1.00 0.00 H new ATOM 0 HA SER A 3 -21.134 3.862 -40.714 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.069 3.584 -42.963 1.00 0.00 H new ATOM 0 HB3 SER A 3 -22.874 4.875 -42.095 1.00 0.00 H new ATOM 0 HG SER A 3 -22.354 5.475 -44.276 1.00 0.00 H new ATOM 30 N GLY A 4 -19.241 2.796 -41.921 1.00 0.00 N ATOM 31 CA GLY A 4 -18.024 2.203 -42.449 1.00 0.00 C ATOM 32 C GLY A 4 -17.762 0.835 -41.817 1.00 0.00 C ATOM 33 O GLY A 4 -18.692 0.059 -41.599 1.00 0.00 O ATOM 0 H GLY A 4 -19.843 2.151 -41.409 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -18.106 2.098 -43.531 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.179 2.865 -42.256 1.00 0.00 H new ATOM 37 N SER A 5 -16.491 0.579 -41.542 1.00 0.00 N ATOM 38 CA SER A 5 -16.095 -0.682 -40.939 1.00 0.00 C ATOM 39 C SER A 5 -14.614 -0.638 -40.559 1.00 0.00 C ATOM 40 O SER A 5 -13.780 -0.194 -41.347 1.00 0.00 O ATOM 41 CB SER A 5 -16.366 -1.853 -41.885 1.00 0.00 C ATOM 42 OG SER A 5 -16.051 -1.531 -43.237 1.00 0.00 O ATOM 0 H SER A 5 -15.722 1.224 -41.726 1.00 0.00 H new ATOM 0 HA SER A 5 -16.690 -0.833 -40.038 1.00 0.00 H new ATOM 0 HB2 SER A 5 -15.778 -2.716 -41.571 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.415 -2.140 -41.816 1.00 0.00 H new ATOM 0 HG SER A 5 -16.236 -2.305 -43.809 1.00 0.00 H new ATOM 48 N SER A 6 -14.331 -1.104 -39.352 1.00 0.00 N ATOM 49 CA SER A 6 -12.965 -1.124 -38.858 1.00 0.00 C ATOM 50 C SER A 6 -12.361 0.280 -38.932 1.00 0.00 C ATOM 51 O SER A 6 -11.803 0.666 -39.958 1.00 0.00 O ATOM 52 CB SER A 6 -12.107 -2.113 -39.649 1.00 0.00 C ATOM 53 OG SER A 6 -11.013 -2.606 -38.880 1.00 0.00 O ATOM 0 H SER A 6 -15.025 -1.471 -38.701 1.00 0.00 H new ATOM 0 HA SER A 6 -12.983 -1.451 -37.818 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.726 -2.949 -39.976 1.00 0.00 H new ATOM 0 HB3 SER A 6 -11.728 -1.626 -40.548 1.00 0.00 H new ATOM 0 HG SER A 6 -10.491 -3.235 -39.420 1.00 0.00 H new ATOM 59 N GLY A 7 -12.494 1.006 -37.832 1.00 0.00 N ATOM 60 CA GLY A 7 -11.969 2.359 -37.760 1.00 0.00 C ATOM 61 C GLY A 7 -13.102 3.381 -37.646 1.00 0.00 C ATOM 62 O GLY A 7 -13.589 3.889 -38.655 1.00 0.00 O ATOM 0 H GLY A 7 -12.958 0.683 -36.983 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.305 2.450 -36.901 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.373 2.569 -38.648 1.00 0.00 H new ATOM 66 N ASN A 8 -13.489 3.653 -36.408 1.00 0.00 N ATOM 67 CA ASN A 8 -14.555 4.606 -36.149 1.00 0.00 C ATOM 68 C ASN A 8 -14.802 4.691 -34.642 1.00 0.00 C ATOM 69 O ASN A 8 -15.224 3.716 -34.022 1.00 0.00 O ATOM 70 CB ASN A 8 -15.859 4.168 -36.818 1.00 0.00 C ATOM 71 CG ASN A 8 -16.673 5.379 -37.278 1.00 0.00 C ATOM 72 OD1 ASN A 8 -16.518 5.882 -38.378 1.00 0.00 O ATOM 73 ND2 ASN A 8 -17.547 5.817 -36.376 1.00 0.00 N ATOM 0 H ASN A 8 -13.083 3.230 -35.573 1.00 0.00 H new ATOM 0 HA ASN A 8 -14.250 5.572 -36.552 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -15.637 3.529 -37.673 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -16.448 3.573 -36.120 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -18.138 6.621 -36.587 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -17.626 5.349 -35.473 1.00 0.00 H new ATOM 80 N GLN A 9 -14.527 5.866 -34.095 1.00 0.00 N ATOM 81 CA GLN A 9 -14.714 6.091 -32.671 1.00 0.00 C ATOM 82 C GLN A 9 -15.547 7.353 -32.438 1.00 0.00 C ATOM 83 O GLN A 9 -15.234 8.415 -32.973 1.00 0.00 O ATOM 84 CB GLN A 9 -13.368 6.181 -31.949 1.00 0.00 C ATOM 85 CG GLN A 9 -13.377 5.347 -30.667 1.00 0.00 C ATOM 86 CD GLN A 9 -12.025 4.666 -30.446 1.00 0.00 C ATOM 87 OE1 GLN A 9 -10.969 5.250 -30.630 1.00 0.00 O ATOM 88 NE2 GLN A 9 -12.115 3.401 -30.044 1.00 0.00 N ATOM 0 H GLN A 9 -14.176 6.672 -34.612 1.00 0.00 H new ATOM 0 HA GLN A 9 -15.255 5.241 -32.256 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -12.573 5.832 -32.609 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -13.149 7.221 -31.709 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -13.610 5.986 -29.815 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -14.163 4.594 -30.725 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -13.031 2.973 -29.909 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -11.268 2.860 -29.871 1.00 0.00 H new ATOM 97 N ASN A 10 -16.592 7.194 -31.640 1.00 0.00 N ATOM 98 CA ASN A 10 -17.473 8.308 -31.329 1.00 0.00 C ATOM 99 C ASN A 10 -17.070 8.911 -29.982 1.00 0.00 C ATOM 100 O ASN A 10 -16.562 8.207 -29.110 1.00 0.00 O ATOM 101 CB ASN A 10 -18.928 7.847 -31.225 1.00 0.00 C ATOM 102 CG ASN A 10 -19.625 7.920 -32.585 1.00 0.00 C ATOM 103 OD1 ASN A 10 -19.070 7.577 -33.615 1.00 0.00 O ATOM 104 ND2 ASN A 10 -20.870 8.384 -32.530 1.00 0.00 N ATOM 0 H ASN A 10 -16.849 6.311 -31.199 1.00 0.00 H new ATOM 0 HA ASN A 10 -17.384 9.042 -32.130 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -18.963 6.825 -30.849 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -19.460 8.470 -30.506 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -21.420 8.470 -33.384 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -21.275 8.654 -31.633 1.00 0.00 H new ATOM 111 N GLN A 11 -17.312 10.207 -29.854 1.00 0.00 N ATOM 112 CA GLN A 11 -16.981 10.913 -28.628 1.00 0.00 C ATOM 113 C GLN A 11 -15.523 10.653 -28.243 1.00 0.00 C ATOM 114 O GLN A 11 -15.200 9.601 -27.694 1.00 0.00 O ATOM 115 CB GLN A 11 -17.927 10.513 -27.493 1.00 0.00 C ATOM 116 CG GLN A 11 -18.447 11.747 -26.753 1.00 0.00 C ATOM 117 CD GLN A 11 -19.976 11.792 -26.768 1.00 0.00 C ATOM 118 OE1 GLN A 11 -20.641 10.975 -27.386 1.00 0.00 O ATOM 119 NE2 GLN A 11 -20.496 12.788 -26.056 1.00 0.00 N ATOM 0 H GLN A 11 -17.734 10.787 -30.579 1.00 0.00 H new ATOM 0 HA GLN A 11 -17.106 11.982 -28.802 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -18.766 9.946 -27.897 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -17.406 9.858 -26.794 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -18.090 11.735 -25.723 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -18.049 12.649 -27.218 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -19.883 13.437 -25.563 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -21.508 12.903 -26.003 1.00 0.00 H new ATOM 128 N THR A 12 -14.682 11.630 -28.547 1.00 0.00 N ATOM 129 CA THR A 12 -13.266 11.521 -28.240 1.00 0.00 C ATOM 130 C THR A 12 -12.965 12.150 -26.878 1.00 0.00 C ATOM 131 O THR A 12 -11.937 12.803 -26.705 1.00 0.00 O ATOM 132 CB THR A 12 -12.482 12.157 -29.389 1.00 0.00 C ATOM 133 OG1 THR A 12 -11.126 12.109 -28.954 1.00 0.00 O ATOM 134 CG2 THR A 12 -12.773 13.652 -29.539 1.00 0.00 C ATOM 0 H THR A 12 -14.954 12.501 -29.003 1.00 0.00 H new ATOM 0 HA THR A 12 -12.959 10.478 -28.156 1.00 0.00 H new ATOM 0 HB THR A 12 -12.724 11.645 -30.320 1.00 0.00 H new ATOM 0 HG1 THR A 12 -11.008 12.706 -28.186 1.00 0.00 H new ATOM 0 HG21 THR A 12 -12.191 14.054 -30.368 1.00 0.00 H new ATOM 0 HG22 THR A 12 -13.835 13.798 -29.736 1.00 0.00 H new ATOM 0 HG23 THR A 12 -12.500 14.170 -28.619 1.00 0.00 H new ATOM 142 N GLN A 13 -13.881 11.932 -25.946 1.00 0.00 N ATOM 143 CA GLN A 13 -13.727 12.469 -24.605 1.00 0.00 C ATOM 144 C GLN A 13 -13.666 11.334 -23.581 1.00 0.00 C ATOM 145 O GLN A 13 -14.013 10.195 -23.891 1.00 0.00 O ATOM 146 CB GLN A 13 -14.856 13.447 -24.273 1.00 0.00 C ATOM 147 CG GLN A 13 -14.523 14.857 -24.763 1.00 0.00 C ATOM 148 CD GLN A 13 -13.466 15.512 -23.872 1.00 0.00 C ATOM 149 OE1 GLN A 13 -12.517 14.887 -23.429 1.00 0.00 O ATOM 150 NE2 GLN A 13 -13.683 16.803 -23.636 1.00 0.00 N ATOM 0 H GLN A 13 -14.733 11.391 -26.093 1.00 0.00 H new ATOM 0 HA GLN A 13 -12.788 13.021 -24.562 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -15.783 13.107 -24.735 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -15.023 13.463 -23.196 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -14.161 14.813 -25.790 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -15.427 15.466 -24.769 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -14.498 17.265 -24.039 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -13.034 17.331 -23.052 1.00 0.00 H new ATOM 159 N HIS A 14 -13.221 11.683 -22.383 1.00 0.00 N ATOM 160 CA HIS A 14 -13.110 10.707 -21.313 1.00 0.00 C ATOM 161 C HIS A 14 -11.891 9.814 -21.556 1.00 0.00 C ATOM 162 O HIS A 14 -10.924 9.858 -20.798 1.00 0.00 O ATOM 163 CB HIS A 14 -14.408 9.911 -21.166 1.00 0.00 C ATOM 164 CG HIS A 14 -15.659 10.750 -21.273 1.00 0.00 C ATOM 165 ND1 HIS A 14 -15.825 11.939 -20.584 1.00 0.00 N ATOM 166 CD2 HIS A 14 -16.800 10.561 -21.995 1.00 0.00 C ATOM 167 CE1 HIS A 14 -17.016 12.434 -20.885 1.00 0.00 C ATOM 168 NE2 HIS A 14 -17.620 11.578 -21.759 1.00 0.00 N ATOM 0 H HIS A 14 -12.933 12.628 -22.130 1.00 0.00 H new ATOM 0 HA HIS A 14 -12.957 11.220 -20.363 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -14.436 9.136 -21.932 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -14.404 9.404 -20.201 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -17.002 9.725 -22.648 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -17.435 13.354 -20.505 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -18.548 11.699 -22.164 1.00 0.00 H new ATOM 176 N LYS A 15 -11.978 9.026 -22.617 1.00 0.00 N ATOM 177 CA LYS A 15 -10.894 8.124 -22.970 1.00 0.00 C ATOM 178 C LYS A 15 -10.896 6.932 -22.011 1.00 0.00 C ATOM 179 O LYS A 15 -11.138 5.799 -22.425 1.00 0.00 O ATOM 180 CB LYS A 15 -9.563 8.877 -23.013 1.00 0.00 C ATOM 181 CG LYS A 15 -8.775 8.526 -24.276 1.00 0.00 C ATOM 182 CD LYS A 15 -8.743 9.707 -25.249 1.00 0.00 C ATOM 183 CE LYS A 15 -7.311 10.198 -25.469 1.00 0.00 C ATOM 184 NZ LYS A 15 -7.196 10.895 -26.769 1.00 0.00 N ATOM 0 H LYS A 15 -12.782 8.993 -23.244 1.00 0.00 H new ATOM 0 HA LYS A 15 -11.041 7.726 -23.974 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -9.747 9.951 -22.982 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -8.972 8.629 -22.131 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -7.757 8.244 -24.007 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -9.227 7.662 -24.762 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -9.180 9.409 -26.202 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -9.354 10.521 -24.859 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -7.023 10.872 -24.662 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -6.622 9.354 -25.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -6.218 11.222 -26.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -7.451 10.242 -27.