USER MOD reduce.3.24.130724 H: found=0, std=0, add=884, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 880 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -120:sc= 0.0905 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS :FLIP no HD1:sc= -0.0717 F(o=-0.61,f=-0.072) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -0.301 X(o=-0.3,f=-0.54) USER MOD Single : A 25 ASN : amide:sc= -0.267 X(o=-0.27,f=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 32 LYS NZ :NH3+ -165:sc= 0.186 (180deg=0.129) USER MOD Single : A 33 GLN : amide:sc=-0.00871 K(o=-0.0087,f=-1.4) USER MOD Single : A 43 GLN : amide:sc= -0.812 X(o=-0.81,f=-0.84) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.197 USER MOD Single : A 50 TYR OH : rot 30:sc= -1.13 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -1.77 K(o=-1.8,f=-2.8!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= -1.74 X(o=-1.7,f=-1.3) USER MOD Single : A 64 CYS SG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot -33:sc= 0.458 USER MOD Single : A 70 ASN :FLIP amide:sc= -0.0288 F(o=-0.6,f=-0.029) USER MOD Single : A 71 LYS NZ :NH3+ -125:sc= -1.59 (180deg=-4.39!) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot -74:sc= 1.12 USER MOD Single : A 79 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0209) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 81 CYS SG : rot -111:sc= -1.1 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 CYS SG : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HE2:sc= -0.127 K(o=-0.13,f=-0.71) USER MOD Single : A 92 THR OG1 : rot 85:sc= 0.858 USER MOD Single : A 93 TYR OH : rot 50:sc= 0.337 USER MOD Single : A 101 ASN : amide:sc= -1.46 K(o=-1.5,f=-2.4!) USER MOD Single : A 104 CYS SG : rot 22:sc= 0.749 USER MOD Single : A 106 GLN : amide:sc= -0.143 X(o=-0.14,f=-0.009) USER MOD Single : A 109 TYR OH : rot -171:sc= 0.00114 USER MOD Single : A 110 ASN : amide:sc= -5.16! C(o=-5.2!,f=-19!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 29.596 -9.799 24.887 1.00 0.00 N ATOM 2 CA GLY A 1 28.172 -9.543 24.779 1.00 0.00 C ATOM 3 C GLY A 1 27.851 -8.471 23.757 1.00 0.00 C ATOM 4 O GLY A 1 28.748 -7.939 23.103 1.00 0.00 O ATOM 0 H1 GLY A 1 29.789 -10.794 24.652 1.00 0.00 H new ATOM 0 H2 GLY A 1 30.111 -9.181 24.228 1.00 0.00 H new ATOM 0 H3 GLY A 1 29.911 -9.606 25.859 1.00 0.00 H new ATOM 0 HA2 GLY A 1 27.660 -10.466 24.506 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.786 -9.240 25.752 1.00 0.00 H new ATOM 8 N SER A 2 26.568 -8.154 23.617 1.00 0.00 N ATOM 9 CA SER A 2 26.130 -7.142 22.663 1.00 0.00 C ATOM 10 C SER A 2 24.930 -6.370 23.202 1.00 0.00 C ATOM 11 O SER A 2 24.373 -6.715 24.244 1.00 0.00 O ATOM 12 CB SER A 2 25.774 -7.793 21.325 1.00 0.00 C ATOM 13 OG SER A 2 24.479 -8.366 21.365 1.00 0.00 O ATOM 0 H SER A 2 25.813 -8.583 24.152 1.00 0.00 H new ATOM 0 HA SER A 2 26.951 -6.441 22.511 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.821 -7.048 20.531 1.00 0.00 H new ATOM 0 HB3 SER A 2 26.508 -8.562 21.085 1.00 0.00 H new ATOM 0 HG SER A 2 24.275 -8.774 20.498 1.00 0.00 H new ATOM 19 N SER A 3 24.535 -5.324 22.482 1.00 0.00 N ATOM 20 CA SER A 3 23.403 -4.500 22.889 1.00 0.00 C ATOM 21 C SER A 3 22.917 -3.635 21.730 1.00 0.00 C ATOM 22 O SER A 3 23.711 -3.161 20.919 1.00 0.00 O ATOM 23 CB SER A 3 23.790 -3.614 24.075 1.00 0.00 C ATOM 24 OG SER A 3 22.646 -3.222 24.813 1.00 0.00 O ATOM 0 H SER A 3 24.982 -5.028 21.614 1.00 0.00 H new ATOM 0 HA SER A 3 22.592 -5.163 23.190 1.00 0.00 H new ATOM 0 HB2 SER A 3 24.479 -4.152 24.725 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.316 -2.729 23.716 1.00 0.00 H new ATOM 0 HG SER A 3 22.920 -2.658 25.566 1.00 0.00 H new ATOM 30 N GLY A 4 21.604 -3.434 21.660 1.00 0.00 N ATOM 31 CA GLY A 4 21.033 -2.627 20.597 1.00 0.00 C ATOM 32 C GLY A 4 20.447 -1.327 21.109 1.00 0.00 C ATOM 33 O GLY A 4 21.169 -0.352 21.317 1.00 0.00 O ATOM 0 H GLY A 4 20.926 -3.815 22.320 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.803 -2.409 19.857 1.00 0.00 H new ATOM 0 HA3 GLY A 4 20.255 -3.198 20.089 1.00 0.00 H new ATOM 37 N SER A 5 19.133 -1.310 21.310 1.00 0.00 N ATOM 38 CA SER A 5 18.449 -0.117 21.795 1.00 0.00 C ATOM 39 C SER A 5 18.518 1.005 20.765 1.00 0.00 C ATOM 40 O SER A 5 18.691 2.173 21.113 1.00 0.00 O ATOM 41 CB SER A 5 19.065 0.348 23.116 1.00 0.00 C ATOM 42 OG SER A 5 18.142 1.121 23.864 1.00 0.00 O ATOM 0 H SER A 5 18.521 -2.109 21.144 1.00 0.00 H new ATOM 0 HA SER A 5 17.402 -0.370 21.960 1.00 0.00 H new ATOM 0 HB2 SER A 5 19.377 -0.518 23.700 1.00 0.00 H new ATOM 0 HB3 SER A 5 19.960 0.937 22.916 1.00 0.00 H new ATOM 0 HG SER A 5 18.559 1.405 24.704 1.00 0.00 H new ATOM 48 N SER A 6 18.382 0.642 19.493 1.00 0.00 N ATOM 49 CA SER A 6 18.433 1.618 18.410 1.00 0.00 C ATOM 50 C SER A 6 17.210 1.490 17.506 1.00 0.00 C ATOM 51 O SER A 6 16.608 0.422 17.405 1.00 0.00 O ATOM 52 CB SER A 6 19.710 1.433 17.589 1.00 0.00 C ATOM 53 OG SER A 6 20.781 2.183 18.135 1.00 0.00 O ATOM 0 H SER A 6 18.236 -0.320 19.187 1.00 0.00 H new ATOM 0 HA SER A 6 18.434 2.615 18.851 1.00 0.00 H new ATOM 0 HB2 SER A 6 19.978 0.377 17.562 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.532 1.744 16.559 1.00 0.00 H new ATOM 0 HG SER A 6 21.586 2.046 17.593 1.00 0.00 H new ATOM 59 N GLY A 7 16.849 2.589 16.851 1.00 0.00 N ATOM 60 CA GLY A 7 15.701 2.580 15.964 1.00 0.00 C ATOM 61 C GLY A 7 15.360 3.962 15.442 1.00 0.00 C ATOM 62 O GLY A 7 16.249 4.732 15.076 1.00 0.00 O ATOM 0 H GLY A 7 17.331 3.485 16.919 1.00 0.00 H new ATOM 0 HA2 GLY A 7 15.901 1.917 15.123 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.840 2.172 16.494 1.00 0.00 H new ATOM 66 N HIS A 8 14.070 4.278 15.406 1.00 0.00 N ATOM 67 CA HIS A 8 13.614 5.577 14.924 1.00 0.00 C ATOM 68 C HIS A 8 13.978 5.769 13.455 1.00 0.00 C ATOM 69 O HIS A 8 14.374 6.859 13.042 1.00 0.00 O ATOM 70 CB HIS A 8 14.224 6.699 15.764 1.00 0.00 C ATOM 71 CG HIS A 8 13.475 7.993 15.669 1.00 0.00 C ATOM 72 ND1 HIS A 8 12.635 8.462 14.717 1.00 0.00 N flip ATOM 73 CD2 HIS A 8 13.549 8.977 16.632 1.00 0.00 C flip ATOM 74 CE1 HIS A 8 12.220 9.708 15.118 1.00 0.00 C flip ATOM 75 NE2 HIS A 8 12.785 9.995 16.277 1.00 0.00 N flip ATOM 0 H HIS A 8 13.322 3.653 15.705 1.00 0.00 H new ATOM 0 HA HIS A 8 12.529 5.612 15.019 1.00 0.00 H new ATOM 0 HB2 HIS A 8 14.258 6.384 16.807 1.00 0.00 H new ATOM 0 HB3 HIS A 8 15.254 6.861 15.446 1.00 0.00 H new ATOM 0 HD2 HIS A 8 14.139 8.924 17.535 1.00 0.00 H new ATOM 0 HE1 HIS A 8 11.542 10.349 14.574 1.00 0.00 H new ATOM 0 HE2 HIS A 8 12.654 10.856 16.808 1.00 0.00 H new ATOM 83 N GLU A 9 13.842 4.704 12.671 1.00 0.00 N ATOM 84 CA GLU A 9 14.159 4.757 11.249 1.00 0.00 C ATOM 85 C GLU A 9 12.956 4.338 10.408 1.00 0.00 C ATOM 86 O GLU A 9 11.953 3.860 10.936 1.00 0.00 O ATOM 87 CB GLU A 9 15.354 3.853 10.936 1.00 0.00 C ATOM 88 CG GLU A 9 15.059 2.373 11.108 1.00 0.00 C ATOM 89 CD GLU A 9 16.054 1.491 10.379 1.00 0.00 C ATOM 90 OE1 GLU A 9 17.260 1.574 10.693 1.00 0.00 O ATOM 91 OE2 GLU A 9 15.628 0.719 9.495 1.00 0.00 O ATOM 0 H GLU A 9 13.515 3.795 12.997 1.00 0.00 H new ATOM 0 HA GLU A 9 14.416 5.786 10.998 1.00 0.00 H new ATOM 0 HB2 GLU A 9 15.677 4.034 9.911 1.00 0.00 H new ATOM 0 HB3 GLU A 9 16.186 4.127 11.585 1.00 0.00 H new ATOM 0 HG2 GLU A 9 15.069 2.125 12.169 1.00 0.00 H new ATOM 0 HG3 GLU A 9 14.055 2.162 10.741 1.00 0.00 H new ATOM 98 N GLU A 10 13.067 4.521 9.096 1.00 0.00 N ATOM 99 CA GLU A 10 11.988 4.164 8.182 1.00 0.00 C ATOM 100 C GLU A 10 11.625 2.688 8.320 1.00 0.00 C ATOM 101 O GLU A 10 12.501 1.827 8.390 1.00 0.00 O ATOM 102 CB GLU A 10 12.391 4.468 6.738 1.00 0.00 C ATOM 103 CG GLU A 10 13.578 3.653 6.252 1.00 0.00 C ATOM 104 CD GLU A 10 14.120 4.146 4.925 1.00 0.00 C ATOM 105 OE1 GLU A 10 14.028 5.363 4.660 1.00 0.00 O ATOM 106 OE2 GLU A 10 14.638 3.314 4.150 1.00 0.00 O ATOM 0 H GLU A 10 13.892 4.914 8.643 1.00 0.00 H new ATOM 0 HA GLU A 10 11.114 4.762 8.441 1.00 0.00 H new ATOM 0 HB2 GLU A 10 11.539 4.279 6.085 1.00 0.00 H new ATOM 0 HB3 GLU A 10 12.629 5.528 6.652 1.00 0.00 H new ATOM 0 HG2 GLU A 10 14.370 3.690 7.000 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.281 2.609 6.154 1.00 0.00 H new ATOM 113 N GLU A 11 10.327 2.405 8.358 1.00 0.00 N ATOM 114 CA GLU A 11 9.848 1.034 8.488 1.00 0.00 C ATOM 115 C GLU A 11 9.446 0.466 7.130 1.00 0.00 C ATOM 116 O GLU A 11 8.318 0.656 6.676 1.00 0.00 O ATOM 117 CB GLU A 11 8.659 0.975 9.450 1.00 0.00 C ATOM 118 CG GLU A 11 8.457 -0.391 10.084 1.00 0.00 C ATOM 119 CD GLU A 11 8.053 -1.449 9.075 1.00 0.00 C ATOM 120 OE1 GLU A 11 6.958 -1.321 8.489 1.00 0.00 O ATOM 121 OE2 GLU A 11 8.832 -2.404 8.872 1.00 0.00 O ATOM 0 H GLU A 11 9.589 3.106 8.301 1.00 0.00 H new ATOM 0 HA GLU A 11 10.661 0.429 8.889 1.00 0.00 H new ATOM 0 HB2 GLU A 11 8.803 1.714 10.238 1.00 0.00 H new ATOM 0 HB3 GLU A 11 7.753 1.254 8.912 1.00 0.00 H new ATOM 0 HG2 GLU A 11 9.379 -0.698 10.577 1.00 0.00 H new ATOM 0 HG3 GLU A 11 7.691 -0.319 10.856 1.00 0.00 H new ATOM 128 N GLU A 12 10.378 -0.231 6.488 1.00 0.00 N ATOM 129 CA GLU A 12 10.121 -0.825 5.181 1.00 0.00 C ATOM 130 C GLU A 12 9.252 0.094 4.327 1.00 0.00 C ATOM 131 O GLU A 12 8.498 -0.367 3.469 1.00 0.00 O ATOM 132 CB GLU A 12 9.440 -2.186 5.340 1.00 0.00 C ATOM 133 CG GLU A 12 10.416 -3.345 5.453 1.00 0.00 C ATOM 134 CD GLU A 12 9.824 -4.656 4.972 1.00 0.00 C ATOM 135 OE1 GLU A 12 9.122 -5.317 5.765 1.00 0.00 O ATOM 136 OE2 GLU A 12 10.063 -5.020 3.802 1.00 0.00 O ATOM 0 H GLU A 12 11.317 -0.398 6.851 1.00 0.00 H new ATOM 0 HA GLU A 12 11.078 -0.962 4.678 1.00 0.00 H new ATOM 0 HB2 GLU A 12 8.809 -2.166 6.228 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.784 -2.356 4.487 1.00 0.00 H new ATOM 0 HG2 GLU A 12 11.310 -3.120 4.872 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.729 -3.451 6.492 1.00 0.00 H new ATOM 143 N LEU A 13 9.364 1.395 4.567 1.00 0.00 N ATOM 144 CA LEU A 13 8.589 2.381 3.821 1.00 0.00 C ATOM 145 C LEU A 13 9.506 3.389 3.136 1.00 0.00 C ATOM 146 O LEU A 13 10.662 3.557 3.524 1.00 0.00 O ATOM 147 CB LEU A 13 7.619 3.108 4.754 1.00 0.00 C ATOM 148 CG LEU A 13 8.239 4.142 5.693 1.00 0.00 C ATOM 149 CD1 LEU A 13 8.412 5.475 4.981 1.00 0.00 C ATOM 150 CD2 LEU A 13 7.385 4.310 6.941 1.00 0.00 C ATOM 0 H LEU A 13 9.984 1.793 5.273 1.00 0.00 H new ATOM 0 HA LEU A 13 8.020 1.855 3.054 1.00 0.00 H new ATOM 0 HB2 LEU A 13 6.865 3.606 4.145 1.00 0.00 H new ATOM 0 HB3 LEU A 13 7.100 2.363 5.358 1.00 0.00 H new ATOM 0 HG LEU A 13 9.223 3.784 5.996 1.00 0.00 H new ATOM 0 HD11 LEU A 13 8.855 6.198 5.666 1.00 0.00 H new ATOM 0 HD12 LEU A 13 9.065 5.345 4.118 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.440 5.838 4.648 1.00 0.00 H new ATOM 0 HD21 LEU A 13 7.842 5.050 7.598 1.00 0.00 H new ATOM 0 HD22 LEU A 13 6.387 4.644 6.657 1.00 0.00 H new ATOM 0 HD23 LEU A 13 7.313 3.356 7.464 1.00 0.00 H new ATOM 162 N LYS A 14 8.981 4.060 2.116 1.00 0.00 N ATOM 163 CA LYS A 14 9.750 5.055 1.378 1.00 0.00 C ATOM 164 C LYS A 14 8.832 5.941 0.541 1.00 0.00 C ATOM 165 O LYS A 14 7.935 5.464 -0.155 1.00 0.00 O ATOM 166 CB LYS A 14 10.776 4.369 0.473 1.00 0.00 C ATOM 167 CG LYS A 14 12.014 5.209 0.211 1.00 0.00 C ATOM 168 CD LYS A 14 11.824 6.122 -0.989 1.00 0.00 C ATOM 169 CE LYS A 14 13.156 6.633 -1.516 1.00 0.00 C ATOM 170 NZ LYS A 14 12.983 7.497 -2.716 1.00 0.00 N ATOM 0 H LYS A 14 8.026 3.933 1.782 1.00 0.00 H new ATOM 0 HA LYS A 14 10.273 5.682 2.100 1.00 0.00 H new ATOM 0 HB2 LYS A 14 11.077 3.426 0.929 1.00 0.00 H new ATOM 0 HB3 LYS A 14 10.304 4.126 -0.479 1.00 0.00 H new ATOM 0 HG2 LYS A 14 12.242 5.808 1.093 1.00 0.00 H new ATOM 0 HG3 LYS A 14 12.869 4.555 0.040 1.00 0.00 H new ATOM 0 HD2 LYS A 14 11.302 5.583 -1.779 1.00 0.00 H new ATOM 0 HD3 LYS A 14 11.194 6.966 -0.709 1.00 0.00 H new ATOM 0 HE2 LYS A 14 13.664 7.196 -0.733 1.00 0.00 H new ATOM 0 HE3 LYS A 14 13.796 5.787 -1.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 13.914 7.825 -3.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 12.521 6.953 -3.