USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 751 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 134:sc= 0.0267 (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 27:sc= 0.129 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -1.49 K(o=-1.5,f=-2.8) USER MOD Single : A 9 GLN : amide:sc= -0.357 K(o=-0.36,f=-2.7!) USER MOD Single : A 10 ASN : amide:sc= -0.177 K(o=-0.18,f=-2.9!) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 THR OG1 : rot 34:sc= 1.12 USER MOD Single : A 13 GLN : amide:sc= -0.771 X(o=-0.77,f=-0.89) USER MOD Single : A 14 HIS : no HD1:sc= -0.641 X(o=-0.64,f=-0.39) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 0.0447 K(o=0.045,f=-3.3!) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= -0.163 X(o=-0.16,f=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 35 ASN : amide:sc= -4.45 K(o=-4.4,f=-7.6!) USER MOD Single : A 42 LYS NZ :NH3+ 167:sc=-0.00489 (180deg=-0.281) USER MOD Single : A 44 LYS NZ :NH3+ 155:sc= -0.0728 (180deg=-0.459) USER MOD Single : A 45 GLN : amide:sc= -0.211 K(o=-0.21,f=-0.73) USER MOD Single : A 50 THR OG1 : rot -78:sc= 1.25! USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.106 X(o=-0.11,f=-0.45) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 57 CYS SG : rot 108:sc= 0.135 USER MOD Single : A 62 HIS : no HD1:sc= -0.998 K(o=-1,f=-0.25) USER MOD Single : A 64 CYS SG : rot 160:sc= -2.88! USER MOD Single : A 65 ASN : amide:sc= -0.23 K(o=-0.23,f=-1.2) USER MOD Single : A 69 ASN : amide:sc= -0.25 X(o=-0.25,f=-0.35) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= -0.0852 X(o=-0.085,f=-0.076) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 33:sc= 0.13 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.732 11.956 -23.879 1.00 0.00 N ATOM 2 CA GLY A 1 17.635 11.380 -24.638 1.00 0.00 C ATOM 3 C GLY A 1 16.904 12.454 -25.447 1.00 0.00 C ATOM 4 O GLY A 1 16.747 13.583 -24.987 1.00 0.00 O ATOM 0 H1 GLY A 1 18.710 11.591 -22.905 1.00 0.00 H new ATOM 0 H2 GLY A 1 19.636 11.698 -24.325 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.637 12.992 -23.863 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.017 10.611 -25.309 1.00 0.00 H new ATOM 0 HA3 GLY A 1 16.935 10.892 -23.959 1.00 0.00 H new ATOM 8 N SER A 2 16.478 12.063 -26.639 1.00 0.00 N ATOM 9 CA SER A 2 15.768 12.977 -27.517 1.00 0.00 C ATOM 10 C SER A 2 14.311 13.107 -27.069 1.00 0.00 C ATOM 11 O SER A 2 13.448 12.359 -27.528 1.00 0.00 O ATOM 12 CB SER A 2 15.837 12.510 -28.972 1.00 0.00 C ATOM 13 OG SER A 2 14.938 13.232 -29.808 1.00 0.00 O ATOM 0 H SER A 2 16.611 11.125 -27.017 1.00 0.00 H new ATOM 0 HA SER A 2 16.249 13.953 -27.455 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.854 12.632 -29.344 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.604 11.446 -29.023 1.00 0.00 H new ATOM 0 HG SER A 2 15.014 12.905 -30.729 1.00 0.00 H new ATOM 19 N SER A 3 14.081 14.062 -26.180 1.00 0.00 N ATOM 20 CA SER A 3 12.743 14.299 -25.665 1.00 0.00 C ATOM 21 C SER A 3 12.600 15.759 -25.232 1.00 0.00 C ATOM 22 O SER A 3 13.256 16.198 -24.289 1.00 0.00 O ATOM 23 CB SER A 3 12.429 13.365 -24.495 1.00 0.00 C ATOM 24 OG SER A 3 11.034 13.317 -24.209 1.00 0.00 O ATOM 0 H SER A 3 14.799 14.681 -25.803 1.00 0.00 H new ATOM 0 HA SER A 3 12.029 14.091 -26.462 1.00 0.00 H new ATOM 0 HB2 SER A 3 12.786 12.362 -24.726 1.00 0.00 H new ATOM 0 HB3 SER A 3 12.969 13.699 -23.609 1.00 0.00 H new ATOM 0 HG SER A 3 10.875 12.709 -23.457 1.00 0.00 H new ATOM 30 N GLY A 4 11.738 16.472 -25.943 1.00 0.00 N ATOM 31 CA GLY A 4 11.500 17.874 -25.644 1.00 0.00 C ATOM 32 C GLY A 4 10.036 18.115 -25.274 1.00 0.00 C ATOM 33 O GLY A 4 9.153 17.372 -25.700 1.00 0.00 O ATOM 0 H GLY A 4 11.196 16.105 -26.725 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.143 18.188 -24.822 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.766 18.484 -26.508 1.00 0.00 H new ATOM 37 N SER A 5 9.822 19.157 -24.484 1.00 0.00 N ATOM 38 CA SER A 5 8.479 19.506 -24.051 1.00 0.00 C ATOM 39 C SER A 5 8.282 21.021 -24.128 1.00 0.00 C ATOM 40 O SER A 5 9.101 21.784 -23.619 1.00 0.00 O ATOM 41 CB SER A 5 8.211 19.007 -22.630 1.00 0.00 C ATOM 42 OG SER A 5 9.094 19.598 -21.681 1.00 0.00 O ATOM 0 H SER A 5 10.556 19.771 -24.132 1.00 0.00 H new ATOM 0 HA SER A 5 7.767 19.019 -24.718 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.180 19.232 -22.355 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.320 17.923 -22.600 1.00 0.00 H new ATOM 0 HG SER A 5 9.388 20.474 -22.009 1.00 0.00 H new ATOM 48 N SER A 6 7.189 21.412 -24.768 1.00 0.00 N ATOM 49 CA SER A 6 6.874 22.822 -24.918 1.00 0.00 C ATOM 50 C SER A 6 5.705 23.196 -24.005 1.00 0.00 C ATOM 51 O SER A 6 4.632 22.600 -24.088 1.00 0.00 O ATOM 52 CB SER A 6 6.541 23.160 -26.373 1.00 0.00 C ATOM 53 OG SER A 6 7.714 23.380 -27.151 1.00 0.00 O ATOM 0 H SER A 6 6.511 20.776 -25.188 1.00 0.00 H new ATOM 0 HA SER A 6 7.751 23.402 -24.631 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.963 22.347 -26.811 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.913 24.050 -26.404 1.00 0.00 H new ATOM 0 HG SER A 6 7.460 23.591 -28.074 1.00 0.00 H new ATOM 59 N GLY A 7 5.952 24.182 -23.155 1.00 0.00 N ATOM 60 CA GLY A 7 4.933 24.643 -22.227 1.00 0.00 C ATOM 61 C GLY A 7 4.649 26.134 -22.421 1.00 0.00 C ATOM 62 O GLY A 7 3.915 26.516 -23.331 1.00 0.00 O ATOM 0 H GLY A 7 6.843 24.674 -23.089 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.016 24.072 -22.375 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.260 24.462 -21.203 1.00 0.00 H new ATOM 66 N ASN A 8 5.245 26.935 -21.550 1.00 0.00 N ATOM 67 CA ASN A 8 5.066 28.375 -21.614 1.00 0.00 C ATOM 68 C ASN A 8 6.274 29.064 -20.976 1.00 0.00 C ATOM 69 O ASN A 8 6.876 29.952 -21.578 1.00 0.00 O ATOM 70 CB ASN A 8 3.815 28.809 -20.847 1.00 0.00 C ATOM 71 CG ASN A 8 3.728 28.101 -19.494 1.00 0.00 C ATOM 72 OD1 ASN A 8 4.179 28.596 -18.475 1.00 0.00 O ATOM 73 ND2 ASN A 8 3.124 26.917 -19.541 1.00 0.00 N ATOM 0 H ASN A 8 5.852 26.614 -20.796 1.00 0.00 H new ATOM 0 HA ASN A 8 4.962 28.655 -22.662 1.00 0.00 H new ATOM 0 HB2 ASN A 8 3.833 29.888 -20.696 1.00 0.00 H new ATOM 0 HB3 ASN A 8 2.926 28.584 -21.437 1.00 0.00 H new ATOM 0 HD21 ASN A 8 3.016 26.365 -18.690 1.00 0.00 H new ATOM 0 HD22 ASN A 8 2.769 26.561 -20.428 1.00 0.00 H new ATOM 80 N GLN A 9 6.592 28.629 -19.766 1.00 0.00 N ATOM 81 CA GLN A 9 7.717 29.193 -19.040 1.00 0.00 C ATOM 82 C GLN A 9 8.467 28.093 -18.286 1.00 0.00 C ATOM 83 O GLN A 9 9.653 27.868 -18.525 1.00 0.00 O ATOM 84 CB GLN A 9 7.257 30.296 -18.086 1.00 0.00 C ATOM 85 CG GLN A 9 7.077 31.623 -18.827 1.00 0.00 C ATOM 86 CD GLN A 9 7.724 32.775 -18.055 1.00 0.00 C ATOM 87 OE1 GLN A 9 8.519 32.580 -17.150 1.00 0.00 O ATOM 88 NE2 GLN A 9 7.339 33.981 -18.461 1.00 0.00 N ATOM 0 H GLN A 9 6.090 27.892 -19.270 1.00 0.00 H new ATOM 0 HA GLN A 9 8.400 29.643 -19.760 1.00 0.00 H new ATOM 0 HB2 GLN A 9 6.317 30.007 -17.617 1.00 0.00 H new ATOM 0 HB3 GLN A 9 7.988 30.418 -17.286 1.00 0.00 H new ATOM 0 HG2 GLN A 9 7.520 31.552 -19.820 1.00 0.00 H new ATOM 0 HG3 GLN A 9 6.015 31.825 -18.966 1.00 0.00 H new ATOM 0 HE21 GLN A 9 6.670 34.072 -19.225 1.00 0.00 H new ATOM 0 HE22 GLN A 9 7.713 34.815 -18.008 1.00 0.00 H new ATOM 97 N ASN A 10 7.745 27.437 -17.389 1.00 0.00 N ATOM 98 CA ASN A 10 8.327 26.366 -16.598 1.00 0.00 C ATOM 99 C ASN A 10 7.207 25.516 -15.996 1.00 0.00 C ATOM 100 O ASN A 10 6.223 26.050 -15.486 1.00 0.00 O ATOM 101 CB ASN A 10 9.167 26.925 -15.448 1.00 0.00 C ATOM 102 CG ASN A 10 9.879 25.801 -14.692 1.00 0.00 C ATOM 103 OD1 ASN A 10 10.169 24.744 -15.228 1.00 0.00 O ATOM 104 ND2 ASN A 10 10.142 26.086 -13.420 1.00 0.00 N ATOM 0 H ASN A 10 6.762 27.627 -17.193 1.00 0.00 H new ATOM 0 HA ASN A 10 8.963 25.770 -17.253 1.00 0.00 H new ATOM 0 HB2 ASN A 10 9.903 27.628 -15.839 1.00 0.00 H new ATOM 0 HB3 ASN A 10 8.527 27.481 -14.762 1.00 0.00 H new ATOM 0 HD21 ASN A 10 10.614 25.400 -12.831 1.00 0.00 H new ATOM 0 HD22 ASN A 10 9.872 26.991 -13.034 1.00 0.00 H new ATOM 111 N GLN A 11 7.393 24.206 -16.075 1.00 0.00 N ATOM 112 CA GLN A 11 6.411 23.277 -15.544 1.00 0.00 C ATOM 113 C GLN A 11 6.947 21.845 -15.605 1.00 0.00 C ATOM 114 O GLN A 11 6.579 21.078 -16.494 1.00 0.00 O ATOM 115 CB GLN A 11 5.082 23.397 -16.293 1.00 0.00 C ATOM 116 CG GLN A 11 3.984 22.593 -15.594 1.00 0.00 C ATOM 117 CD GLN A 11 2.769 22.414 -16.507 1.00 0.00 C ATOM 118 OE1 GLN A 11 1.774 23.112 -16.403 1.00 0.00 O ATOM 119 NE2 GLN A 11 2.906 21.442 -17.405 1.00 0.00 N ATOM 0 H GLN A 11 8.210 23.766 -16.499 1.00 0.00 H new ATOM 0 HA GLN A 11 6.227 23.531 -14.500 1.00 0.00 H new ATOM 0 HB2 GLN A 11 4.788 24.445 -16.353 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.203 23.041 -17.316 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.372 21.617 -15.304 1.00 0.00 H new ATOM 0 HG3 GLN A 11 3.683 23.102 -14.678 1.00 0.00 H new ATOM 0 HE21 GLN A 11 3.766 20.895 -17.438 1.00 0.00 H new ATOM 0 HE22 GLN A 11 2.151 21.244 -18.061 1.00 0.00 H new ATOM 128 N THR A 12 7.807 21.528 -14.649 1.00 0.00 N ATOM 129 CA THR A 12 8.397 20.202 -14.582 1.00 0.00 C ATOM 130 C THR A 12 7.505 19.261 -13.770 1.00 0.00 C ATOM 131 O THR A 12 7.542 19.273 -12.541 1.00 0.00 O ATOM 132 CB THR A 12 9.811 20.342 -14.013 1.00 0.00 C ATOM 133 OG1 THR A 12 9.606 20.832 -12.691 1.00 0.00 O ATOM 134 CG2 THR A 12 10.612 21.449 -14.701 1.00 0.00 C ATOM 0 H THR A 12 8.110 22.167 -13.914 1.00 0.00 H new ATOM 0 HA THR A 12 8.473 19.752 -15.572 1.00 0.00 H new ATOM 0 HB THR A 12 10.339 19.394 -14.116 1.00 0.00 H new ATOM 0 HG1 THR A 12 8.781 20.450 -12.325 1.00 0.00 H new ATOM 0 HG21 THR A 12 11.607 21.506 -14.260 1.00 0.00 H new ATOM 0 HG22 THR A 12 10.699 21.228 -15.765 1.00 0.00 H new ATOM 0 HG23 THR A 12 10.102 22.403 -14.569 1.00 0.00 H new ATOM 142 N GLN A 13 6.725 18.469 -14.491 1.00 0.00 N ATOM 143 CA GLN A 13 5.825 17.524 -13.852 1.00 0.00 C ATOM 144 C GLN A 13 6.582 16.683 -12.822 1.00 0.00 C ATOM 145 O GLN A 13 7.806 16.760 -12.731 1.00 0.00 O ATOM 146 CB GLN A 13 5.140 16.633 -14.890 1.00 0.00 C ATOM 147 CG GLN A 13 6.151 15.711 -15.575 1.00 0.00 C ATOM 148 CD GLN A 13 6.202 14.346 -14.886 1.00 0.00 C ATOM 149 OE1 GLN A 13 5.227 13.615 -14.825 1.00 0.00 O ATOM 150 NE2 GLN A 13 7.390 14.044 -14.370 1.00 0.00 N ATOM 0 H GLN A 13 6.698 18.462 -15.511 1.00 0.00 H new ATOM 0 HA GLN A 13 5.048 18.086 -13.333 1.00 0.00 H new ATOM 0 HB2 GLN A 13 4.366 16.036 -14.408 1.00 0.00 H new ATOM 0 HB3 GLN A 13 4.644 17.254 -15.637 1.00 0.00 H new ATOM 0 HG2 GLN A 13 5.880 15.583 -16.623 1.00 0.00 H new ATOM 0 HG3 GLN A 13 7.139 16.170 -15.554 1.00 0.00 H new ATOM 0 HE21 GLN A 13 8.165 14.701 -14.456 1.00 0.00 H new ATOM 0 HE22 GLN A 13 7.526 13.155 -13.888 1.00 0.00 H new ATOM 159 N HIS A 14 5.822 15.899 -12.072 1.00 0.00 N ATOM 160 CA HIS A 14 6.405 15.045 -11.052 1.00 0.00 C ATOM 161 C HIS A 14 5.465 13.873 -10.764 1.00 0.00 C ATOM 162 O HIS A 14 4.547 13.993 -9.955 1.00 0.00 O ATOM 163 CB HIS A 14 6.747 15.852 -9.797 1.00 0.00 C ATOM 164 CG HIS A 14 5.561 16.543 -9.169 1.00 0.00 C ATOM 165 ND1 HIS A 14 5.145 16.289 -7.874 1.00 0.00 N ATOM 166 CD2 HIS A 14 4.707 17.481 -9.671 1.00 0.00 C ATOM 167 CE1 HIS A 14 4.087 17.045 -7.619 1.00 0.00 C ATOM 168 NE2 HIS A 14 3.818 17.783 -8.734 1.00 0.00 N ATOM 0 H HIS A 14 4.807 15.837 -12.151 1.00 0.00 H new ATOM 0 HA HIS A 14 7.346 14.631 -11.415 1.00 0.00 H new ATOM 0 HB2 HIS A 14 7.198 15.186 -9.061 1.00 0.00 H new ATOM 0 HB3 HIS A 14 7.497 16.600 -10.052 1.00 0.00 H new ATOM 0 HD2 HIS A 14 4.748 17.906 -10.663 1.00 0.00 H new ATOM 0 HE1 HIS A 14 3.535 17.072 -6.691 1.00 0.00 H new ATOM 0 HE2 HIS A 14 3.058 18.456 -8.831 1.00 0.00 H new ATOM 176 N LYS A 15 5.727 12.765 -11.443 1.00 0.00 N ATOM 177 CA LYS A 15 4.915 11.572 -11.271 1.00 0.00 C ATOM 178 C LYS A 15 3.461 11.896 -11.619 1.00 0.00 C ATOM 179 O LYS A 15 2.671 12.241 -10.741 1.00 0.00 O ATOM 180 CB LYS A 15 5.098 10.999 -9.864 1.00 0.00 C ATOM 181 CG LYS A 15 5.244 9.476 -9.908 1.00 0.00 C ATOM 182 CD LYS A 15 5.948 8.957 -8.653 1.00 0.00 C ATOM 183 CE LYS A 15 5.043 9.078 -7.426 1.00 0.00 C ATOM 184 NZ LYS A 15 4.541 7.747 -7.018 1.00 0.00 N ATOM 0 H LYS A 15 6.490 12.669 -12.113 1.00 0.00 H new ATOM 0 HA LYS A 15 5.239 10.788 -11.955 1.00 0.00 H new ATOM 0 HB2 LYS A 15 5.980 11.439 -9.400 1.00 0.00 H new ATOM 0 HB3 LYS A 15 4.243 11.268 -9.243 1.00 0.00 H new ATOM 0 HG2 LYS A 15 4.260 9.015 -9.994 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.810 9.187 -10.793 1.00 0.00 H new ATOM 0 HD2 LYS A 15 6.234 7.915 -8.797 1.00 0.00 H new ATOM 0 HD3 LYS A 15 6.867 9.520 -8.488 1.00 0.00 H new ATOM 0 HE2 LYS A 15 5.595 9.533 -6.603 1.00 0.00 H new ATOM 0 HE3 LYS A 15 4.204 9.737 -7.