USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 759 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 13 GLN : amide:sc= -1.46 K(o=-0.89,f=-1.6!) USER MOD Set 1.2: A 88 SER OG : rot -74:sc= 0.562 USER MOD Set 2.1: A 55 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 79 TYR OH : rot -15:sc= 0.541 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl 154:sc= -1.11 (180deg=-2.36) USER MOD Single : A 11 THR OG1 : rot 114:sc= -1.05 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 41:sc= 0.0722 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 CYS SG : rot 180:sc=-0.00563 USER MOD Single : A 29 CYS SG : rot -105:sc= -1.9! USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -8.48! C(o=-8.5!,f=-9!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot -152:sc= 0.728 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -4.17! C(o=-4.2!,f=-4!) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0.0194 USER MOD Single : A 73 LYS NZ :NH3+ -172:sc= 0.295 (180deg=0.218) USER MOD Single : A 80 SER OG : rot 180:sc= -0.0455 USER MOD Single : A 82 MET CE :methyl 138:sc= -0.0834 (180deg=-2.88!) USER MOD Single : A 83 THR OG1 : rot 129:sc= -0.942 USER MOD Single : A 84 THR OG1 : rot 140:sc= -0.032 USER MOD Single : A 87 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot -63:sc= 1.11 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -36.982 -0.901 -2.016 1.00 0.00 N ATOM 2 CA GLY A 1 -35.750 -1.422 -2.580 1.00 0.00 C ATOM 3 C GLY A 1 -34.575 -1.288 -1.632 1.00 0.00 C ATOM 4 O GLY A 1 -34.228 -0.183 -1.216 1.00 0.00 O ATOM 0 H1 GLY A 1 -37.754 -1.016 -2.703 1.00 0.00 H new ATOM 0 H2 GLY A 1 -37.213 -1.421 -1.145 1.00 0.00 H new ATOM 0 H3 GLY A 1 -36.863 0.108 -1.795 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -35.887 -2.472 -2.837 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -35.527 -0.894 -3.507 1.00 0.00 H new ATOM 8 N SER A 2 -33.963 -2.417 -1.288 1.00 0.00 N ATOM 9 CA SER A 2 -32.824 -2.421 -0.378 1.00 0.00 C ATOM 10 C SER A 2 -31.675 -3.245 -0.950 1.00 0.00 C ATOM 11 O SER A 2 -31.023 -4.005 -0.233 1.00 0.00 O ATOM 12 CB SER A 2 -33.236 -2.978 0.986 1.00 0.00 C ATOM 13 OG SER A 2 -34.164 -2.121 1.628 1.00 0.00 O ATOM 0 H SER A 2 -34.237 -3.340 -1.626 1.00 0.00 H new ATOM 0 HA SER A 2 -32.485 -1.392 -0.255 1.00 0.00 H new ATOM 0 HB2 SER A 2 -33.676 -3.967 0.860 1.00 0.00 H new ATOM 0 HB3 SER A 2 -32.354 -3.099 1.614 1.00 0.00 H new ATOM 0 HG SER A 2 -34.413 -2.500 2.497 1.00 0.00 H new ATOM 19 N SER A 3 -31.432 -3.089 -2.248 1.00 0.00 N ATOM 20 CA SER A 3 -30.364 -3.821 -2.919 1.00 0.00 C ATOM 21 C SER A 3 -30.010 -3.165 -4.251 1.00 0.00 C ATOM 22 O SER A 3 -30.851 -2.529 -4.885 1.00 0.00 O ATOM 23 CB SER A 3 -30.779 -5.275 -3.148 1.00 0.00 C ATOM 24 OG SER A 3 -29.885 -5.928 -4.033 1.00 0.00 O ATOM 0 H SER A 3 -31.960 -2.462 -2.855 1.00 0.00 H new ATOM 0 HA SER A 3 -29.483 -3.799 -2.277 1.00 0.00 H new ATOM 0 HB2 SER A 3 -30.803 -5.804 -2.195 1.00 0.00 H new ATOM 0 HB3 SER A 3 -31.789 -5.308 -3.557 1.00 0.00 H new ATOM 0 HG SER A 3 -30.172 -6.856 -4.161 1.00 0.00 H new ATOM 30 N GLY A 4 -28.758 -3.327 -4.669 1.00 0.00 N ATOM 31 CA GLY A 4 -28.314 -2.746 -5.922 1.00 0.00 C ATOM 32 C GLY A 4 -26.805 -2.621 -6.001 1.00 0.00 C ATOM 33 O GLY A 4 -26.145 -3.413 -6.673 1.00 0.00 O ATOM 0 H GLY A 4 -28.044 -3.850 -4.162 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -28.668 -3.361 -6.750 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -28.764 -1.760 -6.041 1.00 0.00 H new ATOM 37 N SER A 5 -26.259 -1.624 -5.314 1.00 0.00 N ATOM 38 CA SER A 5 -24.819 -1.395 -5.313 1.00 0.00 C ATOM 39 C SER A 5 -24.181 -1.950 -4.044 1.00 0.00 C ATOM 40 O SER A 5 -24.352 -1.398 -2.957 1.00 0.00 O ATOM 41 CB SER A 5 -24.518 0.100 -5.437 1.00 0.00 C ATOM 42 OG SER A 5 -24.512 0.509 -6.794 1.00 0.00 O ATOM 0 H SER A 5 -26.792 -0.961 -4.751 1.00 0.00 H new ATOM 0 HA SER A 5 -24.393 -1.916 -6.171 1.00 0.00 H new ATOM 0 HB2 SER A 5 -25.264 0.671 -4.885 1.00 0.00 H new ATOM 0 HB3 SER A 5 -23.551 0.318 -4.984 1.00 0.00 H new ATOM 0 HG SER A 5 -24.319 1.468 -6.846 1.00 0.00 H new ATOM 48 N SER A 6 -23.444 -3.047 -4.190 1.00 0.00 N ATOM 49 CA SER A 6 -22.783 -3.680 -3.055 1.00 0.00 C ATOM 50 C SER A 6 -21.269 -3.693 -3.246 1.00 0.00 C ATOM 51 O SER A 6 -20.765 -4.155 -4.268 1.00 0.00 O ATOM 52 CB SER A 6 -23.297 -5.109 -2.871 1.00 0.00 C ATOM 53 OG SER A 6 -22.870 -5.649 -1.633 1.00 0.00 O ATOM 0 H SER A 6 -23.290 -3.515 -5.083 1.00 0.00 H new ATOM 0 HA SER A 6 -23.014 -3.100 -2.162 1.00 0.00 H new ATOM 0 HB2 SER A 6 -24.386 -5.116 -2.918 1.00 0.00 H new ATOM 0 HB3 SER A 6 -22.939 -5.736 -3.688 1.00 0.00 H new ATOM 0 HG SER A 6 -23.213 -6.562 -1.539 1.00 0.00 H new ATOM 59 N GLY A 7 -20.549 -3.181 -2.252 1.00 0.00 N ATOM 60 CA GLY A 7 -19.100 -3.142 -2.329 1.00 0.00 C ATOM 61 C GLY A 7 -18.481 -2.352 -1.193 1.00 0.00 C ATOM 62 O GLY A 7 -19.191 -1.757 -0.382 1.00 0.00 O ATOM 0 H GLY A 7 -20.943 -2.793 -1.395 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -18.711 -4.160 -2.314 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.801 -2.700 -3.280 1.00 0.00 H new ATOM 66 N ILE A 8 -17.153 -2.347 -1.134 1.00 0.00 N ATOM 67 CA ILE A 8 -16.439 -1.625 -0.088 1.00 0.00 C ATOM 68 C ILE A 8 -15.922 -0.285 -0.601 1.00 0.00 C ATOM 69 O ILE A 8 -15.369 -0.199 -1.697 1.00 0.00 O ATOM 70 CB ILE A 8 -15.253 -2.445 0.454 1.00 0.00 C ATOM 71 CG1 ILE A 8 -15.759 -3.697 1.174 1.00 0.00 C ATOM 72 CG2 ILE A 8 -14.405 -1.596 1.388 1.00 0.00 C ATOM 73 CD1 ILE A 8 -14.668 -4.701 1.477 1.00 0.00 C ATOM 0 H ILE A 8 -16.551 -2.834 -1.797 1.00 0.00 H new ATOM 0 HA ILE A 8 -17.151 -1.454 0.719 1.00 0.00 H new ATOM 0 HB ILE A 8 -14.631 -2.757 -0.385 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -16.239 -3.401 2.107 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -16.522 -4.176 0.561 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -13.571 -2.190 1.763 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -14.021 -0.732 0.846 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -15.014 -1.257 2.226 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -15.098 -5.563 1.988 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -14.203 -5.026 0.546 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -13.916 -4.239 2.116 1.00 0.00 H new ATOM 85 N MET A 9 -16.106 0.760 0.201 1.00 0.00 N ATOM 86 CA MET A 9 -15.656 2.096 -0.171 1.00 0.00 C ATOM 87 C MET A 9 -14.531 2.565 0.747 1.00 0.00 C ATOM 88 O MET A 9 -14.577 2.356 1.959 1.00 0.00 O ATOM 89 CB MET A 9 -16.822 3.085 -0.113 1.00 0.00 C ATOM 90 CG MET A 9 -18.111 2.538 -0.705 1.00 0.00 C ATOM 91 SD MET A 9 -18.023 2.334 -2.494 1.00 0.00 S ATOM 92 CE MET A 9 -18.636 0.661 -2.674 1.00 0.00 C ATOM 0 H MET A 9 -16.563 0.707 1.111 1.00 0.00 H new ATOM 0 HA MET A 9 -15.276 2.053 -1.192 1.00 0.00 H new ATOM 0 HB2 MET A 9 -16.999 3.366 0.925 1.00 0.00 H new ATOM 0 HB3 MET A 9 -16.544 3.994 -0.646 1.00 0.00 H new ATOM 0 HG2 MET A 9 -18.338 1.577 -0.245 1.00 0.00 H new ATOM 0 HG3 MET A 9 -18.933 3.211 -0.460 1.00 0.00 H new ATOM 0 HE1 MET A 9 -19.074 0.539 -3.665 1.00 0.00 H new ATOM 0 HE2 MET A 9 -17.813 -0.043 -2.551 1.00 0.00 H new ATOM 0 HE3 MET A 9 -19.395 0.468 -1.916 1.00 0.00 H new ATOM 102 N VAL A 10 -13.521 3.200 0.160 1.00 0.00 N ATOM 103 CA VAL A 10 -12.384 3.699 0.925 1.00 0.00 C ATOM 104 C VAL A 10 -12.734 4.995 1.647 1.00 0.00 C ATOM 105 O VAL A 10 -12.741 6.071 1.047 1.00 0.00 O ATOM 106 CB VAL A 10 -11.162 3.943 0.020 1.00 0.00 C ATOM 107 CG1 VAL A 10 -10.013 4.536 0.821 1.00 0.00 C ATOM 108 CG2 VAL A 10 -10.737 2.650 -0.660 1.00 0.00 C ATOM 0 H VAL A 10 -13.467 3.381 -0.842 1.00 0.00 H new ATOM 0 HA VAL A 10 -12.136 2.933 1.659 1.00 0.00 H new ATOM 0 HB VAL A 10 -11.441 4.659 -0.753 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -9.159 4.701 0.164 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -10.325 5.485 1.257 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -9.731 3.847 1.617 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -9.872 2.840 -1.296 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -10.475 1.910 0.096 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -11.558 2.272 -1.269 1.00 0.00 H new ATOM 118 N THR A 11 -13.025 4.887 2.939 1.00 0.00 N ATOM 119 CA THR A 11 -13.377 6.050 3.744 1.00 0.00 C ATOM 120 C THR A 11 -12.187 6.989 3.903 1.00 0.00 C ATOM 121 O THR A 11 -12.340 8.211 3.877 1.00 0.00 O ATOM 122 CB THR A 11 -13.880 5.635 5.140 1.00 0.00 C ATOM 123 OG1 THR A 11 -12.881 4.858 5.810 1.00 0.00 O ATOM 124 CG2 THR A 11 -15.168 4.833 5.036 1.00 0.00 C ATOM 0 H THR A 11 -13.024 4.005 3.451 1.00 0.00 H new ATOM 0 HA THR A 11 -14.178 6.569 3.217 1.00 0.00 H new ATOM 0 HB THR A 11 -14.080 6.540 5.713 1.00 0.00 H new ATOM 0 HG1 THR A 11 -12.549 5.353 6.588 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.503 4.552 6.034 1.00 0.00 H new ATOM 0 HG22 THR A 11 -15.935 5.438 4.553 1.00 0.00 H new ATOM 0 HG23 THR A 11 -14.990 3.934 4.446 1.00 0.00 H new ATOM 132 N LYS A 12 -11.002 6.412 4.066 1.00 0.00 N ATOM 133 CA LYS A 12 -9.784 7.197 4.227 1.00 0.00 C ATOM 134 C LYS A 12 -8.789 6.894 3.111 1.00 0.00 C ATOM 135 O LYS A 12 -8.053 5.910 3.174 1.00 0.00 O ATOM 136 CB LYS A 12 -9.143 6.911 5.587 1.00 0.00 C ATOM 137 CG LYS A 12 -7.882 7.716 5.847 1.00 0.00 C ATOM 138 CD LYS A 12 -7.214 7.302 7.148 1.00 0.00 C ATOM 139 CE LYS A 12 -5.999 8.164 7.450 1.00 0.00 C ATOM 140 NZ LYS A 12 -4.841 7.816 6.580 1.00 0.00 N ATOM 0 H LYS A 12 -10.859 5.402 4.090 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.053 8.252 4.174 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -9.868 7.124 6.373 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -8.906 5.849 5.651 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -7.185 7.580 5.020 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -8.128 8.777 5.885 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -7.930 7.381 7.967 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -6.913 6.256 7.087 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -6.255 9.214 7.310 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -5.717 8.041 8.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -4.033 8.426 6.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -4.580 6.821 6.