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 12.393 8.318 -2.471 1.00 0.00 H new ATOM 184 N PRO A 15 9.059 7.261 0.609 1.00 0.00 N ATOM 185 CA PRO A 15 8.264 8.240 -0.137 1.00 0.00 C ATOM 186 C PRO A 15 8.522 8.174 -1.639 1.00 0.00 C ATOM 187 O PRO A 15 9.611 7.819 -2.090 1.00 0.00 O ATOM 188 CB PRO A 15 8.735 9.583 0.427 1.00 0.00 C ATOM 189 CG PRO A 15 10.112 9.321 0.930 1.00 0.00 C ATOM 190 CD PRO A 15 10.111 7.899 1.419 1.00 0.00 C ATOM 0 HA PRO A 15 7.194 8.066 -0.025 1.00 0.00 H new ATOM 0 HB2 PRO A 15 8.735 10.357 -0.341 1.00 0.00 H new ATOM 0 HB3 PRO A 15 8.080 9.928 1.227 1.00 0.00 H new ATOM 0 HG2 PRO A 15 10.849 9.461 0.140 1.00 0.00 H new ATOM 0 HG3 PRO A 15 10.371 10.010 1.734 1.00 0.00 H new ATOM 0 HD2 PRO A 15 11.079 7.422 1.269 1.00 0.00 H new ATOM 0 HD3 PRO A 15 9.889 7.841 2.485 1.00 0.00 H new ATOM 198 N PRO A 16 7.499 8.522 -2.432 1.00 0.00 N ATOM 199 CA PRO A 16 7.591 8.511 -3.895 1.00 0.00 C ATOM 200 C PRO A 16 8.505 9.610 -4.426 1.00 0.00 C ATOM 201 O PRO A 16 8.733 10.617 -3.757 1.00 0.00 O ATOM 202 CB PRO A 16 6.148 8.752 -4.344 1.00 0.00 C ATOM 203 CG PRO A 16 5.515 9.480 -3.208 1.00 0.00 C ATOM 204 CD PRO A 16 6.172 8.955 -1.962 1.00 0.00 C ATOM 0 HA PRO A 16 8.018 7.581 -4.269 1.00 0.00 H new ATOM 0 HB2 PRO A 16 6.112 9.340 -5.261 1.00 0.00 H new ATOM 0 HB3 PRO A 16 5.634 7.812 -4.548 1.00 0.00 H new ATOM 0 HG2 PRO A 16 5.663 10.556 -3.303 1.00 0.00 H new ATOM 0 HG3 PRO A 16 4.439 9.307 -3.185 1.00 0.00 H new ATOM 0 HD2 PRO A 16 6.249 9.724 -1.194 1.00 0.00 H new ATOM 0 HD3 PRO A 16 5.609 8.128 -1.529 1.00 0.00 H new ATOM 212 N GLU A 17 9.025 9.409 -5.633 1.00 0.00 N ATOM 213 CA GLU A 17 9.915 10.384 -6.253 1.00 0.00 C ATOM 214 C GLU A 17 9.171 11.214 -7.295 1.00 0.00 C ATOM 215 O GLU A 17 9.404 12.415 -7.428 1.00 0.00 O ATOM 216 CB GLU A 17 11.107 9.679 -6.903 1.00 0.00 C ATOM 217 CG GLU A 17 12.075 9.071 -5.902 1.00 0.00 C ATOM 218 CD GLU A 17 13.062 8.118 -6.549 1.00 0.00 C ATOM 219 OE1 GLU A 17 12.645 7.012 -6.948 1.00 0.00 O ATOM 220 OE2 GLU A 17 14.252 8.481 -6.656 1.00 0.00 O ATOM 0 H GLU A 17 8.846 8.581 -6.200 1.00 0.00 H new ATOM 0 HA GLU A 17 10.279 11.053 -5.473 1.00 0.00 H new ATOM 0 HB2 GLU A 17 10.738 8.893 -7.562 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.644 10.393 -7.527 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.622 9.869 -5.400 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.512 8.539 -5.135 1.00 0.00 H new ATOM 227 N GLN A 18 8.275 10.564 -8.032 1.00 0.00 N ATOM 228 CA GLN A 18 7.498 11.241 -9.063 1.00 0.00 C ATOM 229 C GLN A 18 6.170 10.530 -9.298 1.00 0.00 C ATOM 230 O GLN A 18 6.097 9.303 -9.261 1.00 0.00 O ATOM 231 CB GLN A 18 8.293 11.309 -10.368 1.00 0.00 C ATOM 232 CG GLN A 18 8.460 9.960 -11.049 1.00 0.00 C ATOM 233 CD GLN A 18 9.556 9.122 -10.421 1.00 0.00 C ATOM 234 OE1 GLN A 18 10.680 9.589 -10.232 1.00 0.00 O ATOM 235 NE2 GLN A 18 9.235 7.875 -10.094 1.00 0.00 N ATOM 0 H GLN A 18 8.070 9.570 -7.934 1.00 0.00 H new ATOM 0 HA GLN A 18 7.290 12.255 -8.720 1.00 0.00 H new ATOM 0 HB2 GLN A 18 7.793 11.993 -11.053 1.00 0.00 H new ATOM 0 HB3 GLN A 18 9.278 11.727 -10.162 1.00 0.00 H new ATOM 0 HG2 GLN A 18 7.518 9.414 -11.001 1.00 0.00 H new ATOM 0 HG3 GLN A 18 8.686 10.115 -12.104 1.00 0.00 H new ATOM 0 HE21 GLN A 18 8.292 7.529 -10.268 1.00 0.00 H new ATOM 0 HE22 GLN A 18 9.932 7.264 -9.669 1.00 0.00 H new ATOM 244 N GLU A 19 5.121 11.311 -9.540 1.00 0.00 N ATOM 245 CA GLU A 19 3.795 10.754 -9.781 1.00 0.00 C ATOM 246 C GLU A 19 3.837 9.708 -10.891 1.00 0.00 C ATOM 247 O GLU A 19 4.304 9.980 -11.997 1.00 0.00 O ATOM 248 CB GLU A 19 2.810 11.866 -10.149 1.00 0.00 C ATOM 249 CG GLU A 19 1.359 11.416 -10.157 1.00 0.00 C ATOM 250 CD GLU A 19 0.396 12.555 -10.430 1.00 0.00 C ATOM 251 OE1 GLU A 19 0.403 13.080 -11.563 1.00 0.00 O ATOM 252 OE2 GLU A 19 -0.364 12.922 -9.509 1.00 0.00 O ATOM 0 H GLU A 19 5.164 12.330 -9.574 1.00 0.00 H new ATOM 0 HA GLU A 19 3.460 10.270 -8.863 1.00 0.00 H new ATOM 0 HB2 GLU A 19 2.923 12.688 -9.442 1.00 0.00 H new ATOM 0 HB3 GLU A 19 3.066 12.255 -11.134 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.226 10.644 -10.915 1.00 0.00 H new ATOM 0 HG3 GLU A 19 1.118 10.964 -9.195 1.00 0.00 H new ATOM 259 N ILE A 20 3.346 8.511 -10.586 1.00 0.00 N ATOM 260 CA ILE A 20 3.327 7.425 -11.558 1.00 0.00 C ATOM 261 C ILE A 20 1.956 7.299 -12.214 1.00 0.00 C ATOM 262 O ILE A 20 1.059 8.101 -11.959 1.00 0.00 O ATOM 263 CB ILE A 20 3.696 6.080 -10.905 1.00 0.00 C ATOM 264 CG1 ILE A 20 2.634 5.676 -9.881 1.00 0.00 C ATOM 265 CG2 ILE A 20 5.066 6.168 -10.248 1.00 0.00 C ATOM 266 CD1 ILE A 20 2.470 4.179 -9.737 1.00 0.00 C ATOM 0 H ILE A 20 2.957 8.269 -9.675 1.00 0.00 H new ATOM 0 HA ILE A 20 4.070 7.668 -12.318 1.00 0.00 H new ATOM 0 HB ILE A 20 3.735 5.316 -11.681 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.897 6.099 -8.911 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.678 6.112 -10.171 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.313 5.210 -9.791 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.815 6.415 -11.000 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.053 6.943 -9.481 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.701 3.967 -8.994 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.177 3.751 -10.696 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.414 3.739 -9.417 1.00 0.00 H new ATOM 278 N GLU A 21 1.802 6.285 -13.060 1.00 0.00 N ATOM 279 CA GLU A 21 0.540 6.053 -13.753 1.00 0.00 C ATOM 280 C GLU A 21 -0.048 4.698 -13.373 1.00 0.00 C ATOM 281 O GLU A 21 0.679 3.719 -13.206 1.00 0.00 O ATOM 282 CB GLU A 21 0.743 6.127 -15.268 1.00 0.00 C ATOM 283 CG GLU A 21 -0.212 5.245 -16.054 1.00 0.00 C ATOM 284 CD GLU A 21 -0.324 5.657 -17.509 1.00 0.00 C ATOM 285 OE1 GLU A 21 -1.133 6.558 -17.810 1.00 0.00 O ATOM 286 OE2 GLU A 21 0.399 5.077 -18.346 1.00 0.00 O ATOM 0 H GLU A 21 2.535 5.611 -13.282 1.00 0.00 H new ATOM 0 HA GLU A 21 -0.160 6.831 -13.449 1.00 0.00 H new ATOM 0 HB2 GLU A 21 0.620 7.160 -15.592 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.767 5.839 -15.503 1.00 0.00 H new ATOM 0 HG2 GLU A 21 0.126 4.210 -15.998 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -1.199 5.283 -15.593 1.00 0.00 H new ATOM 293 N ILE A 22 -1.369 4.650 -13.238 1.00 0.00 N ATOM 294 CA ILE A 22 -2.056 3.416 -12.878 1.00 0.00 C ATOM 295 C ILE A 22 -3.259 3.172 -13.782 1.00 0.00 C ATOM 296 O ILE A 22 -3.889 4.115 -14.262 1.00 0.00 O ATOM 297 CB ILE A 22 -2.526 3.440 -11.411 1.00 0.00 C ATOM 298 CG1 ILE A 22 -1.329 3.600 -10.472 1.00 0.00 C ATOM 299 CG2 ILE A 22 -3.299 2.171 -11.082 1.00 0.00 C ATOM 300 CD1 ILE A 22 -0.377 2.425 -10.500 1.00 0.00 C ATOM 0 H ILE A 22 -1.985 5.452 -13.373 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.338 2.606 -13.007 1.00 0.00 H new ATOM 0 HB ILE A 22 -3.190 4.293 -11.271 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -0.784 4.505 -10.742 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -1.692 3.738 -9.454 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -3.625 2.203 -10.042 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -4.170 2.097 -11.733 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -2.657 1.304 -11.235 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.447 2.608 -9.810 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -0.907 1.520 -10.201 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.016 2.299 -11.509 1.00 0.00 H new ATOM 312 N ASP A 23 -3.575 1.902 -14.009 1.00 0.00 N ATOM 313 CA ASP A 23 -4.705 1.534 -14.853 1.00 0.00 C ATOM 314 C ASP A 23 -5.837 0.943 -14.019 1.00 0.00 C ATOM 315 O ASP A 23 -5.645 -0.039 -13.301 1.00 0.00 O ATOM 316 CB ASP A 23 -4.266 0.532 -15.922 1.00 0.00 C ATOM 317 CG ASP A 23 -3.636 1.207 -17.125 1.00 0.00 C ATOM 318 OD1 ASP A 23 -3.994 2.370 -17.407 1.00 0.00 O ATOM 319 OD2 ASP A 23 -2.787 0.572 -17.785 1.00 0.00 O ATOM 0 H ASP A 23 -3.064 1.110 -13.620 1.00 0.00 H new ATOM 0 HA ASP A 23 -5.071 2.437 -15.341 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.553 -0.169 -15.488 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.129 -0.050 -16.246 1.00 0.00 H new ATOM 324 N ARG A 24 -7.016 1.547 -14.117 1.00 0.00 N ATOM 325 CA ARG A 24 -8.178 1.082 -13.370 1.00 0.00 C ATOM 326 C ARG A 24 -8.802 -0.140 -14.039 1.00 0.00 C ATOM 327 O ARG A 24 -9.780 -0.698 -13.545 1.00 0.00 O ATOM 328 CB ARG A 24 -9.217 2.199 -13.253 1.00 0.00 C ATOM 329 CG ARG A 24 -8.764 3.365 -12.390 1.00 0.00 C ATOM 330 CD ARG A 24 -7.893 4.334 -13.175 1.00 0.00 C ATOM 331 NE ARG A 24 -7.898 5.672 -12.589 1.00 0.00 N ATOM 332 CZ ARG A 24 -6.923 6.555 -12.768 1.00 0.00 C ATOM 333 NH1 ARG A 24 -5.870 6.245 -13.512 1.00 0.00 N ATOM 334 NH2 ARG A 24 -6.999 7.753 -12.202 1.00 0.00 N ATOM 0 H ARG A 24 -7.192 2.360 -14.707 1.00 0.00 H new ATOM 0 HA ARG A 24 -7.846 0.798 -12.371 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -9.455 2.568 -14.251 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -10.136 1.786 -12.838 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -9.636 3.891 -12.001 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -8.209 2.989 -11.531 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -6.871 3.957 -13.209 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -8.247 4.388 -14.204 1.00 0.00 H new ATOM 0 HE ARG A 24 -8.694 5.943 -12.011 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -5.807 5.326 -13.949 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -5.123 6.926 -13.647 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -7.807 7.996 -11.629 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -6.249 8.431 -12.340 1.00 0.00 H new ATOM 348 N ASN A 25 -8.227 -0.548 -15.165 1.00 0.00 N ATOM 349 CA ASN A 25 -8.727 -1.703 -15.903 1.00 0.00 C ATOM 350 C ASN A 25 -7.632 -2.750 -16.081 1.00 0.00 C ATOM 351 O ASN A 25 -7.873 -3.827 -16.628 1.00 0.00 O ATOM 352 CB ASN A 25 -9.261 -1.269 -17.270 1.00 0.00 C ATOM 353 CG ASN A 25 -10.506 -0.410 -17.158 1.00 0.00 C ATOM 354 OD1 ASN A 25 -11.611 -0.855 -17.467 1.00 0.00 O ATOM 355 ND2 ASN A 25 -10.331 0.830 -16.715 1.00 0.00 N ATOM 0 H ASN A 25 -7.415 -0.097 -15.587 1.00 0.00 H new ATOM 0 HA ASN A 25 -9.539 -2.147 -15.328 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -8.487 -0.714 -17.800 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -9.485 -2.153 -17.867 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -11.131 1.455 -16.620 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -9.396 1.157 -16.470 1.00 0.00 H new ATOM 362 N ILE A 26 -6.431 -2.427 -15.615 1.00 0.00 N ATOM 363 CA ILE A 26 -5.300 -3.341 -15.721 1.00 0.00 C ATOM 364 C ILE A 26 -4.553 -3.447 -14.396 1.00 0.00 C ATOM 365 O ILE A 26 -4.333 -2.446 -13.714 1.00 0.00 O ATOM 366 CB ILE A 26 -4.316 -2.893 -16.818 1.00 0.00 C ATOM 367 CG1 ILE A 26 -5.032 -2.794 -18.167 1.00 0.00 C ATOM 368 CG2 ILE A 26 -3.143 -3.859 -16.904 1.00 0.00 C ATOM 369 CD1 ILE A 26 -5.644 -1.436 -18.428 1.00 0.00 C ATOM 0 H ILE A 26 -6.215 -1.540 -15.160 1.00 0.00 H new ATOM 0 HA ILE A 26 -5.706 -4.317 -15.985 1.00 0.00 H new ATOM 0 HB ILE A 26 -3.931 -1.907 -16.559 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.323 -3.023 -18.963 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -5.815 -3.551 -18.210 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -2.456 -3.529 -17.684 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -2.621 -3.884 -15.947 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -3.510 -4.857 -17.143 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -6.134 -1.439 -19.401 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -6.377 -1.212 -17.653 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -4.862 -0.677 -18.418 1.00 0.00 H new ATOM 381 N ILE A 27 -4.163 -4.666 -14.039 1.00 0.00 N ATOM 382 CA ILE A 27 -3.438 -4.903 -12.797 1.00 0.00 C ATOM 383 C ILE A 27 -1.997 -5.318 -13.073 1.00 0.00 C ATOM 384 O ILE A 27 -1.716 -6.488 -13.332 1.00 0.00 O ATOM 385 CB ILE A 27 -4.119 -5.990 -11.946 1.00 0.00 C ATOM 386 CG1 ILE A 27 -5.600 -5.660 -11.748 1.00 0.00 C ATOM 387 CG2 ILE A 27 -3.417 -6.129 -10.603 1.00 0.00 C ATOM 388 CD1 ILE A 27 -6.362 -6.730 -10.998 1.00 0.00 C ATOM 0 H ILE A 27 -4.337 -5.505 -14.592 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.444 -3.964 -12.244 1.00 0.00 H new ATOM 0 HB ILE A 27 -4.045 -6.942 -12.472 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -5.685 -4.718 -11.207 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -6.064 -5.510 -12.723 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -3.910 -6.901 -10.013 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.375 -6.405 -10.764 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.462 -5.180 -10.069 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.405 -6.429 -10.894 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.308 -7.669 -11.549 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.923 -6.864 -10.009 1.00 0.00 H new ATOM 400 N GLN A 28 -1.087 -4.351 -13.014 1.00 0.00 N ATOM 401 CA GLN A 28 0.327 -4.616 -13.256 1.00 0.00 C ATOM 402 C GLN A 28 1.016 -5.097 -11.984 1.00 0.00 C ATOM 403 O GLN A 28 0.584 -4.781 -10.876 1.00 0.00 O ATOM 404 CB GLN A 28 1.020 -3.359 -13.783 1.00 0.00 C ATOM 405 CG GLN A 28 0.268 -2.677 -14.914 1.00 0.00 C ATOM 406 CD GLN A 28 0.491 -1.178 -14.944 1.00 0.00 C ATOM 407 OE1 GLN A 28 1.583 -0.696 -14.641 1.00 0.00 O ATOM 408 NE2 GLN A 28 -0.544 -0.432 -15.311 1.00 0.00 N ATOM 0 H GLN A 28 -1.303 -3.377 -12.801 1.00 0.00 H new ATOM 0 HA GLN A 28 0.400 -5.403 -14.006 1.00 0.00 H new ATOM 0 HB2 GLN A 28 1.144 -2.652 -12.963 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.019 -3.624 -14.130 1.00 0.00 H new ATOM 0 HG2 GLN A 28 0.583 -3.106 -15.865 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -0.798 -2.880 -14.810 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -1.431 -0.874 -15.554 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -0.453 0.583 -15.350 1.00 0.00 H new ATOM 417 N GLU A 29 2.090 -5.862 -12.151 1.00 0.00 N ATOM 418 CA GLU A 29 2.838 -6.387 -11.015 1.00 0.00 C ATOM 419 C GLU A 29 3.106 -5.291 -9.987 1.00 0.00 C ATOM 420 O GLU A 29 3.157 -5.552 -8.786 1.00 0.00 O ATOM 421 CB GLU A 29 4.161 -6.995 -11.484 1.00 0.00 C ATOM 422 CG GLU A 29 5.014 -6.041 -12.303 1.00 0.00 C ATOM 423 CD GLU A 29 6.229 -6.717 -12.908 1.00 0.00 C ATOM 424 OE1 GLU A 29 6.049 -7.614 -13.757 1.00 0.00 O ATOM 425 OE2 GLU A 29 7.362 -6.347 -12.532 1.00 0.00 O ATOM 0 H GLU A 29 2.461 -6.132 -13.062 1.00 0.00 H new ATOM 0 HA GLU A 29 2.236 -7.164 -10.544 1.00 0.00 H new ATOM 0 HB2 GLU A 29 4.730 -7.321 -10.613 1.00 0.00 H new ATOM 0 HB3 GLU A 29 3.952 -7.884 -12.079 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.408 -5.611 -13.100 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.340 -5.216 -11.670 1.00 0.00 H new ATOM 432 N GLU A 30 3.277 -4.064 -10.470 1.00 0.00 N ATOM 433 CA GLU A 30 3.541 -2.929 -9.593 1.00 0.00 C ATOM 434 C GLU A 30 2.556 -2.901 -8.428 1.00 0.00 C ATOM 435 O GLU A 30 2.946 -2.709 -7.277 1.00 0.00 O ATOM 436 CB GLU A 30 3.456 -1.619 -10.379 1.00 0.00 C ATOM 437 CG GLU A 30 4.778 -1.191 -10.993 1.00 0.00 C ATOM 438 CD GLU A 30 5.087 -1.925 -12.283 1.00 0.00 C ATOM 439 OE1 GLU A 