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.928 7.848 -6.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 3.997 7.327 -7.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 5.345 7.129 -6.785 1.00 0.00 H new ATOM 198 N GLN A 16 3.151 11.772 -12.901 1.00 0.00 N ATOM 199 CA GLN A 16 1.806 12.046 -13.376 1.00 0.00 C ATOM 200 C GLN A 16 0.929 10.801 -13.235 1.00 0.00 C ATOM 201 O GLN A 16 1.351 9.802 -12.653 1.00 0.00 O ATOM 202 CB GLN A 16 1.826 12.542 -14.823 1.00 0.00 C ATOM 203 CG GLN A 16 1.843 14.070 -14.879 1.00 0.00 C ATOM 204 CD GLN A 16 0.421 14.636 -14.865 1.00 0.00 C ATOM 205 OE1 GLN A 16 -0.519 14.010 -14.403 1.00 0.00 O ATOM 206 NE2 GLN A 16 0.317 15.851 -15.396 1.00 0.00 N ATOM 0 H GLN A 16 3.809 11.485 -13.626 1.00 0.00 H new ATOM 0 HA GLN A 16 1.379 12.838 -12.761 1.00 0.00 H new ATOM 0 HB2 GLN A 16 2.703 12.146 -15.335 1.00 0.00 H new ATOM 0 HB3 GLN A 16 0.951 12.165 -15.352 1.00 0.00 H new ATOM 0 HG2 GLN A 16 2.403 14.462 -14.030 1.00 0.00 H new ATOM 0 HG3 GLN A 16 2.360 14.399 -15.781 1.00 0.00 H new ATOM 0 HE21 GLN A 16 1.145 16.319 -15.765 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -0.591 16.315 -15.434 1.00 0.00 H new ATOM 215 N ARG A 17 -0.276 10.900 -13.777 1.00 0.00 N ATOM 216 CA ARG A 17 -1.217 9.794 -13.718 1.00 0.00 C ATOM 217 C ARG A 17 -1.955 9.795 -12.378 1.00 0.00 C ATOM 218 O ARG A 17 -1.332 9.710 -11.322 1.00 0.00 O ATOM 219 CB ARG A 17 -0.502 8.453 -13.898 1.00 0.00 C ATOM 220 CG ARG A 17 -1.459 7.389 -14.438 1.00 0.00 C ATOM 221 CD ARG A 17 -1.091 6.998 -15.871 1.00 0.00 C ATOM 222 NE ARG A 17 -2.267 7.157 -16.756 1.00 0.00 N ATOM 223 CZ ARG A 17 -2.235 6.987 -18.085 1.00 0.00 C ATOM 224 NH1 ARG A 17 -1.087 6.653 -18.690 1.00 0.00 N ATOM 225 NH2 ARG A 17 -3.350 7.153 -18.809 1.00 0.00 N ATOM 0 H ARG A 17 -0.623 11.729 -14.259 1.00 0.00 H new ATOM 0 HA ARG A 17 -1.932 9.924 -14.530 1.00 0.00 H new ATOM 0 HB2 ARG A 17 0.337 8.574 -14.583 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -0.090 8.126 -12.943 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -1.428 6.508 -13.797 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -2.481 7.767 -14.411 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -0.270 7.621 -16.227 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -0.743 5.966 -15.897 1.00 0.00 H new ATOM 0 HE ARG A 17 -3.157 7.412 -16.328 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -0.238 6.528 -18.139 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -1.062 6.524 -19.701 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -4.224 7.409 -18.349 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -3.325 7.024 -19.820 1.00 0.00 H new ATOM 239 N PRO A 18 -3.308 9.895 -12.468 1.00 0.00 N ATOM 240 CA PRO A 18 -4.139 9.908 -11.276 1.00 0.00 C ATOM 241 C PRO A 18 -4.248 8.508 -10.668 1.00 0.00 C ATOM 242 O PRO A 18 -4.651 7.563 -11.344 1.00 0.00 O ATOM 243 CB PRO A 18 -5.478 10.462 -11.735 1.00 0.00 C ATOM 244 CG PRO A 18 -5.499 10.303 -13.246 1.00 0.00 C ATOM 245 CD PRO A 18 -4.081 9.997 -13.703 1.00 0.00 C ATOM 0 HA PRO A 18 -3.721 10.523 -10.479 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -6.304 9.920 -11.274 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -5.586 11.509 -11.451 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -6.175 9.499 -13.536 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -5.865 11.214 -13.721 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -4.040 9.069 -14.274 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -3.694 10.785 -14.349 1.00 0.00 H new ATOM 253 N GLN A 19 -3.881 8.419 -9.398 1.00 0.00 N ATOM 254 CA GLN A 19 -3.933 7.151 -8.691 1.00 0.00 C ATOM 255 C GLN A 19 -4.292 7.377 -7.221 1.00 0.00 C ATOM 256 O GLN A 19 -4.071 6.503 -6.383 1.00 0.00 O ATOM 257 CB GLN A 19 -2.609 6.396 -8.823 1.00 0.00 C ATOM 258 CG GLN A 19 -2.784 4.917 -8.470 1.00 0.00 C ATOM 259 CD GLN A 19 -1.519 4.121 -8.801 1.00 0.00 C ATOM 260 OE1 GLN A 19 -0.573 4.063 -8.033 1.00 0.00 O ATOM 261 NE2 GLN A 19 -1.556 3.514 -9.984 1.00 0.00 N ATOM 0 H GLN A 19 -3.546 9.205 -8.840 1.00 0.00 H new ATOM 0 HA GLN A 19 -4.711 6.536 -9.144 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -2.233 6.488 -9.842 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -1.863 6.845 -8.167 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -3.014 4.817 -7.409 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -3.631 4.506 -9.019 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -2.380 3.604 -10.578 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -0.760 2.958 -10.297 1.00 0.00 H new ATOM 270 N ALA A 20 -4.838 8.553 -6.952 1.00 0.00 N ATOM 271 CA ALA A 20 -5.229 8.905 -5.597 1.00 0.00 C ATOM 272 C ALA A 20 -6.595 9.593 -5.628 1.00 0.00 C ATOM 273 O ALA A 20 -6.917 10.381 -4.740 1.00 0.00 O ATOM 274 CB ALA A 20 -4.148 9.784 -4.965 1.00 0.00 C ATOM 0 H ALA A 20 -5.019 9.275 -7.649 1.00 0.00 H new ATOM 0 HA ALA A 20 -5.323 8.011 -4.981 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -4.442 10.048 -3.949 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -3.204 9.239 -4.940 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -4.027 10.692 -5.555 1.00 0.00 H new ATOM 280 N THR A 21 -7.362 9.270 -6.659 1.00 0.00 N ATOM 281 CA THR A 21 -8.686 9.846 -6.817 1.00 0.00 C ATOM 282 C THR A 21 -9.742 8.743 -6.904 1.00 0.00 C ATOM 283 O THR A 21 -10.483 8.511 -5.950 1.00 0.00 O ATOM 284 CB THR A 21 -8.660 10.761 -8.043 1.00 0.00 C ATOM 285 OG1 THR A 21 -8.215 12.015 -7.532 1.00 0.00 O ATOM 286 CG2 THR A 21 -10.061 11.055 -8.584 1.00 0.00 C ATOM 0 H THR A 21 -7.091 8.616 -7.394 1.00 0.00 H new ATOM 0 HA THR A 21 -8.961 10.447 -5.950 1.00 0.00 H new ATOM 0 HB THR A 21 -8.058 10.301 -8.826 1.00 0.00 H new ATOM 0 HG1 THR A 21 -8.168 12.667 -8.262 1.00 0.00 H new ATOM 0 HG21 THR A 21 -9.986 11.708 -9.453 1.00 0.00 H new ATOM 0 HG22 THR A 21 -10.543 10.121 -8.873 1.00 0.00 H new ATOM 0 HG23 THR A 21 -10.654 11.546 -7.812 1.00 0.00 H new ATOM 294 N ALA A 22 -9.777 8.091 -8.057 1.00 0.00 N ATOM 295 CA ALA A 22 -10.729 7.017 -8.282 1.00 0.00 C ATOM 296 C ALA A 22 -10.081 5.681 -7.914 1.00 0.00 C ATOM 297 O ALA A 22 -10.656 4.894 -7.164 1.00 0.00 O ATOM 298 CB ALA A 22 -11.206 7.053 -9.735 1.00 0.00 C ATOM 0 H ALA A 22 -9.161 8.286 -8.846 1.00 0.00 H new ATOM 0 HA ALA A 22 -11.606 7.143 -7.648 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -11.920 6.247 -9.904 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -11.685 8.011 -9.937 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -10.353 6.927 -10.401 1.00 0.00 H new ATOM 304 N GLU A 23 -8.893 5.466 -8.459 1.00 0.00 N ATOM 305 CA GLU A 23 -8.160 4.239 -8.197 1.00 0.00 C ATOM 306 C GLU A 23 -8.147 3.938 -6.697 1.00 0.00 C ATOM 307 O GLU A 23 -8.519 2.844 -6.277 1.00 0.00 O ATOM 308 CB GLU A 23 -6.737 4.321 -8.753 1.00 0.00 C ATOM 309 CG GLU A 23 -6.339 3.012 -9.437 1.00 0.00 C ATOM 310 CD GLU A 23 -6.646 3.061 -10.935 1.00 0.00 C ATOM 311 OE1 GLU A 23 -5.924 3.801 -11.639 1.00 0.00 O ATOM 312 OE2 GLU A 23 -7.596 2.358 -11.343 1.00 0.00 O ATOM 0 H GLU A 23 -8.419 6.121 -9.081 1.00 0.00 H new ATOM 0 HA GLU A 23 -8.667 3.420 -8.707 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.668 5.143 -9.465 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.039 4.540 -7.945 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -5.275 2.827 -9.286 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -6.875 2.181 -8.979 1.00 0.00 H new ATOM 319 N GLN A 24 -7.714 4.929 -5.931 1.00 0.00 N ATOM 320 CA GLN A 24 -7.647 4.784 -4.487 1.00 0.00 C ATOM 321 C GLN A 24 -8.902 4.080 -3.966 1.00 0.00 C ATOM 322 O GLN A 24 -8.812 3.017 -3.354 1.00 0.00 O ATOM 323 CB GLN A 24 -7.459 6.142 -3.808 1.00 0.00 C ATOM 324 CG GLN A 24 -7.090 5.971 -2.333 1.00 0.00 C ATOM 325 CD GLN A 24 -8.133 6.628 -1.427 1.00 0.00 C ATOM 326 OE1 GLN A 24 -8.180 7.837 -1.266 1.00 0.00 O ATOM 327 NE2 GLN A 24 -8.965 5.767 -0.847 1.00 0.00 N ATOM 0 H GLN A 24 -7.406 5.835 -6.283 1.00 0.00 H new ATOM 0 HA GLN A 24 -6.781 4.169 -4.243 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -6.677 6.703 -4.320 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -8.376 6.725 -3.892 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -7.012 4.910 -2.095 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -6.111 6.412 -2.146 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -8.870 4.767 -1.025 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -9.698 6.107 -0.224 1.00 0.00 H new ATOM 336 N ILE A 25 -10.042 4.702 -4.227 1.00 0.00 N ATOM 337 CA ILE A 25 -11.313 4.148 -3.792 1.00 0.00 C ATOM 338 C ILE A 25 -11.307 2.634 -4.013 1.00 0.00 C ATOM 339 O ILE A 25 -11.549 1.866 -3.083 1.00 0.00 O ATOM 340 CB ILE A 25 -12.475 4.866 -4.482 1.00 0.00 C ATOM 341 CG1 ILE A 25 -12.575 6.319 -4.015 1.00 0.00 C ATOM 342 CG2 ILE A 25 -13.787 4.106 -4.278 1.00 0.00 C ATOM 343 CD1 ILE A 25 -13.386 7.158 -5.005 1.00 0.00 C ATOM 0 H ILE A 25 -10.112 5.584 -4.734 1.00 0.00 H new ATOM 0 HA ILE A 25 -11.455 4.314 -2.724 1.00 0.00 H new ATOM 0 HB ILE A 25 -12.278 4.885 -5.554 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -13.043 6.357 -3.031 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -11.575 6.740 -3.909 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -14.597 4.637 -4.778 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -13.696 3.104 -4.698 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -14.004 4.034 -3.212 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -13.442 8.187 -4.650 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -12.902 7.137 -5.981 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -14.392 6.748 -5.090 1.00 0.00 H new ATOM 355 N ARG A 26 -11.029 2.250 -5.250 1.00 0.00 N ATOM 356 CA ARG A 26 -10.989 0.842 -5.606 1.00 0.00 C ATOM 357 C ARG A 26 -9.858 0.137 -4.854 1.00 0.00 C ATOM 358 O ARG A 26 -10.041 -0.966 -4.342 1.00 0.00 O ATOM 359 CB ARG A 26 -10.783 0.659 -7.111 1.00 0.00 C ATOM 360 CG ARG A 26 -12.065 0.977 -7.882 1.00 0.00 C ATOM 361 