USER MOD reduce.3.24.130724 H: found=0, std=0, add=894, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 891 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 NoAdj-H: A 38 HIS HE2 : A 38 HIS NE2 : A 101 ZNZN :(H bumps) USER MOD NoAdj-H: A 70 HIS HE2 : A 70 HIS NE2 : A 102 ZNZN :(H bumps) USER MOD Set 1.1: A 86 ASN : amide:sc= 1.96 K(o=2.9,f=-0.88) USER MOD Set 1.2: A 90 GLN : amide:sc= 0.931 K(o=2.9,f=0.81) USER MOD Single : A 1 MET CE :methyl 172:sc= 0 (180deg=-0.166) USER MOD Single : A 1 MET N :NH3+ 180:sc= -0.112 (180deg=-0.112) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0576) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0151 USER MOD Single : A 23 GLN : amide:sc= 0.742 K(o=0.74,f=-0.005) USER MOD Single : A 26 THR OG1 : rot 129:sc= 0.105 USER MOD Single : A 28 SER OG : rot 63:sc= 0.00291 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.00309 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0101) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 CYS SG : rot 180:sc= 0.0556 USER MOD Single : A 44 GLN : amide:sc= -0.385 K(o=-0.39,f=-3.5!) USER MOD Single : A 47 ASN : amide:sc= -0.153 X(o=-0.15,f=-0.58) USER MOD Single : A 56 SER OG : rot -140:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -175:sc= 0.742 (180deg=0.702) USER MOD Single : A 62 SER OG : rot 59:sc= 0.134 USER MOD Single : A 65 ASN : amide:sc= 0.912 K(o=0.91,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 155:sc= 0.321 (180deg=0.128) USER MOD Single : A 68 TYR OH : rot 30:sc= 0 USER MOD Single : A 74 HIS : no HD1:sc= -0.0212 X(o=-0.021,f=-0.23) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 75:sc= 1.03 USER MOD Single : A 78 GLN : amide:sc= -0.11 X(o=-0.11,f=-0.22) USER MOD Single : A 82 ASN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : A 85 ASN : amide:sc= 1.46 K(o=1.5,f=-0.59) USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 91 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0142) USER MOD Single : A 92 ASN : amide:sc= -0.0277 K(o=-0.028,f=-0.66) USER MOD Single : B 95 G O2' : rot -28:sc= 0.0945 USER MOD Single : B 96 U O2' : rot -27:sc= 0.0524 USER MOD Single : B 97 C O2' : rot 26:sc= 0.139 USER MOD Single : B 98 U O2' : rot -18:sc= 0.0266 USER MOD Single : B 99 C O2' : rot 167:sc= 0.12 USER MOD Single : B 100 G O2' : rot -52:sc= 0 USER MOD Single : B 101 C O2' : rot -146:sc= 0.246 USER MOD Single : B 102 U O2' : rot 2:sc= 0.191 USER MOD Single : B 103 U O2' : rot -148:sc= 0.612 USER MOD Single : B 104 U O2' : rot -18:sc= 0.179 USER MOD Single : B 105 U O2' : rot 20:sc= 0.231 USER MOD Single : B 106 C O2' : rot -13:sc= 0.151 USER MOD Single : B 107 C O2' : rot -101:sc= 0.116 USER MOD Single : B 108 C O2' : rot -54:sc= 0.371 USER MOD Single : B 109 C O2' : rot -26:sc= 0.0813 USER MOD Single : B 109 C O3' : rot 180:sc= 0.0928 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 27.565 7.339 -7.631 1.00 0.00 N ATOM 2 CA MET A 1 27.137 6.007 -7.184 1.00 0.00 C ATOM 3 C MET A 1 28.048 5.374 -6.112 1.00 0.00 C ATOM 4 O MET A 1 27.704 4.341 -5.533 1.00 0.00 O ATOM 5 CB MET A 1 26.919 5.080 -8.395 1.00 0.00 C ATOM 6 CG MET A 1 28.095 4.960 -9.381 1.00 0.00 C ATOM 7 SD MET A 1 29.643 4.219 -8.783 1.00 0.00 S ATOM 8 CE MET A 1 29.086 2.545 -8.364 1.00 0.00 C ATOM 0 H1 MET A 1 26.902 7.694 -8.349 1.00 0.00 H new ATOM 0 H2 MET A 1 27.578 7.990 -6.820 1.00 0.00 H new ATOM 0 H3 MET A 1 28.519 7.278 -8.041 1.00 0.00 H new ATOM 0 HA MET A 1 26.183 6.142 -6.674 1.00 0.00 H new ATOM 0 HB2 MET A 1 26.680 4.083 -8.024 1.00 0.00 H new ATOM 0 HB3 MET A 1 26.046 5.434 -8.944 1.00 0.00 H new ATOM 0 HG2 MET A 1 27.755 4.376 -10.236 1.00 0.00 H new ATOM 0 HG3 MET A 1 28.325 5.960 -9.749 1.00 0.00 H new ATOM 0 HE1 MET A 1 29.948 1.926 -8.117 1.00 0.00 H new ATOM 0 HE2 MET A 1 28.414 2.589 -7.507 1.00 0.00 H new ATOM 0 HE3 MET A 1 28.560 2.113 -9.215 1.00 0.00 H new ATOM 18 N ALA A 2 29.191 6.002 -5.823 1.00 0.00 N ATOM 19 CA ALA A 2 30.176 5.576 -4.826 1.00 0.00 C ATOM 20 C ALA A 2 31.031 6.760 -4.320 1.00 0.00 C ATOM 21 O ALA A 2 30.960 7.875 -4.848 1.00 0.00 O ATOM 22 CB ALA A 2 31.063 4.485 -5.450 1.00 0.00 C ATOM 0 H ALA A 2 29.467 6.860 -6.300 1.00 0.00 H new ATOM 0 HA ALA A 2 29.652 5.178 -3.957 1.00 0.00 H new ATOM 0 HB1 ALA A 2 31.803 4.156 -4.720 1.00 0.00 H new ATOM 0 HB2 ALA A 2 30.444 3.638 -5.746 1.00 0.00 H new ATOM 0 HB3 ALA A 2 31.572 4.887 -6.326 1.00 0.00 H new ATOM 28 N VAL A 3 31.867 6.501 -3.309 1.00 0.00 N ATOM 29 CA VAL A 3 32.783 7.470 -2.676 1.00 0.00 C ATOM 30 C VAL A 3 34.116 6.800 -2.310 1.00 0.00 C ATOM 31 O VAL A 3 34.176 5.601 -2.028 1.00 0.00 O ATOM 32 CB VAL A 3 32.091 8.160 -1.475 1.00 0.00 C ATOM 33 CG1 VAL A 3 31.457 7.176 -0.481 1.00 0.00 C ATOM 34 CG2 VAL A 3 33.003 9.128 -0.712 1.00 0.00 C ATOM 0 H VAL A 3 31.930 5.574 -2.888 1.00 0.00 H new ATOM 0 HA VAL A 3 33.026 8.258 -3.389 1.00 0.00 H new ATOM 0 HB VAL A 3 31.294 8.737 -1.943 1.00 0.00 H new ATOM 0 HG11 VAL A 3 30.991 7.731 0.333 1.00 0.00 H new ATOM 0 HG12 VAL A 3 30.702 6.579 -0.992 1.00 0.00 H new ATOM 0 HG13 VAL A 3 32.228 6.519 -0.078 1.00 0.00 H new ATOM 0 HG21 VAL A 3 32.450 9.573 0.115 1.00 0.00 H new ATOM 0 HG22 VAL A 3 33.864 8.586 -0.322 1.00 0.00 H new ATOM 0 HG23 VAL A 3 33.344 9.914 -1.386 1.00 0.00 H new ATOM 44 N SER A 4 35.200 7.578 -2.362 1.00 0.00 N ATOM 45 CA SER A 4 36.596 7.140 -2.148 1.00 0.00 C ATOM 46 C SER A 4 36.933 6.586 -0.753 1.00 0.00 C ATOM 47 O SER A 4 37.953 5.910 -0.597 1.00 0.00 O ATOM 48 CB SER A 4 37.550 8.307 -2.443 1.00 0.00 C ATOM 49 OG SER A 4 37.291 8.863 -3.726 1.00 0.00 O ATOM 0 H SER A 4 35.134 8.576 -2.563 1.00 0.00 H new ATOM 0 HA SER A 4 36.721 6.302 -2.834 1.00 0.00 H new ATOM 0 HB2 SER A 4 37.437 9.076 -1.679 1.00 0.00 H new ATOM 0 HB3 SER A 4 38.582 7.959 -2.395 1.00 0.00 H new ATOM 0 HG SER A 4 37.909 9.605 -3.892 1.00 0.00 H new ATOM 55 N VAL A 5 36.099 6.854 0.258 1.00 0.00 N ATOM 56 CA VAL A 5 36.264 6.417 1.661 1.00 0.00 C ATOM 57 C VAL A 5 34.915 6.046 2.288 1.00 0.00 C ATOM 58 O VAL A 5 33.861 6.458 1.802 1.00 0.00 O ATOM 59 CB VAL A 5 36.950 7.505 2.524 1.00 0.00 C ATOM 60 CG1 VAL A 5 38.405 7.744 2.103 1.00 0.00 C ATOM 61 CG2 VAL A 5 36.215 8.854 2.508 1.00 0.00 C ATOM 0 H VAL A 5 35.252 7.405 0.121 1.00 0.00 H new ATOM 0 HA VAL A 5 36.904 5.535 1.641 1.00 0.00 H new ATOM 0 HB VAL A 5 36.917 7.106 3.538 1.00 0.00 H new ATOM 0 HG11 VAL A 5 38.845 8.515 2.736 1.00 0.00 H new ATOM 0 HG12 VAL A 5 38.972 6.819 2.211 1.00 0.00 H new ATOM 0 HG13 VAL A 5 38.434 8.068 1.063 1.00 0.00 H new ATOM 0 HG21 VAL A 5 36.751 9.568 3.133 1.00 0.00 H new ATOM 0 HG22 VAL A 5 36.168 9.230 1.486 1.00 0.00 H new ATOM 0 HG23 VAL A 5 35.204 8.722 2.893 1.00 0.00 H new ATOM 71 N THR A 6 34.932 5.281 3.382 1.00 0.00 N ATOM 72 CA THR A 6 33.719 4.847 4.102 1.00 0.00 C ATOM 73 C THR A 6 32.951 6.064 4.659 1.00 0.00 C ATOM 74 O THR A 6 33.585 6.947 5.250 1.00 0.00 O ATOM 75 CB THR A 6 34.100 3.910 5.264 1.00 0.00 C ATOM 76 OG1 THR A 6 34.985 2.905 4.804 1.00 0.00 O ATOM 77 CG2 THR A 6 32.897 3.190 5.874 1.00 0.00 C ATOM 0 H THR A 6 35.796 4.938 3.803 1.00 0.00 H new ATOM 0 HA THR A 6 33.078 4.315 3.399 1.00 0.00 H new ATOM 0 HB THR A 6 34.556 4.548 6.022 1.00 0.00 H new ATOM 0 HG1 THR A 6 35.224 2.314 5.548 1.00 0.00 H new ATOM 0 HG21 THR A 6 33.232 2.546 6.687 1.00 0.00 H new ATOM 0 HG22 THR A 6 32.191 3.925 6.261 1.00 0.00 H new ATOM 0 HG23 THR A 6 32.409 2.585 5.110 1.00 0.00 H new ATOM 85 N PRO A 7 31.613 6.149 4.496 1.00 0.00 N ATOM 86 CA PRO A 7 30.820 7.277 4.994 1.00 0.00 C ATOM 87 C PRO A 7 30.786 7.357 6.531 1.00 0.00 C ATOM 88 O PRO A 7 31.056 6.380 7.236 1.00 0.00 O ATOM 89 CB PRO A 7 29.418 7.086 4.401 1.00 0.00 C ATOM 90 CG PRO A 7 29.323 5.577 4.198 1.00 0.00 C ATOM 91 CD PRO A 7 30.750 5.192 3.815 1.00 0.00 C ATOM 0 HA PRO A 7 31.264 8.224 4.688 1.00 0.00 H new ATOM 0 HB2 PRO A 7 28.643 7.450 5.076 1.00 0.00 H new ATOM 0 HB3 PRO A 7 29.302 7.626 3.461 1.00 0.00 H new ATOM 0 HG2 PRO A 7 28.997 5.067 5.105 1.00 0.00 H new ATOM 0 HG3 PRO A 7 28.611 5.319 3.414 1.00 0.00 H new ATOM 0 HD2 PRO A 7 30.977 4.172 4.124 1.00 0.00 H new ATOM 0 HD3 PRO A 7 30.891 5.237 2.735 1.00 0.00 H new ATOM 99 N ILE A 8 30.437 8.539 7.051 1.00 0.00 N ATOM 100 CA ILE A 8 30.332 8.811 8.496 1.00 0.00 C ATOM 101 C ILE A 8 29.011 8.300 9.100 1.00 0.00 C ATOM 102 O ILE A 8 28.012 8.105 8.400 1.00 0.00 O ATOM 103 CB ILE A 8 30.522 10.317 8.799 1.00 0.00 C ATOM 104 CG1 ILE A 8 29.473 11.211 8.095 1.00 0.00 C ATOM 105 CG2 ILE A 8 31.964 10.728 8.452 1.00 0.00 C ATOM 106 CD1 ILE A 8 29.534 12.685 8.513 1.00 0.00 C ATOM 0 H ILE A 8 30.215 9.350 6.473 1.00 0.00 H new ATOM 0 HA ILE A 8 31.140 8.256 8.973 1.00 0.00 H new ATOM 0 HB ILE A 8 30.356 10.473 9.865 1.00 0.00 H new ATOM 0 HG12 ILE A 8 29.617 11.143 7.017 1.00 0.00 H new ATOM 0 HG13 ILE A 8 28.477 10.823 8.309 1.00 0.00 H new ATOM 0 HG21 ILE A 8 32.101 11.788 8.664 1.00 0.00 H new ATOM 0 HG22 ILE A 8 32.663 10.145 9.051 1.00 0.00 H new ATOM 0 HG23 ILE A 8 32.151 10.543 7.394 1.00 0.00 H new ATOM 0 HD11 ILE A 8 28.769 13.247 7.977 1.00 0.00 H new ATOM 0 HD12 ILE A 8 29.360 12.766 9.586 1.00 0.00 H new ATOM 0 HD13 ILE A 8 30.517 13.091 8.273 1.00 0.00 H new ATOM 118 N ARG A 9 29.006 8.119 10.426 1.00 0.00 N ATOM 119 CA ARG A 9 27.840 7.678 11.210 1.00 0.00 C ATOM 120 C ARG A 9 26.829 8.813 11.391 1.00 0.00 C ATOM 121 O ARG A 9 27.203 9.983 11.491 1.00 0.00 O ATOM 122 CB ARG A 9 28.303 7.121 12.570 1.00 0.00 C ATOM 123 CG ARG A 9 29.277 5.948 12.378 1.00 0.00 C ATOM 124 CD ARG A 9 29.387 5.040 13.601 1.00 0.00 C ATOM 125 NE ARG A 9 30.343 3.956 13.331 1.00 0.00 N ATOM 126 CZ ARG A 9 30.731 3.021 14.180 1.00 0.00 C ATOM 127 NH1 ARG A 9 31.644 2.159 13.823 1.00 0.00 N ATOM 128 NH2 ARG A 9 30.241 2.913 15.386 1.00 0.00 N ATOM 0 H ARG A 9 29.833 8.279 11.001 1.00 0.00 H new ATOM 0 HA ARG A 9 27.335 6.883 10.662 1.00 0.00 H new ATOM 0 HB2 ARG A 9 28.787 7.910 13.145 1.00 0.00 H new ATOM 0 HB3 ARG A 9 27.438 6.791 13.146 1.00 0.00 H new ATOM 0 HG2 ARG A 9 28.954 5.354 11.523 1.00 0.00 H new ATOM 0 HG3 ARG A 9 30.265 6.342 12.138 1.00 0.00 H new ATOM 0 HD2 ARG A 9 29.713 5.618 14.466 1.00 0.00 H new ATOM 0 HD3 ARG A 9 28.410 4.623 13.845 1.00 0.00 H new ATOM 0 HE ARG A 9 30.747 3.923 12.395 1.00 0.00 H new ATOM 0 HH11 ARG A 9 32.056 2.209 12.891 1.00 0.00 H new ATOM 0 HH12 ARG A 9 31.946 1.436 14.476 1.00 0.00 H new ATOM 0 HH21 ARG A 9 29.528 3.567 15.707 1.00 0.00 H new ATOM 0 HH22 ARG A 9 30.572 2.174 16.007 1.00 0.00 H new ATOM 142 N ASP A 10 25.547 8.460 11.442 1.00 0.00 N ATOM 143 CA ASP A 10 24.427 9.399 11.582 1.00 0.00 C ATOM 144 C ASP A 10 23.184 8.711 12.179 1.00 0.00 C ATOM 145 O ASP A 10 22.421 8.058 11.474 1.00 0.00 O ATOM 146 CB ASP A 10 24.121 10.002 10.194 1.00 0.00 C ATOM 147 CG ASP A 10 22.905 10.933 10.186 1.00 0.00 C ATOM 148 OD1 ASP A 10 22.277 11.061 9.110 1.00 0.00 O ATOM 149 OD2 ASP A 10 22.601 11.516 11.254 1.00 0.00 O ATOM 0 H ASP A 10 25.246 7.487 11.386 1.00 0.00 H new ATOM 0 HA ASP A 10 24.703 10.193 12.275 1.00 0.00 H new ATOM 0 HB2 ASP A 10 24.994 10.555 9.847 1.00 0.00 H new ATOM 0 HB3 ASP A 10 23.953 9.192 9.484 1.00 0.00 H new ATOM 154 N THR A 11 22.929 8.873 13.479 1.00 0.00 N ATOM 155 CA THR A 11 21.765 8.270 14.170 1.00 0.00 C ATOM 156 C THR A 11 20.399 8.567 13.530 1.00 0.00 C ATOM 157 O THR A 11 19.456 7.795 13.725 1.00 0.00 O ATOM 158 CB THR A 11 21.714 8.701 15.645 1.00 0.00 C ATOM 159 OG1 THR A 11 21.736 10.111 15.732 1.00 0.00 O ATOM 160 CG2 THR A 11 22.910 8.167 16.435 1.00 0.00 C ATOM 0 H THR A 11 23.523 9.429 14.095 1.00 0.00 H new ATOM 0 HA THR A 11 21.931 7.197 14.076 1.00 0.00 H new ATOM 0 HB THR A 11 20.795 8.293 16.067 1.00 0.00 H new ATOM 0 HG1 THR A 11 21.702 10.381 16.673 1.00 0.00 H new ATOM 0 HG21 THR A 11 22.836 8.494 17.472 1.00 0.00 H new ATOM 0 HG22 THR A 11 22.914 7.078 16.397 1.00 0.00 H new ATOM 0 HG23 THR A 11 23.833 8.548 15.999 1.00 0.00 H new ATOM 168 N LYS A 12 20.278 9.634 12.725 1.00 0.00 N ATOM 169 CA LYS A 12 19.031 10.032 12.047 1.00 0.00 C ATOM 170 C LYS A 12 18.513 8.990 11.053 1.00 0.00 C ATOM 171 O LYS A 12 17.301 8.893 10.860 1.00 0.00 O ATOM 172 CB LYS A 12 19.188 11.402 11.368 1.00 0.00 C ATOM 173 CG LYS A 12 19.614 12.537 12.317 1.00 0.00 C ATOM 174 CD LYS A 12 18.591 12.821 13.431 1.00 0.00 C ATOM 175 CE LYS A 12 19.035 13.978 14.336 1.00 0.00 C ATOM 176 NZ LYS A 12 19.033 15.273 13.622 1.00 0.00 N ATOM 0 H LYS A 12 21.059 10.258 12.522 1.00 0.00 H new ATOM 0 HA LYS A 12 18.276 10.106 12.829 1.00 0.00 H new ATOM 0 HB2 LYS A 12 19.926 11.316 10.570 1.00 0.00 H new ATOM 0 HB3 LYS A 12 18.242 11.672 10.900 1.00 0.00 H new ATOM 0 HG2 LYS A 12 20.572 12.281 12.770 1.00 0.00 H new ATOM 0 HG3 LYS A 12 19.769 13.446 11.737 1.00 0.00 H new ATOM 0 HD2 LYS A 12 17.626 13.059 12.985 1.00 0.00 H new ATOM 0 HD3 LYS A 12 18.451 11.923 14.033 1.00 0.00 H new ATOM 0 HE2 LYS A 12 18.371 14.039 15.198 1.00 0.00 H new ATOM 0 HE3 LYS A 12 20.036 13.776 14.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 19.206 16.043 14.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 19.781 15.272 12.