30 4.186 -2.017 -13.143 1.00 0.00 O ATOM 440 OE2 GLU A 30 6.228 -2.408 -12.433 1.00 0.00 O ATOM 0 H GLU A 30 3.238 -3.831 -11.462 1.00 0.00 H new ATOM 0 HA GLU A 30 4.548 -3.039 -9.192 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.715 -1.728 -11.171 1.00 0.00 H new ATOM 0 HB3 GLU A 30 3.100 -0.830 -9.716 1.00 0.00 H new ATOM 0 HG2 GLU A 30 4.754 -0.119 -11.186 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.581 -1.368 -10.277 1.00 0.00 H new ATOM 447 N GLU A 31 1.277 -3.093 -8.737 1.00 0.00 N ATOM 448 CA GLU A 31 0.236 -3.088 -7.716 1.00 0.00 C ATOM 449 C GLU A 31 0.197 -4.419 -6.972 1.00 0.00 C ATOM 450 O GLU A 31 -0.047 -4.463 -5.766 1.00 0.00 O ATOM 451 CB GLU A 31 -1.128 -2.804 -8.348 1.00 0.00 C ATOM 452 CG GLU A 31 -1.266 -1.392 -8.891 1.00 0.00 C ATOM 453 CD GLU A 31 -0.542 -1.201 -10.210 1.00 0.00 C ATOM 454 OE1 GLU A 31 -0.861 -1.928 -11.173 1.00 0.00 O ATOM 455 OE2 GLU A 31 0.343 -0.322 -10.277 1.00 0.00 O ATOM 0 H GLU A 31 0.937 -3.254 -9.685 1.00 0.00 H new ATOM 0 HA GLU A 31 0.468 -2.299 -7.001 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.299 -3.514 -9.158 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.906 -2.976 -7.604 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.323 -1.159 -9.024 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.873 -0.685 -8.160 1.00 0.00 H new ATOM 462 N LYS A 32 0.439 -5.504 -7.700 1.00 0.00 N ATOM 463 CA LYS A 32 0.433 -6.838 -7.111 1.00 0.00 C ATOM 464 C LYS A 32 1.533 -6.976 -6.063 1.00 0.00 C ATOM 465 O LYS A 32 1.402 -7.743 -5.110 1.00 0.00 O ATOM 466 CB LYS A 32 0.615 -7.899 -8.199 1.00 0.00 C ATOM 467 CG LYS A 32 -0.498 -7.908 -9.233 1.00 0.00 C ATOM 468 CD LYS A 32 -0.264 -8.969 -10.295 1.00 0.00 C ATOM 469 CE LYS A 32 -1.470 -9.117 -11.209 1.00 0.00 C ATOM 470 NZ LYS A 32 -2.452 -10.102 -10.676 1.00 0.00 N ATOM 0 H LYS A 32 0.642 -5.486 -8.699 1.00 0.00 H new ATOM 0 HA LYS A 32 -0.530 -6.988 -6.623 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.567 -7.731 -8.703 1.00 0.00 H new ATOM 0 HB3 LYS A 32 0.672 -8.882 -7.731 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.453 -8.090 -8.740 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.565 -6.928 -9.705 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.613 -8.706 -10.887 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -0.050 -9.924 -9.816 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -1.956 -8.149 -11.329 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -1.139 -9.433 -12.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -3.122 -10.366 -11.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -1.949 -10.951 -10.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -2.972 -9.678 -9.881 1.00 0.00 H new ATOM 484 N GLN A 33 2.615 -6.226 -6.247 1.00 0.00 N ATOM 485 CA GLN A 33 3.737 -6.265 -5.316 1.00 0.00 C ATOM 486 C GLN A 33 3.374 -5.590 -3.997 1.00 0.00 C ATOM 487 O GLN A 33 3.988 -5.853 -2.964 1.00 0.00 O ATOM 488 CB GLN A 33 4.961 -5.584 -5.931 1.00 0.00 C ATOM 489 CG GLN A 33 5.661 -6.426 -6.985 1.00 0.00 C ATOM 490 CD GLN A 33 7.046 -5.910 -7.319 1.00 0.00 C ATOM 491 OE1 GLN A 33 7.509 -4.923 -6.747 1.00 0.00 O ATOM 492 NE2 GLN A 33 7.718 -6.576 -8.251 1.00 0.00 N ATOM 0 H GLN A 33 2.738 -5.585 -7.031 1.00 0.00 H new ATOM 0 HA GLN A 33 3.974 -7.310 -5.115 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.654 -4.639 -6.378 1.00 0.00 H new ATOM 0 HB3 GLN A 33 5.670 -5.346 -5.138 1.00 0.00 H new ATOM 0 HG2 GLN A 33 5.736 -7.454 -6.632 1.00 0.00 H new ATOM 0 HG3 GLN A 33 5.056 -6.444 -7.891 1.00 0.00 H new ATOM 0 HE21 GLN A 33 7.297 -7.389 -8.700 1.00 0.00 H new ATOM 0 HE22 GLN A 33 8.655 -6.274 -8.518 1.00 0.00 H new ATOM 501 N ALA A 34 2.372 -4.718 -4.041 1.00 0.00 N ATOM 502 CA ALA A 34 1.925 -4.007 -2.849 1.00 0.00 C ATOM 503 C ALA A 34 0.605 -4.570 -2.336 1.00 0.00 C ATOM 504 O ALA A 34 0.283 -4.445 -1.154 1.00 0.00 O ATOM 505 CB ALA A 34 1.789 -2.520 -3.142 1.00 0.00 C ATOM 0 H ALA A 34 1.854 -4.487 -4.889 1.00 0.00 H new ATOM 0 HA ALA A 34 2.675 -4.146 -2.071 1.00 0.00 H new ATOM 0 HB1 ALA A 34 1.455 -2.001 -2.244 1.00 0.00 H new ATOM 0 HB2 ALA A 34 2.754 -2.121 -3.454 1.00 0.00 H new ATOM 0 HB3 ALA A 34 1.061 -2.371 -3.939 1.00 0.00 H new ATOM 511 N ILE A 35 -0.157 -5.189 -3.232 1.00 0.00 N ATOM 512 CA ILE A 35 -1.443 -5.772 -2.868 1.00 0.00 C ATOM 513 C ILE A 35 -1.501 -7.250 -3.239 1.00 0.00 C ATOM 514 O ILE A 35 -2.478 -7.733 -3.812 1.00 0.00 O ATOM 515 CB ILE A 35 -2.608 -5.035 -3.554 1.00 0.00 C ATOM 516 CG1 ILE A 35 -2.388 -3.522 -3.497 1.00 0.00 C ATOM 517 CG2 ILE A 35 -3.930 -5.408 -2.898 1.00 0.00 C ATOM 518 CD1 ILE A 35 -2.296 -2.977 -2.089 1.00 0.00 C ATOM 0 H ILE A 35 0.094 -5.300 -4.215 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.544 -5.668 -1.788 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.645 -5.339 -4.600 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.472 -3.276 -4.034 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -3.206 -3.024 -4.018 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.744 -4.879 -3.394 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.089 -6.483 -2.985 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.905 -5.129 -1.844 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -2.140 -1.899 -2.126 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -3.221 -3.192 -1.555 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.460 -3.447 -1.571 1.00 0.00 H new ATOM 530 N PRO A 36 -0.432 -7.987 -2.905 1.00 0.00 N ATOM 531 CA PRO A 36 -0.338 -9.421 -3.191 1.00 0.00 C ATOM 532 C PRO A 36 -1.296 -10.246 -2.338 1.00 0.00 C ATOM 533 O PRO A 36 -1.581 -11.402 -2.651 1.00 0.00 O ATOM 534 CB PRO A 36 1.114 -9.758 -2.843 1.00 0.00 C ATOM 535 CG PRO A 36 1.513 -8.727 -1.845 1.00 0.00 C ATOM 536 CD PRO A 36 0.768 -7.476 -2.221 1.00 0.00 C ATOM 0 HA PRO A 36 -0.607 -9.650 -4.222 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.199 -10.763 -2.430 1.00 0.00 H new ATOM 0 HB3 PRO A 36 1.752 -9.722 -3.726 1.00 0.00 H new ATOM 0 HG2 PRO A 36 1.258 -9.044 -0.834 1.00 0.00 H new ATOM 0 HG3 PRO A 36 2.590 -8.561 -1.865 1.00 0.00 H new ATOM 0 HD2 PRO A 36 0.509 -6.883 -1.344 1.00 0.00 H new ATOM 0 HD3 PRO A 36 1.361 -6.836 -2.874 1.00 0.00 H new ATOM 544 N GLU A 37 -1.789 -9.645 -1.260 1.00 0.00 N ATOM 545 CA GLU A 37 -2.715 -10.326 -0.363 1.00 0.00 C ATOM 546 C GLU A 37 -4.000 -10.706 -1.093 1.00 0.00 C ATOM 547 O GLU A 37 -4.565 -11.775 -0.863 1.00 0.00 O ATOM 548 CB GLU A 37 -3.041 -9.437 0.839 1.00 0.00 C ATOM 549 CG GLU A 37 -3.902 -8.235 0.491 1.00 0.00 C ATOM 550 CD GLU A 37 -4.338 -7.455 1.716 1.00 0.00 C ATOM 551 OE1 GLU A 37 -3.471 -6.829 2.361 1.00 0.00 O ATOM 552 OE2 GLU A 37 -5.547 -7.471 2.030 1.00 0.00 O ATOM 0 H GLU A 37 -1.563 -8.689 -0.987 1.00 0.00 H new ATOM 0 HA GLU A 37 -2.235 -11.239 -0.011 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.553 -10.034 1.593 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.110 -9.089 1.286 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -3.346 -7.576 -0.176 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -4.784 -8.570 -0.054 1.00 0.00 H new ATOM 559 N PHE A 38 -4.457 -9.821 -1.973 1.00 0.00 N ATOM 560 CA PHE A 38 -5.676 -10.062 -2.736 1.00 0.00 C ATOM 561 C PHE A 38 -5.410 -11.008 -3.903 1.00 0.00 C ATOM 562 O PHE A 38 -6.340 -11.500 -4.542 1.00 0.00 O ATOM 563 CB PHE A 38 -6.247 -8.741 -3.256 1.00 0.00 C ATOM 564 CG PHE A 38 -7.192 -8.076 -2.295 1.00 0.00 C ATOM 565 CD1 PHE A 38 -8.437 -8.626 -2.036 1.00 0.00 C ATOM 566 CD2 PHE A 38 -6.835 -6.902 -1.653 1.00 0.00 C ATOM 567 CE1 PHE A 38 -9.308 -8.017 -1.152 1.00 0.00 C ATOM 568 CE2 PHE A 38 -7.702 -6.289 -0.768 1.00 0.00 C ATOM 569 CZ PHE A 38 -8.940 -6.847 -0.518 1.00 0.00 C ATOM 0 H PHE A 38 -4.002 -8.931 -2.175 1.00 0.00 H new ATOM 0 HA PHE A 38 -6.404 -10.529 -2.072 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -5.425 -8.060 -3.474 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -6.767 -8.924 -4.196 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -8.730 -9.540 -2.530 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -5.868 -6.460 -1.846 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -10.275 -8.456 -0.957 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -7.411 -5.374 -0.273 1.00 0.00 H new ATOM 0 HZ PHE A 38 -9.619 -6.369 0.172 1.00 0.00 H new ATOM 579 N PHE A 39 -4.134 -11.258 -4.174 1.00 0.00 N ATOM 580 CA PHE A 39 -3.743 -12.144 -5.265 1.00 0.00 C ATOM 581 C PHE A 39 -3.171 -13.452 -4.725 1.00 0.00 C ATOM 582 O PHE A 39 -2.688 -14.290 -5.486 1.00 0.00 O ATOM 583 CB PHE A 39 -2.714 -11.457 -6.165 1.00 0.00 C ATOM 584 CG PHE A 39 -3.201 -10.164 -6.754 1.00 0.00 C ATOM 585 CD1 PHE A 39 -4.270 -10.149 -7.636 1.00 0.00 C ATOM 586 CD2 PHE A 39 -2.590 -8.965 -6.427 1.00 0.00 C ATOM 587 CE1 PHE A 39 -4.721 -8.961 -8.180 1.00 0.00 C ATOM 588 CE2 PHE A 39 -3.037 -7.774 -6.968 1.00 0.00 C ATOM 589 CZ PHE A 39 -4.103 -7.772 -7.846 1.00 0.00 C ATOM 0 H PHE A 39 -3.352 -10.860 -3.653 1.00 0.00 H new ATOM 0 HA PHE A 39 -4.633 -12.372 -5.851 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -1.809 -11.266 -5.589 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -2.440 -12.135 -6.973 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -4.756 -11.076 -7.901 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -1.755 -8.960 -5.742 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -5.556 -8.963 -8.865 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -2.553 -6.845 -6.704 1.00 0.00 H new ATOM 0 HZ PHE A 39 -4.453 -6.843 -8.271 1.00 0.00 H new ATOM 599 N GLU A 40 -3.230 -13.617 -3.408 1.00 0.00 N ATOM 600 CA GLU A 40 -2.717 -14.822 -2.766 1.00 0.00 C ATOM 601 C GLU A 40 -3.499 -16.053 -3.215 1.00 0.00 C ATOM 602 O GLU A 40 -2.919 -17.044 -3.656 1.00 0.00 O ATOM 603 CB GLU A 40 -2.788 -14.686 -1.244 1.00 0.00 C ATOM 604 CG GLU A 40 -1.538 -14.080 -0.628 1.00 0.00 C ATOM 605 CD GLU A 40 -1.371 -14.446 0.834 1.00 0.00 C ATOM 606 OE1 GLU A 40 -2.324 -15.003 1.419 1.00 0.00 O ATOM 607 OE2 GLU A 40 -0.288 -14.176 1.393 1.00 0.00 O ATOM 0 H GLU A 40 -3.627 -12.932 -2.765 1.00 0.00 H new ATOM 0 HA GLU A 40 -1.676 -14.946 -3.064 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.648 -14.069 -0.983 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -2.958 -15.670 -0.807 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -0.663 -14.416 -1.185 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -1.579 -12.995 -0.725 1.00 0.00 H new ATOM 614 N GLY A 41 -4.822 -15.982 -3.097 1.00 0.00 N ATOM 615 CA GLY A 41 -5.663 -17.096 -3.493 1.00 0.00 C ATOM 616 C GLY A 41 -6.650 -17.490 -2.412 1.00 0.00 C ATOM 617 O GLY A 41 -7.136 -18.621 -2.389 1.00 0.00 O ATOM 0 H GLY A 41 -5.326 -15.173 -2.734 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -6.208 -16.832 -4.399 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.035 -17.953 -3.737 1.00 0.00 H new ATOM 621 N ARG A 42 -6.946 -16.556 -1.514 1.00 0.00 N ATOM 622 CA ARG A 42 -7.879 -16.813 -0.424 1.00 0.00 C ATOM 623 C ARG A 42 -9.322 -16.736 -0.914 1.00 0.00 C ATOM 624 O ARG A 42 -9.590 -16.235 -2.006 1.00 0.00 O ATOM 625 CB ARG A 42 -7.660 -15.810 0.710 1.00 0.00 C ATOM 626 CG ARG A 42 -6.196 -15.585 1.050 1.00 0.00 C ATOM 627 CD ARG A 42 -5.701 -16.593 2.076 1.00 0.00 C ATOM 628 NE ARG A 42 -6.218 -16.312 3.412 1.00 0.00 N ATOM 629 CZ ARG A 42 -5.880 -17.008 4.492 1.00 0.00 C ATOM 630 NH1 ARG A 42 -5.028 -18.019 4.394 1.00 0.00 N ATOM 631 NH2 ARG A 42 -6.394 -16.692 5.674 1.00 0.00 N ATOM 0 H ARG A 42 -6.553 -15.615 -1.520 1.00 0.00 H new ATOM 0 HA ARG A 42 -7.694 -17.820 -0.050 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.110 -14.857 0.433 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -8.181 -16.162 1.600 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -5.595 -15.661 0.144 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.062 -14.575 1.437 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.003 -17.596 1.774 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -4.611 -16.582 2.099 1.00 0.00 H new ATOM 0 HE ARG A 42 -6.875 -15.539 3.522 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -4.630 -18.264 3.488 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -4.771 -18.551 5.225 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.049 -15.914 5.754 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -6.134 -17.227 6.503 1.00 0.00 H new ATOM 645 N GLN A 43 -10.246 -17.235 -0.100 1.00 0.00 N ATOM 646 CA GLN A 43 -11.661 -17.223 -0.452 1.00 0.00 C ATOM 647 C GLN A 43 -12.304 -15.891 -0.078 1.00 0.00 C ATOM 648 O GLN A 43 -13.336 -15.512 -0.631 1.00 0.00 O ATOM 649 CB GLN A 43 -12.392 -18.370 0.249 1.00 0.00 C ATOM 650 CG GLN A 43 -12.648 -18.116 1.725 1.00 0.00 C ATOM 651 CD GLN A 43 -11.439 -18.419 2.588 1.00 0.00 C ATOM 652 OE1 GLN A 43 -10.962 -19.554 2.632 1.00 0.00 O ATOM 653 NE2 GLN A 43 -10.936 -17.404 3.280 1.00 0.00 N ATOM 0 H GLN A 43 -10.041 -17.653 0.808 1.00 0.00 H new ATOM 0 HA GLN A 43 -11.742 -17.355 -1.531 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -13.345 -18.543 -0.252 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -11.806 -19.283 0.142 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -12.938 -17.075 1.866 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -13.488 -18.728 2.055 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -11.363 -16.480 3.214 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -10.122 -17.548 3.878 1.00 0.00 H new ATOM 662 N ALA A 44 -11.687 -15.186 0.864 1.00 0.00 N ATOM 663 CA ALA A 44 -12.198 -13.895 1.310 1.00 0.00 C ATOM 664 C ALA A 44 -11.610 -12.757 0.483 1.00 0.00 C ATOM 665 O ALA A 44 -12.309 -11.805 0.133 1.00 0.00 O ATOM 666 CB ALA A 44 -11.894 -13.689 2.786 1.00 0.00 C ATOM 0 H ALA A 44 -10.833 -15.487 1.333 1.00 0.00 H new ATOM 0 HA ALA A 44 -13.279 -13.891 1.169 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.281 -12.721 3.106 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -12.367 -14.479 3.369 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -10.816 -13.718 2.943 1.00 0.00 H new ATOM 672 N LYS A 45 -10.322 -12.860 0.173 1.00 0.00 N ATOM 673 CA LYS A 45 -9.640 -11.839 -0.614 1.00 0.00 C ATOM 674 C LYS A 45 -9.626 -12.211 -2.093 1.00 0.00 C ATOM 675 O LYS A 45 -9.086 -13.249 -2.478 1.00 0.00 O ATOM 676 CB LYS A 45 -8.207 -11.651 -0.110 1.00 0.00 C ATOM 677 CG LYS A 45 -8.114 -11.427 1.389 1.00 0.00 C ATOM 678 CD LYS A 45 -6.836 -10.697 1.765 1.00 0.00 C ATOM 679 CE LYS A 45 -6.891 -10.176 3.194 1.00 0.00 C ATOM 680 NZ LYS A 45 -6.674 -11.263 4.188 1.00 0.00 N ATOM 0 H LYS A 45 -9.729 -13.641 0.455 1.00 0.00 H new ATOM 0 HA LYS A 45 -10.185 -10.902 -0.499 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -7.619 -12.530 -0.375 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -7.758 -10.801 -0.624 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -8.976 -10.851 1.726 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -8.151 -12.387 1.904 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -5.986 -11.370 1.654 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.676 -9.865 1.079 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.133 -9.404 3.329 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -7.859 -9.708 3.