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -7.839 11.712 -26.783 1.00 0.00 H new ATOM 198 N GLN A 16 -10.623 7.228 -20.749 1.00 0.00 N ATOM 199 CA GLN A 16 -10.590 6.195 -19.728 1.00 0.00 C ATOM 200 C GLN A 16 -11.174 6.725 -18.417 1.00 0.00 C ATOM 201 O GLN A 16 -11.316 7.934 -18.241 1.00 0.00 O ATOM 202 CB GLN A 16 -9.166 5.672 -19.523 1.00 0.00 C ATOM 203 CG GLN A 16 -9.053 4.208 -19.951 1.00 0.00 C ATOM 204 CD GLN A 16 -8.599 4.096 -21.408 1.00 0.00 C ATOM 205 OE1 GLN A 16 -9.394 4.068 -22.333 1.00 0.00 O ATOM 206 NE2 GLN A 16 -7.279 4.035 -21.560 1.00 0.00 N ATOM 0 H GLN A 16 -10.423 8.169 -20.410 1.00 0.00 H new ATOM 0 HA GLN A 16 -11.204 5.359 -20.064 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -8.466 6.278 -20.098 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -8.886 5.771 -18.474 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -8.344 3.690 -19.305 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -10.017 3.714 -19.828 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -6.670 4.063 -20.743 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -6.876 3.960 -22.494 1.00 0.00 H new ATOM 215 N ARG A 17 -11.497 5.794 -17.531 1.00 0.00 N ATOM 216 CA ARG A 17 -12.062 6.152 -16.242 1.00 0.00 C ATOM 217 C ARG A 17 -10.980 6.738 -15.332 1.00 0.00 C ATOM 218 O ARG A 17 -9.819 6.338 -15.406 1.00 0.00 O ATOM 219 CB ARG A 17 -12.689 4.936 -15.558 1.00 0.00 C ATOM 220 CG ARG A 17 -14.214 5.053 -15.523 1.00 0.00 C ATOM 221 CD ARG A 17 -14.838 3.870 -14.778 1.00 0.00 C ATOM 222 NE ARG A 17 -14.554 3.978 -13.330 1.00 0.00 N ATOM 223 CZ ARG A 17 -14.888 3.045 -12.428 1.00 0.00 C ATOM 224 NH1 ARG A 17 -15.518 1.930 -12.819 1.00 0.00 N ATOM 225 NH2 ARG A 17 -14.590 3.227 -11.134 1.00 0.00 N ATOM 0 H ARG A 17 -11.378 4.792 -17.681 1.00 0.00 H new ATOM 0 HA ARG A 17 -12.838 6.897 -16.416 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.402 4.028 -16.088 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -12.304 4.847 -14.542 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.500 5.985 -15.036 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -14.603 5.093 -16.541 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -15.915 3.851 -14.945 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -14.439 2.933 -15.167 1.00 0.00 H new ATOM 0 HE ARG A 17 -14.074 4.815 -12.998 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -15.744 1.791 -13.804 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -15.772 1.220 -12.132 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -14.109 4.076 -10.836 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -14.844 2.517 -10.447 1.00 0.00 H new ATOM 239 N PRO A 18 -11.410 7.701 -14.473 1.00 0.00 N ATOM 240 CA PRO A 18 -10.491 8.345 -13.550 1.00 0.00 C ATOM 241 C PRO A 18 -10.140 7.416 -12.387 1.00 0.00 C ATOM 242 O PRO A 18 -10.630 6.289 -12.318 1.00 0.00 O ATOM 243 CB PRO A 18 -11.205 9.611 -13.105 1.00 0.00 C ATOM 244 CG PRO A 18 -12.675 9.397 -13.428 1.00 0.00 C ATOM 245 CD PRO A 18 -12.777 8.199 -14.358 1.00 0.00 C ATOM 0 HA PRO A 18 -9.532 8.584 -14.009 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -11.061 9.786 -12.039 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -10.814 10.484 -13.627 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -13.245 9.222 -12.516 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -13.095 10.285 -13.901 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -13.443 7.438 -13.951 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -13.177 8.486 -15.331 1.00 0.00 H new ATOM 253 N GLN A 19 -9.295 7.922 -11.501 1.00 0.00 N ATOM 254 CA GLN A 19 -8.873 7.151 -10.344 1.00 0.00 C ATOM 255 C GLN A 19 -9.250 7.881 -9.054 1.00 0.00 C ATOM 256 O GLN A 19 -9.631 9.050 -9.086 1.00 0.00 O ATOM 257 CB GLN A 19 -7.370 6.866 -10.394 1.00 0.00 C ATOM 258 CG GLN A 19 -7.084 5.384 -10.144 1.00 0.00 C ATOM 259 CD GLN A 19 -6.018 4.861 -11.108 1.00 0.00 C ATOM 260 OE1 GLN A 19 -5.893 5.306 -12.237 1.00 0.00 O ATOM 261 NE2 GLN A 19 -5.258 3.894 -10.602 1.00 0.00 N ATOM 0 H GLN A 19 -8.891 8.857 -11.561 1.00 0.00 H new ATOM 0 HA GLN A 19 -9.392 6.193 -10.361 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -6.973 7.158 -11.366 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -6.857 7.470 -9.646 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.750 5.243 -9.116 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.001 4.808 -10.263 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -5.416 3.567 -9.649 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -4.517 3.479 -11.167 1.00 0.00 H new ATOM 270 N ALA A 20 -9.132 7.160 -7.948 1.00 0.00 N ATOM 271 CA ALA A 20 -9.456 7.725 -6.649 1.00 0.00 C ATOM 272 C ALA A 20 -10.947 8.067 -6.604 1.00 0.00 C ATOM 273 O ALA A 20 -11.654 7.910 -7.599 1.00 0.00 O ATOM 274 CB ALA A 20 -8.570 8.944 -6.386 1.00 0.00 C ATOM 0 H ALA A 20 -8.817 6.190 -7.925 1.00 0.00 H new ATOM 0 HA ALA A 20 -9.259 7.003 -5.857 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -8.814 9.367 -5.412 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -7.523 8.642 -6.399 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -8.742 9.692 -7.160 1.00 0.00 H new ATOM 280 N THR A 21 -11.381 8.528 -5.440 1.00 0.00 N ATOM 281 CA THR A 21 -12.775 8.894 -5.253 1.00 0.00 C ATOM 282 C THR A 21 -13.671 7.659 -5.371 1.00 0.00 C ATOM 283 O THR A 21 -14.102 7.102 -4.362 1.00 0.00 O ATOM 284 CB THR A 21 -13.116 9.990 -6.264 1.00 0.00 C ATOM 285 OG1 THR A 21 -12.188 11.032 -5.973 1.00 0.00 O ATOM 286 CG2 THR A 21 -14.483 10.625 -6.001 1.00 0.00 C ATOM 0 H THR A 21 -10.792 8.656 -4.617 1.00 0.00 H new ATOM 0 HA THR A 21 -12.949 9.289 -4.252 1.00 0.00 H new ATOM 0 HB THR A 21 -13.097 9.573 -7.271 1.00 0.00 H new ATOM 0 HG1 THR A 21 -12.337 11.783 -6.584 1.00 0.00 H new ATOM 0 HG21 THR A 21 -14.675 11.396 -6.747 1.00 0.00 H new ATOM 0 HG22 THR A 21 -15.257 9.860 -6.062 1.00 0.00 H new ATOM 0 HG23 THR A 21 -14.491 11.072 -5.007 1.00 0.00 H new ATOM 294 N ALA A 22 -13.924 7.267 -6.611 1.00 0.00 N ATOM 295 CA ALA A 22 -14.761 6.109 -6.873 1.00 0.00 C ATOM 296 C ALA A 22 -13.935 4.835 -6.683 1.00 0.00 C ATOM 297 O ALA A 22 -14.296 3.968 -5.889 1.00 0.00 O ATOM 298 CB ALA A 22 -15.354 6.215 -8.279 1.00 0.00 C ATOM 0 H ALA A 22 -13.564 7.731 -7.445 1.00 0.00 H new ATOM 0 HA ALA A 22 -15.593 6.070 -6.170 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -15.982 5.346 -8.475 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -15.955 7.121 -8.353 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -14.548 6.253 -9.012 1.00 0.00 H new ATOM 304 N GLU A 23 -12.840 4.761 -7.427 1.00 0.00 N ATOM 305 CA GLU A 23 -11.960 3.608 -7.351 1.00 0.00 C ATOM 306 C GLU A 23 -11.567 3.335 -5.897 1.00 0.00 C ATOM 307 O GLU A 23 -11.778 2.235 -5.389 1.00 0.00 O ATOM 308 CB GLU A 23 -10.721 3.805 -8.226 1.00 0.00 C ATOM 309 CG GLU A 23 -10.232 2.471 -8.793 1.00 0.00 C ATOM 310 CD GLU A 23 -10.475 2.395 -10.302 1.00 0.00 C ATOM 311 OE1 GLU A 23 -10.439 3.470 -10.937 1.00 0.00 O ATOM 312 OE2 GLU A 23 -10.691 1.262 -10.785 1.00 0.00 O ATOM 0 H GLU A 23 -12.543 5.481 -8.085 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.498 2.739 -7.731 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -10.953 4.488 -9.043 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -9.927 4.268 -7.640 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -9.169 2.352 -8.586 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -10.748 1.649 -8.296 1.00 0.00 H new ATOM 319 N GLN A 24 -11.002 4.356 -5.269 1.00 0.00 N ATOM 320 CA GLN A 24 -10.577 4.240 -3.884 1.00 0.00 C ATOM 321 C GLN A 24 -11.620 3.470 -3.072 1.00 0.00 C ATOM 322 O GLN A 24 -11.311 2.438 -2.478 1.00 0.00 O ATOM 323 CB GLN A 24 -10.316 5.618 -3.274 1.00 0.00 C ATOM 324 CG GLN A 24 -9.402 5.512 -2.052 1.00 0.00 C ATOM 325 CD GLN A 24 -9.836 6.488 -0.956 1.00 0.00 C ATOM 326 OE1 GLN A 24 -9.256 7.544 -0.763 1.00 0.00 O ATOM 327 NE2 GLN A 24 -10.886 6.077 -0.250 1.00 0.00 N ATOM 0 H GLN A 24 -10.829 5.267 -5.694 1.00 0.00 H new ATOM 0 HA GLN A 24 -9.640 3.683 -3.857 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -9.859 6.269 -4.019 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -11.262 6.078 -2.987 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -9.422 4.493 -1.665 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -8.373 5.722 -2.344 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -11.325 5.182 -0.464 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -11.252 6.657 0.505 1.00 0.00 H new ATOM 336 N ILE A 25 -12.834 4.000 -3.073 1.00 0.00 N ATOM 337 CA ILE A 25 -13.925 3.375 -2.344 1.00 0.00 C ATOM 338 C ILE A 25 -13.903 1.867 -2.597 1.00 0.00 C ATOM 339 O ILE A 25 -13.886 1.076 -1.655 1.00 0.00 O ATOM 340 CB ILE A 25 -15.257 4.039 -2.698 1.00 0.00 C ATOM 341 CG1 ILE A 25 -15.289 5.493 -2.222 1.00 0.00 C ATOM 342 CG2 ILE A 25 -16.435 3.231 -2.152 1.00 0.00 C ATOM 343 CD1 ILE A 25 -16.403 6.274 -2.920 1.00 0.00 C ATOM 0 H ILE A 25 -13.087 4.856 -3.567 1.00 0.00 H new ATOM 0 HA ILE A 25 -13.799 3.521 -1.271 1.00 0.00 H new ATOM 0 HB ILE A 25 -15.353 4.054 -3.784 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -15.440 5.523 -1.143 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -14.328 5.966 -2.422 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -17.369 3.725 -2.418 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -16.419 2.229 -2.581 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -16.357 3.162 -1.067 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -16.404 7.304 -2.564 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -16.235 6.263 -3.997 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -17.365 5.813 -2.698 1.00 0.00 H new ATOM 355 N ARG A 26 -13.905 1.513 -3.873 1.00 0.00 N ATOM 356 CA ARG A 26 -13.886 0.113 -4.262 1.00 0.00 C ATOM 357 C ARG A 26 -12.576 -0.543 -3.820 1.00 0.00 C ATOM 358 O ARG A 26 -12.549 -1.731 -3.502 1.00 0.00 O ATOM 359 CB ARG A 26 -14.040 -0.040 -5.777 1.00 0.00 C ATOM 360 CG ARG A 26 -15.515 -0.042 -6.181 1.00 0.00 C ATOM 361 CD ARG A 26 -15.777 -1.057 -7.295 1.00 0.00 C ATOM 362 NE ARG A 26 -17.231 -1.308 -7.420 1.00 0.00 N ATOM 363 CZ ARG A 26 -17.758 -2.388 -8.012 1.00 0.00 C ATOM 364 NH1 ARG A 26 -16.956 -3.324 -8.537 1.00 0.00 N ATOM 365 NH2 ARG A 26 -19.089 -2.533 -8.079 1.00 0.00 N ATOM 0 H ARG A 26 -13.919 2.172 -4.652 1.00 0.00 H new ATOM 0 HA ARG A 26 -14.726 -0.379 -3.772 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -13.522 0.775 -6.283 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -13.569 -0.968 -6.102 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -16.133 -0.280 -5.315 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -15.805 0.954 -6.516 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -15.382 -0.683 -8.239 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -15.256 -1.990 -7.078 1.00 0.00 H new ATOM 0 HE ARG A 26 -17.871 -0.616 -7.031 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -15.943 -3.215 -8.486 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -17.358 -4.146 -8.988 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -19.700 -1.821 -7.679 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -19.490 -3.355 -8.530 1.00 0.00 H new ATOM 379 N LEU A 27 -11.522 0.260 -3.816 1.00 0.00 N ATOM 380 CA LEU A 27 -10.212 -0.228 -3.418 1.00 0.00 C ATOM 381 C LEU A 27 -10.223 -0.543 -1.921 1.00 0.00 C ATOM 382 O LEU A 27 -10.124 -1.703 -1.526 1.00 0.00 O ATOM 383 CB LEU A 27 -9.123 0.765 -3.830 1.00 0.00 C ATOM 384 CG LEU A 27 -8.874 0.901 -5.334 1.00 0.00 C ATOM 385 CD1 LEU A 27 -7.499 1.512 -5.609 1.00 0.00 C ATOM 386 CD2 LEU A 27 -9.058 -0.441 -6.044 1.00 0.00 C ATOM 0 H LEU A 27 -11.548 1.244 -4.082 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.977 -1.157 -3.938 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -9.386 1.746 -3.435 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.189 0.469 -3.352 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.617 1.585 -5.743 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -7.347 