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 18.110 15.416 13.165 1.00 0.00 H new ATOM 190 N TRP A 13 19.398 8.182 10.456 1.00 0.00 N ATOM 191 CA TRP A 13 18.975 7.087 9.563 1.00 0.00 C ATOM 192 C TRP A 13 18.570 5.824 10.346 1.00 0.00 C ATOM 193 O TRP A 13 17.928 4.946 9.776 1.00 0.00 O ATOM 194 CB TRP A 13 20.025 6.794 8.476 1.00 0.00 C ATOM 195 CG TRP A 13 21.130 5.826 8.796 1.00 0.00 C ATOM 196 CD1 TRP A 13 22.371 6.163 9.207 1.00 0.00 C ATOM 197 CD2 TRP A 13 21.151 4.370 8.639 1.00 0.00 C ATOM 198 NE1 TRP A 13 23.146 5.030 9.358 1.00 0.00 N ATOM 199 CE2 TRP A 13 22.453 3.896 8.993 1.00 0.00 C ATOM 200 CE3 TRP A 13 20.216 3.404 8.201 1.00 0.00 C ATOM 201 CZ2 TRP A 13 22.807 2.542 8.914 1.00 0.00 C ATOM 202 CZ3 TRP A 13 20.561 2.040 8.126 1.00 0.00 C ATOM 203 CH2 TRP A 13 21.853 1.608 8.480 1.00 0.00 C ATOM 0 H TRP A 13 20.408 8.262 10.572 1.00 0.00 H new ATOM 0 HA TRP A 13 18.078 7.427 9.045 1.00 0.00 H new ATOM 0 HB2 TRP A 13 19.499 6.420 7.598 1.00 0.00 H new ATOM 0 HB3 TRP A 13 20.484 7.741 8.193 1.00 0.00 H new ATOM 0 HD1 TRP A 13 22.709 7.172 9.391 1.00 0.00 H new ATOM 0 HE1 TRP A 13 24.108 5.032 9.696 1.00 0.00 H new ATOM 0 HE3 TRP A 13 19.221 3.717 7.919 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 23.802 2.221 9.184 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 19.828 1.320 7.794 1.00 0.00 H new ATOM 0 HH2 TRP A 13 22.110 0.561 8.418 1.00 0.00 H new ATOM 214 N LEU A 14 18.899 5.745 11.645 1.00 0.00 N ATOM 215 CA LEU A 14 18.574 4.629 12.543 1.00 0.00 C ATOM 216 C LEU A 14 17.412 4.935 13.510 1.00 0.00 C ATOM 217 O LEU A 14 16.879 4.006 14.114 1.00 0.00 O ATOM 218 CB LEU A 14 19.834 4.219 13.332 1.00 0.00 C ATOM 219 CG LEU A 14 20.958 3.581 12.492 1.00 0.00 C ATOM 220 CD1 LEU A 14 22.181 3.341 13.378 1.00 0.00 C ATOM 221 CD2 LEU A 14 20.548 2.232 11.898 1.00 0.00 C ATOM 0 H LEU A 14 19.419 6.486 12.115 1.00 0.00 H new ATOM 0 HA LEU A 14 18.235 3.805 11.915 1.00 0.00 H new ATOM 0 HB2 LEU A 14 20.233 5.102 13.832 1.00 0.00 H new ATOM 0 HB3 LEU A 14 19.542 3.516 14.112 1.00 0.00 H new ATOM 0 HG LEU A 14 21.176 4.272 11.678 1.00 0.00 H new ATOM 0 HD11 LEU A 14 22.977 2.890 12.785 1.00 0.00 H new ATOM 0 HD12 LEU A 14 22.527 4.291 13.786 1.00 0.00 H new ATOM 0 HD13 LEU A 14 21.913 2.671 14.195 1.00 0.00 H new ATOM 0 HD21 LEU A 14 21.374 1.825 11.316 1.00 0.00 H new ATOM 0 HD22 LEU A 14 20.296 1.541 12.703 1.00 0.00 H new ATOM 0 HD23 LEU A 14 19.681 2.367 11.252 1.00 0.00 H new ATOM 233 N THR A 15 17.001 6.195 13.690 1.00 0.00 N ATOM 234 CA THR A 15 15.899 6.549 14.608 1.00 0.00 C ATOM 235 C THR A 15 14.491 6.320 14.046 1.00 0.00 C ATOM 236 O THR A 15 14.239 6.475 12.849 1.00 0.00 O ATOM 237 CB THR A 15 15.950 8.027 15.042 1.00 0.00 C ATOM 238 OG1 THR A 15 16.389 8.884 14.011 1.00 0.00 O ATOM 239 CG2 THR A 15 16.860 8.219 16.248 1.00 0.00 C ATOM 0 H THR A 15 17.414 6.995 13.211 1.00 0.00 H new ATOM 0 HA THR A 15 16.064 5.872 15.446 1.00 0.00 H new ATOM 0 HB THR A 15 14.924 8.291 15.300 1.00 0.00 H new ATOM 0 HG1 THR A 15 16.402 9.808 14.337 1.00 0.00 H new ATOM 0 HG21 THR A 15 16.874 9.272 16.529 1.00 0.00 H new ATOM 0 HG22 THR A 15 16.488 7.626 17.083 1.00 0.00 H new ATOM 0 HG23 THR A 15 17.870 7.897 15.996 1.00 0.00 H new ATOM 247 N LEU A 16 13.551 6.026 14.953 1.00 0.00 N ATOM 248 CA LEU A 16 12.109 5.878 14.714 1.00 0.00 C ATOM 249 C LEU A 16 11.349 6.634 15.815 1.00 0.00 C ATOM 250 O LEU A 16 11.746 6.620 16.982 1.00 0.00 O ATOM 251 CB LEU A 16 11.722 4.387 14.649 1.00 0.00 C ATOM 252 CG LEU A 16 12.140 3.685 13.341 1.00 0.00 C ATOM 253 CD1 LEU A 16 11.853 2.189 13.436 1.00 0.00 C ATOM 254 CD2 LEU A 16 11.380 4.213 12.118 1.00 0.00 C ATOM 0 H LEU A 16 13.791 5.876 15.933 1.00 0.00 H new ATOM 0 HA LEU A 16 11.837 6.309 13.750 1.00 0.00 H new ATOM 0 HB2 LEU A 16 12.180 3.867 15.490 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.642 4.297 14.768 1.00 0.00 H new ATOM 0 HG LEU A 16 13.204 3.886 13.215 1.00 0.00 H new ATOM 0 HD11 LEU A 16 12.151 1.702 12.508 1.00 0.00 H new ATOM 0 HD12 LEU A 16 12.415 1.763 14.267 1.00 0.00 H new ATOM 0 HD13 LEU A 16 10.787 2.033 13.601 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.714 3.684 11.226 1.00 0.00 H new ATOM 0 HD22 LEU A 16 10.311 4.052 12.257 1.00 0.00 H new ATOM 0 HD23 LEU A 16 11.574 5.279 12.001 1.00 0.00 H new ATOM 266 N GLU A 17 10.285 7.344 15.435 1.00 0.00 N ATOM 267 CA GLU A 17 9.497 8.181 16.350 1.00 0.00 C ATOM 268 C GLU A 17 8.547 7.376 17.256 1.00 0.00 C ATOM 269 O GLU A 17 8.009 6.333 16.876 1.00 0.00 O ATOM 270 CB GLU A 17 8.705 9.234 15.560 1.00 0.00 C ATOM 271 CG GLU A 17 9.614 10.238 14.838 1.00 0.00 C ATOM 272 CD GLU A 17 8.782 11.304 14.115 1.00 0.00 C ATOM 273 OE1 GLU A 17 8.600 12.404 14.691 1.00 0.00 O ATOM 274 OE2 GLU A 17 8.323 11.024 12.980 1.00 0.00 O ATOM 0 H GLU A 17 9.941 7.356 14.475 1.00 0.00 H new ATOM 0 HA GLU A 17 10.214 8.670 17.010 1.00 0.00 H new ATOM 0 HB2 GLU A 17 8.071 8.733 14.829 1.00 0.00 H new ATOM 0 HB3 GLU A 17 8.044 9.772 16.240 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.279 10.716 15.557 1.00 0.00 H new ATOM 0 HG3 GLU A 17 10.244 9.714 14.120 1.00 0.00 H new ATOM 281 N VAL A 18 8.322 7.905 18.460 1.00 0.00 N ATOM 282 CA VAL A 18 7.450 7.357 19.507 1.00 0.00 C ATOM 283 C VAL A 18 6.038 7.939 19.382 1.00 0.00 C ATOM 284 O VAL A 18 5.872 9.131 19.106 1.00 0.00 O ATOM 285 CB VAL A 18 8.045 7.661 20.900 1.00 0.00 C ATOM 286 CG1 VAL A 18 7.177 7.143 22.052 1.00 0.00 C ATOM 287 CG2 VAL A 18 9.426 7.011 21.041 1.00 0.00 C ATOM 0 H VAL A 18 8.767 8.776 18.749 1.00 0.00 H new ATOM 0 HA VAL A 18 7.385 6.276 19.385 1.00 0.00 H new ATOM 0 HB VAL A 18 8.102 8.748 20.966 1.00 0.00 H new ATOM 0 HG11 VAL A 18 7.650 7.388 23.003 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.193 7.610 22.005 1.00 0.00 H new ATOM 0 HG13 VAL A 18 7.069 6.062 21.969 1.00 0.00 H new ATOM 0 HG21 VAL A 18 9.834 7.233 22.027 1.00 0.00 H new ATOM 0 HG22 VAL A 18 9.334 5.932 20.921 1.00 0.00 H new ATOM 0 HG23 VAL A 18 10.094 7.405 20.275 1.00 0.00 H new ATOM 297 N CYS A 19 5.017 7.103 19.589 1.00 0.00 N ATOM 298 CA CYS A 19 3.607 7.490 19.518 1.00 0.00 C ATOM 299 C CYS A 19 3.259 8.616 20.518 1.00 0.00 C ATOM 300 O CYS A 19 3.661 8.595 21.690 1.00 0.00 O ATOM 301 CB CYS A 19 2.779 6.217 19.736 1.00 0.00 C ATOM 302 SG CYS A 19 0.989 6.490 19.565 1.00 0.00 S ATOM 0 H CYS A 19 5.151 6.118 19.815 1.00 0.00 H new ATOM 0 HA CYS A 19 3.376 7.916 18.542 1.00 0.00 H new ATOM 0 HB2 CYS A 19 3.095 5.459 19.019 1.00 0.00 H new ATOM 0 HB3 CYS A 19 2.987 5.822 20.730 1.00 0.00 H new ATOM 307 N ARG A 20 2.518 9.632 20.056 1.00 0.00 N ATOM 308 CA ARG A 20 2.085 10.774 20.879 1.00 0.00 C ATOM 309 C ARG A 20 1.072 10.345 21.939 1.00 0.00 C ATOM 310 O ARG A 20 1.183 10.746 23.097 1.00 0.00 O ATOM 311 CB ARG A 20 1.537 11.880 19.957 1.00 0.00 C ATOM 312 CG ARG A 20 1.043 13.150 20.676 1.00 0.00 C ATOM 313 CD ARG A 20 2.017 13.751 21.704 1.00 0.00 C ATOM 314 NE ARG A 20 3.370 13.945 21.151 1.00 0.00 N ATOM 315 CZ ARG A 20 4.508 13.873 21.824 1.00 0.00 C ATOM 316 NH1 ARG A 20 5.649 13.962 21.199 1.00 0.00 N ATOM 317 NH2 ARG A 20 4.556 13.706 23.119 1.00 0.00 N ATOM 0 H ARG A 20 2.198 9.687 19.089 1.00 0.00 H new ATOM 0 HA ARG A 20 2.940 11.173 21.425 1.00 0.00 H new ATOM 0 HB2 ARG A 20 2.318 12.162 19.251 1.00 0.00 H new ATOM 0 HB3 ARG A 20 0.713 11.469 19.373 1.00 0.00 H new ATOM 0 HG2 ARG A 20 0.821 13.908 19.925 1.00 0.00 H new ATOM 0 HG3 ARG A 20 0.106 12.919 21.182 1.00 0.00 H new ATOM 0 HD2 ARG A 20 1.629 14.708 22.051 1.00 0.00 H new ATOM 0 HD3 ARG A 20 2.073 13.096 22.573 1.00 0.00 H new ATOM 0 HE ARG A 20 3.436 14.155 20.155 1.00 0.00 H new ATOM 0 HH11 ARG A 20 5.668 14.088 20.187 1.00 0.00 H new ATOM 0 HH12 ARG A 20 6.523 13.906 21.722 1.00 0.00 H new ATOM 0 HH21 ARG A 20 3.692 13.625 23.655 1.00 0.00 H new ATOM 0 HH22 ARG A 20 5.457 13.656 23.594 1.00 0.00 H new ATOM 331 N GLU A 21 0.121 9.489 21.578 1.00 0.00 N ATOM 332 CA GLU A 21 -0.868 8.949 22.516 1.00 0.00 C ATOM 333 C GLU A 21 -0.206 8.014 23.547 1.00 0.00 C ATOM 334 O GLU A 21 -0.647 7.956 24.694 1.00 0.00 O ATOM 335 CB GLU A 21 -2.012 8.257 21.755 1.00 0.00 C ATOM 336 CG GLU A 21 -2.805 9.190 20.822 1.00 0.00 C ATOM 337 CD GLU A 21 -3.540 10.304 21.578 1.00 0.00 C ATOM 338 OE1 GLU A 21 -2.939 11.392 21.751 1.00 0.00 O ATOM 339 OE2 GLU A 21 -4.709 10.083 21.976 1.00 0.00 O ATOM 0 H GLU A 21 0.011 9.147 20.624 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.302 9.777 23.076 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -1.598 7.439 21.166 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -2.698 7.815 22.477 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -2.123 9.637 20.098 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.529 8.602 20.257 1.00 0.00 H new ATOM 346 N PHE A 22 0.886 7.324 23.198 1.00 0.00 N ATOM 347 CA PHE A 22 1.644 6.493 24.142 1.00 0.00 C ATOM 348 C PHE A 22 2.333 7.367 25.202 1.00 0.00 C ATOM 349 O PHE A 22 2.246 7.079 26.397 1.00 0.00 O ATOM 350 CB PHE A 22 2.661 5.649 23.370 1.00 0.00 C ATOM 351 CG PHE A 22 3.493 4.700 24.209 1.00 0.00 C ATOM 352 CD1 PHE A 22 2.920 3.517 24.711 1.00 0.00 C ATOM 353 CD2 PHE A 22 4.850 4.982 24.462 1.00 0.00 C ATOM 354 CE1 PHE A 22 3.696 2.622 25.468 1.00 0.00 C ATOM 355 CE2 PHE A 22 5.627 4.085 25.215 1.00 0.00 C ATOM 356 CZ PHE A 22 5.051 2.906 25.719 1.00 0.00 C ATOM 0 H PHE A 22 1.270 7.326 22.253 1.00 0.00 H new ATOM 0 HA PHE A 22 0.961 5.825 24.666 1.00 0.00 H new ATOM 0 HB2 PHE A 22 2.128 5.068 22.617 1.00 0.00 H new ATOM 0 HB3 PHE A 22 3.334 6.320 22.837 1.00 0.00 H new ATOM 0 HD1 PHE A 22 1.881 3.296 24.514 1.00 0.00 H new ATOM 0 HD2 PHE A 22 5.294 5.888 24.077 1.00 0.00 H new ATOM 0 HE1 PHE A 22 3.252 1.717 25.857 1.00 0.00 H new ATOM 0 HE2 PHE A 22 6.668 4.302 25.407 1.00 0.00 H new ATOM 0 HZ PHE A 22 5.648 2.218 26.299 1.00 0.00 H new ATOM 366 N GLN A 23 2.958 8.476 24.782 1.00 0.00 N ATOM 367 CA GLN A 23 3.587 9.458 25.682 1.00 0.00 C ATOM 368 C GLN A 23 2.547 10.128 26.604 1.00 0.00 C ATOM 369 O GLN A 23 2.835 10.390 27.775 1.00 0.00 O ATOM 370 CB GLN A 23 4.350 10.501 24.849 1.00 0.00 C ATOM 371 CG GLN A 23 5.631 9.905 24.242 1.00 0.00 C ATOM 372 CD GLN A 23 6.198 10.784 23.133 1.00 0.00 C ATOM 373 OE1 GLN A 23 7.012 11.673 23.349 1.00 0.00 O ATOM 374 NE2 GLN A 23 5.778 10.572 21.906 1.00 0.00 N ATOM 0 H GLN A 23 3.043 8.721 23.796 1.00 0.00 H new ATOM 0 HA GLN A 23 4.293 8.938 26.330 1.00 0.00 H new ATOM 0 HB2 GLN A 23 3.707 10.874 24.052 1.00 0.00 H new ATOM 0 HB3 GLN A 23 4.606 11.354 25.477 1.00 0.00 H new ATOM 0 HG2 GLN A 23 6.379 9.780 25.025 1.00 0.00 H new ATOM 0 HG3 GLN A 23 5.417 8.913 23.845 1.00 0.00 H new ATOM 0 HE21 GLN A 23 5.100 9.833 21.720 1.00 0.00 H new ATOM 0 HE22 GLN A 23 6.130 11.146 21.140 1.00 0.00 H new ATOM 383 N ARG A 24 1.326 10.363 26.099 1.00 0.00 N ATOM 384 CA ARG A 24 0.177 10.907 26.855 1.00 0.00 C ATOM 385 C ARG A 24 -0.497 9.871 27.772 1.00 0.00 C ATOM 386 O ARG A 24 -1.301 10.248 28.627 1.00 0.00 O ATOM 387 CB ARG A 24 -0.855 11.469 25.862 1.00 0.00 C ATOM 388 CG ARG A 24 -0.395 12.783 25.213 1.00 0.00 C ATOM 389 CD ARG A 24 -1.320 13.139 24.046 1.00 0.00 C ATOM 390 NE ARG A 24 -1.034 14.480 23.508 1.00 0.00 N ATOM 391 CZ ARG A 24 -1.560 14.999 22.411 1.00 0.00 C ATOM 392 NH1 ARG A 24 -2.369 14.333 21.629 1.00 0.00 N ATOM 393 NH2 ARG A 24 -1.269 16.223 22.061 1.00 0.00 N ATOM 0 H ARG A 24 1.099 10.175 25.122 1.00 0.00 H new ATOM 0 HA ARG A 24 0.562 11.692 27.506 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -1.044 10.730 25.083 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -1.799 11.635 26.380 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -0.401 13.585 25.951 1.00 0.00 H new ATOM 0 HG3 ARG A 24 0.631 12.684 24.858 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -1.207 12.398 23.254 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -2.357 13.095 24.378 1.00 0.00 H new ATOM 0 HE ARG A 24 -0.373 15.059 24.026 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -2.619 13.370 21.855 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -2.750 14.776 20.793 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -0.635 16.780 22.634 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -1.675 16.622 21.215 1.00 0.00 H new ATOM 407 N GLY A 25 -0.188 8.581 27.610 1.00 0.00 N ATOM 408 CA GLY A 25 -0.756 7.477 28.394 1.00 0.00 C ATOM 409 C GLY A 25 -2.183 7.085 27.978 1.00 0.00 C ATOM 410 O GLY A 25 -2.968 6.656 28.828 1.00 0.00 O ATOM 0 H GLY A 25 0.483 8.266 26.910 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.108 6.606 28.298 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.759 7.757 29.447 1.00 0.00 H new ATOM 414 N THR A 26 -2.539 7.256 26.698 1.00 0.00 N ATOM 415 CA THR A 26 -3.885 6.999 26.145 1.00 0.00 C ATOM 416 C THR A 26 -3.940 5.985 24.991 1.00 0.00 C ATOM 417 O THR A 26 -5.020 5.443 24.735 1.00 0.00 O ATOM 418 CB THR A 26 -4.553 8.311 25.694 1.00 0.00 C ATOM 419 OG1 THR A 26 -3.735 9.006 24.776 1.00 0.00 O ATOM 420 CG2 THR A 26 -4.823 9.258 26.864 1.00 0.00 C ATOM 0 H THR A 26 -1.881 7.587 25.993 1.00 0.00 H new ATOM 0 HA THR A 26 -4.431 6.546 26.973 1.00 0.00 H new ATOM 0 HB THR A 26 -5.497 8.018 25.234 1.00 0.00 H new ATOM 0 HG1 THR A 26 -4.259 9.236 23.980 1.00 0.00 H new ATOM 0 HG21 THR A 26 -5.295 10.168 26.494 1.00 0.00 H new ATOM 0 HG22 THR A 26 -5.485 8.772 27.580 1.00 0.00 H new ATOM 0 HG23 THR A 26 -3.882 9.510 27.353 1.00 0.00 H new ATOM 428 N CYS A 27 -2.823 5.678 24.313 1.00 0.00 N ATOM 429 CA CYS A 27 -2.786 4.673 23.236 1.00 0.00 C ATOM 430 C CYS A 27 -3.160 3.277 23.791 1.00 0.00 C ATOM 431 O CYS A 27 -2.674 2.878 24.859 1.00 0.00 O ATOM 432 CB CYS A 27 -1.401 4.692 22.562 1.00 0.00 C ATOM 433 SG CYS A 27 -1.444 3.993 20.876 1.00 0.00 S ATOM 0 H CYS A 27 -1.921 6.118 24.495 1.00 0.00 H new ATOM 0 HA CYS A 27 -3.526 4.916 22.473 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -1.034 5.717 22.519 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -0.695 4.126 23.170 1.00 0.00 H new ATOM 438 N SER A 28 -4.040 2.547 23.091 1.00 0.00 N ATOM 439 CA SER A 28 -4.567 1.238 23.525 1.00 0.00 C ATOM 440 C SER A 28 -4.599 0.192 22.396 1.00 0.00 C ATOM 441 O SER A 28 -5.650 -0.359 22.054 1.00 0.00 O ATOM 442 CB SER A 28 -5.963 1.415 24.154 1.00 0.00 C ATOM 443 OG SER A 28 -5.938 2.277 25.284 1.00 0.00 O ATOM 0 H SER A 28 -4.414 2.851 22.192 1.00 0.00 H new ATOM 0 HA SER A 28 -3.878 0.848 24.274 1.00 0.00 H new ATOM 0 HB2 SER A 28 -6.648 1.818 23.407 1.00 0.00 H new ATOM 0 HB3 SER A 28 -6.352 0.441 24.451 1.00 0.00 H new ATOM 0 