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -6.719 -10.868 5.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -7.412 -11.988 4.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -5.740 -11.693 4.034 1.00 0.00 H new ATOM 694 N THR A 46 -10.221 -11.357 -2.919 1.00 0.00 N ATOM 695 CA THR A 46 -10.276 -11.596 -4.356 1.00 0.00 C ATOM 696 C THR A 46 -9.699 -10.418 -5.132 1.00 0.00 C ATOM 697 O THR A 46 -9.753 -9.268 -4.694 1.00 0.00 O ATOM 698 CB THR A 46 -11.721 -11.849 -4.828 1.00 0.00 C ATOM 699 OG1 THR A 46 -12.512 -10.672 -4.634 1.00 0.00 O ATOM 700 CG2 THR A 46 -12.341 -13.014 -4.072 1.00 0.00 C ATOM 0 H THR A 46 -10.672 -10.493 -2.618 1.00 0.00 H new ATOM 0 HA THR A 46 -9.676 -12.485 -4.552 1.00 0.00 H new ATOM 0 HB THR A 46 -11.695 -12.098 -5.889 1.00 0.00 H new ATOM 0 HG1 THR A 46 -13.428 -10.840 -4.938 1.00 0.00 H new ATOM 0 HG21 THR A 46 -13.361 -13.174 -4.422 1.00 0.00 H new ATOM 0 HG22 THR A 46 -11.752 -13.915 -4.246 1.00 0.00 H new ATOM 0 HG23 THR A 46 -12.355 -12.790 -3.005 1.00 0.00 H new ATOM 708 N PRO A 47 -9.132 -10.707 -6.313 1.00 0.00 N ATOM 709 CA PRO A 47 -8.535 -9.683 -7.176 1.00 0.00 C ATOM 710 C PRO A 47 -9.581 -8.762 -7.792 1.00 0.00 C ATOM 711 O PRO A 47 -9.282 -7.626 -8.159 1.00 0.00 O ATOM 712 CB PRO A 47 -7.835 -10.501 -8.264 1.00 0.00 C ATOM 713 CG PRO A 47 -8.579 -11.791 -8.307 1.00 0.00 C ATOM 714 CD PRO A 47 -9.032 -12.055 -6.897 1.00 0.00 C ATOM 0 HA PRO A 47 -7.867 -9.023 -6.623 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -7.871 -9.991 -9.227 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -6.783 -10.659 -8.026 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -9.430 -11.728 -8.985 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -7.941 -12.597 -8.670 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -9.990 -12.575 -6.873 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -8.318 -12.676 -6.355 1.00 0.00 H new ATOM 722 N GLU A 48 -10.809 -9.259 -7.903 1.00 0.00 N ATOM 723 CA GLU A 48 -11.900 -8.479 -8.477 1.00 0.00 C ATOM 724 C GLU A 48 -12.401 -7.434 -7.484 1.00 0.00 C ATOM 725 O GLU A 48 -12.892 -6.375 -7.877 1.00 0.00 O ATOM 726 CB GLU A 48 -13.051 -9.398 -8.891 1.00 0.00 C ATOM 727 CG GLU A 48 -12.939 -9.907 -10.319 1.00 0.00 C ATOM 728 CD GLU A 48 -12.830 -8.784 -11.332 1.00 0.00 C ATOM 729 OE1 GLU A 48 -13.805 -8.017 -11.473 1.00 0.00 O ATOM 730 OE2 GLU A 48 -11.771 -8.673 -11.984 1.00 0.00 O ATOM 0 H GLU A 48 -11.073 -10.197 -7.603 1.00 0.00 H new ATOM 0 HA GLU A 48 -11.520 -7.965 -9.360 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -13.087 -10.250 -8.212 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -13.993 -8.861 -8.778 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -12.065 -10.553 -10.403 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -13.811 -10.518 -10.552 1.00 0.00 H new ATOM 737 N ARG A 49 -12.274 -7.739 -6.197 1.00 0.00 N ATOM 738 CA ARG A 49 -12.716 -6.828 -5.148 1.00 0.00 C ATOM 739 C ARG A 49 -11.704 -5.704 -4.943 1.00 0.00 C ATOM 740 O ARG A 49 -12.075 -4.566 -4.656 1.00 0.00 O ATOM 741 CB ARG A 49 -12.923 -7.588 -3.837 1.00 0.00 C ATOM 742 CG ARG A 49 -13.702 -6.803 -2.794 1.00 0.00 C ATOM 743 CD ARG A 49 -13.795 -7.563 -1.480 1.00 0.00 C ATOM 744 NE ARG A 49 -14.682 -8.719 -1.578 1.00 0.00 N ATOM 745 CZ ARG A 49 -16.002 -8.625 -1.699 1.00 0.00 C ATOM 746 NH1 ARG A 49 -16.584 -7.434 -1.737 1.00 0.00 N ATOM 747 NH2 ARG A 49 -16.742 -9.723 -1.783 1.00 0.00 N ATOM 0 H ARG A 49 -11.868 -8.610 -5.855 1.00 0.00 H new ATOM 0 HA ARG A 49 -13.664 -6.388 -5.458 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -13.449 -8.519 -4.046 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -11.950 -7.857 -3.425 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -13.219 -5.841 -2.626 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -14.705 -6.595 -3.167 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -12.800 -7.894 -1.181 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -14.156 -6.894 -0.699 1.00 0.00 H new ATOM 0 HE ARG A 49 -14.265 -9.650 -1.552 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -16.018 -6.588 -1.673 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -17.597 -7.364 -1.830 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -16.298 -10.641 -1.755 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -17.755 -9.649 -1.876 1.00 0.00 H new ATOM 761 N TYR A 50 -10.426 -6.032 -5.092 1.00 0.00 N ATOM 762 CA TYR A 50 -9.360 -5.051 -4.920 1.00 0.00 C ATOM 763 C TYR A 50 -9.504 -3.910 -5.922 1.00 0.00 C ATOM 764 O TYR A 50 -9.154 -2.765 -5.632 1.00 0.00 O ATOM 765 CB TYR A 50 -7.993 -5.719 -5.082 1.00 0.00 C ATOM 766 CG TYR A 50 -6.910 -4.773 -5.551 1.00 0.00 C ATOM 767 CD1 TYR A 50 -6.409 -3.788 -4.710 1.00 0.00 C ATOM 768 CD2 TYR A 50 -6.387 -4.867 -6.835 1.00 0.00 C ATOM 769 CE1 TYR A 50 -5.420 -2.921 -5.134 1.00 0.00 C ATOM 770 CE2 TYR A 50 -5.396 -4.006 -7.267 1.00 0.00 C ATOM 771 CZ TYR A 50 -4.917 -3.035 -6.413 1.00 0.00 C ATOM 772 OH TYR A 50 -3.930 -2.175 -6.839 1.00 0.00 O ATOM 0 H TYR A 50 -10.102 -6.969 -5.331 1.00 0.00 H new ATOM 0 HA TYR A 50 -9.438 -4.639 -3.914 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -7.695 -6.155 -4.128 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -8.081 -6.540 -5.794 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -6.799 -3.698 -3.707 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.761 -5.626 -7.507 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -5.043 -2.159 -4.468 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -4.999 -4.093 -8.268 1.00 0.00 H new ATOM 0 HH TYR A 50 -3.382 -1.901 -6.074 1.00 0.00 H new ATOM 782 N LEU A 51 -10.021 -4.230 -7.103 1.00 0.00 N ATOM 783 CA LEU A 51 -10.213 -3.233 -8.150 1.00 0.00 C ATOM 784 C LEU A 51 -11.341 -2.273 -7.788 1.00 0.00 C ATOM 785 O LEU A 51 -11.162 -1.055 -7.794 1.00 0.00 O ATOM 786 CB LEU A 51 -10.518 -3.917 -9.484 1.00 0.00 C ATOM 787 CG LEU A 51 -9.307 -4.275 -10.347 1.00 0.00 C ATOM 788 CD1 LEU A 51 -9.745 -5.019 -11.598 1.00 0.00 C ATOM 789 CD2 LEU A 51 -8.525 -3.023 -10.715 1.00 0.00 C ATOM 0 H LEU A 51 -10.315 -5.172 -7.360 1.00 0.00 H new ATOM 0 HA LEU A 51 -9.290 -2.660 -8.245 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -11.078 -4.830 -9.282 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -11.172 -3.264 -10.063 1.00 0.00 H new ATOM 0 HG LEU A 51 -8.654 -4.930 -9.769 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.870 -5.265 -12.200 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -10.260 -5.937 -11.314 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -10.419 -4.389 -12.179 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -7.667 -3.297 -11.329 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -9.168 -2.343 -11.273 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.178 -2.530 -9.807 1.00 0.00 H new ATOM 801 N LYS A 52 -12.505 -2.830 -7.470 1.00 0.00 N ATOM 802 CA LYS A 52 -13.664 -2.025 -7.101 1.00 0.00 C ATOM 803 C LYS A 52 -13.269 -0.917 -6.129 1.00 0.00 C ATOM 804 O LYS A 52 -13.575 0.254 -6.352 1.00 0.00 O ATOM 805 CB LYS A 52 -14.745 -2.908 -6.474 1.00 0.00 C ATOM 806 CG LYS A 52 -15.995 -2.144 -6.071 1.00 0.00 C ATOM 807 CD LYS A 52 -16.985 -2.050 -7.219 1.00 0.00 C ATOM 808 CE LYS A 52 -16.746 -0.807 -8.061 1.00 0.00 C ATOM 809 NZ LYS A 52 -17.905 -0.504 -8.946 1.00 0.00 N ATOM 0 H LYS A 52 -12.671 -3.836 -7.460 1.00 0.00 H new ATOM 0 HA LYS A 52 -14.060 -1.565 -8.007 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -15.020 -3.690 -7.182 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -14.333 -3.404 -5.595 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -16.467 -2.639 -5.222 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -15.720 -1.141 -5.743 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -16.901 -2.937 -7.846 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -18.001 -2.033 -6.824 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -16.557 0.044 -7.407 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -15.852 -0.947 -8.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -17.702 0.350 -9.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -18.070 -1.305 -9.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -18.753 -0.345 -8.365 1.00 0.00 H new ATOM 823 N ILE A 53 -12.589 -1.296 -5.052 1.00 0.00 N ATOM 824 CA ILE A 53 -12.151 -0.334 -4.049 1.00 0.00 C ATOM 825 C ILE A 53 -11.189 0.686 -4.648 1.00 0.00 C ATOM 826 O ILE A 53 -11.399 1.894 -4.534 1.00 0.00 O ATOM 827 CB ILE A 53 -11.465 -1.034 -2.860 1.00 0.00 C ATOM 828 CG1 ILE A 53 -12.403 -2.072 -2.240 1.00 0.00 C ATOM 829 CG2 ILE A 53 -11.036 -0.010 -1.819 1.00 0.00 C ATOM 830 CD1 ILE A 53 -11.683 -3.134 -1.439 1.00 0.00 C ATOM 0 H ILE A 53 -12.330 -2.262 -4.852 1.00 0.00 H new ATOM 0 HA ILE A 53 -13.044 0.179 -3.692 1.00 0.00 H new ATOM 0 HB ILE A 53 -10.575 -1.548 -3.224 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -13.118 -1.563 -1.594 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -12.976 -2.552 -3.033 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -10.553 -0.519 -0.985 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -10.336 0.694 -2.268 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -11.911 0.529 -1.457 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -12.410 -3.836 -1.029 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -10.987 -3.669 -2.086 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -11.132 -2.664 -0.624 1.00 0.00 H new ATOM 842 N ARG A 54 -10.134 0.192 -5.288 1.00 0.00 N ATOM 843 CA ARG A 54 -9.140 1.061 -5.906 1.00 0.00 C ATOM 844 C ARG A 54 -9.809 2.114 -6.785 1.00 0.00 C ATOM 845 O ARG A 54 -9.731 3.309 -6.507 1.00 0.00 O ATOM 846 CB ARG A 54 -8.157 0.236 -6.738 1.00 0.00 C ATOM 847 CG ARG A 54 -6.857 0.962 -7.042 1.00 0.00 C ATOM 848 CD ARG A 54 -5.952 0.132 -7.939 1.00 0.00 C ATOM 849 NE ARG A 54 -6.614 -0.247 -9.184 1.00 0.00 N ATOM 850 CZ ARG A 54 -5.991 -0.835 -10.199 1.00 0.00 C ATOM 851 NH1 ARG A 54 -4.696 -1.110 -10.116 1.00 0.00 N ATOM 852 NH2 ARG A 54 -6.662 -1.150 -11.300 1.00 0.00 N ATOM 0 H ARG A 54 -9.946 -0.805 -5.392 1.00 0.00 H new ATOM 0 HA ARG A 54 -8.595 1.570 -5.111 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -7.931 -0.689 -6.207 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -8.635 -0.044 -7.677 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -7.075 1.914 -7.525 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -6.339 1.188 -6.110 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -5.049 0.698 -8.167 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -5.639 -0.766 -7.407 1.00 0.00 H new ATOM 0 HE ARG A 54 -7.610 -0.049 -9.280 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -4.177 -0.870 -9.272 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -4.219 -1.562 -10.897 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -7.658 -0.941 -11.368 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -6.182 -1.602 -12.078 1.00 0.00 H new ATOM 866 N ASN A 55 -10.466 1.659 -7.847 1.00 0.00 N ATOM 867 CA ASN A 55 -11.148 2.561 -8.768 1.00 0.00 C ATOM 868 C ASN A 55 -11.778 3.731 -8.018 1.00 0.00 C ATOM 869 O ASN A 55 -11.630 4.887 -8.412 1.00 0.00 O ATOM 870 CB ASN A 55 -12.222 1.806 -9.553 1.00 0.00 C ATOM 871 CG ASN A 55 -11.676 1.173 -10.819 1.00 0.00 C ATOM 872 OD1 ASN A 55 -12.106 1.500 -11.925 1.00 0.00 O ATOM 873 ND2 ASN A 55 -10.723 0.262 -10.660 1.00 0.00 N ATOM 0 H ASN A 55 -10.541 0.671 -8.091 1.00 0.00 H new ATOM 0 HA ASN A 55 -10.408 2.955 -9.465 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -12.654 1.031 -8.920 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -13.029 2.492 -9.812 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -10.316 -0.198 -11.474 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -10.397 0.023 -9.723 1.00 0.00 H new ATOM 880 N TYR A 56 -12.481 3.421 -6.934 1.00 0.00 N