USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 880 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 7 ASN : amide:sc= -1.77 K(o=-0.27,f=-6.9!) USER MOD Set 1.2: B 5 U O2' : rot -32:sc= 1.5 USER MOD Set 2.1: A 59 ASN : amide:sc= 0.388 K(o=-0.99,f=-13!) USER MOD Set 2.2: A 62 ASN : amide:sc= -1.38 K(o=-0.99,f=-5!) USER MOD Set 3.1: A 50 LYS NZ :NH3+ -124:sc= -0.13 (180deg=-0.408) USER MOD Set 3.2: B 1 A O2' : rot 32:sc= 0.281 USER MOD Set 4.1: A 24 ASN : amide:sc= -0.154 K(o=0.59,f=-4.6!) USER MOD Set 4.2: A 78 GLN : amide:sc= 0.747 K(o=0.59,f=-3.5!) USER MOD Set 5.1: A 6 THR OG1 : rot 88:sc= 1.21 USER MOD Set 5.2: A 47 SER OG : rot 101:sc= 0.899 USER MOD Set 5.3: A 49 HIS : no HE2:sc= -2.51 K(o=-0.41,f=-1.1!) USER MOD Single : A 3 SER OG : rot 90:sc=0.000179 USER MOD Single : A 4 ASN : amide:sc= -0.481 K(o=-0.48,f=-1.8) USER MOD Single : A 8 LYS NZ :NH3+ -158:sc= -0.0614 (180deg=-0.443) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0.393 USER MOD Single : A 14 MET CE :methyl 176:sc= -0.344 (180deg=-0.455) USER MOD Single : A 15 ASN : amide:sc= 0.86 K(o=0.86,f=-1.2) USER MOD Single : A 16 SER OG : rot 79:sc= 1.23 USER MOD Single : A 22 ASN : amide:sc= 0.704 K(o=0.7,f=-0.099) USER MOD Single : A 25 THR OG1 : rot -69:sc= 0.488 USER MOD Single : A 29 LYS NZ :NH3+ -168:sc= 1.02 (180deg=0.873) USER MOD Single : A 30 LYS NZ :NH3+ -164:sc= 1.18 (180deg=0.823) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -34:sc= 0.284 USER MOD Single : A 39 LYS NZ :NH3+ -177:sc= 2.3 (180deg=2.17) USER MOD Single : A 40 TYR OH : rot -120:sc= 0.00494 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 CYS SG : rot 25:sc= -0.158 USER MOD Single : A 56 GLN : amide:sc= 0.322 K(o=0.32,f=-3.3!) USER MOD Single : A 57 TYR OH : rot -9:sc= 0.658 USER MOD Single : A 74 MET CE :methyl -132:sc= -0.054 (180deg=-0.883) USER MOD Single : A 83 ASN : amide:sc= 1.54 K(o=1.5,f=-0.12) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.828 K(o=-0.83,f=-0.0097) USER MOD Single : A 94 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0786) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl 153:sc= -0.0756 (180deg=-0.673) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 A O5' : rot -76:sc= 0.544 USER MOD Single : B 2 U O2' : rot 28:sc= 0.127 USER MOD Single : B 3 U O2' : rot -29:sc= 0.889 USER MOD Single : B 4 U O2' : rot 19:sc= 0.143 USER MOD Single : B 6 U O2' : rot 153:sc= 1 USER MOD Single : B 7 C O2' : rot 178:sc= 0 USER MOD Single : B 7 C O3' : rot 137:sc= 0.132 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 0.945 12.785 -6.123 1.00 0.00 N ATOM 2 CA ALA A 2 0.048 12.922 -4.961 1.00 0.00 C ATOM 3 C ALA A 2 0.836 13.347 -3.720 1.00 0.00 C ATOM 4 O ALA A 2 2.058 13.207 -3.685 1.00 0.00 O ATOM 5 CB ALA A 2 -0.743 11.628 -4.735 1.00 0.00 C ATOM 0 HA ALA A 2 -0.678 13.709 -5.164 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -1.399 11.749 -3.873 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.342 11.408 -5.619 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -0.051 10.806 -4.552 1.00 0.00 H new ATOM 12 N SER A 3 0.140 13.868 -2.700 1.00 0.00 N ATOM 13 CA SER A 3 0.773 14.509 -1.549 1.00 0.00 C ATOM 14 C SER A 3 1.181 13.568 -0.415 1.00 0.00 C ATOM 15 O SER A 3 1.574 14.041 0.650 1.00 0.00 O ATOM 16 CB SER A 3 -0.123 15.636 -1.036 1.00 0.00 C ATOM 17 OG SER A 3 -0.361 16.569 -2.073 1.00 0.00 O ATOM 0 H SER A 3 -0.879 13.855 -2.654 1.00 0.00 H new ATOM 0 HA SER A 3 1.720 14.907 -1.914 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.068 15.227 -0.678 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.351 16.133 -0.189 1.00 0.00 H new ATOM 0 HG SER A 3 -1.167 16.310 -2.567 1.00 0.00 H new ATOM 23 N ASN A 4 1.094 12.247 -0.618 1.00 0.00 N ATOM 24 CA ASN A 4 1.554 11.264 0.362 1.00 0.00 C ATOM 25 C ASN A 4 0.931 11.484 1.743 1.00 0.00 C ATOM 26 O ASN A 4 1.567 11.225 2.761 1.00 0.00 O ATOM 27 CB ASN A 4 3.090 11.262 0.380 1.00 0.00 C ATOM 28 CG ASN A 4 3.682 10.083 1.147 1.00 0.00 C ATOM 29 OD1 ASN A 4 3.014 9.088 1.409 1.00 0.00 O ATOM 30 ND2 ASN A 4 4.955 10.192 1.512 1.00 0.00 N ATOM 0 H ASN A 4 0.703 11.834 -1.465 1.00 0.00 H new ATOM 0 HA ASN A 4 1.215 10.272 0.065 1.00 0.00 H new ATOM 0 HB2 ASN A 4 3.459 11.242 -0.646 1.00 0.00 H new ATOM 0 HB3 ASN A 4 3.443 12.191 0.827 1.00 0.00 H new ATOM 0 HD21 ASN A 4 5.405 9.434 2.026 1.00 0.00 H new ATOM 0 HD22 ASN A 4 5.482 11.033 1.278 1.00 0.00 H new ATOM 37 N VAL A 5 -0.318 11.967 1.786 1.00 0.00 N ATOM 38 CA VAL A 5 -0.988 12.275 3.039 1.00 0.00 C ATOM 39 C VAL A 5 -2.484 11.982 2.934 1.00 0.00 C ATOM 40 O VAL A 5 -3.117 12.299 1.925 1.00 0.00 O ATOM 41 CB VAL A 5 -0.680 13.731 3.407 1.00 0.00 C ATOM 42 CG1 VAL A 5 -1.381 14.701 2.460 1.00 0.00 C ATOM 43 CG2 VAL A 5 -1.057 14.026 4.853 1.00 0.00 C ATOM 0 H VAL A 5 -0.881 12.151 0.956 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.618 11.639 3.843 1.00 0.00 H new ATOM 0 HB VAL A 5 0.395 13.874 3.302 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -1.143 15.725 2.747 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -1.042 14.522 1.440 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -2.459 14.549 2.516 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -0.827 15.066 5.084 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.123 13.850 4.994 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -0.491 13.373 5.517 1.00 0.00 H new ATOM 53 N THR A 6 -3.049 11.369 3.977 1.00 0.00 N ATOM 54 CA THR A 6 -4.427 10.888 3.984 1.00 0.00 C ATOM 55 C THR A 6 -5.032 10.895 5.392 1.00 0.00 C ATOM 56 O THR A 6 -6.094 10.309 5.589 1.00 0.00 O ATOM 57 CB THR A 6 -4.468 9.461 3.416 1.00 0.00 C ATOM 58 OG1 THR A 6 -3.711 8.598 4.233 1.00 0.00 O ATOM 59 CG2 THR A 6 -3.858 9.356 2.019 1.00 0.00 C ATOM 0 H THR A 6 -2.553 11.192 4.851 1.00 0.00 H new ATOM 0 HA THR A 6 -5.020 11.563 3.366 1.00 0.00 H new ATOM 0 HB THR A 6 -5.523 9.190 3.377 1.00 0.00 H new ATOM 0 HG1 THR A 6 -4.279 8.243 4.948 1.00 0.00 H new ATOM 0 HG21 THR A 6 -3.917 8.324 1.673 1.00 0.00 H new ATOM 0 HG22 THR A 6 -4.407 10.001 1.333 1.00 0.00 H new ATOM 0 HG23 THR A 6 -2.814 9.668 2.053 1.00 0.00 H new ATOM 67 N ASN A 7 -4.387 11.539 6.374 1.00 0.00 N ATOM 68 CA ASN A 7 -4.838 11.494 7.767 1.00 0.00 C ATOM 69 C ASN A 7 -5.361 12.825 8.319 1.00 0.00 C ATOM 70 O ASN A 7 -5.496 12.965 9.536 1.00 0.00 O ATOM 71 CB ASN A 7 -3.758 10.869 8.658 1.00 0.00 C ATOM 72 CG ASN A 7 -2.614 11.814 9.024 1.00 0.00 C ATOM 73 OD1 ASN A 7 -2.629 12.999 8.700 1.00 0.00 O ATOM 74 ND2 ASN A 7 -1.607 11.282 9.704 1.00 0.00 N ATOM 0 H ASN A 7 -3.548 12.099 6.226 1.00 0.00 H new ATOM 0 HA ASN A 7 -5.717 10.850 7.780 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -4.224 10.511 9.576 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -3.345 9.998 8.150 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -0.812 11.861 9.974 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -1.628 10.294 9.956 1.00 0.00 H new ATOM 81 N LYS A 8 -5.656 13.806 7.457 1.00 0.00 N ATOM 82 CA LYS A 8 -6.249 15.074 7.886 1.00 0.00 C ATOM 83 C LYS A 8 -7.618 14.814 8.517 1.00 0.00 C ATOM 84 O LYS A 8 -8.121 13.693 8.463 1.00 0.00 O ATOM 85 CB LYS A 8 -6.377 16.025 6.688 1.00 0.00 C ATOM 86 CG LYS A 8 -5.116 16.848 6.401 1.00 0.00 C ATOM 87 CD LYS A 8 -3.873 16.005 6.090 1.00 0.00 C ATOM 88 CE LYS A 8 -3.126 15.579 7.356 1.00 0.00 C ATOM 89 NZ LYS A 8 -2.539 16.735 8.059 1.00 0.00 N ATOM 0 H LYS A 8 -5.491 13.743 6.452 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.604 15.542 8.630 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.627 15.442 5.801 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -7.209 16.706 6.867 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -5.312 17.511 5.558 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -4.905 17.482 7.262 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -4.170 15.118 5.530 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -3.201 16.576 5.449 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -3.811 15.056 8.024 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -2.337 14.874 7.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -1.759 16.412 8.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -2.177 17.417 7.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -3.267 17.192 8.645 1.00 0.00 H new ATOM 103 N THR A 9 -8.233 15.832 9.116 1.00 0.00 N ATOM 104 CA THR A 9 -9.521 15.666 9.788 1.00 0.00 C ATOM 105 C THR A 9 -10.506 16.767 9.408 1.00 0.00 C ATOM 106 O THR A 9 -11.376 17.126 10.200 1.00 0.00 O ATOM 107 CB THR A 9 -9.334 15.559 11.305 1.00 0.00 C ATOM 108 OG1 THR A 9 -8.676 16.702 11.804 1.00 0.00 O ATOM 109 CG2 THR A 9 -8.517 14.320 11.662 1.00 0.00 C ATOM 0 H THR A 9 -7.860 16.781 9.150 1.00 0.00 H new ATOM 0 HA THR A 9 -9.958 14.729 9.444 1.00 0.00 H new ATOM 0 HB THR A 9 -10.323 15.482 11.757 1.00 0.00 H new ATOM 0 HG1 THR A 9 -8.566 16.619 12.774 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.396 14.263 12.744 1.00 0.00 H new ATOM 0 HG22 THR A 9 -9.034 13.428 11.307 1.00 0.00 H new ATOM 0 HG23 THR A 9 -7.536 14.382 11.190 1.00 0.00 H new ATOM 117 N ASP A 10 -10.374 17.310 8.194 1.00 0.00 N ATOM 118 CA ASP A 10 -11.273 18.340 7.703 1.00 0.00 C ATOM 119 C ASP A 10 -12.661 17.750 7.445 1.00 0.00 C ATOM 120 O ASP A 10 -12.787 16.551 7.193 1.00 0.00 O ATOM 121 CB ASP A 10 -10.691 18.950 6.429 1.00 0.00 C ATOM 122 CG ASP A 10 -9.387 19.689 6.713 1.00 0.00 C ATOM 123 OD1 ASP A 10 -9.470 20.844 7.188 1.00 0.00 O ATOM 124 OD2 ASP A 10 -8.315 19.098 6.454 1.00 0.00 O ATOM 0 H ASP A 10 -9.643 17.045 7.533 1.00 0.00 H new ATOM 0 HA ASP A 10 -11.378 19.124 8.453 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -10.513 18.164 5.695 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -11.413 19.638 5.990 1.00 0.00 H new ATOM 129 N PRO A 11 -13.712 18.579 7.507 1.00 0.00 N ATOM 130 CA PRO A 11 -15.100 18.152 7.397 1.00 0.00 C ATOM 131 C PRO A 11 -15.438 17.589 6.016 1.00 0.00 C ATOM 132 O PRO A 11 -16.529 17.051 5.829 1.00 0.00 O ATOM 133 CB PRO A 11 -15.931 19.397 7.706 1.00 0.00 C ATOM 134 CG PRO A 11 -15.007 20.548 7.315 1.00 0.00 C ATOM 135 CD PRO A 11 -13.633 20.016 7.711 1.00 0.00 C ATOM 0 HA PRO A 11 -15.308 17.335 8.088 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -16.858 19.414 7.132 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -16.207 19.444 8.759 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -15.064 20.771 6.250 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -15.255 21.467 7.847 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -12.847 20.459 7.099 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -13.402 20.255 8.749 1.00 0.00 H new ATOM 143 N ARG A 12 -14.522 17.704 5.049 1.00 0.00 N ATOM 144 CA ARG A 12 -14.715 17.140 3.718 1.00 0.00 C ATOM 145 C ARG A 12 -13.653 16.098 3.398 1.00 0.00 C ATOM 146 O ARG A 12 -13.907 15.190 2.615 1.00 0.00 O ATOM 147 CB ARG A 12 -14.767 18.274 2.684 1.00 0.00 C ATOM 148 CG ARG A 12 -13.411 18.960 2.482 1.00 0.00 C ATOM 149 CD ARG A 12 -12.581 18.262 1.397 1.00 0.00 C ATOM 150 NE ARG A 12 -11.216 18.797 1.361 1.00 0.00 N ATOM 151 CZ ARG A 12 -10.833 19.851 0.636 1.00 0.00 C ATOM 152 NH1 ARG A 12 -11.698 20.508 -0.131 1.00 0.00 N ATOM 153 NH2 ARG A 12 -9.565 20.249 0.678 1.00 0.00 N ATOM 0 H ARG A 12 -13.633 18.188 5.170 1.00 0.00 H new ATOM 0 HA ARG A 12 -15.668 16.613 3.683 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -15.112 17.874 1.730 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -15.500 19.016 3.002 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -13.568 20.003 2.206 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -12.858 18.958 3.421 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -12.551 17.190 1.589 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -13.056 18.399 0.425 1.00 0.00 H new ATOM 0 HE ARG A 12 -10.509 18.331 1.930 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -12.672 20.209 -0.172 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -11.387 21.311 -0.678 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -8.893 19.750 1.261 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -9.264 21.053 0.127 1.00 0.00 H new ATOM 167 N SER A 13 -12.458 16.212 3.988 1.00 0.00 N ATOM 168 CA SER A 13 -11.382 15.274 3.703 1.00 0.00 C ATOM 169 C SER A 13 -11.621 13.946 4.416 1.00 0.00 C ATOM 170 O SER A 13 -11.093 12.916 3.998 1.00 0.00 O ATOM 171 CB SER A 13 -10.045 15.887 4.113 1.00 0.00 C ATOM 172 OG SER A 13 -9.859 17.112 3.433 1.00 0.00 O ATOM 0 H SER A 13 -12.219 16.941 4.660 1.00 0.00 H new ATOM 0 HA SER A 13 -11.359 15.072 2.632 1.00 0.00 H new ATOM 0 HB2 SER A 13 -10.023 16.050 5.190 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.231 15.201 3.878 1.00 0.00 H new ATOM 0 HG SER A 13 -9.002 17.506 3.698 1.00 0.00 H new ATOM 178 N MET A 14 -12.416 13.967 5.490 1.00 0.00 N ATOM 179 CA MET A 14 -12.815 12.765 6.213 1.00 0.00 C ATOM 180 C MET A 14 -13.768 11.918 5.374 1.00 0.00 C ATOM 181 O MET A 14 -13.982 10.747 5.682 1.00 0.00 O ATOM 182 CB MET A 14 -13.498 13.175 7.522 1.00 0.00 C ATOM 183 CG MET A 14 -12.457 13.517 8.589 1.00 0.00 C ATOM 184 SD MET A 14 -12.214 12.232 9.849 1.00 0.00 S ATOM 185 CE MET A 14 -11.942 10.771 8.812 1.00 0.00 C ATOM 0 H MET A 14 -12.801 14.827 5.881 1.00 0.00 H new ATOM 0 HA MET A 14 -11.929 12.168 6.426 1.00 0.00 H new ATOM 0 HB2 MET A 14 -14.144 14.036 7.347 1.00 0.00 H new ATOM 0 HB3 MET A 14 -14.136 12.365 7.875 1.00 0.00 H new ATOM 0 HG2 MET A 14 -11.503 13.711 8.098 1.00 0.00 H new ATOM 0 HG3 MET A 14 -12.754 14.441 9.084 1.00 0.00 H new ATOM 0 HE1 MET A 14 -11.707 9.915 9.444 1.00 0.00 H new ATOM 0 HE2 MET A 14 -12.843 10.561 8.236 1.00 0.00 H new ATOM 0 HE3 MET A 14 -11.111 10.958 8.131 1.00 0.00 H new ATOM 195 N ASN A 15 -14.338 12.503 4.318 1.00 0.00 N ATOM 196 CA ASN A 