USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 773 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 25 GLN : amide:sc=-0.00043 X(o=-0.24,f=-0.24) USER MOD Set 1.2: A 77 GLN : amide:sc= -0.241 K(o=-0.24,f=-9.5!) USER MOD Single : A 1 GLY N :NH3+ -112:sc= 0.0919 (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 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.886 K(o=-0.89,f=-4.1!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 29:sc= -2.64! USER MOD Single : A 24 GLN : amide:sc= -0.304 X(o=-0.3,f=-0.27) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.57 K(o=-0.57,f=-4.3!) USER MOD Single : A 46 ASN : amide:sc= -0.392 X(o=-0.39,f=-0.73) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.0667 USER MOD Single : A 49 GLN : amide:sc= -0.131 K(o=-0.13,f=-0.89) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.896 K(o=-0.9,f=-2.6!) USER MOD Single : A 76 MET CE :methyl -178:sc= -4.29! (180deg=-4.38!) USER MOD Single : A 78 ASN : amide:sc= -0.0321 X(o=-0.032,f=-0.45) USER MOD Single : A 81 ASN : amide:sc= -0.201 K(o=-0.2,f=-2.8!) USER MOD Single : A 91 TYR OH : rot 76:sc= -2.39! USER MOD Single : A 92 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 96 SER OG : rot 13:sc= 0.0296 USER MOD Single : A 99 SER OG : rot 53:sc= 0.268 USER MOD Single : A 100 SER OG : rot 180:sc=0.000783 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.362 13.029 -50.544 1.00 0.00 N ATOM 2 CA GLY A 1 12.847 12.264 -49.421 1.00 0.00 C ATOM 3 C GLY A 1 11.659 12.977 -48.771 1.00 0.00 C ATOM 4 O GLY A 1 11.446 14.167 -48.997 1.00 0.00 O ATOM 0 H1 GLY A 1 13.172 12.517 -51.429 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.895 13.958 -50.574 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.388 13.160 -50.433 1.00 0.00 H new ATOM 0 HA2 GLY A 1 12.541 11.274 -49.760 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.636 12.118 -48.683 1.00 0.00 H new ATOM 8 N SER A 2 10.917 12.218 -47.978 1.00 0.00 N ATOM 9 CA SER A 2 9.756 12.762 -47.295 1.00 0.00 C ATOM 10 C SER A 2 9.284 11.790 -46.211 1.00 0.00 C ATOM 11 O SER A 2 8.384 10.985 -46.444 1.00 0.00 O ATOM 12 CB SER A 2 8.621 13.050 -48.280 1.00 0.00 C ATOM 13 OG SER A 2 8.123 14.379 -48.147 1.00 0.00 O ATOM 0 H SER A 2 11.097 11.231 -47.793 1.00 0.00 H new ATOM 0 HA SER A 2 10.044 13.705 -46.829 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.977 12.897 -49.299 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.810 12.341 -48.116 1.00 0.00 H new ATOM 0 HG SER A 2 7.401 14.524 -48.794 1.00 0.00 H new ATOM 19 N SER A 3 9.912 11.898 -45.050 1.00 0.00 N ATOM 20 CA SER A 3 9.567 11.039 -43.930 1.00 0.00 C ATOM 21 C SER A 3 8.701 11.806 -42.929 1.00 0.00 C ATOM 22 O SER A 3 7.588 11.387 -42.617 1.00 0.00 O ATOM 23 CB SER A 3 10.823 10.501 -43.241 1.00 0.00 C ATOM 24 OG SER A 3 10.913 9.082 -43.328 1.00 0.00 O ATOM 0 H SER A 3 10.658 12.567 -44.860 1.00 0.00 H new ATOM 0 HA SER A 3 9.002 10.189 -44.313 1.00 0.00 H new ATOM 0 HB2 SER A 3 11.706 10.949 -43.696 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.818 10.800 -42.193 1.00 0.00 H new ATOM 0 HG SER A 3 11.729 8.778 -42.878 1.00 0.00 H new ATOM 30 N GLY A 4 9.245 12.917 -42.454 1.00 0.00 N ATOM 31 CA GLY A 4 8.535 13.747 -41.495 1.00 0.00 C ATOM 32 C GLY A 4 7.763 12.887 -40.492 1.00 0.00 C ATOM 33 O GLY A 4 6.600 12.556 -40.719 1.00 0.00 O ATOM 0 H GLY A 4 10.169 13.262 -42.715 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.243 14.383 -40.965 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.845 14.407 -42.020 1.00 0.00 H new ATOM 37 N SER A 5 8.440 12.550 -39.404 1.00 0.00 N ATOM 38 CA SER A 5 7.832 11.736 -38.366 1.00 0.00 C ATOM 39 C SER A 5 8.756 11.665 -37.149 1.00 0.00 C ATOM 40 O SER A 5 9.843 11.093 -37.222 1.00 0.00 O ATOM 41 CB SER A 5 7.523 10.328 -38.881 1.00 0.00 C ATOM 42 OG SER A 5 6.614 9.637 -38.029 1.00 0.00 O ATOM 0 H SER A 5 9.404 12.826 -39.219 1.00 0.00 H new ATOM 0 HA SER A 5 6.891 12.201 -38.073 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.102 10.393 -39.884 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.449 9.759 -38.960 1.00 0.00 H new ATOM 0 HG SER A 5 6.440 8.743 -38.392 1.00 0.00 H new ATOM 48 N SER A 6 8.290 12.254 -36.057 1.00 0.00 N ATOM 49 CA SER A 6 9.061 12.265 -34.826 1.00 0.00 C ATOM 50 C SER A 6 8.328 13.077 -33.756 1.00 0.00 C ATOM 51 O SER A 6 7.933 14.216 -34.000 1.00 0.00 O ATOM 52 CB SER A 6 10.462 12.835 -35.057 1.00 0.00 C ATOM 53 OG SER A 6 11.482 11.897 -34.724 1.00 0.00 O ATOM 0 H SER A 6 7.388 12.727 -36.000 1.00 0.00 H new ATOM 0 HA SER A 6 9.169 11.236 -34.482 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.566 13.128 -36.102 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.590 13.737 -34.458 1.00 0.00 H new ATOM 0 HG SER A 6 12.361 12.298 -34.887 1.00 0.00 H new ATOM 59 N GLY A 7 8.169 12.460 -32.595 1.00 0.00 N ATOM 60 CA GLY A 7 7.490 13.111 -31.488 1.00 0.00 C ATOM 61 C GLY A 7 6.178 12.398 -31.153 1.00 0.00 C ATOM 62 O GLY A 7 5.463 11.953 -32.049 1.00 0.00 O ATOM 0 H GLY A 7 8.499 11.515 -32.397 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.139 13.117 -30.612 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.288 14.152 -31.742 1.00 0.00 H new ATOM 66 N LYS A 8 5.903 12.311 -29.860 1.00 0.00 N ATOM 67 CA LYS A 8 4.690 11.660 -29.395 1.00 0.00 C ATOM 68 C LYS A 8 4.531 11.900 -27.892 1.00 0.00 C ATOM 69 O LYS A 8 5.074 11.153 -27.080 1.00 0.00 O ATOM 70 CB LYS A 8 4.693 10.180 -29.785 1.00 0.00 C ATOM 71 CG LYS A 8 6.024 9.520 -29.418 1.00 0.00 C ATOM 72 CD LYS A 8 6.736 8.993 -30.666 1.00 0.00 C ATOM 73 CE LYS A 8 5.832 8.041 -31.451 1.00 0.00 C ATOM 74 NZ LYS A 8 6.629 6.946 -32.049 1.00 0.00 N ATOM 0 H LYS A 8 6.499 12.681 -29.120 1.00 0.00 H new ATOM 0 HA LYS A 8 3.815 12.092 -29.881 1.00 0.00 H new ATOM 0 HB2 LYS A 8 3.876 9.665 -29.280 1.00 0.00 H new ATOM 0 HB3 LYS A 8 4.517 10.082 -30.856 1.00 0.00 H new ATOM 0 HG2 LYS A 8 6.663 10.240 -28.907 1.00 0.00 H new ATOM 0 HG3 LYS A 8 5.848 8.700 -28.722 1.00 0.00 H new ATOM 0 HD2 LYS A 8 7.030 9.828 -31.302 1.00 0.00 H new ATOM 0 HD3 LYS A 8 7.651 8.476 -30.376 1.00 0.00 H new ATOM 0 HE2 LYS A 8 5.070 7.626 -30.791 1.00 0.00 H new ATOM 0 HE3 LYS A 8 5.310 8.589 -32.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.001 6.308 -32.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 7.340 7.346 -32.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 7.107 6.413 -31.295 1.00 0.00 H new ATOM 88 N PRO A 9 3.764 12.973 -27.560 1.00 0.00 N ATOM 89 CA PRO A 9 3.526 13.320 -26.169 1.00 0.00 C ATOM 90 C PRO A 9 2.523 12.360 -25.527 1.00 0.00 C ATOM 91 O PRO A 9 1.879 11.574 -26.221 1.00 0.00 O ATOM 92 CB PRO A 9 3.035 14.758 -26.201 1.00 0.00 C ATOM 93 CG PRO A 9 2.573 15.009 -27.628 1.00 0.00 C ATOM 94 CD PRO A 9 3.105 13.879 -28.495 1.00 0.00 C ATOM 0 HA PRO A 9 4.422 13.232 -25.555 1.00 0.00 H new ATOM 0 HB2 PRO A 9 2.219 14.908 -25.494 1.00 0.00 H new ATOM 0 HB3 PRO A 9 3.830 15.449 -25.921 1.00 0.00 H new ATOM 0 HG2 PRO A 9 1.485 15.047 -27.676 1.00 0.00 H new ATOM 0 HG3 PRO A 9 2.942 15.971 -27.985 1.00 0.00 H new ATOM 0 HD2 PRO A 9 2.299 13.378 -29.031 1.00 0.00 H new ATOM 0 HD3 PRO A 9 3.803 14.250 -29.245 1.00 0.00 H new ATOM 102 N GLU A 10 2.421 12.455 -24.210 1.00 0.00 N ATOM 103 CA GLU A 10 1.506 11.604 -23.467 1.00 0.00 C ATOM 104 C GLU A 10 1.343 12.123 -22.037 1.00 0.00 C ATOM 105 O GLU A 10 2.224 12.805 -21.515 1.00 0.00 O ATOM 106 CB GLU A 10 1.983 10.151 -23.472 1.00 0.00 C ATOM 107 CG GLU A 10 3.333 10.014 -22.764 1.00 0.00 C ATOM 108 CD GLU A 10 4.427 9.592 -23.746 1.00 0.00 C ATOM 109 OE1 GLU A 10 4.130 8.713 -24.584 1.00 0.00 O ATOM 110 OE2 GLU A 10 5.536 10.158 -23.638 1.00 0.00 O ATOM 0 H GLU A 10 2.956 13.108 -23.638 1.00 0.00 H new ATOM 0 HA GLU A 10 0.533 11.634 -23.957 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.244 9.520 -22.978 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.069 9.796 -24.499 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.602 10.963 -22.300 1.00 0.00 H new ATOM 0 HG3 GLU A 10 3.255 9.279 -21.963 1.00 0.00 H new ATOM 117 N PRO A 11 0.179 11.770 -21.427 1.00 0.00 N ATOM 118 CA PRO A 11 -0.111 12.192 -20.067 1.00 0.00 C ATOM 119 C PRO A 11 0.704 11.383 -19.056 1.00 0.00 C ATOM 120 O PRO A 11 1.459 10.489 -19.435 1.00 0.00 O ATOM 121 CB PRO A 11 -1.611 12.003 -19.908 1.00 0.00 C ATOM 122 CG PRO A 11 -2.031 11.052 -21.017 1.00 0.00 C ATOM 123 CD PRO A 11 -0.887 10.964 -22.014 1.00 0.00 C ATOM 0 HA PRO A 11 0.169 13.229 -19.880 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -1.851 11.590 -18.928 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -2.136 12.955 -19.990 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -2.259 10.067 -20.609 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -2.936 11.412 -21.506 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -0.568 9.932 -22.161 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -1.182 11.348 -22.990 1.00 0.00 H new ATOM 131 N THR A 12 0.524 11.727 -17.789 1.00 0.00 N ATOM 132 CA THR A 12 1.234 11.043 -16.721 1.00 0.00 C ATOM 133 C THR A 12 0.253 10.264 -15.842 1.00 0.00 C ATOM 134 O THR A 12 0.215 9.036 -15.886 1.00 0.00 O ATOM 135 CB THR A 12 2.044 12.086 -15.949 1.00 0.00 C ATOM 136 OG1 THR A 12 3.245 12.222 -16.704 1.00 0.00 O ATOM 137 CG2 THR A 12 2.516 11.571 -14.588 1.00 0.00 C ATOM 0 H THR A 12 -0.102 12.470 -17.478 1.00 0.00 H new ATOM 0 HA THR A 12 1.926 10.301 -17.118 1.00 0.00 H new ATOM 0 HB THR A 12 1.440 12.982 -15.808 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.829 12.882 -16.274 1.00 0.00 H new ATOM 0 HG21 THR A 12 3.086 12.350 -14.082 1.00 0.00 H new ATOM 0 HG22 THR A 12 1.652 11.301 -13.981 1.00 0.00 H new ATOM 0 HG23 THR A 12 3.147 10.694 -14.730 1.00 0.00 H new ATOM 145 N ASN A 13 -0.518 11.011 -15.065 1.00 0.00 N ATOM 146 CA ASN A 13 -1.496 10.406 -14.178 1.00 0.00 C ATOM 147 C ASN A 13 -2.413 11.495 -13.617 1.00 0.00 C ATOM 148 O ASN A 13 -2.213 12.679 -13.887 1.00 0.00 O ATOM 149 CB ASN A 13 -0.814 9.709 -12.999 1.00 0.00 C ATOM 150 CG ASN A 13 -0.250 10.731 -12.010 1.00 0.00 C ATOM 151 OD1 ASN A 13 -0.020 11.885 -12.333 1.00 0.00 O ATOM 152 ND2 ASN A 13 -0.040 10.245 -10.790 1.00 0.00 N ATOM 0 H ASN A 13 -0.485 12.030 -15.032 1.00 0.00 H new ATOM 0 HA ASN A 13 -2.063 9.673 -14.752 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.529 9.062 -12.491 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.010 9.070 -13.365 1.00 0.00 H new ATOM 0 HD21 ASN A 13 0.335 10.848 -10.058 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.254 9.269 -10.586 1.00 0.00 H new ATOM 159 N SER A 14 -3.398 11.057 -12.848 1.00 0.00 N ATOM 160 CA SER A 14 -4.346 11.980 -12.247 1.00 0.00 C ATOM 161 C SER A 14 -5.176 11.259 -11.183 1.00 0.00 C ATOM 162 O SER A 14 -5.132 11.619 -10.007 1.00 0.00 O ATOM 163 CB SER A 14 -5.262 12.596 -13.307 1.00 0.00 C ATOM 164 OG SER A 14 -6.189 13.518 -12.740 1.00 0.00 O ATOM 0 H SER A 14 -3.561 10.075 -12.627 1.00 0.00 H new ATOM 0 HA SER A 14 -3.785 12.787 -11.776 1.00 0.00 H new ATOM 0 HB2 SER A 14 -4.657 13.105 -14.057 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.807 11.804 -13.820 1.00 0.00 H new ATOM 0 HG SER A 14 -6.754 13.891 -13.448 1.00 0.00 H new ATOM 170 N SER A 15 -5.913 10.254 -11.633 1.00 0.00 N ATOM 171 CA SER A 15 -6.751 9.480 -10.734 1.00 0.00 C ATOM 172 C SER A 15 -6.635 7.990 -11.063 1.00 0.00 C ATOM 173 O SER A 15 -7.359 7.481 -11.916 1.00 0.00 O ATOM 174 CB SER A 15 -8.211 9.929 -10.818 1.00 0.00 C ATOM 175 OG SER