ATOM 881 CA TYR A 56 -13.135 4.445 -6.128 1.00 0.00 C ATOM 882 C TYR A 56 -12.126 5.476 -5.634 1.00 0.00 C ATOM 883 O TYR A 56 -12.284 6.675 -5.864 1.00 0.00 O ATOM 884 CB TYR A 56 -13.853 3.806 -4.939 1.00 0.00 C ATOM 885 CG TYR A 56 -14.739 4.767 -4.179 1.00 0.00 C ATOM 886 CD1 TYR A 56 -14.199 5.676 -3.278 1.00 0.00 C ATOM 887 CD2 TYR A 56 -16.117 4.766 -4.362 1.00 0.00 C ATOM 888 CE1 TYR A 56 -15.005 6.556 -2.581 1.00 0.00 C ATOM 889 CE2 TYR A 56 -16.930 5.643 -3.671 1.00 0.00 C ATOM 890 CZ TYR A 56 -16.369 6.536 -2.781 1.00 0.00 C ATOM 891 OH TYR A 56 -17.176 7.410 -2.089 1.00 0.00 O ATOM 0 H TYR A 56 -12.612 2.469 -6.593 1.00 0.00 H new ATOM 0 HA TYR A 56 -13.867 4.953 -6.756 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -14.458 2.972 -5.296 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -13.111 3.392 -4.257 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -13.131 5.695 -3.119 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -16.560 4.067 -5.057 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -14.569 7.256 -1.883 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -17.999 5.630 -3.826 1.00 0.00 H new ATOM 0 HH TYR A 56 -18.111 7.266 -2.347 1.00 0.00 H new ATOM 901 N ILE A 57 -11.088 5.000 -4.953 1.00 0.00 N ATOM 902 CA ILE A 57 -10.052 5.879 -4.427 1.00 0.00 C ATOM 903 C ILE A 57 -9.420 6.711 -5.538 1.00 0.00 C ATOM 904 O ILE A 57 -9.444 7.941 -5.498 1.00 0.00 O ATOM 905 CB ILE A 57 -8.948 5.081 -3.708 1.00 0.00 C ATOM 906 CG1 ILE A 57 -9.506 4.422 -2.445 1.00 0.00 C ATOM 907 CG2 ILE A 57 -7.776 5.989 -3.365 1.00 0.00 C ATOM 908 CD1 ILE A 57 -8.505 3.543 -1.729 1.00 0.00 C ATOM 0 H ILE A 57 -10.943 4.010 -4.753 1.00 0.00 H new ATOM 0 HA ILE A 57 -10.536 6.542 -3.710 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.592 4.298 -4.377 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -9.850 5.198 -1.762 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -10.377 3.824 -2.712 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -7.004 5.411 -2.857 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -7.366 6.416 -4.280 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -8.117 6.792 -2.711 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -8.970 3.109 -0.844 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.179 2.745 -2.396 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -7.644 4.141 -1.431 1.00 0.00 H new ATOM 920 N LEU A 58 -8.857 6.031 -6.531 1.00 0.00 N ATOM 921 CA LEU A 58 -8.220 6.706 -7.656 1.00 0.00 C ATOM 922 C LEU A 58 -9.137 7.777 -8.238 1.00 0.00 C ATOM 923 O LEU A 58 -8.674 8.820 -8.702 1.00 0.00 O ATOM 924 CB LEU A 58 -7.847 5.693 -8.740 1.00 0.00 C ATOM 925 CG LEU A 58 -6.533 4.940 -8.532 1.00 0.00 C ATOM 926 CD1 LEU A 58 -6.338 3.895 -9.620 1.00 0.00 C ATOM 927 CD2 LEU A 58 -5.361 5.909 -8.504 1.00 0.00 C ATOM 0 H LEU A 58 -8.829 5.013 -6.580 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.313 7.189 -7.292 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -8.652 4.963 -8.819 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -7.796 6.216 -9.695 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.578 4.429 -7.570 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -5.397 3.369 -9.455 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -7.162 3.182 -9.592 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -6.315 4.384 -10.594 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -4.434 5.355 -8.355 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -5.313 6.449 -9.450 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.495 6.618 -7.687 1.00 0.00 H new ATOM 939 N ASP A 59 -10.438 7.514 -8.210 1.00 0.00 N ATOM 940 CA ASP A 59 -11.421 8.456 -8.732 1.00 0.00 C ATOM 941 C ASP A 59 -11.565 9.659 -7.805 1.00 0.00 C ATOM 942 O ASP A 59 -11.466 10.806 -8.242 1.00 0.00 O ATOM 943 CB ASP A 59 -12.775 7.768 -8.909 1.00 0.00 C ATOM 944 CG ASP A 59 -12.918 7.113 -10.269 1.00 0.00 C ATOM 945 OD1 ASP A 59 -12.976 7.847 -11.277 1.00 0.00 O ATOM 946 OD2 ASP A 59 -12.973 5.866 -10.325 1.00 0.00 O ATOM 0 H ASP A 59 -10.837 6.655 -7.831 1.00 0.00 H new ATOM 0 HA ASP A 59 -11.072 8.807 -9.703 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -12.901 7.015 -8.131 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -13.571 8.500 -8.776 1.00 0.00 H new ATOM 951 N GLN A 60 -11.801 9.389 -6.525 1.00 0.00 N ATOM 952 CA GLN A 60 -11.961 10.450 -5.538 1.00 0.00 C ATOM 953 C GLN A 60 -10.736 11.357 -5.510 1.00 0.00 C ATOM 954 O GLN A 60 -10.859 12.582 -5.480 1.00 0.00 O ATOM 955 CB GLN A 60 -12.200 9.853 -4.150 1.00 0.00 C ATOM 956 CG GLN A 60 -13.485 9.048 -4.047 1.00 0.00 C ATOM 957 CD GLN A 60 -14.680 9.779 -4.627 1.00 0.00 C ATOM 958 OE1 GLN A 60 -15.016 10.883 -4.197 1.00 0.00 O ATOM 959 NE2 GLN A 60 -15.329 9.166 -5.610 1.00 0.00 N ATOM 0 H GLN A 60 -11.886 8.445 -6.148 1.00 0.00 H new ATOM 0 HA GLN A 60 -12.827 11.048 -5.822 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -11.358 9.212 -3.889 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -12.226 10.659 -3.417 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -13.357 8.099 -4.567 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -13.680 8.814 -3.000 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -15.016 8.251 -5.935 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -16.141 9.610 -6.040 1.00 0.00 H new ATOM 968 N TRP A 61 -9.556 10.749 -5.521 1.00 0.00 N ATOM 969 CA TRP A 61 -8.307 11.503 -5.496 1.00 0.00 C ATOM 970 C TRP A 61 -8.389 12.722 -6.408 1.00 0.00 C ATOM 971 O TRP A 61 -8.163 13.850 -5.972 1.00 0.00 O ATOM 972 CB TRP A 61 -7.140 10.610 -5.922 1.00 0.00 C ATOM 973 CG TRP A 61 -6.022 11.365 -6.574 1.00 0.00 C ATOM 974 CD1 TRP A 61 -5.433 11.083 -7.773 1.00 0.00 C ATOM 975 CD2 TRP A 61 -5.357 12.525 -6.061 1.00 0.00 C ATOM 976 NE1 TRP A 61 -4.442 11.998 -8.037 1.00 0.00 N ATOM 977 CE2 TRP A 61 -4.377 12.894 -7.003 1.00 0.00 C ATOM 978 CE3 TRP A 61 -5.497 13.290 -4.900 1.00 0.00 C ATOM 979 CZ2 TRP A 61 -3.541 13.992 -6.815 1.00 0.00 C ATOM 980 CZ3 TRP A 61 -4.667 14.379 -4.715 1.00 0.00 C ATOM 981 CH2 TRP A 61 -3.700 14.722 -5.669 1.00 0.00 C ATOM 0 H TRP A 61 -9.437 9.736 -5.547 1.00 0.00 H new ATOM 0 HA TRP A 61 -8.139 11.847 -4.475 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -6.754 10.087 -5.047 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -7.506 9.850 -6.612 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -5.706 10.262 -8.419 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -3.851 12.008 -8.868 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -6.241 13.034 -4.160 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -2.794 14.258 -7.548 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -4.765 14.976 -3.820 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -3.067 15.580 -5.496 1.00 0.00 H new ATOM 992 N GLU A 62 -8.715 12.487 -7.675 1.00 0.00 N ATOM 993 CA GLU A 62 -8.827 13.568 -8.648 1.00 0.00 C ATOM 994 C GLU A 62 -10.028 14.457 -8.338 1.00 0.00 C ATOM 995 O GLU A 62 -9.997 15.665 -8.576 1.00 0.00 O ATOM 996 CB GLU A 62 -8.950 13.000 -10.063 1.00 0.00 C ATOM 997 CG GLU A 62 -8.193 11.698 -10.264 1.00 0.00 C ATOM 998 CD GLU A 62 -7.802 11.469 -11.711 1.00 0.00 C ATOM 999 OE1 GLU A 62 -7.112 12.338 -12.284 1.00 0.00 O ATOM 1000 OE2 GLU A 62 -8.185 10.420 -12.271 1.00 0.00 O ATOM 0 H GLU A 62 -8.906 11.559 -8.052 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.923 14.174 -8.585 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.004 12.837 -10.290 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.582 13.738 -10.775 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.295 11.705 -9.646 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.810 10.867 -9.922 1.00 0.00 H new ATOM 1007 N ILE A 63 -11.084 13.850 -7.807 1.00 0.00 N ATOM 1008 CA ILE A 63 -12.295 14.586 -7.464 1.00 0.00 C ATOM 1009 C ILE A 63 -11.998 15.695 -6.461 1.00 0.00 C ATOM 1010 O ILE A 63 -12.744 16.670 -6.359 1.00 0.00 O ATOM 1011 CB ILE A 63 -13.373 13.655 -6.879 1.00 0.00 C ATOM 1012 CG1 ILE A 63 -13.965 12.770 -7.978 1.00 0.00 C ATOM 1013 CG2 ILE A 63 -14.465 14.469 -6.201 1.00 0.00 C ATOM 1014 CD1 ILE A 63 -14.829 11.646 -7.450 1.00 0.00 C ATOM 0 H ILE A 63 -11.126 12.851 -7.605 1.00 0.00 H new ATOM 0 HA ILE A 63 -12.670 15.026 -8.388 1.00 0.00 H new ATOM 0 HB ILE A 63 -12.909 13.012 -6.131 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -14.559 13.389 -8.651 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -13.153 12.346 -8.569 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -15.220 13.797 -5.793 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -14.031 15.060 -5.395 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -14.928 15.134 -6.930 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -15.214 11.060 -8.285 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -14.234 11.004 -6.801 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -15.662 12.063 -6.884 1.00 0.00 H new ATOM 1026 N CYS A 64 -10.905 15.542 -5.723 1.00 0.00 N ATOM 1027 CA CYS A 64 -10.508 16.531 -4.728 1.00 0.00 C ATOM 1028 C CYS A 64 -9.240 17.260 -5.161 1.00 0.00 C ATOM 1029 O CYS A 64 -9.066 18.446 -4.880 1.00 0.00 O ATOM 1030 CB CYS A 64 -10.287 15.861 -3.371 1.00 0.00 C ATOM 1031 SG CYS A 64 -11.798 15.642 -2.401 1.00 0.00 S ATOM 0 H CYS A 64 -10.277 14.741 -5.795 1.00 0.00 H new ATOM 0 HA CYS A 64 -11.312 17.261 -4.638 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -9.826 14.886 -3.530 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -9.581 16.458 -2.794 1.00 0.00 H new ATOM 0 HG CYS A 64 -11.509 15.066 -1.272 1.00 0.00 H new ATOM 1037 N LYS A 65 -8.356 16.543 -5.845 1.00 0.00 N ATOM 1038 CA LYS A 65 -7.103 17.119 -6.317 1.00 0.00 C ATOM 1039 C LYS A 65 -7.320 18.533 -6.846 1.00 0.00 C ATOM 1040 O LYS A 65 -8.414 18.899 -7.277 1.00 0.00 O ATOM 1041 CB LYS A 65 -6.494 16.241 -7.412 1.00 0.00 C ATOM 1042 CG LYS A 65 -6.920 16.636 -8.815 1.00 0.00 C ATOM 1043 CD LYS A 65 -6.209 15.804 -9.869 1.00 0.00 C ATOM 1044 CE LYS A 65 -4.798 16.313 -10.122 1.00 0.00 C ATOM 1045 NZ LYS A 65 -4.336 16.005 -11.503 1.00 0.00 N ATOM 0 H LYS A 65 -8.484 15.560 -6.085 1.00 0.00 H new ATOM 0 HA LYS A 65 -6.414 17.167 -5.474 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.407 16.291 -7.344 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.777 15.204 -7.234 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -7.998 16.511 -8.918 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -6.705 17.692 -8.978 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -6.169 14.763 -9.547 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -6.778 15.829 -10.798 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -4.766 17.391 -9.961 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -4.115 15.863 -9.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -3.371 16.368 -11.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -4.342 14.975 -11.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -4.973 16.456 -12.191 1.00 0.00 H new ATOM 1059 N PRO A 66 -6.255 19.348 -6.815 1.00 0.00 N ATOM 1060 CA PRO A 66 -4.948 18.923 -6.304 1.00 0.00 C ATOM 1061 C PRO A 66 -4.956 18.716 -4.793 1.00 0.00 C ATOM 1062 O PRO A 66 -4.012 18.166 -4.226 1.00 0.00 O ATOM 1063 CB PRO A 66 -4.026 20.086 -6.679 1.00 0.00 C ATOM 1064 CG PRO A 66 -4.926 21.269 -6.775 1.00 0.00 C ATOM 1065 CD PRO A 66 -6.244 20.746 -7.277 1.00 0.00 C ATOM 0 HA PRO A 66 -4.639 17.964 -6.721 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -3.253 20.237 -5.925 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.517 19.898 -7.624 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -5.042 21.751 -5.804 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -4.518 22.016 -7.456 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -7.082 21.311 -6.869 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -6.315 20.811 -8.363 1.00 0.00 H new ATOM 1073 N LYS A 67 -6.029 19.160 -4.146 1.00 0.00 N ATOM 1074 CA LYS A 67 -6.161 19.022 -2.700 1.00 0.00 C ATOM 1075 C LYS A 67 -5.942 17.575 -2.269 1.00 0.00 C ATOM 1076 O LYS A 67 -6.073 16.651 -3.073 1.00 0.00 O ATOM 1077 CB LYS A 67 -7.544 19.496 -2.247 1.00 0.00 C ATOM 1078 CG LYS A 67 -7.672 21.007 -2.165 1.00 0.00 C ATOM 1079 CD LYS A 67 -7.279 21.672 -3.473 1.00 0.00 C ATOM 1080 CE LYS A 67 -7.302 23.189 -3.356 1.00 0.00 C ATOM 1081 NZ LYS A 67 -5.991 23.730 -2.904 1.00 0.00 N ATOM 0 H LYS A 67 -6.819 19.618 -4.600 1.00 0.00 H new ATOM 0 HA LYS A 67 -5.398 19.642 -2.229 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -8.295 19.113 -2.938 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -7.763 19.068 -1.269 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -8.699 21.273 -1.915 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -7.040 21.383 -1.360 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -6.281 21.344 -3.764 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -7.961 21.356 -4.262 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -7.561 23.624 -4.321 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -8.080 23.487 -2.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -6.048 24.766 -2.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -5.755 23.335 -1.