HG SER A 28 -5.655 3.173 25.006 1.00 0.00 H new ATOM 449 N ARG A 29 -3.421 -0.106 21.834 1.00 0.00 N ATOM 450 CA ARG A 29 -3.172 -1.118 20.785 1.00 0.00 C ATOM 451 C ARG A 29 -1.685 -1.530 20.776 1.00 0.00 C ATOM 452 O ARG A 29 -0.849 -0.748 21.245 1.00 0.00 O ATOM 453 CB ARG A 29 -3.648 -0.594 19.412 1.00 0.00 C ATOM 454 CG ARG A 29 -2.906 0.646 18.896 1.00 0.00 C ATOM 455 CD ARG A 29 -3.530 1.112 17.577 1.00 0.00 C ATOM 456 NE ARG A 29 -2.820 2.282 17.051 1.00 0.00 N ATOM 457 CZ ARG A 29 -3.191 3.079 16.070 1.00 0.00 C ATOM 458 NH1 ARG A 29 -2.395 4.051 15.724 1.00 0.00 N ATOM 459 NH2 ARG A 29 -4.319 2.940 15.417 1.00 0.00 N ATOM 0 H ARG A 29 -2.565 0.376 22.110 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.750 -2.016 21.005 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.542 -1.393 18.679 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -4.711 -0.361 19.478 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -2.957 1.445 19.635 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -1.851 0.415 18.748 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -3.497 0.303 16.848 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -4.580 1.358 17.733 1.00 0.00 H new ATOM 0 HE ARG A 29 -1.931 2.506 17.499 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -1.508 4.181 16.210 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -2.659 4.682 14.967 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -4.960 2.185 15.661 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -4.556 3.587 14.665 1.00 0.00 H new ATOM 473 N PRO A 30 -1.320 -2.730 20.281 1.00 0.00 N ATOM 474 CA PRO A 30 0.071 -3.185 20.281 1.00 0.00 C ATOM 475 C PRO A 30 0.961 -2.385 19.319 1.00 0.00 C ATOM 476 O PRO A 30 0.498 -1.822 18.325 1.00 0.00 O ATOM 477 CB PRO A 30 0.015 -4.671 19.907 1.00 0.00 C ATOM 478 CG PRO A 30 -1.253 -4.779 19.065 1.00 0.00 C ATOM 479 CD PRO A 30 -2.186 -3.761 19.719 1.00 0.00 C ATOM 0 HA PRO A 30 0.528 -3.031 21.258 1.00 0.00 H new ATOM 0 HB2 PRO A 30 0.897 -4.977 19.345 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -0.035 -5.306 20.792 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -1.064 -4.540 18.018 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -1.671 -5.785 19.092 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -2.875 -3.337 18.989 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -2.792 -4.228 20.495 1.00 0.00 H new ATOM 487 N ASP A 31 2.268 -2.387 19.599 1.00 0.00 N ATOM 488 CA ASP A 31 3.321 -1.729 18.806 1.00 0.00 C ATOM 489 C ASP A 31 3.285 -2.104 17.309 1.00 0.00 C ATOM 490 O ASP A 31 3.613 -1.289 16.448 1.00 0.00 O ATOM 491 CB ASP A 31 4.667 -2.112 19.441 1.00 0.00 C ATOM 492 CG ASP A 31 5.874 -1.511 18.718 1.00 0.00 C ATOM 493 OD1 ASP A 31 6.480 -2.241 17.901 1.00 0.00 O ATOM 494 OD2 ASP A 31 6.215 -0.342 19.013 1.00 0.00 O ATOM 0 H ASP A 31 2.641 -2.866 20.418 1.00 0.00 H new ATOM 0 HA ASP A 31 3.163 -0.651 18.827 1.00 0.00 H new ATOM 0 HB2 ASP A 31 4.676 -1.785 20.481 1.00 0.00 H new ATOM 0 HB3 ASP A 31 4.761 -3.198 19.448 1.00 0.00 H new ATOM 499 N THR A 32 2.874 -3.337 16.997 1.00 0.00 N ATOM 500 CA THR A 32 2.752 -3.872 15.631 1.00 0.00 C ATOM 501 C THR A 32 1.597 -3.249 14.837 1.00 0.00 C ATOM 502 O THR A 32 1.681 -3.136 13.615 1.00 0.00 O ATOM 503 CB THR A 32 2.512 -5.391 15.683 1.00 0.00 C ATOM 504 OG1 THR A 32 3.322 -5.999 16.671 1.00 0.00 O ATOM 505 CG2 THR A 32 2.825 -6.096 14.361 1.00 0.00 C ATOM 0 H THR A 32 2.607 -4.016 17.710 1.00 0.00 H new ATOM 0 HA THR A 32 3.687 -3.626 15.128 1.00 0.00 H new ATOM 0 HB THR A 32 1.451 -5.501 15.909 1.00 0.00 H new ATOM 0 HG1 THR A 32 3.151 -6.964 16.686 1.00 0.00 H new ATOM 0 HG21 THR A 32 2.635 -7.164 14.465 1.00 0.00 H new ATOM 0 HG22 THR A 32 2.191 -5.689 13.573 1.00 0.00 H new ATOM 0 HG23 THR A 32 3.872 -5.937 14.103 1.00 0.00 H new ATOM 513 N GLU A 33 0.519 -2.838 15.512 1.00 0.00 N ATOM 514 CA GLU A 33 -0.669 -2.245 14.883 1.00 0.00 C ATOM 515 C GLU A 33 -0.583 -0.711 14.792 1.00 0.00 C ATOM 516 O GLU A 33 -1.114 -0.121 13.845 1.00 0.00 O ATOM 517 CB GLU A 33 -1.910 -2.679 15.686 1.00 0.00 C ATOM 518 CG GLU A 33 -3.232 -2.329 14.989 1.00 0.00 C ATOM 519 CD GLU A 33 -4.433 -2.878 15.767 1.00 0.00 C ATOM 520 OE1 GLU A 33 -5.054 -2.092 16.521 1.00 0.00 O ATOM 521 OE2 GLU A 33 -4.734 -4.087 15.613 1.00 0.00 O ATOM 0 H GLU A 33 0.445 -2.908 16.527 1.00 0.00 H new ATOM 0 HA GLU A 33 -0.737 -2.604 13.856 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.869 -3.755 15.854 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.886 -2.203 16.666 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.321 -1.247 14.895 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.233 -2.738 13.979 1.00 0.00 H new ATOM 528 N CYS A 34 0.085 -0.067 15.755 1.00 0.00 N ATOM 529 CA CYS A 34 0.235 1.389 15.790 1.00 0.00 C ATOM 530 C CYS A 34 1.161 1.937 14.679 1.00 0.00 C ATOM 531 O CYS A 34 2.022 1.237 14.132 1.00 0.00 O ATOM 532 CB CYS A 34 0.659 1.820 17.204 1.00 0.00 C ATOM 533 SG CYS A 34 0.161 3.546 17.539 1.00 0.00 S ATOM 0 H CYS A 34 0.538 -0.544 16.534 1.00 0.00 H new ATOM 0 HA CYS A 34 -0.732 1.840 15.568 1.00 0.00 H new ATOM 0 HB2 CYS A 34 0.206 1.157 17.941 1.00 0.00 H new ATOM 0 HB3 CYS A 34 1.740 1.722 17.309 1.00 0.00 H new ATOM 538 N LYS A 35 0.971 3.221 14.349 1.00 0.00 N ATOM 539 CA LYS A 35 1.716 3.972 13.319 1.00 0.00 C ATOM 540 C LYS A 35 3.119 4.416 13.765 1.00 0.00 C ATOM 541 O LYS A 35 3.909 4.860 12.929 1.00 0.00 O ATOM 542 CB LYS A 35 0.896 5.206 12.900 1.00 0.00 C ATOM 543 CG LYS A 35 -0.427 4.834 12.206 1.00 0.00 C ATOM 544 CD LYS A 35 -1.264 6.065 11.813 1.00 0.00 C ATOM 545 CE LYS A 35 -0.574 7.015 10.823 1.00 0.00 C ATOM 546 NZ LYS A 35 -0.315 6.361 9.521 1.00 0.00 N ATOM 0 H LYS A 35 0.264 3.794 14.810 1.00 0.00 H new ATOM 0 HA LYS A 35 1.862 3.291 12.481 1.00 0.00 H new ATOM 0 HB2 LYS A 35 0.682 5.811 13.781 1.00 0.00 H new ATOM 0 HB3 LYS A 35 1.493 5.823 12.228 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -0.211 4.248 11.313 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -1.014 4.199 12.870 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -2.203 5.726 11.377 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -1.515 6.621 12.716 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -1.198 7.895 10.669 1.00 0.00 H new ATOM 0 HE3 LYS A 35 0.367 7.362 11.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 0.151 7.035 8.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 0.301 5.536 9.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -1.216 6.052 9.102 1.00 0.00 H new ATOM 560 N PHE A 36 3.428 4.303 15.056 1.00 0.00 N ATOM 561 CA PHE A 36 4.684 4.719 15.690 1.00 0.00 C ATOM 562 C PHE A 36 5.164 3.692 16.737 1.00 0.00 C ATOM 563 O PHE A 36 4.540 2.646 16.931 1.00 0.00 O ATOM 564 CB PHE A 36 4.485 6.118 16.292 1.00 0.00 C ATOM 565 CG PHE A 36 4.236 7.216 15.275 1.00 0.00 C ATOM 566 CD1 PHE A 36 5.296 7.680 14.473 1.00 0.00 C ATOM 567 CD2 PHE A 36 2.951 7.772 15.123 1.00 0.00 C ATOM 568 CE1 PHE A 36 5.074 8.696 13.526 1.00 0.00 C ATOM 569 CE2 PHE A 36 2.728 8.784 14.173 1.00 0.00 C ATOM 570 CZ PHE A 36 3.789 9.248 13.375 1.00 0.00 C ATOM 0 H PHE A 36 2.775 3.897 15.726 1.00 0.00 H new ATOM 0 HA PHE A 36 5.475 4.764 14.941 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.643 6.085 16.984 1.00 0.00 H new ATOM 0 HB3 PHE A 36 5.368 6.376 16.876 1.00 0.00 H new ATOM 0 HD1 PHE A 36 6.282 7.255 14.585 1.00 0.00 H new ATOM 0 HD2 PHE A 36 2.135 7.420 15.737 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.890 9.052 12.915 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.741 9.206 14.056 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.617 10.027 12.647 1.00 0.00 H new ATOM 580 N ALA A 37 6.301 3.959 17.388 1.00 0.00 N ATOM 581 CA ALA A 37 6.927 3.036 18.334 1.00 0.00 C ATOM 582 C ALA A 37 6.450 3.220 19.792 1.00 0.00 C ATOM 583 O ALA A 37 6.163 4.335 20.234 1.00 0.00 O ATOM 584 CB ALA A 37 8.442 3.265 18.241 1.00 0.00 C ATOM 0 H ALA A 37 6.816 4.832 17.270 1.00 0.00 H new ATOM 0 HA ALA A 37 6.644 2.018 18.067 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.954 2.596 18.932 1.00 0.00 H new ATOM 0 HB2 ALA A 37 8.779 3.064 17.224 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.670 4.299 18.501 1.00 0.00 H new ATOM 590 N HIS A 38 6.399 2.111 20.541 1.00 0.00 N ATOM 591 CA HIS A 38 6.017 2.007 21.960 1.00 0.00 C ATOM 592 C HIS A 38 7.186 1.419 22.800 1.00 0.00 C ATOM 593 O HIS A 38 7.130 0.251 23.204 1.00 0.00 O ATOM 594 CB HIS A 38 4.721 1.181 22.096 1.00 0.00 C ATOM 595 CG HIS A 38 3.489 1.743 21.418 1.00 0.00 C ATOM 596 ND1 HIS A 38 2.354 1.037 21.076 1.00 0.00 N ATOM 597 CD2 HIS A 38 3.251 3.051 21.083 1.00 0.00 C ATOM 598 CE1 HIS A 38 1.467 1.898 20.540 1.00 0.00 C ATOM 599 NE2 HIS A 38 1.972 3.142 20.519 1.00 0.00 N ATOM 0 H HIS A 38 6.639 1.201 20.148 1.00 0.00 H new ATOM 0 HA HIS A 38 5.815 3.002 22.355 1.00 0.00 H new ATOM 0 HB2 HIS A 38 4.907 0.185 21.695 1.00 0.00 H new ATOM 0 HB3 HIS A 38 4.502 1.061 23.157 1.00 0.00 H new ATOM 0 HD1 HIS A 38 2.211 0.036 21.206 1.00 0.00 H new ATOM 0 HD2 HIS A 38 3.935 3.874 21.229 1.00 0.00 H new ATOM 0 HE1 HIS A 38 0.487 1.626 20.178 1.00 0.00 H new ATOM 607 N PRO A 39 8.278 2.177 23.036 1.00 0.00 N ATOM 608 CA PRO A 39 9.467 1.719 23.765 1.00 0.00 C ATOM 609 C PRO A 39 9.271 1.574 25.283 1.00 0.00 C ATOM 610 O PRO A 39 8.336 2.114 25.877 1.00 0.00 O ATOM 611 CB PRO A 39 10.548 2.759 23.474 1.00 0.00 C ATOM 612 CG PRO A 39 9.733 4.042 23.324 1.00 0.00 C ATOM 613 CD PRO A 39 8.474 3.556 22.610 1.00 0.00 C ATOM 0 HA PRO A 39 9.724 0.714 23.429 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.273 2.830 24.285 1.00 0.00 H new ATOM 0 HB3 PRO A 39 11.106 2.523 22.568 1.00 0.00 H new ATOM 0 HG2 PRO A 39 9.503 4.491 24.290 1.00 0.00 H new ATOM 0 HG3 PRO A 39 10.265 4.794 22.741 1.00 0.00 H new ATOM 0 HD2 PRO A 39 7.614 4.172 22.873 1.00 0.00 H new ATOM 0 HD3 PRO A 39 8.591 3.617 21.528 1.00 0.00 H new ATOM 621 N SER A 40 10.216 0.877 25.916 1.00 0.00 N ATOM 622 CA SER A 40 10.299 0.677 27.367 1.00 0.00 C ATOM 623 C SER A 40 11.293 1.673 27.979 1.00 0.00 C ATOM 624 O SER A 40 12.136 2.246 27.281 1.00 0.00 O ATOM 625 CB SER A 40 10.748 -0.761 27.675 1.00 0.00 C ATOM 626 OG SER A 40 9.791 -1.693 27.196 1.00 0.00 O ATOM 0 H SER A 40 10.975 0.417 25.414 1.00 0.00 H new ATOM 0 HA SER A 40 9.314 0.844 27.802 1.00 0.00 H new ATOM 0 HB2 SER A 40 11.716 -0.953 27.212 1.00 0.00 H new ATOM 0 HB3 SER A 40 10.879 -0.885 28.750 1.00 0.00 H new ATOM 0 HG SER A 40 10.092 -2.604 27.398 1.00 0.00 H new ATOM 632 N LYS A 41 11.226 1.866 29.301 1.00 0.00 N ATOM 633 CA LYS A 41 12.093 2.798 30.061 1.00 0.00 C ATOM 634 C LYS A 41 13.606 2.572 29.897 1.00 0.00 C ATOM 635 O LYS A 41 14.392 3.501 30.084 1.00 0.00 O ATOM 636 CB LYS A 41 11.677 2.810 31.546 1.00 0.00 C ATOM 637 CG LYS A 41 11.958 1.488 32.284 1.00 0.00 C ATOM 638 CD LYS A 41 11.481 1.562 33.744 1.00 0.00 C ATOM 639 CE LYS A 41 11.828 0.290 34.528 1.00 0.00 C ATOM 640 NZ LYS A 41 11.080 -0.887 34.037 1.00 0.00 N ATOM 0 H LYS A 41 10.557 1.373 29.892 1.00 0.00 H new ATOM 0 HA LYS A 41 11.928 3.781 29.621 1.00 0.00 H new ATOM 0 HB2 LYS A 41 12.204 3.617 32.054 1.00 0.00 H new ATOM 0 HB3 LYS A 41 10.612 3.033 31.613 1.00 0.00 H new ATOM 0 HG2 LYS A 41 11.453 0.668 31.774 1.00 0.00 H new ATOM 0 HG3 LYS A 41 13.026 1.272 32.257 1.00 0.00 H new ATOM 0 HD2 LYS A 41 11.937 2.424 34.231 1.00 0.00 H new ATOM 0 HD3 LYS A 41 10.402 1.718 33.765 1.00 0.00 H new ATOM 0 HE2 LYS A 41 12.898 0.097 34.450 1.00 0.00 H new ATOM 0 HE3 LYS A 41 11.608 0.444 35.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 11.306 -1.713 34.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 10.059 -0.695 34.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 11.348 -1.082 33.051 1.00 0.00 H new ATOM 654 N SER A 42 14.005 1.351 29.541 1.00 0.00 N ATOM 655 CA SER A 42 15.402 0.942 29.324 1.00 0.00 C ATOM 656 C SER A 42 15.947 1.277 27.923 1.00 0.00 C ATOM 657 O SER A 42 17.162 1.229 27.719 1.00 0.00 O ATOM 658 CB SER A 42 15.540 -0.571 29.548 1.00 0.00 C ATOM 659 OG SER A 42 15.030 -0.938 30.823 1.00 0.00 O ATOM 0 H SER A 42 13.344 0.589 29.389 1.00 0.00 H new ATOM 0 HA SER A 42 15.991 1.513 30.042 1.00 0.00 H new ATOM 0 HB2 SER A 42 15.003 -1.110 28.767 1.00 0.00 H new ATOM 0 HB3 SER A 42 16.588 -0.861 29.473 1.00 0.00 H new ATOM 0 HG SER A 42 15.125 -1.905 30.947 1.00 0.00 H new ATOM 665 N CYS A 43 15.086 1.605 26.950 1.00 0.00 N ATOM 666 CA CYS A 43 15.496 1.936 25.582 1.00 0.00 C ATOM 667 C CYS A 43 16.149 3.333 25.481 1.00 0.00 C ATOM 668 O CYS A 43 16.009 4.168 26.377 1.00 0.00 O ATOM 669 CB CYS A 43 14.263 1.842 24.664 1.00 0.00 C ATOM 670 SG CYS A 43 13.544 0.171 24.689 1.00 0.00 S ATOM 0 H CYS A 43 14.077 1.648 27.093 1.00 0.00 H new ATOM 0 HA CYS A 43 16.257 1.222 25.268 1.00 0.00 H new ATOM 0 HB2 CYS A 43 13.514 2.567 24.983 1.00 0.00 H new ATOM 0 HB3 CYS A 43 14.546 2.103 23.644 1.00 0.00 H new ATOM 0 HG CYS A 43 12.507 0.133 23.906 1.00 0.00 H new ATOM 676 N GLN A 44 16.827 3.622 24.362 1.00 0.00 N ATOM 677 CA GLN A 44 17.468 4.921 24.055 1.00 0.00 C ATOM 678 C GLN A 44 16.448 6.020 23.665 1.00 0.00 C ATOM 679 O GLN A 44 16.633 6.741 22.681 1.00 0.00 O ATOM 680 CB GLN A 44 18.543 4.727 22.962 1.00 0.00 C ATOM 681 CG GLN A 44 19.675 3.762 23.348 1.00 0.00 C ATOM 682 CD GLN A 44 20.565 4.313 24.457 1.00 0.00 C ATOM 683 OE1 GLN A 44 21.602 4.906 24.207 1.00 0.00 O ATOM 684 NE2 GLN A 44 20.223 4.131 25.715 1.00 0.00 N ATOM 0 H GLN A 44 16.952 2.938 23.616 1.00 0.00 H new ATOM 0 HA GLN A 44 17.948 5.277 24.967 1.00 0.00 H new ATOM 0 HB2 GLN A 44 18.061 4.358 22.057 1.00 0.00 H new ATOM 0 HB3 GLN A 44 18.976 5.697 22.720 1.00 0.00 H new ATOM 0 HG2 GLN A 44 19.245 2.814 23.670 1.00 0.00 H new ATOM 0 HG3 GLN A 44 20.284 3.553 22.469 1.00 