A 15 -8.536 10.880 -9.807 1.00 0.00 O ATOM 0 H SER A 15 -5.947 9.958 -12.609 1.00 0.00 H new ATOM 0 HA SER A 15 -6.405 9.649 -9.714 1.00 0.00 H new ATOM 0 HB2 SER A 15 -8.401 10.364 -11.799 1.00 0.00 H new ATOM 0 HB3 SER A 15 -8.863 9.061 -10.723 1.00 0.00 H new ATOM 0 HG SER A 15 -9.476 11.143 -9.895 1.00 0.00 H new ATOM 181 N VAL A 16 -5.718 7.333 -10.368 1.00 0.00 N ATOM 182 CA VAL A 16 -5.497 5.912 -10.575 1.00 0.00 C ATOM 183 C VAL A 16 -6.581 5.120 -9.843 1.00 0.00 C ATOM 184 O VAL A 16 -7.253 5.650 -8.959 1.00 0.00 O ATOM 185 CB VAL A 16 -4.081 5.533 -10.138 1.00 0.00 C ATOM 186 CG1 VAL A 16 -3.033 6.266 -10.978 1.00 0.00 C ATOM 187 CG2 VAL A 16 -3.876 5.805 -8.646 1.00 0.00 C ATOM 0 H VAL A 16 -5.119 7.759 -9.661 1.00 0.00 H new ATOM 0 HA VAL A 16 -5.573 5.664 -11.634 1.00 0.00 H new ATOM 0 HB VAL A 16 -3.955 4.463 -10.304 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -2.035 5.979 -10.647 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -3.157 6.000 -12.028 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -3.159 7.342 -10.859 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -2.861 5.527 -8.362 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -4.032 6.865 -8.445 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -4.589 5.217 -8.068 1.00 0.00 H new ATOM 197 N GLU A 17 -6.718 3.862 -10.236 1.00 0.00 N ATOM 198 CA GLU A 17 -7.709 2.991 -9.628 1.00 0.00 C ATOM 199 C GLU A 17 -7.134 2.326 -8.376 1.00 0.00 C ATOM 200 O GLU A 17 -5.955 1.980 -8.338 1.00 0.00 O ATOM 201 CB GLU A 17 -8.206 1.944 -10.626 1.00 0.00 C ATOM 202 CG GLU A 17 -9.016 0.854 -9.921 1.00 0.00 C ATOM 203 CD GLU A 17 -10.220 0.432 -10.766 1.00 0.00 C ATOM 204 OE1 GLU A 17 -10.057 0.388 -12.004 1.00 0.00 O ATOM 205 OE2 GLU A 17 -11.276 0.162 -10.154 1.00 0.00 O ATOM 0 H GLU A 17 -6.159 3.425 -10.969 1.00 0.00 H new ATOM 0 HA GLU A 17 -8.565 3.598 -9.333 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -8.821 2.425 -11.386 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -7.356 1.495 -11.141 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -8.380 -0.011 -9.730 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -9.357 1.219 -8.952 1.00 0.00 H new ATOM 212 N VAL A 18 -7.995 2.167 -7.381 1.00 0.00 N ATOM 213 CA VAL A 18 -7.587 1.549 -6.130 1.00 0.00 C ATOM 214 C VAL A 18 -8.399 0.271 -5.909 1.00 0.00 C ATOM 215 O VAL A 18 -9.617 0.267 -6.084 1.00 0.00 O ATOM 216 CB VAL A 18 -7.725 2.551 -4.982 1.00 0.00 C ATOM 217 CG1 VAL A 18 -7.631 1.848 -3.627 1.00 0.00 C ATOM 218 CG2 VAL A 18 -6.681 3.663 -5.097 1.00 0.00 C ATOM 0 H VAL A 18 -8.973 2.455 -7.416 1.00 0.00 H new ATOM 0 HA VAL A 18 -6.536 1.264 -6.170 1.00 0.00 H new ATOM 0 HB VAL A 18 -8.711 3.009 -5.053 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -7.732 2.583 -2.828 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -8.429 1.110 -3.544 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -6.665 1.350 -3.542 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -6.801 4.362 -4.269 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -5.682 3.229 -5.064 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -6.815 4.192 -6.041 1.00 0.00 H new ATOM 228 N SER A 19 -7.692 -0.783 -5.529 1.00 0.00 N ATOM 229 CA SER A 19 -8.332 -2.064 -5.282 1.00 0.00 C ATOM 230 C SER A 19 -8.985 -2.065 -3.899 1.00 0.00 C ATOM 231 O SER A 19 -8.545 -1.350 -3.000 1.00 0.00 O ATOM 232 CB SER A 19 -7.327 -3.212 -5.395 1.00 0.00 C ATOM 233 OG SER A 19 -7.606 -4.059 -6.506 1.00 0.00 O ATOM 0 H SER A 19 -6.682 -0.776 -5.386 1.00 0.00 H new ATOM 0 HA SER A 19 -9.101 -2.214 -6.040 1.00 0.00 H new ATOM 0 HB2 SER A 19 -6.321 -2.804 -5.494 1.00 0.00 H new ATOM 0 HB3 SER A 19 -7.344 -3.800 -4.478 1.00 0.00 H new ATOM 0 HG SER A 19 -6.941 -4.778 -6.544 1.00 0.00 H new ATOM 239 N PRO A 20 -10.054 -2.896 -3.769 1.00 0.00 N ATOM 240 CA PRO A 20 -10.773 -2.999 -2.510 1.00 0.00 C ATOM 241 C PRO A 20 -9.974 -3.809 -1.487 1.00 0.00 C ATOM 242 O PRO A 20 -10.192 -3.683 -0.283 1.00 0.00 O ATOM 243 CB PRO A 20 -12.103 -3.642 -2.869 1.00 0.00 C ATOM 244 CG PRO A 20 -11.897 -4.297 -4.225 1.00 0.00 C ATOM 245 CD PRO A 20 -10.603 -3.757 -4.812 1.00 0.00 C ATOM 0 HA PRO A 20 -10.929 -2.031 -2.034 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -12.396 -4.378 -2.120 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -12.898 -2.897 -2.912 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -11.846 -5.381 -4.122 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -12.736 -4.079 -4.886 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -9.915 -4.564 -5.062 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -10.787 -3.199 -5.730 1.00 0.00 H new ATOM 253 N ASP A 21 -9.064 -4.622 -2.004 1.00 0.00 N ATOM 254 CA ASP A 21 -8.231 -5.452 -1.150 1.00 0.00 C ATOM 255 C ASP A 21 -6.916 -4.725 -0.865 1.00 0.00 C ATOM 256 O ASP A 21 -5.976 -5.318 -0.339 1.00 0.00 O ATOM 257 CB ASP A 21 -7.899 -6.782 -1.830 1.00 0.00 C ATOM 258 CG ASP A 21 -7.627 -6.689 -3.333 1.00 0.00 C ATOM 259 OD1 ASP A 21 -6.805 -5.827 -3.709 1.00 0.00 O ATOM 260 OD2 ASP A 21 -8.249 -7.483 -4.072 1.00 0.00 O ATOM 0 H ASP A 21 -8.885 -4.724 -3.003 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.780 -5.645 -0.228 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -7.024 -7.213 -1.344 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -8.727 -7.473 -1.668 1.00 0.00 H new ATOM 265 N ILE A 22 -6.892 -3.450 -1.224 1.00 0.00 N ATOM 266 CA ILE A 22 -5.708 -2.635 -1.013 1.00 0.00 C ATOM 267 C ILE A 22 -5.104 -2.964 0.353 1.00 0.00 C ATOM 268 O ILE A 22 -3.889 -2.895 0.532 1.00 0.00 O ATOM 269 CB ILE A 22 -6.037 -1.153 -1.199 1.00 0.00 C ATOM 270 CG1 ILE A 22 -4.830 -0.276 -0.860 1.00 0.00 C ATOM 271 CG2 ILE A 22 -7.276 -0.760 -0.391 1.00 0.00 C ATOM 272 CD1 ILE A 22 -3.892 -0.145 -2.062 1.00 0.00 C ATOM 0 H ILE A 22 -7.674 -2.961 -1.660 1.00 0.00 H new ATOM 0 HA ILE A 22 -4.949 -2.865 -1.761 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.272 -0.985 -2.250 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.170 0.712 -0.550 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -4.289 -0.706 -0.017 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.488 0.299 -0.541 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -8.129 -1.351 -0.723 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.095 -0.947 0.667 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -3.043 0.483 -1.794 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -3.535 -1.133 -2.354 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -4.429 0.308 -2.895 1.00 0.00 H new ATOM 284 N TYR A 23 -5.981 -3.314 1.283 1.00 0.00 N ATOM 285 CA TYR A 23 -5.550 -3.654 2.628 1.00 0.00 C ATOM 286 C TYR A 23 -4.709 -4.933 2.628 1.00 0.00 C ATOM 287 O TYR A 23 -3.542 -4.912 3.016 1.00 0.00 O ATOM 288 CB TYR A 23 -6.829 -3.899 3.432 1.00 0.00 C ATOM 289 CG TYR A 23 -7.905 -2.831 3.229 1.00 0.00 C ATOM 290 CD1 TYR A 23 -7.777 -1.598 3.836 1.00 0.00 C ATOM 291 CD2 TYR A 23 -9.004 -3.100 2.439 1.00 0.00 C ATOM 292 CE1 TYR A 23 -8.790 -0.592 3.645 1.00 0.00 C ATOM 293 CE2 TYR A 23 -10.017 -2.095 2.248 1.00 0.00 C ATOM 294 CZ TYR A 23 -9.860 -0.890 2.860 1.00 0.00 C ATOM 295 OH TYR A 23 -10.817 0.059 2.680 1.00 0.00 O ATOM 0 H TYR A 23 -6.988 -3.369 1.131 1.00 0.00 H new ATOM 0 HA TYR A 23 -4.939 -2.855 3.048 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -7.239 -4.870 3.156 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -6.576 -3.949 4.491 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -6.917 -1.387 4.454 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -9.104 -4.065 1.964 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -8.702 0.377 4.114 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -10.882 -2.293 1.633 1.00 0.00 H new ATOM 0 HH TYR A 23 -10.413 0.949 2.753 1.00 0.00 H new ATOM 305 N GLN A 24 -5.336 -6.014 2.189 1.00 0.00 N ATOM 306 CA GLN A 24 -4.660 -7.300 2.133 1.00 0.00 C ATOM 307 C GLN A 24 -3.384 -7.192 1.297 1.00 0.00 C ATOM 308 O GLN A 24 -2.376 -7.824 1.612 1.00 0.00 O ATOM 309 CB GLN A 24 -5.588 -8.383 1.581 1.00 0.00 C ATOM 310 CG GLN A 24 -5.117 -9.776 2.004 1.00 0.00 C ATOM 311 CD GLN A 24 -5.368 -10.010 3.496 1.00 0.00 C ATOM 312 OE1 GLN A 24 -6.491 -10.174 3.944 1.00 0.00 O ATOM 313 NE2 GLN A 24 -4.263 -10.017 4.236 1.00 0.00 N ATOM 0 H GLN A 24 -6.304 -6.027 1.869 1.00 0.00 H new ATOM 0 HA GLN A 24 -4.383 -7.588 3.147 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -6.603 -8.214 1.939 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.619 -8.320 0.493 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.640 -10.534 1.420 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -4.054 -9.885 1.789 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -3.354 -9.873 3.796 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -4.325 -10.166 5.243 1.00 0.00 H new ATOM 322 N GLN A 25 -3.468 -6.388 0.247 1.00 0.00 N ATOM 323 CA GLN A 25 -2.332 -6.190 -0.637 1.00 0.00 C ATOM 324 C GLN A 25 -1.132 -5.662 0.152 1.00 0.00 C ATOM 325 O GLN A 25 -0.017 -6.161 0.001 1.00 0.00 O ATOM 326 CB GLN A 25 -2.690 -5.247 -1.787 1.00 0.00 C ATOM 327 CG GLN A 25 -3.596 -5.944 -2.805 1.00 0.00 C ATOM 328 CD GLN A 25 -3.224 -5.543 -4.234 1.00 0.00 C ATOM 329 OE1 GLN A 25 -2.468 -6.214 -4.917 1.00 0.00 O ATOM 330 NE2 GLN A 25 -3.796 -4.415 -4.646 1.00 0.00 N ATOM 0 H GLN A 25 -4.305 -5.866 -0.011 1.00 0.00 H new ATOM 0 HA GLN A 25 -2.062 -7.153 -1.071 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -3.191 -4.362 -1.394 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.779 -4.905 -2.279 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -3.511 -7.025 -2.693 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -4.636 -5.684 -2.610 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -4.419 -3.902 -4.023 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -3.611 -4.063 -5.585 1.00 0.00 H new ATOM 339 N VAL A 26 -1.400 -4.659 0.975 1.00 0.00 N ATOM 340 CA VAL A 26 -0.355 -4.058 1.787 1.00 0.00 C ATOM 341 C VAL A 26 0.320 -5.143 2.627 1.00 0.00 C ATOM 342 O VAL A 26 1.495 -5.448 2.426 1.00 0.00 O ATOM 343 CB VAL A 26 -0.938 -2.923 2.632 1.00 0.00 C ATOM 344 CG1 VAL A 26 0.110 -2.366 3.598 1.00 0.00 C ATOM 345 CG2 VAL A 26 -1.511 -1.816 1.745 1.00 0.00 C ATOM 0 H VAL A 26 -2.325 -4.247 1.097 1.00 0.00 H new ATOM 0 HA VAL A 26 0.413 -3.613 1.154 1.00 0.00 H new ATOM 0 HB VAL A 26 -1.756 -3.332 3.225 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.329 -1.561 4.187 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.449 -3.159 4.264 1.00 0.00 H new ATOM 0 HG13 VAL A 26 0.958 -1.981 3.032 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -1.919 -1.022 2.371 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -0.721 -1.410 1.113 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -2.303 -2.226 1.118 1.00 0.00 H new ATOM 355 N ARG A 27 -0.451 -5.698 3.550 1.00 0.00 N ATOM 356 CA ARG A 27 0.058 -6.743 4.422 1.00 0.00 C ATOM 357 C ARG A 27 0.883 -7.750 3.617 1.00 0.00 C ATOM 358 O ARG A 27 2.007 -8.078 3.994 1.00 0.00 O ATOM 359 CB ARG A 27 -1.084 -7.478 5.127 1.00 0.00 C ATOM 360 CG ARG A 27 -1.968 -6.500 5.904 1.00 0.00 C ATOM 361 CD ARG A 27 -2.613 -7.184 7.111 1.00 0.00 C ATOM 362 NE ARG A 27 -1.565 -7.689 8.026 1.00 0.00 N ATOM 363 CZ ARG A 27 -1.815 -8.293 9.195 1.00 0.00 C ATOM 364 NH1 ARG A 27 -3.081 -8.470 9.600 1.00 0.00 N ATOM 365 NH2 ARG A 27 -0.801 -8.719 9.960 1.00 0.00 N ATOM 0 H ARG A 27 -1.425 -5.444 3.713 1.00 0.00 H new