1.598 -6.685 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -7.443 2.501 -5.155 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -6.725 0.873 -5.183 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.875 -0.316 -7.111 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -8.354 -1.167 -5.638 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -10.076 -0.798 -5.890 1.00 0.00 H new ATOM 398 N ALA A 28 -10.343 0.512 -1.128 1.00 0.00 N ATOM 399 CA ALA A 28 -10.368 0.363 0.317 1.00 0.00 C ATOM 400 C ALA A 28 -11.430 -0.669 0.701 1.00 0.00 C ATOM 401 O ALA A 28 -11.366 -1.261 1.777 1.00 0.00 O ATOM 402 CB ALA A 28 -10.617 1.725 0.967 1.00 0.00 C ATOM 0 H ALA A 28 -10.424 1.473 -1.459 1.00 0.00 H new ATOM 0 HA ALA A 28 -9.407 -0.001 0.681 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.636 1.613 2.051 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -9.819 2.413 0.687 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.574 2.121 0.627 1.00 0.00 H new ATOM 408 N GLN A 29 -12.383 -0.854 -0.201 1.00 0.00 N ATOM 409 CA GLN A 29 -13.458 -1.804 0.029 1.00 0.00 C ATOM 410 C GLN A 29 -12.951 -3.235 -0.159 1.00 0.00 C ATOM 411 O GLN A 29 -13.382 -4.148 0.545 1.00 0.00 O ATOM 412 CB GLN A 29 -14.648 -1.519 -0.889 1.00 0.00 C ATOM 413 CG GLN A 29 -15.598 -2.717 -0.944 1.00 0.00 C ATOM 414 CD GLN A 29 -17.057 -2.264 -0.870 1.00 0.00 C ATOM 415 OE1 GLN A 29 -17.478 -1.587 0.054 1.00 0.00 O ATOM 416 NE2 GLN A 29 -17.803 -2.674 -1.892 1.00 0.00 N ATOM 0 H GLN A 29 -12.433 -0.362 -1.093 1.00 0.00 H new ATOM 0 HA GLN A 29 -13.800 -1.693 1.058 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -15.185 -0.641 -0.532 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -14.290 -1.288 -1.892 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -15.433 -3.274 -1.866 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -15.382 -3.395 -0.119 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -17.387 -3.239 -2.633 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -18.791 -2.424 -1.935 1.00 0.00 H new ATOM 425 N MET A 30 -12.043 -3.387 -1.111 1.00 0.00 N ATOM 426 CA MET A 30 -11.472 -4.692 -1.400 1.00 0.00 C ATOM 427 C MET A 30 -10.201 -4.928 -0.582 1.00 0.00 C ATOM 428 O MET A 30 -9.984 -6.024 -0.068 1.00 0.00 O ATOM 429 CB MET A 30 -11.144 -4.786 -2.892 1.00 0.00 C ATOM 430 CG MET A 30 -12.420 -4.917 -3.726 1.00 0.00 C ATOM 431 SD MET A 30 -12.009 -5.386 -5.399 1.00 0.00 S ATOM 432 CE MET A 30 -11.898 -3.772 -6.154 1.00 0.00 C ATOM 0 H MET A 30 -11.688 -2.628 -1.693 1.00 0.00 H new ATOM 0 HA MET A 30 -12.202 -5.455 -1.130 1.00 0.00 H new ATOM 0 HB2 MET A 30 -10.591 -3.900 -3.203 1.00 0.00 H new ATOM 0 HB3 MET A 30 -10.497 -5.645 -3.073 1.00 0.00 H new ATOM 0 HG2 MET A 30 -13.080 -5.662 -3.282 1.00 0.00 H new ATOM 0 HG3 MET A 30 -12.962 -3.972 -3.727 1.00 0.00 H new ATOM 0 HE1 MET A 30 -11.646 -3.880 -7.209 1.00 0.00 H new ATOM 0 HE2 MET A 30 -12.856 -3.260 -6.060 1.00 0.00 H new ATOM 0 HE3 MET A 30 -11.124 -3.189 -5.655 1.00 0.00 H new ATOM 442 N ILE A 31 -9.394 -3.881 -0.486 1.00 0.00 N ATOM 443 CA ILE A 31 -8.151 -3.961 0.261 1.00 0.00 C ATOM 444 C ILE A 31 -8.444 -4.449 1.681 1.00 0.00 C ATOM 445 O ILE A 31 -7.663 -5.206 2.255 1.00 0.00 O ATOM 446 CB ILE A 31 -7.409 -2.624 0.211 1.00 0.00 C ATOM 447 CG1 ILE A 31 -6.693 -2.444 -1.129 1.00 0.00 C ATOM 448 CG2 ILE A 31 -6.451 -2.484 1.396 1.00 0.00 C ATOM 449 CD1 ILE A 31 -6.410 -0.966 -1.405 1.00 0.00 C ATOM 0 H ILE A 31 -9.577 -2.973 -0.913 1.00 0.00 H new ATOM 0 HA ILE A 31 -7.480 -4.689 -0.194 1.00 0.00 H new ATOM 0 HB ILE A 31 -8.143 -1.823 0.294 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -5.757 -3.002 -1.123 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.305 -2.857 -1.931 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -5.936 -1.525 1.336 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -7.015 -2.536 2.328 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -5.719 -3.291 1.369 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.901 -0.866 -2.363 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -7.350 -0.415 -1.434 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.778 -0.563 -0.614 1.00 0.00 H new ATOM 461 N SER A 32 -9.572 -3.995 2.207 1.00 0.00 N ATOM 462 CA SER A 32 -9.979 -4.375 3.549 1.00 0.00 C ATOM 463 C SER A 32 -10.078 -5.899 3.654 1.00 0.00 C ATOM 464 O SER A 32 -9.314 -6.525 4.386 1.00 0.00 O ATOM 465 CB SER A 32 -11.314 -3.730 3.924 1.00 0.00 C ATOM 466 OG SER A 32 -11.736 -4.098 5.234 1.00 0.00 O ATOM 0 H SER A 32 -10.217 -3.367 1.728 1.00 0.00 H new ATOM 0 HA SER A 32 -9.224 -4.017 4.249 1.00 0.00 H new ATOM 0 HB2 SER A 32 -11.222 -2.646 3.864 1.00 0.00 H new ATOM 0 HB3 SER A 32 -12.075 -4.026 3.202 1.00 0.00 H new ATOM 0 HG SER A 32 -12.591 -3.664 5.436 1.00 0.00 H new ATOM 472 N ASP A 33 -11.026 -6.450 2.910 1.00 0.00 N ATOM 473 CA ASP A 33 -11.235 -7.888 2.910 1.00 0.00 C ATOM 474 C ASP A 33 -9.884 -8.596 2.781 1.00 0.00 C ATOM 475 O ASP A 33 -9.660 -9.631 3.405 1.00 0.00 O ATOM 476 CB ASP A 33 -12.108 -8.318 1.729 1.00 0.00 C ATOM 477 CG ASP A 33 -12.946 -9.575 1.969 1.00 0.00 C ATOM 478 OD1 ASP A 33 -12.704 -10.230 3.005 1.00 0.00 O ATOM 479 OD2 ASP A 33 -13.811 -9.853 1.110 1.00 0.00 O ATOM 0 H ASP A 33 -11.658 -5.927 2.303 1.00 0.00 H new ATOM 0 HA ASP A 33 -11.732 -8.156 3.842 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -12.777 -7.497 1.473 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -11.466 -8.487 0.864 1.00 0.00 H new ATOM 484 N HIS A 34 -9.020 -8.008 1.967 1.00 0.00 N ATOM 485 CA HIS A 34 -7.697 -8.569 1.748 1.00 0.00 C ATOM 486 C HIS A 34 -6.869 -8.444 3.028 1.00 0.00 C ATOM 487 O HIS A 34 -7.384 -8.037 4.068 1.00 0.00 O ATOM 488 CB HIS A 34 -7.024 -7.916 0.539 1.00 0.00 C ATOM 489 CG HIS A 34 -7.576 -8.370 -0.791 1.00 0.00 C ATOM 490 ND1 HIS A 34 -6.774 -8.844 -1.814 1.00 0.00 N ATOM 491 CD2 HIS A 34 -8.858 -8.417 -1.254 1.00 0.00 C ATOM 492 CE1 HIS A 34 -7.548 -9.158 -2.842 1.00 0.00 C ATOM 493 NE2 HIS A 34 -8.840 -8.893 -2.493 1.00 0.00 N ATOM 0 H HIS A 34 -9.210 -7.149 1.451 1.00 0.00 H new ATOM 0 HA HIS A 34 -7.781 -9.630 1.514 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -7.133 -6.834 0.616 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -5.956 -8.132 0.570 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -9.739 -8.118 -0.705 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -7.215 -9.554 -3.790 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -9.657 -9.037 -3.086 1.00 0.00 H new ATOM 501 N ASN A 35 -5.598 -8.801 2.910 1.00 0.00 N ATOM 502 CA ASN A 35 -4.693 -8.734 4.044 1.00 0.00 C ATOM 503 C ASN A 35 -5.159 -9.715 5.122 1.00 0.00 C ATOM 504 O ASN A 35 -6.086 -10.492 4.899 1.00 0.00 O ATOM 505 CB ASN A 35 -4.680 -7.331 4.656 1.00 0.00 C ATOM 506 CG ASN A 35 -4.300 -6.281 3.610 1.00 0.00 C ATOM 507 OD1 ASN A 35 -3.149 -5.909 3.456 1.00 0.00 O ATOM 508 ND2 ASN A 35 -5.330 -5.825 2.902 1.00 0.00 N ATOM 0 H ASN A 35 -5.174 -9.138 2.046 1.00 0.00 H new ATOM 0 HA ASN A 35 -3.692 -8.984 3.692 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -5.663 -7.101 5.068 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.972 -7.298 5.484 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -5.180 -5.121 2.179 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -6.269 -6.179 3.082 1.00 0.00 H new ATOM 515 N ASP A 36 -4.495 -9.647 6.266 1.00 0.00 N ATOM 516 CA ASP A 36 -4.830 -10.519 7.379 1.00 0.00 C ATOM 517 C ASP A 36 -5.028 -9.677 8.640 1.00 0.00 C ATOM 518 O ASP A 36 -5.134 -8.454 8.564 1.00 0.00 O ATOM 519 CB ASP A 36 -3.706 -11.521 7.651 1.00 0.00 C ATOM 520 CG ASP A 36 -4.165 -12.878 8.188 1.00 0.00 C ATOM 521 OD1 ASP A 36 -4.833 -13.598 7.414 1.00 0.00 O ATOM 522 OD2 ASP A 36 -3.837 -13.165 9.359 1.00 0.00 O ATOM 0 H ASP A 36 -3.726 -9.001 6.447 1.00 0.00 H new ATOM 0 HA ASP A 36 -5.741 -11.060 7.121 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -3.152 -11.682 6.726 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -3.012 -11.080 8.366 1.00 0.00 H new ATOM 527 N ALA A 37 -5.070 -10.365 9.772 1.00 0.00 N ATOM 528 CA ALA A 37 -5.254 -9.695 11.048 1.00 0.00 C ATOM 529 C ALA A 37 -4.052 -8.787 11.320 1.00 0.00 C ATOM 530 O ALA A 37 -4.218 -7.617 11.662 1.00 0.00 O ATOM 531 CB ALA A 37 -5.456 -10.739 12.149 1.00 0.00 C ATOM 0 H ALA A 37 -4.980 -11.379 9.832 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.145 -9.067 11.027 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -5.594 -10.236 13.106 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -6.338 -11.339 11.924 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -4.580 -11.386 12.202 1.00 0.00 H new ATOM 537 N ASP A 38 -2.869 -9.361 11.158 1.00 0.00 N ATOM 538 CA ASP A 38 -1.640 -8.618 11.381 1.00 0.00 C ATOM 539 C ASP A 38 -1.788 -7.209 10.802 1.00 0.00 C ATOM 540 O ASP A 38 -1.675 -6.221 11.526 1.00 0.00 O ATOM 541 CB ASP A 38 -0.455 -9.292 10.688 1.00 0.00 C ATOM 542 CG ASP A 38 -0.249 -10.765 11.045 1.00 0.00 C ATOM 543 OD1 ASP A 38 -1.220 -11.533 10.871 1.00 0.00 O ATOM 544 OD2 ASP A 38 0.875 -11.091 11.485 1.00 0.00 O ATOM 0 H ASP A 38 -2.735 -10.332 10.875 1.00 0.00 H new ATOM 0 HA ASP A 38 -1.457 -8.584 12.455 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -0.590 -9.211 9.609 1.00 0.00 H new ATOM 0 HB3 ASP A 38 0.453 -8.743 10.938 1.00 0.00 H new ATOM 549 N PHE A 39 -2.040 -7.162 9.502 1.00 0.00 N ATOM 550 CA PHE A 39 -2.204 -5.891 8.817 1.00 0.00 C ATOM 551 C PHE A 39 -3.316 -5.061 9.462 1.00 0.00 C ATOM 552 O PHE A 39 -3.182 -3.848 9.612 1.00 0.00 O ATOM 553 CB PHE A 39 -2.594 -6.209 7.372 1.00 0.00 C ATOM 554 CG PHE A 39 -2.822 -4.971 6.503 1.00 0.00 C ATOM 555 CD1 PHE A 39 -1.765 -4.211 6.111 1.00 0.00 C ATOM 556 CD2 PHE A 39 -4.083 -4.630 6.122 1.00 0.00 C ATOM 557 CE1 PHE A 39 -1.976 -3.062 5.304 1.00 0.00 C ATOM 558 CE2 PHE A 39 -4.294 -3.481 5.315 1.00 0.00 C ATOM 559 CZ PHE A 39 -3.237 -2.721 4.923 1.00 0.00 C ATOM 0 H PHE A 39 -2.135 -7.984 8.905 1.00 0.00 H new ATOM 0 HA PHE A 39 -1.279 -5.316 8.872 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -1.811 -6.818 6.921 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -3.503 -6.810 7.376 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.764 -4.481 6.414 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -4.923 -5.233 6.433 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -1.136 -2.459 4.993 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -5.295 -3.211 5.012 1.00 0.00 H new ATOM 0 HZ PHE A 39 -3.398 -1.847 4.309 1.00 0.00 H new ATOM 569 N GLU A 40 -4.389 -5.748 9.826 1.00 0.00 N ATOM 570 CA GLU A 40 -5.523 -5.090 10.452 1.00 0.00 C ATOM 571 C GLU A 40 -5.086 -4.390 11.740 1.00 0.00 C ATOM 572 O GLU A 40 -5.300 -3.190 11.903 1.00 0.00 O ATOM 573 CB GLU A 40 -6.653 -6.085 10.724 1.00 0.00 C ATOM 574 CG GLU A 40 -7.559 -6.234 9.500 1.00 0.00 C ATOM 575 CD GLU A 40 -8.463 -5.011 9.334 1.00 0.00 C ATOM 576 OE1 GLU A 40 -9.509 -4.982 10.018 1.00 0.00 O ATOM 577 OE2 GLU A 40 -8.088 -4.132 8.528 1.00 0.00 O ATOM 0 H GLU A 40 -4.497 -6.754 9.699 1.00 0.00 H new ATOM 0 HA GLU A 40 -5.906 -4.336 9.764 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.232 -7.055 10.990 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.241 -5.748 11.578 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.949 -6.364 8.606 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.170 -7.131 9.602 1.00 0.00 H new ATOM 584 N GLU A 41 -4.482 -5.171 12.624 1.00 0.00 N ATOM 585 CA GLU A 41 -4.013 -4.641 13.893 1.00 0.00 C ATOM 586 C GLU A 41 -2.997 -3.521 13.659 1.00 0.00 C ATOM 587 O GLU A 41 -2.923 -2.573 14.438 1.00 0.00 O ATOM 588 CB GLU A 41 -3.416 -5.750 14.763 1.00 0.00 C ATOM 589 CG GLU A 41 -4.370 -6.130 15.898 1.00 0.00 C ATOM 590 CD GLU A 41 -3.935 -5.489 17.217 1.00 0.00 C ATOM 591 OE1 GLU A 41 -2.773 -5.731 17.610 1.00 0.00 O ATOM 592 OE2 GLU A 41 -4.774 -4.772 17.803 1.00 0.00 O ATOM 0 H GLU A 41 -4.307 -6.166 12.486 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.866 -4.224 14.428 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.208 -6.626 14.149 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -2.464 -5.419 15.179 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.382 -5.810 15.650 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -4.397 -7.214 16.008 1.00 0.00 H new ATOM 599 N LYS A 42 -2.240 -3.669 12.582 1.00 0.00 N ATOM 600 CA LYS A 42 -1.232 -2.682 12.235 1.00 0.00 C ATOM 601 C LYS A 42 -1.921 -1.393 11.781 1.00 0.00 C ATOM 602 O LYS A 42 -1.621 -0.313 12.287 1.00 0.00 O ATOM 603 CB LYS A 42 -0.255 -3.253 11.204 1.00 0.00 C ATOM 604 CG LYS A 42 0.705 -4.252 11.854 1.00 0.00 C ATOM 605 CD LYS A 42 1.879 -4.566 10.925 1.00 0.00 C ATOM 606 CE LYS A 42 2.739 -5.697 11.493 1.00 0.00 C ATOM 607 NZ LYS A 42 3.799 -6.076 10.531 1.00 0.00 N ATOM 0 H LYS A 42 -2.304 -4.458 11.938 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.629 -2.431 13.107 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.810 -3.744 10.404 1.00 0.00 H new ATOM 0 HB3 LYS A 42 0.312 -2.442 10.747 1.00 0.00 H new ATOM 0 HG2 LYS A 42 1.079 -3.845 12.793 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.171 -5.171 12.095 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.504 -4.848 9.941 1.00 0.00 H new ATOM 0 HD3 LYS A 42 2.489 -3.673 10.789 1.00 0.00 H new ATOM 0 HE2 LYS A 42 3.190 -5.382 12.434 1.00 0.00 H new ATOM 0 HE3 LYS A 42 2.113 -6.562 11.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 4.373 -6.845 10.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 3.363 -6.397 9.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 4.406 -5.253 10.341 1.00 0.00 H new ATOM 621 N VAL A 43 -2.832 -1.550 10.831 1.00 0.00 N ATOM 622 CA VAL A 43 -3.566 -0.413 10.303 1.00 0.00 C ATOM 623 C VAL A 43 -4.041 0.465 11.463 1.00 0.00 C ATOM 624 O VAL A 43 -3.788 1.669 11.479 1.00 0.00 O ATOM 625 CB VAL A 43 -4.711 -0.897 9.412 1.00 0.00 C ATOM 626 CG1 VAL A 43 -5.830 0.144 9.343 1.00 0.00 C ATOM 627 CG2 VAL A 43 -4.205 -1.251 8.013 1.00 0.00 C ATOM 0 H VAL A 43 -3.078 -2.448 10.414 1.00 0.00 H new ATOM 0 HA VAL A 43 -2.920 0.200 9.674 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.123 -1.802 9.858 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -6.631 -0.225 8.703 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.220 0.326 10.344 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.437 1.074 8.932 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.039 -1.592 7.400 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.755 -0.370 7.555 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -3.460 -2.043 8.085 1.00 0.00 H new ATOM 637 N LYS A 44 -4.720 -0.172 12.405 1.00 0.00 N ATOM 638 CA LYS A 44 -5.233 0.536 13.566 1.00 0.00 C ATOM 639 C LYS A 44 -4.063 1.122 14.359 1.00 0.00 C ATOM 640 O LYS A 44 -4.104 2.280 14.769 1.00 0.00 O ATOM 641 CB LYS A 44 -6.140 -0.377 14.393 1.00 0.00 C ATOM 642 CG LYS A 44 -5.922 -0.156 15.891 1.00 0.00 C ATOM 643 CD LYS A 44 -6.755 -1.138 16.718 1.00 0.00 C ATOM 644 CE LYS A 44 -6.180 -1.294 18.127 1.00 0.00 C ATOM 645 NZ LYS A 44 -7.262 -1.563 19.101 1.00 0.00 N ATOM 0 H LYS A 44 -4.927 -1.171 12.388 1.00 0.00 H new ATOM 0 HA LYS A 44 -5.859 1.372 13.256 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.183 -0.184 14.141 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.939 -1.419 14.142 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.866 -0.279 16.130 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -6.192 0.867 16.154 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -7.785 -0.786 16.779 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.779 -2.108 16.222 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -5.457 -2.110 18.143 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -5.645 -0.388 18.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -6.855 -1.666 20.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -7.937 -0.772 19.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -7.755 -2.440 18.838 1.00 0.00 H new ATOM 659 N GLN A 45 -3.046 0.294 14.551 1.00 0.00 N ATOM 660 CA GLN A 45 -1.866 0.715 15.287 1.00 0.00 C ATOM 661 C GLN A 45 -1.309 2.013 14.698 1.00 0.00 C ATOM 662 O GLN A 45 -0.789 2.856 15.428 1.00 0.00 O ATOM 663 CB GLN A 45 -0.803 -0.385 15.294 1.00 0.00 C ATOM 664 CG GLN A 45 -0.699 -1.038 16.674 1.00 0.00 C ATOM 665 CD GLN A 45 0.645 -0.720 17.332 1.00 0.00 C ATOM 666 OE1 GLN A 45 0.778 0.205 18.117 1.00 0.00 O ATOM 667 NE2 GLN A 45 1.631 -1.535 16.968 1.00 0.00 N ATOM 0 H GLN A 45 -3.015 -0.667 14.209 1.00 0.00 H new ATOM 0 HA GLN A 45 -2.154 0.902 16.321 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -1.051 -1.140 14.548 1.00 0.00 H new ATOM 0 HB3 GLN A 45 0.163 0.036 15.013 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -1.511 -0.685 17.309 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -0.815 -2.118 16.579 1.00 0.00 H new ATOM 0 HE21 GLN A 45 1.451 -2.290 16.306 1.00 0.00 H new ATOM 0 HE22 GLN A 45 2.568 -1.405 17.351 1.00 0.00 H new ATOM 676 N LEU A 46 -1.436 2.132 13.385 1.00 0.00 N ATOM 677 CA LEU A 46 -0.951 3.313 12.690 1.00 0.00 C ATOM 678 C LEU A 46 -1.755 4.532 13.145 1.00 0.00 C ATOM 679 O LEU A 46 -1.220 5.637 13.228 1.00 0.00 O ATOM 680 CB LEU A 46 -0.973 3.091 11.177 1.00 0.00 C ATOM 681 CG LEU A 46 0.319 2.552 10.559 1.00 0.00 C ATOM 682 CD1 LEU A 46 0.096 2.126 9.107 1.00 0.00 C ATOM 683 CD2 LEU A 46 1.455 3.569 10.690 1.00 0.00 C ATOM 0 H LEU A 46 -1.868 1.430 12.784 1.00 0.00 H new ATOM 0 HA LEU A 46 0.091 3.505 12.945 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.781 2.398 10.943 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -1.216 4.038 10.694 1.00 0.00 H new ATOM 0 HG LEU A 46 0.618 1.662 11.113 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.030 1.747 8.692 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.662 1.344 9.070 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.239 2.984 8.524 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.362 3.161 10.243 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.180 4.490 10.176 1.00 0.00 H new ATOM 0 HD23 LEU A 46 1.634 3.781 11.744 1.00 0.00 H new ATOM 695 N ILE A 47 -3.027 4.291 13.427 1.00 0.00 N ATOM 696 CA ILE A 47 -3.910 5.356 13.871 1.00 0.00 C ATOM 697 C ILE A 47 -3.420 5.891 15.218 1.00 0.00 C ATOM 698 O ILE A 47 -3.102 7.073 15.342 1.00 0.00 O ATOM 699 CB ILE A 47 -5.362 4.874 13.893 1.00 0.00 C ATOM 700 CG1 ILE A 47 -5.762 4.277 12.542 1.00 0.00 C ATOM 701 CG2 ILE A 47 -6.306 5.998 14.325 1.00 0.00 C ATOM 702 CD1 ILE A 47 -6.993 3.380 12.682 1.00 0.00 C ATOM 0 H ILE A 47 -3.467 3.374 13.357 1.00 0.00 H new ATOM 0 HA ILE A 47 -3.885 6.189 13.168 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.447 4.079 14.634 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -5.970 5.079 11.834 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -4.932 3.700 12.135 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.332 5.629 14.332 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -6.035 6.337 15.325 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.225 6.830 13.626 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -7.256 2.969 11.708 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -6.773 2.566 13.372 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -7.828 3.966 13.066 1.00 0.00 H new ATOM 714 N ASP A 48 -3.373 4.996 16.193 1.00 0.00 N ATOM 715 CA ASP A 48 -2.927 5.363 17.526 1.00 0.00 C ATOM 716 C ASP A 48 -1.517 5.951 17.443 1.00 0.00 C ATOM 717 O ASP A 48 -1.165 6.840 18.217 1.00 0.00 O ATOM 718 CB ASP A 48 -2.877 4.142 18.446 1.00 0.00 C ATOM 719 CG ASP A 48 -3.571 4.321 19.798 1.00 0.00 C ATOM 720 OD1 ASP A 48 -4.778 4.645 19.777 1.00 0.00 O ATOM 721 OD2 ASP A 48 -2.880 4.129 20.821 1.00 0.00 O ATOM 0 H ASP A 48 -3.637 4.016 16.086 1.00 0.00 H new ATOM 0 HA ASP A 48 -3.632 6.089 17.930 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -3.334 3.298 17.929 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.833 3.881 18.622 1.00 0.00 H new ATOM 726 N ILE A 49 -0.748 5.430 16.498 1.00 0.00 N ATOM 727 CA ILE A 49 0.616 5.892 16.304 1.00 0.00 C ATOM 728 C ILE A 49 0.593 7.285 15.672 1.00 0.00 C ATOM 729 O ILE A 49 0.935 8.272 16.322 1.00 0.00 O ATOM 730 CB ILE A 49 1.421 4.866 15.504 1.00 0.00 C ATOM 731 CG1 ILE A 49 1.612 3.575 16.302 1.00 0.00 C ATOM 732 CG2 ILE A 49 2.754 5.456 15.040 1.00 0.00 C ATOM 733 CD1 ILE A 49 1.753 2.370 15.370 1.00 0.00 C ATOM 0 H ILE A 49 -1.044 4.692 15.858 1.00 0.00 H new ATOM 0 HA ILE A 49 1.127 5.985 17.262 1.00 0.00 H new ATOM 0 HB ILE A 49 0.854 4.610 14.609 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.499 3.659 16.930 1.00 0.00 H new ATOM 0 HG13 ILE A 49 0.763 3.426 16.969 1.00 0.00 H new ATOM 0 HG21 ILE A 49 3.306 4.706 14.474 1.00 0.00 H new ATOM 0 HG22 ILE A 49 2.567 6.324 14.407 1.00 0.00 H new ATOM 0 HG23 ILE A 49 3.339 5.759 15.908 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.888 1.465 15.963 1.00 0.00 H new ATOM 0 HD12 ILE A 49 0.854 2.274 14.761 1.00 0.00 H new ATOM 0 HD13 ILE A 49 2.618 2.511 14.722 1.00 0.00 H new ATOM 745 N THR A 50 0.186 7.321 14.411 1.00 0.00 N ATOM 746 CA THR A 50 0.114 8.576 13.683 1.00 0.00 C ATOM 747 C THR A 50 -1.080 9.403 14.164 1.00 0.00 C ATOM 748 O THR A 50 -0.906 10.433 14.813 1.00 0.00 O ATOM 749 CB THR A 50 0.068 8.254 12.188 1.00 0.00 C ATOM 750 OG1 THR A 50 -1.222 7.679 11.997 1.00 0.00 O ATOM 751 CG2 THR A 50 1.037 7.135 11.800 1.00 0.00 C ATOM 0 H THR A 50 -0.097 6.501 13.875 1.00 0.00 H new ATOM 0 HA THR A 50 0.993 9.193 13.870 1.00 0.00 H new ATOM 0 HB THR A 50 0.303 9.151 11.616 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.189 6.724 12.212 1.00 0.00 H new ATOM 0 HG21 THR A 50 0.964 6.946 10.729 1.00 0.00 H new ATOM 0 HG22 THR A 50 2.056 7.434 12.048 1.00 0.00 H new ATOM 0 HG23 THR A 50 0.782 6.227 12.347 1.00 0.00 H new ATOM 759 N GLY A 51 -2.267 8.921 13.826 1.00 0.00 N ATOM 760 CA GLY A 51 -3.490 9.603 14.215 1.00 0.00 C ATOM 761 C GLY A 51 -4.261 10.089 12.986 1.00 0.00 C ATOM 762 O GLY A 51 -5.168 10.912 13.103 1.00 0.00 O ATOM 0 H GLY A 51 -2.408 8.066 13.287 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -4.117 8.929 14.799 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.250 10.451 14.857 1.00 0.00 H new ATOM 766 N LYS A 52 -3.872 9.560 11.835 1.00 0.00 N ATOM 767 CA LYS A 52 -4.515 9.930 10.586 1.00 0.00 C ATOM 768 C LYS A 52 -5.830 9.160 10.447 1.00 0.00 C ATOM 769 O LYS A 52 -6.458 8.811 11.445 1.00 0.00 O ATOM 770 CB LYS A 52 -3.557 9.729 9.410 1.00 0.00 C ATOM 771 CG LYS A 52 -2.180 10.321 9.717 1.00 0.00 C ATOM 772 CD LYS A 52 -2.157 11.827 9.445 1.00 0.00 C ATOM 773 CE LYS A 52 -1.058 12.186 8.443 1.00 0.00 C ATOM 774 NZ LYS A 52 -1.366 13.469 7.773 1.00 0.00 N ATOM 0 H LYS A 52 -3.119 8.878 11.741 1.00 0.00 H new ATOM 0 HA LYS A 52 -4.765 10.991 10.586 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -3.459 8.665 9.194 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -3.968 10.200 8.517 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.923 10.132 10.759 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.424 9.826 9.108 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -3.125 12.145 9.058 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -1.994 12.366 10.378 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -0.099 12.258 8.956 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.963 11.394 7.