USER MOD reduce.3.24.130724 H: found=0, std=0, add=623, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 623 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 39 GLN : amide:sc= 0.00379 K(o=0.0038,f=-6.5!) USER MOD Set 1.2: A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 21:sc= 0.328 USER MOD Single : A 5 THR OG1 : rot -56:sc= 0.37 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 160:sc= 1.13! (180deg=-1.97!) USER MOD Single : A 16 THR OG1 : rot 180:sc=-0.00897 USER MOD Single : A 18 LYS NZ :NH3+ -168:sc= -0.0295 (180deg=-0.198) USER MOD Single : A 20 ASN : amide:sc= -1.25 K(o=-1.2,f=-0.15) USER MOD Single : A 21 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.177 X(o=-0.18,f=-0.27) USER MOD Single : A 33 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 36 HIS : no HD1:sc= -0.168 X(o=-0.17,f=-0.0038) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 78:sc= -0.405 USER MOD Single : A 53 TYR OH : rot -111:sc= 0.35 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -167:sc= 0.0477 (180deg=-0.607!) USER MOD Single : A 63 THR OG1 : rot -99:sc= -0.0996 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 171:sc= 1.25 (180deg=1.14) USER MOD Single : A 73 ASN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 74 ASN : amide:sc=-0.00291 K(o=-0.0029,f=-0.51) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 GLN : amide:sc= -1.99! K(o=-2!,f=-0.17) USER MOD Single : A 79 ASN : amide:sc= -0.0139 K(o=-0.014,f=-2.5!) USER MOD Single : A 81 GLN : amide:sc= 1 K(o=1,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 35 N THR A 3 5.555 -19.224 -16.722 1.00 72.00 N ATOM 36 CA THR A 3 5.368 -18.705 -18.049 1.00 22.00 C ATOM 37 C THR A 3 4.562 -17.480 -17.837 1.00 33.00 C ATOM 38 O THR A 3 3.822 -17.420 -16.846 1.00 1.00 O ATOM 39 CB THR A 3 4.577 -19.739 -18.915 1.00 64.00 C ATOM 40 OG1 THR A 3 5.137 -21.051 -18.708 1.00 41.00 O ATOM 41 CG2 THR A 3 4.729 -19.421 -20.379 1.00 61.00 C ATOM 0 HA THR A 3 6.304 -18.506 -18.571 1.00 22.00 H new ATOM 0 HB THR A 3 3.527 -19.699 -18.625 1.00 64.00 H new ATOM 0 HG1 THR A 3 5.629 -21.067 -17.860 1.00 41.00 H new ATOM 0 HG21 THR A 3 4.173 -20.149 -20.969 1.00 61.00 H new ATOM 0 HG22 THR A 3 4.341 -18.422 -20.576 1.00 61.00 H new ATOM 0 HG23 THR A 3 5.783 -19.461 -20.653 1.00 61.00 H new ATOM 49 N ASP A 4 4.748 -16.482 -18.665 1.00 53.00 N ATOM 50 CA ASP A 4 3.978 -15.280 -18.541 1.00 42.00 C ATOM 51 C ASP A 4 2.532 -15.650 -18.807 1.00 11.00 C ATOM 52 O ASP A 4 2.249 -16.555 -19.592 1.00 52.00 O ATOM 53 CB ASP A 4 4.463 -14.184 -19.520 1.00 72.00 C ATOM 54 CG ASP A 4 5.850 -13.621 -19.229 1.00 25.00 C ATOM 55 OD1 ASP A 4 6.881 -14.234 -19.640 1.00 43.00 O ATOM 56 OD2 ASP A 4 5.943 -12.535 -18.633 1.00 41.00 O ATOM 0 H ASP A 4 5.425 -16.482 -19.428 1.00 53.00 H new ATOM 0 HA ASP A 4 4.093 -14.861 -17.541 1.00 42.00 H new ATOM 0 HB2 ASP A 4 4.459 -14.594 -20.530 1.00 72.00 H new ATOM 0 HB3 ASP A 4 3.745 -13.364 -19.506 1.00 72.00 H new ATOM 61 N THR A 5 1.641 -15.054 -18.134 1.00 22.00 N ATOM 62 CA THR A 5 0.264 -15.375 -18.296 1.00 25.00 C ATOM 63 C THR A 5 -0.530 -14.094 -18.295 1.00 73.00 C ATOM 64 O THR A 5 -0.113 -13.124 -17.688 1.00 32.00 O ATOM 65 CB THR A 5 -0.183 -16.370 -17.178 1.00 11.00 C ATOM 66 OG1 THR A 5 0.532 -17.610 -17.319 1.00 44.00 O ATOM 67 CG2 THR A 5 -1.680 -16.634 -17.182 1.00 61.00 C ATOM 0 H THR A 5 1.831 -14.324 -17.448 1.00 22.00 H new ATOM 0 HA THR A 5 0.087 -15.877 -19.247 1.00 25.00 H new ATOM 0 HB THR A 5 0.053 -15.903 -16.222 1.00 11.00 H new ATOM 0 HG1 THR A 5 0.390 -17.969 -18.220 1.00 44.00 H new ATOM 0 HG21 THR A 5 -1.928 -17.332 -16.383 1.00 61.00 H new ATOM 0 HG22 THR A 5 -2.215 -15.697 -17.025 1.00 61.00 H new ATOM 0 HG23 THR A 5 -1.971 -17.062 -18.141 1.00 61.00 H new ATOM 75 N LEU A 6 -1.631 -14.053 -19.021 1.00 25.00 N ATOM 76 CA LEU A 6 -2.386 -12.832 -19.085 1.00 41.00 C ATOM 77 C LEU A 6 -3.241 -12.641 -17.835 1.00 11.00 C ATOM 78 O LEU A 6 -3.025 -13.297 -16.828 1.00 33.00 O ATOM 79 CB LEU A 6 -3.205 -12.714 -20.379 1.00 14.00 C ATOM 80 CG LEU A 6 -2.410 -12.779 -21.689 1.00 25.00 C ATOM 81 CD1 LEU A 6 -3.272 -12.356 -22.852 1.00 4.00 C ATOM 82 CD2 LEU A 6 -1.130 -11.955 -21.640 1.00 52.00 C ATOM 0 H LEU A 6 -2.009 -14.833 -19.559 1.00 25.00 H new ATOM 0 HA LEU A 6 -1.668 -12.013 -19.112 1.00 41.00 H new ATOM 0 HB2 LEU A 6 -3.948 -13.511 -20.389 1.00 14.00 H new ATOM 0 HB3 LEU A 6 -3.750 -11.771 -20.355 1.00 14.00 H new ATOM 0 HG LEU A 6 -2.110 -13.818 -21.827 1.00 25.00 H new ATOM 0 HD11 LEU A 6 -2.692 -12.408 -23.773 1.00 4.00 H new ATOM 0 HD12 LEU A 6 -4.133 -13.020 -22.927 1.00 4.00 H new ATOM 0 HD13 LEU A 6 -3.616 -11.333 -22.697 1.00 4.00 H new ATOM 0 HD21 LEU A 6 -0.608 -12.037 -22.593 1.00 52.00 H new ATOM 0 HD22 LEU A 6 -1.377 -10.910 -21.451 1.00 52.00 H new ATOM 0 HD23 LEU A 6 -0.488 -12.327 -20.841 1.00 52.00 H new ATOM 94 N GLU A 7 -4.245 -11.784 -17.922 1.00 43.00 N ATOM 95 CA GLU A 7 -5.006 -11.401 -16.767 1.00 63.00 C ATOM 96 C GLU A 7 -5.926 -12.544 -16.356 1.00 12.00 C ATOM 97 O GLU A 7 -6.411 -12.613 -15.229 1.00 51.00 O ATOM 98 CB GLU A 7 -5.806 -10.130 -17.074 1.00 44.00 C ATOM 99 CG GLU A 7 -6.647 -9.674 -15.908 1.00 63.00 C ATOM 100 CD GLU A 7 -7.213 -8.292 -16.050 1.00 33.00 C ATOM 101 OE1 GLU A 7 -8.323 -8.137 -16.581 1.00 75.00 O ATOM 102 OE2 GLU A 7 -6.566 -7.340 -15.582 1.00 4.00 O ATOM 0 H GLU A 7 -4.546 -11.343 -18.791 1.00 43.00 H new ATOM 0 HA GLU A 7 -4.333 -11.189 -15.936 1.00 63.00 H new ATOM 0 HB2 GLU A 7 -5.118 -9.332 -17.354 1.00 44.00 H new ATOM 0 HB3 GLU A 7 -6.452 -10.311 -17.933 1.00 44.00 H new ATOM 0 HG2 GLU A 7 -7.469 -10.377 -15.773 1.00 63.00 H new ATOM 0 HG3 GLU A 7 -6.041 -9.713 -15.003 1.00 63.00 H new ATOM 109 N TYR A 8 -6.093 -13.473 -17.298 1.00 71.00 N ATOM 110 CA TYR A 8 -6.959 -14.621 -17.214 1.00 41.00 C ATOM 111 C TYR A 8 -8.391 -14.322 -16.776 1.00 34.00 C ATOM 112 O TYR A 8 -9.129 -15.223 -16.408 1.00 51.00 O ATOM 113 CB TYR A 8 -6.328 -15.842 -16.477 1.00 15.00 C ATOM 114 CG TYR A 8 -5.894 -15.648 -15.036 1.00 61.00 C ATOM 115 CD1 TYR A 8 -6.786 -15.823 -13.989 1.00 2.00 C ATOM 116 CD2 TYR A 8 -4.578 -15.318 -14.727 1.00 33.00 C ATOM 117 CE1 TYR A 8 -6.384 -15.671 -12.679 1.00 42.00 C ATOM 118 CE2 TYR A 8 -4.169 -15.161 -13.422 1.00 73.00 C ATOM 119 CZ TYR A 8 -5.074 -15.341 -12.402 1.00 10.00 C ATOM 120 OH TYR A 8 -4.668 -15.184 -11.095 1.00 61.00 O ATOM 0 H TYR A 8 -5.593 -13.430 -18.186 1.00 71.00 H new ATOM 0 HA TYR A 8 -7.060 -14.932 -18.254 1.00 41.00 H new ATOM 0 HB2 TYR A 8 -7.049 -16.659 -16.503 1.00 15.00 H new ATOM 0 HB3 TYR A 8 -5.458 -16.166 -17.049 1.00 15.00 H new ATOM 0 HD1 TYR A 8 -7.812 -16.083 -14.203 1.00 2.00 H new ATOM 0 HD2 TYR A 8 -3.864 -15.183 -15.526 1.00 33.00 H new ATOM 0 HE1 TYR A 8 -7.091 -15.810 -11.874 1.00 42.00 H new ATOM 0 HE2 TYR A 8 -3.145 -14.898 -13.201 1.00 73.00 H new ATOM 0 HH TYR A 8 -3.716 -14.953 -11.074 1.00 61.00 H new ATOM 130 N GLN A 9 -8.824 -13.097 -16.969 1.00 73.00 N ATOM 131 CA GLN A 9 -10.105 -12.669 -16.528 1.00 65.00 C ATOM 132 C GLN A 9 -10.691 -11.804 -17.560 1.00 45.00 C ATOM 133 O GLN A 9 -10.343 -10.637 -17.717 1.00 22.00 O ATOM 134 CB GLN A 9 -10.081 -11.979 -15.159 1.00 1.00 C ATOM 135 CG GLN A 9 -9.682 -12.910 -14.042 1.00 2.00 C ATOM 136 CD GLN A 9 -9.758 -12.278 -12.668 1.00 0.00 C ATOM 137 OE1 GLN A 9 -8.797 -11.672 -12.192 1.00 12.00 O ATOM 138 NE2 GLN A 9 -10.871 -12.441 -12.008 1.00 24.00 N ATOM 0 H GLN A 9 -8.282 -12.374 -17.442 1.00 73.00 H new ATOM 0 HA GLN A 9 -10.726 -13.553 -16.384 1.00 65.00 H new ATOM 0 HB2 GLN A 9 -9.386 -11.140 -15.192 1.00 1.00 H new ATOM 0 HB3 GLN A 9 -11.068 -11.567 -14.948 1.00 1.00 H new ATOM 0 HG2 GLN A 9 -10.327 -13.788 -14.065 1.00 2.00 H new ATOM 0 HG3 GLN A 9 -8.664 -13.258 -14.217 1.00 2.00 H new ATOM 0 HE21 GLN A 9 -11.647 -12.949 -12.434 1.00 24.00 H new ATOM 0 HE22 GLN A 9 -10.966 -12.061 -11.066 1.00 24.00 H new ATOM 147 N CYS A 10 -11.500 -12.401 -18.312 1.00 14.00 N ATOM 148 CA CYS A 10 -12.184 -11.765 -19.350 1.00 44.00 C ATOM 149 C CYS A 10 -13.628 -12.178 -19.161 1.00 42.00 C ATOM 150 O CYS A 10 -13.886 -13.280 -18.632 1.00 41.00 O ATOM 151 CB CYS A 10 -11.583 -12.190 -20.703 1.00 54.00 C ATOM 152 SG CYS A 10 -9.803 -11.825 -20.899 1.00 3.00 S ATOM 0 H CYS A 10 -11.719 -13.393 -18.223 1.00 14.00 H new ATOM 0 HA CYS A 10 -12.104 -10.678 -19.339 1.00 44.00 H new ATOM 0 HB2 CYS A 10 -11.736 -13.261 -20.832 1.00 54.00 H new ATOM 0 HB3 CYS A 10 -12.132 -11.691 -21.501 1.00 54.00 H new ATOM 157 N ASP A 11 -14.546 -11.320 -19.507 1.00 62.00 N ATOM 158 CA ASP A 11 -15.961 -11.501 -19.178 1.00 44.00 C ATOM 159 C ASP A 11 -16.552 -12.801 -19.686 1.00 53.00 C ATOM 160 O ASP A 11 -17.119 -13.572 -18.919 1.00 21.00 O ATOM 161 CB ASP A 11 -16.794 -10.329 -19.685 1.00 32.00 C ATOM 162 CG ASP A 11 -18.207 -10.370 -19.161 1.00 0.00 C ATOM 163 OD1 ASP A 11 -18.404 -10.069 -17.964 1.00 52.00 O ATOM 164 OD2 ASP A 11 -19.137 -10.715 -19.924 1.00 33.00 O ATOM 0 H ASP A 11 -14.349 -10.466 -20.028 1.00 62.00 H new ATOM 0 HA ASP A 11 -15.998 -11.543 -18.089 1.00 44.00 H new ATOM 0 HB2 ASP A 11 -16.323 -9.393 -19.384 1.00 32.00 H new ATOM 0 HB3 ASP A 11 -16.811 -10.341 -20.775 1.00 32.00 H new ATOM 169 N GLU A 12 -16.390 -13.064 -20.952 1.00 65.00 N ATOM 170 CA GLU A 12 -17.039 -14.222 -21.557 1.00 32.00 C ATOM 171 C GLU A 12 -16.167 -15.457 -21.487 1.00 63.00 C ATOM 172 O GLU A 12 -16.638 -16.574 -21.725 1.00 71.00 O ATOM 173 CB