USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 874 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 56 LYS NZ :NH3+ 154:sc= -0.0993 (180deg=-0.686) USER MOD Set 1.2: A 61 CYS SG : rot 180:sc= -0.409 USER MOD Set 2.1: A 54 SER OG : rot 48:sc= 1.13 USER MOD Set 2.2: A 63 HIS : no HD1:sc= -3.24! C(o=-2.1!,f=-5.7!) USER MOD Set 3.1: A 45 SER OG : rot 171:sc= 0.759 USER MOD Set 3.2: A 52 THR OG1 : rot 91:sc= 0.873 USER MOD Set 4.1: A 35 GLN : amide:sc= -1.04 K(o=-0.71,f=-1.6!) USER MOD Set 4.2: A 39 SER OG : rot 94:sc= 0.329 USER MOD Single : A 1 GLY N :NH3+ 176:sc= 0 (180deg=-0.0156) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0992 USER MOD Single : A 3 SER OG : rot 180:sc=-0.00722 USER MOD Single : A 5 SER OG : rot 25:sc= 1.08 USER MOD Single : A 6 SER OG : rot 15:sc= 1.01 USER MOD Single : A 9 GLN : amide:sc= -2.36! K(o=-2.4!,f=-1.8) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 HIS : no HD1:sc= -4.54 K(o=-4.5,f=-2.4) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= 0.734 K(o=0.73,f=-0.39) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -0.0873 X(o=-0.087,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 HIS : no HD1:sc= -0.965 K(o=-0.97,f=-0.15) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot -15:sc= -0.351 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot -124:sc= 0.513 USER MOD Single : A 65 MET CE :methyl -123:sc= -0.106 (180deg=-1.55) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.436 USER MOD Single : A 75 MET CE :methyl 165:sc=-0.000111 (180deg=-0.288) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 HIS : no HD1:sc= -8.1! C(o=-8.1!,f=-8.1!) USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.0525 USER MOD Single : A 85 SER OG : rot 18:sc= 0.27 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HE2:sc= -6.6 K(o=-6.6,f=-8.6!) USER MOD Single : A 94 GLN : amide:sc= -1.25 K(o=-1.2,f=-3.7!) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= -1.11! USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 CYS SG : rot 170:sc= -0.654 USER MOD Single : A 111 GLN : amide:sc= -0.015 X(o=-0.015,f=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 SER OG : rot -21:sc= 0.605 USER MOD Single : A 117 SER OG : rot 35:sc= 0.543 USER MOD Single : A 118 SER OG : rot 180:sc= -0.191 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.177 34.805 -23.446 1.00 0.00 N ATOM 2 CA GLY A 1 7.211 34.327 -22.076 1.00 0.00 C ATOM 3 C GLY A 1 7.429 32.830 -21.991 1.00 0.00 C ATOM 4 O GLY A 1 6.772 32.143 -21.207 1.00 0.00 O ATOM 0 H1 GLY A 1 6.958 35.822 -23.454 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.103 34.647 -23.892 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.445 34.290 -23.975 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.007 34.839 -21.535 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.274 34.584 -21.581 1.00 0.00 H new ATOM 8 N SER A 2 8.353 32.321 -22.799 1.00 0.00 N ATOM 9 CA SER A 2 8.652 30.893 -22.815 1.00 0.00 C ATOM 10 C SER A 2 7.381 30.069 -22.635 1.00 0.00 C ATOM 11 O SER A 2 7.365 29.083 -21.899 1.00 0.00 O ATOM 12 CB SER A 2 9.656 30.549 -21.713 1.00 0.00 C ATOM 13 OG SER A 2 9.169 30.934 -20.440 1.00 0.00 O ATOM 0 H SER A 2 8.908 32.875 -23.451 1.00 0.00 H new ATOM 0 HA SER A 2 9.088 30.649 -23.784 1.00 0.00 H new ATOM 0 HB2 SER A 2 9.856 29.477 -21.720 1.00 0.00 H new ATOM 0 HB3 SER A 2 10.603 31.051 -21.910 1.00 0.00 H new ATOM 0 HG SER A 2 9.829 30.702 -19.753 1.00 0.00 H new ATOM 19 N SER A 3 6.315 30.482 -23.313 1.00 0.00 N ATOM 20 CA SER A 3 5.036 29.786 -23.226 1.00 0.00 C ATOM 21 C SER A 3 5.202 28.304 -23.547 1.00 0.00 C ATOM 22 O SER A 3 6.290 27.853 -23.902 1.00 0.00 O ATOM 23 CB SER A 3 4.022 30.416 -24.184 1.00 0.00 C ATOM 24 OG SER A 3 2.699 30.039 -23.846 1.00 0.00 O ATOM 0 H SER A 3 6.311 31.295 -23.929 1.00 0.00 H new ATOM 0 HA SER A 3 4.668 29.880 -22.205 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.113 31.502 -24.153 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.242 30.107 -25.206 1.00 0.00 H new ATOM 0 HG SER A 3 2.070 30.456 -24.472 1.00 0.00 H new ATOM 30 N GLY A 4 4.114 27.551 -23.417 1.00 0.00 N ATOM 31 CA GLY A 4 4.159 26.127 -23.695 1.00 0.00 C ATOM 32 C GLY A 4 2.868 25.424 -23.327 1.00 0.00 C ATOM 33 O GLY A 4 2.058 25.955 -22.568 1.00 0.00 O ATOM 0 H GLY A 4 3.202 27.902 -23.124 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.364 25.973 -24.754 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.984 25.678 -23.142 1.00 0.00 H new ATOM 37 N SER A 5 2.674 24.225 -23.869 1.00 0.00 N ATOM 38 CA SER A 5 1.469 23.449 -23.598 1.00 0.00 C ATOM 39 C SER A 5 1.682 21.979 -23.940 1.00 0.00 C ATOM 40 O SER A 5 2.175 21.645 -25.018 1.00 0.00 O ATOM 41 CB SER A 5 0.289 24.006 -24.397 1.00 0.00 C ATOM 42 OG SER A 5 -0.258 25.151 -23.768 1.00 0.00 O ATOM 0 H SER A 5 3.336 23.770 -24.498 1.00 0.00 H new ATOM 0 HA SER A 5 1.247 23.527 -22.534 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.617 24.262 -25.404 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.480 23.240 -24.497 1.00 0.00 H new ATOM 0 HG SER A 5 0.425 25.573 -23.206 1.00 0.00 H new ATOM 48 N SER A 6 1.305 21.102 -23.015 1.00 0.00 N ATOM 49 CA SER A 6 1.458 19.666 -23.216 1.00 0.00 C ATOM 50 C SER A 6 0.522 18.886 -22.297 1.00 0.00 C ATOM 51 O SER A 6 0.125 19.373 -21.239 1.00 0.00 O ATOM 52 CB SER A 6 2.907 19.244 -22.963 1.00 0.00 C ATOM 53 OG SER A 6 3.746 19.638 -24.035 1.00 0.00 O ATOM 0 H SER A 6 0.891 21.361 -22.119 1.00 0.00 H new ATOM 0 HA SER A 6 1.197 19.440 -24.250 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.263 19.691 -22.035 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.958 18.163 -22.836 1.00 0.00 H new ATOM 0 HG SER A 6 3.280 20.299 -24.589 1.00 0.00 H new ATOM 59 N GLY A 7 0.174 17.671 -22.709 1.00 0.00 N ATOM 60 CA GLY A 7 -0.712 16.843 -21.913 1.00 0.00 C ATOM 61 C GLY A 7 -1.730 16.103 -22.758 1.00 0.00 C ATOM 62 O GLY A 7 -1.870 16.371 -23.950 1.00 0.00 O ATOM 0 H GLY A 7 0.490 17.245 -23.580 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.121 16.122 -21.348 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.232 17.467 -21.187 1.00 0.00 H new ATOM 66 N GLY A 8 -2.444 15.167 -22.139 1.00 0.00 N ATOM 67 CA GLY A 8 -3.443 14.400 -22.857 1.00 0.00 C ATOM 68 C GLY A 8 -2.829 13.407 -23.824 1.00 0.00 C ATOM 69 O GLY A 8 -1.982 13.769 -24.640 1.00 0.00 O ATOM 0 H GLY A 8 -2.347 14.927 -21.152 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -4.069 13.866 -22.142 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -4.094 15.081 -23.405 1.00 0.00 H new ATOM 73 N GLN A 9 -3.254 12.152 -23.729 1.00 0.00 N ATOM 74 CA GLN A 9 -2.737 11.103 -24.601 1.00 0.00 C ATOM 75 C GLN A 9 -3.865 10.443 -25.387 1.00 0.00 C ATOM 76 O GLN A 9 -5.015 10.422 -24.944 1.00 0.00 O ATOM 77 CB GLN A 9 -1.988 10.052 -23.780 1.00 0.00 C ATOM 78 CG GLN A 9 -2.863 9.339 -22.762 1.00 0.00 C ATOM 79 CD GLN A 9 -2.213 8.084 -22.211 1.00 0.00 C ATOM 80 OE1 GLN A 9 -0.988 7.966 -22.184 1.00 0.00 O ATOM 81 NE2 GLN A 9 -3.033 7.139 -21.767 1.00 0.00 N ATOM 0 H GLN A 9 -3.954 11.836 -23.058 1.00 0.00 H new ATOM 0 HA GLN A 9 -2.046 11.561 -25.309 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -1.557 9.314 -24.456 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -1.158 10.532 -23.261 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -3.086 10.019 -21.940 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -3.814 9.077 -23.226 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -4.042 7.279 -21.809 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -2.653 6.273 -21.384 1.00 0.00 H new ATOM 90 N LEU A 10 -3.530 9.906 -26.555 1.00 0.00 N ATOM 91 CA LEU A 10 -4.515 9.245 -27.404 1.00 0.00 C ATOM 92 C LEU A 10 -4.570 7.749 -27.111 1.00 0.00 C ATOM 93 O LEU A 10 -4.613 6.929 -28.027 1.00 0.00 O ATOM 94 CB LEU A 10 -4.183 9.476 -28.879 1.00 0.00 C ATOM 95 CG LEU A 10 -4.788 10.727 -29.516 1.00 0.00 C ATOM 96 CD1 LEU A 10 -3.849 11.914 -29.358 1.00 0.00 C ATOM 97 CD2 LEU A 10 -5.097 10.481 -30.986 1.00 0.00 C ATOM 0 H LEU A 10 -2.584 9.915 -26.936 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.493 9.675 -27.187 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -3.099 9.528 -28.983 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.516 8.607 -29.446 1.00 0.00 H new ATOM 0 HG LEU A 10 -5.722 10.957 -29.003 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.296 12.795 -29.817 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.678 12.104 -28.298 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.899 11.694 -29.845 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -5.527 11.382 -31.423 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -4.178 10.225 -31.513 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.808 9.659 -31.076 1.00 0.00 H new ATOM 109 N ALA A 11 -4.572 7.403 -25.828 1.00 0.00 N ATOM 110 CA ALA A 11 -4.627 6.007 -25.414 1.00 0.00 C ATOM 111 C ALA A 11 -5.856 5.736 -24.553 1.00 0.00 C ATOM 112 O ALA A 11 -6.326 6.618 -23.833 1.00 0.00 O ATOM 113 CB ALA A 11 -3.361 5.628 -24.662 1.00 0.00 C ATOM 0 H ALA A 11 -4.536 8.070 -25.058 1.00 0.00 H new ATOM 0 HA ALA A 11 -4.702 5.392 -26.311 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -3.417 4.582 -24.359 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -2.496 5.773 -25.309 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -3.261 6.257 -23.777 1.00 0.00 H new ATOM 119 N GLN A 12 -6.372 4.514 -24.631 1.00 0.00 N ATOM 120 CA GLN A 12 -7.548 4.131 -23.859 1.00 0.00 C ATOM 121 C GLN A 12 -7.195 3.073 -22.818 1.00 0.00 C ATOM 122 O GLN A 12 -6.403 2.167 -23.083 1.00 0.00 O ATOM 123 CB GLN A 12 -8.644 3.603 -24.786 1.00 0.00 C ATOM 124 CG GLN A 12 -8.143 2.595 -25.808 1.00 0.00 C ATOM 125 CD GLN A 12 -9.242 2.104 -26.731 1.00 0.00 C ATOM 126 OE1 GLN A 12 -9.850 2.887 -27.461 1.00 0.00 O ATOM 127 NE2 GLN A 12 -9.500 0.802 -26.703 1.00 0.00 N ATOM 0 H GLN A 12 -5.994 3.772 -25.221 1.00 0.00 H new ATOM 0 HA GLN A 12 -7.915 5.017 -23.341 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -9.426 3.140 -24.184 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -9.101 4.443 -25.310 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -7.350 3.049 -26.403 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -7.703 1.744 -25.288 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -8.970 0.190 -26.082 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -10.228 0.413 -27.303 1.00 0.00 H new ATOM 136 N ASP A 13 -7.784 3.194 -21.634 1.00 0.00 N ATOM 137 CA ASP A 13 -7.533 2.249 -20.554 1.00 0.00 C ATOM 138 C ASP A 13 -8.445 2.527 -19.363 1.00 0.00 C ATOM 139 O ASP A 13 -8.580 3.670 -18.926 1.00 0.00 O ATOM 140 CB ASP A 13 -6.068 2.320 -20.117 1.00 0.00 C ATOM 141 CG ASP A 13 -5.562 3.744 -20.018 1.00 0.00 C ATOM 142 OD1 ASP A 13 -6.386 4.653 -19.779 1.00 0.00 O ATOM 143 OD2 ASP A 13 -4.341 3.952 -20.177 1.00 0.00 O ATOM 0 H ASP A 13 -8.440 3.939 -21.398 1.00 0.00 H new ATOM 0 HA ASP A 13 -7.747 1.247 -20.925 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -5.956 1.830 -19.150 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -5.453 1.768 -20.827 1.00 0.00 H new ATOM 148 N GLY A 14 -9.072 1.476 -18.845 1.00 0.00 N ATOM 149 CA GLY A 14 -9.966 1.629 -17.711 1.00 0.00 C ATOM 150 C GLY A 14 -9.222 1.689 -16.391 1.00 0.00 C ATOM 151 O GLY A 14 -9.685 1.152 -15.386 1.00 0.00 O ATOM 0 H GLY A 14 -8.977 0.521 -19.190 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -10.553 2.539 -17.835 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -10.669 0.796 -17.691 1.00 0.00 H new ATOM 155 N VAL A 15 -8.064 2.342 -16.395 1.00 0.00 N ATOM 156 CA VAL A 15 -7.255 2.469 -15.189 1.00 0.00 C ATOM 157 C VAL A 15 -6.915 3.928 -14.907 1.00 0.00 C ATOM 158 O VAL A 15 -6.450 4.663 -15.778 1.00 0.00 O ATOM 159 CB VAL A 15 -5.948 1.663 -15.303 1.00 0.00 C ATOM 160 CG1 VAL A 15 -4.984 2.048 -14.191 1.00 0.00 C ATOM 161 CG2 VAL A 15 -6.240 0.170 -15.273 1.00 0.00 C ATOM 0 H VAL A 15 -7.666 2.791 -17.220 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.849 2.071 -14.366 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.477 1.900 -16.257 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.066 1.468 -14.288 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.751 3.110 -14.263 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -5.443 1.842 -13.224 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.306 -0.385 -15.355 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -6.733 -0.086 -14.335 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -6.891 -0.090 -16.108 1.00 0.00 H new ATOM 171 N PRO A 16 -7.152 4.361 -13.659 1.00 0.00 N ATOM 172 CA PRO A 16 -6.877 5.736 -13.233 1.00 0.00 C ATOM 173 C PRO A 16 -5.383 6.032 -13.156 1.00 0.00 C ATOM 174 O PRO A 16 -4.556 5.128 -13.269 1.00 0.00 O ATOM 175 CB PRO A 16 -7.508 5.807 -11.839 1.00 0.00 C ATOM 176 CG PRO A 16 -7.511 4.399 -11.351 1.00 0.00 C ATOM 177 CD PRO A 16 -7.706 3.540 -12.570 1.00 0.00 C ATOM 0 HA PRO A 16 -7.276 6.468 -13.936 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -6.933 6.454 -11.177 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -8.519 6.213 -11.882 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -6.574 4.158 -10.849 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -8.311 4.238 -10.628 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -7.183 2.588 -12.479 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -8.759 