0.00 H new ATOM 0 HE21 GLN A 44 19.360 3.638 25.943 1.00 0.00 H new ATOM 0 HE22 GLN A 44 20.821 4.483 26.462 1.00 0.00 H new ATOM 693 N VAL A 45 15.340 6.125 24.405 1.00 0.00 N ATOM 694 CA VAL A 45 14.259 7.098 24.168 1.00 0.00 C ATOM 695 C VAL A 45 14.764 8.521 24.437 1.00 0.00 C ATOM 696 O VAL A 45 15.293 8.808 25.514 1.00 0.00 O ATOM 697 CB VAL A 45 13.012 6.801 25.031 1.00 0.00 C ATOM 698 CG1 VAL A 45 11.807 7.583 24.489 1.00 0.00 C ATOM 699 CG2 VAL A 45 12.639 5.310 25.043 1.00 0.00 C ATOM 0 H VAL A 45 15.162 5.521 25.208 1.00 0.00 H new ATOM 0 HA VAL A 45 13.960 7.010 23.123 1.00 0.00 H new ATOM 0 HB VAL A 45 13.260 7.103 26.048 1.00 0.00 H new ATOM 0 HG11 VAL A 45 10.930 7.370 25.101 1.00 0.00 H new ATOM 0 HG12 VAL A 45 12.022 8.651 24.522 1.00 0.00 H new ATOM 0 HG13 VAL A 45 11.612 7.283 23.459 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.756 5.161 25.665 1.00 0.00 H new ATOM 0 HG22 VAL A 45 12.427 4.980 24.026 1.00 0.00 H new ATOM 0 HG23 VAL A 45 13.469 4.730 25.447 1.00 0.00 H new ATOM 709 N GLU A 46 14.621 9.417 23.461 1.00 0.00 N ATOM 710 CA GLU A 46 15.090 10.805 23.529 1.00 0.00 C ATOM 711 C GLU A 46 14.215 11.732 22.667 1.00 0.00 C ATOM 712 O GLU A 46 13.983 11.449 21.495 1.00 0.00 O ATOM 713 CB GLU A 46 16.551 10.829 23.029 1.00 0.00 C ATOM 714 CG GLU A 46 17.277 12.163 23.240 1.00 0.00 C ATOM 715 CD GLU A 46 17.546 12.420 24.727 1.00 0.00 C ATOM 716 OE1 GLU A 46 18.556 11.881 25.241 1.00 0.00 O ATOM 717 OE2 GLU A 46 16.726 13.135 25.352 1.00 0.00 O ATOM 0 H GLU A 46 14.164 9.194 22.577 1.00 0.00 H new ATOM 0 HA GLU A 46 15.026 11.167 24.555 1.00 0.00 H new ATOM 0 HB2 GLU A 46 17.108 10.043 23.538 1.00 0.00 H new ATOM 0 HB3 GLU A 46 16.561 10.589 21.966 1.00 0.00 H new ATOM 0 HG2 GLU A 46 18.220 12.157 22.693 1.00 0.00 H new ATOM 0 HG3 GLU A 46 16.676 12.975 22.831 1.00 0.00 H new ATOM 724 N ASN A 47 13.745 12.851 23.231 1.00 0.00 N ATOM 725 CA ASN A 47 12.944 13.898 22.565 1.00 0.00 C ATOM 726 C ASN A 47 11.853 13.413 21.563 1.00 0.00 C ATOM 727 O ASN A 47 11.599 14.061 20.544 1.00 0.00 O ATOM 728 CB ASN A 47 13.936 14.919 21.966 1.00 0.00 C ATOM 729 CG ASN A 47 13.294 16.251 21.596 1.00 0.00 C ATOM 730 OD1 ASN A 47 12.398 16.753 22.262 1.00 0.00 O ATOM 731 ND2 ASN A 47 13.743 16.882 20.534 1.00 0.00 N ATOM 0 H ASN A 47 13.919 13.066 24.213 1.00 0.00 H new ATOM 0 HA ASN A 47 12.313 14.366 23.320 1.00 0.00 H new ATOM 0 HB2 ASN A 47 14.737 15.098 22.683 1.00 0.00 H new ATOM 0 HB3 ASN A 47 14.395 14.487 21.077 1.00 0.00 H new ATOM 0 HD21 ASN A 47 13.345 17.783 20.270 1.00 0.00 H new ATOM 0 HD22 ASN A 47 14.489 16.470 19.974 1.00 0.00 H new ATOM 738 N GLY A 48 11.209 12.268 21.828 1.00 0.00 N ATOM 739 CA GLY A 48 10.149 11.693 20.981 1.00 0.00 C ATOM 740 C GLY A 48 10.593 10.634 19.957 1.00 0.00 C ATOM 741 O GLY A 48 9.788 10.255 19.105 1.00 0.00 O ATOM 0 H GLY A 48 11.412 11.703 22.652 1.00 0.00 H new ATOM 0 HA2 GLY A 48 9.397 11.246 21.631 1.00 0.00 H new ATOM 0 HA3 GLY A 48 9.662 12.506 20.443 1.00 0.00 H new ATOM 745 N ARG A 49 11.837 10.140 20.012 1.00 0.00 N ATOM 746 CA ARG A 49 12.396 9.101 19.116 1.00 0.00 C ATOM 747 C ARG A 49 13.266 8.089 19.863 1.00 0.00 C ATOM 748 O ARG A 49 13.635 8.309 21.014 1.00 0.00 O ATOM 749 CB ARG A 49 13.110 9.759 17.913 1.00 0.00 C ATOM 750 CG ARG A 49 14.234 10.770 18.205 1.00 0.00 C ATOM 751 CD ARG A 49 15.445 10.175 18.940 1.00 0.00 C ATOM 752 NE ARG A 49 16.619 11.061 18.866 1.00 0.00 N ATOM 753 CZ ARG A 49 17.842 10.764 19.275 1.00 0.00 C ATOM 754 NH1 ARG A 49 18.808 11.630 19.136 1.00 0.00 N ATOM 755 NH2 ARG A 49 18.145 9.620 19.830 1.00 0.00 N ATOM 0 H ARG A 49 12.513 10.461 20.706 1.00 0.00 H new ATOM 0 HA ARG A 49 11.570 8.513 18.717 1.00 0.00 H new ATOM 0 HB2 ARG A 49 13.528 8.963 17.297 1.00 0.00 H new ATOM 0 HB3 ARG A 49 12.354 10.264 17.311 1.00 0.00 H new ATOM 0 HG2 ARG A 49 14.572 11.202 17.263 1.00 0.00 H new ATOM 0 HG3 ARG A 49 13.827 11.586 18.802 1.00 0.00 H new ATOM 0 HD2 ARG A 49 15.187 10.001 19.984 1.00 0.00 H new ATOM 0 HD3 ARG A 49 15.693 9.206 18.507 1.00 0.00 H new ATOM 0 HE ARG A 49 16.477 11.987 18.463 1.00 0.00 H new ATOM 0 HH11 ARG A 49 18.621 12.538 18.711 1.00 0.00 H new ATOM 0 HH12 ARG A 49 19.750 11.399 19.452 1.00 0.00 H new ATOM 0 HH21 ARG A 49 17.424 8.911 19.964 1.00 0.00 H new ATOM 0 HH22 ARG A 49 19.103 9.436 20.130 1.00 0.00 H new ATOM 769 N VAL A 50 13.612 6.987 19.200 1.00 0.00 N ATOM 770 CA VAL A 50 14.498 5.933 19.727 1.00 0.00 C ATOM 771 C VAL A 50 15.381 5.450 18.589 1.00 0.00 C ATOM 772 O VAL A 50 14.908 5.311 17.461 1.00 0.00 O ATOM 773 CB VAL A 50 13.749 4.677 20.222 1.00 0.00 C ATOM 774 CG1 VAL A 50 14.631 3.868 21.185 1.00 0.00 C ATOM 775 CG2 VAL A 50 12.417 4.939 20.899 1.00 0.00 C ATOM 0 H VAL A 50 13.279 6.791 18.256 1.00 0.00 H new ATOM 0 HA VAL A 50 15.036 6.377 20.565 1.00 0.00 H new ATOM 0 HB VAL A 50 13.530 4.121 19.311 1.00 0.00 H new ATOM 0 HG11 VAL A 50 14.087 2.987 21.524 1.00 0.00 H new ATOM 0 HG12 VAL A 50 15.541 3.557 20.671 1.00 0.00 H new ATOM 0 HG13 VAL A 50 14.892 4.485 22.045 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.974 3.993 21.208 1.00 0.00 H new ATOM 0 HG22 VAL A 50 12.572 5.571 21.774 1.00 0.00 H new ATOM 0 HG23 VAL A 50 11.747 5.442 20.202 1.00 0.00 H new ATOM 785 N ILE A 51 16.642 5.143 18.879 1.00 0.00 N ATOM 786 CA ILE A 51 17.553 4.547 17.899 1.00 0.00 C ATOM 787 C ILE A 51 17.191 3.051 17.798 1.00 0.00 C ATOM 788 O ILE A 51 17.124 2.359 18.818 1.00 0.00 O ATOM 789 CB ILE A 51 19.023 4.778 18.314 1.00 0.00 C ATOM 790 CG1 ILE A 51 19.302 6.266 18.646 1.00 0.00 C ATOM 791 CG2 ILE A 51 19.930 4.311 17.167 1.00 0.00 C ATOM 792 CD1 ILE A 51 20.741 6.561 19.078 1.00 0.00 C ATOM 0 H ILE A 51 17.063 5.298 19.795 1.00 0.00 H new ATOM 0 HA ILE A 51 17.446 5.012 16.919 1.00 0.00 H new ATOM 0 HB ILE A 51 19.227 4.206 19.219 1.00 0.00 H new ATOM 0 HG12 ILE A 51 19.068 6.871 17.770 1.00 0.00 H new ATOM 0 HG13 ILE A 51 18.626 6.581 19.441 1.00 0.00 H new ATOM 0 HG21 ILE A 51 20.973 4.466 17.442 1.00 0.00 H new ATOM 0 HG22 ILE A 51 19.759 3.252 16.976 1.00 0.00 H new ATOM 0 HG23 ILE A 51 19.703 4.883 16.267 1.00 0.00 H new ATOM 0 HD11 ILE A 51 20.846 7.625 19.290 1.00 0.00 H new ATOM 0 HD12 ILE A 51 20.977 5.987 19.974 1.00 0.00 H new ATOM 0 HD13 ILE A 51 21.426 6.281 18.277 1.00 0.00 H new ATOM 804 N ALA A 52 16.919 2.551 16.591 1.00 0.00 N ATOM 805 CA ALA A 52 16.544 1.157 16.353 1.00 0.00 C ATOM 806 C ALA A 52 17.769 0.227 16.217 1.00 0.00 C ATOM 807 O ALA A 52 18.847 0.659 15.799 1.00 0.00 O ATOM 808 CB ALA A 52 15.649 1.092 15.112 1.00 0.00 C ATOM 0 H ALA A 52 16.954 3.112 15.740 1.00 0.00 H new ATOM 0 HA ALA A 52 15.995 0.793 17.221 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.362 0.057 14.924 1.00 0.00 H new ATOM 0 HB2 ALA A 52 14.754 1.692 15.277 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.193 1.480 14.251 1.00 0.00 H new ATOM 814 N CYS A 53 17.595 -1.050 16.570 1.00 0.00 N ATOM 815 CA CYS A 53 18.627 -2.089 16.524 1.00 0.00 C ATOM 816 C CYS A 53 18.976 -2.464 15.065 1.00 0.00 C ATOM 817 O CYS A 53 18.148 -3.027 14.345 1.00 0.00 O ATOM 818 CB CYS A 53 18.100 -3.275 17.353 1.00 0.00 C ATOM 819 SG CYS A 53 19.293 -4.643 17.547 1.00 0.00 S ATOM 0 H CYS A 53 16.699 -1.401 16.908 1.00 0.00 H new ATOM 0 HA CYS A 53 19.567 -1.741 16.952 1.00 0.00 H new ATOM 0 HB2 CYS A 53 17.814 -2.914 18.341 1.00 0.00 H new ATOM 0 HB3 CYS A 53 17.196 -3.660 16.881 1.00 0.00 H new ATOM 824 N PHE A 54 20.198 -2.153 14.618 1.00 0.00 N ATOM 825 CA PHE A 54 20.736 -2.453 13.277 1.00 0.00 C ATOM 826 C PHE A 54 20.614 -3.949 12.957 1.00 0.00 C ATOM 827 O PHE A 54 20.298 -4.335 11.831 1.00 0.00 O ATOM 828 CB PHE A 54 22.226 -2.054 13.254 1.00 0.00 C ATOM 829 CG PHE A 54 22.974 -2.088 11.936 1.00 0.00 C ATOM 830 CD1 PHE A 54 23.428 -0.881 11.384 1.00 0.00 C ATOM 831 CD2 PHE A 54 23.360 -3.309 11.346 1.00 0.00 C ATOM 832 CE1 PHE A 54 24.189 -0.881 10.200 1.00 0.00 C ATOM 833 CE2 PHE A 54 24.159 -3.312 10.188 1.00 0.00 C ATOM 834 CZ PHE A 54 24.557 -2.097 9.602 1.00 0.00 C ATOM 0 H PHE A 54 20.873 -1.663 15.205 1.00 0.00 H new ATOM 0 HA PHE A 54 20.169 -1.895 12.532 1.00 0.00 H new ATOM 0 HB2 PHE A 54 22.302 -1.041 13.650 1.00 0.00 H new ATOM 0 HB3 PHE A 54 22.753 -2.708 13.949 1.00 0.00 H new ATOM 0 HD1 PHE A 54 23.192 0.054 11.870 1.00 0.00 H new ATOM 0 HD2 PHE A 54 23.042 -4.244 11.784 1.00 0.00 H new ATOM 0 HE1 PHE A 54 24.490 0.054 9.751 1.00 0.00 H new ATOM 0 HE2 PHE A 54 24.467 -4.249 9.748 1.00 0.00 H new ATOM 0 HZ PHE A 54 25.144 -2.099 8.695 1.00 0.00 H new ATOM 844 N ASP A 55 20.849 -4.807 13.953 1.00 0.00 N ATOM 845 CA ASP A 55 20.711 -6.254 13.782 1.00 0.00 C ATOM 846 C ASP A 55 19.232 -6.708 13.725 1.00 0.00 C ATOM 847 O ASP A 55 18.910 -7.617 12.953 1.00 0.00 O ATOM 848 CB ASP A 55 21.555 -6.976 14.834 1.00 0.00 C ATOM 849 CG ASP A 55 23.046 -6.950 14.482 1.00 0.00 C ATOM 850 OD1 ASP A 55 23.401 -7.374 13.356 1.00 0.00 O ATOM 851 OD2 ASP A 55 23.843 -6.533 15.354 1.00 0.00 O ATOM 0 H ASP A 55 21.137 -4.522 14.889 1.00 0.00 H new ATOM 0 HA ASP A 55 21.104 -6.538 12.806 1.00 0.00 H new ATOM 0 HB2 ASP A 55 21.403 -6.508 15.806 1.00 0.00 H new ATOM 0 HB3 ASP A 55 21.220 -8.010 14.922 1.00 0.00 H new ATOM 856 N SER A 56 18.305 -6.043 14.429 1.00 0.00 N ATOM 857 CA SER A 56 16.855 -6.293 14.307 1.00 0.00 C ATOM 858 C SER A 56 16.345 -5.826 12.934 1.00 0.00 C ATOM 859 O SER A 56 15.564 -6.521 12.279 1.00 0.00 O ATOM 860 CB SER A 56 16.081 -5.563 15.409 1.00 0.00 C ATOM 861 OG SER A 56 14.701 -5.890 15.376 1.00 0.00 O ATOM 0 H SER A 56 18.537 -5.313 15.103 1.00 0.00 H new ATOM 0 HA SER A 56 16.691 -7.366 14.410 1.00 0.00 H new ATOM 0 HB2 SER A 56 16.496 -5.826 16.382 1.00 0.00 H new ATOM 0 HB3 SER A 56 16.204 -4.487 15.290 1.00 0.00 H new ATOM 0 HG SER A 56 14.170 -5.086 15.553 1.00 0.00 H new ATOM 867 N LEU A 57 16.861 -4.691 12.444 1.00 0.00 N ATOM 868 CA LEU A 57 16.618 -4.126 11.109 1.00 0.00 C ATOM 869 C LEU A 57 17.005 -5.112 9.986 1.00 0.00 C ATOM 870 O LEU A 57 16.466 -5.022 8.881 1.00 0.00 O ATOM 871 CB LEU A 57 17.405 -2.797 10.988 1.00 0.00 C ATOM 872 CG LEU A 57 16.715 -1.486 11.418 1.00 0.00 C ATOM 873 CD1 LEU A 57 15.541 -1.613 12.391 1.00 0.00 C ATOM 874 CD2 LEU A 57 17.727 -0.500 12.006 1.00 0.00 C ATOM 0 H LEU A 57 17.492 -4.111 12.997 1.00 0.00 H new ATOM 0 HA LEU A 57 15.551 -3.935 10.990 1.00 0.00 H new ATOM 0 HB2 LEU A 57 18.317 -2.898 11.576 1.00 0.00 H new ATOM 0 HB3 LEU A 57 17.707 -2.685 9.947 1.00 0.00 H new ATOM 0 HG LEU A 57 16.285 -1.123 10.484 1.00 0.00 H new ATOM 0 HD11 LEU A 57 15.144 -0.622 12.614 1.00 0.00 H new ATOM 0 HD12 LEU A 57 14.759 -2.224 11.940 1.00 0.00 H new ATOM 0 HD13 LEU A 57 15.882 -2.083 13.313 1.00 0.00 H new ATOM 0 HD21 LEU A 57 17.214 0.415 12.301 1.00 0.00 H new ATOM 0 HD22 LEU A 57 18.204 -0.946 12.879 1.00 0.00 H new ATOM 0 HD23 LEU A 57 18.484 -0.267 11.258 1.00 0.00 H new ATOM 886 N LYS A 58 17.899 -6.070 10.276 1.00 0.00 N ATOM 887 CA LYS A 58 18.353 -7.152 9.382 1.00 0.00 C ATOM 888 C LYS A 58 17.757 -8.533 9.728 1.00 0.00 C ATOM 889 O LYS A 58 18.062 -9.522 9.059 1.00 0.00 O ATOM 890 CB LYS A 58 19.892 -7.127 9.310 1.00 0.00 C ATOM 891 CG LYS A 58 20.351 -5.881 8.533 1.00 0.00 C ATOM 892 CD LYS A 58 21.877 -5.751 8.475 1.00 0.00 C ATOM 893 CE LYS A 58 22.300 -4.598 7.550 1.00 0.00 C ATOM 894 NZ LYS A 58 21.818 -3.286 8.036 1.00 0.00 N ATOM 0 H LYS A 58 18.350 -6.115 11.190 1.00 0.00 H new ATOM 0 HA LYS A 58 17.964 -6.967 8.381 1.00 0.00 H new ATOM 0 HB2 LYS A 58 20.313 -7.117 10.315 1.00 0.00 H new ATOM 0 HB3 LYS A 58 20.258 -8.029 8.820 1.00 0.00 H new ATOM 0 HG2 LYS A 58 19.955 -5.924 7.518 1.00 0.00 H new ATOM 0 HG3 LYS A 58 19.932 -4.991 9.001 1.00 0.00 H new ATOM 0 HD2 LYS A 58 22.269 -5.579 9.478 1.00 0.00 H new ATOM 0 HD3 LYS A 58 22.311 -6.685 8.119 1.00 0.00 H new ATOM 0 HE2 LYS A 58 23.387 -4.577 7.472 1.00 0.00 H new ATOM 0 HE3 LYS A 58 21.911 -4.777 6.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 22.053 -2.550 7.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 20.787 -3.322 8.