GLU A 12 -17.374 -13.930 -22.996 1.00 50.00 C ATOM 174 CG GLU A 12 -17.877 -12.534 -23.202 1.00 22.00 C ATOM 175 CD GLU A 12 -18.333 -12.277 -24.600 1.00 3.00 C ATOM 176 OE1 GLU A 12 -17.533 -12.428 -25.539 1.00 0.00 O ATOM 177 OE2 GLU A 12 -19.511 -11.924 -24.787 1.00 40.00 O ATOM 0 H GLU A 12 -15.823 -12.506 -21.590 1.00 65.00 H new ATOM 0 HA GLU A 12 -17.951 -14.418 -20.993 1.00 32.00 H new ATOM 0 HB2 GLU A 12 -16.487 -14.086 -23.610 1.00 50.00 H new ATOM 0 HB3 GLU A 12 -18.128 -14.638 -23.340 1.00 50.00 H new ATOM 0 HG2 GLU A 12 -18.703 -12.347 -22.516 1.00 22.00 H new ATOM 0 HG3 GLU A 12 -17.086 -11.828 -22.948 1.00 22.00 H new ATOM 184 N LYS A 13 -14.906 -15.273 -21.170 1.00 52.00 N ATOM 185 CA LYS A 13 -14.000 -16.374 -21.087 1.00 30.00 C ATOM 186 C LYS A 13 -12.799 -16.015 -20.307 1.00 73.00 C ATOM 187 O LYS A 13 -12.298 -14.939 -20.464 1.00 25.00 O ATOM 188 CB LYS A 13 -13.533 -16.903 -22.453 1.00 73.00 C ATOM 189 CG LYS A 13 -13.071 -15.916 -23.541 1.00 31.00 C ATOM 190 CD LYS A 13 -12.370 -16.664 -24.687 1.00 12.00 C ATOM 191 CE LYS A 13 -10.921 -17.087 -24.366 1.00 32.00 C ATOM 192 NZ LYS A 13 -10.811 -18.098 -23.288 1.00 50.00 N ATOM 0 H LYS A 13 -14.492 -14.363 -20.966 1.00 52.00 H new ATOM 0 HA LYS A 13 -14.569 -17.163 -20.595 1.00 30.00 H new ATOM 0 HB2 LYS A 13 -12.709 -17.593 -22.270 1.00 73.00 H new ATOM 0 HB3 LYS A 13 -14.352 -17.488 -22.872 1.00 73.00 H new ATOM 0 HG2 LYS A 13 -13.929 -15.366 -23.929 1.00 31.00 H new ATOM 0 HG3 LYS A 13 -12.391 -15.182 -23.109 1.00 31.00 H new ATOM 0 HD2 LYS A 13 -12.950 -17.552 -24.936 1.00 12.00 H new ATOM 0 HD3 LYS A 13 -12.364 -16.028 -25.572 1.00 12.00 H new ATOM 0 HE2 LYS A 13 -10.461 -17.485 -25.271 1.00 32.00 H new ATOM 0 HE3 LYS A 13 -10.351 -16.203 -24.080 1.00 32.00 H new ATOM 0 HZ1 LYS A 13 -9.889 -18.576 -23.353 1.00 50.00 H new ATOM 0 HZ2 LYS A 13 -10.894 -17.630 -22.363 1.00 50.00 H new ATOM 0 HZ3 LYS A 13 -11.572 -18.799 -23.391 1.00 50.00 H new ATOM 206 N PRO A 14 -12.309 -16.887 -19.440 1.00 50.00 N ATOM 207 CA PRO A 14 -11.049 -16.644 -18.783 1.00 42.00 C ATOM 208 C PRO A 14 -9.940 -16.790 -19.833 1.00 73.00 C ATOM 209 O PRO A 14 -10.070 -17.602 -20.767 1.00 25.00 O ATOM 210 CB PRO A 14 -10.949 -17.749 -17.716 1.00 50.00 C ATOM 211 CG PRO A 14 -12.315 -18.353 -17.646 1.00 54.00 C ATOM 212 CD PRO A 14 -12.928 -18.150 -18.999 1.00 64.00 C ATOM 0 HA PRO A 14 -10.962 -15.655 -18.333 1.00 42.00 H new ATOM 0 HB2 PRO A 14 -10.203 -18.495 -17.990 1.00 50.00 H new ATOM 0 HB3 PRO A 14 -10.650 -17.339 -16.751 1.00 50.00 H new ATOM 0 HG2 PRO A 14 -12.260 -19.413 -17.398 1.00 54.00 H new ATOM 0 HG3 PRO A 14 -12.914 -17.875 -16.871 1.00 54.00 H new ATOM 0 HD2 PRO A 14 -12.699 -18.973 -19.676 1.00 64.00 H new ATOM 0 HD3 PRO A 14 -14.014 -18.073 -18.946 1.00 64.00 H new ATOM 220 N LEU A 15 -8.887 -16.032 -19.731 1.00 24.00 N ATOM 221 CA LEU A 15 -7.882 -16.081 -20.746 1.00 13.00 C ATOM 222 C LEU A 15 -6.549 -16.343 -20.136 1.00 73.00 C ATOM 223 O LEU A 15 -5.742 -15.427 -19.909 1.00 33.00 O ATOM 224 CB LEU A 15 -7.864 -14.815 -21.597 1.00 22.00 C ATOM 225 CG LEU A 15 -6.844 -14.801 -22.735 1.00 40.00 C ATOM 226 CD1 LEU A 15 -7.145 -15.889 -23.757 1.00 43.00 C ATOM 227 CD2 LEU A 15 -6.788 -13.443 -23.393 1.00 60.00 C ATOM 0 H LEU A 15 -8.705 -15.382 -18.966 1.00 24.00 H new ATOM 0 HA LEU A 15 -8.126 -16.904 -21.418 1.00 13.00 H new ATOM 0 HB2 LEU A 15 -8.857 -14.669 -22.021 1.00 22.00 H new ATOM 0 HB3 LEU A 15 -7.667 -13.963 -20.946 1.00 22.00 H new ATOM 0 HG LEU A 15 -5.864 -15.009 -22.306 1.00 40.00 H new ATOM 0 HD11 LEU A 15 -6.403 -15.854 -24.555 1.00 43.00 H new ATOM 0 HD12 LEU A 15 -7.110 -16.864 -23.271 1.00 43.00 H new ATOM 0 HD13 LEU A 15 -8.138 -15.728 -24.178 1.00 43.00 H new ATOM 0 HD21 LEU A 15 -6.055 -13.459 -24.199 1.00 60.00 H new ATOM 0 HD22 LEU A 15 -7.769 -13.195 -23.799 1.00 60.00 H new ATOM 0 HD23 LEU A 15 -6.500 -12.693 -22.656 1.00 60.00 H new ATOM 239 N THR A 16 -6.359 -17.548 -19.768 1.00 23.00 N ATOM 240 CA THR A 16 -5.137 -17.945 -19.209 1.00 11.00 C ATOM 241 C THR A 16 -4.231 -18.370 -20.350 1.00 61.00 C ATOM 242 O THR A 16 -4.545 -19.299 -21.106 1.00 72.00 O ATOM 243 CB THR A 16 -5.359 -19.081 -18.217 1.00 31.00 C ATOM 244 OG1 THR A 16 -6.662 -18.905 -17.623 1.00 42.00 O ATOM 245 CG2 THR A 16 -4.322 -18.989 -17.119 1.00 4.00 C ATOM 0 H THR A 16 -7.054 -18.290 -19.848 1.00 23.00 H new ATOM 0 HA THR A 16 -4.673 -17.127 -18.658 1.00 11.00 H new ATOM 0 HB THR A 16 -5.284 -20.044 -18.722 1.00 31.00 H new ATOM 0 HG1 THR A 16 -6.829 -19.626 -16.981 1.00 42.00 H new ATOM 0 HG21 THR A 16 -4.475 -19.799 -16.405 1.00 4.00 H new ATOM 0 HG22 THR A 16 -3.325 -19.070 -17.552 1.00 4.00 H new ATOM 0 HG23 THR A 16 -4.418 -18.031 -16.607 1.00 4.00 H new ATOM 253 N VAL A 17 -3.163 -17.652 -20.508 1.00 14.00 N ATOM 254 CA VAL A 17 -2.265 -17.841 -21.607 1.00 12.00 C ATOM 255 C VAL A 17 -0.921 -18.232 -21.086 1.00 32.00 C ATOM 256 O VAL A 17 -0.499 -17.733 -20.068 1.00 43.00 O ATOM 257 CB VAL A 17 -2.105 -16.521 -22.404 1.00 21.00 C ATOM 258 CG1 VAL A 17 -1.208 -16.703 -23.606 1.00 4.00 C ATOM 259 CG2 VAL A 17 -3.450 -15.981 -22.829 1.00 15.00 C ATOM 0 H VAL A 17 -2.885 -16.907 -19.869 1.00 14.00 H new ATOM 0 HA VAL A 17 -2.670 -18.618 -22.255 1.00 12.00 H new ATOM 0 HB VAL A 17 -1.633 -15.796 -21.740 1.00 21.00 H new ATOM 0 HG11 VAL A 17 -1.119 -15.757 -24.140 1.00 4.00 H new ATOM 0 HG12 VAL A 17 -0.221 -17.028 -23.277 1.00 4.00 H new ATOM 0 HG13 VAL A 17 -1.636 -17.455 -24.269 1.00 4.00 H new ATOM 0 HG21 VAL A 17 -3.311 -15.055 -23.386 1.00 15.00 H new ATOM 0 HG22 VAL A 17 -3.953 -16.713 -23.461 1.00 15.00 H new ATOM 0 HG23 VAL A 17 -4.059 -15.785 -21.946 1.00 15.00 H new ATOM 269 N LYS A 18 -0.259 -19.109 -21.771 1.00 3.00 N ATOM 270 CA LYS A 18 1.057 -19.461 -21.420 1.00 23.00 C ATOM 271 C LYS A 18 1.894 -18.755 -22.415 1.00 44.00 C ATOM 272 O LYS A 18 2.118 -19.240 -23.523 1.00 14.00 O ATOM 273 CB LYS A 18 1.319 -20.991 -21.433 1.00 53.00 C ATOM 274 CG LYS A 18 0.661 -21.805 -20.300 1.00 54.00 C ATOM 275 CD LYS A 18 -0.857 -21.721 -20.314 1.00 74.00 C ATOM 276 CE LYS A 18 -1.490 -22.560 -19.213 1.00 55.00 C ATOM 277 NZ LYS A 18 -1.173 -24.001 -19.350 1.00 3.00 N ATOM 0 H LYS A 18 -0.627 -19.595 -22.589 1.00 3.00 H new ATOM 0 HA LYS A 18 1.279 -19.176 -20.392 1.00 23.00 H new ATOM 0 HB2 LYS A 18 0.973 -21.390 -22.387 1.00 53.00 H new ATOM 0 HB3 LYS A 18 2.396 -21.154 -21.391 1.00 53.00 H new ATOM 0 HG2 LYS A 18 0.963 -22.849 -20.387 1.00 54.00 H new ATOM 0 HG3 LYS A 18 1.031 -21.446 -19.340 1.00 54.00 H new ATOM 0 HD2 LYS A 18 -1.163 -20.681 -20.197 1.00 74.00 H new ATOM 0 HD3 LYS A 18 -1.229 -22.056 -21.282 1.00 74.00 H new ATOM 0 HE2 LYS A 18 -1.142 -22.205 -18.243 1.00 55.00 H new ATOM 0 HE3 LYS A 18 -2.571 -22.425 -19.233 1.00 55.00 H new ATOM 0 HZ1 LYS A 18 -1.781 -24.552 -18.711 1.00 3.00 H new ATOM 0 HZ2 LYS A 18 -1.340 -24.301 -20.332 1.00 3.00 H new ATOM 0 HZ3 LYS A 18 -0.175 -24.162 -19.104 1.00 3.00 H new ATOM 291 N LEU A 19 2.215 -17.565 -22.068 1.00 10.00 N ATOM 292 CA LEU A 19 2.897 -16.678 -22.865 1.00 12.00 C ATOM 293 C LEU A 19 4.340 -16.933 -22.726 1.00 22.00 C ATOM 294 O LEU A 19 4.977 -16.507 -21.763 1.00 22.00 O ATOM 295 CB LEU A 19 2.567 -15.292 -22.383 1.00 51.00 C ATOM 296 CG LEU A 19 3.316 -14.137 -23.022 1.00 5.00 C ATOM 297 CD1 LEU A 19 3.157 -14.118 -24.538 1.00 34.00 C ATOM 298 CD2 LEU A 19 2.893 -12.808 -22.423 1.00 65.00 C ATOM 0 H LEU A 19 1.982 -17.180 -21.152 1.00 10.00 H new ATOM 0 HA LEU A 19 2.618 -16.786 -23.913 1.00 12.00 H new ATOM 0 HB2 LEU A 19 1.500 -15.127 -22.534 1.00 51.00 H new ATOM 0 HB3 LEU A 19 2.746 -15.257 -21.308 1.00 51.00 H new ATOM 0 HG LEU A 19 4.373 -14.290 -22.806 1.00 5.00 H new ATOM 0 HD11 LEU A 19 3.710 -13.275 -24.951 1.00 34.00 H new ATOM 0 HD12 LEU A 19 3.545 -15.047 -24.956 1.00 34.00 H new ATOM 0 HD13 LEU A 19 2.102 -14.019 -24.792 1.00 34.00 H new ATOM 0 HD21 LEU A 19 3.447 -12.000 -22.901 1.00 65.00 H new ATOM 0 HD22 LEU A 19 1.825 -12.660 -22.583 1.00 65.00 H new ATOM 0 HD23 LEU A 19 3.103 -12.808 -21.353 1.00 65.00 H new ATOM 310 N ASN A 20 4.851 -17.689 -23.612 1.00 42.00 N ATOM 311 CA ASN A 20 6.247 -17.896 -23.621 1.00 70.00 C ATOM 312 C ASN A 20 6.788 -16.821 -24.523 1.00 64.00 C ATOM 313 O ASN A 20 7.001 -17.027 -25.718 1.00 71.00 O ATOM 314 CB ASN A 20 6.630 -19.287 -24.113 1.00 51.00 C ATOM 315 CG ASN A 20 8.020 -19.732 -23.652 1.00 2.00 C ATOM 316 OD1 ASN A 20 8.278 -20.919 -23.547 1.00 53.00 O ATOM 317 ND2 ASN A 20 8.893 -18.806 -23.307 1.00 4.00 N ATOM 0 H ASN A 20 4.329 -18.176 -24.341 1.00 42.00 H new ATOM 0 HA ASN A 20 6.662 -17.840 -22.615 1.00 70.00 H new ATOM 0 HB2 ASN A 20 5.891 -20.006 -23.760 1.00 51.00 H new ATOM 0 HB3 ASN A 20 6.594 -19.302 -25.202 1.00 51.00 H new ATOM 0 HD21 ASN A 20 9.807 -19.077 -22.943 1.00 4.00 H new ATOM 0 HD22 ASN A 20 8.655 -17.819 -23.404 1.00 4.00 H new ATOM 324 N ASN A 21 6.924 -15.659 -23.941 1.00 15.00 N ATOM 325 CA ASN A 21 7.227 -14.415 -24.642 1.00 31.00 C ATOM 326 C ASN A 21 8.498 -14.466 -25.514 1.00 65.00 C ATOM 327 O ASN A 21 8.415 -14.196 -26.707 1.00 61.00 O ATOM 328 CB ASN A 21 7.242 -13.243 -23.665 1.00 21.00 C ATOM 329 CG ASN A 21 7.460 -11.902 -24.332 1.00 64.00 C ATOM 330 OD1 ASN A 21 7.105 -11.696 -25.488 1.00 64.00 O ATOM 331 ND2 ASN A 21 8.025 -10.985 -23.609 1.00 44.00 N ATOM 0 H ASN A 21 6.826 -15.536 -22.933 1.00 15.00 H new ATOM 0 HA ASN A 21 6.419 -14.264 -25.358 1.00 31.00 H new