USER MOD reduce.3.24.130724 H: found=0, std=0, add=984, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 986 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 110 HIS :FLIP no HE2:sc= -0.273 F(o=-0.79,f=-0.27) USER MOD Set 1.2: A 129 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 38 THR OG1 : rot -86:sc= 1.16 USER MOD Set 2.2: A 52 TYR OH : rot 104:sc= 1.23 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 1 K(o=1,f=-0.04) USER MOD Single : A 30 LYS NZ :NH3+ 161:sc= -0.0921 (180deg=-0.492) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 162:sc= -0.0981 (180deg=-0.568) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.719 USER MOD Single : A 48 GLN :FLIP amide:sc= -0.938 F(o=-1.9!,f=-0.94) USER MOD Single : A 55 GLN : amide:sc= -0.0257 X(o=-0.026,f=-0.43) USER MOD Single : A 57 GLN :FLIP amide:sc=-0.00191 F(o=-1.4,f=-0.0019) USER MOD Single : A 62 THR OG1 : rot 77:sc= 1.22 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -77:sc= 1.27 USER MOD Single : A 75 ASN : amide:sc= -0.0681 K(o=-0.068,f=-1.6) USER MOD Single : A 80 SER OG : rot 180:sc= 0.91 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= -0.0409 USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 89 SER OG : rot 180:sc= 0.0302 USER MOD Single : A 92 LYS NZ :NH3+ 168:sc= 0.717 (180deg=0.458) USER MOD Single : A 95 ASN : amide:sc= -0.56 K(o=-0.56,f=-4.3!) USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.109 USER MOD Single : A 101 THR OG1 : rot 82:sc= 0.935 USER MOD Single : A 103 LYS NZ :NH3+ -173:sc= 0.967 (180deg=0.837) USER MOD Single : A 104 LYS NZ :NH3+ 153:sc= 1.26 (180deg=0.38) USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 114 THR OG1 : rot 79:sc= 0.359 USER MOD Single : A 116 MET CE :methyl -160:sc= -0.491 (180deg=-1.62) USER MOD Single : A 120 ASN : amide:sc= 0.142 K(o=0.14,f=-5!) USER MOD Single : A 124 LYS NZ :NH3+ -175:sc= 0.517 (180deg=0.449) USER MOD Single : A 130 LYS NZ :NH3+ -168:sc= -0.0172 (180deg=-0.135) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= -0.0037 USER MOD Single : A 139 LYS NZ :NH3+ 174:sc= 1.2 (180deg=1.12) USER MOD Single : A 141 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 144 GLN : amide:sc= -0.409 X(o=-0.41,f=-0.37) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 25 -14.329 -42.953 -4.723 1.00 0.00 N ATOM 2 CA GLY A 25 -13.632 -42.146 -3.722 1.00 0.00 C ATOM 3 C GLY A 25 -14.243 -42.319 -2.366 1.00 0.00 C ATOM 4 O GLY A 25 -15.154 -43.128 -2.191 1.00 0.00 O ATOM 0 HA2 GLY A 25 -12.580 -42.431 -3.689 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -13.668 -41.095 -4.009 1.00 0.00 H new ATOM 10 N ALA A 26 -13.759 -41.579 -1.407 1.00 0.00 N ATOM 11 CA ALA A 26 -14.277 -41.634 -0.065 1.00 0.00 C ATOM 12 C ALA A 26 -15.364 -40.594 0.080 1.00 0.00 C ATOM 13 O ALA A 26 -15.460 -39.674 -0.750 1.00 0.00 O ATOM 14 CB ALA A 26 -13.165 -41.389 0.948 1.00 0.00 C ATOM 0 H ALA A 26 -12.992 -40.918 -1.533 1.00 0.00 H new ATOM 0 HA ALA A 26 -14.690 -42.624 0.127 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -13.575 -41.434 1.957 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -12.395 -42.152 0.835 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -12.728 -40.405 0.778 1.00 0.00 H new ATOM 20 N MET A 27 -16.189 -40.731 1.089 1.00 0.00 N ATOM 21 CA MET A 27 -17.248 -39.776 1.318 1.00 0.00 C ATOM 22 C MET A 27 -16.680 -38.462 1.826 1.00 0.00 C ATOM 23 O MET A 27 -15.793 -38.439 2.708 1.00 0.00 O ATOM 24 CB MET A 27 -18.344 -40.312 2.253 1.00 0.00 C ATOM 25 CG MET A 27 -17.868 -40.703 3.640 1.00 0.00 C ATOM 26 SD MET A 27 -19.207 -41.278 4.697 1.00 0.00 S ATOM 27 CE MET A 27 -18.277 -41.710 6.169 1.00 0.00 C ATOM 0 H MET A 27 -16.149 -41.494 1.765 1.00 0.00 H new ATOM 0 HA MET A 27 -17.731 -39.598 0.357 1.00 0.00 H new ATOM 0 HB2 MET A 27 -19.120 -39.553 2.352 1.00 0.00 H new ATOM 0 HB3 MET A 27 -18.807 -41.181 1.785 1.00 0.00 H new ATOM 0 HG2 MET A 27 -17.116 -41.487 3.554 1.00 0.00 H new ATOM 0 HG3 MET A 27 -17.383 -39.846 4.108 1.00 0.00 H new ATOM 0 HE1 MET A 27 -18.958 -42.087 6.932 1.00 0.00 H new ATOM 0 HE2 MET A 27 -17.545 -42.479 5.924 1.00 0.00 H new ATOM 0 HE3 MET A 27 -17.763 -40.826 6.547 1.00 0.00 H new ATOM 37 N GLU A 28 -17.176 -37.393 1.270 1.00 0.00 N ATOM 38 CA GLU A 28 -16.704 -36.062 1.576 1.00 0.00 C ATOM 39 C GLU A 28 -17.513 -35.461 2.711 1.00 0.00 C ATOM 40 O GLU A 28 -18.608 -35.949 3.038 1.00 0.00 O ATOM 41 CB GLU A 28 -16.823 -35.175 0.339 1.00 0.00 C ATOM 42 CG GLU A 28 -18.260 -34.974 -0.117 1.00 0.00 C ATOM 43 CD GLU A 28 -18.359 -34.180 -1.372 1.00 0.00 C ATOM 44 OE1 GLU A 28 -18.333 -32.935 -1.309 1.00 0.00 O ATOM 45 OE2 GLU A 28 -18.492 -34.791 -2.450 1.00 0.00 O ATOM 0 H GLU A 28 -17.929 -37.416 0.582 1.00 0.00 H new ATOM 0 HA GLU A 28 -15.660 -36.124 1.881 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -16.377 -34.204 0.552 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -16.249 -35.618 -0.475 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -18.728 -35.947 -0.269 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -18.820 -34.471 0.671 1.00 0.00 H new ATOM 52 N GLN A 29 -16.997 -34.422 3.292 1.00 0.00 N ATOM 53 CA GLN A 29 -17.643 -33.728 4.371 1.00 0.00 C ATOM 54 C GLN A 29 -17.696 -32.253 4.032 1.00 0.00 C ATOM 55 O GLN A 29 -16.806 -31.741 3.339 1.00 0.00 O ATOM 56 CB GLN A 29 -16.864 -33.951 5.665 1.00 0.00 C ATOM 57 CG GLN A 29 -16.830 -35.401 6.129 1.00 0.00 C ATOM 58 CD GLN A 29 -18.178 -35.900 6.618 1.00 0.00 C ATOM 59 OE1 GLN A 29 -18.494 -35.813 7.805 1.00 0.00 O ATOM 60 NE2 GLN A 29 -18.997 -36.391 5.729 1.00 0.00 N ATOM 0 H GLN A 29 -16.097 -34.022 3.026 1.00 0.00 H new ATOM 0 HA GLN A 29 -18.656 -34.106 4.511 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -15.841 -33.602 5.525 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -17.305 -33.339 6.452 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -16.492 -36.032 5.307 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -16.099 -35.503 6.931 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -18.712 -36.452 4.752 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -19.923 -36.713 6.011 1.00 0.00 H new ATOM 69 N LYS A 30 -18.714 -31.573 4.486 1.00 0.00 N ATOM 70 CA LYS A 30 -18.844 -30.175 4.186 1.00 0.00 C ATOM 71 C LYS A 30 -17.964 -29.401 5.139 1.00 0.00 C ATOM 72 O LYS A 30 -18.188 -29.395 6.347 1.00 0.00 O ATOM 73 CB LYS A 30 -20.297 -29.763 4.274 1.00 0.00 C ATOM 74 CG LYS A 30 -21.164 -30.581 3.343 1.00 0.00 C ATOM 75 CD LYS A 30 -22.598 -30.151 3.395 1.00 0.00 C ATOM 76 CE LYS A 30 -23.467 -31.067 2.546 1.00 0.00 C ATOM 77 NZ LYS A 30 -23.441 -32.471 3.032 1.00 0.00 N ATOM 0 H LYS A 30 -19.461 -31.962 5.062 1.00 0.00 H new ATOM 0 HA LYS A 30 -18.518 -29.961 3.168 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -20.648 -29.883 5.299 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -20.392 -28.706 4.026 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -20.793 -30.485 2.323 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -21.091 -31.635 3.611 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -22.949 -30.163 4.427 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -22.688 -29.125 3.040 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -24.494 -30.701 2.553 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -23.124 -31.035 1.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -24.262 -32.985 2.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -22.566 -32.933 2.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -23.476 -32.479 4.071 1.00 0.00 H new ATOM 91 N THR A 31 -16.993 -28.747 4.586 1.00 0.00 N ATOM 92 CA THR A 31 -15.933 -28.145 5.339 1.00 0.00 C ATOM 93 C THR A 31 -16.137 -26.632 5.506 1.00 0.00 C ATOM 94 O THR A 31 -16.419 -25.920 4.534 1.00 0.00 O ATOM 95 CB THR A 31 -14.625 -28.427 4.586 1.00 0.00 C ATOM 96 OG1 THR A 31 -14.575 -29.841 4.276 1.00 0.00 O ATOM 97 CG2 THR A 31 -13.414 -28.064 5.424 1.00 0.00 C ATOM 0 H THR A 31 -16.911 -28.612 3.578 1.00 0.00 H new ATOM 0 HA THR A 31 -15.910 -28.567 6.344 1.00 0.00 H new ATOM 0 HB THR A 31 -14.604 -27.822 3.680 1.00 0.00 H new ATOM 0 HG1 THR A 31 -13.746 -30.041 3.793 1.00 0.00 H new ATOM 0 HG21 THR A 31 -12.505 -28.276 4.861 1.00 0.00 H new ATOM 0 HG22 THR A 31 -13.448 -27.003 5.672 1.00 0.00 H new ATOM 0 HG23 THR A 31 -13.418 -28.652 6.342 1.00 0.00 H new ATOM 105 N VAL A 32 -16.015 -26.155 6.733 1.00 0.00 N ATOM 106 CA VAL A 32 -16.137 -24.737 7.005 1.00 0.00 C ATOM 107 C VAL A 32 -14.756 -24.077 6.970 1.00 0.00 C ATOM 108 O VAL A 32 -13.783 -24.576 7.574 1.00 0.00 O ATOM 109 CB VAL A 32 -16.898 -24.446 8.342 1.00 0.00 C ATOM 110 CG1 VAL A 32 -16.220 -25.099 9.542 1.00 0.00 C ATOM 111 CG2 VAL A 32 -17.083 -22.948 8.570 1.00 0.00 C ATOM 0 H VAL A 32 -15.832 -26.730 7.555 1.00 0.00 H new ATOM 0 HA VAL A 32 -16.748 -24.295 6.218 1.00 0.00 H new ATOM 0 HB VAL A 32 -17.886 -24.895 8.242 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -16.783 -24.870 10.447 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -16.188 -26.179 9.398 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -15.204 -24.715 9.639 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -17.615 -22.786 9.507 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -16.108 -22.464 8.618 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -17.659 -22.523 7.748 1.00 0.00 H new ATOM 121 N ILE A 33 -14.661 -23.004 6.230 1.00 0.00 N ATOM 122 CA ILE A 33 -13.410 -22.304 6.046 1.00 0.00 C ATOM 123 C ILE A 33 -13.483 -20.962 6.764 1.00 0.00 C ATOM 124 O ILE A 33 -14.335 -20.138 6.447 1.00 0.00 O ATOM 125 CB ILE A 33 -13.113 -22.054 4.538 1.00 0.00 C ATOM 126 CG1 ILE A 33 -13.231 -23.360 3.716 1.00 0.00 C ATOM 127 CG2 ILE A 33 -11.734 -21.423 4.354 1.00 0.00 C ATOM 128 CD1 ILE A 33 -12.352 -24.497 4.199 1.00 0.00 C ATOM 0 H ILE A 33 -15.449 -22.587 5.735 1.00 0.00 H new ATOM 0 HA ILE A 33 -12.610 -22.921 6.456 1.00 0.00 H new ATOM 0 HB ILE A 33 -13.863 -21.357 4.164 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -14.270 -23.690 3.732 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -12.982 -23.143 2.677 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -11.548 -21.258 3.293 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -11.697 -20.470 4.882 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -10.972 -22.091 4.756 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -12.503 -25.369 3.563 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -11.306 -24.192 4.156 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -12.614 -24.748 5.227 1.00 0.00 H new ATOM 140 N PRO A 34 -12.641 -20.740 7.753 1.00 0.00 N ATOM 141 CA PRO A 34 -12.628 -19.495 8.491 1.00 0.00 C ATOM 142 C PRO A 34 -11.809 -18.408 7.792 1.00 0.00 C ATOM 143 O PRO A 34 -10.750 -18.684 7.188 1.00 0.00 O ATOM 144 CB PRO A 34 -11.975 -19.890 9.801 1.00 0.00 C ATOM 145 CG PRO A 34 -11.043 -20.999 9.448 1.00 0.00 C ATOM 146 CD PRO A 34 -11.642 -21.697 8.261 1.00 0.00 C ATOM 0 HA PRO A 34 -13.625 -19.068 8.598 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -11.440 -19.050 10.244 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -12.717 -20.215 10.530 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -10.052 -20.612 9.211 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -10.925 -21.688 10.284 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.887 -21.924 7.508 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -12.103 -22.643 8.545 1.00 0.00 H new ATOM 154 N GLY A 35 -12.291 -17.193 7.852 1.00 0.00 N ATOM 155 CA GLY A 35 -11.569 -16.087 7.277 1.00 0.00 C ATOM 156 C GLY A 35 -11.978 -15.800 5.852 1.00 0.00 C ATOM 157 O GLY A 35 -11.224 -15.169 5.097 1.00 0.00 O ATOM 0 H GLY A 35 -13.177 -16.945 8.292 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -11.733 -15.197 7.884 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -10.501 -16.301 7.308 1.00 0.00 H new ATOM 161 N MET A 36 -13.152 -16.266 5.475 1.00 0.00 N ATOM 162 CA MET A 36 -13.663 -16.054 4.130 1.00 0.00 C ATOM 163 C MET A 36 -14.184 -14.626 3.975 1.00 0.00 C ATOM 164 O MET A 36 -14.646 -14.023 4.960 1.00 0.00 O ATOM 165 CB MET A 36 -14.769 -17.063 3.787 1.00 0.00 C ATOM 166 CG MET A 36 -14.287 -18.499 3.690 1.00 0.00 C ATOM 167 SD MET A 36 -15.606 -19.673 3.292 1.00 0.00 S ATOM 168 CE MET A 36 -16.120 -19.084 1.680 1.00 0.00 C ATOM 0 H MET A 36 -13.775 -16.797 6.083 1.00 0.00 H new ATOM 0 HA MET A 36 -12.839 -16.207 3.433 1.00 0.00 H new ATOM 0 HB2 MET A 36 -15.549 -17.003 4.546 1.00 0.00 H new ATOM 0 HB3 MET A 36 -15.224 -16.779 2.838 1.00 0.00 H new ATOM 0 HG2 MET A 36 -13.511 -18.563 2.928 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.829 -18.786 4.637 1.00 0.00 H new ATOM 0 HE1 MET A 36 -16.683 -19.866 1.169 1.00 0.00 H new ATOM 0 HE2 MET A 36 -16.750 -18.202 1.799 1.00 0.00 H new ATOM 0 HE3 MET A 36 -15.241 -18.825 1.090 1.00 0.00 H new ATOM 178 N PRO A 37 -14.082 -14.042 2.764 1.00 0.00 N ATOM 179 CA PRO A 37 -14.575 -12.689 2.494 1.00 0.00 C ATOM 180 C PRO A 37 -16.090 -12.568 2.682 1.00 0.00 C ATOM 181 O PRO A 37 -16.844 -13.538 2.473 1.00 0.00 O ATOM 182 CB PRO A 37 -14.204 -12.444 1.027 1.00 0.00 C ATOM 183 CG PRO A 37 -13.122 -13.419 0.748 1.00 0.00 C ATOM 184 CD PRO A 37 -13.451 -14.627 1.564 1.00 0.00 C ATOM 0 HA PRO A 37 -14.140 -11.964 3.182 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -15.059 -12.602 0.370 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -13.866 -11.420 0.869 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -13.078 -13.663 -0.313 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -12.148 -13.013 1.023 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -14.128 -15.300 1.037 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -12.560 -15.202 1.814 1.00 0.00 H new ATOM 192 N THR A 38 -16.513 -11.405 3.081 1.00 0.00 N ATOM 193 CA THR A 38 -17.902 -11.120 3.312 1.00 0.00 C ATOM 194 C THR A 38 -18.667 -10.886 1.994 1.00 0.00 C ATOM 195 O THR A 38 -18.144 -10.276 1.050 1.00 0.00 O ATOM 196 CB THR A 38 -18.070 -9.962 4.351 1.00 0.00 C ATOM 197 OG1 THR A 38 -19.428 -9.519 4.456 1.00 0.00 O ATOM 198 CG2 THR A 38 -17.156 -8.792 4.051 1.00 0.00 C ATOM 0 H THR A 38 -15.894 -10.614 3.258 1.00 0.00 H new ATOM 0 HA THR A 38 -18.363 -12.001 3.759 1.00 0.00 H new ATOM 0 HB THR A 38 -17.780 -10.380 5.315 1.00 0.00 H new ATOM 0 HG1 THR A 38 -19.604 -8.838 3.773 1.00 0.00 H new ATOM 0 HG21 THR A 38 -17.307 -8.012 4.797 1.00 0.00 H new ATOM 0 HG22 THR A 38 -16.118 -9.125 4.078 1.00 0.00 H new ATOM 0 HG23 THR A 38 -17.384 -8.396 3.061 1.00 0.00 H new ATOM 206 N VAL A 39 -19.870 -11.444 1.926 1.00 0.00 N ATOM 207 CA VAL A 39 -20.718 -11.349 0.749 1.00 0.00 C ATOM 208 C VAL A 39 -21.405 -9.973 0.673 1.00 0.00 C ATOM 209 O VAL A 39 -21.908 -9.443 1.684 1.00 0.00 O ATOM 210 CB VAL A 39 -21.764 -12.517 0.692 1.00 0.00 C ATOM 211 CG1 VAL A 39 -22.699 -12.505 1.889 1.00 0.00 C ATOM 212 CG2 VAL A 39 -22.558 -12.501 -0.608 1.00 0.00 C ATOM 0 H VAL A 39 -20.284 -11.977 2.691 1.00 0.00 H new ATOM 0 HA VAL A 39 -20.077 -11.450 -0.127 1.00 0.00 H new ATOM 0 HB VAL A 39 -21.192 -13.444 0.727 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -23.406 -13.331 1.807 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -22.119 -12.614 2.805 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -23.245 -11.562 1.915 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -23.271 -13.325 -0.609 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -23.095 -11.556 -0.695 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -21.877 -12.610 -1.452 1.00 0.00 H new ATOM 222 N ILE A 40 -21.407 -9.416 -0.520 1.00 0.00 N ATOM 223 CA ILE A 40 -21.932 -8.091 -0.792 1.00 0.00 C ATOM 224 C ILE A 40 -23.459 -8.070 -0.667 1.00 0.00 C ATOM 225 O ILE A 40 -24.154 -8.845 -1.339 1.00 0.00 O ATOM 226 CB ILE A 40 -21.552 -7.649 -2.228 1.00 0.00 C ATOM 227 CG1 ILE A 40 -20.045 -7.820 -2.451 1.00 0.00 C ATOM 228 CG2 ILE A 40 -21.963 -6.190 -2.462 1.00 0.00 C ATOM 229 CD1 ILE A 40 -19.606 -7.616 -3.876 1.00 0.00 C ATOM 0 H ILE A 40 -21.035 -9.882 -1.348 1.00 0.00 H new ATOM 0 HA ILE A 40 -21.499 -7.408 -0.061 1.00 0.00 H new ATOM 0 HB ILE A 40 -22.085 -8.278 -2.941 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -19.512 -7.114 -1.814 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -19.753 -8.821 -2.132 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -21.690 -5.893 -3.475 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -23.041 -6.090 -2.333 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -21.451 -5.548 -1.745 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -18.527 -7.755 -3.948 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -20.108 -8.339 -4.519 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -19.864 -6.606 -4.195 1.00 0.00 H new ATOM 241 N PRO A 41 -23.993 -7.215 0.203 1.00 0.00 N ATOM 242 CA PRO A 41 -25.425 -7.048 0.345 1.00 0.00 C ATOM 243 C PRO A 41 -26.012 -6.150 -0.773 1.00 0.00 C ATOM 244 O PRO A 41 -25.343 -5.223 -1.262 1.00 0.00 O ATOM 245 CB PRO A 41 -25.563 -6.361 1.709 1.00 0.00 C ATOM 246 CG PRO A 41 -24.302 -5.594 1.884 1.00 0.00 C ATOM 247 CD PRO A 41 -23.235 -6.358 1.147 1.00 0.00 C ATOM 0 HA PRO A 41 -25.963 -7.993 0.273 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -26.432 -5.703 1.733 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -25.694 -7.092 2.507 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -24.403 -4.585 1.485 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -24.050 -5.496 2.940 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -22.556 -5.688 0.620 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -22.629 -6.955 1.829 1.00 0.00 H new ATOM 255 N PRO A 42 -27.238 -6.441 -1.225 1.00 0.00 N ATOM 256 CA PRO A 42 -27.930 -5.603 -2.196 1.00 0.00 C ATOM 257 C PRO A 42 -28.324 -4.247 -1.582 1.00 0.00 C ATOM 258 O PRO A 42 -28.304 -4.074 -0.344 1.00 0.00 O ATOM 259 CB PRO A 42 -29.175 -6.419 -2.570 1.00 0.00 C ATOM 260 CG PRO A 42 -29.380 -7.350 -1.436 1.00 0.00 C ATOM 261 CD PRO A 42 -28.025 -7.626 -0.857 1.00 0.00 C ATOM 0 HA PRO A 42 -27.308 -5.366 -3.059 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -30.042 -5.773 -2.712 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -29.025 -6.961 -3.504 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -30.039 -6.910 -0.687 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -29.852 -8.273 -1.773 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -28.071 -7.756 0.224 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -27.592 -8.537 -1.269 1.00 0.00 H new ATOM 269 N GLY A 43 -28.656 -3.300 -2.420 1.00 0.00 N ATOM 270 CA GLY A 43 -29.021 -1.977 -1.948 1.00 0.00 C ATOM 271 C GLY A 43 -27.841 -1.034 -1.982 1.00 0.00 C ATOM 272 O GLY A 43 -27.966 0.163 -1.693 1.00 0.00 O ATOM 0 H GLY A 43 -28.683 -3.414 -3.433 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -29.825 -1.578 -2.566 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -29.405 -2.045 -0.930 1.00 0.00 H new ATOM 276 N LEU A 44 -26.698 -1.576 -2.315 1.00 0.00 N ATOM 277 CA LEU A 44 -25.491 -0.825 -2.420 1.00 0.00 C ATOM 278 C LEU A 44 -25.360 -0.311 -3.816 1.00 0.00 C ATOM 279 O LEU A 44 -26.005 -0.816 -4.728 1.00 0.00 O ATOM 280 CB LEU A 44 -24.272 -1.685 -2.075 1.00 0.00 C ATOM 281 CG LEU A 44 -24.189 -2.220 -0.652 1.00 0.00 C ATOM 282 CD1 LEU A 44 -22.932 -3.044 -0.452 1.00 0.00 C ATOM 283 CD2 LEU A 44 -24.229 -1.087 0.328 1.00 0.00 C ATOM 0 H LEU A 44 -26.587 -2.568 -2.523 1.00 0.00 H new ATOM 0 HA LEU A 44 -25.532 0.003 -1.713 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -24.251 -2.534 -2.759 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -23.375 -1.097 -2.269 1.00 0.00 H new ATOM 0 HG LEU A 44 -25.048 -2.868 -0.481 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -22.898 -3.414 0.573 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -22.936 -3.888 -1.142 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -22.056 -2.424 -0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -24.169 -1.481 1.342 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -23.386 -0.420 0.147 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -25.161 -0.535 0.208 1.00 0.00 H new ATOM 295 N THR A 45 -24.565 0.684 -3.986 1.00 0.00 N ATOM 296 CA THR A 45 -24.298 1.218 -5.277 1.00 0.00 C ATOM 297 C THR A 45 -22.988 0.610 -5.715 1.00 0.00 C ATOM 298 O THR A 45 -22.310 0.020 -4.873 1.00 0.00 O ATOM 299 CB THR A 45 -24.173 2.746 -5.169 1.00 0.00 C ATOM 300 OG1 THR A 45 -23.042 3.089 -4.354 1.00 0.00 O ATOM 301 CG2 THR A 45 -25.400 3.298 -4.499 1.00 0.00 C ATOM 0 H THR A 45 -24.075 1.157 -3.226 1.00 0.00 H new ATOM 0 HA THR A 45 -25.090 0.994 -5.992 1.00 0.00 H new ATOM 0 HB THR A 45 -24.056 3.158 -6.171 1.00 0.00 H new ATOM 0 HG1 THR A 45 -22.968 4.064 -4.291 1.00 0.00 H new ATOM 0 HG21 THR A 45 -25.315 4.382 -4.420 1.00 0.00 H new ATOM 0 HG22 THR A 45 -26.281 3.045 -5.088 1.00 0.00 H new ATOM 0 HG23 THR A 45 -25.494 2.868 -3.502 1.00 0.00 H new ATOM 309 N ARG A 46 -22.598 0.730 -6.977 1.00 0.00 N ATOM 310 CA ARG A 46 -21.328 0.157 -7.380 1.00 0.00 C ATOM 311 C ARG A 46 -20.178 0.832 -6.647 1.00 0.00 C ATOM 312 O ARG A 46 -19.196 0.189 -6.293 1.00 0.00 O ATOM 313 CB ARG A 46 -21.085 0.136 -8.910 1.00 0.00 C ATOM 314 CG ARG A 46 -20.991 1.485 -9.624 1.00 0.00 C ATOM 315 CD ARG A 46 -22.350 2.101 -9.904 1.00 0.00 C ATOM 316 NE ARG A 46 -23.183 1.215 -10.728 1.00 0.00 N ATOM 317 CZ ARG A 46 -24.166 1.603 -11.543 1.00 0.00 C ATOM 318 NH1 ARG A 46 -24.420 2.895 -11.725 1.00 0.00 N ATOM 319 NH2 ARG A 46 -24.857 0.690 -12.198 1.00 0.00 N ATOM 0 H ARG A 46 -23.123 1.202 -7.713 1.00 0.00 H new ATOM 0 HA ARG A 46 -21.375 -0.893 -7.090 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -20.160 -0.410 -9.097 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -21.891 -0.435 -9.372 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -20.404 2.173 -9.015 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -20.455 1.356 -10.565 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -22.858 2.308 -8.962 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -22.220 3.056 -10.412 1.00 0.00 H new ATOM 0 HE ARG A 46 -22.993 0.214 -10.672 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -23.862 3.598 -11.240 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -25.173 3.184 -12.350 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -24.637 -0.299 -12.078 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -25.611 0.973 -12.824 1.00 0.00 H new ATOM 333 N GLU A 47 -20.347 2.111 -6.356 1.00 0.00 N ATOM 334 CA GLU A 47 -19.347 2.866 -5.641 1.00 0.00 C ATOM 335 C GLU A 47 -19.300 2.404 -4.195 1.00 0.00 C ATOM 336 O GLU A 47 -18.229 2.253 -3.626 1.00 0.00 O ATOM 337 CB GLU A 47 -19.626 4.374 -5.674 1.00 0.00 C ATOM 338 CG GLU A 47 -20.055 4.917 -7.021 1.00 0.00 C ATOM 339 CD GLU A 47 -21.554 4.927 -7.165 1.00 0.00 C ATOM 340 OE1 GLU A 47 -22.176 3.862 -7.321 1.00 0.00 O ATOM 341 OE2 GLU A 47 -22.150 6.015 -7.097 1.00 0.00 O ATOM 0 H GLU A 47 -21.177 2.647 -6.609 1.00 0.00 H new ATOM 0 HA GLU A 47 -18.391 2.690 -6.134 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -20.403 4.600 -4.944 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -18.727 4.902 -5.356 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -19.671 5.929 -7.145 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -19.617 4.311 -7.814 1.00 0.00 H new ATOM 348 N GLN A 48 -20.474 2.150 -3.609 1.00 0.00 N ATOM 349 CA GLN A 48 -20.543 1.717 -2.227 1.00 0.00 C ATOM 350 C GLN A 48 -20.041 0.295 -2.107 1.00 0.00 C ATOM 351 O GLN A 48 -19.410 -0.063 -1.118 1.00 0.00 O ATOM 352 CB GLN A 48 -21.953 1.835 -1.655 1.00 0.00 C ATOM 353 CG GLN A 48 -21.983 1.719 -0.151 1.00 0.00 C ATOM 354 CD GLN A 48 -23.276 2.197 0.475 1.00 0.00 C ATOM 355 OE1 GLN A 48 -23.912 3.170 -0.128 1.00 0.00 O flip ATOM 356 NE2 GLN A 48 -23.683 1.707 1.527 1.00 0.00 N flip ATOM 0 H GLN A 48 -21.378 2.238 -4.073 1.00 0.00 H new ATOM 0 HA GLN A 48 -19.904 2.379 -1.642 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -22.381 2.793 -1.950 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -22.582 1.058 -2.088 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -21.819 0.678 0.127 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -21.155 2.294 0.265 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -23.164 0.950 1.971 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -24.540 2.058 1.955 1.00 0.00 H new ATOM 365 N GLU A 49 -20.311 -0.511 -3.126 1.00 0.00 N ATOM 366 CA GLU A 49 -19.785 -1.855 -3.181 1.00 0.00 C ATOM 367 C GLU A 49 -18.298 -1.800 -3.211 1.00 0.00 C ATOM 368 O GLU A 49 -17.645 -2.468 -2.427 1.00 0.00 O ATOM 369 CB GLU A 49 -20.295 -2.628 -4.384 1.00 0.00 C ATOM 370 CG GLU A 49 -21.719 -3.075 -4.252 1.00 0.00 C ATOM 371 CD GLU A 49 -22.265 -3.706 -5.502 1.00 0.00 C ATOM 372 OE1 GLU A 49 -21.485 -4.259 -6.318 1.00 0.00 O ATOM 373 OE2 GLU A 49 -23.496 -3.684 -5.694 1.00 0.00 O ATOM 0 H GLU A 49 -20.892 -0.251 -3.923 1.00 0.00 H new ATOM 0 HA GLU A 49 -20.129 -2.382 -2.291 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -20.200 -2.004 -5.273 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -19.662 -3.502 -4.539 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -21.793 -3.789 -3.431 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -22.338 -2.218 -3.986 1.00 0.00 H new ATOM 380 N ARG A 50 -17.758 -0.964 -4.085 1.00 0.00 N ATOM 381 CA ARG A 50 -16.331 -0.796 -4.153 1.00 0.00 C ATOM 382 C ARG A 50 -15.792 -0.287 -2.858 1.00 0.00 C ATOM 383 O ARG A 50 -14.824 -0.773 -2.408 1.00 0.00 O ATOM 384 CB ARG A 50 -15.881 0.096 -5.300 1.00 0.00 C ATOM 385 CG ARG A 50 -16.156 -0.460 -6.673 1.00 0.00 C ATOM 386 CD ARG A 50 -15.642 -1.875 -6.810 1.00 0.00 C ATOM 387 NE ARG A 50 -15.781 -2.362 -8.181 1.00 0.00 N ATOM 388 CZ ARG A 50 -15.792 -3.643 -8.555 1.00 0.00 C ATOM 389 NH1 ARG A 50 -15.565 -4.604 -7.664 1.00 0.00 N ATOM 390 NH2 ARG A 50 -15.999 -3.959 -9.825 1.00 0.00 N ATOM 0 H ARG A 50 -18.289 -0.400 -4.748 1.00 0.00 H new ATOM 0 HA ARG A 50 -15.922 -1.787 -4.350 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -16.377 1.062 -5.208 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -14.810 0.277 -5.204 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -17.229 -0.441 -6.866 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -15.685 0.174 -7.425 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -14.594 -1.913 -6.513 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -16.190 -2.530 -6.132 1.00 0.00 H new ATOM 0 HE ARG A 50 -15.878 -1.662 -8.916 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -15.381 -4.363 -6.690 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -15.574 -5.582 -7.955 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -16.150 -3.224 -10.516 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -16.008 -4.938 -10.112 1.00 0.00 H new ATOM 404 N ALA A 51 -16.470 0.655 -2.254 1.00 0.00 N ATOM 405 CA ALA A 51 -16.050 1.217 -0.967 1.00 0.00 C ATOM 406 C ALA A 51 -15.956 0.119 0.104 1.00 0.00 C ATOM 407 O ALA A 51 -14.985 0.040 0.834 1.00 0.00 O ATOM 408 CB ALA A 51 -17.028 2.300 -0.530 1.00 0.00 C ATOM 0 H ALA A 51 -17.327 1.062 -2.627 1.00 0.00 H new ATOM 0 HA ALA A 51 -15.061 1.658 -1.088 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -16.710 2.713 0.427 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -17.051 3.093 -1.278 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -18.024 1.870 -0.426 1.00 0.00 H new ATOM 414 N TYR A 52 -16.944 -0.750 0.122 1.00 0.00 N ATOM 415 CA TYR A 52 -17.010 -1.863 1.029 1.00 0.00 C ATOM 416 C TYR A 52 -15.870 -2.846 0.742 1.00 0.00 C ATOM 417 O TYR A 52 -15.104 -3.189 1.632 1.00 0.00 O ATOM 418 CB TYR A 52 -18.402 -2.479 0.831 1.00 0.00 C ATOM 419 CG TYR A 52 -18.646 -3.885 1.298 1.00 0.00 C ATOM 420 CD1 TYR A 52 -18.979 -4.180 2.606 1.00 0.00 C ATOM 421 CD2 TYR A 52 -18.628 -4.909 0.379 1.00 0.00 C ATOM 422 CE1 TYR A 52 -19.300 -5.473 2.976 1.00 0.00 C ATOM 423 CE2 TYR A 52 -18.922 -6.206 0.743 1.00 0.00 C ATOM 424 CZ TYR A 52 -19.264 -6.475 2.041 1.00 0.00 C ATOM 425 OH TYR A 52 -19.622 -7.740 2.403 1.00 0.00 O ATOM 0 H TYR A 52 -17.741 -0.696 -0.512 1.00 0.00 H new ATOM 0 HA TYR A 52 -16.881 -1.568 2.070 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -19.122 -1.835 1.335 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -18.631 -2.441 -0.234 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -18.989 -3.394 3.346 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -18.378 -4.692 -0.649 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -19.578 -5.692 3.996 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -18.883 -7.001 0.013 1.00 0.00 H new ATOM 0 HH TYR A 52 -20.520 -7.936 2.063 1.00 0.00 H new ATOM 435 N ILE A 53 -15.724 -3.206 -0.518 1.00 0.00 N ATOM 436 CA ILE A 53 -14.692 -4.135 -0.978 1.00 0.00 C ATOM 437 C ILE A 53 -13.295 -3.542 -0.747 1.00 0.00 C ATOM 438 O ILE A 53 -12.402 -4.206 -0.220 1.00 0.00 O ATOM 439 CB ILE A 53 -14.920 -4.463 -2.486 1.00 0.00 C ATOM 440 CG1 ILE A 53 -16.272 -5.177 -2.641 1.00 0.00 C ATOM 441 CG2 ILE A 53 -13.785 -5.309 -3.064 1.00 0.00 C ATOM 442 CD1 ILE A 53 -16.763 -5.318 -4.066 1.00 0.00 C ATOM 0 H ILE A 53 -16.324 -2.861 -1.267 1.00 0.00 H new ATOM 0 HA ILE A 53 -14.759 -5.060 -0.406 1.00 0.00 H new ATOM 0 HB ILE A 53 -14.930 -3.530 -3.050 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -16.193 -6.171 -2.200 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -17.021 -4.632 -2.067 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -13.984 -5.514 -4.116 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -12.844 -4.767 -2.972 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -13.717 -6.249 -2.517 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -17.723 -5.834 -4.071 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -16.880 -4.329 -4.510 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -16.040 -5.892 -4.645 1.00 0.00 H new ATOM 454 N VAL A 54 -13.145 -2.287 -1.102 1.00 0.00 N ATOM 455 CA VAL A 54 -11.913 -1.549 -0.948 1.00 0.00 C ATOM 456 C VAL A 54 -11.509 -1.460 0.517 1.00 0.00 C ATOM 457 O VAL A 54 -10.355 -1.700 0.842 1.00 0.00 O ATOM 458 CB VAL A 54 -11.995 -0.128 -1.621 1.00 0.00 C ATOM 459 CG1 VAL A 54 -10.866 0.767 -1.180 1.00 0.00 C ATOM 460 CG2 VAL A 54 -11.954 -0.259 -3.146 1.00 0.00 C ATOM 0 H VAL A 54 -13.897 -1.737 -1.517 1.00 0.00 H new ATOM 0 HA VAL A 54 -11.131 -2.099 -1.472 1.00 0.00 H new ATOM 0 HB VAL A 54 -12.938 0.321 -1.307 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -10.960 1.738 -1.667 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -10.907 0.898 -0.099 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -9.914 0.313 -1.455 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -12.012 0.731 -3.598 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -11.023 -0.741 -3.445 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -12.798 -0.861 -3.482 1.00 0.00 H new ATOM 470 N GLN A 55 -12.469 -1.184 1.389 1.00 0.00 N ATOM 471 CA GLN A 55 -12.213 -1.096 2.824 1.00 0.00 C ATOM 472 C GLN A 55 -11.687 -2.429 3.355 1.00 0.00 C ATOM 473 O GLN A 55 -10.705 -2.465 4.108 1.00 0.00 O ATOM 474 CB GLN A 55 -13.472 -0.679 3.566 1.00 0.00 C ATOM 475 CG GLN A 55 -13.271 -0.446 5.050 1.00 0.00 C ATOM 476 CD GLN A 55 -14.513 0.084 5.724 1.00 0.00 C ATOM 477 OE1 GLN A 55 -15.642 -0.208 5.319 1.00 0.00 O ATOM 478 NE2 GLN A 55 -14.323 0.876 6.740 1.00 0.00 N ATOM 0 H GLN A 55 -13.440 -1.016 1.127 1.00 0.00 H new ATOM 0 HA GLN A 55 -11.451 -0.336 2.994 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -13.860 0.235 3.116 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -14.232 -1.449 3.430 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -12.975 -1.381 5.525 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -12.453 0.259 5.197 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -13.375 1.094 7.046 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -15.122 1.278 7.230 1.00 0.00 H new ATOM 487 N LEU A 56 -12.309 -3.517 2.911 1.00 0.00 N ATOM 488 CA LEU A 56 -11.901 -4.871 3.289 1.00 0.00 C ATOM 489 C LEU A 56 -10.460 -5.119 2.830 1.00 0.00 C ATOM 490 O LEU A 56 -9.672 -5.781 3.503 1.00 0.00 O ATOM 491 CB LEU A 56 -12.813 -5.908 2.641 1.00 0.00 C ATOM 492 CG LEU A 56 -14.315 -5.734 2.856 1.00 0.00 C ATOM 493 CD1 LEU A 56 -15.068 -6.798 2.107 1.00 0.00 C ATOM 494 CD2 LEU A 56 -14.690 -5.744 4.334 1.00 0.00 C ATOM 0 H LEU A 56 -13.110 -3.488 2.280 1.00 0.00 H new ATOM 0 HA LEU A 56 -11.971 -4.963 4.373 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -12.621 -5.906 1.568 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -12.528 -6.892 3.014 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.595 -4.755 2.466 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -16.138 -6.666 2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.847 -6.719 1.043 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -14.766 -7.781 2.469 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -15.768 -5.617 4.437 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -14.392 -6.694 4.778 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -14.178 -4.928 4.845 1.00 0.00 H new ATOM 506 N GLN A 57 -10.147 -4.627 1.661 1.00 0.00 N ATOM 507 CA GLN A 57 -8.809 -4.712 1.118 1.00 0.00 C ATOM 508 C GLN A 57 -7.827 -3.823 1.898 1.00 0.00 C ATOM 509 O GLN A 57 -6.707 -4.215 2.132 1.00 0.00 O ATOM 510 CB GLN A 57 -8.799 -4.350 -0.354 1.00 0.00 C ATOM 511 CG GLN A 57 -9.652 -5.251 -1.222 1.00 0.00 C ATOM 512 CD GLN A 57 -9.653 -4.832 -2.680 1.00 0.00 C ATOM 513 OE1 GLN A 57 -9.521 -3.547 -2.935 1.00 0.00 O flip ATOM 514 NE2 GLN A 57 -9.784 -5.664 -3.574 1.00 0.00 N flip ATOM 0 H GLN A 57 -10.814 -4.153 1.052 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.479 -5.746 1.222 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -9.146 -3.323 -0.466 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.772 -4.381 -0.717 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -9.288 -6.275 -1.143 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -10.675 -5.247 -0.847 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -9.884 -6.652 -3.341 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -9.793 -5.367 -4.550 1.00 0.00 H new ATOM 523 N ILE A 58 -8.267 -2.625 2.287 1.00 0.00 N ATOM 524 CA ILE A 58 -7.437 -1.679 3.061 1.00 0.00 C ATOM 525 C ILE A 58 -7.025 -2.308 4.377 1.00 0.00 C ATOM 526 O ILE A 58 -5.847 -2.273 4.753 1.00 0.00 O ATOM 527 CB ILE A 58 -8.196 -0.332 3.362 1.00 0.00 C ATOM 528 CG1 ILE A 58 -8.471 0.468 2.081 1.00 0.00 C ATOM 529 CG2 ILE A 58 -7.432 0.527 4.375 1.00 0.00 C ATOM 530 CD1 ILE A 58 -9.380 1.670 2.281 1.00 0.00 C ATOM 0 H ILE A 58 -9.203 -2.277 2.079 1.00 0.00 H new ATOM 0 HA ILE A 58 -6.561 -1.452 2.453 1.00 0.00 H new ATOM 0 HB ILE A 58 -9.157 -0.604 3.799 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -7.522 0.809 1.668 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -8.921 -0.195 1.342 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -7.984 1.449 4.560 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -7.322 -0.024 5.309 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -6.446 0.768 3.978 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -9.524 2.180 1.328 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -10.345 1.337 2.663 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -8.924 2.356 2.995 1.00 0.00 H new ATOM 542 N GLU A 59 -7.979 -2.901 5.051 1.00 0.00 N ATOM 543 CA GLU A 59 -7.722 -3.527 6.322 1.00 0.00 C ATOM 544 C GLU A 59 -6.836 -4.748 6.139 1.00 0.00 C ATOM 545 O GLU A 59 -5.934 -4.991 6.933 1.00 0.00 O ATOM 546 CB GLU A 59 -9.024 -3.865 7.058 1.00 0.00 C ATOM 547 CG GLU A 59 -9.980 -4.734 6.289 1.00 0.00 C ATOM 548 CD GLU A 59 -11.151 -5.162 7.107 1.00 0.00 C ATOM 549 OE1 GLU A 59 -12.042 -4.353 7.333 1.00 0.00 O ATOM 550 OE2 GLU A 59 -11.190 -6.333 7.558 1.00 0.00 O ATOM 0 H GLU A 59 -8.947 -2.963 4.737 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.186 -2.817 6.952 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.775 -4.364 7.995 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.530 -2.935 7.317 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -10.333 -4.192 5.412 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.452 -5.616 5.927 1.00 0.00 H new ATOM 557 N ASP A 60 -7.071 -5.469 5.048 1.00 0.00 N ATOM 558 CA ASP A 60 -6.302 -6.665 4.692 1.00 0.00 C ATOM 559 C ASP A 60 -4.864 -6.262 4.470 1.00 0.00 C ATOM 560 O ASP A 60 -3.930 -6.872 5.000 1.00 0.00 O ATOM 561 CB ASP A 60 -6.803 -7.206 3.367 1.00 0.00 C ATOM 562 CG ASP A 60 -6.508 -8.666 3.146 1.00 0.00 C ATOM 563 OD1 ASP A 60 -5.384 -9.007 2.744 1.00 0.00 O ATOM 564 OD2 ASP A 60 -7.427 -9.496 3.332 1.00 0.00 O ATOM 0 H ASP A 60 -7.806 -5.241 4.378 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.401 -7.406 5.486 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -7.880 -7.051 3.308 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -6.354 -6.629 2.558 1.00 0.00 H new ATOM 569 N LEU A 61 -4.704 -5.181 3.707 1.00 0.00 N ATOM 570 CA LEU A 61 -3.407 -4.664 3.368 1.00 0.00 C ATOM 571 C LEU A 61 -2.684 -4.178 4.565 1.00 0.00 C ATOM 572 O LEU A 61 -1.580 -4.610 4.817 1.00 0.00 O ATOM 573 CB LEU A 61 -3.504 -3.525 2.357 1.00 0.00 C ATOM 574 CG LEU A 61 -3.765 -3.917 0.913 1.00 0.00 C ATOM 575 CD1 LEU A 61 -4.130 -2.699 0.131 1.00 0.00 C ATOM 576 CD2 LEU A 61 -2.521 -4.528 0.303 1.00 0.00 C ATOM 0 H LEU A 61 -5.480 -4.649 3.313 1.00 0.00 H new ATOM 0 HA LEU A 61 -2.853 -5.492 2.925 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.300 -2.853 2.677 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.574 -2.957 2.393 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.577 -4.644 0.887 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.318 -2.976 -0.906 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.028 -2.250 0.555 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.311 -1.981 0.172 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -2.722 -4.805 -0.732 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.707 -3.804 0.334 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -2.238 -5.416 0.868 1.00 0.00 H new ATOM 588 N THR A 62 -3.328 -3.341 5.345 1.00 0.00 N ATOM 589 CA THR A 62 -2.724 -2.732 6.482 1.00 0.00 C ATOM 590 C THR A 62 -2.264 -3.800 7.465 1.00 0.00 C ATOM 591 O THR A 62 -1.172 -3.753 7.964 1.00 0.00 O ATOM 592 CB THR A 62 -3.689 -1.712 7.124 1.00 0.00 C ATOM 593 OG1 THR A 62 -4.090 -0.754 6.125 1.00 0.00 O ATOM 594 CG2 THR A 62 -3.043 -0.977 8.278 1.00 0.00 C ATOM 0 H THR A 62 -4.299 -3.068 5.196 1.00 0.00 H new ATOM 0 HA THR A 62 -1.839 -2.177 6.170 1.00 0.00 H new ATOM 0 HB THR A 62 -4.550 -2.257 7.510 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.760 -1.158 5.534 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.755 -0.269 8.702 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.743 -1.693 9.043 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.165 -0.439 7.921 1.00 0.00 H new ATOM 602 N ARG A 63 -3.069 -4.801 7.623 1.00 0.00 N ATOM 603 CA ARG A 63 -2.753 -5.954 8.449 1.00 0.00 C ATOM 604 C ARG A 63 -1.445 -6.612 7.948 1.00 0.00 C ATOM 605 O ARG A 63 -0.537 -6.887 8.730 1.00 0.00 O ATOM 606 CB ARG A 63 -3.938 -6.921 8.345 1.00 0.00 C ATOM 607 CG ARG A 63 -3.771 -8.296 8.933 1.00 0.00 C ATOM 608 CD ARG A 63 -4.965 -9.161 8.542 1.00 0.00 C ATOM 609 NE ARG A 63 -4.866 -10.536 9.049 1.00 0.00 N ATOM 610 CZ ARG A 63 -5.679 -11.547 8.702 1.00 0.00 C ATOM 611 NH1 ARG A 63 -6.703 -11.338 7.873 1.00 0.00 N ATOM 612 NH2 ARG A 63 -5.474 -12.762 9.200 1.00 0.00 N ATOM 0 H ARG A 63 -3.986 -4.855 7.179 1.00 0.00 H new ATOM 0 HA ARG A 63 -2.596 -5.670 9.489 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -4.797 -6.452 8.826 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -4.186 -7.035 7.290 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.847 -8.748 8.573 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -3.693 -8.233 10.018 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.878 -8.704 8.923 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.049 -9.185 7.456 1.00 0.00 H new ATOM 0 HE ARG A 63 -4.122 -10.739 9.717 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -6.873 -10.405 7.498 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -7.316 -12.111 7.614 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -4.700 -12.925 9.844 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -6.090 -13.531 8.938 1.00 0.00 H new ATOM 626 N LYS A 64 -1.345 -6.766 6.651 1.00 0.00 N ATOM 627 CA LYS A 64 -0.193 -7.339 5.983 1.00 0.00 C ATOM 628 C LYS A 64 1.067 -6.482 6.163 1.00 0.00 C ATOM 629 O LYS A 64 2.102 -7.000 6.576 1.00 0.00 O ATOM 630 CB LYS A 64 -0.559 -7.493 4.516 1.00 0.00 C ATOM 631 CG LYS A 64 0.531 -7.329 3.513 1.00 0.00 C ATOM 632 CD LYS A 64 -0.068 -7.250 2.124 1.00 0.00 C ATOM 633 CE LYS A 64 -0.915 -8.486 1.833 1.00 0.00 C ATOM 634 NZ LYS A 64 -1.428 -8.531 0.459 1.00 0.00 N ATOM 0 H LYS A 64 -2.085 -6.488 6.006 1.00 0.00 H new ATOM 0 HA LYS A 64 0.050 -8.306 6.422 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.994 -8.483 4.380 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.339 -6.767 4.286 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.103 -6.426 3.726 1.00 0.00 H new ATOM 0 HG3 LYS A 64 1.225 -8.167 3.574 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.682 -6.353 2.037 1.00 0.00 H new ATOM 0 HD3 LYS A 64 0.727 -7.165 1.383 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -0.318 -9.379 2.019 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -1.755 -8.514 2.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.994 -9.394 0.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -2.023 -7.697 0.