3.311 -12.736 1.00 0.00 H new ATOM 185 N GLU A 17 -5.046 7.303 -12.964 1.00 0.00 N ATOM 186 CA GLU A 17 -3.651 7.716 -12.873 1.00 0.00 C ATOM 187 C GLU A 17 -3.109 7.496 -11.464 1.00 0.00 C ATOM 188 O GLU A 17 -1.966 7.071 -11.285 1.00 0.00 O ATOM 189 CB GLU A 17 -3.505 9.189 -13.263 1.00 0.00 C ATOM 190 CG GLU A 17 -4.626 10.071 -12.737 1.00 0.00 C ATOM 191 CD GLU A 17 -5.808 10.137 -13.684 1.00 0.00 C ATOM 192 OE1 GLU A 17 -5.619 9.866 -14.889 1.00 0.00 O ATOM 193 OE2 GLU A 17 -6.922 10.459 -13.221 1.00 0.00 O ATOM 0 H GLU A 17 -5.719 8.064 -12.869 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.072 7.105 -13.566 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.553 9.563 -12.887 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.472 9.267 -14.350 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.960 9.691 -11.771 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -4.243 11.078 -12.569 1.00 0.00 H new ATOM 200 N TRP A 18 -3.934 7.788 -10.466 1.00 0.00 N ATOM 201 CA TRP A 18 -3.538 7.623 -9.072 1.00 0.00 C ATOM 202 C TRP A 18 -3.162 6.175 -8.782 1.00 0.00 C ATOM 203 O TRP A 18 -2.602 5.867 -7.729 1.00 0.00 O ATOM 204 CB TRP A 18 -4.670 8.064 -8.143 1.00 0.00 C ATOM 205 CG TRP A 18 -5.968 7.366 -8.414 1.00 0.00 C ATOM 206 CD1 TRP A 18 -6.995 7.816 -9.193 1.00 0.00 C ATOM 207 CD2 TRP A 18 -6.378 6.092 -7.903 1.00 0.00 C ATOM 208 NE1 TRP A 18 -8.019 6.900 -9.199 1.00 0.00 N ATOM 209 CE2 TRP A 18 -7.665 5.833 -8.415 1.00 0.00 C ATOM 210 CE3 TRP A 18 -5.784 5.145 -7.065 1.00 0.00 C ATOM 211 CZ2 TRP A 18 -8.364 4.667 -8.115 1.00 0.00 C ATOM 212 CZ3 TRP A 18 -6.480 3.989 -6.767 1.00 0.00 C ATOM 213 CH2 TRP A 18 -7.757 3.757 -7.291 1.00 0.00 C ATOM 0 H TRP A 18 -4.882 8.141 -10.596 1.00 0.00 H new ATOM 0 HA TRP A 18 -2.665 8.250 -8.892 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -4.375 7.879 -7.110 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -4.816 9.139 -8.245 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -7.002 8.755 -9.727 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -8.899 6.998 -9.705 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -4.798 5.313 -6.657 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -9.350 4.487 -8.518 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -6.031 3.252 -6.118 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -8.274 2.842 -7.041 1.00 0.00 H new ATOM 224 N PHE A 19 -3.472 5.287 -9.720 1.00 0.00 N ATOM 225 CA PHE A 19 -3.166 3.870 -9.564 1.00 0.00 C ATOM 226 C PHE A 19 -1.902 3.497 -10.333 1.00 0.00 C ATOM 227 O PHE A 19 -1.913 3.405 -11.561 1.00 0.00 O ATOM 228 CB PHE A 19 -4.341 3.016 -10.048 1.00 0.00 C ATOM 229 CG PHE A 19 -4.207 1.560 -9.702 1.00 0.00 C ATOM 230 CD1 PHE A 19 -4.172 1.150 -8.379 1.00 0.00 C ATOM 231 CD2 PHE A 19 -4.118 0.603 -10.699 1.00 0.00 C ATOM 232 CE1 PHE A 19 -4.047 -0.189 -8.058 1.00 0.00 C ATOM 233 CE2 PHE A 19 -3.994 -0.737 -10.384 1.00 0.00 C ATOM 234 CZ PHE A 19 -3.960 -1.133 -9.061 1.00 0.00 C ATOM 0 H PHE A 19 -3.935 5.524 -10.597 1.00 0.00 H new ATOM 0 HA PHE A 19 -2.996 3.676 -8.505 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -5.263 3.401 -9.613 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -4.432 3.117 -11.129 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -4.243 1.884 -7.590 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -4.146 0.907 -11.735 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -4.017 -0.496 -7.023 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -3.924 -1.473 -11.171 1.00 0.00 H new ATOM 0 HZ PHE A 19 -3.865 -2.180 -8.812 1.00 0.00 H new ATOM 244 N HIS A 20 -0.812 3.286 -9.601 1.00 0.00 N ATOM 245 CA HIS A 20 0.460 2.924 -10.214 1.00 0.00 C ATOM 246 C HIS A 20 0.762 1.443 -10.008 1.00 0.00 C ATOM 247 O HIS A 20 1.903 1.060 -9.755 1.00 0.00 O ATOM 248 CB HIS A 20 1.592 3.772 -9.629 1.00 0.00 C ATOM 249 CG HIS A 20 1.358 5.246 -9.753 1.00 0.00 C ATOM 250 ND1 HIS A 20 2.080 6.054 -10.606 1.00 0.00 N ATOM 251 CD2 HIS A 20 0.476 6.059 -9.125 1.00 0.00 C ATOM 252 CE1 HIS A 20 1.653 7.299 -10.498 1.00 0.00 C ATOM 253 NE2 HIS A 20 0.680 7.329 -9.605 1.00 0.00 N ATOM 0 H HIS A 20 -0.785 3.360 -8.584 1.00 0.00 H new ATOM 0 HA HIS A 20 0.386 3.116 -11.284 1.00 0.00 H new ATOM 0 HB2 HIS A 20 1.718 3.519 -8.576 1.00 0.00 H new ATOM 0 HB3 HIS A 20 2.524 3.516 -10.132 1.00 0.00 H new ATOM 0 HD2 HIS A 20 -0.252 5.763 -8.384 1.00 0.00 H new ATOM 0 HE1 HIS A 20 2.034 8.148 -11.046 1.00 0.00 H new ATOM 0 HE2 HIS A 20 0.164 8.161 -9.319 1.00 0.00 H new ATOM 261 N GLY A 21 -0.271 0.613 -10.115 1.00 0.00 N ATOM 262 CA GLY A 21 -0.097 -0.816 -9.936 1.00 0.00 C ATOM 263 C GLY A 21 0.761 -1.149 -8.731 1.00 0.00 C ATOM 264 O GLY A 21 0.408 -0.820 -7.600 1.00 0.00 O ATOM 0 H GLY A 21 -1.226 0.905 -10.323 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -1.074 -1.287 -9.824 1.00 0.00 H new ATOM 0 HA3 GLY A 21 0.360 -1.238 -10.831 1.00 0.00 H new ATOM 268 N ALA A 22 1.890 -1.805 -8.974 1.00 0.00 N ATOM 269 CA ALA A 22 2.801 -2.183 -7.900 1.00 0.00 C ATOM 270 C ALA A 22 4.130 -1.446 -8.024 1.00 0.00 C ATOM 271 O ALA A 22 4.960 -1.781 -8.869 1.00 0.00 O ATOM 272 CB ALA A 22 3.027 -3.687 -7.905 1.00 0.00 C ATOM 0 H ALA A 22 2.196 -2.086 -9.905 1.00 0.00 H new ATOM 0 HA ALA A 22 2.344 -1.899 -6.952 1.00 0.00 H new ATOM 0 HB1 ALA A 22 3.709 -3.955 -7.098 1.00 0.00 H new ATOM 0 HB2 ALA A 22 2.075 -4.198 -7.761 1.00 0.00 H new ATOM 0 HB3 ALA A 22 3.459 -3.987 -8.860 1.00 0.00 H new ATOM 278 N ILE A 23 4.326 -0.442 -7.176 1.00 0.00 N ATOM 279 CA ILE A 23 5.555 0.341 -7.191 1.00 0.00 C ATOM 280 C ILE A 23 6.362 0.122 -5.915 1.00 0.00 C ATOM 281 O ILE A 23 5.920 -0.574 -5.000 1.00 0.00 O ATOM 282 CB ILE A 23 5.263 1.845 -7.348 1.00 0.00 C ATOM 283 CG1 ILE A 23 4.196 2.287 -6.344 1.00 0.00 C ATOM 284 CG2 ILE A 23 4.820 2.153 -8.770 1.00 0.00 C ATOM 285 CD1 ILE A 23 4.174 3.780 -6.103 1.00 0.00 C ATOM 0 H ILE A 23 3.649 -0.152 -6.470 1.00 0.00 H new ATOM 0 HA ILE A 23 6.135 0.000 -8.049 1.00 0.00 H new ATOM 0 HB ILE A 23 6.178 2.401 -7.145 1.00 0.00 H new ATOM 0 HG12 ILE A 23 3.217 1.971 -6.704 1.00 0.00 H new ATOM 0 HG13 ILE A 23 4.367 1.777 -5.396 1.00 0.00 H new ATOM 0 HG21 ILE A 23 4.617 3.220 -8.865 1.00 0.00 H new ATOM 0 HG22 ILE A 23 5.609 1.870 -9.466 1.00 0.00 H new ATOM 0 HG23 ILE A 23 3.915 1.590 -8.999 1.00 0.00 H new ATOM 0 HD11 ILE A 23 3.394 4.021 -5.381 1.00 0.00 H new ATOM 0 HD12 ILE A 23 5.140 4.100 -5.713 1.00 0.00 H new ATOM 0 HD13 ILE A 23 3.972 4.297 -7.041 1.00 0.00 H new ATOM 297 N SER A 24 7.546 0.722 -5.860 1.00 0.00 N ATOM 298 CA SER A 24 8.416 0.590 -4.697 1.00 0.00 C ATOM 299 C SER A 24 8.273 1.797 -3.774 1.00 0.00 C ATOM 300 O SER A 24 8.064 2.921 -4.230 1.00 0.00 O ATOM 301 CB SER A 24 9.874 0.442 -5.138 1.00 0.00 C ATOM 302 OG SER A 24 10.729 0.268 -4.022 1.00 0.00 O ATOM 0 H SER A 24 7.925 1.304 -6.607 1.00 0.00 H new ATOM 0 HA SER A 24 8.117 -0.304 -4.149 1.00 0.00 H new ATOM 0 HB2 SER A 24 9.969 -0.411 -5.810 1.00 0.00 H new ATOM 0 HB3 SER A 24 10.179 1.325 -5.699 1.00 0.00 H new ATOM 0 HG SER A 24 11.654 0.174 -4.330 1.00 0.00 H new ATOM 308 N ARG A 25 8.389 1.554 -2.472 1.00 0.00 N ATOM 309 CA ARG A 25 8.271 2.619 -1.484 1.00 0.00 C ATOM 310 C ARG A 25 9.021 3.868 -1.937 1.00 0.00 C ATOM 311 O ARG A 25 8.612 4.990 -1.642 1.00 0.00 O ATOM 312 CB ARG A 25 8.812 2.150 -0.131 1.00 0.00 C ATOM 313 CG ARG A 25 8.189 2.867 1.055 1.00 0.00 C ATOM 314 CD ARG A 25 8.977 4.113 1.430 1.00 0.00 C ATOM 315 NE ARG A 25 10.309 3.788 1.933 1.00 0.00 N ATOM 316 CZ ARG A 25 11.180 4.700 2.350 1.00 0.00 C ATOM 317 NH1 ARG A 25 10.861 5.987 2.324 1.00 0.00 N ATOM 318 NH2 ARG A 25 12.372 4.326 2.794 1.00 0.00 N ATOM 0 H ARG A 25 8.564 0.630 -2.078 1.00 0.00 H new ATOM 0 HA ARG A 25 7.215 2.868 -1.380 1.00 0.00 H new ATOM 0 HB2 ARG A 25 8.636 1.079 -0.030 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.891 2.300 -0.109 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.162 3.143 0.816 1.00 0.00 H new ATOM 0 HG3 ARG A 25 8.147 2.191 1.909 1.00 0.00 H new ATOM 0 HD2 ARG A 25 9.067 4.761 0.558 1.00 0.00 H new ATOM 0 HD3 ARG A 25 8.430 4.673 2.188 1.00 0.00 H new ATOM 0 HE ARG A 25 10.586 2.807 1.966 1.00 0.00 H new ATOM 0 HH11 ARG A 25 9.945 6.279 1.983 1.00 0.00 H new ATOM 0 HH12 ARG A 25 11.532 6.685 2.645 1.00 0.00 H new ATOM 0 HH21 ARG A 25 12.621 3.337 2.816 1.00 0.00 H new ATOM 0 HH22 ARG A 25 13.040 5.027 3.114 1.00 0.00 H new ATOM 332 N GLU A 26 10.120 3.664 -2.657 1.00 0.00 N ATOM 333 CA GLU A 26 10.927 4.774 -3.150 1.00 0.00 C ATOM 334 C GLU A 26 10.242 5.463 -4.327 1.00 0.00 C ATOM 335 O GLU A 26 10.242 6.690 -4.428 1.00 0.00 O ATOM 336 CB GLU A 26 12.312 4.279 -3.570 1.00 0.00 C ATOM 337 CG GLU A 26 12.868 3.188 -2.670 1.00 0.00 C ATOM 338 CD GLU A 26 14.384 3.185 -2.626 1.00 0.00 C ATOM 339 OE1 GLU A 26 14.975 4.266 -2.427 1.00 0.00 O ATOM 340 OE2 GLU A 26 14.978 2.099 -2.790 1.00 0.00 O ATOM 0 H GLU A 26 10.472 2.741 -2.912 1.00 0.00 H new ATOM 0 HA GLU A 26 11.037 5.497 -2.342 1.00 0.00 H new ATOM 0 HB2 GLU A 26 12.260 3.904 -4.592 1.00 0.00 H new ATOM 0 HB3 GLU A 26 13.003 5.122 -3.575 1.00 0.00 H new ATOM 0 HG2 GLU A 26 12.479 3.322 -1.661 1.00 0.00 H new ATOM 0 HG3 GLU A 26 12.516 2.218 -3.021 1.00 0.00 H new ATOM 347 N ASP A 27 9.660 4.664 -5.215 1.00 0.00 N ATOM 348 CA ASP A 27 8.972 5.196 -6.386 1.00 0.00 C ATOM 349 C ASP A 27 7.875 6.174 -5.974 1.00 0.00 C ATOM 350 O ASP A 27 7.871 7.330 -6.396 1.00 0.00 O ATOM 351 CB ASP A 27 8.372 4.057 -7.212 1.00 0.00 C ATOM 352 CG ASP A 27 9.387 3.415 -8.137 1.00 0.00 C ATOM 353 OD1 ASP A 27 10.088 4.158 -8.855 1.00 0.00 O ATOM 354 OD2 ASP A 27 9.481 2.170 -8.143 1.00 0.00 O ATOM 0 H ASP A 27 9.651 3.646 -5.146 1.00 0.00 H new ATOM 0 HA ASP A 27 9.702 5.731 -6.994 1.00 0.00 H new ATOM 0 HB2 ASP A 27 7.967 3.300 -6.541 1.00 0.00 H new ATOM 0 HB3 ASP A 27 7.539 4.439 -7.801 1.00 0.00 H new ATOM 359 N ALA A 28 6.948 5.701 -5.148 1.00 0.00 N ATOM 360 CA ALA A 28 5.847 6.534 -4.679 1.00 0.00 C ATOM 361 C ALA A 28 6.352 7.892 -4.202 1.00 0.00 C ATOM 362 O ALA A 28 5.934 8.931 -4.710 1.00 0.00 O ATOM 363 CB ALA A 28 5.090 5.828 -3.563 1.00 0.00 C ATOM 0 H ALA A 28 6.937 4.746 -4.790 1.00 0.00 H new ATOM 0 HA ALA A 28 5.168 6.701 -5.515 1.00 0.00 H new ATOM 0 HB1 ALA A 28 4.271 6.461 -3.222 1.00 0.00 H new ATOM 0 HB2 ALA A 28 4.689 4.885 -3.935 1.00 0.00 H new ATOM 0 HB3 ALA A 28 5.767 5.632 -2.732 1.00 0.00 H new ATOM 369 N GLU A 29 7.250 7.875 -3.222 1.00 0.00 N ATOM 370 CA GLU A 29 7.809 9.105 -2.677 1.00 0.00 C ATOM 371 C GLU A 29 8.432 9.956 -3.780 1.00 0.00 C ATOM 372 O GLU A 29 8.239 11.170 -3.826 1.00 0.00 O ATOM 373 CB GLU A 29 8.859 8.787 -1.610 1.00 0.00 C ATOM 374 CG GLU A 29 8.269 8.521 -0.235 1.00 0.00 C ATOM 375 CD GLU A 29 9.206 8.916 0.889 1.00 0.00 C ATOM 376 OE1 GLU A 29 10.435 8.879 0.677 1.00 0.00 O ATOM 377 OE2 GLU A 29 8.709 9.264 1.981 1.00 0.00 O ATOM 0 H GLU A 29 7.606 7.022 -2.790 1.00 0.00 H new ATOM 0 HA GLU A 29 6.997 9.670 -2.220 1.00 0.00 H new ATOM 0 HB2 GLU A 29 9.432 7.915 -1.925 1.00 0.00 H new ATOM 0 HB3 GLU A 29 9.558 9.620 -1.541 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.333 9.071 -0.133 1.00 0.00 H new ATOM 0 HG3 GLU A 29 8.028 7.462 -0.146 1.00 0.00 H new ATOM 384 N ASN A 30 9.179 9.309 -4.668 1.00 0.00 N ATOM 385 CA ASN A 30 9.831 10.005 -5.771 1.00 0.00 C ATOM 386 C ASN A 30 8.805 10.484 -6.794 1.00 0.00 C ATOM 387 O ASN A 30 9.066 11.411 -7.562 1.00 0.00 O ATOM 388 CB ASN A 30 10.853 9.088 -6.447 1.00 0.00 C ATOM 389 CG ASN A 30 12.211 9.138 -5.772 1.00 0.00 C ATOM 390 OD1 ASN A 30 13.168 9.682 -6.320 1.00 0.00 O ATOM 391 ND2 ASN A 30 12.298 8.570 -4.575 1.00 0.00 N ATOM 0 H ASN A 30 9.348 8.303 -4.645 1.00 0.00 H new ATOM 0 HA ASN A 30 10.347 10.875 -5.365 1.00 0.00 H new ATOM 0 HB2 ASN A 30 10.482 8.063 -6.435 1.00 0.00 H new ATOM 0 HB3 ASN A 30 10.959 9.376 -7.493 1.00 0.00 H new ATOM 0 HD21 ASN A 30 13.185 8.574 -4.072 1.00 0.00 H new ATOM 0 HD22 ASN A 30 11.477 8.130 -4.158 1.00 0.00 H new ATOM 398 N LEU A 31 7.640 9.848 -6.798 1.00 0.00 N ATOM 399 CA LEU A 31 6.574 10.209 -7.725 1.00 0.00 C ATOM 400 C LEU A 31 5.858 11.474 -7.265 1.00 0.00 C ATOM 401 O LEU A 31 5.379 12.261 -8.083 1.00 0.00 O ATOM 402 CB LEU A 31 5.571 9.060 -7.854 1.00 0.00 C ATOM 403 CG LEU A 31 5.872 8.025 -8.938 1.00 0.00 C ATOM 404 CD1 LEU A 31 5.222 6.693 -8.600 1.00 0.00 C ATOM 405 CD2 LEU A 31 5.398 8.522 -10.296 1.00 0.00 C ATOM 0 H LEU A 31 7.409 9.079 -6.169 1.00 0.00 H new ATOM 0 HA LEU A 31 7.024 10.401 -8.699 1.00 0.00 H new ATOM 0 HB2 LEU A 31 5.513 8.546 -6.895 1.00 0.00 H new ATOM 0 HB3 LEU A 31 4.586 9.484 -8.048 1.00 0.00 H new ATOM 0 HG LEU A 31 6.951 7.878 -8.983 1.00 0.00 H new ATOM 0 HD11 LEU A 31 5.447 5.969 -9.383 1.00 0.00 H new ATOM 0 HD12 LEU A 31 5.610 6.330 -7.648 1.00 0.00 H new ATOM 0 HD13 LEU A 31 4.142 6.823 -8.526 1.00 0.00 H new ATOM 0 HD21 LEU A 31 5.620 7.773 -11.056 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.323 8.698 -10.264 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.911 9.452 -10.542 1.00 0.00 H new ATOM 417 N LEU A 32 5.790 11.667 -5.953 1.00 0.00 N ATOM 418 CA LEU A 32 5.135 12.839 -5.384 1.00 0.00 C ATOM 419 C LEU A 32 6.141 13.957 -5.131 1.00 0.00 C ATOM 420 O LEU A 32 5.781 15.133 -5.099 1.00 0.00 O ATOM 421 CB LEU A 32 4.429 12.469 -4.079 1.00 0.00 C ATOM 422 CG LEU A 32 3.440 11.306 -4.157 1.00 0.00 C ATOM 423 CD1 LEU A 32 3.126 10.778 -2.766 1.00 0.00 C ATOM 424 CD2 