ATOM 0 HB2 ASN A 21 6.297 -13.220 -23.123 1.00 21.00 H new ATOM 0 HB3 ASN A 21 8.028 -13.405 -22.928 1.00 21.00 H new ATOM 0 HD21 ASN A 21 8.187 -10.056 -23.998 1.00 44.00 H new ATOM 0 HD22 ASN A 21 8.307 -11.193 -22.651 1.00 44.00 H new ATOM 338 N PRO A 22 9.697 -14.830 -24.973 1.00 32.00 N ATOM 339 CA PRO A 22 10.923 -14.913 -25.791 1.00 52.00 C ATOM 340 C PRO A 22 10.825 -15.982 -26.896 1.00 51.00 C ATOM 341 O PRO A 22 11.530 -15.933 -27.912 1.00 31.00 O ATOM 342 CB PRO A 22 12.004 -15.284 -24.779 1.00 31.00 C ATOM 343 CG PRO A 22 11.262 -15.901 -23.666 1.00 63.00 C ATOM 344 CD PRO A 22 9.989 -15.139 -23.560 1.00 13.00 C ATOM 0 HA PRO A 22 11.120 -13.981 -26.320 1.00 52.00 H new ATOM 0 HB2 PRO A 22 12.729 -15.977 -25.207 1.00 31.00 H new ATOM 0 HB3 PRO A 22 12.559 -14.406 -24.449 1.00 31.00 H new ATOM 0 HG2 PRO A 22 11.072 -16.957 -23.860 1.00 63.00 H new ATOM 0 HG3 PRO A 22 11.830 -15.845 -22.738 1.00 63.00 H new ATOM 0 HD2 PRO A 22 9.197 -15.730 -23.100 1.00 13.00 H new ATOM 0 HD3 PRO A 22 10.103 -14.236 -22.960 1.00 13.00 H new ATOM 352 N ARG A 23 9.917 -16.912 -26.707 1.00 61.00 N ATOM 353 CA ARG A 23 9.710 -17.995 -27.647 1.00 23.00 C ATOM 354 C ARG A 23 8.686 -17.583 -28.717 1.00 42.00 C ATOM 355 O ARG A 23 8.589 -18.215 -29.770 1.00 33.00 O ATOM 356 CB ARG A 23 9.264 -19.264 -26.895 1.00 4.00 C ATOM 357 CG ARG A 23 8.908 -20.441 -27.786 1.00 30.00 C ATOM 358 CD ARG A 23 8.463 -21.648 -26.988 1.00 25.00 C ATOM 359 NE ARG A 23 7.830 -22.640 -27.859 1.00 23.00 N ATOM 360 CZ ARG A 23 7.482 -23.880 -27.523 1.00 23.00 C ATOM 361 NH1 ARG A 23 7.874 -24.395 -26.371 1.00 10.00 N ATOM 362 NH2 ARG A 23 6.752 -24.599 -28.366 1.00 44.00 N ATOM 0 H ARG A 23 9.299 -16.941 -25.896 1.00 61.00 H new ATOM 0 HA ARG A 23 10.648 -18.217 -28.156 1.00 23.00 H new ATOM 0 HB2 ARG A 23 10.063 -19.568 -26.218 1.00 4.00 H new ATOM 0 HB3 ARG A 23 8.399 -19.019 -26.278 1.00 4.00 H new ATOM 0 HG2 ARG A 23 8.113 -20.148 -28.472 1.00 30.00 H new ATOM 0 HG3 ARG A 23 9.772 -20.708 -28.395 1.00 30.00 H new ATOM 0 HD2 ARG A 23 9.321 -22.094 -26.485 1.00 25.00 H new ATOM 0 HD3 ARG A 23 7.763 -21.339 -26.212 1.00 25.00 H new ATOM 0 HE ARG A 23 7.637 -22.352 -28.818 1.00 23.00 H new ATOM 0 HH11 ARG A 23 8.447 -23.842 -25.733 1.00 10.00 H new ATOM 0 HH12 ARG A 23 7.604 -25.346 -26.119 1.00 10.00 H new ATOM 0 HH21 ARG A 23 6.464 -24.200 -29.260 1.00 44.00 H new ATOM 0 HH22 ARG A 23 6.479 -25.551 -28.120 1.00 44.00 H new ATOM 376 N GLN A 24 7.970 -16.482 -28.452 1.00 35.00 N ATOM 377 CA GLN A 24 6.942 -15.949 -29.333 1.00 2.00 C ATOM 378 C GLN A 24 5.828 -16.982 -29.576 1.00 60.00 C ATOM 379 O GLN A 24 5.351 -17.170 -30.709 1.00 40.00 O ATOM 380 CB GLN A 24 7.575 -15.451 -30.637 1.00 11.00 C ATOM 381 CG GLN A 24 8.510 -14.259 -30.460 1.00 53.00 C ATOM 382 CD GLN A 24 9.070 -13.741 -31.772 1.00 1.00 C ATOM 383 OE1 GLN A 24 8.491 -12.861 -32.411 1.00 53.00 O ATOM 384 NE2 GLN A 24 10.181 -14.282 -32.193 1.00 54.00 N ATOM 0 H GLN A 24 8.097 -15.933 -27.602 1.00 35.00 H new ATOM 0 HA GLN A 24 6.468 -15.095 -28.850 1.00 2.00 H new ATOM 0 HB2 GLN A 24 8.130 -16.270 -31.095 1.00 11.00 H new ATOM 0 HB3 GLN A 24 6.781 -15.177 -31.332 1.00 11.00 H new ATOM 0 HG2 GLN A 24 7.972 -13.454 -29.959 1.00 53.00 H new ATOM 0 HG3 GLN A 24 9.335 -14.546 -29.808 1.00 53.00 H new ATOM 0 HE21 GLN A 24 10.636 -15.009 -31.640 1.00 54.00 H new ATOM 0 HE22 GLN A 24 10.594 -13.978 -33.075 1.00 54.00 H new ATOM 393 N GLU A 25 5.408 -17.625 -28.490 1.00 2.00 N ATOM 394 CA GLU A 25 4.343 -18.622 -28.504 1.00 24.00 C ATOM 395 C GLU A 25 3.469 -18.519 -27.279 1.00 14.00 C ATOM 396 O GLU A 25 3.950 -18.285 -26.176 1.00 61.00 O ATOM 397 CB GLU A 25 4.892 -20.042 -28.627 1.00 12.00 C ATOM 398 CG GLU A 25 5.129 -20.484 -30.049 1.00 21.00 C ATOM 399 CD GLU A 25 5.836 -21.806 -30.136 1.00 63.00 C ATOM 400 OE1 GLU A 25 5.201 -22.852 -30.003 1.00 3.00 O ATOM 401 OE2 GLU A 25 7.070 -21.823 -30.324 1.00 74.00 O ATOM 0 H GLU A 25 5.803 -17.466 -27.563 1.00 2.00 H new ATOM 0 HA GLU A 25 3.737 -18.410 -29.385 1.00 24.00 H new ATOM 0 HB2 GLU A 25 5.830 -20.108 -28.075 1.00 12.00 H new ATOM 0 HB3 GLU A 25 4.195 -20.733 -28.153 1.00 12.00 H new ATOM 0 HG2 GLU A 25 4.173 -20.553 -30.567 1.00 21.00 H new ATOM 0 HG3 GLU A 25 5.718 -19.727 -30.567 1.00 21.00 H new ATOM 408 N VAL A 26 2.191 -18.676 -27.490 1.00 43.00 N ATOM 409 CA VAL A 26 1.194 -18.655 -26.434 1.00 22.00 C ATOM 410 C VAL A 26 0.384 -19.902 -26.509 1.00 0.00 C ATOM 411 O VAL A 26 0.156 -20.444 -27.585 1.00 12.00 O ATOM 412 CB VAL A 26 0.228 -17.434 -26.553 1.00 33.00 C ATOM 413 CG1 VAL A 26 0.966 -16.122 -26.453 1.00 74.00 C ATOM 414 CG2 VAL A 26 -0.621 -17.484 -27.818 1.00 34.00 C ATOM 0 H VAL A 26 1.796 -18.826 -28.419 1.00 43.00 H new ATOM 0 HA VAL A 26 1.724 -18.577 -25.485 1.00 22.00 H new ATOM 0 HB VAL A 26 -0.452 -17.502 -25.704 1.00 33.00 H new ATOM 0 HG11 VAL A 26 0.257 -15.298 -26.541 1.00 74.00 H new ATOM 0 HG12 VAL A 26 1.474 -16.063 -25.490 1.00 74.00 H new ATOM 0 HG13 VAL A 26 1.700 -16.056 -27.256 1.00 74.00 H new ATOM 0 HG21 VAL A 26 -1.275 -16.613 -27.852 1.00 34.00 H new ATOM 0 HG22 VAL A 26 0.029 -17.484 -28.693 1.00 34.00 H new ATOM 0 HG23 VAL A 26 -1.225 -18.391 -27.815 1.00 34.00 H new ATOM 424 N SER A 27 0.031 -20.403 -25.395 1.00 63.00 N ATOM 425 CA SER A 27 -0.895 -21.468 -25.331 1.00 10.00 C ATOM 426 C SER A 27 -2.008 -20.987 -24.469 1.00 34.00 C ATOM 427 O SER A 27 -1.795 -20.688 -23.306 1.00 63.00 O ATOM 428 CB SER A 27 -0.248 -22.701 -24.750 1.00 72.00 C ATOM 429 OG SER A 27 0.976 -22.976 -25.426 1.00 61.00 O ATOM 0 H SER A 27 0.377 -20.086 -24.489 1.00 63.00 H new ATOM 0 HA SER A 27 -1.257 -21.748 -26.320 1.00 10.00 H new ATOM 0 HB2 SER A 27 -0.060 -22.556 -23.686 1.00 72.00 H new ATOM 0 HB3 SER A 27 -0.922 -23.552 -24.841 1.00 72.00 H new ATOM 0 HG SER A 27 1.390 -23.777 -25.041 1.00 61.00 H new ATOM 435 N PHE A 28 -3.155 -20.847 -25.019 1.00 40.00 N ATOM 436 CA PHE A 28 -4.222 -20.288 -24.262 1.00 74.00 C ATOM 437 C PHE A 28 -5.376 -21.213 -24.217 1.00 22.00 C ATOM 438 O PHE A 28 -5.502 -22.126 -25.030 1.00 74.00 O ATOM 439 CB PHE A 28 -4.647 -18.860 -24.722 1.00 55.00 C ATOM 440 CG PHE A 28 -5.452 -18.745 -26.003 1.00 52.00 C ATOM 441 CD1 PHE A 28 -6.837 -18.881 -25.982 1.00 5.00 C ATOM 442 CD2 PHE A 28 -4.841 -18.469 -27.204 1.00 22.00 C ATOM 443 CE1 PHE A 28 -7.586 -18.748 -27.130 1.00 13.00 C ATOM 444 CE2 PHE A 28 -5.591 -18.338 -28.360 1.00 3.00 C ATOM 445 CZ PHE A 28 -6.961 -18.479 -28.321 1.00 1.00 C ATOM 0 H PHE A 28 -3.384 -21.106 -25.979 1.00 40.00 H new ATOM 0 HA PHE A 28 -3.838 -20.158 -23.250 1.00 74.00 H new ATOM 0 HB2 PHE A 28 -5.228 -18.407 -23.918 1.00 55.00 H new ATOM 0 HB3 PHE A 28 -3.743 -18.262 -24.838 1.00 55.00 H new ATOM 0 HD1 PHE A 28 -7.334 -19.095 -25.047 1.00 5.00 H new ATOM 0 HD2 PHE A 28 -3.768 -18.354 -27.245 1.00 22.00 H new ATOM 0 HE1 PHE A 28 -8.660 -18.855 -27.093 1.00 13.00 H new ATOM 0 HE2 PHE A 28 -5.100 -18.124 -29.298 1.00 3.00 H new ATOM 0 HZ PHE A 28 -7.541 -18.378 -29.226 1.00 1.00 H new ATOM 455 N VAL A 29 -6.194 -20.979 -23.284 1.00 1.00 N ATOM 456 CA VAL A 29 -7.342 -21.740 -23.068 1.00 25.00 C ATOM 457 C VAL A 29 -8.522 -21.073 -23.744 1.00 4.00 C ATOM 458 O VAL A 29 -8.860 -19.908 -23.478 1.00 60.00 O ATOM 459 CB VAL A 29 -7.595 -21.976 -21.542 1.00 2.00 C ATOM 460 CG1 VAL A 29 -7.832 -20.683 -20.772 1.00 50.00 C ATOM 461 CG2 VAL A 29 -8.703 -22.994 -21.310 1.00 41.00 C ATOM 0 H VAL A 29 -6.077 -20.216 -22.618 1.00 1.00 H new ATOM 0 HA VAL A 29 -7.203 -22.727 -23.510 1.00 25.00 H new ATOM 0 HB VAL A 29 -6.675 -22.398 -21.137 1.00 2.00 H new ATOM 0 HG11 VAL A 29 -8.001 -20.912 -19.720 1.00 50.00 H new ATOM 0 HG12 VAL A 29 -6.959 -20.038 -20.867 1.00 50.00 H new ATOM 0 HG13 VAL A 29 -8.706 -20.173 -21.178 1.00 50.00 H new ATOM 0 HG21 VAL A 29 -8.851 -23.133 -20.239 1.00 41.00 H new ATOM 0 HG22 VAL A 29 -9.628 -22.634 -21.761 1.00 41.00 H new ATOM 0 HG23 VAL A 29 -8.424 -23.945 -21.764 1.00 41.00 H new ATOM 471 N TYR A 30 -9.061 -21.765 -24.690 1.00 53.00 N ATOM 472 CA TYR A 30 -10.292 -21.355 -25.355 1.00 65.00 C ATOM 473 C TYR A 30 -11.407 -21.386 -24.332 1.00 31.00 C ATOM 474 O TYR A 30 -12.042 -20.366 -24.049 1.00 33.00 O ATOM 475 CB TYR A 30 -10.608 -22.304 -26.534 1.00 32.00 C ATOM 476 CG TYR A 30 -12.054 -22.249 -27.007 1.00 64.00 C ATOM 477 CD1 TYR A 30 -12.582 -21.123 -27.621 1.00 5.00 C ATOM 478 CD2 TYR A 30 -12.894 -23.332 -26.801 1.00 55.00 C ATOM 479 CE1 TYR A 30 -13.907 -21.091 -28.018 1.00 15.00 C ATOM 480 CE2 TYR A 30 -14.210 -23.305 -27.191 1.00 53.00 C ATOM 481 CZ TYR A 30 -14.714 -22.187 -27.797 1.00 34.00 C ATOM 482 OH TYR A 30 -16.032 -22.156 -28.182 1.00 44.00 O ATOM 0 H TYR A 30 -8.672 -22.640 -25.040 1.00 53.00 H new ATOM 0 HA TYR A 30 -10.186 -20.349 -25.761 1.00 65.00 H new ATOM 0 HB2 TYR A 30 -9.954 -22.057 -27.370 1.00 32.00 H new ATOM 0 HB3 TYR A 30 -10.373 -23.326 -26.237 1.00 32.00 H new ATOM 0 HD1 TYR A 30 -11.952 -20.262 -27.791 1.00 5.00 H new ATOM 0 HD2 TYR A 30 -12.504 -24.218 -26.322 1.00 55.00 H new ATOM 0 HE1 TYR A 30 -14.308 -20.211 -28.499 1.00 15.00 H new ATOM 0 HE2 TYR A 30 -14.844 -24.162 -27.020 1.00 53.00 H new ATOM 0 HH TYR A 30 -16.459 -23.008 -27.955 1.00 44.00 H new ATOM 492 N ASP A 31 -11.576 -22.536 -23.738 1.00 22.00 N ATOM 493 CA ASP A 31 -12.599 -22.762 -22.738 1.00 63.00 C ATOM 494 C ASP A 31 -12.300 -24.026 -21.969 1.00 43.00 C ATOM 495 O ASP A 31 -12.237 -24.019 -20.745 1.00 