15 -15.251 11.805 3.428 1.00 0.00 C ATOM 197 C ASN A 15 -14.789 11.879 1.970 1.00 0.00 C ATOM 198 O ASN A 15 -15.533 11.494 1.071 1.00 0.00 O ATOM 199 CB ASN A 15 -16.685 12.309 3.625 1.00 0.00 C ATOM 200 CG ASN A 15 -16.765 13.823 3.707 1.00 0.00 C ATOM 201 OD1 ASN A 15 -16.942 14.508 2.705 1.00 0.00 O ATOM 202 ND2 ASN A 15 -16.635 14.353 4.919 1.00 0.00 N ATOM 0 H ASN A 15 -14.175 13.476 4.061 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.244 10.747 3.689 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -17.306 11.960 2.800 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -17.096 11.877 4.537 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -16.681 15.365 5.041 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -16.489 13.748 5.727 1.00 0.00 H new ATOM 209 N SER A 16 -13.569 12.367 1.729 1.00 0.00 N ATOM 210 CA SER A 16 -12.977 12.400 0.399 1.00 0.00 C ATOM 211 C SER A 16 -11.813 11.416 0.297 1.00 0.00 C ATOM 212 O SER A 16 -11.084 11.422 -0.693 1.00 0.00 O ATOM 213 CB SER A 16 -12.534 13.814 0.031 1.00 0.00 C ATOM 214 OG SER A 16 -13.640 14.687 0.033 1.00 0.00 O ATOM 0 H SER A 16 -12.966 12.750 2.457 1.00 0.00 H new ATOM 0 HA SER A 16 -13.740 12.094 -0.317 1.00 0.00 H new ATOM 0 HB2 SER A 16 -11.784 14.164 0.740 1.00 0.00 H new ATOM 0 HB3 SER A 16 -12.065 13.811 -0.953 1.00 0.00 H new ATOM 0 HG SER A 16 -13.856 14.939 0.955 1.00 0.00 H new ATOM 220 N ARG A 17 -11.626 10.568 1.314 1.00 0.00 N ATOM 221 CA ARG A 17 -10.576 9.554 1.311 1.00 0.00 C ATOM 222 C ARG A 17 -11.174 8.154 1.394 1.00 0.00 C ATOM 223 O ARG A 17 -12.378 7.996 1.584 1.00 0.00 O ATOM 224 CB ARG A 17 -9.572 9.832 2.429 1.00 0.00 C ATOM 225 CG ARG A 17 -10.150 9.496 3.796 1.00 0.00 C ATOM 226 CD ARG A 17 -9.101 9.755 4.863 1.00 0.00 C ATOM 227 NE ARG A 17 -8.699 11.164 4.832 1.00 0.00 N ATOM 228 CZ ARG A 17 -8.555 11.934 5.906 1.00 0.00 C ATOM 229 NH1 ARG A 17 -8.735 11.450 7.131 1.00 0.00 N ATOM 230 NH2 ARG A 17 -8.224 13.208 5.741 1.00 0.00 N ATOM 0 H ARG A 17 -12.198 10.568 2.158 1.00 0.00 H new ATOM 0 HA ARG A 17 -10.032 9.604 0.368 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -8.668 9.246 2.261 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -9.280 10.882 2.404 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -11.036 10.101 3.987 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -10.464 8.453 3.824 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -9.499 9.502 5.846 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -8.234 9.116 4.696 1.00 0.00 H new ATOM 0 HE ARG A 17 -8.517 11.584 3.921 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -8.989 10.471 7.260 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -8.619 12.058 7.942 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -8.085 13.581 4.802 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -8.109 13.814 6.553 1.00 0.00 H new ATOM 244 N VAL A 18 -10.319 7.144 1.252 1.00 0.00 N ATOM 245 CA VAL A 18 -10.714 5.749 1.205 1.00 0.00 C ATOM 246 C VAL A 18 -9.931 4.949 2.240 1.00 0.00 C ATOM 247 O VAL A 18 -8.708 5.062 2.306 1.00 0.00 O ATOM 248 CB VAL A 18 -10.417 5.197 -0.195 1.00 0.00 C ATOM 249 CG1 VAL A 18 -10.947 3.773 -0.332 1.00 0.00 C ATOM 250 CG2 VAL A 18 -11.039 6.057 -1.293 1.00 0.00 C ATOM 0 H VAL A 18 -9.312 7.281 1.165 1.00 0.00 H new ATOM 0 HA VAL A 18 -11.779 5.665 1.424 1.00 0.00 H new ATOM 0 HB VAL A 18 -9.334 5.209 -0.314 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -10.727 3.398 -1.331 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -10.468 3.134 0.409 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -12.025 3.769 -0.172 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -10.803 5.629 -2.268 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -12.121 6.088 -1.162 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -10.637 7.069 -1.234 1.00 0.00 H new ATOM 260 N PHE A 19 -10.631 4.142 3.039 1.00 0.00 N ATOM 261 CA PHE A 19 -9.997 3.184 3.925 1.00 0.00 C ATOM 262 C PHE A 19 -9.914 1.854 3.182 1.00 0.00 C ATOM 263 O PHE A 19 -10.878 1.461 2.526 1.00 0.00 O ATOM 264 CB PHE A 19 -10.810 3.062 5.213 1.00 0.00 C ATOM 265 CG PHE A 19 -10.323 1.979 6.152 1.00 0.00 C ATOM 266 CD1 PHE A 19 -8.954 1.818 6.410 1.00 0.00 C ATOM 267 CD2 PHE A 19 -11.251 1.130 6.769 1.00 0.00 C ATOM 268 CE1 PHE A 19 -8.517 0.803 7.274 1.00 0.00 C ATOM 269 CE2 PHE A 19 -10.814 0.116 7.631 1.00 0.00 C ATOM 270 CZ PHE A 19 -9.445 -0.051 7.884 1.00 0.00 C ATOM 0 H PHE A 19 -11.650 4.139 3.085 1.00 0.00 H new ATOM 0 HA PHE A 19 -8.993 3.504 4.205 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.788 4.018 5.736 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -11.850 2.864 4.956 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -8.236 2.476 5.943 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -12.307 1.258 6.579 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -7.462 0.680 7.470 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -11.533 -0.538 8.102 1.00 0.00 H new ATOM 0 HZ PHE A 19 -9.107 -0.835 8.546 1.00 0.00 H new ATOM 280 N ILE A 20 -8.778 1.154 3.274 1.00 0.00 N ATOM 281 CA ILE A 20 -8.570 -0.107 2.573 1.00 0.00 C ATOM 282 C ILE A 20 -8.019 -1.128 3.558 1.00 0.00 C ATOM 283 O ILE A 20 -6.808 -1.251 3.718 1.00 0.00 O ATOM 284 CB ILE A 20 -7.603 0.096 1.401 1.00 0.00 C ATOM 285 CG1 ILE A 20 -8.089 1.217 0.475 1.00 0.00 C ATOM 286 CG2 ILE A 20 -7.465 -1.215 0.623 1.00 0.00 C ATOM 287 CD1 ILE A 20 -7.000 1.620 -0.519 1.00 0.00 C ATOM 0 H ILE A 20 -7.981 1.450 3.837 1.00 0.00 H new ATOM 0 HA ILE A 20 -9.515 -0.470 2.169 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.630 0.388 1.796 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -8.976 0.887 -0.066 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -8.382 2.083 1.069 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -6.778 -1.073 -0.211 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -7.078 -1.991 1.284 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -8.441 -1.516 0.242 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -7.372 2.417 -1.163 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -6.124 1.972 0.025 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -6.727 0.759 -1.128 1.00 0.00 H new ATOM 299 N GLY A 21 -8.910 -1.863 4.221 1.00 0.00 N ATOM 300 CA GLY A 21 -8.532 -2.837 5.235 1.00 0.00 C ATOM 301 C GLY A 21 -8.358 -4.243 4.675 1.00 0.00 C ATOM 302 O GLY A 21 -8.725 -4.520 3.534 1.00 0.00 O ATOM 0 H GLY A 21 -9.916 -1.797 4.067 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -7.600 -2.521 5.705 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -9.293 -2.854 6.016 1.00 0.00 H new ATOM 306 N ASN A 22 -7.792 -5.136 5.496 1.00 0.00 N ATOM 307 CA ASN A 22 -7.593 -6.547 5.186 1.00 0.00 C ATOM 308 C ASN A 22 -6.766 -6.754 3.911 1.00 0.00 C ATOM 309 O ASN A 22 -6.779 -7.832 3.320 1.00 0.00 O ATOM 310 CB ASN A 22 -8.948 -7.266 5.162 1.00 0.00 C ATOM 311 CG ASN A 22 -8.809 -8.771 5.355 1.00 0.00 C ATOM 312 OD1 ASN A 22 -8.736 -9.247 6.485 1.00 0.00 O ATOM 313 ND2 ASN A 22 -8.772 -9.528 4.265 1.00 0.00 N ATOM 0 H ASN A 22 -7.451 -4.883 6.423 1.00 0.00 H new ATOM 0 HA ASN A 22 -6.994 -7.000 5.976 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -9.586 -6.859 5.946 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -9.445 -7.068 4.212 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -8.680 -10.540 4.350 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -8.835 -9.097 3.343 1.00 0.00 H new ATOM 320 N LEU A 23 -6.040 -5.719 3.478 1.00 0.00 N ATOM 321 CA LEU A 23 -5.252 -5.762 2.258 1.00 0.00 C ATOM 322 C LEU A 23 -4.027 -6.657 2.436 1.00 0.00 C ATOM 323 O LEU A 23 -3.473 -6.746 3.529 1.00 0.00 O ATOM 324 CB LEU A 23 -4.853 -4.327 1.895 1.00 0.00 C ATOM 325 CG LEU A 23 -3.948 -4.214 0.663 1.00 0.00 C ATOM 326 CD1 LEU A 23 -4.609 -4.782 -0.590 1.00 0.00 C ATOM 327 CD2 LEU A 23 -3.640 -2.742 0.419 1.00 0.00 C ATOM 0 H LEU A 23 -5.987 -4.828 3.971 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.839 -6.191 1.446 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.758 -3.744 1.721 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -4.344 -3.878 2.747 1.00 0.00 H new ATOM 0 HG LEU A 23 -3.042 -4.788 0.859 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.931 -4.680 -1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.839 -5.836 -0.434 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.530 -4.236 -0.795 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.996 -2.645 -0.455 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -4.570 -2.199 0.247 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.133 -2.327 1.290 1.00 0.00 H new ATOM 339 N ASN A 24 -3.600 -7.321 1.357 1.00 0.00 N ATOM 340 CA ASN A 24 -2.365 -8.084 1.351 1.00 0.00 C ATOM 341 C ASN A 24 -1.208 -7.108 1.182 1.00 0.00 C ATOM 342 O ASN A 24 -1.020 -6.549 0.102 1.00 0.00 O ATOM 343 CB ASN A 24 -2.404 -9.106 0.218 1.00 0.00 C ATOM 344 CG ASN A 24 -1.065 -9.814 0.072 1.00 0.00 C ATOM 345 OD1 ASN A 24 -0.798 -10.805 0.741 1.00 0.00 O ATOM 346 ND2 ASN A 24 -0.217 -9.297 -0.808 1.00 0.00 N ATOM 0 H ASN A 24 -4.104 -7.340 0.471 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.237 -8.631 2.285 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.187 -9.839 0.412 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -2.659 -8.607 -0.717 1.00 0.00 H new ATOM 0 HD21 ASN A 24 0.698 -9.726 -0.948 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -0.480 -8.470 -1.345 1.00 0.00 H new ATOM 353 N THR A 25 -0.435 -6.903 2.245 1.00 0.00 N ATOM 354 CA THR A 25 0.597 -5.878 2.279 1.00 0.00 C ATOM 355 C THR A 25 2.003 -6.450 2.146 1.00 0.00 C ATOM 356 O THR A 25 2.977 -5.740 2.393 1.00 0.00 O ATOM 357 CB THR A 25 0.425 -5.013 3.529 1.00 0.00 C ATOM 358 OG1 THR A 25 0.554 -5.806 4.687 1.00 0.00 O ATOM 359 CG2 THR A 25 -0.977 -4.410 3.513 1.00 0.00 C ATOM 0 H THR A 25 -0.509 -7.445 3.106 1.00 0.00 H new ATOM 0 HA THR A 25 0.472 -5.241 1.404 1.00 0.00 H new ATOM 0 HB THR A 25 1.186 -4.233 3.535 1.00 0.00 H new ATOM 0 HG1 THR A 25 -0.215 -6.410 4.757 1.00 0.00 H new ATOM 0 HG21 THR A 25 -1.116 -3.790 4.398 1.00 0.00 H new ATOM 0 HG22 THR A 25 -1.100 -3.799 2.619 1.00 0.00 H new ATOM 0 HG23 THR A 25 -1.717 -5.210 3.510 1.00 0.00 H new ATOM 367 N LEU A 26 2.118 -7.725 1.759 1.00 0.00 N ATOM 368 CA LEU A 26 3.421 -8.341 1.541 1.00 0.00 C ATOM 369 C LEU A 26 3.836 -8.276 0.073 1.00 0.00 C ATOM 370 O LEU A 26 4.993 -8.540 -0.250 1.00 0.00 O ATOM 371 CB LEU A 26 3.417 -9.804 1.993 1.00 0.00 C ATOM 372 CG LEU A 26 2.818 -10.058 3.377 1.00 0.00 C ATOM 373 CD1 LEU A 26 3.268 -11.451 3.814 1.00 0.00 C ATOM 374 CD2 LEU A 26 3.267 -9.048 4.432 1.00 0.00 C ATOM 0 H LEU A 26 1.325 -8.344 1.592 1.00 0.00 H new ATOM 0 HA LEU A 26 4.140 -7.777 2.135 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.862 -10.392 1.262 1.00 0.00 H new ATOM 0 HB3 LEU A 26 4.443 -10.172 1.986 1.00 0.00 H new ATOM 0 HG LEU A 26 1.735 -9.964 3.298 1.00 0.00 H new ATOM 0 HD11 LEU A 26 2.861 -11.672 4.801 1.00 0.00 H new ATOM 0 HD12 LEU A 26 2.908 -12.191 3.099 1.00 0.00 H new ATOM 0 HD13 LEU A 26 4.357 -11.485 3.855 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.803 -9.290 5.388 1.00 0.00 H new ATOM 0 HD22 LEU A 26 4.351 -9.087 4.535 1.00 0.00 H new ATOM 0 HD23 LEU A 26 2.967 -8.045 4.127 1.00 0.00 H new ATOM 386 N VAL A 27 2.896 -7.927 -0.812 1.00 0.00 N ATOM 387 CA VAL A 27 3.144 -7.891 -2.252 1.00 0.00 C ATOM 388 C VAL A 27 2.655 -6.573 -2.842 1.00 0.00 C ATOM 389 O VAL A 27 3.107 -6.177 -3.917 1.00 0.00 O ATOM 390 CB VAL A 27 2.461 -9.087 -2.920 1.00 0.00 C ATOM 391 CG1 VAL A 27 2.853 -9.191 -4.395 1.00 0.00 C ATOM 392 CG2 VAL A 27 2.853 -10.393 -2.225 1.00 0.00 C ATOM 0 H VAL A 27 1.947 -7.663 -0.549 1.00 0.00 H new ATOM 0 HA VAL A 27 4.216 -7.958 -2.437 1.00 0.00 H new ATOM 0 HB VAL A 27 1.386 -8.930 -2.837 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.353 -10.049 -4.845 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.553 -8.282 -4.916 1.00 0.00 H new ATOM 0 HG13 VAL A 27 3.933 -9.316 -4.477 1.00 0.00 H new ATOM 0 HG21 VAL A 27 2.356 -11.230 -2.716 1.00 0.00 H new ATOM 0 HG22 VAL A 27 3.933 -10.527 -2.284 1.00 0.00 H new ATOM 0 HG23 VAL A 27 2.549 -10.354 -1.179 1.00 0.00 H new ATOM 402 N VAL A 28 1.738 -5.887 -2.157 1.00 0.00 N ATOM 403 CA VAL A 28 1.306 -4.566 -2.578 1.00 0.00 C ATOM 404 C VAL A 28 2.303 -3.538 -2.052 1.00 0.00 C ATOM 405 O VAL A 28 3.002 -3.787 -1.068 1.00 0.00 O ATOM 406 CB VAL A 28 -0.128 -4.304 -2.095 1.00 0.00 C ATOM 407 CG1 VAL A 28 -0.123 -3.562 -0.762 1.00 0.00 C ATOM 408 CG2 VAL A 28 -0.927 -3.478 -3.103 1.00 0.00 C ATOM 0 H VAL A 28 1.284 -6.230 -1.310 1.00 0.00 H new ATOM 0 HA VAL A 28 1.286 -4.491 -3.665 1.00 0.00 H new ATOM 0 HB VAL A 28 -0.600 -5.280 -1.981 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.149 -3.387 -0.439 1.00 0.00 H new ATOM 0 HG12 VAL A 28 0.396 -4.161 -0.014 1.00 0.00 H new ATOM 0 HG13 VAL A 28 0.388 -2.606 -0.879 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.935 -3.316 -2.722 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.437 -2.516 -3.255 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.979 -4.012 -4.052 1.00 0.00 H new ATOM 418 N LYS A 29 2.370 -2.380 -2.704 1.00 0.00 N ATOM 419 CA LYS A 29 3.231 -1.277 -2.302 1.00 0.00 C ATOM 420 C LYS A 29 2.492 0.033 -2.531 1.00 0.00 C ATOM 421 O LYS A 29 1.401 0.042 -3.098 1.00 0.00 O ATOM 422 CB LYS A 29 4.562 -1.293 -3.068 1.00 0.00 C ATOM 423 CG LYS A 29 4.449 -1.887 -4.474 1.00 0.00 C ATOM 424 CD LYS A 29 4.839 -3.364 -4.442 1.00 0.00 C ATOM 425 CE LYS A 29 4.422 -4.041 -5.745 1.00 0.00 C ATOM 426 NZ LYS A 29 4.958 -5.414 -5.833 1.00 0.00 N ATOM 0 H LYS A 29 1.818 -2.181 -3.539 1.00 0.00 H new ATOM 0 HA LYS A 29 3.472 -1.383 -1.244 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.942 -0.274 -3.142 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.294 -1.865 -2.498 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.430 -1.778 -4.844 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.098 -1.344 -5.162 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.915 -3.462 -4.300 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.360 -3.857 -3.596 1.00 0.00 H new ATOM 0 HE2 LYS A 29 3.334 -4.068 -5.811 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.778 -3.455 -6.