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -0.631 -8.535 -0.209 1.00 0.00 H new ATOM 648 N LEU A 65 0.971 -5.169 5.922 1.00 0.00 N ATOM 649 CA LEU A 65 2.145 -4.298 6.074 1.00 0.00 C ATOM 650 C LEU A 65 2.521 -4.102 7.529 1.00 0.00 C ATOM 651 O LEU A 65 3.640 -3.736 7.850 1.00 0.00 O ATOM 652 CB LEU A 65 2.032 -2.931 5.320 1.00 0.00 C ATOM 653 CG LEU A 65 0.664 -2.225 5.302 1.00 0.00 C ATOM 654 CD1 LEU A 65 0.807 -0.753 5.541 1.00 0.00 C ATOM 655 CD2 LEU A 65 0.029 -2.382 3.952 1.00 0.00 C ATOM 0 H LEU A 65 0.117 -4.695 5.628 1.00 0.00 H new ATOM 0 HA LEU A 65 2.958 -4.833 5.584 1.00 0.00 H new ATOM 0 HB2 LEU A 65 2.755 -2.246 5.762 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.337 -3.094 4.286 1.00 0.00 H new ATOM 0 HG LEU A 65 0.059 -2.677 6.088 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -0.177 -0.284 5.522 1.00 0.00 H new ATOM 0 HD12 LEU A 65 1.270 -0.586 6.513 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.432 -0.317 4.762 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.939 -1.881 3.945 1.00 0.00 H new ATOM 0 HD22 LEU A 65 0.673 -1.938 3.193 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.110 -3.441 3.736 1.00 0.00 H new ATOM 667 N ARG A 66 1.568 -4.306 8.396 1.00 0.00 N ATOM 668 CA ARG A 66 1.787 -4.175 9.825 1.00 0.00 C ATOM 669 C ARG A 66 2.424 -5.405 10.446 1.00 0.00 C ATOM 670 O ARG A 66 3.324 -5.290 11.277 1.00 0.00 O ATOM 671 CB ARG A 66 0.502 -3.758 10.552 1.00 0.00 C ATOM 672 CG ARG A 66 0.240 -2.245 10.536 1.00 0.00 C ATOM 673 CD ARG A 66 0.394 -1.628 9.141 1.00 0.00 C ATOM 674 NE ARG A 66 0.590 -0.180 9.175 1.00 0.00 N ATOM 675 CZ ARG A 66 1.597 0.500 8.575 1.00 0.00 C ATOM 676 NH1 ARG A 66 2.644 -0.135 8.035 1.00 0.00 N ATOM 677 NH2 ARG A 66 1.559 1.818 8.558 1.00 0.00 N ATOM 0 H ARG A 66 0.616 -4.568 8.141 1.00 0.00 H new ATOM 0 HA ARG A 66 2.513 -3.372 9.955 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.345 -4.268 10.093 1.00 0.00 H new ATOM 0 HB3 ARG A 66 0.556 -4.096 11.587 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -0.768 -2.052 10.904 1.00 0.00 H new ATOM 0 HG3 ARG A 66 0.930 -1.755 11.223 1.00 0.00 H new ATOM 0 HD2 ARG A 66 1.241 -2.092 8.636 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -0.493 -1.855 8.549 1.00 0.00 H new ATOM 0 HE ARG A 66 -0.093 0.368 9.698 1.00 0.00 H new ATOM 0 HH11 ARG A 66 2.696 -1.153 8.070 1.00 0.00 H new ATOM 0 HH12 ARG A 66 3.390 0.399 7.589 1.00 0.00 H new ATOM 0 HH21 ARG A 66 0.779 2.311 8.993 1.00 0.00 H new ATOM 0 HH22 ARG A 66 2.309 2.344 8.110 1.00 0.00 H new ATOM 691 N THR A 67 1.981 -6.570 10.042 1.00 0.00 N ATOM 692 CA THR A 67 2.484 -7.803 10.624 1.00 0.00 C ATOM 693 C THR A 67 3.661 -8.382 9.833 1.00 0.00 C ATOM 694 O THR A 67 4.410 -9.225 10.339 1.00 0.00 O ATOM 695 CB THR A 67 1.359 -8.859 10.751 1.00 0.00 C ATOM 696 OG1 THR A 67 0.731 -9.054 9.471 1.00 0.00 O ATOM 697 CG2 THR A 67 0.311 -8.410 11.759 1.00 0.00 C ATOM 0 H THR A 67 1.276 -6.697 9.316 1.00 0.00 H new ATOM 0 HA THR A 67 2.847 -7.550 11.620 1.00 0.00 H new ATOM 0 HB THR A 67 1.802 -9.794 11.094 1.00 0.00 H new ATOM 0 HG1 THR A 67 0.121 -8.309 9.289 1.00 0.00 H new ATOM 0 HG21 THR A 67 -0.470 -9.166 11.833 1.00 0.00 H new ATOM 0 HG22 THR A 67 0.779 -8.275 12.734 1.00 0.00 H new ATOM 0 HG23 THR A 67 -0.127 -7.467 11.433 1.00 0.00 H new ATOM 705 N GLY A 68 3.828 -7.922 8.602 1.00 0.00 N ATOM 706 CA GLY A 68 4.878 -8.444 7.754 1.00 0.00 C ATOM 707 C GLY A 68 4.433 -9.733 7.106 1.00 0.00 C ATOM 708 O GLY A 68 5.253 -10.565 6.701 1.00 0.00 O ATOM 0 H GLY A 68 3.254 -7.195 8.175 1.00 0.00 H new ATOM 0 HA2 GLY A 68 5.134 -7.713 6.987 1.00 0.00 H new ATOM 0 HA3 GLY A 68 5.779 -8.617 8.343 1.00 0.00 H new ATOM 712 N ASP A 69 3.126 -9.883 7.006 1.00 0.00 N ATOM 713 CA ASP A 69 2.498 -11.079 6.474 1.00 0.00 C ATOM 714 C ASP A 69 2.296 -10.953 4.985 1.00 0.00 C ATOM 715 O ASP A 69 1.290 -10.439 4.516 1.00 0.00 O ATOM 716 CB ASP A 69 1.175 -11.336 7.197 1.00 0.00 C ATOM 717 CG ASP A 69 0.416 -12.572 6.744 1.00 0.00 C ATOM 718 OD1 ASP A 69 1.040 -13.636 6.546 1.00 0.00 O ATOM 719 OD2 ASP A 69 -0.832 -12.533 6.715 1.00 0.00 O ATOM 0 H ASP A 69 2.460 -9.167 7.296 1.00 0.00 H new ATOM 0 HA ASP A 69 3.153 -11.933 6.645 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.375 -11.424 8.265 1.00 0.00 H new ATOM 0 HB3 ASP A 69 0.532 -10.466 7.063 1.00 0.00 H new ATOM 724 N LEU A 70 3.321 -11.315 4.264 1.00 0.00 N ATOM 725 CA LEU A 70 3.311 -11.286 2.810 1.00 0.00 C ATOM 726 C LEU A 70 3.132 -12.687 2.264 1.00 0.00 C ATOM 727 O LEU A 70 2.845 -12.887 1.084 1.00 0.00 O ATOM 728 CB LEU A 70 4.633 -10.688 2.282 1.00 0.00 C ATOM 729 CG LEU A 70 4.763 -9.154 2.208 1.00 0.00 C ATOM 730 CD1 LEU A 70 3.887 -8.628 1.105 1.00 0.00 C ATOM 731 CD2 LEU A 70 4.396 -8.474 3.529 1.00 0.00 C ATOM 0 H LEU A 70 4.200 -11.643 4.664 1.00 0.00 H new ATOM 0 HA LEU A 70 2.480 -10.664 2.478 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.441 -11.060 2.912 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.801 -11.085 1.281 1.00 0.00 H new ATOM 0 HG LEU A 70 5.808 -8.922 2.003 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.979 -7.543 1.053 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.196 -9.064 0.155 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.849 -8.895 1.306 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.504 -7.394 3.425 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.364 -8.712 3.787 1.00 0.00 H new ATOM 0 HD23 LEU A 70 5.058 -8.830 4.318 1.00 0.00 H new ATOM 743 N GLY A 71 3.319 -13.649 3.138 1.00 0.00 N ATOM 744 CA GLY A 71 3.246 -15.039 2.761 1.00 0.00 C ATOM 745 C GLY A 71 4.551 -15.496 2.151 1.00 0.00 C ATOM 746 O GLY A 71 4.669 -16.618 1.674 1.00 0.00 O ATOM 0 H GLY A 71 3.525 -13.490 4.124 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.015 -15.647 3.636 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.435 -15.186 2.048 1.00 0.00 H new ATOM 750 N ILE A 72 5.527 -14.619 2.184 1.00 0.00 N ATOM 751 CA ILE A 72 6.818 -14.862 1.595 1.00 0.00 C ATOM 752 C ILE A 72 7.810 -15.236 2.690 1.00 0.00 C ATOM 753 O ILE A 72 8.119 -14.407 3.561 1.00 0.00 O ATOM 754 CB ILE A 72 7.338 -13.597 0.835 1.00 0.00 C ATOM 755 CG1 ILE A 72 6.354 -13.167 -0.277 1.00 0.00 C ATOM 756 CG2 ILE A 72 8.738 -13.830 0.252 1.00 0.00 C ATOM 757 CD1 ILE A 72 6.128 -14.206 -1.362 1.00 0.00 C ATOM 0 H ILE A 72 5.443 -13.704 2.628 1.00 0.00 H new ATOM 0 HA ILE A 72 6.722 -15.678 0.879 1.00 0.00 H new ATOM 0 HB ILE A 72 7.405 -12.788 1.563 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.395 -12.924 0.180 1.00 0.00 H new ATOM 0 HG13 ILE A 72 6.727 -12.253 -0.740 1.00 0.00 H new ATOM 0 HG21 ILE A 72 9.069 -12.932 -0.269 1.00 0.00 H new ATOM 0 HG22 ILE A 72 9.434 -14.059 1.059 1.00 0.00 H new ATOM 0 HG23 ILE A 72 8.706 -14.665 -0.448 1.00 0.00 H new ATOM 0 HD11 ILE A 72 5.424 -13.817 -2.098 1.00 0.00 H new ATOM 0 HD12 ILE A 72 7.075 -14.433 -1.851 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.722 -15.114 -0.917 1.00 0.00 H new ATOM 769 N PRO A 73 8.286 -16.484 2.695 1.00 0.00 N ATOM 770 CA PRO A 73 9.281 -16.926 3.653 1.00 0.00 C ATOM 771 C PRO A 73 10.633 -16.267 3.369 1.00 0.00 C ATOM 772 O PRO A 73 10.999 -16.076 2.196 1.00 0.00 O ATOM 773 CB PRO A 73 9.396 -18.440 3.424 1.00 0.00 C ATOM 774 CG PRO A 73 8.292 -18.807 2.486 1.00 0.00 C ATOM 775 CD PRO A 73 7.899 -17.555 1.765 1.00 0.00 C ATOM 0 HA PRO A 73 9.002 -16.669 4.675 1.00 0.00 H new ATOM 0 HB2 PRO A 73 10.367 -18.697 3.001 1.00 0.00 H new ATOM 0 HB3 PRO A 73 9.304 -18.984 4.364 1.00 0.00 H new ATOM 0 HG2 PRO A 73 8.622 -19.571 1.782 1.00 0.00 H new ATOM 0 HG3 PRO A 73 7.444 -19.221 3.031 1.00 0.00 H new ATOM 0 HD2 PRO A 73 8.417 -17.463 0.810 1.00 0.00 H new ATOM 0 HD3 PRO A 73 6.830 -17.534 1.552 1.00 0.00 H new ATOM 783 N PRO A 74 11.381 -15.885 4.417 1.00 0.00 N ATOM 784 CA PRO A 74 12.711 -15.290 4.256 1.00 0.00 C ATOM 785 C PRO A 74 13.657 -16.251 3.542 1.00 0.00 C ATOM 786 O PRO A 74 13.595 -17.469 3.749 1.00 0.00 O ATOM 787 CB PRO A 74 13.184 -15.061 5.698 1.00 0.00 C ATOM 788 CG PRO A 74 11.938 -15.047 6.510 1.00 0.00 C ATOM 789 CD PRO A 74 10.991 -15.986 5.832 1.00 0.00 C ATOM 0 HA PRO A 74 12.690 -14.379 3.658 1.00 0.00 H new ATOM 0 HB2 PRO A 74 13.859 -15.853 6.023 1.00 0.00 H new ATOM 0 HB3 PRO A 74 13.727 -14.121 5.791 1.00 0.00 H new ATOM 0 HG2 PRO A 74 12.136 -15.365 7.534 1.00 0.00 H new ATOM 0 HG3 PRO A 74 11.519 -14.042 6.564 1.00 0.00 H new ATOM 0 HD2 PRO A 74 11.094 -17.004 6.207 1.00 0.00 H new ATOM 0 HD3 PRO A 74 9.952 -15.693 5.986 1.00 0.00 H new ATOM 797 N ASN A 75 14.506 -15.721 2.714 1.00 0.00 N ATOM 798 CA ASN A 75 15.433 -16.529 1.959 1.00 0.00 C ATOM 799 C ASN A 75 16.744 -16.525 2.727 1.00 0.00 C ATOM 800 O ASN A 75 17.042 -15.536 3.351 1.00 0.00 O ATOM 801 CB ASN A 75 15.607 -15.922 0.548 1.00 0.00 C ATOM 802 CG ASN A 75 16.079 -16.921 -0.508 1.00 0.00 C ATOM 803 OD1 ASN A 75 15.273 -17.592 -1.144 1.00 0.00 O ATOM 804 ND2 ASN A 75 17.351 -17.000 -0.748 1.00 0.00 N ATOM 0 H ASN A 75 14.581 -14.719 2.539 1.00 0.00 H new ATOM 0 HA ASN A 75 15.077 -17.552 1.835 1.00 0.00 H new ATOM 0 HB2 ASN A 75 14.657 -15.494 0.229 1.00 0.00 H new ATOM 0 HB3 ASN A 75 16.323 -15.102 0.603 1.00 0.00 H new ATOM 0 HD21 ASN A 75 17.695 -17.627 -1.475 1.00 0.00 H new ATOM 0 HD22 ASN A 75 18.008 -16.435 -0.210 1.00 0.00 H new ATOM 811 N PRO A 76 17.487 -17.658 2.742 1.00 0.00 N ATOM 812 CA PRO A 76 18.775 -17.869 3.460 1.00 0.00 C ATOM 813 C PRO A 76 19.695 -16.633 3.725 1.00 0.00 C ATOM 814 O PRO A 76 20.380 -16.588 4.740 1.00 0.00 O ATOM 815 CB PRO A 76 19.495 -18.851 2.549 1.00 0.00 C ATOM 816 CG PRO A 76 18.434 -19.505 1.706 1.00 0.00 C ATOM 817 CD PRO A 76 17.111 -18.902 2.084 1.00 0.00 C ATOM 0 HA PRO A 76 18.555 -18.189 4.478 1.00 0.00 H new ATOM 0 HB2 PRO A 76 20.225 -18.337 1.924 1.00 0.00 H new ATOM 0 HB3 PRO A 76 20.040 -19.593 3.132 1.00 0.00 H new ATOM 0 HG2 PRO A 76 18.637 -19.348 0.647 1.00 0.00 H new ATOM 0 HG3 PRO A 76 18.424 -20.582 1.872 1.00 0.00 H new ATOM 0 HD2 PRO A 76 16.486 -18.722 1.209 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.547 -19.555 2.750 1.00 0.00 H new ATOM 825 N GLU A 77 19.723 -15.669 2.831 1.00 0.00 N ATOM 826 CA GLU A 77 20.575 -14.488 2.982 1.00 0.00 C ATOM 827 C GLU A 77 19.975 -13.467 3.941 1.00 0.00 C ATOM 828 O GLU A 77 20.593 -12.440 4.234 1.00 0.00 O ATOM 829 CB GLU A 77 20.788 -13.782 1.647 1.00 0.00 C ATOM 830 CG GLU A 77 21.409 -14.612 0.535 1.00 0.00 C ATOM 831 CD GLU A 77 20.396 -15.480 -0.172 1.00 0.00 C ATOM 832 OE1 GLU A 77 19.196 -15.437 0.186 1.00 0.00 O ATOM 833 OE2 GLU A 77 20.763 -16.175 -1.139 1.00 0.00 O ATOM 0 H GLU A 77 19.162 -15.672 1.979 1.00 0.00 H new ATOM 0 HA GLU A 77 21.521 -14.857 3.377 1.00 0.00 H new ATOM 0 HB2 GLU A 77 19.824 -13.411 1.299 1.00 0.00 H new ATOM 0 HB3 GLU A 77 21.421 -12.912 1.818 1.00 0.00 H new ATOM 0 HG2 GLU A 77 21.882 -13.948 -0.189 1.00 0.00 H new ATOM 0 HG3 GLU A 77 22.195 -15.242 0.952 1.00 0.00 H new ATOM 840 N ASP A 78 18.802 -13.739 4.434 1.00 0.00 N ATOM 841 CA ASP A 78 18.061 -12.787 5.257 1.00 0.00 C ATOM 842 C ASP A 78 18.656 -12.674 6.645 1.00 0.00 C ATOM 843 O ASP A 78 18.422 -11.709 7.366 1.00 0.00 O ATOM 844 CB ASP A 78 16.604 -13.186 5.307 1.00 0.00 C ATOM 845 CG ASP A 78 15.675 -12.061 5.703 1.00 0.00 C ATOM 846 OD1 ASP A 78 15.218 -11.335 4.797 1.00 0.00 O ATOM 847 OD2 ASP A 78 15.352 -11.889 6.898 1.00 0.00 O ATOM 0 H ASP A 78 18.319 -14.625 4.285 1.00 0.00 H new ATOM 0 HA ASP A 78 18.136 -11.799 4.803 1.00 0.00 H new ATOM 0 HB2 ASP A 78 16.307 -13.562 4.328 1.00 0.00 H new ATOM 0 HB3 ASP A 78 16.486 -14.007 6.014 1.00 0.00 H new ATOM 852 N ARG A 79 19.444 -13.653 7.006 1.00 0.00 N ATOM 853 CA ARG A 79 20.178 -13.624 8.260 1.00 0.00 C ATOM 854 C ARG A 79 21.425 -12.726 8.165 1.00 0.00 C ATOM 855 O ARG A 79 22.123 -12.510 9.146 1.00 0.00 O ATOM 856 CB ARG A 79 20.507 -15.059 8.759 1.00 0.00 C ATOM 857 CG ARG A 79 21.073 -16.020 7.705 1.00 0.00 C ATOM 858 CD ARG A 79 22.445 -15.623 7.189 1.00 0.00 C ATOM 859 NE ARG A 79 23.500 -15.809 8.202 1.00 0.00 N ATOM 860 CZ ARG A 79 24.746 -15.311 8.129 1.00 0.00 C ATOM 861 NH1 ARG A 79 25.062 -14.408 7.211 1.00 0.00 N ATOM 862 NH2 ARG A 79 25.666 -15.697 9.004 1.00 0.00 N ATOM 0 H ARG A 79 19.600 -14.492 6.448 1.00 0.00 H new ATOM 0 HA ARG A 79 19.532 -13.174 9.014 1.00 0.00 H new ATOM 0 HB2 ARG A 79 21.224 -14.983 9.576 1.00 0.00 H new ATOM 0 HB3 ARG A 79 19.598 -15.497 9.172 1.00 0.00 H new ATOM 0 HG2 ARG A 79 21.131 -17.021 8.133 1.00 0.00 H new ATOM 0 HG3 ARG A 79 20.380 -16.073 6.865 1.00 0.00 H new ATOM 0 HD2 ARG A 79 22.684 -16.216 6.306 1.00 0.00 H new ATOM 0 HD3 ARG A 79 22.425 -14.579 6.876 1.00 0.00 H new ATOM 0 HE ARG A 79 23.265 -16.361 9.027 1.00 0.00 H new ATOM 0 HH11 ARG A 79 24.356 -14.084 6.550 1.00 0.00 H new ATOM 0 HH12 ARG A 79 26.011 -14.037 7.166 1.00 0.00 H new ATOM 0 HH21 ARG A 79 25.427 -16.371 9.731 1.00 0.00 H new ATOM 0 HH22 ARG A 79 26.612 -15.320 8.949 1.00 0.00 H new ATOM 876 N SER A 80 21.679 -12.213 6.992 1.00 0.00 N ATOM 877 CA SER A 80 22.811 -11.364 6.750 1.00 0.00 C ATOM 878 C SER A 80 22.368 -9.894 6.762 1.00 0.00 C ATOM 879 O SER A 80 21.245 -9.589 6.332 1.00 0.00 O ATOM 880 CB SER A 80 23.384 -11.726 5.390 1.00 0.00 C ATOM 881 OG SER A 80 23.599 -13.130 5.311 1.00 0.00 O ATOM 0 H SER A 80 21.099 -12.375 6.169 1.00 0.00 H new ATOM 0 HA SER A 80 23.565 -11.502 7.525 1.00 0.00 H new ATOM 0 HB2 SER A 80 22.700 -11.410 4.602 1.00 0.00 H new ATOM 0 HB3 SER A 80 24.323 -11.196 5.229 1.00 0.00 H new ATOM 0 HG SER A 80 23.967 -13.356 4.431 1.00 0.00 H new ATOM 887 N PRO A 81 23.199 -8.975 7.311 1.00 0.00 N ATOM 888 CA PRO A 81 22.917 -7.528 7.297 1.00 0.00 C ATOM 889 C PRO A 81 22.663 -7.021 5.879 1.00 0.00 C ATOM 890 O PRO A 81 23.230 -7.551 4.905 1.00 0.00 O ATOM 891 CB PRO A 81 24.202 -6.907 7.854 1.00 0.00 C ATOM 892 CG PRO A 81 24.788 -7.972 8.708 1.00 0.00 C ATOM 893 CD PRO A 81 24.460 -9.271 8.027 1.00 0.00 C ATOM 0 HA PRO A 81 22.025 -7.276 7.871 1.00 0.00 H new ATOM 0 HB2 PRO A 81 24.884 -6.620 7.053 1.00 0.00 H new ATOM 0 HB3 PRO A 81 23.990 -6.007 8.431 1.00 0.00 H new ATOM 0 HG2 PRO A 81 25.866 -7.844 8.808 1.00 0.00 H new ATOM 0 HG3 PRO A 81 24.369 -7.941 9.714 1.00 0.00 H new ATOM 0 HD2 PRO A 81 25.250 -9.575 7.340 1.00 0.00 H new ATOM 0 HD3 PRO A 81 24.333 -10.081 8.746 1.00 0.00 H new ATOM 901 N SER A 82 21.825 -6.026 5.772 1.00 0.00 N ATOM 902 CA SER A 82 21.433 -5.465 4.511 1.00 0.00 C ATOM 903 C SER A 82 22.624 -4.787 3.818 1.00 0.00 C ATOM 904 O SER A 82 23.394 -4.066 4.476 1.00 0.00 O ATOM 905 CB SER A 82 20.336 -4.443 4.783 1.00 0.00 C ATOM 906 OG SER A 82 19.325 -5.015 5.613 1.00 0.00 O ATOM 0 H SER A 82 21.388 -5.575 6.576 1.00 0.00 H new ATOM 0 HA SER A 82 21.074 -6.253 3.849 1.00 0.00 H new ATOM 0 HB2 SER A 82 20.760 -3.564 5.267 1.00 0.00 H new ATOM 0 HB3 SER A 82 19.899 -4.109 3.842 1.00 0.00 H new ATOM 0 HG SER A 82 18.626 -4.349 5.783 1.00 0.00 H new ATOM 912 N PRO A 83 22.834 -5.069 2.510 1.00 0.00 N ATOM 913 CA PRO A 83 23.844 -4.384 1.702 1.00 0.00 C ATOM 914 C PRO A 83 23.637 -2.879 1.798 1.00 0.00 C ATOM 915 O PRO A 83 22.493 -2.409 1.879 1.00 0.00 O ATOM 916 CB PRO A 83 23.555 -4.878 0.287 1.00 0.00 C ATOM 917 CG PRO A 83 22.967 -6.225 0.495 1.00 0.00 C ATOM 918 CD PRO A 83 22.127 -6.102 1.730 1.00 0.00 C ATOM 0 HA PRO A 83 24.868 -4.583 2.017 1.00 0.00 H new ATOM 0 HB2 PRO A 83 22.864 -4.216 -0.234 1.00 0.00 H new ATOM 0 HB3 PRO A 83 24.464 -4.927 -0.313 1.00 0.00 H new ATOM 0 HG2 PRO A 83 22.365 -6.528 -0.362 1.00 0.00 H new ATOM 0 HG3 PRO A 83 23.744 -6.979 0.621 1.00 0.00 H new ATOM 0 HD2 PRO A 83 21.106 -5.802 1.495 1.00 0.00 H new ATOM 0 HD3 PRO A 83 22.066 -7.046 2.272 1.00 0.00 H new ATOM 926 N GLU A 84 24.707 -2.140 1.781 1.00 0.00 N ATOM 927 CA GLU A 84 24.649 -0.721 2.046 1.00 0.00 C ATOM 928 C GLU A 84 24.424 0.128 0.789 1.00 0.00 C ATOM 929 O GLU A 84 25.275 0.165 -0.105 1.00 0.00 O ATOM 930 CB GLU A 84 25.908 -0.287 2.780 1.00 0.00 C ATOM 931 CG GLU A 84 26.068 -0.958 4.139 1.00 0.00 C ATOM 932 CD GLU A 84 27.365 -0.617 4.804 1.00 0.00 C ATOM 933 OE1 GLU A 84 27.482 0.480 5.387 1.00 0.00 O ATOM 934 OE2 GLU A 84 28.308 -1.441 4.741 1.00 0.00 O ATOM 0 H GLU A 84 25.643 -2.495 1.585 1.00 0.00 H new ATOM 0 HA GLU A 84 23.776 -0.548 2.676 1.00 0.00 H new ATOM 0 HB2 GLU A 84 26.778 -0.515 2.164 1.00 0.00 H new ATOM 0 HB3 GLU A 84 25.888 0.794 2.915 1.00 0.00 H new ATOM 0 HG2 GLU A 84 25.243 -0.659 4.786 1.00 0.00 H new ATOM 0 HG3 GLU A 84 26.001 -2.039 4.016 1.00 0.00 H new ATOM 941 N PRO A 85 23.258 0.799 0.702 1.00 0.00 N ATOM 942 CA PRO A 85 22.938 1.739 -0.376 1.00 0.00 C ATOM 943 C PRO A 85 23.622 3.092 -0.135 1.00 0.00 C ATOM 944 O PRO A 85 24.072 3.374 0.991 1.00 0.00 O ATOM 945 CB PRO A 85 21.418 1.878 -0.294 1.00 0.00 C ATOM 946 CG PRO A 85 21.099 