32.00 O ATOM 496 CB ASP A 31 -13.987 -22.850 -23.384 1.00 64.00 C ATOM 497 CG ASP A 31 -15.059 -23.305 -22.418 1.00 34.00 C ATOM 498 OD1 ASP A 31 -15.582 -22.483 -21.638 1.00 33.00 O ATOM 499 OD2 ASP A 31 -15.411 -24.495 -22.440 1.00 3.00 O ATOM 0 H ASP A 31 -11.003 -23.357 -23.933 1.00 22.00 H new ATOM 0 HA ASP A 31 -12.598 -21.917 -22.049 1.00 63.00 H new ATOM 0 HB2 ASP A 31 -14.258 -21.873 -23.785 1.00 64.00 H new ATOM 0 HB3 ASP A 31 -13.947 -23.541 -24.226 1.00 64.00 H new ATOM 504 N ASN A 32 -12.098 -25.104 -22.684 1.00 53.00 N ATOM 505 CA ASN A 32 -11.829 -26.386 -22.056 1.00 43.00 C ATOM 506 C ASN A 32 -10.649 -27.084 -22.753 1.00 14.00 C ATOM 507 O ASN A 32 -10.384 -28.255 -22.543 1.00 62.00 O ATOM 508 CB ASN A 32 -13.146 -27.232 -22.069 1.00 12.00 C ATOM 509 CG ASN A 32 -13.070 -28.641 -21.467 1.00 54.00 C ATOM 510 OD1 ASN A 32 -12.843 -29.623 -22.180 1.00 11.00 O ATOM 511 ND2 ASN A 32 -13.266 -28.757 -20.175 1.00 3.00 N ATOM 0 H ASN A 32 -12.113 -25.126 -23.704 1.00 53.00 H new ATOM 0 HA ASN A 32 -11.527 -26.256 -21.017 1.00 43.00 H new ATOM 0 HB2 ASN A 32 -13.913 -26.674 -21.532 1.00 12.00 H new ATOM 0 HB3 ASN A 32 -13.482 -27.322 -23.102 1.00 12.00 H new ATOM 0 HD21 ASN A 32 -13.233 -29.676 -19.735 1.00 3.00 H new ATOM 0 HD22 ASN A 32 -13.452 -27.928 -19.611 1.00 3.00 H new ATOM 518 N GLN A 33 -9.881 -26.332 -23.537 1.00 74.00 N ATOM 519 CA GLN A 33 -8.765 -26.887 -24.218 1.00 63.00 C ATOM 520 C GLN A 33 -7.780 -25.799 -24.385 1.00 22.00 C ATOM 521 O GLN A 33 -8.158 -24.599 -24.429 1.00 13.00 O ATOM 522 CB GLN A 33 -9.128 -27.506 -25.579 1.00 41.00 C ATOM 523 CG GLN A 33 -9.533 -26.505 -26.634 1.00 74.00 C ATOM 524 CD GLN A 33 -9.793 -27.143 -27.994 1.00 3.00 C ATOM 525 OE1 GLN A 33 -9.188 -28.162 -28.358 1.00 1.00 O ATOM 526 NE2 GLN A 33 -10.676 -26.567 -28.750 1.00 30.00 N ATOM 0 H GLN A 33 -10.030 -25.337 -23.703 1.00 74.00 H new ATOM 0 HA GLN A 33 -8.362 -27.711 -23.629 1.00 63.00 H new ATOM 0 HB2 GLN A 33 -8.273 -28.075 -25.945 1.00 41.00 H new ATOM 0 HB3 GLN A 33 -9.944 -28.214 -25.436 1.00 41.00 H new ATOM 0 HG2 GLN A 33 -10.432 -25.984 -26.306 1.00 74.00 H new ATOM 0 HG3 GLN A 33 -8.749 -25.755 -26.735 1.00 74.00 H new ATOM 0 HE21 GLN A 33 -11.158 -25.729 -28.424 1.00 30.00 H new ATOM 0 HE22 GLN A 33 -10.888 -26.952 -29.671 1.00 30.00 H new ATOM 535 N LEU A 34 -6.571 -26.174 -24.445 1.00 64.00 N ATOM 536 CA LEU A 34 -5.501 -25.262 -24.576 1.00 63.00 C ATOM 537 C LEU A 34 -4.971 -25.384 -25.977 1.00 2.00 C ATOM 538 O LEU A 34 -4.685 -26.488 -26.433 1.00 12.00 O ATOM 539 CB LEU A 34 -4.360 -25.582 -23.583 1.00 70.00 C ATOM 540 CG LEU A 34 -4.547 -25.295 -22.070 1.00 23.00 C ATOM 541 CD1 LEU A 34 -4.708 -23.826 -21.804 1.00 15.00 C ATOM 542 CD2 LEU A 34 -5.689 -26.097 -21.454 1.00 62.00 C ATOM 0 H LEU A 34 -6.281 -27.151 -24.404 1.00 64.00 H new ATOM 0 HA LEU A 34 -5.860 -24.255 -24.363 1.00 63.00 H new ATOM 0 HB2 LEU A 34 -4.128 -26.642 -23.686 1.00 70.00 H new ATOM 0 HB3 LEU A 34 -3.480 -25.030 -23.912 1.00 70.00 H new ATOM 0 HG LEU A 34 -3.632 -25.628 -21.579 1.00 23.00 H new ATOM 0 HD11 LEU A 34 -4.837 -23.662 -20.734 1.00 15.00 H new ATOM 0 HD12 LEU A 34 -3.821 -23.294 -22.148 1.00 15.00 H new ATOM 0 HD13 LEU A 34 -5.583 -23.454 -22.336 1.00 15.00 H new ATOM 0 HD21 LEU A 34 -5.773 -25.856 -20.394 1.00 62.00 H new ATOM 0 HD22 LEU A 34 -6.622 -25.847 -21.958 1.00 62.00 H new ATOM 0 HD23 LEU A 34 -5.489 -27.162 -21.569 1.00 62.00 H new ATOM 554 N LEU A 35 -4.858 -24.298 -26.653 1.00 20.00 N ATOM 555 CA LEU A 35 -4.331 -24.303 -27.993 1.00 72.00 C ATOM 556 C LEU A 35 -3.176 -23.344 -28.078 1.00 52.00 C ATOM 557 O LEU A 35 -3.174 -22.304 -27.408 1.00 4.00 O ATOM 558 CB LEU A 35 -5.412 -24.050 -29.091 1.00 25.00 C ATOM 559 CG LEU A 35 -6.140 -22.683 -29.160 1.00 12.00 C ATOM 560 CD1 LEU A 35 -7.035 -22.663 -30.370 1.00 21.00 C ATOM 561 CD2 LEU A 35 -6.976 -22.408 -27.919 1.00 75.00 C ATOM 0 H LEU A 35 -5.124 -23.377 -26.305 1.00 20.00 H new ATOM 0 HA LEU A 35 -3.968 -25.308 -28.207 1.00 72.00 H new ATOM 0 HB2 LEU A 35 -4.937 -24.213 -30.058 1.00 25.00 H new ATOM 0 HB3 LEU A 35 -6.176 -24.819 -28.977 1.00 25.00 H new ATOM 0 HG LEU A 35 -5.378 -21.906 -29.224 1.00 12.00 H new ATOM 0 HD11 LEU A 35 -7.551 -21.704 -30.425 1.00 21.00 H new ATOM 0 HD12 LEU A 35 -6.435 -22.805 -31.269 1.00 21.00 H new ATOM 0 HD13 LEU A 35 -7.769 -23.466 -30.293 1.00 21.00 H new ATOM 0 HD21 LEU A 35 -7.465 -21.439 -28.017 1.00 75.00 H new ATOM 0 HD22 LEU A 35 -7.731 -23.186 -27.809 1.00 75.00 H new ATOM 0 HD23 LEU A 35 -6.331 -22.402 -27.040 1.00 75.00 H new ATOM 573 N HIS A 36 -2.187 -23.691 -28.860 1.00 64.00 N ATOM 574 CA HIS A 36 -0.980 -22.925 -28.933 1.00 22.00 C ATOM 575 C HIS A 36 -0.832 -22.251 -30.280 1.00 21.00 C ATOM 576 O HIS A 36 -1.105 -22.841 -31.328 1.00 50.00 O ATOM 577 CB HIS A 36 0.256 -23.772 -28.556 1.00 64.00 C ATOM 578 CG HIS A 36 0.572 -24.927 -29.476 1.00 51.00 C ATOM 579 ND1 HIS A 36 1.752 -24.976 -30.176 1.00 55.00 N ATOM 580 CD2 HIS A 36 -0.155 -26.037 -29.758 1.00 53.00 C ATOM 581 CE1 HIS A 36 1.713 -26.101 -30.868 1.00 31.00 C ATOM 582 NE2 HIS A 36 0.582 -26.773 -30.645 1.00 12.00 N ATOM 0 H HIS A 36 -2.200 -24.514 -29.463 1.00 64.00 H new ATOM 0 HA HIS A 36 -1.048 -22.129 -28.191 1.00 22.00 H new ATOM 0 HB2 HIS A 36 1.125 -23.115 -28.519 1.00 64.00 H new ATOM 0 HB3 HIS A 36 0.110 -24.164 -27.550 1.00 64.00 H new ATOM 0 HD2 HIS A 36 -1.126 -26.290 -29.360 1.00 53.00 H new ATOM 0 HE1 HIS A 36 2.498 -26.435 -31.531 1.00 31.00 H new ATOM 0 HE2 HIS A 36 0.317 -27.667 -31.058 1.00 12.00 H new ATOM 590 N LEU A 37 -0.450 -21.011 -30.228 1.00 20.00 N ATOM 591 CA LEU A 37 -0.324 -20.162 -31.391 1.00 61.00 C ATOM 592 C LEU A 37 0.968 -19.445 -31.307 1.00 62.00 C ATOM 593 O LEU A 37 1.490 -19.216 -30.207 1.00 74.00 O ATOM 594 CB LEU A 37 -1.460 -19.125 -31.480 1.00 12.00 C ATOM 595 CG LEU A 37 -2.914 -19.667 -31.456 1.00 74.00 C ATOM 596 CD1 LEU A 37 -3.349 -20.069 -30.063 1.00 31.00 C ATOM 597 CD2 LEU A 37 -3.895 -18.689 -32.056 1.00 43.00 C ATOM 0 H LEU A 37 -0.209 -20.542 -29.355 1.00 20.00 H new ATOM 0 HA LEU A 37 -0.378 -20.792 -32.279 1.00 61.00 H new ATOM 0 HB2 LEU A 37 -1.346 -18.426 -30.652 1.00 12.00 H new ATOM 0 HB3 LEU A 37 -1.326 -18.555 -32.399 1.00 12.00 H new ATOM 0 HG LEU A 37 -2.914 -20.563 -32.077 1.00 74.00 H new ATOM 0 HD11 LEU A 37 -4.373 -20.442 -30.095 1.00 31.00 H new ATOM 0 HD12 LEU A 37 -2.689 -20.851 -29.687 1.00 31.00 H new ATOM 0 HD13 LEU A 37 -3.299 -19.204 -29.402 1.00 31.00 H new ATOM 0 HD21 LEU A 37 -4.899 -19.111 -32.018 1.00 43.00 H new ATOM 0 HD22 LEU A 37 -3.871 -17.757 -31.491 1.00 43.00 H new ATOM 0 HD23 LEU A 37 -3.624 -18.492 -33.093 1.00 43.00 H new ATOM 609 N LYS A 38 1.480 -19.063 -32.426 1.00 62.00 N ATOM 610 CA LYS A 38 2.752 -18.459 -32.457 1.00 3.00 C ATOM 611 C LYS A 38 2.732 -17.136 -33.151 1.00 43.00 C ATOM 612 O LYS A 38 1.892 -16.885 -34.017 1.00 62.00 O ATOM 613 CB LYS A 38 3.731 -19.367 -33.131 1.00 72.00 C ATOM 614 CG LYS A 38 3.449 -19.643 -34.596 1.00 72.00 C ATOM 615 CD LYS A 38 4.605 -20.381 -35.197 1.00 50.00 C ATOM 616 CE LYS A 38 4.390 -20.679 -36.672 1.00 32.00 C ATOM 617 NZ LYS A 38 5.523 -21.444 -37.246 1.00 40.00 N ATOM 0 H LYS A 38 1.027 -19.163 -33.335 1.00 62.00 H new ATOM 0 HA LYS A 38 3.055 -18.285 -31.424 1.00 3.00 H new ATOM 0 HB2 LYS A 38 4.726 -18.931 -33.044 1.00 72.00 H new ATOM 0 HB3 LYS A 38 3.751 -20.316 -32.596 1.00 72.00 H new ATOM 0 HG2 LYS A 38 2.537 -20.231 -34.697 1.00 72.00 H new ATOM 0 HG3 LYS A 38 3.285 -18.706 -35.129 1.00 72.00 H new ATOM 0 HD2 LYS A 38 5.513 -19.791 -35.076 1.00 50.00 H new ATOM 0 HD3 LYS A 38 4.758 -21.316 -34.657 1.00 50.00 H new ATOM 0 HE2 LYS A 38 3.467 -21.245 -36.798 1.00 32.00 H new ATOM 0 HE3 LYS A 38 4.268 -19.744 -37.219 1.00 32.00 H new ATOM 0 HZ1 LYS A 38 5.342 -21.629 -38.253 1.00 40.00 H new ATOM 0 HZ2 LYS A 38 6.399 -20.893 -37.147 1.00 40.00 H new ATOM 0 HZ3 LYS A 38 5.623 -22.347 -36.741 1.00 40.00 H new ATOM 631 N GLN A 39 3.657 -16.328 -32.774 1.00 3.00 N ATOM 632 CA GLN A 39 3.858 -15.029 -33.341 1.00 12.00 C ATOM 633 C GLN A 39 4.785 -15.150 -34.511 1.00 15.00 C ATOM 634 O GLN A 39 5.968 -15.459 -34.369 1.00 62.00 O ATOM 635 CB GLN A 39 4.379 -14.067 -32.265 1.00 73.00 C ATOM 636 CG GLN A 39 5.133 -12.816 -32.732 1.00 73.00 C ATOM 637 CD GLN A 39 4.332 -11.799 -33.517 1.00 54.00 C ATOM 638 OE1 GLN A 39 3.391 -12.112 -34.225 1.00 51.00 O ATOM 639 NE2 GLN A 39 4.713 -10.562 -33.389 1.00 31.00 N ATOM 0 H GLN A 39 4.323 -16.555 -32.035 1.00 3.00 H new ATOM 0 HA GLN A 39 2.918 -14.614 -33.704 1.00 12.00 H new ATOM 0 HB2 GLN A 39 3.529 -13.742 -31.666 1.00 73.00 H new ATOM 0 HB3 GLN A 39 5.039 -14.629 -31.604 1.00 73.00 H new ATOM 0 HG2 GLN A 39 5.548 -12.320 -31.854 1.00 73.00 H new ATOM 0 HG3 GLN A 39 5.975 -13.135 -33.346 1.00 73.00 H new ATOM 0 HE21 GLN A 39 5.505 -10.332 -32.789 1.00 31.00 H new ATOM 0 HE22 GLN A 39 4.220 -9.822 -33.889 1.00 31.00 H new ATOM 648 N GLY A 40 4.228 -14.974 -35.650 1.00 4.00 N ATOM 649 CA GLY A 40 4.964 -15.077 -36.873 1.00 61.00 C ATOM 650 C GLY A 40 4.521 -14.014 -37.808 1.00 42.00 C ATOM 651 O GLY A 40 5.207 -13.007 -37.988 1.00 3.00 O ATOM 0 H GLY A 40 3.240 -14.752 -35.771 1.00 4.00 H new ATOM 0 HA2 GLY A 40 6.032 -14.981 -36.676 1.00 61.00 H new ATOM 0 HA3 GLY A 40 4.809 -16.058 -37.321 1.00 61.00 H new ATOM 655 N ILE A 41 3.359 -14.207 -38.374 1.00 52.00 N ATOM 656 CA ILE A 41 2.762 -13.219 -39.235 1.00 64.00 C