USER MOD reduce.3.24.130724 H: found=0, std=0, add=853, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 849 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 133 GLN : amide:sc= -2.22! C(o=-1.9!,f=-1.6!) USER MOD Set 1.2: A 134 SER OG : rot -72:sc= 0.343 USER MOD Set 2.1: A 46 HIS : no HD1:sc= -6.05! C(o=-16!,f=-20!) USER MOD Set 2.2: A 120 HIS :FLIP no HD1:sc= -9.86! C(o=-21!,f=-16!) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN :FLIP amide:sc= -0.588 F(o=-1.6,f=-0.59) USER MOD Single : A 19 ASN :FLIP amide:sc= -1.75 F(o=-2.7!,f=-1.7) USER MOD Single : A 22 GLN : amide:sc= -1.66 K(o=-1.7,f=-5.6!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 17:sc= 0.659 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -12.1! C(o=-12!,f=-16!) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 86 ASN : amide:sc= -7.03! C(o=-7!,f=-10!) USER MOD Single : A 88 THR OG1 : rot -15:sc= -0.582! USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 49:sc= 0.278 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= -0.452 K(o=-0.45,f=-0.98) USER MOD Single : A 111 SER OG : rot 29:sc= 0.914 USER MOD Single : A 116 THR OG1 : rot -168:sc= -7! USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 THR OG1 : rot 110:sc= 0.721 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0.00657 USER MOD Single : A 139 ASN : amide:sc= -0.1 X(o=-0.1,f=0) USER MOD Single : A 142 SER OG : rot 65:sc= 1.01 USER MOD Single : A 146 CYS SG : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc=-0.00977 X(o=-0.0098,f=0) USER MOD ----------------------------------------------------------------- ATOM 11 N THR A 2 -6.671 -6.020 -12.028 1.00 10.00 N ATOM 12 CA THR A 2 -5.473 -5.209 -11.893 1.00 10.00 C ATOM 13 C THR A 2 -4.941 -5.277 -10.460 1.00 10.00 C ATOM 14 O THR A 2 -5.153 -4.357 -9.671 1.00 10.00 O ATOM 15 CB THR A 2 -5.810 -3.788 -12.349 1.00 10.00 C ATOM 16 OG1 THR A 2 -5.401 -3.754 -13.714 1.00 10.00 O ATOM 17 CG2 THR A 2 -4.934 -2.732 -11.672 1.00 10.00 C ATOM 0 HA THR A 2 -4.668 -5.586 -12.523 1.00 10.00 H new ATOM 0 HB THR A 2 -6.859 -3.579 -12.138 1.00 10.00 H new ATOM 0 HG1 THR A 2 -5.585 -2.867 -14.089 1.00 10.00 H new ATOM 0 HG21 THR A 2 -5.215 -1.742 -12.031 1.00 10.00 H new ATOM 0 HG22 THR A 2 -5.075 -2.780 -10.592 1.00 10.00 H new ATOM 0 HG23 THR A 2 -3.887 -2.921 -11.910 1.00 10.00 H new ATOM 25 N LYS A 3 -4.261 -6.375 -10.167 1.00 10.00 N ATOM 26 CA LYS A 3 -3.697 -6.576 -8.843 1.00 10.00 C ATOM 27 C LYS A 3 -2.258 -6.056 -8.822 1.00 10.00 C ATOM 28 O LYS A 3 -1.342 -6.737 -9.280 1.00 10.00 O ATOM 29 CB LYS A 3 -3.828 -8.040 -8.421 1.00 10.00 C ATOM 30 CG LYS A 3 -3.269 -8.257 -7.013 1.00 10.00 C ATOM 31 CD LYS A 3 -2.177 -9.329 -7.015 1.00 10.00 C ATOM 32 CE LYS A 3 -2.760 -10.706 -6.692 1.00 10.00 C ATOM 33 NZ LYS A 3 -1.768 -11.768 -6.973 1.00 10.00 N ATOM 0 H LYS A 3 -4.088 -7.136 -10.824 1.00 10.00 H new ATOM 0 HA LYS A 3 -4.254 -6.004 -8.101 1.00 10.00 H new ATOM 0 HB2 LYS A 3 -4.876 -8.338 -8.450 1.00 10.00 H new ATOM 0 HB3 LYS A 3 -3.296 -8.675 -9.129 1.00 10.00 H new ATOM 0 HG2 LYS A 3 -2.863 -7.320 -6.631 1.00 10.00 H new ATOM 0 HG3 LYS A 3 -4.074 -8.554 -6.340 1.00 10.00 H new ATOM 0 HD2 LYS A 3 -1.690 -9.356 -7.990 1.00 10.00 H new ATOM 0 HD3 LYS A 3 -1.411 -9.074 -6.283 1.00 10.00 H new ATOM 0 HE2 LYS A 3 -3.056 -10.745 -5.644 1.00 10.00 H new ATOM 0 HE3 LYS A 3 -3.660 -10.875 -7.284 1.00 10.00 H new ATOM 0 HZ1 LYS A 3 -2.180 -12.696 -6.748 1.00 10.00 H new ATOM 0 HZ2 LYS A 3 -1.505 -11.740 -7.979 1.00 10.00 H new ATOM 0 HZ3 LYS A 3 -0.921 -11.615 -6.390 1.00 10.00 H new ATOM 47 N ALA A 4 -2.105 -4.854 -8.286 1.00 10.00 N ATOM 48 CA ALA A 4 -0.793 -4.235 -8.200 1.00 10.00 C ATOM 49 C ALA A 4 -0.089 -4.717 -6.929 1.00 10.00 C ATOM 50 O ALA A 4 -0.741 -5.021 -5.932 1.00 10.00 O ATOM 51 CB ALA A 4 -0.942 -2.713 -8.242 1.00 10.00 C ATOM 0 H ALA A 4 -2.867 -4.292 -7.907 1.00 10.00 H new ATOM 0 HA ALA A 4 -0.175 -4.525 -9.050 1.00 10.00 H new ATOM 0 HB1 ALA A 4 0.042 -2.249 -8.177 1.00 10.00 H new ATOM 0 HB2 ALA A 4 -1.421 -2.420 -9.176 1.00 10.00 H new ATOM 0 HB3 ALA A 4 -1.554 -2.384 -7.402 1.00 10.00 H new ATOM 57 N VAL A 5 1.232 -4.770 -7.007 1.00 10.00 N ATOM 58 CA VAL A 5 2.031 -5.209 -5.876 1.00 10.00 C ATOM 59 C VAL A 5 2.964 -4.076 -5.445 1.00 10.00 C ATOM 60 O VAL A 5 3.360 -3.248 -6.264 1.00 10.00 O ATOM 61 CB VAL A 5 2.779 -6.496 -6.231 1.00 10.00 C ATOM 62 CG1 VAL A 5 3.346 -7.165 -4.978 1.00 10.00 C ATOM 63 CG2 VAL A 5 1.875 -7.459 -7.005 1.00 10.00 C ATOM 0 H VAL A 5 1.769 -4.516 -7.836 1.00 10.00 H new ATOM 0 HA VAL A 5 1.391 -5.445 -5.026 1.00 10.00 H new ATOM 0 HB VAL A 5 3.616 -6.230 -6.876 1.00 10.00 H new ATOM 0 HG11 VAL A 5 3.872 -8.077 -5.259 1.00 10.00 H new ATOM 0 HG12 VAL A 5 4.039 -6.484 -4.484 1.00 10.00 H new ATOM 0 HG13 VAL A 5 2.531 -7.411 -4.297 1.00 10.00 H new ATOM 0 HG21 VAL A 5 2.430 -8.366 -7.245 1.00 10.00 H new ATOM 0 HG22 VAL A 5 1.009 -7.715 -6.395 1.00 10.00 H new ATOM 0 HG23 VAL A 5 1.541 -6.983 -7.927 1.00 10.00 H new ATOM 73 N ALA A 6 3.289 -4.075 -4.161 1.00 10.00 N ATOM 74 CA ALA A 6 4.168 -3.057 -3.611 1.00 10.00 C ATOM 75 C ALA A 6 4.846 -3.600 -2.352 1.00 10.00 C ATOM 76 O ALA A 6 4.353 -3.400 -1.242 1.00 10.00 O ATOM 77 CB ALA A 6 3.366 -1.783 -3.339 1.00 10.00 C ATOM 0 H ALA A 6 2.959 -4.764 -3.485 1.00 10.00 H new ATOM 0 HA ALA A 6 4.953 -2.802 -4.323 1.00 10.00 H new ATOM 0 HB1 ALA A 6 4.025 -1.019 -2.926 1.00 10.00 H new ATOM 0 HB2 ALA A 6 2.930 -1.422 -4.270 1.00 10.00 H new ATOM 0 HB3 ALA A 6 2.570 -1.999 -2.626 1.00 10.00 H new ATOM 83 N VAL A 7 5.964 -4.277 -2.565 1.00 10.00 N ATOM 84 CA VAL A 7 6.714 -4.851 -1.461 1.00 10.00 C ATOM 85 C VAL A 7 7.635 -3.783 -0.866 1.00 10.00 C ATOM 86 O VAL A 7 8.636 -3.411 -1.477 1.00 10.00 O ATOM 87 CB VAL A 7 7.469 -6.096 -1.931 1.00 10.00 C ATOM 88 CG1 VAL A 7 8.403 -5.763 -3.096 1.00 10.00 C ATOM 89 CG2 VAL A 7 8.240 -6.739 -0.776 1.00 10.00 C ATOM 0 H VAL A 7 6.369 -4.441 -3.487 1.00 10.00 H new ATOM 0 HA VAL A 7 6.039 -5.177 -0.670 1.00 10.00 H new ATOM 0 HB VAL A 7 6.735 -6.819 -2.286 1.00 10.00 H new ATOM 0 HG11 VAL A 7 8.928 -6.665 -3.411 1.00 10.00 H new ATOM 0 HG12 VAL A 7 7.820 -5.373 -3.930 1.00 10.00 H new ATOM 0 HG13 VAL A 7 9.128 -5.014 -2.778 1.00 10.00 H new ATOM 0 HG21 VAL A 7 8.768 -7.622 -1.137 1.00 10.00 H new ATOM 0 HG22 VAL A 7 8.960 -6.024 -0.376 1.00 10.00 H new ATOM 0 HG23 VAL A 7 7.543 -7.030 0.010 1.00 10.00 H new ATOM 99 N LEU A 8 7.263 -3.319 0.318 1.00 10.00 N ATOM 100 CA LEU A 8 8.043 -2.302 1.002 1.00 10.00 C ATOM 101 C LEU A 8 9.481 -2.795 1.172 1.00 10.00 C ATOM 102 O LEU A 8 9.707 -3.916 1.626 1.00 10.00 O ATOM 103 CB LEU A 8 7.369 -1.905 2.317 1.00 10.00 C ATOM 104 CG LEU A 8 6.105 -1.052 2.193 1.00 10.00 C ATOM 105 CD1 LEU A 8 6.456 0.428 2.032 1.00 10.00 C ATOM 106 CD2 LEU A 8 5.213 -1.557 1.057 1.00 10.00 C ATOM 0 H LEU A 8 6.432 -3.629 0.821 1.00 10.00 H new ATOM 0 HA LEU A 8 8.088 -1.391 0.405 1.00 10.00 H new ATOM 0 HB2 LEU A 8 7.117 -2.815 2.862 1.00 10.00 H new ATOM 0 HB3 LEU A 8 8.093 -1.360 2.923 1.00 10.00 H new ATOM 0 HG LEU A 8 5.535 -1.148 3.117 1.00 10.00 H new ATOM 0 HD11 LEU A 8 5.540 1.012 1.946 1.00 10.00 H new ATOM 0 HD12 LEU A 8 7.021 0.765 2.901 1.00 10.00 H new ATOM 0 HD13 LEU A 8 7.058 0.563 1.134 1.00 10.00 H new ATOM 0 HD21 LEU A 8 4.321 -0.934 0.990 1.00 10.00 H new ATOM 0 HD22 LEU A 8 5.761 -1.509 0.116 1.00 10.00 H new ATOM 0 HD23 LEU A 8 4.921 -2.588 1.255 1.00 10.00 H new ATOM 118 N LYS A 9 10.416 -1.935 0.798 1.00 10.00 N ATOM 119 CA LYS A 9 11.826 -2.270 0.903 1.00 10.00 C ATOM 120 C LYS A 9 12.652 -0.982 0.913 1.00 10.00 C ATOM 121 O LYS A 9 12.444 -0.100 0.081 1.00 10.00 O ATOM 122 CB LYS A 9 12.228 -3.249 -0.202 1.00 10.00 C ATOM 123 CG LYS A 9 13.702 -3.642 -0.077 1.00 10.00 C ATOM 124 CD LYS A 9 14.009 -4.890 -0.907 1.00 10.00 C ATOM 125 CE LYS A 9 15.496 -5.243 -0.836 1.00 10.00 C ATOM 126 NZ LYS A 9 16.084 -5.289 -2.193 1.00 10.00 N ATOM 0 H LYS A 9 10.225 -1.006 0.422 1.00 10.00 H new ATOM 0 HA LYS A 9 12.026 -2.786 1.842 1.00 10.00 H new ATOM 0 HB2 LYS A 9 11.604 -4.141 -0.147 1.00 10.00 H new ATOM 0 HB3 LYS A 9 12.050 -2.795 -1.177 1.00 10.00 H new ATOM 0 HG2 LYS A 9 14.332 -2.816 -0.409 1.00 10.00 H new ATOM 0 HG3 LYS A 9 13.945 -3.828 0.969 1.00 10.00 H new ATOM 0 HD2 LYS A 9 13.415 -5.728 -0.543 1.00 10.00 H new ATOM 0 HD3 LYS A 9 13.721 -4.721 -1.945 1.00 10.00 H new ATOM 0 HE2 LYS A 9 16.022 -4.505 -0.230 1.00 10.00 H new ATOM 0 HE3 LYS A 9 15.624 -6.208 -0.345 1.00 10.00 H new ATOM 0 HZ1 LYS A 9 17.093 -5.530 -2.126 1.00 10.00 H new ATOM 0 HZ2 LYS A 9 15.593 -6.010 -2.760 1.00 10.00 H new ATOM 0 HZ3 LYS A 9 15.979 -4.360 -2.648 1.00 10.00 H new ATOM 140 N GLY A 10 13.572 -0.914 1.864 1.00 10.00 N ATOM 141 CA GLY A 10 14.430 0.251 1.994 1.00 10.00 C ATOM 142 C GLY A 10 15.337 0.130 3.220 1.00 10.00 C ATOM 143 O GLY A 10 16.405 -0.476 3.150 1.00 10.00 O ATOM 0 H GLY A 10 13.742 -1.647 2.552 1.00 10.00 H new ATOM 0 HA2 GLY A 10 15.039 0.361 1.096 1.00 10.00 H new ATOM 0 HA3 GLY A 10 13.819 1.150 2.077 1.00 10.00 H new ATOM 147 N ASP A 11 14.878 0.717 4.316 1.00 10.00 N ATOM 148 CA ASP A 11 15.634 0.683 5.556 1.00 10.00 C ATOM 149 C ASP A 11 16.292 -0.689 5.710 1.00 10.00 C ATOM 150 O ASP A 11 17.517 -0.796 5.730 1.00 10.00 O ATOM 151 CB ASP A 11 14.722 0.908 6.764 1.00 10.00 C ATOM 152 CG ASP A 11 15.435 0.936 8.117 1.00 10.00 C ATOM 153 OD1 ASP A 11 16.667 1.152 8.105 1.00 10.00 O ATOM 154 OD2 ASP A 11 14.734 0.742 9.133 1.00 10.00 O ATOM 0 H ASP A 11 13.992 1.219 4.371 1.00 10.00 H new ATOM 0 HA ASP A 11 16.382 1.475 5.516 1.00 10.00 H new ATOM 0 HB2 ASP A 11 14.193 1.851 6.630 1.00 10.00 H new ATOM 0 HB3 ASP A 11 13.969 0.120 6.783 1.00 10.00 H new ATOM 159 N GLY A 12 15.449 -1.706 5.814 1.00 10.00 N ATOM 160 CA GLY A 12 15.933 -3.068 5.965 1.00 10.00 C ATOM 161 C GLY A 12 14.867 -3.961 6.602 1.00 10.00 C ATOM 162 O GLY A 12 14.494 -4.988 6.036 1.00 10.00 O ATOM 0 H GLY A 12 14.433 -1.614 5.797 1.00 10.00 H new ATOM 0 HA2 GLY A 12 16.213 -3.468 4.991 1.00 10.00 H new ATOM 0 HA3 GLY A 12 16.832 -3.072 6.582 1.00 10.00 H new ATOM 166 N PRO A 13 14.393 -3.527 7.800 1.00 10.00 N ATOM 167 CA PRO A 13 13.377 -4.276 8.520 1.00 10.00 C ATOM 168 C PRO A 13 12.002 -4.097 7.872 1.00 10.00 C ATOM 169 O PRO A 13 11.219 -5.042 7.798 1.00 10.00 O ATOM 170 CB PRO A 13 13.436 -3.751 9.944 1.00 10.00 C ATOM 171 CG PRO A 13 14.151 -2.412 9.866 1.00 10.00 C ATOM 172 CD PRO A 13 14.811 -2.315 8.500 1.00 10.00 C ATOM 0 HA PRO A 13 13.553 -5.351 8.499 1.00 10.00 H new ATOM 0 HB2 PRO A 13 12.435 -3.635 10.359 1.00 10.00 H new ATOM 0 HB3 PRO A 13 13.973 -4.443 10.593 1.00 10.00 H new ATOM 0 HG2 PRO A 13 13.445 -1.594 10.008 1.00 10.00 H new ATOM 0 HG3 PRO A 13 14.897 -2.331 10.657 1.00 10.00 H new ATOM 0 HD2 PRO A 13 14.490 -1.420 7.968 1.00 10.00 H new ATOM 0 HD3 PRO A 13 15.896 -2.262 8.587 1.00 10.00 H new ATOM 180 N VAL A 14 11.751 -2.877 7.420 1.00 10.00 N ATOM 181 CA VAL A 14 10.485 -2.561 6.781 1.00 10.00 C ATOM 182 C VAL A 14 10.366 -3.351 5.476 1.00 10.00 C ATOM 183 O VAL A 14 10.855 -2.914 4.435 1.00 10.00 O ATOM 184 CB VAL A 14 10.363 -1.050 6.579 1.00 10.00 C ATOM 185 CG1 VAL A 14 9.399 -0.725 5.436 1.00 10.00 C ATOM 186 CG2 VAL A 14 9.934 -0.356 7.873 1.00 10.00 C ATOM 0 H VAL A 14 12.403 -2.095 7.484 1.00 10.00 H new ATOM 0 HA VAL A 14 9.651 -2.858 7.418 1.00 10.00 H new ATOM 0 HB VAL A 14 11.347 -0.669 6.305 1.00 10.00 H new ATOM 0 HG11 VAL A 14 9.331 0.356 5.314 1.00 10.00 H new ATOM 0 HG12 VAL A 14 9.766 -1.172 4.512 1.00 10.00 H new ATOM 0 HG13 VAL A 14 8.412 -1.127 5.667 1.00 10.00 H new ATOM 0 HG21 VAL A 14 9.855 0.717 7.701 1.00 10.00 H new ATOM 0 HG22 VAL A 14 8.967 -0.745 8.191 1.00 10.00 H new ATOM 0 HG23 VAL A 14 10.674 -0.545 8.650 1.00 10.00 H new ATOM 196 N GLN A 15 9.714 -4.500 5.574 1.00 10.00 N ATOM 197 CA GLN A 15 9.525 -5.354 4.414 1.00 10.00 C ATOM 198 C GLN A 15 8.033 -5.547 4.134 1.00 10.00 C ATOM 199 O GLN A 15 7.606 -6.634 3.748 1.00 10.00 O ATOM 200 CB GLN A 15 10.226 -6.701 4.605 1.00 10.00 C ATOM 201 CG GLN A 15 11.662 -6.507 5.094 1.00 10.00 C ATOM 202 CD GLN A 15 12.004 -7.508 6.200 1.00 10.00 C ATOM 203 OE1 GLN A 15 11.109 -7.555 7.183 1.00 10.00 O flip ATOM 204 NE2 GLN A 15 13.013 -8.192 6.163 1.00 10.00 N flip ATOM 0 H GLN A 15 9.310 -4.860 6.439 1.00 10.00 H new ATOM 0 HA GLN A 15 9.976 -4.866 3.550 1.00 10.00 H new ATOM 0 HB2 GLN A 15 9.672 -7.305 5.324 1.00 10.00 H new ATOM 0 HB3 GLN A 15 10.230 -7.250 3.663 1.00 10.00 H new ATOM 0 HG2 GLN A 15 12.354 -6.630 4.261 1.00 10.00 H new ATOM 0 HG3 GLN A 15 11.789 -5.490 5.466 1.00 10.00 H new ATOM 0 HE21 GLN A 15 13.659 -8.106 5.378 1.00 10.00 H new ATOM 0 HE22 GLN A 15 13.211 -8.850 6.917 1.00 10.00 H new ATOM 213 N GLY A 16 7.282 -4.475 4.339 1.00 10.00 N ATOM 214 CA GLY A 16 5.847 -4.512 4.114 1.00 10.00 C ATOM 215 C GLY A 16 5.526 -5.044 2.716 1.00 10.00 C ATOM 216 O GLY A 16 6.389 -5.060 1.840 1.00 10.00 O ATOM 0 H GLY A 16 7.640 -3.575 4.659 1.00 10.00 H new ATOM 0 HA2 GLY A 16 5.373 -5.144 4.865 1.00 10.00 H new ATOM 0 HA3 GLY A 16 5.431 -3.511 4.231 1.00 10.00 H new ATOM 220 N ILE A 17 4.281 -5.467 2.550 1.00 10.00 N ATOM 221 CA ILE A 17 3.834 -5.998 1.274 1.00 10.00 C ATOM 222 C ILE A 17 2.392 -5.556 1.019 1.00 10.00 C ATOM 223 O ILE A 17 1.455 -6.136 1.566 1.00 10.00 O ATOM 224 CB ILE A 17 4.030 -7.515 1.226 1.00 10.00 C ATOM 225 CG1 ILE A 17 5.517 -7.877 1.255 1.00 10.00 C ATOM 226 CG2 ILE A 17 3.315 -8.123 0.018 1.00 10.00 C ATOM 227 CD1 ILE A 17 5.719 -9.330 1.689 1.00 10.00 C ATOM 0 H ILE A 17 3.568 -5.453 3.279 1.00 10.00 H new ATOM 0 HA ILE A 17 4.439 -5.596 0.462 1.00 10.00 H new ATOM 0 HB ILE A 17 3.576 -7.946 2.118 1.00 10.00 H new ATOM 0 HG12 ILE A 17 5.951 -7.725 0.267 1.00 10.00 H new ATOM 0 HG13 ILE A 17 6.043 -7.212 1.940 1.00 10.00 H new ATOM 0 HG21 ILE A 17 3.471 -9.202 0.008 1.00 10.00 H new ATOM 0 HG22 ILE A 17 2.248 -7.911 0.082 1.00 10.00 H new ATOM 0 HG23 ILE A 17 3.716 -7.690 -0.898 1.00 10.00 H new ATOM 0 HD11 ILE A 17 6.784 -9.561 1.701 1.00 10.00 H new ATOM 0 HD12 ILE A 17 5.305 -9.472 2.687 1.00 10.00 H new ATOM 0 HD13 ILE A 17 5.212 -9.993 0.988 1.00 10.00 H new ATOM 239 N ILE A 18 2.258 -4.534 0.187 1.00 10.00 N ATOM 240 CA ILE A 18 0.946 -4.007 -0.147 1.00 10.00 C ATOM 241 C ILE A 18 0.602 -4.386 -1.590 1.00 10.00 C ATOM 242 O ILE A 18 1.486 -4.724 -2.374 1.00 10.00 O ATOM 243 CB ILE A 18 0.886 -2.503 0.125 1.00 10.00 C ATOM 244 CG1 ILE A 18 -0.209 -1.837 -0.711 1.00 10.00 C ATOM 245 CG2 ILE A 18 2.253 -1.851 -0.097 1.00 10.00 C ATOM 246 CD1 ILE A 18 -0.155 -0.315 -0.572 1.00 10.00 C ATOM 0 H ILE A 18 3.037 -4.056 -0.266 1.00 10.00 H new ATOM 0 HA ILE A 18 0.183 -4.452 0.491 1.00 10.00 H new ATOM 0 HB ILE A 18 0.625 -2.356 1.173 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -0.091 -2.115 -1.758 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -1.186 -2.200 -0.393 1.00 10.00 H new ATOM 0 HG21 ILE A 18 2.183 -0.782 0.103 1.00 10.00 H new ATOM 0 HG22 ILE A 18 2.984 -2.299 0.577 1.00 10.00 H new ATOM 0 HG23 ILE A 18 2.567 -2.007 -1.129 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -0.944 0.134 -1.176 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -0.297 -0.040 0.473 1.00 10.00 H new ATOM 0 HD13 ILE A 18 0.814 0.047 -0.914 1.00 10.00 H new ATOM 258 N ASN A 19 -0.686 -4.315 -1.895 1.00 10.00 N ATOM 259 CA ASN A 19 -1.158 -4.646 -3.229 1.00 10.00 C ATOM 260 C ASN A 19 -2.451 -3.878 -3.512 1.00 10.00 C ATOM 261 O ASN A 19 -3.144 -3.460 -2.587 1.00 10.00 O ATOM 262 CB ASN A 19 -1.459 -6.141 -3.351 1.00 10.00 C ATOM 263 CG ASN A 19 -0.535 -6.962 -2.450 1.00 10.00 C ATOM 264 OD1 ASN A 19 -0.831 -6.883 -1.156 1.00 10.00 O flip ATOM 265 ND2 ASN A 19 0.386 -7.624 -2.900 1.00 10.00 N flip ATOM 0 H ASN A 19 -1.417 -4.033 -1.241 1.00 10.00 H new ATOM 0 HA ASN A 19 -0.377 -4.376 -3.940 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -2.498 -6.330 -3.081 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -1.337 -6.457 -4.387 1.00 10.00 H new ATOM 0 HD21 ASN A 19 0.558 -7.641 -3.905 1.00 10.00 H new ATOM 0 HD22 ASN A 19 0.983 -8.161 -2.271 1.00 10.00 H new ATOM 272 N PHE A 20 -2.735 -3.716 -4.796 1.00 10.00 N ATOM 273 CA PHE A 20 -3.933 -3.007 -5.213 1.00 10.00 C ATOM 274 C PHE A 20 -4.721 -3.819 -6.242 1.00 10.00 C ATOM 275 O PHE A 20 -4.309 -3.935 -7.395 1.00 10.00 O ATOM 276 CB PHE A 20 -3.474 -1.697 -5.858 1.00 10.00 C ATOM 277 CG PHE A 20 -2.773 -0.740 -4.893 1.00 10.00 C ATOM 278 CD1 PHE A 20 -1.598 -1.100 -4.311 1.00 10.00 C ATOM 279 CD2 PHE A 20 -3.326 0.472 -4.616 1.00 10.00 C ATOM 280 CE1 PHE A 20 -0.948 -0.211 -3.414 1.00 10.00 C ATOM 281 CE2 PHE A 20 -2.675 1.361 -3.719 1.00 10.00 C ATOM 282 CZ PHE A 20 -1.500 1.000 -3.138 1.00 10.00 C ATOM 0 H PHE A 20 -2.157 -4.063 -5.561 1.00 10.00 H new ATOM 0 HA PHE A 20 -4.581 -2.834 -4.354 1.00 10.00 H new ATOM 0 HB2 PHE A 20 -2.797 -1.927 -6.681 1.00 10.00 H new ATOM 0 HB3 PHE A 20 -4.340 -1.193 -6.288 1.00 10.00 H new ATOM 0 HD1 PHE A 20 -1.159 -2.062 -4.531 1.00 10.00 H new ATOM 0 HD2 PHE A 20 -4.259 0.758 -5.078 1.00 10.00 H new ATOM 0 HE1 PHE A 20 -0.015 -0.497 -2.951 1.00 10.00 H new ATOM 0 HE2 PHE A 20 -3.113 2.323 -3.499 1.00 10.00 H new ATOM 0 HZ PHE A 20 -1.005 1.676 -2.457 1.00 10.00 H new ATOM 292 N GLU A 21 -5.842 -4.361 -5.788 1.00 10.00 N ATOM 293 CA GLU A 21 -6.692 -5.159 -6.654 1.00 10.00 C ATOM 294 C GLU A 21 -7.829 -4.304 -7.217 1.00 10.00 C ATOM 295 O GLU A 21 -8.288 -3.368 -6.564 1.00 10.00 O ATOM 296 CB GLU A 21 -7.240 -6.380 -5.911 1.00 10.00 C ATOM 297 CG GLU A 21 -8.162 -7.202 -6.814 1.00 10.00 C ATOM 298 CD GLU A 21 -8.321 -8.628 -6.282 1.00 10.00 C ATOM 299 OE1 GLU A 21 -7.299 -9.176 -5.815 1.00 10.00 O ATOM 300 OE2 GLU A 21 -9.460 -9.137 -6.354 1.00 10.00 O ATOM 0 H GLU A 21 -6.181 -4.263 -4.831 1.00 10.00 H new ATOM 0 HA GLU A 21 -6.090 -5.522 -7.487 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -6.414 -7.002 -5.566 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -7.786 -6.056 -5.025 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -9.139 -6.722 -6.876 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -7.756 -7.230 -7.825 1.00 10.00 H new ATOM 307 N GLN A 22 -8.250 -4.656 -8.423 1.00 10.00 N ATOM 308 CA GLN A 22 -9.324 -3.932 -9.081 1.00 10.00 C ATOM 309 C GLN A 22 -10.158 -4.885 -9.940 1.00 10.00 C ATOM 310 O GLN A 22 -9.944 -4.986 -11.147 1.00 10.00 O ATOM 311 CB GLN A 22 -8.774 -2.777 -9.920 1.00 10.00 C ATOM 312 CG GLN A 22 -9.903 -1.863 -10.403 1.00 10.00 C ATOM 313 CD GLN A 22 -9.526 -1.174 -11.716 1.00 10.00 C ATOM 314 OE1 GLN A 22 -8.701 -1.646 -12.480 1.00 10.00 O ATOM 315 NE2 GLN A 22 -10.176 -0.035 -11.935 1.00 10.00 N ATOM 0 H GLN A 22 -7.867 -5.433 -8.961 1.00 10.00 H new ATOM 0 HA GLN A 22 -9.970 -3.505 -8.314 1.00 10.00 H new ATOM 0 HB2 GLN A 22 -8.062 -2.200 -9.329 1.00 10.00 H new ATOM 0 HB3 GLN A 22 -8.230 -3.173 -10.777 1.00 10.00 H new ATOM 0 HG2 GLN A 22 -10.813 -2.446 -10.542 1.00 10.00 H new ATOM 0 HG3 GLN A 22 -10.118 -1.112 -9.643 1.00 10.00 H new ATOM 0 HE21 GLN A 22 -10.855 0.304 -11.253 1.00 10.00 H new ATOM 0 HE22 GLN A 22 -9.996 0.500 -12.785 1.00 10.00 H new ATOM 324 N LYS A 23 -11.091 -5.559 -9.284 1.00 10.00 N ATOM 325 CA LYS A 23 -11.958 -6.500 -9.972 1.00 10.00 C ATOM 326 C LYS A 23 -13.025 -5.728 -10.752 1.00 10.00 C ATOM 327 O LYS A 23 -14.220 -5.949 -10.561 1.00 10.00 O ATOM 328 CB LYS A 23 -12.534 -7.518 -8.986 1.00 10.00 C ATOM 329 CG LYS A 23 -12.051 -8.933 -9.314 1.00 10.00 C ATOM 330 CD LYS A 23 -12.984 -9.984 -8.710 1.00 10.00 C ATOM 331 CE LYS A 23 -12.850 -11.321 -9.442 1.00 10.00 C ATOM 332 NZ LYS A 23 -13.675 -12.358 -8.782 1.00 10.00 N ATOM 0 H LYS A 23 -11.265 -5.472 -8.283 1.00 10.00 H new ATOM 0 HA LYS A 23 -11.389 -7.081 -10.698 1.00 10.00 H new ATOM 0 HB2 LYS A 23 -12.237 -7.255 -7.971 1.00 10.00 H new ATOM 0 HB3 LYS A 23 -13.623 -7.485 -9.018 1.00 10.00 H new ATOM 0 HG2 LYS A 23 -12.002 -9.063 -10.395 1.00 10.00 H new ATOM 0 HG3 LYS A 23 -11.041 -9.075 -8.930 1.00 10.00 H new ATOM 0 HD2 LYS A 23 -12.751 -10.119 -7.654 1.00 10.00 H new ATOM 0 HD3 LYS A 23 -14.015 -9.636 -8.767 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -13.161 -11.207 -10.480 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -11.806 -11.632 -9.455 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -13.573 -13.259 -9.291 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -13.360 -12.478 -7.798 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -14.673 -12.066 -8.792 1.00 10.00 H new ATOM 346 N GLU A 24 -12.554 -4.838 -11.613 1.00 10.00 N ATOM 347 CA GLU A 24 -13.453 -4.032 -12.422 1.00 10.00 C ATOM 348 C GLU A 24 -12.740 -3.551 -13.688 1.00 10.00 C ATOM 349 O GLU A 24 -13.303 -3.603 -14.780 1.00 10.00 O ATOM 350 CB GLU A 24 -14.003 -2.851 -11.620 1.00 10.00 C ATOM 351 CG GLU A 24 -15.474 -3.069 -11.262 1.00 10.00 C ATOM 352 CD GLU A 24 -16.393 -2.418 -12.299 1.00 10.00 C ATOM 353 OE1 GLU A 24 -16.611 -3.062 -13.348 1.00 10.00 O ATOM 354 OE2 GLU A 24 -16.855 -1.291 -12.019 1.00 10.00 O ATOM 0 H GLU A 24 -11.562 -4.657 -11.768 1.00 10.00 H new ATOM 0 HA GLU A 24 -14.299 -4.652 -12.718 1.00 10.00 H new ATOM 0 HB2 GLU A 24 -13.419 -2.722 -10.709 1.00 10.00 H new ATOM 0 HB3 GLU A 24 -13.898 -1.933 -12.199 1.00 10.00 H new ATOM 0 HG2 GLU A 24 -15.684 -4.137 -11.205 1.00 10.00 H new ATOM 0 HG3 GLU A 24 -15.678 -2.651 -10.276 1.00 10.00 H new ATOM 361 N SER A 25 -11.511 -3.093 -13.498 1.00 10.00 N ATOM 362 CA SER A 25 -10.715 -2.603 -14.611 1.00 10.00 C ATOM 363 C SER A 25 -11.215 -1.223 -15.044 1.00 10.00 C ATOM 364 O SER A 25 -10.696 -0.642 -15.995 1.00 10.00 O ATOM 365 CB SER A 25 -10.758 -3.577 -15.790 1.00 10.00 C ATOM 366 OG SER A 25 -9.465 -4.082 -16.113 1.00 10.00 O ATOM 0 H SER A 25 -11.047 -3.051 -12.591 1.00 10.00 H new ATOM 0 HA SER A 25 -9.680 -2.520 -14.281 1.00 10.00 H new ATOM 0 HB2 SER A 25 -11.422 -4.407 -15.550 1.00 10.00 H new ATOM 0 HB3 SER A 25 -11.179 -3.074 -16.661 1.00 10.00 H new ATOM 0 HG SER A 25 -9.535 -4.701 -16.869 1.00 10.00 H new ATOM 372 N ASN A 26 -12.217 -0.739 -14.324 1.00 10.00 N ATOM 373 CA ASN A 26 -12.792 0.561 -14.622 1.00 10.00 C ATOM 374 C ASN A 26 -13.704 0.987 -13.469 1.00 10.00 C ATOM 375 O ASN A 26 -14.695 1.683 -13.681 1.00 10.00 O ATOM 376 CB ASN A 26 -13.635 0.512 -15.897 1.00 10.00 C ATOM 377 CG ASN A 26 -13.122 1.514 -16.933 1.00 10.00 C ATOM 378 OD1 ASN A 26 -12.667 1.158 -18.008 1.00 10.00 O ATOM 379 ND2 ASN A 26 -13.220 2.784 -16.551 1.00 10.00 N ATOM 0 H ASN A 26 -12.645 -1.224 -13.535 1.00 10.00 H new ATOM 0 HA ASN A 26 -11.974 1.268 -14.758 1.00 10.00 H new ATOM 0 HB2 ASN A 26 -13.610 -0.494 -16.315 1.00 10.00 H new ATOM 0 HB3 ASN A 26 -14.676 0.732 -15.658 1.00 10.00 H new ATOM 0 HD21 ASN A 26 -12.904 3.529 -17.172 1.00 10.00 H new ATOM 0 HD22 ASN A 26 -13.611 3.013 -15.637 1.00 10.00 H new ATOM 386 N GLY A 27 -13.335 0.551 -12.273 1.00 10.00 N ATOM 387 CA GLY A 27 -14.107 0.878 -11.087 1.00 10.00 C ATOM 388 C GLY A 27 -13.189 1.165 -9.897 1.00 10.00 C ATOM 389 O GLY A 27 -12.114 1.739 -10.062 1.00 10.00 O ATOM 0 H GLY A 27 -12.512 -0.026 -12.100 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -14.734 1.747 -11.285 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -14.775 0.052 -10.844 1.00 10.00 H new ATOM 393 N PRO A 28 -13.659 0.741 -8.693 1.00 10.00 N ATOM 394 CA PRO A 28 -12.893 0.947 -7.476 1.00 10.00 C ATOM 395 C PRO A 28 -11.716 -0.027 -7.398 1.00 10.00 C ATOM 396 O PRO A 28 -11.731 -1.077 -8.039 1.00 10.00 O ATOM 397 CB PRO A 28 -13.892 0.763 -6.346 1.00 10.00 C ATOM 398 CG PRO A 28 -15.066 0.008 -6.946 1.00 10.00 C ATOM 399 CD PRO A 28 -14.928 0.058 -8.459 1.00 10.00 C ATOM 0 HA PRO A 28 -12.437 1.936 -7.429 1.00 10.00 H new ATOM 0 HB2 PRO A 28 -13.450 0.205 -5.521 1.00 10.00 H new ATOM 0 HB3 PRO A 28 -14.210 1.726 -5.946 1.00 10.00 H new ATOM 0 HG2 PRO A 28 -15.074 -1.025 -6.597 1.00 10.00 H new ATOM 0 HG3 PRO A 28 -16.009 0.457 -6.634 1.00 10.00 H new ATOM 0 HD2 PRO A 28 -14.924 -0.943 -8.890 1.00 10.00 H new ATOM 0 HD3 PRO A 28 -15.758 0.598 -8.915 1.00 10.00 H new ATOM 407 N VAL A 29 -10.723 0.355 -6.608 1.00 10.00 N ATOM 408 CA VAL A 29 -9.541 -0.472 -6.438 1.00 10.00 C ATOM 409 C VAL A 29 -9.387 -0.837 -4.960 1.00 10.00 C ATOM 410 O VAL A 29 -9.155 0.034 -4.123 1.00 10.00 O ATOM 411 CB VAL A 29 -8.315 0.245 -7.007 1.00 10.00 C ATOM 412 CG1 VAL A 29 -7.070 -0.640 -6.914 1.00 10.00 C ATOM 413 CG2 VAL A 29 -8.562 0.693 -8.449 1.00 10.00 C ATOM 0 H VAL A 29 -10.713 1.227 -6.078 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.644 -1.404 -6.994 1.00 10.00 H new ATOM 0 