ATOM 0 HA ARG A 27 0.689 -6.269 5.174 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -1.686 -8.013 4.392 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -0.675 -8.224 5.808 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -1.371 -5.652 6.238 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -2.744 -6.105 5.248 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -3.258 -6.480 7.637 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -3.245 -8.008 6.778 1.00 0.00 H new ATOM 0 HE ARG A 27 -0.591 -7.569 7.749 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -3.853 -8.145 9.018 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -3.272 -8.930 10.490 1.00 0.00 H new ATOM 0 HH21 ARG A 27 0.162 -8.583 9.652 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -0.992 -9.179 10.850 1.00 0.00 H new ATOM 379 N ASP A 28 0.292 -8.211 2.525 1.00 0.00 N ATOM 380 CA ASP A 28 0.959 -9.174 1.664 1.00 0.00 C ATOM 381 C ASP A 28 2.282 -8.583 1.174 1.00 0.00 C ATOM 382 O ASP A 28 3.295 -9.278 1.122 1.00 0.00 O ATOM 383 CB ASP A 28 0.104 -9.501 0.438 1.00 0.00 C ATOM 384 CG ASP A 28 -0.220 -10.985 0.252 1.00 0.00 C ATOM 385 OD1 ASP A 28 0.707 -11.798 0.459 1.00 0.00 O ATOM 386 OD2 ASP A 28 -1.387 -11.272 -0.092 1.00 0.00 O ATOM 0 H ASP A 28 -0.641 -7.936 2.216 1.00 0.00 H new ATOM 0 HA ASP A 28 1.125 -10.084 2.241 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -0.832 -8.946 0.508 1.00 0.00 H new ATOM 0 HB3 ASP A 28 0.621 -9.143 -0.452 1.00 0.00 H new ATOM 391 N GLU A 29 2.230 -7.305 0.826 1.00 0.00 N ATOM 392 CA GLU A 29 3.412 -6.613 0.342 1.00 0.00 C ATOM 393 C GLU A 29 4.476 -6.547 1.439 1.00 0.00 C ATOM 394 O GLU A 29 5.651 -6.810 1.187 1.00 0.00 O ATOM 395 CB GLU A 29 3.059 -5.212 -0.163 1.00 0.00 C ATOM 396 CG GLU A 29 4.314 -4.453 -0.597 1.00 0.00 C ATOM 397 CD GLU A 29 4.995 -5.148 -1.778 1.00 0.00 C ATOM 398 OE1 GLU A 29 4.495 -4.964 -2.909 1.00 0.00 O ATOM 399 OE2 GLU A 29 5.999 -5.846 -1.524 1.00 0.00 O ATOM 0 H GLU A 29 1.388 -6.731 0.870 1.00 0.00 H new ATOM 0 HA GLU A 29 3.819 -7.175 -0.498 1.00 0.00 H new ATOM 0 HB2 GLU A 29 2.367 -5.288 -1.002 1.00 0.00 H new ATOM 0 HB3 GLU A 29 2.547 -4.657 0.623 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.048 -3.433 -0.875 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.009 -4.385 0.240 1.00 0.00 H new ATOM 406 N LEU A 30 4.026 -6.195 2.635 1.00 0.00 N ATOM 407 CA LEU A 30 4.925 -6.092 3.772 1.00 0.00 C ATOM 408 C LEU A 30 5.519 -7.469 4.074 1.00 0.00 C ATOM 409 O LEU A 30 6.718 -7.592 4.316 1.00 0.00 O ATOM 410 CB LEU A 30 4.209 -5.455 4.965 1.00 0.00 C ATOM 411 CG LEU A 30 3.433 -4.169 4.673 1.00 0.00 C ATOM 412 CD1 LEU A 30 2.527 -3.797 5.849 1.00 0.00 C ATOM 413 CD2 LEU A 30 4.382 -3.029 4.298 1.00 0.00 C ATOM 0 H LEU A 30 3.051 -5.978 2.841 1.00 0.00 H new ATOM 0 HA LEU A 30 5.759 -5.430 3.540 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.517 -6.187 5.381 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.949 -5.242 5.736 1.00 0.00 H new ATOM 0 HG LEU A 30 2.788 -4.347 3.813 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.987 -2.879 5.616 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.814 -4.602 6.028 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.134 -3.644 6.742 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.805 -2.127 4.095 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.070 -2.842 5.123 1.00 0.00 H new ATOM 0 HD23 LEU A 30 4.948 -3.305 3.408 1.00 0.00 H new ATOM 425 N LYS A 31 4.651 -8.470 4.051 1.00 0.00 N ATOM 426 CA LYS A 31 5.074 -9.834 4.319 1.00 0.00 C ATOM 427 C LYS A 31 6.002 -10.305 3.198 1.00 0.00 C ATOM 428 O LYS A 31 6.644 -11.348 3.315 1.00 0.00 O ATOM 429 CB LYS A 31 3.860 -10.739 4.535 1.00 0.00 C ATOM 430 CG LYS A 31 4.209 -12.202 4.252 1.00 0.00 C ATOM 431 CD LYS A 31 2.998 -13.108 4.478 1.00 0.00 C ATOM 432 CE LYS A 31 3.180 -14.453 3.770 1.00 0.00 C ATOM 433 NZ LYS A 31 2.786 -15.566 4.662 1.00 0.00 N ATOM 0 H LYS A 31 3.657 -8.363 3.851 1.00 0.00 H new ATOM 0 HA LYS A 31 5.645 -9.881 5.246 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.505 -10.638 5.560 1.00 0.00 H new ATOM 0 HB3 LYS A 31 3.046 -10.423 3.883 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.557 -12.304 3.224 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.028 -12.516 4.899 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.856 -13.272 5.546 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.098 -12.617 4.108 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.578 -14.477 2.862 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.220 -14.573 3.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.916 -16.471 4.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 3.378 -15.552 5.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 1.787 -15.459 4.931 1.00 0.00 H new ATOM 447 N ARG A 32 6.043 -9.515 2.135 1.00 0.00 N ATOM 448 CA ARG A 32 6.881 -9.839 0.993 1.00 0.00 C ATOM 449 C ARG A 32 8.270 -9.220 1.162 1.00 0.00 C ATOM 450 O ARG A 32 9.279 -9.914 1.059 1.00 0.00 O ATOM 451 CB ARG A 32 6.258 -9.331 -0.309 1.00 0.00 C ATOM 452 CG ARG A 32 6.317 -10.402 -1.399 1.00 0.00 C ATOM 453 CD ARG A 32 4.968 -11.110 -1.545 1.00 0.00 C ATOM 454 NE ARG A 32 4.729 -11.455 -2.964 1.00 0.00 N ATOM 455 CZ ARG A 32 3.521 -11.725 -3.478 1.00 0.00 C ATOM 456 NH1 ARG A 32 2.436 -11.691 -2.692 1.00 0.00 N ATOM 457 NH2 ARG A 32 3.398 -12.028 -4.777 1.00 0.00 N ATOM 0 H ARG A 32 5.509 -8.651 2.041 1.00 0.00 H new ATOM 0 HA ARG A 32 6.967 -10.924 0.942 1.00 0.00 H new ATOM 0 HB2 ARG A 32 5.222 -9.043 -0.132 1.00 0.00 H new ATOM 0 HB3 ARG A 32 6.784 -8.437 -0.644 1.00 0.00 H new ATOM 0 HG2 ARG A 32 6.597 -9.945 -2.348 1.00 0.00 H new ATOM 0 HG3 ARG A 32 7.090 -11.131 -1.156 1.00 0.00 H new ATOM 0 HD2 ARG A 32 4.954 -12.013 -0.935 1.00 0.00 H new ATOM 0 HD3 ARG A 32 4.168 -10.466 -1.179 1.00 0.00 H new ATOM 0 HE ARG A 32 5.534 -11.489 -3.590 1.00 0.00 H new ATOM 0 HH11 ARG A 32 2.530 -11.460 -1.703 1.00 0.00 H new ATOM 0 HH12 ARG A 32 1.516 -11.896 -3.083 1.00 0.00 H new ATOM 0 HH21 ARG A 32 4.224 -12.053 -5.375 1.00 0.00 H new ATOM 0 HH22 ARG A 32 2.479 -12.233 -5.168 1.00 0.00 H new ATOM 471 N ALA A 33 8.276 -7.920 1.418 1.00 0.00 N ATOM 472 CA ALA A 33 9.524 -7.199 1.602 1.00 0.00 C ATOM 473 C ALA A 33 9.972 -7.327 3.060 1.00 0.00 C ATOM 474 O ALA A 33 11.069 -6.899 3.416 1.00 0.00 O ATOM 475 CB ALA A 33 9.341 -5.742 1.174 1.00 0.00 C ATOM 0 H ALA A 33 7.436 -7.347 1.502 1.00 0.00 H new ATOM 0 HA ALA A 33 10.309 -7.625 0.977 1.00 0.00 H new ATOM 0 HB1 ALA A 33 10.278 -5.202 1.312 1.00 0.00 H new ATOM 0 HB2 ALA A 33 9.052 -5.705 0.124 1.00 0.00 H new ATOM 0 HB3 ALA A 33 8.562 -5.280 1.781 1.00 0.00 H new ATOM 481 N SER A 34 9.100 -7.919 3.863 1.00 0.00 N ATOM 482 CA SER A 34 9.392 -8.108 5.274 1.00 0.00 C ATOM 483 C SER A 34 9.782 -6.773 5.912 1.00 0.00 C ATOM 484 O SER A 34 10.734 -6.706 6.688 1.00 0.00 O ATOM 485 CB SER A 34 10.507 -9.137 5.473 1.00 0.00 C ATOM 486 OG SER A 34 10.439 -9.759 6.753 1.00 0.00 O ATOM 0 H SER A 34 8.192 -8.274 3.564 1.00 0.00 H new ATOM 0 HA SER A 34 8.493 -8.487 5.761 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.440 -9.899 4.696 1.00 0.00 H new ATOM 0 HB3 SER A 34 11.475 -8.649 5.358 1.00 0.00 H new ATOM 0 HG SER A 34 11.167 -10.410 6.840 1.00 0.00 H new ATOM 492 N VAL A 35 9.026 -5.743 5.561 1.00 0.00 N ATOM 493 CA VAL A 35 9.280 -4.414 6.090 1.00 0.00 C ATOM 494 C VAL A 35 8.195 -4.059 7.109 1.00 0.00 C ATOM 495 O VAL A 35 7.120 -4.656 7.109 1.00 0.00 O ATOM 496 CB VAL A 35 9.377 -3.405 4.944 1.00 0.00 C ATOM 497 CG1 VAL A 35 9.407 -4.115 3.589 1.00 0.00 C ATOM 498 CG2 VAL A 35 8.233 -2.391 5.007 1.00 0.00 C ATOM 0 H VAL A 35 8.237 -5.802 4.917 1.00 0.00 H new ATOM 0 HA VAL A 35 10.237 -4.387 6.612 1.00 0.00 H new ATOM 0 HB VAL A 35 10.314 -2.860 5.057 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.476 -3.375 2.792 1.00 0.00 H new ATOM 0 HG12 VAL A 35 10.271 -4.778 3.545 1.00 0.00 H new ATOM 0 HG13 VAL A 35 8.495 -4.699 3.464 1.00 0.00 H new ATOM 0 HG21 VAL A 35 8.326 -1.686 4.181 1.00 0.00 H new ATOM 0 HG22 VAL A 35 7.279 -2.913 4.932 1.00 0.00 H new ATOM 0 HG23 VAL A 35 8.278 -1.851 5.953 1.00 0.00 H new ATOM 508 N SER A 36 8.515 -3.088 7.952 1.00 0.00 N ATOM 509 CA SER A 36 7.581 -2.646 8.973 1.00 0.00 C ATOM 510 C SER A 36 6.539 -1.709 8.360 1.00 0.00 C ATOM 511 O SER A 36 6.872 -0.858 7.536 1.00 0.00 O ATOM 512 CB SER A 36 8.311 -1.948 10.123 1.00 0.00 C ATOM 513 OG SER A 36 8.543 -2.827 11.220 1.00 0.00 O ATOM 0 H SER A 36 9.408 -2.595 7.949 1.00 0.00 H new ATOM 0 HA SER A 36 7.077 -3.524 9.378 1.00 0.00 H new ATOM 0 HB2 SER A 36 9.263 -1.557 9.764 1.00 0.00 H new ATOM 0 HB3 SER A 36 7.723 -1.094 10.461 1.00 0.00 H new ATOM 0 HG SER A 36 9.012 -2.344 11.932 1.00 0.00 H new ATOM 519 N GLN A 37 5.298 -1.897 8.785 1.00 0.00 N ATOM 520 CA GLN A 37 4.205 -1.079 8.287 1.00 0.00 C ATOM 521 C GLN A 37 4.656 0.376 8.140 1.00 0.00 C ATOM 522 O GLN A 37 4.236 1.069 7.214 1.00 0.00 O ATOM 523 CB GLN A 37 2.982 -1.184 9.200 1.00 0.00 C ATOM 524 CG GLN A 37 2.234 -2.498 8.965 1.00 0.00 C ATOM 525 CD GLN A 37 0.895 -2.506 9.705 1.00 0.00 C ATOM 526 OE1 GLN A 37 0.255 -1.485 9.896 1.00 0.00 O ATOM 527 NE2 GLN A 37 0.507 -3.713 10.109 1.00 0.00 N ATOM 0 H GLN A 37 5.025 -2.603 9.468 1.00 0.00 H new ATOM 0 HA GLN A 37 3.917 -1.451 7.304 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.295 -1.121 10.242 1.00 0.00 H new ATOM 0 HB3 GLN A 37 2.313 -0.343 9.017 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.065 -2.638 7.897 1.00 0.00 H new ATOM 0 HG3 GLN A 37 2.846 -3.334 9.303 1.00 0.00 H new ATOM 0 HE21 GLN A 37 1.090 -4.527 9.916 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -0.374 -3.824 10.611 1.00 0.00 H new ATOM 536 N ALA A 38 5.504 0.797 9.067 1.00 0.00 N ATOM 537 CA ALA A 38 6.016 2.156 9.051 1.00 0.00 C ATOM 538 C ALA A 38 6.883 2.356 7.807 1.00 0.00 C ATOM 539 O ALA A 38 6.566 3.181 6.951 1.00 0.00 O ATOM 540 CB ALA A 38 6.783 2.428 10.347 1.00 0.00 C ATOM 0 H ALA A 38 5.849 0.220 9.834 1.00 0.00 H new ATOM 0 HA ALA A 38 5.197 2.874 9.000 1.00 0.00 H new ATOM 0 HB1 ALA A 38 7.167 3.448 10.335 1.00 0.00 H new ATOM 0 HB2 ALA A 38 6.115 2.302 11.199 1.00 0.00 H new ATOM 0 HB3 ALA A 38 7.614 1.728 10.432 1.00 0.00 H new ATOM 546 N VAL A 39 7.960 1.587 7.745 1.00 0.00 N ATOM 547 CA VAL A 39 8.875 1.670 6.620 1.00 0.00 C ATOM 548 C VAL A 39 8.072 1.807 5.324 1.00 0.00 C ATOM 549 O VAL A 39 8.343 2.690 4.512 1.00 0.00 O ATOM 550 CB VAL A 39 9.812 0.460 6.617 1.00 0.00 C ATOM 551 CG1 VAL A 39 10.443 0.258 5.238 1.00 0.00 C ATOM 552 CG2 VAL A 39 10.887 0.598 7.697 1.00 0.00 C ATOM 0 H VAL A 39 8.219 0.903 8.456 1.00 0.00 H new ATOM 0 HA VAL A 39 9.507 2.554 6.706 1.00 0.00 H new ATOM 0 HB VAL A 39 9.218 -0.425 6.846 1.00 0.00 H new ATOM 0 HG11 VAL A 39 11.104 -0.608 5.264 1.00 0.00 H new ATOM 0 HG12 VAL A 39 9.658 0.094 4.499 1.00 0.00 H new ATOM 0 HG13 VAL A 39 11.017 1.144 4.967 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.540 -0.275 7.674 1.00 0.00 H new ATOM 0 HG22 VAL A 39 11.476 1.497 7.512 1.00 0.00 H new ATOM 0 HG23 VAL A 39 10.412 0.670 8.676 1.00 0.00 H new ATOM 562 N PHE A 40 7.100 0.919 5.172 1.00 0.00 N ATOM 563 CA PHE A 40 6.256 0.930 3.989 1.00 0.00 C ATOM 564 C PHE A 40 5.410 2.203 3.931 1.00 0.00 C ATOM 565 O PHE A 40 5.549 3.004 3.007 1.00 0.00 O ATOM 566 CB PHE A 40 5.328 -0.282 4.091 1.00 0.00 C ATOM 567 CG PHE A 40 4.156 -0.252 3.108 1.00 0.00 C ATOM 568 CD1 PHE A 40 4.291 -0.802 1.872 1.00 0.00 C ATOM 569 CD2 PHE