CD ARG A 26 -12.487 -0.206 -8.756 1.00 0.00 C ATOM 362 NE ARG A 26 -13.918 -0.085 -9.113 1.00 0.00 N ATOM 363 CZ ARG A 26 -14.595 -0.999 -9.823 1.00 0.00 C ATOM 364 NH1 ARG A 26 -13.975 -2.105 -10.255 1.00 0.00 N ATOM 365 NH2 ARG A 26 -15.892 -0.806 -10.100 1.00 0.00 N ATOM 0 H ARG A 26 -10.829 2.890 -6.019 1.00 0.00 H new ATOM 0 HA ARG A 26 -11.946 0.402 -5.326 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -9.978 1.309 -7.453 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.475 -0.366 -7.318 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -12.864 1.220 -7.182 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.910 1.857 -8.506 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -11.879 -0.236 -9.660 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -12.314 -1.142 -8.224 1.00 0.00 H new ATOM 0 HE ARG A 26 -14.421 0.745 -8.799 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -12.988 -2.252 -10.044 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -14.490 -2.800 -10.795 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -16.364 0.036 -9.771 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -16.407 -1.501 -10.640 1.00 0.00 H new ATOM 379 N LEU A 27 -8.713 0.803 -4.811 1.00 0.00 N ATOM 380 CA LEU A 27 -7.553 0.254 -4.131 1.00 0.00 C ATOM 381 C LEU A 27 -7.944 -0.147 -2.707 1.00 0.00 C ATOM 382 O LEU A 27 -7.866 -1.320 -2.345 1.00 0.00 O ATOM 383 CB LEU A 27 -6.381 1.236 -4.193 1.00 0.00 C ATOM 384 CG LEU A 27 -5.758 1.451 -5.574 1.00 0.00 C ATOM 385 CD1 LEU A 27 -4.345 2.024 -5.455 1.00 0.00 C ATOM 386 CD2 LEU A 27 -5.786 0.160 -6.395 1.00 0.00 C ATOM 0 H LEU A 27 -8.564 1.718 -5.236 1.00 0.00 H new ATOM 0 HA LEU A 27 -7.209 -0.650 -4.634 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -6.721 2.200 -3.815 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -5.602 0.885 -3.516 1.00 0.00 H new ATOM 0 HG LEU A 27 -6.359 2.186 -6.109 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -3.925 2.167 -6.451 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -4.383 2.982 -4.936 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -3.718 1.332 -4.893 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -5.337 0.340 -7.372 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -5.223 -0.615 -5.874 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -6.818 -0.167 -6.524 1.00 0.00 H new ATOM 398 N ALA A 28 -8.357 0.850 -1.938 1.00 0.00 N ATOM 399 CA ALA A 28 -8.760 0.616 -0.562 1.00 0.00 C ATOM 400 C ALA A 28 -9.813 -0.494 -0.526 1.00 0.00 C ATOM 401 O ALA A 28 -9.896 -1.245 0.445 1.00 0.00 O ATOM 402 CB ALA A 28 -9.269 1.922 0.050 1.00 0.00 C ATOM 0 H ALA A 28 -8.421 1.822 -2.242 1.00 0.00 H new ATOM 0 HA ALA A 28 -7.911 0.285 0.036 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -9.571 1.746 1.082 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.475 2.669 0.026 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -10.124 2.283 -0.522 1.00 0.00 H new ATOM 408 N GLN A 29 -10.592 -0.562 -1.595 1.00 0.00 N ATOM 409 CA GLN A 29 -11.636 -1.567 -1.698 1.00 0.00 C ATOM 410 C GLN A 29 -11.024 -2.943 -1.965 1.00 0.00 C ATOM 411 O GLN A 29 -11.536 -3.957 -1.493 1.00 0.00 O ATOM 412 CB GLN A 29 -12.648 -1.197 -2.784 1.00 0.00 C ATOM 413 CG GLN A 29 -13.478 -2.414 -3.198 1.00 0.00 C ATOM 414 CD GLN A 29 -14.938 -2.026 -3.441 1.00 0.00 C ATOM 415 OE1 GLN A 29 -15.244 -1.040 -4.091 1.00 0.00 O ATOM 416 NE2 GLN A 29 -15.818 -2.853 -2.885 1.00 0.00 N ATOM 0 H GLN A 29 -10.521 0.063 -2.398 1.00 0.00 H new ATOM 0 HA GLN A 29 -12.170 -1.607 -0.748 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -13.308 -0.410 -2.418 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -12.125 -0.797 -3.652 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -13.059 -2.853 -4.104 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -13.425 -3.176 -2.420 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -15.493 -3.661 -2.353 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -16.818 -2.680 -2.990 1.00 0.00 H new ATOM 425 N MET A 30 -9.936 -2.935 -2.722 1.00 0.00 N ATOM 426 CA MET A 30 -9.248 -4.170 -3.057 1.00 0.00 C ATOM 427 C MET A 30 -8.327 -4.612 -1.918 1.00 0.00 C ATOM 428 O MET A 30 -8.264 -5.795 -1.590 1.00 0.00 O ATOM 429 CB MET A 30 -8.424 -3.966 -4.330 1.00 0.00 C ATOM 430 CG MET A 30 -9.310 -4.048 -5.575 1.00 0.00 C ATOM 431 SD MET A 30 -8.508 -3.238 -6.949 1.00 0.00 S ATOM 432 CE MET A 30 -7.281 -4.467 -7.361 1.00 0.00 C ATOM 0 H MET A 30 -9.514 -2.092 -3.113 1.00 0.00 H new ATOM 0 HA MET A 30 -9.995 -4.948 -3.217 1.00 0.00 H new ATOM 0 HB2 MET A 30 -7.928 -2.996 -4.295 1.00 0.00 H new ATOM 0 HB3 MET A 30 -7.641 -4.722 -4.386 1.00 0.00 H new ATOM 0 HG2 MET A 30 -9.508 -5.091 -5.822 1.00 0.00 H new ATOM 0 HG3 MET A 30 -10.274 -3.578 -5.377 1.00 0.00 H new ATOM 0 HE1 MET A 30 -6.687 -4.119 -8.206 1.00 0.00 H new ATOM 0 HE2 MET A 30 -6.629 -4.632 -6.503 1.00 0.00 H new ATOM 0 HE3 MET A 30 -7.776 -5.401 -7.626 1.00 0.00 H new ATOM 442 N ILE A 31 -7.636 -3.636 -1.347 1.00 0.00 N ATOM 443 CA ILE A 31 -6.721 -3.910 -0.251 1.00 0.00 C ATOM 444 C ILE A 31 -7.489 -4.569 0.896 1.00 0.00 C ATOM 445 O ILE A 31 -7.039 -5.567 1.456 1.00 0.00 O ATOM 446 CB ILE A 31 -5.978 -2.636 0.157 1.00 0.00 C ATOM 447 CG1 ILE A 31 -4.831 -2.337 -0.810 1.00 0.00 C ATOM 448 CG2 ILE A 31 -5.498 -2.722 1.607 1.00 0.00 C ATOM 449 CD1 ILE A 31 -4.931 -0.911 -1.355 1.00 0.00 C ATOM 0 H ILE A 31 -7.691 -2.655 -1.622 1.00 0.00 H new ATOM 0 HA ILE A 31 -5.950 -4.614 -0.564 1.00 0.00 H new ATOM 0 HB ILE A 31 -6.675 -1.800 0.098 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.877 -2.469 -0.300 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -4.852 -3.048 -1.636 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.973 -1.804 1.872 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.356 -2.853 2.267 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -4.823 -3.571 1.717 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.104 -0.724 -2.040 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -5.876 -0.790 -1.885 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -4.885 -0.202 -0.529 1.00 0.00 H new ATOM 461 N SER A 32 -8.635 -3.983 1.212 1.00 0.00 N ATOM 462 CA SER A 32 -9.469 -4.500 2.283 1.00 0.00 C ATOM 463 C SER A 32 -9.741 -5.990 2.062 1.00 0.00 C ATOM 464 O SER A 32 -9.524 -6.804 2.958 1.00 0.00 O ATOM 465 CB SER A 32 -10.787 -3.729 2.376 1.00 0.00 C ATOM 466 OG SER A 32 -11.420 -3.904 3.641 1.00 0.00 O ATOM 0 H SER A 32 -9.005 -3.155 0.745 1.00 0.00 H new ATOM 0 HA SER A 32 -8.936 -4.370 3.225 1.00 0.00 H new ATOM 0 HB2 SER A 32 -10.599 -2.668 2.208 1.00 0.00 H new ATOM 0 HB3 SER A 32 -11.459 -4.063 1.585 1.00 0.00 H new ATOM 0 HG SER A 32 -12.257 -3.395 3.661 1.00 0.00 H new ATOM 472 N ASP A 33 -10.211 -6.301 0.863 1.00 0.00 N ATOM 473 CA ASP A 33 -10.514 -7.678 0.512 1.00 0.00 C ATOM 474 C ASP A 33 -9.316 -8.564 0.860 1.00 0.00 C ATOM 475 O ASP A 33 -9.482 -9.646 1.421 1.00 0.00 O ATOM 476 CB ASP A 33 -10.786 -7.818 -0.987 1.00 0.00 C ATOM 477 CG ASP A 33 -12.229 -8.171 -1.352 1.00 0.00 C ATOM 478 OD1 ASP A 33 -13.126 -7.762 -0.582 1.00 0.00 O ATOM 479 OD2 ASP A 33 -12.404 -8.840 -2.393 1.00 0.00 O ATOM 0 H ASP A 33 -10.389 -5.623 0.122 1.00 0.00 H new ATOM 0 HA ASP A 33 -11.401 -7.980 1.069 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -10.522 -6.881 -1.478 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -10.127 -8.587 -1.390 1.00 0.00 H new ATOM 484 N HIS A 34 -8.136 -8.072 0.513 1.00 0.00 N ATOM 485 CA HIS A 34 -6.911 -8.805 0.781 1.00 0.00 C ATOM 486 C HIS A 34 -6.249 -8.253 2.045 1.00 0.00 C ATOM 487 O HIS A 34 -5.211 -7.597 1.972 1.00 0.00 O ATOM 488 CB HIS A 34 -5.983 -8.776 -0.435 1.00 0.00 C ATOM 489 CG HIS A 34 -6.441 -9.649 -1.578 1.00 0.00 C ATOM 490 ND1 HIS A 34 -6.506 -11.028 -1.489 1.00 0.00 N ATOM 491 CD2 HIS A 34 -6.857 -9.325 -2.836 1.00 0.00 C ATOM 492 CE1 HIS A 34 -6.942 -11.503 -2.647 1.00 0.00 C ATOM 493 NE2 HIS A 34 -7.158 -10.445 -3.481 1.00 0.00 N ATOM 0 H HIS A 34 -8.002 -7.174 0.048 1.00 0.00 H new ATOM 0 HA HIS A 34 -7.143 -9.854 0.963 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -5.896 -7.749 -0.788 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -4.987 -9.092 -0.126 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -6.929 -8.326 -3.239 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -7.099 -12.544 -2.888 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -7.495 -10.505 -4.442 1.00 0.00 H new ATOM 501 N ASN A 35 -6.877 -8.540 3.177 1.00 0.00 N ATOM 502 CA ASN A 35 -6.362 -8.081 4.455 1.00 0.00 C ATOM 503 C ASN A 35 -6.180 -9.281 5.388 1.00 0.00 C ATOM 504 O ASN A 35 -6.568 -10.398 5.050 1.00 0.00 O ATOM 505 CB ASN A 35 -7.334 -7.106 5.123 1.00 0.00 C ATOM 506 CG ASN A 35 -7.092 -5.675 4.641 1.00 0.00 C ATOM 507 OD1 ASN A 35 -6.309 -5.419 3.741 1.00 0.00 O ATOM 508 ND2 ASN A 35 -7.806 -4.758 5.288 1.00 0.00 N ATOM 0 H ASN A 35 -7.737 -9.085 3.235 1.00 0.00 H new ATOM 0 HA ASN A 35 -5.413 -7.577 4.274 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -8.360 -7.400 4.901 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -7.216 -7.154 6.206 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -7.716 -3.773 5.040 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -8.444 -5.040 6.032 1.00 0.00 H new ATOM 515 N ASP A 36 -5.590 -9.008 6.542 1.00 0.00 N ATOM 516 CA ASP A 36 -5.353 -10.051 7.526 1.00 0.00 C ATOM 517 C ASP A 36 -5.186 -9.415 8.907 1.00 0.00 C ATOM 518 O ASP A 36 -4.967 -8.210 9.017 1.00 0.00 O ATOM 519 CB ASP A 36 -4.074 -10.829 7.206 1.00 0.00 C ATOM 520 CG ASP A 36 -4.293 -12.272 6.748 1.00 0.00 C ATOM 521 OD1 ASP A 36 -4.608 -12.446 5.551 1.00 0.00 O ATOM 522 OD2 ASP A 36 -4.140 -13.169 7.605 1.00 0.00 O ATOM 0 H ASP A 36 -5.269 -8.080 6.818 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.204 -10.732 7.508 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -3.527 -10.296 6.428 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -3.440 -10.837 8.093 1.00 0.00 H new ATOM 527 N ALA A 37 -5.296 -10.254 9.927 1.00 0.00 N ATOM 528 CA ALA A 37 -5.161 -9.789 11.297 1.00 0.00 C ATOM 529 C ALA A 37 -3.898 -8.933 11.417 1.00 0.00 C ATOM 530 O ALA A 37 -3.948 -7.815 11.927 1.00 0.00 O ATOM 531 CB ALA A 37 -5.144 -10.990 12.244 1.00 0.00 C ATOM 0 H ALA A 37 -5.477 -11.253 9.832 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.010 -9.166 11.577 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -5.043 -10.642 13.272 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -6.074 -11.548 12.140 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -4.303 -11.637 11.996 1.00 0.00 H new ATOM 537 N ASP A 38 -2.795 -9.492 10.940 1.00 0.00 N ATOM 538 CA ASP A 38 -1.522 -8.794 10.988 1.00 0.00 C ATOM 539 C ASP A 38 -1.710 -7.362 10.482 1.00 0.00 C ATOM 540 O ASP A 38 -1.501 -6.405 11.225 1.00 0.00 O ATOM 541 CB ASP A 38 -0.485 -9.478 10.096 1.00 0.00 C ATOM 542 CG ASP A 38 -0.234 -10.954 10.411 1.00 0.00 C ATOM 543 OD1 ASP A 38 -0.272 -11.292 11.613 1.00 0.00 O ATOM 544 OD2 ASP A 38 -0.009 -11.711 9.442 1.00 0.00 O ATOM 0 H ASP A 38 -2.757 -10.420 10.519 1.00 0.00 H new ATOM 0 HA ASP A 38 -1.172 -8.803 12.020 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -0.808 -9.393 9.058 1.00 0.00 H new ATOM 0 HB3 ASP A 38 0.458 -8.938 10.181 1.00 0.00 H new ATOM 549 N PHE A 39 -2.104 -7.261 9.221 1.00 0.00 N ATOM 550 CA PHE A 39 -2.323 -5.963 8.607 1.00 0.00 C ATOM 551 C PHE A 39 -3.360 -5.154 9.389 1.00 0.00 C ATOM 552 O PHE A 39 -3.195 -3.951 9.585 1.00 0.00 O ATOM 553 CB PHE A 39 -2.853 -6.220 7.195 1.00 0.00 C ATOM 554 CG PHE A 39 -3.175 -4.946 6.410 1.00 0.00 C ATOM 555 CD1 PHE A 39 -2.172 -4.112 6.027 1.00 0.00 C ATOM 556 CD2 PHE A 39 -4.464 -4.649 6.095 1.00 0.00 C ATOM 557 CE1 PHE A 39 -2.470 -2.930 5.299 1.00 0.00 C ATOM 558 CE2 PHE A 39 -4.763 -3.467 5.367 1.00 0.00 C ATOM 559 CZ PHE A 39 -3.760 -2.633 4.984 1.00 0.00 C ATOM 0 H PHE A 39 -2.277 -8.057 8.608 1.00 0.00 H new ATOM 0 HA PHE A 39 -1.393 -5.395 8.595 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -2.115 -6.799 6.641 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -3.753 -6.831 7.261 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -1.148 -4.349 6.277 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -5.261 -5.312 6.399 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -1.673 -2.267 4.995 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -5.787 -3.231 5.118 1.00 0.00 H new ATOM 0 HZ PHE A 39 -3.987 -1.734 4.430 1.00 0.00 H new ATOM 569 N GLU A 40 -4.405 -5.848 9.816 1.00 0.00 N ATOM 570 CA GLU A 40 -5.469 -5.209 10.572 1.00 0.00 C ATOM 571 C GLU A 40 -4.900 -4.536 11.823 1.00 0.00 C ATOM 572 O GLU A 40 -5.085 -3.337 12.026 1.00 0.00 O ATOM 573 CB GLU A 40 -6.561 -6.216 10.940 1.00 0.00 C ATOM 574 CG GLU A 40 -7.597 -6.334 9.821 1.00 0.00 C ATOM 575 CD GLU A 40 -8.509 -5.106 9.787 1.00 0.00 C ATOM 576 OE1 GLU A 40 -9.275 -4.941 10.761 1.00 0.00 O ATOM 577 OE2 GLU A 40 -8.420 -4.360 8.788 1.00 0.00 O ATOM 0 H GLU A 40 -4.538 -6.846 9.653 1.00 0.00 H new ATOM 0 HA GLU A 40 -5.924 -4.442 9.945 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.113 -7.191 11.130 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.051 -5.906 11.863 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.091 -6.442 8.862 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.196 -7.233 9.968 1.00 0.00 H new ATOM 584 N GLU A 41 -4.219 -5.337 12.630 1.00 0.00 N ATOM 585 CA GLU A 41 -3.622 -4.834 13.855 1.00 0.00 C ATOM 586 C GLU A 41 -2.672 -3.675 13.546 1.00 0.00 C ATOM 587 O GLU A 41 -2.569 -2.728 14.323 1.00 0.00 O ATOM 588 CB GLU A 41 -2.898 -5.950 14.611 1.00 0.00 C ATOM 589 CG GLU A 41 -3.588 -6.245 15.945 1.00 0.00 C ATOM 590 CD GLU A 41 -2.569 -6.653 17.010 1.00 0.00 C ATOM 591 OE1 GLU A 41 -1.770 -5.773 17.398 1.00 0.00 O ATOM 592 OE2 GLU A 41 -2.612 -7.835 17.414 1.00 0.00 O ATOM 0 H GLU A 41 -4.068 -6.331 12.459 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.419 -4.463 14.499 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.877 -6.853 14.001 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.862 -5.661 14.789 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.135 -5.363 16.279 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -4.319 -7.042 15.812 1.00 0.00 H new ATOM 599 N LYS A 42 -2.001 -3.789 12.408 1.00 0.00 N ATOM 600 CA LYS A 42 -1.063 -2.763 11.987 1.00 0.00 C ATOM 601 C LYS A 42 -1.823 -1.463 11.719 1.00 0.00 C ATOM 602 O LYS A 42 -1.477 -0.415 12.262 1.00 0.00 O ATOM 603 CB LYS A 42 -0.237 -3.250 10.794 1.00 0.00 C ATOM 604 CG LYS A 42 0.931 -4.123 11.256 1.00 0.00 C ATOM 605 CD LYS A 42 2.061 -4.119 10.224 1.00 0.00 C ATOM 606 CE LYS A 42 3.225 -5.000 10.681 1.00 0.00 C ATOM 607 NZ LYS A 42 4.518 -4.391 10.299 1.00 0.00 N ATOM 0 H LYS A 42 -2.089 -4.576 11.765 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.344 -2.555 12.780 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.873 -3.817 10.114 1.00 0.00 H new ATOM 0 HB3 LYS A 42 0.143 -2.394 10.236 1.00 0.00 H new ATOM 0 HG2 LYS A 42 1.306 -3.758 12.212 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.585 -5.144 11.418 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.684 -4.477 9.266 1.00 0.00 H new ATOM 0 HD3 LYS A 42 2.412 -3.099 10.068 1.00 0.00 H new ATOM 0 HE2 LYS A 42 3.185 -5.134 11.762 1.00 0.00 H new ATOM 0 HE3 LYS A 42 3.137 -5.990 10.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 5.291 -4.875 10.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 4.657 -4.486 9.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 4.517 -3.383 10.557 1.00 0.00 H new ATOM 621 N VAL A 43 -2.843 -1.573 10.881 1.00 0.00 N ATOM 622 CA VAL A 43 -3.654 -0.418 10.534 1.00 0.00 C ATOM 623 C VAL A 43 -3.937 0.399 11.797 1.00 0.00 C ATOM 624 O VAL A 43 -3.602 1.581 11.864 1.00 0.00 O ATOM 625 CB VAL A 43 -4.928 -0.870 9.817 1.00 0.00 C ATOM 626 CG1 VAL A 43 -5.925 0.284 9.690 1.00 0.00 C ATOM 627 CG2 VAL A 43 -4.603 -1.467 8.446 1.00 0.00 C ATOM 0 H VAL A 43 -3.127 -2.444 10.432 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.119 0.230 9.840 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.393 -1.650 10.420 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -6.821 -0.064 9.177 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.193 0.645 10.683 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.472 1.095 9.119 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.526 -1.780 7.958 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -4.104 -0.718 7.832 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -3.948 -2.329 8.571 1.00 0.00 H new ATOM 637 N LYS A 44 -4.550 -0.263 12.767 1.00 0.00 N ATOM 638 CA LYS A 44 -4.882 0.386 14.023 1.00 0.00 C ATOM 639 C LYS A 44 -3.628 1.052 14.595 1.00 0.00 C ATOM 640 O LYS A 44 -3.662 2.218 14.983 1.00 0.00 O ATOM 641 CB LYS A 44 -5.542 -0.606 14.982 1.00 0.00 C ATOM 642 CG LYS A 44 -7.004 -0.848 14.599 1.00 0.00 C ATOM 643 CD LYS A 44 -7.593 -2.015 15.394 1.00 0.00 C ATOM 644 CE LYS A 44 -8.175 -1.534 16.724 1.00 0.00 C ATOM 645 NZ LYS A 44 -9.389 -0.719 16.494 1.00 0.00 N ATOM 0 H LYS A 44 -4.826 -1.243 12.708 1.00 0.00 H new ATOM 0 HA LYS A 44 -5.617 1.174 13.861 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -4.997 -1.550 14.967 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.488 -0.223 16.001 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -7.587 0.054 14.785 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -7.074 -1.058 13.532 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -8.372 -2.503 14.808 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.820 -2.760 15.580 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -8.419 -2.391 17.352 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -7.431 -0.946 17.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -9.996 -0.754 17.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -9.115 0.266 16.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -9.910 -1.096 15.677 1.00 0.00 H new ATOM 659 N GLN A 45 -2.551 0.281 14.628 1.00 0.00 N ATOM 660 CA GLN A 45 -1.288 0.781 15.145 1.00 0.00 C ATOM 661 C GLN A 45 -0.947 2.126 14.502 1.00 0.00 C ATOM 662 O GLN A 45 -0.469 3.037 15.177 1.00 0.00 O ATOM 663 CB GLN A 45 -0.165 -0.234 14.924 1.00 0.00 C ATOM 664 CG GLN A 45 0.189 -0.954 16.226 1.00 0.00 C ATOM 665 CD GLN A 45 1.558 -0.508 16.745 1.00 0.00 C ATOM 666 OE1 GLN A 45 1.689 0.461 17.473 1.00 0.00 O ATOM 667 NE2 GLN A 45 2.567 -1.269 16.329 1.00 0.00 N ATOM 0 H GLN A 45 -2.527 -0.686 14.305 1.00 0.00 H new ATOM 0 HA GLN A 45 -1.391 0.930 16.220 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -0.471 -0.963 14.173 1.00 0.00 H new ATOM 0 HB3 GLN A 45 0.717 0.274 14.534 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -0.573 -0.749 16.978 1.00 0.00 H new ATOM 0 HG3 GLN A 45 0.192 -2.031 16.061 1.00 0.00 H new ATOM 0 HE21 GLN A 45 2.387 -2.067 15.720 1.00 0.00 H new ATOM 0 HE22 GLN A 45 3.521 -1.055 16.620 1.00 0.00 H new ATOM 676 N LEU A 46 -1.205 2.209 13.205 1.00 0.00 N ATOM 677 CA LEU A 46 -0.931 3.428 12.464 1.00 0.00 C ATOM 678 C LEU A 46 -1.812 4.557 13.003 1.00 0.00 C ATOM 679 O LEU A 46 -1.338 5.672 13.214 1.00 0.00 O ATOM 680 CB LEU A 46 -1.090 3.188 10.961 1.00 0.00 C ATOM 681 CG LEU A 46 0.162 2.711 10.222 1.00 0.00 C ATOM 682 CD1 LEU A 46 -0.167 2.326 8.778 1.00 0.00 C ATOM 683 CD2 LEU A 46 1.276 3.757 10.297 1.00 0.00 C ATOM 0 H LEU A 46 -1.601 1.451 12.648 1.00 0.00 H new ATOM 0 HA LEU A 46 0.105 3.736 12.607 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.879 2.450 10.812 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -1.429 4.115 10.499 1.00 0.00 H new ATOM 0 HG LEU A 46 0.530 1.813 10.719 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.740 1.991 8.275 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.902 1.522 8.774 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.573 3.191 8.254 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.154 3.392 9.764 1.00 0.00 H new ATOM 0 HD22 LEU A 46 0.934 4.686 9.841 1.00 0.00 H new ATOM 0 HD23 LEU A 46 1.535 3.939 11.340 1.00 0.00 H new ATOM 695 N ILE A 47 -3.078 4.228 13.211 1.00 0.00 N ATOM 696 CA ILE A 47 -4.029 5.200 13.722 1.00 0.00 C ATOM 697 C ILE A 47 -3.585 5.661 15.112 1.00 0.00 C ATOM 698 O ILE A 47 -3.364 6.850 15.334 1.00 0.00 O ATOM 699 CB ILE A 47 -5.449 4.630 13.688 1.00 0.00 C ATOM 700 CG1 ILE A 47 -6.078 4.807 12.305 1.00 0.00 C ATOM 701 CG2 ILE A 47 -6.312 5.242 14.793 1.00 0.00 C ATOM 702 CD1 ILE A 47 -7.406 4.054 12.205 1.00 0.00 C ATOM 0 H ILE A 47 -3.467 3.302 13.035 1.00 0.00 H new ATOM 0 HA ILE A 47 -4.049 6.084 13.084 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.392 3.559 13.881 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.241 5.867 12.109 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -5.392 4.444 11.540 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.316 4.820 14.746 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -5.870 5.021 15.764 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.366 6.322 14.656 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -7.831 4.197 11.212 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -7.236 2.991 12.377 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.099 4.437 12.955 1.00 0.00 H new ATOM 714 N ASP A 48 -3.468 4.695 16.011 1.00 0.00 N ATOM 715 CA ASP A 48 -3.054 4.987 17.373 1.00 0.00 C ATOM 716 C ASP A 48 -1.745 5.779 17.345 1.00 0.00 C ATOM 717 O ASP A 48 -1.578 6.735 18.101 1.00 0.00 O ATOM 718 CB ASP A 48 -2.809 3.699 18.162 1.00 0.00 C ATOM 719 CG ASP A 48 -3.824 3.418 19.273 1.00 0.00 C ATOM 720 OD1 ASP A 48 -4.981 3.863 19.110 1.00 0.00 O ATOM 721 OD2 ASP A 48 -3.419 2.766 20.259 1.00 0.00 O ATOM 0 H ASP A 48 -3.653 3.710 15.823 1.00 0.00 H new ATOM 0 HA ASP A 48 -3.849 5.558 17.852 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.812 2.859 17.467 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.813 3.745 18.603 1.00 0.00 H new ATOM 726 N ILE A 49 -0.851 5.353 16.465 1.00 0.00 N ATOM 727 CA ILE A 49 0.437 6.011 16.329 1.00 0.00 C ATOM 728 C ILE A 49 0.224 7.443 15.833 1.00 0.00 C ATOM 729 O ILE A 49 0.437 8.399 16.577 1.00 0.00 O ATOM 730 CB ILE A 49 1.369 5.185 15.440 1.00 0.00 C ATOM 731 CG1 ILE A 49 1.823 3.911 16.156 1.00 0.00 C ATOM 732 CG2 ILE A 49 2.554 6.025 14.959 1.00 0.00 C ATOM 733 CD1 ILE A 49 2.167 2.810 15.150 1.00 0.00 C ATOM 0 H ILE A 49 -0.993 4.560 15.839 1.00 0.00 H new ATOM 0 HA ILE A 49 0.934 6.079 17.297 1.00 0.00 H new ATOM 0 HB ILE A 49 0.812 4.876 14.555 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.694 4.128 16.775 1.00 0.00 H new ATOM 0 HG13 ILE A 49 1.035 3.565 16.824 1.00 0.00 