LEU A 32 2.163 11.738 -4.864 1.00 0.00 C ATOM 0 H LEU A 32 6.181 11.026 -5.262 1.00 0.00 H new ATOM 0 HA LEU A 32 4.396 13.196 -6.102 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.188 12.225 -3.335 1.00 0.00 H new ATOM 0 HB3 LEU A 32 3.897 13.348 -3.715 1.00 0.00 H new ATOM 0 HG LEU A 32 3.899 10.503 -4.734 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.420 9.951 -2.842 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.044 10.430 -2.293 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.688 11.575 -2.165 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.471 10.897 -4.910 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.702 12.558 -4.313 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.401 12.068 -5.875 1.00 0.00 H new ATOM 436 N GLU A 33 7.405 13.582 -4.957 1.00 0.00 N ATOM 437 CA GLU A 33 8.462 14.553 -4.710 1.00 0.00 C ATOM 438 C GLU A 33 8.518 15.592 -5.826 1.00 0.00 C ATOM 439 O GLU A 33 8.605 16.794 -5.566 1.00 0.00 O ATOM 440 CB GLU A 33 9.815 13.848 -4.587 1.00 0.00 C ATOM 441 CG GLU A 33 10.556 13.718 -5.908 1.00 0.00 C ATOM 442 CD GLU A 33 11.861 12.958 -5.773 1.00 0.00 C ATOM 443 OE1 GLU A 33 12.513 13.080 -4.714 1.00 0.00 O ATOM 444 OE2 GLU A 33 12.230 12.240 -6.725 1.00 0.00 O ATOM 0 H GLU A 33 7.721 12.612 -4.983 1.00 0.00 H new ATOM 0 HA GLU A 33 8.239 15.063 -3.773 1.00 0.00 H new ATOM 0 HB2 GLU A 33 10.439 14.398 -3.883 1.00 0.00 H new ATOM 0 HB3 GLU A 33 9.660 12.854 -4.167 1.00 0.00 H new ATOM 0 HG2 GLU A 33 9.917 13.210 -6.630 1.00 0.00 H new ATOM 0 HG3 GLU A 33 10.759 14.712 -6.306 1.00 0.00 H new ATOM 451 N SER A 34 8.467 15.122 -7.068 1.00 0.00 N ATOM 452 CA SER A 34 8.517 16.010 -8.224 1.00 0.00 C ATOM 453 C SER A 34 7.127 16.541 -8.560 1.00 0.00 C ATOM 454 O SER A 34 6.916 17.131 -9.619 1.00 0.00 O ATOM 455 CB SER A 34 9.100 15.276 -9.432 1.00 0.00 C ATOM 456 OG SER A 34 10.404 14.794 -9.155 1.00 0.00 O ATOM 0 H SER A 34 8.391 14.132 -7.300 1.00 0.00 H new ATOM 0 HA SER A 34 9.160 16.854 -7.976 1.00 0.00 H new ATOM 0 HB2 SER A 34 8.451 14.443 -9.704 1.00 0.00 H new ATOM 0 HB3 SER A 34 9.132 15.948 -10.289 1.00 0.00 H new ATOM 0 HG SER A 34 10.754 14.327 -9.942 1.00 0.00 H new ATOM 462 N GLN A 35 6.182 16.328 -7.648 1.00 0.00 N ATOM 463 CA GLN A 35 4.812 16.785 -7.849 1.00 0.00 C ATOM 464 C GLN A 35 4.468 17.914 -6.884 1.00 0.00 C ATOM 465 O GLN A 35 5.088 18.075 -5.832 1.00 0.00 O ATOM 466 CB GLN A 35 3.833 15.624 -7.663 1.00 0.00 C ATOM 467 CG GLN A 35 3.732 14.714 -8.878 1.00 0.00 C ATOM 468 CD GLN A 35 3.339 15.463 -10.137 1.00 0.00 C ATOM 469 OE1 GLN A 35 2.211 15.942 -10.261 1.00 0.00 O ATOM 470 NE2 GLN A 35 4.269 15.567 -11.078 1.00 0.00 N ATOM 0 H GLN A 35 6.340 15.843 -6.765 1.00 0.00 H new ATOM 0 HA GLN A 35 4.727 17.164 -8.868 1.00 0.00 H new ATOM 0 HB2 GLN A 35 4.142 15.033 -6.801 1.00 0.00 H new ATOM 0 HB3 GLN A 35 2.845 16.025 -7.436 1.00 0.00 H new ATOM 0 HG2 GLN A 35 4.690 14.220 -9.038 1.00 0.00 H new ATOM 0 HG3 GLN A 35 2.999 13.932 -8.681 1.00 0.00 H new ATOM 0 HE21 GLN A 35 5.190 15.154 -10.932 1.00 0.00 H new ATOM 0 HE22 GLN A 35 4.062 16.059 -11.947 1.00 0.00 H new ATOM 479 N PRO A 36 3.457 18.716 -7.246 1.00 0.00 N ATOM 480 CA PRO A 36 3.007 19.845 -6.425 1.00 0.00 C ATOM 481 C PRO A 36 2.317 19.390 -5.144 1.00 0.00 C ATOM 482 O PRO A 36 1.730 18.309 -5.092 1.00 0.00 O ATOM 483 CB PRO A 36 2.016 20.574 -7.336 1.00 0.00 C ATOM 484 CG PRO A 36 1.520 19.526 -8.272 1.00 0.00 C ATOM 485 CD PRO A 36 2.672 18.582 -8.486 1.00 0.00 C ATOM 0 HA PRO A 36 3.839 20.466 -6.095 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.199 21.011 -6.762 1.00 0.00 H new ATOM 0 HB3 PRO A 36 2.499 21.389 -7.875 1.00 0.00 H new ATOM 0 HG2 PRO A 36 0.660 19.004 -7.853 1.00 0.00 H new ATOM 0 HG3 PRO A 36 1.196 19.967 -9.215 1.00 0.00 H new ATOM 0 HD2 PRO A 36 2.330 17.558 -8.637 1.00 0.00 H new ATOM 0 HD3 PRO A 36 3.258 18.855 -9.364 1.00 0.00 H new ATOM 493 N LEU A 37 2.391 20.222 -4.111 1.00 0.00 N ATOM 494 CA LEU A 37 1.773 19.907 -2.827 1.00 0.00 C ATOM 495 C LEU A 37 0.307 19.525 -3.008 1.00 0.00 C ATOM 496 O LEU A 37 -0.451 20.229 -3.674 1.00 0.00 O ATOM 497 CB LEU A 37 1.887 21.099 -1.877 1.00 0.00 C ATOM 498 CG LEU A 37 1.970 20.765 -0.387 1.00 0.00 C ATOM 499 CD1 LEU A 37 0.790 19.902 0.033 1.00 0.00 C ATOM 500 CD2 LEU A 37 3.284 20.066 -0.070 1.00 0.00 C ATOM 0 H LEU A 37 2.873 21.121 -4.137 1.00 0.00 H new ATOM 0 HA LEU A 37 2.301 19.056 -2.397 1.00 0.00 H new ATOM 0 HB2 LEU A 37 2.773 21.672 -2.150 1.00 0.00 H new ATOM 0 HB3 LEU A 37 1.026 21.748 -2.036 1.00 0.00 H new ATOM 0 HG LEU A 37 1.931 21.697 0.178 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.866 19.674 1.096 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.139 20.439 -0.158 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.797 18.974 -0.538 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.326 19.836 0.995 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.352 19.142 -0.644 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.116 20.719 -0.333 1.00 0.00 H new ATOM 512 N GLY A 38 -0.086 18.404 -2.410 1.00 0.00 N ATOM 513 CA GLY A 38 -1.459 17.949 -2.516 1.00 0.00 C ATOM 514 C GLY A 38 -1.600 16.731 -3.407 1.00 0.00 C ATOM 515 O GLY A 38 -2.597 16.012 -3.334 1.00 0.00 O ATOM 0 H GLY A 38 0.523 17.803 -1.854 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -1.838 17.713 -1.522 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -2.077 18.756 -2.909 1.00 0.00 H new ATOM 519 N SER A 39 -0.600 16.499 -4.251 1.00 0.00 N ATOM 520 CA SER A 39 -0.619 15.361 -5.164 1.00 0.00 C ATOM 521 C SER A 39 -0.746 14.050 -4.395 1.00 0.00 C ATOM 522 O SER A 39 0.070 13.745 -3.526 1.00 0.00 O ATOM 523 CB SER A 39 0.651 15.344 -6.017 1.00 0.00 C ATOM 524 OG SER A 39 0.770 16.534 -6.777 1.00 0.00 O ATOM 0 H SER A 39 0.233 17.083 -4.322 1.00 0.00 H new ATOM 0 HA SER A 39 -1.486 15.465 -5.817 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.524 15.231 -5.374 1.00 0.00 H new ATOM 0 HB3 SER A 39 0.633 14.483 -6.685 1.00 0.00 H new ATOM 0 HG SER A 39 1.323 17.180 -6.289 1.00 0.00 H new ATOM 530 N PHE A 40 -1.776 13.277 -4.722 1.00 0.00 N ATOM 531 CA PHE A 40 -2.013 11.999 -4.062 1.00 0.00 C ATOM 532 C PHE A 40 -1.918 10.847 -5.059 1.00 0.00 C ATOM 533 O PHE A 40 -2.202 11.013 -6.246 1.00 0.00 O ATOM 534 CB PHE A 40 -3.387 11.993 -3.390 1.00 0.00 C ATOM 535 CG PHE A 40 -4.530 11.910 -4.362 1.00 0.00 C ATOM 536 CD1 PHE A 40 -5.001 10.682 -4.795 1.00 0.00 C ATOM 537 CD2 PHE A 40 -5.133 13.062 -4.843 1.00 0.00 C ATOM 538 CE1 PHE A 40 -6.052 10.602 -5.689 1.00 0.00 C ATOM 539 CE2 PHE A 40 -6.184 12.988 -5.737 1.00 0.00 C ATOM 540 CZ PHE A 40 -6.643 11.757 -6.161 1.00 0.00 C ATOM 0 H PHE A 40 -2.460 13.514 -5.441 1.00 0.00 H new ATOM 0 HA PHE A 40 -1.244 11.864 -3.301 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -3.443 11.149 -2.703 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.494 12.898 -2.792 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -4.541 9.776 -4.430 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -4.777 14.028 -4.515 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -6.410 9.638 -6.018 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -6.646 13.893 -6.104 1.00 0.00 H new ATOM 0 HZ PHE A 40 -7.463 11.698 -6.861 1.00 0.00 H new ATOM 550 N LEU A 41 -1.516 9.680 -4.569 1.00 0.00 N ATOM 551 CA LEU A 41 -1.382 8.499 -5.414 1.00 0.00 C ATOM 552 C LEU A 41 -1.382 7.225 -4.576 1.00 0.00 C ATOM 553 O LEU A 41 -0.829 7.194 -3.476 1.00 0.00 O ATOM 554 CB LEU A 41 -0.095 8.581 -6.238 1.00 0.00 C ATOM 555 CG LEU A 41 1.139 7.921 -5.622 1.00 0.00 C ATOM 556 CD1 LEU A 41 1.352 8.409 -4.198 1.00 0.00 C ATOM 557 CD2 LEU A 41 1.004 6.404 -5.653 1.00 0.00 C ATOM 0 H LEU A 41 -1.277 9.526 -3.589 1.00 0.00 H new ATOM 0 HA LEU A 41 -2.238 8.467 -6.089 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.280 8.124 -7.210 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.131 9.632 -6.418 1.00 0.00 H new ATOM 0 HG LEU A 41 2.010 8.201 -6.214 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.235 7.928 -3.777 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.494 9.490 -4.201 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.480 8.160 -3.594 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.891 5.951 -5.211 1.00 0.00 H new ATOM 0 HD22 LEU A 41 0.123 6.105 -5.085 1.00 0.00 H new ATOM 0 HD23 LEU A 41 0.902 6.069 -6.685 1.00 0.00 H new ATOM 569 N ILE A 42 -2.004 6.176 -5.103 1.00 0.00 N ATOM 570 CA ILE A 42 -2.073 4.899 -4.405 1.00 0.00 C ATOM 571 C ILE A 42 -1.293 3.821 -5.151 1.00 0.00 C ATOM 572 O ILE A 42 -1.045 3.939 -6.351 1.00 0.00 O ATOM 573 CB ILE A 42 -3.529 4.432 -4.228 1.00 0.00 C ATOM 574 CG1 ILE A 42 -4.364 5.530 -3.565 1.00 0.00 C ATOM 575 CG2 ILE A 42 -3.580 3.152 -3.407 1.00 0.00 C ATOM 576 CD1 ILE A 42 -5.836 5.196 -3.469 1.00 0.00 C ATOM 0 H ILE A 42 -2.468 6.186 -6.012 1.00 0.00 H new ATOM 0 HA ILE A 42 -1.627 5.053 -3.422 1.00 0.00 H new ATOM 0 HB ILE A 42 -3.950 4.226 -5.212 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.976 5.715 -2.563 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.246 6.455 -4.129 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -4.616 2.835 -3.291 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -3.016 2.370 -3.916 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.144 3.332 -2.425 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -6.365 6.019 -2.989 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.240 5.040 -4.469 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -5.965 4.288 -2.880 1.00 0.00 H new ATOM 588 N ARG A 43 -0.910 2.772 -4.432 1.00 0.00 N ATOM 589 CA ARG A 43 -0.158 1.671 -5.025 1.00 0.00 C ATOM 590 C ARG A 43 -0.442 0.363 -4.295 1.00 0.00 C ATOM 591 O ARG A 43 -0.559 0.335 -3.069 1.00 0.00 O ATOM 592 CB ARG A 43 1.341 1.974 -4.991 1.00 0.00 C ATOM 593 CG ARG A 43 1.902 2.107 -3.584 1.00 0.00 C ATOM 594 CD ARG A 43 1.831 3.543 -3.089 1.00 0.00 C ATOM 595 NE ARG A 43 2.209 3.658 -1.684 1.00 0.00 N ATOM 596 CZ ARG A 43 3.459 3.548 -1.247 1.00 0.00 C ATOM 597 NH1 ARG A 43 4.446 3.324 -2.104 1.00 0.00 N ATOM 598 NH2 ARG A 43 3.724 3.664 0.047 1.00 0.00 N ATOM 0 H ARG A 43 -1.108 2.660 -3.438 1.00 0.00 H new ATOM 0 HA ARG A 43 -0.476 1.563 -6.062 1.00 0.00 H new ATOM 0 HB2 ARG A 43 1.876 1.181 -5.513 1.00 0.00 H new ATOM 0 HB3 ARG A 43 1.529 2.898 -5.537 1.00 0.00 H new ATOM 0 HG2 ARG A 43 1.345 1.460 -2.907 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.938 1.767 -3.570 1.00 0.00 H new ATOM 0 HD2 ARG A 43 2.489 4.167 -3.693 1.00 0.00 H new ATOM 0 HD3 ARG A 43 0.818 3.923 -3.224 1.00 0.00 H new ATOM 0 HE ARG A 43 1.473 3.832 -1.000 1.00 0.00 H new ATOM 0 HH11 ARG A 43 4.246 3.236 -3.100 1.00 0.00 H new ATOM 0 HH12 ARG A 43 5.405 3.240 -1.767 1.00 0.00 H new ATOM 0 HH21 ARG A 43 2.968 3.838 0.709 1.00 0.00 H new ATOM 0 HH22 ARG A 43 4.684 3.579 0.381 1.00 0.00 H new ATOM 612 N VAL A 44 -0.551 -0.722 -5.056 1.00 0.00 N ATOM 613 CA VAL A 44 -0.820 -2.035 -4.482 1.00 0.00 C ATOM 614 C VAL A 44 0.219 -2.397 -3.425 1.00 0.00 C ATOM 615 O VAL A 44 1.417 -2.433 -3.705 1.00 0.00 O ATOM 616 CB VAL A 44 -0.837 -3.129 -5.565 1.00 0.00 C ATOM 617 CG1 VAL A 44 -0.977 -4.505 -4.933 1.00 0.00 C ATOM 618 CG2 VAL A 44 -1.956 -2.874 -6.563 1.00 0.00 C ATOM 0 H VAL A 44 -0.457 -0.717 -6.072 1.00 0.00 H new ATOM 0 HA VAL A 44 -1.804 -1.980 -4.016 1.00 0.00 H new ATOM 0 HB VAL A 44 0.111 -3.098 -6.102 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.987 -5.265 -5.714 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.136 -4.685 -4.263 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -1.908 -4.553 -4.368 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.953 -3.657 -7.321 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.914 -2.876 -6.044 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.804 -1.906 -7.041 1.00 0.00 H new ATOM 628 N SER A 45 -0.249 -2.663 -2.211 1.00 0.00 N ATOM 629 CA SER A 45 0.640 -3.020 -1.111 1.00 0.00 C ATOM 630 C SER A 45 1.145 -4.451 -1.261 1.00 0.00 C ATOM 631 O SER A 45 0.595 -5.237 -2.034 1.00 0.00 O ATOM 632 CB SER A 45 -0.082 -2.860 0.229 1.00 0.00 C ATOM 633 OG SER A 45 -0.201 -1.493 0.584 1.00 0.00 O ATOM 0 H SER A 45 -1.238 -2.638 -1.963 1.00 0.00 H new ATOM 0 HA SER A 45 1.497 -2.347 -1.137 1.00 0.00 H new ATOM 0 HB2 SER A 45 -1.073 -3.311 0.168 1.00 0.00 H new ATOM 0 HB3 SER A 45 0.464 -3.395 1.006 1.00 0.00 H new ATOM 0 HG SER A 45 -0.788 -1.407 1.364 1.00 0.00 H new ATOM 639 N HIS A 46 2.196 -4.783 -0.519 1.00 0.00 N ATOM 640 CA HIS A 46 2.777 -6.119 -0.568 1.00 0.00 C ATOM 641 C HIS A 46 2.847 -6.733 0.827 1.00 0.00 C ATOM 642 O HIS A 46 2.454 -7.882 1.031 1.00 0.00 O ATOM 643 CB HIS A 46 4.173 -6.069 -1.188 1.00 0.00 C ATOM 644 CG HIS A 46 4.171 -5.720 -2.644 1.00 0.00 C ATOM 645 ND1 HIS A 46 4.374 -4.438 -3.111 1.00 0.00 N ATOM 646 CD2 HIS A 46 3.990 -6.494 -3.740 1.00 0.00 C ATOM 647 CE1 HIS A 46 4.316 -4.439 -4.430 1.00 0.00 C ATOM 648 NE2 HIS A 46 4.085 -5.674 -4.837 1.00 0.00 N ATOM 0 H HIS A 46 2.663 -4.144 0.124 1.00 0.00 H new ATOM 0 HA HIS A 46 2.135 -6.745 -1.188 1.00 0.00 H new ATOM 0 HB2 HIS A 46 4.775 -5.338 -0.649 1.00 0.00 H new ATOM 0 HB3 HIS A 46 4.655 -7.038 -1.056 1.00 0.00 H new ATOM 0 HD2 HIS A 46 3.805 -7.558 -3.750 1.00 0.00 H new ATOM 0 HE1 HIS A 46 4.437 -3.576 -5.068 1.00 0.00 H new ATOM 0 HE2 HIS A 46 3.992 -5.970 -5.809 1.00 0.00 H new ATOM 656 N SER A 47 3.353 -5.960 1.783 1.00 0.00 