A 40 2.978 0.324 3.471 1.00 0.00 C ATOM 570 CE1 PHE A 40 3.203 -0.774 0.959 1.00 0.00 C ATOM 571 CE2 PHE A 40 1.890 0.352 2.559 1.00 0.00 C ATOM 572 CZ PHE A 40 2.026 -0.198 1.322 1.00 0.00 C ATOM 0 H PHE A 40 6.878 0.188 5.848 1.00 0.00 H new ATOM 0 HA PHE A 40 6.873 0.895 3.091 1.00 0.00 H new ATOM 0 HB2 PHE A 40 5.910 -1.188 3.920 1.00 0.00 H new ATOM 0 HB3 PHE A 40 4.936 -0.342 5.106 1.00 0.00 H new ATOM 0 HD1 PHE A 40 5.226 -1.260 1.584 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.870 0.760 4.453 1.00 0.00 H new ATOM 0 HE1 PHE A 40 3.311 -1.210 -0.023 1.00 0.00 H new ATOM 0 HE2 PHE A 40 0.955 0.810 2.847 1.00 0.00 H new ATOM 0 HZ PHE A 40 1.199 -0.177 0.628 1.00 0.00 H new ATOM 582 N ALA A 41 4.551 2.350 4.929 1.00 0.00 N ATOM 583 CA ALA A 41 3.682 3.512 5.003 1.00 0.00 C ATOM 584 C ALA A 41 4.459 4.754 4.561 1.00 0.00 C ATOM 585 O ALA A 41 3.886 5.676 3.982 1.00 0.00 O ATOM 586 CB ALA A 41 3.129 3.647 6.423 1.00 0.00 C ATOM 0 H ALA A 41 4.438 1.684 5.693 1.00 0.00 H new ATOM 0 HA ALA A 41 2.832 3.398 4.331 1.00 0.00 H new ATOM 0 HB1 ALA A 41 2.477 4.519 6.478 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.561 2.752 6.679 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.954 3.766 7.125 1.00 0.00 H new ATOM 592 N ARG A 42 5.752 4.738 4.849 1.00 0.00 N ATOM 593 CA ARG A 42 6.613 5.851 4.488 1.00 0.00 C ATOM 594 C ARG A 42 6.833 5.883 2.974 1.00 0.00 C ATOM 595 O ARG A 42 6.639 6.917 2.337 1.00 0.00 O ATOM 596 CB ARG A 42 7.968 5.750 5.191 1.00 0.00 C ATOM 597 CG ARG A 42 8.825 6.987 4.912 1.00 0.00 C ATOM 598 CD ARG A 42 8.062 8.269 5.250 1.00 0.00 C ATOM 599 NE ARG A 42 8.941 9.201 5.991 1.00 0.00 N ATOM 600 CZ ARG A 42 9.970 9.860 5.441 1.00 0.00 C ATOM 601 NH1 ARG A 42 10.255 9.694 4.142 1.00 0.00 N ATOM 602 NH2 ARG A 42 10.714 10.686 6.189 1.00 0.00 N ATOM 0 H ARG A 42 6.224 3.972 5.328 1.00 0.00 H new ATOM 0 HA ARG A 42 6.119 6.769 4.806 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.817 5.643 6.265 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.492 4.856 4.852 1.00 0.00 H new ATOM 0 HG2 ARG A 42 9.742 6.939 5.500 1.00 0.00 H new ATOM 0 HG3 ARG A 42 9.120 7.001 3.863 1.00 0.00 H new ATOM 0 HD2 ARG A 42 7.706 8.742 4.335 1.00 0.00 H new ATOM 0 HD3 ARG A 42 7.183 8.032 5.849 1.00 0.00 H new ATOM 0 HE ARG A 42 8.752 9.351 6.982 1.00 0.00 H new ATOM 0 HH11 ARG A 42 9.689 9.066 3.572 1.00 0.00 H new ATOM 0 HH12 ARG A 42 11.038 10.196 3.724 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.497 10.813 7.178 1.00 0.00 H new ATOM 0 HH22 ARG A 42 11.497 11.187 5.770 1.00 0.00 H new ATOM 616 N VAL A 43 7.235 4.738 2.443 1.00 0.00 N ATOM 617 CA VAL A 43 7.484 4.621 1.016 1.00 0.00 C ATOM 618 C VAL A 43 6.166 4.328 0.296 1.00 0.00 C ATOM 619 O VAL A 43 6.157 4.058 -0.904 1.00 0.00 O ATOM 620 CB VAL A 43 8.556 3.561 0.756 1.00 0.00 C ATOM 621 CG1 VAL A 43 9.783 3.795 1.639 1.00 0.00 C ATOM 622 CG2 VAL A 43 7.995 2.153 0.959 1.00 0.00 C ATOM 0 H VAL A 43 7.395 3.883 2.975 1.00 0.00 H new ATOM 0 HA VAL A 43 7.871 5.559 0.618 1.00 0.00 H new ATOM 0 HB VAL A 43 8.870 3.650 -0.284 1.00 0.00 H new ATOM 0 HG11 VAL A 43 10.530 3.028 1.435 1.00 0.00 H new ATOM 0 HG12 VAL A 43 10.204 4.777 1.424 1.00 0.00 H new ATOM 0 HG13 VAL A 43 9.491 3.747 2.688 1.00 0.00 H new ATOM 0 HG21 VAL A 43 8.777 1.419 0.768 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.640 2.047 1.984 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.167 1.988 0.270 1.00 0.00 H new ATOM 632 N ALA A 44 5.085 4.390 1.059 1.00 0.00 N ATOM 633 CA ALA A 44 3.764 4.135 0.508 1.00 0.00 C ATOM 634 C ALA A 44 3.042 5.465 0.288 1.00 0.00 C ATOM 635 O ALA A 44 2.627 5.773 -0.828 1.00 0.00 O ATOM 636 CB ALA A 44 2.994 3.200 1.443 1.00 0.00 C ATOM 0 H ALA A 44 5.096 4.613 2.054 1.00 0.00 H new ATOM 0 HA ALA A 44 3.840 3.639 -0.459 1.00 0.00 H new ATOM 0 HB1 ALA A 44 2.003 3.008 1.031 1.00 0.00 H new ATOM 0 HB2 ALA A 44 3.534 2.259 1.542 1.00 0.00 H new ATOM 0 HB3 ALA A 44 2.895 3.666 2.423 1.00 0.00 H new ATOM 642 N PHE A 45 2.914 6.219 1.370 1.00 0.00 N ATOM 643 CA PHE A 45 2.249 7.509 1.309 1.00 0.00 C ATOM 644 C PHE A 45 2.840 8.480 2.334 1.00 0.00 C ATOM 645 O PHE A 45 2.173 9.423 2.757 1.00 0.00 O ATOM 646 CB PHE A 45 0.775 7.269 1.643 1.00 0.00 C ATOM 647 CG PHE A 45 0.542 6.159 2.670 1.00 0.00 C ATOM 648 CD1 PHE A 45 0.746 4.860 2.325 1.00 0.00 C ATOM 649 CD2 PHE A 45 0.132 6.472 3.928 1.00 0.00 C ATOM 650 CE1 PHE A 45 0.531 3.830 3.279 1.00 0.00 C ATOM 651 CE2 PHE A 45 -0.084 5.443 4.882 1.00 0.00 C ATOM 652 CZ PHE A 45 0.120 4.143 4.537 1.00 0.00 C ATOM 0 H PHE A 45 3.260 5.961 2.294 1.00 0.00 H new ATOM 0 HA PHE A 45 2.376 7.946 0.319 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.343 8.196 2.021 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.241 7.019 0.726 1.00 0.00 H new ATOM 0 HD1 PHE A 45 1.071 4.611 1.326 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.029 7.504 4.202 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.694 2.798 3.005 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -0.410 5.692 5.881 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.044 3.360 5.262 1.00 0.00 H new ATOM 662 N ASN A 46 4.084 8.214 2.704 1.00 0.00 N ATOM 663 CA ASN A 46 4.772 9.052 3.671 1.00 0.00 C ATOM 664 C ASN A 46 3.952 9.114 4.961 1.00 0.00 C ATOM 665 O ASN A 46 3.460 10.177 5.337 1.00 0.00 O ATOM 666 CB ASN A 46 4.935 10.480 3.145 1.00 0.00 C ATOM 667 CG ASN A 46 5.859 11.296 4.052 1.00 0.00 C ATOM 668 OD1 ASN A 46 7.069 11.309 3.898 1.00 0.00 O ATOM 669 ND2 ASN A 46 5.223 11.974 5.003 1.00 0.00 N ATOM 0 H ASN A 46 4.633 7.430 2.352 1.00 0.00 H new ATOM 0 HA ASN A 46 5.756 8.620 3.852 1.00 0.00 H new ATOM 0 HB2 ASN A 46 5.341 10.455 2.134 1.00 0.00 H new ATOM 0 HB3 ASN A 46 3.960 10.963 3.085 1.00 0.00 H new ATOM 0 HD21 ASN A 46 5.751 12.549 5.659 1.00 0.00 H new ATOM 0 HD22 ASN A 46 4.207 11.919 5.076 1.00 0.00 H new ATOM 676 N ARG A 47 3.830 7.961 5.603 1.00 0.00 N ATOM 677 CA ARG A 47 3.077 7.871 6.842 1.00 0.00 C ATOM 678 C ARG A 47 3.801 6.962 7.837 1.00 0.00 C ATOM 679 O ARG A 47 4.888 6.462 7.550 1.00 0.00 O ATOM 680 CB ARG A 47 1.670 7.326 6.594 1.00 0.00 C ATOM 681 CG ARG A 47 0.653 8.463 6.481 1.00 0.00 C ATOM 682 CD ARG A 47 0.441 9.145 7.835 1.00 0.00 C ATOM 683 NE ARG A 47 -0.265 10.433 7.648 1.00 0.00 N ATOM 684 CZ ARG A 47 0.296 11.524 7.110 1.00 0.00 C ATOM 685 NH1 ARG A 47 1.572 11.491 6.702 1.00 0.00 N ATOM 686 NH2 ARG A 47 -0.420 12.650 6.979 1.00 0.00 N ATOM 0 H ARG A 47 4.240 7.082 5.288 1.00 0.00 H new ATOM 0 HA ARG A 47 2.996 8.877 7.255 1.00 0.00 H new ATOM 0 HB2 ARG A 47 1.662 6.734 5.679 1.00 0.00 H new ATOM 0 HB3 ARG A 47 1.386 6.659 7.408 1.00 0.00 H new ATOM 0 HG2 ARG A 47 1.000 9.195 5.751 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.296 8.072 6.114 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -0.138 8.496 8.492 1.00 0.00 H new ATOM 0 HD3 ARG A 47 1.402 9.315 8.320 1.00 0.00 H new ATOM 0 HE ARG A 47 -1.238 10.493 7.947 1.00 0.00 H new ATOM 0 HH11 ARG A 47 2.117 10.635 6.801 1.00 0.00 H new ATOM 0 HH12 ARG A 47 1.998 12.322 6.292 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -1.391 12.676 7.289 1.00 0.00 H new ATOM 0 HH22 ARG A 47 0.007 13.481 6.569 1.00 0.00 H new ATOM 700 N THR A 48 3.170 6.775 8.987 1.00 0.00 N ATOM 701 CA THR A 48 3.740 5.935 10.026 1.00 0.00 C ATOM 702 C THR A 48 3.019 4.586 10.077 1.00 0.00 C ATOM 703 O THR A 48 2.232 4.265 9.187 1.00 0.00 O ATOM 704 CB THR A 48 3.677 6.706 11.346 1.00 0.00 C ATOM 705 OG1 THR A 48 2.429 7.391 11.289 1.00 0.00 O ATOM 706 CG2 THR A 48 4.714 7.829 11.417 1.00 0.00 C ATOM 0 H THR A 48 2.269 7.191 9.222 1.00 0.00 H new ATOM 0 HA THR A 48 4.784 5.703 9.817 1.00 0.00 H new ATOM 0 HB THR A 48 3.829 6.017 12.177 1.00 0.00 H new ATOM 0 HG1 THR A 48 2.306 7.915 12.108 1.00 0.00 H new ATOM 0 HG21 THR A 48 4.627 8.345 12.373 1.00 0.00 H new ATOM 0 HG22 THR A 48 5.714 7.407 11.322 1.00 0.00 H new ATOM 0 HG23 THR A 48 4.540 8.537 10.606 1.00 0.00 H new ATOM 714 N GLN A 49 3.314 3.832 11.126 1.00 0.00 N ATOM 715 CA GLN A 49 2.704 2.526 11.304 1.00 0.00 C ATOM 716 C GLN A 49 1.384 2.655 12.066 1.00 0.00 C ATOM 717 O GLN A 49 0.339 2.220 11.584 1.00 0.00 O ATOM 718 CB GLN A 49 3.659 1.568 12.020 1.00 0.00 C ATOM 719 CG GLN A 49 2.931 0.296 12.461 1.00 0.00 C ATOM 720 CD GLN A 49 3.926 -0.780 12.900 1.00 0.00 C ATOM 721 OE1 GLN A 49 5.106 -0.534 13.083 1.00 0.00 O ATOM 722 NE2 GLN A 49 3.384 -1.985 13.057 1.00 0.00 N ATOM 0 H GLN A 49 3.968 4.101 11.861 1.00 0.00 H new ATOM 0 HA GLN A 49 2.493 2.109 10.320 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.484 1.308 11.357 1.00 0.00 H new ATOM 0 HB3 GLN A 49 4.093 2.063 12.889 1.00 0.00 H new ATOM 0 HG2 GLN A 49 2.253 0.527 13.283 1.00 0.00 H new ATOM 0 HG3 GLN A 49 2.320 -0.081 11.641 1.00 0.00 H new ATOM 0 HE21 GLN A 49 2.388 -2.122 12.887 1.00 0.00 H new ATOM 0 HE22 GLN A 49 3.965 -2.772 13.347 1.00 0.00 H new ATOM 731 N GLY A 50 1.474 3.256 13.243 1.00 0.00 N ATOM 732 CA GLY A 50 0.299 3.449 14.077 1.00 0.00 C ATOM 733 C GLY A 50 -0.918 3.825 13.230 1.00 0.00 C ATOM 734 O GLY A 50 -2.045 3.454 13.557 1.00 0.00 O ATOM 0 H GLY A 50 2.342 3.616 13.639 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.090 2.536 14.635 1.00 0.00 H new ATOM 0 HA3 GLY A 50 0.493 4.233 14.809 1.00 0.00 H new ATOM 738 N LEU A 51 -0.651 4.557 12.159 1.00 0.00 N ATOM 739 CA LEU A 51 -1.710 4.988 11.263 1.00 0.00 C ATOM 740 C LEU A 51 -2.088 3.832 10.335 1.00 0.00 C ATOM 741 O LEU A 51 -3.185 3.283 10.436 1.00 0.00 O ATOM 742 CB LEU A 51 -1.301 6.262 10.522 1.00 0.00 C ATOM 743 CG LEU A 51 -2.215 6.693 9.373 1.00 0.00 C ATOM 744 CD1 LEU A 51 -1.826 5.991 8.070 1.00 0.00 C ATOM 745 CD2 LEU A 51 -3.686 6.469 9.729 1.00 0.00 C ATOM 0 H LEU A 51 0.285 4.863 11.891 1.00 0.00 H new ATOM 0 HA LEU A 51 -2.604 5.250 11.829 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -1.249 7.077 11.244 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.295 6.121 10.126 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.082 7.763 9.214 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.491 6.315 7.270 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.798 6.245 7.813 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.912 4.912 8.198 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.314 6.783 8.895 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -3.854 5.411 9.931 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -3.939 7.052 10.614 1.00 0.00 H new ATOM 757 N LEU A 52 -1.160 3.496 9.451 1.00 0.00 N ATOM 758 CA LEU A 52 -1.382 2.415 8.506 1.00 0.00 C ATOM 759 C LEU A 52 -2.112 1.270 9.210 1.00 0.00 C ATOM 760 O LEU A 52 -2.968 0.616 8.615 1.00 0.00 O ATOM 761 CB LEU A 52 -0.064 1.995 7.852 1.00 0.00 C ATOM 762 CG LEU A 52 -0.089 0.673 7.082 1.00 0.00 C ATOM 763 CD1 LEU A 52 -0.906 0.803 5.796 1.00 0.00 C ATOM 764 CD2 LEU A 52 1.331 0.170 6.812 1.00 0.00 C ATOM 0 H LEU A 52 -0.252 3.954 9.369 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.023 2.748 7.690 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.247 2.785 7.169 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.698 1.926 8.628 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.583 -0.075 7.702 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -0.908 -0.151 5.268 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.930 1.083 6.042 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.463 1.569 5.160 1.00 0.00 H new ATOM 0 HD21 LEU A 52 1.286 -0.771 6.264 1.00 0.00 H new ATOM 0 HD22 LEU