H new ATOM 0 HG21 ILE A 49 3.201 5.414 14.329 1.00 0.00 H new ATOM 0 HG22 ILE A 49 2.188 6.876 14.385 1.00 0.00 H new ATOM 0 HG23 ILE A 49 3.119 6.384 15.819 1.00 0.00 H new ATOM 0 HD11 ILE A 49 2.487 1.916 15.685 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.288 2.579 14.549 1.00 0.00 H new ATOM 0 HD13 ILE A 49 2.972 3.151 14.499 1.00 0.00 H new ATOM 745 N THR A 50 -0.195 7.545 14.581 1.00 0.00 N ATOM 746 CA THR A 50 -0.440 8.844 13.977 1.00 0.00 C ATOM 747 C THR A 50 -1.864 9.313 14.280 1.00 0.00 C ATOM 748 O THR A 50 -2.061 10.260 15.040 1.00 0.00 O ATOM 749 CB THR A 50 -0.142 8.733 12.480 1.00 0.00 C ATOM 750 OG1 THR A 50 -1.183 7.899 11.980 1.00 0.00 O ATOM 751 CG2 THR A 50 1.138 7.944 12.195 1.00 0.00 C ATOM 0 H THR A 50 -0.371 6.749 13.968 1.00 0.00 H new ATOM 0 HA THR A 50 0.216 9.606 14.398 1.00 0.00 H new ATOM 0 HB THR A 50 -0.055 9.732 12.052 1.00 0.00 H new ATOM 0 HG1 THR A 50 -0.987 6.964 12.199 1.00 0.00 H new ATOM 0 HG21 THR A 50 1.303 7.895 11.119 1.00 0.00 H new ATOM 0 HG22 THR A 50 1.985 8.440 12.670 1.00 0.00 H new ATOM 0 HG23 THR A 50 1.039 6.934 12.593 1.00 0.00 H new ATOM 759 N GLY A 51 -2.820 8.628 13.670 1.00 0.00 N ATOM 760 CA GLY A 51 -4.221 8.963 13.865 1.00 0.00 C ATOM 761 C GLY A 51 -4.833 9.529 12.582 1.00 0.00 C ATOM 762 O GLY A 51 -5.821 10.260 12.631 1.00 0.00 O ATOM 0 H GLY A 51 -2.653 7.843 13.041 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -4.772 8.074 14.174 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -4.316 9.692 14.670 1.00 0.00 H new ATOM 766 N LYS A 52 -4.221 9.169 11.463 1.00 0.00 N ATOM 767 CA LYS A 52 -4.693 9.632 10.169 1.00 0.00 C ATOM 768 C LYS A 52 -5.912 8.806 9.751 1.00 0.00 C ATOM 769 O LYS A 52 -6.202 7.773 10.352 1.00 0.00 O ATOM 770 CB LYS A 52 -3.556 9.612 9.145 1.00 0.00 C ATOM 771 CG LYS A 52 -2.385 10.479 9.611 1.00 0.00 C ATOM 772 CD LYS A 52 -2.737 11.966 9.530 1.00 0.00 C ATOM 773 CE LYS A 52 -1.487 12.812 9.276 1.00 0.00 C ATOM 774 NZ LYS A 52 -1.808 13.959 8.398 1.00 0.00 N ATOM 0 H LYS A 52 -3.402 8.562 11.426 1.00 0.00 H new ATOM 0 HA LYS A 52 -5.017 10.671 10.231 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -3.217 8.587 8.993 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -3.921 9.973 8.184 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.121 10.219 10.636 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.509 10.275 8.995 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -3.460 12.129 8.731 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -3.212 12.282 10.459 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -1.086 13.172 10.223 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.713 12.199 8.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.949 14.523 8.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -2.170 13.609 7.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -2.531 14.553 8.853 1.00 0.00 H new ATOM 788 N ASN A 53 -6.592 9.294 8.724 1.00 0.00 N ATOM 789 CA ASN A 53 -7.773 8.614 8.218 1.00 0.00 C ATOM 790 C ASN A 53 -7.458 7.129 8.026 1.00 0.00 C ATOM 791 O ASN A 53 -6.574 6.774 7.247 1.00 0.00 O ATOM 792 CB ASN A 53 -8.200 9.185 6.865 1.00 0.00 C ATOM 793 CG ASN A 53 -8.353 10.706 6.935 1.00 0.00 C ATOM 794 OD1 ASN A 53 -7.429 11.461 6.682 1.00 0.00 O ATOM 795 ND2 ASN A 53 -9.568 11.111 7.293 1.00 0.00 N ATOM 0 H ASN A 53 -6.348 10.152 8.229 1.00 0.00 H new ATOM 0 HA ASN A 53 -8.578 8.755 8.939 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.461 8.925 6.107 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -9.144 8.735 6.558 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -9.771 12.108 7.370 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -10.297 10.425 7.491 1.00 0.00 H new ATOM 802 N GLN A 54 -8.198 6.302 8.749 1.00 0.00 N ATOM 803 CA GLN A 54 -8.009 4.863 8.668 1.00 0.00 C ATOM 804 C GLN A 54 -7.726 4.446 7.224 1.00 0.00 C ATOM 805 O GLN A 54 -6.709 3.813 6.944 1.00 0.00 O ATOM 806 CB GLN A 54 -9.223 4.118 9.227 1.00 0.00 C ATOM 807 CG GLN A 54 -8.894 2.646 9.479 1.00 0.00 C ATOM 808 CD GLN A 54 -10.091 1.914 10.091 1.00 0.00 C ATOM 809 OE1 GLN A 54 -11.038 2.513 10.572 1.00 0.00 O ATOM 810 NE2 GLN A 54 -9.995 0.588 10.046 1.00 0.00 N ATOM 0 H GLN A 54 -8.930 6.600 9.394 1.00 0.00 H new ATOM 0 HA GLN A 54 -7.147 4.594 9.279 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -9.545 4.587 10.157 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -10.055 4.194 8.527 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -8.611 2.167 8.542 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -8.036 2.570 10.147 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -9.174 0.150 9.629 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -10.743 0.009 10.429 1.00 0.00 H new ATOM 819 N ASP A 55 -8.645 4.816 6.344 1.00 0.00 N ATOM 820 CA ASP A 55 -8.507 4.488 4.935 1.00 0.00 C ATOM 821 C ASP A 55 -7.086 4.818 4.475 1.00 0.00 C ATOM 822 O ASP A 55 -6.425 3.993 3.847 1.00 0.00 O ATOM 823 CB ASP A 55 -9.482 5.302 4.082 1.00 0.00 C ATOM 824 CG ASP A 55 -10.928 5.307 4.579 1.00 0.00 C ATOM 825 OD1 ASP A 55 -11.248 4.425 5.404 1.00 0.00 O ATOM 826 OD2 ASP A 55 -11.682 6.194 4.123 1.00 0.00 O ATOM 0 H ASP A 55 -9.488 5.340 6.579 1.00 0.00 H new ATOM 0 HA ASP A 55 -8.722 3.426 4.814 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -9.127 6.331 4.034 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -9.465 4.911 3.065 1.00 0.00 H new ATOM 831 N GLU A 56 -6.657 6.027 4.807 1.00 0.00 N ATOM 832 CA GLU A 56 -5.326 6.477 4.436 1.00 0.00 C ATOM 833 C GLU A 56 -4.267 5.549 5.034 1.00 0.00 C ATOM 834 O GLU A 56 -3.356 5.108 4.334 1.00 0.00 O ATOM 835 CB GLU A 56 -5.096 7.925 4.871 1.00 0.00 C ATOM 836 CG GLU A 56 -5.930 8.891 4.027 1.00 0.00 C ATOM 837 CD GLU A 56 -5.102 9.469 2.877 1.00 0.00 C ATOM 838 OE1 GLU A 56 -4.951 8.747 1.868 1.00 0.00 O ATOM 839 OE2 GLU A 56 -4.640 10.620 3.034 1.00 0.00 O ATOM 0 H GLU A 56 -7.208 6.709 5.329 1.00 0.00 H new ATOM 0 HA GLU A 56 -5.240 6.441 3.350 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.357 8.038 5.923 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.039 8.173 4.776 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -6.801 8.372 3.628 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.302 9.701 4.655 1.00 0.00 H new ATOM 846 N CYS A 57 -4.420 5.281 6.322 1.00 0.00 N ATOM 847 CA CYS A 57 -3.488 4.413 7.022 1.00 0.00 C ATOM 848 C CYS A 57 -3.453 3.064 6.302 1.00 0.00 C ATOM 849 O CYS A 57 -2.385 2.590 5.917 1.00 0.00 O ATOM 850 CB CYS A 57 -3.857 4.262 8.500 1.00 0.00 C ATOM 851 SG CYS A 57 -3.977 5.909 9.287 1.00 0.00 S ATOM 0 H CYS A 57 -5.176 5.650 6.900 1.00 0.00 H new ATOM 0 HA CYS A 57 -2.493 4.857 7.007 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -4.806 3.735 8.594 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -3.106 3.660 9.011 1.00 0.00 H new ATOM 0 HG CYS A 57 -5.225 6.189 9.520 1.00 0.00 H new ATOM 857 N VAL A 58 -4.633 2.485 6.140 1.00 0.00 N ATOM 858 CA VAL A 58 -4.751 1.200 5.473 1.00 0.00 C ATOM 859 C VAL A 58 -4.053 1.270 4.113 1.00 0.00 C ATOM 860 O VAL A 58 -3.509 0.275 3.638 1.00 0.00 O ATOM 861 CB VAL A 58 -6.223 0.797 5.368 1.00 0.00 C ATOM 862 CG1 VAL A 58 -6.384 -0.485 4.549 1.00 0.00 C ATOM 863 CG2 VAL A 58 -6.849 0.644 6.756 1.00 0.00 C ATOM 0 H VAL A 58 -5.516 2.882 6.459 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.255 0.422 6.054 1.00 0.00 H new ATOM 0 HB VAL A 58 -6.753 1.595 4.847 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.440 -0.749 4.490 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.993 -0.326 3.544 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.834 -1.295 5.029 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.896 0.357 6.654 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.315 -0.125 7.313 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.783 1.591 7.291 1.00 0.00 H new ATOM 873 N ILE A 59 -4.091 2.457 3.525 1.00 0.00 N ATOM 874 CA ILE A 59 -3.468 2.671 2.230 1.00 0.00 C ATOM 875 C ILE A 59 -1.955 2.805 2.412 1.00 0.00 C ATOM 876 O ILE A 59 -1.198 1.919 2.019 1.00 0.00 O ATOM 877 CB ILE A 59 -4.110 3.863 1.517 1.00 0.00 C ATOM 878 CG1 ILE A 59 -5.582 3.587 1.204 1.00 0.00 C ATOM 879 CG2 ILE A 59 -3.319 4.244 0.264 1.00 0.00 C ATOM 880 CD1 ILE A 59 -6.384 4.889 1.142 1.00 0.00 C ATOM 0 H ILE A 59 -4.544 3.280 3.922 1.00 0.00 H new ATOM 0 HA ILE A 59 -3.636 1.812 1.580 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.079 4.720 2.190 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -5.663 3.061 0.253 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -6.003 2.933 1.967 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -3.797 5.094 -0.224 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -2.300 4.512 0.544 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -3.295 3.398 -0.423 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -7.427 4.664 0.918 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.322 5.401 2.102 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -5.976 5.531 0.361 1.00 0.00 H new ATOM 892 N ALA A 60 -1.560 3.921 3.007 1.00 0.00 N ATOM 893 CA ALA A 60 -0.150 4.182 3.246 1.00 0.00 C ATOM 894 C ALA A 60 0.537 2.888 3.686 1.00 0.00 C ATOM 895 O ALA A 60 1.600 2.541 3.174 1.00 0.00 O ATOM 896 CB ALA A 60 -0.007 5.300 4.281 1.00 0.00 C ATOM 0 H ALA A 60 -2.191 4.654 3.331 1.00 0.00 H new ATOM 0 HA ALA A 60 0.339 4.519 2.332 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.050 5.496 4.461 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -0.486 6.205 3.907 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.483 4.996 5.213 1.00 0.00 H new ATOM 902 N LEU A 61 -0.099 2.209 4.629 1.00 0.00 N ATOM 903 CA LEU A 61 0.438 0.961 5.144 1.00 0.00 C ATOM 904 C LEU A 61 0.866 0.074 3.973 1.00 0.00 C ATOM 905 O LEU A 61 2.053 -0.197 3.797 1.00 0.00 O ATOM 906 CB LEU A 61 -0.566 0.294 6.086 1.00 0.00 C ATOM 907 CG LEU A 61 -0.066 -0.946 6.830 1.00 0.00 C ATOM 908 CD1 LEU A 61 1.391 -0.776 7.263 1.00 0.00 C ATOM 909 CD2 LEU A 61 -0.979 -1.282 8.011 1.00 0.00 C ATOM 0 H LEU A 61 -0.981 2.500 5.050 1.00 0.00 H new ATOM 0 HA LEU A 61 1.328 1.148 5.745 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -0.887 1.030 6.823 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -1.447 0.016 5.508 1.00 0.00 H new ATOM 0 HG LEU A 61 -0.101 -1.793 6.144 1.00 0.00 H new ATOM 0 HD11 LEU A 61 1.721 -1.672 7.789 1.00 0.00 H new ATOM 0 HD12 LEU A 61 2.016 -0.621 6.384 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.476 0.086 7.925 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.601 -2.167 8.523 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -0.999 -0.442 8.706 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.988 -1.476 7.647 1.00 0.00 H new ATOM 921 N HIS A 62 -0.124 -0.354 3.204 1.00 0.00 N ATOM 922 CA HIS A 62 0.135 -1.205 2.055 1.00 0.00 C ATOM 923 C HIS A 62 1.002 -0.452 1.044 1.00 0.00 C ATOM 924 O HIS A 62 2.039 -0.955 0.614 1.00 0.00 O ATOM 925 CB HIS A 62 -1.175 -1.714 1.450 1.00 0.00 C ATOM 926 CG HIS A 62 -1.043 -2.212 0.030 1.00 0.00 C ATOM 927 ND1 HIS A 62 -1.147 -3.550 -0.308 1.00 0.00 N ATOM 928 CD2 HIS A 62 -0.815 -1.537 -1.133 1.00 0.00 C ATOM 929 CE1 HIS A 62 -0.987 -3.664 -1.618 1.00 0.00 C ATOM 930 NE2 HIS A 62 -0.781 -2.416 -2.128 1.00 0.00 N ATOM 0 H HIS A 62 -1.107 -0.127 3.354 1.00 0.00 