HB VAL A 29 -8.139 1.136 -6.405 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -6.213 -0.107 -7.325 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -6.877 -0.888 -5.870 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -7.232 -1.557 -7.480 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -7.675 1.200 -8.830 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -8.776 -0.178 -9.069 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -9.411 1.376 -8.477 1.00 10.00 H new ATOM 423 N LYS A 30 -9.522 -2.125 -4.684 1.00 10.00 N ATOM 424 CA LYS A 30 -9.401 -2.616 -3.322 1.00 10.00 C ATOM 425 C LYS A 30 -7.923 -2.653 -2.927 1.00 10.00 C ATOM 426 O LYS A 30 -7.214 -3.606 -3.249 1.00 10.00 O ATOM 427 CB LYS A 30 -10.111 -3.963 -3.173 1.00 10.00 C ATOM 428 CG LYS A 30 -11.494 -3.787 -2.542 1.00 10.00 C ATOM 429 CD LYS A 30 -11.844 -4.979 -1.649 1.00 10.00 C ATOM 430 CE LYS A 30 -13.177 -4.753 -0.932 1.00 10.00 C ATOM 431 NZ LYS A 30 -13.620 -5.994 -0.258 1.00 10.00 N ATOM 0 H LYS A 30 -9.714 -2.845 -5.381 1.00 10.00 H new ATOM 0 HA LYS A 30 -9.900 -1.940 -2.628 1.00 10.00 H new ATOM 0 HB2 LYS A 30 -10.211 -4.436 -4.150 1.00 10.00 H new ATOM 0 HB3 LYS A 30 -9.508 -4.630 -2.556 1.00 10.00 H new ATOM 0 HG2 LYS A 30 -11.516 -2.869 -1.955 1.00 10.00 H new ATOM 0 HG3 LYS A 30 -12.245 -3.682 -3.325 1.00 10.00 H new ATOM 0 HD2 LYS A 30 -11.900 -5.886 -2.252 1.00 10.00 H new ATOM 0 HD3 LYS A 30 -11.053 -5.133 -0.915 1.00 10.00 H new ATOM 0 HE2 LYS A 30 -13.072 -3.952 -0.200 1.00 10.00 H new ATOM 0 HE3 LYS A 30 -13.933 -4.432 -1.649 1.00 10.00 H new ATOM 0 HZ1 LYS A 30 -14.526 -5.823 0.224 1.00 10.00 H new ATOM 0 HZ2 LYS A 30 -13.740 -6.748 -0.964 1.00 10.00 H new ATOM 0 HZ3 LYS A 30 -12.906 -6.284 0.440 1.00 10.00 H new ATOM 445 N VAL A 31 -7.502 -1.604 -2.236 1.00 10.00 N ATOM 446 CA VAL A 31 -6.121 -1.505 -1.794 1.00 10.00 C ATOM 447 C VAL A 31 -5.985 -2.147 -0.412 1.00 10.00 C ATOM 448 O VAL A 31 -6.878 -2.020 0.426 1.00 10.00 O ATOM 449 CB VAL A 31 -5.667 -0.044 -1.822 1.00 10.00 C ATOM 450 CG1 VAL A 31 -4.185 0.076 -1.462 1.00 10.00 C ATOM 451 CG2 VAL A 31 -5.954 0.593 -3.183 1.00 10.00 C ATOM 0 H VAL A 31 -8.092 -0.815 -1.971 1.00 10.00 H new ATOM 0 HA VAL A 31 -5.463 -2.049 -2.471 1.00 10.00 H new ATOM 0 HB VAL A 31 -6.239 0.500 -1.070 1.00 10.00 H new ATOM 0 HG11 VAL A 31 -3.888 1.124 -1.489 1.00 10.00 H new ATOM 0 HG12 VAL A 31 -4.020 -0.322 -0.461 1.00 10.00 H new ATOM 0 HG13 VAL A 31 -3.589 -0.489 -2.179 1.00 10.00 H new ATOM 0 HG21 VAL A 31 -5.622 1.631 -3.176 1.00 10.00 H new ATOM 0 HG22 VAL A 31 -5.420 0.046 -3.960 1.00 10.00 H new ATOM 0 HG23 VAL A 31 -7.025 0.556 -3.383 1.00 10.00 H new ATOM 461 N TRP A 32 -4.862 -2.821 -0.216 1.00 10.00 N ATOM 462 CA TRP A 32 -4.598 -3.483 1.051 1.00 10.00 C ATOM 463 C TRP A 32 -3.124 -3.894 1.071 1.00 10.00 C ATOM 464 O TRP A 32 -2.505 -4.051 0.020 1.00 10.00 O ATOM 465 CB TRP A 32 -5.550 -4.662 1.262 1.00 10.00 C ATOM 466 CG TRP A 32 -5.020 -5.994 0.727 1.00 10.00 C ATOM 467 CD1 TRP A 32 -4.079 -6.782 1.264 1.00 10.00 C ATOM 468 CD2 TRP A 32 -5.442 -6.665 -0.478 1.00 10.00 C ATOM 469 NE1 TRP A 32 -3.864 -7.908 0.495 1.00 10.00 N ATOM 470 CE2 TRP A 32 -4.719 -7.834 -0.598 1.00 10.00 C ATOM 471 CE3 TRP A 32 -6.403 -6.296 -1.436 1.00 10.00 C ATOM 472 CZ2 TRP A 32 -4.881 -8.730 -1.662 1.00 10.00 C ATOM 473 CZ3 TRP A 32 -6.553 -7.202 -2.493 1.00 10.00 C ATOM 474 CH2 TRP A 32 -5.833 -8.383 -2.628 1.00 10.00 C ATOM 0 H TRP A 32 -4.124 -2.923 -0.913 1.00 10.00 H new ATOM 0 HA TRP A 32 -4.783 -2.807 1.886 1.00 10.00 H new ATOM 0 HB2 TRP A 32 -5.753 -4.765 2.328 1.00 10.00 H new ATOM 0 HB3 TRP A 32 -6.500 -4.440 0.777 1.00 10.00 H new ATOM 0 HD1 TRP A 32 -3.555 -6.564 2.183 1.00 10.00 H new ATOM 0 HE1 TRP A 32 -3.200 -8.657 0.693 1.00 10.00 H new ATOM 0 HE3 TRP A 32 -6.980 -5.386 -1.362 1.00 10.00 H new ATOM 0 HZ2 TRP A 32 -4.303 -9.639 -1.733 1.00 10.00 H new ATOM 0 HZ3 TRP A 32 -7.279 -6.967 -3.257 1.00 10.00 H new ATOM 0 HH2 TRP A 32 -6.007 -9.030 -3.475 1.00 10.00 H new ATOM 485 N GLY A 33 -2.605 -4.055 2.279 1.00 10.00 N ATOM 486 CA GLY A 33 -1.215 -4.445 2.450 1.00 10.00 C ATOM 487 C GLY A 33 -0.908 -4.751 3.917 1.00 10.00 C ATOM 488 O GLY A 33 -1.809 -4.762 4.755 1.00 10.00 O ATOM 0 H GLY A 33 -3.121 -3.923 3.149 1.00 10.00 H new ATOM 0 HA2 GLY A 33 -1.002 -5.323 1.839 1.00 10.00 H new ATOM 0 HA3 GLY A 33 -0.563 -3.646 2.097 1.00 10.00 H new ATOM 492 N SER A 34 0.367 -4.994 4.184 1.00 10.00 N ATOM 493 CA SER A 34 0.804 -5.300 5.535 1.00 10.00 C ATOM 494 C SER A 34 2.291 -4.978 5.690 1.00 10.00 C ATOM 495 O SER A 34 3.126 -5.522 4.970 1.00 10.00 O ATOM 496 CB SER A 34 0.540 -6.767 5.881 1.00 10.00 C ATOM 497 OG SER A 34 -0.837 -7.011 6.157 1.00 10.00 O ATOM 0 H SER A 34 1.112 -4.985 3.487 1.00 10.00 H new ATOM 0 HA SER A 34 0.231 -4.683 6.227 1.00 10.00 H new ATOM 0 HB2 SER A 34 0.861 -7.398 5.053 1.00 10.00 H new ATOM 0 HB3 SER A 34 1.139 -7.049 6.747 1.00 10.00 H new ATOM 0 HG SER A 34 -1.376 -6.269 5.812 1.00 10.00 H new ATOM 503 N ILE A 35 2.577 -4.093 6.634 1.00 10.00 N ATOM 504 CA ILE A 35 3.950 -3.692 6.893 1.00 10.00 C ATOM 505 C ILE A 35 4.606 -4.707 7.830 1.00 10.00 C ATOM 506 O ILE A 35 3.920 -5.523 8.445 1.00 10.00 O ATOM 507 CB ILE A 35 3.998 -2.254 7.413 1.00 10.00 C ATOM 508 CG1 ILE A 35 4.508 -1.297 6.333 1.00 10.00 C ATOM 509 CG2 ILE A 35 4.826 -2.162 8.696 1.00 10.00 C ATOM 510 CD1 ILE A 35 3.938 0.109 6.532 1.00 10.00 C ATOM 0 H ILE A 35 1.882 -3.642 7.229 1.00 10.00 H new ATOM 0 HA ILE A 35 4.528 -3.692 5.969 1.00 10.00 H new ATOM 0 HB ILE A 35 2.982 -1.947 7.662 1.00 10.00 H new ATOM 0 HG12 ILE A 35 5.597 -1.259 6.361 1.00 10.00 H new ATOM 0 HG13 ILE A 35 4.227 -1.671 5.349 1.00 10.00 H new ATOM 0 HG21 ILE A 35 4.844 -1.129 9.044 1.00 10.00 H new ATOM 0 HG22 ILE A 35 4.381 -2.796 9.463 1.00 10.00 H new ATOM 0 HG23 ILE A 35 5.844 -2.495 8.496 1.00 10.00 H new ATOM 0 HD11 ILE A 35 4.316 0.769 5.751 1.00 10.00 H new ATOM 0 HD12 ILE A 35 2.850 0.071 6.479 1.00 10.00 H new ATOM 0 HD13 ILE A 35 4.241 0.490 7.507 1.00 10.00 H new ATOM 522 N LYS A 36 5.926 -4.624 7.910 1.00 10.00 N ATOM 523 CA LYS A 36 6.682 -5.526 8.763 1.00 10.00 C ATOM 524 C LYS A 36 8.014 -4.872 9.134 1.00 10.00 C ATOM 525 O LYS A 36 8.894 -4.724 8.288 1.00 10.00 O ATOM 526 CB LYS A 36 6.833 -6.894 8.094 1.00 10.00 C ATOM 527 CG LYS A 36 5.473 -7.573 7.921 1.00 10.00 C ATOM 528 CD LYS A 36 5.636 -9.079 7.706 1.00 10.00 C ATOM 529 CE LYS A 36 5.139 -9.492 6.319 1.00 10.00 C ATOM 530 NZ LYS A 36 4.709 -10.908 6.322 1.00 10.00 N ATOM 0 H LYS A 36 6.491 -3.946 7.398 1.00 10.00 H new ATOM 0 HA LYS A 36 6.146 -5.710 9.694 1.00 10.00 H new ATOM 0 HB2 LYS A 36 7.311 -6.776 7.121 1.00 10.00 H new ATOM 0 HB3 LYS A 36 7.486 -7.527 8.695 1.00 10.00 H new ATOM 0 HG2 LYS A 36 4.858 -7.392 8.802 1.00 10.00 H new ATOM 0 HG3 LYS A 36 4.949 -7.135 7.071 1.00 10.00 H new ATOM 0 HD2 LYS A 36 6.685 -9.354 7.817 1.00 10.00 H new ATOM 0 HD3 LYS A 36 5.081 -9.621 8.471 1.00 10.00 H new ATOM 0 HE2 LYS A 36 4.307 -8.854 6.020 1.00 10.00 H new ATOM 0 HE3 LYS A 36 5.932 -9.348 5.585 1.00 10.00 H new ATOM 0 HZ1 LYS A 36 4.375 -11.171 5.373 1.00 10.00 H new ATOM 0 HZ2 LYS A 36 5.512 -11.514 6.587 1.00 10.00 H new ATOM 0 HZ3 LYS A 36 3.938 -11.035 7.008 1.00 10.00 H new ATOM 544 N GLY A 37 8.120 -4.499 10.401 1.00 10.00 N ATOM 545 CA GLY A 37 9.331 -3.865 10.895 1.00 10.00 C ATOM 546 C GLY A 37 8.998 -2.730 11.866 1.00 10.00 C ATOM 547 O GLY A 37 9.610 -2.615 12.926 1.00 10.00 O ATOM 0 H GLY A 37 7.388 -4.623 11.100 1.00 10.00 H new ATOM 0 HA2 GLY A 37 9.955 -4.605 11.395 1.00 10.00 H new ATOM 0 HA3 GLY A 37 9.909 -3.474 10.058 1.00 10.00 H new ATOM 551 N LEU A 38 8.028 -1.919 11.468 1.00 10.00 N ATOM 552 CA LEU A 38 7.606 -0.797 12.289 1.00 10.00 C ATOM 553 C LEU A 38 7.286 -1.295 13.700 1.00 10.00 C ATOM 554 O LEU A 38 7.547 -2.452 14.028 1.00 10.00 O ATOM 555 CB LEU A 38 6.449 -0.051 11.623 1.00 10.00 C ATOM 556 CG LEU A 38 6.835 0.951 10.533 1.00 10.00 C ATOM 557 CD1 LEU A 38 6.636 0.350 9.140 1.00 10.00 C ATOM 558 CD2 LEU A 38 6.074 2.267 10.704 1.00 10.00 C ATOM 0 H LEU A 38 7.522 -2.017 10.588 1.00 10.00 H new ATOM 0 HA LEU A 38 8.412 -0.069 12.383 1.00 10.00 H new ATOM 0 HB2 LEU A 38 5.771 -0.786 11.189 1.00 10.00 H new ATOM 0 HB3 LEU A 38 5.892 0.479 12.396 1.00 10.00 H new ATOM 0 HG LEU A 38 7.896 1.177 10.637 1.00 10.00 H new ATOM 0 HD11 LEU A 38 6.918 1.083 8.384 1.00 10.00 H new ATOM 0 HD12 LEU A 38 7.259 -0.538 9.034 1.00 10.00 H new ATOM 0 HD13 LEU A 38 5.589 0.076 9.008 1.00 10.00 H new ATOM 0 HD21 LEU A 38 6.367 2.962 9.917 1.00 10.00 H new ATOM 0 HD22 LEU A 38 5.002 2.078 10.641 1.00 10.00 H new ATOM 0 HD23 LEU A 38 6.310 2.700 11.676 1.00 10.00 H new ATOM 570 N THR A 39 6.725 -0.398 14.497 1.00 10.00 N ATOM 571 CA THR A 39 6.367 -0.731 15.865 1.00 10.00 C ATOM 572 C THR A 39 4.951 -0.245 16.179 1.00 10.00 C ATOM 573 O THR A 39 4.572 0.861 15.797 1.00 10.00 O ATOM 574 CB THR A 39 7.432 -0.140 16.791 1.00 10.00 C ATOM 575 OG1 THR A 39 7.594 1.197 16.324 1.00 10.00 O ATOM 576 CG2 THR A 39 8.808 -0.776 16.582 1.00 10.00 C ATOM 0 H THR A 39 6.509 0.560 14.221 1.00 10.00 H new ATOM 0 HA THR A 39 6.348 -1.810 16.017 1.00 10.00 H new ATOM 0 HB THR A 39 7.125 -0.272 17.828 1.00 10.00 H new ATOM 0 HG1 THR A 39 8.267 1.655 16.870 1.00 10.00 H new ATOM 0 HG21 THR A 39 9.527 -0.321 17.264 1.00 10.00 H new ATOM 0 HG22 THR A 39 8.748 -1.846 16.780 1.00 10.00 H new ATOM 0 HG23 THR A 39 9.131 -0.615 15.554 1.00 10.00 H new ATOM 584 N GLU A 40 4.208 -1.095 16.872 1.00 10.00 N ATOM 585 CA GLU A 40 2.842 -0.766 17.242 1.00 10.00 C ATOM 586 C GLU A 40 2.730 0.719 17.593 1.00 10.00 C ATOM 587 O GLU A 40 3.348 1.183 18.551 1.00 10.00 O ATOM 588 CB GLU A 40 2.361 -1.641 18.402 1.00 10.00 C ATOM 589 CG GLU A 40 3.098 -1.289 19.696 1.00 10.00 C ATOM 590 CD GLU A 40 2.213 -0.449 20.619 1.00 10.00 C ATOM 591 OE1 GLU A 40 1.319 0.237 20.079 1.00 10.00 O ATOM 592 OE2 GLU A 40 2.451 -0.513 21.845 1.00 10.00 O ATOM 0 H GLU A 40 4.526 -2.011 17.187 1.00 10.00 H new ATOM 0 HA GLU A 40 2.197 -0.967 16.387 1.00 10.00 H new ATOM 0 HB2 GLU A 40 1.288 -1.508 18.542 1.00 10.00 H new ATOM 0 HB3 GLU A 40 2.523 -2.692 18.161 1.00 10.00 H new ATOM 0 HG2 GLU A 40 3.399 -2.203 20.208 1.00 10.00 H new ATOM 0 HG3 GLU A 40 4.010 -0.740 19.462 1.00 10.00 H new ATOM 599 N GLY A 41 1.938 1.425 16.799 1.00 10.00 N ATOM 600 CA GLY A 41 1.738 2.848 17.014 1.00 10.00 C ATOM 601 C GLY A 41 1.426 3.562 15.697 1.00 10.00 C ATOM 602 O GLY A 41 1.316 2.924 14.651 1.00 10.00 O ATOM 0 H GLY A 41 1.427 1.038 16.006 1.00 10.00 H new ATOM 0 HA2 GLY A 41 0.920 3.002 17.718 1.00 10.00 H new ATOM 0 HA3 GLY A 41 2.632 3.281 17.464 1.00 10.00 H new ATOM 606 N LEU A 42 1.294 4.877 15.792 1.00 10.00 N ATOM 607 CA LEU A 42 0.997 5.685 14.621 1.00 10.00 C ATOM 608 C LEU A 42 2.260 5.823 13.768 1.00 10.00 C ATOM 609 O LEU A 42 3.354 6.013 14.298 1.00 10.00 O ATOM 610 CB LEU A 42 0.386 7.026 15.036 1.00 10.00 C ATOM 611 CG LEU A 42 -1.108 7.009 15.366 1.00 10.00 C ATOM 612 CD1 LEU A 42 -1.403 7.844 16.613 1.00 10.00 C ATOM 613 CD2 LEU A 42 -1.939 7.460 14.163 1.00 10.00 C ATOM 0 H LEU A 42 1.387 5.403 16.661 1.00 10.00 H new ATOM 0 HA LEU A 42 0.245 5.196 14.002 1.00 10.00 H new ATOM 0 HB2 LEU A 42 0.926 7.394 15.908 1.00 10.00 H new ATOM 0 HB3 LEU A 42 0.552 7.743 14.232 1.00 10.00 H new ATOM 0 HG LEU A 42 -1.398 5.983 15.591 1.00 10.00 H new ATOM 0 HD11 LEU A 42 -2.472 7.815 16.826 1.00 10.00 H new ATOM 0 HD12 LEU A 42 -0.853 7.437 17.462 1.00 10.00 H new ATOM 0 HD13 LEU A 42 -1.095 8.875 16.442 1.00 10.00 H new ATOM 0 HD21 LEU A 42 -2.997 7.439 14.423 1.00 10.00 H new ATOM 0 HD22 LEU A 42 -1.654 8.474 13.884 1.00 10.00 H new ATOM 0 HD23 LEU A 42 -1.759 6.788 13.324 1.00 10.00 H new ATOM 625 N HIS A 43 2.067 5.722 12.461 1.00 10.00 N ATOM 626 CA HIS A 43 3.176 5.832 11.530 1.00 10.00 C ATOM 627 C HIS A 43 2.792 6.768 10.382 1.00 10.00 C ATOM 628 O HIS A 43 1.632 7.159 10.257 1.00 10.00 O ATOM 629 CB HIS A 43 3.619 4.450 11.045 1.00 10.00 C ATOM 630 CG HIS A 43 4.006 3.505 12.157 1.00 10.00 C ATOM 631 ND1 HIS A 43 4.881 3.856 13.170 1.00 10.00 N ATOM 632 CD2 HIS A 43 3.627 2.218 12.405 1.00 10.00 C ATOM 633 CE1 HIS A 43 5.017 2.820 13.984 1.00 10.00 C ATOM 634 NE2 HIS A 43 4.239 1.806 13.509 1.00 10.00 