ATOM 657 C ILE A 41 2.248 -12.122 -38.346 1.00 14.00 C ATOM 658 O ILE A 41 1.358 -12.341 -37.546 1.00 53.00 O ATOM 659 CB ILE A 41 1.592 -13.802 -40.033 1.00 14.00 C ATOM 660 CG1 ILE A 41 2.070 -15.010 -40.849 1.00 4.00 C ATOM 661 CG2 ILE A 41 1.016 -12.718 -40.943 1.00 74.00 C ATOM 662 CD1 ILE A 41 0.963 -15.775 -41.530 1.00 14.00 C ATOM 0 H ILE A 41 2.800 -15.052 -38.252 1.00 52.00 H new ATOM 0 HA ILE A 41 3.502 -12.859 -39.950 1.00 64.00 H new ATOM 0 HB ILE A 41 0.810 -14.141 -39.354 1.00 14.00 H new ATOM 0 HG12 ILE A 41 2.777 -14.667 -41.604 1.00 4.00 H new ATOM 0 HG13 ILE A 41 2.612 -15.688 -40.190 1.00 4.00 H new ATOM 0 HG21 ILE A 41 0.182 -13.127 -41.514 1.00 74.00 H new ATOM 0 HG22 ILE A 41 0.665 -11.883 -40.337 1.00 74.00 H new ATOM 0 HG23 ILE A 41 1.789 -12.370 -41.628 1.00 74.00 H new ATOM 0 HD11 ILE A 41 1.387 -16.612 -42.085 1.00 14.00 H new ATOM 0 HD12 ILE A 41 0.267 -16.152 -40.781 1.00 14.00 H new ATOM 0 HD13 ILE A 41 0.434 -15.115 -42.218 1.00 14.00 H new ATOM 674 N SER A 42 2.817 -10.980 -38.458 1.00 22.00 N ATOM 675 CA SER A 42 2.513 -9.934 -37.561 1.00 43.00 C ATOM 676 C SER A 42 1.763 -8.787 -38.217 1.00 73.00 C ATOM 677 O SER A 42 1.455 -8.807 -39.411 1.00 44.00 O ATOM 678 CB SER A 42 3.793 -9.422 -36.988 1.00 25.00 C ATOM 679 OG SER A 42 4.568 -10.474 -36.455 1.00 72.00 O ATOM 0 H SER A 42 3.505 -10.746 -39.173 1.00 22.00 H new ATOM 0 HA SER A 42 1.858 -10.337 -36.788 1.00 43.00 H new ATOM 0 HB2 SER A 42 4.360 -8.904 -37.762 1.00 25.00 H new ATOM 0 HB3 SER A 42 3.579 -8.692 -36.207 1.00 25.00 H new ATOM 0 HG SER A 42 5.401 -10.113 -36.087 1.00 72.00 H new ATOM 685 N ALA A 43 1.542 -7.782 -37.413 1.00 21.00 N ATOM 686 CA ALA A 43 0.869 -6.585 -37.717 1.00 41.00 C ATOM 687 C ALA A 43 1.179 -5.700 -36.540 1.00 41.00 C ATOM 688 O ALA A 43 2.109 -6.035 -35.788 1.00 1.00 O ATOM 689 CB ALA A 43 -0.623 -6.820 -37.870 1.00 71.00 C ATOM 0 H ALA A 43 1.865 -7.800 -36.446 1.00 21.00 H new ATOM 0 HA ALA A 43 1.183 -6.145 -38.663 1.00 41.00 H new ATOM 0 HB1 ALA A 43 -1.118 -5.877 -38.105 1.00 71.00 H new ATOM 0 HB2 ALA A 43 -0.798 -7.532 -38.676 1.00 71.00 H new ATOM 0 HB3 ALA A 43 -1.026 -7.219 -36.939 1.00 71.00 H new ATOM 695 N SER A 44 0.471 -4.611 -36.364 1.00 74.00 N ATOM 696 CA SER A 44 0.693 -3.747 -35.220 1.00 3.00 C ATOM 697 C SER A 44 0.262 -4.468 -33.923 1.00 74.00 C ATOM 698 O SER A 44 -0.918 -4.521 -33.580 1.00 23.00 O ATOM 699 CB SER A 44 -0.062 -2.437 -35.428 1.00 53.00 C ATOM 700 OG SER A 44 0.298 -1.872 -36.690 1.00 1.00 O ATOM 0 H SER A 44 -0.266 -4.298 -36.996 1.00 74.00 H new ATOM 0 HA SER A 44 1.753 -3.514 -35.122 1.00 3.00 H new ATOM 0 HB2 SER A 44 -1.137 -2.615 -35.391 1.00 53.00 H new ATOM 0 HB3 SER A 44 0.173 -1.738 -34.625 1.00 53.00 H new ATOM 0 HG SER A 44 -0.189 -1.032 -36.823 1.00 1.00 H new ATOM 706 N GLY A 45 1.220 -5.090 -33.275 1.00 45.00 N ATOM 707 CA GLY A 45 0.984 -5.874 -32.100 1.00 60.00 C ATOM 708 C GLY A 45 1.821 -7.120 -32.163 1.00 63.00 C ATOM 709 O GLY A 45 2.985 -7.074 -32.558 1.00 75.00 O ATOM 0 H GLY A 45 2.199 -5.060 -33.560 1.00 45.00 H new ATOM 0 HA2 GLY A 45 1.233 -5.299 -31.208 1.00 60.00 H new ATOM 0 HA3 GLY A 45 -0.072 -6.134 -32.027 1.00 60.00 H new ATOM 713 N ALA A 46 1.235 -8.220 -31.853 1.00 74.00 N ATOM 714 CA ALA A 46 1.874 -9.462 -31.859 1.00 32.00 C ATOM 715 C ALA A 46 0.810 -10.397 -32.216 1.00 33.00 C ATOM 716 O ALA A 46 -0.262 -10.373 -31.600 1.00 4.00 O ATOM 717 CB ALA A 46 2.446 -9.767 -30.490 1.00 24.00 C ATOM 0 H ALA A 46 0.254 -8.268 -31.578 1.00 74.00 H new ATOM 0 HA ALA A 46 2.716 -9.512 -32.550 1.00 32.00 H new ATOM 0 HB1 ALA A 46 2.941 -10.738 -30.510 1.00 24.00 H new ATOM 0 HB2 ALA A 46 3.168 -8.997 -30.218 1.00 24.00 H new ATOM 0 HB3 ALA A 46 1.641 -9.785 -29.755 1.00 24.00 H new ATOM 723 N ARG A 47 1.013 -11.157 -33.218 1.00 55.00 N ATOM 724 CA ARG A 47 -0.028 -11.978 -33.656 1.00 53.00 C ATOM 725 C ARG A 47 0.315 -13.420 -33.452 1.00 52.00 C ATOM 726 O ARG A 47 1.096 -13.987 -34.198 1.00 24.00 O ATOM 727 CB ARG A 47 -0.382 -11.769 -35.112 1.00 51.00 C ATOM 728 CG ARG A 47 -0.954 -10.422 -35.494 1.00 52.00 C ATOM 729 CD ARG A 47 -1.473 -10.499 -36.925 1.00 10.00 C ATOM 730 NE ARG A 47 -2.332 -11.693 -37.099 1.00 53.00 N ATOM 731 CZ ARG A 47 -2.556 -12.337 -38.260 1.00 32.00 C ATOM 732 NH1 ARG A 47 -2.206 -11.790 -39.422 1.00 22.00 N ATOM 733 NH2 ARG A 47 -3.159 -13.516 -38.243 1.00 22.00 N ATOM 0 H ARG A 47 1.884 -11.225 -33.744 1.00 55.00 H new ATOM 0 HA ARG A 47 -0.895 -11.700 -33.057 1.00 53.00 H new ATOM 0 HB2 ARG A 47 0.516 -11.936 -35.706 1.00 51.00 H new ATOM 0 HB3 ARG A 47 -1.101 -12.536 -35.399 1.00 51.00 H new ATOM 0 HG2 ARG A 47 -1.760 -10.147 -34.814 1.00 52.00 H new ATOM 0 HG3 ARG A 47 -0.190 -9.649 -35.410 1.00 52.00 H new ATOM 0 HD2 ARG A 47 -2.039 -9.598 -37.162 1.00 10.00 H new ATOM 0 HD3 ARG A 47 -0.635 -10.541 -37.621 1.00 10.00 H new ATOM 0 HE ARG A 47 -2.794 -12.059 -36.267 1.00 53.00 H new ATOM 0 HH11 ARG A 47 -1.762 -10.872 -39.440 1.00 22.00 H new ATOM 0 HH12 ARG A 47 -2.382 -12.289 -40.294 1.00 22.00 H new ATOM 0 HH21 ARG A 47 -3.449 -13.928 -37.356 1.00 22.00 H new ATOM 0 HH22 ARG A 47 -3.333 -14.012 -39.117 1.00 22.00 H new ATOM 747 N TYR A 48 -0.263 -14.002 -32.475 1.00 43.00 N ATOM 748 CA TYR A 48 -0.081 -15.370 -32.215 1.00 51.00 C ATOM 749 C TYR A 48 -1.191 -16.039 -32.930 1.00 75.00 C ATOM 750 O TYR A 48 -2.350 -15.880 -32.592 1.00 72.00 O ATOM 751 CB TYR A 48 -0.115 -15.635 -30.721 1.00 65.00 C ATOM 752 CG TYR A 48 0.929 -14.849 -29.941 1.00 13.00 C ATOM 753 CD1 TYR A 48 0.652 -13.575 -29.463 1.00 71.00 C ATOM 754 CD2 TYR A 48 2.187 -15.381 -29.688 1.00 5.00 C ATOM 755 CE1 TYR A 48 1.590 -12.856 -28.760 1.00 2.00 C ATOM 756 CE2 TYR A 48 3.136 -14.663 -28.980 1.00 52.00 C ATOM 757 CZ TYR A 48 2.829 -13.400 -28.518 1.00 41.00 C ATOM 758 OH TYR A 48 3.767 -12.674 -27.816 1.00 43.00 O ATOM 0 H TYR A 48 -0.888 -13.530 -31.822 1.00 43.00 H new ATOM 0 HA TYR A 48 0.886 -15.743 -32.554 1.00 51.00 H new ATOM 0 HB2 TYR A 48 -1.105 -15.387 -30.339 1.00 65.00 H new ATOM 0 HB3 TYR A 48 0.037 -16.700 -30.545 1.00 65.00 H new ATOM 0 HD1 TYR A 48 -0.319 -13.140 -29.647 1.00 71.00 H new ATOM 0 HD2 TYR A 48 2.429 -16.370 -30.049 1.00 5.00 H new ATOM 0 HE1 TYR A 48 1.354 -11.866 -28.399 1.00 2.00 H new ATOM 0 HE2 TYR A 48 4.110 -15.089 -28.791 1.00 52.00 H new ATOM 0 HH TYR A 48 4.590 -13.200 -27.729 1.00 43.00 H new ATOM 768 N THR A 49 -0.878 -16.698 -33.973 1.00 71.00 N ATOM 769 CA THR A 49 -1.883 -17.237 -34.809 1.00 5.00 C ATOM 770 C THR A 49 -1.392 -18.503 -35.450 1.00 3.00 C ATOM 771 O THR A 49 -0.224 -18.606 -35.818 1.00 72.00 O ATOM 772 CB THR A 49 -2.300 -16.205 -35.909 1.00 51.00 C ATOM 773 OG1 THR A 49 -2.792 -14.992 -35.301 1.00 74.00 O ATOM 774 CG2 THR A 49 -3.361 -16.769 -36.850 1.00 31.00 C ATOM 0 H THR A 49 0.078 -16.882 -34.276 1.00 71.00 H new ATOM 0 HA THR A 49 -2.758 -17.461 -34.198 1.00 5.00 H new ATOM 0 HB THR A 49 -1.409 -15.987 -36.497 1.00 51.00 H new ATOM 0 HG1 THR A 49 -2.036 -14.454 -34.987 1.00 74.00 H new ATOM 0 HG21 THR A 49 -3.620 -16.019 -37.597 1.00 31.00 H new ATOM 0 HG22 THR A 49 -2.971 -17.657 -37.347 1.00 31.00 H new ATOM 0 HG23 THR A 49 -4.250 -17.034 -36.278 1.00 31.00 H new ATOM 782 N ASP A 50 -2.241 -19.488 -35.487 1.00 13.00 N ATOM 783 CA ASP A 50 -1.937 -20.680 -36.231 1.00 10.00 C ATOM 784 C ASP A 50 -2.966 -20.858 -37.325 1.00 63.00 C ATOM 785 O ASP A 50 -2.650 -21.267 -38.432 1.00 74.00 O ATOM 786 CB ASP A 50 -1.865 -21.925 -35.353 1.00 53.00 C ATOM 787 CG ASP A 50 -1.561 -23.165 -36.175 1.00 54.00 C ATOM 788 OD1 ASP A 50 -0.381 -23.391 -36.528 1.00 34.00 O ATOM 789 OD2 ASP A 50 -2.504 -23.918 -36.519 1.00 61.00 O ATOM 0 H ASP A 50 -3.145 -19.492 -35.014 1.00 13.00 H new ATOM 0 HA ASP A 50 -0.945 -20.557 -36.665 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -1.095 -21.792 -34.593 1.00 53.00 H new ATOM 0 HB3 ASP A 50 -2.811 -22.057 -34.828 1.00 53.00 H new ATOM 794 N GLY A 51 -4.195 -20.489 -37.025 1.00 1.00 N ATOM 795 CA GLY A 51 -5.248 -20.634 -37.990 1.00 12.00 C ATOM 796 C GLY A 51 -6.581 -20.869 -37.339 1.00 54.00 C ATOM 797 O GLY A 51 -7.609 -20.551 -37.917 1.00 52.00 O ATOM 0 H GLY A 51 -4.480 -20.092 -36.130 1.00 1.00 H new ATOM 0 HA2 GLY A 51 -5.299 -19.737 -38.608 1.00 12.00 H new ATOM 0 HA3 GLY A 51 -5.018 -21.466 -38.655 1.00 12.00 H new ATOM 801 N ILE A 52 -6.563 -21.395 -36.115 1.00 11.00 N ATOM 802 CA ILE A 52 -7.787 -21.674 -35.385 1.00 5.00 C ATOM 803 C ILE A 52 -8.442 -20.344 -35.098 1.00 12.00 C ATOM 804 O ILE A 52 -9.570 -20.085 -35.504 1.00 24.00 O ATOM 805 CB ILE A 52 -7.572 -22.438 -34.022 1.00 63.00 C ATOM 806 CG1 ILE A 52 -6.689 -23.705 -34.157 1.00 54.00 C ATOM 807 CG2 ILE A 52 -8.920 -22.848 -33.450 1.00 42.00 C ATOM 808 CD1 ILE A 52 -5.191 -23.471 -34.026 1.00 55.00 C ATOM 0 H ILE A 52 -5.709 -21.635 -35.612 1.00 11.00 H new ATOM 0 HA ILE A 52 -8.398 -22.333 -36.002 1.00 5.00 H new ATOM 0 HB ILE A 52 -7.051 -21.745 -33.361 1.00 63.00 H new ATOM 0 HG12 ILE A 52 -6.996 -24.424 -33.397 1.00 54.00 H new ATOM 0 HG13 ILE A 52 -6.885 -24.163 -35.127 1.00 54.00 H new ATOM 0 HG21 ILE A 52 -8.770 -23.376 -32.508 1.00 42.00 H new ATOM 0 HG22 ILE A 52 -9.527 -21.959 -33.275 1.00 42.00 H new ATOM 0 HG23 ILE A 52 -9.431 -23.503 -34.156 1.00 42.00 H new ATOM 0 HD11 ILE A 52 -4.664 -24.419 -34.135 1.00 55.00 H new ATOM 0 HD12 ILE A 52 -4.861 -22.781 -34.802 1.00 55.00 H new ATOM 0 HD13 ILE A 52 -4.973 -23.046 -33.046 1.00 55.00 