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 22.275 -3.063 8.943 1.00 0.00 H new ATOM 908 N GLY A 59 16.874 -8.602 10.729 1.00 0.00 N ATOM 909 CA GLY A 59 16.116 -9.796 11.131 1.00 0.00 C ATOM 910 C GLY A 59 16.756 -10.757 12.136 1.00 0.00 C ATOM 911 O GLY A 59 16.177 -11.821 12.374 1.00 0.00 O ATOM 0 H GLY A 59 16.657 -7.791 11.309 1.00 0.00 H new ATOM 0 HA2 GLY A 59 15.166 -9.462 11.549 1.00 0.00 H new ATOM 0 HA3 GLY A 59 15.886 -10.363 10.229 1.00 0.00 H new ATOM 915 N ARG A 60 17.905 -10.424 12.743 1.00 0.00 N ATOM 916 CA ARG A 60 18.566 -11.281 13.747 1.00 0.00 C ATOM 917 C ARG A 60 19.453 -10.479 14.705 1.00 0.00 C ATOM 918 O ARG A 60 20.647 -10.300 14.454 1.00 0.00 O ATOM 919 CB ARG A 60 19.354 -12.414 13.054 1.00 0.00 C ATOM 920 CG ARG A 60 19.884 -13.465 14.050 1.00 0.00 C ATOM 921 CD ARG A 60 18.799 -14.299 14.750 1.00 0.00 C ATOM 922 NE ARG A 60 17.966 -15.052 13.794 1.00 0.00 N ATOM 923 CZ ARG A 60 16.920 -15.804 14.093 1.00 0.00 C ATOM 924 NH1 ARG A 60 16.255 -16.413 13.149 1.00 0.00 N ATOM 925 NH2 ARG A 60 16.503 -15.979 15.322 1.00 0.00 N ATOM 0 H ARG A 60 18.404 -9.555 12.554 1.00 0.00 H new ATOM 0 HA ARG A 60 17.785 -11.732 14.360 1.00 0.00 H new ATOM 0 HB2 ARG A 60 18.711 -12.904 12.323 1.00 0.00 H new ATOM 0 HB3 ARG A 60 20.192 -11.985 12.505 1.00 0.00 H new ATOM 0 HG2 ARG A 60 20.555 -14.141 13.520 1.00 0.00 H new ATOM 0 HG3 ARG A 60 20.478 -12.957 14.810 1.00 0.00 H new ATOM 0 HD2 ARG A 60 19.270 -14.995 15.444 1.00 0.00 H new ATOM 0 HD3 ARG A 60 18.163 -13.640 15.342 1.00 0.00 H new ATOM 0 HE ARG A 60 18.221 -14.987 12.809 1.00 0.00 H new ATOM 0 HH11 ARG A 60 16.541 -16.310 12.175 1.00 0.00 H new ATOM 0 HH12 ARG A 60 15.449 -16.992 13.385 1.00 0.00 H new ATOM 0 HH21 ARG A 60 16.990 -15.526 16.095 1.00 0.00 H new ATOM 0 HH22 ARG A 60 15.691 -16.568 15.506 1.00 0.00 H new ATOM 939 N CYS A 61 18.853 -10.028 15.809 1.00 0.00 N ATOM 940 CA CYS A 61 19.523 -9.286 16.889 1.00 0.00 C ATOM 941 C CYS A 61 20.791 -10.034 17.365 1.00 0.00 C ATOM 942 O CYS A 61 20.761 -11.257 17.553 1.00 0.00 O ATOM 943 CB CYS A 61 18.521 -9.051 18.032 1.00 0.00 C ATOM 944 SG CYS A 61 19.231 -7.938 19.294 1.00 0.00 S ATOM 0 H CYS A 61 17.859 -10.171 15.985 1.00 0.00 H new ATOM 0 HA CYS A 61 19.857 -8.316 16.521 1.00 0.00 H new ATOM 0 HB2 CYS A 61 17.603 -8.619 17.634 1.00 0.00 H new ATOM 0 HB3 CYS A 61 18.253 -10.004 18.489 1.00 0.00 H new ATOM 949 N SER A 62 21.907 -9.310 17.527 1.00 0.00 N ATOM 950 CA SER A 62 23.218 -9.881 17.895 1.00 0.00 C ATOM 951 C SER A 62 23.994 -9.089 18.968 1.00 0.00 C ATOM 952 O SER A 62 25.209 -9.267 19.104 1.00 0.00 O ATOM 953 CB SER A 62 24.080 -10.045 16.629 1.00 0.00 C ATOM 954 OG SER A 62 23.484 -10.919 15.678 1.00 0.00 O ATOM 0 H SER A 62 21.929 -8.298 17.405 1.00 0.00 H new ATOM 0 HA SER A 62 23.005 -10.847 18.352 1.00 0.00 H new ATOM 0 HB2 SER A 62 24.239 -9.068 16.172 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.061 -10.430 16.908 1.00 0.00 H new ATOM 0 HG SER A 62 22.602 -10.575 15.426 1.00 0.00 H new ATOM 960 N ARG A 63 23.327 -8.238 19.761 1.00 0.00 N ATOM 961 CA ARG A 63 23.967 -7.473 20.852 1.00 0.00 C ATOM 962 C ARG A 63 24.289 -8.370 22.058 1.00 0.00 C ATOM 963 O ARG A 63 23.556 -9.320 22.340 1.00 0.00 O ATOM 964 CB ARG A 63 23.062 -6.298 21.278 1.00 0.00 C ATOM 965 CG ARG A 63 23.839 -5.020 21.663 1.00 0.00 C ATOM 966 CD ARG A 63 24.058 -4.045 20.496 1.00 0.00 C ATOM 967 NE ARG A 63 24.995 -4.556 19.482 1.00 0.00 N ATOM 968 CZ ARG A 63 24.676 -5.150 18.344 1.00 0.00 C ATOM 969 NH1 ARG A 63 25.603 -5.543 17.516 1.00 0.00 N ATOM 970 NH2 ARG A 63 23.449 -5.392 17.976 1.00 0.00 N ATOM 0 H ARG A 63 22.327 -8.057 19.668 1.00 0.00 H new ATOM 0 HA ARG A 63 24.911 -7.077 20.476 1.00 0.00 H new ATOM 0 HB2 ARG A 63 22.378 -6.064 20.462 1.00 0.00 H new ATOM 0 HB3 ARG A 63 22.452 -6.610 22.126 1.00 0.00 H new ATOM 0 HG2 ARG A 63 23.299 -4.504 22.457 1.00 0.00 H new ATOM 0 HG3 ARG A 63 24.809 -5.306 22.071 1.00 0.00 H new ATOM 0 HD2 ARG A 63 23.099 -3.834 20.022 1.00 0.00 H new ATOM 0 HD3 ARG A 63 24.435 -3.100 20.886 1.00 0.00 H new ATOM 0 HE ARG A 63 25.990 -4.440 19.676 1.00 0.00 H new ATOM 0 HH11 ARG A 63 26.586 -5.394 17.743 1.00 0.00 H new ATOM 0 HH12 ARG A 63 25.345 -6.000 16.641 1.00 0.00 H new ATOM 0 HH21 ARG A 63 22.673 -5.119 18.579 1.00 0.00 H new ATOM 0 HH22 ARG A 63 23.265 -5.854 17.085 1.00 0.00 H new ATOM 984 N GLU A 64 25.347 -8.050 22.812 1.00 0.00 N ATOM 985 CA GLU A 64 25.701 -8.762 24.061 1.00 0.00 C ATOM 986 C GLU A 64 24.569 -8.621 25.104 1.00 0.00 C ATOM 987 O GLU A 64 24.199 -9.570 25.798 1.00 0.00 O ATOM 988 CB GLU A 64 27.020 -8.178 24.604 1.00 0.00 C ATOM 989 CG GLU A 64 27.512 -8.870 25.885 1.00 0.00 C ATOM 990 CD GLU A 64 28.791 -8.207 26.414 1.00 0.00 C ATOM 991 OE1 GLU A 64 28.671 -7.124 27.037 1.00 0.00 O ATOM 992 OE2 GLU A 64 29.889 -8.774 26.192 1.00 0.00 O ATOM 0 H GLU A 64 25.987 -7.291 22.579 1.00 0.00 H new ATOM 0 HA GLU A 64 25.830 -9.825 23.856 1.00 0.00 H new ATOM 0 HB2 GLU A 64 27.789 -8.262 23.836 1.00 0.00 H new ATOM 0 HB3 GLU A 64 26.883 -7.115 24.804 1.00 0.00 H new ATOM 0 HG2 GLU A 64 26.734 -8.827 26.647 1.00 0.00 H new ATOM 0 HG3 GLU A 64 27.702 -9.924 25.683 1.00 0.00 H new ATOM 999 N ASN A 65 23.995 -7.417 25.151 1.00 0.00 N ATOM 1000 CA ASN A 65 22.853 -6.977 25.946 1.00 0.00 C ATOM 1001 C ASN A 65 22.235 -5.816 25.148 1.00 0.00 C ATOM 1002 O ASN A 65 22.871 -4.770 25.006 1.00 0.00 O ATOM 1003 CB ASN A 65 23.337 -6.550 27.341 1.00 0.00 C ATOM 1004 CG ASN A 65 22.223 -5.900 28.147 1.00 0.00 C ATOM 1005 OD1 ASN A 65 21.300 -6.554 28.612 1.00 0.00 O ATOM 1006 ND2 ASN A 65 22.261 -4.599 28.322 1.00 0.00 N ATOM 0 H ASN A 65 24.355 -6.654 24.577 1.00 0.00 H new ATOM 0 HA ASN A 65 22.110 -7.757 26.112 1.00 0.00 H new ATOM 0 HB2 ASN A 65 23.715 -7.420 27.878 1.00 0.00 H new ATOM 0 HB3 ASN A 65 24.168 -5.852 27.240 1.00 0.00 H new ATOM 0 HD21 ASN A 65 21.520 -4.133 28.846 1.00 0.00 H new ATOM 0 HD22 ASN A 65 23.031 -4.054 27.934 1.00 0.00 H new ATOM 1013 N CYS A 66 21.053 -6.017 24.560 1.00 0.00 N ATOM 1014 CA CYS A 66 20.441 -5.032 23.667 1.00 0.00 C ATOM 1015 C CYS A 66 19.745 -3.887 24.439 1.00 0.00 C ATOM 1016 O CYS A 66 19.207 -4.072 25.539 1.00 0.00 O ATOM 1017 CB CYS A 66 19.576 -5.799 22.655 1.00 0.00 C ATOM 1018 SG CYS A 66 19.107 -4.753 21.243 1.00 0.00 S ATOM 0 H CYS A 66 20.497 -6.862 24.689 1.00 0.00 H new ATOM 0 HA CYS A 66 21.193 -4.486 23.097 1.00 0.00 H new ATOM 0 HB2 CYS A 66 20.123 -6.671 22.296 1.00 0.00 H new ATOM 0 HB3 CYS A 66 18.677 -6.167 23.150 1.00 0.00 H new ATOM 1023 N LYS A 67 19.836 -2.681 23.863 1.00 0.00 N ATOM 1024 CA LYS A 67 19.415 -1.382 24.432 1.00 0.00 C ATOM 1025 C LYS A 67 18.612 -0.498 23.456 1.00 0.00 C ATOM 1026 O LYS A 67 18.088 0.549 23.836 1.00 0.00 O ATOM 1027 CB LYS A 67 20.728 -0.699 24.879 1.00 0.00 C ATOM 1028 CG LYS A 67 20.572 0.532 25.783 1.00 0.00 C ATOM 1029 CD LYS A 67 21.930 1.082 26.253 1.00 0.00 C ATOM 1030 CE LYS A 67 22.806 1.585 25.096 1.00 0.00 C ATOM 1031 NZ LYS A 67 24.067 2.165 25.599 1.00 0.00 N ATOM 0 H LYS A 67 20.230 -2.573 22.928 1.00 0.00 H new ATOM 0 HA LYS A 67 18.720 -1.537 25.257 1.00 0.00 H new ATOM 0 HB2 LYS A 67 21.337 -1.435 25.403 1.00 0.00 H new ATOM 0 HB3 LYS A 67 21.282 -0.403 23.988 1.00 0.00 H new ATOM 0 HG2 LYS A 67 20.033 1.311 25.244 1.00 0.00 H new ATOM 0 HG3 LYS A 67 19.968 0.269 26.651 1.00 0.00 H new ATOM 0 HD2 LYS A 67 21.762 1.898 26.956 1.00 0.00 H new ATOM 0 HD3 LYS A 67 22.465 0.301 26.794 1.00 0.00 H new ATOM 0 HE2 LYS A 67 23.026 0.761 24.417 1.00 0.00 H new ATOM 0 HE3 LYS A 67 22.261 2.334 24.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 24.795 2.107 24.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 23.913 3.161 25.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 24.382 1.636 26.437 1.00 0.00 H new ATOM 1045 N TYR A 68 18.504 -0.916 22.199 1.00 0.00 N ATOM 1046 CA TYR A 68 17.826 -0.220 21.102 1.00 0.00 C ATOM 1047 C TYR A 68 16.383 -0.725 20.881 1.00 0.00 C ATOM 1048 O TYR A 68 15.962 -1.732 21.457 1.00 0.00 O ATOM 1049 CB TYR A 68 18.695 -0.403 19.850 1.00 0.00 C ATOM 1050 CG TYR A 68 20.099 0.170 19.961 1.00 0.00 C ATOM 1051 CD1 TYR A 68 20.279 1.543 20.218 1.00 0.00 C ATOM 1052 CD2 TYR A 68 21.223 -0.667 19.800 1.00 0.00 C ATOM 1053 CE1 TYR A 68 21.576 2.085 20.310 1.00 0.00 C ATOM 1054 CE2 TYR A 68 22.522 -0.131 19.896 1.00 0.00 C ATOM 1055 CZ TYR A 68 22.700 1.248 20.141 1.00 0.00 C ATOM 1056 OH TYR A 68 23.954 1.769 20.209 1.00 0.00 O ATOM 0 H TYR A 68 18.910 -1.802 21.897 1.00 0.00 H new ATOM 0 HA TYR A 68 17.717 0.837 21.343 1.00 0.00 H new ATOM 0 HB2 TYR A 68 18.768 -1.468 19.628 1.00 0.00 H new ATOM 0 HB3 TYR A 68 18.192 0.065 19.004 1.00 0.00 H new ATOM 0 HD1 TYR A 68 19.419 2.183 20.345 1.00 0.00 H new ATOM 0 HD2 TYR A 68 21.087 -1.720 19.603 1.00 0.00 H new ATOM 0 HE1 TYR A 68 21.710 3.138 20.509 1.00 0.00 H new ATOM 0 HE2 TYR A 68 23.382 -0.775 19.782 1.00 0.00 H new ATOM 0 HH TYR A 68 23.955 2.541 20.813 1.00 0.00 H new ATOM 1066 N LEU A 69 15.603 -0.028 20.045 1.00 0.00 N ATOM 1067 CA LEU A 69 14.213 -0.384 19.738 1.00 0.00 C ATOM 1068 C LEU A 69 14.154 -1.435 18.613 1.00 0.00 C ATOM 1069 O LEU A 69 14.825 -1.302 17.590 1.00 0.00 O ATOM 1070 CB LEU A 69 13.504 0.906 19.266 1.00 0.00 C ATOM 1071 CG LEU A 69 12.136 0.733 18.575 1.00 0.00 C ATOM 1072 CD1 LEU A 69 11.052 0.276 19.551 1.00 0.00 C ATOM 1073 CD2 LEU A 69 11.709 2.058 17.952 1.00 0.00 C ATOM 0 H LEU A 69 15.924 0.809 19.557 1.00 0.00 H new ATOM 0 HA LEU A 69 13.732 -0.806 20.621 1.00 0.00 H new ATOM 0 HB2 LEU A 69 13.368 1.555 20.131 1.00 0.00 H new ATOM 0 HB3 LEU A 69 14.169 1.427 18.577 1.00 0.00 H new ATOM 0 HG LEU A 69 12.251 -0.036 17.811 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.106 0.168 19.020 1.00 0.00 H new ATOM 0 HD12 LEU A 69 11.335 -0.682 19.987 1.00 0.00 H new ATOM 0 HD13 LEU A 69 10.940 1.016 20.343 1.00 0.00 H new ATOM 0 HD21 LEU A 69 10.742 1.936 17.464 1.00 0.00 H new ATOM 0 HD22 LEU A 69 11.629 2.817 18.730 1.00 0.00 H new ATOM 0 HD23 LEU A 69 12.450 2.370 17.216 1.00 0.00 H new ATOM 1085 N HIS A 70 13.317 -2.462 18.794 1.00 0.00 N ATOM 1086 CA HIS A 70 13.032 -3.479 17.773 1.00 0.00 C ATOM 1087 C HIS A 70 11.694 -3.101 17.100 1.00 0.00 C ATOM 1088 O HIS A 70 10.636 -3.281 17.716 1.00 0.00 O ATOM 1089 CB HIS A 70 12.927 -4.867 18.434 1.00 0.00 C ATOM 1090 CG HIS A 70 14.236 -5.490 18.856 1.00 0.00 C ATOM 1091 ND1 HIS A 70 14.414 -6.807 19.223 1.00 0.00 N ATOM 1092 CD2 HIS A 70 15.475 -4.903 18.870 1.00 0.00 C ATOM 1093 CE1 HIS A 70 15.728 -7.010 19.430 1.00 0.00 C ATOM 1094 NE2 HIS A 70 16.416 -5.876 19.223 1.00 0.00 N ATOM 0 H HIS A 70 12.810 -2.613 19.666 1.00 0.00 H new ATOM 0 HA HIS A 70 13.830 -3.518 17.031 1.00 0.00 H new ATOM 0 HB2 HIS A 70 12.285 -4.784 19.311 1.00 0.00 H new ATOM 0 HB3 HIS A 70 12.431 -5.544 17.739 1.00 0.00 H new ATOM 0 HD1 HIS A 70 13.678 -7.506 19.321 1.00 0.00 H new ATOM 0 HD2 HIS A 70 15.688 -3.868 18.647 1.00 0.00 H new ATOM 0 HE1 HIS A 70 16.167 -7.953 19.722 1.00 0.00 H new ATOM 1102 N PRO A 71 11.697 -2.565 15.865 1.00 0.00 N ATOM 1103 CA PRO A 71 10.474 -2.130 15.190 1.00 0.00 C ATOM 1104 C PRO A 71 9.708 -3.269 14.486 1.00 0.00 C ATOM 1105 O PRO A 71 10.299 -4.296 14.133 1.00 0.00 O ATOM 1106 CB PRO A 71 10.961 -1.107 14.165 1.00 0.00 C ATOM 1107 CG PRO A 71 12.341 -1.621 13.766 1.00 0.00 C ATOM 1108 CD PRO A 71 12.867 -2.254 15.051 1.00 0.00 C ATOM 0 HA PRO A 71 9.760 -1.733 15.912 1.00 0.00 H new ATOM 0 HB2 PRO A 71 10.291 -1.051 13.307 1.00 0.00 H new ATOM 0 HB3 PRO A 71 11.015 -0.106 14.593 1.00 0.00 H new ATOM 0 HG2 PRO A 71 12.280 -2.347 12.956 1.00 0.00 H new ATOM 0 HG3 PRO A 71 12.987 -0.813 13.422 1.00 0.00 H new ATOM 0 HD2 PRO A 71 13.440 -3.156 14.834 1.00 0.00 H new ATOM 0 HD3 PRO A 71 13.535 -1.571 15.576 1.00 0.00 H new ATOM 1116 N PRO A 72 8.398 -3.083 14.227 1.00 0.00 N ATOM 1117 CA PRO A 72 7.579 -4.039 13.481 1.00 0.00 C ATOM 1118 C PRO A 72 7.937 -4.006 11.980 1.00 0.00 C ATOM 1119 O PRO A 72 8.508 -3.012 11.519 1.00 0.00 O ATOM 1120 CB PRO A 72 6.137 -3.592 13.735 1.00 0.00 C ATOM 1121 CG PRO A 72 6.262 -2.077 13.881 1.00 0.00 C ATOM 1122 CD PRO A 72 7.604 -1.918 14.592 1.00 0.00 C ATOM 0 HA PRO A 72 7.739 -5.070 13.797 1.00 0.00 H new ATOM 0 HB2 PRO A 72 5.480 -3.864 12.909 1.00 0.00 H new ATOM 0 HB3 PRO A 72 5.726 -4.051 14.634 1.00 0.00 H new ATOM 0 HG2 PRO A 72 6.254 -1.575 12.914 1.00 0.00 H new ATOM 0 HG3 PRO A 72 5.442 -1.657 14.464 1.00 0.00 H new ATOM 0 HD2 PRO A 72 8.100 -0.997 14.285 1.00 0.00 H new ATOM 0 HD3 PRO A 72 7.468 -1.862 15.672 1.00 0.00 H new ATOM 1130 N PRO A 73 7.600 -5.048 11.191 1.00 0.00 N ATOM 1131 CA PRO A 73 7.912 -5.143 9.759 1.00 0.00 C ATOM 1132 C PRO A 73 7.679 -3.875 8.920 1.00 0.00 C ATOM 1133 O PRO A 73 8.517 -3.543 8.079 1.00 0.00 O ATOM 1134 CB PRO A 73 7.084 -6.324 9.243 1.00 0.00 C ATOM 1135 CG PRO A 73 7.004 -7.240 10.461 1.00 0.00 C ATOM 1136 CD PRO A 73 6.914 -6.260 11.628 1.00 0.00 C ATOM 0 HA PRO A 73 8.987 -5.283 9.649 1.00 0.00 H new ATOM 0 HB2 PRO A 73 6.096 -6.009 8.908 1.00 0.00 H new ATOM 0 HB3 PRO A 73 7.565 -6.816 8.398 1.00 0.00 H new ATOM 0 HG2 PRO A 73 6.133 -7.894 10.416 1.00 0.00 H new ATOM 0 HG3 PRO A 73 7.881 -7.882 10.541 1.00 0.00 H new ATOM 0 HD2 PRO A 73 5.875 -6.050 11.882 1.00 0.00 H new ATOM 0 HD3 PRO A 73 7.383 -6.673 12.521 1.00 0.00 H new ATOM 1144 N HIS A 74 6.581 -3.136 9.142 1.00 0.00 N ATOM 1145 CA HIS A 74 6.300 -1.903 8.386 1.00 0.00 C ATOM 1146 C HIS A 74 7.293 -0.771 8.692 1.00 0.00 C ATOM 1147 O HIS A 74 7.884 -0.218 7.763 1.00 0.00 O ATOM 1148 CB HIS A 74 4.822 -1.490 8.534 1.00 0.00 C ATOM 1149 CG HIS A 74 4.388 -0.999 9.895 1.00 0.00 C ATOM 1150 ND1 HIS A 74 3.977 -1.782 10.961 1.00 0.00 N ATOM 1151 CD2 HIS A 74 4.205 0.310 10.250 1.00 0.00 C ATOM 1152 CE1 HIS A 74 3.555 -0.962 11.943 1.00 0.00 C ATOM 1153 NE2 HIS A 74 3.694 0.313 11.534 1.00 0.00 N ATOM 0 H HIS A 74 5.873 -3.370 9.838 1.00 0.00 H new ATOM 0 HA HIS A 74 6.459 -2.122 7.330 1.00 0.00 H new ATOM 0 HB2 HIS A 74 4.613 -0.705 7.807 1.00 0.00 H new ATOM 0 HB3 HIS A 74 4.201 -2.345 8.267 1.00 0.00 H new ATOM 0 HD2 HIS A 74 4.419 1.176 9.642 1.00 0.00 H new ATOM 0 HE1 HIS A 74 3.169 -1.276 12.901 1.00 0.00 H new ATOM 0 HE2 HIS A 74 3.461 1.142 12.080 1.00 0.00 H new ATOM 1162 N LEU A 75 7.550 -0.458 9.968 1.00 0.00 N ATOM 1163 CA LEU A 75 8.543 0.565 10.345 1.00 0.00 C ATOM 1164 C LEU A 75 9.973 0.105 10.016 1.00 0.00 C ATOM 1165 O LEU A 75 10.782 0.911 9.565 1.00 0.00 O ATOM 1166 CB LEU A 75 8.409 0.956 11.827 1.00 0.00 C ATOM 1167 CG LEU A 75 7.071 1.599 12.236 1.00 0.00 C ATOM 1168 CD1 LEU A 75 7.129 2.048 13.698 1.00 0.00 C ATOM 1169 CD2 LEU A 75 6.715 2.819 11.383 1.00 0.00 C ATOM 0 H LEU A 75 7.084 -0.898 10.762 1.00 0.00 H new ATOM 0 HA LEU A 75 8.339 1.455 9.750 1.00 0.00 H new ATOM 0 HB2 LEU A 75 8.561 0.063 12.433 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.213 1.649 12.074 1.00 0.00 H new ATOM 0 HG LEU A 75 6.307 0.836 12.086 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.178 2.501 13.977 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.321 1.185 14.336 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.929 2.777 13.823 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.762 3.231 11.716 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.493 3.575 11.487 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.635 2.521 10.337 1.00 0.00 H new ATOM 1181 N LYS A 76 10.268 -1.193 10.161 1.00 0.00 N ATOM 1182 CA LYS A 76 11.545 -1.819 9.774 1.00 0.00 C ATOM 1183 C LYS A 76 11.824 -1.587 8.283 1.00 0.00 C ATOM 1184 O LYS A 76 12.910 -1.148 7.915 1.00 0.00 O ATOM 1185 CB LYS A 76 11.459 -3.313 10.129 1.00 0.00 C ATOM 1186 CG LYS A 76 12.656 -4.145 9.656 1.00 0.00 C ATOM 1187 CD LYS A 76 12.532 -5.577 10.192 1.00 0.00 C ATOM 1188 CE LYS A 76 13.546 -6.489 9.504 1.00 0.00 C ATOM 1189 NZ LYS A 76 13.470 -7.862 10.039 1.00 0.00 N ATOM 0 H LYS A 76 9.607 -1.859 10.562 1.00 0.00 H new ATOM 0 HA LYS A 76 12.380 -1.373 10.314 1.00 0.00 H new ATOM 0 HB2 LYS A 76 11.367 -3.412 11.211 1.00 0.00 H new ATOM 0 HB3 LYS A 76 10.550 -3.726 9.693 1.00 0.00 H new ATOM 0 HG2 LYS A 76 12.696 -4.156 8.567 1.00 0.00 H new ATOM 0 HG3 LYS A 76 13.585 -3.695 10.005 1.00 0.00 H new ATOM 0 HD2 LYS A 76 12.697 -5.585 11.269 1.00 0.00 H new ATOM 0 HD3 LYS A 76 11.522 -5.950 10.022 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.359 -6.502 8.430 1.00 0.00 H new ATOM 0 HE3 LYS A 76 14.552 -6.094 9.