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -5.101 7.958 5.583 1.00 0.00 H new ATOM 154 N GLN A 13 -8.773 7.746 2.091 1.00 0.00 N ATOM 155 CA GLN A 13 -7.868 7.569 0.962 1.00 0.00 C ATOM 156 C GLN A 13 -6.413 7.658 1.411 1.00 0.00 C ATOM 157 O GLN A 13 -6.104 8.280 2.428 1.00 0.00 O ATOM 158 CB GLN A 13 -8.148 8.620 -0.114 1.00 0.00 C ATOM 159 CG GLN A 13 -9.598 8.653 -0.569 1.00 0.00 C ATOM 160 CD GLN A 13 -9.975 7.448 -1.407 1.00 0.00 C ATOM 161 OE1 GLN A 13 -10.961 6.766 -1.126 1.00 0.00 O ATOM 162 NE2 GLN A 13 -9.190 7.178 -2.443 1.00 0.00 N ATOM 0 H GLN A 13 -9.376 8.566 2.023 1.00 0.00 H new ATOM 0 HA GLN A 13 -8.040 6.577 0.544 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -7.874 9.603 0.270 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -7.510 8.425 -0.976 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -10.248 8.700 0.305 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -9.773 9.561 -1.146 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -8.383 7.770 -2.639 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -9.394 6.379 -3.043 1.00 0.00 H new ATOM 171 N LEU A 14 -5.524 7.034 0.646 1.00 0.00 N ATOM 172 CA LEU A 14 -4.101 7.043 0.965 1.00 0.00 C ATOM 173 C LEU A 14 -3.542 8.462 0.922 1.00 0.00 C ATOM 174 O LEU A 14 -4.090 9.334 0.250 1.00 0.00 O ATOM 175 CB LEU A 14 -3.333 6.151 -0.011 1.00 0.00 C ATOM 176 CG LEU A 14 -3.778 4.689 -0.077 1.00 0.00 C ATOM 177 CD1 LEU A 14 -3.337 4.055 -1.386 1.00 0.00 C ATOM 178 CD2 LEU A 14 -3.226 3.910 1.108 1.00 0.00 C ATOM 0 H LEU A 14 -5.764 6.516 -0.199 1.00 0.00 H new ATOM 0 HA LEU A 14 -3.979 6.654 1.976 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -3.418 6.581 -1.009 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -2.277 6.177 0.258 1.00 0.00 H new ATOM 0 HG LEU A 14 -4.867 4.658 -0.032 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -3.663 3.015 -1.415 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.781 4.597 -2.221 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -2.251 4.097 -1.463 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.552 2.872 1.045 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.137 3.949 1.094 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -3.593 4.350 2.035 1.00 0.00 H new ATOM 190 N GLU A 15 -2.447 8.683 1.643 1.00 0.00 N ATOM 191 CA GLU A 15 -1.813 9.996 1.685 1.00 0.00 C ATOM 192 C GLU A 15 -0.341 9.903 1.294 1.00 0.00 C ATOM 193 O GLU A 15 0.416 9.119 1.867 1.00 0.00 O ATOM 194 CB GLU A 15 -1.944 10.605 3.082 1.00 0.00 C ATOM 195 CG GLU A 15 -1.052 9.945 4.120 1.00 0.00 C ATOM 196 CD GLU A 15 -1.314 10.454 5.524 1.00 0.00 C ATOM 197 OE1 GLU A 15 -2.499 10.540 5.911 1.00 0.00 O ATOM 198 OE2 GLU A 15 -0.337 10.766 6.235 1.00 0.00 O ATOM 0 H GLU A 15 -1.981 7.971 2.205 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.321 10.640 0.967 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.703 11.667 3.030 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -2.982 10.529 3.406 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -1.207 8.866 4.094 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.008 10.123 3.862 1.00 0.00 H new ATOM 205 N ASP A 16 0.057 10.707 0.315 1.00 0.00 N ATOM 206 CA ASP A 16 1.438 10.716 -0.153 1.00 0.00 C ATOM 207 C ASP A 16 2.408 10.541 1.012 1.00 0.00 C ATOM 208 O ASP A 16 2.250 11.160 2.064 1.00 0.00 O ATOM 209 CB ASP A 16 1.740 12.021 -0.891 1.00 0.00 C ATOM 210 CG ASP A 16 3.228 12.280 -1.026 1.00 0.00 C ATOM 211 OD1 ASP A 16 3.861 11.654 -1.902 1.00 0.00 O ATOM 212 OD2 ASP A 16 3.759 13.106 -0.255 1.00 0.00 O ATOM 0 H ASP A 16 -0.557 11.361 -0.170 1.00 0.00 H new ATOM 0 HA ASP A 16 1.568 9.880 -0.840 1.00 0.00 H new ATOM 0 HB2 ASP A 16 1.289 11.987 -1.883 1.00 0.00 H new ATOM 0 HB3 ASP A 16 1.277 12.852 -0.359 1.00 0.00 H new ATOM 217 N THR A 17 3.411 9.691 0.817 1.00 0.00 N ATOM 218 CA THR A 17 4.405 9.431 1.851 1.00 0.00 C ATOM 219 C THR A 17 5.819 9.616 1.313 1.00 0.00 C ATOM 220 O THR A 17 6.119 9.235 0.181 1.00 0.00 O ATOM 221 CB THR A 17 4.266 8.006 2.418 1.00 0.00 C ATOM 222 OG1 THR A 17 2.942 7.808 2.926 1.00 0.00 O ATOM 223 CG2 THR A 17 5.280 7.763 3.526 1.00 0.00 C ATOM 0 H THR A 17 3.557 9.171 -0.048 1.00 0.00 H new ATOM 0 HA THR A 17 4.226 10.151 2.650 1.00 0.00 H new ATOM 0 HB THR A 17 4.456 7.298 1.611 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.293 8.218 2.316 1.00 0.00 H new ATOM 0 HG21 THR A 17 5.163 6.750 3.911 1.00 0.00 H new ATOM 0 HG22 THR A 17 6.288 7.886 3.130 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.117 8.479 4.332 1.00 0.00 H new ATOM 231 N THR A 18 6.687 10.202 2.132 1.00 0.00 N ATOM 232 CA THR A 18 8.070 10.438 1.738 1.00 0.00 C ATOM 233 C THR A 18 9.040 9.870 2.768 1.00 0.00 C ATOM 234 O THR A 18 9.106 10.346 3.901 1.00 0.00 O ATOM 235 CB THR A 18 8.355 11.941 1.557 1.00 0.00 C ATOM 236 OG1 THR A 18 7.387 12.520 0.674 1.00 0.00 O ATOM 237 CG2 THR A 18 9.753 12.164 1.002 1.00 0.00 C ATOM 0 H THR A 18 6.456 10.522 3.073 1.00 0.00 H new ATOM 0 HA THR A 18 8.217 9.930 0.785 1.00 0.00 H new ATOM 0 HB THR A 18 8.289 12.421 2.533 1.00 0.00 H new ATOM 0 HG1 THR A 18 7.574 13.476 0.565 1.00 0.00 H new ATOM 0 HG21 THR A 18 9.931 13.233 0.883 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.488 11.748 1.691 1.00 0.00 H new ATOM 0 HG23 THR A 18 9.843 11.671 0.034 1.00 0.00 H new ATOM 245 N ALA A 19 9.790 8.849 2.367 1.00 0.00 N ATOM 246 CA ALA A 19 10.758 8.217 3.256 1.00 0.00 C ATOM 247 C ALA A 19 12.142 8.174 2.617 1.00 0.00 C ATOM 248 O ALA A 19 12.272 8.145 1.393 1.00 0.00 O ATOM 249 CB ALA A 19 10.300 6.814 3.623 1.00 0.00 C ATOM 0 H ALA A 19 9.746 8.442 1.433 1.00 0.00 H new ATOM 0 HA ALA A 19 10.824 8.814 4.165 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.032 6.354 4.287 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.335 6.867 4.128 1.00 0.00 H new ATOM 0 HB3 ALA A 19 10.204 6.214 2.718 1.00 0.00 H new ATOM 255 N TYR A 20 13.175 8.171 3.454 1.00 0.00 N ATOM 256 CA TYR A 20 14.550 8.135 2.970 1.00 0.00 C ATOM 257 C TYR A 20 14.927 6.732 2.507 1.00 0.00 C ATOM 258 O TYR A 20 14.173 5.778 2.700 1.00 0.00 O ATOM 259 CB TYR A 20 15.510 8.598 4.067 1.00 0.00 C ATOM 260 CG TYR A 20 15.571 10.100 4.225 1.00 0.00 C ATOM 261 CD1 TYR A 20 14.424 10.877 4.115 1.00 0.00 C ATOM 262 CD2 TYR A 20 16.775 10.744 4.482 1.00 0.00 C ATOM 263 CE1 TYR A 20 14.474 12.250 4.258 1.00 0.00 C ATOM 264 CE2 TYR A 20 16.835 12.116 4.627 1.00 0.00 C ATOM 265 CZ TYR A 20 15.682 12.865 4.514 1.00 0.00 C ATOM 266 OH TYR A 20 15.738 14.232 4.657 1.00 0.00 O ATOM 0 H TYR A 20 13.086 8.193 4.470 1.00 0.00 H new ATOM 0 HA TYR A 20 14.628 8.812 2.119 1.00 0.00 H new ATOM 0 HB2 TYR A 20 15.206 8.154 5.015 1.00 0.00 H new ATOM 0 HB3 TYR A 20 16.509 8.224 3.845 1.00 0.00 H new ATOM 0 HD1 TYR A 20 13.477 10.399 3.914 1.00 0.00 H new ATOM 0 HD2 TYR A 20 17.680 10.161 4.570 1.00 0.00 H new ATOM 0 HE1 TYR A 20 13.573 12.839 4.170 1.00 0.00 H new ATOM 0 HE2 TYR A 20 17.779 12.600 4.828 1.00 0.00 H new ATOM 0 HH TYR A 20 16.662 14.505 4.835 1.00 0.00 H new ATOM 276 N CYS A 21 16.100 6.614 1.895 1.00 0.00 N ATOM 277 CA CYS A 21 16.580 5.327 1.402 1.00 0.00 C ATOM 278 C CYS A 21 16.917 4.393 2.560 1.00 0.00 C ATOM 279 O CYS A 21 17.774 4.698 3.389 1.00 0.00 O ATOM 280 CB CYS A 21 17.811 5.524 0.516 1.00 0.00 C ATOM 281 SG CYS A 21 18.391 4.011 -0.287 1.00 0.00 S ATOM 0 H CYS A 21 16.736 7.393 1.728 1.00 0.00 H new ATOM 0 HA CYS A 21 15.785 4.872 0.811 1.00 0.00 H new ATOM 0 HB2 CYS A 21 17.579 6.264 -0.250 1.00 0.00 H new ATOM 0 HB3 CYS A 21 18.619 5.934 1.121 1.00 0.00 H new ATOM 0 HG CYS A 21 19.433 4.279 -1.016 1.00 0.00 H new ATOM 287 N GLY A 22 16.234 3.254 2.613 1.00 0.00 N ATOM 288 CA GLY A 22 16.473 2.293 3.674 1.00 0.00 C ATOM 289 C GLY A 22 15.425 2.364 4.767 1.00 0.00 C ATOM 290 O GLY A 22 15.293 1.440 5.568 1.00 0.00 O ATOM 0 H GLY A 22 15.519 2.979 1.940 1.00 0.00 H new ATOM 0 HA2 GLY A 22 16.487 1.288 3.253 1.00 0.00 H new ATOM 0 HA3 GLY A 22 17.457 2.471 4.107 1.00 0.00 H new ATOM 294 N GLU A 23 14.680 3.464 4.800 1.00 0.00 N ATOM 295 CA GLU A 23 13.641 3.652 5.805 1.00 0.00 C ATOM 296 C GLU A 23 12.437 2.760 5.516 1.00 0.00 C ATOM 297 O GLU A 23 12.295 2.229 4.415 1.00 0.00 O ATOM 298 CB GLU A 23 13.204 5.118 5.852 1.00 0.00 C ATOM 299 CG GLU A 23 14.009 5.962 6.826 1.00 0.00 C ATOM 300 CD GLU A 23 13.444 5.928 8.233 1.00 0.00 C ATOM 301 OE1 GLU A 23 12.276 6.334 8.412 1.00 0.00 O ATOM 302 OE2 GLU A 23 14.168 5.496 9.153 1.00 0.00 O ATOM 0 H GLU A 23 14.777 4.238 4.143 1.00 0.00 H new ATOM 0 HA GLU A 23 14.054 3.373 6.774 1.00 0.00 H new ATOM 0 HB2 GLU A 23 13.292 5.547 4.854 1.00 0.00 H new ATOM 0 HB3 GLU A 23 12.150 5.166 6.128 1.00 0.00 H new ATOM 0 HG2 GLU A 23 15.039 5.606 6.844 1.00 0.00 H new ATOM 0 HG3 GLU A 23 14.034 6.993 6.473 1.00 0.00 H new ATOM 309 N ARG A 24 11.573 2.600 6.513 1.00 0.00 N ATOM 310 CA ARG A 24 10.382 1.772 6.367 1.00 0.00 C ATOM 311 C ARG A 24 9.151 2.632 6.099 1.00 0.00 C ATOM 312 O ARG A 24 8.813 3.514 6.889 1.00 0.00 O ATOM 313 CB ARG A 24 10.165 0.928 7.625 1.00 0.00 C ATOM 314 CG ARG A 24 8.792 0.280 7.694 1.00 0.00 C ATOM 315 CD ARG A 24 8.321 0.124 9.131 1.00 0.00 C ATOM 316 NE ARG A 24 8.673 -1.181 9.683 1.00 0.00 N ATOM 317 CZ ARG A 24 8.220 -1.634 10.847 1.00 0.00 C ATOM 318 NH1 ARG A 24 7.400 -0.891 11.577 1.00 0.00 N ATOM 319 NH2 ARG A 24 8.586 -2.833 11.283 1.00 0.00 N ATOM 0 H ARG A 24 11.676 3.033 7.431 1.00 0.00 H new ATOM 0 HA ARG A 24 10.533 1.109 5.515 1.00 0.00 H new ATOM 0 HB2 ARG A 24 10.927 0.150 7.666 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.305 1.558 8.504 1.00 0.00 H new ATOM 0 HG2 ARG A 24 8.075 0.885 7.139 1.00 0.00 H new ATOM 0 HG3 ARG A 24 8.825 -0.697 7.213 1.00 0.00 H new ATOM 0 HD2 ARG A 24 8.763 0.909 9.745 1.00 0.00 H new ATOM 0 HD3 ARG A 24 7.240 0.257 9.175 1.00 0.00 H new ATOM 0 HE ARG A 24 9.301 -1.778 9.145 1.00 0.00 H new ATOM 0 HH11 ARG A 24 7.115 0.031 11.245 1.00 0.00 H new ATOM 0 HH12 ARG A 24 7.054 -1.241 12.470 1.00 0.00 H new ATOM 0 HH21 ARG A 24 9.216 -3.408 10.724 1.00 0.00 H new ATOM 0 HH22 ARG A 24 8.237 -3.179 12.177 1.00 0.00 H new ATOM 333 N VAL A 25 8.484 2.369 4.980 1.00 0.00 N ATOM 334 CA VAL A 25 7.290 3.118 4.608 1.00 0.00 C ATOM 335 C VAL A 25 6.027 2.417 5.096 1.00 0.00 C ATOM 336 O VAL A 25 5.922 1.193 5.034 1.00 0.00 O ATOM 337 CB VAL A 25 7.200 3.310 3.082 1.00 0.00 C ATOM 338 CG1 VAL A 25 5.971 4.128 2.718 1.00 0.00 C ATOM 339 CG2 VAL A 25 8.466 3.969 2.553 1.00 0.00 C ATOM 0 H VAL A 25 8.750 1.643 4.315 1.00 0.00 H new ATOM 0 HA VAL A 25 7.368 4.095 5.086 1.00 0.00 H new ATOM 0 HB VAL A 25 7.105 2.330 2.615 1.00 0.00 H new ATOM 0 HG11 VAL A 25 5.924 4.253 1.636 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.075 3.612 3.062 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.031 5.107 3.194 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.386 4.097 1.474 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.594 4.943 3.026 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.326 3.339 2.781 1.00 0.00 H new ATOM 349 N GLU A 26 5.070 3.203 5.581 1.00 0.00 N ATOM 350 CA GLU A 26 3.814 2.656 6.080 1.00 0.00 C ATOM 351 C GLU A 26 2.624 3.435 5.526 1.00 0.00 C ATOM 352 O GLU A 26 2.509 4.644 5.732 1.00 0.00 O ATOM 353 CB GLU A 26 3.791 2.686 7.609 1.00 0.00 C ATOM 354 CG GLU A 26 4.670 1.627 8.252 1.00 0.00 C ATOM 355 CD GLU A 26 4.465 1.531 9.752 1.00 0.00 C ATOM 356 OE1 GLU A 26 5.001 2.392 10.480 1.00 0.00 O ATOM 357 OE2 GLU A 26 3.770 0.594 10.197 1.00 0.00 O ATOM 0 H GLU A 26 5.141 4.219 5.639 1.00 0.00 H new ATOM 0 HA GLU A 26 3.738 1.622 5.744 1.00 0.00 H new ATOM 0 HB2 GLU A 26 4.114 3.670 7.950 1.00 0.00 H new ATOM 0 HB3 GLU A 26 2.765 2.551 7.951 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.458 0.659 7.797 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.716 1.854 8.046 1.00 0.00 H new ATOM 364 N LEU A 27 1.741 2.735 4.824 1.00 0.00 N ATOM 365 CA LEU A 27 0.559 3.359 4.239 1.00 0.00 C ATOM 366 C LEU A 27 -0.710 2.888 4.943 1.00 0.00 C ATOM 367 O LEU A 27 -1.091 1.723 