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.610 13.698 7.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -2.271 13.388 7.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -1.434 14.225 8.484 1.00 0.00 H new ATOM 788 N ASN A 53 -6.208 8.918 9.200 1.00 0.00 N ATOM 789 CA ASN A 53 -7.436 8.195 8.917 1.00 0.00 C ATOM 790 C ASN A 53 -7.103 6.737 8.595 1.00 0.00 C ATOM 791 O ASN A 53 -6.288 6.463 7.715 1.00 0.00 O ATOM 792 CB ASN A 53 -8.161 8.793 7.710 1.00 0.00 C ATOM 793 CG ASN A 53 -8.639 10.216 8.006 1.00 0.00 C ATOM 794 OD1 ASN A 53 -9.294 10.484 9.000 1.00 0.00 O ATOM 795 ND2 ASN A 53 -8.277 11.110 7.090 1.00 0.00 N ATOM 0 H ASN A 53 -5.685 9.210 8.374 1.00 0.00 H new ATOM 0 HA ASN A 53 -8.078 8.265 9.795 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.494 8.802 6.848 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -9.013 8.167 7.447 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -8.548 12.088 7.196 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -7.728 10.818 6.281 1.00 0.00 H new ATOM 802 N GLN A 54 -7.750 5.840 9.324 1.00 0.00 N ATOM 803 CA GLN A 54 -7.532 4.417 9.127 1.00 0.00 C ATOM 804 C GLN A 54 -7.356 4.109 7.639 1.00 0.00 C ATOM 805 O GLN A 54 -6.291 3.663 7.215 1.00 0.00 O ATOM 806 CB GLN A 54 -8.678 3.599 9.725 1.00 0.00 C ATOM 807 CG GLN A 54 -8.418 2.099 9.573 1.00 0.00 C ATOM 808 CD GLN A 54 -9.654 1.286 9.966 1.00 0.00 C ATOM 809 OE1 GLN A 54 -10.503 1.726 10.723 1.00 0.00 O ATOM 810 NE2 GLN A 54 -9.706 0.079 9.410 1.00 0.00 N ATOM 0 H GLN A 54 -8.426 6.071 10.052 1.00 0.00 H new ATOM 0 HA GLN A 54 -6.617 4.133 9.648 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -8.794 3.847 10.780 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -9.613 3.862 9.231 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -8.145 1.876 8.542 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -7.573 1.808 10.197 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -8.961 -0.227 8.785 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -10.491 -0.541 9.609 1.00 0.00 H new ATOM 819 N ASP A 55 -8.418 4.358 6.886 1.00 0.00 N ATOM 820 CA ASP A 55 -8.394 4.113 5.454 1.00 0.00 C ATOM 821 C ASP A 55 -7.039 4.545 4.889 1.00 0.00 C ATOM 822 O ASP A 55 -6.304 3.727 4.338 1.00 0.00 O ATOM 823 CB ASP A 55 -9.482 4.916 4.739 1.00 0.00 C ATOM 824 CG ASP A 55 -9.876 6.226 5.426 1.00 0.00 C ATOM 825 OD1 ASP A 55 -10.604 6.139 6.438 1.00 0.00 O ATOM 826 OD2 ASP A 55 -9.439 7.284 4.924 1.00 0.00 O ATOM 0 H ASP A 55 -9.300 4.727 7.241 1.00 0.00 H new ATOM 0 HA ASP A 55 -8.566 3.049 5.292 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -9.141 5.141 3.728 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -10.370 4.292 4.644 1.00 0.00 H new ATOM 831 N GLU A 56 -6.751 5.828 5.046 1.00 0.00 N ATOM 832 CA GLU A 56 -5.497 6.378 4.558 1.00 0.00 C ATOM 833 C GLU A 56 -4.318 5.554 5.078 1.00 0.00 C ATOM 834 O GLU A 56 -3.390 5.252 4.329 1.00 0.00 O ATOM 835 CB GLU A 56 -5.354 7.850 4.952 1.00 0.00 C ATOM 836 CG GLU A 56 -6.355 8.721 4.191 1.00 0.00 C ATOM 837 CD GLU A 56 -5.703 9.359 2.962 1.00 0.00 C ATOM 838 OE1 GLU A 56 -5.465 8.608 1.992 1.00 0.00 O ATOM 839 OE2 GLU A 56 -5.458 10.584 3.021 1.00 0.00 O ATOM 0 H GLU A 56 -7.364 6.503 5.504 1.00 0.00 H new ATOM 0 HA GLU A 56 -5.499 6.326 3.469 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.513 7.960 6.025 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.339 8.189 4.743 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.208 8.116 3.882 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.739 9.500 4.849 1.00 0.00 H new ATOM 846 N CYS A 57 -4.393 5.214 6.356 1.00 0.00 N ATOM 847 CA CYS A 57 -3.343 4.430 6.984 1.00 0.00 C ATOM 848 C CYS A 57 -3.211 3.108 6.226 1.00 0.00 C ATOM 849 O CYS A 57 -2.101 2.641 5.974 1.00 0.00 O ATOM 850 CB CYS A 57 -3.617 4.209 8.473 1.00 0.00 C ATOM 851 SG CYS A 57 -3.526 5.802 9.370 1.00 0.00 S ATOM 0 H CYS A 57 -5.164 5.467 6.974 1.00 0.00 H new ATOM 0 HA CYS A 57 -2.399 4.973 6.931 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -4.602 3.762 8.607 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -2.891 3.508 8.885 1.00 0.00 H new ATOM 0 HG CYS A 57 -4.471 6.591 8.951 1.00 0.00 H new ATOM 857 N VAL A 58 -4.358 2.542 5.883 1.00 0.00 N ATOM 858 CA VAL A 58 -4.385 1.283 5.158 1.00 0.00 C ATOM 859 C VAL A 58 -3.665 1.455 3.819 1.00 0.00 C ATOM 860 O VAL A 58 -2.780 0.671 3.481 1.00 0.00 O ATOM 861 CB VAL A 58 -5.828 0.798 5.004 1.00 0.00 C ATOM 862 CG1 VAL A 58 -5.881 -0.539 4.261 1.00 0.00 C ATOM 863 CG2 VAL A 58 -6.521 0.697 6.364 1.00 0.00 C ATOM 0 H VAL A 58 -5.277 2.932 6.094 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.855 0.510 5.715 1.00 0.00 H new ATOM 0 HB VAL A 58 -6.367 1.534 4.408 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.918 -0.861 4.165 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.444 -0.422 3.269 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.319 -1.288 4.819 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.545 0.350 6.226 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -5.981 -0.008 6.996 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.531 1.677 6.841 1.00 0.00 H new ATOM 873 N ILE A 59 -4.072 2.486 3.093 1.00 0.00 N ATOM 874 CA ILE A 59 -3.478 2.771 1.798 1.00 0.00 C ATOM 875 C ILE A 59 -1.966 2.939 1.962 1.00 0.00 C ATOM 876 O ILE A 59 -1.187 2.211 1.349 1.00 0.00 O ATOM 877 CB ILE A 59 -4.163 3.973 1.147 1.00 0.00 C ATOM 878 CG1 ILE A 59 -5.603 3.638 0.755 1.00 0.00 C ATOM 879 CG2 ILE A 59 -3.350 4.490 -0.042 1.00 0.00 C ATOM 880 CD1 ILE A 59 -6.587 4.630 1.379 1.00 0.00 C ATOM 0 H ILE A 59 -4.806 3.134 3.377 1.00 0.00 H new ATOM 0 HA ILE A 59 -3.635 1.936 1.115 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.209 4.778 1.880 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -5.702 3.657 -0.330 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -5.846 2.626 1.080 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -3.859 5.345 -0.487 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -2.360 4.794 0.299 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -3.250 3.700 -0.786 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -7.603 4.369 1.084 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.503 4.591 2.465 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -6.357 5.638 1.033 1.00 0.00 H new ATOM 892 N ALA A 60 -1.596 3.902 2.793 1.00 0.00 N ATOM 893 CA ALA A 60 -0.192 4.175 3.046 1.00 0.00 C ATOM 894 C ALA A 60 0.512 2.876 3.444 1.00 0.00 C ATOM 895 O ALA A 60 1.468 2.458 2.793 1.00 0.00 O ATOM 896 CB ALA A 60 -0.067 5.258 4.119 1.00 0.00 C ATOM 0 H ALA A 60 -2.245 4.503 3.300 1.00 0.00 H new ATOM 0 HA ALA A 60 0.294 4.551 2.146 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.987 5.462 4.309 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -0.557 6.169 3.775 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.541 4.915 5.039 1.00 0.00 H new ATOM 902 N LEU A 61 0.012 2.273 4.513 1.00 0.00 N ATOM 903 CA LEU A 61 0.580 1.030 5.006 1.00 0.00 C ATOM 904 C LEU A 61 0.921 0.124 3.821 1.00 0.00 C ATOM 905 O LEU A 61 2.067 -0.292 3.663 1.00 0.00 O ATOM 906 CB LEU A 61 -0.356 0.381 6.027 1.00 0.00 C ATOM 907 CG LEU A 61 0.229 -0.786 6.827 1.00 0.00 C ATOM 908 CD1 LEU A 61 1.660 -0.480 7.275 1.00 0.00 C ATOM 909 CD2 LEU A 61 -0.675 -1.151 8.005 1.00 0.00 C ATOM 0 H LEU A 61 -0.781 2.623 5.051 1.00 0.00 H new ATOM 0 HA LEU A 61 1.511 1.222 5.539 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -0.684 1.148 6.728 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -1.244 0.027 5.503 1.00 0.00 H new ATOM 0 HG LEU A 61 0.275 -1.658 6.175 1.00 0.00 H new ATOM 0 HD11 LEU A 61 2.052 -1.325 7.841 1.00 0.00 H new ATOM 0 HD12 LEU A 61 2.286 -0.307 6.400 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.662 0.410 7.904 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.236 -1.983 8.556 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -0.776 -0.290 8.666 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.658 -1.441 7.633 1.00 0.00 H new ATOM 921 N HIS A 62 -0.096 -0.154 3.018 1.00 0.00 N ATOM 922 CA HIS A 62 0.081 -1.002 1.852 1.00 0.00 C ATOM 923 C HIS A 62 1.065 -0.344 0.883 1.00 0.00 C ATOM 924 O HIS A 62 2.078 -0.941 0.521 1.00 0.00 O ATOM 925 CB HIS A 62 -1.267 -1.322 1.203 1.00 0.00 C ATOM 926 CG HIS A 62 -1.161 -1.825 -0.217 1.00 0.00 C ATOM 927 ND1 HIS A 62 -1.516 -3.111 -0.584 1.00 0.00 N ATOM 928 CD2 HIS A 62 -0.737 -1.203 -1.354 1.00 0.00 C ATOM 929 CE1 HIS A 62 -1.310 -3.246 -1.886 1.00 0.00 C ATOM 930 NE2 HIS A 62 -0.827 -2.062 -2.361 1.00 0.00 N ATOM 0 H HIS A 62 -1.046 0.193 3.152 1.00 0.00 H new ATOM 0 HA HIS A 62 0.508 -1.958 2.155 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.780 -2.071 1.806 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -1.886 -0.425 1.215 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -0.387 -0.184 -1.423 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.492 -4.137 -2.469 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -0.576 -1.869 -3.331 1.00 0.00 H new ATOM 938 N ASP A 63 0.733 0.877 0.491 1.00 0.00 N ATOM 939 CA ASP A 63 1.574 1.622 -0.429 1.00 0.00 C ATOM 940 C ASP A 63 3.044 1.390 -0.071 1.00 0.00 C ATOM 941 O ASP A 63 3.836 0.984 -0.919 1.00 0.00 O ATOM 942 CB ASP A 63 1.297 3.124 -0.336 1.00 0.00 C ATOM 943 CG ASP A 63 1.090 3.828 -1.678 1.00 0.00 C ATOM 944 OD1 ASP A 63 0.048 3.550 -2.310 1.00 0.00 O ATOM 945 OD2 ASP A 63 1.980 4.628 -2.042 1.00 0.00 O ATOM 0 H ASP A 63 -0.108 1.369 0.794 1.00 0.00 H new ATOM 0 HA ASP A 63 1.356 1.277 -1.440 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.410 3.277 0.278 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.129 3.600 0.182 1.00 0.00 H new ATOM 950 N CYS A 64 3.363 1.658 1.187 1.00 0.00 N ATOM 951 CA CYS A 64 4.723 1.484 1.667 1.00 0.00 C ATOM 952 C CYS A 64 5.132 0.028 1.435 1.00 0.00 C ATOM 953 O CYS A 64 5.965 -0.257 0.575 1.00 0.00 O ATOM 954 CB CYS A 64 4.860 1.887 3.137 1.00 0.00 C ATOM 955 SG CYS A 64 5.869 3.407 3.277 1.00 0.00 S ATOM 0 H CYS A 64 2.703 1.994 1.888 1.00 0.00 H new ATOM 0 HA CYS A 64 5.393 2.142 1.113 1.00 0.00 H new ATOM 0 HB2 CYS A 64 3.874 2.054 3.570 1.00 0.00 H new ATOM 0 HB3 CYS A 64 5.324 1.079 3.703 1.00 0.00 H new ATOM 0 HG CYS A 64 5.512 4.069 4.337 1.00 0.00 H new ATOM 961 