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 14.168 -8.462 9.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 13.672 -7.849 11.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 12.516 -8.244 9.880 1.00 0.00 H new ATOM 1203 N THR A 77 10.822 -1.819 7.432 1.00 0.00 N ATOM 1204 CA THR A 77 10.918 -1.569 5.984 1.00 0.00 C ATOM 1205 C THR A 77 11.124 -0.078 5.695 1.00 0.00 C ATOM 1206 O THR A 77 11.985 0.270 4.888 1.00 0.00 O ATOM 1207 CB THR A 77 9.679 -2.091 5.237 1.00 0.00 C ATOM 1208 OG1 THR A 77 9.517 -3.476 5.460 1.00 0.00 O ATOM 1209 CG2 THR A 77 9.810 -1.907 3.725 1.00 0.00 C ATOM 0 H THR A 77 9.917 -2.187 7.724 1.00 0.00 H new ATOM 0 HA THR A 77 11.787 -2.116 5.619 1.00 0.00 H new ATOM 0 HB THR A 77 8.830 -1.521 5.615 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.167 -3.623 6.363 1.00 0.00 H new ATOM 0 HG21 THR A 77 8.915 -2.288 3.233 1.00 0.00 H new ATOM 0 HG22 THR A 77 9.927 -0.848 3.496 1.00 0.00 H new ATOM 0 HG23 THR A 77 10.682 -2.454 3.366 1.00 0.00 H new ATOM 1217 N GLN A 78 10.400 0.821 6.378 1.00 0.00 N ATOM 1218 CA GLN A 78 10.587 2.269 6.207 1.00 0.00 C ATOM 1219 C GLN A 78 11.999 2.711 6.620 1.00 0.00 C ATOM 1220 O GLN A 78 12.581 3.580 5.968 1.00 0.00 O ATOM 1221 CB GLN A 78 9.513 3.057 6.979 1.00 0.00 C ATOM 1222 CG GLN A 78 8.113 2.946 6.350 1.00 0.00 C ATOM 1223 CD GLN A 78 8.021 3.530 4.938 1.00 0.00 C ATOM 1224 OE1 GLN A 78 8.646 4.525 4.593 1.00 0.00 O ATOM 1225 NE2 GLN A 78 7.245 2.932 4.057 1.00 0.00 N ATOM 0 H GLN A 78 9.679 0.570 7.054 1.00 0.00 H new ATOM 0 HA GLN A 78 10.474 2.491 5.146 1.00 0.00 H new ATOM 0 HB2 GLN A 78 9.473 2.694 8.006 1.00 0.00 H new ATOM 0 HB3 GLN A 78 9.803 4.107 7.023 1.00 0.00 H new ATOM 0 HG2 GLN A 78 7.822 1.896 6.318 1.00 0.00 H new ATOM 0 HG3 GLN A 78 7.395 3.457 6.992 1.00 0.00 H new ATOM 0 HE21 GLN A 78 6.716 2.102 4.324 1.00 0.00 H new ATOM 0 HE22 GLN A 78 7.173 3.299 3.108 1.00 0.00 H new ATOM 1234 N LEU A 79 12.580 2.097 7.657 1.00 0.00 N ATOM 1235 CA LEU A 79 13.948 2.361 8.108 1.00 0.00 C ATOM 1236 C LEU A 79 14.954 1.973 7.010 1.00 0.00 C ATOM 1237 O LEU A 79 15.805 2.780 6.641 1.00 0.00 O ATOM 1238 CB LEU A 79 14.184 1.596 9.429 1.00 0.00 C ATOM 1239 CG LEU A 79 15.355 2.061 10.312 1.00 0.00 C ATOM 1240 CD1 LEU A 79 16.730 1.895 9.667 1.00 0.00 C ATOM 1241 CD2 LEU A 79 15.175 3.513 10.751 1.00 0.00 C ATOM 0 H LEU A 79 12.102 1.390 8.216 1.00 0.00 H new ATOM 0 HA LEU A 79 14.094 3.424 8.299 1.00 0.00 H new ATOM 0 HB2 LEU A 79 13.271 1.655 10.021 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.340 0.545 9.187 1.00 0.00 H new ATOM 0 HG LEU A 79 15.329 1.401 11.179 1.00 0.00 H new ATOM 0 HD11 LEU A 79 17.499 2.246 10.355 1.00 0.00 H new ATOM 0 HD12 LEU A 79 16.900 0.843 9.439 1.00 0.00 H new ATOM 0 HD13 LEU A 79 16.773 2.477 8.747 1.00 0.00 H new ATOM 0 HD21 LEU A 79 16.018 3.812 11.373 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.127 4.156 9.872 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.251 3.609 11.321 1.00 0.00 H new ATOM 1253 N GLU A 80 14.825 0.772 6.432 1.00 0.00 N ATOM 1254 CA GLU A 80 15.691 0.313 5.334 1.00 0.00 C ATOM 1255 C GLU A 80 15.589 1.236 4.103 1.00 0.00 C ATOM 1256 O GLU A 80 16.606 1.572 3.491 1.00 0.00 O ATOM 1257 CB GLU A 80 15.347 -1.140 4.965 1.00 0.00 C ATOM 1258 CG GLU A 80 15.756 -2.131 6.065 1.00 0.00 C ATOM 1259 CD GLU A 80 15.299 -3.553 5.718 1.00 0.00 C ATOM 1260 OE1 GLU A 80 14.139 -3.899 6.046 1.00 0.00 O ATOM 1261 OE2 GLU A 80 16.103 -4.293 5.099 1.00 0.00 O ATOM 0 H GLU A 80 14.119 0.091 6.711 1.00 0.00 H new ATOM 0 HA GLU A 80 16.725 0.353 5.678 1.00 0.00 H new ATOM 0 HB2 GLU A 80 14.275 -1.223 4.784 1.00 0.00 H new ATOM 0 HB3 GLU A 80 15.849 -1.405 4.035 1.00 0.00 H new ATOM 0 HG2 GLU A 80 16.838 -2.113 6.192 1.00 0.00 H new ATOM 0 HG3 GLU A 80 15.319 -1.826 7.016 1.00 0.00 H new ATOM 1268 N ILE A 81 14.376 1.701 3.768 1.00 0.00 N ATOM 1269 CA ILE A 81 14.147 2.662 2.676 1.00 0.00 C ATOM 1270 C ILE A 81 14.860 3.989 2.985 1.00 0.00 C ATOM 1271 O ILE A 81 15.602 4.489 2.140 1.00 0.00 O ATOM 1272 CB ILE A 81 12.629 2.846 2.421 1.00 0.00 C ATOM 1273 CG1 ILE A 81 12.046 1.557 1.792 1.00 0.00 C ATOM 1274 CG2 ILE A 81 12.344 4.052 1.502 1.00 0.00 C ATOM 1275 CD1 ILE A 81 10.512 1.504 1.783 1.00 0.00 C ATOM 0 H ILE A 81 13.521 1.420 4.249 1.00 0.00 H new ATOM 0 HA ILE A 81 14.574 2.271 1.752 1.00 0.00 H new ATOM 0 HB ILE A 81 12.150 3.040 3.381 1.00 0.00 H new ATOM 0 HG12 ILE A 81 12.408 1.469 0.768 1.00 0.00 H new ATOM 0 HG13 ILE A 81 12.426 0.694 2.339 1.00 0.00 H new ATOM 0 HG21 ILE A 81 11.269 4.146 1.348 1.00 0.00 H new ATOM 0 HG22 ILE A 81 12.725 4.961 1.966 1.00 0.00 H new ATOM 0 HG23 ILE A 81 12.836 3.902 0.541 1.00 0.00 H new ATOM 0 HD11 ILE A 81 10.183 0.571 1.326 1.00 0.00 H new ATOM 0 HD12 ILE A 81 10.140 1.558 2.806 1.00 0.00 H new ATOM 0 HD13 ILE A 81 10.122 2.345 1.210 1.00 0.00 H new ATOM 1287 N ASN A 82 14.687 4.542 4.194 1.00 0.00 N ATOM 1288 CA ASN A 82 15.341 5.785 4.630 1.00 0.00 C ATOM 1289 C ASN A 82 16.874 5.682 4.591 1.00 0.00 C ATOM 1290 O ASN A 82 17.541 6.603 4.115 1.00 0.00 O ATOM 1291 CB ASN A 82 14.862 6.170 6.042 1.00 0.00 C ATOM 1292 CG ASN A 82 13.603 7.021 6.004 1.00 0.00 C ATOM 1293 OD1 ASN A 82 13.652 8.243 5.994 1.00 0.00 O ATOM 1294 ND2 ASN A 82 12.440 6.414 5.964 1.00 0.00 N ATOM 0 H ASN A 82 14.081 4.134 4.906 1.00 0.00 H new ATOM 0 HA ASN A 82 15.055 6.567 3.927 1.00 0.00 H new ATOM 0 HB2 ASN A 82 14.671 5.265 6.619 1.00 0.00 H new ATOM 0 HB3 ASN A 82 15.653 6.715 6.557 1.00 0.00 H new ATOM 0 HD21 ASN A 82 11.580 6.961 5.925 1.00 0.00 H new ATOM 0 HD22 ASN A 82 12.396 5.395 5.972 1.00 0.00 H new ATOM 1301 N GLY A 83 17.433 4.563 5.061 1.00 0.00 N ATOM 1302 CA GLY A 83 18.873 4.312 5.062 1.00 0.00 C ATOM 1303 C GLY A 83 19.472 4.402 3.659 1.00 0.00 C ATOM 1304 O GLY A 83 20.373 5.204 3.414 1.00 0.00 O ATOM 0 H GLY A 83 16.888 3.797 5.457 1.00 0.00 H new ATOM 0 HA2 GLY A 83 19.366 5.034 5.713 1.00 0.00 H new ATOM 0 HA3 GLY A 83 19.068 3.323 5.476 1.00 0.00 H new ATOM 1308 N ARG A 84 18.944 3.618 2.713 1.00 0.00 N ATOM 1309 CA ARG A 84 19.406 3.612 1.316 1.00 0.00 C ATOM 1310 C ARG A 84 19.146 4.938 0.595 1.00 0.00 C ATOM 1311 O ARG A 84 20.023 5.424 -0.117 1.00 0.00 O ATOM 1312 CB ARG A 84 18.765 2.417 0.606 1.00 0.00 C ATOM 1313 CG ARG A 84 19.577 1.960 -0.611 1.00 0.00 C ATOM 1314 CD ARG A 84 19.059 0.598 -1.079 1.00 0.00 C ATOM 1315 NE ARG A 84 19.849 0.100 -2.215 1.00 0.00 N ATOM 1316 CZ ARG A 84 20.586 -0.996 -2.259 1.00 0.00 C ATOM 1317 NH1 ARG A 84 21.332 -1.223 -3.302 1.00 0.00 N ATOM 1318 NH2 ARG A 84 20.631 -1.873 -1.293 1.00 0.00 N ATOM 0 H ARG A 84 18.181 2.966 2.893 1.00 0.00 H new ATOM 0 HA ARG A 84 20.491 3.505 1.298 1.00 0.00 H new ATOM 0 HB2 ARG A 84 18.669 1.589 1.308 1.00 0.00 H new ATOM 0 HB3 ARG A 84 17.757 2.684 0.288 1.00 0.00 H new ATOM 0 HG2 ARG A 84 19.492 2.691 -1.415 1.00 0.00 H new ATOM 0 HG3 ARG A 84 20.634 1.892 -0.353 1.00 0.00 H new ATOM 0 HD2 ARG A 84 19.106 -0.116 -0.257 1.00 0.00 H new ATOM 0 HD3 ARG A 84 18.011 0.682 -1.368 1.00 0.00 H new ATOM 0 HE ARG A 84 19.825 0.664 -3.065 1.00 0.00 H new ATOM 0 HH11 ARG A 84 21.344 -0.558 -4.075 1.00 0.00 H new ATOM 0 HH12 ARG A 84 21.905 -2.066 -3.346 1.00 0.00 H new ATOM 0 HH21 ARG A 84 20.078 -1.730 -0.448 1.00 0.00 H new ATOM 0 HH22 ARG A 84 21.219 -2.701 -1.383 1.00 0.00 H new ATOM 1332 N ASN A 85 17.989 5.564 0.827 1.00 0.00 N ATOM 1333 CA ASN A 85 17.643 6.887 0.292 1.00 0.00 C ATOM 1334 C ASN A 85 18.708 7.931 0.677 1.00 0.00 C ATOM 1335 O ASN A 85 19.141 8.709 -0.173 1.00 0.00 O ATOM 1336 CB ASN A 85 16.236 7.259 0.805 1.00 0.00 C ATOM 1337 CG ASN A 85 15.896 8.738 0.718 1.00 0.00 C ATOM 1338 OD1 ASN A 85 16.002 9.471 1.690 1.00 0.00 O ATOM 1339 ND2 ASN A 85 15.483 9.233 -0.424 1.00 0.00 N ATOM 0 H ASN A 85 17.251 5.159 1.403 1.00 0.00 H new ATOM 0 HA ASN A 85 17.625 6.866 -0.798 1.00 0.00 H new ATOM 0 HB2 ASN A 85 15.496 6.696 0.235 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.147 6.941 1.844 1.00 0.00 H new ATOM 0 HD21 ASN A 85 15.253 10.224 -0.497 1.00 0.00 H new ATOM 0 HD22 ASN A 85 15.392 8.627 -1.239 1.00 0.00 H new ATOM 1346 N ASN A 86 19.184 7.919 1.928 1.00 0.00 N ATOM 1347 CA ASN A 86 20.230 8.832 2.388 1.00 0.00 C ATOM 1348 C ASN A 86 21.581 8.636 1.657 1.00 0.00 C ATOM 1349 O ASN A 86 22.351 9.591 1.555 1.00 0.00 O ATOM 1350 CB ASN A 86 20.363 8.715 3.917 1.00 0.00 C ATOM 1351 CG ASN A 86 21.034 9.935 4.533 1.00 0.00 C ATOM 1352 OD1 ASN A 86 20.678 11.073 4.263 1.00 0.00 O ATOM 1353 ND2 ASN A 86 22.003 9.751 5.396 1.00 0.00 N ATOM 0 H ASN A 86 18.853 7.276 2.647 1.00 0.00 H new ATOM 0 HA ASN A 86 19.930 9.849 2.134 1.00 0.00 H new ATOM 0 HB2 ASN A 86 19.374 8.586 4.357 1.00 0.00 H new ATOM 0 HB3 ASN A 86 20.940 7.823 4.162 1.00 0.00 H new ATOM 0 HD21 ASN A 86 22.453 10.554 5.836 1.00 0.00 H new ATOM 0 HD22 ASN A 86 22.307 8.805 5.628 1.00 0.00 H new ATOM 1360 N LEU A 87 21.862 7.441 1.106 1.00 0.00 N ATOM 1361 CA LEU A 87 23.084 7.183 0.320 1.00 0.00 C ATOM 1362 C LEU A 87 22.928 7.658 -1.136 1.00 0.00 C ATOM 1363 O LEU A 87 23.853 8.243 -1.700 1.00 0.00 O ATOM 1364 CB LEU A 87 23.440 5.684 0.321 1.00 0.00 C ATOM 1365 CG LEU A 87 23.577 5.039 1.708 1.00 0.00 C ATOM 1366 CD1 LEU A 87 23.977 3.576 1.557 1.00 0.00 C ATOM 1367 CD2 LEU A 87 24.622 5.705 2.600 1.00 0.00 C ATOM 0 H LEU A 87 21.251 6.629 1.192 1.00 0.00 H new ATOM 0 HA LEU A 87 23.887 7.746 0.795 1.00 0.00 H new ATOM 0 HB2 LEU A 87 22.674 5.146 -0.237 1.00 0.00 H new ATOM 0 HB3 LEU A 87 24.379 5.551 -0.217 1.00 0.00 H new ATOM 0 HG LEU A 87 22.603 5.157 2.183 1.00 0.00 H new ATOM 0 HD11 LEU A 87 24.073 3.122 2.543 1.00 0.00 H new ATOM 0 HD12 LEU A 87 23.213 3.047 0.987 1.00 0.00 H new ATOM 0 HD13 LEU A 87 24.931 3.512 1.033 1.00 0.00 H new ATOM 0 HD21 LEU A 87 24.659 5.193 3.561 1.00 0.00 H new ATOM 0 HD22 LEU A 87 25.599 5.648 2.120 1.00 0.00 H new ATOM 0 HD23 LEU A 87 24.355 6.750 2.756 1.00 0.00 H new ATOM 1379 N ILE A 88 21.754 7.417 -1.737 1.00 0.00 N ATOM 1380 CA ILE A 88 21.416 7.815 -3.118 1.00 0.00 C ATOM 1381 C ILE A 88 21.356 9.349 -3.263 1.00 0.00 C ATOM 1382 O ILE A 88 21.792 9.886 -4.282 1.00 0.00 O ATOM 1383 CB ILE A 88 20.068 7.163 -3.527 1.00 0.00 C ATOM 1384 CG1 ILE A 88 20.185 5.619 -3.546 1.00 0.00 C ATOM 1385 CG2 ILE A 88 19.585 7.657 -4.906 1.00 0.00 C ATOM 1386 CD1 ILE A 88 18.846 4.877 -3.642 1.00 0.00 C ATOM 0 H ILE A 88 20.992 6.928 -1.268 1.00 0.00 H new ATOM 0 HA ILE A 88 22.201 7.462 -3.787 1.00 0.00 H new ATOM 0 HB ILE A 88 19.334 7.462 -2.779 1.00 0.00 H new ATOM 0 HG12 ILE A 88 20.809 5.326 -4.390 1.00 0.00 H new ATOM 0 HG13 ILE A 88 20.700 5.296 -2.641 1.00 0.00 H new ATOM 0 HG21 ILE A 88 18.639 7.176 -5.154 1.00 0.00 H new ATOM 0 HG22 ILE A 88 19.446 8.738 -4.877 1.00 0.00 H new ATOM 0 HG23 ILE A 88 20.328 7.407 -5.663 1.00 0.00 H new ATOM 0 HD11 ILE A 88 19.025 3.802 -3.649 1.00 0.00 H new ATOM 0 HD12 ILE A 88 18.225 5.135 -2.785 1.00 0.00 H new ATOM 0 HD13 ILE A 88 18.335 5.166 -4.561 1.00 0.00 H new ATOM 1398 N GLN A 89 20.802 10.006 -2.235 1.00 0.00 N ATOM 1399 CA GLN A 89 20.508 11.434 -1.997 1.00 0.00 C ATOM 1400 C GLN A 89 19.047 11.500 -1.526 1.00 0.00 C ATOM 1401 O GLN A 89 18.177 10.876 -2.136 1.00 0.00 O ATOM 1402 CB GLN A 89 20.761 12.355 -3.211 1.00 0.00 C ATOM 1403 CG GLN A 89 20.482 13.839 -2.921 1.00 0.00 C ATOM 1404 CD GLN A 89 20.774 14.713 -4.140 1.00 0.00 C ATOM 1405 OE1 GLN A 89 19.949 14.881 -5.027 1.00 0.00 O ATOM 1406 NE2 GLN A 89 21.947 15.305 -4.236 1.00 0.00 N ATOM 0 H GLN A 89 20.502 9.465 -1.424 1.00 0.00 H new ATOM 0 HA GLN A 89 21.198 11.818 -1.246 1.00 0.00 H new ATOM 0 HB2 GLN A 89 21.797 12.244 -3.532 1.00 0.00 H new ATOM 0 HB3 GLN A 89 20.133 12.030 -4.041 1.00 0.00 H new ATOM 0 HG2 GLN A 89 19.441 13.963 -2.624 1.00 0.00 H new ATOM 0 HG3 GLN A 89 21.094 14.168 -2.081 1.00 0.00 H new ATOM 0 HE21 GLN A 89 22.646 15.175 -3.504 1.00 0.00 H new ATOM 0 HE22 GLN A 89 22.157 15.894 -5.042 1.00 0.00 H new ATOM 1415 N GLN A 90 18.760 12.249 -0.454 1.00 0.00 N ATOM 1416 CA GLN A 90 17.419 12.342 0.155 1.00 0.00 C ATOM 1417 C GLN A 90 16.266 12.641 -0.828 1.00 0.00 C ATOM 1418 O GLN A 90 15.154 12.142 -0.638 1.00 0.00 O ATOM 1419 CB GLN A 90 17.440 13.345 1.321 1.00 0.00 C ATOM 1420 CG GLN A 90 18.326 12.852 2.480 1.00 0.00 C ATOM 1421 CD GLN A 90 18.359 13.794 3.686 1.00 0.00 C ATOM 1422 OE1 GLN A 90 17.661 14.799 3.775 1.00 0.00 O ATOM 1423 NE2 GLN A 90 19.183 13.502 4.668 1.00 0.00 N ATOM 0 H GLN A 90 19.459 12.817 0.024 1.00 0.00 H new ATOM 0 HA GLN A 90 17.194 11.342 0.527 1.00 0.00 H new ATOM 0 HB2 GLN A 90 17.807 14.308 0.966 1.00 0.00 H new ATOM 0 HB3 GLN A 90 16.424 13.505 1.682 1.00 0.00 H new ATOM 0 HG2 GLN A 90 17.969 11.875 2.806 1.00 0.00 H new ATOM 0 HG3 GLN A 90 19.343 12.714 2.112 1.00 0.00 H new ATOM 0 HE21 GLN A 90 19.771 12.670 4.610 1.00 0.00 H new ATOM 0 HE22 GLN A 90 19.235 14.107 5.487 1.00 0.00 H new ATOM 1432 N LYS A 91 16.528 13.397 -1.903 1.00 0.00 N ATOM 1433 CA LYS A 91 15.563 13.727 -2.975 1.00 0.00 C ATOM 1434 C LYS A 91 15.152 12.521 -3.842 1.00 0.00 C ATOM 1435 O LYS A 91 14.117 12.566 -4.508 1.00 0.00 O ATOM 1436 CB LYS A 91 16.154 14.821 -3.884 1.00 0.00 C ATOM 1437 CG LYS A 91 16.539 16.092 -3.111 1.00 0.00 C ATOM 1438 CD LYS A 91 17.005 17.200 -4.069 1.00 0.00 C ATOM 1439 CE LYS A 91 17.470 18.454 -3.318 1.00 0.00 C ATOM 1440 NZ LYS A 91 16.354 19.126 -2.618 1.00 0.00 N ATOM 0 H LYS A 91 17.446 13.812 -2.061 1.00 0.00 H new ATOM 0 HA LYS A 91 14.660 14.074 -2.472 1.00 0.00 H new ATOM 0 HB2 LYS A 91 17.035 14.429 -4.391 1.00 0.00 H new ATOM 0 HB3 LYS A 91 15.429 15.076 -4.656 1.00 0.00 H new ATOM 0 HG2 LYS A 91 15.685 16.443 -2.532 1.00 0.00 H new ATOM 0 HG3 LYS A 91 17.333 15.863 -2.400 1.00 0.00 H new ATOM 0 HD2 LYS A 91 17.821 16.825 -4.687 1.00 0.00 H new ATOM 0 HD3 LYS A 91 16.189 17.463 -4.743 1.00 0.00 H new ATOM 0 HE2 LYS A 91 18.239 18.180 -2.595 1.00 0.00 H new ATOM 0 HE3 LYS A 91 17.928 19.149 -4.