4.840 1.00 0.00 O ATOM 368 CB LEU A 27 0.476 3.042 2.745 1.00 0.00 C ATOM 369 CG LEU A 27 1.716 3.380 1.917 1.00 0.00 C ATOM 370 CD1 LEU A 27 1.562 2.870 0.493 1.00 0.00 C ATOM 371 CD2 LEU A 27 1.970 4.880 1.925 1.00 0.00 C ATOM 0 H LEU A 27 1.821 1.734 4.646 1.00 0.00 H new ATOM 0 HA LEU A 27 0.646 4.438 4.370 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.266 1.978 2.631 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.374 3.581 2.326 1.00 0.00 H new ATOM 0 HG LEU A 27 2.576 2.884 2.367 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.454 3.120 -0.081 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.430 1.788 0.506 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.691 3.336 0.032 1.00 0.00 H new ATOM 0 HD21 LEU A 27 2.856 5.102 1.331 1.00 0.00 H new ATOM 0 HD22 LEU A 27 1.109 5.397 1.500 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.126 5.217 2.950 1.00 0.00 H new ATOM 383 N GLU A 28 -1.360 3.803 5.655 1.00 0.00 N ATOM 384 CA GLU A 28 -2.587 3.480 6.374 1.00 0.00 C ATOM 385 C GLU A 28 -3.813 3.943 5.592 1.00 0.00 C ATOM 386 O GLU A 28 -3.756 4.926 4.852 1.00 0.00 O ATOM 387 CB GLU A 28 -2.578 4.127 7.760 1.00 0.00 C ATOM 388 CG GLU A 28 -3.564 3.500 8.731 1.00 0.00 C ATOM 389 CD GLU A 28 -3.970 4.448 9.844 1.00 0.00 C ATOM 390 OE1 GLU A 28 -4.751 5.383 9.572 1.00 0.00 O ATOM 391 OE2 GLU A 28 -3.505 4.253 10.987 1.00 0.00 O ATOM 0 H GLU A 28 -1.058 4.773 5.749 1.00 0.00 H new ATOM 0 HA GLU A 28 -2.637 2.397 6.487 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -1.574 4.056 8.178 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -2.806 5.188 7.658 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -4.453 3.183 8.186 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -3.121 2.604 9.166 1.00 0.00 H new ATOM 398 N CYS A 29 -4.920 3.228 5.762 1.00 0.00 N ATOM 399 CA CYS A 29 -6.160 3.563 5.072 1.00 0.00 C ATOM 400 C CYS A 29 -7.349 2.859 5.717 1.00 0.00 C ATOM 401 O CYS A 29 -7.183 1.878 6.440 1.00 0.00 O ATOM 402 CB CYS A 29 -6.066 3.181 3.594 1.00 0.00 C ATOM 403 SG CYS A 29 -5.122 1.671 3.281 1.00 0.00 S ATOM 0 H CYS A 29 -4.984 2.413 6.372 1.00 0.00 H new ATOM 0 HA CYS A 29 -6.311 4.639 5.152 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -7.073 3.056 3.197 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -5.607 4.004 3.045 1.00 0.00 H new ATOM 0 HG CYS A 29 -3.962 1.980 2.782 1.00 0.00 H new ATOM 409 N GLU A 30 -8.548 3.368 5.450 1.00 0.00 N ATOM 410 CA GLU A 30 -9.764 2.788 6.007 1.00 0.00 C ATOM 411 C GLU A 30 -10.746 2.415 4.900 1.00 0.00 C ATOM 412 O GLU A 30 -10.649 2.908 3.776 1.00 0.00 O ATOM 413 CB GLU A 30 -10.424 3.768 6.980 1.00 0.00 C ATOM 414 CG GLU A 30 -9.862 3.698 8.389 1.00 0.00 C ATOM 415 CD GLU A 30 -10.681 4.497 9.385 1.00 0.00 C ATOM 416 OE1 GLU A 30 -11.712 3.974 9.858 1.00 0.00 O ATOM 417 OE2 GLU A 30 -10.292 5.644 9.689 1.00 0.00 O ATOM 0 H GLU A 30 -8.703 4.180 4.852 1.00 0.00 H new ATOM 0 HA GLU A 30 -9.489 1.881 6.546 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -10.302 4.782 6.599 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -11.495 3.567 7.015 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -9.823 2.657 8.709 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -8.837 4.069 8.386 1.00 0.00 H new ATOM 424 N VAL A 31 -11.692 1.539 5.226 1.00 0.00 N ATOM 425 CA VAL A 31 -12.692 1.099 4.260 1.00 0.00 C ATOM 426 C VAL A 31 -14.096 1.182 4.847 1.00 0.00 C ATOM 427 O VAL A 31 -14.274 1.545 6.010 1.00 0.00 O ATOM 428 CB VAL A 31 -12.426 -0.345 3.796 1.00 0.00 C ATOM 429 CG1 VAL A 31 -11.330 -0.374 2.741 1.00 0.00 C ATOM 430 CG2 VAL A 31 -12.060 -1.227 4.980 1.00 0.00 C ATOM 0 H VAL A 31 -11.787 1.120 6.151 1.00 0.00 H new ATOM 0 HA VAL A 31 -12.620 1.768 3.402 1.00 0.00 H new ATOM 0 HB VAL A 31 -13.339 -0.738 3.348 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -11.156 -1.403 2.425 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -11.636 0.222 1.882 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -10.411 0.037 3.159 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -11.876 -2.244 4.633 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -11.161 -0.838 5.459 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -12.881 -1.232 5.698 1.00 0.00 H new ATOM 440 N SER A 32 -15.092 0.842 4.035 1.00 0.00 N ATOM 441 CA SER A 32 -16.482 0.881 4.473 1.00 0.00 C ATOM 442 C SER A 32 -16.823 -0.349 5.309 1.00 0.00 C ATOM 443 O SER A 32 -17.675 -0.293 6.196 1.00 0.00 O ATOM 444 CB SER A 32 -17.417 0.966 3.265 1.00 0.00 C ATOM 445 OG SER A 32 -18.763 1.144 3.673 1.00 0.00 O ATOM 0 H SER A 32 -14.962 0.537 3.071 1.00 0.00 H new ATOM 0 HA SER A 32 -16.618 1.768 5.092 1.00 0.00 H new ATOM 0 HB2 SER A 32 -17.115 1.795 2.625 1.00 0.00 H new ATOM 0 HB3 SER A 32 -17.331 0.057 2.670 1.00 0.00 H new ATOM 0 HG SER A 32 -19.340 1.197 2.883 1.00 0.00 H new ATOM 451 N GLU A 33 -16.152 -1.459 5.019 1.00 0.00 N ATOM 452 CA GLU A 33 -16.384 -2.703 5.743 1.00 0.00 C ATOM 453 C GLU A 33 -15.260 -2.971 6.739 1.00 0.00 C ATOM 454 O GLU A 33 -14.195 -2.356 6.670 1.00 0.00 O ATOM 455 CB GLU A 33 -16.504 -3.874 4.765 1.00 0.00 C ATOM 456 CG GLU A 33 -17.790 -3.862 3.956 1.00 0.00 C ATOM 457 CD GLU A 33 -17.943 -5.094 3.085 1.00 0.00 C ATOM 458 OE1 GLU A 33 -17.667 -6.207 3.579 1.00 0.00 O ATOM 459 OE2 GLU A 33 -18.337 -4.945 1.910 1.00 0.00 O ATOM 0 H GLU A 33 -15.444 -1.522 4.288 1.00 0.00 H new ATOM 0 HA GLU A 33 -17.319 -2.603 6.295 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -15.655 -3.854 4.082 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -16.444 -4.809 5.322 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -18.641 -3.793 4.634 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -17.811 -2.972 3.327 1.00 0.00 H new ATOM 466 N ASP A 34 -15.504 -3.893 7.664 1.00 0.00 N ATOM 467 CA ASP A 34 -14.513 -4.244 8.674 1.00 0.00 C ATOM 468 C ASP A 34 -13.785 -5.530 8.298 1.00 0.00 C ATOM 469 O ASP A 34 -14.301 -6.346 7.534 1.00 0.00 O ATOM 470 CB ASP A 34 -15.180 -4.402 10.041 1.00 0.00 C ATOM 471 CG ASP A 34 -16.151 -5.566 10.080 1.00 0.00 C ATOM 472 OD1 ASP A 34 -17.176 -5.509 9.369 1.00 0.00 O ATOM 473 OD2 ASP A 34 -15.884 -6.536 10.820 1.00 0.00 O ATOM 0 H ASP A 34 -16.380 -4.411 7.735 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.783 -3.437 8.726 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -14.413 -4.547 10.802 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -15.709 -3.483 10.292 1.00 0.00 H new ATOM 478 N ASP A 35 -12.583 -5.704 8.838 1.00 0.00 N ATOM 479 CA ASP A 35 -11.784 -6.891 8.558 1.00 0.00 C ATOM 480 C ASP A 35 -11.899 -7.290 7.091 1.00 0.00 C ATOM 481 O ASP A 35 -12.163 -8.449 6.771 1.00 0.00 O ATOM 482 CB ASP A 35 -12.226 -8.051 9.452 1.00 0.00 C ATOM 483 CG ASP A 35 -11.170 -9.134 9.559 1.00 0.00 C ATOM 484 OD1 ASP A 35 -10.177 -8.924 10.287 1.00 0.00 O ATOM 485 OD2 ASP A 35 -11.336 -10.191 8.914 1.00 0.00 O ATOM 0 H ASP A 35 -12.141 -5.038 9.472 1.00 0.00 H new ATOM 0 HA ASP A 35 -10.741 -6.656 8.770 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.455 -7.672 10.448 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -13.145 -8.482 9.055 1.00 0.00 H new ATOM 490 N ALA A 36 -11.699 -6.323 6.202 1.00 0.00 N ATOM 491 CA ALA A 36 -11.779 -6.574 4.768 1.00 0.00 C ATOM 492 C ALA A 36 -10.424 -6.995 4.208 1.00 0.00 C ATOM 493 O ALA A 36 -9.437 -7.069 4.937 1.00 0.00 O ATOM 494 CB ALA A 36 -12.291 -5.338 4.044 1.00 0.00 C ATOM 0 H ALA A 36 -11.480 -5.358 6.450 1.00 0.00 H new ATOM 0 HA ALA A 36 -12.480 -7.393 4.606 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -12.346 -5.540 2.974 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.283 -5.083 4.416 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -11.611 -4.505 4.222 1.00 0.00 H new ATOM 500 N ASN A 37 -10.386 -7.270 2.908 1.00 0.00 N ATOM 501 CA ASN A 37 -9.153 -7.685 2.251 1.00 0.00 C ATOM 502 C ASN A 37 -8.891 -6.845 1.004 1.00 0.00 C ATOM 503 O ASN A 37 -9.364 -7.168 -0.086 1.00 0.00 O ATOM 504 CB ASN A 37 -9.224 -9.167 1.875 1.00 0.00 C ATOM 505 CG ASN A 37 -7.970 -9.645 1.169 1.00 0.00 C ATOM 506 OD1 ASN A 37 -7.943 -9.770 -0.055 1.00 0.00 O ATOM 507 ND2 ASN A 37 -6.923 -9.915 1.941 1.00 0.00 N ATOM 0 H ASN A 37 -11.195 -7.213 2.289 1.00 0.00 H new ATOM 0 HA ASN A 37 -8.330 -7.533 2.950 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.379 -9.761 2.776 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -10.087 -9.335 1.230 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -6.051 -10.240 1.523 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -6.991 -9.797 2.952 1.00 0.00 H new ATOM 514 N VAL A 38 -8.135 -5.765 1.173 1.00 0.00 N ATOM 515 CA VAL A 38 -7.809 -4.879 0.062 1.00 0.00 C ATOM 516 C VAL A 38 -6.635 -5.420 -0.746 1.00 0.00 C ATOM 517 O VAL A 38 -5.858 -6.242 -0.260 1.00 0.00 O ATOM 518 CB VAL A 38 -7.466 -3.461 0.558 1.00 0.00 C ATOM 519 CG1 VAL A 38 -8.529 -2.961 1.524 1.00 0.00 C ATOM 520 CG2 VAL A 38 -6.091 -3.442 1.208 1.00 0.00 C ATOM 0 H VAL A 38 -7.737 -5.483 2.069 1.00 0.00 H new ATOM 0 HA VAL A 38 -8.693 -4.830 -0.574 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.446 -2.790 -0.301 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -8.269 -1.958 1.863 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -9.495 -2.935 1.020 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -8.585 -3.631 2.382 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -5.865 -2.433 1.552 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -6.080 -4.126 2.057 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -5.341 -3.754 0.481 1.00 0.00 H new ATOM 530 N LYS A 39 -6.512 -4.954 -1.985 1.00 0.00 N ATOM 531 CA LYS A 39 -5.433 -5.390 -2.863 1.00 0.00 C ATOM 532 C LYS A 39 -4.493 -4.232 -3.185 1.00 0.00 C ATOM 533 O LYS A 39 -4.867 -3.296 -3.891 1.00 0.00 O ATOM 534 CB LYS A 39 -6.004 -5.972 -4.157 1.00 0.00 C ATOM 535 CG LYS A 39 -6.662 -7.329 -3.975 1.00 0.00 C ATOM 536 CD LYS A 39 -7.764 -7.555 -4.996 1.00 0.00 C ATOM 537 CE LYS A 39 -8.194 -9.014 -5.038 1.00 0.00 C ATOM 538 NZ LYS A 39 -9.066 -9.369 -3.883 1.00 0.00 N ATOM 0 H LYS A 39 -7.147 -4.274 -2.403 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.866 -6.163 -2.344 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -6.735 -5.275 -4.567 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.202 -6.062 -4.890 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -5.911 -8.114 -4.068 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.076 -7.402 -2.969 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -8.622 -6.929 -4.752 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -7.416 -7.248 -5.982 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.727 -9.209 -5.969 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -7.311 -9.653 -5.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.337 -10.371 -3.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -8.549 -9.207 -2.