N ASN A 65 4.526 -0.855 2.215 1.00 0.00 N ATOM 962 CA ASN A 65 4.817 -2.275 2.105 1.00 0.00 C ATOM 963 C ASN A 65 4.217 -3.008 3.306 1.00 0.00 C ATOM 964 O ASN A 65 4.849 -3.897 3.874 1.00 0.00 O ATOM 965 CB ASN A 65 6.325 -2.530 2.100 1.00 0.00 C ATOM 966 CG ASN A 65 6.729 -3.409 0.915 1.00 0.00 C ATOM 967 OD1 ASN A 65 6.955 -2.942 -0.189 1.00 0.00 O ATOM 968 ND2 ASN A 65 6.808 -4.704 1.205 1.00 0.00 N ATOM 0 H ASN A 65 3.835 -0.615 2.926 1.00 0.00 H new ATOM 0 HA ASN A 65 4.388 -2.636 1.170 1.00 0.00 H new ATOM 0 HB2 ASN A 65 6.858 -1.580 2.051 1.00 0.00 H new ATOM 0 HB3 ASN A 65 6.619 -3.013 3.032 1.00 0.00 H new ATOM 0 HD21 ASN A 65 7.071 -5.373 0.482 1.00 0.00 H new ATOM 0 HD22 ASN A 65 6.605 -5.028 2.151 1.00 0.00 H new ATOM 975 N GLY A 66 3.003 -2.609 3.657 1.00 0.00 N ATOM 976 CA GLY A 66 2.310 -3.218 4.780 1.00 0.00 C ATOM 977 C GLY A 66 3.101 -3.034 6.076 1.00 0.00 C ATOM 978 O GLY A 66 2.817 -3.687 7.079 1.00 0.00 O ATOM 0 H GLY A 66 2.481 -1.871 3.183 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.321 -2.772 4.887 1.00 0.00 H new ATOM 0 HA3 GLY A 66 2.162 -4.281 4.588 1.00 0.00 H new ATOM 982 N ASP A 67 4.079 -2.142 6.014 1.00 0.00 N ATOM 983 CA ASP A 67 4.913 -1.864 7.171 1.00 0.00 C ATOM 984 C ASP A 67 4.388 -0.617 7.885 1.00 0.00 C ATOM 985 O ASP A 67 4.141 0.408 7.252 1.00 0.00 O ATOM 986 CB ASP A 67 6.361 -1.595 6.754 1.00 0.00 C ATOM 987 CG ASP A 67 7.360 -2.686 7.146 1.00 0.00 C ATOM 988 OD1 ASP A 67 7.593 -2.830 8.365 1.00 0.00 O ATOM 989 OD2 ASP A 67 7.867 -3.351 6.217 1.00 0.00 O ATOM 0 H ASP A 67 4.312 -1.602 5.180 1.00 0.00 H new ATOM 0 HA ASP A 67 4.882 -2.734 7.826 1.00 0.00 H new ATOM 0 HB2 ASP A 67 6.394 -1.465 5.672 1.00 0.00 H new ATOM 0 HB3 ASP A 67 6.682 -0.653 7.198 1.00 0.00 H new ATOM 994 N VAL A 68 4.232 -0.746 9.195 1.00 0.00 N ATOM 995 CA VAL A 68 3.740 0.357 10.002 1.00 0.00 C ATOM 996 C VAL A 68 4.803 1.456 10.058 1.00 0.00 C ATOM 997 O VAL A 68 4.490 2.636 9.909 1.00 0.00 O ATOM 998 CB VAL A 68 3.330 -0.150 11.387 1.00 0.00 C ATOM 999 CG1 VAL A 68 3.374 0.979 12.419 1.00 0.00 C ATOM 1000 CG2 VAL A 68 1.947 -0.801 11.344 1.00 0.00 C ATOM 0 H VAL A 68 4.438 -1.598 9.717 1.00 0.00 H new ATOM 0 HA VAL A 68 2.847 0.791 9.552 1.00 0.00 H new ATOM 0 HB VAL A 68 4.049 -0.910 11.693 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.078 0.592 13.394 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.387 1.378 12.479 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.688 1.772 12.120 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.679 -1.153 12.340 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.211 -0.071 11.007 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.963 -1.644 10.654 1.00 0.00 H new ATOM 1010 N ASN A 69 6.039 1.029 10.275 1.00 0.00 N ATOM 1011 CA ASN A 69 7.150 1.962 10.352 1.00 0.00 C ATOM 1012 C ASN A 69 7.255 2.734 9.036 1.00 0.00 C ATOM 1013 O ASN A 69 7.158 3.960 9.021 1.00 0.00 O ATOM 1014 CB ASN A 69 8.473 1.226 10.576 1.00 0.00 C ATOM 1015 CG ASN A 69 8.304 0.091 11.588 1.00 0.00 C ATOM 1016 OD1 ASN A 69 7.549 -0.846 11.390 1.00 0.00 O ATOM 1017 ND2 ASN A 69 9.049 0.228 12.682 1.00 0.00 N ATOM 0 H ASN A 69 6.295 0.050 10.400 1.00 0.00 H new ATOM 0 HA ASN A 69 6.966 2.636 11.189 1.00 0.00 H new ATOM 0 HB2 ASN A 69 8.834 0.824 9.630 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.227 1.927 10.933 1.00 0.00 H new ATOM 0 HD21 ASN A 69 9.008 -0.477 13.418 1.00 0.00 H new ATOM 0 HD22 ASN A 69 9.661 1.038 12.784 1.00 0.00 H new ATOM 1024 N ARG A 70 7.453 1.984 7.961 1.00 0.00 N ATOM 1025 CA ARG A 70 7.573 2.583 6.643 1.00 0.00 C ATOM 1026 C ARG A 70 6.390 3.516 6.374 1.00 0.00 C ATOM 1027 O ARG A 70 6.547 4.554 5.734 1.00 0.00 O ATOM 1028 CB ARG A 70 7.624 1.510 5.553 1.00 0.00 C ATOM 1029 CG ARG A 70 8.878 0.644 5.695 1.00 0.00 C ATOM 1030 CD ARG A 70 10.119 1.391 5.202 1.00 0.00 C ATOM 1031 NE ARG A 70 11.316 0.532 5.343 1.00 0.00 N ATOM 1032 CZ ARG A 70 12.481 0.759 4.722 1.00 0.00 C ATOM 1033 NH1 ARG A 70 12.614 1.820 3.914 1.00 0.00 N ATOM 1034 NH2 ARG A 70 13.514 -0.073 4.909 1.00 0.00 N ATOM 0 H ARG A 70 7.533 0.967 7.976 1.00 0.00 H new ATOM 0 HA ARG A 70 8.502 3.152 6.621 1.00 0.00 H new ATOM 0 HB2 ARG A 70 6.735 0.882 5.614 1.00 0.00 H new ATOM 0 HB3 ARG A 70 7.614 1.983 4.571 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.011 0.359 6.739 1.00 0.00 H new ATOM 0 HG3 ARG A 70 8.754 -0.278 5.126 1.00 0.00 H new ATOM 0 HD2 ARG A 70 9.989 1.680 4.159 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.251 2.310 5.773 1.00 0.00 H new ATOM 0 HE ARG A 70 11.250 -0.284 5.951 1.00 0.00 H new ATOM 0 HH11 ARG A 70 11.828 2.455 3.772 1.00 0.00 H new ATOM 0 HH12 ARG A 70 13.501 1.993 3.441 1.00 0.00 H new ATOM 0 HH21 ARG A 70 13.414 -0.880 5.525 1.00 0.00 H new ATOM 0 HH22 ARG A 70 14.401 0.101 4.436 1.00 0.00 H new ATOM 1048 N ALA A 71 5.233 3.112 6.877 1.00 0.00 N ATOM 1049 CA ALA A 71 4.025 3.899 6.700 1.00 0.00 C ATOM 1050 C ALA A 71 4.192 5.248 7.402 1.00 0.00 C ATOM 1051 O ALA A 71 4.033 6.299 6.782 1.00 0.00 O ATOM 1052 CB ALA A 71 2.822 3.114 7.225 1.00 0.00 C ATOM 0 H ALA A 71 5.107 2.250 7.407 1.00 0.00 H new ATOM 0 HA ALA A 71 3.849 4.097 5.643 1.00 0.00 H new ATOM 0 HB1 ALA A 71 1.916 3.705 7.092 1.00 0.00 H new ATOM 0 HB2 ALA A 71 2.729 2.178 6.674 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.962 2.898 8.284 1.00 0.00 H new ATOM 1058 N ILE A 72 4.510 5.175 8.686 1.00 0.00 N ATOM 1059 CA ILE A 72 4.701 6.378 9.480 1.00 0.00 C ATOM 1060 C ILE A 72 5.610 7.346 8.720 1.00 0.00 C ATOM 1061 O ILE A 72 5.486 8.561 8.864 1.00 0.00 O ATOM 1062 CB ILE A 72 5.213 6.022 10.877 1.00 0.00 C ATOM 1063 CG1 ILE A 72 4.117 5.351 11.708 1.00 0.00 C ATOM 1064 CG2 ILE A 72 5.791 7.253 11.579 1.00 0.00 C ATOM 1065 CD1 ILE A 72 4.668 4.143 12.468 1.00 0.00 C ATOM 0 H ILE A 72 4.640 4.302 9.197 1.00 0.00 H new ATOM 0 HA ILE A 72 3.750 6.888 9.635 1.00 0.00 H new ATOM 0 HB ILE A 72 6.024 5.301 10.770 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.699 6.069 12.413 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.303 5.035 11.056 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.148 6.973 12.570 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.620 7.650 10.994 1.00 0.00 H new ATOM 0 HG23 ILE A 72 5.017 8.015 11.674 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.869 3.684 13.051 1.00 0.00 H new ATOM 0 HD12 ILE A 72 5.063 3.416 11.758 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.465 4.467 13.137 1.00 0.00 H new ATOM 1077 N ASN A 73 6.502 6.771 7.927 1.00 0.00 N ATOM 1078 CA ASN A 73 7.432 7.568 7.145 1.00 0.00 C ATOM 1079 C ASN A 73 6.654 8.368 6.097 1.00 0.00 C ATOM 1080 O ASN A 73 6.969 9.529 5.838 1.00 0.00 O ATOM 1081 CB ASN A 73 8.437 6.679 6.410 1.00 0.00 C ATOM 1082 CG ASN A 73 9.872 7.036 6.800 1.00 0.00 C ATOM 1083 OD1 ASN A 73 10.509 7.892 6.209 1.00 0.00 O ATOM 1084 ND2 ASN A 73 10.345 6.334 7.826 1.00 0.00 N ATOM 0 H ASN A 73 6.601 5.763 7.809 1.00 0.00 H new ATOM 0 HA ASN A 73 7.967 8.229 7.827 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.242 5.633 6.645 1.00 0.00 H new ATOM 0 HB3 ASN A 73 8.310 6.793 5.333 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.294 6.498 8.162 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.759 5.631 8.277 1.00 0.00 H new ATOM 1091 N VAL A 74 5.654 7.715 5.523 1.00 0.00 N ATOM 1092 CA VAL A 74 4.830 8.351 4.510 1.00 0.00 C ATOM 1093 C VAL A 74 3.707 9.137 5.191 1.00 0.00 C ATOM 1094 O VAL A 74 3.502 10.314 4.897 1.00 0.00 O ATOM 1095 CB VAL A 74 4.311 7.303 3.523 1.00 0.00 C ATOM 1096 CG1 VAL A 74 3.477 7.954 2.419 1.00 0.00 C ATOM 1097 CG2 VAL A 74 5.464 6.489 2.932 1.00 0.00 C ATOM 0 H VAL A 74 5.396 6.752 5.740 1.00 0.00 H new ATOM 0 HA VAL A 74 5.419 9.061 3.930 1.00 0.00 H new ATOM 0 HB VAL A 74 3.664 6.619 4.071 1.00 0.00 H new ATOM 0 HG11 VAL A 74 3.121 7.187 1.732 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.624 8.468 2.862 1.00 0.00 H new ATOM 0 HG13 VAL A 74 4.091 8.672 1.875 1.00 0.00 H new ATOM 0 HG21 VAL A 74 5.068 5.751 2.234 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.148 7.155 2.407 1.00 0.00 H new ATOM 0 HG23 VAL A 74 5.998 5.980 3.734 1.00 0.00 H new ATOM 1107 N LEU A 75 3.011 8.455 6.088 1.00 0.00 N ATOM 1108 CA LEU A 75 1.915 9.074 6.813 1.00 0.00 C ATOM 1109 C LEU A 75 2.364 10.439 7.339 1.00 0.00 C ATOM 1110 O LEU A 75 1.793 11.466 6.977 1.00 0.00 O ATOM 1111 CB LEU A 75 1.395 8.135 7.904 1.00 0.00 C ATOM 1112 CG LEU A 75 0.217 7.241 7.514 1.00 0.00 C ATOM 1113 CD1 LEU A 75 0.042 6.097 8.514 1.00 0.00 C ATOM 1114 CD2 LEU A 75 -1.064 8.061 7.351 1.00 0.00 C ATOM 0 H LEU A 75 3.185 7.479 6.329 1.00 0.00 H new ATOM 0 HA LEU A 75 1.070 9.250 6.148 1.00 0.00 H new ATOM 0 HB2 LEU A 75 2.217 7.497 8.229 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.100 8.737 8.763 1.00 0.00 H new ATOM 0 HG LEU A 75 0.436 6.791 6.546 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -0.802 5.477 8.213 1.00 0.00 H new ATOM 0 HD12 LEU A 75 0.948 5.491 8.536 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -0.144 6.507 9.507 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.886 7.401 7.074 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -1.300 8.558 8.292 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.920 8.809 6.571 1.00 0.00 H new ATOM 1126 N LEU A 76 3.383 10.405 8.185 1.00 0.00 N ATOM 1127 CA LEU A 76 3.915 11.626 8.765 1.00 0.00 C ATOM 1128 C LEU A 76 3.958 12.718 7.694 1.00 0.00 C ATOM 1129 O LEU A 76 3.340 13.770 7.849 1.00 0.00 O ATOM 1130 CB LEU A 76 5.269 11.360 9.426 1.00 0.00 C ATOM 1131 CG LEU A 76 5.229 10.611 10.759 1.00 0.00 C ATOM 1132 CD1 LEU A 76 6.615 10.083 11.133 1.00 0.00 C ATOM 1133 CD2 LEU A 76 4.633 11.488 11.863 1.00 0.00 C ATOM 0 H LEU A 76 3.854 9.551 8.483 1.00 0.00 H new ATOM 0 HA LEU A 76 3.263 11.985 9.561 1.00 0.00 H new ATOM 0 HB2 LEU A 76 5.885 10.790 8.730 1.00 0.00 H new ATOM 0 HB3 LEU A 76 5.768 12.316 9.584 1.00 0.00 H new ATOM 0 HG LEU A 76 4.575 9.747 10.645 1.00 0.00 H new ATOM 0 HD11 LEU A 76 6.558 9.555 12.085 1.00 0.00 H new ATOM 0 HD12 LEU A 76 6.965 9.400 10.359 1.00 0.00 H new ATOM 0 HD13 LEU A 76 7.310 10.918 11.222 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.616 10.932 12.800 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.241 12.384 11.984 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.617 11.773 11.592 1.00 0.00 H new ATOM 1145 N GLU A 77 4.693 12.430 6.630 1.00 0.00 N ATOM 1146 CA GLU A 77 4.824 13.374 5.533 1.00 0.00 C ATOM 1147 C GLU A 77 4.065 12.869 4.304 1.00 0.00 C ATOM 1148 O GLU A 77 4.662 12.632 3.255 1.00 0.00 O ATOM 1149 CB GLU A 77 6.296 13.628 5.202 1.00 0.00 C ATOM 1150 CG GLU A 77 6.809 14.883 5.910 1.00 0.00 C ATOM 1151 CD GLU A 77 7.770 15.666 5.013 1.00 0.00 C ATOM 1152 OE1 GLU A 77 7.262 16.465 4.197 1.00 0.00 O ATOM 1153 OE2 GLU A 77 8.992 15.446 5.163 1.00 0.00 O ATOM 0 H GLU A 77 5.204 11.556 6.504 1.00 0.00 H new ATOM 0 HA GLU A 77 4.386 14.323 5.842 1.00 0.00 H new ATOM 0 HB2 GLU A 77 6.894 12.767 5.502 1.00 0.00 H new ATOM 0 HB3 GLU A 77 6.416 13.739 4.124 1.00 0.00 H new ATOM 0 HG2 GLU A 77 5.967 15.517 6.188 1.00 0.00 H new ATOM 0 HG3 GLU A 77 7.315 14.602 6.834 1.00 0.00 H new ATOM 1160 N GLY A 78 2.760 12.719 4.475 1.00 0.00 N ATOM 1161 CA