H new ATOM 0 HA HIS A 62 0.690 -2.089 2.370 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.562 -2.521 2.073 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -1.911 -0.911 1.476 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -0.684 -0.469 -1.229 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.015 -4.584 -2.183 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -0.626 -2.194 -3.112 1.00 0.00 H new ATOM 938 N ASP A 63 0.545 0.741 0.693 1.00 0.00 N ATOM 939 CA ASP A 63 1.266 1.569 -0.259 1.00 0.00 C ATOM 940 C ASP A 63 2.767 1.464 0.015 1.00 0.00 C ATOM 941 O ASP A 63 3.561 1.298 -0.910 1.00 0.00 O ATOM 942 CB ASP A 63 0.863 3.039 -0.128 1.00 0.00 C ATOM 943 CG ASP A 63 0.651 3.772 -1.455 1.00 0.00 C ATOM 944 OD1 ASP A 63 1.675 4.090 -2.097 1.00 0.00 O ATOM 945 OD2 ASP A 63 -0.530 3.997 -1.796 1.00 0.00 O ATOM 0 H ASP A 63 -0.316 1.154 1.051 1.00 0.00 H new ATOM 0 HA ASP A 63 1.024 1.217 -1.262 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.057 3.098 0.453 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.632 3.562 0.440 1.00 0.00 H new ATOM 950 N CYS A 64 3.112 1.566 1.290 1.00 0.00 N ATOM 951 CA CYS A 64 4.504 1.485 1.698 1.00 0.00 C ATOM 952 C CYS A 64 4.972 0.038 1.524 1.00 0.00 C ATOM 953 O CYS A 64 5.769 -0.257 0.635 1.00 0.00 O ATOM 954 CB CYS A 64 4.704 1.980 3.132 1.00 0.00 C ATOM 955 SG CYS A 64 5.943 3.327 3.162 1.00 0.00 S ATOM 0 H CYS A 64 2.451 1.704 2.055 1.00 0.00 H new ATOM 0 HA CYS A 64 5.108 2.140 1.070 1.00 0.00 H new ATOM 0 HB2 CYS A 64 3.757 2.336 3.538 1.00 0.00 H new ATOM 0 HB3 CYS A 64 5.033 1.157 3.767 1.00 0.00 H new ATOM 0 HG CYS A 64 5.808 4.016 4.256 1.00 0.00 H new ATOM 961 N ASN A 65 4.458 -0.824 2.388 1.00 0.00 N ATOM 962 CA ASN A 65 4.814 -2.232 2.341 1.00 0.00 C ATOM 963 C ASN A 65 4.137 -2.964 3.502 1.00 0.00 C ATOM 964 O ASN A 65 4.732 -3.849 4.114 1.00 0.00 O ATOM 965 CB ASN A 65 6.325 -2.424 2.479 1.00 0.00 C ATOM 966 CG ASN A 65 6.746 -3.819 2.012 1.00 0.00 C ATOM 967 OD1 ASN A 65 6.189 -4.387 1.087 1.00 0.00 O ATOM 968 ND2 ASN A 65 7.758 -4.338 2.703 1.00 0.00 N ATOM 0 H ASN A 65 3.798 -0.575 3.125 1.00 0.00 H new ATOM 0 HA ASN A 65 4.486 -2.630 1.381 1.00 0.00 H new ATOM 0 HB2 ASN A 65 6.846 -1.668 1.892 1.00 0.00 H new ATOM 0 HB3 ASN A 65 6.620 -2.280 3.518 1.00 0.00 H new ATOM 0 HD21 ASN A 65 8.113 -5.265 2.469 1.00 0.00 H new ATOM 0 HD22 ASN A 65 8.179 -3.808 3.466 1.00 0.00 H new ATOM 975 N GLY A 66 2.901 -2.567 3.770 1.00 0.00 N ATOM 976 CA GLY A 66 2.137 -3.173 4.847 1.00 0.00 C ATOM 977 C GLY A 66 2.855 -3.011 6.188 1.00 0.00 C ATOM 978 O GLY A 66 2.516 -3.680 7.163 1.00 0.00 O ATOM 0 H GLY A 66 2.410 -1.833 3.260 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.150 -2.713 4.901 1.00 0.00 H new ATOM 0 HA3 GLY A 66 1.984 -4.232 4.638 1.00 0.00 H new ATOM 982 N ASP A 67 3.835 -2.119 6.194 1.00 0.00 N ATOM 983 CA ASP A 67 4.604 -1.860 7.400 1.00 0.00 C ATOM 984 C ASP A 67 4.071 -0.597 8.078 1.00 0.00 C ATOM 985 O ASP A 67 3.719 0.372 7.406 1.00 0.00 O ATOM 986 CB ASP A 67 6.081 -1.634 7.072 1.00 0.00 C ATOM 987 CG ASP A 67 7.036 -2.696 7.622 1.00 0.00 C ATOM 988 OD1 ASP A 67 6.688 -3.284 8.669 1.00 0.00 O ATOM 989 OD2 ASP A 67 8.091 -2.895 6.983 1.00 0.00 O ATOM 0 H ASP A 67 4.114 -1.567 5.383 1.00 0.00 H new ATOM 0 HA ASP A 67 4.508 -2.726 8.054 1.00 0.00 H new ATOM 0 HB2 ASP A 67 6.195 -1.591 5.989 1.00 0.00 H new ATOM 0 HB3 ASP A 67 6.380 -0.661 7.463 1.00 0.00 H new ATOM 994 N VAL A 68 4.027 -0.648 9.401 1.00 0.00 N ATOM 995 CA VAL A 68 3.542 0.480 10.178 1.00 0.00 C ATOM 996 C VAL A 68 4.597 1.588 10.172 1.00 0.00 C ATOM 997 O VAL A 68 4.273 2.757 9.968 1.00 0.00 O ATOM 998 CB VAL A 68 3.166 0.021 11.589 1.00 0.00 C ATOM 999 CG1 VAL A 68 3.233 1.185 12.580 1.00 0.00 C ATOM 1000 CG2 VAL A 68 1.782 -0.631 11.602 1.00 0.00 C ATOM 0 H VAL A 68 4.319 -1.453 9.955 1.00 0.00 H new ATOM 0 HA VAL A 68 2.636 0.890 9.732 1.00 0.00 H new ATOM 0 HB VAL A 68 3.893 -0.728 11.903 1.00 0.00 H new ATOM 0 HG11 VAL A 68 2.961 0.832 13.575 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.246 1.587 12.602 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.539 1.967 12.270 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.539 -0.948 12.616 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.038 0.088 11.258 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.782 -1.498 10.941 1.00 0.00 H new ATOM 1010 N ASN A 69 5.838 1.182 10.398 1.00 0.00 N ATOM 1011 CA ASN A 69 6.942 2.127 10.421 1.00 0.00 C ATOM 1012 C ASN A 69 7.060 2.800 9.053 1.00 0.00 C ATOM 1013 O ASN A 69 6.914 4.016 8.941 1.00 0.00 O ATOM 1014 CB ASN A 69 8.266 1.419 10.716 1.00 0.00 C ATOM 1015 CG ASN A 69 8.087 0.348 11.794 1.00 0.00 C ATOM 1016 OD1 ASN A 69 7.970 -0.835 11.517 1.00 0.00 O ATOM 1017 ND2 ASN A 69 8.073 0.826 13.034 1.00 0.00 N ATOM 0 H ASN A 69 6.103 0.212 10.567 1.00 0.00 H new ATOM 0 HA ASN A 69 6.743 2.860 11.203 1.00 0.00 H new ATOM 0 HB2 ASN A 69 8.649 0.961 9.804 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.008 2.148 11.042 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.959 0.191 13.824 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.176 1.828 13.196 1.00 0.00 H new ATOM 1024 N ARG A 70 7.323 1.980 8.046 1.00 0.00 N ATOM 1025 CA ARG A 70 7.463 2.481 6.689 1.00 0.00 C ATOM 1026 C ARG A 70 6.329 3.457 6.365 1.00 0.00 C ATOM 1027 O ARG A 70 6.545 4.461 5.688 1.00 0.00 O ATOM 1028 CB ARG A 70 7.446 1.336 5.675 1.00 0.00 C ATOM 1029 CG ARG A 70 8.727 0.504 5.766 1.00 0.00 C ATOM 1030 CD ARG A 70 9.668 0.816 4.600 1.00 0.00 C ATOM 1031 NE ARG A 70 10.739 -0.202 4.528 1.00 0.00 N ATOM 1032 CZ ARG A 70 11.756 -0.163 3.655 1.00 0.00 C ATOM 1033 NH1 ARG A 70 11.845 0.844 2.776 1.00 0.00 N ATOM 1034 NH2 ARG A 70 12.682 -1.130 3.662 1.00 0.00 N ATOM 0 H ARG A 70 7.443 0.972 8.143 1.00 0.00 H new ATOM 0 HA ARG A 70 8.421 2.996 6.622 1.00 0.00 H new ATOM 0 HB2 ARG A 70 6.580 0.699 5.855 1.00 0.00 H new ATOM 0 HB3 ARG A 70 7.341 1.739 4.668 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.232 0.709 6.710 1.00 0.00 H new ATOM 0 HG3 ARG A 70 8.477 -0.557 5.762 1.00 0.00 H new ATOM 0 HD2 ARG A 70 9.108 0.834 3.665 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.104 1.806 4.729 1.00 0.00 H new ATOM 0 HE ARG A 70 10.701 -0.983 5.184 1.00 0.00 H new ATOM 0 HH11 ARG A 70 11.139 1.581 2.771 1.00 0.00 H new ATOM 0 HH12 ARG A 70 12.618 0.874 2.112 1.00 0.00 H new ATOM 0 HH21 ARG A 70 12.614 -1.897 4.331 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.456 -1.100 2.998 1.00 0.00 H new ATOM 1048 N ALA A 71 5.147 3.127 6.863 1.00 0.00 N ATOM 1049 CA ALA A 71 3.980 3.962 6.635 1.00 0.00 C ATOM 1050 C ALA A 71 4.172 5.305 7.342 1.00 0.00 C ATOM 1051 O ALA A 71 4.087 6.359 6.714 1.00 0.00 O ATOM 1052 CB ALA A 71 2.725 3.227 7.111 1.00 0.00 C ATOM 0 H ALA A 71 4.972 2.293 7.424 1.00 0.00 H new ATOM 0 HA ALA A 71 3.856 4.165 5.571 1.00 0.00 H new ATOM 0 HB1 ALA A 71 1.850 3.853 6.940 1.00 0.00 H new ATOM 0 HB2 ALA A 71 2.618 2.294 6.557 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.813 3.009 8.175 1.00 0.00 H new ATOM 1058 N ILE A 72 4.428 5.223 8.640 1.00 0.00 N ATOM 1059 CA ILE A 72 4.634 6.419 9.439 1.00 0.00 C ATOM 1060 C ILE A 72 5.586 7.362 8.702 1.00 0.00 C ATOM 1061 O ILE A 72 5.440 8.581 8.778 1.00 0.00 O ATOM 1062 CB ILE A 72 5.103 6.048 10.847 1.00 0.00 C ATOM 1063 CG1 ILE A 72 3.973 5.396 11.647 1.00 0.00 C ATOM 1064 CG2 ILE A 72 5.688 7.264 11.568 1.00 0.00 C ATOM 1065 CD1 ILE A 72 4.515 4.300 12.568 1.00 0.00 C ATOM 0 H ILE A 72 4.497 4.347 9.158 1.00 0.00 H new ATOM 0 HA ILE A 72 3.694 6.955 9.572 1.00 0.00 H new ATOM 0 HB ILE A 72 5.901 5.311 10.758 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.459 6.153 12.240 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.237 4.971 10.964 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.014 6.973 12.567 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.540 7.646 11.005 1.00 0.00 H new ATOM 0 HG23 ILE A 72 4.928 8.041 11.647 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.692 3.853 13.125 1.00 0.00 H new ATOM 0 HD12 ILE A 72 5.008 3.533 11.970 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.232 4.733 13.265 1.00 0.00 H new ATOM 1077 N ASN A 73 6.541 6.763 8.006 1.00 0.00 N ATOM 1078 CA ASN A 73 7.517 7.534 7.256 1.00 0.00 C ATOM 1079 C ASN A 73 6.795 8.377 6.203 1.00 0.00 C ATOM 1080 O ASN A 73 7.139 9.539 5.990 1.00 0.00 O ATOM 1081 CB ASN A 73 8.505 6.617 6.531 1.00 0.00 C ATOM 1082 CG ASN A 73 9.937 6.868 7.008 1.00 0.00 C ATOM 1083 OD1 ASN A 73 10.633 7.747 6.527 1.00 0.00 O ATOM 1084 ND2 ASN A 73 10.336 6.049 7.976 1.00 0.00 N ATOM 0 H ASN A 73 6.659 5.752 7.946 1.00 0.00 H new ATOM 0 HA ASN A 73 8.060 8.165 7.960 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.236 5.575 6.707 1.00 0.00 H new ATOM 0 HB3 ASN A 73 8.441 6.785 5.456 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.276 6.135 8.362 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.702 5.334 8.333 1.00 0.00 H new ATOM 1091 N VAL A 74 5.808 7.759 5.572 1.00 0.00 N ATOM 1092 CA VAL A 74 5.034 8.438 4.546 1.00 0.00 C ATOM 1093 C VAL A 74 3.925 9.258 5.209 1.00 0.00 C ATOM 1094 O VAL A 74 3.772 10.445 4.925 1.00 0.00 O ATOM 1095 CB VAL A 74 4.502 7.422 3.533 1.00 0.00 C ATOM 1096 CG1 VAL A 74 3.718 8.118 2.419 1.00 0.00 C ATOM 1097 CG2 VAL A 74 5.639 6.576 2.957 1.00 0.00 C ATOM 0 H VAL A 74 5.526 6.795 5.751 1.00 0.00 H new ATOM 0 HA VAL A 74 5.664 9.132 3.990 1.00 0.00 H new ATOM 0 HB VAL A 74 3.819 6.753 4.056 1.00 0.00 H new ATOM 0 HG11 VAL A 74 3.351 7.373 1.713 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.874 8.657 2.850 1.00 0.00 H new ATOM 0 HG13 VAL A 74 4.370 8.821 1.900 1.00 0.00 H new ATOM 0 HG21 VAL A 74 5.234 5.862 2.240 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.358 7.225 2.457 1.00 0.00 H new ATOM 0 HG23 VAL A 74 6.136 6.037 3.764 1.00 0.00 H new ATOM 1107 N LEU A 75 3.181 8.593 6.080 1.00 0.00 N ATOM 1108 CA LEU A 75 2.091 9.245 6.786 1.00 0.00 C ATOM 1109 C LEU A 75 2.563 10.608 7.296 1.00 0.00 C ATOM 1110 O LEU A 75 1.937 11.629 7.018 1.00 0.00 O ATOM 1111 CB LEU A 75 1.542 8.333 7.885 1.00 0.00 C ATOM 1112 CG LEU A 75 0.382 7.421 7.482 1.00 0.00 C ATOM 1113 CD1 LEU A 75 0.229 6.260 8.468 1.00 0.00 C ATOM 1114 CD2 LEU A 75 -0.915 8.218 7.330 1.00 0.00 C ATOM 0 H LEU A 75 3.311 7.609 6.313 1.00 0.00 H new ATOM 0 HA LEU A 75 1.256 9.429 6.110 1.00 0.00 H new ATOM 0 HB2 LEU A 75 2.357 7.710 8.253 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.216 8.956 8.718 1.00 0.00 H new ATOM 0 HG LEU A 75 0.610 6.989 6.508 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -0.603 5.627 8.158 1.00 0.00 H new ATOM 0 HD12 LEU A 75 1.147 5.672 8.483 1.00 0.00 H new ATOM 0 HD13 LEU A 75 0.034 6.653 9.466 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.724 7.546 7.043 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -1.161 8.697 8.278 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.786 8.980 6.561 1.00 0.00 H new ATOM 1126 N LEU A 76 3.663 10.579 8.034 1.00 0.00 N ATOM 1127 CA LEU A 76 4.226 11.799 8.586 1.00 0.00 C ATOM 1128 C LEU A 76 4.715 12.692 7.444 1.00 0.00 C ATOM 1129 O LEU A 76 4.239 13.815 7.281 1.00 0.00 O ATOM 1130 CB LEU A 76 5.308 11.472 9.618 1.00 0.00 C ATOM 1131 CG LEU A 76 4.829 10.779 10.895 1.00 0.00 C ATOM 1132 CD1 LEU A 76 6.014 10.355 11.765 1.00 