N ATOM 0 H HIS A 43 1.158 5.565 12.025 1.00 10.00 H new ATOM 0 HA HIS A 43 4.037 6.268 12.036 1.00 10.00 H new ATOM 0 HB2 HIS A 43 2.811 4.003 10.467 1.00 10.00 H new ATOM 0 HB3 HIS A 43 4.467 4.567 10.370 1.00 10.00 H new ATOM 0 HD2 HIS A 43 2.945 1.634 11.805 1.00 10.00 H new ATOM 0 HE1 HIS A 43 5.636 2.785 14.869 1.00 10.00 H new ATOM 0 HE2 HIS A 43 4.143 0.883 13.932 1.00 10.00 H new ATOM 642 N GLY A 44 3.787 7.100 9.573 1.00 10.00 N ATOM 643 CA GLY A 44 3.567 7.982 8.440 1.00 10.00 C ATOM 644 C GLY A 44 3.119 7.192 7.209 1.00 10.00 C ATOM 645 O GLY A 44 3.428 6.009 7.080 1.00 10.00 O ATOM 0 H GLY A 44 4.748 6.774 9.680 1.00 10.00 H new ATOM 0 HA2 GLY A 44 2.811 8.725 8.694 1.00 10.00 H new ATOM 0 HA3 GLY A 44 4.485 8.525 8.214 1.00 10.00 H new ATOM 649 N PHE A 45 2.397 7.879 6.335 1.00 10.00 N ATOM 650 CA PHE A 45 1.903 7.256 5.119 1.00 10.00 C ATOM 651 C PHE A 45 1.951 8.235 3.943 1.00 10.00 C ATOM 652 O PHE A 45 0.930 8.810 3.568 1.00 10.00 O ATOM 653 CB PHE A 45 0.449 6.860 5.378 1.00 10.00 C ATOM 654 CG PHE A 45 -0.050 5.711 4.499 1.00 10.00 C ATOM 655 CD1 PHE A 45 0.097 4.424 4.914 1.00 10.00 C ATOM 656 CD2 PHE A 45 -0.639 5.977 3.302 1.00 10.00 C ATOM 657 CE1 PHE A 45 -0.366 3.358 4.098 1.00 10.00 C ATOM 658 CE2 PHE A 45 -1.102 4.911 2.486 1.00 10.00 C ATOM 659 CZ PHE A 45 -0.955 3.624 2.901 1.00 10.00 C ATOM 0 H PHE A 45 2.143 8.861 6.445 1.00 10.00 H new ATOM 0 HA PHE A 45 2.520 6.394 4.865 1.00 10.00 H new ATOM 0 HB2 PHE A 45 0.342 6.576 6.425 1.00 10.00 H new ATOM 0 HB3 PHE A 45 -0.188 7.730 5.217 1.00 10.00 H new ATOM 0 HD1 PHE A 45 0.566 4.213 5.864 1.00 10.00 H new ATOM 0 HD2 PHE A 45 -0.754 6.999 2.972 1.00 10.00 H new ATOM 0 HE1 PHE A 45 -0.251 2.336 4.428 1.00 10.00 H new ATOM 0 HE2 PHE A 45 -1.571 5.122 1.536 1.00 10.00 H new ATOM 0 HZ PHE A 45 -1.306 2.813 2.280 1.00 10.00 H new ATOM 669 N HIS A 46 3.146 8.393 3.395 1.00 10.00 N ATOM 670 CA HIS A 46 3.340 9.292 2.270 1.00 10.00 C ATOM 671 C HIS A 46 3.003 8.564 0.967 1.00 10.00 C ATOM 672 O HIS A 46 2.695 7.373 0.979 1.00 10.00 O ATOM 673 CB HIS A 46 4.756 9.873 2.276 1.00 10.00 C ATOM 674 CG HIS A 46 5.309 10.129 3.657 1.00 10.00 C ATOM 675 ND1 HIS A 46 6.598 9.787 4.024 1.00 10.00 N ATOM 676 CD2 HIS A 46 4.734 10.699 4.756 1.00 10.00 C ATOM 677 CE1 HIS A 46 6.781 10.138 5.289 1.00 10.00 C ATOM 678 NE2 HIS A 46 5.624 10.702 5.740 1.00 10.00 N ATOM 0 H HIS A 46 3.990 7.914 3.709 1.00 10.00 H new ATOM 0 HA HIS A 46 2.662 10.141 2.357 1.00 10.00 H new ATOM 0 HB2 HIS A 46 5.421 9.187 1.751 1.00 10.00 H new ATOM 0 HB3 HIS A 46 4.756 10.809 1.717 1.00 10.00 H new ATOM 0 HD2 HIS A 46 3.726 11.082 4.815 1.00 10.00 H new ATOM 0 HE1 HIS A 46 7.687 10.001 5.862 1.00 10.00 H new ATOM 0 HE2 HIS A 46 5.468 11.066 6.680 1.00 10.00 H new ATOM 686 N VAL A 47 3.074 9.310 -0.126 1.00 10.00 N ATOM 687 CA VAL A 47 2.780 8.751 -1.434 1.00 10.00 C ATOM 688 C VAL A 47 3.784 9.293 -2.453 1.00 10.00 C ATOM 689 O VAL A 47 3.400 9.960 -3.413 1.00 10.00 O ATOM 690 CB VAL A 47 1.326 9.042 -1.813 1.00 10.00 C ATOM 691 CG1 VAL A 47 1.099 8.833 -3.312 1.00 10.00 C ATOM 692 CG2 VAL A 47 0.363 8.187 -0.988 1.00 10.00 C ATOM 0 H VAL A 47 3.331 10.297 -0.132 1.00 10.00 H new ATOM 0 HA VAL A 47 2.887 7.666 -1.419 1.00 10.00 H new ATOM 0 HB VAL A 47 1.123 10.088 -1.586 1.00 10.00 H new ATOM 0 HG11 VAL A 47 0.058 9.046 -3.556 1.00 10.00 H new ATOM 0 HG12 VAL A 47 1.748 9.503 -3.875 1.00 10.00 H new ATOM 0 HG13 VAL A 47 1.329 7.800 -3.574 1.00 10.00 H new ATOM 0 HG21 VAL A 47 -0.663 8.413 -1.277 1.00 10.00 H new ATOM 0 HG22 VAL A 47 0.567 7.132 -1.169 1.00 10.00 H new ATOM 0 HG23 VAL A 47 0.498 8.406 0.071 1.00 10.00 H new ATOM 702 N HIS A 48 5.050 8.988 -2.209 1.00 10.00 N ATOM 703 CA HIS A 48 6.112 9.437 -3.094 1.00 10.00 C ATOM 704 C HIS A 48 5.622 9.402 -4.542 1.00 10.00 C ATOM 705 O HIS A 48 5.119 8.380 -5.007 1.00 10.00 O ATOM 706 CB HIS A 48 7.383 8.613 -2.878 1.00 10.00 C ATOM 707 CG HIS A 48 8.562 9.420 -2.388 1.00 10.00 C ATOM 708 ND1 HIS A 48 8.511 10.205 -1.249 1.00 10.00 N ATOM 709 CD2 HIS A 48 9.821 9.555 -2.893 1.00 10.00 C ATOM 710 CE1 HIS A 48 9.693 10.782 -1.086 1.00 10.00 C ATOM 711 NE2 HIS A 48 10.503 10.379 -2.107 1.00 10.00 N ATOM 0 H HIS A 48 5.364 8.435 -1.411 1.00 10.00 H new ATOM 0 HA HIS A 48 6.373 10.469 -2.860 1.00 10.00 H new ATOM 0 HB2 HIS A 48 7.173 7.822 -2.158 1.00 10.00 H new ATOM 0 HB3 HIS A 48 7.653 8.127 -3.816 1.00 10.00 H new ATOM 0 HD2 HIS A 48 10.200 9.073 -3.782 1.00 10.00 H new ATOM 0 HE1 HIS A 48 9.967 11.453 -0.285 1.00 10.00 H new ATOM 0 HE2 HIS A 48 11.473 10.664 -2.244 1.00 10.00 H new ATOM 1194 N GLY A 82 -1.572 14.015 0.216 1.00 10.00 N ATOM 1195 CA GLY A 82 -1.037 12.736 -0.218 1.00 10.00 C ATOM 1196 C GLY A 82 -1.288 11.652 0.832 1.00 10.00 C ATOM 1197 O GLY A 82 -1.810 10.584 0.515 1.00 10.00 O ATOM 0 HA2 GLY A 82 -1.498 12.446 -1.162 1.00 10.00 H new ATOM 0 HA3 GLY A 82 0.033 12.829 -0.401 1.00 10.00 H new ATOM 1201 N ASP A 83 -0.905 11.964 2.062 1.00 10.00 N ATOM 1202 CA ASP A 83 -1.082 11.029 3.160 1.00 10.00 C ATOM 1203 C ASP A 83 -2.569 10.937 3.511 1.00 10.00 C ATOM 1204 O ASP A 83 -3.131 9.844 3.561 1.00 10.00 O ATOM 1205 CB ASP A 83 -0.331 11.498 4.408 1.00 10.00 C ATOM 1206 CG ASP A 83 1.179 11.250 4.384 1.00 10.00 C ATOM 1207 OD1 ASP A 83 1.838 11.847 3.506 1.00 10.00 O ATOM 1208 OD2 ASP A 83 1.640 10.471 5.246 1.00 10.00 O ATOM 0 H ASP A 83 -0.473 12.851 2.322 1.00 10.00 H new ATOM 0 HA ASP A 83 -0.692 10.061 2.845 1.00 10.00 H new ATOM 0 HB2 ASP A 83 -0.507 12.566 4.540 1.00 10.00 H new ATOM 0 HB3 ASP A 83 -0.753 10.995 5.278 1.00 10.00 H new ATOM 1213 N LEU A 84 -3.162 12.098 3.744 1.00 10.00 N ATOM 1214 CA LEU A 84 -4.573 12.162 4.088 1.00 10.00 C ATOM 1215 C LEU A 84 -4.732 12.001 5.601 1.00 10.00 C ATOM 1216 O LEU A 84 -5.839 12.103 6.127 1.00 10.00 O ATOM 1217 CB LEU A 84 -5.369 11.140 3.274 1.00 10.00 C ATOM 1218 CG LEU A 84 -6.804 11.536 2.920 1.00 10.00 C ATOM 1219 CD1 LEU A 84 -6.876 12.134 1.513 1.00 10.00 C ATOM 1220 CD2 LEU A 84 -7.758 10.352 3.089 1.00 10.00 C ATOM 0 H LEU A 84 -2.692 13.002 3.702 1.00 10.00 H new ATOM 0 HA LEU A 84 -4.986 13.136 3.825 1.00 10.00 H new ATOM 0 HB2 LEU A 84 -4.829 10.942 2.348 1.00 10.00 H new ATOM 0 HB3 LEU A 84 -5.398 10.204 3.832 1.00 10.00 H new ATOM 0 HG LEU A 84 -7.126 12.310 3.616 1.00 10.00 H new ATOM 0 HD11 LEU A 84 -7.907 12.407 1.286 1.00 10.00 H new ATOM 0 HD12 LEU A 84 -6.246 13.022 1.462 1.00 10.00 H new ATOM 0 HD13 LEU A 84 -6.527 11.400 0.787 1.00 10.00 H new ATOM 0 HD21 LEU A 84 -8.771 10.661 2.831 1.00 10.00 H new ATOM 0 HD22 LEU A 84 -7.448 9.539 2.433 1.00 10.00 H new ATOM 0 HD23 LEU A 84 -7.735 10.011 4.124 1.00 10.00 H new ATOM 1232 N GLY A 85 -3.608 11.754 6.259 1.00 10.00 N ATOM 1233 CA GLY A 85 -3.609 11.578 7.702 1.00 10.00 C ATOM 1234 C GLY A 85 -2.480 10.644 8.141 1.00 10.00 C ATOM 1235 O GLY A 85 -1.459 10.537 7.463 1.00 10.00 O ATOM 0 H GLY A 85 -2.691 11.672 5.820 1.00 10.00 H new ATOM 0 HA2 GLY A 85 -3.496 12.546 8.190 1.00 10.00 H new ATOM 0 HA3 GLY A 85 -4.568 11.170 8.022 1.00 10.00 H new ATOM 1239 N ASN A 86 -2.702 9.991 9.273 1.00 10.00 N ATOM 1240 CA ASN A 86 -1.716 9.070 9.811 1.00 10.00 C ATOM 1241 C ASN A 86 -2.344 7.681 9.947 1.00 10.00 C ATOM 1242 O ASN A 86 -3.566 7.550 9.997 1.00 10.00 O ATOM 1243 CB ASN A 86 -1.245 9.514 11.197 1.00 10.00 C ATOM 1244 CG ASN A 86 -2.432 9.731 12.136 1.00 10.00 C ATOM 1245 OD1 ASN A 86 -3.585 9.581 11.766 1.00 10.00 O ATOM 1246 ND2 ASN A 86 -2.088 10.092 13.369 1.00 10.00 N ATOM 0 H ASN A 86 -3.550 10.082 9.832 1.00 10.00 H new ATOM 0 HA ASN A 86 -0.865 9.052 9.130 1.00 10.00 H new ATOM 0 HB2 ASN A 86 -0.578 8.761 11.617 1.00 10.00 H new ATOM 0 HB3 ASN A 86 -0.671 10.437 11.112 1.00 10.00 H new ATOM 0 HD21 ASN A 86 -2.809 10.261 14.071 1.00 10.00 H new ATOM 0 HD22 ASN A 86 -1.103 10.200 13.613 1.00 10.00 H new ATOM 1253 N VAL A 87 -1.479 6.679 10.005 1.00 10.00 N ATOM 1254 CA VAL A 87 -1.933 5.305 10.136 1.00 10.00 C ATOM 1255 C VAL A 87 -1.497 4.755 11.495 1.00 10.00 C ATOM 1256 O VAL A 87 -1.077 5.511 12.369 1.00 10.00 O ATOM 1257 CB VAL A 87 -1.420 4.470 8.961 1.00 10.00 C ATOM 1258 CG1 VAL A 87 -1.864 5.072 7.626 1.00 10.00 C ATOM 1259 CG2 VAL A 87 0.101 4.322 9.016 1.00 10.00 C ATOM 0 H VAL A 87 -0.466 6.791 9.964 1.00 10.00 H new ATOM 0 HA VAL A 87 -3.021 5.258 10.101 1.00 10.00 H new ATOM 0 HB VAL A 87 -1.856 3.474 9.042 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -1.486 4.460 6.807 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -2.953 5.102 7.585 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -1.470 6.084 7.534 1.00 10.00 H new ATOM 0 HG21 VAL A 87 0.439 3.724 8.170 1.00 10.00 H new ATOM 0 HG22 VAL A 87 0.564 5.308 8.972 1.00 10.00 H new ATOM 0 HG23 VAL A 87 0.385 3.828 9.945 1.00 10.00 H new ATOM 1269 N THR A 88 -1.612 3.442 11.631 1.00 10.00 N ATOM 1270 CA THR A 88 -1.234 2.782 12.869 1.00 10.00 C ATOM 1271 C THR A 88 -0.893 1.313 12.608 1.00 10.00 C ATOM 1272 O THR A 88 -1.460 0.690 11.711 1.00 10.00 O ATOM 1273 CB THR A 88 -2.374 2.972 13.873 1.00 10.00 C ATOM 1274 OG1 THR A 88 -2.428 4.381 14.074 1.00 10.00 O ATOM 1275 CG2 THR A 88 -2.036 2.411 15.255 1.00 10.00 C ATOM 0 H THR A 88 -1.962 2.818 10.904 1.00 10.00 H new ATOM 0 HA THR A 88 -0.331 3.222 13.292 1.00 10.00 H new ATOM 0 HB THR A 88 -3.275 2.488 13.495 1.00 10.00 H new ATOM 0 HG1 THR A 88 -1.604 4.791 13.737 1.00 10.00 H new ATOM 0 HG21 THR A 88 -2.878 2.572 15.929 1.00 10.00 H new ATOM 0 HG22 THR A 88 -1.834 1.343 15.175 1.00 10.00 H new ATOM 0 HG23 THR A 88 -1.155 2.918 15.648 1.00 10.00 H new ATOM 1283 N ALA A 89 0.032 0.803 13.408 1.00 10.00 N ATOM 1284 CA ALA A 89 0.455 -0.581 13.274 1.00 10.00 C ATOM 1285 C ALA A 89 -0.489 -1.478 14.078 1.00 10.00 C ATOM 1286 O ALA A 89 -1.379 -0.987 14.770 1.00 10.00 O ATOM 1287 CB ALA A 89 1.911 -0.715 13.724 1.00 10.00 C ATOM 0 H ALA A 89 0.500 1.323 14.151 1.00 10.00 H new ATOM 0 HA ALA A 89 0.405 -0.899 12.233 1.00 10.00 H new ATOM 0 HB1 ALA A 89 2.229 -1.753 13.624 1.00 10.00 H new ATOM 0 HB2 ALA A 89 2.544 -0.080 13.103 1.00 10.00 H new ATOM 0 HB3 ALA A 89 2.000 -0.408 14.766 1.00 10.00 H new ATOM 1293 N ASP A 90 -0.261 -2.778 13.959 1.00 10.00 N ATOM 1294 CA ASP A 90 -1.080 -3.748 14.666 1.00 10.00 C ATOM 1295 C ASP A 90 -0.649 -3.801 16.133 1.00 10.00 C ATOM 1296 O ASP A 90 -1.074 -2.975 16.938 1.00 10.00 O ATOM 1297 CB ASP A 90 -0.910 -5.148 14.073 1.00 10.00 C ATOM 1298 CG ASP A 90 -1.463 -6.287 14.933 1.00 10.00 C ATOM 1299 OD1 ASP A 90 -2.704 -6.352 15.059 1.00 10.00 O ATOM 1300 OD2 ASP A 90 -0.630 -7.066 15.445 1.00 10.00 O ATOM 0 H ASP A 90 0.478 -3.182 13.384 1.00 10.00 H new ATOM 0 HA ASP A 90 -2.122 -3.441 14.574 1.00 10.00 H new ATOM 0 HB2 ASP A 90 -1.401 -5.176 13.100 1.00 10.00 H new ATOM 0 HB3 ASP A 90 0.151 -5.326 13.900 1.00 10.00 H new ATOM 1305 N LYS A 91 0.190 -4.781 16.435 1.00 10.00 N ATOM 1306 CA LYS A 91 0.683 -4.953 17.791 1.00 10.00 C ATOM 1307 C LYS A 91 2.173 -5.296 17.747 1.00 10.00 C ATOM 1308 O LYS A 91 2.755 -5.679 18.761 1.00 10.00 O ATOM 1309 CB LYS A 91 -0.164 -5.982 18.543 1.00 10.00 C ATOM 1310 CG LYS A 91 -1.657 -5.712 18.348 1.00 10.00 C ATOM 1311 CD LYS A 91 -2.462 -6.174 19.564 1.00 10.00 C ATOM 1312 CE LYS A 91 -2.850 -7.648 19.436 1.00 10.00 C ATOM 1313 NZ LYS A 91 -3.625 -8.084 20.619 1.00 10.00 N ATOM 0 H LYS A 91 0.541 -5.464 15.764 1.00 10.00 H new ATOM 0 HA LYS A 91 0.586 -4.024 18.353 1.00 10.00 H new ATOM 0 HB2 LYS A 91 0.077 -6.985 18.189 1.00 10.00 H new ATOM 0 HB3 LYS A 91 0.079 -5.952 19.605 1.00 10.00 H new ATOM 0 HG2 LYS A 91 -1.819 -4.647 18.184 1.00 10.00 H new ATOM 0 HG3 LYS A 91 -2.010 -6.229 17.456 1.00 10.00 H new ATOM 0 HD2 LYS A 91 -1.875 -6.026 20.471 1.00 10.00 H new ATOM 0 HD3 LYS A 91 -3.361 -5.565 19.663 1.00 10.00 H new ATOM 0 HE2 LYS A 91 -3.440 -7.798 18.532 1.00 10.00 H new ATOM 0 HE3 LYS A 91 -1.953 -8.259 19.336 1.00 10.00 H new ATOM 0 HZ1 LYS A 91 -3.881 -9.087 20.516 1.00 10.00 H new ATOM 0 HZ2 LYS A 91 -3.049 -7.959 21.476 1.00 10.00 H new ATOM 0 HZ3 LYS A 91 -4.490 -7.513 20.697 1.00 10.00 H new ATOM 1327 N ASP A 92 2.748 -5.147 16.563 1.00 10.00 N ATOM 1328 CA ASP A 92 4.159 -5.437 16.374 1.00 10.00 C ATOM 1329 C ASP A 92 4.685 -4.632 15.184 1.00 10.00 C ATOM 1330 O ASP A 92 5.673 -5.015 14.559 1.00 10.00 O