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.921 -8.777 -3.899 1.00 0.00 H new ATOM 552 N TRP A 40 -3.274 -4.303 -2.664 1.00 0.00 N ATOM 553 CA TRP A 40 -2.281 -3.261 -2.898 1.00 0.00 C ATOM 554 C TRP A 40 -1.524 -3.512 -4.198 1.00 0.00 C ATOM 555 O TRP A 40 -1.015 -4.609 -4.429 1.00 0.00 O ATOM 556 CB TRP A 40 -1.299 -3.191 -1.727 1.00 0.00 C ATOM 557 CG TRP A 40 -1.960 -2.891 -0.416 1.00 0.00 C ATOM 558 CD1 TRP A 40 -2.641 -3.769 0.379 1.00 0.00 C ATOM 559 CD2 TRP A 40 -2.004 -1.625 0.252 1.00 0.00 C ATOM 560 NE1 TRP A 40 -3.105 -3.125 1.500 1.00 0.00 N ATOM 561 CE2 TRP A 40 -2.727 -1.810 1.447 1.00 0.00 C ATOM 562 CE3 TRP A 40 -1.501 -0.355 -0.041 1.00 0.00 C ATOM 563 CZ2 TRP A 40 -2.959 -0.770 2.344 1.00 0.00 C ATOM 564 CZ3 TRP A 40 -1.732 0.676 0.850 1.00 0.00 C ATOM 565 CH2 TRP A 40 -2.455 0.463 2.031 1.00 0.00 C ATOM 0 H TRP A 40 -2.949 -5.071 -2.077 1.00 0.00 H new ATOM 0 HA TRP A 40 -2.804 -2.308 -2.982 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -0.768 -4.140 -1.650 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -0.552 -2.424 -1.933 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -2.792 -4.815 0.158 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -3.644 -3.557 2.251 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -0.941 -0.182 -0.948 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -3.517 -0.931 3.255 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -1.349 1.662 0.632 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -2.618 1.289 2.708 1.00 0.00 H new ATOM 576 N PHE A 41 -1.453 -2.490 -5.043 1.00 0.00 N ATOM 577 CA PHE A 41 -0.758 -2.601 -6.321 1.00 0.00 C ATOM 578 C PHE A 41 0.318 -1.526 -6.450 1.00 0.00 C ATOM 579 O PHE A 41 0.072 -0.350 -6.185 1.00 0.00 O ATOM 580 CB PHE A 41 -1.752 -2.485 -7.478 1.00 0.00 C ATOM 581 CG PHE A 41 -2.822 -3.538 -7.457 1.00 0.00 C ATOM 582 CD1 PHE A 41 -3.930 -3.404 -6.636 1.00 0.00 C ATOM 583 CD2 PHE A 41 -2.720 -4.664 -8.259 1.00 0.00 C ATOM 584 CE1 PHE A 41 -4.915 -4.372 -6.614 1.00 0.00 C ATOM 585 CE2 PHE A 41 -3.703 -5.636 -8.242 1.00 0.00 C ATOM 586 CZ PHE A 41 -4.802 -5.489 -7.419 1.00 0.00 C ATOM 0 H PHE A 41 -1.868 -1.575 -4.867 1.00 0.00 H new ATOM 0 HA PHE A 41 -0.277 -3.578 -6.361 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -2.221 -1.501 -7.446 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -1.209 -2.549 -8.421 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -4.025 -2.532 -6.006 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -1.863 -4.783 -8.905 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -5.773 -4.256 -5.968 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -3.611 -6.509 -8.871 1.00 0.00 H new ATOM 0 HZ PHE A 41 -5.572 -6.246 -7.405 1.00 0.00 H new ATOM 596 N LYS A 42 1.513 -1.940 -6.858 1.00 0.00 N ATOM 597 CA LYS A 42 2.628 -1.016 -7.024 1.00 0.00 C ATOM 598 C LYS A 42 2.559 -0.317 -8.378 1.00 0.00 C ATOM 599 O LYS A 42 2.988 -0.865 -9.392 1.00 0.00 O ATOM 600 CB LYS A 42 3.959 -1.760 -6.889 1.00 0.00 C ATOM 601 CG LYS A 42 5.162 -0.934 -7.310 1.00 0.00 C ATOM 602 CD LYS A 42 6.426 -1.389 -6.599 1.00 0.00 C ATOM 603 CE LYS A 42 7.629 -0.555 -7.013 1.00 0.00 C ATOM 604 NZ LYS A 42 8.322 -1.132 -8.198 1.00 0.00 N ATOM 0 H LYS A 42 1.734 -2.911 -7.080 1.00 0.00 H new ATOM 0 HA LYS A 42 2.560 -0.261 -6.241 1.00 0.00 H new ATOM 0 HB2 LYS A 42 4.088 -2.072 -5.853 1.00 0.00 H new ATOM 0 HB3 LYS A 42 3.922 -2.667 -7.493 1.00 0.00 H new ATOM 0 HG2 LYS A 42 5.301 -1.014 -8.388 1.00 0.00 H new ATOM 0 HG3 LYS A 42 4.978 0.118 -7.090 1.00 0.00 H new ATOM 0 HD2 LYS A 42 6.285 -1.316 -5.521 1.00 0.00 H new ATOM 0 HD3 LYS A 42 6.614 -2.439 -6.825 1.00 0.00 H new ATOM 0 HE2 LYS A 42 7.306 0.461 -7.240 1.00 0.00 H new ATOM 0 HE3 LYS A 42 8.329 -0.488 -6.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 9.136 -0.535 -8.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 8.653 -2.092 -7.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 7.662 -1.172 -9.001 1.00 0.00 H new ATOM 618 N ASN A 43 2.017 0.897 -8.386 1.00 0.00 N ATOM 619 CA ASN A 43 1.893 1.670 -9.616 1.00 0.00 C ATOM 620 C ASN A 43 1.242 0.840 -10.717 1.00 0.00 C ATOM 621 O ASN A 43 1.443 1.096 -11.903 1.00 0.00 O ATOM 622 CB ASN A 43 3.268 2.160 -10.076 1.00 0.00 C ATOM 623 CG ASN A 43 4.116 1.043 -10.653 1.00 0.00 C ATOM 624 OD1 ASN A 43 3.639 0.236 -11.452 1.00 0.00 O ATOM 625 ND2 ASN A 43 5.380 0.991 -10.251 1.00 0.00 N ATOM 0 H ASN A 43 1.657 1.366 -7.555 1.00 0.00 H new ATOM 0 HA ASN A 43 1.257 2.532 -9.412 1.00 0.00 H new ATOM 0 HB2 ASN A 43 3.140 2.940 -10.826 1.00 0.00 H new ATOM 0 HB3 ASN A 43 3.791 2.611 -9.233 1.00 0.00 H new ATOM 0 HD21 ASN A 43 5.998 0.261 -10.606 1.00 0.00 H new ATOM 0 HD22 ASN A 43 5.733 1.681 -9.587 1.00 0.00 H new ATOM 632 N GLY A 44 0.459 -0.157 -10.315 1.00 0.00 N ATOM 633 CA GLY A 44 -0.211 -1.009 -11.280 1.00 0.00 C ATOM 634 C GLY A 44 0.108 -2.477 -11.076 1.00 0.00 C ATOM 635 O GLY A 44 -0.739 -3.340 -11.307 1.00 0.00 O ATOM 0 H GLY A 44 0.277 -0.390 -9.339 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -1.288 -0.860 -11.205 1.00 0.00 H new ATOM 0 HA3 GLY A 44 0.082 -0.713 -12.287 1.00 0.00 H new ATOM 639 N GLU A 45 1.332 -2.761 -10.643 1.00 0.00 N ATOM 640 CA GLU A 45 1.760 -4.135 -10.411 1.00 0.00 C ATOM 641 C GLU A 45 1.085 -4.714 -9.171 1.00 0.00 C ATOM 642 O GLU A 45 0.820 -3.998 -8.206 1.00 0.00 O ATOM 643 CB GLU A 45 3.281 -4.200 -10.254 1.00 0.00 C ATOM 644 CG GLU A 45 4.038 -3.937 -11.545 1.00 0.00 C ATOM 645 CD GLU A 45 5.417 -3.354 -11.305 1.00 0.00 C ATOM 646 OE1 GLU A 45 5.560 -2.535 -10.373 1.00 0.00 O ATOM 647 OE2 GLU A 45 6.353 -3.716 -12.048 1.00 0.00 O ATOM 0 H GLU A 45 2.044 -2.058 -10.446 1.00 0.00 H new ATOM 0 HA GLU A 45 1.465 -4.730 -11.275 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.592 -3.471 -9.505 1.00 0.00 H new ATOM 0 HB3 GLU A 45 3.557 -5.184 -9.875 1.00 0.00 H new ATOM 0 HG2 GLU A 45 4.134 -4.869 -12.102 1.00 0.00 H new ATOM 0 HG3 GLU A 45 3.461 -3.252 -12.167 1.00 0.00 H new ATOM 654 N GLU A 46 0.809 -6.014 -9.207 1.00 0.00 N ATOM 655 CA GLU A 46 0.163 -6.687 -8.087 1.00 0.00 C ATOM 656 C GLU A 46 1.194 -7.149 -7.062 1.00 0.00 C ATOM 657 O GLU A 46 2.095 -7.927 -7.379 1.00 0.00 O ATOM 658 CB GLU A 46 -0.650 -7.885 -8.583 1.00 0.00 C ATOM 659 CG GLU A 46 -1.248 -8.721 -7.464 1.00 0.00 C ATOM 660 CD GLU A 46 -2.227 -9.762 -7.972 1.00 0.00 C ATOM 661 OE1 GLU A 46 -3.377 -9.389 -8.286 1.00 0.00 O ATOM 662 OE2 GLU A 46 -1.844 -10.947 -8.055 1.00 0.00 O ATOM 0 H GLU A 46 1.022 -6.621 -9.998 1.00 0.00 H new ATOM 0 HA GLU A 46 -0.508 -5.975 -7.607 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -1.454 -7.527 -9.226 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.010 -8.519 -9.196 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.446 -9.218 -6.918 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.756 -8.065 -6.757 1.00 0.00 H new ATOM 669 N ILE A 47 1.056 -6.664 -5.832 1.00 0.00 N ATOM 670 CA ILE A 47 1.975 -7.027 -4.761 1.00 0.00 C ATOM 671 C ILE A 47 1.561 -8.338 -4.102 1.00 0.00 C ATOM 672 O ILE A 47 0.397 -8.526 -3.748 1.00 0.00 O ATOM 673 CB ILE A 47 2.049 -5.926 -3.686 1.00 0.00 C ATOM 674 CG1 ILE A 47 2.537 -4.613 -4.302 1.00 0.00 C ATOM 675 CG2 ILE A 47 2.965 -6.357 -2.549 1.00 0.00 C ATOM 676 CD1 ILE A 47 2.539 -3.454 -3.330 1.00 0.00 C ATOM 0 H ILE A 47 0.317 -6.019 -5.553 1.00 0.00 H new ATOM 0 HA ILE A 47 2.958 -7.147 -5.216 1.00 0.00 H new ATOM 0 HB ILE A 47 1.050 -5.766 -3.281 1.00 0.00 H new ATOM 0 HG12 ILE A 47 3.547 -4.755 -4.688 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.903 -4.362 -5.153 1.00 0.00 H new ATOM 0 HG21 ILE A 47 3.007 -5.569 -1.797 1.00 0.00 H new ATOM 0 HG22 ILE A 47 2.578 -7.270 -2.096 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.966 -6.541 -2.938 1.00 0.00 H new ATOM 0 HD11 ILE A 47 2.896 -2.556 -3.835 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.527 -3.285 -2.963 1.00 0.00 H new ATOM 0 HD13 ILE A 47 3.196 -3.684 -2.491 1.00 0.00 H new ATOM 688 N ILE A 48 2.522 -9.241 -3.939 1.00 0.00 N ATOM 689 CA ILE A 48 2.258 -10.534 -3.320 1.00 0.00 C ATOM 690 C ILE A 48 3.117 -10.734 -2.076 1.00 0.00 C ATOM 691 O ILE A 48 4.232 -11.254 -2.139 1.00 0.00 O ATOM 692 CB ILE A 48 2.517 -11.692 -4.301 1.00 0.00 C ATOM 693 CG1 ILE A 48 1.682 -11.511 -5.570 1.00 0.00 C ATOM 694 CG2 ILE A 48 2.204 -13.027 -3.641 1.00 0.00 C ATOM 695 CD1 ILE A 48 0.197 -11.698 -5.348 1.00 0.00 C ATOM 0 H ILE A 48 3.490 -9.101 -4.227 1.00 0.00 H new ATOM 0 HA ILE A 48 1.206 -10.538 -3.036 1.00 0.00 H new ATOM 0 HB ILE A 48 3.571 -11.684 -4.578 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.858 -10.513 -5.972 1.00 0.00 H new ATOM 0 HG13 ILE A 48 2.021 -12.223 -6.323 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.392 -13.835 -4.348 1.00 0.00 H new ATOM 0 HG22 ILE A 48 2.838 -13.157 -2.764 1.00 0.00 H new ATOM 0 HG23 ILE A 48 1.157 -13.046 -3.338 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -0.333 -11.555 -6.290 1.00 0.00 H new ATOM 0 HD12 ILE A 48 0.009 -12.705 -4.975 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -0.157 -10.969 -4.619 1.00 0.00 H new ATOM 707 N PRO A 49 2.588 -10.314 -0.917 1.00 0.00 N ATOM 708 CA PRO A 49 3.289 -10.439 0.364 1.00 0.00 C ATOM 709 C PRO A 49 3.399 -11.888 0.826 1.00 0.00 C ATOM 710 O PRO A 49 3.022 -12.810 0.104 1.00 0.00 O ATOM 711 CB PRO A 49 2.413 -9.635 1.327 1.00 0.00 C ATOM 712 CG PRO A 49 1.053 -9.669 0.720 1.00 0.00 C ATOM 713 CD PRO A 49 1.265 -9.686 -0.769 1.00 0.00 C ATOM 0 HA PRO A 49 4.317 -10.082 0.303 1.00 0.00 H new ATOM 0 HB2 PRO A 49 2.413 -10.076 2.324 1.00 0.00 H new ATOM 0 HB3 PRO A 49 2.775 -8.612 1.431 1.00 0.00 H new ATOM 0 HG2 PRO A 49 0.502 -10.551 1.046 1.00 0.00 H new ATOM 0 HG3 PRO A 49 0.469 -8.799 1.021 1.00 0.00 H new ATOM 0 HD2 PRO A 49 0.489 -10.257 -1.279 1.00 0.00 H new ATOM 0 HD3 PRO A 49 1.248 -8.680 -1.189 1.00 0.00 H new ATOM 721 N GLY A 50 3.918 -12.081 2.035 1.00 0.00 N ATOM 722 CA GLY A 50 4.068 -13.421 2.572 1.00 0.00 C ATOM 723 C GLY A 50 5.219 -13.527 3.553 1.00 0.00 C ATOM 724 O GLY A 50 5.802 -12.526 3.970 1.00 0.00 O ATOM 0 H GLY A 50 4.237 -11.334 2.652 1.00 0.00 H new ATOM 0 HA2 GLY A 50 3.143 -13.716 3.068 1.00 0.00 H new ATOM 0 HA3 GLY A 50 4.227 -14.122 1.752 1.00 0.00 H new ATOM 728 N PRO A 51 5.561 -14.765 3.938 1.00 0.00 N ATOM 729 CA PRO A 51 6.652 -15.028 4.881 1.00 0.00 C ATOM 730 C PRO A 51 8.022 -14.730 4.281 1.00 0.00 C ATOM 731 O PRO A 51 8.980 -14.449 5.001 1.00 0.00 O ATOM 732 CB PRO A 51 6.512 -16.523 5.178 1.00 0.00 C ATOM 733 CG PRO A 51 5.830 -17.085 3.979 1.00 0.00 C ATOM 734 CD PRO A 51 4.910 -16.005 3.481 1.00 0.00 C ATOM 0 HA PRO A 51 6.586 -14.396 5.766 1.00 0.00 H new ATOM 0 HB2 PRO A 51 7.485 -16.988 5.334 1.00 0.00 H new ATOM 0 HB3 PRO A 51 5.928 -16.694 6.082 1.00 0.00 H new ATOM 0 HG2 PRO A 51 6.554 -17.364 3.214 1.00 0.00 H new ATOM 0 HG3 PRO A 51 5.272 -17.986 4.234 1.00 0.00 H new ATOM 0 HD2 PRO A 51 4.811 -16.030 2.396 1.00 0.00 H new ATOM 0 HD3 PRO A 51 3.907 -16.109 3.895 1.00 0.00 H new ATOM 742 N LYS A 52 8.109 -14.793 2.956 1.00 0.00 N ATOM 743 CA LYS A 52 9.361 -14.528 2.257 1.00 0.00 C ATOM 744 C LYS A 52 9.181 -13.427 1.218 1.00 0.00 C ATOM 745 O LYS A 52 9.617 -13.562 0.074 1.00 0.00 O ATOM 746 CB LYS A 52 9.871 -15.803 1.582 1.00 0.00 C ATOM 747 CG LYS A 52 10.511 -16.788 2.546 1.00 0.00 C ATOM 748 CD LYS A 52 11.230 -17.904 1.808 1.00 0.00 C ATOM 749 CE LYS A 52 12.060 -18.755 2.756 1.00 0.00 C ATOM 750 NZ LYS A 52 13.172 -19.450 2.049 1.00 0.00 N ATOM 0 H LYS A 52 7.326 -15.026 2.345 1.00 0.00 H new ATOM 0 HA LYS A 52 10.095 -14.194 2.991 1.00 0.00 H new ATOM 0 HB2 LYS A 52 9.040 -16.292 1.074 1.00 0.00 H new ATOM 0 HB3 LYS A 52 10.598 -15.533 0.816 1.00 0.00 H new ATOM 0 HG2 LYS A 52 11.217 -16.262 3.189 1.00 0.00 H new ATOM 0 HG3 LYS A 52 9.745 -17.214 3.194 1.00 0.00 H new ATOM 0 HD2 LYS A 52 10.501 -18.533 1.297 1.00 0.00 H new ATOM 0 HD3 LYS A 52 11.876 -17.477 1.041 1.00 0.00 H new ATOM 0 HE2 LYS A 52 12.469 -18.125 3.546 1.00 0.00 H new ATOM 0 HE3 LYS A 52 11.418 -19.493 3.