H new ATOM 820 N TYR A 53 -7.694 -19.500 -34.424 1.00 3.00 N ATOM 821 CA TYR A 53 -8.074 -18.146 -34.166 1.00 21.00 C ATOM 822 C TYR A 53 -6.859 -17.302 -34.389 1.00 65.00 C ATOM 823 O TYR A 53 -5.752 -17.836 -34.610 1.00 72.00 O ATOM 824 CB TYR A 53 -8.550 -17.926 -32.722 1.00 62.00 C ATOM 825 CG TYR A 53 -9.654 -18.861 -32.278 1.00 30.00 C ATOM 826 CD1 TYR A 53 -10.927 -18.778 -32.819 1.00 44.00 C ATOM 827 CD2 TYR A 53 -9.402 -19.856 -31.348 1.00 62.00 C ATOM 828 CE1 TYR A 53 -11.918 -19.658 -32.443 1.00 32.00 C ATOM 829 CE2 TYR A 53 -10.385 -20.745 -30.970 1.00 72.00 C ATOM 830 CZ TYR A 53 -11.640 -20.642 -31.521 1.00 40.00 C ATOM 831 OH TYR A 53 -12.622 -21.534 -31.157 1.00 45.00 O ATOM 0 H TYR A 53 -6.785 -19.750 -34.035 1.00 3.00 H new ATOM 0 HA TYR A 53 -8.903 -17.887 -34.825 1.00 21.00 H new ATOM 0 HB2 TYR A 53 -7.700 -18.043 -32.050 1.00 62.00 H new ATOM 0 HB3 TYR A 53 -8.898 -16.898 -32.620 1.00 62.00 H new ATOM 0 HD1 TYR A 53 -11.146 -18.011 -33.547 1.00 44.00 H new ATOM 0 HD2 TYR A 53 -8.418 -19.937 -30.911 1.00 62.00 H new ATOM 0 HE1 TYR A 53 -12.907 -19.576 -32.869 1.00 32.00 H new ATOM 0 HE2 TYR A 53 -10.171 -21.517 -30.246 1.00 72.00 H new ATOM 0 HH TYR A 53 -12.882 -21.372 -30.226 1.00 45.00 H new ATOM 841 N VAL A 54 -7.049 -16.036 -34.341 1.00 22.00 N ATOM 842 CA VAL A 54 -6.001 -15.071 -34.433 1.00 34.00 C ATOM 843 C VAL A 54 -5.909 -14.402 -33.086 1.00 25.00 C ATOM 844 O VAL A 54 -6.837 -13.710 -32.675 1.00 33.00 O ATOM 845 CB VAL A 54 -6.365 -14.020 -35.492 1.00 60.00 C ATOM 846 CG1 VAL A 54 -5.406 -12.824 -35.475 1.00 31.00 C ATOM 847 CG2 VAL A 54 -6.399 -14.640 -36.879 1.00 4.00 C ATOM 0 H VAL A 54 -7.974 -15.620 -34.232 1.00 22.00 H new ATOM 0 HA VAL A 54 -5.057 -15.540 -34.712 1.00 34.00 H new ATOM 0 HB VAL A 54 -7.359 -13.651 -35.241 1.00 60.00 H new ATOM 0 HG11 VAL A 54 -5.704 -12.108 -36.241 1.00 31.00 H new ATOM 0 HG12 VAL A 54 -5.440 -12.344 -34.497 1.00 31.00 H new ATOM 0 HG13 VAL A 54 -4.391 -13.168 -35.675 1.00 31.00 H new ATOM 0 HG21 VAL A 54 -6.659 -13.877 -37.612 1.00 4.00 H new ATOM 0 HG22 VAL A 54 -5.419 -15.053 -37.117 1.00 4.00 H new ATOM 0 HG23 VAL A 54 -7.144 -15.436 -36.904 1.00 4.00 H new ATOM 857 N PHE A 55 -4.852 -14.645 -32.385 1.00 13.00 N ATOM 858 CA PHE A 55 -4.677 -14.066 -31.086 1.00 54.00 C ATOM 859 C PHE A 55 -3.760 -12.870 -31.225 1.00 50.00 C ATOM 860 O PHE A 55 -2.563 -13.008 -31.456 1.00 51.00 O ATOM 861 CB PHE A 55 -4.116 -15.106 -30.110 1.00 71.00 C ATOM 862 CG PHE A 55 -4.047 -14.644 -28.692 1.00 63.00 C ATOM 863 CD1 PHE A 55 -5.176 -14.669 -27.906 1.00 52.00 C ATOM 864 CD2 PHE A 55 -2.860 -14.188 -28.144 1.00 64.00 C ATOM 865 CE1 PHE A 55 -5.135 -14.252 -26.605 1.00 33.00 C ATOM 866 CE2 PHE A 55 -2.809 -13.766 -26.835 1.00 24.00 C ATOM 867 CZ PHE A 55 -3.951 -13.799 -26.065 1.00 44.00 C ATOM 0 H PHE A 55 -4.087 -15.246 -32.690 1.00 13.00 H new ATOM 0 HA PHE A 55 -5.633 -13.737 -30.679 1.00 54.00 H new ATOM 0 HB2 PHE A 55 -4.734 -16.003 -30.158 1.00 71.00 H new ATOM 0 HB3 PHE A 55 -3.116 -15.391 -30.436 1.00 71.00 H new ATOM 0 HD1 PHE A 55 -6.107 -15.023 -28.323 1.00 52.00 H new ATOM 0 HD2 PHE A 55 -1.966 -14.163 -28.749 1.00 64.00 H new ATOM 0 HE1 PHE A 55 -6.030 -14.278 -26.001 1.00 33.00 H new ATOM 0 HE2 PHE A 55 -1.880 -13.411 -26.414 1.00 24.00 H new ATOM 0 HZ PHE A 55 -3.918 -13.469 -25.037 1.00 44.00 H new ATOM 877 N TRP A 56 -4.321 -11.725 -31.122 1.00 15.00 N ATOM 878 CA TRP A 56 -3.638 -10.530 -31.332 1.00 14.00 C ATOM 879 C TRP A 56 -3.403 -9.904 -29.984 1.00 14.00 C ATOM 880 O TRP A 56 -4.322 -9.696 -29.200 1.00 63.00 O ATOM 881 CB TRP A 56 -4.495 -9.624 -32.195 1.00 43.00 C ATOM 882 CG TRP A 56 -3.767 -8.513 -32.884 1.00 0.00 C ATOM 883 CD1 TRP A 56 -2.712 -7.790 -32.416 1.00 24.00 C ATOM 884 CD2 TRP A 56 -4.075 -7.983 -34.175 1.00 33.00 C ATOM 885 NE1 TRP A 56 -2.346 -6.853 -33.333 1.00 24.00 N ATOM 886 CE2 TRP A 56 -3.169 -6.945 -34.423 1.00 51.00 C ATOM 887 CE3 TRP A 56 -5.036 -8.290 -35.147 1.00 13.00 C ATOM 888 CZ2 TRP A 56 -3.187 -6.206 -35.601 1.00 25.00 C ATOM 889 CZ3 TRP A 56 -5.056 -7.556 -36.316 1.00 0.00 C ATOM 890 CH2 TRP A 56 -4.137 -6.524 -36.534 1.00 70.00 C ATOM 0 H TRP A 56 -5.304 -11.602 -30.880 1.00 15.00 H new ATOM 0 HA TRP A 56 -2.686 -10.694 -31.837 1.00 14.00 H new ATOM 0 HB2 TRP A 56 -4.991 -10.234 -32.950 1.00 43.00 H new ATOM 0 HB3 TRP A 56 -5.277 -9.191 -31.571 1.00 43.00 H new ATOM 0 HD1 TRP A 56 -2.236 -7.938 -31.458 1.00 24.00 H new ATOM 0 HE1 TRP A 56 -1.580 -6.188 -33.225 1.00 24.00 H new ATOM 0 HE3 TRP A 56 -5.748 -9.086 -34.985 1.00 13.00 H new ATOM 0 HZ2 TRP A 56 -2.477 -5.410 -35.773 1.00 25.00 H new ATOM 0 HZ3 TRP A 56 -5.792 -7.782 -37.073 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -4.178 -5.966 -37.458 1.00 70.00 H new ATOM 901 N SER A 57 -2.207 -9.651 -29.734 1.00 2.00 N ATOM 902 CA SER A 57 -1.765 -9.061 -28.514 1.00 41.00 C ATOM 903 C SER A 57 -1.255 -7.682 -28.868 1.00 30.00 C ATOM 904 O SER A 57 -0.312 -7.558 -29.640 1.00 61.00 O ATOM 905 CB SER A 57 -0.643 -9.934 -27.925 1.00 54.00 C ATOM 906 OG SER A 57 -0.242 -9.509 -26.624 1.00 41.00 O ATOM 0 H SER A 57 -1.450 -9.848 -30.388 1.00 2.00 H new ATOM 0 HA SER A 57 -2.559 -8.988 -27.771 1.00 41.00 H new ATOM 0 HB2 SER A 57 -0.981 -10.969 -27.877 1.00 54.00 H new ATOM 0 HB3 SER A 57 0.219 -9.911 -28.592 1.00 54.00 H new ATOM 0 HG SER A 57 0.470 -10.095 -26.293 1.00 41.00 H new ATOM 912 N LYS A 58 -1.907 -6.654 -28.388 1.00 65.00 N ATOM 913 CA LYS A 58 -1.511 -5.322 -28.743 1.00 31.00 C ATOM 914 C LYS A 58 -1.676 -4.332 -27.601 1.00 42.00 C ATOM 915 O LYS A 58 -2.773 -4.147 -27.070 1.00 31.00 O ATOM 916 CB LYS A 58 -2.248 -4.880 -30.020 1.00 42.00 C ATOM 917 CG LYS A 58 -3.775 -4.977 -29.963 1.00 52.00 C ATOM 918 CD LYS A 58 -4.349 -4.888 -31.357 1.00 53.00 C ATOM 919 CE LYS A 58 -5.870 -4.945 -31.389 1.00 61.00 C ATOM 920 NZ LYS A 58 -6.494 -3.727 -30.843 1.00 51.00 N ATOM 0 H LYS A 58 -2.706 -6.715 -27.757 1.00 65.00 H new ATOM 0 HA LYS A 58 -0.441 -5.334 -28.952 1.00 31.00 H new ATOM 0 HB2 LYS A 58 -1.974 -3.848 -30.238 1.00 42.00 H new ATOM 0 HB3 LYS A 58 -1.893 -5.487 -30.853 1.00 42.00 H new ATOM 0 HG2 LYS A 58 -4.071 -5.917 -29.498 1.00 52.00 H new ATOM 0 HG3 LYS A 58 -4.176 -4.175 -29.343 1.00 52.00 H new ATOM 0 HD2 LYS A 58 -4.018 -3.958 -31.820 1.00 53.00 H new ATOM 0 HD3 LYS A 58 -3.949 -5.704 -31.959 1.00 53.00 H new ATOM 0 HE2 LYS A 58 -6.203 -5.090 -32.417 1.00 61.00 H new ATOM 0 HE3 LYS A 58 -6.210 -5.810 -30.819 1.00 61.00 H new ATOM 0 HZ1 LYS A 58 -7.507 -3.898 -30.682 1.00 51.00 H new ATOM 0 HZ2 LYS A 58 -6.038 -3.477 -29.942 1.00 51.00 H new ATOM 0 HZ3 LYS A 58 -6.378 -2.945 -31.518 1.00 51.00 H new ATOM 934 N GLY A 59 -0.555 -3.769 -27.183 1.00 21.00 N ATOM 935 CA GLY A 59 -0.530 -2.709 -26.189 1.00 10.00 C ATOM 936 C GLY A 59 -0.889 -3.155 -24.783 1.00 32.00 C ATOM 937 O GLY A 59 -0.010 -3.402 -23.947 1.00 0.00 O ATOM 0 H GLY A 59 0.368 -4.036 -27.525 1.00 21.00 H new ATOM 0 HA2 GLY A 59 0.466 -2.267 -26.173 1.00 10.00 H new ATOM 0 HA3 GLY A 59 -1.222 -1.925 -26.495 1.00 10.00 H new ATOM 941 N ASP A 60 -2.165 -3.252 -24.532 1.00 30.00 N ATOM 942 CA ASP A 60 -2.701 -3.584 -23.211 1.00 22.00 C ATOM 943 C ASP A 60 -3.842 -4.581 -23.363 1.00 72.00 C ATOM 944 O ASP A 60 -4.419 -5.049 -22.389 1.00 53.00 O ATOM 945 CB ASP A 60 -3.232 -2.287 -22.561 1.00 0.00 C ATOM 946 CG ASP A 60 -3.795 -2.436 -21.158 1.00 32.00 C ATOM 947 OD1 ASP A 60 -3.019 -2.419 -20.192 1.00 15.00 O ATOM 948 OD2 ASP A 60 -5.044 -2.500 -21.004 1.00 34.00 O ATOM 0 H ASP A 60 -2.885 -3.103 -25.239 1.00 30.00 H new ATOM 0 HA ASP A 60 -1.923 -4.025 -22.588 1.00 22.00 H new ATOM 0 HB2 ASP A 60 -2.421 -1.559 -22.532 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.010 -1.873 -23.203 1.00 0.00 H new ATOM 953 N GLU A 61 -4.137 -4.958 -24.580 1.00 5.00 N ATOM 954 CA GLU A 61 -5.276 -5.771 -24.818 1.00 3.00 C ATOM 955 C GLU A 61 -4.890 -7.007 -25.571 1.00 5.00 C ATOM 956 O GLU A 61 -3.814 -7.080 -26.202 1.00 72.00 O ATOM 957 CB GLU A 61 -6.356 -5.001 -25.590 1.00 72.00 C ATOM 958 CG GLU A 61 -5.945 -4.639 -26.995 1.00 24.00 C ATOM 959 CD GLU A 61 -6.992 -3.884 -27.753 1.00 34.00 C ATOM 960 OE1 GLU A 61 -8.113 -4.394 -27.917 1.00 0.00 O ATOM 961 OE2 GLU A 61 -6.691 -2.762 -28.240 1.00 20.00 O ATOM 0 H GLU A 61 -3.600 -4.711 -25.411 1.00 5.00 H new ATOM 0 HA GLU A 61 -5.687 -6.059 -23.851 1.00 3.00 H new ATOM 0 HB2 GLU A 61 -7.264 -5.603 -25.629 1.00 72.00 H new ATOM 0 HB3 GLU A 61 -6.601 -4.090 -25.045 1.00 72.00 H new ATOM 0 HG2 GLU A 61 -5.035 -4.040 -26.955 1.00 24.00 H new ATOM 0 HG3 GLU A 61 -5.702 -5.551 -27.539 1.00 24.00 H new ATOM 968 N ALA A 62 -5.742 -7.960 -25.495 1.00 62.00 N ATOM 969 CA ALA A 62 -5.608 -9.160 -26.207 1.00 21.00 C ATOM 970 C ALA A 62 -6.922 -9.397 -26.900 1.00 14.00 C ATOM 971 O ALA A 62 -7.986 -9.425 -26.258 1.00 25.00 O ATOM 972 CB ALA A 62 -5.251 -10.313 -25.291 1.00 64.00 C ATOM 0 H ALA A 62 -6.579 -7.918 -24.913 1.00 62.00 H new ATOM 0 HA ALA A 62 -4.795 -9.091 -26.930 1.00 21.00 H new ATOM 0 HB1 ALA A 62 -5.155 -11.227 -25.877 1.00 64.00 H new ATOM 0 HB2 ALA A 62 -4.306 -10.102 -24.791 1.00 64.00 H new ATOM 0 HB3 ALA A 62 -6.035 -10.441 -24.545 1.00 64.00 H new ATOM 978 N THR A 63 -6.861 -9.499 -28.163 1.00 31.00 N ATOM 979 CA THR A 63 -8.012 -9.642 -28.987 1.00 14.00 C ATOM 980 C THR A 63 -7.905 -10.985 -29.736 1.00 65.00 C ATOM 981 O THR A 63 -6.896 -11.240 -30.386 1.00 55.00 O ATOM 982 CB THR A 63 -8.009 -8.483 -30.009 1.00 1.00 C ATOM 983 OG1 THR A 63 -7.559 -7.265 -29.363 1.00 2.00 O ATOM 984 CG2 THR A 63 -9.400 -8.254 -30.542 1.00 43.00 C ATOM 0 H THR A 63 -5.983 -9.486 -28.683 1.00 31.00 H new ATOM 0 HA THR A 63 -8.928 -9.620 -28.396 1.00 14.00 H new ATOM 0 HB THR A 63 -7.340 -8.746 -30.829 1.00 1.00 H new ATOM 0 HG1 THR A 63 -8.335 -6.717 -29.121 1.00 2.00 H new ATOM 0 HG21 THR A 63 -9.384 -7.435 -31.261 1.00 43.00 H new ATOM 0 HG22 THR A 63 -9.756 -9.160 -31.032 1.00 43.00 H new ATOM 0 HG23 THR A 63 -10.068 -8.001 -29.719 1.00 43.00 H new ATOM 992 N VAL A 64 -8.904 -11.845 -29.638 1.00 2.00 N ATOM 993 CA VAL A 64 -8.828 -13.116 -30.299 1.00 71.00 C ATOM 994 C VAL A 64 -9.953 -13.244 -31.354 1.00 34.00 C ATOM 995 O VAL A 64 -11.120 -13.529 -31.042 1.00 63.00 O ATOM 996 CB VAL A 64 -8.769 -14.291 -29.266 1.00 30.00 C ATOM 997 CG1 VAL A 64 -9.939 -14.302 -28.325 1.00 72.00 C ATOM 998 CG2 VAL A 64 -8.562 -15.630 -29.939 1.00 71.00 C ATOM 0 H VAL A 64 -9.762 -11.681 -29.112 1.00 2.00 H new ATOM 0 HA VAL A 64 -7.891 -13.183 -30.853 1.00 71.00 H new ATOM 0 HB VAL A 64 -7.890 -14.108 -28.648 1.00 30.00 H new ATOM 0 HG11 VAL A 64 -9.842 -15.139 -27.633 1.00 72.00 H new ATOM 0 HG12 VAL A 64 -9.963 -13.368 -27.764 1.00 72.00 H new ATOM 0 HG13 VAL A 64 -10.863 -14.407 -28.894 1.00 72.00 H new ATOM 0 HG21 VAL A 64 -8.527 -16.415 -29.184 1.00 71.00 H new ATOM 0 HG22 VAL A 64 -9.386 -15.823 -30.626 1.00 71.00 H new ATOM 0 HG23 VAL A 64 -7.623 -15.618 -30.493 1.00 71.00 H new ATOM 1008 N TYR A 65 -9.570 -13.002 -32.597 1.00 64.00 N ATOM 1009 CA TYR A 65 -10.490 -12.858 -33.734 1.00 72.00 C ATOM 1010 C TYR A 65 -10.180 -13.828 -34.872 1.00 71.00 C ATOM 1011 O TYR A 65 -9.230 -13.625 -35.600 1.00 73.00 O ATOM 1012 CB TYR A 65 -10.256 -11.457 -34.351 1.00 73.00 C ATOM 1013 CG TYR A 65 -11.313 -10.390 -34.186 1.00 43.00 C ATOM 1014 CD1 TYR A 65 -11.510 -9.756 -32.981 1.00 11.00 C ATOM 1015 CD2 TYR A 65 -12.084 -9.984 -35.276 1.00 33.00 C ATOM 1016 CE1 TYR A 65 -12.448 -8.749 -32.846 1.00 53.00 C ATOM 1017 CE2 TYR A 65 -13.018 -8.972 -35.155 1.00 44.00 C ATOM 1018 CZ TYR A 65 -13.197 -8.360 -33.935 1.00 71.00 C ATOM 1019 OH TYR A 65 -14.121 -7.339 -33.802 1.00 40.00 O ATOM 0 H TYR A 65 -8.590 -12.896 -32.859 1.00 64.00 H new ATOM 0 HA TYR A 65 -11.496 -13.034 -33.354 1.00 72.00 H new ATOM 0 HB2 TYR A 65 -9.328 -11.066 -33.933 1.00 73.00 H new ATOM 0 HB3 TYR A 65 -10.092 -11.593 -35.420 1.00 73.00 H new ATOM 0 HD1 TYR A 65 -10.921 -10.050 -32.125 1.00 11.00 H new ATOM 0 HD2 TYR A 65 -11.949 -10.469 -36.231 1.00 33.00 H new ATOM 0 HE1 TYR A 65 -12.593 -8.269 -31.890 1.00 53.00 H new ATOM 0 HE2 TYR A 65 -13.602 -8.664 -36.010 1.00 44.00 H new ATOM 0 HH TYR A 65 -14.565 -7.185 -34.662 1.00 40.00 H new ATOM 1029 N LYS A 66 -10.939 -14.859 -35.028 1.00 22.00 N ATOM 1030 CA LYS A 66 -10.936 -15.540 -36.238 1.00 64.00 C ATOM 1031 C LYS A 66 -11.975 -14.786 -37.013 1.00 3.00 C ATOM 1032 O LYS A 66 -12.889 -14.216 -36.409 1.00 73.00 O ATOM 1033 CB LYS A 66 -11.347 -17.008 -36.073 1.00 34.00 C ATOM 1034 CG LYS A 66 -11.363 -17.818 -37.362 1.00 2.00 C ATOM 1035 CD LYS A 66 -9.971 -17.971 -37.975 1.00 14.00 C ATOM 1036 CE LYS A 66 -10.031 -18.768 -39.271 1.00 23.00 C ATOM 1037 NZ LYS A 66 -8.702 -18.992 -39.863 1.00 31.00 N ATOM 0 H LYS A 66 -11.566 -15.236 -34.317 1.00 22.00 H new ATOM 0 HA LYS A 66 -9.954 -15.577 -36.709 1.00 64.00 H new ATOM 0 HB2 LYS A 66 -10.664 -17.485 -35.370 1.00 34.00 H new ATOM 0 HB3 LYS A 66 -12.341 -17.044 -35.626 1.00 34.00 H new ATOM 0 HG2 LYS A 66 -11.779 -18.806 -37.162 1.00 2.00 H new ATOM 0 HG3 LYS A 66 -12.023 -17.335 -38.083 1.00 2.00 H new ATOM 0 HD2 LYS A 66 -9.545 -16.987 -38.168 1.00 14.00 H new ATOM 0 HD3 LYS A 66 -9.310 -18.471 -37.267 1.00 14.00 H new ATOM 0 HE2 LYS A 66 -10.505 -19.730 -39.079 1.00 23.00 H new ATOM 0 HE3 LYS A 66 -10.659 -18.240 -39.988 1.00 23.00 H new ATOM 0 HZ1 LYS A 66 -8.783 -19.663 -40.653 1.00 31.00 H new ATOM 0 HZ2 LYS A 66 -8.321 -18.090 -40.212 1.00 31.00 H new ATOM 0 HZ3 LYS A 66 -8.062 -19.382 -39.142 1.00 31.00 H new ATOM 1051 N ARG A 67 -11.829 -14.747 -38.273 1.00 74.00 N ATOM 1052 CA ARG A 67 -12.708 -13.989 -39.162 1.00 40.00 C ATOM 1053 C ARG A 67 -14.206 -14.246 -38.892 1.00 15.00 C ATOM 1054 O ARG A 67 -15.018 -13.314 -38.928 1.00 62.00 O ATOM 1055 CB ARG A 67 -12.358 -14.229 -40.639 1.00 75.00 C ATOM 1056 CG ARG A 67 -13.190 -13.397 -41.606 1.00 1.00 C ATOM 1057 CD ARG A 67 -13.028 -11.912 -41.320 1.00 64.00 C ATOM 1058 NE ARG A 67 -13.904 -11.081 -42.141 1.00 61.00 N ATOM 1059 CZ ARG A 67 -14.259 -9.819 -41.841 1.00 0.00 C ATOM 1060 NH1 ARG A 67 -13.776 -9.216 -40.744 1.00 71.00 N ATOM 1061 NH2 ARG A 67 -15.102 -9.179 -42.625 1.00 70.00 N ATOM 0 H ARG A 67 -11.084 -15.244 -38.762 1.00 74.00 H new ATOM 0 HA ARG A 67 -12.531 -12.937 -38.939 1.00 40.00 H new ATOM 0 HB2 ARG A 67 -11.303 -14.005 -40.795 1.00 75.00 H new ATOM 0 HB3 ARG A 67 -12.497 -15.285 -40.870 1.00 75.00 H new ATOM 0 HG2 ARG A 67 -12.885 -13.610 -42.631 1.00 1.00 H new ATOM 0 HG3 ARG A 67 -14.240 -13.676 -41.521 1.00 1.00 H new ATOM 0 HD2 ARG A 67 -13.238 -11.724 -40.267 1.00 64.00 H new ATOM 0 HD3 ARG A 67 -11.992 -11.623 -41.495 1.00 64.00 H new ATOM 0 HE ARG A 67 -14.272 -11.486 -43.002 1.00 61.00 H new ATOM 0 HH11 ARG A 67 -13.133 -9.715 -40.129 1.00 71.00 H new ATOM 0 HH12 ARG A 67 -14.051 -8.259 -40.525 1.00 71.00 H new ATOM 0 HH21 ARG A 67 -15.480 -9.641 -43.452 1.00 70.00 H new ATOM 0 HH22 ARG A 67 -15.377 -8.222 -42.405 1.00 70.00 H new ATOM 1075 N ASP A 68 -14.559 -15.473 -38.592 1.00 51.00 N ATOM 1076 CA ASP A 68 -15.942 -15.789 -38.282 1.00 44.00 C ATOM 1077 C ASP A 68 -16.115 -15.989 -36.796 1.00 52.00 C ATOM 1078 O ASP A 68 -17.234 -15.944 -36.277 1.00 64.00 O ATOM 1079 CB ASP A 68 -16.418 -17.044 -39.039 1.00 53.00 C ATOM 1080 CG ASP A 68 -17.890 -17.385 -38.791 1.00 25.00 C ATOM 1081 OD1 ASP A 68 -18.784 -16.717 -39.388 1.00 4.00 O ATOM 1082 OD2 ASP A 68 -18.184 -18.345 -38.041 1.00 2.00 O ATOM 0 H ASP A 68 -13.918 -16.266 -38.555 1.00 51.00 H new ATOM 0 HA ASP A 68 -16.553 -14.946 -38.605 1.00 44.00 H new ATOM 0 HB2 ASP A 68 -16.263 -16.895 -40.108 1.00 53.00 H new ATOM 0 HB3 ASP A 68 -15.802 -17.893 -38.743 1.00 53.00 H new ATOM 1087 N ARG A 69 -15.021 -16.104 -36.077 1.00 70.00 N ATOM 1088 CA ARG A 69 -15.151 -16.478 -34.715 1.00 33.00 C ATOM 1089 C ARG A 69 -14.193 -15.762 -33.779 1.00 40.00 C ATOM 1090 O ARG A 69 -13.031 -16.139 -33.619 1.00 43.00 O ATOM 1091 CB ARG A 69 -15.081 -17.997 -34.529 1.00 2.00 C ATOM 1092 CG ARG A 69 -15.432 -18.454 -33.122 1.00 22.00 C ATOM 1093 CD ARG A 69 -16.845 -18.017 -32.755 1.00 45.00 C ATOM 1094 NE ARG A 69 -17.301 -18.565 -31.480 1.00 52.00 N ATOM 1095 CZ ARG A 69 -17.981 -17.888 -30.546 1.00 52.00 C ATOM 1096 NH1 ARG A 69 -18.040 -16.562 -30.584 1.00 23.00 N ATOM 1097 NH2 ARG A 69 -18.528 -18.537 -29.535 1.00 31.00 N ATOM 0 H ARG A 69 -14.070 -15.947 -36.410 1.00 70.00 H new ATOM 0 HA ARG A 69 -16.148 -16.145 -34.426 1.00 33.00 H new ATOM 0 HB2 ARG A 69 -15.760 -18.473 -35.237 1.00 2.00 H new ATOM 0 HB3 ARG A 69 -14.075 -18.339 -34.773 1.00 2.00 H new ATOM 0 HG2 ARG A 69 -15.352 -19.539 -33.055 1.00 22.00 H new ATOM 0 HG3 ARG A 69 -14.720 -18.037 -32.410 1.00 22.00 H new ATOM 0 HD2 ARG A 69 -16.882 -16.929 -32.710 1.00 45.00 H new ATOM 0 HD3 ARG A 69 -17.531 -18.327 -33.543 1.00 45.00 H new ATOM 0 HE ARG A 69 -17.084 -19.542 -31.285 1.00 52.00 H new ATOM 0 HH11 ARG A 69 -17.565 -16.052 -31.329 1.00 23.00 H new ATOM 0 HH12 ARG A 69 -18.560 -16.054 -29.869 1.00 23.00 H new ATOM 0 HH21 ARG A 69 -18.432 -19.550 -29.467 1.00 31.00 H new ATOM 0 HH22 ARG A 69 -19.047 -18.025 -28.821 1.00 31.00 H new ATOM 1111 N ILE A 70 -14.673 -14.717 -33.220 1.00 73.00 N ATOM 1112 CA ILE A 70 -14.021 -14.037 -32.165 1.00 74.00 C ATOM 1113 C ILE A 70 -14.445 -14.765 -30.948 1.00 63.00 C ATOM 1114 O ILE A 70 -15.613 -15.131 -30.832 1.00 25.00 O ATOM 1115 CB ILE A 70 -14.501 -12.567 -32.024 1.00 20.00 C ATOM 1116 CG1 ILE A 70 -14.369 -11.754 -33.314 1.00 44.00 C ATOM 1117 CG2 ILE A 70 -13.801 -11.848 -30.878 1.00 54.00 C ATOM 1118 CD1 ILE A 70 -15.403 -12.009 -34.394 1.00 55.00 C ATOM 0 H ILE A 70 -15.561 -14.296 -33.493 1.00 73.00 H new ATOM 0 HA ILE A 70 -12.945 -14.011 -32.335 1.00 74.00 H new ATOM 0 HB ILE A 70 -15.565 -12.637 -31.798 1.00 20.00 H new ATOM 0 HG12 ILE A 70 -14.404 -10.696 -33.054 1.00 44.00 H new ATOM 0 HG13 ILE A 70 -13.383 -11.946 -33.736 1.00 44.00 H new ATOM 0 HG21 ILE A 70 -14.166 -10.823 -30.815 1.00 54.00 H new ATOM 0 HG22 ILE A 70 -14.010 -12.366 -29.942 1.00 54.00 H new ATOM 0 HG23 ILE A 70 -12.726 -11.840 -31.056 1.00 54.00 H new ATOM 0 HD11 ILE A 70 -15.197 -11.371 -35.253 1.00 55.00 H new ATOM 0 HD12 ILE A 70 -15.360 -13.054 -34.700 1.00 55.00 H new ATOM 0 HD13 ILE A 70 -16.397 -11.785 -34.006 1.00 55.00 H new ATOM 1130 N VAL A 71 -13.546 -15.011 -30.072 1.00 43.00 N ATOM 1131 CA VAL A 71 -13.935 -15.729 -28.874 1.00 3.00 C ATOM 1132 C VAL A 71 -13.841 -14.842 -27.661 1.00 73.00 C ATOM 1133 O VAL A 71 -14.362 -15.164 -26.600 1.00 60.00 O ATOM 1134 CB VAL A 71 -13.267 -17.150 -28.670 1.00 30.00 C ATOM 1135 CG1 VAL A 71 -13.534 -18.033 -29.868 1.00 41.00 C ATOM 1136 CG2 VAL A 71 -11.775 -17.101 -28.386 1.00 34.00 C ATOM 0 H VAL A 71 -12.563 -14.746 -30.136 1.00 43.00 H new ATOM 0 HA VAL A 71 -14.983 -15.989 -29.025 1.00 3.00 H new ATOM 0 HB VAL A 71 -13.733 -17.570 -27.778 1.00 30.00 H new ATOM 0 