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 4.835 -5.773 -6.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.970 -5.408 -5.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 4.448 -6.029 -5.168 1.00 0.00 H new ATOM 440 N LYS A 30 3.078 1.149 -2.095 1.00 0.00 N ATOM 441 CA LYS A 30 2.443 2.449 -2.269 1.00 0.00 C ATOM 442 C LYS A 30 2.186 2.725 -3.743 1.00 0.00 C ATOM 443 O LYS A 30 1.186 3.353 -4.078 1.00 0.00 O ATOM 444 CB LYS A 30 3.332 3.546 -1.681 1.00 0.00 C ATOM 445 CG LYS A 30 2.671 4.900 -1.933 1.00 0.00 C ATOM 446 CD LYS A 30 3.365 6.010 -1.151 1.00 0.00 C ATOM 447 CE LYS A 30 2.700 7.342 -1.486 1.00 0.00 C ATOM 448 NZ LYS A 30 2.987 7.754 -2.875 1.00 0.00 N ATOM 0 H LYS A 30 3.982 1.176 -1.624 1.00 0.00 H new ATOM 0 HA LYS A 30 1.487 2.442 -1.745 1.00 0.00 H new ATOM 0 HB2 LYS A 30 3.471 3.387 -0.612 1.00 0.00 H new ATOM 0 HB3 LYS A 30 4.321 3.517 -2.139 1.00 0.00 H new ATOM 0 HG2 LYS A 30 2.701 5.129 -2.998 1.00 0.00 H new ATOM 0 HG3 LYS A 30 1.620 4.853 -1.647 1.00 0.00 H new ATOM 0 HD2 LYS A 30 3.299 5.815 -0.081 1.00 0.00 H new ATOM 0 HD3 LYS A 30 4.425 6.044 -1.404 1.00 0.00 H new ATOM 0 HE2 LYS A 30 1.622 7.258 -1.345 1.00 0.00 H new ATOM 0 HE3 LYS A 30 3.052 8.110 -0.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 2.762 8.763 -2.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 3.994 7.598 -3.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 2.407 7.192 -3.531 1.00 0.00 H new ATOM 462 N SER A 31 3.082 2.252 -4.611 1.00 0.00 N ATOM 463 CA SER A 31 3.008 2.483 -6.046 1.00 0.00 C ATOM 464 C SER A 31 1.918 1.631 -6.681 1.00 0.00 C ATOM 465 O SER A 31 1.575 1.838 -7.844 1.00 0.00 O ATOM 466 CB SER A 31 4.362 2.168 -6.677 1.00 0.00 C ATOM 467 OG SER A 31 5.375 2.931 -6.054 1.00 0.00 O ATOM 0 H SER A 31 3.887 1.692 -4.329 1.00 0.00 H new ATOM 0 HA SER A 31 2.757 3.529 -6.222 1.00 0.00 H new ATOM 0 HB2 SER A 31 4.581 1.105 -6.575 1.00 0.00 H new ATOM 0 HB3 SER A 31 4.335 2.387 -7.744 1.00 0.00 H new ATOM 0 HG SER A 31 6.241 2.722 -6.463 1.00 0.00 H new ATOM 473 N ASP A 32 1.373 0.675 -5.925 1.00 0.00 N ATOM 474 CA ASP A 32 0.284 -0.163 -6.383 1.00 0.00 C ATOM 475 C ASP A 32 -1.046 0.423 -5.921 1.00 0.00 C ATOM 476 O ASP A 32 -2.013 0.411 -6.675 1.00 0.00 O ATOM 477 CB ASP A 32 0.477 -1.581 -5.843 1.00 0.00 C ATOM 478 CG ASP A 32 1.314 -2.440 -6.786 1.00 0.00 C ATOM 479 OD1 ASP A 32 2.355 -1.937 -7.263 1.00 0.00 O ATOM 480 OD2 ASP A 32 0.905 -3.598 -7.025 1.00 0.00 O ATOM 0 H ASP A 32 1.682 0.467 -4.976 1.00 0.00 H new ATOM 0 HA ASP A 32 0.277 -0.203 -7.472 1.00 0.00 H new ATOM 0 HB2 ASP A 32 0.961 -1.535 -4.868 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.496 -2.048 -5.694 1.00 0.00 H new ATOM 485 N VAL A 33 -1.118 0.939 -4.690 1.00 0.00 N ATOM 486 CA VAL A 33 -2.371 1.492 -4.192 1.00 0.00 C ATOM 487 C VAL A 33 -2.724 2.752 -4.984 1.00 0.00 C ATOM 488 O VAL A 33 -3.894 2.980 -5.289 1.00 0.00 O ATOM 489 CB VAL A 33 -2.267 1.774 -2.690 1.00 0.00 C ATOM 490 CG1 VAL A 33 -3.592 2.327 -2.167 1.00 0.00 C ATOM 491 CG2 VAL A 33 -1.954 0.486 -1.925 1.00 0.00 C ATOM 0 H VAL A 33 -0.337 0.983 -4.035 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.174 0.768 -4.331 1.00 0.00 H new ATOM 0 HB VAL A 33 -1.468 2.500 -2.539 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.508 2.524 -1.098 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -3.831 3.253 -2.689 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -4.384 1.598 -2.340 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -1.883 0.704 -0.859 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.749 -0.240 -2.095 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -1.007 0.076 -2.275 1.00 0.00 H new ATOM 501 N GLU A 34 -1.727 3.572 -5.326 1.00 0.00 N ATOM 502 CA GLU A 34 -1.957 4.755 -6.146 1.00 0.00 C ATOM 503 C GLU A 34 -2.137 4.402 -7.626 1.00 0.00 C ATOM 504 O GLU A 34 -2.283 5.295 -8.459 1.00 0.00 O ATOM 505 CB GLU A 34 -0.828 5.768 -5.949 1.00 0.00 C ATOM 506 CG GLU A 34 0.493 5.263 -6.522 1.00 0.00 C ATOM 507 CD GLU A 34 1.612 6.273 -6.283 1.00 0.00 C ATOM 508 OE1 GLU A 34 1.889 6.560 -5.094 1.00 0.00 O ATOM 509 OE2 GLU A 34 2.186 6.756 -7.287 1.00 0.00 O ATOM 0 H GLU A 34 -0.756 3.435 -5.046 1.00 0.00 H new ATOM 0 HA GLU A 34 -2.891 5.211 -5.817 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -1.096 6.709 -6.429 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -0.707 5.976 -4.886 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.753 4.310 -6.061 1.00 0.00 H new ATOM 0 HG3 GLU A 34 0.384 5.081 -7.591 1.00 0.00 H new ATOM 516 N ALA A 35 -2.126 3.106 -7.960 1.00 0.00 N ATOM 517 CA ALA A 35 -2.317 2.643 -9.326 1.00 0.00 C ATOM 518 C ALA A 35 -3.586 1.800 -9.465 1.00 0.00 C ATOM 519 O ALA A 35 -4.028 1.531 -10.581 1.00 0.00 O ATOM 520 CB ALA A 35 -1.085 1.842 -9.747 1.00 0.00 C ATOM 0 H ALA A 35 -1.984 2.354 -7.286 1.00 0.00 H new ATOM 0 HA ALA A 35 -2.440 3.507 -9.979 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -1.213 1.488 -10.770 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -0.201 2.478 -9.691 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -0.961 0.989 -9.080 1.00 0.00 H new ATOM 526 N ILE A 36 -4.172 1.383 -8.338 1.00 0.00 N ATOM 527 CA ILE A 36 -5.383 0.575 -8.315 1.00 0.00 C ATOM 528 C ILE A 36 -6.601 1.451 -8.023 1.00 0.00 C ATOM 529 O ILE A 36 -7.725 1.072 -8.346 1.00 0.00 O ATOM 530 CB ILE A 36 -5.196 -0.535 -7.271 1.00 0.00 C ATOM 531 CG1 ILE A 36 -4.102 -1.499 -7.754 1.00 0.00 C ATOM 532 CG2 ILE A 36 -6.487 -1.321 -7.036 1.00 0.00 C ATOM 533 CD1 ILE A 36 -3.549 -2.328 -6.596 1.00 0.00 C ATOM 0 H ILE A 36 -3.811 1.602 -7.410 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.561 0.115 -9.287 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.912 -0.066 -6.329 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.508 -2.162 -8.518 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.294 -0.934 -8.219 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.310 -2.096 -6.291 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.265 -0.645 -6.680 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -6.807 -1.782 -7.970 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.776 -3.001 -6.967 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.121 -1.664 -5.845 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.354 -2.911 -6.149 1.00 0.00 H new ATOM 545 N PHE A 37 -6.387 2.622 -7.417 1.00 0.00 N ATOM 546 CA PHE A 37 -7.476 3.526 -7.074 1.00 0.00 C ATOM 547 C PHE A 37 -7.460 4.783 -7.947 1.00 0.00 C ATOM 548 O PHE A 37 -8.400 5.574 -7.905 1.00 0.00 O ATOM 549 CB PHE A 37 -7.405 3.835 -5.576 1.00 0.00 C ATOM 550 CG PHE A 37 -7.783 2.649 -4.720 1.00 0.00 C ATOM 551 CD1 PHE A 37 -6.923 1.546 -4.620 1.00 0.00 C ATOM 552 CD2 PHE A 37 -9.006 2.652 -4.032 1.00 0.00 C ATOM 553 CE1 PHE A 37 -7.292 0.443 -3.839 1.00 0.00 C ATOM 554 CE2 PHE A 37 -9.374 1.543 -3.254 1.00 0.00 C ATOM 555 CZ PHE A 37 -8.516 0.442 -3.156 1.00 0.00 C ATOM 0 H PHE A 37 -5.462 2.963 -7.155 1.00 0.00 H new ATOM 0 HA PHE A 37 -8.433 3.047 -7.279 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -6.394 4.154 -5.322 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -8.069 4.669 -5.349 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -5.978 1.547 -5.144 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -9.663 3.506 -4.101 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -6.632 -0.408 -3.763 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -10.319 1.540 -2.731 1.00 0.00 H new ATOM 0 HZ PHE A 37 -8.797 -0.409 -2.554 1.00 0.00 H new ATOM 565 N SER A 38 -6.407 4.988 -8.743 1.00 0.00 N ATOM 566 CA SER A 38 -6.325 6.157 -9.608 1.00 0.00 C ATOM 567 C SER A 38 -7.243 6.019 -10.827 1.00 0.00 C ATOM 568 O SER A 38 -7.424 6.976 -11.580 1.00 0.00 O ATOM 569 CB SER A 38 -4.868 6.382 -10.014 1.00 0.00 C ATOM 570 OG SER A 38 -4.736 7.585 -10.744 1.00 0.00 O ATOM 0 H SER A 38 -5.605 4.360 -8.803 1.00 0.00 H new ATOM 0 HA SER A 38 -6.674 7.032 -9.060 1.00 0.00 H new ATOM 0 HB2 SER A 38 -4.238 6.419 -9.125 1.00 0.00 H new ATOM 0 HB3 SER A 38 -4.519 5.544 -10.617 1.00 0.00 H new ATOM 0 HG SER A 38 -5.538 7.726 -11.290 1.00 0.00 H new ATOM 576 N LYS A 39 -7.831 4.835 -11.035 1.00 0.00 N ATOM 577 CA LYS A 39 -8.758 4.604 -12.140 1.00 0.00 C ATOM 578 C LYS A 39 -10.199 4.942 -11.763 1.00 0.00 C ATOM 579 O LYS A 39 -11.091 4.855 -12.609 1.00 0.00 O ATOM 580 CB LYS A 39 -8.637 3.167 -12.648 1.00 0.00 C ATOM 581 CG LYS A 39 -9.121 2.158 -11.604 1.00 0.00 C ATOM 582 CD LYS A 39 -9.242 0.785 -12.260 1.00 0.00 C ATOM 583 CE LYS A 39 -9.803 -0.242 -11.277 1.00 0.00 C ATOM 584 NZ LYS A 39 -8.837 -0.555 -10.209 1.00 0.00 N ATOM 0 H LYS A 39 -7.677 4.018 -10.445 1.00 0.00 H new ATOM 0 HA LYS A 39 -8.481 5.280 -12.949 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.220 3.053 -13.562 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -7.598 2.957 -12.904 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.422 2.116 -10.769 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -10.084 2.468 -11.199 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -9.891 0.851 -13.133 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.264 0.459 -12.614 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -10.723 0.141 -10.835 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -10.063 -1.155 -11.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.231 -1.292 -9.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -7.950 -0.896 -10.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -8.647 0.302 -9.650 1.00 0.00 H new ATOM 598 N TYR A 40 -10.434 5.324 -10.503 1.00 0.00 N ATOM 599 CA TYR A 40 -11.760 5.669 -10.004 1.00 0.00 C ATOM 600 C TYR A 40 -11.817 7.121 -9.534 1.00 0.00 C ATOM 601 O TYR A 40 -12.882 7.595 -9.138 1.00 0.00 O ATOM 602 CB TYR A 40 -12.141 4.710 -8.875 1.00 0.00 C ATOM 603 CG TYR A 40 -12.849 3.455 -9.338 1.00 0.00 C ATOM 604 CD1 TYR A 40 -14.160 3.539 -9.826 1.00 0.00 C ATOM 605 CD2 TYR A 40 -12.203 2.210 -9.266 1.00 0.00 C ATOM 606 CE1 TYR A 40 -14.839 2.382 -10.229 1.00 0.00 C ATOM 607 CE2 TYR A 40 -12.875 1.051 -9.677 1.00 0.00 C ATOM 608 CZ TYR A 40 -14.194 1.132 -10.162 1.00 0.00 C ATOM 609 OH TYR A 40 -14.851 0.006 -10.560 1.00 0.00 O ATOM 0 H TYR A 40 -9.700 5.401 -9.799 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.479 5.568 -10.817 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -11.238 4.426 -8.335 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -12.783 5.236 -8.168 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.649 4.500 -9.892 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -11.191 2.146 -8.895 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -15.855 2.448 -10.590 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.380 0.093 -9.621 1.00 0.00 H new ATOM 0 HH TYR A 40 -14.918 -0.617 -9.807 1.00 0.00 H new ATOM 619 N GLY A 41 -10.691 7.841 -9.572 1.00 0.00 N ATOM 620 CA GLY A 41 -10.669 9.235 -9.168 1.00 0.00 C ATOM 621 C GLY A 41 -9.255 9.799 -9.144 1.00 0.00 C ATOM 622 O GLY A 41 -8.280 9.050 -9.213 1.00 0.00 O ATOM 0 H GLY A 41 -9.790 7.475 -9.879 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -11.282 9.821 -9.853 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -11.115 9.333 -8.178 1.00 0.00 H new ATOM 626 N LYS A 42 -9.144 11.126 -9.043 1.00 0.00 N ATOM 627 CA LYS A 42 -7.857 11.796 -8.951 1.00 0.00 C ATOM 628 C LYS A 42 -7.337 11.680 -7.528 1.00 0.00 C ATOM 629 O LYS A 42 -7.937 12.223 -6.602 1.00 0.00 O ATOM 630 CB LYS A 42 -8.010 13.263 -9.370 1.00 0.00 C ATOM 631 CG LYS A 42 -6.769 14.090 -9.009 1.00 0.00 C ATOM 632 CD LYS A 42 -5.493 13.553 -9.663 1.00 0.00 C ATOM 633 CE LYS A 42 -4.296 14.298 -9.073 1.00 0.00 C ATOM 634 NZ LYS A 42 -3.034 13.853 -9.697 1.00 0.00 N ATOM 0 H LYS A 42 -9.944 11.759 -9.023 1.00 0.00 H new ATOM 0 HA LYS A 42 -7.138 11.327 -9.622 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -8.184 13.318 -10.445 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -8.886 13.691 -8.883 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -6.924 15.124 -9.318 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -6.643 14.096 -7.926 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.398 12.482 -9.485 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -5.532 13.694 -10.743 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -4.421 15.370 -9.223 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -4.253 14.129 -7.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -2.237 14.374 -9.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -2.906 12.834 -9.