0.00 C ATOM 1133 CD2 LEU A 76 3.841 11.661 11.660 1.00 0.00 C ATOM 0 H LEU A 76 4.179 9.730 8.262 1.00 0.00 H new ATOM 0 HA LEU A 76 3.463 12.360 9.126 1.00 0.00 H new ATOM 0 HB2 LEU A 76 6.056 10.837 9.142 1.00 0.00 H new ATOM 0 HB3 LEU A 76 5.808 12.399 9.897 1.00 0.00 H new ATOM 0 HG LEU A 76 4.296 9.871 10.613 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.646 9.865 12.667 1.00 0.00 H new ATOM 0 HD12 LEU A 76 6.645 9.663 11.208 1.00 0.00 H new ATOM 0 HD13 LEU A 76 6.595 11.235 12.042 1.00 0.00 H new ATOM 0 HD21 LEU A 76 3.516 11.145 12.563 1.00 0.00 H new ATOM 0 HD22 LEU A 76 4.326 12.599 11.932 1.00 0.00 H new ATOM 0 HD23 LEU A 76 2.976 11.869 11.030 1.00 0.00 H new ATOM 1145 N GLU A 77 5.660 12.160 6.683 1.00 0.00 N ATOM 1146 CA GLU A 77 6.219 12.895 5.561 1.00 0.00 C ATOM 1147 C GLU A 77 6.438 14.360 5.942 1.00 0.00 C ATOM 1148 O GLU A 77 6.304 15.250 5.103 1.00 0.00 O ATOM 1149 CB GLU A 77 5.322 12.777 4.327 1.00 0.00 C ATOM 1150 CG GLU A 77 3.904 13.267 4.631 1.00 0.00 C ATOM 1151 CD GLU A 77 3.050 13.295 3.362 1.00 0.00 C ATOM 1152 OE1 GLU A 77 3.397 14.089 2.461 1.00 0.00 O ATOM 1153 OE2 GLU A 77 2.069 12.521 3.321 1.00 0.00 O ATOM 0 H GLU A 77 6.053 11.229 6.821 1.00 0.00 H new ATOM 0 HA GLU A 77 7.185 12.457 5.310 1.00 0.00 H new ATOM 0 HB2 GLU A 77 5.745 13.360 3.509 1.00 0.00 H new ATOM 0 HB3 GLU A 77 5.289 11.739 3.995 1.00 0.00 H new ATOM 0 HG2 GLU A 77 3.441 12.615 5.371 1.00 0.00 H new ATOM 0 HG3 GLU A 77 3.946 14.265 5.068 1.00 0.00 H new ATOM 1160 N GLY A 78 6.770 14.566 7.208 1.00 0.00 N ATOM 1161 CA GLY A 78 7.009 15.908 7.710 1.00 0.00 C ATOM 1162 C GLY A 78 8.504 16.159 7.915 1.00 0.00 C ATOM 1163 O GLY A 78 8.966 16.293 9.047 1.00 0.00 O ATOM 0 H GLY A 78 6.879 13.826 7.901 1.00 0.00 H new ATOM 0 HA2 GLY A 78 6.607 16.639 7.009 1.00 0.00 H new ATOM 0 HA3 GLY A 78 6.481 16.047 8.653 1.00 0.00 H new ATOM 1167 N ASN A 79 9.220 16.216 6.801 1.00 0.00 N ATOM 1168 CA ASN A 79 10.654 16.449 6.844 1.00 0.00 C ATOM 1169 C ASN A 79 10.935 17.926 6.562 1.00 0.00 C ATOM 1170 O ASN A 79 10.233 18.556 5.773 1.00 0.00 O ATOM 1171 CB ASN A 79 11.379 15.619 5.783 1.00 0.00 C ATOM 1172 CG ASN A 79 11.214 14.121 6.052 1.00 0.00 C ATOM 1173 OD1 ASN A 79 11.966 13.511 6.795 1.00 0.00 O ATOM 1174 ND2 ASN A 79 10.192 13.565 5.407 1.00 0.00 N ATOM 0 H ASN A 79 8.834 16.105 5.863 1.00 0.00 H new ATOM 0 HA ASN A 79 11.012 16.163 7.833 1.00 0.00 H new ATOM 0 HB2 ASN A 79 10.985 15.860 4.796 1.00 0.00 H new ATOM 0 HB3 ASN A 79 12.438 15.876 5.776 1.00 0.00 H new ATOM 0 HD21 ASN A 79 9.999 12.570 5.519 1.00 0.00 H new ATOM 0 HD22 ASN A 79 9.602 14.134 4.800 1.00 0.00 H new ATOM 1181 N PRO A 80 11.991 18.450 7.241 1.00 0.00 N ATOM 1182 CA PRO A 80 12.374 19.841 7.071 1.00 0.00 C ATOM 1183 C PRO A 80 13.083 20.055 5.733 1.00 0.00 C ATOM 1184 O PRO A 80 12.642 20.861 4.914 1.00 0.00 O ATOM 1185 CB PRO A 80 13.257 20.155 8.268 1.00 0.00 C ATOM 1186 CG PRO A 80 13.713 18.811 8.813 1.00 0.00 C ATOM 1187 CD PRO A 80 12.845 17.734 8.184 1.00 0.00 C ATOM 0 HA PRO A 80 11.516 20.512 7.039 1.00 0.00 H new ATOM 0 HB2 PRO A 80 14.110 20.767 7.974 1.00 0.00 H new ATOM 0 HB3 PRO A 80 12.707 20.716 9.023 1.00 0.00 H new ATOM 0 HG2 PRO A 80 14.764 18.640 8.578 1.00 0.00 H new ATOM 0 HG3 PRO A 80 13.622 18.789 9.899 1.00 0.00 H new ATOM 0 HD2 PRO A 80 13.451 16.983 7.678 1.00 0.00 H new ATOM 0 HD3 PRO A 80 12.254 17.212 8.937 1.00 0.00 H new ATOM 1195 N ASP A 81 14.171 19.320 5.551 1.00 0.00 N ATOM 1196 CA ASP A 81 14.945 19.420 4.326 1.00 0.00 C ATOM 1197 C ASP A 81 15.849 18.192 4.198 1.00 0.00 C ATOM 1198 O ASP A 81 17.049 18.270 4.459 1.00 0.00 O ATOM 1199 CB ASP A 81 15.836 20.663 4.337 1.00 0.00 C ATOM 1200 CG ASP A 81 16.193 21.216 2.956 1.00 0.00 C ATOM 1201 OD1 ASP A 81 16.187 20.407 2.003 1.00 0.00 O ATOM 1202 OD2 ASP A 81 16.464 22.434 2.884 1.00 0.00 O ATOM 0 H ASP A 81 14.534 18.653 6.232 1.00 0.00 H new ATOM 0 HA ASP A 81 14.248 19.484 3.491 1.00 0.00 H new ATOM 0 HB2 ASP A 81 15.335 21.446 4.906 1.00 0.00 H new ATOM 0 HB3 ASP A 81 16.759 20.425 4.866 1.00 0.00 H new ATOM 1207 N THR A 82 15.239 17.087 3.796 1.00 0.00 N ATOM 1208 CA THR A 82 15.973 15.844 3.630 1.00 0.00 C ATOM 1209 C THR A 82 17.140 16.040 2.661 1.00 0.00 C ATOM 1210 O THR A 82 17.030 16.794 1.695 1.00 0.00 O ATOM 1211 CB THR A 82 14.984 14.767 3.181 1.00 0.00 C ATOM 1212 OG1 THR A 82 14.389 14.314 4.394 1.00 0.00 O ATOM 1213 CG2 THR A 82 15.684 13.526 2.623 1.00 0.00 C ATOM 0 H THR A 82 14.244 17.026 3.580 1.00 0.00 H new ATOM 0 HA THR A 82 16.422 15.521 4.569 1.00 0.00 H new ATOM 0 HB THR A 82 14.317 15.179 2.424 1.00 0.00 H new ATOM 0 HG1 THR A 82 13.732 13.614 4.195 1.00 0.00 H new ATOM 0 HG21 THR A 82 14.937 12.793 2.319 1.00 0.00 H new ATOM 0 HG22 THR A 82 16.289 13.806 1.761 1.00 0.00 H new ATOM 0 HG23 THR A 82 16.325 13.094 3.391 1.00 0.00 H new ATOM 1221 N HIS A 83 18.232 15.348 2.952 1.00 0.00 N ATOM 1222 CA HIS A 83 19.419 15.436 2.119 1.00 0.00 C ATOM 1223 C HIS A 83 19.098 14.925 0.713 1.00 0.00 C ATOM 1224 O HIS A 83 19.072 15.700 -0.242 1.00 0.00 O ATOM 1225 CB HIS A 83 20.593 14.697 2.764 1.00 0.00 C ATOM 1226 CG HIS A 83 21.326 15.503 3.809 1.00 0.00 C ATOM 1227 ND1 HIS A 83 22.704 15.636 3.823 1.00 0.00 N ATOM 1228 CD2 HIS A 83 20.860 16.217 4.873 1.00 0.00 C ATOM 1229 CE1 HIS A 83 23.040 16.397 4.854 1.00 0.00 C ATOM 1230 NE2 HIS A 83 21.896 16.756 5.504 1.00 0.00 N ATOM 0 H HIS A 83 18.319 14.724 3.754 1.00 0.00 H new ATOM 0 HA HIS A 83 19.727 16.478 2.029 1.00 0.00 H new ATOM 0 HB2 HIS A 83 20.224 13.779 3.221 1.00 0.00 H new ATOM 0 HB3 HIS A 83 21.297 14.405 1.985 1.00 0.00 H new ATOM 0 HD2 HIS A 83 19.823 16.326 5.155 1.00 0.00 H new ATOM 0 HE1 HIS A 83 24.044 16.683 5.131 1.00 0.00 H new ATOM 0 HE2 HIS A 83 21.845 17.342 6.337 1.00 0.00 H new ATOM 1238 N SER A 84 18.861 13.624 0.630 1.00 0.00 N ATOM 1239 CA SER A 84 18.542 13.001 -0.643 1.00 0.00 C ATOM 1240 C SER A 84 17.293 12.129 -0.500 1.00 0.00 C ATOM 1241 O SER A 84 16.847 11.854 0.613 1.00 0.00 O ATOM 1242 CB SER A 84 19.716 12.165 -1.156 1.00 0.00 C ATOM 1243 OG SER A 84 20.232 12.667 -2.385 1.00 0.00 O ATOM 0 H SER A 84 18.884 12.984 1.424 1.00 0.00 H new ATOM 0 HA SER A 84 18.346 13.789 -1.370 1.00 0.00 H new ATOM 0 HB2 SER A 84 20.508 12.155 -0.407 1.00 0.00 H new ATOM 0 HB3 SER A 84 19.394 11.133 -1.293 1.00 0.00 H new ATOM 0 HG SER A 84 20.981 12.107 -2.678 1.00 0.00 H new ATOM 1249 N TRP A 85 16.762 11.720 -1.643 1.00 0.00 N ATOM 1250 CA TRP A 85 15.573 10.885 -1.660 1.00 0.00 C ATOM 1251 C TRP A 85 15.880 9.640 -2.495 1.00 0.00 C ATOM 1252 O TRP A 85 16.812 9.642 -3.298 1.00 0.00 O ATOM 1253 CB TRP A 85 14.362 11.666 -2.175 1.00 0.00 C ATOM 1254 CG TRP A 85 13.336 12.009 -1.093 1.00 0.00 C ATOM 1255 CD1 TRP A 85 13.231 13.142 -0.385 1.00 0.00 C ATOM 1256 CD2 TRP A 85 12.268 11.161 -0.622 1.00 0.00 C ATOM 1257 NE1 TRP A 85 12.178 13.086 0.504 1.00 0.00 N ATOM 1258 CE2 TRP A 85 11.573 11.843 0.356 1.00 0.00 C ATOM 1259 CE3 TRP A 85 11.901 9.860 -1.009 1.00 0.00 C ATOM 1260 CZ2 TRP A 85 10.469 11.307 1.028 1.00 0.00 C ATOM 1261 CZ3 TRP A 85 10.795 9.338 -0.328 1.00 0.00 C ATOM 1262 CH2 TRP A 85 10.084 10.012 0.658 1.00 0.00 C ATOM 0 H TRP A 85 17.134 11.951 -2.564 1.00 0.00 H new ATOM 0 HA TRP A 85 15.309 10.570 -0.650 1.00 0.00 H new ATOM 0 HB2 TRP A 85 14.709 12.590 -2.638 1.00 0.00 H new ATOM 0 HB3 TRP A 85 13.871 11.083 -2.955 1.00 0.00 H new ATOM 0 HD1 TRP A 85 13.888 13.992 -0.497 1.00 0.00 H new ATOM 0 HE1 TRP A 85 11.895 13.822 1.151 1.00 0.00 H new ATOM 0 HE3 TRP A 85 12.430 9.307 -1.771 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 9.942 11.862 1.791 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 10.471 8.341 -0.587 1.00 0.00 H new ATOM 0 HH2 TRP A 85 9.239 9.540 1.136 1.00 0.00 H new ATOM 1273 N GLU A 86 15.079 8.608 -2.277 1.00 0.00 N ATOM 1274 CA GLU A 86 15.254 7.359 -2.999 1.00 0.00 C ATOM 1275 C GLU A 86 14.556 7.430 -4.358 1.00 0.00 C ATOM 1276 O GLU A 86 13.816 8.373 -4.632 1.00 0.00 O ATOM 1277 CB GLU A 86 14.739 6.175 -2.179 1.00 0.00 C ATOM 1278 CG GLU A 86 15.894 5.423 -1.515 1.00 0.00 C ATOM 1279 CD GLU A 86 15.700 5.346 0.001 1.00 0.00 C ATOM 1280 OE1 GLU A 86 15.931 6.385 0.656 1.00 0.00 O ATOM 1281 OE2 GLU A 86 15.324 4.250 0.470 1.00 0.00 O ATOM 0 H GLU A 86 14.307 8.611 -1.611 1.00 0.00 H new ATOM 0 HA GLU A 86 16.320 7.205 -3.167 1.00 0.00 H new ATOM 0 HB2 GLU A 86 14.046 6.530 -1.416 1.00 0.00 H new ATOM 0 HB3 GLU A 86 14.182 5.496 -2.825 1.00 0.00 H new ATOM 0 HG2 GLU A 86 15.962 4.417 -1.928 1.00 0.00 H new ATOM 0 HG3 GLU A 86 16.836 5.924 -1.740 1.00 0.00 H new ATOM 1288 N MET A 87 14.817 6.420 -5.175 1.00 0.00 N ATOM 1289 CA MET A 87 14.224 6.356 -6.500 1.00 0.00 C ATOM 1290 C MET A 87 12.967 5.482 -6.495 1.00 0.00 C ATOM 1291 O MET A 87 12.820 4.597 -7.336 1.00 0.00 O ATOM 1292 CB MET A 87 15.241 5.782 -7.488 1.00 0.00 C ATOM 1293 CG MET A 87 15.593 4.336 -7.135 1.00 0.00 C ATOM 1294 SD MET A 87 17.356 4.088 -7.263 1.00 0.00 S ATOM 1295 CE MET A 87 17.441 2.325 -6.994 1.00 0.00 C ATOM 0 H MET A 87 15.431 5.639 -4.945 1.00 0.00 H new ATOM 0 HA MET A 87 13.942 7.365 -6.801 1.00 0.00 H new ATOM 0 HB2 MET A 87 14.835 5.825 -8.499 1.00 0.00 H new ATOM 0 HB3 MET A 87 16.144 6.392 -7.481 1.00 0.00 H new ATOM 0 HG2 MET A 87 15.258 4.108 -6.123 1.00 0.00 H new ATOM 0 HG3 MET A 87 15.072 3.652 -7.805 1.00 0.00 H new ATOM 0 HE1 MET A 87 18.480 1.999 -7.041 1.00 0.00 H new ATOM 0 HE2 MET A 87 17.030 2.086 -6.013 1.00 0.00 H new ATOM 0 HE3 MET A 87 16.865 1.811 -7.763 1.00 0.00 H new ATOM 1305 N VAL A 88 12.094 5.762 -5.539 1.00 0.00 N ATOM 1306 CA VAL A 88 10.855 5.013 -5.415 1.00 0.00 C ATOM 1307 C VAL A 88 10.190 4.904 -6.788 1.00 0.00 C ATOM 1308 O VAL A 88 9.858 3.807 -7.235 1.00 0.00 O ATOM 1309 CB VAL A 88 9.953 5.665 -4.364 1.00 0.00 C ATOM 1310 CG1 VAL A 88 8.568 5.015 -4.352 1.00 0.00 C ATOM 1311 CG2 VAL A 88 10.597 5.609 -2.978 1.00 0.00 C ATOM 0 H VAL A 88 12.220 6.497 -4.843 1.00 0.00 H new ATOM 0 HA VAL A 88 11.055 3.999 -5.069 1.00 0.00 H new ATOM 0 HB VAL A 88 9.829 6.714 -4.633 1.00 0.00 H new ATOM 0 HG11 VAL A 88 7.947 5.496 -3.597 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.103 5.130 -5.331 1.00 0.00 H new ATOM 0 HG13 VAL A 88 8.666 3.955 -4.119 1.00 0.00 H new ATOM 0 HG21 VAL A 88 9.936 6.079 -2.250 1.00 0.00 H new ATOM 0 HG22 VAL A 88 10.766 4.569 -2.697 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.549 6.139 -2.998 1.00 0.00 H new ATOM 1321 N GLY A 89 10.016 6.055 -7.420 1.00 0.00 N ATOM 1322 CA GLY A 89 9.397 6.102 -8.734 1.00 0.00 C ATOM 1323 C GLY A 89 9.486 7.507 -9.332 1.00 0.00 C ATOM 1324 O GLY A 89 8.554 8.300 -9.206 1.00 0.00 O ATOM 0 H GLY A 89 10.293 6.963 -7.047 1.00 0.00 H new ATOM 0 HA2 GLY A 89 9.888 5.389 -9.397 1.00 0.00 H new ATOM 0 HA3 GLY A 89 8.352 5.800 -8.659 1.00 0.00 H new ATOM 1328 N LYS A 90 10.617 7.773 -9.970 1.00 0.00 N ATOM 1329 CA LYS A 90 10.840 9.069 -10.588 1.00 0.00 C ATOM 1330 C LYS A 90 11.163 8.874 -12.071 1.00 0.00 C ATOM 1331 O LYS A 90 11.879 7.942 -12.436 1.00 0.00 O ATOM 1332 CB LYS A 90 11.910 9.851 -9.824 1.00 0.00 C ATOM 1333 CG LYS A 90 11.572 11.342 -9.778 1.00 0.00 C ATOM 1334 CD LYS A 90 10.458 11.622 -8.767 1.00 0.00 C ATOM 1335 CE LYS A 90 9.566 12.772 -9.238 1.00 0.00 C ATOM 1336 NZ LYS A 90 9.939 14.031 -8.555 1.00 0.00 N ATOM 0 H LYS A 90 11.388 7.113 -10.072 1.00 0.00 H new ATOM 0 HA LYS A 90 9.936 9.676 -10.535 1.00 0.00 H new ATOM 0 HB2 LYS A 90 11.994 9.462 -8.809 1.00 0.00 H new ATOM 0 HB3 LYS A 90 12.880 9.709 -10.301 1.00 0.00 H new ATOM 0 HG2 LYS A 90 12.462 11.912 -9.511 1.00 0.00 H new ATOM 0 HG3 LYS A 90 11.263 11.679 -10.767 1.00 0.00 H new ATOM 0 HD2 LYS A 90 9.856 10.724 -8.626 1.00 0.00 H new ATOM 0 HD3 LYS A 90 10.894 11.868 -7.799 1.00 0.00 H new ATOM 0 HE2 LYS A 90 9.661 12.895 -10.317 1.00 0.00 H new ATOM 0 HE3 LYS A 90 8.521 12.537 -9.