1.655 1.140 1.00 0.00 C ATOM 947 CD PRO A 85 22.128 0.683 1.661 1.00 0.00 C ATOM 0 HA PRO A 85 23.279 1.397 -1.353 1.00 0.00 H new ATOM 0 HB2 PRO A 85 21.092 2.864 -0.624 1.00 0.00 H new ATOM 0 HB3 PRO A 85 20.918 1.147 -0.930 1.00 0.00 H new ATOM 0 HG2 PRO A 85 21.134 2.592 1.696 1.00 0.00 H new ATOM 0 HG3 PRO A 85 20.092 1.253 1.256 1.00 0.00 H new ATOM 0 HD2 PRO A 85 22.438 0.937 2.675 1.00 0.00 H new ATOM 0 HD3 PRO A 85 21.736 -0.333 1.693 1.00 0.00 H new ATOM 955 N ILE A 86 23.727 3.913 -1.162 1.00 0.00 N ATOM 956 CA ILE A 86 24.389 5.187 -1.015 1.00 0.00 C ATOM 957 C ILE A 86 23.425 6.156 -0.299 1.00 0.00 C ATOM 958 O ILE A 86 22.194 5.974 -0.320 1.00 0.00 O ATOM 959 CB ILE A 86 24.844 5.770 -2.399 1.00 0.00 C ATOM 960 CG1 ILE A 86 25.846 6.917 -2.227 1.00 0.00 C ATOM 961 CG2 ILE A 86 23.652 6.256 -3.210 1.00 0.00 C ATOM 962 CD1 ILE A 86 27.138 6.510 -1.551 1.00 0.00 C ATOM 0 H ILE A 86 23.366 3.721 -2.096 1.00 0.00 H new ATOM 0 HA ILE A 86 25.294 5.054 -0.422 1.00 0.00 H new ATOM 0 HB ILE A 86 25.333 4.958 -2.937 1.00 0.00 H new ATOM 0 HG12 ILE A 86 26.077 7.334 -3.207 1.00 0.00 H new ATOM 0 HG13 ILE A 86 25.378 7.711 -1.645 1.00 0.00 H new ATOM 0 HG21 ILE A 86 23.999 6.654 -4.163 1.00 0.00 H new ATOM 0 HG22 ILE A 86 22.971 5.424 -3.390 1.00 0.00 H new ATOM 0 HG23 ILE A 86 23.131 7.038 -2.658 1.00 0.00 H new ATOM 0 HD11 ILE A 86 27.793 7.377 -1.467 1.00 0.00 H new ATOM 0 HD12 ILE A 86 26.921 6.121 -0.556 1.00 0.00 H new ATOM 0 HD13 ILE A 86 27.631 5.739 -2.143 1.00 0.00 H new ATOM 974 N TYR A 87 23.990 7.116 0.369 1.00 0.00 N ATOM 975 CA TYR A 87 23.266 8.005 1.232 1.00 0.00 C ATOM 976 C TYR A 87 22.533 9.070 0.465 1.00 0.00 C ATOM 977 O TYR A 87 22.949 9.475 -0.620 1.00 0.00 O ATOM 978 CB TYR A 87 24.220 8.632 2.256 1.00 0.00 C ATOM 979 CG TYR A 87 24.903 7.600 3.124 1.00 0.00 C ATOM 980 CD1 TYR A 87 25.972 6.850 2.638 1.00 0.00 C ATOM 981 CD2 TYR A 87 24.456 7.342 4.403 1.00 0.00 C ATOM 982 CE1 TYR A 87 26.572 5.888 3.405 1.00 0.00 C ATOM 983 CE2 TYR A 87 25.049 6.374 5.174 1.00 0.00 C ATOM 984 CZ TYR A 87 26.106 5.650 4.669 1.00 0.00 C ATOM 985 OH TYR A 87 26.678 4.670 5.430 1.00 0.00 O ATOM 0 H TYR A 87 24.991 7.309 0.329 1.00 0.00 H new ATOM 0 HA TYR A 87 22.512 7.418 1.756 1.00 0.00 H new ATOM 0 HB2 TYR A 87 24.975 9.218 1.732 1.00 0.00 H new ATOM 0 HB3 TYR A 87 23.664 9.323 2.889 1.00 0.00 H new ATOM 0 HD1 TYR A 87 26.334 7.031 1.637 1.00 0.00 H new ATOM 0 HD2 TYR A 87 23.629 7.909 4.803 1.00 0.00 H new ATOM 0 HE1 TYR A 87 27.406 5.322 3.016 1.00 0.00 H new ATOM 0 HE2 TYR A 87 24.688 6.181 6.173 1.00 0.00 H new ATOM 0 HH TYR A 87 26.232 4.630 6.302 1.00 0.00 H new ATOM 995 N ASN A 88 21.422 9.480 1.027 1.00 0.00 N ATOM 996 CA ASN A 88 20.600 10.551 0.496 1.00 0.00 C ATOM 997 C ASN A 88 21.351 11.851 0.645 1.00 0.00 C ATOM 998 O ASN A 88 22.273 11.939 1.463 1.00 0.00 O ATOM 999 CB ASN A 88 19.285 10.687 1.297 1.00 0.00 C ATOM 1000 CG ASN A 88 18.310 9.519 1.186 1.00 0.00 C ATOM 1001 OD1 ASN A 88 18.683 8.372 0.938 1.00 0.00 O ATOM 1002 ND2 ASN A 88 17.048 9.802 1.401 1.00 0.00 N ATOM 0 H ASN A 88 21.052 9.072 1.886 1.00 0.00 H new ATOM 0 HA ASN A 88 20.373 10.327 -0.546 1.00 0.00 H new ATOM 0 HB2 ASN A 88 19.536 10.826 2.349 1.00 0.00 H new ATOM 0 HB3 ASN A 88 18.775 11.593 0.969 1.00 0.00 H new ATOM 0 HD21 ASN A 88 16.346 9.063 1.365 1.00 0.00 H new ATOM 0 HD22 ASN A 88 16.768 10.762 1.604 1.00 0.00 H new ATOM 1009 N SER A 89 20.912 12.867 -0.059 1.00 0.00 N ATOM 1010 CA SER A 89 21.524 14.185 -0.022 1.00 0.00 C ATOM 1011 C SER A 89 21.557 14.764 1.407 1.00 0.00 C ATOM 1012 O SER A 89 22.500 15.448 1.792 1.00 0.00 O ATOM 1013 CB SER A 89 20.748 15.086 -0.970 1.00 0.00 C ATOM 1014 OG SER A 89 19.346 14.856 -0.818 1.00 0.00 O ATOM 0 H SER A 89 20.108 12.806 -0.684 1.00 0.00 H new ATOM 0 HA SER A 89 22.564 14.115 -0.340 1.00 0.00 H new ATOM 0 HB2 SER A 89 20.979 16.131 -0.764 1.00 0.00 H new ATOM 0 HB3 SER A 89 21.048 14.891 -1.999 1.00 0.00 H new ATOM 0 HG SER A 89 18.851 15.440 -1.429 1.00 0.00 H new ATOM 1020 N GLU A 90 20.560 14.400 2.201 1.00 0.00 N ATOM 1021 CA GLU A 90 20.436 14.877 3.573 1.00 0.00 C ATOM 1022 C GLU A 90 21.338 14.079 4.538 1.00 0.00 C ATOM 1023 O GLU A 90 21.436 14.404 5.727 1.00 0.00 O ATOM 1024 CB GLU A 90 18.978 14.759 4.024 1.00 0.00 C ATOM 1025 CG GLU A 90 18.446 13.337 3.973 1.00 0.00 C ATOM 1026 CD GLU A 90 17.060 13.210 4.521 1.00 0.00 C ATOM 1027 OE1 GLU A 90 16.923 13.036 5.739 1.00 0.00 O ATOM 1028 OE2 GLU A 90 16.095 13.237 3.735 1.00 0.00 O ATOM 0 H GLU A 90 19.814 13.766 1.913 1.00 0.00 H new ATOM 0 HA GLU A 90 20.756 15.919 3.597 1.00 0.00 H new ATOM 0 HB2 GLU A 90 18.888 15.137 5.043 1.00 0.00 H new ATOM 0 HB3 GLU A 90 18.357 15.395 3.393 1.00 0.00 H new ATOM 0 HG2 GLU A 90 18.455 12.989 2.940 1.00 0.00 H new ATOM 0 HG3 GLU A 90 19.114 12.685 4.536 1.00 0.00 H new ATOM 1035 N GLY A 91 21.994 13.047 4.027 1.00 0.00 N ATOM 1036 CA GLY A 91 22.841 12.212 4.860 1.00 0.00 C ATOM 1037 C GLY A 91 22.056 11.106 5.533 1.00 0.00 C ATOM 1038 O GLY A 91 22.389 10.673 6.636 1.00 0.00 O ATOM 0 H GLY A 91 21.955 12.771 3.046 1.00 0.00 H new ATOM 0 HA2 GLY A 91 23.633 11.776 4.251 1.00 0.00 H new ATOM 0 HA3 GLY A 91 23.324 12.828 5.619 1.00 0.00 H new ATOM 1042 N LYS A 92 21.021 10.659 4.870 1.00 0.00 N ATOM 1043 CA LYS A 92 20.166 9.597 5.372 1.00 0.00 C ATOM 1044 C LYS A 92 20.387 8.338 4.559 1.00 0.00 C ATOM 1045 O LYS A 92 20.731 8.409 3.387 1.00 0.00 O ATOM 1046 CB LYS A 92 18.673 10.034 5.304 1.00 0.00 C ATOM 1047 CG LYS A 92 17.641 8.918 5.566 1.00 0.00 C ATOM 1048 CD LYS A 92 16.190 9.412 5.470 1.00 0.00 C ATOM 1049 CE LYS A 92 15.619 9.957 6.797 1.00 0.00 C ATOM 1050 NZ LYS A 92 16.414 11.054 7.384 1.00 0.00 N ATOM 0 H LYS A 92 20.740 11.020 3.958 1.00 0.00 H new ATOM 0 HA LYS A 92 20.418 9.394 6.413 1.00 0.00 H new ATOM 0 HB2 LYS A 92 18.513 10.831 6.030 1.00 0.00 H new ATOM 0 HB3 LYS A 92 18.481 10.458 4.318 1.00 0.00 H new ATOM 0 HG2 LYS A 92 17.794 8.113 4.847 1.00 0.00 H new ATOM 0 HG3 LYS A 92 17.812 8.497 6.557 1.00 0.00 H new ATOM 0 HD2 LYS A 92 16.134 10.195 4.714 1.00 0.00 H new ATOM 0 HD3 LYS A 92 15.560 8.591 5.126 1.00 0.00 H new ATOM 0 HE2 LYS A 92 14.602 10.310 6.626 1.00 0.00 H new ATOM 0 HE3 LYS A 92 15.557 9.141 7.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 15.873 11.503 8.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 17.304 10.673 7.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 16.626 11.760 6.651 1.00 0.00 H new ATOM 1064 N ARG A 93 20.222 7.214 5.176 1.00 0.00 N ATOM 1065 CA ARG A 93 20.277 5.963 4.508 1.00 0.00 C ATOM 1066 C ARG A 93 19.146 5.164 5.077 1.00 0.00 C ATOM 1067 O ARG A 93 18.832 5.309 6.263 1.00 0.00 O ATOM 1068 CB ARG A 93 21.602 5.264 4.756 1.00 0.00 C ATOM 1069 CG ARG A 93 21.850 4.112 3.815 1.00 0.00 C ATOM 1070 CD ARG A 93 23.150 3.417 4.118 1.00 0.00 C ATOM 1071 NE ARG A 93 23.114 2.709 5.399 1.00 0.00 N ATOM 1072 CZ ARG A 93 24.121 1.991 5.907 1.00 0.00 C ATOM 1073 NH1 ARG A 93 25.346 2.111 5.406 1.00 0.00 N ATOM 1074 NH2 ARG A 93 23.905 1.211 6.959 1.00 0.00 N ATOM 0 H ARG A 93 20.042 7.142 6.177 1.00 0.00 H new ATOM 0 HA ARG A 93 20.194 6.083 3.428 1.00 0.00 H new ATOM 0 HB2 ARG A 93 22.411 5.987 4.656 1.00 0.00 H new ATOM 0 HB3 ARG A 93 21.626 4.898 5.782 1.00 0.00 H new ATOM 0 HG2 ARG A 93 21.030 3.398 3.889 1.00 0.00 H new ATOM 0 HG3 ARG A 93 21.863 4.477 2.788 1.00 0.00 H new ATOM 0 HD2 ARG A 93 23.376 2.710 3.320 1.00 0.00 H new ATOM 0 HD3 ARG A 93 23.957 4.150 4.132 1.00 0.00 H new ATOM 0 HE ARG A 93 22.255 2.768 5.946 1.00 0.00 H new ATOM 0 HH11 ARG A 93 25.520 2.752 4.632 1.00 0.00 H new ATOM 0 HH12 ARG A 93 26.112 1.562 5.796 1.00 0.00 H new ATOM 0 HH21 ARG A 93 22.975 1.162 7.375 1.00 0.00 H new ATOM 0 HH22 ARG A 93 24.669 0.661 7.351 1.00 0.00 H new ATOM 1088 N LEU A 94 18.515 4.374 4.282 1.00 0.00 N ATOM 1089 CA LEU A 94 17.356 3.656 4.743 1.00 0.00 C ATOM 1090 C LEU A 94 17.384 2.238 4.214 1.00 0.00 C ATOM 1091 O LEU A 94 18.407 1.776 3.702 1.00 0.00 O ATOM 1092 CB LEU A 94 16.044 4.390 4.309 1.00 0.00 C ATOM 1093 CG LEU A 94 15.571 4.266 2.835 1.00 0.00 C ATOM 1094 CD1 LEU A 94 14.350 5.121 2.592 1.00 0.00 C ATOM 1095 CD2 LEU A 94 16.657 4.599 1.838 1.00 0.00 C ATOM 0 H LEU A 94 18.772 4.202 3.310 1.00 0.00 H new ATOM 0 HA LEU A 94 17.373 3.620 5.832 1.00 0.00 H new ATOM 0 HB2 LEU A 94 15.237 4.028 4.946 1.00 0.00 H new ATOM 0 HB3 LEU A 94 16.171 5.450 4.527 1.00 0.00 H new ATOM 0 HG LEU A 94 15.312 3.219 2.680 1.00 0.00 H new ATOM 0 HD11 LEU A 94 14.035 5.019 1.553 1.00 0.00 H new ATOM 0 HD12 LEU A 94 13.543 4.797 3.249 1.00 0.00 H new ATOM 0 HD13 LEU A 94 14.589 6.164 2.798 1.00 0.00 H new ATOM 0 HD21 LEU A 94 16.266 4.494 0.826 1.00 0.00 H new ATOM 0 HD22 LEU A 94 16.992 5.625 1.993 1.00 0.00 H new ATOM 0 HD23 LEU A 94 17.497 3.919 1.975 1.00 0.00 H new ATOM 1107 N ASN A 95 16.267 1.571 4.337 1.00 0.00 N ATOM 1108 CA ASN A 95 16.093 0.209 3.860 1.00 0.00 C ATOM 1109 C ASN A 95 15.926 0.203 2.357 1.00 0.00 C ATOM 1110 O ASN A 95 15.404 1.164 1.795 1.00 0.00 O ATOM 1111 CB ASN A 95 14.892 -0.474 4.511 1.00 0.00 C ATOM 1112 CG ASN A 95 15.061 -0.870 5.971 1.00 0.00 C ATOM 1113 OD1 ASN A 95 14.459 -1.839 6.420 1.00 0.00 O ATOM 1114 ND2 ASN A 95 15.842 -0.142 6.719 1.00 0.00 N ATOM 0 H ASN A 95 15.433 1.959 4.778 1.00 0.00 H new ATOM 0 HA ASN A 95 16.987 -0.350 4.136 1.00 0.00 H new ATOM 0 HB2 ASN A 95 14.033 0.193 4.433 1.00 0.00 H new ATOM 0 HB3 ASN A 95 14.653 -1.370 3.937 1.00 0.00 H new ATOM 0 HD21 ASN A 95 15.965 -0.373 7.705 1.00 0.00 H new ATOM 0 HD22 ASN A 95 16.331 0.659 6.318 1.00 0.00 H new ATOM 1121 N THR A 96 16.390 -0.829 1.703 1.00 0.00 N ATOM 1122 CA THR A 96 16.292 -0.876 0.268 1.00 0.00 C ATOM 1123 C THR A 96 15.182 -1.851 -0.189 1.00 0.00 C ATOM 1124 O THR A 96 14.067 -1.429 -0.515 1.00 0.00 O ATOM 1125 CB THR A 96 17.637 -1.261 -0.363 1.00 0.00 C ATOM 1126 OG1 THR A 96 18.687 -0.505 0.266 1.00 0.00 O ATOM 1127 CG2 THR A 96 17.639 -0.956 -1.854 1.00 0.00 C ATOM 0 H THR A 96 16.834 -1.639 2.134 1.00 0.00 H new ATOM 0 HA THR A 96 16.025 0.124 -0.074 1.00 0.00 H new ATOM 0 HB THR A 96 17.796 -2.330 -0.219 1.00 0.00 H new ATOM 0 HG1 THR A 96 19.549 -0.748 -0.132 1.00 0.00 H new ATOM 0 HG21 THR A 96 18.602 -1.236 -2.281 1.00 0.00 H new ATOM 0 HG22 THR A 96 16.846 -1.523 -2.342 1.00 0.00 H new ATOM 0 HG23 THR A 96 17.471 0.110 -2.008 1.00 0.00 H new ATOM 1135 N ARG A 97 15.450 -3.154 -0.137 1.00 0.00 N ATOM 1136 CA ARG A 97 14.480 -4.136 -0.629 1.00 0.00 C ATOM 1137 C ARG A 97 13.386 -4.372 0.399 1.00 0.00 C ATOM 1138 O ARG A 97 12.253 -4.740 0.063 1.00 0.00 O ATOM 1139 CB ARG A 97 15.180 -5.454 -1.093 1.00 0.00 C ATOM 1140 CG ARG A 97 15.963 -6.223 -0.023 1.00 0.00 C ATOM 1141 CD ARG A 97 15.070 -7.121 0.825 1.00 0.00 C ATOM 1142 NE ARG A 97 15.784 -7.644 1.990 1.00 0.00 N ATOM 1143 CZ ARG A 97 15.546 -8.807 2.600 1.00 0.00 C ATOM 1144 NH1 ARG A 97 14.626 -9.632 2.128 1.00 0.00 N ATOM 1145 NH2 ARG A 97 16.225 -9.142 3.687 1.00 0.00 N ATOM 0 H ARG A 97 16.313 -3.552 0.233 1.00 0.00 H new ATOM 0 HA ARG A 97 13.996 -3.728 -1.517 1.00 0.00 H new ATOM 0 HB2 ARG A 97 14.420 -6.118 -1.503 1.00 0.00 H new ATOM 0 HB3 ARG A 97 15.863 -5.210 -1.907 1.00 0.00 H new ATOM 0 HG2 ARG A 97 16.729 -6.830 -0.505 1.00 0.00 H new ATOM 0 HG3 ARG A 97 16.479 -5.514 0.625 1.00 0.00 H new ATOM 0 HD2 ARG A 97 14.196 -6.559 1.155 1.00 0.00 H new ATOM 0 HD3 ARG A 97 14.705 -7.950 0.218 1.00 0.00 H new ATOM 0 HE ARG A 97 16.533 -7.066 2.371 1.00 0.00 H new ATOM 0 HH11 ARG A 97 14.095 -9.380 1.294 1.00 0.00 H new ATOM 0 HH12 ARG A 97 14.448 -10.520 2.598 1.00 0.00 H new ATOM 0 HH21 ARG A 97 16.933 -8.510 4.061 1.00 0.00 H new ATOM 0 HH22 ARG A 97 16.040 -10.032 4.150 1.00 0.00 H new ATOM 1159 N GLU A 98 13.726 -4.125 1.647 1.00 0.00 N ATOM 1160 CA GLU A 98 12.800 -4.266 2.748 1.00 0.00 C ATOM 1161 C GLU A 98 11.777 -3.168 2.610 1.00 0.00 C ATOM 1162 O GLU A 98 10.562 -3.381 2.722 1.00 0.00 O ATOM 1163 CB GLU A 98 13.512 -4.061 4.107 1.00 0.00 C ATOM 1164 CG GLU A 98 14.724 -4.954 4.413 1.00 0.00 C ATOM 1165 CD GLU A 98 15.933 -4.667 3.534 1.00 0.00 C ATOM 1166 OE1 GLU A 98 16.039 -3.540 2.963 1.00 0.00 O ATOM 1167 OE2 GLU A 98 16.776 -5.557 3.359 1.00 0.00 O ATOM 0 H GLU A 98 14.658 -3.819 1.926 1.00 0.00 H new ATOM 0 HA GLU A 98 12.361 -5.263 2.722 1.00 0.00 H new ATOM 0 HB2 GLU A 98 13.837 -3.022 4.164 1.00 0.00 H new ATOM 0 HB3 GLU A 98 12.777 -4.209 4.898 1.00 0.00 H new ATOM 0 HG2 GLU A 98 15.006 -4.823 5.458 1.00 0.00 H new ATOM 0 HG3 GLU A 98 14.436 -5.998 4.289 1.00 0.00 H new ATOM 1174 N PHE A 99 12.299 -1.999 2.295 1.00 0.00 N ATOM 1175 CA PHE A 99 11.527 -0.800 2.205 1.00 0.00 C ATOM 1176 C PHE A 99 10.592 -0.884 1.050 1.00 0.00 C ATOM 1177 O PHE A 99 9.437 -0.641 1.213 1.00 0.00 O ATOM 1178 CB PHE A 99 12.439 0.388 2.006 1.00 0.00 C ATOM 1179 CG PHE A 99 11.842 1.720 2.352 1.00 0.00 C ATOM 1180 CD1 PHE A 99 11.877 2.152 3.661 1.00 0.00 C ATOM 1181 CD2 PHE A 99 11.280 2.554 1.380 1.00 0.00 C ATOM 1182 CE1 PHE A 99 11.368 3.386 4.009 1.00 0.00 C ATOM 1183 CE2 PHE A 99 10.779 3.790 1.726 1.00 0.00 C ATOM 1184 CZ PHE A 99 10.821 4.204 3.039 1.00 0.00 C ATOM 0 H PHE A 99 13.290 -1.866 2.093 1.00 0.00 H new ATOM 0 HA PHE A 99 10.962 -0.680 3.130 1.00 0.00 H new ATOM 0 HB2 PHE A 99 13.335 0.242 2.609 1.00 0.00 H new ATOM 0 HB3 PHE A 99 12.757 0.411 0.964 1.00 0.00 H new ATOM 0 HD1 PHE A 99 12.307 1.518 4.422 1.00 0.00 H new ATOM 0 HD2 PHE A 99 11.238 2.227 0.352 1.00 0.00 H new ATOM 0 HE1 PHE A 99 11.397 3.712 5.038 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.354 4.433 0.969 1.00 0.00 H new ATOM 0 HZ PHE A 99 10.425 5.171 3.311 1.00 0.00 H new ATOM 1194 N ARG A 100 11.102 -1.302 -0.107 1.00 0.00 N ATOM 1195 CA ARG A 100 10.310 -1.323 -1.331 1.00 0.00 C ATOM 1196 C ARG A 100 9.084 -2.227 -1.196 1.00 0.00 C ATOM 1197 O ARG A 100 8.003 -1.863 -1.638 1.00 0.00 O ATOM 1198 CB ARG A 100 11.158 -1.733 -2.548 1.00 0.00 C ATOM 1199 CG ARG A 100 10.425 -1.573 -3.878 1.00 0.00 C ATOM 1200 CD ARG A 100 11.280 -1.987 -5.068 1.00 0.00 C ATOM 1201 NE ARG A 100 11.563 -3.428 -5.086 1.00 0.00 N ATOM 1202 CZ ARG A 100 12.283 -4.052 -6.032 1.00 0.00 C ATOM 1203 NH1 ARG A 100 12.850 -3.355 -7.015 1.00 0.00 N ATOM 1204 NH2 ARG A 100 12.453 -5.366 -5.980 1.00 0.00 N ATOM 0 H ARG A 100 12.061 -1.631 -0.221 1.00 0.00 H new ATOM 0 HA ARG A 100 9.957 -0.305 -1.496 1.00 0.00 H new ATOM 0 HB2 ARG A 100 12.067 -1.132 -2.568 1.00 0.00 H new ATOM 0 HB3 ARG A 100 11.466 -2.772 -2.434 1.00 0.00 H new ATOM 0 HG2 ARG A 100 9.515 -2.173 -3.862 1.00 0.00 H new ATOM 0 HG3 ARG A 100 10.120 -0.534 -3.998 1.00 0.00 H new ATOM 0 HD2 ARG A 100 10.771 -1.709 -5.991 1.00 0.00 H new ATOM 0 HD3 