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -5.253 23.467 -3.588 1.00 0.00 H new ATOM 1095 N TYR A 68 -5.609 17.385 -0.998 1.00 0.00 N ATOM 1096 CA TYR A 68 -5.370 16.051 -0.461 1.00 0.00 C ATOM 1097 C TYR A 68 -6.685 15.305 -0.253 1.00 0.00 C ATOM 1098 O TYR A 68 -7.741 15.916 -0.088 1.00 0.00 O ATOM 1099 CB TYR A 68 -4.607 16.140 0.862 1.00 0.00 C ATOM 1100 CG TYR A 68 -4.323 14.793 1.488 1.00 0.00 C ATOM 1101 CD1 TYR A 68 -3.302 13.983 1.008 1.00 0.00 C ATOM 1102 CD2 TYR A 68 -5.076 14.332 2.562 1.00 0.00 C ATOM 1103 CE1 TYR A 68 -3.040 12.751 1.577 1.00 0.00 C ATOM 1104 CE2 TYR A 68 -4.820 13.103 3.138 1.00 0.00 C ATOM 1105 CZ TYR A 68 -3.801 12.316 2.642 1.00 0.00 C ATOM 1106 OH TYR A 68 -3.542 11.091 3.212 1.00 0.00 O ATOM 0 H TYR A 68 -5.498 18.139 -0.319 1.00 0.00 H new ATOM 0 HA TYR A 68 -4.769 15.498 -1.183 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -3.664 16.659 0.694 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -5.182 16.744 1.564 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -2.703 14.322 0.176 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -5.875 14.945 2.953 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -2.244 12.132 1.190 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -5.414 12.760 3.972 1.00 0.00 H new ATOM 0 HH TYR A 68 -3.236 10.467 2.521 1.00 0.00 H new ATOM 1116 N LEU A 69 -6.612 13.978 -0.262 1.00 0.00 N ATOM 1117 CA LEU A 69 -7.795 13.145 -0.074 1.00 0.00 C ATOM 1118 C LEU A 69 -7.616 12.206 1.114 1.00 0.00 C ATOM 1119 O LEU A 69 -6.738 11.344 1.111 1.00 0.00 O ATOM 1120 CB LEU A 69 -8.079 12.336 -1.340 1.00 0.00 C ATOM 1121 CG LEU A 69 -9.061 11.174 -1.188 1.00 0.00 C ATOM 1122 CD1 LEU A 69 -10.487 11.646 -1.428 1.00 0.00 C ATOM 1123 CD2 LEU A 69 -8.703 10.044 -2.143 1.00 0.00 C ATOM 0 H LEU A 69 -5.746 13.456 -0.397 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.642 13.800 0.129 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.465 13.014 -2.101 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.135 11.941 -1.714 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.992 10.796 -0.168 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.172 10.806 -1.316 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.741 12.420 -0.704 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.571 12.051 -2.437 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.413 9.226 -2.021 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.743 10.409 -3.169 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.697 9.687 -1.924 1.00 0.00 H new ATOM 1135 N ASN A 70 -8.457 12.378 2.129 1.00 0.00 N ATOM 1136 CA ASN A 70 -8.393 11.545 3.324 1.00 0.00 C ATOM 1137 C ASN A 70 -9.150 10.237 3.116 1.00 0.00 C ATOM 1138 O ASN A 70 -10.196 10.208 2.467 1.00 0.00 O ATOM 1139 CB ASN A 70 -8.970 12.296 4.526 1.00 0.00 C ATOM 1140 CG ASN A 70 -8.774 13.795 4.420 1.00 0.00 C ATOM 1141 OD1 ASN A 70 -9.747 14.479 3.828 1.00 0.00 O flip ATOM 1142 ND2 ASN A 70 -7.759 14.333 4.865 1.00 0.00 N flip ATOM 0 H ASN A 70 -9.190 13.087 2.148 1.00 0.00 H new ATOM 0 HA ASN A 70 -7.346 11.311 3.519 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -10.034 12.077 4.611 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -8.496 11.934 5.438 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -7.037 13.768 5.312 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -7.641 15.343 4.786 1.00 0.00 H new ATOM 1149 N LYS A 71 -8.616 9.155 3.673 1.00 0.00 N ATOM 1150 CA LYS A 71 -9.240 7.843 3.551 1.00 0.00 C ATOM 1151 C LYS A 71 -10.564 7.799 4.307 1.00 0.00 C ATOM 1152 O LYS A 71 -11.391 6.914 4.082 1.00 0.00 O ATOM 1153 CB LYS A 71 -8.301 6.757 4.081 1.00 0.00 C ATOM 1154 CG LYS A 71 -7.810 7.015 5.495 1.00 0.00 C ATOM 1155 CD LYS A 71 -7.323 5.737 6.158 1.00 0.00 C ATOM 1156 CE LYS A 71 -8.474 4.955 6.773 1.00 0.00 C ATOM 1157 NZ LYS A 71 -8.880 5.513 8.093 1.00 0.00 N ATOM 0 H LYS A 71 -7.751 9.161 4.214 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.438 7.659 2.495 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -8.817 5.797 4.054 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -7.441 6.675 3.416 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -7.001 7.745 5.473 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -8.615 7.449 6.087 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -6.812 5.116 5.422 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.594 5.982 6.930 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -9.327 4.970 6.094 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -8.181 3.912 6.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.846 4.763 8.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -8.230 6.279 8.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.848 5.888 8.029 1.00 0.00 H new ATOM 1171 N THR A 72 -10.760 8.760 5.205 1.00 0.00 N ATOM 1172 CA THR A 72 -11.984 8.830 5.994 1.00 0.00 C ATOM 1173 C THR A 72 -13.172 9.239 5.131 1.00 0.00 C ATOM 1174 O THR A 72 -14.324 9.120 5.548 1.00 0.00 O ATOM 1175 CB THR A 72 -11.844 9.827 7.160 1.00 0.00 C ATOM 1176 OG1 THR A 72 -10.541 9.718 7.744 1.00 0.00 O ATOM 1177 CG2 THR A 72 -12.904 9.572 8.221 1.00 0.00 C ATOM 0 H THR A 72 -10.087 9.500 5.404 1.00 0.00 H new ATOM 0 HA THR A 72 -12.158 7.832 6.397 1.00 0.00 H new ATOM 0 HB THR A 72 -11.982 10.834 6.766 1.00 0.00 H new ATOM 0 HG1 THR A 72 -10.459 10.356 8.483 1.00 0.00 H new ATOM 0 HG21 THR A 72 -12.785 10.288 9.034 1.00 0.00 H new ATOM 0 HG22 THR A 72 -13.895 9.685 7.780 1.00 0.00 H new ATOM 0 HG23 THR A 72 -12.793 8.560 8.610 1.00 0.00 H new ATOM 1185 N SER A 73 -12.884 9.720 3.926 1.00 0.00 N ATOM 1186 CA SER A 73 -13.930 10.149 3.005 1.00 0.00 C ATOM 1187 C SER A 73 -14.397 8.988 2.133 1.00 0.00 C ATOM 1188 O SER A 73 -15.501 9.008 1.590 1.00 0.00 O ATOM 1189 CB SER A 73 -13.424 11.293 2.123 1.00 0.00 C ATOM 1190 OG SER A 73 -12.554 10.811 1.113 1.00 0.00 O ATOM 0 H SER A 73 -11.936 9.822 3.565 1.00 0.00 H new ATOM 0 HA SER A 73 -14.777 10.501 3.594 1.00 0.00 H new ATOM 0 HB2 SER A 73 -14.270 11.805 1.665 1.00 0.00 H new ATOM 0 HB3 SER A 73 -12.902 12.027 2.737 1.00 0.00 H new ATOM 0 HG SER A 73 -11.690 10.575 1.511 1.00 0.00 H new ATOM 1196 N VAL A 74 -13.546 7.974 2.003 1.00 0.00 N ATOM 1197 CA VAL A 74 -13.870 6.802 1.199 1.00 0.00 C ATOM 1198 C VAL A 74 -14.144 5.589 2.081 1.00 0.00 C ATOM 1199 O VAL A 74 -14.686 4.584 1.620 1.00 0.00 O ATOM 1200 CB VAL A 74 -12.732 6.463 0.218 1.00 0.00 C ATOM 1201 CG1 VAL A 74 -12.284 7.708 -0.532 1.00 0.00 C ATOM 1202 CG2 VAL A 74 -11.564 5.827 0.956 1.00 0.00 C ATOM 0 H VAL A 74 -12.627 7.941 2.445 1.00 0.00 H new ATOM 0 HA VAL A 74 -14.768 7.045 0.632 1.00 0.00 H new ATOM 0 HB VAL A 74 -13.107 5.744 -0.511 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -11.480 7.448 -1.220 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -13.124 8.117 -1.093 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -11.927 8.453 0.179 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -10.769 5.594 0.247 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -11.188 6.520 1.708 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -11.897 4.910 1.442 1.00 0.00 H new ATOM 1212 N ARG A 75 -13.768 5.691 3.351 1.00 0.00 N ATOM 1213 CA ARG A 75 -13.973 4.602 4.298 1.00 0.00 C ATOM 1214 C ARG A 75 -15.428 4.142 4.291 1.00 0.00 C ATOM 1215 O ARG A 75 -15.738 2.986 4.003 1.00 0.00 O ATOM 1216 CB ARG A 75 -13.571 5.040 5.707 1.00 0.00 C ATOM 1217 CG ARG A 75 -12.140 4.683 6.072 1.00 0.00 C ATOM 1218 CD ARG A 75 -11.982 4.473 7.570 1.00 0.00 C ATOM 1219 NE ARG A 75 -10.869 3.581 7.883 1.00 0.00 N ATOM 1220 CZ ARG A 75 -10.665 3.055 9.086 1.00 0.00 C ATOM 1221 NH1 ARG A 75 -11.495 3.330 10.083 1.00 0.00 N ATOM 1222 NH2 ARG A 75 -9.629 2.253 9.293 1.00 0.00 N ATOM 0 H ARG A 75 -13.320 6.517 3.748 1.00 0.00 H new ATOM 0 HA ARG A 75 -13.344 3.765 3.993 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -13.700 6.119 5.793 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -14.246 4.579 6.428 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -11.844 3.777 5.543 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -11.470 5.477 5.742 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -11.823 5.436 8.056 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -12.904 4.059 7.977 1.00 0.00 H new ATOM 0 HE ARG A 75 -10.212 3.349 7.138 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -12.292 3.947 9.927 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -11.336 2.925 11.005 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -8.988 2.040 8.528 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -9.473 1.850 10.217 1.00 0.00 H new ATOM 1236 N PRO A 76 -16.342 5.067 4.618 1.00 0.00 N ATOM 1237 CA PRO A 76 -17.779 4.781 4.657 1.00 0.00 C ATOM 1238 C PRO A 76 -18.363 4.553 3.267 1.00 0.00 C ATOM 1239 O PRO A 76 -19.374 3.870 3.112 1.00 0.00 O ATOM 1240 CB PRO A 76 -18.375 6.042 5.288 1.00 0.00 C ATOM 1241 CG PRO A 76 -17.397 7.121 4.975 1.00 0.00 C ATOM 1242 CD PRO A 76 -16.044 6.465 4.974 1.00 0.00 C ATOM 0 HA PRO A 76 -17.998 3.867 5.210 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -19.358 6.266 4.873 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -18.503 5.924 6.364 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -17.612 7.574 4.007 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -17.444 7.918 5.717 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -15.373 6.929 4.251 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -15.562 6.537 5.949 1.00 0.00 H new ATOM 1250 N GLY A 77 -17.718 5.130 2.257 1.00 0.00 N ATOM 1251 CA GLY A 77 -18.189 4.978 0.893 1.00 0.00 C ATOM 1252 C GLY A 77 -18.158 3.536 0.427 1.00 0.00 C ATOM 1253 O GLY A 77 -19.128 3.041 -0.149 1.00 0.00 O ATOM 0 H GLY A 77 -16.878 5.700 2.359 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -19.208 5.359 0.819 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -17.573 5.585 0.229 1.00 0.00 H new ATOM 1257 N LEU A 78 -17.042 2.859 0.674 1.00 0.00 N ATOM 1258 CA LEU A 78 -16.888 1.465 0.275 1.00 0.00 C ATOM 1259 C LEU A 78 -16.814 0.553 1.496 1.00 0.00 C ATOM 1260 O LEU A 78 -16.028 -0.394 1.530 1.00 0.00 O ATOM 1261 CB LEU A 78 -15.632 1.294 -0.581 1.00 0.00 C ATOM 1262 CG LEU A 78 -15.505 2.233 -1.781 1.00 0.00 C ATOM 1263 CD1 LEU A 78 -14.043 2.436 -2.147 1.00 0.00 C ATOM 1264 CD2 LEU A 78 -16.283 1.686 -2.970 1.00 0.00 C ATOM 0 H LEU A 78 -16.230 3.253 1.149 1.00 0.00 H new ATOM 0 HA LEU A 78 -17.762 1.183 -0.313 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -14.760 1.433 0.058 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -15.601 0.267 -0.944 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.928 3.200 -1.508 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -13.972 3.107 -3.003 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -13.513 2.871 -1.300 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -13.595 1.475 -2.401 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -16.182 2.367 -3.815 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.889 0.707 -3.243 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -17.336 1.592 -2.704 1.00 0.00 H new ATOM 1276 N LYS A 79 -17.638 0.845 2.496 1.00 0.00 N ATOM 1277 CA LYS A 79 -17.669 0.051 3.719 1.00 0.00 C ATOM 1278 C LYS A 79 -18.168 -1.363 3.437 1.00 0.00 C ATOM 1279 O LYS A 79 -17.876 -2.295 4.185 1.00 0.00 O ATOM 1280 CB LYS A 79 -18.564 0.720 4.764 1.00 0.00 C ATOM 1281 CG LYS A 79 -20.035 0.736 4.383 1.00 0.00 C ATOM 1282 CD LYS A 79 -20.802 1.786 5.170 1.00 0.00 C ATOM 1283 CE LYS A 79 -21.299 1.235 6.497 1.00 0.00 C ATOM 1284 NZ LYS A 79 -22.489 0.357 6.323 1.00 0.00 N ATOM 0 H LYS A 79 -18.294 1.626 2.484 1.00 0.00 H new ATOM 0 HA LYS A 79 -16.652 -0.012 4.107 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -18.449 0.200 5.715 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -18.226 1.745 4.918 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -20.134 0.935 3.316 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -20.470 -0.247 4.565 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -20.160 2.648 5.350 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -21.649 2.137 4.581 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -20.500 0.672 6.978 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -21.552 2.061 7.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -22.868 0.098 7.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -23.218 0.864 5.