GLY A 78 1.913 12.246 3.394 1.00 0.00 C ATOM 1162 C GLY A 78 0.853 13.288 3.032 1.00 0.00 C ATOM 1163 O GLY A 78 0.566 14.187 3.821 1.00 0.00 O ATOM 0 H GLY A 78 2.268 12.917 5.347 1.00 0.00 H new ATOM 0 HA2 GLY A 78 2.524 12.024 2.519 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.428 11.315 3.688 1.00 0.00 H new ATOM 1167 N ASN A 79 0.301 13.134 1.837 1.00 0.00 N ATOM 1168 CA ASN A 79 -0.721 14.051 1.361 1.00 0.00 C ATOM 1169 C ASN A 79 -0.127 15.456 1.249 1.00 0.00 C ATOM 1170 O ASN A 79 0.547 15.924 2.166 1.00 0.00 O ATOM 1171 CB ASN A 79 -1.902 14.112 2.332 1.00 0.00 C ATOM 1172 CG ASN A 79 -2.570 12.743 2.471 1.00 0.00 C ATOM 1173 OD1 ASN A 79 -2.703 11.990 1.521 1.00 0.00 O ATOM 1174 ND2 ASN A 79 -2.982 12.464 3.705 1.00 0.00 N ATOM 0 H ASN A 79 0.542 12.388 1.184 1.00 0.00 H new ATOM 0 HA ASN A 79 -1.070 13.694 0.392 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -1.557 14.453 3.308 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -2.631 14.842 1.978 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -3.441 11.574 3.901 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -2.839 13.140 4.455 1.00 0.00 H new ATOM 1181 N PRO A 80 -0.406 16.107 0.088 1.00 0.00 N ATOM 1182 CA PRO A 80 0.093 17.450 -0.155 1.00 0.00 C ATOM 1183 C PRO A 80 -0.694 18.483 0.654 1.00 0.00 C ATOM 1184 O PRO A 80 -1.243 19.430 0.092 1.00 0.00 O ATOM 1185 CB PRO A 80 -0.033 17.650 -1.657 1.00 0.00 C ATOM 1186 CG PRO A 80 -1.022 16.600 -2.136 1.00 0.00 C ATOM 1187 CD PRO A 80 -1.201 15.585 -1.019 1.00 0.00 C ATOM 0 HA PRO A 80 1.127 17.579 0.166 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -0.387 18.654 -1.889 1.00 0.00 H new ATOM 0 HB3 PRO A 80 0.932 17.531 -2.149 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -1.976 17.062 -2.389 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -0.654 16.113 -3.039 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -2.250 15.484 -0.740 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -0.856 14.597 -1.323 1.00 0.00 H new ATOM 1195 N ASP A 81 -0.725 18.266 1.960 1.00 0.00 N ATOM 1196 CA ASP A 81 -1.436 19.166 2.852 1.00 0.00 C ATOM 1197 C ASP A 81 -2.824 19.455 2.278 1.00 0.00 C ATOM 1198 O ASP A 81 -3.032 20.481 1.632 1.00 0.00 O ATOM 1199 CB ASP A 81 -0.697 20.498 2.994 1.00 0.00 C ATOM 1200 CG ASP A 81 0.073 20.674 4.305 1.00 0.00 C ATOM 1201 OD1 ASP A 81 0.646 19.664 4.766 1.00 0.00 O ATOM 1202 OD2 ASP A 81 0.070 21.815 4.815 1.00 0.00 O ATOM 0 H ASP A 81 -0.269 17.480 2.423 1.00 0.00 H new ATOM 0 HA ASP A 81 -1.507 18.687 3.828 1.00 0.00 H new ATOM 0 HB2 ASP A 81 0.002 20.599 2.163 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -1.420 21.309 2.903 1.00 0.00 H new ATOM 1207 N THR A 82 -3.739 18.531 2.534 1.00 0.00 N ATOM 1208 CA THR A 82 -5.102 18.673 2.051 1.00 0.00 C ATOM 1209 C THR A 82 -5.923 19.530 3.016 1.00 0.00 C ATOM 1210 O THR A 82 -5.508 19.767 4.149 1.00 0.00 O ATOM 1211 CB THR A 82 -5.678 17.272 1.841 1.00 0.00 C ATOM 1212 OG1 THR A 82 -5.790 16.742 3.159 1.00 0.00 O ATOM 1213 CG2 THR A 82 -4.693 16.332 1.144 1.00 0.00 C ATOM 0 H THR A 82 -3.563 17.681 3.070 1.00 0.00 H new ATOM 0 HA THR A 82 -5.131 19.197 1.096 1.00 0.00 H new ATOM 0 HB THR A 82 -6.593 17.340 1.252 1.00 0.00 H new ATOM 0 HG1 THR A 82 -6.158 15.835 3.117 1.00 0.00 H new ATOM 0 HG21 THR A 82 -5.152 15.351 1.020 1.00 0.00 H new ATOM 0 HG22 THR A 82 -4.433 16.738 0.166 1.00 0.00 H new ATOM 0 HG23 THR A 82 -3.791 16.236 1.749 1.00 0.00 H new ATOM 1221 N HIS A 83 -7.075 19.972 2.532 1.00 0.00 N ATOM 1222 CA HIS A 83 -7.958 20.797 3.337 1.00 0.00 C ATOM 1223 C HIS A 83 -7.154 21.923 3.991 1.00 0.00 C ATOM 1224 O HIS A 83 -7.033 21.974 5.214 1.00 0.00 O ATOM 1225 CB HIS A 83 -8.721 19.945 4.354 1.00 0.00 C ATOM 1226 CG HIS A 83 -7.842 19.023 5.165 1.00 0.00 C ATOM 1227 ND1 HIS A 83 -7.024 19.474 6.186 1.00 0.00 N ATOM 1228 CD2 HIS A 83 -7.663 17.673 5.095 1.00 0.00 C ATOM 1229 CE1 HIS A 83 -6.385 18.433 6.700 1.00 0.00 C ATOM 1230 NE2 HIS A 83 -6.782 17.318 6.022 1.00 0.00 N ATOM 0 H HIS A 83 -7.417 19.774 1.592 1.00 0.00 H new ATOM 0 HA HIS A 83 -8.712 21.259 2.699 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -9.262 20.605 5.033 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -9.466 19.349 3.827 1.00 0.00 H new ATOM 0 HD1 HIS A 83 -6.929 20.443 6.491 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -8.155 17.006 4.403 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -5.675 18.462 7.513 1.00 0.00 H new ATOM 1238 N SER A 84 -6.626 22.797 3.148 1.00 0.00 N ATOM 1239 CA SER A 84 -5.837 23.918 3.628 1.00 0.00 C ATOM 1240 C SER A 84 -6.524 25.236 3.265 1.00 0.00 C ATOM 1241 O SER A 84 -7.509 25.244 2.528 1.00 0.00 O ATOM 1242 CB SER A 84 -4.420 23.882 3.052 1.00 0.00 C ATOM 1243 OG SER A 84 -3.429 24.055 4.061 1.00 0.00 O ATOM 0 H SER A 84 -6.729 22.752 2.134 1.00 0.00 H new ATOM 0 HA SER A 84 -5.761 23.842 4.713 1.00 0.00 H new ATOM 0 HB2 SER A 84 -4.259 22.931 2.545 1.00 0.00 H new ATOM 0 HB3 SER A 84 -4.314 24.665 2.301 1.00 0.00 H new ATOM 0 HG SER A 84 -2.538 24.024 3.653 1.00 0.00 H new ATOM 1249 N TRP A 85 -5.978 26.318 3.799 1.00 0.00 N ATOM 1250 CA TRP A 85 -6.526 27.639 3.540 1.00 0.00 C ATOM 1251 C TRP A 85 -5.555 28.674 4.110 1.00 0.00 C ATOM 1252 O TRP A 85 -5.688 29.088 5.261 1.00 0.00 O ATOM 1253 CB TRP A 85 -7.940 27.767 4.110 1.00 0.00 C ATOM 1254 CG TRP A 85 -9.042 27.764 3.049 1.00 0.00 C ATOM 1255 CD1 TRP A 85 -10.019 26.863 2.877 1.00 0.00 C ATOM 1256 CD2 TRP A 85 -9.241 28.749 2.014 1.00 0.00 C ATOM 1257 NE1 TRP A 85 -10.830 27.195 1.811 1.00 0.00 N ATOM 1258 CE2 TRP A 85 -10.342 28.378 1.269 1.00 0.00 C ATOM 1259 CE3 TRP A 85 -8.515 29.916 1.716 1.00 0.00 C ATOM 1260 CZ2 TRP A 85 -10.816 29.118 0.179 1.00 0.00 C ATOM 1261 CZ3 TRP A 85 -9.001 30.645 0.624 1.00 0.00 C ATOM 1262 CH2 TRP A 85 -10.108 30.284 -0.136 1.00 0.00 C ATOM 0 H TRP A 85 -5.161 26.307 4.410 1.00 0.00 H new ATOM 0 HA TRP A 85 -6.628 27.811 2.469 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -8.116 26.945 4.804 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -8.006 28.690 4.685 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -10.155 25.988 3.495 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -11.639 26.669 1.481 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -7.651 30.225 2.285 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -11.681 28.806 -0.388 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -8.480 31.551 0.353 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -10.420 30.901 -0.966 1.00 0.00 H new ATOM 1273 N GLU A 86 -4.599 29.063 3.279 1.00 0.00 N ATOM 1274 CA GLU A 86 -3.606 30.043 3.686 1.00 0.00 C ATOM 1275 C GLU A 86 -3.148 30.866 2.481 1.00 0.00 C ATOM 1276 O GLU A 86 -2.768 30.309 1.452 1.00 0.00 O ATOM 1277 CB GLU A 86 -2.418 29.366 4.372 1.00 0.00 C ATOM 1278 CG GLU A 86 -2.545 29.446 5.894 1.00 0.00 C ATOM 1279 CD GLU A 86 -1.328 30.140 6.510 1.00 0.00 C ATOM 1280 OE1 GLU A 86 -1.122 31.327 6.177 1.00 0.00 O ATOM 1281 OE2 GLU A 86 -0.630 29.467 7.300 1.00 0.00 O ATOM 0 H GLU A 86 -4.491 28.717 2.326 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.064 30.718 4.409 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.361 28.322 4.063 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -1.491 29.843 4.055 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.451 29.991 6.159 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -2.644 28.442 6.308 1.00 0.00 H new ATOM 1288 N MET A 87 -3.198 32.180 2.648 1.00 0.00 N ATOM 1289 CA MET A 87 -2.792 33.086 1.587 1.00 0.00 C ATOM 1290 C MET A 87 -3.316 32.610 0.230 1.00 0.00 C ATOM 1291 O MET A 87 -2.623 31.894 -0.490 1.00 0.00 O ATOM 1292 CB MET A 87 -1.265 33.170 1.544 1.00 0.00 C ATOM 1293 CG MET A 87 -0.807 34.433 0.811 1.00 0.00 C ATOM 1294 SD MET A 87 0.440 34.018 -0.397 1.00 0.00 S ATOM 1295 CE MET A 87 0.206 35.357 -1.555 1.00 0.00 C ATOM 0 H MET A 87 -3.514 32.639 3.503 1.00 0.00 H new ATOM 0 HA MET A 87 -3.213 34.070 1.793 1.00 0.00 H new ATOM 0 HB2 MET A 87 -0.868 33.170 2.559 1.00 0.00 H new ATOM 0 HB3 MET A 87 -0.862 32.289 1.044 1.00 0.00 H new ATOM 0 HG2 MET A 87 -1.657 34.907 0.320 1.00 0.00 H new ATOM 0 HG3 MET A 87 -0.408 35.154 1.525 1.00 0.00 H new ATOM 0 HE1 MET A 87 0.911 35.252 -2.380 1.00 0.00 H new ATOM 0 HE2 MET A 87 -0.813 35.329 -1.942 1.00 0.00 H new ATOM 0 HE3 MET A 87 0.377 36.308 -1.051 1.00 0.00 H new ATOM 1305 N VAL A 88 -4.536 33.027 -0.076 1.00 0.00 N ATOM 1306 CA VAL A 88 -5.160 32.653 -1.334 1.00 0.00 C ATOM 1307 C VAL A 88 -4.874 31.178 -1.621 1.00 0.00 C ATOM 1308 O VAL A 88 -4.293 30.844 -2.653 1.00 0.00 O ATOM 1309 CB VAL A 88 -4.685 33.583 -2.452 1.00 0.00 C ATOM 1310 CG1 VAL A 88 -3.159 33.564 -2.569 1.00 0.00 C ATOM 1311 CG2 VAL A 88 -5.342 33.219 -3.784 1.00 0.00 C ATOM 0 H VAL A 88 -5.109 33.620 0.525 1.00 0.00 H new ATOM 0 HA VAL A 88 -6.242 32.769 -1.272 1.00 0.00 H new ATOM 0 HB VAL A 88 -4.989 34.598 -2.196 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -2.847 34.233 -3.371 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -2.718 33.894 -1.629 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -2.824 32.551 -2.791 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.987 33.895 -4.562 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -5.083 32.194 -4.049 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -6.424 33.308 -3.692 1.00 0.00 H new ATOM 1321 N GLY A 89 -5.295 30.334 -0.691 1.00 0.00 N ATOM 1322 CA GLY A 89 -5.091 28.902 -0.831 1.00 0.00 C ATOM 1323 C GLY A 89 -6.077 28.304 -1.837 1.00 0.00 C ATOM 1324 O GLY A 89 -5.841 28.347 -3.043 1.00 0.00 O ATOM 0 H GLY A 89 -5.777 30.614 0.163 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.070 28.707 -1.157 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.215 28.417 0.137 1.00 0.00 H new ATOM 1328 N LYS A 90 -7.160 27.760 -1.302 1.00 0.00 N ATOM 1329 CA LYS A 90 -8.183 27.154 -2.138 1.00 0.00 C ATOM 1330 C LYS A 90 -7.614 25.900 -2.804 1.00 0.00 C ATOM 1331 O LYS A 90 -6.407 25.664 -2.763 1.00 0.00 O ATOM 1332 CB LYS A 90 -8.741 28.177 -3.129 1.00 0.00 C ATOM 1333 CG LYS A 90 -10.242 27.972 -3.342 1.00 0.00 C ATOM 1334 CD LYS A 90 -10.521 27.338 -4.706 1.00 0.00 C ATOM 1335 CE LYS A 90 -11.660 28.063 -5.426 1.00 0.00 C ATOM 1336 NZ LYS A 90 -11.184 28.636 -6.704 1.00 0.00 N ATOM 0 H LYS A 90 -7.352 27.726 -0.301 1.00 0.00 H new ATOM 0 HA LYS A 90 -9.031 26.837 -1.532 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.557 29.185 -2.758 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -8.219 28.088 -4.082 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -10.641 27.335 -2.553 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -10.757 28.930 -3.270 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.620 27.372 -5.318 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.779 26.287 -4.576 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -12.479 27.369 -5.615 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -12.054 28.856 -4.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -11.959 28.630 -7.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -10.866 29.614 -6.