ARG A 100 12.220 -1.436 -5.044 1.00 0.00 H new ATOM 0 HE ARG A 100 11.186 -3.995 -4.326 1.00 0.00 H new ATOM 0 HH11 ARG A 100 12.738 -2.342 -7.052 1.00 0.00 H new ATOM 0 HH12 ARG A 100 13.396 -3.834 -7.731 1.00 0.00 H new ATOM 0 HH21 ARG A 100 12.036 -5.904 -5.220 1.00 0.00 H new ATOM 0 HH22 ARG A 100 13.000 -5.838 -6.700 1.00 0.00 H new ATOM 1218 N THR A 101 9.253 -3.372 -0.555 1.00 0.00 N ATOM 1219 CA THR A 101 8.152 -4.291 -0.345 1.00 0.00 C ATOM 1220 C THR A 101 7.094 -3.656 0.562 1.00 0.00 C ATOM 1221 O THR A 101 5.924 -3.608 0.206 1.00 0.00 O ATOM 1222 CB THR A 101 8.652 -5.606 0.274 1.00 0.00 C ATOM 1223 OG1 THR A 101 9.809 -6.062 -0.466 1.00 0.00 O ATOM 1224 CG2 THR A 101 7.556 -6.663 0.185 1.00 0.00 C ATOM 0 H THR A 101 10.145 -3.685 -0.171 1.00 0.00 H new ATOM 0 HA THR A 101 7.703 -4.511 -1.314 1.00 0.00 H new ATOM 0 HB THR A 101 8.915 -5.442 1.319 1.00 0.00 H new ATOM 0 HG1 THR A 101 10.607 -5.591 -0.148 1.00 0.00 H new ATOM 0 HG21 THR A 101 7.912 -7.595 0.624 1.00 0.00 H new ATOM 0 HG22 THR A 101 6.675 -6.320 0.727 1.00 0.00 H new ATOM 0 HG23 THR A 101 7.296 -6.831 -0.860 1.00 0.00 H new ATOM 1232 N ARG A 102 7.526 -3.114 1.697 1.00 0.00 N ATOM 1233 CA ARG A 102 6.600 -2.491 2.631 1.00 0.00 C ATOM 1234 C ARG A 102 5.993 -1.235 2.025 1.00 0.00 C ATOM 1235 O ARG A 102 4.815 -0.997 2.156 1.00 0.00 O ATOM 1236 CB ARG A 102 7.269 -2.187 3.976 1.00 0.00 C ATOM 1237 CG ARG A 102 7.776 -3.427 4.695 1.00 0.00 C ATOM 1238 CD ARG A 102 8.380 -3.097 6.054 1.00 0.00 C ATOM 1239 NE ARG A 102 9.497 -2.151 5.961 1.00 0.00 N ATOM 1240 CZ ARG A 102 10.748 -2.369 6.406 1.00 0.00 C ATOM 1241 NH1 ARG A 102 11.111 -3.565 6.867 1.00 0.00 N ATOM 1242 NH2 ARG A 102 11.632 -1.383 6.372 1.00 0.00 N ATOM 0 H ARG A 102 8.503 -3.094 1.989 1.00 0.00 H new ATOM 0 HA ARG A 102 5.797 -3.202 2.825 1.00 0.00 H new ATOM 0 HB2 ARG A 102 8.103 -1.505 3.812 1.00 0.00 H new ATOM 0 HB3 ARG A 102 6.556 -1.670 4.619 1.00 0.00 H new ATOM 0 HG2 ARG A 102 6.954 -4.131 4.826 1.00 0.00 H new ATOM 0 HG3 ARG A 102 8.525 -3.923 4.077 1.00 0.00 H new ATOM 0 HD2 ARG A 102 7.607 -2.678 6.699 1.00 0.00 H new ATOM 0 HD3 ARG A 102 8.726 -4.016 6.526 1.00 0.00 H new ATOM 0 HE ARG A 102 9.309 -1.250 5.521 1.00 0.00 H new ATOM 0 HH11 ARG A 102 10.437 -4.330 6.886 1.00 0.00 H new ATOM 0 HH12 ARG A 102 12.063 -3.715 7.201 1.00 0.00 H new ATOM 0 HH21 ARG A 102 11.362 -0.468 6.011 1.00 0.00 H new ATOM 0 HH22 ARG A 102 12.583 -1.539 6.707 1.00 0.00 H new ATOM 1256 N LYS A 103 6.812 -0.481 1.318 1.00 0.00 N ATOM 1257 CA LYS A 103 6.413 0.748 0.647 1.00 0.00 C ATOM 1258 C LYS A 103 5.315 0.449 -0.345 1.00 0.00 C ATOM 1259 O LYS A 103 4.319 1.135 -0.375 1.00 0.00 O ATOM 1260 CB LYS A 103 7.625 1.351 -0.077 1.00 0.00 C ATOM 1261 CG LYS A 103 7.416 2.706 -0.729 1.00 0.00 C ATOM 1262 CD LYS A 103 7.100 3.785 0.290 1.00 0.00 C ATOM 1263 CE LYS A 103 7.166 5.161 -0.344 1.00 0.00 C ATOM 1264 NZ LYS A 103 6.208 5.316 -1.467 1.00 0.00 N ATOM 0 H LYS A 103 7.798 -0.709 1.189 1.00 0.00 H new ATOM 0 HA LYS A 103 6.043 1.463 1.382 1.00 0.00 H new ATOM 0 HB2 LYS A 103 8.442 1.439 0.639 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.949 0.648 -0.845 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.312 2.983 -1.284 1.00 0.00 H new ATOM 0 HG3 LYS A 103 6.602 2.639 -1.451 1.00 0.00 H new ATOM 0 HD2 LYS A 103 6.106 3.619 0.706 1.00 0.00 H new ATOM 0 HD3 LYS A 103 7.806 3.727 1.118 1.00 0.00 H new ATOM 0 HE2 LYS A 103 6.958 5.917 0.413 1.00 0.00 H new ATOM 0 HE3 LYS A 103 8.178 5.342 -0.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 6.373 6.227 -1.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 6.343 4.542 -2.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 5.235 5.289 -1.100 1.00 0.00 H new ATOM 1278 N LYS A 104 5.497 -0.621 -1.120 1.00 0.00 N ATOM 1279 CA LYS A 104 4.519 -1.052 -2.110 1.00 0.00 C ATOM 1280 C LYS A 104 3.185 -1.352 -1.440 1.00 0.00 C ATOM 1281 O LYS A 104 2.130 -0.996 -1.947 1.00 0.00 O ATOM 1282 CB LYS A 104 5.049 -2.285 -2.887 1.00 0.00 C ATOM 1283 CG LYS A 104 4.059 -2.904 -3.887 1.00 0.00 C ATOM 1284 CD LYS A 104 3.484 -1.868 -4.849 1.00 0.00 C ATOM 1285 CE LYS A 104 2.531 -2.506 -5.846 1.00 0.00 C ATOM 1286 NZ LYS A 104 1.760 -1.494 -6.601 1.00 0.00 N ATOM 0 H LYS A 104 6.328 -1.211 -1.076 1.00 0.00 H new ATOM 0 HA LYS A 104 4.360 -0.246 -2.826 1.00 0.00 H new ATOM 0 HB2 LYS A 104 5.951 -1.995 -3.426 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.340 -3.050 -2.167 1.00 0.00 H new ATOM 0 HG2 LYS A 104 4.562 -3.686 -4.456 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.245 -3.381 -3.341 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.960 -1.097 -4.285 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.296 -1.375 -5.384 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.096 -3.125 -6.543 1.00 0.00 H new ATOM 0 HE3 LYS A 104 1.843 -3.167 -5.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 1.490 -1.883 -7.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 0.903 -1.242 -6.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.344 -0.645 -6.739 1.00 0.00 H new ATOM 1300 N LEU A 105 3.254 -1.945 -0.283 1.00 0.00 N ATOM 1301 CA LEU A 105 2.075 -2.291 0.475 1.00 0.00 C ATOM 1302 C LEU A 105 1.366 -1.035 0.955 1.00 0.00 C ATOM 1303 O LEU A 105 0.130 -0.928 0.889 1.00 0.00 O ATOM 1304 CB LEU A 105 2.466 -3.116 1.677 1.00 0.00 C ATOM 1305 CG LEU A 105 3.277 -4.370 1.411 1.00 0.00 C ATOM 1306 CD1 LEU A 105 3.473 -5.138 2.683 1.00 0.00 C ATOM 1307 CD2 LEU A 105 2.634 -5.224 0.335 1.00 0.00 C ATOM 0 H LEU A 105 4.131 -2.205 0.168 1.00 0.00 H new ATOM 0 HA LEU A 105 1.406 -2.861 -0.170 1.00 0.00 H new ATOM 0 HB2 LEU A 105 3.036 -2.480 2.355 1.00 0.00 H new ATOM 0 HB3 LEU A 105 1.555 -3.405 2.201 1.00 0.00 H new ATOM 0 HG LEU A 105 4.258 -4.075 1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 105 4.056 -6.036 2.480 1.00 0.00 H new ATOM 0 HD12 LEU A 105 4.003 -4.517 3.405 1.00 0.00 H new ATOM 0 HD13 LEU A 105 2.502 -5.421 3.091 1.00 0.00 H new ATOM 0 HD21 LEU A 105 3.239 -6.115 0.168 1.00 0.00 H new ATOM 0 HD22 LEU A 105 1.634 -5.519 0.654 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.566 -4.653 -0.591 1.00 0.00 H new ATOM 1319 N GLU A 106 2.146 -0.087 1.427 1.00 0.00 N ATOM 1320 CA GLU A 106 1.627 1.167 1.913 1.00 0.00 C ATOM 1321 C GLU A 106 1.006 1.942 0.753 1.00 0.00 C ATOM 1322 O GLU A 106 -0.004 2.649 0.928 1.00 0.00 O ATOM 1323 CB GLU A 106 2.733 1.970 2.609 1.00 0.00 C ATOM 1324 CG GLU A 106 3.437 1.175 3.718 1.00 0.00 C ATOM 1325 CD GLU A 106 3.419 1.831 5.095 1.00 0.00 C ATOM 1326 OE1 GLU A 106 2.844 2.932 5.253 1.00 0.00 O ATOM 1327 OE2 GLU A 106 3.983 1.245 6.063 1.00 0.00 O ATOM 0 H GLU A 106 3.161 -0.167 1.483 1.00 0.00 H new ATOM 0 HA GLU A 106 0.850 0.981 2.654 1.00 0.00 H new ATOM 0 HB2 GLU A 106 3.469 2.283 1.869 1.00 0.00 H new ATOM 0 HB3 GLU A 106 2.304 2.877 3.035 1.00 0.00 H new ATOM 0 HG2 GLU A 106 2.968 0.194 3.794 1.00 0.00 H new ATOM 0 HG3 GLU A 106 4.474 1.011 3.424 1.00 0.00 H new ATOM 1334 N GLU A 107 1.592 1.773 -0.432 1.00 0.00 N ATOM 1335 CA GLU A 107 1.077 2.367 -1.651 1.00 0.00 C ATOM 1336 C GLU A 107 -0.264 1.758 -2.026 1.00 0.00 C ATOM 1337 O GLU A 107 -1.187 2.478 -2.394 1.00 0.00 O ATOM 1338 CB GLU A 107 2.033 2.197 -2.827 1.00 0.00 C ATOM 1339 CG GLU A 107 3.381 2.867 -2.672 1.00 0.00 C ATOM 1340 CD GLU A 107 3.291 4.312 -2.260 1.00 0.00 C ATOM 1341 OE1 GLU A 107 2.924 5.171 -3.085 1.00 0.00 O ATOM 1342 OE2 GLU A 107 3.642 4.628 -1.105 1.00 0.00 O ATOM 0 H GLU A 107 2.438 1.219 -0.567 1.00 0.00 H new ATOM 0 HA GLU A 107 0.962 3.431 -1.446 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.193 1.131 -2.992 1.00 0.00 H new ATOM 0 HB3 GLU A 107 1.552 2.589 -3.723 1.00 0.00 H new ATOM 0 HG2 GLU A 107 3.965 2.322 -1.931 1.00 0.00 H new ATOM 0 HG3 GLU A 107 3.922 2.800 -3.616 1.00 0.00 H new ATOM 1349 N GLU A 108 -0.372 0.429 -1.935 1.00 0.00 N ATOM 1350 CA GLU A 108 -1.610 -0.263 -2.241 1.00 0.00 C ATOM 1351 C GLU A 108 -2.720 0.221 -1.323 1.00 0.00 C ATOM 1352 O GLU A 108 -3.848 0.461 -1.770 1.00 0.00 O ATOM 1353 CB GLU A 108 -1.426 -1.768 -2.104 1.00 0.00 C ATOM 1354 CG GLU A 108 -0.446 -2.367 -3.094 1.00 0.00 C ATOM 1355 CD GLU A 108 -0.919 -2.271 -4.524 1.00 0.00 C ATOM 1356 OE1 GLU A 108 -1.639 -3.188 -4.996 1.00 0.00 O ATOM 1357 OE2 GLU A 108 -0.573 -1.307 -5.222 1.00 0.00 O ATOM 0 H GLU A 108 0.392 -0.184 -1.650 1.00 0.00 H new ATOM 0 HA GLU A 108 -1.888 -0.043 -3.272 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -1.085 -1.991 -1.093 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -2.394 -2.254 -2.229 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.514 -1.859 -3.000 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.278 -3.414 -2.842 1.00 0.00 H new ATOM 1364 N ARG A 109 -2.386 0.385 -0.044 1.00 0.00 N ATOM 1365 CA ARG A 109 -3.323 0.915 0.938 1.00 0.00 C ATOM 1366 C ARG A 109 -3.721 2.337 0.542 1.00 0.00 C ATOM 1367 O ARG A 109 -4.888 2.682 0.548 1.00 0.00 O ATOM 1368 CB ARG A 109 -2.672 0.955 2.325 1.00 0.00 C ATOM 1369 CG ARG A 109 -3.554 1.558 3.425 1.00 0.00 C ATOM 1370 CD ARG A 109 -2.721 1.926 4.645 1.00 0.00 C ATOM 1371 NE ARG A 109 -1.653 2.872 4.264 1.00 0.00 N ATOM 1372 CZ ARG A 109 -0.470 2.980 4.878 1.00 0.00 C ATOM 1373 NH1 ARG A 109 -0.288 2.490 6.102 1.00 0.00 N ATOM 1374 NH2 ARG A 109 0.507 3.670 4.301 1.00 0.00 N ATOM 0 H ARG A 109 -1.467 0.156 0.335 1.00 0.00 H new ATOM 0 HA ARG A 109 -4.201 0.270 0.968 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -2.397 -0.060 2.613 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -1.748 1.530 2.262 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -4.062 2.444 3.045 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -4.328 0.845 3.709 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -3.358 2.373 5.408 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -2.283 1.028 5.081 1.00 0.00 H new ATOM 0 HE ARG A 109 -1.831 3.490 3.472 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -1.057 2.024 6.584 1.00 0.00 H new ATOM 0 HH12 ARG A 109 0.620 2.580 6.558 1.00 0.00 H new ATOM 0 HH21 ARG A 109 0.352 4.113 3.395 1.00 0.00 H new ATOM 0 HH22 ARG A 109 1.412 3.757 4.763 1.00 0.00 H new ATOM 1388 N HIS A 110 -2.728 3.128 0.163 1.00 0.00 N ATOM 1389 CA HIS A 110 -2.915 4.530 -0.213 1.00 0.00 C ATOM 1390 C HIS A 110 -3.796 4.666 -1.458 1.00 0.00 C ATOM 1391 O HIS A 110 -4.682 5.525 -1.509 1.00 0.00 O ATOM 1392 CB HIS A 110 -1.543 5.211 -0.417 1.00 0.00 C ATOM 1393 CG HIS A 110 -1.606 6.602 -0.979 1.00 0.00 C ATOM 1394 ND1 HIS A 110 -2.332 7.676 -0.585 1.00 0.00 N flip ATOM 1395 CD2 HIS A 110 -0.888 7.010 -2.076 1.00 0.00 C flip ATOM 1396 CE1 HIS A 110 -2.066 8.737 -1.433 1.00 0.00 C flip ATOM 1397 NE2 HIS A 110 -1.191 8.283 -2.312 1.00 0.00 N flip ATOM 0 H HIS A 110 -1.759 2.816 0.106 1.00 0.00 H new ATOM 0 HA HIS A 110 -3.435 5.036 0.600 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -1.024 5.245 0.541 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -0.942 4.592 -1.083 1.00 0.00 H new ATOM 0 HD1 HIS A 110 -2.972 7.699 0.209 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -0.199 6.404 -2.646 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -2.487 9.731 -1.386 1.00 0.00 H new ATOM 1405 N ASN A 111 -3.564 3.809 -2.432 1.00 0.00 N ATOM 1406 CA ASN A 111 -4.344 3.799 -3.668 1.00 0.00 C ATOM 1407 C ASN A 111 -5.809 3.556 -3.331 1.00 0.00 C ATOM 1408 O ASN A 111 -6.710 4.202 -3.872 1.00 0.00 O ATOM 1409 CB ASN A 111 -3.822 2.702 -4.623 1.00 0.00 C ATOM 1410 CG ASN A 111 -4.552 2.656 -5.966 1.00 0.00 C ATOM 1411 OD1 ASN A 111 -5.037 3.665 -6.463 1.00 0.00 O ATOM 1412 ND2 ASN A 111 -4.602 1.498 -6.571 1.00 0.00 N ATOM 0 H ASN A 111 -2.833 3.099 -2.396 1.00 0.00 H new ATOM 0 HA ASN A 111 -4.243 4.762 -4.169 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -2.759 2.865 -4.803 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -3.917 1.732 -4.135 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -5.054 1.418 -7.482 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -4.189 0.675 -6.132 1.00 0.00 H new ATOM 1419 N LEU A 112 -6.026 2.682 -2.376 1.00 0.00 N ATOM 1420 CA LEU A 112 -7.353 2.374 -1.915 1.00 0.00 C ATOM 1421 C LEU A 112 -7.955 3.529 -1.117 1.00 0.00 C ATOM 1422 O LEU A 112 -9.124 3.851 -1.299 1.00 0.00 O ATOM 1423 CB LEU A 112 -7.355 1.099 -1.100 1.00 0.00 C ATOM 1424 CG LEU A 112 -6.963 -0.185 -1.826 1.00 0.00 C ATOM 1425 CD1 LEU A 112 -7.162 -1.367 -0.916 1.00 0.00 C ATOM 1426 CD2 LEU A 112 -7.752 -0.366 -3.113 1.00 0.00 C ATOM 0 H LEU A 112 -5.286 2.167 -1.899 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.979 2.222 -2.794 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.676 1.233 -0.258 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.354 0.963 -0.685 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.910 -0.112 -2.097 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.881 -2.281 -1.440 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.540 -1.251 -0.028 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.209 -1.426 -0.620 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.445 -1.291 -3.601 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.817 -0.413 -2.884 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.561 0.476 -3.778 1.00 0.00 H new ATOM 1438 N ILE A 113 -7.153 4.157 -0.252 1.00 0.00 N ATOM 1439 CA ILE A 113 -7.619 5.313 0.531 1.00 0.00 C ATOM 1440 C ILE A 113 -8.122 6.421 -0.389 1.00 0.00 C ATOM 1441 O ILE A 113 -9.253 6.887 -0.242 1.00 0.00 O ATOM 1442 CB ILE A 113 -6.498 5.919 1.425 1.00 0.00 C ATOM 1443 CG1 ILE A 113 -5.929 4.879 2.408 1.00 0.00 C ATOM 1444 CG2 ILE A 113 -7.056 7.109 2.190 1.00 0.00 C ATOM 1445 CD1 ILE A 113 -6.936 4.304 3.377 1.00 0.00 C ATOM 0 H ILE A 113 -6.185 3.890 -0.075 1.00 0.00 H new ATOM 0 HA ILE A 113 -8.421 4.938 1.167 1.00 0.00 H new ATOM 0 HB ILE A 113 -5.681 6.240 0.779 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -5.489 4.062 1.836 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -5.122 5.341 2.976 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -6.274 7.537 2.818 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.408 7.862 1.485 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.886 6.782 2.816 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.443 3.582 4.028 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -7.360 5.107 3.980 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -7.733 3.808 2.822 1.00 0.00 H new ATOM 1457 N THR A 114 -7.320 6.770 -1.375 1.00 0.00 N ATOM 1458 CA THR A 114 -7.664 7.823 -2.306 1.00 0.00 C ATOM 1459 C THR A 114 -8.921 7.445 -3.123 1.00 0.00 C ATOM 1460 O THR A 114 -9.794 