ATOM 1331 CB ASP A 92 4.382 -6.921 16.077 1.00 10.00 C ATOM 1332 CG ASP A 92 5.058 -7.711 17.199 1.00 10.00 C ATOM 1333 OD1 ASP A 92 4.322 -8.140 18.114 1.00 10.00 O ATOM 1334 OD2 ASP A 92 6.295 -7.868 17.117 1.00 10.00 O ATOM 0 H ASP A 92 2.262 -4.829 15.724 1.00 10.00 H new ATOM 0 HA ASP A 92 4.684 -5.171 17.291 1.00 10.00 H new ATOM 0 HB2 ASP A 92 3.418 -7.381 15.859 1.00 10.00 H new ATOM 0 HB3 ASP A 92 4.988 -7.008 15.175 1.00 10.00 H new ATOM 1339 N GLY A 93 4.002 -3.531 14.906 1.00 10.00 N ATOM 1340 CA GLY A 93 4.389 -2.669 13.802 1.00 10.00 C ATOM 1341 C GLY A 93 3.618 -3.028 12.530 1.00 10.00 C ATOM 1342 O GLY A 93 3.243 -2.148 11.758 1.00 10.00 O ATOM 0 H GLY A 93 3.183 -3.216 15.426 1.00 10.00 H new ATOM 0 HA2 GLY A 93 4.200 -1.628 14.065 1.00 10.00 H new ATOM 0 HA3 GLY A 93 5.460 -2.762 13.621 1.00 10.00 H new ATOM 1346 N VAL A 94 3.405 -4.324 12.352 1.00 10.00 N ATOM 1347 CA VAL A 94 2.685 -4.811 11.187 1.00 10.00 C ATOM 1348 C VAL A 94 1.498 -3.888 10.904 1.00 10.00 C ATOM 1349 O VAL A 94 0.465 -3.980 11.565 1.00 10.00 O ATOM 1350 CB VAL A 94 2.273 -6.269 11.398 1.00 10.00 C ATOM 1351 CG1 VAL A 94 1.368 -6.752 10.263 1.00 10.00 C ATOM 1352 CG2 VAL A 94 3.500 -7.170 11.543 1.00 10.00 C ATOM 0 H VAL A 94 3.718 -5.051 12.995 1.00 10.00 H new ATOM 0 HA VAL A 94 3.327 -4.794 10.306 1.00 10.00 H new ATOM 0 HB VAL A 94 1.705 -6.326 12.327 1.00 10.00 H new ATOM 0 HG11 VAL A 94 1.089 -7.791 10.437 1.00 10.00 H new ATOM 0 HG12 VAL A 94 0.469 -6.136 10.227 1.00 10.00 H new ATOM 0 HG13 VAL A 94 1.900 -6.673 9.315 1.00 10.00 H new ATOM 0 HG21 VAL A 94 3.179 -8.201 11.692 1.00 10.00 H new ATOM 0 HG22 VAL A 94 4.107 -7.106 10.640 1.00 10.00 H new ATOM 0 HG23 VAL A 94 4.090 -6.846 12.401 1.00 10.00 H new ATOM 1362 N ALA A 95 1.685 -3.020 9.920 1.00 10.00 N ATOM 1363 CA ALA A 95 0.642 -2.082 9.542 1.00 10.00 C ATOM 1364 C ALA A 95 -0.082 -2.605 8.300 1.00 10.00 C ATOM 1365 O ALA A 95 0.517 -2.727 7.232 1.00 10.00 O ATOM 1366 CB ALA A 95 1.256 -0.699 9.319 1.00 10.00 C ATOM 0 H ALA A 95 2.543 -2.947 9.373 1.00 10.00 H new ATOM 0 HA ALA A 95 -0.096 -1.987 10.339 1.00 10.00 H new ATOM 0 HB1 ALA A 95 0.474 0.005 9.035 1.00 10.00 H new ATOM 0 HB2 ALA A 95 1.733 -0.360 10.239 1.00 10.00 H new ATOM 0 HB3 ALA A 95 1.999 -0.755 8.524 1.00 10.00 H new ATOM 1372 N ASP A 96 -1.361 -2.900 8.480 1.00 10.00 N ATOM 1373 CA ASP A 96 -2.174 -3.408 7.387 1.00 10.00 C ATOM 1374 C ASP A 96 -3.148 -2.319 6.934 1.00 10.00 C ATOM 1375 O ASP A 96 -3.567 -1.483 7.734 1.00 10.00 O ATOM 1376 CB ASP A 96 -2.993 -4.622 7.827 1.00 10.00 C ATOM 1377 CG ASP A 96 -4.250 -4.296 8.637 1.00 10.00 C ATOM 1378 OD1 ASP A 96 -4.118 -3.501 9.593 1.00 10.00 O ATOM 1379 OD2 ASP A 96 -5.313 -4.847 8.281 1.00 10.00 O ATOM 0 H ASP A 96 -1.855 -2.797 9.367 1.00 10.00 H new ATOM 0 HA ASP A 96 -1.506 -3.699 6.577 1.00 10.00 H new ATOM 0 HB2 ASP A 96 -3.286 -5.184 6.940 1.00 10.00 H new ATOM 0 HB3 ASP A 96 -2.355 -5.275 8.422 1.00 10.00 H new ATOM 1384 N VAL A 97 -3.481 -2.363 5.652 1.00 10.00 N ATOM 1385 CA VAL A 97 -4.399 -1.391 5.083 1.00 10.00 C ATOM 1386 C VAL A 97 -5.559 -2.125 4.409 1.00 10.00 C ATOM 1387 O VAL A 97 -5.484 -3.331 4.175 1.00 10.00 O ATOM 1388 CB VAL A 97 -3.648 -0.458 4.131 1.00 10.00 C ATOM 1389 CG1 VAL A 97 -4.607 0.526 3.458 1.00 10.00 C ATOM 1390 CG2 VAL A 97 -2.526 0.283 4.861 1.00 10.00 C ATOM 0 H VAL A 97 -3.131 -3.057 4.991 1.00 10.00 H new ATOM 0 HA VAL A 97 -4.824 -0.762 5.866 1.00 10.00 H new ATOM 0 HB VAL A 97 -3.194 -1.070 3.352 1.00 10.00 H new ATOM 0 HG11 VAL A 97 -4.048 1.178 2.787 1.00 10.00 H new ATOM 0 HG12 VAL A 97 -5.354 -0.026 2.888 1.00 10.00 H new ATOM 0 HG13 VAL A 97 -5.103 1.129 4.219 1.00 10.00 H new ATOM 0 HG21 VAL A 97 -2.008 0.939 4.162 1.00 10.00 H new ATOM 0 HG22 VAL A 97 -2.949 0.877 5.671 1.00 10.00 H new ATOM 0 HG23 VAL A 97 -1.820 -0.439 5.271 1.00 10.00 H new ATOM 1400 N SER A 98 -6.606 -1.368 4.114 1.00 10.00 N ATOM 1401 CA SER A 98 -7.780 -1.931 3.471 1.00 10.00 C ATOM 1402 C SER A 98 -8.784 -0.822 3.150 1.00 10.00 C ATOM 1403 O SER A 98 -9.603 -0.459 3.993 1.00 10.00 O ATOM 1404 CB SER A 98 -8.432 -2.998 4.353 1.00 10.00 C ATOM 1405 OG SER A 98 -8.654 -2.531 5.681 1.00 10.00 O ATOM 0 H SER A 98 -6.665 -0.369 4.309 1.00 10.00 H new ATOM 0 HA SER A 98 -7.466 -2.407 2.542 1.00 10.00 H new ATOM 0 HB2 SER A 98 -9.381 -3.302 3.912 1.00 10.00 H new ATOM 0 HB3 SER A 98 -7.796 -3.883 4.382 1.00 10.00 H new ATOM 0 HG SER A 98 -9.092 -1.655 5.651 1.00 10.00 H new ATOM 1411 N ILE A 99 -8.687 -0.315 1.930 1.00 10.00 N ATOM 1412 CA ILE A 99 -9.577 0.745 1.488 1.00 10.00 C ATOM 1413 C ILE A 99 -10.100 0.416 0.088 1.00 10.00 C ATOM 1414 O ILE A 99 -9.446 -0.299 -0.670 1.00 10.00 O ATOM 1415 CB ILE A 99 -8.878 2.104 1.579 1.00 10.00 C ATOM 1416 CG1 ILE A 99 -8.489 2.424 3.023 1.00 10.00 C ATOM 1417 CG2 ILE A 99 -9.739 3.206 0.959 1.00 10.00 C ATOM 1418 CD1 ILE A 99 -7.241 3.308 3.072 1.00 10.00 C ATOM 0 H ILE A 99 -8.006 -0.618 1.234 1.00 10.00 H new ATOM 0 HA ILE A 99 -10.444 0.813 2.145 1.00 10.00 H new ATOM 0 HB ILE A 99 -7.955 2.053 1.001 1.00 10.00 H new ATOM 0 HG12 ILE A 99 -9.316 2.928 3.523 1.00 10.00 H new ATOM 0 HG13 ILE A 99 -8.305 1.498 3.567 1.00 10.00 H new ATOM 0 HG21 ILE A 99 -9.219 4.161 1.037 1.00 10.00 H new ATOM 0 HG22 ILE A 99 -9.922 2.977 -0.091 1.00 10.00 H new ATOM 0 HG23 ILE A 99 -10.690 3.266 1.489 1.00 10.00 H new ATOM 0 HD11 ILE A 99 -6.986 3.521 4.110 1.00 10.00 H new ATOM 0 HD12 ILE A 99 -6.410 2.791 2.593 1.00 10.00 H new ATOM 0 HD13 ILE A 99 -7.437 4.243 2.548 1.00 10.00 H new ATOM 1430 N GLU A 100 -11.274 0.952 -0.211 1.00 10.00 N ATOM 1431 CA GLU A 100 -11.892 0.724 -1.506 1.00 10.00 C ATOM 1432 C GLU A 100 -12.385 2.045 -2.100 1.00 10.00 C ATOM 1433 O GLU A 100 -13.524 2.448 -1.867 1.00 10.00 O ATOM 1434 CB GLU A 100 -13.034 -0.289 -1.398 1.00 10.00 C ATOM 1435 CG GLU A 100 -13.577 -0.653 -2.781 1.00 10.00 C ATOM 1436 CD GLU A 100 -15.094 -0.851 -2.740 1.00 10.00 C ATOM 1437 OE1 GLU A 100 -15.754 -0.039 -2.056 1.00 10.00 O ATOM 1438 OE2 GLU A 100 -15.559 -1.810 -3.394 1.00 10.00 O ATOM 0 H GLU A 100 -11.814 1.543 0.421 1.00 10.00 H new ATOM 0 HA GLU A 100 -11.141 0.305 -2.176 1.00 10.00 H new ATOM 0 HB2 GLU A 100 -12.680 -1.188 -0.894 1.00 10.00 H new ATOM 0 HB3 GLU A 100 -13.835 0.125 -0.786 1.00 10.00 H new ATOM 0 HG2 GLU A 100 -13.329 0.135 -3.492 1.00 10.00 H new ATOM 0 HG3 GLU A 100 -13.097 -1.565 -3.136 1.00 10.00 H new ATOM 1445 N ASP A 101 -11.503 2.683 -2.855 1.00 10.00 N ATOM 1446 CA ASP A 101 -11.834 3.951 -3.483 1.00 10.00 C ATOM 1447 C ASP A 101 -12.305 3.697 -4.917 1.00 10.00 C ATOM 1448 O ASP A 101 -12.021 2.646 -5.491 1.00 10.00 O ATOM 1449 CB ASP A 101 -10.614 4.872 -3.543 1.00 10.00 C ATOM 1450 CG ASP A 101 -10.174 5.449 -2.196 1.00 10.00 C ATOM 1451 OD1 ASP A 101 -11.065 5.634 -1.339 1.00 10.00 O ATOM 1452 OD2 ASP A 101 -8.956 5.693 -2.054 1.00 10.00 O ATOM 0 H ASP A 101 -10.560 2.346 -3.046 1.00 10.00 H new ATOM 0 HA ASP A 101 -12.616 4.426 -2.890 1.00 10.00 H new ATOM 0 HB2 ASP A 101 -9.780 4.318 -3.974 1.00 10.00 H new ATOM 0 HB3 ASP A 101 -10.833 5.697 -4.221 1.00 10.00 H new ATOM 1457 N SER A 102 -13.017 4.676 -5.455 1.00 10.00 N ATOM 1458 CA SER A 102 -13.529 4.572 -6.810 1.00 10.00 C ATOM 1459 C SER A 102 -13.360 5.907 -7.538 1.00 10.00 C ATOM 1460 O SER A 102 -13.933 6.113 -8.607 1.00 10.00 O ATOM 1461 CB SER A 102 -15.000 4.150 -6.812 1.00 10.00 C ATOM 1462 OG SER A 102 -15.606 4.320 -5.534 1.00 10.00 O ATOM 0 H SER A 102 -13.251 5.546 -4.976 1.00 10.00 H new ATOM 0 HA SER A 102 -12.957 3.805 -7.333 1.00 10.00 H new ATOM 0 HB2 SER A 102 -15.544 4.736 -7.552 1.00 10.00 H new ATOM 0 HB3 SER A 102 -15.077 3.105 -7.114 1.00 10.00 H new ATOM 0 HG SER A 102 -16.545 4.041 -5.577 1.00 10.00 H new ATOM 1468 N VAL A 103 -12.570 6.780 -6.929 1.00 10.00 N ATOM 1469 CA VAL A 103 -12.318 8.090 -7.506 1.00 10.00 C ATOM 1470 C VAL A 103 -10.991 8.060 -8.268 1.00 10.00 C ATOM 1471 O VAL A 103 -10.887 8.612 -9.362 1.00 10.00 O ATOM 1472 CB VAL A 103 -12.356 9.159 -6.413 1.00 10.00 C ATOM 1473 CG1 VAL A 103 -11.820 10.495 -6.933 1.00 10.00 C ATOM 1474 CG2 VAL A 103 -13.769 9.318 -5.849 1.00 10.00 C ATOM 0 H VAL A 103 -12.096 6.606 -6.043 1.00 10.00 H new ATOM 0 HA VAL A 103 -13.098 8.349 -8.222 1.00 10.00 H new ATOM 0 HB VAL A 103 -11.707 8.830 -5.602 1.00 10.00 H new ATOM 0 HG11 VAL A 103 -11.858 11.237 -6.136 1.00 10.00 H new ATOM 0 HG12 VAL A 103 -10.789 10.370 -7.263 1.00 10.00 H new ATOM 0 HG13 VAL A 103 -12.431 10.831 -7.771 1.00 10.00 H new ATOM 0 HG21 VAL A 103 -13.767 10.084 -5.074 1.00 10.00 H new ATOM 0 HG22 VAL A 103 -14.449 9.612 -6.649 1.00 10.00 H new ATOM 0 HG23 VAL A 103 -14.099 8.371 -5.422 1.00 10.00 H new ATOM 1484 N ILE A 104 -10.011 7.410 -7.659 1.00 10.00 N ATOM 1485 CA ILE A 104 -8.695 7.301 -8.266 1.00 10.00 C ATOM 1486 C ILE A 104 -8.729 6.229 -9.357 1.00 10.00 C ATOM 1487 O ILE A 104 -9.781 5.656 -9.637 1.00 10.00 O ATOM 1488 CB ILE A 104 -7.630 7.056 -7.196 1.00 10.00 C ATOM 1489 CG1 ILE A 104 -7.508 5.564 -6.875 1.00 10.00 C ATOM 1490 CG2 ILE A 104 -7.907 7.890 -5.944 1.00 10.00 C ATOM 1491 CD1 ILE A 104 -8.872 4.965 -6.529 1.00 10.00 C ATOM 0 H ILE A 104 -10.101 6.953 -6.751 1.00 10.00 H new ATOM 0 HA ILE A 104 -8.419 8.239 -8.748 1.00 10.00 H new ATOM 0 HB ILE A 104 -6.668 7.381 -7.592 1.00 10.00 H new ATOM 0 HG12 ILE A 104 -7.082 5.038 -7.729 1.00 10.00 H new ATOM 0 HG13 ILE A 104 -6.822 5.423 -6.040 1.00 10.00 H new ATOM 0 HG21 ILE A 104 -7.135 7.696 -5.200 1.00 10.00 H new ATOM 0 HG22 ILE A 104 -7.903 8.949 -6.204 1.00 10.00 H new ATOM 0 HG23 ILE A 104 -8.881 7.620 -5.535 1.00 10.00 H new ATOM 0 HD11 ILE A 104 -8.757 3.904 -6.305 1.00 10.00 H new ATOM 0 HD12 ILE A 104 -9.284 5.477 -5.659 1.00 10.00 H new ATOM 0 HD13 ILE A 104 -9.548 5.086 -7.376 1.00 10.00 H new ATOM 1503 N SER A 105 -7.565 5.991 -9.945 1.00 10.00 N ATOM 1504 CA SER A 105 -7.449 4.999 -10.999 1.00 10.00 C ATOM 1505 C SER A 105 -5.980 4.619 -11.201 1.00 10.00 C ATOM 1506 O SER A 105 -5.091 5.453 -11.032 1.00 10.00 O ATOM 1507 CB SER A 105 -8.048 5.513 -12.309 1.00 10.00 C ATOM 1508 OG SER A 105 -7.927 4.561 -13.362 1.00 10.00 O ATOM 0 H SER A 105 -6.695 6.469 -9.711 1.00 10.00 H new ATOM 0 HA SER A 105 -8.009 4.114 -10.698 1.00 10.00 H new ATOM 0 HB2 SER A 105 -9.100 5.753 -12.157 1.00 10.00 H new ATOM 0 HB3 SER A 105 -7.549 6.438 -12.598 1.00 10.00 H new ATOM 0 HG SER A 105 -8.323 4.927 -14.181 1.00 10.00 H new ATOM 1514 N LEU A 106 -5.771 3.361 -11.558 1.00 10.00 N ATOM 1515 CA LEU A 106 -4.425 2.861 -11.785 1.00 10.00 C ATOM 1516 C LEU A 106 -3.785 3.637 -12.938 1.00 10.00 C ATOM 1517 O LEU A 106 -2.611 3.998 -12.871 1.00 10.00 O ATOM 1518 CB LEU A 106 -4.445 1.346 -11.999 1.00 10.00 C ATOM 1519 CG LEU A 106 -4.717 0.497 -10.756 1.00 10.00 C ATOM 1520 CD1 LEU A 106 -3.888 0.984 -9.566 1.00 10.00 C ATOM 1521 CD2 LEU A 106 -6.213 0.459 -10.434 1.00 10.00 C ATOM 0 H LEU A 106 -6.511 2.672 -11.696 1.00 10.00 H new ATOM 0 HA LEU A 106 -3.804 3.027 -10.905 1.00 10.00 H new ATOM 0 HB2 LEU A 106 -5.204 1.115 -12.746 1.00 10.00 H new ATOM 0 HB3 LEU A 106 -3.484 1.045 -12.417 1.00 10.00 H new ATOM 0 HG LEU A 106 -4.406 -0.526 -10.968 1.00 10.00 H new ATOM 0 HD11 LEU A 106 -4.101 0.363 -8.696 1.00 10.00 H new ATOM 0 HD12 LEU A 106 -2.828 0.917 -9.809 1.00 10.00 H new ATOM 0 HD13 LEU A 106 -4.144 2.020 -9.344 1.00 10.00 H new ATOM 0 HD21 LEU A 106 -6.379 -0.151 -9.546 1.00 10.00 H new ATOM 0 HD22 LEU A 106 -6.571 1.472 -10.250 1.00 10.00 H new ATOM 0 HD23 LEU A 106 -6.756 0.029 -11.276 1.00 10.00 H new ATOM 1533 N SER A 107 -4.584 3.870 -13.968 1.00 10.00 N ATOM 1534 CA SER A 107 -4.110 4.596 -15.134 1.00 10.00 C ATOM 1535 C SER A 107 -5.286 5.271 -15.843 1.00 10.00 C ATOM 1536 O SER A 107 -5.860 4.709 -16.774 1.00 10.00 O ATOM 1537 CB SER A 107 -3.372 3.666 -16.099 1.00 10.00 C ATOM 1538 OG SER A 107 -2.069 4.150 -16.414 1.00 10.00 O ATOM 0 H SER A 107 -5.557 3.569 -14.020 1.00 10.00 H new ATOM 0 HA SER A 107 -3.408 5.360 -14.800 1.00 10.00 H new ATOM 0 HB2 SER A 107 -3.293 2.673 -15.657 1.00 10.00 H new ATOM 0 HB3 SER A 107 -3.952 3.561 -17.016 1.00 10.00 H new ATOM 0 HG SER A 107 -1.629 3.528 -17.031 1.00 10.00 H new ATOM 1544 N GLY A 108 -5.608 6.468 -15.376 1.00 10.00 N ATOM 1545 CA GLY A 108 -6.705 7.227 -15.954 