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -3.069 14.037 -10.720 1.00 0.00 H new ATOM 648 N ILE A 43 -6.216 10.976 -7.353 1.00 0.00 N ATOM 649 CA ILE A 43 -5.581 10.846 -6.052 1.00 0.00 C ATOM 650 C ILE A 43 -4.666 12.046 -5.828 1.00 0.00 C ATOM 651 O ILE A 43 -3.826 12.362 -6.671 1.00 0.00 O ATOM 652 CB ILE A 43 -4.816 9.519 -5.968 1.00 0.00 C ATOM 653 CG1 ILE A 43 -5.799 8.348 -6.103 1.00 0.00 C ATOM 654 CG2 ILE A 43 -4.067 9.443 -4.636 1.00 0.00 C ATOM 655 CD1 ILE A 43 -5.119 6.984 -5.960 1.00 0.00 C ATOM 0 H ILE A 43 -5.732 10.487 -8.105 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.333 10.834 -5.263 1.00 0.00 H new ATOM 0 HB ILE A 43 -4.091 9.461 -6.780 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -6.576 8.443 -5.345 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -6.292 8.403 -7.074 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -3.524 8.500 -4.577 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.363 10.272 -4.567 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -4.780 9.503 -3.814 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -5.863 6.194 -6.064 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -4.360 6.873 -6.735 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -4.649 6.913 -4.979 1.00 0.00 H new ATOM 667 N VAL A 44 -4.831 12.712 -4.685 1.00 0.00 N ATOM 668 CA VAL A 44 -4.007 13.850 -4.291 1.00 0.00 C ATOM 669 C VAL A 44 -3.280 13.561 -2.984 1.00 0.00 C ATOM 670 O VAL A 44 -2.652 14.444 -2.413 1.00 0.00 O ATOM 671 CB VAL A 44 -4.842 15.128 -4.205 1.00 0.00 C ATOM 672 CG1 VAL A 44 -5.261 15.565 -5.609 1.00 0.00 C ATOM 673 CG2 VAL A 44 -6.088 14.917 -3.349 1.00 0.00 C ATOM 0 H VAL A 44 -5.549 12.472 -4.001 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.251 14.010 -5.060 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.230 15.901 -3.740 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -5.856 16.476 -5.544 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -4.373 15.754 -6.212 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -5.854 14.777 -6.074 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -6.661 15.843 -3.307 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.702 14.130 -3.787 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -5.792 14.627 -2.341 1.00 0.00 H new ATOM 683 N GLY A 45 -3.363 12.317 -2.511 1.00 0.00 N ATOM 684 CA GLY A 45 -2.625 11.853 -1.350 1.00 0.00 C ATOM 685 C GLY A 45 -2.787 10.341 -1.231 1.00 0.00 C ATOM 686 O GLY A 45 -3.831 9.806 -1.593 1.00 0.00 O ATOM 0 H GLY A 45 -3.953 11.600 -2.933 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.571 12.112 -1.446 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.993 12.343 -0.449 1.00 0.00 H new ATOM 690 N CYS A 46 -1.771 9.636 -0.732 1.00 0.00 N ATOM 691 CA CYS A 46 -1.847 8.186 -0.619 1.00 0.00 C ATOM 692 C CYS A 46 -0.876 7.679 0.443 1.00 0.00 C ATOM 693 O CYS A 46 0.182 8.273 0.643 1.00 0.00 O ATOM 694 CB CYS A 46 -1.517 7.575 -1.986 1.00 0.00 C ATOM 695 SG CYS A 46 -1.677 5.771 -1.904 1.00 0.00 S ATOM 0 H CYS A 46 -0.896 10.044 -0.404 1.00 0.00 H new ATOM 0 HA CYS A 46 -2.852 7.892 -0.315 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -2.189 7.975 -2.746 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -0.504 7.847 -2.281 1.00 0.00 H new ATOM 0 HG CYS A 46 -2.501 5.451 -0.950 1.00 0.00 H new ATOM 701 N SER A 47 -1.232 6.587 1.116 1.00 0.00 N ATOM 702 CA SER A 47 -0.345 5.917 2.055 1.00 0.00 C ATOM 703 C SER A 47 -0.679 4.430 2.111 1.00 0.00 C ATOM 704 O SER A 47 -1.784 4.014 1.770 1.00 0.00 O ATOM 705 CB SER A 47 -0.447 6.549 3.445 1.00 0.00 C ATOM 706 OG SER A 47 -1.735 6.361 3.991 1.00 0.00 O ATOM 0 H SER A 47 -2.146 6.144 1.023 1.00 0.00 H new ATOM 0 HA SER A 47 0.683 6.034 1.711 1.00 0.00 H new ATOM 0 HB2 SER A 47 0.300 6.108 4.105 1.00 0.00 H new ATOM 0 HB3 SER A 47 -0.227 7.615 3.381 1.00 0.00 H new ATOM 0 HG SER A 47 -1.711 5.626 4.639 1.00 0.00 H new ATOM 712 N VAL A 48 0.285 3.620 2.547 1.00 0.00 N ATOM 713 CA VAL A 48 0.103 2.179 2.653 1.00 0.00 C ATOM 714 C VAL A 48 0.798 1.678 3.914 1.00 0.00 C ATOM 715 O VAL A 48 1.834 2.213 4.310 1.00 0.00 O ATOM 716 CB VAL A 48 0.601 1.500 1.372 1.00 0.00 C ATOM 717 CG1 VAL A 48 2.094 1.731 1.163 1.00 0.00 C ATOM 718 CG2 VAL A 48 0.325 -0.002 1.375 1.00 0.00 C ATOM 0 H VAL A 48 1.208 3.945 2.834 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.953 1.925 2.748 1.00 0.00 H new ATOM 0 HB VAL A 48 0.047 1.956 0.552 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.414 1.236 0.246 1.00 0.00 H new ATOM 0 HG12 VAL A 48 2.289 2.801 1.085 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.647 1.322 2.008 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.695 -0.442 0.449 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.831 -0.463 2.223 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.748 -0.175 1.456 1.00 0.00 H new ATOM 728 N HIS A 49 0.223 0.652 4.543 1.00 0.00 N ATOM 729 CA HIS A 49 0.648 0.186 5.856 1.00 0.00 C ATOM 730 C HIS A 49 0.603 -1.339 5.906 1.00 0.00 C ATOM 731 O HIS A 49 0.392 -1.980 4.879 1.00 0.00 O ATOM 732 CB HIS A 49 -0.295 0.790 6.902 1.00 0.00 C ATOM 733 CG HIS A 49 -0.584 2.249 6.654 1.00 0.00 C ATOM 734 ND1 HIS A 49 0.225 3.318 7.041 1.00 0.00 N ATOM 735 CD2 HIS A 49 -1.682 2.728 5.996 1.00 0.00 C ATOM 736 CE1 HIS A 49 -0.405 4.418 6.596 1.00 0.00 C ATOM 737 NE2 HIS A 49 -1.547 4.096 5.962 1.00 0.00 N ATOM 0 H HIS A 49 -0.554 0.121 4.151 1.00 0.00 H new ATOM 0 HA HIS A 49 1.672 0.498 6.059 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -1.232 0.234 6.904 1.00 0.00 H new ATOM 0 HB3 HIS A 49 0.146 0.675 7.892 1.00 0.00 H new ATOM 0 HD1 HIS A 49 1.106 3.274 7.552 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -2.494 2.147 5.584 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -0.043 5.427 6.729 1.00 0.00 H new ATOM 745 N LYS A 50 0.795 -1.928 7.091 1.00 0.00 N ATOM 746 CA LYS A 50 0.623 -3.365 7.270 1.00 0.00 C ATOM 747 C LYS A 50 -0.857 -3.679 7.447 1.00 0.00 C ATOM 748 O LYS A 50 -1.521 -3.085 8.292 1.00 0.00 O ATOM 749 CB LYS A 50 1.420 -3.852 8.484 1.00 0.00 C ATOM 750 CG LYS A 50 2.900 -4.079 8.172 1.00 0.00 C ATOM 751 CD LYS A 50 3.067 -5.274 7.224 1.00 0.00 C ATOM 752 CE LYS A 50 4.538 -5.664 7.081 1.00 0.00 C ATOM 753 NZ LYS A 50 5.101 -6.130 8.363 1.00 0.00 N ATOM 0 H LYS A 50 1.069 -1.428 7.937 1.00 0.00 H new ATOM 0 HA LYS A 50 0.997 -3.883 6.387 1.00 0.00 H new ATOM 0 HB2 LYS A 50 1.331 -3.121 9.288 1.00 0.00 H new ATOM 0 HB3 LYS A 50 0.984 -4.782 8.849 1.00 0.00 H new ATOM 0 HG2 LYS A 50 3.324 -3.184 7.718 1.00 0.00 H new ATOM 0 HG3 LYS A 50 3.450 -4.259 9.096 1.00 0.00 H new ATOM 0 HD2 LYS A 50 2.498 -6.123 7.601 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.657 -5.025 6.245 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.636 -6.450 6.332 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.109 -4.808 6.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 5.937 -5.560 8.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.387 -6.029 9.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 5.376 -7.130 8.279 1.00 0.00 H new ATOM 767 N GLY A 51 -1.371 -4.616 6.647 1.00 0.00 N ATOM 768 CA GLY A 51 -2.753 -5.075 6.709 1.00 0.00 C ATOM 769 C GLY A 51 -3.786 -4.072 6.182 1.00 0.00 C ATOM 770 O GLY A 51 -4.948 -4.443 6.029 1.00 0.00 O ATOM 0 H GLY A 51 -0.824 -5.084 5.925 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.840 -5.999 6.138 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.996 -5.315 7.744 1.00 0.00 H new ATOM 774 N PHE A 52 -3.403 -2.822 5.901 1.00 0.00 N ATOM 775 CA PHE A 52 -4.339 -1.830 5.389 1.00 0.00 C ATOM 776 C PHE A 52 -3.619 -0.714 4.635 1.00 0.00 C ATOM 777 O PHE A 52 -2.394 -0.622 4.664 1.00 0.00 O ATOM 778 CB PHE A 52 -5.165 -1.240 6.535 1.00 0.00 C ATOM 779 CG PHE A 52 -4.365 -0.442 7.540 1.00 0.00 C ATOM 780 CD1 PHE A 52 -3.712 -1.090 8.598 1.00 0.00 C ATOM 781 CD2 PHE A 52 -4.278 0.950 7.409 1.00 0.00 C ATOM 782 CE1 PHE A 52 -2.965 -0.347 9.521 1.00 0.00 C ATOM 783 CE2 PHE A 52 -3.529 1.692 8.332 1.00 0.00 C ATOM 784 CZ PHE A 52 -2.869 1.046 9.384 1.00 0.00 C ATOM 0 H PHE A 52 -2.450 -2.479 6.021 1.00 0.00 H new ATOM 0 HA PHE A 52 -5.004 -2.334 4.687 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -5.939 -0.598 6.115 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -5.672 -2.052 7.056 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -3.785 -2.163 8.701 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -4.787 1.450 6.598 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -2.464 -0.846 10.337 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.461 2.765 8.232 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.286 1.620 10.090 1.00 0.00 H new ATOM 794 N ALA A 53 -4.393 0.140 3.957 1.00 0.00 N ATOM 795 CA ALA A 53 -3.875 1.282 3.214 1.00 0.00 C ATOM 796 C ALA A 53 -4.902 2.417 3.196 1.00 0.00 C ATOM 797 O ALA A 53 -6.042 2.234 3.623 1.00 0.00 O ATOM 798 CB ALA A 53 -3.535 0.833 1.794 1.00 0.00 C ATOM 0 H ALA A 53 -5.408 0.052 3.911 1.00 0.00 H new ATOM 0 HA ALA A 53 -2.974 1.659 3.698 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -3.146 1.680 1.228 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -2.782 0.045 1.832 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -4.433 0.453 1.308 1.00 0.00 H new ATOM 804 N PHE A 54 -4.496 3.590 2.703 1.00 0.00 N ATOM 805 CA PHE A 54 -5.359 4.756 2.600 1.00 0.00 C ATOM 806 C PHE A 54 -5.095 5.526 1.310 1.00 0.00 C ATOM 807 O PHE A 54 -3.979 5.535 0.790 1.00 0.00 O ATOM 808 CB PHE A 54 -5.143 5.683 3.800 1.00 0.00 C ATOM 809 CG PHE A 54 -6.072 5.426 4.962 1.00 0.00 C ATOM 810 CD1 PHE A 54 -7.374 5.944 4.925 1.00 0.00 C ATOM 811 CD2 PHE A 54 -5.641 4.686 6.071 1.00 0.00 C ATOM 812 CE1 PHE A 54 -8.252 5.716 5.991 1.00 0.00 C ATOM 813 CE2 PHE A 54 -6.520 4.458 7.138 1.00 0.00 C ATOM 814 CZ PHE A 54 -7.823 4.972 7.097 1.00 0.00 C ATOM 0 H PHE A 54 -3.548 3.752 2.362 1.00 0.00 H new ATOM 0 HA PHE A 54 -6.391 4.405 2.590 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -4.114 5.579 4.144 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.267 6.715 3.473 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.700 6.520 4.072 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.636 4.293 6.103 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.256 6.112 5.961 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -6.193 3.885 7.993 1.00 0.00 H new ATOM 0 HZ PHE A 54 -8.498 4.794 7.921 1.00 0.00 H new ATOM 824 N VAL A 55 -6.140 6.180 0.796 1.00 0.00 N ATOM 825 CA VAL A 55 -6.063 6.987 -0.415 1.00 0.00 C ATOM 826 C VAL A 55 -6.892 8.249 -0.219 1.00 0.00 C ATOM 827 O VAL A 55 -7.977 8.181 0.346 1.00 0.00 O ATOM 828 CB VAL A 55 -6.583 6.182 -1.611 1.00 0.00 C ATOM 829 CG1 VAL A 55 -6.574 7.042 -2.871 1.00 0.00 C ATOM 830 CG2 VAL A 55 -5.711 4.955 -1.863 1.00 0.00 C ATOM 0 H VAL A 55 -7.069 6.161 1.216 1.00 0.00 H new ATOM 0 HA VAL A 55 -5.027 7.264 -0.613 1.00 0.00 H new ATOM 0 HB VAL A 55 -7.600 5.866 -1.377 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.946 6.458 -3.713 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.214 7.912 -2.722 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.556 7.372 -3.079 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -6.101 4.401 -2.717 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.689 5.272 -2.072 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.719 4.315 -0.981 1.00 0.00 H new ATOM 840 N GLN A 56 -6.393 9.396 -0.680 1.00 0.00 N ATOM 841 CA GLN A 56 -7.074 10.673 -0.544 1.00 0.00 C ATOM 842 C GLN A 56 -7.416 11.206 -1.932 1.00 0.00 C ATOM 843 O GLN A 56 -6.523 11.452 -2.742 1.00 0.00 O ATOM 844 CB GLN A 56 -6.172 11.633 0.241 1.00 0.00 C ATOM 845 CG GLN A 56 -6.760 13.034 0.416 1.00 0.00 C ATOM 846 CD GLN A 56 -7.935 13.032 1.381 1.00 0.00 C ATOM 847 OE1 GLN A 56 -7.757 12.943 2.593 1.00 0.00 O ATOM 848 NE2 GLN A 56 -9.146 13.134 0.850 1.00 0.00 N ATOM 0 H GLN A 56 -5.496 9.460 -1.162 1.00 0.00 H new ATOM 0 HA GLN A 56 -8.008 10.564 0.007 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -5.974 11.207 1.225 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -5.213 11.714 -0.270 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -5.988 13.710 0.784 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -7.084 13.417 -0.552 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -9.255 13.206 -0.162 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -9.968 13.140 1.453 1.00 0.00 H new ATOM 857 N TYR A 57 -8.711 11.386 -2.201 1.00 0.00 N ATOM 858 CA TYR A 57 -9.193 11.943 -3.453 1.00 0.00 C ATOM 859 C TYR A 57 -9.447 13.439 -3.300 1.00 0.00 C ATOM 860 O TYR A 57 -9.240 14.005 -2.223 1.00 0.00 O ATOM 861 CB TYR A 57 -10.480 11.243 -3.883 1.00 0.00 C ATOM 862 CG TYR A 57 -10.321 9.809 -4.327 1.00 0.00 C ATOM 863 CD1 TYR A 57 -9.370 9.471 -5.304 1.00 0.00 C ATOM 864 CD2 TYR A 57 -11.148 8.823 -3.777 1.00 0.00 C ATOM 865 CE1 TYR A 57 -9.275 8.153 -5.763 1.00 0.00 C ATOM 866 CE2 TYR A 57 -11.065 7.502 -4.239 1.00 0.00 C ATOM 867 CZ TYR A 57 -10.134 7.166 -5.239 1.00 0.00 C ATOM 868 OH TYR A 57 -10.072 5.889 -5.691 1.00 0.00 O ATOM 0 H TYR A 57 -9.455 11.145 -1.546 1.00 0.00 H new ATOM 0 HA TYR A 57 -8.432 11.787 -4.217 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -11.184 11.272 -3.052 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -10.927 11.811 -4.699 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -8.712 10.229 -5.701 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -11.850 9.080 -2.997 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -8.546 7.893 -6.516 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -11.715 6.743 -3.828 1.00 0.00 H new ATOM 0 HH TYR A 57 -9.486 5.848 -6.475 1.00 0.00 H new ATOM 878 N VAL A 58 -9.900 14.077 -4.382 1.00 0.00 N ATOM 879 CA VAL A 58 -10.160 15.510 -4.397 1.00 0.00 C ATOM 880 C VAL A 58 -11.518 15.822 -3.767 1.00 0.00 C ATOM 881 O VAL A 58 -11.722 16.924 -3.259 1.00 0.00 O ATOM 882 CB VAL A 58 -10.104 16.015 -5.844 1.00 0.00 C ATOM 883 CG1 VAL A 58 -10.399 17.514 -5.926 1.00 0.00 C ATOM 884 CG2 VAL A 58 -8.711 15.774 -6.429 1.00 0.00 C ATOM 0 H VAL A 58 -10.095 13.612 -5.268 1.00 0.00 H new ATOM 0 HA VAL A 58 -9.398 16.020 -3.807 1.00 0.00 H new ATOM 0 HB VAL A 58 -10.860 15.468 -6.407 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -10.351 17.838 -6.966 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -11.395 17.711 -5.530 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.661 18.063 -5.341 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.680 16.136 -7.457 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.969 16.307 -5.834 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -8.489 14.707 -6.413 1.00 0.00 H new ATOM 894 N ASN A 59 -12.444 14.859 -3.794 1.00 0.00 N ATOM 895 CA ASN A 59 -13.791 15.041 -3.271 1.00 0.00 C ATOM 896 C ASN A 59 -14.401 13.710 -2.825 1.00 0.00 C ATOM 897 O ASN A 59 -13.789 12.651 -2.970 1.00 0.00 O ATOM 898 CB ASN A 59 -14.651 15.685 -4.360 1.00 0.00 C ATOM 899 CG ASN A 59 -14.695 14.828 -5.611 1.00 0.00 C ATOM 900 OD1 ASN A 59 -15.122 13.682 -5.572 1.00 0.00 O ATOM 901 ND2 ASN A 59 -14.248 15.374 -6.736 1.00 0.00 N ATOM 0 H ASN A 59 -12.275 13.931 -4.181 1.00 0.00 H new ATOM 0 HA ASN A 59 -13.751 15.687 -2.394 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -15.663 15.835 -3.985 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -14.253 16.669 -4.606 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -14.254 14.835 -7.602 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -13.899 16.332 -6.734 1.00 0.00 H new ATOM 908 N GLU A 60 -15.620 13.776 -2.281 1.00 0.00 N ATOM 909 CA GLU A 60 -16.342 12.614 -1.783 1.00 0.00 C ATOM 910 C GLU A 60 -16.840 11.735 -2.926 1.00 0.00 C ATOM 911 O GLU A 60 -16.885 10.513 -2.796 1.00 0.00 O ATOM 912 CB GLU A 60 -17.512 13.109 -0.927 1.00 0.00 C ATOM 913 CG GLU A 60 -18.550 12.005 -0.711 1.00 0.00 C ATOM 914 CD GLU A 60 -19.594 12.414 0.326 1.00 0.00 C ATOM 915 OE1 GLU A 60 -20.129 13.539 0.202 1.00 0.00 O ATOM 916 OE2 GLU A 60 -19.852 11.595 1.238 1.00 0.00 O ATOM 0 H GLU A 60 -16.134 14.651 -2.175 1.00 0.00 H new ATOM 0 HA GLU A 60 -15.672 11.999 -1.182 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -17.139 13.454 0.037 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -17.983 13.964 -1.411 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -19.044 11.778 -1.656 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -18.050 11.093 -0.385 1.00 0.00 H new ATOM 923 N ARG A 61 -17.215 12.348 -4.048 1.00 0.00 N ATOM 924 CA ARG A 61 -17.730 11.633 -5.207 1.00 0.00 C ATOM 925 C ARG A 61 -16.710 10.602 -5.687 1.00 0.00 C ATOM 926 O ARG A 61 -17.073 9.487 -6.056 1.00 0.00 O ATOM 927 CB ARG A 61 -18.070 12.702 -6.254 1.00 0.00 C ATOM 928 CG ARG A 61 -17.767 12.315 -7.702 1.00 0.00 C ATOM 929 CD ARG A 61 -18.689 11.203 -8.192 1.00 0.00 C ATOM 930 NE ARG A 61 -18.392 10.841 -9.582 1.00 0.00 N ATOM 931 CZ ARG A 61 -18.896 11.465 -10.653 1.00 0.00 C ATOM 932 NH1 ARG A 61 -19.726 12.496 -10.512 1.00 0.00 N ATOM 933 NH2 ARG A 61 -18.567 11.059 -11.873 1.00 0.00 N ATOM 0 H ARG A 61 -17.169 13.359 -4.176 1.00 0.00 H new ATOM 0 HA ARG A 61 -18.628 11.057 -4.982 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -19.130 12.942 -6.173 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -17.518 13.611 -6.015 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -17.878 13.189 -8.343 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -16.730 11.990 -7.783 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -18.577 10.327 -7.554 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -19.727 11.526 -8.111 1.00 0.00 H new ATOM 0 HE ARG A 61 -17.757 10.059 -9.743 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -19.985 12.819 -9.580 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -20.103 12.963 -11.336 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -17.930 10.271 -11.994 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -18.951 11.534 -12.690 1.00 0.00 H new ATOM 947 N ASN A 62 -15.426 10.967 -5.680 1.00 0.00 N ATOM 948 CA ASN A 62 -14.357 10.068 -6.089 1.00 0.00 C ATOM 949 C ASN A 62 -14.214 8.923 -5.080 1.00 0.00 C ATOM 950 O ASN A 62 -13.889 7.796 -5.457 1.00 0.00 O ATOM 951 CB ASN A 62 -13.064 10.878 -6.197 1.00 0.00 C ATOM 952 CG ASN A 62 -12.959 11.659 -7.503 1.00 0.00 C ATOM 953 OD1 ASN A 62 -11.949 11.590 -8.193 1.00 0.00 O ATOM 954 ND2 ASN A 62 -13.991 12.412 -7.865 1.00 0.00 N ATOM 0 H ASN A 62 -15.104 11.891 -5.391 1.00 0.00 H new ATOM 0 HA ASN A 62 -14.585 9.622 -7.057 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -13.005 11.572 -5.359 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -12.211 10.204 -6.113 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -13.952 12.947 -8.732 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -14.822 12.455 -7.276 1.00 0.00 H new ATOM 961 N ALA A 63 -14.458 9.197 -3.795 1.00 0.00 N ATOM 962 CA ALA A 63 -14.363 8.169 -2.772 1.00 0.00 C ATOM 963 C ALA A 63 -15.477 7.139 -2.930 1.00 0.00 C ATOM 964 O ALA A 63 -15.219 5.946 -2.798 1.00 0.00 O ATOM 965 CB ALA A 63 -14.404 8.808 -1.384 1.00 0.00 C ATOM 0 H ALA A 63 -14.721 10.119 -3.447 1.00 0.00 H new ATOM 0 HA ALA A 63 -13.412 7.649 -2.888 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -14.332 8.031 -0.623 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -13.568 9.499 -1.277 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -15.341 9.351 -1.261 1.00 0.00 H new ATOM 971 N ARG A 64 -16.706 7.581 -3.217 1.00 0.00 N ATOM 972 CA ARG A 64 -17.820 6.668 -3.421 1.00 0.00 C ATOM 973 C ARG A 64 -17.586 5.822 -4.668 1.00 0.00 C ATOM 974 O ARG A 64 -18.130 4.724 -4.778 1.00 0.00 O ATOM 975 CB ARG A 64 -19.122 7.462 -3.594 1.00 0.00 C ATOM 976 CG ARG A 64 -19.441 8.370 -2.404 1.00 0.00 C ATOM 977 CD ARG A 64 -19.669 7.591 -1.112 1.00 0.00 C ATOM 978 NE ARG A 64 -19.929 8.511 -0.001 1.00 0.00 N ATOM 979 CZ ARG A 64 -20.282 8.140 1.233 1.00 0.00 C ATOM 980 NH1 ARG A 64 -20.430 6.859 1.551 1.00 0.00 N ATOM 981 NH2 ARG A 64 -20.487 9.068 2.159 1.00 0.00 N ATOM 0 H ARG A 64 -16.948 8.567 -3.312 1.00 0.00 H new ATOM 0 HA ARG A 64 -17.898 6.017 -2.550 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -19.052 8.069 -4.497 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -19.947 6.765 -3.742 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -18.621 9.073 -2.259 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -20.330 8.959 -2.630 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -20.512 6.910 -1.234 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -18.795 6.979 -0.889 1.00 0.00 H new ATOM 0 HE ARG A 64 -19.833 9.510 -0.184 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -20.274 6.137 0.847 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -20.700 6.597 2.499 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -20.375 10.055 1.926 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -20.757 8.795 3.104 1.00 0.00 H new ATOM 995 N ALA A 65 -16.778 6.319 -5.610 1.00 0.00 N ATOM 996 CA ALA A 65 -16.495 5.607 -6.844 1.00 0.00 C ATOM 997 C ALA A 65 -15.638 4.372 -6.583 1.00 0.00 C ATOM 998 O ALA A 65 -15.892 3.321 -7.163 1.00 0.00 O ATOM 999 CB ALA A 65 -15.786 6.558 -7.806 1.00 0.00 C ATOM 0 H ALA A 65 -16.308 7.221 -5.532 1.00 0.00 H new ATOM 0 HA ALA A 65 -17.432 5.265 -7.284 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -15.567 6.037 -8.738 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -16.429 7.414 -8.012 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -14.855 6.903 -7.356 1.00 0.00 H new ATOM 1005 N ALA A 66 -14.628 4.488 -5.715 1.00 0.00 N ATOM 1006 CA ALA A 66 -13.761 3.359 -5.414 1.00 0.00 C ATOM 1007 C ALA A 66 -14.255 2.551 -4.211 1.00 0.00 C ATOM 1008 O ALA A 66 -13.991 1.353 -4.132 1.00 0.00 O ATOM 1009 CB ALA A 66 -12.343 3.875 -5.189 1.00 0.00 C ATOM 0 H ALA A 66 -14.397 5.347 -5.216 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.774 2.674 -6.262 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -11.683 3.038 -4.962 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -11.993 4.380 -6.089 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -12.339 4.576 -4.355 1.00 0.00 H new ATOM 1015 N VAL A 67 -14.965 3.188 -3.282 1.00 0.00 N ATOM 1016 CA VAL A 67 -15.528 2.504 -2.125 1.00 0.00 C ATOM 1017 C VAL A 67 -16.670 1.583 -2.557 1.00 0.00 C ATOM 1018 O VAL A 67 -17.012 0.647 -1.837 1.00 0.00 O ATOM 1019 CB VAL A 67 -15.969 3.529 -1.069 1.00 0.00 C ATOM 1020 CG1 VAL A 67 -16.891 2.905 -0.027 1.00 0.00 C ATOM 1021 CG2 VAL A 67 -14.732 4.078 -0.365 1.00 0.00 C ATOM 0 H VAL A 67 -15.164 4.188 -3.312 1.00 0.00 H new ATOM 0 HA VAL A 67 -14.765 1.874 -1.667 1.00 0.00 H new ATOM 0 HB VAL A 67 -16.516 4.324 -1.576 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -17.181 3.662 0.702 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -17.782 2.514 -0.518 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -16.370 2.093 0.480 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -15.035 4.807 0.387 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -14.195 3.261 0.117 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -14.081 4.559 -1.095 1.00 0.00 H new ATOM 1031 N ALA A 68 -17.260 1.838 -3.726 1.00 0.00 N ATOM 1032 CA ALA A 68 -18.258 0.951 -4.307 1.00 0.00 C ATOM 1033 C ALA A 68 -17.743 0.258 -5.573 1.00 0.00 C ATOM 1034 O ALA A 68 -18.391 -0.657 -6.077 1.00 0.00 O ATOM 1035 CB ALA A 68 -19.528 1.750 -4.591 1.00 0.00 C ATOM 0 H ALA A 68 -17.058 2.663 -4.291 1.00 0.00 H new ATOM 0 HA ALA A 68 -18.479 0.158 -3.592 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -20.281 1.093 -5.026 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -19.908 2.172 -3.661 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -19.302 2.556 -5.289 1.00 0.00 H new ATOM 1041 N GLY A 69 -16.588 0.685 -6.094 1.00 0.00 N ATOM 1042 CA GLY A 69 -16.034 0.113 -7.314 1.00 0.00 C ATOM 1043 C GLY A 69 -15.040 -1.021 -7.059 1.00 0.00 C ATOM 1044 O GLY A 69 -14.964 -1.950 -7.861 1.00 0.00 O ATOM 0 H GLY A 69 -16.021 1.427 -5.684 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.849 -0.261 -7.933 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -15.538 0.900 -7.882 1.00 0.00 H new ATOM 1048 N GLU A 70 -14.282 -0.957 -5.961 1.00 0.00 N ATOM 1049 CA GLU A 70 -13.239 -1.939 -5.665 1.00 0.00 C ATOM 1050 C GLU A 70 -13.528 -2.717 -4.385 1.00 0.00 C ATOM 1051 O GLU A 70 -12.872 -3.725 -4.130 1.00 0.00 O ATOM 1052 CB GLU A 70 -11.893 -1.220 -5.544 1.00 0.00 C ATOM 1053 CG GLU A 70 -11.449 -0.579 -6.862 1.00 0.00 C ATOM 1054 CD GLU A 70 -11.061 -1.626 -7.905 1.00 0.00 C ATOM 1055 OE1 GLU A 70 -11.973 -2.144 -8.584 1.00 0.00 O ATOM 1056 OE2 GLU A 70 -9.847 -1.901 -8.020 1.00 0.00 O ATOM 0 H GLU A 70 -14.374 -0.226 -5.256 1.00 0.00 H new ATOM 0 HA GLU A 70 -13.213 -2.660 -6.482 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -11.964 -0.450 -4.775 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -11.134 -1.930 -5.215 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -12.255 0.041 -7.253 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -10.601 0.080 -6.677 1.00 0.00 H new ATOM 1063 N ASP A 71 -14.486 -2.285 -3.564 1.00 0.00 N ATOM 1064 CA ASP A 71 -14.756 -2.974 -2.313 1.00 0.00 C ATOM 1065 C ASP A 71 -15.140 -4.430 -2.572 1.00 0.00 C ATOM 1066 O ASP A 71 -16.002 -4.719 -3.403 1.00 0.00 O ATOM 1067 CB ASP A 71 -15.848 -2.237 -1.544 1.00 0.00 C ATOM 1068 CG ASP A 71 -16.271 -3.024 -0.306 1.00 0.00 C ATOM 1069 OD1 ASP A 71 -15.360 -3.504 0.404 1.00 0.00 O ATOM 1070 OD2 ASP A 71 -17.498 -3.137 -0.084 1.00 0.00 O ATOM 0 H ASP A 71 -15.077 -1.473 -3.743 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.852 -2.979 -1.704 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -15.488 -1.252 -1.248 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -16.711 -2.079 -2.191 1.00 0.00 H new ATOM 1075 N GLY A 72 -14.493 -5.351 -1.847 1.00 0.00 N ATOM 1076 CA GLY A 72 -14.766 -6.775 -1.958 1.00 0.00 C ATOM 1077 C GLY A 72 -14.003 -7.430 -3.108 1.00 0.00 C ATOM 1078 O GLY A 72 -14.327 -8.560 -3.480 1.00 0.00 O ATOM 0 H GLY A 72 -13.766 -5.122 -1.169 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.499 -7.267 -1.023 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -15.836 -6.926 -2.103 1.00 0.00 H new ATOM 1082 N ARG A 73 -13.003 -6.746 -3.676 1.00 0.00 N ATOM 1083 CA ARG A 73 -12.234 -7.292 -4.791 1.00 0.00 C ATOM 1084 C ARG A 73 -11.002 -8.039 -4.292 1.00 0.00 C ATOM 1085 O ARG A 73 -10.568 -7.833 -3.162 1.00 0.00 O ATOM 1086 CB ARG A 73 -11.856 -6.210 -5.804 1.00 0.00 C ATOM 1087 CG ARG A 73 -10.610 -5.406 -5.410 1.00 0.00 C ATOM 1088 CD ARG A 73 -10.022 -4.722 -6.639 1.00 0.00 C ATOM 1089 NE ARG A 73 -9.345 -5.700 -7.499 1.00 0.00 N ATOM 1090 CZ ARG A 73 -8.737 -5.405 -8.648 1.00 0.00 C ATOM 1091 NH1 ARG A 73 -8.712 -4.157 -9.112 1.00 0.00 N ATOM 1092 NH2 ARG A 73 -8.144 -6.366 -9.345 1.00 0.00 N ATOM 0 H ARG A 73 -12.711 -5.815 -3.380 1.00 0.00 H new ATOM 0 HA ARG A 73 -12.873 -8.007 -5.309 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -11.685 -6.677 -6.774 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -12.696 -5.526 -5.923 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -10.870 -4.661 -4.658 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.868 -6.066 -4.961 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -10.814 -4.224 -7.199 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.316 -3.951 -6.330 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.339 -6.674 -7.196 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -9.163 -3.408 -8.586 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -8.242 -3.950 -9.993 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -8.155 -7.326 -9.001 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.678 -6.144 -10.225 1.00 0.00 H new ATOM 1106 N MET A 74 -10.434 -8.902 -5.136 1.00 0.00 N ATOM 1107 CA MET A 74 -9.218 -9.616 -4.796 1.00 0.00 C ATOM 1108 C MET A 74 -7.992 -8.926 -5.388 1.00 0.00 C ATOM 1109 O MET A 74 -8.009 -8.476 -6.533 1.00 0.00 O ATOM 1110 CB MET A 74 -9.321 -11.072 -5.243 1.00 0.00 C ATOM 1111 CG MET A 74 -7.982 -11.775 -5.017 1.00 0.00 C ATOM 1112 SD MET A 74 -8.100 -13.575 -4.897 1.00 0.00 S ATOM 1113 CE MET A 74 -8.848 -13.650 -3.251 1.00 0.00 C ATOM 0 H MET A 74 -10.804 -9.119 -6.062 1.00 0.00 H new