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 13.714 -20.020 2.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 12.781 -20.071 1.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 13.799 -18.745 1.611 1.00 0.00 H new ATOM 764 N SER A 53 8.538 -12.336 1.622 1.00 0.00 N ATOM 765 CA SER A 53 8.299 -11.212 0.725 1.00 0.00 C ATOM 766 C SER A 53 8.747 -9.902 1.364 1.00 0.00 C ATOM 767 O SER A 53 8.958 -9.830 2.575 1.00 0.00 O ATOM 768 CB SER A 53 6.817 -11.133 0.356 1.00 0.00 C ATOM 769 OG SER A 53 6.449 -12.193 -0.510 1.00 0.00 O ATOM 0 H SER A 53 8.173 -12.207 2.566 1.00 0.00 H new ATOM 0 HA SER A 53 8.883 -11.372 -0.181 1.00 0.00 H new ATOM 0 HB2 SER A 53 6.211 -11.172 1.261 1.00 0.00 H new ATOM 0 HB3 SER A 53 6.609 -10.177 -0.125 1.00 0.00 H new ATOM 0 HG SER A 53 5.700 -11.909 -1.075 1.00 0.00 H new ATOM 775 N ARG A 54 8.888 -8.867 0.542 1.00 0.00 N ATOM 776 CA ARG A 54 9.311 -7.559 1.026 1.00 0.00 C ATOM 777 C ARG A 54 8.123 -6.768 1.566 1.00 0.00 C ATOM 778 O ARG A 54 8.208 -6.144 2.624 1.00 0.00 O ATOM 779 CB ARG A 54 9.993 -6.773 -0.095 1.00 0.00 C ATOM 780 CG ARG A 54 11.376 -7.294 -0.451 1.00 0.00 C ATOM 781 CD ARG A 54 11.307 -8.355 -1.538 1.00 0.00 C ATOM 782 NE ARG A 54 12.593 -9.020 -1.735 1.00 0.00 N ATOM 783 CZ ARG A 54 12.784 -10.008 -2.603 1.00 0.00 C ATOM 784 NH1 ARG A 54 11.778 -10.442 -3.351 1.00 0.00 N ATOM 785 NH2 ARG A 54 13.983 -10.562 -2.725 1.00 0.00 N ATOM 0 H ARG A 54 8.715 -8.909 -0.462 1.00 0.00 H new ATOM 0 HA ARG A 54 10.022 -7.713 1.838 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.363 -6.803 -0.984 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.074 -5.728 0.203 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.002 -6.468 -0.787 1.00 0.00 H new ATOM 0 HG3 ARG A 54 11.849 -7.712 0.438 1.00 0.00 H new ATOM 0 HD2 ARG A 54 10.552 -9.096 -1.274 1.00 0.00 H new ATOM 0 HD3 ARG A 54 10.989 -7.895 -2.474 1.00 0.00 H new ATOM 0 HE ARG A 54 13.387 -8.709 -1.176 1.00 0.00 H new ATOM 0 HH11 ARG A 54 10.855 -10.017 -3.261 1.00 0.00 H new ATOM 0 HH12 ARG A 54 11.927 -11.200 -4.016 1.00 0.00 H new ATOM 0 HH21 ARG A 54 14.759 -10.230 -2.152 1.00 0.00 H new ATOM 0 HH22 ARG A 54 14.129 -11.320 -3.391 1.00 0.00 H new ATOM 799 N TYR A 55 7.016 -6.799 0.832 1.00 0.00 N ATOM 800 CA TYR A 55 5.811 -6.083 1.235 1.00 0.00 C ATOM 801 C TYR A 55 4.987 -6.913 2.214 1.00 0.00 C ATOM 802 O TYR A 55 4.904 -8.136 2.093 1.00 0.00 O ATOM 803 CB TYR A 55 4.967 -5.733 0.009 1.00 0.00 C ATOM 804 CG TYR A 55 5.725 -4.965 -1.050 1.00 0.00 C ATOM 805 CD1 TYR A 55 6.478 -5.628 -2.011 1.00 0.00 C ATOM 806 CD2 TYR A 55 5.688 -3.577 -1.089 1.00 0.00 C ATOM 807 CE1 TYR A 55 7.173 -4.930 -2.980 1.00 0.00 C ATOM 808 CE2 TYR A 55 6.379 -2.871 -2.055 1.00 0.00 C ATOM 809 CZ TYR A 55 7.121 -3.552 -2.997 1.00 0.00 C ATOM 810 OH TYR A 55 7.811 -2.853 -3.961 1.00 0.00 O ATOM 0 H TYR A 55 6.928 -7.312 -0.045 1.00 0.00 H new ATOM 0 HA TYR A 55 6.115 -5.162 1.733 1.00 0.00 H new ATOM 0 HB2 TYR A 55 4.579 -6.653 -0.429 1.00 0.00 H new ATOM 0 HB3 TYR A 55 4.107 -5.144 0.327 1.00 0.00 H new ATOM 0 HD1 TYR A 55 6.521 -6.707 -2.000 1.00 0.00 H new ATOM 0 HD2 TYR A 55 5.109 -3.041 -0.352 1.00 0.00 H new ATOM 0 HE1 TYR A 55 7.754 -5.461 -3.720 1.00 0.00 H new ATOM 0 HE2 TYR A 55 6.338 -1.792 -2.072 1.00 0.00 H new ATOM 0 HH TYR A 55 7.668 -1.892 -3.833 1.00 0.00 H new ATOM 820 N ARG A 56 4.378 -6.239 3.184 1.00 0.00 N ATOM 821 CA ARG A 56 3.559 -6.913 4.186 1.00 0.00 C ATOM 822 C ARG A 56 2.251 -6.162 4.413 1.00 0.00 C ATOM 823 O ARG A 56 2.243 -5.066 4.975 1.00 0.00 O ATOM 824 CB ARG A 56 4.326 -7.035 5.504 1.00 0.00 C ATOM 825 CG ARG A 56 5.774 -7.462 5.329 1.00 0.00 C ATOM 826 CD ARG A 56 6.656 -6.909 6.437 1.00 0.00 C ATOM 827 NE ARG A 56 6.218 -7.353 7.758 1.00 0.00 N ATOM 828 CZ ARG A 56 6.425 -8.578 8.227 1.00 0.00 C ATOM 829 NH1 ARG A 56 7.059 -9.477 7.487 1.00 0.00 N ATOM 830 NH2 ARG A 56 5.996 -8.907 9.439 1.00 0.00 N ATOM 0 H ARG A 56 4.436 -5.227 3.298 1.00 0.00 H new ATOM 0 HA ARG A 56 3.325 -7.911 3.817 1.00 0.00 H new ATOM 0 HB2 ARG A 56 4.299 -6.075 6.020 1.00 0.00 H new ATOM 0 HB3 ARG A 56 3.818 -7.756 6.145 1.00 0.00 H new ATOM 0 HG2 ARG A 56 5.835 -8.550 5.323 1.00 0.00 H new ATOM 0 HG3 ARG A 56 6.142 -7.117 4.363 1.00 0.00 H new ATOM 0 HD2 ARG A 56 7.686 -7.224 6.272 1.00 0.00 H new ATOM 0 HD3 ARG A 56 6.646 -5.820 6.399 1.00 0.00 H new ATOM 0 HE ARG A 56 5.726 -6.686 8.353 1.00 0.00 H new ATOM 0 HH11 ARG A 56 7.389 -9.229 6.555 1.00 0.00 H new ATOM 0 HH12 ARG A 56 7.216 -10.417 7.850 1.00 0.00 H new ATOM 0 HH21 ARG A 56 5.507 -8.219 10.011 1.00 0.00 H new ATOM 0 HH22 ARG A 56 6.155 -9.848 9.798 1.00 0.00 H new ATOM 844 N ILE A 57 1.148 -6.758 3.973 1.00 0.00 N ATOM 845 CA ILE A 57 -0.165 -6.146 4.130 1.00 0.00 C ATOM 846 C ILE A 57 -0.862 -6.653 5.387 1.00 0.00 C ATOM 847 O ILE A 57 -1.158 -7.842 5.508 1.00 0.00 O ATOM 848 CB ILE A 57 -1.064 -6.423 2.910 1.00 0.00 C ATOM 849 CG1 ILE A 57 -0.439 -5.834 1.644 1.00 0.00 C ATOM 850 CG2 ILE A 57 -2.455 -5.848 3.137 1.00 0.00 C ATOM 851 CD1 ILE A 57 -0.947 -6.469 0.368 1.00 0.00 C ATOM 0 H ILE A 57 1.138 -7.664 3.505 1.00 0.00 H new ATOM 0 HA ILE A 57 -0.004 -5.071 4.216 1.00 0.00 H new ATOM 0 HB ILE A 57 -1.154 -7.502 2.780 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.641 -4.763 1.613 1.00 0.00 H new ATOM 0 HG13 ILE A 57 0.643 -5.953 1.694 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -3.079 -6.051 2.267 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.900 -6.309 4.019 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -2.383 -4.771 3.288 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.461 -6.003 -0.489 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.721 -7.535 0.377 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.025 -6.327 0.295 1.00 0.00 H new ATOM 863 N ARG A 58 -1.124 -5.744 6.321 1.00 0.00 N ATOM 864 CA ARG A 58 -1.787 -6.100 7.569 1.00 0.00 C ATOM 865 C ARG A 58 -3.105 -5.345 7.719 1.00 0.00 C ATOM 866 O ARG A 58 -3.227 -4.197 7.291 1.00 0.00 O ATOM 867 CB ARG A 58 -0.876 -5.797 8.760 1.00 0.00 C ATOM 868 CG ARG A 58 -1.593 -5.829 10.099 1.00 0.00 C ATOM 869 CD ARG A 58 -0.643 -5.524 11.247 1.00 0.00 C ATOM 870 NE ARG A 58 0.484 -6.451 11.286 1.00 0.00 N ATOM 871 CZ ARG A 58 1.300 -6.573 12.327 1.00 0.00 C ATOM 872 NH1 ARG A 58 1.114 -5.832 13.410 1.00 0.00 N ATOM 873 NH2 ARG A 58 2.304 -7.440 12.286 1.00 0.00 N ATOM 0 H ARG A 58 -0.887 -4.756 6.236 1.00 0.00 H new ATOM 0 HA ARG A 58 -2.000 -7.169 7.546 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -0.061 -6.521 8.777 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -0.426 -4.814 8.622 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -2.406 -5.103 10.095 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -2.043 -6.810 10.249 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -0.270 -4.504 11.148 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -1.187 -5.574 12.190 1.00 0.00 H new ATOM 0 HE ARG A 58 0.654 -7.037 10.469 1.00 0.00 H new ATOM 0 HH11 ARG A 58 0.343 -5.166 13.446 1.00 0.00 H new ATOM 0 HH12 ARG A 58 1.742 -5.928 14.208 1.00 0.00 H new ATOM 0 HH21 ARG A 58 2.449 -8.013 11.455 1.00 0.00 H new ATOM 0 HH22 ARG A 58 2.930 -7.533 13.086 1.00 0.00 H new ATOM 887 N VAL A 59 -4.089 -5.999 8.328 1.00 0.00 N ATOM 888 CA VAL A 59 -5.398 -5.390 8.534 1.00 0.00 C ATOM 889 C VAL A 59 -5.711 -5.250 10.020 1.00 0.00 C ATOM 890 O VAL A 59 -5.725 -6.236 10.756 1.00 0.00 O ATOM 891 CB VAL A 59 -6.512 -6.214 7.862 1.00 0.00 C ATOM 892 CG1 VAL A 59 -6.515 -7.640 8.390 1.00 0.00 C ATOM 893 CG2 VAL A 59 -7.866 -5.554 8.077 1.00 0.00 C ATOM 0 H VAL A 59 -4.005 -6.950 8.687 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.362 -4.401 8.078 1.00 0.00 H new ATOM 0 HB VAL A 59 -6.317 -6.250 6.790 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -7.309 -8.206 7.903 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.554 -8.108 8.179 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.685 -7.629 9.467 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -8.642 -6.150 7.596 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -8.072 -5.485 9.145 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -7.856 -4.554 7.644 1.00 0.00 H new ATOM 903 N GLU A 60 -5.961 -4.018 10.453 1.00 0.00 N ATOM 904 CA GLU A 60 -6.273 -3.750 11.851 1.00 0.00 C ATOM 905 C GLU A 60 -7.645 -3.095 11.987 1.00 0.00 C ATOM 906 O GLU A 60 -7.804 -1.904 11.724 1.00 0.00 O ATOM 907 CB GLU A 60 -5.203 -2.850 12.472 1.00 0.00 C ATOM 908 CG GLU A 60 -3.996 -3.610 12.995 1.00 0.00 C ATOM 909 CD GLU A 60 -3.333 -2.917 14.169 1.00 0.00 C ATOM 910 OE1 GLU A 60 -3.503 -1.687 14.305 1.00 0.00 O ATOM 911 OE2 GLU A 60 -2.644 -3.604 14.953 1.00 0.00 O ATOM 0 H GLU A 60 -5.953 -3.191 9.856 1.00 0.00 H new ATOM 0 HA GLU A 60 -6.290 -4.702 12.381 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -4.871 -2.127 11.727 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -5.647 -2.283 13.290 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -4.304 -4.611 13.296 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -3.270 -3.729 12.191 1.00 0.00 H new ATOM 918 N GLY A 61 -8.633 -3.884 12.398 1.00 0.00 N ATOM 919 CA GLY A 61 -9.978 -3.365 12.560 1.00 0.00 C ATOM 920 C GLY A 61 -10.636 -3.034 11.235 1.00 0.00 C ATOM 921 O GLY A 61 -11.024 -3.930 10.485 1.00 0.00 O ATOM 0 H GLY A 61 -8.526 -4.873 12.622 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -10.585 -4.098 13.091 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -9.946 -2.469 13.180 1.00 0.00 H new ATOM 925 N LYS A 62 -10.764 -1.744 10.945 1.00 0.00 N ATOM 926 CA LYS A 62 -11.380 -1.296 9.702 1.00 0.00 C ATOM 927 C LYS A 62 -10.395 -0.482 8.869 1.00 0.00 C ATOM 928 O LYS A 62 -10.790 0.263 7.973 1.00 0.00 O ATOM 929 CB LYS A 62 -12.626 -0.459 9.999 1.00 0.00 C ATOM 930 CG LYS A 62 -13.572 -1.108 10.995 1.00 0.00 C ATOM 931 CD LYS A 62 -14.716 -0.178 11.364 1.00 0.00 C ATOM 932 CE LYS A 62 -15.820 -0.211 10.319 1.00 0.00 C ATOM 933 NZ LYS A 62 -17.001 0.596 10.734 1.00 0.00 N ATOM 0 H LYS A 62 -10.449 -0.989 11.555 1.00 0.00 H new ATOM 0 HA LYS A 62 -11.670 -2.178 9.131 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -12.317 0.513 10.384 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -13.162 -0.277 9.067 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -13.973 -2.029 10.571 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -13.022 -1.384 11.894 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -15.122 -0.466 12.333 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -14.340 0.840 11.466 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -15.435 0.168 9.372 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -16.127 -1.243 10.