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -22.213 -0.504 5.810 1.00 0.00 H new ATOM 1298 N ASN A 80 -18.920 -1.514 2.351 1.00 0.00 N ATOM 1299 CA ASN A 80 -19.458 -2.815 1.970 1.00 0.00 C ATOM 1300 C ASN A 80 -18.366 -3.706 1.386 1.00 0.00 C ATOM 1301 O ASN A 80 -18.204 -4.856 1.795 1.00 0.00 O ATOM 1302 CB ASN A 80 -20.590 -2.644 0.955 1.00 0.00 C ATOM 1303 CG ASN A 80 -21.848 -2.075 1.582 1.00 0.00 C ATOM 1304 OD1 ASN A 80 -22.340 -2.587 2.589 1.00 0.00 O ATOM 1305 ND2 ASN A 80 -22.376 -1.011 0.989 1.00 0.00 N ATOM 0 H ASN A 80 -19.170 -0.752 1.720 1.00 0.00 H new ATOM 0 HA ASN A 80 -19.852 -3.294 2.866 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -20.258 -1.986 0.152 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -20.817 -3.609 0.503 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -23.223 -0.585 1.366 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -21.935 -0.620 0.157 1.00 0.00 H new ATOM 1312 N CYS A 81 -17.621 -3.167 0.428 1.00 0.00 N ATOM 1313 CA CYS A 81 -16.544 -3.912 -0.214 1.00 0.00 C ATOM 1314 C CYS A 81 -15.346 -4.049 0.720 1.00 0.00 C ATOM 1315 O CYS A 81 -14.668 -3.068 1.025 1.00 0.00 O ATOM 1316 CB CYS A 81 -16.119 -3.221 -1.510 1.00 0.00 C ATOM 1317 SG CYS A 81 -17.341 -3.329 -2.839 1.00 0.00 S ATOM 0 H CYS A 81 -17.743 -2.217 0.078 1.00 0.00 H new ATOM 0 HA CYS A 81 -16.915 -4.910 -0.448 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -15.918 -2.170 -1.300 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -15.183 -3.662 -1.854 1.00 0.00 H new ATOM 0 HG CYS A 81 -16.887 -4.098 -3.784 1.00 0.00 H new ATOM 1323 N GLY A 82 -15.091 -5.273 1.173 1.00 0.00 N ATOM 1324 CA GLY A 82 -13.976 -5.515 2.070 1.00 0.00 C ATOM 1325 C GLY A 82 -14.166 -4.857 3.422 1.00 0.00 C ATOM 1326 O GLY A 82 -15.289 -4.539 3.813 1.00 0.00 O ATOM 0 H GLY A 82 -15.637 -6.101 0.935 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -13.850 -6.589 2.207 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -13.059 -5.142 1.614 1.00 0.00 H new ATOM 1330 N ASP A 83 -13.066 -4.654 4.139 1.00 0.00 N ATOM 1331 CA ASP A 83 -13.116 -4.030 5.456 1.00 0.00 C ATOM 1332 C ASP A 83 -12.112 -2.885 5.553 1.00 0.00 C ATOM 1333 O ASP A 83 -11.400 -2.586 4.594 1.00 0.00 O ATOM 1334 CB ASP A 83 -12.834 -5.066 6.545 1.00 0.00 C ATOM 1335 CG ASP A 83 -13.499 -4.717 7.862 1.00 0.00 C ATOM 1336 OD1 ASP A 83 -14.746 -4.665 7.901 1.00 0.00 O ATOM 1337 OD2 ASP A 83 -12.773 -4.495 8.854 1.00 0.00 O ATOM 0 H ASP A 83 -12.129 -4.913 3.830 1.00 0.00 H new ATOM 0 HA ASP A 83 -14.117 -3.625 5.602 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -13.184 -6.043 6.212 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -11.757 -5.147 6.695 1.00 0.00 H new ATOM 1342 N VAL A 84 -12.062 -2.247 6.718 1.00 0.00 N ATOM 1343 CA VAL A 84 -11.146 -1.134 6.941 1.00 0.00 C ATOM 1344 C VAL A 84 -9.697 -1.571 6.758 1.00 0.00 C ATOM 1345 O VAL A 84 -8.902 -0.872 6.131 1.00 0.00 O ATOM 1346 CB VAL A 84 -11.318 -0.540 8.352 1.00 0.00 C ATOM 1347 CG1 VAL A 84 -12.793 -0.384 8.690 1.00 0.00 C ATOM 1348 CG2 VAL A 84 -10.614 -1.408 9.384 1.00 0.00 C ATOM 0 H VAL A 84 -12.645 -2.481 7.522 1.00 0.00 H new ATOM 0 HA VAL A 84 -11.388 -0.370 6.202 1.00 0.00 H new ATOM 0 HB VAL A 84 -10.860 0.449 8.370 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.895 0.037 9.690 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -13.264 0.282 7.967 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -13.279 -1.359 8.656 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -10.746 -0.974 10.375 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -11.040 -2.411 9.368 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -9.551 -1.462 9.150 1.00 0.00 H new ATOM 1358 N ASN A 85 -9.360 -2.732 7.311 1.00 0.00 N ATOM 1359 CA ASN A 85 -8.005 -3.262 7.209 1.00 0.00 C ATOM 1360 C ASN A 85 -7.532 -3.270 5.759 1.00 0.00 C ATOM 1361 O ASN A 85 -6.356 -3.037 5.478 1.00 0.00 O ATOM 1362 CB ASN A 85 -7.945 -4.678 7.785 1.00 0.00 C ATOM 1363 CG ASN A 85 -7.763 -4.683 9.290 1.00 0.00 C ATOM 1364 OD1 ASN A 85 -6.649 -4.537 9.793 1.00 0.00 O ATOM 1365 ND2 ASN A 85 -8.861 -4.852 10.018 1.00 0.00 N ATOM 0 H ASN A 85 -10.006 -3.323 7.834 1.00 0.00 H new ATOM 0 HA ASN A 85 -7.343 -2.614 7.784 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -8.862 -5.210 7.531 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.122 -5.222 7.321 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -8.801 -4.864 11.036 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -9.764 -4.969 9.559 1.00 0.00 H new ATOM 1372 N CYS A 86 -8.455 -3.539 4.843 1.00 0.00 N ATOM 1373 CA CYS A 86 -8.133 -3.577 3.420 1.00 0.00 C ATOM 1374 C CYS A 86 -8.103 -2.171 2.831 1.00 0.00 C ATOM 1375 O CYS A 86 -7.133 -1.780 2.181 1.00 0.00 O ATOM 1376 CB CYS A 86 -9.150 -4.437 2.669 1.00 0.00 C ATOM 1377 SG CYS A 86 -9.412 -6.073 3.392 1.00 0.00 S ATOM 0 H CYS A 86 -9.432 -3.734 5.059 1.00 0.00 H new ATOM 0 HA CYS A 86 -7.143 -4.018 3.308 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -10.103 -3.909 2.637 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -8.817 -4.557 1.638 1.00 0.00 H new ATOM 0 HG CYS A 86 -10.290 -6.723 2.688 1.00 0.00 H new ATOM 1383 N ILE A 87 -9.172 -1.416 3.062 1.00 0.00 N ATOM 1384 CA ILE A 87 -9.267 -0.053 2.553 1.00 0.00 C ATOM 1385 C ILE A 87 -7.959 0.703 2.758 1.00 0.00 C ATOM 1386 O ILE A 87 -7.457 1.354 1.842 1.00 0.00 O ATOM 1387 CB ILE A 87 -10.408 0.724 3.237 1.00 0.00 C ATOM 1388 CG1 ILE A 87 -11.766 0.223 2.738 1.00 0.00 C ATOM 1389 CG2 ILE A 87 -10.261 2.216 2.980 1.00 0.00 C ATOM 1390 CD1 ILE A 87 -12.912 0.560 3.665 1.00 0.00 C ATOM 0 H ILE A 87 -9.983 -1.724 3.598 1.00 0.00 H new ATOM 0 HA ILE A 87 -9.477 -0.128 1.486 1.00 0.00 H new ATOM 0 HB ILE A 87 -10.351 0.553 4.312 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -11.965 0.653 1.756 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -11.720 -0.858 2.608 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -11.074 2.751 3.470 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -9.307 2.562 3.379 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -10.296 2.406 1.907 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -13.843 0.175 3.248 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -12.736 0.107 4.641 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -12.985 1.642 3.775 1.00 0.00 H new ATOM 1402 N GLY A 88 -7.411 0.611 3.966 1.00 0.00 N ATOM 1403 CA GLY A 88 -6.164 1.290 4.268 1.00 0.00 C ATOM 1404 C GLY A 88 -5.014 0.798 3.413 1.00 0.00 C ATOM 1405 O GLY A 88 -4.198 1.591 2.943 1.00 0.00 O ATOM 0 H GLY A 88 -7.808 0.079 4.740 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -6.292 2.362 4.117 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -5.919 1.143 5.320 1.00 0.00 H new ATOM 1409 N ARG A 89 -4.947 -0.514 3.211 1.00 0.00 N ATOM 1410 CA ARG A 89 -3.886 -1.110 2.409 1.00 0.00 C ATOM 1411 C ARG A 89 -3.827 -0.472 1.024 1.00 0.00 C ATOM 1412 O ARG A 89 -2.783 0.030 0.606 1.00 0.00 O ATOM 1413 CB ARG A 89 -4.103 -2.619 2.279 1.00 0.00 C ATOM 1414 CG ARG A 89 -3.510 -3.421 3.426 1.00 0.00 C ATOM 1415 CD ARG A 89 -2.026 -3.679 3.217 1.00 0.00 C ATOM 1416 NE ARG A 89 -1.306 -3.785 4.483 1.00 0.00 N ATOM 1417 CZ ARG A 89 0.008 -3.960 4.569 1.00 0.00 C ATOM 1418 NH1 ARG A 89 0.742 -4.046 3.468 1.00 0.00 N ATOM 1419 NH2 ARG A 89 0.591 -4.047 5.758 1.00 0.00 N ATOM 0 H ARG A 89 -5.615 -1.184 3.592 1.00 0.00 H new ATOM 0 HA ARG A 89 -2.937 -0.928 2.914 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -5.173 -2.820 2.221 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -3.663 -2.961 1.342 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -3.659 -2.883 4.362 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -4.036 -4.371 3.517 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -1.895 -4.599 2.647 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.598 -2.872 2.623 1.00 0.00 H new ATOM 0 HE ARG A 89 -1.841 -3.721 5.349 1.00 0.00 H new ATOM 0 HH11 ARG A 89 0.298 -3.978 2.552 1.00 0.00 H new ATOM 0 HH12 ARG A 89 1.751 -4.180 3.537 1.00 0.00 H new ATOM 0 HH21 ARG A 89 0.030 -3.980 6.607 1.00 0.00 H new ATOM 0 HH22 ARG A 89 1.600 -4.181 5.823 1.00 0.00 H new ATOM 1433 N ILE A 90 -4.952 -0.497 0.319 1.00 0.00 N ATOM 1434 CA ILE A 90 -5.028 0.080 -1.018 1.00 0.00 C ATOM 1435 C ILE A 90 -4.712 1.571 -0.992 1.00 0.00 C ATOM 1436 O ILE A 90 -3.738 2.021 -1.597 1.00 0.00 O ATOM 1437 CB ILE A 90 -6.421 -0.127 -1.642 1.00 0.00 C ATOM 1438 CG1 ILE A 90 -6.804 -1.608 -1.609 1.00 0.00 C ATOM 1439 CG2 ILE A 90 -6.446 0.400 -3.068 1.00 0.00 C ATOM 1440 CD1 ILE A 90 -8.238 -1.871 -2.011 1.00 0.00 C ATOM 0 H ILE A 90 -5.824 -0.910 0.651 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.286 -0.436 -1.627 1.00 0.00 H new ATOM 0 HB ILE A 90 -7.152 0.431 -1.056 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -6.141 -2.161 -2.275 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -6.641 -1.995 -0.603 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -7.437 0.246 -3.495 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -6.212 1.465 -3.067 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.707 -0.133 -3.666 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -8.438 -2.941 -1.964 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -8.909 -1.346 -1.331 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -8.402 -1.515 -3.028 1.00 0.00 H new ATOM 1452 N HIS A 91 -5.540 2.334 -0.286 1.00 0.00 N ATOM 1453 CA HIS A 91 -5.347 3.776 -0.179 1.00 0.00 C ATOM 1454 C HIS A 91 -3.881 4.110 0.081 1.00 0.00 C ATOM 1455 O HIS A 91 -3.229 4.770 -0.730 1.00 0.00 O ATOM 1456 CB HIS A 91 -6.218 4.347 0.940 1.00 0.00 C ATOM 1457 CG HIS A 91 -6.459 5.820 0.820 1.00 0.00 C ATOM 1458 ND1 HIS A 91 -5.701 6.763 1.480 1.00 0.00 N ATOM 1459 CD2 HIS A 91 -7.380 6.511 0.108 1.00 0.00 C ATOM 1460 CE1 HIS A 91 -6.146 7.971 1.181 1.00 0.00 C ATOM 1461 NE2 HIS A 91 -7.164 7.846 0.350 1.00 0.00 N ATOM 0 H HIS A 91 -6.351 1.978 0.220 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.642 4.228 -1.126 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -7.177 3.829 0.942 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.743 4.142 1.899 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -4.919 6.560 2.102 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -8.143 6.091 -0.531 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -5.745 8.902 1.553 1.00 0.00 H new ATOM 1469 N THR A 92 -3.367 3.651 1.219 1.00 0.00 N ATOM 1470 CA THR A 92 -1.979 3.903 1.587 1.00 0.00 C ATOM 1471 C THR A 92 -1.044 3.646 0.411 1.00 0.00 C ATOM 1472 O THR A 92 -0.455 4.576 -0.141 1.00 0.00 O ATOM 1473 CB THR A 92 -1.545 3.025 2.775 1.00 0.00 C ATOM 1474 OG1 THR A 92 -2.325 3.346 3.932 1.00 0.00 O ATOM 1475 CG2 THR A 92 -0.068 3.221 3.082 1.00 0.00 C ATOM 0 H THR A 92 -3.891 3.103 1.901 1.00 0.00 H new ATOM 0 HA THR A 92 -1.914 4.952 1.877 1.00 0.00 H new ATOM 0 HB THR A 92 -1.708 1.981 2.506 1.00 0.00 H new ATOM 0 HG1 THR A 92 -3.166 2.843 3.910 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.215 2.590 3.925 1.00 0.00 H new ATOM 0 HG22 THR A 92 0.525 2.947 2.209 1.00 0.00 H new ATOM 0 HG23 THR A 92 0.116 4.266 3.333 1.00 0.00 H new ATOM 1483 N TYR A 93 -0.911 2.380 0.032 1.00 0.00 N ATOM 1484 CA TYR A 93 -0.045 2.001 -1.078 1.00 0.00 C ATOM 1485 C TYR A 93 -0.085 3.051 -2.183 1.00 0.00 C ATOM 1486 O TYR A 93 0.907 3.734 -2.444 1.00 0.00 O ATOM 1487 CB TYR A 93 -0.463 0.640 -1.636 1.00 0.00 C ATOM 1488 CG TYR A 93 0.161 0.317 -2.976 1.00 0.00 C ATOM 1489 CD1 TYR A 93 1.541 0.249 -3.123 1.00 0.00 C ATOM 1490 CD2 TYR A 93 -0.630 0.082 -4.094 1.00 0.00 C ATOM 1491 CE1 TYR A 93 2.115 -0.044 -4.345 1.00 0.00 C ATOM 1492 CE2 TYR A 93 -0.064 -0.213 -5.319 1.00 0.00 C ATOM 1493 CZ TYR A 93 1.308 -0.275 -5.439 1.00 0.00 C ATOM 1494 OH TYR A 93 1.875 -0.568 -6.659 1.00 0.00 O ATOM 0 H TYR A 93 -1.392 1.599 0.477 1.00 0.00 H new ATOM 0 HA TYR A 93 0.976 1.934 -0.703 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -0.190 -0.136 -0.921 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -1.548 0.615 -1.734 1.00 0.00 H new ATOM 0 HD1 TYR A 93 2.176 0.428 -2.268 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -1.705 0.131 -4.004 1.00 0.00 H new ATOM 0 HE1 TYR A 93 3.189 -0.092 -4.443 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -0.693 -0.394 -6.178 1.00 0.00 H new ATOM 0 HH TYR A 93 2.530 -1.289 -6.551 1.00 0.00 H new ATOM 1504 N LEU A 94 -1.238 3.175 -2.830 1.00 0.00 N ATOM 1505 CA LEU A 94 -1.411 4.143 -3.909 1.00 0.00 C ATOM 1506 C LEU A 94 -0.806 5.491 -3.532 1.00 0.00 C ATOM 1507 O LEU A 94 -0.283 6.208 -4.385 1.00 0.00 O ATOM 1508 CB LEU A 94 -2.895 4.310 -4.238 1.00 0.00 C ATOM 1509 CG LEU A 94 -3.633 3.044 -4.675 1.00 0.00 C ATOM 1510 CD1 LEU A 94 -5.102 3.123 -4.290 1.00 0.00 C ATOM 1511 CD2 LEU A 94 -3.483 2.831 -6.174 1.00 0.00 C ATOM 0 H LEU A 94 -2.068 2.618 -2.627 1.00 0.00 H new ATOM 0 HA LEU A 94 -0.891 3.766 -4.790 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.398 4.715 -3.360 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.990 5.053 -5.030 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.190 2.191 -4.161 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.611 2.214 -4.609 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.190 3.228 -3.209 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.560 3.985 -4.776 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.014 1.926 -6.468 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -3.900 3.686 -6.706 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.427 2.729 -6.423 1.00 0.00 H new ATOM 1523 N GLU A 95 -0.880 5.829 -2.248 1.00 0.00 N ATOM 1524 CA GLU A 95 -0.338 7.092 -1.759 1.00 0.00 C ATOM 1525 C GLU A 95 1.184 7.035 -1.677 1.00 0.00 C ATOM 1526 O GLU A 95 1.865 8.045 -1.862 1.00 0.00 O ATOM 1527 CB GLU A 95 -0.922 7.424 -0.384 1.00 0.00 C ATOM 1528 CG GLU A 95 -0.835 8.898 -0.026 1.00 0.00 C ATOM 1529 CD GLU A 95 -1.288 9.182 1.393 1.00 0.00 C ATOM 1530 OE1 GLU A 95 -2.420 8.788 1.744 1.00 0.00 O ATOM 1531 OE2 GLU A 95 -0.511 9.798 2.151 1.00 0.00 O ATOM 0 H GLU A 95 -1.309 5.247 -1.529 1.00 0.00 H new ATOM 0 HA GLU A 95 -0.617 7.875 -2.463 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -1.966 7.113 -0.357 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -0.397 6.843 0.374 1.00 0.00 H new ATOM 0 HG2 GLU A 95 0.193 9.238 -0.150 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -1.447 9.473 -0.721 1.00 0.00 H new ATOM 1538 N LEU A 96 1.712 5.848 -1.398 1.00 0.00 N ATOM 1539 CA LEU A 96 3.154 5.658 -1.291 1.00 0.00 C ATOM 1540 C LEU A 96 3.813 5.699 -2.666 1.00 0.00 C ATOM 1541 O LEU A 96 4.946 6.160 -2.809 1.00 0.00 O ATOM 1542 CB LEU A 96 3.463 4.327 -0.604 1.00 0.00 C ATOM 1543 CG LEU A 96 2.654 4.018 0.656 1.00 0.00 C ATOM 1544 CD1 LEU A 96 3.018 2.645 1.201 1.00 0.00 C ATOM 1545 CD2 LEU A 96 2.881 5.090 1.712 1.00 0.00 C ATOM 0 H LEU A 96 1.163 5.003 -1.242 1.00 0.00 H new ATOM 0 HA LEU A 96 3.559 6.473 -0.691 