A 52 1.872 0.909 6.221 1.00 0.00 H new ATOM 0 HD23 LEU A 52 1.848 0.013 7.759 1.00 0.00 H new ATOM 776 N SER A 53 -1.747 1.061 10.466 1.00 0.00 N ATOM 777 CA SER A 53 -2.357 0.006 11.257 1.00 0.00 C ATOM 778 C SER A 53 -3.869 0.221 11.340 1.00 0.00 C ATOM 779 O SER A 53 -4.645 -0.618 10.887 1.00 0.00 O ATOM 780 CB SER A 53 -1.751 -0.050 12.661 1.00 0.00 C ATOM 781 OG SER A 53 -1.741 -1.374 13.186 1.00 0.00 O ATOM 0 H SER A 53 -1.036 1.604 10.956 1.00 0.00 H new ATOM 0 HA SER A 53 -2.159 -0.947 10.766 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.732 0.336 12.632 1.00 0.00 H new ATOM 0 HB3 SER A 53 -2.319 0.600 13.327 1.00 0.00 H new ATOM 0 HG SER A 53 -1.345 -1.367 14.082 1.00 0.00 H new ATOM 787 N GLU A 54 -4.243 1.351 11.923 1.00 0.00 N ATOM 788 CA GLU A 54 -5.649 1.688 12.071 1.00 0.00 C ATOM 789 C GLU A 54 -6.378 1.522 10.736 1.00 0.00 C ATOM 790 O GLU A 54 -7.557 1.175 10.708 1.00 0.00 O ATOM 791 CB GLU A 54 -5.818 3.107 12.616 1.00 0.00 C ATOM 792 CG GLU A 54 -5.939 4.121 11.477 1.00 0.00 C ATOM 793 CD GLU A 54 -5.551 5.524 11.948 1.00 0.00 C ATOM 794 OE1 GLU A 54 -4.641 5.605 12.801 1.00 0.00 O ATOM 795 OE2 GLU A 54 -6.174 6.484 11.444 1.00 0.00 O ATOM 0 H GLU A 54 -3.597 2.045 12.298 1.00 0.00 H new ATOM 0 HA GLU A 54 -6.093 1.002 12.792 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -6.706 3.155 13.246 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -4.966 3.362 13.246 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.297 3.821 10.649 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -6.962 4.130 11.100 1.00 0.00 H new ATOM 802 N ILE A 55 -5.645 1.777 9.662 1.00 0.00 N ATOM 803 CA ILE A 55 -6.207 1.661 8.328 1.00 0.00 C ATOM 804 C ILE A 55 -6.411 0.182 7.992 1.00 0.00 C ATOM 805 O ILE A 55 -7.449 -0.198 7.451 1.00 0.00 O ATOM 806 CB ILE A 55 -5.338 2.407 7.313 1.00 0.00 C ATOM 807 CG1 ILE A 55 -5.278 3.901 7.636 1.00 0.00 C ATOM 808 CG2 ILE A 55 -5.818 2.149 5.884 1.00 0.00 C ATOM 809 CD1 ILE A 55 -4.265 4.616 6.740 1.00 0.00 C ATOM 0 H ILE A 55 -4.666 2.064 9.689 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.187 2.137 8.285 1.00 0.00 H new ATOM 0 HB ILE A 55 -4.321 2.020 7.385 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -6.264 4.345 7.502 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -5.005 4.040 8.682 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.183 2.691 5.183 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -5.766 1.082 5.670 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.848 2.490 5.779 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -4.242 5.677 6.991 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -3.275 4.186 6.894 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -4.554 4.496 5.696 1.00 0.00 H new ATOM 821 N LEU A 56 -5.405 -0.612 8.327 1.00 0.00 N ATOM 822 CA LEU A 56 -5.461 -2.041 8.068 1.00 0.00 C ATOM 823 C LEU A 56 -6.394 -2.703 9.085 1.00 0.00 C ATOM 824 O LEU A 56 -6.788 -3.855 8.913 1.00 0.00 O ATOM 825 CB LEU A 56 -4.053 -2.637 8.046 1.00 0.00 C ATOM 826 CG LEU A 56 -3.097 -2.062 6.999 1.00 0.00 C ATOM 827 CD1 LEU A 56 -1.641 -2.212 7.445 1.00 0.00 C ATOM 828 CD2 LEU A 56 -3.344 -2.691 5.627 1.00 0.00 C ATOM 0 H LEU A 56 -4.546 -0.293 8.776 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.878 -2.233 7.080 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.607 -2.500 9.031 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -4.137 -3.711 7.881 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.296 -0.995 6.904 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.982 -1.795 6.683 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -1.492 -1.680 8.384 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.411 -3.268 7.586 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.651 -2.265 4.901 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.189 -3.768 5.687 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -4.368 -2.489 5.313 1.00 0.00 H new ATOM 840 N ARG A 57 -6.719 -1.945 10.122 1.00 0.00 N ATOM 841 CA ARG A 57 -7.598 -2.444 11.166 1.00 0.00 C ATOM 842 C ARG A 57 -9.059 -2.155 10.814 1.00 0.00 C ATOM 843 O ARG A 57 -9.904 -3.046 10.877 1.00 0.00 O ATOM 844 CB ARG A 57 -7.269 -1.802 12.516 1.00 0.00 C ATOM 845 CG ARG A 57 -6.087 -2.505 13.184 1.00 0.00 C ATOM 846 CD ARG A 57 -5.960 -2.090 14.651 1.00 0.00 C ATOM 847 NE ARG A 57 -5.371 -0.736 14.745 1.00 0.00 N ATOM 848 CZ ARG A 57 -5.364 0.005 15.862 1.00 0.00 C ATOM 849 NH1 ARG A 57 -5.914 -0.473 16.986 1.00 0.00 N ATOM 850 NH2 ARG A 57 -4.806 1.223 15.854 1.00 0.00 N ATOM 0 H ARG A 57 -6.390 -0.990 10.262 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.445 -3.521 11.241 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.036 -0.747 12.374 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -8.141 -1.851 13.168 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.217 -3.585 13.118 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -5.167 -2.262 12.653 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.940 -2.103 15.127 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -5.336 -2.805 15.187 1.00 0.00 H new ATOM 0 HE ARG A 57 -4.943 -0.342 13.907 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -6.338 -1.401 16.992 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -5.909 0.091 17.836 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.387 1.586 14.998 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.801 1.787 16.704 1.00 0.00 H new ATOM 864 N LYS A 58 -9.310 -0.906 10.451 1.00 0.00 N ATOM 865 CA LYS A 58 -10.654 -0.488 10.089 1.00 0.00 C ATOM 866 C LYS A 58 -10.912 -0.832 8.620 1.00 0.00 C ATOM 867 O LYS A 58 -12.020 -1.224 8.256 1.00 0.00 O ATOM 868 CB LYS A 58 -10.863 0.991 10.419 1.00 0.00 C ATOM 869 CG LYS A 58 -10.602 1.264 11.902 1.00 0.00 C ATOM 870 CD LYS A 58 -10.030 2.668 12.109 1.00 0.00 C ATOM 871 CE LYS A 58 -9.615 2.881 13.566 1.00 0.00 C ATOM 872 NZ LYS A 58 -10.661 3.626 14.300 1.00 0.00 N ATOM 0 H LYS A 58 -8.606 -0.170 10.400 1.00 0.00 H new ATOM 0 HA LYS A 58 -11.393 -1.030 10.679 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -10.196 1.601 9.810 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -11.882 1.283 10.166 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.530 1.159 12.464 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -9.906 0.523 12.295 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -9.169 2.814 11.457 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -10.774 3.413 11.826 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.442 1.917 14.046 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -8.674 3.430 13.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -10.363 3.762 15.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -10.806 4.553 13.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -11.551 3.088 14.278 1.00 0.00 H new ATOM 886 N GLU A 59 -9.871 -0.674 7.817 1.00 0.00 N ATOM 887 CA GLU A 59 -9.970 -0.963 6.396 1.00 0.00 C ATOM 888 C GLU A 59 -11.051 -0.092 5.752 1.00 0.00 C ATOM 889 O GLU A 59 -11.881 -0.587 4.991 1.00 0.00 O ATOM 890 CB GLU A 59 -10.249 -2.448 6.157 1.00 0.00 C ATOM 891 CG GLU A 59 -9.016 -3.296 6.476 1.00 0.00 C ATOM 892 CD GLU A 59 -9.128 -4.686 5.847 1.00 0.00 C ATOM 893 OE1 GLU A 59 -9.030 -4.755 4.603 1.00 0.00 O ATOM 894 OE2 GLU A 59 -9.309 -5.647 6.624 1.00 0.00 O ATOM 0 H GLU A 59 -8.954 -0.349 8.123 1.00 0.00 H new ATOM 0 HA GLU A 59 -9.014 -0.727 5.929 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.086 -2.769 6.777 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -10.543 -2.604 5.119 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.121 -2.796 6.105 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.904 -3.390 7.556 1.00 0.00 H new ATOM 901 N GLU A 60 -11.005 1.191 6.080 1.00 0.00 N ATOM 902 CA GLU A 60 -11.970 2.136 5.543 1.00 0.00 C ATOM 903 C GLU A 60 -12.120 1.940 4.033 1.00 0.00 C ATOM 904 O GLU A 60 -11.248 2.336 3.262 1.00 0.00 O ATOM 905 CB GLU A 60 -11.569 3.575 5.872 1.00 0.00 C ATOM 906 CG GLU A 60 -12.633 4.257 6.734 1.00 0.00 C ATOM 907 CD GLU A 60 -12.941 5.663 6.215 1.00 0.00 C ATOM 908 OE1 GLU A 60 -12.009 6.496 6.247 1.00 0.00 O ATOM 909 OE2 GLU A 60 -14.101 5.873 5.799 1.00 0.00 O ATOM 0 H GLU A 60 -10.315 1.598 6.711 1.00 0.00 H new ATOM 0 HA GLU A 60 -12.935 1.947 6.012 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.613 3.579 6.396 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -11.428 4.137 4.949 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.544 3.658 6.735 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -12.288 4.314 7.766 1.00 0.00 H new ATOM 916 N ASP A 61 -13.233 1.328 3.656 1.00 0.00 N ATOM 917 CA ASP A 61 -13.509 1.075 2.252 1.00 0.00 C ATOM 918 C ASP A 61 -13.167 2.323 1.436 1.00 0.00 C ATOM 919 O ASP A 61 -13.449 3.443 1.860 1.00 0.00 O ATOM 920 CB ASP A 61 -14.989 0.756 2.031 1.00 0.00 C ATOM 921 CG ASP A 61 -15.263 -0.445 1.122 1.00 0.00 C ATOM 922 OD1 ASP A 61 -14.482 -1.416 1.214 1.00 0.00 O ATOM 923 OD2 ASP A 61 -16.248 -0.364 0.357 1.00 0.00 O ATOM 0 H ASP A 61 -13.954 1.000 4.298 1.00 0.00 H new ATOM 0 HA ASP A 61 -12.905 0.223 1.938 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -15.454 0.573 3.000 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -15.475 1.634 1.605 1.00 0.00 H new ATOM 928 N PRO A 62 -12.549 2.082 0.249 1.00 0.00 N ATOM 929 CA PRO A 62 -12.166 3.173 -0.630 1.00 0.00 C ATOM 930 C PRO A 62 -13.386 3.756 -1.345 1.00 0.00 C ATOM 931 O PRO A 62 -13.259 4.687 -2.140 1.00 0.00 O ATOM 932 CB PRO A 62 -11.150 2.570 -1.586 1.00 0.00 C ATOM 933 CG PRO A 62 -11.346 1.065 -1.508 1.00 0.00 C ATOM 934 CD PRO A 62 -12.200 0.769 -0.286 1.00 0.00 C ATOM 0 HA PRO A 62 -11.734 4.016 -0.090 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -11.307 2.932 -2.602 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.135 2.847 -1.302 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -11.831 0.696 -2.411 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -10.384 0.558 -1.433 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -13.091 0.201 -0.554 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -11.652 0.176 0.446 1.00 0.00 H new ATOM 942 N ARG A 63 -14.541 3.185 -1.036 1.00 0.00 N ATOM 943 CA ARG A 63 -15.784 3.637 -1.639 1.00 0.00 C ATOM 944 C ARG A 63 -16.472 4.660 -0.734 1.00 0.00 C ATOM 945 O ARG A 63 -17.194 5.533 -1.214 1.00 0.00 O ATOM 946 CB ARG A 63 -16.735 2.464 -1.886 1.00 0.00 C ATOM 947 CG ARG A 63 -16.099 1.429 -2.816 1.00 0.00 C ATOM 948 CD ARG A 63 -16.237 1.849 -4.281 1.00 0.00 C ATOM 949 NE ARG A 63 -16.645 0.689 -5.104 1.00 0.00 N ATOM 950 CZ ARG A 63 -17.808 0.039 -4.962 1.00 0.00 C ATOM 951 NH1 ARG A 63 -18.685 0.431 -4.028 1.00 0.00 N ATOM 952 NH2 ARG A 63 -18.093 -1.004 -5.754 1.00 0.00 N ATOM 0 H ARG A 63 -14.642 2.414 -0.376 1.00 0.00 H new ATOM 0 HA ARG A 63 -15.539 4.099 -2.595 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -16.994 1.995 -0.937 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -17.664 2.830 -2.324 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -15.045 1.310 -2.566 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -16.574 0.459 -2.666 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -16.974 2.647 -4.371 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -15.290 2.248 -4.644 1.00 0.00 H new ATOM 0 HE ARG A 63 -16.000 0.364 -5.825 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -18.467 1.224 -3.425 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -19.570 -0.064 -3.920 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -17.425 -1.303 -6.464 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -18.978 -1.499 -5.646 1.00 0.00 H new ATOM 966 N THR A 64 -16.224 4.520 0.560 1.00 0.00 N ATOM 967 CA THR A 64 -16.811 5.421 1.537 1.00 0.00 C ATOM 968 C THR A 64 -15.717 6.217 2.252 1.00 0.00 C ATOM 969 O THR A 64 -16.006 7.190 2.947 1.00 0.00 O ATOM 970 CB THR A 64 -17.677 4.591 2.486 1.00 0.00 C ATOM 971 OG1 THR A 64 -16.790 3.593 2.983 1.00 0.00 O ATOM 972 CG2 THR A 64 -18.757 3.796 1.748 1.00 0.00 C ATOM 0 H THR A 64 -15.624 3.796 0.955 1.00 0.00 H new ATOM 0 HA THR A 64 -17.449 6.163 1.057 1.00 0.00 H new ATOM 0 HB THR A 64 -18.146 5.249 3.218 1.00 0.00 H new ATOM 0 HG1 THR A 64 -17.270 3.011 3.608 1.00 0.00 H new ATOM 0 HG21 THR A 64 -19.343 3.224 2.467 1.00 0.00 H new ATOM 0 HG22 THR A 64 -19.411 4.483 1.211 1.00 0.00 H new ATOM 0 HG23 THR A 64 -18.287 3.114 1.040 1.00 0.00 H new ATOM 980 N ALA A 65 -14.484 5.774 2.057 1.00 0.00 N ATOM 981 CA ALA A 65 -13.346 6.433 2.675 1.00 0.00 C ATOM 982 C ALA A 65 -13.448 7.942 2.444 1.00 0.00 C ATOM 983 O ALA A 65 -14.316 8.403 1.704 1.00 0.00 O ATOM 984 CB ALA A 65 -12.049 5.845 2.115 1.00 0.00 C ATOM 0 H ALA A 65 -14.248 4.967 1.480 1.00 0.00 H new ATOM 0 HA ALA A 65 -13.343 6.263 3.752 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -11.195 6.339 2.579 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -12.011 4.777 2.330 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -12.016 5.999 1.036 1.00 0.00 H new ATOM 990 N SER A 66 -12.550 8.670 3.092 1.00 0.00 N ATOM 991 CA SER A 66 -12.529 10.118 2.966 1.00 0.00 C ATOM 992 C SER A 66 -11.292 10.557 2.180 1.00 0.00 C ATOM 993 O SER A 66 -10.288 9.847 2.148 1.00 0.00 O ATOM 994 CB SER A 66 -12.550 10.790 4.341 1.00 0.00 C ATOM 995 OG SER A 66 -11.245 10.896 4.903 1.00 0.00 O ATOM 0 H SER A 66 -11.832 8.285 3.706 1.00 0.00 H new ATOM 0 HA SER A 66 -13.424 10.428 2.426 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.988 11.784 4.252 1.00 0.00 H new ATOM 0 HB3 SER A 66 -13.189 10.219 5.014 1.00 0.00 H new ATOM 0 HG SER A 66 -11.301 11.331 5.779 1.00 0.00 H new ATOM 1001 N GLN A 67 -11.406 11.725 1.564 1.00 0.00 N ATOM 1002 CA GLN A 67 -10.309 12.266 0.780 1.00 0.00 C ATOM 1003 C GLN A 67 -8.980 12.053 1.507 1.00 0.00 C ATOM 1004 O GLN A 67 -7.985 11.673 0.891 1.00 0.00 O ATOM 1005 CB GLN A 67 -10.534 13.748 0.473 1.00 0.00 C ATOM 1006 CG GLN A 67 -10.642 14.565 1.763 1.00 0.00 C ATOM 1007 CD GLN A 67 -10.948 16.033 1.458 1.00 0.00 C ATOM 1008 OE1 GLN A 67 -11.213 16.418 0.331 1.00 0.00 O ATOM 1009 NE2 GLN A 67 -10.899 16.828 2.524 1.00 0.00 N ATOM 0 H GLN A 67 -12.240 12.311 1.592 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.270 11.733 -0.170 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -9.711 14.126 -0.134 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -11.444 13.867 -0.115 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -11.426 14.150 2.396 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -9.709 14.493 2.323 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -10.671 16.440 3.439 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -11.090 17.825 2.426 1.00 0.00 H new ATOM 1018 N SER A 68 -9.006 12.306 2.807 1.00 0.00 N ATOM 1019 CA SER A 68 -7.815 12.146 3.625 1.00 0.00 C ATOM 1020 C SER A 68 -7.249 10.736 3.454 1.00 0.00 C ATOM 1021 O SER A 68 -6.082 10.570 3.103 1.00 0.00 O ATOM 1022 CB SER A 68 -8.118 12.422 5.099 1.00 0.00 C ATOM 1023 OG SER A 68 -7.405 13.555 5.588 1.00 0.00 O ATOM 0 H SER A 68 -9.833 12.621 3.315 1.00 0.00 H new ATOM 0 HA SER A 68 -7.072 12.871 3.293 1.00 0.00 H new ATOM 0 HB2 SER A 68 -9.188 12.585 5.225 1.00 0.00 H new ATOM 0 HB3 SER A 68 -7.858 11.546 5.693 1.00 0.00 H new ATOM 0 HG SER A 68 -7.627 13.699 6.532 1.00 0.00 H new ATOM 1029 N LEU A 69 -8.102 9.755 3.710 1.00 0.00 N ATOM 1030 CA LEU A 69 -7.701 8.363 3.589 1.00 0.00 C ATOM 1031 C LEU A 69 -7.462 8.033 2.114 1.00 0.00 C ATOM 1032 O LEU A 69 -6.392 7.549 1.749 1.00 0.00 O ATOM 1033 CB LEU A 69 -8.725 7.450 4.266 1.00 0.00 C ATOM 1034 CG LEU A 69 -8.156 6.241 5.011 1.00 0.00 C ATOM 1035 CD1 LEU A 69 -9.204 5.628 5.943 1.00 0.00 C ATOM 1036 CD2 LEU A 69 -7.587 5.212 4.032 1.00 0.00 C ATOM 0 H LEU A 69 -9.069 9.896 4.001 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.760 8.190 4.111 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.304 8.047 4.971 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.419 7.090 3.507 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.330 6.582 5.636 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.774 4.770 6.460 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -9.520 6.372 6.674 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.066 5.305 5.359 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -7.189 4.363 4.587 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.377 4.870 3.363 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -6.789 5.669 3.447 1.00 0.00 H new ATOM 1048 N LEU A 70 -8.477 8.306 1.307 1.00 0.00 N ATOM 1049 CA LEU A 70 -8.390 8.043 -0.119 1.00 0.00 C ATOM 1050 C LEU A 70 -7.027 8.506 -0.637 1.00 0.00 C ATOM 1051 O LEU A 70 -6.366 7.788 -1.384 1.00 0.00 O ATOM 1052 CB LEU A 70 -9.574 8.675 -0.853 1.00 0.00 C ATOM 1053 CG LEU A 70 -10.857 7.843 -0.899 1.00 0.00 C ATOM 1054 CD1 LEU A 70 -12.090 8.724 -0.688 1.00 0.00 C ATOM 1055 CD2 LEU A 70 -10.942 7.038 -2.198 1.00 0.00 C ATOM 0 H LEU A 70 -9.363 8.707 1.614 1.00 0.00 H new ATOM 0 HA LEU A 70 -8.458 6.973 -0.314 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -9.801 9.630 -0.380 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -9.268 8.891 -1.877 1.00 0.00 H new ATOM 0 HG LEU A 70 -10.830 7.127 -0.078 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -12.988 8.108 -0.725 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -12.026 9.213 0.284 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -12.136 9.480 -1.472 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -11.863 6.455 -2.205 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -10.936 7.719 -3.049 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -10.087 6.365 -2.266 1.00 0.00 H new ATOM 1067 N VAL A 71 -6.647 9.705 -0.219 1.00 0.00 N ATOM 1068 CA VAL A 71 -5.375 10.273 -0.631 1.00 0.00 C ATOM 1069 C VAL A 71 -4.263 9.249 -0.393 1.00 0.00 C ATOM 1070 O VAL A 71 -3.382 9.077 -1.234 1.00 0.00 O ATOM 1071 CB VAL A 71 -5.133 11.597 0.096 1.00 0.00 C ATOM 1072 CG1 VAL A 71 -3.637 11.898 0.205 1.00 0.00 C ATOM 1073 CG2 VAL A 71 -5.873 12.745 -0.595 1.00 0.00 C ATOM 0 H VAL A 71 -7.198 10.299 0.401 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.386 10.500 -1.697 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.530 11.501 1.107 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.493 12.845 0.726 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -3.145 11.100 0.761 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.206 11.964 -0.794 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.684 13.675 -0.058 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.519 12.840 -1.622 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.943 12.539 -0.598 1.00 0.00 H new ATOM 1083 N ASN A 72 -4.341 8.595 0.757 1.00 0.00 N ATOM 1084 CA ASN A 72 -3.353 7.592 1.116 1.00 0.00 C ATOM 1085 C ASN A 72 -3.605 6.320 0.305 1.00 0.00 C ATOM 1086 O ASN A 72 -2.688 5.780 -0.313 1.00 0.00 O ATOM 1087 CB ASN A 72 -3.446 7.234 2.600 1.00 0.00 C ATOM 1088 CG ASN A 72 -3.734 8.475 3.447 1.00 0.00 C ATOM 1089 OD1 ASN A 72 -3.473 9.600 3.055 1.00 0.00 O ATOM 1090 ND2 ASN A 72 -4.285 8.208 4.628 1.00 0.00 N ATOM 0 H ASN A 72 -5.073 8.740 1.452 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.365 8.002 0.905 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -4.234 6.496 2.751 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.513 6.775 2.926 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -4.515 8.969 5.267 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -4.478 7.242 4.894 1.00 0.00 H new ATOM 1097 N LEU A 73 -4.854 5.876 0.334 1.00 0.00 N ATOM 1098 CA LEU A 73 -5.238 4.677 -0.391 1.00 0.00 C ATOM 1099 C LEU A 73 -4.700 4.756 -1.821 1.00 0.00 C ATOM 1100 O LEU A 73 -4.119 3.795 -2.323 1.00 0.00 O ATOM 1101 CB LEU A 73 -6.752 4.467 -0.314 1.00 0.00 C ATOM 1102 CG LEU A 73 -7.356 4.445 1.092 1.00 0.00 C ATOM 1103 CD1 LEU A 73 -8.876 4.288 1.033 1.00 0.00 C ATOM 1104 CD2 LEU A 73 -6.701 3.363 1.953 1.00 0.00 C ATOM 0 H LEU A 73 -5.612 6.325 0.848 1.00 0.00 H new ATOM 0 HA LEU A 73 -4.793 3.795 0.069 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -7.238 5.259 -0.884 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.994 3.525 -0.806 1.00 0.00 H new ATOM 0 HG LEU A 73 -7.150 5.404 1.568 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -9.280 4.275 2.045 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -9.307 5.123 0.481 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -9.126 3.353 0.531 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -7.148 3.369 2.947 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -6.855 2.388 1.491 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -5.632 3.561 2.035 1.00 0.00 H new ATOM 1116 N ARG A 74 -4.914 5.909 -2.437 1.00 0.00 N ATOM 1117 CA ARG A 74 -4.457 6.126 -3.799 1.00 0.00 C ATOM 1118 C ARG A 74 -2.929 6.105 -3.857 1.00 0.00 C ATOM 1119 O ARG A 74 -2.346 5.526 -4.773 1.00 0.00 O ATOM 1120 CB ARG A 74 -4.963 7.464 -4.343 1.00 0.00 C ATOM 1121 CG ARG A 74 -6.434 7.369 -4.751 1.00 0.00 C ATOM 1122 CD ARG A 74 -7.100 8.746 -4.724 1.00 0.00 C ATOM 1123 NE ARG A 74 -8.039 8.877 -5.861 1.00 0.00 N ATOM 1124 CZ ARG A 74 -9.155 8.150 -6.001 1.00 0.00 C ATOM 1125 NH1 ARG A 74 -9.480 7.236 -5.077 1.00 0.00 N ATOM 1126 NH2 ARG A 74 -9.947 8.337 -7.065 1.00 0.00 N ATOM 0 H ARG A 74 -5.398 6.703 -2.018 1.00 0.00 H new ATOM 0 HA ARG A 74 -4.858 5.321 -4.415 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -4.841 8.238 -3.585 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -4.362 7.762 -5.202 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -6.511 6.943 -5.752 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -6.960 6.694 -4.076 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -7.634 8.883 -3.783 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -6.341 9.527 -4.776 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.822 9.564 -6.583 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -8.877 7.094 -4.266 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -10.330 6.683 -5.184 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -9.700 9.033 -7.769 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -10.797 7.783 -7.172 1.00 0.00 H new ATOM 1140 N ALA A 75 -2.322 6.743 -2.867 1.00 0.00 N ATOM 1141 CA ALA A 75 -0.872 6.804 -2.793 1.00 0.00 C ATOM 1142 C ALA A 75 -0.308 5.383 -2.738 1.00 0.00 C ATOM 1143 O ALA A 75 0.540 5.016 -3.550 1.00 0.00 O ATOM 1144 CB ALA A 75 -0.457 7.643 -1.583 1.00 0.00 C ATOM 0 H ALA A 75 -2.808 7.222 -2.109 1.00 0.00 H new ATOM 0 HA ALA A 75 -0.463 7.287 -3.680 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.631 7.689 -1.528 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.858 8.652 -1.685 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.848 7.187 -0.673 1.00 0.00 H new ATOM 1150 N MET A 76 -0.801 4.622 -1.773 1.00 0.00 N ATOM 1151 CA MET A 76 -0.357 3.249 -1.601 1.00 0.00 C ATOM 1152 C MET A 76 -0.413 2.485 -2.926 1.00 0.00 C ATOM 1153 O MET A 76 0.617 2.051 -3.440 1.00 0.00 O ATOM 1154 CB MET A 76 -1.245 2.549 -0.570 1.00 0.00 C ATOM 1155 CG MET A 76 -0.969 3.077 0.839 1.00 0.00 C ATOM 1156 SD MET A 76 -2.066 2.296 2.009 1.00 0.00 S ATOM 1157 CE MET A 76 -3.127 3.675 2.408 1.00 0.00 C ATOM 0 H MET A 76 -1.504 4.930 -1.101 1.00 0.00 H new ATOM 0 HA MET A 76 0.676 3.262 -1.253 1.00 0.00 H new ATOM 0 HB2 MET A 76 -2.294 2.705 -0.822 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.067 1.474 -0.601 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.068 2.881 1.113 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.107 4.158 0.865 1.00 0.00 H new ATOM 0 HE1 MET A 76 -3.855 3.369 3.160 1.00 0.00 H new ATOM 0 HE2 MET A 76 -2.525 4.496 2.799 1.00 0.00 H new ATOM 0 HE3 MET A 76 -3.650 4.004 1.510 1.00 0.00 H new ATOM 1167 N GLN A 77 -1.626 2.344 -3.440 1.00 0.00 N ATOM 1168 CA GLN A 77 -1.830 1.641 -4.695 1.00 0.00 C ATOM 1169 C GLN A 77 -0.786 2.078 -5.724 1.00 0.00 C ATOM 1170 O GLN A 77 -0.348 1.276 -6.548 1.00 0.00 O ATOM 1171 CB GLN A 77 -3.248 1.863 -5.224 1.00 0.00 C ATOM 1172 CG GLN A 77 -3.519 0.989 -6.450 1.00 0.00 C ATOM 1173 CD GLN A 77 -4.240 -0.301 -6.056 1.00 0.00 C ATOM 1174 OE1 GLN A 77 -5.211 -0.300 -5.318 1.00 0.00 O ATOM 1175 NE2 GLN A 77 -3.712 -1.400 -6.588 1.00 0.00 N ATOM 0 H GLN A 77 -2.478 2.705 -3.010 1.00 0.00 H new ATOM 0 HA GLN A 77 -1.708 0.573 -4.514 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -3.972 1.633 -4.442 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -3.383 2.913 -5.484 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -4.123 1.542 -7.169 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.578 0.747 -6.944 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -2.898 -1.331 -7.198 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -4.121 -2.312 -6.385 1.00 0.00 H new ATOM 1184 N ASN A 78 -0.417 3.348 -5.644 1.00 0.00 N ATOM 1185 CA ASN A 78 0.567 3.901 -6.558 1.00 0.00 C ATOM 1186 C ASN A 78 1.915 3.217 -6.324 1.00 0.00 C ATOM 1187 O ASN A 78 2.610 2.864 -7.276 1.00 0.00 O ATOM 1188 CB ASN A 78 0.752 5.402 -6.327 1.00 0.00 C ATOM 1189 CG ASN A 78 0.742 6.167 -7.652 1.00 0.00 C ATOM 1190 OD1 ASN A 78 1.136 5.664 -8.691 1.00 0.00 O ATOM 1191 ND2 ASN A 78 0.272 7.407 -7.557 1.00 0.00 N ATOM 0 H ASN A 78 -0.782 4.010 -4.960 1.00 0.00 H new ATOM 0 HA ASN A 78 0.213 3.734 -7.575 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -0.044 5.775 -5.682 1.00 0.00 H new ATOM 0 HB3 ASN A 78 1.694 5.580 -5.807 1.00 0.00 H new ATOM 0 HD21 ASN A 78 0.225 8.000 -8.386 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.042 7.766 -6.655 1.00 0.00 H new ATOM 1198 N PHE A 79 2.245 3.050 -5.052 1.00 0.00 N ATOM 1199 CA PHE A 79 3.498 2.414 -4.681 1.00 0.00 C ATOM 1200 C PHE A 79 3.458 0.913 -4.972 1.00 0.00 C ATOM 1201 O PHE A 79 4.462 0.329 -5.379 1.00 0.00 O ATOM 1202 CB PHE A 79 3.678 2.625 -3.176 1.00 0.00 C ATOM 1203 CG PHE A 79 4.812 1.801 -2.564 1.00 0.00 C ATOM 1204 CD1 PHE A 79 6.102 2.048 -2.920 1.00 0.00 C ATOM 1205 CD2 PHE A 79 4.531 0.822 -1.663 1.00 0.00 C ATOM 1206 CE1 PHE A 79 7.154 1.283 -2.351 1.00 0.00 C ATOM 1207 CE2 PHE A 79 5.584 0.057 -1.094 1.00 0.00 C ATOM 1208 CZ PHE A 79 6.873 0.303 -1.450 1.00 0.00 C ATOM 0 H PHE A 79 1.667 3.344 -4.265 1.00 0.00 H new ATOM 0 HA PHE A 79 4.319 2.846 -5.254 1.00 0.00 H new ATOM 0 HB2 PHE A 79 3.868 3.682 -2.988 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.746 2.374 -2.670 1.00 0.00 H new ATOM 0 HD1 PHE A 79 6.325 2.826 -3.635 1.00 0.00 H new ATOM 0 HD2 PHE A 79 3.507 0.626 -1.380 1.00 0.00 H new ATOM 0 HE1 PHE A 79 8.178 1.479 -2.633 1.00 0.00 H new ATOM 0 HE2 PHE A 79 5.361 -0.720 -0.378 1.00 0.00 H new ATOM 0 HZ PHE A 79 7.673 -0.279 -1.018 1.00 0.00 H new ATOM 1218 N LEU A 80 2.289 0.330 -4.752 1.00 0.00 N ATOM 1219 CA LEU A 80 2.105 -1.092 -4.985 1.00 0.00 C ATOM 1220 C LEU A 80 2.094 -1.360 -6.492 1.00 0.00 C ATOM 1221 O LEU A 80 2.235 -2.503 -6.924 1.00 0.00 O ATOM 1222 CB LEU A 80 0.855 -1.597 -4.262 1.00 0.00 C ATOM 1223 CG LEU A 80 0.857 -1.452 -2.739 1.00 0.00 C ATOM 1224 CD1 LEU A 80 -0.539 -1.696 -2.163 1.00 0.00 C ATOM 1225 CD2 LEU A 80 1.907 -2.365 -2.102 1.00 0.00 C ATOM 0 H LEU A 80 1.459 0.817 -4.414 1.00 0.00 H new ATOM 0 HA LEU A 80 2.937 -1.657 -4.566 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.010 -1.063 -4.657 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.718 -2.650 -4.507 1.00 0.00 H new ATOM 0 HG LEU A 80 1.132 -0.426 -2.495 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.509 -1.587 -1.079 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.237 -0.971 -2.582 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.866 -2.704 -2.417 1.00 0.00 H new ATOM 0 HD21 LEU A 80 1.887 -2.242 -1.019 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.688 -3.403 -2.354 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.895 -2.101 -2.479 1.00 0.00 H new ATOM 1237 N ASN A 81 1.926 -0.287 -7.250 1.00 0.00 N ATOM 1238 CA ASN A 81 1.895 -0.391 -8.699 1.00 0.00 C ATOM 1239 C ASN A 81 3.328 -0.432 -9.234 1.00 0.00 C ATOM 1240 O ASN A 81 3.554 -0.802 -10.385 1.00 0.00 O ATOM 1241 CB ASN A 81 1.191 0.815 -9.324 1.00 0.00 C ATOM 1242 CG ASN A 81 -0.273 0.495 -9.635 1.00 0.00 C ATOM 1243 OD1 ASN A 81 -0.714 -0.641 -9.572 1.00 0.00 O ATOM 1244 ND2 ASN A 81 -0.998 1.557 -9.972 1.00 0.00 N ATOM 0 H ASN A 81 1.810 0.659 -6.888 1.00 0.00 H new ATOM 0 HA ASN A 81 1.352 -1.300 -8.960 1.00 0.00 H new ATOM 0 HB2 ASN A 81 1.245 1.665 -8.643 1.00 0.00 H new ATOM 0 HB3 ASN A 81 1.706 1.107 -10.239 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -1.987 1.449 -10.198 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -0.565 2.480 -10.005 1.00 0.00 H new ATOM 1251 N LEU A 82 4.258 -0.045 -8.373 1.00 0.00 N ATOM 1252 CA LEU A 82 5.662 -0.033 -8.745 1.00 0.00 C ATOM 1253 C LEU A 82 6.160 -1.473 -8.891 1.00 0.00 C ATOM 1254 O LEU A 82 5.537 -2.403 -8.382 1.00 0.00 O ATOM 1255 CB LEU A 82 6.473 0.800 -7.749 1.00 0.00 C ATOM 1256 CG LEU A 82 6.396 2.318 -7.926 1.00 0.00 C ATOM 1257 CD1 LEU A 82 7.269 3.034 -6.894 1.00 0.00 C ATOM 1258 CD2 LEU A 82 6.752 2.722 -9.358 1.00 0.00 C ATOM 0 H LEU A 82 4.066 0.262 -7.419 1.00 0.00 H new ATOM 0 HA LEU A 82 5.795 0.450 -9.713 1.00 0.00 H new ATOM 0 HB2 LEU A 82 6.137 0.554 -6.742 1.00 0.00 H new ATOM 0 HB3 LEU A 82 7.518 0.498 -7.819 1.00 0.00 H new ATOM 0 HG LEU A 82 5.367 2.631 -7.750 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.197 4.112 -7.041 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.927 2.781 -5.890 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.306 2.720 -7.014 1.00 0.00 H new ATOM 0 HD21 LEU A 82 6.689 3.806 -9.457 1.00 0.00 H new ATOM 0 HD22 LEU A 82 7.766 2.395 -9.587 1.00 0.00 H new ATOM 0 HD23 LEU A 82 6.054 2.254 -10.052 1.00 0.00 H new ATOM 1270 N PRO A 83 7.307 -1.614 -9.607 1.00 0.00 N ATOM 1271 CA PRO A 83 7.895 -2.925 -9.826 1.00 0.00 C ATOM 1272 C PRO A 83 8.583 -3.436 -8.559 1.00 0.00 C ATOM 1273 O PRO A 83 9.216 -2.667 -7.838 1.00 0.00 O ATOM 1274 CB PRO A 83 8.857 -2.735 -10.988 1.00 0.00 C ATOM 1275 CG PRO A 83 9.118 -1.240 -11.073 1.00 0.00 C ATOM 1276 CD PRO A 83 8.072 -0.535 -10.225 1.00 0.00 C ATOM 0 HA PRO A 83 7.151 -3.686 -10.062 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.784 -3.284 -10.822 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.427 -3.110 -11.917 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.121 -1.007 -10.714 1.00 0.00 H new ATOM 0 HG3 PRO A 83 9.062 -0.901 -12.107 1.00 0.00 H new ATOM 0 HD2 PRO A 83 8.536 0.102 -9.473 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.433 0.104 -10.834 1.00 0.00 H new ATOM 1284 N GLU A 84 8.434 -4.732 -8.325 1.00 0.00 N ATOM 1285 CA GLU A 84 9.032 -5.356 -7.157 1.00 0.00 C ATOM 1286 C GLU A 84 10.458 -4.841 -6.953 1.00 0.00 C ATOM 1287 O GLU A 84 10.870 -4.574 -5.825 1.00 0.00 O ATOM 1288 CB GLU A 84 9.012 -6.881 -7.279 1.00 0.00 C ATOM 1289 CG GLU A 84 9.771 -7.533 -6.122 1.00 0.00 C ATOM 1290 CD GLU A 84 9.380 -9.004 -5.970 1.00 0.00 C ATOM 1291 OE1 GLU A 84 8.362 -9.253 -5.288 1.00 0.00 O ATOM 1292 OE2 GLU A 84 10.108 -9.847 -6.538 1.00 0.00 O ATOM 0 H GLU A 84 7.907 -5.367 -8.925 1.00 0.00 H new ATOM 0 HA GLU A 84 8.440 -5.087 -6.282 1.00 0.00 H new ATOM 0 HB2 GLU A 84 7.981 -7.235 -7.288 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.460 -7.180 -8.227 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.844 -7.454 -6.296 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.558 -6.999 -5.196 1.00 0.00 H new ATOM 1299 N VAL A 85 11.173 -4.717 -8.062 1.00 0.00 N ATOM 1300 CA VAL A 85 12.545 -4.239 -8.019 1.00 0.00 C ATOM 1301 C VAL A 85 12.586 -2.886 -7.306 1.00 0.00 C ATOM 1302 O VAL A 85 13.489 -2.626 -6.512 1.00 0.00 O ATOM 1303 CB VAL A 85 13.126 -4.188 -9.433 1.00 0.00 C ATOM 1304 CG1 VAL A 85 12.635 -5.371 -10.270 1.00 0.00 C ATOM 1305 CG2 VAL A 85 12.794 -2.859 -10.114 1.00 0.00 C ATOM 0 H VAL A 85 10.828 -4.939 -8.996 1.00 0.00 H new ATOM 0 HA VAL A 85 13.172 -4.926 -7.450 1.00 0.00 H new ATOM 0 HB VAL A 85 14.211 -4.262 -9.353 1.00 0.00 H new ATOM 0 HG11 VAL A 85 13.063 -5.311 -11.271 1.00 0.00 H new ATOM 0 HG12 VAL A 85 12.945 -6.304 -9.798 1.00 0.00 H new ATOM 0 HG13 VAL A 85 11.547 -5.342 -10.338 1.00 0.00 H new ATOM 0 HG21 VAL A 85 13.219 -2.849 -11.118 1.00 0.00 H new ATOM 0 HG22 VAL A 85 11.712 -2.742 -10.176 1.00 0.00 H new ATOM 0 HG23 VAL A 85 13.215 -2.038 -9.534 1.00 0.00 H new ATOM 1315 N GLU A 86 11.598 -2.059 -7.615 1.00 0.00 N ATOM 1316 CA GLU A 86 11.511 -0.740 -7.014 1.00 0.00 C ATOM 1317 C GLU A 86 11.222 -0.857 -5.516 1.00 0.00 C ATOM 1318 O GLU A 86 12.021 -0.418 -4.690 1.00 0.00 O ATOM 1319 CB GLU A 86 10.448 0.112 -7.712 1.00 0.00 C ATOM 1320 CG GLU A 86 11.049 0.878 -8.892 1.00 0.00 C ATOM 1321 CD GLU A 86 10.070 1.931 -9.417 1.00 0.00 C ATOM 1322 OE1 GLU A 86 9.791 2.878 -8.651 1.00 0.00 O ATOM 1323 OE2 GLU A 86 9.623 1.764 -10.573 1.00 0.00 O ATOM 0 H GLU A 86 10.851 -2.277 -8.274 1.00 0.00 H new ATOM 0 HA GLU A 86 12.471 -0.241 -7.141 1.00 0.00 H new ATOM 0 HB2 GLU A 86 9.638 -0.527 -8.063 1.00 0.00 H new ATOM 0 HB3 GLU A 86 10.015 0.815 -7.000 1.00 0.00 H new ATOM 0 HG2 GLU A 86 11.976 1.360 -8.583 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.303 0.182 -9.691 1.00 0.00 H new ATOM 1330 N ARG A 87 10.078 -1.451 -5.211 1.00 0.00 N ATOM 1331 CA ARG A 87 9.674 -1.631 -3.827 1.00 0.00 C ATOM 1332 C ARG A 87 10.762 -2.373 -3.049 1.00 0.00 C ATOM 1333 O ARG A 87 11.122 -1.973 -1.943 1.00 0.00 O ATOM 1334 CB ARG A 87 8.364 -2.416 -3.733 1.00 0.00 C ATOM 1335 CG ARG A 87 7.275 -1.769 -4.592 1.00 0.00 C ATOM 1336 CD ARG A 87 5.912 -2.411 -4.323 1.00 0.00 C ATOM 1337 NE ARG A 87 5.737 -3.605 -5.179 1.00 0.00 N ATOM 1338 CZ ARG A 87 6.195 -4.825 -4.869 1.00 0.00 C ATOM 1339 NH1 ARG A 87 6.859 -5.020 -3.721 1.00 0.00 N ATOM 1340 NH2 ARG A 87 5.990 -5.851 -5.707 1.00 0.00 N ATOM 0 H ARG A 87 9.418 -1.814 -5.899 1.00 0.00 H new ATOM 0 HA ARG A 87 9.523 -0.642 -3.394 1.00 0.00 H new ATOM 0 HB2 ARG A 87 8.527 -3.443 -4.059 1.00 0.00 H new ATOM 0 HB3 ARG A 87 8.035 -2.459 -2.695 1.00 0.00 H new ATOM 0 HG2 ARG A 87 7.226 -0.701 -4.380 1.00 0.00 H new ATOM 0 HG3 ARG A 87 7.529 -1.874 -5.647 1.00 0.00 H new ATOM 0 HD2 ARG A 87 5.834 -2.692 -3.273 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.117 -1.692 -4.521 1.00 0.00 H new ATOM 0 HE ARG A 87 5.236 -3.492 -6.060 1.00 0.00 H new ATOM 0 HH11 ARG A 87 7.016 -4.239 -3.083 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.208 -5.949 -3.485 1.00 0.00 H new ATOM 0 HH21 ARG A 87 5.485 -5.703 -6.581 1.00 0.00 H new ATOM 0 HH22 ARG A 87 6.339 -6.780 -5.471 1.00 0.00 H new ATOM 1354 N ASP A 88 11.255 -3.442 -3.657 1.00 0.00 N ATOM 1355 CA ASP A 88 12.294 -4.244 -3.035 1.00 0.00 C ATOM 1356 C ASP A 88 13.452 -3.336 -2.616 1.00 0.00 C ATOM 1357 O ASP A 88 13.893 -3.375 -1.469 1.00 0.00 O ATOM 1358 CB ASP A 88 12.842 -5.289 -4.010 1.00 0.00 C ATOM 1359 CG ASP A 88 14.102 -6.016 -3.537 1.00 0.00 C ATOM 1360 OD1 ASP A 88 14.391 -5.923 -2.325 1.00 0.00 O ATOM 1361 OD2 ASP A 88 14.748 -6.650 -4.399 1.00 0.00 O ATOM 0 H ASP A 88 10.954 -3.771 -4.574 1.00 0.00 H new ATOM 0 HA ASP A 88 11.859 -4.749 -2.172 1.00 0.00 H new ATOM 0 HB2 ASP A 88 12.064 -6.028 -4.202 1.00 0.00 H new ATOM 0 HB3 ASP A 88 13.058 -4.800 -4.960 1.00 0.00 H new ATOM 1366 N ARG A 89 13.910 -2.538 -3.569 1.00 0.00 N ATOM 1367 CA ARG A 89 15.008 -1.620 -3.314 1.00 0.00 C ATOM 1368 C ARG A 89 14.553 -0.495 -2.383 1.00 0.00 C ATOM 1369 O ARG A 89 15.259 -0.142 -1.439 1.00 0.00 O ATOM 1370 CB ARG A 89 15.534 -1.014 -4.617 1.00 0.00 C ATOM 1371 CG ARG A 89 17.042 -1.231 -4.752 1.00 0.00 C ATOM 1372 CD ARG A 89 17.441 -1.412 -6.219 1.00 0.00 C ATOM 1373 NE ARG A 89 18.857 -1.832 -6.310 1.00 0.00 N ATOM 1374 CZ ARG A 89 19.562 -1.852 -7.449 1.00 0.00 C ATOM 1375 NH1 ARG A 89 18.988 -1.475 -8.600 1.00 0.00 N ATOM 1376 NH2 ARG A 89 20.842 -2.248 -7.438 1.00 0.00 N ATOM 0 H ARG A 89 13.541 -2.508 -4.519 1.00 0.00 H new ATOM 0 HA ARG A 89 15.810 -2.186 -2.841 1.00 0.00 H new ATOM 0 HB2 ARG A 89 15.020 -1.466 -5.466 1.00 0.00 H new ATOM 0 HB3 ARG A 89 15.313 0.053 -4.642 1.00 0.00 H new ATOM 0 HG2 ARG A 89 17.575 -0.379 -4.329 1.00 0.00 H new ATOM 0 HG3 ARG A 89 17.339 -2.110 -4.179 1.00 0.00 H new ATOM 0 HD2 ARG A 89 16.801 -2.158 -6.689 1.00 0.00 H new ATOM 0 HD3 ARG A 89 17.294 -0.478 -6.762 1.00 0.00 H new ATOM 0 HE ARG A 89 19.325 -2.124 -5.452 1.00 0.00 H new ATOM 0 HH11 ARG A 89 18.014 -1.173 -8.609 1.00 0.00 H new ATOM 0 HH12 ARG A 89 19.525 -1.490 -9.467 1.00 0.00 H new ATOM 0 HH21 ARG A 89 21.280 -2.534 -6.562 1.00 0.00 H new ATOM 0 HH22 ARG A 89 21.379 -2.263 -8.305 1.00 0.00 H new ATOM 1390 N ILE A 90 13.377 0.038 -2.681 1.00 0.00 N ATOM 1391 CA ILE A 90 12.820 1.116 -1.883 1.00 0.00 C ATOM 1392 C ILE A 90 12.826 0.709 -0.408 1.00 0.00 C ATOM 1393 O ILE A 90 13.263 1.476 0.449 1.00 0.00 O ATOM 1394 CB ILE A 90 11.437 1.511 -2.406 1.00 0.00 C ATOM 1395 CG1 ILE A 90 11.542 2.197 -3.769 1.00 0.00 C ATOM 1396 CG2 ILE A 90 10.691 2.374 -1.386 1.00 0.00 C ATOM 1397 CD1 ILE A 90 10.212 2.127 -4.522 1.00 0.00 C ATOM 0 H ILE A 90 12.795 -0.257 -3.465 1.00 0.00 H new ATOM 0 HA ILE A 90 13.436 2.011 -1.970 1.00 0.00 H new ATOM 0 HB ILE A 90 10.853 0.602 -2.547 1.00 0.00 H new ATOM 0 HG12 ILE A 90 11.833 3.239 -3.634 1.00 0.00 H new ATOM 0 HG13 ILE A 90 12.324 1.721 -4.360 1.00 0.00 H new ATOM 0 HG21 ILE A 90 9.711 2.641 -1.782 1.00 0.00 H new ATOM 0 HG22 ILE A 90 10.567 1.816 -0.458 1.00 0.00 H new ATOM 0 HG23 ILE A 90 11.262 3.281 -1.190 1.00 0.00 H new ATOM 0 HD11 ILE A 90 10.314 2.622 -5.488 1.00 0.00 H new ATOM 0 HD12 ILE A 90 9.936 1.084 -4.676 1.00 0.00 H new ATOM 0 HD13 ILE A 90 9.437 2.625 -3.939 1.00 0.00 H new ATOM 1409 N TYR A 91 12.337 -0.496 -0.158 1.00 0.00 N ATOM 1410 CA TYR A 91 12.281 -1.015 1.198 1.00 0.00 C ATOM 1411 C TYR A 91 13.675 -1.059 1.827 1.00 0.00 C ATOM 1412 O TYR A 91 13.864 -0.617 2.959 1.00 0.00 O ATOM 1413 CB TYR A 91 11.741 -2.442 1.083 1.00 0.00 C ATOM 1414 CG TYR A 91 10.267 -2.518 0.681 1.00 0.00 C ATOM 1415 CD1 TYR A 91 9.345 -1.682 1.277 1.00 0.00 C ATOM 1416 CD2 TYR A 91 9.859 -3.424 -0.277 1.00 0.00 C ATOM 1417 CE1 TYR A 91 7.957 -1.754 0.900 1.00 0.00 C ATOM 1418 CE2 TYR A 91 8.471 -3.496 -0.655 1.00 0.00 C ATOM 1419 CZ TYR A 91 7.589 -2.658 -0.048 1.00 0.00 C ATOM 1420 OH TYR A 91 6.278 -2.726 -0.405 1.00 0.00 O ATOM 0 H TYR A 91 11.976 -1.129 -0.872 1.00 0.00 H new ATOM 0 HA TYR A 91 11.654 -0.381 1.825 1.00 0.00 H new ATOM 0 HB2 TYR A 91 12.336 -2.987 0.350 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.873 -2.948 2.039 1.00 0.00 H new ATOM 0 HD1 TYR A 91 9.665 -0.973 2.027 1.00 0.00 H new ATOM 0 HD2 TYR A 91 10.580 -4.079 -0.743 1.00 0.00 H new ATOM 0 HE1 TYR A 91 7.225 -1.106 1.359 1.00 0.00 H new ATOM 0 HE2 TYR A 91 8.138 -4.200 -1.404 1.00 0.00 H new ATOM 0 HH TYR A 91 6.056 -1.965 -0.982 1.00 0.00 H new ATOM 1430 N GLN A 92 14.616 -1.597 1.064 1.00 0.00 N ATOM 1431 CA GLN A 92 15.987 -1.705 1.532 1.00 0.00 C ATOM 1432 C GLN A 92 16.614 -0.316 1.663 1.00 0.00 C ATOM 1433 O GLN A 92 17.366 -0.056 2.601 1.00 0.00 O ATOM 1434 CB GLN A 92 16.815 -2.595 0.602 1.00 0.00 C ATOM 1435 CG GLN A 92 17.744 -1.755 -0.277 1.00 0.00 C ATOM 1436 CD GLN A 92 18.495 -2.635 -1.278 1.00 0.00 C ATOM 1437 OE1 GLN A 92 18.367 -3.848 -1.296 1.00 0.00 O ATOM 1438 NE2 GLN A 92 19.284 -1.958 -2.107 1.00 0.00 N ATOM 0 H GLN A 92 14.456 -1.963 0.125 1.00 0.00 H new ATOM 0 HA GLN A 92 15.979 -2.173 2.517 1.00 0.00 H new ATOM 0 HB2 GLN A 92 17.404 -3.296 1.193 1.00 0.00 H new ATOM 0 HB3 GLN A 92 16.151 -3.187 -0.027 1.00 0.00 H new ATOM 0 HG2 GLN A 92 17.163 -1.004 -0.812 1.00 0.00 H new ATOM 0 HG3 GLN A 92 18.458 -1.220 0.349 1.00 0.00 H new ATOM 0 HE21 GLN A 92 19.345 -0.942 -2.038 1.00 0.00 H new ATOM 0 HE22 GLN A 92 19.828 -2.455 -2.812 1.00 0.00 H new ATOM 1447 N ASP A 93 16.282 0.541 0.708 1.00 0.00 N ATOM 1448 CA ASP A 93 16.803 1.897 0.705 1.00 0.00 C ATOM 1449 C ASP A 93 16.117 2.705 1.809 1.00 0.00 C ATOM 1450 O ASP A 93 16.718 3.612 2.384 1.00 0.00 O ATOM 1451 CB ASP A 93 16.525 2.591 -0.630 1.00 0.00 C ATOM 1452 CG ASP A 93 17.718 3.337 -1.231 1.00 0.00 C ATOM 1453 OD1 ASP A 93 18.059 4.404 -0.675 1.00 0.00 O ATOM 1454 OD2 ASP A 93 18.262 2.825 -2.233 1.00 0.00 O ATOM 0 H ASP A 93 15.658 0.322 -0.069 1.00 0.00 H new ATOM 0 HA ASP A 93 17.880 1.845 0.867 1.00 0.00 H new ATOM 0 HB2 ASP A 93 16.184 1.844 -1.347 1.00 0.00 H new ATOM 0 HB3 ASP A 93 15.706 3.297 -0.492 1.00 0.00 H new ATOM 1459 N GLU A 94 14.870 2.346 2.073 1.00 0.00 N ATOM 1460 CA GLU A 94 14.096 3.026 3.098 1.00 0.00 C ATOM 1461 C GLU A 94 14.443 2.471 4.481 1.00 0.00 C ATOM 1462 O GLU A 94 14.553 3.224 5.447 1.00 0.00 O ATOM 1463 CB GLU A 94 12.596 2.909 2.821 1.00 0.00 C ATOM 1464 CG GLU A 94 11.786 3.080 4.107 1.00 0.00 C ATOM 1465 CD GLU A 94 12.256 4.306 4.892 1.00 0.00 C ATOM 1466 OE1 GLU A 94 12.622 5.300 4.228 1.00 0.00 O ATOM 1467 OE2 GLU A 94 12.238 4.222 6.140 1.00 0.00 O ATOM 0 H GLU A 94 14.376 1.593 1.595 1.00 0.00 H new ATOM 0 HA GLU A 94 14.354 4.085 3.078 1.00 0.00 H new ATOM 0 HB2 GLU A 94 12.297 3.665 2.095 1.00 0.00 H new ATOM 0 HB3 GLU A 94 12.379 1.937 2.377 1.00 0.00 H new ATOM 0 HG2 GLU A 94 10.728 3.183 3.864 1.00 0.00 H new ATOM 0 HG3 GLU A 94 11.886 2.188 4.725 1.00 0.00 H new ATOM 1474 N ARG A 95 14.605 1.157 4.532 1.00 0.00 N ATOM 1475 CA ARG A 95 14.937 0.492 5.780 1.00 0.00 C ATOM 1476 C ARG A 95 16.226 1.072 6.365 1.00 0.00 C ATOM 1477 O ARG A 95 16.334 1.261 7.575 1.00 0.00 O ATOM 1478 CB ARG A 95 15.112 -1.014 5.573 1.00 0.00 C ATOM 1479 CG ARG A 95 13.761 -1.732 5.601 1.00 0.00 C ATOM 1480 CD ARG A 95 13.864 -3.119 4.963 1.00 0.00 C ATOM 1481 NE ARG A 95 14.573 -4.044 5.875 1.00 0.00 N ATOM 1482 CZ ARG A 95 13.987 -4.694 6.890 1.00 0.00 C ATOM 1483 NH1 ARG A 95 12.679 -4.522 7.130 1.00 0.00 N ATOM 1484 NH2 ARG A 95 14.708 -5.514 7.666 1.00 0.00 N ATOM 0 H ARG A 95 14.512 0.535 3.729 1.00 0.00 H new ATOM 0 HA ARG A 95 14.112 0.659 6.473 1.00 0.00 H new ATOM 0 HB2 ARG A 95 15.606 -1.199 4.619 1.00 0.00 H new ATOM 0 HB3 ARG A 95 15.759 -1.419 6.351 1.00 0.00 H new ATOM 0 HG2 ARG A 95 13.416 -1.826 6.631 1.00 0.00 H new ATOM 0 HG3 ARG A 95 13.018 -1.137 5.069 1.00 0.00 H new ATOM 0 HD2 ARG A 95 12.867 -3.503 4.745 1.00 0.00 H new ATOM 0 HD3 ARG A 95 14.395 -3.053 4.013 1.00 0.00 H new ATOM 0 HE ARG A 95 15.570 -4.196 5.722 1.00 0.00 H new ATOM 0 HH11 ARG A 95 12.130 -3.897 6.540 1.00 0.00 H new ATOM 0 HH12 ARG A 95 12.233 -5.017 7.902 1.00 0.00 H new ATOM 0 HH21 ARG A 95 15.703 -5.644 7.484 1.00 0.00 H new ATOM 0 HH22 ARG A 95 14.262 -6.009 8.438 1.00 0.00 H new ATOM 1498 N SER A 96 17.173 1.340 5.477 1.00 0.00 N ATOM 1499 CA SER A 96 18.450 1.895 5.889 1.00 0.00 C ATOM 1500 C SER A 96 19.051 1.048 7.013 1.00 0.00 C ATOM 1501 O SER A 96 18.932 1.395 8.187 1.00 0.00 O ATOM 1502 CB SER A 96 18.299 3.348 6.343 1.00 0.00 C ATOM 1503 OG SER A 96 17.881 4.199 5.278 1.00 0.00 O ATOM 0 H SER A 96 17.080 1.183 4.473 1.00 0.00 H new ATOM 0 HA SER A 96 19.122 1.879 5.031 1.00 0.00 H new ATOM 0 HB2 SER A 96 17.574 3.401 7.155 1.00 0.00 H new ATOM 0 HB3 SER A 96 19.249 3.704 6.740 1.00 0.00 H new ATOM 0 HG SER A 96 17.576 3.653 4.523 1.00 0.00 H new ATOM 1509 N GLY A 97 19.682 -0.046 6.613 1.00 0.00 N ATOM 1510 CA GLY A 97 20.301 -0.945 7.572 1.00 0.00 C ATOM 1511 C GLY A 97 20.744 -2.245 6.898 1.00 0.00 C ATOM 1512 O GLY A 97 20.495 -2.449 5.711 1.00 0.00 O ATOM 0 H GLY A 97 19.778 -0.330 5.638 1.00 0.00 H new ATOM 0 HA2 GLY A 97 21.161 -0.457 8.030 1.00 0.00 H new ATOM 0 HA3 GLY A 97 19.597 -1.168 8.374 1.00 0.00 H new ATOM 1516 N PRO A 98 21.411 -3.113 7.705 1.00 0.00 N ATOM 1517 CA PRO A 98 21.891 -4.388 7.200 1.00 0.00 C ATOM 1518 C PRO A 98 20.738 -5.379 7.028 1.00 0.00 C ATOM 1519 O PRO A 98 20.541 -5.925 5.944 1.00 0.00 O ATOM 1520 CB PRO A 98 22.925 -4.849 8.214 1.00 0.00 C ATOM 1521 CG PRO A 98 22.653 -4.052 9.479 1.00 0.00 C ATOM 1522 CD PRO A 98 21.724 -2.904 9.116 1.00 0.00 C ATOM 0 HA PRO A 98 22.335 -4.307 6.208 1.00 0.00 H new ATOM 0 HB2 PRO A 98 22.839 -5.919 8.401 1.00 0.00 H new ATOM 0 HB3 PRO A 98 23.936 -4.670 7.849 1.00 0.00 H new ATOM 0 HG2 PRO A 98 22.197 -4.686 10.239 1.00 0.00 H new ATOM 0 HG3 PRO A 98 23.584 -3.671 9.898 1.00 0.00 H new ATOM 0 HD2 PRO A 98 20.822 -2.916 9.728 1.00 0.00 H new ATOM 0 HD3 PRO A 98 22.205 -1.939 9.276 1.00 0.00 H new ATOM 1530 N SER A 99 20.007 -5.581 8.115 1.00 0.00 N ATOM 1531 CA SER A 99 18.879 -6.496 8.098 1.00 0.00 C ATOM 1532 C SER A 99 18.107 -6.399 9.415 1.00 0.00 C ATOM 1533 O SER A 99 18.581 -5.790 10.373 1.00 0.00 O ATOM 1534 CB SER A 99 19.341 -7.935 7.859 1.00 0.00 C ATOM 1535 OG SER A 99 19.063 -8.372 6.532 1.00 0.00 O ATOM 0 H SER A 99 20.174 -5.127 9.013 1.00 0.00 H new ATOM 0 HA SER A 99 18.221 -6.213 7.276 1.00 0.00 H new ATOM 0 HB2 SER A 99 20.412 -8.008 8.048 1.00 0.00 H new ATOM 0 HB3 SER A 99 18.846 -8.597 8.570 1.00 0.00 H new ATOM 0 HG SER A 99 19.428 -7.726 5.892 1.00 0.00 H new ATOM 1541 N SER A 100 16.930 -7.008 9.421 1.00 0.00 N ATOM 1542 CA SER A 100 16.087 -6.997 10.604 1.00 0.00 C ATOM 1543 C SER A 100 16.925 -7.311 11.846 1.00 0.00 C ATOM 1544 O SER A 100 18.016 -7.869 11.738 1.00 0.00 O ATOM 1545 CB SER A 100 14.939 -7.999 10.472 1.00 0.00 C ATOM 1546 OG SER A 100 13.679 -7.351 10.319 1.00 0.00 O ATOM 0 H SER A 100 16.540 -7.512 8.625 1.00 0.00 H new ATOM 0 HA SER A 100 15.654 -6.002 10.706 1.00 0.00 H new ATOM 0 HB2 SER A 100 15.120 -8.647 9.614 1.00 0.00 H new ATOM 0 HB3 SER A 100 14.913 -8.639 11.354 1.00 0.00 H new ATOM 0 HG SER A 100 12.972 -8.025 10.236 1.00 0.00 H new ATOM 1552 N GLY A 101 16.383 -6.938 12.996 1.00 0.00 N ATOM 1553 CA GLY A 101 17.066 -7.173 14.256 1.00 0.00 C ATOM 1554 C GLY A 101 17.985 -6.001 14.608 1.00 0.00 C ATOM 1555 O GLY A 101 17.515 -4.941 15.020 1.00 0.00 O ATOM 0 H GLY A 101 15.478 -6.475 13.081 1.00 0.00 H new ATOM 0 HA2 GLY A 101 16.333 -7.316 15.050 1.00 0.00 H new ATOM 0 HA3 GLY A 101 17.650 -8.091 14.192 1.00 0.00 H new TER 1559 GLY A 101