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -10.392 28.068 -7.066 1.00 0.00 H new ATOM 1350 N LYS A 91 -8.509 25.128 -3.403 1.00 0.00 N ATOM 1351 CA LYS A 91 -8.111 23.904 -4.077 1.00 0.00 C ATOM 1352 C LYS A 91 -8.546 23.970 -5.543 1.00 0.00 C ATOM 1353 O LYS A 91 -7.708 23.996 -6.442 1.00 0.00 O ATOM 1354 CB LYS A 91 -8.649 22.682 -3.330 1.00 0.00 C ATOM 1355 CG LYS A 91 -7.653 21.522 -3.390 1.00 0.00 C ATOM 1356 CD LYS A 91 -7.026 21.266 -2.018 1.00 0.00 C ATOM 1357 CE LYS A 91 -5.499 21.275 -2.103 1.00 0.00 C ATOM 1358 NZ LYS A 91 -4.965 22.595 -1.701 1.00 0.00 N ATOM 0 H LYS A 91 -9.509 25.327 -3.435 1.00 0.00 H new ATOM 0 HA LYS A 91 -7.026 23.800 -4.070 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -8.846 22.944 -2.290 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.599 22.374 -3.766 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -8.159 20.621 -3.736 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -6.871 21.747 -4.115 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -7.359 22.029 -1.314 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -7.367 20.305 -1.632 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -5.088 20.498 -1.458 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -5.184 21.043 -3.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -3.927 22.584 -1.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -5.343 23.329 -2.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -5.250 22.801 -0.722 1.00 0.00 H new ATOM 1372 N LYS A 92 -9.857 23.994 -5.737 1.00 0.00 N ATOM 1373 CA LYS A 92 -10.413 24.056 -7.078 1.00 0.00 C ATOM 1374 C LYS A 92 -10.265 22.690 -7.750 1.00 0.00 C ATOM 1375 O LYS A 92 -11.259 22.025 -8.041 1.00 0.00 O ATOM 1376 CB LYS A 92 -9.780 25.202 -7.869 1.00 0.00 C ATOM 1377 CG LYS A 92 -10.576 25.496 -9.142 1.00 0.00 C ATOM 1378 CD LYS A 92 -11.763 26.416 -8.846 1.00 0.00 C ATOM 1379 CE LYS A 92 -12.803 26.345 -9.966 1.00 0.00 C ATOM 1380 NZ LYS A 92 -13.927 27.268 -9.688 1.00 0.00 N ATOM 0 H LYS A 92 -10.549 23.972 -4.988 1.00 0.00 H new ATOM 0 HA LYS A 92 -11.479 24.279 -7.038 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -9.737 26.097 -7.248 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -8.753 24.945 -8.129 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -9.926 25.962 -9.882 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -10.934 24.562 -9.575 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -12.222 26.130 -7.900 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -11.413 27.442 -8.734 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -12.339 26.603 -10.918 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -13.176 25.325 -10.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -14.624 27.208 -10.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -14.379 27.004 -8.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -13.568 28.242 -9.621 1.00 0.00 H new ATOM 1394 N GLY A 93 -9.016 22.310 -7.979 1.00 0.00 N ATOM 1395 CA GLY A 93 -8.725 21.035 -8.612 1.00 0.00 C ATOM 1396 C GLY A 93 -7.305 21.017 -9.181 1.00 0.00 C ATOM 1397 O GLY A 93 -6.954 21.855 -10.011 1.00 0.00 O ATOM 0 H GLY A 93 -8.194 22.863 -7.737 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -8.840 20.230 -7.886 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -9.443 20.849 -9.411 1.00 0.00 H new ATOM 1401 N VAL A 94 -6.526 20.053 -8.713 1.00 0.00 N ATOM 1402 CA VAL A 94 -5.152 19.915 -9.165 1.00 0.00 C ATOM 1403 C VAL A 94 -5.141 19.315 -10.572 1.00 0.00 C ATOM 1404 O VAL A 94 -6.100 18.661 -10.979 1.00 0.00 O ATOM 1405 CB VAL A 94 -4.350 19.091 -8.156 1.00 0.00 C ATOM 1406 CG1 VAL A 94 -4.817 17.634 -8.144 1.00 0.00 C ATOM 1407 CG2 VAL A 94 -2.850 19.183 -8.442 1.00 0.00 C ATOM 0 H VAL A 94 -6.820 19.360 -8.025 1.00 0.00 H new ATOM 0 HA VAL A 94 -4.669 20.890 -9.224 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.528 19.509 -7.165 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -4.231 17.070 -7.418 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -5.871 17.592 -7.870 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -4.682 17.201 -9.135 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -2.303 18.588 -7.710 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -2.647 18.803 -9.443 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -2.530 20.223 -8.376 1.00 0.00 H new ATOM 1417 N SER A 95 -4.045 19.557 -11.275 1.00 0.00 N ATOM 1418 CA SER A 95 -3.896 19.048 -12.628 1.00 0.00 C ATOM 1419 C SER A 95 -2.419 18.785 -12.929 1.00 0.00 C ATOM 1420 O SER A 95 -1.540 19.365 -12.293 1.00 0.00 O ATOM 1421 CB SER A 95 -4.480 20.025 -13.651 1.00 0.00 C ATOM 1422 OG SER A 95 -4.950 19.357 -14.819 1.00 0.00 O ATOM 0 H SER A 95 -3.251 20.099 -10.933 1.00 0.00 H new ATOM 0 HA SER A 95 -4.448 18.111 -12.704 1.00 0.00 H new ATOM 0 HB2 SER A 95 -5.300 20.579 -13.195 1.00 0.00 H new ATOM 0 HB3 SER A 95 -3.720 20.754 -13.931 1.00 0.00 H new ATOM 0 HG SER A 95 -5.317 20.014 -15.447 1.00 0.00 H new ATOM 1428 N GLY A 96 -2.192 17.911 -13.898 1.00 0.00 N ATOM 1429 CA GLY A 96 -0.837 17.564 -14.291 1.00 0.00 C ATOM 1430 C GLY A 96 -0.799 17.041 -15.728 1.00 0.00 C ATOM 1431 O GLY A 96 -1.688 17.339 -16.525 1.00 0.00 O ATOM 0 H GLY A 96 -2.924 17.432 -14.423 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -0.193 18.439 -14.202 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -0.441 16.807 -13.614 1.00 0.00 H new ATOM 1435 N GLN A 97 0.239 16.270 -16.016 1.00 0.00 N ATOM 1436 CA GLN A 97 0.404 15.703 -17.344 1.00 0.00 C ATOM 1437 C GLN A 97 0.542 14.182 -17.258 1.00 0.00 C ATOM 1438 O GLN A 97 1.241 13.666 -16.387 1.00 0.00 O ATOM 1439 CB GLN A 97 1.607 16.322 -18.059 1.00 0.00 C ATOM 1440 CG GLN A 97 1.437 16.252 -19.578 1.00 0.00 C ATOM 1441 CD GLN A 97 2.767 15.932 -20.264 1.00 0.00 C ATOM 1442 OE1 GLN A 97 3.559 15.130 -19.797 1.00 0.00 O ATOM 1443 NE2 GLN A 97 2.966 16.601 -21.396 1.00 0.00 N ATOM 0 H GLN A 97 0.974 16.025 -15.353 1.00 0.00 H new ATOM 0 HA GLN A 97 -0.485 15.936 -17.930 1.00 0.00 H new ATOM 0 HB2 GLN A 97 1.723 17.361 -17.750 1.00 0.00 H new ATOM 0 HB3 GLN A 97 2.517 15.799 -17.767 1.00 0.00 H new ATOM 0 HG2 GLN A 97 0.701 15.489 -19.830 1.00 0.00 H new ATOM 0 HG3 GLN A 97 1.052 17.202 -19.949 1.00 0.00 H new ATOM 0 HE21 GLN A 97 2.261 17.258 -21.731 1.00 0.00 H new ATOM 0 HE22 GLN A 97 3.823 16.457 -21.930 1.00 0.00 H new ATOM 1452 N LYS A 98 -0.137 13.505 -18.173 1.00 0.00 N ATOM 1453 CA LYS A 98 -0.099 12.053 -18.211 1.00 0.00 C ATOM 1454 C LYS A 98 -0.818 11.496 -16.981 1.00 0.00 C ATOM 1455 O LYS A 98 -0.868 12.148 -15.938 1.00 0.00 O ATOM 1456 CB LYS A 98 1.341 11.558 -18.358 1.00 0.00 C ATOM 1457 CG LYS A 98 1.465 10.570 -19.520 1.00 0.00 C ATOM 1458 CD LYS A 98 2.700 9.681 -19.354 1.00 0.00 C ATOM 1459 CE LYS A 98 3.939 10.346 -19.956 1.00 0.00 C ATOM 1460 NZ LYS A 98 4.359 9.640 -21.187 1.00 0.00 N ATOM 0 H LYS A 98 -0.717 13.935 -18.894 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.630 11.681 -19.087 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.006 12.406 -18.524 1.00 0.00 H new ATOM 0 HB3 LYS A 98 1.661 11.079 -17.433 1.00 0.00 H new ATOM 0 HG2 LYS A 98 0.570 9.950 -19.572 1.00 0.00 H new ATOM 0 HG3 LYS A 98 1.529 11.116 -20.461 1.00 0.00 H new ATOM 0 HD2 LYS A 98 2.868 9.480 -18.296 1.00 0.00 H new ATOM 0 HD3 LYS A 98 2.528 8.719 -19.837 1.00 0.00 H new ATOM 0 HE2 LYS A 98 3.724 11.390 -20.184 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.752 10.339 -19.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.201 10.104 -21.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 4.583 8.650 -20.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 3.588 9.669 -21.884 1.00 0.00 H new ATOM 1474 N SER A 99 -1.357 10.297 -17.143 1.00 0.00 N ATOM 1475 CA SER A 99 -2.071 9.645 -16.058 1.00 0.00 C ATOM 1476 C SER A 99 -1.980 8.125 -16.211 1.00 0.00 C ATOM 1477 O SER A 99 -1.802 7.618 -17.317 1.00 0.00 O ATOM 1478 CB SER A 99 -3.535 10.087 -16.018 1.00 0.00 C ATOM 1479 OG SER A 99 -3.930 10.508 -14.715 1.00 0.00 O ATOM 0 H SER A 99 -1.314 9.760 -18.009 1.00 0.00 H new ATOM 0 HA SER A 99 -1.605 9.938 -15.117 1.00 0.00 H new ATOM 0 HB2 SER A 99 -3.687 10.903 -16.724 1.00 0.00 H new ATOM 0 HB3 SER A 99 -4.171 9.263 -16.341 1.00 0.00 H new ATOM 0 HG SER A 99 -4.870 10.784 -14.731 1.00 0.00 H new ATOM 1485 N GLY A 100 -2.107 7.441 -15.083 1.00 0.00 N ATOM 1486 CA GLY A 100 -2.041 5.989 -15.078 1.00 0.00 C ATOM 1487 C GLY A 100 -3.189 5.385 -15.890 1.00 0.00 C ATOM 1488 O GLY A 100 -4.219 6.027 -16.087 1.00 0.00 O ATOM 0 H GLY A 100 -2.255 7.865 -14.167 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -1.087 5.663 -15.493 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -2.084 5.623 -14.052 1.00 0.00 H new ATOM 1492 N PRO A 101 -2.966 4.125 -16.350 1.00 0.00 N ATOM 1493 CA PRO A 101 -3.970 3.427 -17.136 1.00 0.00 C ATOM 1494 C PRO A 101 -5.117 2.938 -16.250 1.00 0.00 C ATOM 1495 O PRO A 101 -4.994 2.911 -15.027 1.00 0.00 O ATOM 1496 CB PRO A 101 -3.219 2.294 -17.815 1.00 0.00 C ATOM 1497 CG PRO A 101 -1.931 2.116 -17.028 1.00 0.00 C ATOM 1498 CD PRO A 101 -1.758 3.334 -16.135 1.00 0.00 C ATOM 0 HA PRO A 101 -4.448 4.070 -17.875 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -3.809 1.377 -17.811 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -3.010 2.534 -18.857 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -1.972 1.206 -16.429 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -1.082 2.014 -17.704 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -1.654 3.046 -15.089 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -0.863 3.897 -16.402 1.00 0.00 H new ATOM 1506 N SER A 102 -6.208 2.564 -16.903 1.00 0.00 N ATOM 1507 CA SER A 102 -7.377 2.077 -16.190 1.00 0.00 C ATOM 1508 C SER A 102 -8.389 1.497 -17.179 1.00 0.00 C ATOM 1509 O SER A 102 -9.367 2.156 -17.531 1.00 0.00 O ATOM 1510 CB SER A 102 -8.021 3.192 -15.363 1.00 0.00 C ATOM 1511 OG SER A 102 -8.385 2.747 -14.059 1.00 0.00 O ATOM 0 H SER A 102 -6.307 2.588 -17.918 1.00 0.00 H new ATOM 0 HA SER A 102 -7.058 1.292 -15.505 1.00 0.00 H new ATOM 0 HB2 SER A 102 -7.327 4.029 -15.280 1.00 0.00 H new ATOM 0 HB3 SER A 102 -8.906 3.562 -15.880 1.00 0.00 H new ATOM 0 HG SER A 102 -8.791 3.488 -13.562 1.00 0.00 H new ATOM 1517 N SER A 103 -8.120 0.270 -17.601 1.00 0.00 N ATOM 1518 CA SER A 103 -8.996 -0.406 -18.543 1.00 0.00 C ATOM 1519 C SER A 103 -8.566 -1.865 -18.703 1.00 0.00 C ATOM 1520 O SER A 103 -7.421 -2.214 -18.416 1.00 0.00 O ATOM 1521 CB SER A 103 -8.994 0.299 -19.901 1.00 0.00 C ATOM 1522 OG SER A 103 -10.104 -0.089 -20.706 1.00 0.00 O ATOM 0 H SER A 103 -7.308 -0.273 -17.308 1.00 0.00 H new ATOM 0 HA SER A 103 -10.012 -0.374 -18.148 1.00 0.00 H new ATOM 0 HB2 SER A 103 -9.016 1.378 -19.749 1.00 0.00 H new ATOM 0 HB3 SER A 103 -8.067 0.070 -20.427 1.00 0.00 H new ATOM 0 HG SER A 103 -10.067 0.384 -21.563 1.00 0.00 H new ATOM 1528 N GLY A 104 -9.506 -2.679 -19.160 1.00 0.00 N ATOM 1529 CA GLY A 104 -9.238 -4.093 -19.361 1.00 0.00 C ATOM 1530 C GLY A 104 -7.999 -4.298 -20.235 1.00 0.00 C ATOM 1531 O GLY A 104 -6.917 -4.588 -19.727 1.00 0.00 O ATOM 0 H GLY A 104 -10.454 -2.387 -19.397 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -9.092 -4.580 -18.397 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -10.100 -4.567 -19.830 1.00 0.00 H new TER 1535 GLY A 104