8.288 -3.384 1.00 0.00 O ATOM 1461 CB THR A 114 -6.464 8.120 -3.239 1.00 0.00 C ATOM 1462 OG1 THR A 114 -5.290 8.342 -2.430 1.00 0.00 O ATOM 1463 CG2 THR A 114 -6.719 9.363 -4.087 1.00 0.00 C ATOM 0 H THR A 114 -6.415 6.333 -1.552 1.00 0.00 H new ATOM 0 HA THR A 114 -7.895 8.726 -1.742 1.00 0.00 H new ATOM 0 HB THR A 114 -6.323 7.269 -3.905 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.926 7.480 -2.138 1.00 0.00 H new ATOM 0 HG21 THR A 114 -5.859 9.546 -4.732 1.00 0.00 H new ATOM 0 HG22 THR A 114 -7.607 9.209 -4.701 1.00 0.00 H new ATOM 0 HG23 THR A 114 -6.873 10.223 -3.435 1.00 0.00 H new ATOM 1471 N GLU A 115 -9.042 6.170 -3.454 1.00 0.00 N ATOM 1472 CA GLU A 115 -10.170 5.689 -4.221 1.00 0.00 C ATOM 1473 C GLU A 115 -11.449 5.716 -3.366 1.00 0.00 C ATOM 1474 O GLU A 115 -12.483 6.219 -3.794 1.00 0.00 O ATOM 1475 CB GLU A 115 -9.908 4.261 -4.707 1.00 0.00 C ATOM 1476 CG GLU A 115 -10.966 3.729 -5.654 1.00 0.00 C ATOM 1477 CD GLU A 115 -10.942 4.414 -6.998 1.00 0.00 C ATOM 1478 OE1 GLU A 115 -11.449 5.543 -7.126 1.00 0.00 O ATOM 1479 OE2 GLU A 115 -10.436 3.810 -7.964 1.00 0.00 O ATOM 0 H GLU A 115 -8.367 5.449 -3.200 1.00 0.00 H new ATOM 0 HA GLU A 115 -10.304 6.342 -5.083 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.939 4.230 -5.206 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -9.843 3.600 -3.843 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -10.817 2.658 -5.794 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -11.950 3.858 -5.203 1.00 0.00 H new ATOM 1486 N MET A 116 -11.356 5.218 -2.142 1.00 0.00 N ATOM 1487 CA MET A 116 -12.519 5.109 -1.273 1.00 0.00 C ATOM 1488 C MET A 116 -13.016 6.475 -0.808 1.00 0.00 C ATOM 1489 O MET A 116 -14.219 6.678 -0.660 1.00 0.00 O ATOM 1490 CB MET A 116 -12.263 4.167 -0.096 1.00 0.00 C ATOM 1491 CG MET A 116 -13.501 3.896 0.740 1.00 0.00 C ATOM 1492 SD MET A 116 -13.204 2.722 2.063 1.00 0.00 S ATOM 1493 CE MET A 116 -14.820 2.694 2.836 1.00 0.00 C ATOM 0 H MET A 116 -10.486 4.883 -1.727 1.00 0.00 H new ATOM 0 HA MET A 116 -13.318 4.668 -1.869 1.00 0.00 H new ATOM 0 HB2 MET A 116 -11.875 3.221 -0.475 1.00 0.00 H new ATOM 0 HB3 MET A 116 -11.490 4.596 0.542 1.00 0.00 H new ATOM 0 HG2 MET A 116 -13.858 4.834 1.166 1.00 0.00 H new ATOM 0 HG3 MET A 116 -14.293 3.516 0.095 1.00 0.00 H new ATOM 0 HE1 MET A 116 -14.730 2.312 3.853 1.00 0.00 H new ATOM 0 HE2 MET A 116 -15.228 3.704 2.863 1.00 0.00 H new ATOM 0 HE3 MET A 116 -15.486 2.049 2.263 1.00 0.00 H new ATOM 1503 N VAL A 117 -12.097 7.412 -0.607 1.00 0.00 N ATOM 1504 CA VAL A 117 -12.456 8.785 -0.263 1.00 0.00 C ATOM 1505 C VAL A 117 -13.230 9.424 -1.431 1.00 0.00 C ATOM 1506 O VAL A 117 -14.165 10.201 -1.232 1.00 0.00 O ATOM 1507 CB VAL A 117 -11.186 9.634 0.114 1.00 0.00 C ATOM 1508 CG1 VAL A 117 -11.503 11.112 0.239 1.00 0.00 C ATOM 1509 CG2 VAL A 117 -10.606 9.159 1.430 1.00 0.00 C ATOM 0 H VAL A 117 -11.093 7.246 -0.676 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.098 8.768 0.617 1.00 0.00 H new ATOM 0 HB VAL A 117 -10.467 9.496 -0.694 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.596 11.658 0.500 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.889 11.483 -0.711 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -12.252 11.259 1.017 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.728 9.756 1.677 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.352 9.268 2.217 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.320 8.111 1.344 1.00 0.00 H new ATOM 1519 N ALA A 118 -12.857 9.045 -2.642 1.00 0.00 N ATOM 1520 CA ALA A 118 -13.510 9.531 -3.842 1.00 0.00 C ATOM 1521 C ALA A 118 -14.904 8.918 -3.980 1.00 0.00 C ATOM 1522 O ALA A 118 -15.852 9.583 -4.410 1.00 0.00 O ATOM 1523 CB ALA A 118 -12.675 9.189 -5.050 1.00 0.00 C ATOM 0 H ALA A 118 -12.093 8.392 -2.819 1.00 0.00 H new ATOM 0 HA ALA A 118 -13.614 10.614 -3.770 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -13.169 9.556 -5.950 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.694 9.656 -4.959 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -12.557 8.107 -5.116 1.00 0.00 H new ATOM 1529 N LEU A 119 -15.013 7.659 -3.618 1.00 0.00 N ATOM 1530 CA LEU A 119 -16.274 6.928 -3.672 1.00 0.00 C ATOM 1531 C LEU A 119 -17.242 7.409 -2.593 1.00 0.00 C ATOM 1532 O LEU A 119 -18.417 7.688 -2.870 1.00 0.00 O ATOM 1533 CB LEU A 119 -16.018 5.425 -3.492 1.00 0.00 C ATOM 1534 CG LEU A 119 -15.148 4.749 -4.554 1.00 0.00 C ATOM 1535 CD1 LEU A 119 -14.831 3.329 -4.142 1.00 0.00 C ATOM 1536 CD2 LEU A 119 -15.841 4.755 -5.909 1.00 0.00 C ATOM 0 H LEU A 119 -14.229 7.104 -3.275 1.00 0.00 H new ATOM 0 HA LEU A 119 -16.724 7.113 -4.647 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -15.550 5.273 -2.520 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -16.981 4.916 -3.465 1.00 0.00 H new ATOM 0 HG LEU A 119 -14.219 5.312 -4.641 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -14.212 2.858 -4.905 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -14.294 3.337 -3.193 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -15.758 2.767 -4.030 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -15.202 4.269 -6.646 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -16.786 4.217 -5.837 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -16.032 5.783 -6.216 1.00 0.00 H new ATOM 1548 N ASN A 120 -16.750 7.523 -1.382 1.00 0.00 N ATOM 1549 CA ASN A 120 -17.585 7.896 -0.249 1.00 0.00 C ATOM 1550 C ASN A 120 -16.996 9.089 0.476 1.00 0.00 C ATOM 1551 O ASN A 120 -15.918 8.995 1.050 1.00 0.00 O ATOM 1552 CB ASN A 120 -17.742 6.718 0.737 1.00 0.00 C ATOM 1553 CG ASN A 120 -18.651 7.030 1.928 1.00 0.00 C ATOM 1554 OD1 ASN A 120 -19.546 7.870 1.854 1.00 0.00 O ATOM 1555 ND2 ASN A 120 -18.462 6.323 3.014 1.00 0.00 N ATOM 0 H ASN A 120 -15.770 7.363 -1.148 1.00 0.00 H new ATOM 0 HA ASN A 120 -18.569 8.161 -0.636 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -18.143 5.858 0.201 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -16.758 6.432 1.108 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -19.065 6.463 3.825 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -17.712 5.633 3.049 1.00 0.00 H new ATOM 1562 N PRO A 121 -17.703 10.221 0.484 1.00 0.00 N ATOM 1563 CA PRO A 121 -17.241 11.445 1.163 1.00 0.00 C ATOM 1564 C PRO A 121 -17.297 11.311 2.688 1.00 0.00 C ATOM 1565 O PRO A 121 -16.650 12.053 3.417 1.00 0.00 O ATOM 1566 CB PRO A 121 -18.251 12.494 0.697 1.00 0.00 C ATOM 1567 CG PRO A 121 -19.483 11.707 0.426 1.00 0.00 C ATOM 1568 CD PRO A 121 -19.013 10.425 -0.176 1.00 0.00 C ATOM 0 HA PRO A 121 -16.204 11.683 0.927 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -18.421 13.252 1.461 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -17.904 13.014 -0.196 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -20.044 11.527 1.343 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -20.147 12.240 -0.254 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -19.702 9.605 0.027 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -18.915 10.498 -1.259 1.00 0.00 H new ATOM 1576 N ASP A 122 -18.051 10.336 3.153 1.00 0.00 N ATOM 1577 CA ASP A 122 -18.226 10.106 4.582 1.00 0.00 C ATOM 1578 C ASP A 122 -17.196 9.081 5.082 1.00 0.00 C ATOM 1579 O ASP A 122 -17.225 8.643 6.224 1.00 0.00 O ATOM 1580 CB ASP A 122 -19.674 9.638 4.861 1.00 0.00 C ATOM 1581 CG ASP A 122 -20.001 9.479 6.341 1.00 0.00 C ATOM 1582 OD1 ASP A 122 -20.296 10.492 7.016 1.00 0.00 O ATOM 1583 OD2 ASP A 122 -19.990 8.334 6.848 1.00 0.00 O ATOM 0 H ASP A 122 -18.559 9.681 2.559 1.00 0.00 H new ATOM 0 HA ASP A 122 -18.059 11.036 5.126 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -20.367 10.355 4.421 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -19.840 8.685 4.359 1.00 0.00 H new ATOM 1588 N PHE A 123 -16.268 8.723 4.217 1.00 0.00 N ATOM 1589 CA PHE A 123 -15.231 7.782 4.568 1.00 0.00 C ATOM 1590 C PHE A 123 -14.174 8.441 5.441 1.00 0.00 C ATOM 1591 O PHE A 123 -13.556 9.440 5.045 1.00 0.00 O ATOM 1592 CB PHE A 123 -14.577 7.173 3.309 1.00 0.00 C ATOM 1593 CG PHE A 123 -13.343 6.336 3.581 1.00 0.00 C ATOM 1594 CD1 PHE A 123 -13.342 5.345 4.548 1.00 0.00 C ATOM 1595 CD2 PHE A 123 -12.186 6.566 2.878 1.00 0.00 C ATOM 1596 CE1 PHE A 123 -12.203 4.604 4.799 1.00 0.00 C ATOM 1597 CE2 PHE A 123 -11.044 5.836 3.114 1.00 0.00 C ATOM 1598 CZ PHE A 123 -11.048 4.849 4.079 1.00 0.00 C ATOM 0 H PHE A 123 -16.214 9.074 3.261 1.00 0.00 H new ATOM 0 HA PHE A 123 -15.698 6.976 5.134 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -15.314 6.555 2.796 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -14.309 7.981 2.628 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -14.242 5.149 5.112 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -12.172 7.338 2.123 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -12.215 3.834 5.557 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -10.147 6.035 2.546 1.00 0.00 H new ATOM 0 HZ PHE A 123 -10.155 4.272 4.270 1.00 0.00 H new ATOM 1608 N LYS A 124 -13.988 7.899 6.624 1.00 0.00 N ATOM 1609 CA LYS A 124 -12.937 8.352 7.499 1.00 0.00 C ATOM 1610 C LYS A 124 -11.762 7.417 7.317 1.00 0.00 C ATOM 1611 O LYS A 124 -11.877 6.217 7.620 1.00 0.00 O ATOM 1612 CB LYS A 124 -13.332 8.343 9.001 1.00 0.00 C ATOM 1613 CG LYS A 124 -14.562 9.159 9.405 1.00 0.00 C ATOM 1614 CD LYS A 124 -15.859 8.477 9.009 1.00 0.00 C ATOM 1615 CE LYS A 124 -17.071 9.284 9.437 1.00 0.00 C ATOM 1616 NZ LYS A 124 -18.337 8.637 9.043 1.00 0.00 N ATOM 0 H LYS A 124 -14.556 7.140 7.001 1.00 0.00 H new ATOM 0 HA LYS A 124 -12.709 9.385 7.235 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -13.500 7.308 9.300 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -12.481 8.707 9.576 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -14.552 9.318 10.483 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -14.513 10.142 8.937 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -15.880 8.334 7.929 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -15.903 7.487 9.462 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -17.054 9.417 10.519 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -17.019 10.278 8.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -19.134 9.262 9.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -18.330 8.456 8.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -18.440 7.736 9.553 1.00 0.00 H new ATOM 1630 N PRO A 125 -10.656 7.903 6.753 1.00 0.00 N ATOM 1631 CA PRO A 125 -9.453 7.102 6.591 1.00 0.00 C ATOM 1632 C PRO A 125 -8.873 6.703 7.954 1.00 0.00 C ATOM 1633 O PRO A 125 -8.942 7.484 8.911 1.00 0.00 O ATOM 1634 CB PRO A 125 -8.479 8.037 5.866 1.00 0.00 C ATOM 1635 CG PRO A 125 -9.317 9.136 5.314 1.00 0.00 C ATOM 1636 CD PRO A 125 -10.496 9.257 6.217 1.00 0.00 C ATOM 0 HA PRO A 125 -9.645 6.176 6.049 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -7.725 8.425 6.551 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -7.949 7.512 5.072 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -8.758 10.071 5.278 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -9.630 8.912 4.294 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -10.322 9.985 7.010 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -11.385 9.582 5.676 1.00 0.00 H new ATOM 1644 N PRO A 126 -8.303 5.491 8.063 1.00 0.00 N ATOM 1645 CA PRO A 126 -7.719 4.995 9.313 1.00 0.00 C ATOM 1646 C PRO A 126 -6.548 5.864 9.789 1.00 0.00 C ATOM 1647 O PRO A 126 -5.864 6.515 8.976 1.00 0.00 O ATOM 1648 CB PRO A 126 -7.223 3.587 8.942 1.00 0.00 C ATOM 1649 CG PRO A 126 -7.078 3.617 7.469 1.00 0.00 C ATOM 1650 CD PRO A 126 -8.190 4.493 6.985 1.00 0.00 C ATOM 0 HA PRO A 126 -8.438 5.006 10.132 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -6.275 3.360 9.429 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -7.933 2.822 9.255 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -6.107 4.016 7.177 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -7.152 2.616 7.045 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -7.954 4.956 6.027 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -9.117 3.935 6.850 1.00 0.00 H new ATOM 1658 N ALA A 127 -6.298 5.856 11.086 1.00 0.00 N ATOM 1659 CA ALA A 127 -5.228 6.661 11.686 1.00 0.00 C ATOM 1660 C ALA A 127 -3.851 6.162 11.265 1.00 0.00 C ATOM 1661 O ALA A 127 -2.841 6.867 11.383 1.00 0.00 O ATOM 1662 CB ALA A 127 -5.344 6.671 13.194 1.00 0.00 C ATOM 0 H ALA A 127 -6.824 5.297 11.758 1.00 0.00 H new ATOM 0 HA ALA A 127 -5.343 7.681 11.320 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -4.540 7.274 13.617 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -6.306 7.095 13.482 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.270 5.651 13.571 1.00 0.00 H new ATOM 1668 N ASP A 128 -3.816 4.963 10.736 1.00 0.00 N ATOM 1669 CA ASP A 128 -2.581 4.367 10.279 1.00 0.00 C ATOM 1670 C ASP A 128 -2.217 4.891 8.899 1.00 0.00 C ATOM 1671 O ASP A 128 -1.050 4.861 8.495 1.00 0.00 O ATOM 1672 CB ASP A 128 -2.739 2.853 10.217 1.00 0.00 C ATOM 1673 CG ASP A 128 -1.499 2.176 9.722 1.00 0.00 C ATOM 1674 OD1 ASP A 128 -0.569 1.967 10.526 1.00 0.00 O ATOM 1675 OD2 ASP A 128 -1.417 1.847 8.526 1.00 0.00 O ATOM 0 H ASP A 128 -4.639 4.374 10.610 1.00 0.00 H new ATOM 0 HA ASP A 128 -1.787 4.629 10.978 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -2.987 2.474 11.209 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -3.574 2.603 9.562 1.00 0.00 H new ATOM 1680 N TYR A 129 -3.193 5.481 8.235 1.00 0.00 N ATOM 1681 CA TYR A 129 -2.993 6.009 6.912 1.00 0.00 C ATOM 1682 C TYR A 129 -2.110 7.229 6.938 1.00 0.00 C ATOM 1683 O TYR A 129 -2.402 8.222 7.593 1.00 0.00 O ATOM 1684 CB TYR A 129 -4.334 6.282 6.193 1.00 0.00 C ATOM 1685 CG TYR A 129 -4.238 7.213 4.987 1.00 0.00 C ATOM 1686 CD1 TYR A 129 -3.310 7.006 3.968 1.00 0.00 C ATOM 1687 CD2 TYR A 129 -5.080 8.306 4.886 1.00 0.00 C ATOM 1688 CE1 TYR A 129 -3.222 7.871 2.899 1.00 0.00 C ATOM 1689 CE2 TYR A 129 -5.007 9.167 3.815 1.00 0.00 C ATOM 1690 CZ TYR A 129 -4.081 8.952 2.825 1.00 0.00 C ATOM 1691 OH TYR A 129 -3.996 9.836 1.772 1.00 0.00 O ATOM 0 H TYR A 129 -4.138 5.604 8.600 1.00 0.00 H new ATOM 0 HA TYR A 129 -2.475 5.246 6.331 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -4.755 5.331 5.867 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -5.034 6.711 6.910 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -2.649 6.153 4.017 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -5.809 8.487 5.662 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -2.487 7.706 2.125 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -5.678 10.011 3.754 1.00 0.00 H new ATOM 0 HH TYR A 129 -4.674 10.535 1.877 1.00 0.00 H new ATOM 1701 N LYS A 130 -1.023 7.116 6.258 1.00 0.00 N ATOM 1702 CA LYS A 130 -0.092 8.173 6.115 1.00 0.00 C ATOM 1703 C LYS A 130 -0.035 8.576 4.664 1.00 0.00 C ATOM 1704 O LYS A 130 0.088 7.708 3.785 1.00 0.00 O ATOM 1705 CB LYS A 130 1.276 7.718 6.574 1.00 0.00 C ATOM 1706 CG LYS A 130 1.348 7.365 8.053 1.00 0.00 C ATOM 1707 CD LYS A 130 1.093 8.589 8.928 1.00 0.00 C ATOM 1708 CE LYS A 130 1.085 8.232 10.405 1.00 0.00 C ATOM 1709 NZ LYS A 130 -0.042 7.327 10.764 1.00 0.00 N ATOM 0 H LYS A 130 -0.752 6.260 5.773 1.00 0.00 H new ATOM 0 HA LYS A 130 -0.402 9.023 6.723 1.00 0.00 H new ATOM 0 HB2 LYS A 130 1.573 6.848 5.989 1.00 0.00 H new ATOM 0 HB3 LYS A 130 1.999 8.506 6.364 1.00 0.00 H new ATOM 0 HG2 LYS A 130 0.613 6.593 8.281 1.00 0.00 H new ATOM 0 HG3 LYS A 130 2.329 6.949 8.283 1.00 0.00 H new ATOM 0 HD2 LYS A 130 1.862 9.338 8.739 1.00 0.00 H new ATOM 0 HD3 LYS A 130 0.137 9.038 8.657 1.00 0.00 H new ATOM 0 HE2 LYS A 130 2.029 7.753 10.665 1.00 0.00 H new ATOM 0 HE3 LYS A 130 1.017 9.145 10.