N ATOM 657 CA SER A 47 3.479 -6.429 3.158 1.00 0.00 C ATOM 658 C SER A 47 2.139 -6.934 3.685 1.00 0.00 C ATOM 659 O SER A 47 2.011 -8.090 4.088 1.00 0.00 O ATOM 660 CB SER A 47 4.004 -5.309 4.056 1.00 0.00 C ATOM 661 OG SER A 47 3.979 -5.692 5.419 1.00 0.00 O ATOM 0 H SER A 47 3.682 -5.007 1.631 1.00 0.00 H new ATOM 0 HA SER A 47 4.189 -7.256 3.169 1.00 0.00 H new ATOM 0 HB2 SER A 47 5.023 -5.054 3.766 1.00 0.00 H new ATOM 0 HB3 SER A 47 3.399 -4.413 3.916 1.00 0.00 H new ATOM 0 HG SER A 47 4.321 -4.958 5.971 1.00 0.00 H new ATOM 667 N HIS A 48 1.141 -6.055 3.682 1.00 0.00 N ATOM 668 CA HIS A 48 -0.192 -6.409 4.160 1.00 0.00 C ATOM 669 C HIS A 48 -1.209 -6.352 3.023 1.00 0.00 C ATOM 670 O HIS A 48 -1.136 -5.484 2.154 1.00 0.00 O ATOM 671 CB HIS A 48 -0.617 -5.471 5.289 1.00 0.00 C ATOM 672 CG HIS A 48 -1.228 -4.191 4.807 1.00 0.00 C ATOM 673 ND1 HIS A 48 -0.492 -3.051 4.563 1.00 0.00 N ATOM 674 CD2 HIS A 48 -2.513 -3.877 4.520 1.00 0.00 C ATOM 675 CE1 HIS A 48 -1.298 -2.089 4.151 1.00 0.00 C ATOM 676 NE2 HIS A 48 -2.530 -2.565 4.115 1.00 0.00 N ATOM 0 H HIS A 48 1.230 -5.093 3.354 1.00 0.00 H new ATOM 0 HA HIS A 48 -0.156 -7.430 4.541 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -1.333 -5.987 5.929 1.00 0.00 H new ATOM 0 HB3 HIS A 48 0.252 -5.240 5.905 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -3.366 -4.535 4.595 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -1.001 -1.085 3.888 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -3.359 -2.043 3.832 1.00 0.00 H new ATOM 684 N VAL A 49 -2.157 -7.283 3.037 1.00 0.00 N ATOM 685 CA VAL A 49 -3.189 -7.339 2.010 1.00 0.00 C ATOM 686 C VAL A 49 -4.052 -6.082 2.028 1.00 0.00 C ATOM 687 O VAL A 49 -4.637 -5.734 3.052 1.00 0.00 O ATOM 688 CB VAL A 49 -4.095 -8.572 2.190 1.00 0.00 C ATOM 689 CG1 VAL A 49 -4.748 -8.559 3.563 1.00 0.00 C ATOM 690 CG2 VAL A 49 -5.145 -8.626 1.091 1.00 0.00 C ATOM 0 H VAL A 49 -2.231 -8.009 3.749 1.00 0.00 H new ATOM 0 HA VAL A 49 -2.676 -7.411 1.051 1.00 0.00 H new ATOM 0 HB VAL A 49 -3.479 -9.468 2.116 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.384 -9.437 3.672 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -3.977 -8.572 4.333 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -5.352 -7.658 3.670 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -5.776 -9.503 1.234 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -5.759 -7.727 1.130 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -4.653 -8.687 0.120 1.00 0.00 H new ATOM 700 N GLY A 50 -4.125 -5.404 0.886 1.00 0.00 N ATOM 701 CA GLY A 50 -4.918 -4.193 0.793 1.00 0.00 C ATOM 702 C GLY A 50 -4.269 -3.141 -0.084 1.00 0.00 C ATOM 703 O GLY A 50 -3.880 -3.422 -1.218 1.00 0.00 O ATOM 0 H GLY A 50 -3.649 -5.672 0.025 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -5.903 -4.437 0.394 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -5.071 -3.785 1.792 1.00 0.00 H new ATOM 707 N TYR A 51 -4.153 -1.926 0.440 1.00 0.00 N ATOM 708 CA TYR A 51 -3.551 -0.826 -0.305 1.00 0.00 C ATOM 709 C TYR A 51 -2.988 0.230 0.642 1.00 0.00 C ATOM 710 O TYR A 51 -3.235 0.195 1.847 1.00 0.00 O ATOM 711 CB TYR A 51 -4.581 -0.192 -1.242 1.00 0.00 C ATOM 712 CG TYR A 51 -5.163 -1.160 -2.246 1.00 0.00 C ATOM 713 CD1 TYR A 51 -6.087 -2.122 -1.859 1.00 0.00 C ATOM 714 CD2 TYR A 51 -4.788 -1.113 -3.584 1.00 0.00 C ATOM 715 CE1 TYR A 51 -6.621 -3.009 -2.772 1.00 0.00 C ATOM 716 CE2 TYR A 51 -5.319 -1.995 -4.505 1.00 0.00 C ATOM 717 CZ TYR A 51 -6.235 -2.941 -4.095 1.00 0.00 C ATOM 718 OH TYR A 51 -6.763 -3.823 -5.009 1.00 0.00 O ATOM 0 H TYR A 51 -4.468 -1.678 1.378 1.00 0.00 H new ATOM 0 HA TYR A 51 -2.731 -1.229 -0.899 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -5.390 0.231 -0.646 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -4.113 0.635 -1.776 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -6.393 -2.177 -0.825 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -4.070 -0.375 -3.909 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -7.337 -3.752 -2.453 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -5.018 -1.944 -5.541 1.00 0.00 H new ATOM 0 HH TYR A 51 -6.388 -3.639 -5.895 1.00 0.00 H new ATOM 728 N THR A 52 -2.230 1.170 0.085 1.00 0.00 N ATOM 729 CA THR A 52 -1.631 2.236 0.878 1.00 0.00 C ATOM 730 C THR A 52 -1.788 3.587 0.189 1.00 0.00 C ATOM 731 O THR A 52 -1.270 3.800 -0.908 1.00 0.00 O ATOM 732 CB THR A 52 -0.136 1.973 1.135 1.00 0.00 C ATOM 733 OG1 THR A 52 0.021 0.861 2.022 1.00 0.00 O ATOM 734 CG2 THR A 52 0.535 3.203 1.730 1.00 0.00 C ATOM 0 H THR A 52 -2.017 1.214 -0.911 1.00 0.00 H new ATOM 0 HA THR A 52 -2.157 2.255 1.832 1.00 0.00 H new ATOM 0 HB THR A 52 0.339 1.745 0.181 1.00 0.00 H new ATOM 0 HG1 THR A 52 0.101 0.035 1.500 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.591 2.994 1.903 1.00 0.00 H new ATOM 0 HG22 THR A 52 0.440 4.040 1.038 1.00 0.00 H new ATOM 0 HG23 THR A 52 0.056 3.457 2.675 1.00 0.00 H new ATOM 742 N LEU A 53 -2.504 4.498 0.838 1.00 0.00 N ATOM 743 CA LEU A 53 -2.728 5.830 0.289 1.00 0.00 C ATOM 744 C LEU A 53 -1.586 6.771 0.658 1.00 0.00 C ATOM 745 O LEU A 53 -1.146 6.808 1.806 1.00 0.00 O ATOM 746 CB LEU A 53 -4.055 6.397 0.797 1.00 0.00 C ATOM 747 CG LEU A 53 -4.233 7.910 0.664 1.00 0.00 C ATOM 748 CD1 LEU A 53 -4.493 8.292 -0.783 1.00 0.00 C ATOM 749 CD2 LEU A 53 -5.366 8.393 1.558 1.00 0.00 C ATOM 0 H LEU A 53 -2.940 4.338 1.746 1.00 0.00 H new ATOM 0 HA LEU A 53 -2.768 5.745 -0.797 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.866 5.907 0.259 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.163 6.130 1.848 1.00 0.00 H new ATOM 0 HG LEU A 53 -3.311 8.395 0.985 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -4.617 9.372 -0.857 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -3.649 7.980 -1.399 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -5.399 7.798 -1.133 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -5.479 9.472 1.451 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.294 7.900 1.268 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.138 8.153 2.596 1.00 0.00 H new ATOM 761 N SER A 54 -1.111 7.531 -0.324 1.00 0.00 N ATOM 762 CA SER A 54 -0.020 8.472 -0.102 1.00 0.00 C ATOM 763 C SER A 54 -0.272 9.783 -0.841 1.00 0.00 C ATOM 764 O SER A 54 -1.013 9.821 -1.824 1.00 0.00 O ATOM 765 CB SER A 54 1.307 7.863 -0.562 1.00 0.00 C ATOM 766 OG SER A 54 2.397 8.406 0.163 1.00 0.00 O ATOM 0 H SER A 54 -1.465 7.513 -1.281 1.00 0.00 H new ATOM 0 HA SER A 54 0.033 8.682 0.966 1.00 0.00 H new ATOM 0 HB2 SER A 54 1.280 6.782 -0.428 1.00 0.00 H new ATOM 0 HB3 SER A 54 1.446 8.049 -1.627 1.00 0.00 H new ATOM 0 HG SER A 54 2.189 8.398 1.121 1.00 0.00 H new ATOM 772 N TYR A 55 0.347 10.854 -0.360 1.00 0.00 N ATOM 773 CA TYR A 55 0.187 12.168 -0.971 1.00 0.00 C ATOM 774 C TYR A 55 1.167 13.172 -0.370 1.00 0.00 C ATOM 775 O TYR A 55 1.560 13.055 0.791 1.00 0.00 O ATOM 776 CB TYR A 55 -1.247 12.667 -0.790 1.00 0.00 C ATOM 777 CG TYR A 55 -1.591 13.015 0.640 1.00 0.00 C ATOM 778 CD1 TYR A 55 -2.067 12.046 1.516 1.00 0.00 C ATOM 779 CD2 TYR A 55 -1.442 14.311 1.117 1.00 0.00 C ATOM 780 CE1 TYR A 55 -2.384 12.358 2.824 1.00 0.00 C ATOM 781 CE2 TYR A 55 -1.754 14.631 2.424 1.00 0.00 C ATOM 782 CZ TYR A 55 -2.225 13.653 3.273 1.00 0.00 C ATOM 783 OH TYR A 55 -2.539 13.969 4.575 1.00 0.00 O ATOM 0 H TYR A 55 0.965 10.839 0.452 1.00 0.00 H new ATOM 0 HA TYR A 55 0.400 12.073 -2.036 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -1.398 13.547 -1.416 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -1.937 11.901 -1.145 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -2.191 11.031 1.168 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -1.076 15.082 0.455 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -2.754 11.593 3.491 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -1.629 15.643 2.779 1.00 0.00 H new ATOM 0 HH TYR A 55 -3.074 13.247 4.967 1.00 0.00 H new ATOM 793 N LYS A 56 1.558 14.158 -1.170 1.00 0.00 N ATOM 794 CA LYS A 56 2.489 15.185 -0.718 1.00 0.00 C ATOM 795 C LYS A 56 1.849 16.074 0.343 1.00 0.00 C ATOM 796 O LYS A 56 0.723 16.542 0.175 1.00 0.00 O ATOM 797 CB LYS A 56 2.952 16.038 -1.901 1.00 0.00 C ATOM 798 CG LYS A 56 4.269 16.754 -1.657 1.00 0.00 C ATOM 799 CD LYS A 56 5.455 15.834 -1.897 1.00 0.00 C ATOM 800 CE LYS A 56 6.691 16.312 -1.150 1.00 0.00 C ATOM 801 NZ LYS A 56 6.510 16.240 0.326 1.00 0.00 N ATOM 0 H LYS A 56 1.245 14.268 -2.134 1.00 0.00 H new ATOM 0 HA LYS A 56 3.352 14.687 -0.276 1.00 0.00 H new ATOM 0 HB2 LYS A 56 3.052 15.401 -2.780 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.183 16.777 -2.128 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.341 17.621 -2.314 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.298 17.127 -0.633 1.00 0.00 H new ATOM 0 HD2 LYS A 56 5.203 14.823 -1.577 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.670 15.786 -2.965 1.00 0.00 H new ATOM 0 HE2 LYS A 56 7.548 15.705 -1.441 1.00 0.00 H new ATOM 0 HE3 LYS A 56 6.915 17.339 -1.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 7.438 16.138 0.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.051 17.111 0.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 5.915 15.421 0.563 1.00 0.00 H new ATOM 815 N ALA A 57 2.573 16.302 1.433 1.00 0.00 N ATOM 816 CA ALA A 57 2.076 17.138 2.519 1.00 0.00 C ATOM 817 C ALA A 57 3.030 18.293 2.804 1.00 0.00 C ATOM 818 O ALA A 57 4.248 18.128 2.757 1.00 0.00 O ATOM 819 CB ALA A 57 1.865 16.302 3.773 1.00 0.00 C ATOM 0 H ALA A 57 3.506 15.920 1.588 1.00 0.00 H new ATOM 0 HA ALA A 57 1.119 17.560 2.212 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.494 16.938 4.576 1.00 0.00 H new ATOM 0 HB2 ALA A 57 1.139 15.516 3.568 1.00 0.00 H new ATOM 0 HB3 ALA A 57 2.811 15.852 4.074 1.00 0.00 H new ATOM 825 N GLN A 58 2.467 19.460 3.100 1.00 0.00 N ATOM 826 CA GLN A 58 3.270 20.642 3.392 1.00 0.00 C ATOM 827 C GLN A 58 4.539 20.265 4.149 1.00 0.00 C ATOM 828 O GLN A 58 5.609 20.823 3.904 1.00 0.00 O ATOM 829 CB GLN A 58 2.456 21.649 4.205 1.00 0.00 C ATOM 830 CG GLN A 58 1.680 22.638 3.350 1.00 0.00 C ATOM 831 CD GLN A 58 0.406 23.114 4.019 1.00 0.00 C ATOM 832 OE1 GLN A 58 0.359 23.293 5.235 1.00 0.00 O ATOM 833 NE2 GLN A 58 -0.638 23.321 3.224 1.00 0.00 N ATOM 0 H GLN A 58 1.459 19.612 3.144 1.00 0.00 H new ATOM 0 HA GLN A 58 3.557 21.099 2.445 1.00 0.00 H new ATOM 0 HB2 GLN A 58 1.758 21.108 4.843 1.00 0.00 H new ATOM 0 HB3 GLN A 58 3.128 22.200 4.863 1.00 0.00 H new ATOM 0 HG2 GLN A 58 2.313 23.497 3.130 1.00 0.00 H new ATOM 0 HG3 GLN A 58 1.433 22.172 2.396 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.555 23.160 2.220 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.523 23.641 3.617 1.00 0.00 H new ATOM 842 N SER A 59 4.412 19.317 5.072 1.00 0.00 N ATOM 843 CA SER A 59 5.547 18.869 5.869 1.00 0.00 C ATOM 844 C SER A 59 6.425 17.909 5.071 1.00 0.00 C ATOM 845 O SER A 59 7.593 18.195 4.804 1.00 0.00 O ATOM 846 CB SER A 59 5.062 18.188 7.150 1.00 0.00 C ATOM 847 OG SER A 59 4.326 19.090 7.959 1.00 0.00 O ATOM 0 H SER A 59 3.534 18.844 5.286 1.00 0.00 H new ATOM 0 HA SER A 59 6.141 19.744 6.134 1.00 0.00 H new ATOM 0 HB2 SER A 59 4.439 17.330 6.896 1.00 0.00 H new ATOM 0 HB3 SER A 59 5.917 17.807 7.709 1.00 0.00 H new ATOM 0 HG SER A 59 4.025 18.631 8.771 1.00 0.00 H new ATOM 853 N SER A 60 5.856 16.769 4.694 1.00 0.00 N ATOM 854 CA SER A 60 6.586 15.765 3.930 1.00 0.00 C ATOM 855 C SER A 60 5.659 14.633 3.496 1.00 0.00 C ATOM 856 O SER A 60 4.553 14.488 4.015 1.00 0.00 O ATOM 857 CB SER A 60 7.741 15.203 4.761 1.00 0.00 C ATOM 858 OG SER A 60 7.262 14.410 5.832 1.00 0.00 O ATOM 0 H SER A 60 4.890 16.517 4.906 1.00 0.00 H new ATOM 0 HA SER A 60 6.989 16.244 3.038 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.393 14.604 4.125 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.343 16.023 5.153 1.00 0.00 H new ATOM 0 HG SER A 60 8.020 14.062 6.346 1.00 0.00 H new ATOM 864 N CYS A 61 6.121 13.833 2.541 1.00 0.00 N ATOM 865 CA CYS A 61 5.335 12.714 2.034 1.00 0.00 C ATOM 866 C CYS A 61 4.849 11.830 3.178 1.00 0.00 C ATOM 867 O CYS A 61 5.631 11.429 4.041 1.00 0.00 O ATOM 868 CB CYS A 61 6.162 11.887 1.050 1.00 0.00 C ATOM 869 SG CYS A 61 6.690 12.798 -0.420 1.00 0.00 S ATOM 0 H CYS A 61 7.036 13.939 2.102 1.00 0.00 H new ATOM 0 HA CYS A 61 4.465 13.118 1.516 1.00 0.00 H new ATOM 0 HB2 CYS A 61 7.044 11.506 1.564 1.00 0.00 H new ATOM 0 HB3 CYS A 61 5.577 11.022 0.737 1.00 0.00 H new ATOM 0 HG CYS A 61 7.385 12.014 -1.190 1.00 0.00 H new ATOM 875 N CYS A 62 3.555 11.531 3.179 1.00 0.00 N ATOM 876 CA CYS A 62 2.963 10.697 4.219 1.00 0.00 C ATOM 877 C CYS A 62 2.447 9.385 3.635 1.00 0.00 C ATOM 878 O CYS A 62 2.205 9.316 2.430 1.00 0.00 O ATOM 879 CB CYS A 62 1.823 11.442 4.914 1.00 0.00 C ATOM 880 SG CYS A 62 1.392 10.780 6.540 1.00 0.00 S ATOM 0 H CYS A 62 2.895 11.854 2.471 1.00 0.00 H new ATOM 0 HA CYS A 62 3.737 10.469 4.951 1.00 0.00 H new ATOM 0 HB2 CYS A 62 2.101 12.490 5.022 1.00 0.00 H new ATOM 0 HB3 CYS A 62 0.940 11.411 4.275 1.00 0.00 H new ATOM 0 HG CYS A 62 0.130 10.467 6.561 1.00 0.00 H new ATOM 886 N HIS A 63 2.293 8.385 4.490 1.00 0.00 N ATOM 887 CA HIS A 63 1.810 7.088 4.046 1.00 0.00 C ATOM 888 C HIS A 63 0.699 6.607 4.981 1.00 0.00 C ATOM 889 O HIS A 63 0.765 6.750 6.202 1.00 0.00 O ATOM 890 CB HIS A 63 2.962 6.088 3.933 1.00 0.00 C ATOM 891 CG HIS A 63 3.917 6.378 2.799 1.00 0.00 C ATOM 892 ND1 HIS A 63 3.802 5.791 1.551 