1.00 10.00 C ATOM 1546 C GLY A 108 -6.495 8.730 -15.759 1.00 10.00 C ATOM 1547 O GLY A 108 -5.542 9.301 -16.286 1.00 10.00 O ATOM 0 H GLY A 108 -5.129 6.931 -14.604 1.00 10.00 H new ATOM 0 HA2 GLY A 108 -6.786 7.003 -17.018 1.00 10.00 H new ATOM 0 HA3 GLY A 108 -7.645 6.925 -15.492 1.00 10.00 H new ATOM 1551 N ASP A 109 -7.401 9.327 -14.999 1.00 10.00 N ATOM 1552 CA ASP A 109 -7.327 10.753 -14.728 1.00 10.00 C ATOM 1553 C ASP A 109 -6.657 10.975 -13.370 1.00 10.00 C ATOM 1554 O ASP A 109 -6.602 12.101 -12.878 1.00 10.00 O ATOM 1555 CB ASP A 109 -8.723 11.376 -14.673 1.00 10.00 C ATOM 1556 CG ASP A 109 -8.819 12.797 -15.233 1.00 10.00 C ATOM 1557 OD1 ASP A 109 -7.793 13.507 -15.159 1.00 10.00 O ATOM 1558 OD2 ASP A 109 -9.917 13.142 -15.721 1.00 10.00 O ATOM 0 H ASP A 109 -8.190 8.850 -14.562 1.00 10.00 H new ATOM 0 HA ASP A 109 -6.755 11.220 -15.530 1.00 10.00 H new ATOM 0 HB2 ASP A 109 -9.412 10.737 -15.225 1.00 10.00 H new ATOM 0 HB3 ASP A 109 -9.059 11.387 -13.636 1.00 10.00 H new ATOM 1563 N HIS A 110 -6.164 9.884 -12.804 1.00 10.00 N ATOM 1564 CA HIS A 110 -5.500 9.945 -11.513 1.00 10.00 C ATOM 1565 C HIS A 110 -4.179 9.176 -11.579 1.00 10.00 C ATOM 1566 O HIS A 110 -3.143 9.675 -11.142 1.00 10.00 O ATOM 1567 CB HIS A 110 -6.424 9.443 -10.402 1.00 10.00 C ATOM 1568 CG HIS A 110 -7.557 10.386 -10.073 1.00 10.00 C ATOM 1569 ND1 HIS A 110 -8.645 10.570 -10.908 1.00 10.00 N ATOM 1570 CD2 HIS A 110 -7.760 11.193 -8.992 1.00 10.00 C ATOM 1571 CE1 HIS A 110 -9.459 11.451 -10.346 1.00 10.00 C ATOM 1572 NE2 HIS A 110 -8.908 11.837 -9.159 1.00 10.00 N ATOM 0 H HIS A 110 -6.211 8.952 -13.216 1.00 10.00 H new ATOM 0 HA HIS A 110 -5.265 10.981 -11.269 1.00 10.00 H new ATOM 0 HB2 HIS A 110 -6.840 8.480 -10.697 1.00 10.00 H new ATOM 0 HB3 HIS A 110 -5.834 9.272 -9.502 1.00 10.00 H new ATOM 0 HD2 HIS A 110 -7.098 11.291 -8.144 1.00 10.00 H new ATOM 0 HE1 HIS A 110 -10.395 11.802 -10.756 1.00 10.00 H new ATOM 0 HE2 HIS A 110 -9.312 12.510 -8.507 1.00 10.00 H new ATOM 1580 N SER A 111 -4.258 7.973 -12.127 1.00 10.00 N ATOM 1581 CA SER A 111 -3.082 7.129 -12.256 1.00 10.00 C ATOM 1582 C SER A 111 -2.376 7.007 -10.904 1.00 10.00 C ATOM 1583 O SER A 111 -1.472 7.782 -10.599 1.00 10.00 O ATOM 1584 CB SER A 111 -2.120 7.683 -13.308 1.00 10.00 C ATOM 1585 OG SER A 111 -1.739 9.027 -13.030 1.00 10.00 O ATOM 0 H SER A 111 -5.119 7.562 -12.487 1.00 10.00 H new ATOM 0 HA SER A 111 -3.404 6.140 -12.582 1.00 10.00 H new ATOM 0 HB2 SER A 111 -1.230 7.056 -13.351 1.00 10.00 H new ATOM 0 HB3 SER A 111 -2.591 7.636 -14.290 1.00 10.00 H new ATOM 0 HG SER A 111 -1.767 9.182 -12.063 1.00 10.00 H new ATOM 1591 N ILE A 112 -2.817 6.026 -10.129 1.00 10.00 N ATOM 1592 CA ILE A 112 -2.239 5.792 -8.817 1.00 10.00 C ATOM 1593 C ILE A 112 -1.050 4.837 -8.951 1.00 10.00 C ATOM 1594 O ILE A 112 -0.344 4.580 -7.977 1.00 10.00 O ATOM 1595 CB ILE A 112 -3.310 5.307 -7.838 1.00 10.00 C ATOM 1596 CG1 ILE A 112 -3.812 3.914 -8.221 1.00 10.00 C ATOM 1597 CG2 ILE A 112 -4.452 6.319 -7.730 1.00 10.00 C ATOM 1598 CD1 ILE A 112 -4.742 3.350 -7.144 1.00 10.00 C ATOM 0 H ILE A 112 -3.568 5.385 -10.385 1.00 10.00 H new ATOM 0 HA ILE A 112 -1.856 6.723 -8.398 1.00 10.00 H new ATOM 0 HB ILE A 112 -2.858 5.225 -6.849 1.00 10.00 H new ATOM 0 HG12 ILE A 112 -4.340 3.963 -9.173 1.00 10.00 H new ATOM 0 HG13 ILE A 112 -2.964 3.244 -8.361 1.00 10.00 H new ATOM 0 HG21 ILE A 112 -5.200 5.950 -7.028 1.00 10.00 H new ATOM 0 HG22 ILE A 112 -4.061 7.273 -7.376 1.00 10.00 H new ATOM 0 HG23 ILE A 112 -4.910 6.456 -8.709 1.00 10.00 H new ATOM 0 HD11 ILE A 112 -5.084 2.359 -7.442 1.00 10.00 H new ATOM 0 HD12 ILE A 112 -4.204 3.279 -6.199 1.00 10.00 H new ATOM 0 HD13 ILE A 112 -5.601 4.010 -7.023 1.00 10.00 H new ATOM 1610 N ILE A 113 -0.867 4.338 -10.164 1.00 10.00 N ATOM 1611 CA ILE A 113 0.223 3.417 -10.438 1.00 10.00 C ATOM 1612 C ILE A 113 1.548 4.071 -10.042 1.00 10.00 C ATOM 1613 O ILE A 113 1.967 5.053 -10.653 1.00 10.00 O ATOM 1614 CB ILE A 113 0.178 2.952 -11.895 1.00 10.00 C ATOM 1615 CG1 ILE A 113 -0.965 1.959 -12.118 1.00 10.00 C ATOM 1616 CG2 ILE A 113 1.528 2.378 -12.329 1.00 10.00 C ATOM 1617 CD1 ILE A 113 -0.617 0.584 -11.543 1.00 10.00 C ATOM 0 H ILE A 113 -1.455 4.554 -10.969 1.00 10.00 H new ATOM 0 HA ILE A 113 0.120 2.514 -9.836 1.00 10.00 H new ATOM 0 HB ILE A 113 -0.021 3.819 -12.525 1.00 10.00 H new ATOM 0 HG12 ILE A 113 -1.874 2.334 -11.648 1.00 10.00 H new ATOM 0 HG13 ILE A 113 -1.171 1.870 -13.185 1.00 10.00 H new ATOM 0 HG21 ILE A 113 1.469 2.055 -13.368 1.00 10.00 H new ATOM 0 HG22 ILE A 113 2.298 3.144 -12.230 1.00 10.00 H new ATOM 0 HG23 ILE A 113 1.781 1.526 -11.698 1.00 10.00 H new ATOM 0 HD11 ILE A 113 -1.446 -0.103 -11.715 1.00 10.00 H new ATOM 0 HD12 ILE A 113 0.279 0.201 -12.032 1.00 10.00 H new ATOM 0 HD13 ILE A 113 -0.436 0.673 -10.472 1.00 10.00 H new ATOM 1629 N GLY A 114 2.172 3.500 -9.022 1.00 10.00 N ATOM 1630 CA GLY A 114 3.441 4.015 -8.537 1.00 10.00 C ATOM 1631 C GLY A 114 3.258 4.778 -7.223 1.00 10.00 C ATOM 1632 O GLY A 114 3.854 5.836 -7.027 1.00 10.00 O ATOM 0 H GLY A 114 1.822 2.685 -8.518 1.00 10.00 H new ATOM 0 HA2 GLY A 114 4.139 3.191 -8.389 1.00 10.00 H new ATOM 0 HA3 GLY A 114 3.880 4.674 -9.286 1.00 10.00 H new ATOM 1636 N ARG A 115 2.431 4.210 -6.357 1.00 10.00 N ATOM 1637 CA ARG A 115 2.162 4.823 -5.068 1.00 10.00 C ATOM 1638 C ARG A 115 3.249 4.442 -4.062 1.00 10.00 C ATOM 1639 O ARG A 115 2.993 3.696 -3.118 1.00 10.00 O ATOM 1640 CB ARG A 115 0.799 4.388 -4.525 1.00 10.00 C ATOM 1641 CG ARG A 115 -0.339 4.995 -5.348 1.00 10.00 C ATOM 1642 CD ARG A 115 -1.317 5.758 -4.452 1.00 10.00 C ATOM 1643 NE ARG A 115 -1.711 4.917 -3.301 1.00 10.00 N ATOM 1644 CZ ARG A 115 -2.209 5.398 -2.154 1.00 10.00 C ATOM 1645 NH1 ARG A 115 -2.377 6.718 -1.999 1.00 10.00 N ATOM 1646 NH2 ARG A 115 -2.539 4.560 -1.162 1.00 10.00 N ATOM 0 H ARG A 115 1.939 3.332 -6.523 1.00 10.00 H new ATOM 0 HA ARG A 115 2.156 5.904 -5.210 1.00 10.00 H new ATOM 0 HB2 ARG A 115 0.726 3.301 -4.544 1.00 10.00 H new ATOM 0 HB3 ARG A 115 0.704 4.696 -3.484 1.00 10.00 H new ATOM 0 HG2 ARG A 115 0.071 5.668 -6.101 1.00 10.00 H new ATOM 0 HG3 ARG A 115 -0.869 4.205 -5.881 1.00 10.00 H new ATOM 0 HD2 ARG A 115 -0.855 6.680 -4.098 1.00 10.00 H new ATOM 0 HD3 ARG A 115 -2.200 6.043 -5.024 1.00 10.00 H new ATOM 0 HE ARG A 115 -1.596 3.907 -3.386 1.00 10.00 H new ATOM 0 HH11 ARG A 115 -2.126 7.356 -2.754 1.00 10.00 H new ATOM 0 HH12 ARG A 115 -2.756 7.085 -1.126 1.00 10.00 H new ATOM 0 HH21 ARG A 115 -2.411 3.555 -1.280 1.00 10.00 H new ATOM 0 HH22 ARG A 115 -2.918 4.927 -0.289 1.00 10.00 H new ATOM 1660 N THR A 116 4.441 4.972 -4.298 1.00 10.00 N ATOM 1661 CA THR A 116 5.568 4.697 -3.424 1.00 10.00 C ATOM 1662 C THR A 116 5.291 5.223 -2.014 1.00 10.00 C ATOM 1663 O THR A 116 5.760 6.299 -1.645 1.00 10.00 O ATOM 1664 CB THR A 116 6.820 5.302 -4.063 1.00 10.00 C ATOM 1665 OG1 THR A 116 6.909 4.658 -5.330 1.00 10.00 O ATOM 1666 CG2 THR A 116 8.104 4.886 -3.343 1.00 10.00 C ATOM 0 H THR A 116 4.650 5.590 -5.082 1.00 10.00 H new ATOM 0 HA THR A 116 5.728 3.625 -3.311 1.00 10.00 H new ATOM 0 HB THR A 116 6.739 6.389 -4.062 1.00 10.00 H new ATOM 0 HG1 THR A 116 7.784 4.844 -5.731 1.00 10.00 H new ATOM 0 HG21 THR A 116 8.962 5.342 -3.836 1.00 10.00 H new ATOM 0 HG22 THR A 116 8.063 5.218 -2.306 1.00 10.00 H new ATOM 0 HG23 THR A 116 8.203 3.801 -3.373 1.00 10.00 H new ATOM 1674 N LEU A 117 4.530 4.440 -1.264 1.00 10.00 N ATOM 1675 CA LEU A 117 4.185 4.813 0.098 1.00 10.00 C ATOM 1676 C LEU A 117 5.408 4.627 0.998 1.00 10.00 C ATOM 1677 O LEU A 117 5.901 3.511 1.158 1.00 10.00 O ATOM 1678 CB LEU A 117 2.951 4.041 0.568 1.00 10.00 C ATOM 1679 CG LEU A 117 3.202 2.942 1.603 1.00 10.00 C ATOM 1680 CD1 LEU A 117 1.951 2.689 2.447 1.00 10.00 C ATOM 1681 CD2 LEU A 117 3.710 1.664 0.934 1.00 10.00 C ATOM 0 H LEU A 117 4.142 3.549 -1.573 1.00 10.00 H new ATOM 0 HA LEU A 117 3.910 5.867 0.147 1.00 10.00 H new ATOM 0 HB2 LEU A 117 2.240 4.752 0.988 1.00 10.00 H new ATOM 0 HB3 LEU A 117 2.475 3.591 -0.303 1.00 10.00 H new ATOM 0 HG LEU A 117 3.985 3.283 2.281 1.00 10.00 H new ATOM 0 HD11 LEU A 117 2.156 1.904 3.175 1.00 10.00 H new ATOM 0 HD12 LEU A 117 1.673 3.604 2.969 1.00 10.00 H new ATOM 0 HD13 LEU A 117 1.132 2.378 1.799 1.00 10.00 H new ATOM 0 HD21 LEU A 117 3.880 0.899 1.692 1.00 10.00 H new ATOM 0 HD22 LEU A 117 2.968 1.308 0.219 1.00 10.00 H new ATOM 0 HD23 LEU A 117 4.644 1.873 0.413 1.00 10.00 H new ATOM 1693 N VAL A 118 5.861 5.736 1.564 1.00 10.00 N ATOM 1694 CA VAL A 118 7.016 5.709 2.444 1.00 10.00 C ATOM 1695 C VAL A 118 6.583 6.098 3.859 1.00 10.00 C ATOM 1696 O VAL A 118 6.030 7.177 4.068 1.00 10.00 O ATOM 1697 CB VAL A 118 8.120 6.610 1.888 1.00 10.00 C ATOM 1698 CG1 VAL A 118 9.501 6.121 2.327 1.00 10.00 C ATOM 1699 CG2 VAL A 118 8.032 6.707 0.363 1.00 10.00 C ATOM 0 H VAL A 118 5.449 6.659 1.430 1.00 10.00 H new ATOM 0 HA VAL A 118 7.432 4.703 2.496 1.00 10.00 H new ATOM 0 HB VAL A 118 7.974 7.610 2.297 1.00 10.00 H new ATOM 0 HG11 VAL A 118 10.267 6.779 1.918 1.00 10.00 H new ATOM 0 HG12 VAL A 118 9.560 6.128 3.415 1.00 10.00 H new ATOM 0 HG13 VAL A 118 9.661 5.107 1.961 1.00 10.00 H new ATOM 0 HG21 VAL A 118 8.828 7.353 -0.007 1.00 10.00 H new ATOM 0 HG22 VAL A 118 8.140 5.713 -0.072 1.00 10.00 H new ATOM 0 HG23 VAL A 118 7.065 7.124 0.080 1.00 10.00 H new ATOM 1709 N VAL A 119 6.851 5.199 4.794 1.00 10.00 N ATOM 1710 CA VAL A 119 6.495 5.435 6.183 1.00 10.00 C ATOM 1711 C VAL A 119 7.574 6.296 6.842 1.00 10.00 C ATOM 1712 O VAL A 119 8.745 6.222 6.472 1.00 10.00 O ATOM 1713 CB VAL A 119 6.274 4.101 6.901 1.00 10.00 C ATOM 1714 CG1 VAL A 119 5.067 3.361 6.322 1.00 10.00 C ATOM 1715 CG2 VAL A 119 7.532 3.232 6.841 1.00 10.00 C ATOM 0 H VAL A 119 7.311 4.306 4.617 1.00 10.00 H new ATOM 0 HA VAL A 119 5.556 5.984 6.248 1.00 10.00 H new ATOM 0 HB VAL A 119 6.064 4.314 7.949 1.00 10.00 H new ATOM 0 HG11 VAL A 119 4.932 2.417 6.849 1.00 10.00 H new ATOM 0 HG12 VAL A 119 4.173 3.974 6.440 1.00 10.00 H new ATOM 0 HG13 VAL A 119 5.234 3.164 5.263 1.00 10.00 H new ATOM 0 HG21 VAL A 119 7.349 2.290 7.358 1.00 10.00 H new ATOM 0 HG22 VAL A 119 7.786 3.031 5.800 1.00 10.00 H new ATOM 0 HG23 VAL A 119 8.359 3.755 7.322 1.00 10.00 H new ATOM 1725 N HIS A 120 7.142 7.094 7.807 1.00 10.00 N ATOM 1726 CA HIS A 120 8.056 7.969 8.521 1.00 10.00 C ATOM 1727 C HIS A 120 8.717 7.198 9.665 1.00 10.00 C ATOM 1728 O HIS A 120 8.136 6.254 10.199 1.00 10.00 O ATOM 1729 CB HIS A 120 7.339 9.235 8.995 1.00 10.00 C ATOM 1730 CG HIS A 120 7.679 10.470 8.196 1.00 10.00 C ATOM 1731 ND1 HIS A 120 6.930 11.568 7.891 1.00 10.00 N flip ATOM 1732 CD2 HIS A 120 8.917 10.666 7.610 1.00 10.00 C flip ATOM 1733 CE1 HIS A 120 7.671 12.392 7.160 1.00 10.00 C flip ATOM 1734 NE2 HIS A 120 8.903 11.834 6.984 1.00 10.00 N flip ATOM 0 H HIS A 120 6.170 7.153 8.111 1.00 10.00 H new ATOM 0 HA HIS A 120 8.847 8.300 7.848 1.00 10.00 H new ATOM 0 HB2 HIS A 120 6.263 9.070 8.948 1.00 10.00 H new ATOM 0 HB3 HIS A 120 7.589 9.412 10.041 1.00 10.00 H new ATOM 0 HD2 HIS A 120 9.753 9.983 7.655 1.00 10.00 H new ATOM 0 HE1 HIS A 120 7.351 13.347 6.769 1.00 10.00 H new ATOM 0 HE2 HIS A 120 9.678 12.244 6.462 1.00 10.00 H new ATOM 1742 N GLU A 121 9.922 7.629 10.009 1.00 10.00 N ATOM 1743 CA GLU A 121 10.667 6.990 11.080 1.00 10.00 C ATOM 1744 C GLU A 121 9.881 7.064 12.391 1.00 10.00 C ATOM 1745 O GLU A 121 10.203 6.366 13.351 1.00 10.00 O ATOM 1746 CB GLU A 121 12.053 7.621 11.235 1.00 10.00 C ATOM 1747 CG GLU A 121 13.154 6.572 11.069 1.00 10.00 C ATOM 1748 CD GLU A 121 14.437 7.007 11.780 1.00 10.00 C ATOM 1749 OE1 GLU A 121 14.548 6.705 12.988 1.00 10.00 O ATOM 1750 OE2 GLU A 121 15.279 7.633 11.100 1.00 10.00 O ATOM 0 H GLU A 121 10.401 8.413 9.565 1.00 10.00 H new ATOM 0 HA GLU A 121 10.808 5.940 10.823 1.00 10.00 H new ATOM 0 HB2 GLU A 121 12.182 8.410 10.494 1.00 10.00 H new ATOM 0 HB3 GLU A 121 12.136 8.089 12.216 1.00 10.00 H new ATOM 0 HG2 GLU A 121 12.816 5.618 11.473 1.00 10.00 H new ATOM 0 HG3 GLU A 121 13.356 6.416 10.009 1.00 10.00 H new ATOM 1757 N LYS A 122 8.866 7.916 12.388 1.00 10.00 N ATOM 1758 CA LYS A 122 8.032 8.090 13.565 1.00 10.00 C ATOM 1759 C LYS A 122 6.614 8.463 13.129 1.00 10.00 C ATOM 1760 O LYS A 122 6.332 8.557 11.935 1.00 10.00 O ATOM 