ATOM 0 HA MET A 74 -9.097 -9.605 -3.713 1.00 0.00 H new ATOM 0 HB2 MET A 74 -10.108 -11.579 -4.685 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.595 -11.121 -6.297 1.00 0.00 H new ATOM 0 HG2 MET A 74 -7.308 -11.520 -5.835 1.00 0.00 H new ATOM 0 HG3 MET A 74 -7.532 -11.390 -4.102 1.00 0.00 H new ATOM 0 HE1 MET A 74 -8.312 -14.376 -2.640 1.00 0.00 H new ATOM 0 HE2 MET A 74 -8.792 -12.668 -2.781 1.00 0.00 H new ATOM 0 HE3 MET A 74 -9.892 -13.951 -3.339 1.00 0.00 H new ATOM 1123 N ILE A 75 -6.925 -8.856 -4.587 1.00 0.00 N ATOM 1124 CA ILE A 75 -5.631 -8.331 -4.984 1.00 0.00 C ATOM 1125 C ILE A 75 -4.550 -9.172 -4.310 1.00 0.00 C ATOM 1126 O ILE A 75 -4.649 -9.463 -3.116 1.00 0.00 O ATOM 1127 CB ILE A 75 -5.501 -6.853 -4.580 1.00 0.00 C ATOM 1128 CG1 ILE A 75 -6.641 -6.027 -5.196 1.00 0.00 C ATOM 1129 CG2 ILE A 75 -4.144 -6.300 -5.032 1.00 0.00 C ATOM 1130 CD1 ILE A 75 -6.651 -4.575 -4.714 1.00 0.00 C ATOM 0 H ILE A 75 -6.946 -9.174 -3.618 1.00 0.00 H new ATOM 0 HA ILE A 75 -5.522 -8.385 -6.067 1.00 0.00 H new ATOM 0 HB ILE A 75 -5.567 -6.782 -3.494 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -6.549 -6.044 -6.282 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -7.595 -6.493 -4.950 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -4.063 -5.253 -4.741 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -3.343 -6.871 -4.561 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -4.060 -6.383 -6.116 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -7.478 -4.042 -5.183 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -6.772 -4.552 -3.631 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -5.710 -4.095 -4.984 1.00 0.00 H new ATOM 1142 N ALA A 76 -3.524 -9.560 -5.068 1.00 0.00 N ATOM 1143 CA ALA A 76 -2.408 -10.363 -4.582 1.00 0.00 C ATOM 1144 C ALA A 76 -2.825 -11.641 -3.840 1.00 0.00 C ATOM 1145 O ALA A 76 -2.018 -12.212 -3.104 1.00 0.00 O ATOM 1146 CB ALA A 76 -1.476 -9.482 -3.751 1.00 0.00 C ATOM 0 H ALA A 76 -3.447 -9.319 -6.056 1.00 0.00 H new ATOM 0 HA ALA A 76 -1.871 -10.734 -5.455 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -0.640 -10.079 -3.386 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -1.098 -8.668 -4.369 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -2.024 -9.070 -2.904 1.00 0.00 H new ATOM 1152 N GLY A 77 -4.067 -12.108 -4.022 1.00 0.00 N ATOM 1153 CA GLY A 77 -4.513 -13.385 -3.480 1.00 0.00 C ATOM 1154 C GLY A 77 -5.438 -13.253 -2.270 1.00 0.00 C ATOM 1155 O GLY A 77 -5.893 -14.269 -1.753 1.00 0.00 O ATOM 0 H GLY A 77 -4.784 -11.608 -4.548 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.031 -13.940 -4.262 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -3.640 -13.973 -3.196 1.00 0.00 H new ATOM 1159 N GLN A 78 -5.723 -12.029 -1.813 1.00 0.00 N ATOM 1160 CA GLN A 78 -6.658 -11.798 -0.715 1.00 0.00 C ATOM 1161 C GLN A 78 -7.630 -10.684 -1.078 1.00 0.00 C ATOM 1162 O GLN A 78 -7.365 -9.879 -1.971 1.00 0.00 O ATOM 1163 CB GLN A 78 -5.923 -11.448 0.579 1.00 0.00 C ATOM 1164 CG GLN A 78 -5.228 -12.664 1.199 1.00 0.00 C ATOM 1165 CD GLN A 78 -3.727 -12.439 1.312 1.00 0.00 C ATOM 1166 OE1 GLN A 78 -3.196 -12.239 2.399 1.00 0.00 O ATOM 1167 NE2 GLN A 78 -3.033 -12.471 0.179 1.00 0.00 N ATOM 0 H GLN A 78 -5.312 -11.177 -2.194 1.00 0.00 H new ATOM 0 HA GLN A 78 -7.213 -12.721 -0.550 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -5.183 -10.674 0.376 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -6.631 -11.032 1.296 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -5.645 -12.860 2.187 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -5.422 -13.547 0.590 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -3.510 -12.640 -0.707 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -2.023 -12.326 0.195 1.00 0.00 H new ATOM 1176 N VAL A 79 -8.765 -10.642 -0.376 1.00 0.00 N ATOM 1177 CA VAL A 79 -9.772 -9.611 -0.576 1.00 0.00 C ATOM 1178 C VAL A 79 -9.566 -8.501 0.446 1.00 0.00 C ATOM 1179 O VAL A 79 -9.119 -8.748 1.565 1.00 0.00 O ATOM 1180 CB VAL A 79 -11.179 -10.211 -0.489 1.00 0.00 C ATOM 1181 CG1 VAL A 79 -12.258 -9.135 -0.611 1.00 0.00 C ATOM 1182 CG2 VAL A 79 -11.381 -11.213 -1.625 1.00 0.00 C ATOM 0 H VAL A 79 -9.006 -11.323 0.344 1.00 0.00 H new ATOM 0 HA VAL A 79 -9.667 -9.183 -1.573 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.268 -10.697 0.483 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.243 -9.598 -0.545 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.143 -8.411 0.195 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.159 -8.628 -1.571 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -12.382 -11.639 -1.561 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -11.263 -10.706 -2.583 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.642 -12.010 -1.543 1.00 0.00 H new ATOM 1192 N LEU A 80 -9.898 -7.275 0.050 1.00 0.00 N ATOM 1193 CA LEU A 80 -9.733 -6.089 0.869 1.00 0.00 C ATOM 1194 C LEU A 80 -11.088 -5.448 1.130 1.00 0.00 C ATOM 1195 O LEU A 80 -11.960 -5.431 0.262 1.00 0.00 O ATOM 1196 CB LEU A 80 -8.714 -5.093 0.281 1.00 0.00 C ATOM 1197 CG LEU A 80 -8.466 -5.111 -1.234 1.00 0.00 C ATOM 1198 CD1 LEU A 80 -7.784 -6.391 -1.722 1.00 0.00 C ATOM 1199 CD2 LEU A 80 -9.757 -4.881 -2.010 1.00 0.00 C ATOM 0 H LEU A 80 -10.297 -7.080 -0.868 1.00 0.00 H new ATOM 0 HA LEU A 80 -9.309 -6.397 1.825 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -9.037 -4.088 0.553 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.758 -5.265 0.776 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.778 -4.288 -1.428 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -7.639 -6.337 -2.801 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.817 -6.498 -1.231 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -8.410 -7.251 -1.482 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.547 -4.900 -3.079 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -10.472 -5.667 -1.767 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -10.176 -3.912 -1.739 1.00 0.00 H new ATOM 1211 N ASP A 81 -11.248 -4.920 2.343 1.00 0.00 N ATOM 1212 CA ASP A 81 -12.478 -4.307 2.795 1.00 0.00 C ATOM 1213 C ASP A 81 -12.344 -2.796 2.654 1.00 0.00 C ATOM 1214 O ASP A 81 -11.698 -2.147 3.479 1.00 0.00 O ATOM 1215 CB ASP A 81 -12.713 -4.728 4.250 1.00 0.00 C ATOM 1216 CG ASP A 81 -13.965 -4.085 4.845 1.00 0.00 C ATOM 1217 OD1 ASP A 81 -14.974 -3.992 4.113 1.00 0.00 O ATOM 1218 OD2 ASP A 81 -13.899 -3.692 6.030 1.00 0.00 O ATOM 0 H ASP A 81 -10.508 -4.911 3.045 1.00 0.00 H new ATOM 0 HA ASP A 81 -13.334 -4.627 2.201 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -12.805 -5.813 4.302 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -11.846 -4.453 4.850 1.00 0.00 H new ATOM 1223 N ILE A 82 -12.950 -2.237 1.607 1.00 0.00 N ATOM 1224 CA ILE A 82 -12.836 -0.822 1.306 1.00 0.00 C ATOM 1225 C ILE A 82 -14.082 -0.097 1.793 1.00 0.00 C ATOM 1226 O ILE A 82 -15.197 -0.595 1.643 1.00 0.00 O ATOM 1227 CB ILE A 82 -12.600 -0.644 -0.194 1.00 0.00 C ATOM 1228 CG1 ILE A 82 -11.316 -1.369 -0.607 1.00 0.00 C ATOM 1229 CG2 ILE A 82 -12.494 0.838 -0.548 1.00 0.00 C ATOM 1230 CD1 ILE A 82 -11.239 -1.524 -2.125 1.00 0.00 C ATOM 0 H ILE A 82 -13.531 -2.756 0.949 1.00 0.00 H new ATOM 0 HA ILE A 82 -11.984 -0.384 1.826 1.00 0.00 H new ATOM 0 HB ILE A 82 -13.446 -1.071 -0.733 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -10.449 -0.813 -0.250 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -11.281 -2.351 -0.135 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -12.326 0.945 -1.620 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -13.419 1.345 -0.273 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -11.661 1.283 -0.004 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -10.318 -2.042 -2.392 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -12.094 -2.101 -2.476 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -11.250 -0.539 -2.592 1.00 0.00 H new ATOM 1242 N ASN A 83 -13.897 1.086 2.382 1.00 0.00 N ATOM 1243 CA ASN A 83 -14.999 1.822 2.978 1.00 0.00 C ATOM 1244 C ASN A 83 -14.663 3.309 3.070 1.00 0.00 C ATOM 1245 O ASN A 83 -13.500 3.698 2.968 1.00 0.00 O ATOM 1246 CB ASN A 83 -15.265 1.235 4.372 1.00 0.00 C ATOM 1247 CG ASN A 83 -16.636 1.622 4.909 1.00 0.00 C ATOM 1248 OD1 ASN A 83 -17.619 0.933 4.661 1.00 0.00 O ATOM 1249 ND2 ASN A 83 -16.727 2.725 5.649 1.00 0.00 N ATOM 0 H ASN A 83 -12.992 1.550 2.456 1.00 0.00 H new ATOM 0 HA ASN A 83 -15.892 1.728 2.360 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -15.188 0.149 4.327 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -14.496 1.581 5.062 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -17.630 3.014 6.024 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -15.893 3.281 5.841 1.00 0.00 H new ATOM 1256 N LEU A 84 -15.687 4.145 3.268 1.00 0.00 N ATOM 1257 CA LEU A 84 -15.495 5.563 3.527 1.00 0.00 C ATOM 1258 C LEU A 84 -14.778 5.700 4.869 1.00 0.00 C ATOM 1259 O LEU A 84 -15.008 4.896 5.771 1.00 0.00 O ATOM 1260 CB LEU A 84 -16.864 6.256 3.548 1.00 0.00 C ATOM 1261 CG LEU A 84 -16.990 7.444 2.590 1.00 0.00 C ATOM 1262 CD1 LEU A 84 -16.023 8.553 2.985 1.00 0.00 C ATOM 1263 CD2 LEU A 84 -16.720 7.043 1.141 1.00 0.00 C ATOM 0 H LEU A 84 -16.664 3.854 3.252 1.00 0.00 H new ATOM 0 HA LEU A 84 -14.892 6.035 2.751 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -17.632 5.523 3.300 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -17.067 6.600 4.562 1.00 0.00 H new ATOM 0 HG LEU A 84 -18.017 7.801 2.663 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -16.126 9.389 2.293 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -16.249 8.889 3.997 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -15.001 8.175 2.948 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -16.820 7.917 0.497 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -15.709 6.644 1.056 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -17.437 6.282 0.834 1.00 0.00 H new ATOM 1275 N ALA A 85 -13.909 6.703 5.024 1.00 0.00 N ATOM 1276 CA ALA A 85 -13.079 6.808 6.214 1.00 0.00 C ATOM 1277 C ALA A 85 -13.812 7.416 7.410 1.00 0.00 C ATOM 1278 O ALA A 85 -13.231 7.537 8.485 1.00 0.00 O ATOM 1279 CB ALA A 85 -11.817 7.590 5.887 1.00 0.00 C ATOM 0 H ALA A 85 -13.767 7.447 4.341 1.00 0.00 H new ATOM 0 HA ALA A 85 -12.814 5.795 6.517 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -11.196 7.668 6.779 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -11.262 7.075 5.103 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -12.087 8.589 5.544 1.00 0.00 H new ATOM 1285 N ALA A 86 -15.075 7.797 7.232 1.00 0.00 N ATOM 1286 CA ALA A 86 -15.887 8.345 8.304 1.00 0.00 C ATOM 1287 C ALA A 86 -17.205 7.578 8.447 1.00 0.00 C ATOM 1288 O ALA A 86 -18.117 8.045 9.125 1.00 0.00 O ATOM 1289 CB ALA A 86 -16.123 9.831 8.038 1.00 0.00 C ATOM 0 H ALA A 86 -15.560 7.732 6.337 1.00 0.00 H new ATOM 0 HA ALA A 86 -15.360 8.236 9.252 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -16.732 10.252 8.838 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -15.165 10.350 8.000 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -16.640 9.953 7.086 1.00 0.00 H new ATOM 1295 N GLU A 87 -17.304 6.406 7.810 1.00 0.00 N ATOM 1296 CA GLU A 87 -18.534 5.625 7.813 1.00 0.00 C ATOM 1297 C GLU A 87 -18.286 4.132 8.053 1.00 0.00 C ATOM 1298 O GLU A 87 -18.820 3.309 7.313 1.00 0.00 O ATOM 1299 CB GLU A 87 -19.300 5.840 6.506 1.00 0.00 C ATOM 1300 CG GLU A 87 -19.589 7.323 6.250 1.00 0.00 C ATOM 1301 CD GLU A 87 -20.487 7.521 5.030 1.00 0.00 C ATOM 1302 OE1 GLU A 87 -20.676 6.551 4.267 1.00 0.00 O ATOM 1303 OE2 GLU A 87 -20.985 8.657 4.863 1.00 0.00 O ATOM 0 H GLU A 87 -16.540 5.981 7.285 1.00 0.00 H new ATOM 0 HA GLU A 87 -19.137 5.980 8.648 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -18.722 5.434 5.676 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -20.239 5.288 6.541 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -20.067 7.758 7.128 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -18.650 7.856 6.101 1.00 0.00 H new ATOM 1310 N PRO A 88 -17.489 3.753 9.064 1.00 0.00 N ATOM 1311 CA PRO A 88 -17.179 2.363 9.340 1.00 0.00 C ATOM 1312 C PRO A 88 -18.430 1.598 9.767 1.00 0.00 C ATOM 1313 O PRO A 88 -19.279 2.129 10.481 1.00 0.00 O ATOM 1314 CB PRO A 88 -16.131 2.389 10.454 1.00 0.00 C ATOM 1315 CG PRO A 88 -16.413 3.711 11.172 1.00 0.00 C ATOM 1316 CD PRO A 88 -16.846 4.625 10.027 1.00 0.00 C ATOM 0 HA PRO A 88 -16.803 1.850 8.455 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -16.236 1.536 11.125 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -15.118 2.357 10.054 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -17.195 3.605 11.924 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.529 4.092 11.683 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.531 5.397 10.377 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -15.990 5.135 9.586 1.00 0.00 H new ATOM 1324 N LYS A 89 -18.536 0.342 9.319 1.00 0.00 N ATOM 1325 CA LYS A 89 -19.667 -0.533 9.618 1.00 0.00 C ATOM 1326 C LYS A 89 -19.194 -1.949 9.946 1.00 0.00 C ATOM 1327 O LYS A 89 -20.011 -2.830 10.209 1.00 0.00 O ATOM 1328 CB LYS A 89 -20.615 -0.576 8.419 1.00 0.00 C ATOM 1329 CG LYS A 89 -21.210 0.800 8.123 1.00 0.00 C ATOM 1330 CD LYS A 89 -22.108 0.709 6.892 1.00 0.00 C ATOM 1331 CE LYS A 89 -22.683 2.087 6.573 1.00 0.00 C ATOM 1332 NZ LYS A 89 -23.549 2.041 5.379 1.00 0.00 N ATOM 0 H LYS A 89 -17.828 -0.098 8.731 1.00 0.00 H new ATOM 0 HA LYS A 89 -20.188 -0.133 10.488 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.077 -0.937 7.542 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -21.418 -1.286 8.615 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.784 1.153 8.980 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -20.413 1.524 7.953 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -21.538 0.336 6.041 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -22.916 -0.001 7.071 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -23.255 2.452 7.426 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -21.870 2.794 6.