HG11 VAL A 71 -13.069 -19.006 -29.713 1.00 41.00 H new ATOM 0 HG12 VAL A 71 -14.609 -18.161 -29.994 1.00 41.00 H new ATOM 0 HG13 VAL A 71 -13.117 -17.569 -30.762 1.00 41.00 H new ATOM 0 HG21 VAL A 71 -11.395 -18.115 -28.259 1.00 34.00 H new ATOM 0 HG22 VAL A 71 -11.261 -16.623 -29.220 1.00 34.00 H new ATOM 0 HG23 VAL A 71 -11.597 -16.530 -27.475 1.00 34.00 H new ATOM 1146 N LEU A 72 -13.203 -13.696 -27.852 1.00 14.00 N ATOM 1147 CA LEU A 72 -13.095 -12.665 -26.848 1.00 44.00 C ATOM 1148 C LEU A 72 -12.424 -11.438 -27.493 1.00 42.00 C ATOM 1149 O LEU A 72 -11.388 -11.587 -28.142 1.00 73.00 O ATOM 1150 CB LEU A 72 -12.232 -13.113 -25.678 1.00 64.00 C ATOM 1151 CG LEU A 72 -12.724 -12.575 -24.295 1.00 31.00 C ATOM 1152 CD1 LEU A 72 -12.515 -11.113 -24.179 1.00 55.00 C ATOM 1153 CD2 LEU A 72 -14.215 -12.797 -24.124 1.00 23.00 C ATOM 0 H LEU A 72 -12.739 -13.459 -28.729 1.00 14.00 H new ATOM 0 HA LEU A 72 -14.094 -12.437 -26.476 1.00 44.00 H new ATOM 0 HB2 LEU A 72 -12.212 -14.202 -25.648 1.00 64.00 H new ATOM 0 HB3 LEU A 72 -11.208 -12.780 -25.844 1.00 64.00 H new ATOM 0 HG LEU A 72 -12.151 -13.115 -23.541 1.00 31.00 H new ATOM 0 HD11 LEU A 72 -12.868 -10.771 -23.206 1.00 55.00 H new ATOM 0 HD12 LEU A 72 -11.453 -10.888 -24.280 1.00 55.00 H new ATOM 0 HD13 LEU A 72 -13.070 -10.603 -24.966 1.00 55.00 H new ATOM 0 HD21 LEU A 72 -14.531 -12.414 -23.154 1.00 23.00 H new ATOM 0 HD22 LEU A 72 -14.754 -12.274 -24.914 1.00 23.00 H new ATOM 0 HD23 LEU A 72 -14.433 -13.863 -24.181 1.00 23.00 H new ATOM 1165 N ASN A 73 -12.987 -10.256 -27.386 1.00 14.00 N ATOM 1166 CA ASN A 73 -12.308 -9.074 -27.972 1.00 24.00 C ATOM 1167 C ASN A 73 -12.087 -7.951 -26.969 1.00 5.00 C ATOM 1168 O ASN A 73 -11.798 -6.823 -27.341 1.00 74.00 O ATOM 1169 CB ASN A 73 -12.984 -8.547 -29.272 1.00 71.00 C ATOM 1170 CG ASN A 73 -14.419 -8.054 -29.127 1.00 14.00 C ATOM 1171 OD1 ASN A 73 -15.195 -8.551 -28.326 1.00 1.00 O ATOM 1172 ND2 ASN A 73 -14.783 -7.077 -29.913 1.00 2.00 N ATOM 0 H ASN A 73 -13.876 -10.068 -26.923 1.00 14.00 H new ATOM 0 HA ASN A 73 -11.324 -9.443 -28.261 1.00 24.00 H new ATOM 0 HB2 ASN A 73 -12.379 -7.731 -29.667 1.00 71.00 H new ATOM 0 HB3 ASN A 73 -12.968 -9.344 -30.015 1.00 71.00 H new ATOM 0 HD21 ASN A 73 -15.734 -6.712 -29.866 1.00 2.00 H new ATOM 0 HD22 ASN A 73 -14.116 -6.679 -30.574 1.00 2.00 H new ATOM 1179 N ASN A 74 -12.127 -8.291 -25.709 1.00 60.00 N ATOM 1180 CA ASN A 74 -11.938 -7.333 -24.627 1.00 72.00 C ATOM 1181 C ASN A 74 -11.222 -8.003 -23.447 1.00 64.00 C ATOM 1182 O ASN A 74 -11.816 -8.317 -22.422 1.00 1.00 O ATOM 1183 CB ASN A 74 -13.271 -6.693 -24.172 1.00 1.00 C ATOM 1184 CG ASN A 74 -13.082 -5.608 -23.111 1.00 62.00 C ATOM 1185 OD1 ASN A 74 -12.060 -4.920 -23.080 1.00 61.00 O ATOM 1186 ND2 ASN A 74 -14.054 -5.448 -22.243 1.00 44.00 N ATOM 0 H ASN A 74 -12.292 -9.246 -25.391 1.00 60.00 H new ATOM 0 HA ASN A 74 -11.314 -6.524 -25.008 1.00 72.00 H new ATOM 0 HB2 ASN A 74 -13.775 -6.263 -25.037 1.00 1.00 H new ATOM 0 HB3 ASN A 74 -13.924 -7.470 -23.776 1.00 1.00 H new ATOM 0 HD21 ASN A 74 -13.976 -4.737 -21.515 1.00 44.00 H new ATOM 0 HD22 ASN A 74 -14.887 -6.034 -22.296 1.00 44.00 H new ATOM 1193 N CYS A 75 -9.980 -8.283 -23.651 1.00 62.00 N ATOM 1194 CA CYS A 75 -9.116 -8.855 -22.653 1.00 52.00 C ATOM 1195 C CYS A 75 -8.082 -7.859 -22.407 1.00 21.00 C ATOM 1196 O CYS A 75 -7.528 -7.300 -23.355 1.00 53.00 O ATOM 1197 CB CYS A 75 -8.490 -10.182 -23.082 1.00 11.00 C ATOM 1198 SG CYS A 75 -9.582 -11.619 -22.912 1.00 22.00 S ATOM 0 H CYS A 75 -9.515 -8.118 -24.544 1.00 62.00 H new ATOM 0 HA CYS A 75 -9.692 -9.092 -21.759 1.00 52.00 H new ATOM 0 HB2 CYS A 75 -8.176 -10.101 -24.123 1.00 11.00 H new ATOM 0 HB3 CYS A 75 -7.591 -10.353 -22.490 1.00 11.00 H new ATOM 1203 N GLN A 76 -7.806 -7.615 -21.189 1.00 42.00 N ATOM 1204 CA GLN A 76 -7.001 -6.514 -20.837 1.00 34.00 C ATOM 1205 C GLN A 76 -5.995 -7.007 -19.941 1.00 64.00 C ATOM 1206 O GLN A 76 -6.296 -7.698 -18.985 1.00 34.00 O ATOM 1207 CB GLN A 76 -7.863 -5.464 -20.199 1.00 32.00 C ATOM 1208 CG GLN A 76 -8.935 -4.997 -21.145 1.00 30.00 C ATOM 1209 CD GLN A 76 -10.041 -4.276 -20.439 1.00 11.00 C ATOM 1210 OE1 GLN A 76 -10.031 -3.053 -20.296 1.00 43.00 O ATOM 1211 NE2 GLN A 76 -10.992 -5.030 -19.950 1.00 40.00 N ATOM 0 H GLN A 76 -8.133 -8.175 -20.401 1.00 42.00 H new ATOM 0 HA GLN A 76 -6.521 -6.054 -21.701 1.00 34.00 H new ATOM 0 HB2 GLN A 76 -8.321 -5.865 -19.295 1.00 32.00 H new ATOM 0 HB3 GLN A 76 -7.247 -4.618 -19.896 1.00 32.00 H new ATOM 0 HG2 GLN A 76 -8.494 -4.338 -21.893 1.00 30.00 H new ATOM 0 HG3 GLN A 76 -9.345 -5.855 -21.678 1.00 30.00 H new ATOM 0 HE21 GLN A 76 -10.965 -6.040 -20.090 1.00 40.00 H new ATOM 0 HE22 GLN A 76 -11.761 -4.608 -19.429 1.00 40.00 H new ATOM 1220 N LEU A 77 -4.816 -6.765 -20.275 1.00 35.00 N ATOM 1221 CA LEU A 77 -3.770 -7.337 -19.530 1.00 3.00 C ATOM 1222 C LEU A 77 -3.354 -6.438 -18.388 1.00 74.00 C ATOM 1223 O LEU A 77 -3.009 -5.286 -18.614 1.00 5.00 O ATOM 1224 CB LEU A 77 -2.588 -7.704 -20.417 1.00 22.00 C ATOM 1225 CG LEU A 77 -1.349 -8.270 -19.709 1.00 35.00 C ATOM 1226 CD1 LEU A 77 -1.689 -9.535 -18.955 1.00 33.00 C ATOM 1227 CD2 LEU A 77 -0.231 -8.504 -20.712 1.00 60.00 C ATOM 0 H LEU A 77 -4.532 -6.176 -21.058 1.00 35.00 H new ATOM 0 HA LEU A 77 -4.145 -8.264 -19.095 1.00 3.00 H new ATOM 0 HB2 LEU A 77 -2.926 -8.436 -21.150 1.00 22.00 H new ATOM 0 HB3 LEU A 77 -2.288 -6.814 -20.970 1.00 22.00 H new ATOM 0 HG LEU A 77 -1.001 -7.540 -18.979 1.00 35.00 H new ATOM 0 HD11 LEU A 77 -0.795 -9.916 -18.462 1.00 33.00 H new ATOM 0 HD12 LEU A 77 -2.451 -9.319 -18.207 1.00 33.00 H new ATOM 0 HD13 LEU A 77 -2.066 -10.284 -19.652 1.00 33.00 H new ATOM 0 HD21 LEU A 77 0.642 -8.905 -20.197 1.00 60.00 H new ATOM 0 HD22 LEU A 77 -0.564 -9.214 -21.469 1.00 60.00 H new ATOM 0 HD23 LEU A 77 0.032 -7.561 -21.190 1.00 60.00 H new ATOM 1239 N GLN A 78 -3.394 -6.935 -17.170 1.00 13.00 N ATOM 1240 CA GLN A 78 -2.924 -6.118 -16.073 1.00 44.00 C ATOM 1241 C GLN A 78 -1.397 -6.090 -16.013 1.00 32.00 C ATOM 1242 O GLN A 78 -0.798 -5.029 -16.141 1.00 10.00 O ATOM 1243 CB GLN A 78 -3.558 -6.497 -14.736 1.00 15.00 C ATOM 1244 CG GLN A 78 -3.459 -7.954 -14.374 1.00 1.00 C ATOM 1245 CD GLN A 78 -4.086 -8.240 -13.042 1.00 44.00 C ATOM 1246 OE1 GLN A 78 -3.425 -8.204 -12.012 1.00 61.00 O ATOM 1247 NE2 GLN A 78 -5.364 -8.450 -13.039 1.00 72.00 N ATOM 0 H GLN A 78 -3.733 -7.864 -16.920 1.00 13.00 H new ATOM 0 HA GLN A 78 -3.256 -5.099 -16.273 1.00 44.00 H new ATOM 0 HB2 GLN A 78 -3.086 -5.910 -13.948 1.00 15.00 H new ATOM 0 HB3 GLN A 78 -4.611 -6.214 -14.757 1.00 15.00 H new ATOM 0 HG2 GLN A 78 -3.948 -8.554 -15.142 1.00 1.00 H new ATOM 0 HG3 GLN A 78 -2.411 -8.253 -14.354 1.00 1.00 H new ATOM 0 HE21 GLN A 78 -5.879 -8.473 -13.919 1.00 72.00 H new ATOM 0 HE22 GLN A 78 -5.855 -8.593 -12.157 1.00 72.00 H new ATOM 1256 N ASN A 79 -0.782 -7.252 -15.884 1.00 32.00 N ATOM 1257 CA ASN A 79 0.660 -7.383 -15.796 1.00 14.00 C ATOM 1258 C ASN A 79 0.929 -8.873 -15.729 1.00 21.00 C ATOM 1259 O ASN A 79 0.525 -9.515 -14.772 1.00 64.00 O ATOM 1260 CB ASN A 79 1.177 -6.667 -14.537 1.00 72.00 C ATOM 1261 CG ASN A 79 2.677 -6.560 -14.465 1.00 44.00 C ATOM 1262 OD1 ASN A 79 3.371 -6.532 -15.483 1.00 52.00 O ATOM 1263 ND2 ASN A 79 3.181 -6.433 -13.278 1.00 32.00 N ATOM 0 H ASN A 79 -1.277 -8.142 -15.837 1.00 32.00 H new ATOM 0 HA ASN A 79 1.169 -6.930 -16.647 1.00 14.00 H new ATOM 0 HB2 ASN A 79 0.749 -5.665 -14.500 1.00 72.00 H new ATOM 0 HB3 ASN A 79 0.818 -7.199 -13.656 1.00 72.00 H new ATOM 0 HD21 ASN A 79 4.186 -6.304 -13.162 1.00 32.00 H new ATOM 0 HD22 ASN A 79 2.573 -6.462 -12.460 1.00 32.00 H new ATOM 1270 N PRO A 80 1.554 -9.449 -16.767 1.00 41.00 N ATOM 1271 CA PRO A 80 1.655 -10.903 -16.920 1.00 10.00 C ATOM 1272 C PRO A 80 2.364 -11.674 -15.776 1.00 23.00 C ATOM 1273 O PRO A 80 1.762 -12.521 -15.122 1.00 11.00 O ATOM 1274 CB PRO A 80 2.372 -11.110 -18.259 1.00 62.00 C ATOM 1275 CG PRO A 80 3.006 -9.802 -18.581 1.00 32.00 C ATOM 1276 CD PRO A 80 2.202 -8.735 -17.883 1.00 44.00 C ATOM 0 HA PRO A 80 0.651 -11.325 -16.883 1.00 10.00 H new ATOM 0 HB2 PRO A 80 3.119 -11.900 -18.185 1.00 62.00 H new ATOM 0 HB3 PRO A 80 1.670 -11.407 -19.038 1.00 62.00 H new ATOM 0 HG2 PRO A 80 4.043 -9.784 -18.246 1.00 32.00 H new ATOM 0 HG3 PRO A 80 3.016 -9.634 -19.658 1.00 32.00 H new ATOM 0 HD2 PRO A 80 2.839 -7.927 -17.524 1.00 44.00 H new ATOM 0 HD3 PRO A 80 1.466 -8.288 -18.552 1.00 44.00 H new ATOM 1284 N GLN A 81 3.637 -11.406 -15.555 1.00 42.00 N ATOM 1285 CA GLN A 81 4.373 -12.119 -14.533 1.00 65.00 C ATOM 1286 C GLN A 81 4.492 -11.333 -13.254 1.00 31.00 C ATOM 1287 O GLN A 81 5.029 -11.831 -12.265 1.00 64.00 O ATOM 1288 CB GLN A 81 5.742 -12.543 -15.015 1.00 70.00 C ATOM 1289 CG GLN A 81 6.589 -11.429 -15.589 1.00 20.00 C ATOM 1290 CD GLN A 81 7.975 -11.905 -15.923 1.00 60.00 C ATOM 1291 OE1 GLN A 81 8.895 -11.810 -15.110 1.00 34.00 O ATOM 1292 NE2 GLN A 81 8.132 -12.462 -17.075 1.00 5.00 N ATOM 0 H GLN A 81 4.177 -10.707 -16.065 1.00 42.00 H new ATOM 0 HA GLN A 81 3.792 -13.016 -14.318 1.00 65.00 H new ATOM 0 HB2 GLN A 81 6.280 -12.996 -14.182 1.00 70.00 H new ATOM 0 HB3 GLN A 81 5.621 -13.315 -15.774 1.00 70.00 H new ATOM 0 HG2 GLN A 81 6.113 -11.034 -16.487 1.00 20.00 H new ATOM 0 HG3 GLN A 81 6.648 -10.609 -14.873 1.00 20.00 H new ATOM 0 HE21 GLN A 81 7.347 -12.523 -17.723 1.00 5.00 H new ATOM 0 HE22 GLN A 81 9.041 -12.842 -17.338 1.00 5.00 H new