1761 CB LYS A 122 8.665 9.097 14.526 1.00 10.00 C ATOM 1762 CG LYS A 122 8.559 8.615 15.974 1.00 10.00 C ATOM 1763 CD LYS A 122 7.768 9.609 16.827 1.00 10.00 C ATOM 1764 CE LYS A 122 7.228 8.938 18.092 1.00 10.00 C ATOM 1765 NZ LYS A 122 6.117 9.730 18.665 1.00 10.00 N ATOM 0 H LYS A 122 8.602 8.493 11.589 1.00 10.00 H new ATOM 0 HA LYS A 122 7.959 7.156 14.122 1.00 10.00 H new ATOM 0 HB2 LYS A 122 9.713 9.246 14.264 1.00 10.00 H new ATOM 0 HB3 LYS A 122 8.171 10.063 14.424 1.00 10.00 H new ATOM 0 HG2 LYS A 122 8.073 7.640 16.002 1.00 10.00 H new ATOM 0 HG3 LYS A 122 9.557 8.486 16.392 1.00 10.00 H new ATOM 0 HD2 LYS A 122 8.407 10.448 17.101 1.00 10.00 H new ATOM 0 HD3 LYS A 122 6.941 10.015 16.245 1.00 10.00 H new ATOM 0 HE2 LYS A 122 6.882 7.932 17.857 1.00 10.00 H new ATOM 0 HE3 LYS A 122 8.027 8.837 18.827 1.00 10.00 H new ATOM 0 HZ1 LYS A 122 5.762 9.261 19.523 1.00 10.00 H new ATOM 0 HZ2 LYS A 122 6.458 10.682 18.907 1.00 10.00 H new ATOM 0 HZ3 LYS A 122 5.348 9.805 17.968 1.00 10.00 H new ATOM 1779 N ALA A 123 5.758 8.666 14.120 1.00 10.00 N ATOM 1780 CA ALA A 123 4.376 9.027 13.854 1.00 10.00 C ATOM 1781 C ALA A 123 4.326 10.445 13.282 1.00 10.00 C ATOM 1782 O ALA A 123 5.313 11.176 13.337 1.00 10.00 O ATOM 1783 CB ALA A 123 3.555 8.886 15.137 1.00 10.00 C ATOM 0 H ALA A 123 5.995 8.587 15.109 1.00 10.00 H new ATOM 0 HA ALA A 123 3.940 8.357 13.113 1.00 10.00 H new ATOM 0 HB1 ALA A 123 2.518 9.157 14.937 1.00 10.00 H new ATOM 0 HB2 ALA A 123 3.600 7.854 15.486 1.00 10.00 H new ATOM 0 HB3 ALA A 123 3.961 9.546 15.903 1.00 10.00 H new ATOM 1789 N ASP A 124 3.165 10.791 12.746 1.00 10.00 N ATOM 1790 CA ASP A 124 2.972 12.109 12.164 1.00 10.00 C ATOM 1791 C ASP A 124 3.555 13.167 13.104 1.00 10.00 C ATOM 1792 O ASP A 124 4.729 13.518 12.997 1.00 10.00 O ATOM 1793 CB ASP A 124 1.485 12.415 11.973 1.00 10.00 C ATOM 1794 CG ASP A 124 0.545 11.679 12.930 1.00 10.00 C ATOM 1795 OD1 ASP A 124 0.694 10.442 13.032 1.00 10.00 O ATOM 1796 OD2 ASP A 124 -0.300 12.370 13.538 1.00 10.00 O ATOM 0 H ASP A 124 2.348 10.182 12.702 1.00 10.00 H new ATOM 0 HA ASP A 124 3.471 12.126 11.195 1.00 10.00 H new ATOM 0 HB2 ASP A 124 1.332 13.488 12.091 1.00 10.00 H new ATOM 0 HB3 ASP A 124 1.206 12.164 10.950 1.00 10.00 H new ATOM 1801 N ASP A 125 2.707 13.644 14.004 1.00 10.00 N ATOM 1802 CA ASP A 125 3.124 14.654 14.962 1.00 10.00 C ATOM 1803 C ASP A 125 1.979 14.925 15.941 1.00 10.00 C ATOM 1804 O ASP A 125 2.209 15.098 17.137 1.00 10.00 O ATOM 1805 CB ASP A 125 3.467 15.970 14.261 1.00 10.00 C ATOM 1806 CG ASP A 125 4.409 16.891 15.038 1.00 10.00 C ATOM 1807 OD1 ASP A 125 5.576 16.481 15.226 1.00 10.00 O ATOM 1808 OD2 ASP A 125 3.942 17.983 15.428 1.00 10.00 O ATOM 0 H ASP A 125 1.734 13.350 14.090 1.00 10.00 H new ATOM 0 HA ASP A 125 4.007 14.282 15.482 1.00 10.00 H new ATOM 0 HB2 ASP A 125 3.920 15.743 13.296 1.00 10.00 H new ATOM 0 HB3 ASP A 125 2.541 16.509 14.060 1.00 10.00 H new ATOM 1813 N LEU A 126 0.772 14.953 15.397 1.00 10.00 N ATOM 1814 CA LEU A 126 -0.409 15.199 16.207 1.00 10.00 C ATOM 1815 C LEU A 126 -0.181 16.445 17.066 1.00 10.00 C ATOM 1816 O LEU A 126 -0.826 16.617 18.099 1.00 10.00 O ATOM 1817 CB LEU A 126 -0.773 13.953 17.016 1.00 10.00 C ATOM 1818 CG LEU A 126 -1.728 12.968 16.337 1.00 10.00 C ATOM 1819 CD1 LEU A 126 -1.484 11.540 16.830 1.00 10.00 C ATOM 1820 CD2 LEU A 126 -3.184 13.399 16.524 1.00 10.00 C ATOM 0 H LEU A 126 0.586 14.809 14.404 1.00 10.00 H new ATOM 0 HA LEU A 126 -1.272 15.401 15.572 1.00 10.00 H new ATOM 0 HB2 LEU A 126 0.147 13.424 17.265 1.00 10.00 H new ATOM 0 HB3 LEU A 126 -1.221 14.273 17.957 1.00 10.00 H new ATOM 0 HG LEU A 126 -1.525 12.978 15.266 1.00 10.00 H new ATOM 0 HD11 LEU A 126 -2.175 10.860 16.332 1.00 10.00 H new ATOM 0 HD12 LEU A 126 -0.459 11.247 16.602 1.00 10.00 H new ATOM 0 HD13 LEU A 126 -1.643 11.495 17.907 1.00 10.00 H new ATOM 0 HD21 LEU A 126 -3.842 12.682 16.032 1.00 10.00 H new ATOM 0 HD22 LEU A 126 -3.419 13.436 17.588 1.00 10.00 H new ATOM 0 HD23 LEU A 126 -3.330 14.386 16.085 1.00 10.00 H new ATOM 1832 N GLY A 127 0.738 17.281 16.607 1.00 10.00 N ATOM 1833 CA GLY A 127 1.059 18.506 17.321 1.00 10.00 C ATOM 1834 C GLY A 127 2.094 18.246 18.418 1.00 10.00 C ATOM 1835 O GLY A 127 1.772 17.670 19.456 1.00 10.00 O ATOM 0 H GLY A 127 1.271 17.135 15.750 1.00 10.00 H new ATOM 0 HA2 GLY A 127 1.444 19.249 16.622 1.00 10.00 H new ATOM 0 HA3 GLY A 127 0.153 18.922 17.762 1.00 10.00 H new ATOM 1839 N LYS A 128 3.315 18.684 18.150 1.00 10.00 N ATOM 1840 CA LYS A 128 4.399 18.507 19.101 1.00 10.00 C ATOM 1841 C LYS A 128 4.500 19.748 19.990 1.00 10.00 C ATOM 1842 O LYS A 128 3.948 19.774 21.089 1.00 10.00 O ATOM 1843 CB LYS A 128 5.700 18.165 18.372 1.00 10.00 C ATOM 1844 CG LYS A 128 5.850 16.653 18.197 1.00 10.00 C ATOM 1845 CD LYS A 128 7.300 16.278 17.884 1.00 10.00 C ATOM 1846 CE LYS A 128 7.725 15.033 18.665 1.00 10.00 C ATOM 1847 NZ LYS A 128 8.617 15.404 19.786 1.00 10.00 N ATOM 0 H LYS A 128 3.578 19.161 17.288 1.00 10.00 H new ATOM 0 HA LYS A 128 4.196 17.661 19.757 1.00 10.00 H new ATOM 0 HB2 LYS A 128 5.712 18.650 17.396 1.00 10.00 H new ATOM 0 HB3 LYS A 128 6.549 18.556 18.933 1.00 10.00 H new ATOM 0 HG2 LYS A 128 5.527 16.144 19.105 1.00 10.00 H new ATOM 0 HG3 LYS A 128 5.200 16.310 17.392 1.00 10.00 H new ATOM 0 HD2 LYS A 128 7.410 16.096 16.815 1.00 10.00 H new ATOM 0 HD3 LYS A 128 7.957 17.111 18.135 1.00 10.00 H new ATOM 0 HE2 LYS A 128 6.844 14.519 19.049 1.00 10.00 H new ATOM 0 HE3 LYS A 128 8.237 14.337 18.001 1.00 10.00 H new ATOM 0 HZ1 LYS A 128 8.896 14.547 20.306 1.00 10.00 H new ATOM 0 HZ2 LYS A 128 9.466 15.875 19.413 1.00 10.00 H new ATOM 0 HZ3 LYS A 128 8.117 16.051 20.428 1.00 10.00 H new ATOM 1861 N GLY A 129 5.208 20.745 19.482 1.00 10.00 N ATOM 1862 CA GLY A 129 5.388 21.986 20.217 1.00 10.00 C ATOM 1863 C GLY A 129 6.451 22.866 19.555 1.00 10.00 C ATOM 1864 O GLY A 129 6.342 24.091 19.565 1.00 10.00 O ATOM 0 H GLY A 129 5.664 20.719 18.570 1.00 10.00 H new ATOM 0 HA2 GLY A 129 4.442 22.525 20.264 1.00 10.00 H new ATOM 0 HA3 GLY A 129 5.681 21.766 21.244 1.00 10.00 H new ATOM 1868 N GLY A 130 7.454 22.206 18.995 1.00 10.00 N ATOM 1869 CA GLY A 130 8.536 22.913 18.330 1.00 10.00 C ATOM 1870 C GLY A 130 8.013 23.719 17.140 1.00 10.00 C ATOM 1871 O GLY A 130 6.807 23.913 16.998 1.00 10.00 O ATOM 0 H GLY A 130 7.540 21.190 18.988 1.00 10.00 H new ATOM 0 HA2 GLY A 130 9.029 23.580 19.038 1.00 10.00 H new ATOM 0 HA3 GLY A 130 9.286 22.200 17.989 1.00 10.00 H new ATOM 1875 N ASN A 131 8.947 24.167 16.313 1.00 10.00 N ATOM 1876 CA ASN A 131 8.596 24.948 15.139 1.00 10.00 C ATOM 1877 C ASN A 131 9.663 24.748 14.061 1.00 10.00 C ATOM 1878 O ASN A 131 10.856 24.731 14.359 1.00 10.00 O ATOM 1879 CB ASN A 131 8.532 26.440 15.469 1.00 10.00 C ATOM 1880 CG ASN A 131 7.136 26.833 15.959 1.00 10.00 C ATOM 1881 OD1 ASN A 131 6.218 27.053 15.186 1.00 10.00 O ATOM 1882 ND2 ASN A 131 7.029 26.910 17.282 1.00 10.00 N ATOM 0 H ASN A 131 9.947 24.004 16.433 1.00 10.00 H new ATOM 0 HA ASN A 131 7.619 24.613 14.791 1.00 10.00 H new ATOM 0 HB2 ASN A 131 9.271 26.679 16.234 1.00 10.00 H new ATOM 0 HB3 ASN A 131 8.789 27.023 14.585 1.00 10.00 H new ATOM 0 HD21 ASN A 131 6.138 27.166 17.708 1.00 10.00 H new ATOM 0 HD22 ASN A 131 7.838 26.713 17.871 1.00 10.00 H new ATOM 1889 N GLU A 132 9.195 24.600 12.830 1.00 10.00 N ATOM 1890 CA GLU A 132 10.094 24.402 11.707 1.00 10.00 C ATOM 1891 C GLU A 132 10.767 23.031 11.800 1.00 10.00 C ATOM 1892 O GLU A 132 11.740 22.764 11.098 1.00 10.00 O ATOM 1893 CB GLU A 132 11.137 25.520 11.635 1.00 10.00 C ATOM 1894 CG GLU A 132 11.495 25.843 10.183 1.00 10.00 C ATOM 1895 CD GLU A 132 12.993 26.118 10.035 1.00 10.00 C ATOM 1896 OE1 GLU A 132 13.493 26.963 10.808 1.00 10.00 O ATOM 1897 OE2 GLU A 132 13.603 25.476 9.153 1.00 10.00 O ATOM 0 H GLU A 132 8.205 24.613 12.586 1.00 10.00 H new ATOM 0 HA GLU A 132 9.508 24.436 10.789 1.00 10.00 H new ATOM 0 HB2 GLU A 132 10.752 26.414 12.126 1.00 10.00 H new ATOM 0 HB3 GLU A 132 12.034 25.221 12.177 1.00 10.00 H new ATOM 0 HG2 GLU A 132 11.209 25.010 9.541 1.00 10.00 H new ATOM 0 HG3 GLU A 132 10.928 26.712 9.850 1.00 10.00 H new ATOM 1904 N GLN A 133 10.220 22.197 12.673 1.00 10.00 N ATOM 1905 CA GLN A 133 10.754 20.860 12.867 1.00 10.00 C ATOM 1906 C GLN A 133 9.640 19.820 12.741 1.00 10.00 C ATOM 1907 O GLN A 133 9.654 18.997 11.827 1.00 10.00 O ATOM 1908 CB GLN A 133 11.463 20.744 14.218 1.00 10.00 C ATOM 1909 CG GLN A 133 10.893 21.746 15.224 1.00 10.00 C ATOM 1910 CD GLN A 133 11.013 21.216 16.655 1.00 10.00 C ATOM 1911 OE1 GLN A 133 10.220 20.411 17.115 1.00 10.00 O ATOM 1912 NE2 GLN A 133 12.047 21.710 17.330 1.00 10.00 N ATOM 0 H GLN A 133 9.412 22.422 13.254 1.00 10.00 H new ATOM 0 HA GLN A 133 11.492 20.668 12.089 1.00 10.00 H new ATOM 0 HB2 GLN A 133 11.352 19.731 14.605 1.00 10.00 H new ATOM 0 HB3 GLN A 133 12.531 20.920 14.089 1.00 10.00 H new ATOM 0 HG2 GLN A 133 11.423 22.694 15.138 1.00 10.00 H new ATOM 0 HG3 GLN A 133 9.846 21.944 14.992 1.00 10.00 H new ATOM 0 HE21 GLN A 133 12.673 22.381 16.885 1.00 10.00 H new ATOM 0 HE22 GLN A 133 12.214 21.418 18.293 1.00 10.00 H new ATOM 1921 N SER A 134 8.700 19.890 13.673 1.00 10.00 N ATOM 1922 CA SER A 134 7.580 18.964 13.678 1.00 10.00 C ATOM 1923 C SER A 134 6.409 19.556 12.893 1.00 10.00 C ATOM 1924 O SER A 134 5.498 18.834 12.490 1.00 10.00 O ATOM 1925 CB SER A 134 7.148 18.631 15.107 1.00 10.00 C ATOM 1926 OG SER A 134 7.660 19.566 16.052 1.00 10.00 O ATOM 0 H SER A 134 8.691 20.574 14.430 1.00 10.00 H new ATOM 0 HA SER A 134 7.899 18.038 13.199 1.00 10.00 H new ATOM 0 HB2 SER A 134 6.060 18.619 15.163 1.00 10.00 H new ATOM 0 HB3 SER A 134 7.492 17.629 15.365 1.00 10.00 H new ATOM 0 HG SER A 134 8.625 19.431 16.155 1.00 10.00 H new ATOM 1932 N THR A 135 6.469 20.865 12.698 1.00 10.00 N ATOM 1933 CA THR A 135 5.424 21.563 11.969 1.00 10.00 C ATOM 1934 C THR A 135 5.660 21.449 10.461 1.00 10.00 C ATOM 1935 O THR A 135 4.971 22.093 9.671 1.00 10.00 O ATOM 1936 CB THR A 135 5.382 23.008 12.470 1.00 10.00 C ATOM 1937 OG1 THR A 135 6.692 23.504 12.211 1.00 10.00 O ATOM 1938 CG2 THR A 135 5.243 23.096 13.991 1.00 10.00 C ATOM 0 H THR A 135 7.226 21.461 13.033 1.00 10.00 H new ATOM 0 HA THR A 135 4.448 21.113 12.149 1.00 10.00 H new ATOM 0 HB THR A 135 4.550 23.531 11.999 1.00 10.00 H new ATOM 0 HG1 THR A 135 6.655 24.162 11.485 1.00 10.00 H new ATOM 0 HG21 THR A 135 5.218 24.143 14.294 1.00 10.00 H new ATOM 0 HG22 THR A 135 4.320 22.606 14.301 1.00 10.00 H new ATOM 0 HG23 THR A 135 6.092 22.602 14.463 1.00 10.00 H new ATOM 1946 N LYS A 136 6.636 20.626 10.107 1.00 10.00 N ATOM 1947 CA LYS A 136 6.971 20.420 8.709 1.00 10.00 C ATOM 1948 C LYS A 136 6.980 18.920 8.407 1.00 10.00 C ATOM 1949 O LYS A 136 6.308 18.465 7.483 1.00 10.00 O ATOM 1950 CB LYS A 136 8.284 21.125 8.363 1.00 10.00 C ATOM 1951 CG LYS A 136 8.972 20.451 7.173 1.00 10.00 C ATOM 1952 CD LYS A 136 9.580 21.491 6.230 1.00 10.00 C ATOM 1953 CE LYS A 136 11.109 21.446 6.277 1.00 10.00 C ATOM 1954 NZ LYS A 136 11.677 22.759 5.898 1.00 10.00 N ATOM 0 H LYS A 136 7.206 20.094 10.765 1.00 10.00 H new ATOM 0 HA LYS A 136 6.215 20.871 8.066 1.00 10.00 H new ATOM 0 HB2 LYS A 136 8.088 22.172 8.129 1.00 10.00 H new ATOM 0 HB3 LYS A 136 8.948 21.110 9.228 1.00 10.00 H new ATOM 0 HG2 LYS A 136 9.752 19.780 7.532 1.00 10.00 H new ATOM 0 HG3 LYS A 136 8.251 19.840 6.630 1.00 10.00 H new ATOM 0 HD2 LYS A 136 9.238 21.307 5.211 1.00 10.00 H new ATOM 0 HD3 LYS A 136 9.233 22.486 6.508 1.00 10.00 H new ATOM 0 HE2 LYS A 136 11.440 21.175 7.280 1.00 10.00 H new ATOM 0 HE3 LYS A 136 11.477 20.675 5.601 1.00 10.00 H new ATOM 0 HZ1 LYS A 136 12.715 22.712 5.935 1.00 10.00 H new ATOM 0 HZ2 LYS A 136 11.376 23.002 4.933 1.00 10.00 H new ATOM 0 HZ3 LYS A 136 11.340 23.487 6.560 1.00 10.00 H new ATOM 1968 N THR A 137 7.750 18.193 9.203 1.00 10.00 N ATOM 1969 CA THR A 137 7.856 16.754 9.033 1.00 10.00 C ATOM 1970 C THR A 137 7.265 16.029 10.244 1.00 10.00 C ATOM 1971 O THR A 137 6.879 14.865 10.147 1.00 10.00 O ATOM 1972 CB THR A 137 9.326 16.415 8.778 1.00 10.00 C ATOM 1973 OG1 THR A 137 10.022 17.074 9.833 1.00 10.00 O ATOM 1974 CG2 THR A 137 9.867 17.072 7.507 1.00 10.00 C ATOM 0 H THR A 137 8.307 18.574 9.968 1.00 10.00 H