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -23.925 2.991 5.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -22.995 1.715 4.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -24.337 1.384 5.547 1.00 0.00 H new ATOM 1346 N VAL A 90 -17.876 -2.167 9.934 1.00 0.00 N ATOM 1347 CA VAL A 90 -17.279 -3.474 10.173 1.00 0.00 C ATOM 1348 C VAL A 90 -16.606 -3.495 11.540 1.00 0.00 C ATOM 1349 O VAL A 90 -16.184 -2.459 12.054 1.00 0.00 O ATOM 1350 CB VAL A 90 -16.325 -3.819 9.024 1.00 0.00 C ATOM 1351 CG1 VAL A 90 -15.709 -5.207 9.194 1.00 0.00 C ATOM 1352 CG2 VAL A 90 -17.085 -3.806 7.698 1.00 0.00 C ATOM 0 H VAL A 90 -17.192 -1.432 9.756 1.00 0.00 H new ATOM 0 HA VAL A 90 -18.047 -4.247 10.193 1.00 0.00 H new ATOM 0 HB VAL A 90 -15.531 -3.072 9.031 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -15.039 -5.413 8.359 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -15.147 -5.244 10.127 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -16.501 -5.956 9.217 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -16.402 -4.052 6.885 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -17.889 -4.542 7.732 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -17.507 -2.815 7.530 1.00 0.00 H new ATOM 1362 N ASN A 91 -16.504 -4.689 12.129 1.00 0.00 N ATOM 1363 CA ASN A 91 -16.016 -4.871 13.489 1.00 0.00 C ATOM 1364 C ASN A 91 -14.493 -4.764 13.585 1.00 0.00 C ATOM 1365 O ASN A 91 -13.939 -4.919 14.672 1.00 0.00 O ATOM 1366 CB ASN A 91 -16.478 -6.232 14.021 1.00 0.00 C ATOM 1367 CG ASN A 91 -17.906 -6.557 13.611 1.00 0.00 C ATOM 1368 OD1 ASN A 91 -18.857 -6.256 14.328 1.00 0.00 O ATOM 1369 ND2 ASN A 91 -18.058 -7.178 12.445 1.00 0.00 N ATOM 0 H ASN A 91 -16.761 -5.561 11.667 1.00 0.00 H new ATOM 0 HA ASN A 91 -16.432 -4.067 14.096 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -15.810 -7.010 13.651 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -16.404 -6.239 15.108 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -18.992 -7.423 12.115 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -17.241 -7.410 11.880 1.00 0.00 H new ATOM 1376 N ARG A 92 -13.821 -4.508 12.458 1.00 0.00 N ATOM 1377 CA ARG A 92 -12.368 -4.491 12.361 1.00 0.00 C ATOM 1378 C ARG A 92 -11.757 -5.721 13.030 1.00 0.00 C ATOM 1379 O ARG A 92 -10.805 -5.620 13.802 1.00 0.00 O ATOM 1380 CB ARG A 92 -11.795 -3.177 12.896 1.00 0.00 C ATOM 1381 CG ARG A 92 -12.219 -2.023 11.984 1.00 0.00 C ATOM 1382 CD ARG A 92 -11.507 -0.727 12.370 1.00 0.00 C ATOM 1383 NE ARG A 92 -11.829 -0.324 13.742 1.00 0.00 N ATOM 1384 CZ ARG A 92 -10.945 -0.223 14.737 1.00 0.00 C ATOM 1385 NH1 ARG A 92 -9.658 -0.496 14.550 1.00 0.00 N ATOM 1386 NH2 ARG A 92 -11.355 0.155 15.946 1.00 0.00 N ATOM 0 H ARG A 92 -14.286 -4.304 11.574 1.00 0.00 H new ATOM 0 HA ARG A 92 -12.093 -4.543 11.308 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.150 -3.001 13.911 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -10.708 -3.235 12.944 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -11.991 -2.272 10.948 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -13.298 -1.882 12.048 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -10.430 -0.860 12.272 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -11.794 0.066 11.680 1.00 0.00 H new ATOM 0 HE ARG A 92 -12.803 -0.104 13.952 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -9.327 -0.790 13.631 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -9.001 -0.412 15.326 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -12.340 0.366 16.108 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -10.684 0.234 16.710 1.00 0.00 H new ATOM 1400 N GLY A 93 -12.322 -6.892 12.721 1.00 0.00 N ATOM 1401 CA GLY A 93 -11.918 -8.164 13.301 1.00 0.00 C ATOM 1402 C GLY A 93 -10.567 -8.670 12.804 1.00 0.00 C ATOM 1403 O GLY A 93 -10.191 -9.800 13.111 1.00 0.00 O ATOM 0 H GLY A 93 -13.085 -6.978 12.049 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -11.880 -8.062 14.386 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -12.679 -8.912 13.078 1.00 0.00 H new ATOM 1407 N LYS A 94 -9.841 -7.843 12.043 1.00 0.00 N ATOM 1408 CA LYS A 94 -8.530 -8.154 11.480 1.00 0.00 C ATOM 1409 C LYS A 94 -8.518 -9.376 10.560 1.00 0.00 C ATOM 1410 O LYS A 94 -7.454 -9.781 10.093 1.00 0.00 O ATOM 1411 CB LYS A 94 -7.501 -8.269 12.608 1.00 0.00 C ATOM 1412 CG LYS A 94 -7.500 -7.009 13.478 1.00 0.00 C ATOM 1413 CD LYS A 94 -6.379 -7.055 14.516 1.00 0.00 C ATOM 1414 CE LYS A 94 -6.517 -8.250 15.459 1.00 0.00 C ATOM 1415 NZ LYS A 94 -7.747 -8.163 16.270 1.00 0.00 N ATOM 0 H LYS A 94 -10.165 -6.908 11.796 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.257 -7.325 10.827 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -7.726 -9.140 13.223 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -6.508 -8.425 12.186 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -7.379 -6.128 12.847 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -8.462 -6.911 13.982 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -5.416 -7.105 14.007 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -6.385 -6.133 15.097 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.528 -9.173 14.879 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -5.649 -8.297 16.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -7.742 -8.913 16.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -7.790 -7.235 16.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -8.577 -8.279 15.655 1.00 0.00 H new ATOM 1429 N ALA A 95 -9.682 -9.966 10.287 1.00 0.00 N ATOM 1430 CA ALA A 95 -9.814 -11.083 9.368 1.00 0.00 C ATOM 1431 C ALA A 95 -11.241 -11.133 8.820 1.00 0.00 C ATOM 1432 O ALA A 95 -12.180 -10.690 9.480 1.00 0.00 O ATOM 1433 CB ALA A 95 -9.485 -12.386 10.101 1.00 0.00 C ATOM 0 H ALA A 95 -10.566 -9.674 10.705 1.00 0.00 H new ATOM 0 HA ALA A 95 -9.121 -10.956 8.536 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -9.584 -13.225 9.413 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -8.463 -12.344 10.478 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -10.174 -12.518 10.935 1.00 0.00 H new ATOM 1439 N GLY A 96 -11.405 -11.676 7.611 1.00 0.00 N ATOM 1440 CA GLY A 96 -12.715 -11.825 6.989 1.00 0.00 C ATOM 1441 C GLY A 96 -13.508 -12.974 7.608 1.00 0.00 C ATOM 1442 O GLY A 96 -14.645 -13.227 7.213 1.00 0.00 O ATOM 0 H GLY A 96 -10.634 -12.022 7.041 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -13.276 -10.897 7.096 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -12.592 -12.002 5.920 1.00 0.00 H new ATOM 1446 N VAL A 97 -12.905 -13.670 8.577 1.00 0.00 N ATOM 1447 CA VAL A 97 -13.523 -14.805 9.252 1.00 0.00 C ATOM 1448 C VAL A 97 -14.514 -14.332 10.314 1.00 0.00 C ATOM 1449 O VAL A 97 -15.424 -15.067 10.693 1.00 0.00 O ATOM 1450 CB VAL A 97 -12.414 -15.646 9.891 1.00 0.00 C ATOM 1451 CG1 VAL A 97 -12.983 -16.904 10.544 1.00 0.00 C ATOM 1452 CG2 VAL A 97 -11.396 -16.071 8.830 1.00 0.00 C ATOM 0 H VAL A 97 -11.966 -13.456 8.914 1.00 0.00 H new ATOM 0 HA VAL A 97 -14.078 -15.404 8.530 1.00 0.00 H new ATOM 0 HB VAL A 97 -11.933 -15.031 10.652 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -12.173 -17.481 10.989 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -13.695 -16.621 11.319 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -13.488 -17.509 9.790 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -10.612 -16.668 9.296 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -11.895 -16.663 8.063 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -10.954 -15.185 8.374 1.00 0.00 H new ATOM 1462 N LYS A 98 -14.337 -13.099 10.797 1.00 0.00 N ATOM 1463 CA LYS A 98 -15.193 -12.526 11.823 1.00 0.00 C ATOM 1464 C LYS A 98 -16.513 -12.049 11.224 1.00 0.00 C ATOM 1465 O LYS A 98 -16.578 -11.705 10.044 1.00 0.00 O ATOM 1466 CB LYS A 98 -14.455 -11.387 12.530 1.00 0.00 C ATOM 1467 CG LYS A 98 -13.179 -11.872 13.228 1.00 0.00 C ATOM 1468 CD LYS A 98 -13.482 -12.927 14.296 1.00 0.00 C ATOM 1469 CE LYS A 98 -12.196 -13.307 15.023 1.00 0.00 C ATOM 1470 NZ LYS A 98 -12.451 -14.319 16.065 1.00 0.00 N ATOM 0 H LYS A 98 -13.594 -12.475 10.483 1.00 0.00 H new ATOM 0 HA LYS A 98 -15.432 -13.293 12.560 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -14.199 -10.615 11.804 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -15.117 -10.927 13.264 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -12.496 -12.289 12.488 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -12.671 -11.024 13.688 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -14.212 -12.540 15.007 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -13.924 -13.810 13.834 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -11.471 -13.694 14.307 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -11.755 -12.419 15.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -11.559 -14.558 16.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -13.125 -13.939 16.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -12.850 -15.174 15.628 1.00 0.00 H new ATOM 1484 N ARG A 99 -17.561 -12.035 12.049 1.00 0.00 N ATOM 1485 CA ARG A 99 -18.921 -11.689 11.648 1.00 0.00 C ATOM 1486 C ARG A 99 -19.552 -10.735 12.662 1.00 0.00 C ATOM 1487 O ARG A 99 -18.969 -10.466 13.710 1.00 0.00 O ATOM 1488 CB ARG A 99 -19.739 -12.982 11.548 1.00 0.00 C ATOM 1489 CG ARG A 99 -20.475 -13.140 10.217 1.00 0.00 C ATOM 1490 CD ARG A 99 -19.490 -13.444 9.089 1.00 0.00 C ATOM 1491 NE ARG A 99 -18.877 -12.227 8.543 1.00 0.00 N ATOM 1492 CZ ARG A 99 -19.450 -11.420 7.648 1.00 0.00 C ATOM 1493 NH1 ARG A 99 -20.666 -11.677 7.170 1.00 0.00 N ATOM 1494 NH2 ARG A 99 -18.799 -10.339 7.225 1.00 0.00 N ATOM 0 H ARG A 99 -17.483 -12.270 13.038 1.00 0.00 H new ATOM 0 HA ARG A 99 -18.905 -11.184 10.682 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -19.074 -13.834 11.689 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -20.465 -13.006 12.360 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -21.207 -13.944 10.294 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -21.026 -12.227 9.990 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -18.708 -14.107 9.461 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -20.007 -13.977 8.291 1.00 0.00 H new ATOM 0 HE ARG A 99 -17.944 -11.980 8.872 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -21.175 -12.502 7.488 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -21.088 -11.049 6.486 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -17.867 -10.131 7.585 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -19.232 -9.718 6.541 1.00 0.00 H new ATOM 1508 N SER A 100 -20.747 -10.226 12.344 1.00 0.00 N ATOM 1509 CA SER A 100 -21.493 -9.365 13.248 1.00 0.00 C ATOM 1510 C SER A 100 -22.037 -10.211 14.395 1.00 0.00 C ATOM 1511 O SER A 100 -22.282 -11.400 14.217 1.00 0.00 O ATOM 1512 CB SER A 100 -22.632 -8.689 12.490 1.00 0.00 C ATOM 1513 OG SER A 100 -23.387 -7.884 13.372 1.00 0.00 O ATOM 0 H SER A 100 -21.216 -10.402 11.456 1.00 0.00 H new ATOM 0 HA SER A 100 -20.843 -8.589 13.652 1.00 0.00 H new ATOM 0 HB2 SER A 100 -22.230 -8.079 11.681 1.00 0.00 H new ATOM 0 HB3 SER A 100 -23.273 -9.442 12.033 1.00 0.00 H new ATOM 0 HG SER A 100 -24.115 -7.452 12.878 1.00 0.00 H new ATOM 1519 N ALA A 101 -22.229 -9.605 15.570 1.00 0.00 N ATOM 1520 CA ALA A 101 -22.664 -10.324 16.761 1.00 0.00 C ATOM 1521 C ALA A 101 -24.082 -10.885 16.617 1.00 0.00 C ATOM 1522 O ALA A 101 -24.571 -11.562 17.521 1.00 0.00 O ATOM 1523 CB ALA A 101 -22.561 -9.387 17.966 1.00 0.00 C ATOM 0 H ALA A 101 -22.087 -8.606 15.718 1.00 0.00 H new ATOM 0 HA ALA A 101 -22.012 -11.185 16.905 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -22.884 -9.913 18.864 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -21.528 -9.062 18.087 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -23.198 -8.517 17.806 1.00 0.00 H new ATOM 1529 N ALA A 102 -24.743 -10.610 15.488 1.00 0.00 N ATOM 1530 CA ALA A 102 -26.078 -11.107 15.196 1.00 0.00 C ATOM 1531 C ALA A 102 -26.060 -12.108 14.042 1.00 0.00 C ATOM 1532 O ALA A 102 -27.074 -12.739 13.745 1.00 0.00 O ATOM 1533 CB ALA A 102 -26.958 -9.914 14.848 1.00 0.00 C ATOM 0 H ALA A 102 -24.355 -10.028 14.746 1.00 0.00 H new ATOM 0 HA ALA A 102 -26.470 -11.630 16.068 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -27.967 -10.259 14.624 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -26.989 -9.226 15.693 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -26.549 -9.401 13.978 1.00 0.00 H new ATOM 1539 N GLU A 103 -24.905 -12.254 13.386 1.00 0.00 N ATOM 1540 CA GLU A 103 -24.750 -13.096 12.206 1.00 0.00 C ATOM 1541 C GLU A 103 -23.708 -14.188 12.432 1.00 0.00 C ATOM 1542 O GLU A 103 -23.346 -14.906 11.501 1.00 0.00 O ATOM 1543 CB GLU A 103 -24.371 -12.230 11.001 1.00 0.00 C ATOM 1544 CG GLU A 103 -25.409 -11.136 10.735 1.00 0.00 C ATOM 1545 CD GLU A 103 -26.783 -11.709 10.385 1.00 0.00 C ATOM 1546 OE1 GLU A 103 -26.822 -12.707 9.630 1.00 0.00 O ATOM 1547 OE2 GLU A 103 -27.789 -11.147 10.876 1.00 0.00 O ATOM 0 H GLU A 103 -24.044 -11.784 13.666 1.00 0.00 H new ATOM 0 HA GLU A 103 -25.702 -13.590 12.009 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -23.397 -11.772 11.175 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -24.273 -12.860 10.117 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -25.497 -10.501 11.616 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -25.064 -10.502 9.918 1.00 0.00 H new ATOM 1554 N MET A 104 -23.213 -14.323 13.667 1.00 0.00 N ATOM 1555 CA MET A 104 -22.179 -15.309 13.967 1.00 0.00 