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -17.731 0.548 9.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -17.384 0.219 11.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -16.714 1.586 10.873 1.00 0.00 H new ATOM 947 N LYS A 63 -9.109 -0.632 9.169 1.00 0.00 N ATOM 948 CA LYS A 63 -8.066 0.087 8.446 1.00 0.00 C ATOM 949 C LYS A 63 -6.908 -0.843 8.096 1.00 0.00 C ATOM 950 O LYS A 63 -6.533 -1.710 8.887 1.00 0.00 O ATOM 951 CB LYS A 63 -7.555 1.262 9.282 1.00 0.00 C ATOM 952 CG LYS A 63 -6.578 0.855 10.371 1.00 0.00 C ATOM 953 CD LYS A 63 -5.800 2.050 10.898 1.00 0.00 C ATOM 954 CE LYS A 63 -6.712 3.045 11.598 1.00 0.00 C ATOM 955 NZ LYS A 63 -6.948 2.676 13.021 1.00 0.00 N ATOM 0 H LYS A 63 -8.764 -1.245 9.908 1.00 0.00 H new ATOM 0 HA LYS A 63 -8.497 0.468 7.520 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -7.071 1.983 8.623 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.405 1.768 9.739 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -7.121 0.383 11.190 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -5.884 0.112 9.979 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -5.032 1.708 11.592 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -5.287 2.544 10.073 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -6.269 4.040 11.550 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -7.666 3.095 11.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -7.574 3.379 13.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -7.394 1.738 13.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -6.041 2.653 13.529 1.00 0.00 H new ATOM 969 N HIS A 64 -6.344 -0.656 6.907 1.00 0.00 N ATOM 970 CA HIS A 64 -5.226 -1.476 6.453 1.00 0.00 C ATOM 971 C HIS A 64 -3.914 -0.704 6.543 1.00 0.00 C ATOM 972 O HIS A 64 -3.906 0.527 6.542 1.00 0.00 O ATOM 973 CB HIS A 64 -5.460 -1.944 5.017 1.00 0.00 C ATOM 974 CG HIS A 64 -6.579 -2.930 4.882 1.00 0.00 C ATOM 975 ND1 HIS A 64 -6.415 -4.186 4.337 1.00 0.00 N ATOM 976 CD2 HIS A 64 -7.885 -2.840 5.227 1.00 0.00 C ATOM 977 CE1 HIS A 64 -7.571 -4.825 4.351 1.00 0.00 C ATOM 978 NE2 HIS A 64 -8.480 -4.030 4.887 1.00 0.00 N ATOM 0 H HIS A 64 -6.643 0.056 6.240 1.00 0.00 H new ATOM 0 HA HIS A 64 -5.158 -2.348 7.104 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -5.673 -1.077 4.392 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -4.543 -2.394 4.636 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -8.369 -1.990 5.685 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -7.744 -5.827 3.986 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -9.463 -4.262 5.026 1.00 0.00 H new ATOM 987 N ILE A 65 -2.807 -1.435 6.620 1.00 0.00 N ATOM 988 CA ILE A 65 -1.489 -0.819 6.710 1.00 0.00 C ATOM 989 C ILE A 65 -0.470 -1.574 5.864 1.00 0.00 C ATOM 990 O ILE A 65 -0.121 -2.717 6.166 1.00 0.00 O ATOM 991 CB ILE A 65 -0.991 -0.763 8.166 1.00 0.00 C ATOM 992 CG1 ILE A 65 -1.903 0.133 9.006 1.00 0.00 C ATOM 993 CG2 ILE A 65 0.444 -0.263 8.216 1.00 0.00 C ATOM 994 CD1 ILE A 65 -3.054 -0.609 9.649 1.00 0.00 C ATOM 0 H ILE A 65 -2.797 -2.455 6.622 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.590 0.198 6.331 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.019 -1.770 8.583 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.310 0.613 9.785 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -2.301 0.927 8.374 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.782 -0.229 9.252 1.00 0.00 H new ATOM 0 HG22 ILE A 65 1.084 -0.938 7.648 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.496 0.737 7.784 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -3.658 0.089 10.229 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -3.670 -1.066 8.875 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -2.664 -1.385 10.308 1.00 0.00 H new ATOM 1006 N LEU A 66 0.006 -0.930 4.805 1.00 0.00 N ATOM 1007 CA LEU A 66 0.988 -1.540 3.915 1.00 0.00 C ATOM 1008 C LEU A 66 2.398 -1.065 4.253 1.00 0.00 C ATOM 1009 O LEU A 66 2.780 0.059 3.926 1.00 0.00 O ATOM 1010 CB LEU A 66 0.661 -1.208 2.458 1.00 0.00 C ATOM 1011 CG LEU A 66 1.605 -1.795 1.408 1.00 0.00 C ATOM 1012 CD1 LEU A 66 1.319 -3.274 1.201 1.00 0.00 C ATOM 1013 CD2 LEU A 66 1.480 -1.036 0.095 1.00 0.00 C ATOM 0 H LEU A 66 -0.272 0.015 4.541 1.00 0.00 H new ATOM 0 HA LEU A 66 0.945 -2.620 4.053 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.349 -1.557 2.245 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.654 -0.124 2.346 1.00 0.00 H new ATOM 0 HG LEU A 66 2.629 -1.691 1.768 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.000 -3.675 0.450 1.00 0.00 H new ATOM 0 HD12 LEU A 66 1.461 -3.807 2.141 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.291 -3.402 0.863 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.159 -1.467 -0.641 1.00 0.00 H new ATOM 0 HD22 LEU A 66 0.456 -1.108 -0.271 1.00 0.00 H new ATOM 0 HD23 LEU A 66 1.736 0.011 0.254 1.00 0.00 H new ATOM 1025 N ILE A 67 3.167 -1.930 4.907 1.00 0.00 N ATOM 1026 CA ILE A 67 4.535 -1.600 5.286 1.00 0.00 C ATOM 1027 C ILE A 67 5.522 -2.027 4.205 1.00 0.00 C ATOM 1028 O ILE A 67 5.348 -3.065 3.567 1.00 0.00 O ATOM 1029 CB ILE A 67 4.927 -2.267 6.617 1.00 0.00 C ATOM 1030 CG1 ILE A 67 6.359 -1.888 7.000 1.00 0.00 C ATOM 1031 CG2 ILE A 67 4.782 -3.778 6.515 1.00 0.00 C ATOM 1032 CD1 ILE A 67 7.410 -2.757 6.346 1.00 0.00 C ATOM 0 H ILE A 67 2.866 -2.864 5.185 1.00 0.00 H new ATOM 0 HA ILE A 67 4.577 -0.517 5.406 1.00 0.00 H new ATOM 0 HB ILE A 67 4.256 -1.909 7.398 1.00 0.00 H new ATOM 0 HG12 ILE A 67 6.537 -0.848 6.725 1.00 0.00 H new ATOM 0 HG13 ILE A 67 6.467 -1.955 8.083 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.063 -4.235 7.464 1.00 0.00 H new ATOM 0 HG22 ILE A 67 3.747 -4.029 6.283 1.00 0.00 H new ATOM 0 HG23 ILE A 67 5.432 -4.153 5.725 1.00 0.00 H new ATOM 0 HD11 ILE A 67 8.401 -2.431 6.663 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.258 -3.795 6.641 1.00 0.00 H new ATOM 0 HD13 ILE A 67 7.330 -2.672 5.262 1.00 0.00 H new ATOM 1044 N ILE A 68 6.561 -1.222 4.008 1.00 0.00 N ATOM 1045 CA ILE A 68 7.578 -1.519 3.007 1.00 0.00 C ATOM 1046 C ILE A 68 8.974 -1.495 3.619 1.00 0.00 C ATOM 1047 O ILE A 68 9.549 -0.429 3.837 1.00 0.00 O ATOM 1048 CB ILE A 68 7.525 -0.518 1.837 1.00 0.00 C ATOM 1049 CG1 ILE A 68 6.092 -0.380 1.320 1.00 0.00 C ATOM 1050 CG2 ILE A 68 8.457 -0.961 0.719 1.00 0.00 C ATOM 1051 CD1 ILE A 68 5.883 0.828 0.434 1.00 0.00 C ATOM 0 H ILE A 68 6.720 -0.359 4.528 1.00 0.00 H new ATOM 0 HA ILE A 68 7.367 -2.519 2.629 1.00 0.00 H new ATOM 0 HB ILE A 68 7.857 0.456 2.196 1.00 0.00 H new ATOM 0 HG12 ILE A 68 5.827 -1.279 0.763 1.00 0.00 H new ATOM 0 HG13 ILE A 68 5.412 -0.319 2.170 1.00 0.00 H new ATOM 0 HG21 ILE A 68 8.409 -0.244 -0.101 1.00 0.00 H new ATOM 0 HG22 ILE A 68 9.478 -1.013 1.096 1.00 0.00 H new ATOM 0 HG23 ILE A 68 8.152 -1.944 0.359 1.00 0.00 H new ATOM 0 HD11 ILE A 68 4.845 0.862 0.104 1.00 0.00 H new ATOM 0 HD12 ILE A 68 6.116 1.734 0.993 1.00 0.00 H new ATOM 0 HD13 ILE A 68 6.537 0.759 -0.435 1.00 0.00 H new ATOM 1063 N GLU A 69 9.515 -2.678 3.892 1.00 0.00 N ATOM 1064 CA GLU A 69 10.846 -2.793 4.478 1.00 0.00 C ATOM 1065 C GLU A 69 11.919 -2.382 3.474 1.00 0.00 C ATOM 1066 O GLU A 69 12.162 -3.078 2.490 1.00 0.00 O ATOM 1067 CB GLU A 69 11.097 -4.225 4.952 1.00 0.00 C ATOM 1068 CG GLU A 69 10.664 -4.476 6.387 1.00 0.00 C ATOM 1069 CD GLU A 69 10.600 -5.952 6.728 1.00 0.00 C ATOM 1070 OE1 GLU A 69 10.412 -6.768 5.801 1.00 0.00 O ATOM 1071 OE2 GLU A 69 10.738 -6.292 7.922 1.00 0.00 O ATOM 0 H GLU A 69 9.053 -3.570 3.717 1.00 0.00 H new ATOM 0 HA GLU A 69 10.897 -2.121 5.335 1.00 0.00 H new ATOM 0 HB2 GLU A 69 10.566 -4.914 4.295 1.00 0.00 H new ATOM 0 HB3 GLU A 69 12.160 -4.449 4.858 1.00 0.00 H new ATOM 0 HG2 GLU A 69 11.360 -3.980 7.064 1.00 0.00 H new ATOM 0 HG3 GLU A 69 9.685 -4.026 6.551 1.00 0.00 H new ATOM 1078 N GLY A 70 12.558 -1.245 3.732 1.00 0.00 N ATOM 1079 CA GLY A 70 13.598 -0.760 2.843 1.00 0.00 C ATOM 1080 C GLY A 70 13.037 -0.012 1.650 1.00 0.00 C ATOM 1081 O GLY A 70 12.802 -0.600 0.595 1.00 0.00 O ATOM 0 H GLY A 70 12.374 -0.651 4.541 1.00 0.00 H new ATOM 0 HA2 GLY A 70 14.269 -0.103 3.397 1.00 0.00 H new ATOM 0 HA3 GLY A 70 14.194 -1.602 2.492 1.00 0.00 H new ATOM 1085 N ALA A 71 12.821 1.289 1.817 1.00 0.00 N ATOM 1086 CA ALA A 71 12.285 2.118 0.744 1.00 0.00 C ATOM 1087 C ALA A 71 13.405 2.724 -0.094 1.00 0.00 C ATOM 1088 O ALA A 71 13.912 3.803 0.215 1.00 0.00 O ATOM 1089 CB ALA A 71 11.399 3.214 1.318 1.00 0.00 C ATOM 0 H ALA A 71 13.009 1.791 2.685 1.00 0.00 H new ATOM 0 HA ALA A 71 11.684 1.483 0.093 1.00 0.00 H new ATOM 0 HB1 ALA A 71 11.005 3.826 0.506 1.00 0.00 H new ATOM 0 HB2 ALA A 71 10.572 2.763 1.867 1.00 0.00 H new ATOM 0 HB3 ALA A 71 11.984 3.839 1.992 1.00 0.00 H new ATOM 1095 N THR A 72 13.789 2.023 -1.156 1.00 0.00 N ATOM 1096 CA THR A 72 14.851 2.491 -2.038 1.00 0.00 C ATOM 1097 C THR A 72 14.293 3.363 -3.157 1.00 0.00 C ATOM 1098 O THR A 72 13.089 3.362 -3.417 1.00 0.00 O ATOM 1099 CB THR A 72 15.626 1.313 -2.658 1.00 0.00 C ATOM 1100 OG1 THR A 72 14.712 0.304 -3.101 1.00 0.00 O ATOM 1101 CG2 THR A 72 16.599 0.717 -1.653 1.00 0.00 C ATOM 0 H THR A 72 13.380 1.129 -1.426 1.00 0.00 H new ATOM 0 HA THR A 72 15.532 3.083 -1.426 1.00 0.00 H new ATOM 0 HB THR A 72 16.193 1.688 -3.510 1.00 0.00 H new ATOM 0 HG1 THR A 72 15.213 -0.441 -3.495 1.00 0.00 H new ATOM 0 HG21 THR A 72 17.135 -0.113 -2.113 1.00 0.00 H new ATOM 0 HG22 THR A 72 17.312 1.480 -1.340 1.00 0.00 H new ATOM 0 HG23 THR A 72 16.049 0.356 -0.784 1.00 0.00 H new ATOM 1109 N LYS A 73 15.174 4.106 -3.817 1.00 0.00 N ATOM 1110 CA LYS A 73 14.770 4.982 -4.911 1.00 0.00 C ATOM 1111 C LYS A 73 13.832 4.257 -5.871 1.00 0.00 C ATOM 1112 O LYS A 73 12.991 4.878 -6.518 1.00 0.00 O ATOM 1113 CB LYS A 73 16.000 5.488 -5.667 1.00 0.00 C ATOM 1114 CG LYS A 73 16.668 6.685 -5.012 1.00 0.00 C ATOM 1115 CD LYS A 73 16.064 7.993 -5.495 1.00 0.00 C ATOM 1116 CE LYS A 73 16.898 9.187 -5.057 1.00 0.00 C ATOM 1117 NZ LYS A 73 16.738 9.474 -3.605 1.00 0.00 N ATOM 0 H LYS A 73 16.173 4.119 -3.614 1.00 0.00 H new ATOM 0 HA LYS A 73 14.238 5.833 -4.485 1.00 0.00 H new ATOM 0 HB2 LYS A 73 16.725 4.678 -5.748 1.00 0.00 H new ATOM 0 HB3 LYS A 73 15.707 5.757 -6.682 1.00 0.00 H new ATOM 0 HG2 LYS A 73 16.565 6.613 -3.929 1.00 0.00 H new ATOM 0 HG3 LYS A 73 17.736 6.673 -5.232 1.00 0.00 H new ATOM 0 HD2 LYS A 73 15.988 7.980 -6.582 1.00 0.00 H new ATOM 0 HD3 LYS A 73 15.051 8.093 -5.106 1.00 0.00 H new ATOM 0 HE2 LYS A 73 17.949 8.996 -5.275 1.00 0.00 H new ATOM 0 HE3 LYS A 73 16.607 10.064 -5.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 17.212 10.370 -3.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 15.726 9.548 -3.