new ATOM 0 HA THR A 137 7.276 16.413 8.175 1.00 10.00 H new ATOM 0 HB THR A 137 9.441 15.334 8.704 1.00 10.00 H new ATOM 0 HG1 THR A 137 10.984 16.906 9.746 1.00 10.00 H new ATOM 0 HG21 THR A 137 10.914 16.799 7.373 1.00 10.00 H new ATOM 0 HG22 THR A 137 9.290 16.731 6.647 1.00 10.00 H new ATOM 0 HG23 THR A 137 9.783 18.155 7.593 1.00 10.00 H new ATOM 1982 N GLY A 138 7.214 16.747 11.356 1.00 10.00 N ATOM 1983 CA GLY A 138 6.677 16.187 12.585 1.00 10.00 C ATOM 1984 C GLY A 138 7.798 15.657 13.481 1.00 10.00 C ATOM 1985 O GLY A 138 7.544 14.906 14.421 1.00 10.00 O ATOM 0 H GLY A 138 7.536 17.712 11.432 1.00 10.00 H new ATOM 0 HA2 GLY A 138 6.110 16.949 13.119 1.00 10.00 H new ATOM 0 HA3 GLY A 138 5.983 15.380 12.349 1.00 10.00 H new ATOM 1989 N ASN A 139 9.015 16.070 13.159 1.00 10.00 N ATOM 1990 CA ASN A 139 10.176 15.647 13.923 1.00 10.00 C ATOM 1991 C ASN A 139 10.611 14.257 13.455 1.00 10.00 C ATOM 1992 O ASN A 139 11.620 13.729 13.920 1.00 10.00 O ATOM 1993 CB ASN A 139 9.852 15.563 15.416 1.00 10.00 C ATOM 1994 CG ASN A 139 11.100 15.813 16.264 1.00 10.00 C ATOM 1995 OD1 ASN A 139 11.601 14.939 16.952 1.00 10.00 O ATOM 1996 ND2 ASN A 139 11.573 17.054 16.177 1.00 10.00 N ATOM 0 H ASN A 139 9.222 16.694 12.379 1.00 10.00 H new ATOM 0 HA ASN A 139 10.968 16.380 13.766 1.00 10.00 H new ATOM 0 HB2 ASN A 139 9.085 16.296 15.667 1.00 10.00 H new ATOM 0 HB3 ASN A 139 9.442 14.580 15.648 1.00 10.00 H new ATOM 0 HD21 ASN A 139 12.403 17.322 16.706 1.00 10.00 H new ATOM 0 HD22 ASN A 139 11.105 17.738 15.582 1.00 10.00 H new ATOM 2003 N ALA A 140 9.828 13.704 12.540 1.00 10.00 N ATOM 2004 CA ALA A 140 10.119 12.385 12.004 1.00 10.00 C ATOM 2005 C ALA A 140 10.230 12.472 10.480 1.00 10.00 C ATOM 2006 O ALA A 140 9.286 12.136 9.766 1.00 10.00 O ATOM 2007 CB ALA A 140 9.039 11.400 12.455 1.00 10.00 C ATOM 0 H ALA A 140 8.992 14.145 12.156 1.00 10.00 H new ATOM 0 HA ALA A 140 11.073 12.018 12.384 1.00 10.00 H new ATOM 0 HB1 ALA A 140 9.258 10.411 12.053 1.00 10.00 H new ATOM 0 HB2 ALA A 140 9.021 11.353 13.544 1.00 10.00 H new ATOM 0 HB3 ALA A 140 8.067 11.733 12.090 1.00 10.00 H new ATOM 2013 N GLY A 141 11.389 12.926 10.028 1.00 10.00 N ATOM 2014 CA GLY A 141 11.635 13.061 8.602 1.00 10.00 C ATOM 2015 C GLY A 141 12.787 12.158 8.156 1.00 10.00 C ATOM 2016 O GLY A 141 13.938 12.388 8.524 1.00 10.00 O ATOM 0 H GLY A 141 12.168 13.205 10.624 1.00 10.00 H new ATOM 0 HA2 GLY A 141 10.732 12.805 8.048 1.00 10.00 H new ATOM 0 HA3 GLY A 141 11.870 14.099 8.367 1.00 10.00 H new ATOM 2020 N SER A 142 12.437 11.151 7.370 1.00 10.00 N ATOM 2021 CA SER A 142 13.427 10.212 6.870 1.00 10.00 C ATOM 2022 C SER A 142 12.734 8.971 6.305 1.00 10.00 C ATOM 2023 O SER A 142 12.374 8.062 7.052 1.00 10.00 O ATOM 2024 CB SER A 142 14.414 9.814 7.970 1.00 10.00 C ATOM 2025 OG SER A 142 15.636 10.542 7.880 1.00 10.00 O ATOM 0 H SER A 142 11.481 10.964 7.067 1.00 10.00 H new ATOM 0 HA SER A 142 13.989 10.700 6.074 1.00 10.00 H new ATOM 0 HB2 SER A 142 13.959 9.988 8.945 1.00 10.00 H new ATOM 0 HB3 SER A 142 14.622 8.746 7.901 1.00 10.00 H new ATOM 0 HG SER A 142 15.464 11.492 8.049 1.00 10.00 H new ATOM 2031 N ARG A 143 12.566 8.973 4.991 1.00 10.00 N ATOM 2032 CA ARG A 143 11.922 7.859 4.317 1.00 10.00 C ATOM 2033 C ARG A 143 12.496 6.532 4.818 1.00 10.00 C ATOM 2034 O ARG A 143 13.581 6.500 5.396 1.00 10.00 O ATOM 2035 CB ARG A 143 12.110 7.948 2.801 1.00 10.00 C ATOM 2036 CG ARG A 143 11.106 8.921 2.180 1.00 10.00 C ATOM 2037 CD ARG A 143 11.697 10.329 2.080 1.00 10.00 C ATOM 2038 NE ARG A 143 10.976 11.247 2.989 1.00 10.00 N ATOM 2039 CZ ARG A 143 10.973 12.581 2.863 1.00 10.00 C ATOM 2040 NH1 ARG A 143 11.653 13.161 1.865 1.00 10.00 N ATOM 2041 NH2 ARG A 143 10.290 13.335 3.735 1.00 10.00 N ATOM 0 H ARG A 143 12.865 9.729 4.375 1.00 10.00 H new ATOM 0 HA ARG A 143 10.857 7.907 4.543 1.00 10.00 H new ATOM 0 HB2 ARG A 143 13.125 8.274 2.575 1.00 10.00 H new ATOM 0 HB3 ARG A 143 11.987 6.960 2.357 1.00 10.00 H new ATOM 0 HG2 ARG A 143 10.821 8.571 1.188 1.00 10.00 H new ATOM 0 HG3 ARG A 143 10.198 8.946 2.782 1.00 10.00 H new ATOM 0 HD2 ARG A 143 12.756 10.307 2.337 1.00 10.00 H new ATOM 0 HD3 ARG A 143 11.626 10.690 1.054 1.00 10.00 H new ATOM 0 HE ARG A 143 10.448 10.839 3.760 1.00 10.00 H new ATOM 0 HH11 ARG A 143 12.173 12.587 1.201 1.00 10.00 H new ATOM 0 HH12 ARG A 143 11.651 14.176 1.769 1.00 10.00 H new ATOM 0 HH21 ARG A 143 9.772 12.894 4.495 1.00 10.00 H new ATOM 0 HH22 ARG A 143 10.288 14.350 3.639 1.00 10.00 H new ATOM 2055 N LEU A 144 11.743 5.469 4.576 1.00 10.00 N ATOM 2056 CA LEU A 144 12.163 4.143 4.996 1.00 10.00 C ATOM 2057 C LEU A 144 12.207 3.218 3.778 1.00 10.00 C ATOM 2058 O LEU A 144 13.282 2.914 3.263 1.00 10.00 O ATOM 2059 CB LEU A 144 11.269 3.630 6.126 1.00 10.00 C ATOM 2060 CG LEU A 144 11.372 4.379 7.456 1.00 10.00 C ATOM 2061 CD1 LEU A 144 10.284 3.921 8.429 1.00 10.00 C ATOM 2062 CD2 LEU A 144 12.773 4.242 8.056 1.00 10.00 C ATOM 0 H LEU A 144 10.844 5.499 4.094 1.00 10.00 H new ATOM 0 HA LEU A 144 13.171 4.176 5.409 1.00 10.00 H new ATOM 0 HB2 LEU A 144 10.233 3.669 5.789 1.00 10.00 H new ATOM 0 HB3 LEU A 144 11.507 2.581 6.303 1.00 10.00 H new ATOM 0 HG LEU A 144 11.207 5.439 7.264 1.00 10.00 H new ATOM 0 HD11 LEU A 144 10.380 4.469 9.366 1.00 10.00 H new ATOM 0 HD12 LEU A 144 9.303 4.114 7.995 1.00 10.00 H new ATOM 0 HD13 LEU A 144 10.393 2.853 8.620 1.00 10.00 H new ATOM 0 HD21 LEU A 144 12.819 4.784 9.001 1.00 10.00 H new ATOM 0 HD22 LEU A 144 12.993 3.189 8.231 1.00 10.00 H new ATOM 0 HD23 LEU A 144 13.507 4.656 7.365 1.00 10.00 H new ATOM 2074 N ALA A 145 11.026 2.795 3.353 1.00 10.00 N ATOM 2075 CA ALA A 145 10.915 1.911 2.205 1.00 10.00 C ATOM 2076 C ALA A 145 10.113 2.608 1.105 1.00 10.00 C ATOM 2077 O ALA A 145 9.618 3.717 1.300 1.00 10.00 O ATOM 2078 CB ALA A 145 10.282 0.587 2.639 1.00 10.00 C ATOM 0 H ALA A 145 10.137 3.048 3.783 1.00 10.00 H new ATOM 0 HA ALA A 145 11.901 1.683 1.800 1.00 10.00 H new ATOM 0 HB1 ALA A 145 10.199 -0.076 1.778 1.00 10.00 H new ATOM 0 HB2 ALA A 145 10.906 0.117 3.400 1.00 10.00 H new ATOM 0 HB3 ALA A 145 9.290 0.775 3.049 1.00 10.00 H new ATOM 2084 N CYS A 146 10.010 1.929 -0.028 1.00 10.00 N ATOM 2085 CA CYS A 146 9.276 2.469 -1.160 1.00 10.00 C ATOM 2086 C CYS A 146 8.677 1.301 -1.946 1.00 10.00 C ATOM 2087 O CYS A 146 9.115 1.006 -3.057 1.00 10.00 O ATOM 2088 CB CYS A 146 10.163 3.353 -2.039 1.00 10.00 C ATOM 2089 SG CYS A 146 11.961 3.065 -1.852 1.00 10.00 S ATOM 0 H CYS A 146 10.423 1.010 -0.186 1.00 10.00 H new ATOM 0 HA CYS A 146 8.474 3.114 -0.802 1.00 10.00 H new ATOM 0 HB2 CYS A 146 9.890 3.193 -3.082 1.00 10.00 H new ATOM 0 HB3 CYS A 146 9.951 4.397 -1.810 1.00 10.00 H new ATOM 0 HG CYS A 146 12.613 3.864 -2.643 1.00 10.00 H new ATOM 2094 N GLY A 147 7.684 0.669 -1.338 1.00 10.00 N ATOM 2095 CA GLY A 147 7.020 -0.461 -1.967 1.00 10.00 C ATOM 2096 C GLY A 147 6.868 -0.238 -3.474 1.00 10.00 C ATOM 2097 O GLY A 147 7.361 -1.030 -4.275 1.00 10.00 O ATOM 0 H GLY A 147 7.323 0.917 -0.417 1.00 10.00 H new ATOM 0 HA2 GLY A 147 7.593 -1.371 -1.786 1.00 10.00 H new ATOM 0 HA3 GLY A 147 6.038 -0.608 -1.516 1.00 10.00 H new ATOM 2101 N VAL A 148 6.184 0.845 -3.813 1.00 10.00 N ATOM 2102 CA VAL A 148 5.961 1.182 -5.209 1.00 10.00 C ATOM 2103 C VAL A 148 5.023 0.148 -5.835 1.00 10.00 C ATOM 2104 O VAL A 148 5.373 -1.025 -5.948 1.00 10.00 O ATOM 2105 CB VAL A 148 7.300 1.295 -5.940 1.00 10.00 C ATOM 2106 CG1 VAL A 148 7.089 1.527 -7.438 1.00 10.00 C ATOM 2107 CG2 VAL A 148 8.167 2.398 -5.331 1.00 10.00 C ATOM 0 H VAL A 148 5.777 1.500 -3.146 1.00 10.00 H new ATOM 0 HA VAL A 148 5.476 2.154 -5.295 1.00 10.00 H new ATOM 0 HB VAL A 148 7.828 0.349 -5.818 1.00 10.00 H new ATOM 0 HG11 VAL A 148 8.057 1.604 -7.934 1.00 10.00 H new ATOM 0 HG12 VAL A 148 6.530 0.692 -7.860 1.00 10.00 H new ATOM 0 HG13 VAL A 148 6.530 2.451 -7.588 1.00 10.00 H new ATOM 0 HG21 VAL A 148 9.113 2.457 -5.870 1.00 10.00 H new ATOM 0 HG22 VAL A 148 7.647 3.353 -5.406 1.00 10.00 H new ATOM 0 HG23 VAL A 148 8.360 2.172 -4.282 1.00 10.00 H new ATOM 2117 N ILE A 149 3.848 0.622 -6.225 1.00 10.00 N ATOM 2118 CA ILE A 149 2.857 -0.247 -6.836 1.00 10.00 C ATOM 2119 C ILE A 149 3.342 -0.669 -8.225 1.00 10.00 C ATOM 2120 O ILE A 149 3.836 0.157 -8.991 1.00 10.00 O ATOM 2121 CB ILE A 149 1.484 0.428 -6.844 1.00 10.00 C ATOM 2122 CG1 ILE A 149 0.758 0.208 -5.515 1.00 10.00 C ATOM 2123 CG2 ILE A 149 0.650 -0.039 -8.038 1.00 10.00 C ATOM 2124 CD1 ILE A 149 1.462 0.948 -4.376 1.00 10.00 C ATOM 0 H ILE A 149 3.561 1.596 -6.130 1.00 10.00 H new ATOM 0 HA ILE A 149 2.736 -1.158 -6.249 1.00 10.00 H new ATOM 0 HB ILE A 149 1.632 1.502 -6.956 1.00 10.00 H new ATOM 0 HG12 ILE A 149 -0.272 0.556 -5.597 1.00 10.00 H new ATOM 0 HG13 ILE A 149 0.718 -0.858 -5.291 1.00 10.00 H new ATOM 0 HG21 ILE A 149 -0.321 0.456 -8.020 1.00 10.00 H new ATOM 0 HG22 ILE A 149 1.168 0.212 -8.964 1.00 10.00 H new ATOM 0 HG23 ILE A 149 0.508 -1.118 -7.983 1.00 10.00 H new ATOM 0 HD11 ILE A 149 0.925 0.775 -3.443 1.00 10.00 H new ATOM 0 HD12 ILE A 149 2.484 0.581 -4.280 1.00 10.00 H new ATOM 0 HD13 ILE A 149 1.479 2.016 -4.592 1.00 10.00 H new ATOM 2136 N GLY A 150 3.185 -1.954 -8.506 1.00 10.00 N ATOM 2137 CA GLY A 150 3.601 -2.496 -9.789 1.00 10.00 C ATOM 2138 C GLY A 150 2.650 -3.602 -10.251 1.00 10.00 C ATOM 2139 O GLY A 150 2.617 -4.682 -9.663 1.00 10.00 O ATOM 0 H GLY A 150 2.776 -2.636 -7.867 1.00 10.00 H new ATOM 0 HA2 GLY A 150 3.627 -1.700 -10.533 1.00 10.00 H new ATOM 0 HA3 GLY A 150 4.614 -2.892 -9.710 1.00 10.00 H new ATOM 2143 N ILE A 151 1.902 -3.296 -11.300 1.00 10.00 N ATOM 2144 CA ILE A 151 0.954 -4.251 -11.848 1.00 10.00 C ATOM 2145 C ILE A 151 1.572 -5.650 -11.818 1.00 10.00 C ATOM 2146 O ILE A 151 2.778 -5.804 -12.001 1.00 10.00 O ATOM 2147 CB ILE A 151 0.493 -3.811 -13.239 1.00 10.00 C ATOM 2148 CG1 ILE A 151 -0.490 -2.642 -13.147 1.00 10.00 C ATOM 2149 CG2 ILE A 151 -0.089 -4.990 -14.022 1.00 10.00 C ATOM 2150 CD1 ILE A 151 -1.750 -3.045 -12.378 1.00 10.00 C ATOM 0 H ILE A 151 1.933 -2.400 -11.786 1.00 10.00 H new ATOM 0 HA ILE A 151 0.053 -4.287 -11.236 1.00 10.00 H new ATOM 0 HB ILE A 151 1.363 -3.456 -13.791 1.00 10.00 H new ATOM 0 HG12 ILE A 151 -0.011 -1.798 -12.651 1.00 10.00 H new ATOM 0 HG13 ILE A 151 -0.762 -2.311 -14.149 1.00 10.00 H new ATOM 0 HG21 ILE A 151 -0.409 -4.650 -15.007 1.00 10.00 H new ATOM 0 HG22 ILE A 151 0.671 -5.763 -14.134 1.00 10.00 H new ATOM 0 HG23 ILE A 151 -0.944 -5.398 -13.483 1.00 10.00 H new ATOM 0 HD11 ILE A 151 -2.432 -2.196 -12.327 1.00 10.00 H new ATOM 0 HD12 ILE A 151 -2.239 -3.874 -12.890 1.00 10.00 H new ATOM 0 HD13 ILE A 151 -1.477 -3.353 -11.368 1.00 10.00 H new ATOM 2162 N ALA A 152 0.716 -6.635 -11.587 1.00 10.00 N ATOM 2163 CA ALA A 152 1.163 -8.017 -11.531 1.00 10.00 C ATOM 2164 C ALA A 152 0.096 -8.919 -12.155 1.00 10.00 C ATOM 2165 O ALA A 152 -1.024 -8.479 -12.407 1.00 10.00 O ATOM 2166 CB ALA A 152 1.472 -8.396 -10.081 1.00 10.00 C ATOM 0 H ALA A 152 -0.284 -6.504 -11.437 1.00 10.00 H new ATOM 0 HA ALA A 152 2.081 -8.147 -12.104 1.00 10.00 H new ATOM 0 HB1 ALA A 152 1.807 -9.432 -10.039 1.00 10.00 H new ATOM 0 HB2 ALA A 152 2.256 -7.745 -9.694 1.00 10.00 H new ATOM 0 HB3 ALA A 152 0.573 -8.281 -9.475 1.00 10.00 H new ATOM 2172 N GLN A 153 0.482 -10.165 -12.386 1.00 10.00 N ATOM 2173 CA GLN A 153 -0.427 -11.133 -12.976 1.00 10.00 C ATOM 2174 C GLN A 153 -0.297 -12.483 -12.268 1.00 10.00 C ATOM 2175 O GLN A 153 -1.297 -13.151 -12.009 1.00 10.00 O ATOM 2176 CB GLN A 153 -0.177 -11.276 -14.478 1.00 10.00 C ATOM 2177 CG GLN A 153 -1.469 -11.067 -15.271 1.00 10.00 C ATOM 2178 CD GLN A 153 -1.467 -11.906 -16.551 1.00 10.00 C ATOM 2179 OE1 GLN A 153 -0.528 -11.895 -17.330 1.00 10.00 O ATOM 2180 NE2 GLN A 153 -2.569 -12.630 -16.724 1.00 10.00 N ATOM 0 H GLN A 153 1.412 -10.527 -12.175 1.00 10.00 H new ATOM 0 HA GLN A 153 -1.447 -10.772 -12.844 1.00 10.00 H new ATOM 0 HB2 GLN A 153 0.571 -10.550 -14.797 1.00 10.00 H new ATOM 0 HB3 GLN A 153 0.228 -12.265 -14.690 1.00 10.00 H new ATOM 0 HG2 GLN A 153 -2.326 -11.339 -14.655 1.00 10.00 H new ATOM 0 HG3 GLN A 153 -1.579 -10.012 -15.523 1.00 10.00 H new ATOM 0 HE21 GLN A 153 -3.318 -12.593 -16.032 1.00 10.00 H new ATOM 0 HE22 GLN A 153 -2.666 -13.223 -17.548 1.00 10.00 H new