1.00 0.00 N ATOM 893 CD2 HIS A 63 5.005 7.201 2.737 1.00 0.00 C ATOM 894 CE1 HIS A 63 4.781 6.245 0.783 1.00 0.00 C ATOM 895 NE2 HIS A 63 5.525 7.118 1.519 1.00 0.00 N ATOM 0 H HIS A 63 2.494 8.446 5.488 1.00 0.00 H new ATOM 0 HA HIS A 63 1.384 7.178 3.047 1.00 0.00 H new ATOM 0 HB2 HIS A 63 3.518 6.082 4.870 1.00 0.00 H new ATOM 0 HB3 HIS A 63 2.550 5.088 3.801 1.00 0.00 H new ATOM 0 HD2 HIS A 63 5.379 7.815 3.543 1.00 0.00 H new ATOM 0 HE1 HIS A 63 4.959 5.971 -0.247 1.00 0.00 H new ATOM 0 HE2 HIS A 63 6.346 7.624 1.188 1.00 0.00 H new ATOM 903 N PHE A 64 -0.333 6.030 4.375 1.00 0.00 N ATOM 904 CA PHE A 64 -1.474 5.519 5.127 1.00 0.00 C ATOM 905 C PHE A 64 -1.867 4.128 4.641 1.00 0.00 C ATOM 906 O PHE A 64 -2.073 3.911 3.447 1.00 0.00 O ATOM 907 CB PHE A 64 -2.664 6.472 5.000 1.00 0.00 C ATOM 908 CG PHE A 64 -2.515 7.729 5.810 1.00 0.00 C ATOM 909 CD1 PHE A 64 -2.722 7.714 7.180 1.00 0.00 C ATOM 910 CD2 PHE A 64 -2.170 8.924 5.202 1.00 0.00 C ATOM 911 CE1 PHE A 64 -2.587 8.868 7.928 1.00 0.00 C ATOM 912 CE2 PHE A 64 -2.033 10.082 5.944 1.00 0.00 C ATOM 913 CZ PHE A 64 -2.241 10.054 7.310 1.00 0.00 C ATOM 0 H PHE A 64 -0.403 5.904 3.365 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.184 5.449 6.175 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -2.795 6.739 3.951 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.570 5.953 5.313 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.992 6.790 7.669 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.006 8.952 4.135 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.752 8.843 8.995 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.764 11.008 5.457 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.133 10.957 7.893 1.00 0.00 H new ATOM 923 N MET A 65 -1.971 3.189 5.576 1.00 0.00 N ATOM 924 CA MET A 65 -2.342 1.817 5.243 1.00 0.00 C ATOM 925 C MET A 65 -3.858 1.653 5.223 1.00 0.00 C ATOM 926 O MET A 65 -4.556 2.144 6.110 1.00 0.00 O ATOM 927 CB MET A 65 -1.723 0.842 6.246 1.00 0.00 C ATOM 928 CG MET A 65 -2.392 0.869 7.611 1.00 0.00 C ATOM 929 SD MET A 65 -1.842 -0.474 8.681 1.00 0.00 S ATOM 930 CE MET A 65 -2.764 -1.850 7.999 1.00 0.00 C ATOM 0 H MET A 65 -1.804 3.352 6.569 1.00 0.00 H new ATOM 0 HA MET A 65 -1.959 1.594 4.247 1.00 0.00 H new ATOM 0 HB2 MET A 65 -1.781 -0.169 5.842 1.00 0.00 H new ATOM 0 HB3 MET A 65 -0.665 1.077 6.364 1.00 0.00 H new ATOM 0 HG2 MET A 65 -2.183 1.823 8.095 1.00 0.00 H new ATOM 0 HG3 MET A 65 -3.473 0.807 7.483 1.00 0.00 H new ATOM 0 HE1 MET A 65 -3.371 -2.305 8.782 1.00 0.00 H new ATOM 0 HE2 MET A 65 -3.412 -1.493 7.199 1.00 0.00 H new ATOM 0 HE3 MET A 65 -2.071 -2.591 7.601 1.00 0.00 H new ATOM 940 N VAL A 66 -4.360 0.959 4.207 1.00 0.00 N ATOM 941 CA VAL A 66 -5.793 0.729 4.073 1.00 0.00 C ATOM 942 C VAL A 66 -6.115 -0.761 4.082 1.00 0.00 C ATOM 943 O VAL A 66 -5.821 -1.476 3.124 1.00 0.00 O ATOM 944 CB VAL A 66 -6.343 1.354 2.777 1.00 0.00 C ATOM 945 CG1 VAL A 66 -7.846 1.143 2.678 1.00 0.00 C ATOM 946 CG2 VAL A 66 -5.998 2.834 2.711 1.00 0.00 C ATOM 0 H VAL A 66 -3.795 0.546 3.465 1.00 0.00 H new ATOM 0 HA VAL A 66 -6.271 1.206 4.929 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.874 0.857 1.927 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -8.216 1.591 1.756 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -8.064 0.075 2.675 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.336 1.611 3.532 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.394 3.259 1.789 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.437 3.348 3.566 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.915 2.956 2.731 1.00 0.00 H new ATOM 956 N LYS A 67 -6.719 -1.224 5.170 1.00 0.00 N ATOM 957 CA LYS A 67 -7.083 -2.630 5.304 1.00 0.00 C ATOM 958 C LYS A 67 -8.322 -2.953 4.475 1.00 0.00 C ATOM 959 O LYS A 67 -9.106 -2.064 4.140 1.00 0.00 O ATOM 960 CB LYS A 67 -7.335 -2.974 6.775 1.00 0.00 C ATOM 961 CG LYS A 67 -6.313 -2.374 7.723 1.00 0.00 C ATOM 962 CD LYS A 67 -6.654 -2.675 9.173 1.00 0.00 C ATOM 963 CE LYS A 67 -7.807 -1.814 9.665 1.00 0.00 C ATOM 964 NZ LYS A 67 -8.057 -2.001 11.122 1.00 0.00 N ATOM 0 H LYS A 67 -6.967 -0.646 5.973 1.00 0.00 H new ATOM 0 HA LYS A 67 -6.253 -3.232 4.933 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -8.328 -2.624 7.056 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -7.334 -4.058 6.891 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.324 -2.769 7.491 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -6.268 -1.295 7.575 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -6.916 -3.728 9.275 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -5.777 -2.502 9.797 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -7.588 -0.765 9.466 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -8.710 -2.062 9.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -8.850 -1.397 11.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -8.291 -2.997 11.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.204 -1.740 11.657 1.00 0.00 H new ATOM 978 N LEU A 68 -8.494 -4.229 4.150 1.00 0.00 N ATOM 979 CA LEU A 68 -9.640 -4.670 3.362 1.00 0.00 C ATOM 980 C LEU A 68 -10.675 -5.358 4.245 1.00 0.00 C ATOM 981 O LEU A 68 -10.508 -6.518 4.628 1.00 0.00 O ATOM 982 CB LEU A 68 -9.185 -5.620 2.252 1.00 0.00 C ATOM 983 CG LEU A 68 -10.048 -5.642 0.991 1.00 0.00 C ATOM 984 CD1 LEU A 68 -9.508 -6.653 -0.009 1.00 0.00 C ATOM 985 CD2 LEU A 68 -11.495 -5.957 1.341 1.00 0.00 C ATOM 0 H LEU A 68 -7.855 -4.977 4.420 1.00 0.00 H new ATOM 0 HA LEU A 68 -10.101 -3.791 2.912 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -8.168 -5.352 1.967 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -9.147 -6.630 2.659 1.00 0.00 H new ATOM 0 HG LEU A 68 -10.012 -4.654 0.532 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -10.136 -6.654 -0.900 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -8.488 -6.384 -0.284 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.513 -7.646 0.439 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -12.095 -5.969 0.431 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -11.548 -6.933 1.823 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -11.879 -5.195 2.019 1.00 0.00 H new ATOM 997 N LEU A 69 -11.746 -4.640 4.562 1.00 0.00 N ATOM 998 CA LEU A 69 -12.811 -5.182 5.398 1.00 0.00 C ATOM 999 C LEU A 69 -13.340 -6.493 4.825 1.00 0.00 C ATOM 1000 O LEU A 69 -13.115 -6.806 3.656 1.00 0.00 O ATOM 1001 CB LEU A 69 -13.952 -4.171 5.523 1.00 0.00 C ATOM 1002 CG LEU A 69 -13.648 -2.914 6.341 1.00 0.00 C ATOM 1003 CD1 LEU A 69 -12.796 -3.258 7.552 1.00 0.00 C ATOM 1004 CD2 LEU A 69 -12.954 -1.871 5.476 1.00 0.00 C ATOM 0 H LEU A 69 -11.900 -3.680 4.253 1.00 0.00 H new ATOM 0 HA LEU A 69 -12.398 -5.380 6.387 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -14.251 -3.865 4.521 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -14.809 -4.674 5.971 1.00 0.00 H new ATOM 0 HG LEU A 69 -14.591 -2.496 6.694 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -12.590 -2.352 8.121 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -13.330 -3.969 8.182 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.856 -3.700 7.222 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -12.745 -0.984 6.073 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -12.019 -2.279 5.094 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -13.601 -1.602 4.641 1.00 0.00 H new ATOM 1016 N ASP A 70 -14.045 -7.254 5.654 1.00 0.00 N ATOM 1017 CA ASP A 70 -14.608 -8.529 5.229 1.00 0.00 C ATOM 1018 C ASP A 70 -15.781 -8.316 4.277 1.00 0.00 C ATOM 1019 O ASP A 70 -16.092 -9.179 3.456 1.00 0.00 O ATOM 1020 CB ASP A 70 -15.064 -9.341 6.444 1.00 0.00 C ATOM 1021 CG ASP A 70 -16.427 -8.912 6.948 1.00 0.00 C ATOM 1022 OD1 ASP A 70 -16.625 -7.697 7.162 1.00 0.00 O ATOM 1023 OD2 ASP A 70 -17.296 -9.790 7.129 1.00 0.00 O ATOM 0 H ASP A 70 -14.240 -7.010 6.625 1.00 0.00 H new ATOM 0 HA ASP A 70 -13.831 -9.082 4.702 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -15.094 -10.398 6.180 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -14.333 -9.232 7.245 1.00 0.00 H new ATOM 1028 N ASP A 71 -16.428 -7.161 4.394 1.00 0.00 N ATOM 1029 CA ASP A 71 -17.567 -6.834 3.544 1.00 0.00 C ATOM 1030 C ASP A 71 -17.104 -6.439 2.144 1.00 0.00 C ATOM 1031 O ASP A 71 -17.902 -6.005 1.315 1.00 0.00 O ATOM 1032 CB ASP A 71 -18.383 -5.698 4.163 1.00 0.00 C ATOM 1033 CG ASP A 71 -19.322 -6.187 5.249 1.00 0.00 C ATOM 1034 OD1 ASP A 71 -20.283 -6.913 4.919 1.00 0.00 O ATOM 1035 OD2 ASP A 71 -19.097 -5.842 6.429 1.00 0.00 O ATOM 0 H ASP A 71 -16.183 -6.436 5.069 1.00 0.00 H new ATOM 0 HA ASP A 71 -18.196 -7.721 3.464 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -17.706 -4.953 4.580 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -18.961 -5.202 3.383 1.00 0.00 H new ATOM 1040 N GLY A 72 -15.808 -6.590 1.890 1.00 0.00 N ATOM 1041 CA GLY A 72 -15.260 -6.243 0.591 1.00 0.00 C ATOM 1042 C GLY A 72 -15.022 -4.755 0.441 1.00 0.00 C ATOM 1043 O GLY A 72 -14.856 -4.252 -0.671 1.00 0.00 O ATOM 0 H GLY A 72 -15.127 -6.947 2.561 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.320 -6.775 0.443 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -15.943 -6.579 -0.189 1.00 0.00 H new ATOM 1047 N THR A 73 -15.005 -4.043 1.565 1.00 0.00 N ATOM 1048 CA THR A 73 -14.787 -2.602 1.554 1.00 0.00 C ATOM 1049 C THR A 73 -13.411 -2.250 2.106 1.00 0.00 C ATOM 1050 O THR A 73 -12.639 -3.130 2.487 1.00 0.00 O ATOM 1051 CB THR A 73 -15.862 -1.866 2.376 1.00 0.00 C ATOM 1052 OG1 THR A 73 -15.866 -2.351 3.723 1.00 0.00 O ATOM 1053 CG2 THR A 73 -17.239 -2.055 1.760 1.00 0.00 C ATOM 0 H THR A 73 -15.140 -4.442 2.494 1.00 0.00 H new ATOM 0 HA THR A 73 -14.851 -2.280 0.515 1.00 0.00 H new ATOM 0 HB THR A 73 -15.624 -0.802 2.374 1.00 0.00 H new ATOM 0 HG1 THR A 73 -16.551 -1.877 4.239 1.00 0.00 H new ATOM 0 HG21 THR A 73 -17.981 -1.526 2.358 1.00 0.00 H new ATOM 0 HG22 THR A 73 -17.241 -1.658 0.745 1.00 0.00 H new ATOM 0 HG23 THR A 73 -17.484 -3.117 1.735 1.00 0.00 H new ATOM 1061 N PHE A 74 -13.109 -0.956 2.149 1.00 0.00 N ATOM 1062 CA PHE A 74 -11.824 -0.487 2.655 1.00 0.00 C ATOM 1063 C PHE A 74 -12.015 0.649 3.654 1.00 0.00 C ATOM 1064 O PHE A 74 -12.749 1.603 3.394 1.00 0.00 O ATOM 1065 CB PHE A 74 -10.937 -0.020 1.499 1.00 0.00 C ATOM 1066 CG PHE A 74 -10.740 -1.062 0.435 1.00 0.00 C ATOM 1067 CD1 PHE A 74 -11.764 -1.375 -0.445 1.00 0.00 C ATOM 1068 CD2 PHE A 74 -9.531 -1.730 0.315 1.00 0.00 C ATOM 1069 CE1 PHE A 74 -11.586 -2.334 -1.425 1.00 0.00 C ATOM 1070 CE2 PHE A 74 -9.348 -2.689 -0.663 1.00 0.00 C ATOM 1071 CZ PHE A 74 -10.377 -2.992 -1.534 1.00 0.00 C ATOM 0 H PHE A 74 -13.737 -0.214 1.840 1.00 0.00 H new ATOM 0 HA PHE A 74 -11.337 -1.318 3.165 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -11.379 0.869 1.048 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.964 0.273 1.894 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -12.712 -0.864 -0.364 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -8.723 -1.498 0.993 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -12.392 -2.568 -2.105 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -8.401 -3.201 -0.747 1.00 0.00 H new ATOM 0 HZ PHE A 74 -10.236 -3.742 -2.298 1.00 0.00 H new ATOM 1081 N MET A 75 -11.351 0.540 4.800 1.00 0.00 N ATOM 1082 CA MET A 75 -11.446 1.558 5.840 1.00 0.00 C ATOM 1083 C MET A 75 -10.087 1.808 6.483 1.00 0.00 C ATOM 1084 O MET A 75 -9.425 0.876 6.940 1.00 0.00 O ATOM 1085 CB MET A 75 -12.458 1.134 6.906 1.00 0.00 C ATOM 1086 CG MET A 75 -12.384 1.965 8.177 1.00 0.00 C ATOM 1087 SD MET A 75 -13.972 2.077 9.027 1.00 0.00 S ATOM 1088 CE MET A 75 -13.760 3.601 9.942 1.00 0.00 C ATOM 0 H MET A 75 -10.741 -0.244 5.032 1.00 0.00 H new ATOM 0 HA MET A 75 -11.783 2.485 5.376 1.00 0.00 H new ATOM 0 HB2 MET A 75 -13.463 1.208 6.491 1.00 0.00 H new ATOM 0 HB3 MET A 75 -12.293 0.086 7.156 1.00 0.00 H new ATOM 0 HG2 MET A 75 -11.646 1.528 8.850 1.00 0.00 H new ATOM 0 HG3 MET A 75 -12.036 2.968 7.931 1.00 0.00 H new ATOM 0 HE1 MET A 75 -14.729 3.947 10.301 1.00 0.00 H new ATOM 0 HE2 MET A 75 -13.099 3.427 10.791 1.00 0.00 H new ATOM 0 HE3 MET A 75 -13.322 4.358 9.291 1.00 0.00 H new ATOM 1098 N ILE A 76 -9.676 3.072 6.515 1.00 0.00 N ATOM 1099 CA ILE A 76 -8.395 3.443 7.103 1.00 0.00 C ATOM 1100 C ILE A 76 -8.438 3.340 8.623 1.00 0.00 C ATOM 1101 O ILE A 76 -9.355 3.837 9.278 1.00 0.00 O ATOM 1102 CB ILE A 76 -7.988 4.875 6.707 1.00 0.00 C ATOM 1103 CG1 ILE A 76 -7.761 4.965 5.196 1.00 0.00 C ATOM 1104 CG2 ILE A 76 -6.738 5.298 7.462 1.00 0.00 C ATOM 1105 CD1 ILE A 76 -7.488 6.371 4.709 1.00 0.00 C ATOM 0 H ILE A 76 -10.211 3.855 6.141 1.00 0.00 H new ATOM 0 HA ILE A 76 -7.655 2.743 6.715 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.797 5.554 6.975 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -6.921 4.325 4.924 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.639 4.575 4.681 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -6.463 6.312 7.171 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.933 5.268 8.534 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -5.921 4.618 7.223 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.337 6.359 3.630 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -8.337 7.011 4.950 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -6.593 6.758 5.196 1.00 0.00 H new ATOM 1117 N PRO A 77 -7.422 2.683 9.201 1.00 0.00 N ATOM 1118 CA PRO A 77 -7.318 2.501 10.652 1.00 0.00 C ATOM 1119 C PRO A 77 -7.015 3.807 11.379 1.00 0.00 C ATOM 1120 O PRO A 77 -5.862 4.103 11.687 1.00 0.00 O ATOM 1121 CB PRO A 77 -6.153 1.520 10.805 1.00 0.00 C ATOM 1122 CG PRO A 77 -5.328 1.718 9.581 1.00 0.00 C ATOM 1123 CD PRO A 77 -6.295 2.064 8.482 1.00 0.00 C ATOM 0 HA PRO A 77 -8.252 2.144 11.086 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -5.578 1.726 11.708 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -6.508 0.492 10.881 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -4.600 2.516 9.726 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -4.767 0.815 9.338 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -5.853 2.751 7.760 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -6.609 1.178 7.929 1.00 0.00 H new ATOM 1131 N GLY A 78 -8.059 4.584 11.650 1.00 0.00 N ATOM 1132 CA GLY A 78 -7.882 5.849 12.340 1.00 0.00 C ATOM 1133 C GLY A 78 -9.016 6.819 12.070 1.00 0.00 C ATOM 1134 O GLY A 78 -9.168 7.816 12.776 1.00 0.00 O ATOM 0 H GLY A 78 -9.023 4.361 11.404 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -7.810 5.668 13.412 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -6.940 6.300 12.029 1.00 0.00 H new ATOM 1138 N GLU A 79 -9.811 6.528 11.046 1.00 0.00 N ATOM 1139 CA GLU A 79 -10.934 7.385 10.684 1.00 0.00 C ATOM 1140 C GLU A 79 -12.249 6.804 11.196 1.00 0.00 C ATOM 1141 O GLU A 79 -12.262 5.795 11.900 1.00 0.00 O ATOM 1142 CB GLU A 79 -10.999 7.564 9.166 1.00 0.00 C ATOM 1143 CG GLU A 79 -9.786 8.268 8.583 1.00 0.00 C ATOM 1144 CD GLU A 79 -9.864 9.776 8.720 1.00 0.00 C ATOM 1145 OE1 GLU A 79 -9.414 10.304 9.758 1.00 0.00 O ATOM 1146 OE2 GLU A 79 -10.378 10.430 7.786 1.00 0.00 O ATOM 0 H GLU A 79 -9.699 5.706 10.453 1.00 0.00 H new ATOM 0 HA GLU A 79 -10.781 8.358 11.151 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -11.100 6.585 8.697 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -11.894 8.132 8.914 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -8.887 7.908 9.083 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -9.691 8.007 7.529 1.00 0.00 H new ATOM 1153 N LYS A 80 -13.353 7.448 10.836 1.00 0.00 N ATOM 1154 CA LYS A 80 -14.675 6.996 11.257 1.00 0.00 C ATOM 1155 C LYS A 80 -15.572 6.742 10.051 1.00 0.00 C ATOM 1156 O LYS A 80 -16.797 6.704 10.173 1.00 0.00 O ATOM 1157 CB LYS A 80 -15.321 8.034 12.178 1.00 0.00 C ATOM 1158 CG LYS A 80 -14.490 8.357 13.408 1.00 0.00 C ATOM 1159 CD LYS A 80 -13.478 9.454 13.123 1.00 0.00 C ATOM 1160 CE LYS A 80 -12.233 9.299 13.984 1.00 0.00 C ATOM 1161 NZ LYS A 80 -12.407 9.919 15.327 1.00 0.00 N ATOM 0 H LYS A 80 -13.360 8.285 10.253 1.00 0.00 H new ATOM 0 HA LYS A 80 -14.556 6.060 11.802 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.492 8.951 11.614 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -16.297 7.668 12.495 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.146 8.668 14.221 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -13.971 7.459 13.744 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -13.199 9.429 12.070 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -13.932 10.427 13.309 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -12.001 8.240 14.100 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -11.383 9.758 13.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -11.537 9.792 15.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -12.603 10.934 15.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -13.202 9.464 15.819 1.00 0.00 H new ATOM 1175 N VAL A 81 -14.956 6.568 8.886 1.00 0.00 N ATOM 1176 CA VAL A 81 -15.699 6.314 7.657 1.00 0.00 C ATOM 1177 C VAL A 81 -14.978 5.301 6.777 1.00 0.00 C ATOM 1178 O VAL A 81 -13.764 5.125 6.881 1.00 0.00 O ATOM 1179 CB VAL A 81 -15.916 7.611 6.855 1.00 0.00 C ATOM 1180 CG1 VAL A 81 -17.097 8.393 7.412 1.00 0.00 C ATOM 1181 CG2 VAL A 81 -14.653 8.460 6.862 1.00 0.00 C ATOM 0 H VAL A 81 -13.943 6.598 8.767 1.00 0.00 H new ATOM 0 HA VAL A 81 -16.668 5.910 7.951 1.00 0.00 H new ATOM 0 HB VAL A 81 -16.142 7.345 5.822 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -17.235 9.306 6.833 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -17.999 7.784 7.349 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -16.904 8.650 8.454 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -14.825 9.372 6.291 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -14.394 8.718 7.889 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -13.835 7.898 6.412 1.00 0.00 H new ATOM 1191 N ALA A 82 -15.733 4.634 5.911 1.00 0.00 N ATOM 1192 CA ALA A 82 -15.165 3.638 5.010 1.00 0.00 C ATOM 1193 C ALA A 82 -15.530 3.937 3.561 1.00 0.00 C ATOM 1194 O ALA A 82 -16.142 4.964 3.262 1.00 0.00 O ATOM 1195 CB ALA A 82 -15.637 2.245 5.399 1.00 0.00 C ATOM 0 H ALA A 82 -16.740 4.765 5.814 1.00 0.00 H new ATOM 0 HA ALA A 82 -14.079 3.680 5.099 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -15.205 1.511 4.718 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -15.320 2.025 6.418 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -16.724 2.200 5.340 1.00 0.00 H new ATOM 1201 N HIS A 83 -15.153 3.034 2.661 1.00 0.00 N ATOM 1202 CA HIS A 83 -15.442 3.201 1.241 1.00 0.00 C ATOM 1203 C HIS A 83 -15.371 1.864 0.511 1.00 0.00 C ATOM 1204 O HIS A 83 -14.455 1.071 0.731 1.00 0.00 O ATOM 1205 CB HIS A 83 -14.460 4.191 0.613 1.00 0.00 C ATOM 1206 CG HIS A 83 -14.042 5.290 1.540 1.00 0.00 C ATOM 1207 ND1 HIS A 83 -14.785 6.434 1.736 1.00 0.00 N ATOM 1208 CD2 HIS A 83 -12.949 5.414 2.330 1.00 0.00 C ATOM 1209 CE1 HIS A 83 -14.168 7.216 2.604 1.00 0.00 C ATOM 1210 NE2 HIS A 83 -13.051 6.620 2.981 1.00 0.00 N ATOM 0 H HIS A 83 -14.646 2.179 2.890 1.00 0.00 H new ATOM 0 HA HIS A 83 -16.454 3.594 1.145 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -13.574 3.650 0.281 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -14.917 4.629 -0.274 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -12.146 4.698 2.430 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -14.517 8.179 2.947 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -12.375 6.994 3.647 1.00 0.00 H new ATOM 1218 N THR A 84 -16.346 1.619 -0.360 1.00 0.00 N ATOM 1219 CA THR A 84 -16.395 0.377 -1.121 1.00 0.00 C ATOM 1220 C THR A 84 -15.022 0.017 -1.676 1.00 0.00 C ATOM 1221 O THR A 84 -14.557 -1.113 -1.527 1.00 0.00 O ATOM 1222 CB THR A 84 -17.399 0.471 -2.286 1.00 0.00 C ATOM 1223 OG1 THR A 84 -17.076 1.588 -3.121 1.00 0.00 O ATOM 1224 CG2 THR A 84 -18.820 0.616 -1.764 1.00 0.00 C ATOM 0 H THR A 84 -17.111 2.264 -0.555 1.00 0.00 H new ATOM 0 HA THR A 84 -16.721 -0.403 -0.432 1.00 0.00 H new ATOM 0 HB THR A 84 -17.335 -0.448 -2.868 1.00 0.00 H new ATOM 0 HG1 THR A 84 -17.717 1.640 -3.860 1.00 0.00 H new ATOM 0 HG21 THR A 84 -19.511 0.681 -2.604 1.00 0.00 H new ATOM 0 HG22 THR A 84 -19.073 -0.250 -1.152 1.00 0.00 H new ATOM 0 HG23 THR A 84 -18.896 1.521 -1.161 1.00 0.00 H new ATOM 1232 N SER A 85 -14.377 0.986 -2.318 1.00 0.00 N ATOM 1233 CA SER A 85 -13.056 0.769 -2.899 1.00 0.00 C ATOM 1234 C SER A 85 -12.242 2.061 -2.893 1.00 0.00 C ATOM 1235 O SER A 85 -12.761 3.134 -2.584 1.00 0.00 O ATOM 1236 CB SER A 85 -13.185 0.242 -4.329 1.00 0.00 C ATOM 1237 OG SER A 85 -13.463 -1.149 -4.336 1.00 0.00 O ATOM 0 H SER A 85 -14.747 1.928 -2.449 1.00 0.00 H new ATOM 0 HA SER A 85 -12.536 0.028 -2.292 1.00 0.00 H new ATOM 0 HB2 SER A 85 -13.980 0.778 -4.847 1.00 0.00 H new ATOM 0 HB3 SER A 85 -12.262 0.435 -4.876 1.00 0.00 H new ATOM 0 HG SER A 85 -13.792 -1.421 -3.454 1.00 0.00 H new ATOM 1243 N LEU A 86 -10.964 1.947 -3.237 1.00 0.00 N ATOM 1244 CA LEU A 86 -10.077 3.105 -3.272 1.00 0.00 C ATOM 1245 C LEU A 86 -10.746 4.283 -3.971 1.00 0.00 C ATOM 1246 O LEU A 86 -10.706 5.412 -3.481 1.00 0.00 O ATOM 1247 CB LEU A 86 -8.771 2.749 -3.987 1.00 0.00 C ATOM 1248 CG LEU A 86 -8.011 1.543 -3.434 1.00 0.00 C ATOM 1249 CD1 LEU A 86 -6.914 1.117 -4.398 1.00 0.00 C ATOM 1250 CD2 LEU A 86 -7.428 1.860 -2.066 1.00 0.00 C ATOM 0 H LEU A 86 -10.519 1.066 -3.495 1.00 0.00 H new ATOM 0 HA LEU A 86 -9.856 3.394 -2.244 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -8.994 2.562 -5.037 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -8.112 3.616 -3.951 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.712 0.716 -3.324 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.383 0.257 -3.988 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.357 0.847 -5.357 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -6.215 1.941 -4.541 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -6.891 0.990 -1.689 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -6.741 2.702 -2.149 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -8.233 2.116 -1.378 1.00 0.00 H new ATOM 1262 N ASP A 87 -11.364 4.014 -5.115 1.00 0.00 N ATOM 1263 CA ASP A 87 -12.046 5.052 -5.879 1.00 0.00 C ATOM 1264 C ASP A 87 -12.958 5.878 -4.979 1.00 0.00 C ATOM 1265 O ASP A 87 -12.814 7.098 -4.884 1.00 0.00 O ATOM 1266 CB ASP A 87 -12.859 4.428 -7.015 1.00 0.00 C ATOM 1267 CG ASP A 87 -13.389 3.053 -6.660 1.00 0.00 C ATOM 1268 OD1 ASP A 87 -12.629 2.072 -6.792 1.00 0.00 O ATOM 1269 OD2 ASP A 87 -14.565 2.957 -6.251 1.00 0.00 O ATOM 0 H ASP A 87 -11.407 3.085 -5.534 1.00 0.00 H new ATOM 0 HA ASP A 87 -11.290 5.712 -6.304 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -13.694 5.083 -7.263 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -12.236 4.355 -7.906 1.00 0.00 H new ATOM 1274 N ALA A 88 -13.897 5.208 -4.320 1.00 0.00 N ATOM 1275 CA ALA A 88 -14.831 5.880 -3.427 1.00 0.00 C ATOM 1276 C ALA A 88 -14.132 6.359 -2.159 1.00 0.00 C ATOM 1277 O ALA A 88 -14.727 7.053 -1.334 1.00 0.00 O ATOM 1278 CB ALA A 88 -15.987 4.955 -3.077 1.00 0.00 C ATOM 0 H ALA A 88 -14.031 4.199 -4.388 1.00 0.00 H new ATOM 0 HA ALA A 88 -15.224 6.754 -3.946 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -16.677 5.471 -2.409 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -16.511 4.667 -3.988 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -15.602 4.063 -2.583 1.00 0.00 H new ATOM 1284 N LEU A 89 -12.867 5.983 -2.009 1.00 0.00 N ATOM 1285 CA LEU A 89 -12.085 6.373 -0.841 1.00 0.00 C ATOM 1286 C LEU A 89 -11.169 7.549 -1.166 1.00 0.00 C ATOM 1287 O LEU A 89 -10.723 8.268 -0.272 1.00 0.00 O ATOM 1288 CB LEU A 89 -11.256 5.190 -0.338 1.00 0.00 C ATOM 1289 CG LEU A 89 -9.911 5.536 0.300 1.00 0.00 C ATOM 1290 CD1 LEU A 89 -9.419 4.386 1.165 1.00 0.00 C ATOM 1291 CD2 LEU A 89 -8.884 5.877 -0.771 1.00 0.00 C ATOM 0 H LEU A 89 -12.360 5.408 -2.682 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.778 6.682 -0.058 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -11.850 4.640 0.391 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.075 4.516 -1.176 1.00 0.00 H new ATOM 0 HG LEU A 89 -10.047 6.410 0.936 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.460 4.650 1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -10.144 4.188 1.954 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -9.299 3.494 0.550 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -7.933 6.121 -0.298 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -8.751 5.022 -1.433 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -9.232 6.733 -1.349 1.00 0.00 H new ATOM 1303 N VAL A 90 -10.894 7.739 -2.453 1.00 0.00 N ATOM 1304 CA VAL A 90 -10.034 8.830 -2.897 1.00 0.00 C ATOM 1305 C VAL A 90 -10.806 10.141 -2.976 1.00 0.00 C ATOM 1306 O VAL A 90 -10.310 11.193 -2.571 1.00 0.00 O ATOM 1307 CB VAL A 90 -9.413 8.529 -4.274 1.00 0.00 C ATOM 1308 CG1 VAL A 90 -8.702 9.759 -4.820 1.00 0.00 C ATOM 1309 CG2 VAL A 90 -8.456 7.349 -4.180 1.00 0.00 C ATOM 0 H VAL A 90 -11.254 7.152 -3.206 1.00 0.00 H new ATOM 0 HA VAL A 90 -9.237 8.925 -2.160 1.00 0.00 H new ATOM 0 HB VAL A 90 -10.214 8.265 -4.964 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -8.270 9.527 -5.793 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.416 10.575 -4.925 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -7.910 10.057 -4.133 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -8.026 7.150 -5.162 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -7.658 7.583 -3.475 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -8.997 6.468 -3.836 1.00 0.00 H new ATOM 1319 N THR A 91 -12.026 10.073 -3.502 1.00 0.00 N ATOM 1320 CA THR A 91 -12.868 11.255 -3.635 1.00 0.00 C ATOM 1321 C THR A 91 -13.259 11.809 -2.269 1.00 0.00 C ATOM 1322 O THR A 91 -13.177 13.014 -2.030 1.00 0.00 O ATOM 1323 CB THR A 91 -14.147 10.946 -4.436 1.00 0.00 C ATOM 1324 OG1 THR A 91 -13.805 10.532 -5.764 1.00 0.00 O ATOM 1325 CG2 THR A 91 -15.055 12.166 -4.498 1.00 0.00 C ATOM 0 H THR A 91 -12.452 9.211 -3.843 1.00 0.00 H new ATOM 0 HA THR A 91 -12.282 12.001 -4.172 1.00 0.00 H new ATOM 0 HB THR A 91 -14.680 10.141 -3.930 1.00 0.00 H new ATOM 0 HG1 THR A 91 -14.623 10.336 -6.266 1.00 0.00 H new ATOM 0 HG21 THR A 91 -15.952 11.924 -5.069 1.00 0.00 H new ATOM 0 HG22 THR A 91 -15.337 12.462 -3.487 1.00 0.00 H new ATOM 0 HG23 THR A 91 -14.528 12.988 -4.983 1.00 0.00 H new ATOM 1333 N PHE A 92 -13.684 10.921 -1.376 1.00 0.00 N ATOM 1334 CA PHE A 92 -14.088 11.321 -0.033 1.00 0.00 C ATOM 1335 C PHE A 92 -12.916 11.934 0.728 1.00 0.00 C ATOM 1336 O PHE A 92 -13.102 12.785 1.599 1.00 0.00 O ATOM 1337 CB PHE A 92 -14.639 10.120 0.736 1.00 0.00 C ATOM 1338 CG PHE A 92 -15.352 10.495 2.004 1.00 0.00 C ATOM 1339 CD1 PHE A 92 -14.638 10.882 3.127 1.00 0.00 C ATOM 1340 CD2 PHE A 92 -16.735 10.459 2.074 1.00 0.00 C ATOM 1341 CE1 PHE A 92 -15.291 11.229 4.295 1.00 0.00 C ATOM 1342 CE2 PHE A 92 -17.394 10.805 3.239 1.00 0.00 C ATOM 1343 CZ PHE A 92 -16.670 11.188 4.351 1.00 0.00 C ATOM 0 H PHE A 92 -13.758 9.920 -1.558 1.00 0.00 H new ATOM 0 HA PHE A 92 -14.871 12.074 -0.125 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -15.325 9.570 0.092 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -13.818 9.445 0.977 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -13.559 10.913 3.089 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -17.305 10.157 1.208 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -14.723 11.532 5.162 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -18.473 10.776 3.279 1.00 0.00 H new ATOM 0 HZ PHE A 92 -17.182 11.455 5.264 1.00 0.00 H new ATOM 1353 N HIS A 93 -11.707 11.491 0.395 1.00 0.00 N ATOM 1354 CA HIS A 93 -10.503 11.995 1.046 1.00 0.00 C ATOM 1355 C HIS A 93 -10.209 13.429 0.614 1.00 0.00 C ATOM 1356 O HIS A 93 -9.630 14.207 1.370 1.00 0.00 O ATOM 1357 CB HIS A 93 -9.309 11.097 0.722 1.00 0.00 C ATOM 1358 CG HIS A 93 -9.156 9.941 1.662 1.00 0.00 C ATOM 1359 ND1 HIS A 93 -9.579 9.977 2.974 1.00 0.00 N ATOM 1360 CD2 HIS A 93 -8.622 8.711 1.474 1.00 0.00 C ATOM 1361 CE1 HIS A 93 -9.311 8.819 3.552 1.00 0.00 C ATOM 1362 NE2 HIS A 93 -8.731 8.033 2.662 1.00 0.00 N ATOM 0 H HIS A 93 -11.536 10.785 -0.321 1.00 0.00 H new ATOM 0 HA HIS A 93 -10.673 11.987 2.123 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -9.416 10.717 -0.294 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -8.398 11.696 0.744 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -10.028 10.773 3.427 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -8.190 8.334 0.559 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -9.529 8.559 4.577 1.00 0.00 H new ATOM 1370 N GLN A 94 -10.613 13.767 -0.606 1.00 0.00 N ATOM 1371 CA GLN A 94 -10.391 15.106 -1.139 1.00 0.00 C ATOM 1372 C GLN A 94 -11.169 16.146 -0.338 1.00 0.00 C ATOM 1373 O GLN A 94 -10.900 17.344 -0.434 1.00 0.00 O ATOM 1374 CB GLN A 94 -10.801 15.167 -2.611 1.00 0.00 C ATOM 1375 CG GLN A 94 -9.695 14.758 -3.569 1.00 0.00 C ATOM 1376 CD GLN A 94 -10.220 14.371 -4.937 1.00 0.00 C ATOM 1377 OE1 GLN A 94 -10.782 13.291 -5.117 1.00 0.00 O ATOM 1378 NE2 GLN A 94 -10.039 15.255 -5.913 1.00 0.00 N ATOM 0 H GLN A 94 -11.095 13.133 -1.243 1.00 0.00 H new ATOM 0 HA GLN A 94 -9.328 15.331 -1.057 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -11.663 14.518 -2.766 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -11.119 16.182 -2.849 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -8.989 15.581 -3.675 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -9.144 13.918 -3.145 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -9.568 16.139 -5.720 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -10.371 15.050 -6.855 1.00 0.00 H new ATOM 1387 N GLN A 95 -12.132 15.680 0.449 1.00 0.00 N ATOM 1388 CA GLN A 95 -12.949 16.571 1.265 1.00 0.00 C ATOM 1389 C GLN A 95 -12.718 16.314 2.750 1.00 0.00 C ATOM 1390 O GLN A 95 -12.874 17.212 3.579 1.00 0.00 O ATOM 1391 CB GLN A 95 -14.430 16.389 0.929 1.00 0.00 C ATOM 1392 CG GLN A 95 -14.720 16.387 -0.563 1.00 0.00 C ATOM 1393 CD GLN A 95 -16.203 16.334 -0.870 1.00 0.00 C ATOM 1394 OE1 GLN A 95 -16.948 17.264 -0.556 1.00 0.00 O ATOM 1395 NE2 GLN A 95 -16.643 15.244 -1.486 1.00 0.00 N ATOM 0 H GLN A 95 -12.366 14.691 0.539 1.00 0.00 H new ATOM 0 HA GLN A 95 -12.656 17.597 1.043 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -14.779 15.450 1.360 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -15.002 17.188 1.401 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -14.292 17.282 -1.014 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -14.227 15.531 -1.024 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -15.992 14.497 -1.728 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -17.632 15.153 -1.717 1.00 0.00 H new ATOM 1404 N LYS A 96 -12.344 15.083 3.081 1.00 0.00 N ATOM 1405 CA LYS A 96 -12.090 14.707 4.467 1.00 0.00 C ATOM 1406 C LYS A 96 -10.689 14.122 4.624 1.00 0.00 C ATOM 1407 O LYS A 96 -10.403 13.008 4.187 1.00 0.00 O ATOM 1408 CB LYS A 96 -13.132 13.693 4.942 1.00 0.00 C ATOM 1409 CG LYS A 96 -14.356 14.330 5.576 1.00 0.00 C ATOM 1410 CD LYS A 96 -14.164 14.544 7.067 1.00 0.00 C ATOM 1411 CE LYS A 96 -14.184 13.225 7.826 1.00 0.00 C ATOM 1412 NZ LYS A 96 -14.377 13.429 9.288 1.00 0.00 N ATOM 0 H LYS A 96 -12.210 14.328 2.408 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.161 15.606 5.079 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -13.447 13.085 4.094 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.669 13.019 5.663 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.561 15.286 5.094 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.226 13.695 5.408 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.216 15.053 7.244 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -14.951 15.196 7.447 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -14.985 12.595 7.438 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.248 12.693 7.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -14.385 12.507 9.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -13.599 14.009 9.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -15.282 13.914 9.454 1.00 0.00 H new ATOM 1426 N PRO A 97 -9.794 14.891 5.263 1.00 0.00 N ATOM 1427 CA PRO A 97 -8.409 14.468 5.493 1.00 0.00 C ATOM 1428 C PRO A 97 -8.310 13.337 6.510 1.00 0.00 C ATOM 1429 O PRO A 97 -9.320 12.886 7.052 1.00 0.00 O ATOM 1430 CB PRO A 97 -7.738 15.734 6.034 1.00 0.00 C ATOM 1431 CG PRO A 97 -8.848 16.521 6.643 1.00 0.00 C ATOM 1432 CD PRO A 97 -10.066 16.230 5.810 1.00 0.00 C ATOM 0 HA PRO A 97 -7.946 14.077 4.587 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -6.973 15.492 6.772 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -7.247 16.293 5.237 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -9.007 16.232 7.682 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -8.618 17.587 6.640 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -10.976 16.241 6.411 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -10.197 16.968 5.019 1.00 0.00 H new ATOM 1440 N ILE A 98 -7.088 12.883 6.766 1.00 0.00 N ATOM 1441 CA ILE A 98 -6.858 11.804 7.719 1.00 0.00 C ATOM 1442 C ILE A 98 -6.860 12.326 9.152 1.00 0.00 C ATOM 1443 O ILE A 98 -6.481 13.469 9.406 1.00 0.00 O ATOM 1444 CB ILE A 98 -5.522 11.089 7.448 1.00 0.00 C ATOM 1445 CG1 ILE A 98 -5.191 11.128 5.954 1.00 0.00 C ATOM 1446 CG2 ILE A 98 -5.579 9.652 7.946 1.00 0.00 C ATOM 1447 CD1 ILE A 98 -6.329 10.664 5.072 1.00 0.00 C ATOM 0 H ILE A 98 -6.242 13.245 6.327 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.674 11.093 7.593 1.00 0.00 H new ATOM 0 HB ILE A 98 -4.732 11.610 7.990 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.919 12.146 5.677 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -4.318 10.502 5.767 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -4.627 9.160 7.747 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -5.773 9.646 9.019 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.378 9.119 7.430 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -6.025 10.718 4.027 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.587 9.635 5.322 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -7.197 11.304 5.231 1.00 0.00 H new ATOM 1459 N GLU A 99 -7.289 11.482 10.084 1.00 0.00 N ATOM 1460 CA GLU A 99 -7.340 11.859 11.491 1.00 0.00 C ATOM 1461 C GLU A 99 -6.090 12.637 11.891 1.00 0.00 C ATOM 1462 O GLU A 99 -6.158 13.779 12.348 1.00 0.00 O ATOM 1463 CB GLU A 99 -7.482 10.615 12.371 1.00 0.00 C ATOM 1464 CG GLU A 99 -6.820 10.753 13.732 1.00 0.00 C ATOM 1465 CD GLU A 99 -7.286 9.698 14.716 1.00 0.00 C ATOM 1466 OE1 GLU A 99 -8.490 9.682 15.043 1.00 0.00 O ATOM 1467 OE2 GLU A 99 -6.444 8.889 15.159 1.00 0.00 O ATOM 0 H GLU A 99 -7.606 10.532 9.890 1.00 0.00 H new ATOM 0 HA GLU A 99 -8.209 12.500 11.637 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -8.541 10.399 12.512 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -7.049 9.761 11.851 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -5.739 10.683 13.615 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -7.033 11.742 14.137 1.00 0.00 H new ATOM 1474 N PRO A 100 -4.919 12.008 11.714 1.00 0.00 N ATOM 1475 CA PRO A 100 -3.631 12.621 12.050 1.00 0.00 C ATOM 1476 C PRO A 100 -3.270 13.764 11.106 1.00 0.00 C ATOM 1477 O PRO A 100 -2.938 14.864 11.547 1.00 0.00 O ATOM 1478 CB PRO A 100 -2.637 11.467 11.897 1.00 0.00 C ATOM 1479 CG PRO A 100 -3.282 10.537 10.929 1.00 0.00 C ATOM 1480 CD PRO A 100 -4.763 10.647 11.173 1.00 0.00 C ATOM 0 HA PRO A 100 -3.638 13.065 13.045 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -1.675 11.820 11.526 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -2.450 10.977 12.852 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -3.034 10.808 9.903 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -2.936 9.514 11.081 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -5.333 10.512 10.254 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -5.111 9.892 11.878 1.00 0.00 H new ATOM 1488 N ARG A 101 -3.336 13.495 9.806 1.00 0.00 N ATOM 1489 CA ARG A 101 -3.016 14.501 8.801 1.00 0.00 C ATOM 1490 C ARG A 101 -4.275 15.230 8.340 1.00 0.00 C ATOM 1491 O ARG A 101 -5.160 14.634 7.727 1.00 0.00 O ATOM 1492 CB ARG A 101 -2.323 13.850 7.602 1.00 0.00 C ATOM 1493 CG ARG A 101 -0.994 13.197 7.946 1.00 0.00 C ATOM 1494 CD ARG A 101 0.024 14.223 8.418 1.00 0.00 C ATOM 1495 NE ARG A 101 -0.023 14.416 9.865 1.00 0.00 N ATOM 1496 CZ ARG A 101 0.630 15.383 10.499 1.00 0.00 C ATOM 1497 NH1 ARG A 101 1.378 16.241 9.818 1.00 0.00 N ATOM 1498 NH2 ARG A 101 0.538 15.493 11.818 1.00 0.00 N ATOM 0 H ARG A 101 -3.608 12.589 9.424 1.00 0.00 H new ATOM 0 HA ARG A 101 -2.341 15.228 9.253 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -2.987 13.099 7.173 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -2.159 14.606 6.834 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -1.145 12.448 8.724 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -0.607 12.674 7.071 1.00 0.00 H new ATOM 0 HD2 ARG A 101 1.024 13.901 8.128 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -0.162 15.174 7.919 1.00 0.00 H new ATOM 0 HE ARG A 101 -0.588 13.773 10.419 1.00 0.00 H new ATOM 0 HH11 ARG A 101 1.453 16.159 8.804 1.00 0.00 H new ATOM 0 HH12 ARG A 101 1.878 16.983 10.308 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -0.035 14.834 12.346 1.00 0.00 H new ATOM 0 HH22 ARG A 101 1.040 16.236 12.304 1.00 0.00 H new ATOM 1512 N ARG A 102 -4.347 16.522 8.643 1.00 0.00 N ATOM 1513 CA ARG A 102 -5.498 17.333 8.261 1.00 0.00 C ATOM 1514 C ARG A 102 -5.415 17.738 6.793 1.00 0.00 C ATOM 1515 O ARG A 102 -6.412 18.136 6.193 1.00 0.00 O ATOM 1516 CB ARG A 102 -5.583 18.581 9.142 1.00 0.00 C ATOM 1517 CG ARG A 102 -4.426 19.547 8.943 1.00 0.00 C ATOM 1518 CD ARG A 102 -4.739 20.575 7.867 1.00 0.00 C ATOM 1519 NE ARG A 102 -5.353 21.778 8.421 1.00 0.00 N ATOM 1520 CZ ARG A 102 -5.678 22.840 7.693 1.00 0.00 C ATOM 1521 NH1 ARG A 102 -5.448 22.849 6.388 1.00 0.00 N ATOM 1522 NH2 ARG A 102 -6.235 23.897 8.271 1.00 0.00 N ATOM 0 H ARG A 102 -3.623 17.030 9.151 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.397 16.733 8.404 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -6.519 19.100 8.933 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.615 18.276 10.188 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -4.210 20.056 9.882 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -3.530 18.991 8.668 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -3.821 20.844 7.345 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -5.408 20.134 7.128 1.00 0.00 H new ATOM 0 HE ARG A 102 -5.543 21.804 9.423 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -5.020 22.039 5.940 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -5.699 23.666 5.832 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -6.414 23.894 9.275 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -6.484 24.712 7.711 1.00 0.00 H new ATOM 1536 N GLU A 103 -4.220 17.632 6.222 1.00 0.00 N ATOM 1537 CA GLU A 103 -4.008 17.989 4.824 1.00 0.00 C ATOM 1538 C GLU A 103 -5.004 17.267 3.921 1.00 0.00 C ATOM 1539 O GLU A 103 -5.349 16.110 4.159 1.00 0.00 O ATOM 1540 CB GLU A 103 -2.578 17.649 4.399 1.00 0.00 C ATOM 1541 CG GLU A 103 -1.591 18.782 4.617 1.00 0.00 C ATOM 1542 CD GLU A 103 -1.359 19.078 6.087 1.00 0.00 C ATOM 1543 OE1 GLU A 103 -2.353 19.277 6.817 1.00 0.00 O ATOM 1544 OE2 GLU A 103 -0.183 19.109 6.506 1.00 0.00 O ATOM 0 H GLU A 103 -3.384 17.302 6.705 1.00 0.00 H new ATOM 0 HA GLU A 103 -4.164 19.063 4.722 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -2.242 16.774 4.955 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.577 17.376 3.344 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -0.641 18.527 4.147 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -1.960 19.681 4.123 1.00 0.00 H new ATOM 1551 N LEU A 104 -5.462 17.960 2.884 1.00 0.00 N ATOM 1552 CA LEU A 104 -6.420 17.387 1.945 1.00 0.00 C ATOM 1553 C LEU A 104 -5.757 17.089 0.604 1.00 0.00 C ATOM 1554 O LEU A 104 -4.586 17.407 0.395 1.00 0.00 O ATOM 1555 CB LEU A 104 -7.601 18.339 1.743 1.00 0.00 C ATOM 1556 CG LEU A 104 -8.773 18.170 2.709 