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 17.164 8.704 -3.050 1.00 0.00 H new ATOM 1131 N ALA A 74 13.983 2.939 -5.956 1.00 0.00 N ATOM 1132 CA ALA A 74 13.147 2.130 -6.834 1.00 0.00 C ATOM 1133 C ALA A 74 11.757 1.932 -6.239 1.00 0.00 C ATOM 1134 O ALA A 74 10.762 1.892 -6.963 1.00 0.00 O ATOM 1135 CB ALA A 74 13.807 0.784 -7.098 1.00 0.00 C ATOM 0 H ALA A 74 14.676 2.409 -5.428 1.00 0.00 H new ATOM 0 HA ALA A 74 13.037 2.660 -7.780 1.00 0.00 H new ATOM 0 HB1 ALA A 74 13.172 0.190 -7.755 1.00 0.00 H new ATOM 0 HB2 ALA A 74 14.775 0.941 -7.574 1.00 0.00 H new ATOM 0 HB3 ALA A 74 13.947 0.256 -6.155 1.00 0.00 H new ATOM 1141 N ASP A 75 11.696 1.806 -4.918 1.00 0.00 N ATOM 1142 CA ASP A 75 10.427 1.612 -4.226 1.00 0.00 C ATOM 1143 C ASP A 75 9.506 2.810 -4.434 1.00 0.00 C ATOM 1144 O ASP A 75 8.304 2.732 -4.183 1.00 0.00 O ATOM 1145 CB ASP A 75 10.666 1.391 -2.731 1.00 0.00 C ATOM 1146 CG ASP A 75 11.061 -0.038 -2.414 1.00 0.00 C ATOM 1147 OD1 ASP A 75 11.886 -0.606 -3.161 1.00 0.00 O ATOM 1148 OD2 ASP A 75 10.546 -0.589 -1.419 1.00 0.00 O ATOM 0 H ASP A 75 12.511 1.835 -4.305 1.00 0.00 H new ATOM 0 HA ASP A 75 9.945 0.728 -4.644 1.00 0.00 H new ATOM 0 HB2 ASP A 75 11.449 2.066 -2.387 1.00 0.00 H new ATOM 0 HB3 ASP A 75 9.761 1.646 -2.180 1.00 0.00 H new ATOM 1153 N ALA A 76 10.079 3.918 -4.894 1.00 0.00 N ATOM 1154 CA ALA A 76 9.309 5.132 -5.137 1.00 0.00 C ATOM 1155 C ALA A 76 8.346 4.947 -6.304 1.00 0.00 C ATOM 1156 O ALA A 76 8.714 5.142 -7.462 1.00 0.00 O ATOM 1157 CB ALA A 76 10.242 6.304 -5.401 1.00 0.00 C ATOM 0 H ALA A 76 11.073 4.000 -5.106 1.00 0.00 H new ATOM 0 HA ALA A 76 8.720 5.344 -4.245 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.654 7.204 -5.581 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.886 6.458 -4.535 1.00 0.00 H new ATOM 0 HB3 ALA A 76 10.856 6.091 -6.276 1.00 0.00 H new ATOM 1163 N ALA A 77 7.111 4.568 -5.992 1.00 0.00 N ATOM 1164 CA ALA A 77 6.095 4.358 -7.015 1.00 0.00 C ATOM 1165 C ALA A 77 4.701 4.663 -6.476 1.00 0.00 C ATOM 1166 O ALA A 77 4.500 4.748 -5.265 1.00 0.00 O ATOM 1167 CB ALA A 77 6.159 2.930 -7.537 1.00 0.00 C ATOM 0 H ALA A 77 6.790 4.400 -5.038 1.00 0.00 H new ATOM 0 HA ALA A 77 6.296 5.044 -7.838 1.00 0.00 H new ATOM 0 HB1 ALA A 77 5.394 2.787 -8.301 1.00 0.00 H new ATOM 0 HB2 ALA A 77 7.142 2.744 -7.969 1.00 0.00 H new ATOM 0 HB3 ALA A 77 5.986 2.234 -6.716 1.00 0.00 H new ATOM 1173 N GLU A 78 3.744 4.829 -7.384 1.00 0.00 N ATOM 1174 CA GLU A 78 2.370 5.127 -6.997 1.00 0.00 C ATOM 1175 C GLU A 78 1.666 3.876 -6.481 1.00 0.00 C ATOM 1176 O GLU A 78 1.272 3.006 -7.258 1.00 0.00 O ATOM 1177 CB GLU A 78 1.597 5.707 -8.185 1.00 0.00 C ATOM 1178 CG GLU A 78 0.117 5.909 -7.907 1.00 0.00 C ATOM 1179 CD GLU A 78 -0.565 6.751 -8.967 1.00 0.00 C ATOM 1180 OE1 GLU A 78 -0.827 6.221 -10.068 1.00 0.00 O ATOM 1181 OE2 GLU A 78 -0.837 7.939 -8.697 1.00 0.00 O ATOM 0 H GLU A 78 3.895 4.762 -8.391 1.00 0.00 H new ATOM 0 HA GLU A 78 2.397 5.864 -6.195 1.00 0.00 H new ATOM 0 HB2 GLU A 78 2.040 6.663 -8.464 1.00 0.00 H new ATOM 0 HB3 GLU A 78 1.710 5.042 -9.041 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.374 4.938 -7.848 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.005 6.387 -6.935 1.00 0.00 H new ATOM 1188 N TYR A 79 1.512 3.793 -5.164 1.00 0.00 N ATOM 1189 CA TYR A 79 0.859 2.647 -4.542 1.00 0.00 C ATOM 1190 C TYR A 79 -0.654 2.841 -4.495 1.00 0.00 C ATOM 1191 O TYR A 79 -1.156 3.723 -3.798 1.00 0.00 O ATOM 1192 CB TYR A 79 1.401 2.430 -3.128 1.00 0.00 C ATOM 1193 CG TYR A 79 2.822 1.917 -3.096 1.00 0.00 C ATOM 1194 CD1 TYR A 79 3.898 2.781 -3.262 1.00 0.00 C ATOM 1195 CD2 TYR A 79 3.091 0.568 -2.901 1.00 0.00 C ATOM 1196 CE1 TYR A 79 5.198 2.317 -3.235 1.00 0.00 C ATOM 1197 CE2 TYR A 79 4.389 0.095 -2.871 1.00 0.00 C ATOM 1198 CZ TYR A 79 5.439 0.973 -3.039 1.00 0.00 C ATOM 1199 OH TYR A 79 6.733 0.506 -3.010 1.00 0.00 O ATOM 0 H TYR A 79 1.830 4.505 -4.507 1.00 0.00 H new ATOM 0 HA TYR A 79 1.075 1.766 -5.146 1.00 0.00 H new ATOM 0 HB2 TYR A 79 1.351 3.371 -2.581 1.00 0.00 H new ATOM 0 HB3 TYR A 79 0.757 1.723 -2.606 1.00 0.00 H new ATOM 0 HD1 TYR A 79 3.714 3.834 -3.415 1.00 0.00 H new ATOM 0 HD2 TYR A 79 2.271 -0.123 -2.771 1.00 0.00 H new ATOM 0 HE1 TYR A 79 6.022 3.003 -3.367 1.00 0.00 H new ATOM 0 HE2 TYR A 79 4.580 -0.957 -2.717 1.00 0.00 H new ATOM 0 HH TYR A 79 7.335 1.187 -3.376 1.00 0.00 H new ATOM 1209 N SER A 80 -1.374 2.010 -5.241 1.00 0.00 N ATOM 1210 CA SER A 80 -2.829 2.092 -5.289 1.00 0.00 C ATOM 1211 C SER A 80 -3.462 0.790 -4.806 1.00 0.00 C ATOM 1212 O SER A 80 -3.030 -0.300 -5.181 1.00 0.00 O ATOM 1213 CB SER A 80 -3.298 2.403 -6.711 1.00 0.00 C ATOM 1214 OG SER A 80 -2.832 3.672 -7.136 1.00 0.00 O ATOM 0 H SER A 80 -0.974 1.272 -5.821 1.00 0.00 H new ATOM 0 HA SER A 80 -3.145 2.898 -4.626 1.00 0.00 H new ATOM 0 HB2 SER A 80 -2.937 1.633 -7.393 1.00 0.00 H new ATOM 0 HB3 SER A 80 -4.387 2.380 -6.751 1.00 0.00 H new ATOM 0 HG SER A 80 -3.144 3.846 -8.048 1.00 0.00 H new ATOM 1220 N VAL A 81 -4.488 0.913 -3.970 1.00 0.00 N ATOM 1221 CA VAL A 81 -5.182 -0.253 -3.436 1.00 0.00 C ATOM 1222 C VAL A 81 -6.469 -0.527 -4.205 1.00 0.00 C ATOM 1223 O VAL A 81 -7.014 0.362 -4.860 1.00 0.00 O ATOM 1224 CB VAL A 81 -5.518 -0.071 -1.943 1.00 0.00 C ATOM 1225 CG1 VAL A 81 -4.383 0.640 -1.223 1.00 0.00 C ATOM 1226 CG2 VAL A 81 -6.824 0.693 -1.781 1.00 0.00 C ATOM 0 H VAL A 81 -4.857 1.808 -3.648 1.00 0.00 H new ATOM 0 HA VAL A 81 -4.507 -1.102 -3.549 1.00 0.00 H new ATOM 0 HB VAL A 81 -5.641 -1.056 -1.493 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -4.638 0.760 -0.170 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -3.471 0.050 -1.310 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -4.225 1.621 -1.672 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -7.046 0.813 -0.721 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -6.731 1.675 -2.245 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -7.631 0.140 -2.261 1.00 0.00 H new ATOM 1236 N MET A 82 -6.950 -1.763 -4.122 1.00 0.00 N ATOM 1237 CA MET A 82 -8.175 -2.154 -4.810 1.00 0.00 C ATOM 1238 C MET A 82 -9.071 -2.984 -3.896 1.00 0.00 C ATOM 1239 O MET A 82 -8.634 -3.982 -3.321 1.00 0.00 O ATOM 1240 CB MET A 82 -7.844 -2.946 -6.076 1.00 0.00 C ATOM 1241 CG MET A 82 -8.881 -2.793 -7.177 1.00 0.00 C ATOM 1242 SD MET A 82 -8.958 -4.231 -8.263 1.00 0.00 S ATOM 1243 CE MET A 82 -7.418 -4.060 -9.161 1.00 0.00 C ATOM 0 H MET A 82 -6.510 -2.511 -3.585 1.00 0.00 H new ATOM 0 HA MET A 82 -8.711 -1.247 -5.088 1.00 0.00 H new ATOM 0 HB2 MET A 82 -6.874 -2.622 -6.454 1.00 0.00 H new ATOM 0 HB3 MET A 82 -7.750 -4.001 -5.820 1.00 0.00 H new ATOM 0 HG2 MET A 82 -9.861 -2.629 -6.728 1.00 0.00 H new ATOM 0 HG3 MET A 82 -8.649 -1.908 -7.769 1.00 0.00 H new ATOM 0 HE1 MET A 82 -6.945 -5.037 -9.261 1.00 0.00 H new ATOM 0 HE2 MET A 82 -7.618 -3.651 -10.151 1.00 0.00 H new ATOM 0 HE3 MET A 82 -6.753 -3.388 -8.618 1.00 0.00 H new ATOM 1253 N THR A 83 -10.326 -2.567 -3.766 1.00 0.00 N ATOM 1254 CA THR A 83 -11.282 -3.271 -2.921 1.00 0.00 C ATOM 1255 C THR A 83 -12.455 -3.799 -3.739 1.00 0.00 C ATOM 1256 O THR A 83 -12.510 -3.615 -4.956 1.00 0.00 O ATOM 1257 CB THR A 83 -11.821 -2.360 -1.802 1.00 0.00 C ATOM 1258 OG1 THR A 83 -12.532 -1.254 -2.370 1.00 0.00 O ATOM 1259 CG2 THR A 83 -10.686 -1.845 -0.930 1.00 0.00 C ATOM 0 H THR A 83 -10.704 -1.744 -4.236 1.00 0.00 H new ATOM 0 HA THR A 83 -10.749 -4.109 -2.472 1.00 0.00 H new ATOM 0 HB THR A 83 -12.498 -2.946 -1.181 1.00 0.00 H new ATOM 0 HG1 THR A 83 -13.411 -1.177 -1.945 1.00 0.00 H new ATOM 0 HG21 THR A 83 -11.091 -1.204 -0.147 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.165 -2.688 -0.476 1.00 0.00 H new ATOM 0 HG23 THR A 83 -9.988 -1.274 -1.542 1.00 0.00 H new ATOM 1267 N THR A 84 -13.393 -4.458 -3.065 1.00 0.00 N ATOM 1268 CA THR A 84 -14.564 -5.013 -3.730 1.00 0.00 C ATOM 1269 C THR A 84 -15.346 -3.929 -4.463 1.00 0.00 C ATOM 1270 O THR A 84 -15.969 -4.187 -5.491 1.00 0.00 O ATOM 1271 CB THR A 84 -15.499 -5.716 -2.727 1.00 0.00 C ATOM 1272 OG1 THR A 84 -15.843 -4.818 -1.666 1.00 0.00 O ATOM 1273 CG2 THR A 84 -14.839 -6.960 -2.152 1.00 0.00 C ATOM 0 H THR A 84 -13.364 -4.620 -2.058 1.00 0.00 H new ATOM 0 HA THR A 84 -14.201 -5.745 -4.451 1.00 0.00 H new ATOM 0 HB THR A 84 -16.404 -6.016 -3.256 1.00 0.00 H new ATOM 0 HG1 THR A 84 -16.789 -4.931 -1.435 1.00 0.00 H new ATOM 0 HG21 THR A 84 -15.518 -7.439 -1.447 1.00 0.00 H new ATOM 0 HG22 THR A 84 -14.605 -7.654 -2.959 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.920 -6.679 -1.637 1.00 0.00 H new ATOM 1281 N GLY A 85 -15.309 -2.713 -3.925 1.00 0.00 N ATOM 1282 CA GLY A 85 -16.018 -1.608 -4.542 1.00 0.00 C ATOM 1283 C GLY A 85 -15.374 -0.268 -4.246 1.00 0.00 C ATOM 1284 O GLY A 85 -16.063 0.710 -3.959 1.00 0.00 O ATOM 0 H GLY A 85 -14.801 -2.474 -3.073 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -16.053 -1.760 -5.621 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -17.049 -1.598 -4.187 1.00 0.00 H new ATOM 1288 N GLY A 86 -14.047 -0.223 -4.314 1.00 0.00 N ATOM 1289 CA GLY A 86 -13.331 1.011 -4.047 1.00 0.00 C ATOM 1290 C GLY A 86 -11.874 0.936 -4.456 1.00 0.00 C ATOM 1291 O GLY A 86 -11.331 -0.152 -4.647 1.00 0.00 O ATOM 0 H GLY A 86 -13.455 -1.019 -4.549 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -13.813 1.830 -4.581 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -13.395 1.242 -2.984 1.00 0.00 H new ATOM 1295 N GLN A 87 -11.240 2.096 -4.593 1.00 0.00 N ATOM 1296 CA GLN A 87 -9.837 2.157 -4.986 1.00 0.00 C ATOM 1297 C GLN A 87 -9.183 3.437 -4.474 1.00 0.00 C ATOM 1298 O GLN A 87 -9.861 4.433 -4.220 1.00 0.00 O ATOM 1299 CB GLN A 87 -9.707 2.078 -6.508 1.00 0.00 C ATOM 1300 CG GLN A 87 -8.272 2.167 -7.001 1.00 0.00 C ATOM 1301 CD GLN A 87 -8.181 2.339 -8.505 1.00 0.00 C ATOM 1302 OE1 GLN A 87 -9.195 2.500 -9.185 1.00 0.00 O ATOM 1303 NE2 GLN A 87 -6.963 2.304 -9.033 1.00 0.00 N ATOM 0 H GLN A 87 -11.675 3.005 -4.438 1.00 0.00 H new ATOM 0 HA GLN A 87 -9.324 1.305 -4.540 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -10.144 1.141 -6.854 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -10.287 2.885 -6.956 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -7.775 3.005 -6.513 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -7.735 1.264 -6.709 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -6.150 2.168 -8.432 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -6.840 2.413 -10.040 1.00 0.00 H new ATOM 1312 N SER A 88 -7.863 3.402 -4.324 1.00 0.00 N ATOM 1313 CA SER A 88 -7.118 4.558 -3.838 1.00 0.00 C ATOM 1314 C SER A 88 -5.726 4.607 -4.458 1.00 0.00 C ATOM 1315 O SER A 88 -5.219 3.601 -4.953 1.00 0.00 O ATOM 1316 CB SER A 88 -7.008 4.516 -2.312 1.00 0.00 C ATOM 1317 OG SER A 88 -6.623 5.777 -1.794 1.00 0.00 O ATOM 0 H SER A 88 -7.287 2.586 -4.532 1.00 0.00 H new ATOM 0 HA SER A 88 -7.659 5.457 -4.132 1.00 0.00 H new ATOM 0 HB2 SER A 88 -7.965 4.220 -1.883 1.00 0.00 H new ATOM 0 HB3 SER A 88 -6.280 3.760 -2.017 1.00 0.00 H new ATOM 0 HG SER A 88 -5.672 5.929 -1.977 1.00 0.00 H new ATOM 1323 N SER A 89 -5.113 5.786 -4.428 1.00 0.00 N ATOM 1324 CA SER A 89 -3.780 5.970 -4.991 1.00 0.00 C ATOM 1325 C SER A 89 -2.927 6.857 -4.090 1.00 0.00 C ATOM 1326 O SER A 89 -3.436 7.762 -3.430 1.00 0.00 O ATOM 1327 CB SER A 89 -3.874 6.583 -6.390 1.00 0.00 C ATOM 