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 16.701 19.996 -2.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 15.609 19.366 -3.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 15.966 18.490 -1.893 1.00 0.00 H new ATOM 1454 N ASN A 92 15.962 11.460 -3.842 1.00 0.00 N ATOM 1455 CA ASN A 92 15.778 10.224 -4.612 1.00 0.00 C ATOM 1456 C ASN A 92 16.376 9.011 -3.876 1.00 0.00 C ATOM 1457 O ASN A 92 15.687 8.321 -3.114 1.00 0.00 O ATOM 1458 CB ASN A 92 16.439 10.417 -5.992 1.00 0.00 C ATOM 1459 CG ASN A 92 16.301 9.215 -6.918 1.00 0.00 C ATOM 1460 OD1 ASN A 92 15.511 8.305 -6.705 1.00 0.00 O ATOM 1461 ND2 ASN A 92 17.078 9.164 -7.976 1.00 0.00 N ATOM 0 H ASN A 92 16.810 11.437 -3.275 1.00 0.00 H new ATOM 0 HA ASN A 92 14.714 10.021 -4.734 1.00 0.00 H new ATOM 0 HB2 ASN A 92 15.998 11.288 -6.476 1.00 0.00 H new ATOM 0 HB3 ASN A 92 17.498 10.633 -5.849 1.00 0.00 H new ATOM 0 HD21 ASN A 92 17.020 8.370 -8.613 1.00 0.00 H new ATOM 0 HD22 ASN A 92 17.739 9.919 -8.160 1.00 0.00 H new TER 1468 ASN A 92 ATOM 1469 P G B 95 43.466 11.339 29.643 1.00 0.00 P ATOM 1470 OP1 G B 95 44.549 10.629 28.918 1.00 0.00 O ATOM 1471 OP2 G B 95 42.314 11.881 28.880 1.00 0.00 O ATOM 1472 O5' G B 95 42.870 10.307 30.749 1.00 0.00 O ATOM 1473 C5' G B 95 43.640 9.884 31.871 1.00 0.00 C ATOM 1474 C4' G B 95 43.775 10.961 32.960 1.00 0.00 C ATOM 1475 O4' G B 95 44.462 12.121 32.508 1.00 0.00 O ATOM 1476 C3' G B 95 42.447 11.494 33.486 1.00 0.00 C ATOM 1477 O3' G B 95 41.761 10.627 34.377 1.00 0.00 O ATOM 1478 C2' G B 95 42.936 12.747 34.218 1.00 0.00 C ATOM 1479 O2' G B 95 43.412 12.460 35.531 1.00 0.00 O ATOM 1480 C1' G B 95 44.134 13.212 33.370 1.00 0.00 C ATOM 1481 N9 G B 95 43.843 14.505 32.677 1.00 0.00 N ATOM 1482 C8 G B 95 43.266 15.621 33.240 1.00 0.00 C ATOM 1483 N7 G B 95 43.244 16.676 32.470 1.00 0.00 N ATOM 1484 C5 G B 95 43.871 16.241 31.298 1.00 0.00 C ATOM 1485 C6 G B 95 44.189 16.944 30.078 1.00 0.00 C ATOM 1486 O6 G B 95 43.969 18.119 29.775 1.00 0.00 O ATOM 1487 N1 G B 95 44.835 16.161 29.142 1.00 0.00 N ATOM 1488 C2 G B 95 45.164 14.864 29.350 1.00 0.00 C ATOM 1489 N2 G B 95 45.801 14.236 28.395 1.00 0.00 N ATOM 1490 N3 G B 95 44.892 14.176 30.458 1.00 0.00 N ATOM 1491 C4 G B 95 44.240 14.913 31.412 1.00 0.00 C ATOM 0 H5' G B 95 44.634 9.595 31.531 1.00 0.00 H new ATOM 0 H5'' G B 95 43.180 8.996 32.304 1.00 0.00 H new ATOM 0 H4' G B 95 44.320 10.429 33.740 1.00 0.00 H new ATOM 0 H3' G B 95 41.712 11.642 32.695 1.00 0.00 H new ATOM 0 H2' G B 95 42.132 13.475 34.327 1.00 0.00 H new ATOM 0 HO2' G B 95 42.952 11.668 35.880 1.00 0.00 H new ATOM 0 H1' G B 95 45.008 13.449 33.977 1.00 0.00 H new ATOM 0 H8 G B 95 42.862 15.624 34.242 1.00 0.00 H new ATOM 0 H1 G B 95 45.078 16.582 28.245 1.00 0.00 H new ATOM 0 H21 G B 95 46.065 13.258 28.516 1.00 0.00 H new ATOM 0 H22 G B 95 46.033 14.724 27.530 1.00 0.00 H new ATOM 1503 P U B 96 40.266 10.129 34.050 1.00 0.00 P ATOM 1504 OP1 U B 96 39.716 9.502 35.273 1.00 0.00 O ATOM 1505 OP2 U B 96 40.299 9.380 32.774 1.00 0.00 O ATOM 1506 O5' U B 96 39.520 11.538 33.800 1.00 0.00 O ATOM 1507 C5' U B 96 39.269 12.460 34.849 1.00 0.00 C ATOM 1508 C4' U B 96 38.860 13.836 34.302 1.00 0.00 C ATOM 1509 O4' U B 96 39.952 14.527 33.700 1.00 0.00 O ATOM 1510 C3' U B 96 37.786 13.796 33.217 1.00 0.00 C ATOM 1511 O3' U B 96 36.487 13.496 33.712 1.00 0.00 O ATOM 1512 C2' U B 96 37.916 15.218 32.654 1.00 0.00 C ATOM 1513 O2' U B 96 37.209 16.187 33.429 1.00 0.00 O ATOM 1514 C1' U B 96 39.421 15.501 32.801 1.00 0.00 C ATOM 1515 N1 U B 96 40.086 15.557 31.461 1.00 0.00 N ATOM 1516 C2 U B 96 40.462 14.383 30.782 1.00 0.00 C ATOM 1517 O2 U B 96 40.314 13.241 31.210 1.00 0.00 O ATOM 1518 N3 U B 96 41.019 14.532 29.529 1.00 0.00 N ATOM 1519 C4 U B 96 41.204 15.719 28.864 1.00 0.00 C ATOM 1520 O4 U B 96 41.711 15.725 27.746 1.00 0.00 O ATOM 1521 C5 U B 96 40.761 16.883 29.596 1.00 0.00 C ATOM 1522 C6 U B 96 40.226 16.782 30.842 1.00 0.00 C ATOM 0 H5' U B 96 40.162 12.563 35.466 1.00 0.00 H new ATOM 0 H5'' U B 96 38.479 12.074 35.493 1.00 0.00 H new ATOM 0 H4' U B 96 38.483 14.338 35.193 1.00 0.00 H new ATOM 0 H3' U B 96 37.920 13.005 32.479 1.00 0.00 H new ATOM 0 H2' U B 96 37.515 15.282 31.643 1.00 0.00 H new ATOM 0 HO2' U B 96 36.462 15.754 33.892 1.00 0.00 H new ATOM 0 H1' U B 96 39.613 16.485 33.230 1.00 0.00 H new ATOM 0 H3 U B 96 41.321 13.682 29.053 1.00 0.00 H new ATOM 0 H5 U B 96 40.857 17.858 29.142 1.00 0.00 H new ATOM 0 H6 U B 96 39.905 17.676 31.356 1.00 0.00 H new ATOM 1533 P C B 97 35.296 13.042 32.726 1.00 0.00 P ATOM 1534 OP1 C B 97 35.564 13.564 31.367 1.00 0.00 O ATOM 1535 OP2 C B 97 34.012 13.338 33.398 1.00 0.00 O ATOM 1536 O5' C B 97 35.483 11.439 32.712 1.00 0.00 O ATOM 1537 C5' C B 97 36.355 10.781 31.803 1.00 0.00 C ATOM 1538 C4' C B 97 36.398 9.267 32.060 1.00 0.00 C ATOM 1539 O4' C B 97 37.145 9.006 33.242 1.00 0.00 O ATOM 1540 C3' C B 97 35.000 8.643 32.224 1.00 0.00 C ATOM 1541 O3' C B 97 34.939 7.350 31.628 1.00 0.00 O ATOM 1542 C2' C B 97 34.877 8.541 33.748 1.00 0.00 C ATOM 1543 O2' C B 97 34.023 7.484 34.174 1.00 0.00 O ATOM 1544 C1' C B 97 36.330 8.315 34.173 1.00 0.00 C ATOM 1545 N1 C B 97 36.602 8.798 35.556 1.00 0.00 N ATOM 1546 C2 C B 97 36.977 7.875 36.545 1.00 0.00 C ATOM 1547 O2 C B 97 37.110 6.672 36.300 1.00 0.00 O ATOM 1548 N3 C B 97 37.203 8.286 37.819 1.00 0.00 N ATOM 1549 C4 C B 97 37.073 9.566 38.101 1.00 0.00 C ATOM 1550 N4 C B 97 37.305 9.900 39.342 1.00 0.00 N ATOM 1551 C5 C B 97 36.701 10.550 37.145 1.00 0.00 C ATOM 1552 C6 C B 97 36.473 10.127 35.877 1.00 0.00 C ATOM 0 H5' C B 97 37.359 11.195 31.896 1.00 0.00 H new ATOM 0 H5'' C B 97 36.026 10.968 30.781 1.00 0.00 H new ATOM 0 H4' C B 97 36.865 8.816 31.184 1.00 0.00 H new ATOM 0 H3' C B 97 34.206 9.218 31.749 1.00 0.00 H new ATOM 0 H2' C B 97 34.417 9.422 34.195 1.00 0.00 H new ATOM 0 HO2' C B 97 33.999 6.785 33.487 1.00 0.00 H new ATOM 0 H1' C B 97 36.543 7.246 34.180 1.00 0.00 H new ATOM 0 H41 C B 97 37.223 10.875 39.632 1.00 0.00 H new ATOM 0 H42 C B 97 37.568 9.186 40.022 1.00 0.00 H new ATOM 0 H5 C B 97 36.604 11.591 37.417 1.00 0.00 H new ATOM 0 H6 C B 97 36.189 10.839 35.116 1.00 0.00 H new ATOM 1564 P U B 98 34.565 7.175 30.073 1.00 0.00 P ATOM 1565 OP1 U B 98 34.542 5.731 29.753 1.00 0.00 O ATOM 1566 OP2 U B 98 35.395 8.107 29.277 1.00 0.00 O ATOM 1567 O5' U B 98 33.053 7.733 30.080 1.00 0.00 O ATOM 1568 C5' U B 98 31.998 7.006 30.697 1.00 0.00 C ATOM 1569 C4' U B 98 30.704 7.826 30.731 1.00 0.00 C ATOM 1570 O4' U B 98 30.812 8.942 31.608 1.00 0.00 O ATOM 1571 C3' U B 98 30.284 8.386 29.372 1.00 0.00 C ATOM 1572 O3' U B 98 29.714 7.384 28.543 1.00 0.00 O ATOM 1573 C2' U B 98 29.314 9.489 29.818 1.00 0.00 C ATOM 1574 O2' U B 98 28.015 8.987 30.129 1.00 0.00 O ATOM 1575 C1' U B 98 29.975 9.987 31.117 1.00 0.00 C ATOM 1576 N1 U B 98 30.766 11.233 30.891 1.00 0.00 N ATOM 1577 C2 U B 98 30.168 12.462 31.208 1.00 0.00 C ATOM 1578 O2 U B 98 29.045 12.569 31.705 1.00 0.00 O ATOM 1579 N3 U B 98 30.893 13.604 30.934 1.00 0.00 N ATOM 1580 C4 U B 98 32.145 13.645 30.369 1.00 0.00 C ATOM 1581 O4 U B 98 32.690 14.726 30.158 1.00 0.00 O ATOM 1582 C5 U B 98 32.709 12.345 30.072 1.00 0.00 C ATOM 1583 C6 U B 98 32.029 11.197 30.333 1.00 0.00 C ATOM 0 H5' U B 98 32.286 6.734 31.713 1.00 0.00 H new ATOM 0 H5'' U B 98 31.828 6.076 30.154 1.00 0.00 H new ATOM 0 H4' U B 98 29.955 7.112 31.073 1.00 0.00 H new ATOM 0 H3' U B 98 31.089 8.761 28.740 1.00 0.00 H new ATOM 0 H2' U B 98 29.162 10.240 29.043 1.00 0.00 H new ATOM 0 HO2' U B 98 27.904 8.098 29.732 1.00 0.00 H new ATOM 0 H1' U B 98 29.204 10.235 31.846 1.00 0.00 H new ATOM 0 H3 U B 98 30.461 14.497 31.172 1.00 0.00 H new ATOM 0 H5 U B 98 33.694 12.286 29.632 1.00 0.00 H new ATOM 0 H6 U B 98 32.482 10.245 30.101 1.00 0.00 H new ATOM 1594 P C B 99 29.343 7.661 27.000 1.00 0.00 P ATOM 1595 OP1 C B 99 29.990 6.619 26.172 1.00 0.00 O ATOM 1596 OP2 C B 99 29.548 9.093 26.691 1.00 0.00 O ATOM 1597 O5' C B 99 27.754 7.372 27.019 1.00 0.00 O ATOM 1598 C5' C B 99 27.246 6.105 27.423 1.00 0.00 C ATOM 1599 C4' C B 99 26.066 5.645 26.556 1.00 0.00 C ATOM 1600 O4' C B 99 24.855 6.320 26.873 1.00 0.00 O ATOM 1601 C3' C B 99 26.308 5.816 25.041 1.00 0.00 C ATOM 1602 O3' C B 99 26.168 4.570 24.366 1.00 0.00 O ATOM 1603 C2' C B 99 25.162 6.764 24.653 1.00 0.00 C ATOM 1604 O2' C B 99 24.745 6.604 23.303 1.00 0.00 O ATOM 1605 C1' C B 99 24.095 6.372 25.677 1.00 0.00 C ATOM 1606 N1 C B 99 22.895 7.254 25.827 1.00 0.00 N ATOM 1607 C2 C B 99 21.883 6.832 26.708 1.00 0.00 C ATOM 1608 O2 C B 99 21.967 5.783 27.355 1.00 0.00 O ATOM 1609 N3 C B 99 20.745 7.557 26.856 1.00 0.00 N ATOM 1610 C4 C B 99 20.580 8.632 26.117 1.00 0.00 C ATOM 1611 N4 C B 99 19.469 9.288 26.316 1.00 0.00 N ATOM 1612 C5 C B 99 21.521 9.066 25.147 1.00 0.00 C ATOM 1613 C6 C B 99 22.670 8.352 25.025 1.00 0.00 C ATOM 0 H5' C B 99 26.929 6.159 28.464 1.00 0.00 H new ATOM 0 H5'' C B 99 28.043 5.363 27.370 1.00 0.00 H new ATOM 0 H4' C B 99 25.977 4.584 26.788 1.00 0.00 H new ATOM 0 H3' C B 99 27.303 6.183 24.788 1.00 0.00 H new ATOM 0 H2' C B 99 25.425 7.821 24.683 1.00 0.00 H new ATOM 0 HO2' C B 99 23.892 7.066 23.167 1.00 0.00 H new ATOM 0 H1' C B 99 23.603 5.451 25.365 1.00 0.00 H new ATOM 0 H41 C B 99 19.272 10.132 25.779 1.00 0.00 H new ATOM 0 H42 C B 99 18.798 8.956 27.009 1.00 0.00 H new ATOM 0 H5 C B 99 21.331 9.931 24.529 1.00 0.00 H new ATOM 0 H6 C B 99 23.411 8.646 24.296 1.00 0.00 H new ATOM 1625 P G B 100 27.396 3.533 24.281 1.00 0.00 P ATOM 1626 OP1 G B 100 27.891 3.274 25.650 1.00 0.00 O ATOM 1627 OP2 G B 100 28.321 3.980 23.217 1.00 0.00 O ATOM 1628 O5' G B 100 26.583 2.234 23.787 1.00 0.00 O ATOM 1629 C5' G B 100 26.353 1.949 22.415 1.00 0.00 C ATOM 1630 C4' G B 100 27.513 1.140 21.795 1.00 0.00 C ATOM 1631 O4' G B 100 27.786 -0.033 22.553 1.00 0.00 O ATOM 1632 C3' G B 100 27.177 0.619 20.390 1.00 0.00 C ATOM 1633 O3' G B 100 28.407 0.355 19.718 1.00 0.00 O ATOM 1634 C2' G B 100 26.376 -0.651 20.733 1.00 0.00 C ATOM 1635 O2' G B 100 26.470 -1.692 19.773 1.00 0.00 O ATOM 1636 C1' G B 100 26.982 -1.102 22.068 1.00 0.00 C ATOM 1637 N9 G B 100 26.011 -1.508 23.119 1.00 0.00 N ATOM 1638 C8 G B 100 24.729 -1.072 23.366 1.00 0.00 C ATOM 1639 N7 G B 100 24.219 -1.510 24.489 1.00 0.00 N ATOM 1640 C5 G B 100 25.217 -2.351 25.003 1.00 0.00 C ATOM 1641 C6 G B 100 25.296 -3.125 26.220 1.00 0.00 C ATOM 1642 O6 G B 100 24.503 -3.189 27.163 1.00 0.00 O ATOM 1643 N1 G B 100 26.450 -3.883 26.319 1.00 0.00 N ATOM 1644 C2 G B 100 27.444 -3.858 25.394 1.00 0.00 C ATOM 1645 N2 G B 100 28.489 -4.619 25.590 1.00 0.00 N ATOM 1646 N3 G B 100 27.437 -3.122 24.286 1.00 0.00 N ATOM 1647 C4 G B 100 26.292 -2.389 24.140 1.00 0.00 C ATOM 0 H5' G B 100 26.227 2.882 21.866 1.00 0.00 H new ATOM 0 H5'' G B 100 25.423 1.390 22.311 1.00 0.00 H new ATOM 0 H4' G B 100 28.355 1.832 21.774 1.00 0.00 H new ATOM 0 H3' G B 100 26.621 1.284 19.729 1.00 0.00 H new ATOM 0 H2' G B 100 25.309 -0.430 20.764 1.00 0.00 H new ATOM 0 HO2' G B 100 26.252 -1.339 18.885 1.00 0.00 H new ATOM 0 H1' G B 100 27.549 -2.009 21.860 1.00 0.00 H new ATOM 0 H8 G B 100 24.190 -0.424 22.691 1.00 0.00 H new ATOM 0 H1 G B 100 26.560 -4.493 27.129 1.00 0.00 H new ATOM 0 H21 G B 100 29.252 -4.622 24.913 1.00 0.00 H new ATOM 0 H22 G B 100 28.541 -5.210 26.420 1.00 0.00 H new ATOM 1659 P C B 101 28.678 0.852 18.211 1.00 0.00 P ATOM 1660 OP1 C B 101 30.121 0.700 17.923 1.00 0.00 O ATOM 1661 OP2 C B 101 28.029 2.168 18.024 1.00 0.00 O ATOM 1662 O5' C B 101 27.867 -0.226 17.331 1.00 0.00 O ATOM 1663 C5' C B 101 28.364 -1.540 17.108 1.00 0.00 C ATOM 1664 C4' C B 101 27.472 -2.291 16.111 1.00 0.00 C ATOM 1665 O4' C B 101 26.201 -2.562 16.687 1.00 0.00 O ATOM 1666 C3' C B 101 27.242 -1.548 14.786 1.00 0.00 C ATOM 1667 O3' C B 101 28.219 -1.841 13.798 1.00 0.00 O ATOM 1668 C2' C B 101 25.866 -2.069 14.369 1.00 0.00 C ATOM 1669 O2' C B 101 25.952 -3.298 13.655 1.00 0.00 O ATOM 1670 C1' C B 101 25.189 -2.363 15.709 1.00 0.00 C ATOM 1671 N1 C B 101 24.262 -1.300 16.181 1.00 0.00 N ATOM 1672 C2 C B 101 22.915 -1.641 16.368 1.00 0.00 C ATOM 1673 O2 C B 101 22.523 -2.810 16.333 1.00 0.00 O ATOM 1674 N3 C B 101 21.986 -0.669 16.515 1.00 0.00 N ATOM 1675 C4 C B 101 22.384 0.578 16.599 1.00 0.00 C ATOM 1676 N4 C B 101 21.441 1.464 16.672 1.00 0.00 N ATOM 1677 C5 C B 101 23.743 0.982 16.536 1.00 0.00 C ATOM 1678 C6 C B 101 24.660 0.009 16.324 1.00 0.00 C ATOM 0 H5' C B 101 28.404 -2.085 18.051 1.00 0.00 H new ATOM 0 H5'' C B 101 29.384 -1.489 16.726 1.00 0.00 H new ATOM 0 H4' C B 101 28.014 -3.209 15.885 1.00 0.00 H new ATOM 0 H3' C B 101 27.307 -0.466 14.897 1.00 0.00 H new ATOM 0 H2' C B 101 25.350 -1.357 13.724 1.00 0.00 H new ATOM 0 HO2' C B 101 25.243 -3.334 12.980 1.00 0.00 H new ATOM 0 H1' C B 101 24.574 -3.250 15.559 1.00 0.00 H new ATOM 0 H41 C B 101 21.676 2.454 16.740 