1.00 0.00 C ATOM 1557 CD1 LEU A 104 -9.850 19.207 2.428 1.00 0.00 C ATOM 1558 CD2 LEU A 104 -9.345 16.763 2.612 1.00 0.00 C ATOM 0 H LEU A 104 -5.186 18.919 2.672 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.785 16.450 2.365 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -7.235 19.362 1.824 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -7.973 18.213 0.726 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.408 18.322 3.725 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -10.677 19.071 3.125 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -9.433 20.207 2.550 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -10.213 19.087 1.407 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -10.179 16.660 3.307 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -9.695 16.582 1.596 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.571 16.038 2.864 1.00 0.00 H new ATOM 1570 N LEU A 105 -6.513 16.480 -0.303 1.00 0.00 N ATOM 1571 CA LEU A 105 -6.000 16.142 -1.625 1.00 0.00 C ATOM 1572 C LEU A 105 -6.413 17.189 -2.654 1.00 0.00 C ATOM 1573 O LEU A 105 -7.373 17.934 -2.448 1.00 0.00 O ATOM 1574 CB LEU A 105 -6.505 14.763 -2.052 1.00 0.00 C ATOM 1575 CG LEU A 105 -6.308 13.633 -1.042 1.00 0.00 C ATOM 1576 CD1 LEU A 105 -6.728 12.300 -1.642 1.00 0.00 C ATOM 1577 CD2 LEU A 105 -4.859 13.578 -0.579 1.00 0.00 C ATOM 0 H LEU A 105 -7.484 16.210 -0.146 1.00 0.00 H new ATOM 0 HA LEU A 105 -4.911 16.123 -1.571 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -7.569 14.841 -2.276 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -6.003 14.486 -2.979 1.00 0.00 H new ATOM 0 HG LEU A 105 -6.939 13.833 -0.176 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -6.580 11.508 -0.908 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.780 12.343 -1.923 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -6.125 12.093 -2.526 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -4.737 12.768 0.140 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.209 13.403 -1.437 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.591 14.524 -0.108 1.00 0.00 H new ATOM 1589 N THR A 106 -5.685 17.240 -3.765 1.00 0.00 N ATOM 1590 CA THR A 106 -5.976 18.195 -4.827 1.00 0.00 C ATOM 1591 C THR A 106 -6.224 17.483 -6.153 1.00 0.00 C ATOM 1592 O THR A 106 -7.284 17.636 -6.759 1.00 0.00 O ATOM 1593 CB THR A 106 -4.828 19.204 -5.006 1.00 0.00 C ATOM 1594 OG1 THR A 106 -3.820 18.654 -5.862 1.00 0.00 O ATOM 1595 CG2 THR A 106 -4.214 19.570 -3.662 1.00 0.00 C ATOM 0 H THR A 106 -4.889 16.631 -3.953 1.00 0.00 H new ATOM 0 HA THR A 106 -6.877 18.732 -4.531 1.00 0.00 H new ATOM 0 HB THR A 106 -5.236 20.107 -5.460 1.00 0.00 H new ATOM 0 HG1 THR A 106 -3.094 19.303 -5.972 1.00 0.00 H new ATOM 0 HG21 THR A 106 -3.405 20.284 -3.814 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.976 20.016 -3.023 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.821 18.672 -3.185 1.00 0.00 H new ATOM 1603 N GLN A 107 -5.240 16.708 -6.595 1.00 0.00 N ATOM 1604 CA GLN A 107 -5.353 15.974 -7.850 1.00 0.00 C ATOM 1605 C GLN A 107 -4.520 14.696 -7.810 1.00 0.00 C ATOM 1606 O GLN A 107 -3.504 14.610 -7.120 1.00 0.00 O ATOM 1607 CB GLN A 107 -4.906 16.851 -9.020 1.00 0.00 C ATOM 1608 CG GLN A 107 -3.456 17.299 -8.927 1.00 0.00 C ATOM 1609 CD GLN A 107 -3.038 18.172 -10.094 1.00 0.00 C ATOM 1610 OE1 GLN A 107 -2.818 17.682 -11.202 1.00 0.00 O ATOM 1611 NE2 GLN A 107 -2.927 19.472 -9.852 1.00 0.00 N ATOM 0 H GLN A 107 -4.356 16.572 -6.104 1.00 0.00 H new ATOM 0 HA GLN A 107 -6.399 15.700 -7.989 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -5.048 16.301 -9.950 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -5.547 17.731 -9.069 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -3.308 17.848 -7.997 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -2.811 16.422 -8.885 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -3.119 19.835 -8.918 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -2.650 20.108 -10.600 1.00 0.00 H new ATOM 1620 N PRO A 108 -4.958 13.679 -8.567 1.00 0.00 N ATOM 1621 CA PRO A 108 -4.268 12.389 -8.635 1.00 0.00 C ATOM 1622 C PRO A 108 -2.931 12.483 -9.363 1.00 0.00 C ATOM 1623 O PRO A 108 -2.795 13.225 -10.336 1.00 0.00 O ATOM 1624 CB PRO A 108 -5.242 11.505 -9.419 1.00 0.00 C ATOM 1625 CG PRO A 108 -6.042 12.459 -10.238 1.00 0.00 C ATOM 1626 CD PRO A 108 -6.161 13.712 -9.415 1.00 0.00 C ATOM 0 HA PRO A 108 -4.026 12.005 -7.644 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -4.710 10.791 -10.049 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -5.879 10.927 -8.750 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -5.552 12.662 -11.190 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -7.025 12.048 -10.467 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -6.186 14.603 -10.042 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -7.073 13.716 -8.818 1.00 0.00 H new ATOM 1634 N CYS A 109 -1.948 11.727 -8.887 1.00 0.00 N ATOM 1635 CA CYS A 109 -0.622 11.727 -9.494 1.00 0.00 C ATOM 1636 C CYS A 109 -0.614 10.912 -10.783 1.00 0.00 C ATOM 1637 O CYS A 109 -1.504 10.095 -11.018 1.00 0.00 O ATOM 1638 CB CYS A 109 0.409 11.164 -8.514 1.00 0.00 C ATOM 1639 SG CYS A 109 2.118 11.275 -9.095 1.00 0.00 S ATOM 0 H CYS A 109 -2.044 11.107 -8.083 1.00 0.00 H new ATOM 0 HA CYS A 109 -0.359 12.757 -9.736 1.00 0.00 H new ATOM 0 HB2 CYS A 109 0.323 11.697 -7.567 1.00 0.00 H new ATOM 0 HB3 CYS A 109 0.172 10.119 -8.314 1.00 0.00 H new ATOM 0 HG CYS A 109 2.927 10.975 -8.123 1.00 0.00 H new ATOM 1645 N ARG A 110 0.396 11.143 -11.616 1.00 0.00 N ATOM 1646 CA ARG A 110 0.518 10.432 -12.882 1.00 0.00 C ATOM 1647 C ARG A 110 1.788 9.586 -12.912 1.00 0.00 C ATOM 1648 O ARG A 110 2.852 10.033 -12.486 1.00 0.00 O ATOM 1649 CB ARG A 110 0.526 11.423 -14.049 1.00 0.00 C ATOM 1650 CG ARG A 110 -0.276 12.685 -13.781 1.00 0.00 C ATOM 1651 CD ARG A 110 -1.772 12.422 -13.865 1.00 0.00 C ATOM 1652 NE ARG A 110 -2.527 13.640 -14.148 1.00 0.00 N ATOM 1653 CZ ARG A 110 -2.549 14.231 -15.337 1.00 0.00 C ATOM 1654 NH1 ARG A 110 -1.861 13.718 -16.348 1.00 0.00 N ATOM 1655 NH2 ARG A 110 -3.261 15.336 -15.517 1.00 0.00 N ATOM 0 H ARG A 110 1.141 11.817 -11.437 1.00 0.00 H new ATOM 0 HA ARG A 110 -0.342 9.769 -12.981 1.00 0.00 H new ATOM 0 HB2 ARG A 110 1.556 11.698 -14.274 1.00 0.00 H new ATOM 0 HB3 ARG A 110 0.127 10.930 -14.936 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -0.028 13.072 -12.793 1.00 0.00 H new ATOM 0 HG3 ARG A 110 0.001 13.454 -14.503 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -1.967 11.685 -14.644 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -2.118 11.991 -12.925 1.00 0.00 H new ATOM 0 HE ARG A 110 -3.067 14.059 -13.391 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -1.314 12.868 -16.213 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -1.879 14.173 -17.260 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -3.792 15.732 -14.742 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -3.277 15.789 -16.431 1.00 0.00 H new ATOM 1669 N GLN A 111 1.665 8.362 -13.415 1.00 0.00 N ATOM 1670 CA GLN A 111 2.802 7.453 -13.497 1.00 0.00 C ATOM 1671 C GLN A 111 3.931 8.066 -14.319 1.00 0.00 C ATOM 1672 O GLN A 111 3.690 8.859 -15.230 1.00 0.00 O ATOM 1673 CB GLN A 111 2.373 6.120 -14.113 1.00 0.00 C ATOM 1674 CG GLN A 111 2.266 6.156 -15.629 1.00 0.00 C ATOM 1675 CD GLN A 111 1.310 5.113 -16.172 1.00 0.00 C ATOM 1676 OE1 GLN A 111 1.722 4.163 -16.837 1.00 0.00 O ATOM 1677 NE2 GLN A 111 0.023 5.285 -15.890 1.00 0.00 N ATOM 0 H GLN A 111 0.790 7.977 -13.772 1.00 0.00 H new ATOM 0 HA GLN A 111 3.168 7.277 -12.485 1.00 0.00 H new ATOM 0 HB2 GLN A 111 3.089 5.350 -13.826 1.00 0.00 H new ATOM 0 HB3 GLN A 111 1.409 5.830 -13.696 1.00 0.00 H new ATOM 0 HG2 GLN A 111 1.934 7.146 -15.942 1.00 0.00 H new ATOM 0 HG3 GLN A 111 3.254 5.999 -16.063 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -0.275 6.087 -15.335 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -0.667 4.615 -16.228 1.00 0.00 H new ATOM 1686 N LYS A 112 5.164 7.695 -13.991 1.00 0.00 N ATOM 1687 CA LYS A 112 6.331 8.207 -14.699 1.00 0.00 C ATOM 1688 C LYS A 112 6.141 8.103 -16.209 1.00 0.00 C ATOM 1689 O LYS A 112 5.495 7.178 -16.700 1.00 0.00 O ATOM 1690 CB LYS A 112 7.586 7.440 -14.278 1.00 0.00 C ATOM 1691 CG LYS A 112 8.172 7.909 -12.958 1.00 0.00 C ATOM 1692 CD LYS A 112 8.858 9.257 -13.100 1.00 0.00 C ATOM 1693 CE LYS A 112 8.991 9.959 -11.756 1.00 0.00 C ATOM 1694 NZ LYS A 112 9.314 11.404 -11.916 1.00 0.00 N ATOM 0 H LYS A 112 5.381 7.041 -13.239 1.00 0.00 H new ATOM 0 HA LYS A 112 6.451 9.258 -14.437 1.00 0.00 H new ATOM 0 HB2 LYS A 112 7.345 6.380 -14.202 1.00 0.00 H new ATOM 0 HB3 LYS A 112 8.341 7.541 -15.057 1.00 0.00 H new ATOM 0 HG2 LYS A 112 7.380 7.979 -12.212 1.00 0.00 H new ATOM 0 HG3 LYS A 112 8.888 7.172 -12.594 1.00 0.00 H new ATOM 0 HD2 LYS A 112 9.846 9.119 -13.539 1.00 0.00 H new ATOM 0 HD3 LYS A 112 8.289 9.886 -13.785 1.00 0.00 H new ATOM 0 HE2 LYS A 112 8.061 9.854 -11.198 1.00 0.00 H new ATOM 0 HE3 LYS A 112 9.771 9.475 -11.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 9.396 11.847 -10.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 10.214 11.504 -12.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 8.557 11.871 -12.454 1.00 0.00 H new ATOM 1708 N ASP A 113 6.709 9.057 -16.939 1.00 0.00 N ATOM 1709 CA ASP A 113 6.604 9.071 -18.394 1.00 0.00 C ATOM 1710 C ASP A 113 7.389 7.914 -19.006 1.00 0.00 C ATOM 1711 O ASP A 113 8.541 8.077 -19.409 1.00 0.00 O ATOM 1712 CB ASP A 113 7.114 10.400 -18.950 1.00 0.00 C ATOM 1713 CG ASP A 113 6.966 10.492 -20.457 1.00 0.00 C ATOM 1714 OD1 ASP A 113 5.830 10.336 -20.951 1.00 0.00 O ATOM 1715 OD2 ASP A 113 7.987 10.719 -21.141 1.00 0.00 O ATOM 0 H ASP A 113 7.247 9.830 -16.547 1.00 0.00 H new ATOM 0 HA ASP A 113 5.553 8.955 -18.660 1.00 0.00 H new ATOM 0 HB2 ASP A 113 6.567 11.220 -18.483 1.00 0.00 H new ATOM 0 HB3 ASP A 113 8.163 10.524 -18.683 1.00 0.00 H new ATOM 1720 N SER A 114 6.757 6.746 -19.072 1.00 0.00 N ATOM 1721 CA SER A 114 7.398 5.561 -19.630 1.00 0.00 C ATOM 1722 C SER A 114 6.357 4.531 -20.057 1.00 0.00 C ATOM 1723 O SER A 114 5.532 4.097 -19.256 1.00 0.00 O ATOM 1724 CB SER A 114 8.355 4.943 -18.608 1.00 0.00 C ATOM 1725 OG SER A 114 9.308 5.893 -18.163 1.00 0.00 O ATOM 0 H SER A 114 5.802 6.595 -18.746 1.00 0.00 H new ATOM 0 HA SER A 114 7.965 5.865 -20.510 1.00 0.00 H new ATOM 0 HB2 SER A 114 7.789 4.565 -17.757 1.00 0.00 H new ATOM 0 HB3 SER A 114 8.867 4.090 -19.054 1.00 0.00 H new ATOM 0 HG SER A 114 9.376 6.619 -18.818 1.00 0.00 H new ATOM 1731 N GLY A 115 6.403 4.144 -21.328 1.00 0.00 N ATOM 1732 CA GLY A 115 5.460 3.168 -21.842 1.00 0.00 C ATOM 1733 C GLY A 115 5.780 1.757 -21.388 1.00 0.00 C ATOM 1734 O GLY A 115 6.942 1.383 -21.225 1.00 0.00 O ATOM 0 H GLY A 115 7.077 4.489 -22.011 1.00 0.00 H new ATOM 0 HA2 GLY A 115 4.454 3.432 -21.515 1.00 0.00 H new ATOM 0 HA3 GLY A 115 5.461 3.205 -22.931 1.00 0.00 H new ATOM 1738 N PRO A 116 4.732 0.949 -21.174 1.00 0.00 N ATOM 1739 CA PRO A 116 4.882 -0.441 -20.732 1.00 0.00 C ATOM 1740 C PRO A 116 5.475 -1.333 -21.817 1.00 0.00 C ATOM 1741 O PRO A 116 5.798 -0.868 -22.910 1.00 0.00 O ATOM 1742 CB PRO A 116 3.448 -0.869 -20.413 1.00 0.00 C ATOM 1743 CG PRO A 116 2.593 0.014 -21.254 1.00 0.00 C ATOM 1744 CD PRO A 116 3.320 1.327 -21.348 1.00 0.00 C ATOM 0 HA PRO A 116 5.565 -0.528 -19.887 1.00 0.00 H new ATOM 0 HB2 PRO A 116 3.286 -1.920 -20.651 1.00 0.00 H new ATOM 0 HB3 PRO A 116 3.224 -0.744 -19.354 1.00 0.00 H new ATOM 0 HG2 PRO A 116 2.439 -0.418 -22.243 1.00 0.00 H new ATOM 0 HG3 PRO A 116 1.608 0.145 -20.806 1.00 0.00 H new ATOM 0 HD2 PRO A 116 3.150 1.813 -22.309 1.00 0.00 H new ATOM 0 HD3 PRO A 116 2.993 2.024 -20.576 1.00 0.00 H new ATOM 1752 N SER A 117 5.616 -2.619 -21.508 1.00 0.00 N ATOM 1753 CA SER A 117 6.173 -3.577 -22.456 1.00 0.00 C ATOM 1754 C SER A 117 5.763 -5.001 -22.095 1.00 0.00 C ATOM 1755 O SER A 117 6.204 -5.549 -21.086 1.00 0.00 O ATOM 1756 CB SER A 117 7.699 -3.466 -22.488 1.00 0.00 C ATOM 1757 OG SER A 117 8.121 -2.519 -23.454 1.00 0.00 O ATOM 0 H SER A 117 5.352 -3.021 -20.608 1.00 0.00 H new ATOM 0 HA SER A 117 5.778 -3.344 -23.445 1.00 0.00 H new ATOM 0 HB2 SER A 117 8.066 -3.175 -21.504 1.00 0.00 H new ATOM 0 HB3 SER A 117 8.133 -4.440 -22.715 1.00 0.00 H new ATOM 0 HG SER A 117 7.474 -1.784 -23.496 1.00 0.00 H new ATOM 1763 N SER A 118 4.914 -5.595 -22.928 1.00 0.00 N ATOM 1764 CA SER A 118 4.439 -6.954 -22.696 1.00 0.00 C ATOM 1765 C SER A 118 5.562 -7.836 -22.160 1.00 0.00 C ATOM 1766 O SER A 118 5.431 -8.455 -21.105 1.00 0.00 O ATOM 1767 CB SER A 118 3.880 -7.549 -23.989 1.00 0.00 C ATOM 1768 OG SER A 118 4.876 -7.609 -24.996 1.00 0.00 O ATOM 0 H SER A 118 4.541 -5.156 -23.770 1.00 0.00 H new ATOM 0 HA SER A 118 3.645 -6.914 -21.951 1.00 0.00 H new ATOM 0 HB2 SER A 118 3.494 -8.550 -23.795 1.00 0.00 H new ATOM 0 HB3 SER A 118 3.042 -6.946 -24.338 1.00 0.00 H new ATOM 0 HG SER A 118 4.494 -7.995 -25.812 1.00 0.00 H new ATOM 1774 N GLY A 119 6.667 -7.891 -22.898 1.00 0.00 N ATOM 1775 CA GLY A 119 7.798 -8.700 -22.482 1.00 0.00 C ATOM 1776 C GLY A 119 8.637 -9.169 -23.654 1.00 0.00 C ATOM 1777 O GLY A 119 9.134 -10.296 -23.659 1.00 0.00 O ATOM 0 H GLY A 119 6.799 -7.390 -23.776 1.00 0.00 H new ATOM 0 HA2 GLY A 119 8.422 -8.123 -21.800 1.00 0.00 H new ATOM 0 HA3 GLY A 119 7.437 -9.566 -21.928 1.00 0.00 H new TER 1781 GLY A 119