C ATOM 1556 C MET A 104 -22.712 -16.740 13.894 1.00 0.00 C ATOM 1557 O MET A 104 -21.943 -17.672 13.664 1.00 0.00 O ATOM 1558 CB MET A 104 -21.598 -15.059 15.361 1.00 0.00 C ATOM 1559 CG MET A 104 -20.941 -13.685 15.457 1.00 0.00 C ATOM 1560 SD MET A 104 -19.520 -13.614 16.571 1.00 0.00 S ATOM 1561 CE MET A 104 -18.393 -14.650 15.606 1.00 0.00 C ATOM 0 H MET A 104 -23.511 -13.765 14.467 1.00 0.00 H new ATOM 0 HA MET A 104 -21.401 -15.197 13.212 1.00 0.00 H new ATOM 0 HB2 MET A 104 -22.390 -15.137 16.105 1.00 0.00 H new ATOM 0 HB3 MET A 104 -20.865 -15.831 15.594 1.00 0.00 H new ATOM 0 HG2 MET A 104 -20.622 -13.378 14.461 1.00 0.00 H new ATOM 0 HG3 MET A 104 -21.685 -12.962 15.791 1.00 0.00 H new ATOM 0 HE1 MET A 104 -17.363 -14.370 15.827 1.00 0.00 H new ATOM 0 HE2 MET A 104 -18.548 -15.697 15.866 1.00 0.00 H new ATOM 0 HE3 MET A 104 -18.588 -14.508 14.543 1.00 0.00 H new ATOM 1571 N TYR A 105 -24.022 -16.917 14.088 1.00 0.00 N ATOM 1572 CA TYR A 105 -24.660 -18.231 14.062 1.00 0.00 C ATOM 1573 C TYR A 105 -26.018 -18.192 13.360 1.00 0.00 C ATOM 1574 O TYR A 105 -26.662 -19.229 13.201 1.00 0.00 O ATOM 1575 CB TYR A 105 -24.831 -18.732 15.496 1.00 0.00 C ATOM 1576 CG TYR A 105 -23.534 -18.887 16.259 1.00 0.00 C ATOM 1577 CD1 TYR A 105 -23.006 -17.797 16.966 1.00 0.00 C ATOM 1578 CD2 TYR A 105 -22.861 -20.118 16.259 1.00 0.00 C ATOM 1579 CE1 TYR A 105 -21.804 -17.935 17.678 1.00 0.00 C ATOM 1580 CE2 TYR A 105 -21.657 -20.262 16.964 1.00 0.00 C ATOM 1581 CZ TYR A 105 -21.125 -19.170 17.682 1.00 0.00 C ATOM 1582 OH TYR A 105 -19.959 -19.307 18.374 1.00 0.00 O ATOM 0 H TYR A 105 -24.669 -16.149 14.268 1.00 0.00 H new ATOM 0 HA TYR A 105 -24.020 -18.909 13.498 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -25.476 -18.039 16.036 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -25.343 -19.694 15.474 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -23.525 -16.850 16.963 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -23.271 -20.956 15.715 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -21.400 -17.095 18.223 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -21.137 -21.209 16.957 1.00 0.00 H new ATOM 0 HH TYR A 105 -19.624 -20.222 18.272 1.00 0.00 H new ATOM 1592 N GLY A 106 -26.454 -17.001 12.942 1.00 0.00 N ATOM 1593 CA GLY A 106 -27.721 -16.813 12.246 1.00 0.00 C ATOM 1594 C GLY A 106 -27.695 -17.464 10.867 1.00 0.00 C ATOM 1595 O GLY A 106 -26.688 -18.052 10.479 1.00 0.00 O ATOM 1596 OXT GLY A 106 -28.662 -17.416 10.126 1.00 0.00 O ATOM 0 H GLY A 106 -25.931 -16.136 13.080 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -28.531 -17.240 12.838 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -27.928 -15.748 12.144 1.00 0.00 H new TER 1600 GLY A 106 ATOM 1601 O5' A B 1 4.134 -14.227 8.724 1.00 0.00 O ATOM 1602 C5' A B 1 3.559 -13.033 8.230 1.00 0.00 C ATOM 1603 C4' A B 1 3.803 -11.895 9.226 1.00 0.00 C ATOM 1604 O4' A B 1 5.176 -11.545 9.257 1.00 0.00 O ATOM 1605 C3' A B 1 3.098 -10.627 8.756 1.00 0.00 C ATOM 1606 O3' A B 1 2.976 -9.702 9.822 1.00 0.00 O ATOM 1607 C2' A B 1 4.075 -10.125 7.706 1.00 0.00 C ATOM 1608 O2' A B 1 4.003 -8.721 7.558 1.00 0.00 O ATOM 1609 C1' A B 1 5.425 -10.570 8.256 1.00 0.00 C ATOM 1610 N9 A B 1 6.285 -11.058 7.150 1.00 0.00 N ATOM 1611 C8 A B 1 6.606 -10.398 5.989 1.00 0.00 C ATOM 1612 N7 A B 1 7.387 -11.066 5.186 1.00 0.00 N ATOM 1613 C5 A B 1 7.608 -12.262 5.869 1.00 0.00 C ATOM 1614 C6 A B 1 8.364 -13.416 5.570 1.00 0.00 C ATOM 1615 N6 A B 1 9.069 -13.570 4.445 1.00 0.00 N ATOM 1616 N1 A B 1 8.379 -14.420 6.454 1.00 0.00 N ATOM 1617 C2 A B 1 7.691 -14.289 7.579 1.00 0.00 C ATOM 1618 N3 A B 1 6.950 -13.267 7.986 1.00 0.00 N ATOM 1619 C4 A B 1 6.945 -12.267 7.068 1.00 0.00 C ATOM 0 H5' A B 1 2.489 -13.170 8.074 1.00 0.00 H new ATOM 0 H5'' A B 1 3.993 -12.782 7.262 1.00 0.00 H new ATOM 0 H4' A B 1 3.444 -12.242 10.195 1.00 0.00 H new ATOM 0 H3' A B 1 2.083 -10.778 8.388 1.00 0.00 H new ATOM 0 H2' A B 1 3.873 -10.516 6.709 1.00 0.00 H new ATOM 0 HO2' A B 1 3.764 -8.313 8.417 1.00 0.00 H new ATOM 0 HO5' A B 1 5.106 -14.195 8.607 1.00 0.00 H new ATOM 0 H1' A B 1 5.973 -9.746 8.713 1.00 0.00 H new ATOM 0 H8 A B 1 6.242 -9.407 5.760 1.00 0.00 H new ATOM 0 H61 A B 1 9.596 -14.429 4.287 1.00 0.00 H new ATOM 0 H62 A B 1 9.080 -12.829 3.745 1.00 0.00 H new ATOM 0 H2 A B 1 7.740 -15.129 8.257 1.00 0.00 H new ATOM 1631 P U B 2 1.734 -9.777 10.834 1.00 0.00 P ATOM 1632 OP1 U B 2 2.017 -8.894 11.990 1.00 0.00 O ATOM 1633 OP2 U B 2 1.390 -11.200 11.062 1.00 0.00 O ATOM 1634 O5' U B 2 0.552 -9.110 9.966 1.00 0.00 O ATOM 1635 C5' U B 2 0.513 -7.714 9.749 1.00 0.00 C ATOM 1636 C4' U B 2 -0.739 -7.310 8.962 1.00 0.00 C ATOM 1637 O4' U B 2 -0.595 -7.649 7.587 1.00 0.00 O ATOM 1638 C3' U B 2 -1.979 -8.027 9.500 1.00 0.00 C ATOM 1639 O3' U B 2 -3.100 -7.170 9.434 1.00 0.00 O ATOM 1640 C2' U B 2 -2.111 -9.183 8.518 1.00 0.00 C ATOM 1641 O2' U B 2 -3.439 -9.665 8.428 1.00 0.00 O ATOM 1642 C1' U B 2 -1.623 -8.555 7.223 1.00 0.00 C ATOM 1643 N1 U B 2 -1.129 -9.626 6.334 1.00 0.00 N ATOM 1644 C2 U B 2 -1.910 -9.995 5.245 1.00 0.00 C ATOM 1645 O2 U B 2 -2.941 -9.401 4.937 1.00 0.00 O ATOM 1646 N3 U B 2 -1.464 -11.077 4.508 1.00 0.00 N ATOM 1647 C4 U B 2 -0.309 -11.804 4.756 1.00 0.00 C ATOM 1648 O4 U B 2 -0.017 -12.767 4.053 1.00 0.00 O ATOM 1649 C5 U B 2 0.467 -11.318 5.877 1.00 0.00 C ATOM 1650 C6 U B 2 0.055 -10.257 6.606 1.00 0.00 C ATOM 0 H5' U B 2 1.404 -7.403 9.204 1.00 0.00 H new ATOM 0 H5'' U B 2 0.527 -7.194 10.707 1.00 0.00 H new ATOM 0 H4' U B 2 -0.858 -6.232 9.074 1.00 0.00 H new ATOM 0 H3' U B 2 -1.909 -8.342 10.541 1.00 0.00 H new ATOM 0 H2' U B 2 -1.546 -10.069 8.806 1.00 0.00 H new ATOM 0 HO2' U B 2 -4.065 -8.942 8.642 1.00 0.00 H new ATOM 0 H1' U B 2 -2.408 -8.024 6.684 1.00 0.00 H new ATOM 0 H3 U B 2 -2.034 -11.366 3.713 1.00 0.00 H new ATOM 0 H5 U B 2 1.392 -11.812 6.136 1.00 0.00 H new ATOM 0 H6 U B 2 0.671 -9.900 7.418 1.00 0.00 H new ATOM 1661 P U B 3 -3.419 -6.168 10.647 1.00 0.00 P ATOM 1662 OP1 U B 3 -2.143 -5.569 11.099 1.00 0.00 O ATOM 1663 OP2 U B 3 -4.273 -6.885 11.621 1.00 0.00 O ATOM 1664 O5' U B 3 -4.295 -5.006 9.966 1.00 0.00 O ATOM 1665 C5' U B 3 -5.565 -5.284 9.413 1.00 0.00 C ATOM 1666 C4' U B 3 -6.272 -3.964 9.109 1.00 0.00 C ATOM 1667 O4' U B 3 -7.337 -4.189 8.198 1.00 0.00 O ATOM 1668 C3' U B 3 -6.839 -3.374 10.403 1.00 0.00 C ATOM 1669 O3' U B 3 -6.681 -1.969 10.417 1.00 0.00 O ATOM 1670 C2' U B 3 -8.302 -3.801 10.294 1.00 0.00 C ATOM 1671 O2' U B 3 -9.199 -2.942 10.966 1.00 0.00 O ATOM 1672 C1' U B 3 -8.548 -3.764 8.795 1.00 0.00 C ATOM 1673 N1 U B 3 -9.680 -4.651 8.454 1.00 0.00 N ATOM 1674 C2 U B 3 -10.829 -4.086 7.919 1.00 0.00 C ATOM 1675 O2 U B 3 -10.926 -2.885 7.689 1.00 0.00 O ATOM 1676 N3 U B 3 -11.877 -4.950 7.651 1.00 0.00 N ATOM 1677 C4 U B 3 -11.883 -6.313 7.895 1.00 0.00 C ATOM 1678 O4 U B 3 -12.876 -6.989 7.643 1.00 0.00 O ATOM 1679 C5 U B 3 -10.646 -6.816 8.451 1.00 0.00 C ATOM 1680 C6 U B 3 -9.602 -5.991 8.694 1.00 0.00 C ATOM 0 H5' U B 3 -6.158 -5.877 10.109 1.00 0.00 H new ATOM 0 H5'' U B 3 -5.459 -5.873 8.502 1.00 0.00 H new ATOM 0 H4' U B 3 -5.555 -3.270 8.671 1.00 0.00 H new ATOM 0 H3' U B 3 -6.357 -3.707 11.322 1.00 0.00 H new ATOM 0 H2' U B 3 -8.473 -4.771 10.761 1.00 0.00 H new ATOM 0 HO2' U B 3 -8.742 -2.520 11.724 1.00 0.00 H new ATOM 0 H1' U B 3 -8.818 -2.771 8.436 1.00 0.00 H new ATOM 0 H3 U B 3 -12.718 -4.547 7.238 1.00 0.00 H new ATOM 0 H5 U B 3 -10.554 -7.868 8.676 1.00 0.00 H new ATOM 0 H6 U B 3 -8.685 -6.403 9.088 1.00 0.00 H new ATOM 1691 P U B 4 -6.624 -1.175 11.823 1.00 0.00 P ATOM 1692 OP1 U B 4 -5.436 -1.646 12.569 1.00 0.00 O ATOM 1693 OP2 U B 4 -7.959 -1.258 12.458 1.00 0.00 O ATOM 1694 O5' U B 4 -6.370 0.358 11.402 1.00 0.00 O ATOM 1695 C5' U B 4 -7.342 1.068 10.665 1.00 0.00 C ATOM 1696 C4' U B 4 -7.017 2.564 10.620 1.00 0.00 C ATOM 1697 O4' U B 4 -7.905 3.159 9.688 1.00 0.00 O ATOM 1698 C3' U B 4 -7.280 3.217 11.982 1.00 0.00 C ATOM 1699 O3' U B 4 -6.519 4.401 12.151 1.00 0.00 O ATOM 1700 C2' U B 4 -8.750 3.582 11.847 1.00 0.00 C ATOM 1701 O2' U B 4 -9.135 4.625 12.719 1.00 0.00 O ATOM 1702 C1' U B 4 -8.812 3.994 10.385 1.00 0.00 C ATOM 1703 N1 U B 4 -10.197 3.910 9.865 1.00 0.00 N ATOM 1704 C2 U B 4 -10.788 5.089 9.434 1.00 0.00 C ATOM 1705 O2 U B 4 -10.210 6.171 9.457 1.00 0.00 O ATOM 1706 N3 U B 4 -12.087 4.988 8.965 1.00 0.00 N ATOM 1707 C4 U B 4 -12.828 3.827 8.875 1.00 0.00 C ATOM 1708 O4 U B 4 -13.965 3.850 8.413 1.00 0.00 O ATOM 1709 C5 U B 4 -12.145 2.651 9.360 1.00 0.00 C ATOM 1710 C6 U B 4 -10.875 2.720 9.830 1.00 0.00 C ATOM 0 H5' U B 4 -8.324 0.920 11.115 1.00 0.00 H new ATOM 0 H5'' U B 4 -7.393 0.673 9.650 1.00 0.00 H new ATOM 0 H4' U B 4 -5.970 2.700 10.350 1.00 0.00 H new ATOM 0 H3' U B 4 -7.026 2.577 12.827 1.00 0.00 H new ATOM 0 H2' U B 4 -9.434 2.777 12.115 1.00 0.00 H new ATOM 0 HO2' U B 4 -8.339 5.110 13.021 1.00 0.00 H new ATOM 0 H1' U B 4 -8.524 5.037 10.250 1.00 0.00 H new ATOM 0 H3 U B 4 -12.537 5.850 8.658 1.00 0.00 H new ATOM 0 H5 U B 4 -12.655 1.699 9.348 1.00 0.00 H new ATOM 0 H6 U B 4 -10.390 1.822 10.183 1.00 0.00 H new ATOM 1721 P U B 5 -5.091 4.394 12.897 1.00 0.00 P ATOM 1722 OP1 U B 5 -4.743 3.000 13.252 1.00 0.00 O ATOM 1723 OP2 U B 5 -5.135 5.428 13.954 1.00 0.00 O ATOM 1724 O5' U B 5 -4.067 4.901 11.763 1.00 0.00 O ATOM 1725 C5' U B 5 -3.397 3.990 10.923 1.00 0.00 C ATOM 1726 C4' U B 5 -2.606 4.711 9.828 1.00 0.00 C ATOM 1727 O4' U B 5 -3.480 5.163 8.805 1.00 0.00 O ATOM 1728 C3' U B 5 -1.856 5.931 10.371 1.00 0.00 C ATOM 1729 O3' U B 5 -0.660 6.100 9.635 1.00 0.00 O ATOM 1730 C2' U B 5 -2.859 7.050 10.104 1.00 0.00 C ATOM 1731 O2' U B 5 -2.246 8.314 9.942 1.00 0.00 O ATOM 1732 C1' U B 5 -3.512 6.579 8.809 1.00 0.00 C ATOM 1733 N1 U B 5 -4.900 7.069 8.698 1.00 0.00 N ATOM 1734 C2 U B 5 -5.230 7.839 7.594 1.00 0.00 C ATOM 1735 O2 U B 5 -4.426 8.095 6.703 1.00 0.00 O ATOM 1736 N3 U B 5 -6.525 8.314 7.538 1.00 0.00 N ATOM 1737 C4 U B 5 -7.515 8.090 8.479 1.00 0.00 C ATOM 1738 O4 U B 5 -8.629 8.586 8.330 1.00 0.00 O ATOM 1739 C5 U B 5 -7.095 7.256 9.582 1.00 0.00 C ATOM 1740 C6 U B 5 -5.828 6.781 9.659 1.00 0.00 C ATOM 0 H5' U B 5 -4.121 3.316 10.466 1.00 0.00 H new ATOM 0 H5'' U B 5 -2.720 3.376 11.517 1.00 0.00 H new ATOM 0 H4' U B 5 -1.887 3.991 9.438 1.00 0.00 H new ATOM 0 H3' U B 5 -1.556 5.875 11.417 1.00 0.00 H new ATOM 0 H2' U B 5 -3.553 7.205 10.930 1.00 0.00 H new ATOM 0 HO2' U B 5 -1.436 8.358 10.492 1.00 0.00 H new ATOM 0 H1' U B 5 -2.968 6.978 7.952 1.00 0.00 H new ATOM 0 H3 U B 5 -6.775 8.882 6.729 1.00 0.00 H new ATOM 0 H5 U B 5 -7.803 7.007 10.358 1.00 0.00 H new ATOM 0 H6 U B 5 -5.546 6.162 10.498 1.00 0.00 H new ATOM 1751 P U B 6 0.620 6.841 10.280 1.00 0.00 P ATOM 1752 OP1 U B 6 1.232 5.926 11.268 1.00 0.00 O ATOM 1753 OP2 U B 6 0.217 8.204 10.693 1.00 0.00 O ATOM 1754 O5' U B 6 1.615 6.969 9.020 1.00 0.00 O ATOM 1755 C5' U B 6 2.191 5.810 8.458 1.00 0.00 C ATOM 1756 C4' U B 6 3.001 6.107 7.192 1.00 0.00 C ATOM 1757 O4' U B 6 2.201 6.736 6.194 1.00 0.00 O ATOM 1758 C3' U B 6 4.181 7.034 7.478 1.00 0.00 C ATOM 1759 O3' U B 6 5.233 6.761 6.570 1.00 0.00 O ATOM 1760 C2' U B 6 3.569 8.401 7.198 1.00 0.00 C ATOM 1761 O2' U B 6 4.563 9.340 6.828 1.00 0.00 O ATOM 1762 C1' U B 6 2.574 8.105 6.077 1.00 0.00 C ATOM 1763 N1 U B 6 1.421 9.012 6.225 1.00 0.00 N ATOM 1764 C2 U B 6 1.606 10.330 5.846 1.00 0.00 C ATOM 1765 O2 U B 6 2.682 10.763 5.440 1.00 0.00 O ATOM 1766 N3 U B 6 0.503 11.154 5.950 1.00 0.00 N ATOM 1767 C4 U B 6 -0.755 10.773 6.376 1.00 0.00 C ATOM 1768 O4 U B 6 -1.679 11.576 6.377 1.00 0.00 O ATOM 1769 C5 U B 6 -0.849 9.396 6.796 1.00 0.00 C ATOM 1770 C6 U B 6 0.222 8.576 6.718 1.00 0.00 C ATOM 0 H5' U B 6 1.403 5.096 8.221 1.00 0.00 H new ATOM 0 H5'' U B 6 2.838 5.337 9.196 1.00 0.00 H new ATOM 0 H4' U B 6 3.360 5.141 6.838 1.00 0.00 H new ATOM 0 H3' U B 6 4.607 6.938 8.477 1.00 0.00 H new ATOM 0 H2' U B 6 3.087 8.857 8.063 1.00 0.00 H new ATOM 0 HO2' U B 6 4.165 10.031 6.258 1.00 0.00 H new ATOM 0 H1' U B 6 2.998 8.270 5.087 1.00 0.00 H new ATOM 0 H3 U B 6 0.628 12.132 5.689 1.00 0.00 H new ATOM 0 H5 U B 6 -1.786 9.017 7.177 1.00 0.00 H new ATOM 0 H6 U B 6 0.129 7.553 7.052 1.00 0.00 H new ATOM 1781 P C B 7 6.367 5.661 6.886 1.00 0.00 P ATOM 1782 OP1 C B 7 6.829 5.853 8.280 1.00 0.00 O ATOM 1783 OP2 C B 7 7.353 5.711 5.780 1.00 0.00 O ATOM 1784 O5' C B 7 5.608 4.241 6.790 1.00 0.00 O ATOM 1785 C5' C B 7 5.163 3.570 7.951 1.00 0.00 C ATOM 1786 C4' C B 7 4.450 2.268 7.570 1.00 0.00 C ATOM 1787 O4' C B 7 5.389 1.305 7.128 1.00 0.00 O ATOM 1788 C3' C B 7 3.818 1.632 8.801 1.00 0.00 C ATOM 1789 O3' C B 7 2.879 0.645 8.407 1.00 0.00 O ATOM 1790 C2' C B 7 5.045 1.003 9.452 1.00 0.00 C ATOM 1791 O2' C B 7 4.700 -0.121 10.235 1.00 0.00 O ATOM 1792 C1' C B 7 5.936 0.633 8.259 1.00 0.00 C ATOM 1793 N1 C B 7 7.367 0.968 8.507 1.00 0.00 N ATOM 1794 C2 C B 7 8.198 1.281 7.430 1.00 0.00 C ATOM 1795 O2 C B 7 7.793 1.242 6.268 1.00 0.00 O ATOM 1796 N3 C B 7 9.487 1.632 7.679 1.00 0.00 N ATOM 1797 C4 C B 7 9.962 1.645 8.924 1.00 0.00 C ATOM 1798 N4 C B 7 11.231 2.003 9.111 1.00 0.00 N ATOM 1799 C5 C B 7 9.150 1.282 10.040 1.00 0.00 C ATOM 1800 C6 C B 7 7.867 0.949 9.782 1.00 0.00 C ATOM 0 H5' C B 7 4.486 4.212 8.514 1.00 0.00 H new ATOM 0 H5'' C B 7 6.010 3.352 8.601 1.00 0.00 H new ATOM 0 H4' C B 7 3.717 2.523 6.805 1.00 0.00 H new ATOM 0 H3' C B 7 3.268 2.313 9.451 1.00 0.00 H new ATOM 0 H2' C B 7 5.547 1.673 10.150 1.00 0.00 H new ATOM 0 HO2' C B 7 5.513 -0.522 10.608 1.00 0.00 H new ATOM 0 HO3' C B 7 2.978 -0.146 8.977 1.00 0.00 H new ATOM 0 H1' C B 7 5.941 -0.443 8.087 1.00 0.00 H new ATOM 0 H41 C B 7 11.622 2.022 10.053 1.00 0.00 H new ATOM 0 H42 C B 7 11.812 2.258 8.312 1.00 0.00 H new ATOM 0 H5 C B 7 9.544 1.274 11.046 1.00 0.00 H new ATOM 0 H6 C B 7 7.221 0.662 10.599 1.00 0.00 H new TER 1812 C B 7