1.00 0.00 H new ATOM 0 H42 C B 101 20.464 1.171 16.662 1.00 0.00 H new ATOM 0 H5 C B 101 24.032 2.016 16.652 1.00 0.00 H new ATOM 0 H6 C B 101 25.709 0.262 16.267 1.00 0.00 H new ATOM 1690 P U B 102 29.344 -0.766 13.407 1.00 0.00 P ATOM 1691 OP1 U B 102 30.267 -1.386 12.432 1.00 0.00 O ATOM 1692 OP2 U B 102 29.868 -0.162 14.650 1.00 0.00 O ATOM 1693 O5' U B 102 28.437 0.326 12.643 1.00 0.00 O ATOM 1694 C5' U B 102 27.780 -0.010 11.428 1.00 0.00 C ATOM 1695 C4' U B 102 27.027 1.177 10.826 1.00 0.00 C ATOM 1696 O4' U B 102 25.914 1.573 11.613 1.00 0.00 O ATOM 1697 C3' U B 102 27.881 2.414 10.568 1.00 0.00 C ATOM 1698 O3' U B 102 28.697 2.153 9.434 1.00 0.00 O ATOM 1699 C2' U B 102 26.771 3.468 10.438 1.00 0.00 C ATOM 1700 O2' U B 102 26.131 3.496 9.168 1.00 0.00 O ATOM 1701 C1' U B 102 25.724 2.974 11.451 1.00 0.00 C ATOM 1702 N1 U B 102 25.797 3.678 12.764 1.00 0.00 N ATOM 1703 C2 U B 102 25.282 4.979 12.830 1.00 0.00 C ATOM 1704 O2 U B 102 24.942 5.626 11.839 1.00 0.00 O ATOM 1705 N3 U B 102 25.185 5.557 14.079 1.00 0.00 N ATOM 1706 C4 U B 102 25.593 4.985 15.261 1.00 0.00 C ATOM 1707 O4 U B 102 25.470 5.600 16.314 1.00 0.00 O ATOM 1708 C5 U B 102 26.157 3.660 15.120 1.00 0.00 C ATOM 1709 C6 U B 102 26.247 3.048 13.909 1.00 0.00 C ATOM 0 H5' U B 102 27.081 -0.826 11.610 1.00 0.00 H new ATOM 0 H5'' U B 102 28.514 -0.373 10.709 1.00 0.00 H new ATOM 0 H4' U B 102 26.695 0.789 9.863 1.00 0.00 H new ATOM 0 H3' U B 102 28.615 2.734 11.307 1.00 0.00 H new ATOM 0 H2' U B 102 27.183 4.466 10.589 1.00 0.00 H new ATOM 0 HO2' U B 102 26.505 2.792 8.598 1.00 0.00 H new ATOM 0 H1' U B 102 24.729 3.195 11.064 1.00 0.00 H new ATOM 0 H3 U B 102 24.775 6.490 14.130 1.00 0.00 H new ATOM 0 H5 U B 102 26.515 3.144 15.999 1.00 0.00 H new ATOM 0 H6 U B 102 26.675 2.059 13.841 1.00 0.00 H new ATOM 1720 P U B 103 29.592 3.249 8.656 1.00 0.00 P ATOM 1721 OP1 U B 103 30.979 2.738 8.573 1.00 0.00 O ATOM 1722 OP2 U B 103 29.317 4.597 9.195 1.00 0.00 O ATOM 1723 O5' U B 103 28.885 3.102 7.215 1.00 0.00 O ATOM 1724 C5' U B 103 28.907 1.866 6.510 1.00 0.00 C ATOM 1725 C4' U B 103 27.569 1.563 5.817 1.00 0.00 C ATOM 1726 O4' U B 103 26.447 1.932 6.616 1.00 0.00 O ATOM 1727 C3' U B 103 27.348 2.194 4.441 1.00 0.00 C ATOM 1728 O3' U B 103 28.131 1.572 3.430 1.00 0.00 O ATOM 1729 C2' U B 103 25.838 1.997 4.314 1.00 0.00 C ATOM 1730 O2' U B 103 25.462 0.693 3.883 1.00 0.00 O ATOM 1731 C1' U B 103 25.341 2.185 5.753 1.00 0.00 C ATOM 1732 N1 U B 103 24.684 3.520 5.926 1.00 0.00 N ATOM 1733 C2 U B 103 25.430 4.692 6.164 1.00 0.00 C ATOM 1734 O2 U B 103 26.652 4.752 6.242 1.00 0.00 O ATOM 1735 N3 U B 103 24.734 5.879 6.251 1.00 0.00 N ATOM 1736 C4 U B 103 23.390 6.036 6.034 1.00 0.00 C ATOM 1737 O4 U B 103 22.892 7.156 6.064 1.00 0.00 O ATOM 1738 C5 U B 103 22.687 4.806 5.760 1.00 0.00 C ATOM 1739 C6 U B 103 23.323 3.607 5.720 1.00 0.00 C ATOM 0 H5' U B 103 29.145 1.059 7.204 1.00 0.00 H new ATOM 0 H5'' U B 103 29.702 1.890 5.765 1.00 0.00 H new ATOM 0 H4' U B 103 27.644 0.485 5.678 1.00 0.00 H new ATOM 0 H3' U B 103 27.659 3.233 4.329 1.00 0.00 H new ATOM 0 H2' U B 103 25.425 2.682 3.573 1.00 0.00 H new ATOM 0 HO2' U B 103 24.638 0.748 3.356 1.00 0.00 H new ATOM 0 H1' U B 103 24.552 1.479 6.012 1.00 0.00 H new ATOM 0 H3 U B 103 25.266 6.713 6.499 1.00 0.00 H new ATOM 0 H5 U B 103 21.622 4.840 5.581 1.00 0.00 H new ATOM 0 H6 U B 103 22.755 2.709 5.524 1.00 0.00 H new ATOM 1750 P U B 104 28.035 2.025 1.889 1.00 0.00 P ATOM 1751 OP1 U B 104 29.302 1.657 1.219 1.00 0.00 O ATOM 1752 OP2 U B 104 27.543 3.417 1.833 1.00 0.00 O ATOM 1753 O5' U B 104 26.862 1.038 1.374 1.00 0.00 O ATOM 1754 C5' U B 104 27.156 -0.289 0.959 1.00 0.00 C ATOM 1755 C4' U B 104 25.916 -1.033 0.447 1.00 0.00 C ATOM 1756 O4' U B 104 25.034 -1.382 1.504 1.00 0.00 O ATOM 1757 C3' U B 104 25.054 -0.264 -0.556 1.00 0.00 C ATOM 1758 O3' U B 104 25.581 -0.234 -1.878 1.00 0.00 O ATOM 1759 C2' U B 104 23.772 -1.104 -0.501 1.00 0.00 C ATOM 1760 O2' U B 104 23.836 -2.214 -1.392 1.00 0.00 O ATOM 1761 C1' U B 104 23.748 -1.634 0.943 1.00 0.00 C ATOM 1762 N1 U B 104 22.682 -0.991 1.766 1.00 0.00 N ATOM 1763 C2 U B 104 21.600 -1.770 2.199 1.00 0.00 C ATOM 1764 O2 U B 104 21.477 -2.971 1.949 1.00 0.00 O ATOM 1765 N3 U B 104 20.621 -1.133 2.937 1.00 0.00 N ATOM 1766 C4 U B 104 20.615 0.198 3.283 1.00 0.00 C ATOM 1767 O4 U B 104 19.710 0.652 3.974 1.00 0.00 O ATOM 1768 C5 U B 104 21.739 0.952 2.774 1.00 0.00 C ATOM 1769 C6 U B 104 22.728 0.354 2.057 1.00 0.00 C ATOM 0 H5' U B 104 27.587 -0.840 1.795 1.00 0.00 H new ATOM 0 H5'' U B 104 27.910 -0.262 0.172 1.00 0.00 H new ATOM 0 H4' U B 104 26.356 -1.900 -0.047 1.00 0.00 H new ATOM 0 H3' U B 104 24.954 0.794 -0.312 1.00 0.00 H new ATOM 0 H2' U B 104 22.895 -0.520 -0.782 1.00 0.00 H new ATOM 0 HO2' U B 104 24.536 -2.057 -2.060 1.00 0.00 H new ATOM 0 H1' U B 104 23.520 -2.700 0.936 1.00 0.00 H new ATOM 0 H3 U B 104 19.834 -1.699 3.253 1.00 0.00 H new ATOM 0 H5 U B 104 21.794 2.013 2.967 1.00 0.00 H new ATOM 0 H6 U B 104 23.563 0.944 1.710 1.00 0.00 H new ATOM 1780 P U B 105 26.264 1.089 -2.501 1.00 0.00 P ATOM 1781 OP1 U B 105 27.241 0.655 -3.522 1.00 0.00 O ATOM 1782 OP2 U B 105 26.687 1.992 -1.410 1.00 0.00 O ATOM 1783 O5' U B 105 25.032 1.791 -3.271 1.00 0.00 O ATOM 1784 C5' U B 105 23.782 2.058 -2.649 1.00 0.00 C ATOM 1785 C4' U B 105 22.935 3.060 -3.456 1.00 0.00 C ATOM 1786 O4' U B 105 23.273 4.384 -3.061 1.00 0.00 O ATOM 1787 C3' U B 105 23.133 2.960 -4.982 1.00 0.00 C ATOM 1788 O3' U B 105 21.956 3.306 -5.703 1.00 0.00 O ATOM 1789 C2' U B 105 24.210 4.026 -5.223 1.00 0.00 C ATOM 1790 O2' U B 105 24.117 4.592 -6.525 1.00 0.00 O ATOM 1791 C1' U B 105 23.907 5.060 -4.139 1.00 0.00 C ATOM 1792 N1 U B 105 25.126 5.780 -3.679 1.00 0.00 N ATOM 1793 C2 U B 105 25.389 7.056 -4.197 1.00 0.00 C ATOM 1794 O2 U B 105 24.664 7.627 -5.014 1.00 0.00 O ATOM 1795 N3 U B 105 26.539 7.684 -3.763 1.00 0.00 N ATOM 1796 C4 U B 105 27.438 7.175 -2.856 1.00 0.00 C ATOM 1797 O4 U B 105 28.426 7.827 -2.536 1.00 0.00 O ATOM 1798 C5 U B 105 27.107 5.858 -2.359 1.00 0.00 C ATOM 1799 C6 U B 105 25.990 5.203 -2.773 1.00 0.00 C ATOM 0 H5' U B 105 23.953 2.453 -1.647 1.00 0.00 H new ATOM 0 H5'' U B 105 23.228 1.126 -2.534 1.00 0.00 H new ATOM 0 H4' U B 105 21.895 2.815 -3.242 1.00 0.00 H new ATOM 0 H3' U B 105 23.388 1.952 -5.310 1.00 0.00 H new ATOM 0 H2' U B 105 25.223 3.628 -5.172 1.00 0.00 H new ATOM 0 HO2' U B 105 23.218 4.439 -6.885 1.00 0.00 H new ATOM 0 H1' U B 105 23.251 5.827 -4.550 1.00 0.00 H new ATOM 0 H3 U B 105 26.739 8.607 -4.149 1.00 0.00 H new ATOM 0 H5 U B 105 27.762 5.384 -1.643 1.00 0.00 H new ATOM 0 H6 U B 105 25.777 4.217 -2.387 1.00 0.00 H new ATOM 1810 P C B 106 20.780 2.249 -5.993 1.00 0.00 P ATOM 1811 OP1 C B 106 19.689 2.969 -6.683 1.00 0.00 O ATOM 1812 OP2 C B 106 20.505 1.511 -4.741 1.00 0.00 O ATOM 1813 O5' C B 106 21.458 1.232 -7.051 1.00 0.00 O ATOM 1814 C5' C B 106 21.789 -0.108 -6.703 1.00 0.00 C ATOM 1815 C4' C B 106 22.238 -0.930 -7.918 1.00 0.00 C ATOM 1816 O4' C B 106 21.220 -1.029 -8.904 1.00 0.00 O ATOM 1817 C3' C B 106 23.439 -0.353 -8.657 1.00 0.00 C ATOM 1818 O3' C B 106 24.671 -0.605 -7.993 1.00 0.00 O ATOM 1819 C2' C B 106 23.340 -1.109 -9.993 1.00 0.00 C ATOM 1820 O2' C B 106 24.057 -2.338 -9.979 1.00 0.00 O ATOM 1821 C1' C B 106 21.843 -1.443 -10.114 1.00 0.00 C ATOM 1822 N1 C B 106 21.189 -0.853 -11.321 1.00 0.00 N ATOM 1823 C2 C B 106 21.219 0.533 -11.569 1.00 0.00 C ATOM 1824 O2 C B 106 21.742 1.337 -10.796 1.00 0.00 O ATOM 1825 N3 C B 106 20.670 1.042 -12.703 1.00 0.00 N ATOM 1826 C4 C B 106 20.117 0.215 -13.566 1.00 0.00 C ATOM 1827 N4 C B 106 19.611 0.764 -14.635 1.00 0.00 N ATOM 1828 C5 C B 106 20.055 -1.191 -13.377 1.00 0.00 C ATOM 1829 C6 C B 106 20.603 -1.691 -12.241 1.00 0.00 C ATOM 0 H5' C B 106 20.924 -0.586 -6.243 1.00 0.00 H new ATOM 0 H5'' C B 106 22.584 -0.102 -5.957 1.00 0.00 H new ATOM 0 H4' C B 106 22.490 -1.894 -7.476 1.00 0.00 H new ATOM 0 H3' C B 106 23.425 0.733 -8.744 1.00 0.00 H new ATOM 0 H2' C B 106 23.751 -0.510 -10.806 1.00 0.00 H new ATOM 0 HO2' C B 106 24.643 -2.366 -9.194 1.00 0.00 H new ATOM 0 H1' C B 106 21.727 -2.517 -10.258 1.00 0.00 H new ATOM 0 H41 C B 106 19.167 0.182 -15.346 1.00 0.00 H new ATOM 0 H42 C B 106 19.659 1.775 -14.761 1.00 0.00 H new ATOM 0 H5 C B 106 19.590 -1.836 -14.108 1.00 0.00 H new ATOM 0 H6 C B 106 20.579 -2.755 -12.058 1.00 0.00 H new ATOM 1841 P C B 107 25.826 0.512 -7.912 1.00 0.00 P ATOM 1842 OP1 C B 107 26.980 -0.094 -7.214 1.00 0.00 O ATOM 1843 OP2 C B 107 25.227 1.761 -7.399 1.00 0.00 O ATOM 1844 O5' C B 107 26.252 0.723 -9.458 1.00 0.00 O ATOM 1845 C5' C B 107 25.644 1.708 -10.289 1.00 0.00 C ATOM 1846 C4' C B 107 26.265 1.718 -11.691 1.00 0.00 C ATOM 1847 O4' C B 107 27.595 2.217 -11.653 1.00 0.00 O ATOM 1848 C3' C B 107 26.353 0.342 -12.352 1.00 0.00 C ATOM 1849 O3' C B 107 25.109 -0.129 -12.854 1.00 0.00 O ATOM 1850 C2' C B 107 27.416 0.621 -13.423 1.00 0.00 C ATOM 1851 O2' C B 107 26.891 1.234 -14.595 1.00 0.00 O ATOM 1852 C1' C B 107 28.325 1.648 -12.735 1.00 0.00 C ATOM 1853 N1 C B 107 29.584 1.013 -12.249 1.00 0.00 N ATOM 1854 C2 C B 107 30.764 1.200 -12.987 1.00 0.00 C ATOM 1855 O2 C B 107 30.813 1.968 -13.949 1.00 0.00 O ATOM 1856 N3 C B 107 31.896 0.523 -12.661 1.00 0.00 N ATOM 1857 C4 C B 107 31.873 -0.279 -11.616 1.00 0.00 C ATOM 1858 N4 C B 107 32.991 -0.895 -11.349 1.00 0.00 N ATOM 1859 C5 C B 107 30.720 -0.490 -10.813 1.00 0.00 C ATOM 1860 C6 C B 107 29.588 0.173 -11.160 1.00 0.00 C ATOM 0 H5' C B 107 25.757 2.691 -9.832 1.00 0.00 H new ATOM 0 H5'' C B 107 24.574 1.512 -10.365 1.00 0.00 H new ATOM 0 H4' C B 107 25.594 2.351 -12.271 1.00 0.00 H new ATOM 0 H3' C B 107 26.614 -0.475 -11.679 1.00 0.00 H new ATOM 0 H2' C B 107 27.889 -0.305 -13.749 1.00 0.00 H new ATOM 0 HO2' C B 107 26.783 0.559 -15.297 1.00 0.00 H new ATOM 0 H1' C B 107 28.616 2.422 -13.445 1.00 0.00 H new ATOM 0 H41 C B 107 33.045 -1.532 -10.554 1.00 0.00 H new ATOM 0 H42 C B 107 33.811 -0.740 -11.935 1.00 0.00 H new ATOM 0 H5 C B 107 30.744 -1.152 -9.960 1.00 0.00 H new ATOM 0 H6 C B 107 28.687 0.041 -10.579 1.00 0.00 H new ATOM 1872 P C B 108 24.954 -1.621 -13.437 1.00 0.00 P ATOM 1873 OP1 C B 108 23.536 -2.022 -13.308 1.00 0.00 O ATOM 1874 OP2 C B 108 26.025 -2.472 -12.874 1.00 0.00 O ATOM 1875 O5' C B 108 25.277 -1.406 -14.999 1.00 0.00 O ATOM 1876 C5' C B 108 24.385 -0.698 -15.848 1.00 0.00 C ATOM 1877 C4' C B 108 24.902 -0.670 -17.293 1.00 0.00 C ATOM 1878 O4' C B 108 26.209 -0.102 -17.333 1.00 0.00 O ATOM 1879 C3' C B 108 24.975 -2.067 -17.932 1.00 0.00 C ATOM 1880 O3' C B 108 24.607 -1.976 -19.303 1.00 0.00 O ATOM 1881 C2' C B 108 26.457 -2.418 -17.764 1.00 0.00 C ATOM 1882 O2' C B 108 26.965 -3.353 -18.711 1.00 0.00 O ATOM 1883 C1' C B 108 27.100 -1.038 -17.924 1.00 0.00 C ATOM 1884 N1 C B 108 28.463 -0.920 -17.327 1.00 0.00 N ATOM 1885 C2 C B 108 29.498 -0.373 -18.101 1.00 0.00 C ATOM 1886 O2 C B 108 29.319 -0.004 -19.265 1.00 0.00 O ATOM 1887 N3 C B 108 30.746 -0.230 -17.585 1.00 0.00 N ATOM 1888 C4 C B 108 30.963 -0.612 -16.342 1.00 0.00 C ATOM 1889 N4 C B 108 32.174 -0.424 -15.894 1.00 0.00 N ATOM 1890 C5 C B 108 29.966 -1.196 -15.514 1.00 0.00 C ATOM 1891 C6 C B 108 28.724 -1.337 -16.042 1.00 0.00 C ATOM 0 H5' C B 108 24.263 0.322 -15.483 1.00 0.00 H new ATOM 0 H5'' C B 108 23.402 -1.167 -15.819 1.00 0.00 H new ATOM 0 H4' C B 108 24.189 -0.070 -17.859 1.00 0.00 H new ATOM 0 H3' C B 108 24.312 -2.812 -17.492 1.00 0.00 H new ATOM 0 H2' C B 108 26.661 -2.926 -16.822 1.00 0.00 H new ATOM 0 HO2' C B 108 26.411 -4.161 -18.702 1.00 0.00 H new ATOM 0 H1' C B 108 27.255 -0.849 -18.986 1.00 0.00 H new ATOM 0 H41 C B 108 32.413 -0.696 -14.940 1.00 0.00 H new ATOM 0 H42 C B 108 32.882 -0.005 -16.497 1.00 0.00 H new ATOM 0 H5 C B 108 30.188 -1.514 -14.506 1.00 0.00 H new ATOM 0 H6 C B 108 27.936 -1.779 -15.450 1.00 0.00 H new ATOM 1903 P C B 109 23.129 -2.386 -19.781 1.00 0.00 P ATOM 1904 OP1 C B 109 22.988 -2.072 -21.222 1.00 0.00 O ATOM 1905 OP2 C B 109 22.155 -1.864 -18.797 1.00 0.00 O ATOM 1906 O5' C B 109 23.242 -3.984 -19.598 1.00 0.00 O ATOM 1907 C5' C B 109 24.022 -4.772 -20.489 1.00 0.00 C ATOM 1908 C4' C B 109 24.419 -6.104 -19.844 1.00 0.00 C ATOM 1909 O4' C B 109 25.267 -5.884 -18.721 1.00 0.00 O ATOM 1910 C3' C B 109 23.236 -6.941 -19.346 1.00 0.00 C ATOM 1911 O3' C B 109 22.587 -7.691 -20.373 1.00 0.00 O ATOM 1912 C2' C B 109 23.932 -7.832 -18.306 1.00 0.00 C ATOM 1913 O2' C B 109 24.529 -8.991 -18.887 1.00 0.00 O ATOM 1914 C1' C B 109 25.059 -6.930 -17.777 1.00 0.00 C ATOM 1915 N1 C B 109 24.735 -6.356 -16.438 1.00 0.00 N ATOM 1916 C2 C B 109 25.375 -6.878 -15.302 1.00 0.00 C ATOM 1917 O2 C B 109 26.224 -7.768 -15.384 1.00 0.00 O ATOM 1918 N3 C B 109 25.068 -6.413 -14.064 1.00 0.00 N ATOM 1919 C4 C B 109 24.163 -5.464 -13.951 1.00 0.00 C ATOM 1920 N4 C B 109 23.913 -5.061 -12.737 1.00 0.00 N ATOM 1921 C5 C B 109 23.483 -4.892 -15.060 1.00 0.00 C ATOM 1922 C6 C B 109 23.791 -5.367 -16.293 1.00 0.00 C ATOM 0 H5' C B 109 24.918 -4.222 -20.776 1.00 0.00 H new ATOM 0 H5'' C B 109 23.457 -4.961 -21.402 1.00 0.00 H new ATOM 0 H4' C B 109 24.920 -6.653 -20.641 1.00 0.00 H new ATOM 0 H3' C B 109 22.413 -6.344 -18.954 1.00 0.00 H new ATOM 0 H2' C B 109 23.226 -8.191 -17.557 1.00 0.00 H new ATOM 0 HO2' C B 109 24.060 -9.220 -19.716 1.00 0.00 H new ATOM 0 HO3' C B 109 21.845 -8.201 -19.986 1.00 0.00 H new ATOM 0 H1' C B 109 25.962 -7.528 -17.654 1.00 0.00 H new ATOM 0 H41 C B 109 23.223 -4.328 -12.575 1.00 0.00 H new ATOM 0 H42 C B 109 24.408 -5.479 -11.949 1.00 0.00 H new ATOM 0 H5 C B 109 22.750 -4.110 -14.927 1.00 0.00 H new ATOM 0 H6 C B 109 23.293 -4.967 -17.164 1.00 0.00 H new TER 1934 C B 109 HETATM 1935 ZN ZN A 101 0.460 4.278 19.667 1.00 0.00 ZN HETATM 1936 ZN ZN A 102 18.478 -5.797 19.328 1.00 0.00 ZN