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 9.324 14.801 -8.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 9.826 13.915 -7.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 10.930 14.262 -8.770 1.00 0.00 H new ATOM 1350 N LYS A 91 10.619 9.766 -12.885 1.00 0.00 N ATOM 1351 CA LYS A 91 10.841 9.703 -14.320 1.00 0.00 C ATOM 1352 C LYS A 91 10.679 11.102 -14.919 1.00 0.00 C ATOM 1353 O LYS A 91 10.320 12.045 -14.214 1.00 0.00 O ATOM 1354 CB LYS A 91 9.930 8.652 -14.957 1.00 0.00 C ATOM 1355 CG LYS A 91 10.708 7.375 -15.279 1.00 0.00 C ATOM 1356 CD LYS A 91 9.775 6.282 -15.805 1.00 0.00 C ATOM 1357 CE LYS A 91 9.997 6.046 -17.300 1.00 0.00 C ATOM 1358 NZ LYS A 91 11.203 5.217 -17.520 1.00 0.00 N ATOM 0 H LYS A 91 10.025 10.536 -12.579 1.00 0.00 H new ATOM 0 HA LYS A 91 11.860 9.380 -14.534 1.00 0.00 H new ATOM 0 HB2 LYS A 91 9.108 8.420 -14.280 1.00 0.00 H new ATOM 0 HB3 LYS A 91 9.489 9.053 -15.869 1.00 0.00 H new ATOM 0 HG2 LYS A 91 11.476 7.591 -16.022 1.00 0.00 H new ATOM 0 HG3 LYS A 91 11.220 7.021 -14.384 1.00 0.00 H new ATOM 0 HD2 LYS A 91 9.948 5.356 -15.257 1.00 0.00 H new ATOM 0 HD3 LYS A 91 8.738 6.568 -15.628 1.00 0.00 H new ATOM 0 HE2 LYS A 91 9.126 5.552 -17.730 1.00 0.00 H new ATOM 0 HE3 LYS A 91 10.107 7.002 -17.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 11.339 5.066 -18.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 12.035 5.703 -17.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 11.084 4.298 -17.047 1.00 0.00 H new ATOM 1372 N LYS A 92 10.951 11.193 -16.212 1.00 0.00 N ATOM 1373 CA LYS A 92 10.840 12.460 -16.913 1.00 0.00 C ATOM 1374 C LYS A 92 9.396 12.655 -17.379 1.00 0.00 C ATOM 1375 O LYS A 92 8.675 13.496 -16.843 1.00 0.00 O ATOM 1376 CB LYS A 92 11.867 12.539 -18.045 1.00 0.00 C ATOM 1377 CG LYS A 92 13.275 12.236 -17.529 1.00 0.00 C ATOM 1378 CD LYS A 92 14.010 11.279 -18.469 1.00 0.00 C ATOM 1379 CE LYS A 92 14.446 10.012 -17.731 1.00 0.00 C ATOM 1380 NZ LYS A 92 15.438 9.260 -18.532 1.00 0.00 N ATOM 0 H LYS A 92 11.248 10.409 -16.793 1.00 0.00 H new ATOM 0 HA LYS A 92 11.074 13.287 -16.243 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.603 11.831 -18.830 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.845 13.533 -18.492 1.00 0.00 H new ATOM 0 HG2 LYS A 92 13.839 13.164 -17.435 1.00 0.00 H new ATOM 0 HG3 LYS A 92 13.214 11.798 -16.533 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.361 11.013 -19.303 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.883 11.777 -18.891 1.00 0.00 H new ATOM 0 HE2 LYS A 92 14.876 10.277 -16.765 1.00 0.00 H new ATOM 0 HE3 LYS A 92 13.578 9.383 -17.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 15.723 8.403 -18.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.016 8.991 -19.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 16.273 9.857 -18.700 1.00 0.00 H new ATOM 1394 N GLY A 93 9.016 11.865 -18.372 1.00 0.00 N ATOM 1395 CA GLY A 93 7.671 11.940 -18.916 1.00 0.00 C ATOM 1396 C GLY A 93 7.703 12.113 -20.436 1.00 0.00 C ATOM 1397 O GLY A 93 8.419 12.970 -20.953 1.00 0.00 O ATOM 0 H GLY A 93 9.617 11.169 -18.814 1.00 0.00 H new ATOM 0 HA2 GLY A 93 7.121 11.034 -18.661 1.00 0.00 H new ATOM 0 HA3 GLY A 93 7.138 12.775 -18.462 1.00 0.00 H new ATOM 1401 N VAL A 94 6.919 11.284 -21.111 1.00 0.00 N ATOM 1402 CA VAL A 94 6.848 11.334 -22.561 1.00 0.00 C ATOM 1403 C VAL A 94 5.717 10.424 -23.044 1.00 0.00 C ATOM 1404 O VAL A 94 5.481 9.363 -22.469 1.00 0.00 O ATOM 1405 CB VAL A 94 8.207 10.970 -23.164 1.00 0.00 C ATOM 1406 CG1 VAL A 94 8.523 9.489 -22.948 1.00 0.00 C ATOM 1407 CG2 VAL A 94 8.263 11.333 -24.649 1.00 0.00 C ATOM 0 H VAL A 94 6.327 10.574 -20.680 1.00 0.00 H new ATOM 0 HA VAL A 94 6.618 12.345 -22.897 1.00 0.00 H new ATOM 0 HB VAL A 94 8.970 11.553 -22.649 1.00 0.00 H new ATOM 0 HG11 VAL A 94 9.494 9.256 -23.386 1.00 0.00 H new ATOM 0 HG12 VAL A 94 8.546 9.274 -21.880 1.00 0.00 H new ATOM 0 HG13 VAL A 94 7.755 8.880 -23.424 1.00 0.00 H new ATOM 0 HG21 VAL A 94 9.239 11.064 -25.053 1.00 0.00 H new ATOM 0 HG22 VAL A 94 7.486 10.789 -25.186 1.00 0.00 H new ATOM 0 HG23 VAL A 94 8.104 12.405 -24.768 1.00 0.00 H new ATOM 1417 N SER A 95 5.048 10.873 -24.096 1.00 0.00 N ATOM 1418 CA SER A 95 3.947 10.112 -24.663 1.00 0.00 C ATOM 1419 C SER A 95 4.461 8.781 -25.215 1.00 0.00 C ATOM 1420 O SER A 95 5.603 8.690 -25.662 1.00 0.00 O ATOM 1421 CB SER A 95 3.239 10.905 -25.762 1.00 0.00 C ATOM 1422 OG SER A 95 1.822 10.878 -25.612 1.00 0.00 O ATOM 0 H SER A 95 5.247 11.754 -24.570 1.00 0.00 H new ATOM 0 HA SER A 95 3.224 9.914 -23.872 1.00 0.00 H new ATOM 0 HB2 SER A 95 3.586 11.938 -25.744 1.00 0.00 H new ATOM 0 HB3 SER A 95 3.508 10.495 -26.735 1.00 0.00 H new ATOM 0 HG SER A 95 1.407 11.397 -26.332 1.00 0.00 H new ATOM 1428 N GLY A 96 3.592 7.782 -25.166 1.00 0.00 N ATOM 1429 CA GLY A 96 3.943 6.460 -25.656 1.00 0.00 C ATOM 1430 C GLY A 96 4.745 5.683 -24.610 1.00 0.00 C ATOM 1431 O GLY A 96 5.933 5.935 -24.420 1.00 0.00 O ATOM 0 H GLY A 96 2.645 7.862 -24.794 1.00 0.00 H new ATOM 0 HA2 GLY A 96 3.037 5.909 -25.908 1.00 0.00 H new ATOM 0 HA3 GLY A 96 4.526 6.551 -26.573 1.00 0.00 H new ATOM 1435 N GLN A 97 4.062 4.753 -23.959 1.00 0.00 N ATOM 1436 CA GLN A 97 4.695 3.937 -22.937 1.00 0.00 C ATOM 1437 C GLN A 97 5.997 3.335 -23.470 1.00 0.00 C ATOM 1438 O GLN A 97 6.135 3.109 -24.671 1.00 0.00 O ATOM 1439 CB GLN A 97 3.747 2.842 -22.444 1.00 0.00 C ATOM 1440 CG GLN A 97 3.391 1.875 -23.575 1.00 0.00 C ATOM 1441 CD GLN A 97 1.993 2.165 -24.125 1.00 0.00 C ATOM 1442 OE1 GLN A 97 0.990 2.036 -23.443 1.00 0.00 O ATOM 1443 NE2 GLN A 97 1.983 2.563 -25.394 1.00 0.00 N ATOM 0 H GLN A 97 3.076 4.546 -24.120 1.00 0.00 H new ATOM 0 HA GLN A 97 4.933 4.575 -22.086 1.00 0.00 H new ATOM 0 HB2 GLN A 97 4.213 2.294 -21.625 1.00 0.00 H new ATOM 0 HB3 GLN A 97 2.838 3.294 -22.048 1.00 0.00 H new ATOM 0 HG2 GLN A 97 4.126 1.960 -24.376 1.00 0.00 H new ATOM 0 HG3 GLN A 97 3.436 0.849 -23.209 1.00 0.00 H new ATOM 0 HE21 GLN A 97 2.860 2.650 -25.908 1.00 0.00 H new ATOM 0 HE22 GLN A 97 1.099 2.781 -25.853 1.00 0.00 H new ATOM 1452 N LYS A 98 6.920 3.094 -22.550 1.00 0.00 N ATOM 1453 CA LYS A 98 8.206 2.523 -22.912 1.00 0.00 C ATOM 1454 C LYS A 98 8.984 2.181 -21.640 1.00 0.00 C ATOM 1455 O LYS A 98 9.785 2.984 -21.163 1.00 0.00 O ATOM 1456 CB LYS A 98 8.959 3.458 -23.861 1.00 0.00 C ATOM 1457 CG LYS A 98 9.685 2.666 -24.950 1.00 0.00 C ATOM 1458 CD LYS A 98 10.691 3.548 -25.692 1.00 0.00 C ATOM 1459 CE LYS A 98 10.255 3.779 -27.140 1.00 0.00 C ATOM 1460 NZ LYS A 98 9.737 5.155 -27.312 1.00 0.00 N ATOM 0 H LYS A 98 6.803 3.284 -21.555 1.00 0.00 H new ATOM 0 HA LYS A 98 8.068 1.592 -23.461 1.00 0.00 H new ATOM 0 HB2 LYS A 98 8.259 4.157 -24.320 1.00 0.00 H new ATOM 0 HB3 LYS A 98 9.679 4.052 -23.297 1.00 0.00 H new ATOM 0 HG2 LYS A 98 10.201 1.816 -24.503 1.00 0.00 H new ATOM 0 HG3 LYS A 98 8.959 2.263 -25.656 1.00 0.00 H new ATOM 0 HD2 LYS A 98 10.787 4.506 -25.180 1.00 0.00 H new ATOM 0 HD3 LYS A 98 11.674 3.078 -25.675 1.00 0.00 H new ATOM 0 HE2 LYS A 98 11.099 3.615 -27.811 1.00 0.00 H new ATOM 0 HE3 LYS A 98 9.485 3.057 -27.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 9.445 5.295 -28.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 8.919 5.299 -26.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 10.482 5.839 -27.071 1.00 0.00 H new ATOM 1474 N SER A 99 8.720 0.989 -21.126 1.00 0.00 N ATOM 1475 CA SER A 99 9.386 0.531 -19.918 1.00 0.00 C ATOM 1476 C SER A 99 10.903 0.607 -20.096 1.00 0.00 C ATOM 1477 O SER A 99 11.574 1.380 -19.413 1.00 0.00 O ATOM 1478 CB SER A 99 8.963 -0.896 -19.564 1.00 0.00 C ATOM 1479 OG SER A 99 9.889 -1.523 -18.681 1.00 0.00 O ATOM 0 H SER A 99 8.054 0.326 -21.524 1.00 0.00 H new ATOM 0 HA SER A 99 9.091 1.183 -19.096 1.00 0.00 H new ATOM 0 HB2 SER A 99 7.976 -0.878 -19.101 1.00 0.00 H new ATOM 0 HB3 SER A 99 8.876 -1.485 -20.477 1.00 0.00 H new ATOM 0 HG SER A 99 9.583 -2.431 -18.477 1.00 0.00 H new ATOM 1485 N GLY A 100 11.400 -0.206 -21.016 1.00 0.00 N ATOM 1486 CA GLY A 100 12.827 -0.241 -21.292 1.00 0.00 C ATOM 1487 C GLY A 100 13.152 0.503 -22.589 1.00 0.00 C ATOM 1488 O GLY A 100 12.288 0.668 -23.448 1.00 0.00 O ATOM 0 H GLY A 100 10.841 -0.846 -21.580 1.00 0.00 H new ATOM 0 HA2 GLY A 100 13.373 0.210 -20.463 1.00 0.00 H new ATOM 0 HA3 GLY A 100 13.161 -1.276 -21.368 1.00 0.00 H new ATOM 1492 N PRO A 101 14.435 0.944 -22.691 1.00 0.00 N ATOM 1493 CA PRO A 101 14.885 1.667 -23.869 1.00 0.00 C ATOM 1494 C PRO A 101 15.080 0.719 -25.053 1.00 0.00 C ATOM 1495 O PRO A 101 14.434 0.871 -26.088 1.00 0.00 O ATOM 1496 CB PRO A 101 16.172 2.354 -23.440 1.00 0.00 C ATOM 1497 CG PRO A 101 16.639 1.623 -22.192 1.00 0.00 C ATOM 1498 CD PRO A 101 15.485 0.768 -21.693 1.00 0.00 C ATOM 0 HA PRO A 101 14.156 2.398 -24.218 1.00 0.00 H new ATOM 0 HB2 PRO A 101 16.924 2.302 -24.228 1.00 0.00 H new ATOM 0 HB3 PRO A 101 16.000 3.410 -23.233 1.00 0.00 H new ATOM 0 HG2 PRO A 101 17.506 1.001 -22.416 1.00 0.00 H new ATOM 0 HG3 PRO A 101 16.946 2.334 -21.425 1.00 0.00 H new ATOM 0 HD2 PRO A 101 15.777 -0.279 -21.605 1.00 0.00 H new ATOM 0 HD3 PRO A 101 15.152 1.090 -20.706 1.00 0.00 H new ATOM 1506 N SER A 102 15.975 -0.240 -24.862 1.00 0.00 N ATOM 1507 CA SER A 102 16.264 -1.213 -25.901 1.00 0.00 C ATOM 1508 C SER A 102 15.608 -2.553 -25.560 1.00 0.00 C ATOM 1509 O SER A 102 15.545 -2.938 -24.394 1.00 0.00 O ATOM 1510 CB SER A 102 17.772 -1.391 -26.086 1.00 0.00 C ATOM 1511 OG SER A 102 18.369 -2.063 -24.980 1.00 0.00 O ATOM 0 H SER A 102 16.510 -0.363 -24.002 1.00 0.00 H new ATOM 0 HA SER A 102 15.852 -0.843 -26.840 1.00 0.00 H new ATOM 0 HB2 SER A 102 17.961 -1.956 -26.999 1.00 0.00 H new ATOM 0 HB3 SER A 102 18.240 -0.415 -26.213 1.00 0.00 H new ATOM 0 HG SER A 102 19.332 -2.159 -25.136 1.00 0.00 H new ATOM 1517 N SER A 103 15.137 -3.226 -26.600 1.00 0.00 N ATOM 1518 CA SER A 103 14.488 -4.514 -26.425 1.00 0.00 C ATOM 1519 C SER A 103 14.656 -5.360 -27.688 1.00 0.00 C ATOM 1520 O SER A 103 14.961 -4.833 -28.757 1.00 0.00 O ATOM 1521 CB SER A 103 13.004 -4.344 -26.094 1.00 0.00 C ATOM 1522 OG SER A 103 12.775 -4.276 -24.689 1.00 0.00 O ATOM 0 H SER A 103 15.192 -2.904 -27.566 1.00 0.00 H new ATOM 0 HA SER A 103 14.963 -5.024 -25.587 1.00 0.00 H new ATOM 0 HB2 SER A 103 12.629 -3.436 -26.567 1.00 0.00 H new ATOM 0 HB3 SER A 103 12.441 -5.178 -26.513 1.00 0.00 H new ATOM 0 HG SER A 103 13.540 -3.846 -24.253 1.00 0.00 H new ATOM 1528 N GLY A 104 14.451 -6.659 -27.524 1.00 0.00 N ATOM 1529 CA GLY A 104 14.576 -7.583 -28.638 1.00 0.00 C ATOM 1530 C GLY A 104 13.289 -7.623 -29.465 1.00 0.00 C ATOM 1531 O GLY A 104 12.290 -7.009 -29.094 1.00 0.00 O ATOM 0 H GLY A 104 14.199 -7.093 -26.636 1.00 0.00 H new ATOM 0 HA2 GLY A 104 15.411 -7.283 -29.272 1.00 0.00 H new ATOM 0 HA3 GLY A 104 14.803 -8.581 -28.263 1.00 0.00 H new TER 1535 GLY A 104