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -0.129 7.274 11.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -0.926 7.697 10.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 0.141 6.377 10.383 1.00 0.00 H new ATOM 1723 N PRO A 131 -0.185 9.864 4.383 1.00 0.00 N ATOM 1724 CA PRO A 131 -0.075 10.380 3.031 1.00 0.00 C ATOM 1725 C PRO A 131 1.386 10.370 2.561 1.00 0.00 C ATOM 1726 O PRO A 131 2.316 10.426 3.385 1.00 0.00 O ATOM 1727 CB PRO A 131 -0.588 11.815 3.159 1.00 0.00 C ATOM 1728 CG PRO A 131 -0.312 12.185 4.573 1.00 0.00 C ATOM 1729 CD PRO A 131 -0.490 10.931 5.364 1.00 0.00 C ATOM 0 HA PRO A 131 -0.630 9.788 2.303 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -0.075 12.483 2.467 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -1.652 11.878 2.933 1.00 0.00 H new ATOM 0 HG2 PRO A 131 0.699 12.577 4.684 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -0.995 12.963 4.914 1.00 0.00 H new ATOM 0 HD2 PRO A 131 0.184 10.896 6.220 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -1.504 10.842 5.754 1.00 0.00 H new ATOM 1737 N PRO A 132 1.610 10.283 1.254 1.00 0.00 N ATOM 1738 CA PRO A 132 2.950 10.267 0.688 1.00 0.00 C ATOM 1739 C PRO A 132 3.619 11.631 0.799 1.00 0.00 C ATOM 1740 O PRO A 132 2.953 12.652 1.013 1.00 0.00 O ATOM 1741 CB PRO A 132 2.712 9.914 -0.785 1.00 0.00 C ATOM 1742 CG PRO A 132 1.330 10.379 -1.064 1.00 0.00 C ATOM 1743 CD PRO A 132 0.569 10.204 0.216 1.00 0.00 C ATOM 0 HA PRO A 132 3.609 9.568 1.204 1.00 0.00 H new ATOM 0 HB2 PRO A 132 3.435 10.409 -1.433 1.00 0.00 H new ATOM 0 HB3 PRO A 132 2.812 8.842 -0.957 1.00 0.00 H new ATOM 0 HG2 PRO A 132 1.326 11.422 -1.381 1.00 0.00 H new ATOM 0 HG3 PRO A 132 0.878 9.799 -1.869 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -0.184 10.982 0.344 1.00 0.00 H new ATOM 0 HD3 PRO A 132 0.047 9.247 0.244 1.00 0.00 H new ATOM 1751 N ALA A 133 4.917 11.653 0.700 1.00 0.00 N ATOM 1752 CA ALA A 133 5.631 12.896 0.728 1.00 0.00 C ATOM 1753 C ALA A 133 5.810 13.423 -0.681 1.00 0.00 C ATOM 1754 O ALA A 133 5.319 14.496 -1.027 1.00 0.00 O ATOM 1755 CB ALA A 133 6.959 12.727 1.430 1.00 0.00 C ATOM 0 H ALA A 133 5.502 10.824 0.599 1.00 0.00 H new ATOM 0 HA ALA A 133 5.052 13.628 1.291 1.00 0.00 H new ATOM 0 HB1 ALA A 133 7.488 13.680 1.442 1.00 0.00 H new ATOM 0 HB2 ALA A 133 6.790 12.393 2.454 1.00 0.00 H new ATOM 0 HB3 ALA A 133 7.558 11.986 0.901 1.00 0.00 H new ATOM 1761 N THR A 134 6.464 12.657 -1.489 1.00 0.00 N ATOM 1762 CA THR A 134 6.731 13.029 -2.856 1.00 0.00 C ATOM 1763 C THR A 134 6.231 11.952 -3.814 1.00 0.00 C ATOM 1764 O THR A 134 6.026 10.794 -3.408 1.00 0.00 O ATOM 1765 CB THR A 134 8.246 13.241 -3.060 1.00 0.00 C ATOM 1766 OG1 THR A 134 8.965 12.150 -2.465 1.00 0.00 O ATOM 1767 CG2 THR A 134 8.713 14.550 -2.447 1.00 0.00 C ATOM 0 H THR A 134 6.836 11.744 -1.225 1.00 0.00 H new ATOM 0 HA THR A 134 6.204 13.959 -3.068 1.00 0.00 H new ATOM 0 HB THR A 134 8.442 13.281 -4.132 1.00 0.00 H new ATOM 0 HG1 THR A 134 9.927 12.283 -2.595 1.00 0.00 H new ATOM 0 HG21 THR A 134 9.785 14.666 -2.610 1.00 0.00 H new ATOM 0 HG22 THR A 134 8.183 15.380 -2.914 1.00 0.00 H new ATOM 0 HG23 THR A 134 8.507 14.544 -1.377 1.00 0.00 H new ATOM 1775 N ARG A 135 5.987 12.335 -5.056 1.00 0.00 N ATOM 1776 CA ARG A 135 5.619 11.392 -6.085 1.00 0.00 C ATOM 1777 C ARG A 135 6.843 10.608 -6.520 1.00 0.00 C ATOM 1778 O ARG A 135 7.680 11.117 -7.273 1.00 0.00 O ATOM 1779 CB ARG A 135 5.037 12.088 -7.321 1.00 0.00 C ATOM 1780 CG ARG A 135 3.614 12.624 -7.219 1.00 0.00 C ATOM 1781 CD ARG A 135 2.601 11.499 -7.032 1.00 0.00 C ATOM 1782 NE ARG A 135 1.287 11.855 -7.595 1.00 0.00 N ATOM 1783 CZ ARG A 135 0.093 11.537 -7.078 1.00 0.00 C ATOM 1784 NH1 ARG A 135 0.011 10.893 -5.915 1.00 0.00 N ATOM 1785 NH2 ARG A 135 -1.018 11.874 -7.729 1.00 0.00 N ATOM 0 H ARG A 135 6.039 13.303 -5.373 1.00 0.00 H new ATOM 0 HA ARG A 135 4.860 10.734 -5.662 1.00 0.00 H new ATOM 0 HB2 ARG A 135 5.693 12.920 -7.579 1.00 0.00 H new ATOM 0 HB3 ARG A 135 5.073 11.384 -8.152 1.00 0.00 H new ATOM 0 HG2 ARG A 135 3.546 13.319 -6.382 1.00 0.00 H new ATOM 0 HG3 ARG A 135 3.371 13.187 -8.120 1.00 0.00 H new ATOM 0 HD2 ARG A 135 2.970 10.593 -7.512 1.00 0.00 H new ATOM 0 HD3 ARG A 135 2.495 11.277 -5.970 1.00 0.00 H new ATOM 0 HE ARG A 135 1.286 12.395 -8.460 1.00 0.00 H new ATOM 0 HH11 ARG A 135 0.861 10.639 -5.412 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -0.902 10.654 -5.528 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -0.958 12.372 -8.617 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -1.930 11.634 -7.340 1.00 0.00 H new ATOM 1799 N VAL A 136 6.978 9.419 -6.016 1.00 0.00 N ATOM 1800 CA VAL A 136 8.048 8.527 -6.434 1.00 0.00 C ATOM 1801 C VAL A 136 7.615 7.883 -7.743 1.00 0.00 C ATOM 1802 O VAL A 136 8.418 7.539 -8.620 1.00 0.00 O ATOM 1803 CB VAL A 136 8.328 7.432 -5.360 1.00 0.00 C ATOM 1804 CG1 VAL A 136 9.502 6.541 -5.759 1.00 0.00 C ATOM 1805 CG2 VAL A 136 8.575 8.062 -3.993 1.00 0.00 C ATOM 0 H VAL A 136 6.359 9.029 -5.305 1.00 0.00 H new ATOM 0 HA VAL A 136 8.972 9.090 -6.562 1.00 0.00 H new ATOM 0 HB VAL A 136 7.440 6.803 -5.296 1.00 0.00 H new ATOM 0 HG11 VAL A 136 9.668 5.790 -4.987 1.00 0.00 H new ATOM 0 HG12 VAL A 136 9.279 6.046 -6.704 1.00 0.00 H new ATOM 0 HG13 VAL A 136 10.399 7.150 -5.871 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.768 7.278 -3.261 1.00 0.00 H new ATOM 0 HG22 VAL A 136 9.437 8.726 -4.049 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.697 8.632 -3.691 1.00 0.00 H new ATOM 1815 N SER A 137 6.331 7.737 -7.857 1.00 0.00 N ATOM 1816 CA SER A 137 5.688 7.216 -9.026 1.00 0.00 C ATOM 1817 C SER A 137 4.356 7.953 -9.225 1.00 0.00 C ATOM 1818 O SER A 137 3.384 7.698 -8.523 1.00 0.00 O ATOM 1819 CB SER A 137 5.474 5.705 -8.872 1.00 0.00 C ATOM 1820 OG SER A 137 6.716 5.061 -8.591 1.00 0.00 O ATOM 0 H SER A 137 5.678 7.986 -7.114 1.00 0.00 H new ATOM 0 HA SER A 137 6.312 7.374 -9.906 1.00 0.00 H new ATOM 0 HB2 SER A 137 4.764 5.510 -8.068 1.00 0.00 H new ATOM 0 HB3 SER A 137 5.042 5.296 -9.785 1.00 0.00 H new ATOM 0 HG SER A 137 6.570 4.097 -8.493 1.00 0.00 H new ATOM 1826 N ASP A 138 4.354 8.926 -10.121 1.00 0.00 N ATOM 1827 CA ASP A 138 3.142 9.722 -10.403 1.00 0.00 C ATOM 1828 C ASP A 138 2.380 9.113 -11.561 1.00 0.00 C ATOM 1829 O ASP A 138 1.158 9.030 -11.558 1.00 0.00 O ATOM 1830 CB ASP A 138 3.523 11.169 -10.736 1.00 0.00 C ATOM 1831 CG ASP A 138 2.331 12.026 -11.111 1.00 0.00 C ATOM 1832 OD1 ASP A 138 1.567 12.430 -10.224 1.00 0.00 O ATOM 1833 OD2 ASP A 138 2.147 12.312 -12.314 1.00 0.00 O ATOM 0 H ASP A 138 5.170 9.193 -10.672 1.00 0.00 H new ATOM 0 HA ASP A 138 2.508 9.719 -9.516 1.00 0.00 H new ATOM 0 HB2 ASP A 138 4.026 11.613 -9.877 1.00 0.00 H new ATOM 0 HB3 ASP A 138 4.237 11.170 -11.559 1.00 0.00 H new ATOM 1838 N LYS A 139 3.146 8.667 -12.517 1.00 0.00 N ATOM 1839 CA LYS A 139 2.707 8.022 -13.749 1.00 0.00 C ATOM 1840 C LYS A 139 3.967 7.741 -14.518 1.00 0.00 C ATOM 1841 O LYS A 139 4.064 6.810 -15.308 1.00 0.00 O ATOM 1842 CB LYS A 139 1.698 8.866 -14.573 1.00 0.00 C ATOM 1843 CG LYS A 139 2.187 10.230 -15.038 1.00 0.00 C ATOM 1844 CD LYS A 139 1.123 10.943 -15.866 1.00 0.00 C ATOM 1845 CE LYS A 139 -0.106 11.344 -15.042 1.00 0.00 C ATOM 1846 NZ LYS A 139 0.191 12.411 -14.057 1.00 0.00 N ATOM 0 H LYS A 139 4.162 8.744 -12.465 1.00 0.00 H new ATOM 0 HA LYS A 139 2.150 7.113 -13.524 1.00 0.00 H new ATOM 0 HB2 LYS A 139 1.405 8.289 -15.450 1.00 0.00 H new ATOM 0 HB3 LYS A 139 0.800 9.010 -13.972 1.00 0.00 H new ATOM 0 HG2 LYS A 139 2.448 10.840 -14.173 1.00 0.00 H new ATOM 0 HG3 LYS A 139 3.094 10.112 -15.630 1.00 0.00 H new ATOM 0 HD2 LYS A 139 1.558 11.835 -16.317 1.00 0.00 H new ATOM 0 HD3 LYS A 139 0.810 10.293 -16.683 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -0.894 11.684 -15.714 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -0.489 10.468 -14.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -0.691 12.716 -13.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 0.847 12.046 -13.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 0.626 13.221 -14.543 1.00 0.00 H new ATOM 1860 N VAL A 140 4.926 8.602 -14.276 1.00 0.00 N ATOM 1861 CA VAL A 140 6.290 8.390 -14.646 1.00 0.00 C ATOM 1862 C VAL A 140 7.003 7.998 -13.357 1.00 0.00 C ATOM 1863 O VAL A 140 6.596 8.461 -12.260 1.00 0.00 O ATOM 1864 CB VAL A 140 6.946 9.670 -15.263 1.00 0.00 C ATOM 1865 CG1 VAL A 140 6.287 10.030 -16.587 1.00 0.00 C ATOM 1866 CG2 VAL A 140 6.877 10.862 -14.307 1.00 0.00 C ATOM 0 H VAL A 140 4.767 9.491 -13.803 1.00 0.00 H new ATOM 0 HA VAL A 140 6.363 7.622 -15.416 1.00 0.00 H new ATOM 0 HB VAL A 140 7.997 9.438 -15.438 1.00 0.00 H new ATOM 0 HG11 VAL A 140 6.759 10.923 -16.997 1.00 0.00 H new ATOM 0 HG12 VAL A 140 6.403 9.203 -17.288 1.00 0.00 H new ATOM 0 HG13 VAL A 140 5.226 10.222 -16.425 1.00 0.00 H new ATOM 0 HG21 VAL A 140 7.343 11.730 -14.773 1.00 0.00 H new ATOM 0 HG22 VAL A 140 5.835 11.087 -14.081 1.00 0.00 H new ATOM 0 HG23 VAL A 140 7.404 10.619 -13.384 1.00 0.00 H new ATOM 1876 N MET A 141 7.955 7.115 -13.434 1.00 0.00 N ATOM 1877 CA MET A 141 8.668 6.694 -12.245 1.00 0.00 C ATOM 1878 C MET A 141 10.151 6.738 -12.465 1.00 0.00 C ATOM 1879 O MET A 141 10.645 6.314 -13.506 1.00 0.00 O ATOM 1880 CB MET A 141 8.230 5.297 -11.756 1.00 0.00 C ATOM 1881 CG MET A 141 8.442 4.163 -12.752 1.00 0.00 C ATOM 1882 SD MET A 141 7.955 2.559 -12.087 1.00 0.00 S ATOM 1883 CE MET A 141 8.163 1.535 -13.534 1.00 0.00 C ATOM 0 H MET A 141 8.261 6.669 -14.299 1.00 0.00 H new ATOM 0 HA MET A 141 8.410 7.402 -11.458 1.00 0.00 H new ATOM 0 HB2 MET A 141 8.775 5.063 -10.842 1.00 0.00 H new ATOM 0 HB3 MET A 141 7.172 5.336 -11.495 1.00 0.00 H new ATOM 0 HG2 MET A 141 7.869 4.367 -13.657 1.00 0.00 H new ATOM 0 HG3 MET A 141 9.493 4.129 -13.041 1.00 0.00 H new ATOM 0 HE1 MET A 141 7.901 0.505 -13.291 1.00 0.00 H new ATOM 0 HE2 MET A 141 7.514 1.896 -14.332 1.00 0.00 H new ATOM 0 HE3 MET A 141 9.201 1.578 -13.864 1.00 0.00 H new ATOM 1893 N ILE A 142 10.855 7.288 -11.524 1.00 0.00 N ATOM 1894 CA ILE A 142 12.290 7.321 -11.589 1.00 0.00 C ATOM 1895 C ILE A 142 12.834 6.230 -10.666 1.00 0.00 C ATOM 1896 O ILE A 142 12.634 6.294 -9.444 1.00 0.00 O ATOM 1897 CB ILE A 142 12.905 8.734 -11.213 1.00 0.00 C ATOM 1898 CG1 ILE A 142 12.591 9.821 -12.282 1.00 0.00 C ATOM 1899 CG2 ILE A 142 14.418 8.645 -11.006 1.00 0.00 C ATOM 1900 CD1 ILE A 142 11.139 10.250 -12.390 1.00 0.00 C ATOM 0 H ILE A 142 10.457 7.725 -10.693 1.00 0.00 H new ATOM 0 HA ILE A 142 12.588 7.141 -12.622 1.00 0.00 H new ATOM 0 HB ILE A 142 12.431 9.031 -10.278 1.00 0.00 H new ATOM 0 HG12 ILE A 142 13.194 10.702 -12.063 1.00 0.00 H new ATOM 0 HG13 ILE A 142 12.912 9.449 -13.255 1.00 0.00 H new ATOM 0 HG21 ILE A 142 14.809 9.630 -10.750 1.00 0.00 H new ATOM 0 HG22 ILE A 142 14.634 7.947 -10.197 1.00 0.00 H new ATOM 0 HG23 ILE A 142 14.891 8.295 -11.924 1.00 0.00 H new ATOM 0 HD11 ILE A 142 11.041 11.010 -13.166 1.00 0.00 H new ATOM 0 HD12 ILE A 142 10.523 9.388 -12.646 1.00 0.00 H new ATOM 0 HD13 ILE A 142 10.809 10.661 -11.436 1.00 0.00 H new ATOM 1912 N PRO A 143 13.449 5.178 -11.239 1.00 0.00 N ATOM 1913 CA PRO A 143 14.049 4.086 -10.467 1.00 0.00 C ATOM 1914 C PRO A 143 15.223 4.567 -9.610 1.00 0.00 C ATOM 1915 O PRO A 143 15.831 5.620 -9.886 1.00 0.00 O ATOM 1916 CB PRO A 143 14.537 3.090 -11.533 1.00 0.00 C ATOM 1917 CG PRO A 143 13.819 3.473 -12.778 1.00 0.00 C ATOM 1918 CD PRO A 143 13.590 4.949 -12.687 1.00 0.00 C ATOM 0 HA PRO A 143 13.335 3.650 -9.768 1.00 0.00 H new ATOM 0 HB2 PRO A 143 15.617 3.152 -11.666 1.00 0.00 H new ATOM 0 HB3 PRO A 143 14.310 2.063 -11.247 1.00 0.00 H new ATOM 0 HG2 PRO A 143 14.408 3.224 -13.660 1.00 0.00 H new ATOM 0 HG3 PRO A 143 12.874 2.936 -12.864 1.00 0.00 H new ATOM 0 HD2 PRO A 143 14.424 5.513 -13.105 1.00 0.00 H new ATOM 0 HD3 PRO A 143 12.696 5.252 -13.232 1.00 0.00 H new ATOM 1926 N GLN A 144 15.539 3.812 -8.598 1.00 0.00 N ATOM 1927 CA GLN A 144 16.595 4.164 -7.685 1.00 0.00 C ATOM 1928 C GLN A 144 17.906 3.691 -8.272 1.00 0.00 C ATOM 1929 O GLN A 144 18.002 2.542 -8.728 1.00 0.00 O ATOM 1930 CB GLN A 144 16.376 3.529 -6.289 1.00 0.00 C ATOM 1931 CG GLN A 144 15.196 4.074 -5.446 1.00 0.00 C ATOM 1932 CD GLN A 144 13.819 3.897 -6.077 1.00 0.00 C ATOM 1933 OE1 GLN A 144 13.165 2.870 -5.900 1.00 0.00 O ATOM 1934 NE2 GLN A 144 13.357 4.898 -6.787 1.00 0.00 N ATOM 0 H GLN A 144 15.072 2.932 -8.379 1.00 0.00 H new ATOM 0 HA GLN A 144 16.604 5.246 -7.549 1.00 0.00 H new ATOM 0 HB2 GLN A 144 16.230 2.457 -6.423 1.00 0.00 H new ATOM 0 HB3 GLN A 144 17.292 3.656 -5.712 1.00 0.00 H new ATOM 0 HG2 GLN A 144 15.202 3.577 -4.476 1.00 0.00 H new ATOM 0 HG3 GLN A 144 15.361 5.135 -5.261 1.00 0.00 H new ATOM 0 HE21 GLN A 144 13.924 5.736 -6.916 1.00 0.00 H new ATOM 0 HE22 GLN A 144 12.431 4.838 -7.211 1.00 0.00 H new ATOM 1943 N ASP A 145 18.885 4.595 -8.272 1.00 0.00 N ATOM 1944 CA ASP A 145 20.222 4.397 -8.862 1.00 0.00 C ATOM 1945 C ASP A 145 20.175 4.569 -10.353 1.00 0.00 C ATOM 1946 O ASP A 145 19.845 3.613 -11.086 1.00 0.00 O ATOM 1947 CB ASP A 145 20.930 3.081 -8.471 1.00 0.00 C ATOM 1948 CG ASP A 145 21.318 3.020 -7.022 1.00 0.00 C ATOM 1949 OD1 ASP A 145 22.223 3.771 -6.596 1.00 0.00 O ATOM 1950 OD2 ASP A 145 20.727 2.229 -6.265 1.00 0.00 O ATOM 1951 OXT ASP A 145 20.429 5.689 -10.821 1.00 0.00 O ATOM 0 H ASP A 145 18.773 5.517 -7.850 1.00 0.00 H new ATOM 0 HA ASP A 145 20.843 5.178 -8.422 1.00 0.00 H new ATOM 0 HB2 ASP A 145 20.273 2.242 -8.699 1.00 0.00 H new ATOM 0 HB3 ASP A 145 21.823 2.962 -9.084 1.00 0.00 H new TER 1956 ASP A 145