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.300 3.524 -1.322 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.522 4.312 -0.345 1.00 0.00 H new ATOM 0 HG LEU A 96 1.596 4.013 0.393 1.00 0.00 H new ATOM 0 HD11 LEU A 96 2.432 2.442 2.098 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.804 1.886 0.448 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.079 2.621 1.448 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.297 4.854 2.602 1.00 0.00 H new ATOM 0 HD22 LEU A 96 3.939 5.127 1.971 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.569 6.058 1.320 1.00 0.00 H new ATOM 1557 N ILE A 97 3.095 5.217 -3.675 1.00 0.00 N ATOM 1558 CA ILE A 97 3.609 5.202 -5.039 1.00 0.00 C ATOM 1559 C ILE A 97 3.428 6.560 -5.709 1.00 0.00 C ATOM 1560 O ILE A 97 4.080 6.862 -6.708 1.00 0.00 O ATOM 1561 CB ILE A 97 2.912 4.125 -5.891 1.00 0.00 C ATOM 1562 CG1 ILE A 97 1.395 4.197 -5.703 1.00 0.00 C ATOM 1563 CG2 ILE A 97 3.431 2.742 -5.524 1.00 0.00 C ATOM 1564 CD1 ILE A 97 0.623 3.359 -6.698 1.00 0.00 C ATOM 0 H ILE A 97 2.156 4.832 -3.574 1.00 0.00 H new ATOM 0 HA ILE A 97 4.672 4.970 -4.974 1.00 0.00 H new ATOM 0 HB ILE A 97 3.138 4.311 -6.941 1.00 0.00 H new ATOM 0 HG12 ILE A 97 1.146 3.869 -4.694 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.075 5.235 -5.789 1.00 0.00 H new ATOM 0 HG21 ILE A 97 2.929 1.991 -6.134 1.00 0.00 H new ATOM 0 HG22 ILE A 97 4.505 2.697 -5.704 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.231 2.546 -4.471 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -0.445 3.458 -6.506 1.00 0.00 H new ATOM 0 HD12 ILE A 97 0.843 3.701 -7.709 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.915 2.314 -6.597 1.00 0.00 H new ATOM 1576 N GLY A 98 2.539 7.376 -5.151 1.00 0.00 N ATOM 1577 CA GLY A 98 2.290 8.693 -5.707 1.00 0.00 C ATOM 1578 C GLY A 98 1.018 8.743 -6.531 1.00 0.00 C ATOM 1579 O GLY A 98 0.408 9.801 -6.679 1.00 0.00 O ATOM 0 H GLY A 98 1.987 7.149 -4.324 1.00 0.00 H new ATOM 0 HA2 GLY A 98 2.223 9.419 -4.897 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.135 8.987 -6.330 1.00 0.00 H new ATOM 1583 N ALA A 99 0.619 7.596 -7.071 1.00 0.00 N ATOM 1584 CA ALA A 99 -0.588 7.514 -7.884 1.00 0.00 C ATOM 1585 C ALA A 99 -1.656 8.479 -7.381 1.00 0.00 C ATOM 1586 O ALA A 99 -2.430 9.028 -8.166 1.00 0.00 O ATOM 1587 CB ALA A 99 -1.123 6.089 -7.892 1.00 0.00 C ATOM 0 H ALA A 99 1.114 6.711 -6.960 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.329 7.799 -8.904 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -2.025 6.042 -8.503 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -0.369 5.420 -8.306 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -1.359 5.783 -6.873 1.00 0.00 H new ATOM 1593 N ILE A 100 -1.693 8.682 -6.068 1.00 0.00 N ATOM 1594 CA ILE A 100 -2.666 9.581 -5.462 1.00 0.00 C ATOM 1595 C ILE A 100 -2.023 10.431 -4.370 1.00 0.00 C ATOM 1596 O ILE A 100 -1.142 9.968 -3.648 1.00 0.00 O ATOM 1597 CB ILE A 100 -3.852 8.805 -4.860 1.00 0.00 C ATOM 1598 CG1 ILE A 100 -3.359 7.816 -3.801 1.00 0.00 C ATOM 1599 CG2 ILE A 100 -4.619 8.078 -5.955 1.00 0.00 C ATOM 1600 CD1 ILE A 100 -4.408 7.460 -2.772 1.00 0.00 C ATOM 0 H ILE A 100 -1.060 8.236 -5.404 1.00 0.00 H new ATOM 0 HA ILE A 100 -3.033 10.230 -6.257 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.526 9.515 -4.381 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -3.023 6.905 -4.295 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.493 8.241 -3.293 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.454 7.534 -5.514 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -4.998 8.802 -6.676 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -3.955 7.376 -6.460 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.989 6.756 -2.054 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.728 8.362 -2.251 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.265 7.005 -3.269 1.00 0.00 H new ATOM 1612 N ASN A 101 -2.473 11.677 -4.256 1.00 0.00 N ATOM 1613 CA ASN A 101 -1.943 12.591 -3.252 1.00 0.00 C ATOM 1614 C ASN A 101 -0.427 12.713 -3.373 1.00 0.00 C ATOM 1615 O ASN A 101 0.302 12.515 -2.400 1.00 0.00 O ATOM 1616 CB ASN A 101 -2.317 12.113 -1.848 1.00 0.00 C ATOM 1617 CG ASN A 101 -3.759 11.651 -1.759 1.00 0.00 C ATOM 1618 OD1 ASN A 101 -4.650 12.240 -2.371 1.00 0.00 O ATOM 1619 ND2 ASN A 101 -3.994 10.590 -0.995 1.00 0.00 N ATOM 0 H ASN A 101 -3.203 12.076 -4.846 1.00 0.00 H new ATOM 0 HA ASN A 101 -2.383 13.573 -3.423 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -1.658 11.295 -1.558 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -2.153 12.922 -1.136 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -4.944 10.232 -0.898 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -3.224 10.133 -0.506 1.00 0.00 H new ATOM 1626 N PHE A 102 0.041 13.040 -4.572 1.00 0.00 N ATOM 1627 CA PHE A 102 1.471 13.188 -4.821 1.00 0.00 C ATOM 1628 C PHE A 102 1.998 14.482 -4.209 1.00 0.00 C ATOM 1629 O PHE A 102 1.286 15.482 -4.134 1.00 0.00 O ATOM 1630 CB PHE A 102 1.753 13.170 -6.325 1.00 0.00 C ATOM 1631 CG PHE A 102 3.204 13.355 -6.665 1.00 0.00 C ATOM 1632 CD1 PHE A 102 4.146 12.416 -6.276 1.00 0.00 C ATOM 1633 CD2 PHE A 102 3.626 14.468 -7.374 1.00 0.00 C ATOM 1634 CE1 PHE A 102 5.482 12.583 -6.588 1.00 0.00 C ATOM 1635 CE2 PHE A 102 4.961 14.640 -7.689 1.00 0.00 C ATOM 1636 CZ PHE A 102 5.890 13.697 -7.294 1.00 0.00 C ATOM 0 H PHE A 102 -0.549 13.208 -5.387 1.00 0.00 H new ATOM 0 HA PHE A 102 1.985 12.349 -4.352 1.00 0.00 H new ATOM 0 HB2 PHE A 102 1.409 12.223 -6.740 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.172 13.958 -6.805 1.00 0.00 H new ATOM 0 HD1 PHE A 102 3.832 11.543 -5.722 1.00 0.00 H new ATOM 0 HD2 PHE A 102 2.904 15.209 -7.684 1.00 0.00 H new ATOM 0 HE1 PHE A 102 6.206 11.843 -6.280 1.00 0.00 H new ATOM 0 HE2 PHE A 102 5.277 15.511 -8.244 1.00 0.00 H new ATOM 0 HZ PHE A 102 6.934 13.831 -7.537 1.00 0.00 H new ATOM 1646 N GLY A 103 3.254 14.454 -3.772 1.00 0.00 N ATOM 1647 CA GLY A 103 3.856 15.630 -3.171 1.00 0.00 C ATOM 1648 C GLY A 103 2.876 16.413 -2.320 1.00 0.00 C ATOM 1649 O GLY A 103 2.275 17.381 -2.786 1.00 0.00 O ATOM 0 H GLY A 103 3.865 13.639 -3.824 1.00 0.00 H new ATOM 0 HA2 GLY A 103 4.704 15.327 -2.557 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.247 16.276 -3.957 1.00 0.00 H new ATOM 1653 N CYS A 104 2.714 15.993 -1.071 1.00 0.00 N ATOM 1654 CA CYS A 104 1.797 16.661 -0.153 1.00 0.00 C ATOM 1655 C CYS A 104 2.197 16.405 1.297 1.00 0.00 C ATOM 1656 O CYS A 104 2.405 15.261 1.700 1.00 0.00 O ATOM 1657 CB CYS A 104 0.365 16.182 -0.392 1.00 0.00 C ATOM 1658 SG CYS A 104 -0.415 16.890 -1.862 1.00 0.00 S ATOM 0 H CYS A 104 3.205 15.194 -0.670 1.00 0.00 H new ATOM 0 HA CYS A 104 1.850 17.733 -0.341 1.00 0.00 H new ATOM 0 HB2 CYS A 104 0.367 15.096 -0.482 1.00 0.00 H new ATOM 0 HB3 CYS A 104 -0.239 16.428 0.481 1.00 0.00 H new ATOM 0 HG CYS A 104 0.503 17.307 -2.682 1.00 0.00 H new ATOM 1664 N GLU A 105 2.304 17.478 2.074 1.00 0.00 N ATOM 1665 CA GLU A 105 2.681 17.368 3.478 1.00 0.00 C ATOM 1666 C GLU A 105 1.655 16.548 4.255 1.00 0.00 C ATOM 1667 O GLU A 105 1.914 16.116 5.378 1.00 0.00 O ATOM 1668 CB GLU A 105 2.817 18.758 4.103 1.00 0.00 C ATOM 1669 CG GLU A 105 1.547 19.589 4.021 1.00 0.00 C ATOM 1670 CD GLU A 105 1.751 21.015 4.495 1.00 0.00 C ATOM 1671 OE1 GLU A 105 1.793 21.232 5.724 1.00 0.00 O ATOM 1672 OE2 GLU A 105 1.870 21.914 3.636 1.00 0.00 O ATOM 0 H GLU A 105 2.135 18.432 1.755 1.00 0.00 H new ATOM 0 HA GLU A 105 3.643 16.858 3.530 1.00 0.00 H new ATOM 0 HB2 GLU A 105 3.104 18.650 5.149 1.00 0.00 H new ATOM 0 HB3 GLU A 105 3.625 19.294 3.604 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.190 19.600 2.991 1.00 0.00 H new ATOM 0 HG3 GLU A 105 0.770 19.118 4.622 1.00 0.00 H new ATOM 1679 N GLN A 106 0.492 16.338 3.648 1.00 0.00 N ATOM 1680 CA GLN A 106 -0.573 15.570 4.283 1.00 0.00 C ATOM 1681 C GLN A 106 -0.555 14.120 3.810 1.00 0.00 C ATOM 1682 O GLN A 106 -1.601 13.536 3.531 1.00 0.00 O ATOM 1683 CB GLN A 106 -1.934 16.201 3.982 1.00 0.00 C ATOM 1684 CG GLN A 106 -2.362 17.240 5.004 1.00 0.00 C ATOM 1685 CD GLN A 106 -3.251 18.314 4.408 1.00 0.00 C ATOM 1686 OE1 GLN A 106 -4.380 18.521 4.854 1.00 0.00 O ATOM 1687 NE2 GLN A 106 -2.745 19.005 3.393 1.00 0.00 N ATOM 0 H GLN A 106 0.263 16.688 2.718 1.00 0.00 H new ATOM 0 HA GLN A 106 -0.404 15.583 5.360 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -1.900 16.666 2.997 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -2.688 15.415 3.938 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -2.892 16.746 5.819 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -1.476 17.706 5.436 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -1.805 18.800 3.055 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -3.297 19.740 2.951 1.00 0.00 H new ATOM 1696 N ALA A 107 0.640 13.546 3.724 1.00 0.00 N ATOM 1697 CA ALA A 107 0.794 12.164 3.286 1.00 0.00 C ATOM 1698 C ALA A 107 1.042 11.238 4.472 1.00 0.00 C ATOM 1699 O ALA A 107 0.999 11.665 5.626 1.00 0.00 O ATOM 1700 CB ALA A 107 1.929 12.052 2.280 1.00 0.00 C ATOM 0 H ALA A 107 1.516 14.016 3.952 1.00 0.00 H new ATOM 0 HA ALA A 107 -0.134 11.855 2.805 1.00 0.00 H new ATOM 0 HB1 ALA A 107 2.032 11.015 1.962 1.00 0.00 H new ATOM 0 HB2 ALA A 107 1.711 12.677 1.414 1.00 0.00 H new ATOM 0 HB3 ALA A 107 2.859 12.384 2.742 1.00 0.00 H new ATOM 1706 N VAL A 108 1.303 9.967 4.180 1.00 0.00 N ATOM 1707 CA VAL A 108 1.559 8.981 5.222 1.00 0.00 C ATOM 1708 C VAL A 108 3.014 8.528 5.205 1.00 0.00 C ATOM 1709 O VAL A 108 3.421 7.679 5.999 1.00 0.00 O ATOM 1710 CB VAL A 108 0.648 7.749 5.065 1.00 0.00 C ATOM 1711 CG1 VAL A 108 0.960 7.015 3.769 1.00 0.00 C ATOM 1712 CG2 VAL A 108 0.796 6.820 6.261 1.00 0.00 C ATOM 0 H VAL A 108 1.342 9.597 3.230 1.00 0.00 H new ATOM 0 HA VAL A 108 1.343 9.465 6.175 1.00 0.00 H new ATOM 0 HB VAL A 108 -0.387 8.088 5.023 1.00 0.00 H new ATOM 0 HG11 VAL A 108 0.306 6.148 3.676 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.798 7.684 2.924 1.00 0.00 H new ATOM 0 HG13 VAL A 108 1.999 6.687 3.778 1.00 0.00 H new ATOM 0 HG21 VAL A 108 0.145 5.955 6.133 1.00 0.00 H new ATOM 0 HG22 VAL A 108 1.831 6.487 6.337 1.00 0.00 H new ATOM 0 HG23 VAL A 108 0.518 7.351 7.171 1.00 0.00 H new ATOM 1722 N TYR A 109 3.795 9.101 4.296 1.00 0.00 N ATOM 1723 CA TYR A 109 5.206 8.756 4.174 1.00 0.00 C ATOM 1724 C TYR A 109 6.088 9.846 4.775 1.00 0.00 C ATOM 1725 O TYR A 109 7.124 9.562 5.375 1.00 0.00 O ATOM 1726 CB TYR A 109 5.575 8.538 2.706 1.00 0.00 C ATOM 1727 CG TYR A 109 4.899 9.507 1.762 1.00 0.00 C ATOM 1728 CD1 TYR A 109 5.419 10.778 1.550 1.00 0.00 C ATOM 1729 CD2 TYR A 109 3.740 9.152 1.083 1.00 0.00 C ATOM 1730 CE1 TYR A 109 4.805 11.666 0.689 1.00 0.00 C ATOM 1731 CE2 TYR A 109 3.120 10.034 0.219 1.00 0.00 C ATOM 1732 CZ TYR A 109 3.656 11.290 0.026 1.00 0.00 C ATOM 1733 OH TYR A 109 3.040 12.172 -0.833 1.00 0.00 O ATOM 0 H TYR A 109 3.475 9.807 3.633 1.00 0.00 H new ATOM 0 HA TYR A 109 5.376 7.831 4.725 1.00 0.00 H new ATOM 0 HB2 TYR A 109 6.655 8.629 2.594 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.309 7.520 2.420 1.00 0.00 H new ATOM 0 HD1 TYR A 109 6.319 11.076 2.067 1.00 0.00 H new ATOM 0 HD2 TYR A 109 3.317 8.170 1.233 1.00 0.00 H new ATOM 0 HE1 TYR A 109 5.223 12.650 0.536 1.00 0.00 H new ATOM 0 HE2 TYR A 109 2.221 9.742 -0.302 1.00 0.00 H new ATOM 0 HH TYR A 109 2.172 11.809 -1.107 1.00 0.00 H new ATOM 1743 N ASN A 110 5.668 11.096 4.608 1.00 0.00 N ATOM 1744 CA ASN A 110 6.419 12.231 5.133 1.00 0.00 C ATOM 1745 C ASN A 110 6.301 12.305 6.653 1.00 0.00 C ATOM 1746 O ASN A 110 7.257 12.656 7.343 1.00 0.00 O ATOM 1747 CB ASN A 110 5.917 13.534 4.508 1.00 0.00 C ATOM 1748 CG ASN A 110 4.436 13.488 4.184 1.00 0.00 C ATOM 1749 OD1 ASN A 110 3.723 12.584 4.619 1.00 0.00 O ATOM 1750 ND2 ASN A 110 3.968 14.466 3.418 1.00 0.00 N ATOM 0 H ASN A 110 4.812 11.349 4.114 1.00 0.00 H new ATOM 0 HA ASN A 110 7.469 12.092 4.874 1.00 0.00 H new ATOM 0 HB2 ASN A 110 6.111 14.360 5.192 1.00 0.00 H new ATOM 0 HB3 ASN A 110 6.479 13.737 3.596 1.00 0.00 H new ATOM 0 HD21 ASN A 110 2.980 14.489 3.167 1.00 0.00 H new ATOM 0 HD22 ASN A 110 4.597 15.195 3.080 1.00 0.00 H new ATOM 1757 N ARG A 111 5.121 11.971 7.166 1.00 0.00 N ATOM 1758 CA ARG A 111 4.877 12.000 8.603 1.00 0.00 C ATOM 1759 C ARG A 111 6.036 11.362 9.364 1.00 0.00 C ATOM 1760 O ARG A 111 6.447 10.242 9.062 1.00 0.00 O ATOM 1761 CB ARG A 111 3.573 11.273 8.936 1.00 0.00 C ATOM 1762 CG ARG A 111 2.330 11.999 8.447 1.00 0.00 C ATOM 1763 CD ARG A 111 1.062 11.359 8.990 1.00 0.00 C ATOM 1764 NE ARG A 111 0.976 11.462 10.444 1.00 0.00 N ATOM 1765 CZ ARG A 111 0.173 10.710 11.188 1.00 0.00 C ATOM 1766 NH1 ARG A 111 -0.609 9.804 10.617 1.00 0.00 N ATOM 1767 NH2 ARG A 111 0.151 10.863 12.506 1.00 0.00 N ATOM 0 H ARG A 111 4.319 11.677 6.608 1.00 0.00 H new ATOM 0 HA ARG A 111 4.792 13.042 8.910 1.00 0.00 H new ATOM 0 HB2 ARG A 111 3.599 10.277 8.494 1.00 0.00 H new ATOM 0 HB3 ARG A 111 3.506 11.141 10.016 1.00 0.00 H new ATOM 0 HG2 ARG A 111 2.372 13.044 8.755 1.00 0.00 H new ATOM 0 HG3 ARG A 111 2.306 11.989 7.357 1.00 0.00 H new ATOM 0 HD2 ARG A 111 0.193 11.839 8.541 1.00 0.00 H new ATOM 0 HD3 ARG A 111 1.033 10.309 8.699 1.00 0.00 H new ATOM 0 HE ARG A 111 1.565 12.149 10.914 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -0.595 9.683 9.604 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -1.225 9.228 11.191 1.00 0.00 H new ATOM 0 HH21 ARG A 111 0.751 11.559 12.949 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -0.466 10.285 13.076 1.00 0.00 H new TER 1781 ARG A 111