1328 OG SER A 89 -4.517 7.846 -6.350 1.00 0.00 O ATOM 0 H SER A 89 -5.518 6.628 -4.020 1.00 0.00 H new ATOM 0 HA SER A 89 -3.305 4.992 -5.062 1.00 0.00 H new ATOM 0 HB2 SER A 89 -2.874 6.693 -6.810 1.00 0.00 H new ATOM 0 HB3 SER A 89 -4.425 5.911 -7.049 1.00 0.00 H new ATOM 0 HG SER A 89 -4.564 8.218 -7.255 1.00 0.00 H new ATOM 1334 N ALA A 90 -1.625 6.591 -4.069 1.00 0.00 N ATOM 1335 CA ALA A 90 -0.700 7.365 -3.251 1.00 0.00 C ATOM 1336 C ALA A 90 0.685 7.416 -3.887 1.00 0.00 C ATOM 1337 O ALA A 90 1.157 6.429 -4.453 1.00 0.00 O ATOM 1338 CB ALA A 90 -0.618 6.780 -1.849 1.00 0.00 C ATOM 0 H ALA A 90 -1.187 5.845 -4.609 1.00 0.00 H new ATOM 0 HA ALA A 90 -1.079 8.385 -3.185 1.00 0.00 H new ATOM 0 HB1 ALA A 90 0.077 7.368 -1.249 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -1.605 6.802 -1.387 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.267 5.750 -1.905 1.00 0.00 H new ATOM 1344 N LYS A 91 1.333 8.572 -3.792 1.00 0.00 N ATOM 1345 CA LYS A 91 2.664 8.753 -4.358 1.00 0.00 C ATOM 1346 C LYS A 91 3.737 8.604 -3.283 1.00 0.00 C ATOM 1347 O LYS A 91 3.690 9.271 -2.249 1.00 0.00 O ATOM 1348 CB LYS A 91 2.778 10.128 -5.020 1.00 0.00 C ATOM 1349 CG LYS A 91 2.069 10.218 -6.359 1.00 0.00 C ATOM 1350 CD LYS A 91 2.684 11.289 -7.245 1.00 0.00 C ATOM 1351 CE LYS A 91 2.252 12.683 -6.817 1.00 0.00 C ATOM 1352 NZ LYS A 91 2.714 13.725 -7.776 1.00 0.00 N ATOM 0 H LYS A 91 0.957 9.399 -3.328 1.00 0.00 H new ATOM 0 HA LYS A 91 2.819 7.981 -5.111 1.00 0.00 H new ATOM 0 HB2 LYS A 91 2.365 10.881 -4.348 1.00 0.00 H new ATOM 0 HB3 LYS A 91 3.832 10.369 -5.159 1.00 0.00 H new ATOM 0 HG2 LYS A 91 2.120 9.253 -6.864 1.00 0.00 H new ATOM 0 HG3 LYS A 91 1.014 10.439 -6.199 1.00 0.00 H new ATOM 0 HD2 LYS A 91 3.771 11.216 -7.205 1.00 0.00 H new ATOM 0 HD3 LYS A 91 2.391 11.118 -8.281 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.165 12.718 -6.738 1.00 0.00 H new ATOM 0 HE3 LYS A 91 2.651 12.899 -5.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 2.400 14.661 -7.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 3.752 13.709 -7.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 2.313 13.534 -8.716 1.00 0.00 H new ATOM 1366 N LEU A 92 4.702 7.726 -3.535 1.00 0.00 N ATOM 1367 CA LEU A 92 5.787 7.491 -2.589 1.00 0.00 C ATOM 1368 C LEU A 92 7.108 8.028 -3.131 1.00 0.00 C ATOM 1369 O LEU A 92 7.604 7.564 -4.157 1.00 0.00 O ATOM 1370 CB LEU A 92 5.916 5.996 -2.291 1.00 0.00 C ATOM 1371 CG LEU A 92 6.840 5.619 -1.133 1.00 0.00 C ATOM 1372 CD1 LEU A 92 6.236 6.053 0.194 1.00 0.00 C ATOM 1373 CD2 LEU A 92 7.111 4.122 -1.132 1.00 0.00 C ATOM 0 H LEU A 92 4.755 7.166 -4.386 1.00 0.00 H new ATOM 0 HA LEU A 92 5.552 8.021 -1.666 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.922 5.601 -2.080 1.00 0.00 H new ATOM 0 HB3 LEU A 92 6.273 5.496 -3.191 1.00 0.00 H new ATOM 0 HG LEU A 92 7.788 6.140 -1.266 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.907 5.777 1.007 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.093 7.134 0.193 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.274 5.560 0.334 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.770 3.872 -0.301 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.170 3.582 -1.024 1.00 0.00 H new ATOM 0 HD23 LEU A 92 7.587 3.838 -2.071 1.00 0.00 H new ATOM 1385 N SER A 93 7.673 9.008 -2.433 1.00 0.00 N ATOM 1386 CA SER A 93 8.936 9.610 -2.845 1.00 0.00 C ATOM 1387 C SER A 93 10.078 9.146 -1.946 1.00 0.00 C ATOM 1388 O SER A 93 9.978 9.196 -0.720 1.00 0.00 O ATOM 1389 CB SER A 93 8.833 11.136 -2.810 1.00 0.00 C ATOM 1390 OG SER A 93 8.188 11.630 -3.972 1.00 0.00 O ATOM 0 H SER A 93 7.276 9.402 -1.580 1.00 0.00 H new ATOM 0 HA SER A 93 9.147 9.290 -3.865 1.00 0.00 H new ATOM 0 HB2 SER A 93 8.280 11.446 -1.923 1.00 0.00 H new ATOM 0 HB3 SER A 93 9.830 11.569 -2.731 1.00 0.00 H new ATOM 0 HG SER A 93 8.133 12.607 -3.925 1.00 0.00 H new ATOM 1396 N VAL A 94 11.163 8.693 -2.566 1.00 0.00 N ATOM 1397 CA VAL A 94 12.326 8.220 -1.824 1.00 0.00 C ATOM 1398 C VAL A 94 13.465 9.230 -1.885 1.00 0.00 C ATOM 1399 O VAL A 94 13.752 9.794 -2.942 1.00 0.00 O ATOM 1400 CB VAL A 94 12.824 6.867 -2.364 1.00 0.00 C ATOM 1401 CG1 VAL A 94 14.140 6.481 -1.707 1.00 0.00 C ATOM 1402 CG2 VAL A 94 11.774 5.787 -2.147 1.00 0.00 C ATOM 0 H VAL A 94 11.261 8.644 -3.580 1.00 0.00 H new ATOM 0 HA VAL A 94 12.011 8.095 -0.788 1.00 0.00 H new ATOM 0 HB VAL A 94 12.995 6.965 -3.436 1.00 0.00 H new ATOM 0 HG11 VAL A 94 14.476 5.522 -2.101 1.00 0.00 H new ATOM 0 HG12 VAL A 94 14.890 7.243 -1.919 1.00 0.00 H new ATOM 0 HG13 VAL A 94 13.999 6.401 -0.629 1.00 0.00 H new ATOM 0 HG21 VAL A 94 12.143 4.838 -2.535 1.00 0.00 H new ATOM 0 HG22 VAL A 94 11.568 5.688 -1.081 1.00 0.00 H new ATOM 0 HG23 VAL A 94 10.857 6.061 -2.670 1.00 0.00 H new ATOM 1412 N ASP A 95 14.113 9.454 -0.747 1.00 0.00 N ATOM 1413 CA ASP A 95 15.223 10.396 -0.672 1.00 0.00 C ATOM 1414 C ASP A 95 16.464 9.728 -0.088 1.00 0.00 C ATOM 1415 O ASP A 95 16.389 8.628 0.462 1.00 0.00 O ATOM 1416 CB ASP A 95 14.835 11.608 0.177 1.00 0.00 C ATOM 1417 CG ASP A 95 15.556 12.871 -0.254 1.00 0.00 C ATOM 1418 OD1 ASP A 95 15.836 13.011 -1.463 1.00 0.00 O ATOM 1419 OD2 ASP A 95 15.840 13.719 0.618 1.00 0.00 O ATOM 0 H ASP A 95 13.888 8.996 0.136 1.00 0.00 H new ATOM 0 HA ASP A 95 15.453 10.729 -1.684 1.00 0.00 H new ATOM 0 HB2 ASP A 95 13.759 11.766 0.109 1.00 0.00 H new ATOM 0 HB3 ASP A 95 15.061 11.403 1.223 1.00 0.00 H new ATOM 1424 N LEU A 96 17.604 10.398 -0.212 1.00 0.00 N ATOM 1425 CA LEU A 96 18.863 9.868 0.303 1.00 0.00 C ATOM 1426 C LEU A 96 19.327 10.657 1.523 1.00 0.00 C ATOM 1427 O LEU A 96 19.326 11.888 1.517 1.00 0.00 O ATOM 1428 CB LEU A 96 19.938 9.908 -0.784 1.00 0.00 C ATOM 1429 CG LEU A 96 20.036 8.670 -1.677 1.00 0.00 C ATOM 1430 CD1 LEU A 96 21.110 8.860 -2.737 1.00 0.00 C ATOM 1431 CD2 LEU A 96 20.322 7.431 -0.841 1.00 0.00 C ATOM 0 H LEU A 96 17.683 11.309 -0.664 1.00 0.00 H new ATOM 0 HA LEU A 96 18.698 8.833 0.604 1.00 0.00 H new ATOM 0 HB2 LEU A 96 19.753 10.775 -1.418 1.00 0.00 H new ATOM 0 HB3 LEU A 96 20.905 10.064 -0.305 1.00 0.00 H new ATOM 0 HG LEU A 96 19.079 8.532 -2.180 1.00 0.00 H new ATOM 0 HD11 LEU A 96 21.165 7.969 -3.363 1.00 0.00 H new ATOM 0 HD12 LEU A 96 20.862 9.723 -3.355 1.00 0.00 H new ATOM 0 HD13 LEU A 96 22.073 9.024 -2.254 1.00 0.00 H new ATOM 0 HD21 LEU A 96 20.388 6.560 -1.493 1.00 0.00 H new ATOM 0 HD22 LEU A 96 21.265 7.560 -0.310 1.00 0.00 H new ATOM 0 HD23 LEU A 96 19.517 7.285 -0.120 1.00 0.00 H new ATOM 1443 N LYS A 97 19.726 9.940 2.568 1.00 0.00 N ATOM 1444 CA LYS A 97 20.197 10.572 3.795 1.00 0.00 C ATOM 1445 C LYS A 97 21.644 11.033 3.649 1.00 0.00 C ATOM 1446 O LYS A 97 22.558 10.215 3.548 1.00 0.00 O ATOM 1447 CB LYS A 97 20.076 9.601 4.972 1.00 0.00 C ATOM 1448 CG LYS A 97 19.777 10.283 6.295 1.00 0.00 C ATOM 1449 CD LYS A 97 20.760 11.407 6.578 1.00 0.00 C ATOM 1450 CE LYS A 97 20.237 12.347 7.653 1.00 0.00 C ATOM 1451 NZ LYS A 97 20.329 11.743 9.011 1.00 0.00 N ATOM 0 H LYS A 97 19.733 8.920 2.590 1.00 0.00 H new ATOM 0 HA LYS A 97 19.574 11.445 3.987 1.00 0.00 H new ATOM 0 HB2 LYS A 97 19.287 8.880 4.758 1.00 0.00 H new ATOM 0 HB3 LYS A 97 21.005 9.038 5.065 1.00 0.00 H new ATOM 0 HG2 LYS A 97 18.762 10.681 6.279 1.00 0.00 H new ATOM 0 HG3 LYS A 97 19.819 9.550 7.101 1.00 0.00 H new ATOM 0 HD2 LYS A 97 21.714 10.986 6.894 1.00 0.00 H new ATOM 0 HD3 LYS A 97 20.947 11.968 5.662 1.00 0.00 H new ATOM 0 HE2 LYS A 97 20.805 13.277 7.630 1.00 0.00 H new ATOM 0 HE3 LYS A 97 19.199 12.602 7.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 19.963 12.415 9.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 19.766 10.869 9.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 21.322 11.523 9.226 1.00 0.00 H new ATOM 1465 N SER A 98 21.843 12.347 3.639 1.00 0.00 N ATOM 1466 CA SER A 98 23.178 12.917 3.503 1.00 0.00 C ATOM 1467 C SER A 98 23.588 13.652 4.775 1.00 0.00 C ATOM 1468 O SER A 98 23.483 14.875 4.860 1.00 0.00 O ATOM 1469 CB SER A 98 23.229 13.872 2.309 1.00 0.00 C ATOM 1470 OG SER A 98 22.737 13.248 1.135 1.00 0.00 O ATOM 0 H SER A 98 21.097 13.037 3.723 1.00 0.00 H new ATOM 0 HA SER A 98 23.879 12.100 3.335 1.00 0.00 H new ATOM 0 HB2 SER A 98 22.639 14.762 2.526 1.00 0.00 H new ATOM 0 HB3 SER A 98 24.255 14.202 2.147 1.00 0.00 H new ATOM 0 HG SER A 98 22.779 13.880 0.387 1.00 0.00 H new ATOM 1476 N GLY A 99 24.054 12.896 5.765 1.00 0.00 N ATOM 1477 CA GLY A 99 24.472 13.492 7.020 1.00 0.00 C ATOM 1478 C GLY A 99 25.952 13.300 7.289 1.00 0.00 C ATOM 1479 O GLY A 99 26.767 14.194 7.063 1.00 0.00 O ATOM 0 H GLY A 99 24.149 11.881 5.720 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.244 14.558 7.006 1.00 0.00 H new ATOM 0 HA3 GLY A 99 23.898 13.053 7.836 1.00 0.00 H new ATOM 1483 N PRO A 100 26.316 12.108 7.786 1.00 0.00 N ATOM 1484 CA PRO A 100 27.709 11.774 8.099 1.00 0.00 C ATOM 1485 C PRO A 100 28.564 11.623 6.845 1.00 0.00 C ATOM 1486 O PRO A 100 28.067 11.243 5.785 1.00 0.00 O ATOM 1487 CB PRO A 100 27.596 10.436 8.833 1.00 0.00 C ATOM 1488 CG PRO A 100 26.322 9.839 8.341 1.00 0.00 C ATOM 1489 CD PRO A 100 25.397 10.996 8.080 1.00 0.00 C ATOM 0 HA PRO A 100 28.195 12.556 8.682 1.00 0.00 H new ATOM 0 HB2 PRO A 100 28.446 9.791 8.613 1.00 0.00 H new ATOM 0 HB3 PRO A 100 27.575 10.578 9.914 1.00 0.00 H new ATOM 0 HG2 PRO A 100 26.488 9.259 7.433 1.00 0.00 H new ATOM 0 HG3 PRO A 100 25.898 9.159 9.080 1.00 0.00 H new ATOM 0 HD2 PRO A 100 24.729 10.795 7.243 1.00 0.00 H new ATOM 0 HD3 PRO A 100 24.769 11.211 8.945 1.00 0.00 H new ATOM 1497 N SER A 101 29.852 11.922 6.974 1.00 0.00 N ATOM 1498 CA SER A 101 30.776 11.823 5.850 1.00 0.00 C ATOM 1499 C SER A 101 30.659 10.463 5.169 1.00 0.00 C ATOM 1500 O SER A 101 31.307 9.497 5.571 1.00 0.00 O ATOM 1501 CB SER A 101 32.214 12.046 6.323 1.00 0.00 C ATOM 1502 OG SER A 101 32.450 13.414 6.609 1.00 0.00 O ATOM 0 H SER A 101 30.280 12.235 7.845 1.00 0.00 H new ATOM 0 HA SER A 101 30.514 12.596 5.128 1.00 0.00 H new ATOM 0 HB2 SER A 101 32.404 11.447 7.213 1.00 0.00 H new ATOM 0 HB3 SER A 101 32.910 11.706 5.556 1.00 0.00 H new ATOM 0 HG SER A 101 33.375 13.530 6.911 1.00 0.00 H new ATOM 1508 N SER A 102 29.826 10.396 4.134 1.00 0.00 N ATOM 1509 CA SER A 102 29.619 9.154 3.399 1.00 0.00 C ATOM 1510 C SER A 102 29.240 9.439 1.948 1.00 0.00 C ATOM 1511 O SER A 102 28.330 10.220 1.675 1.00 0.00 O ATOM 1512 CB SER A 102 28.529 8.316 4.068 1.00 0.00 C ATOM 1513 OG SER A 102 27.334 9.062 4.222 1.00 0.00 O ATOM 0 H SER A 102 29.284 11.187 3.786 1.00 0.00 H new ATOM 0 HA SER A 102 30.554 8.594 3.409 1.00 0.00 H new ATOM 0 HB2 SER A 102 28.331 7.426 3.470 1.00 0.00 H new ATOM 0 HB3 SER A 102 28.876 7.974 5.043 1.00 0.00 H new ATOM 0 HG SER A 102 27.497 9.820 4.821 1.00 0.00 H new ATOM 1519 N GLY A 103 29.946 8.799 1.022 1.00 0.00 N ATOM 1520 CA GLY A 103 29.670 8.995 -0.389 1.00 0.00 C ATOM 1521 C GLY A 103 30.581 8.173 -1.279 1.00 0.00 C ATOM 1522 O GLY A 103 31.646 7.730 -0.848 1.00 0.00 O ATOM 0 H GLY A 103 30.705 8.148 1.224 1.00 0.00 H new ATOM 0 HA2 GLY A 103 28.633 8.730 -0.593 1.00 0.00 H new ATOM 0 HA3 GLY A 103 29.784 10.051 -0.635 1.00 0.00 H new TER 1526 GLY A 103