USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1160 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 54 GLN : amide:sc= 0.58 K(o=0.62,f=0.11) USER MOD Set 1.2: A 69 TYR OH : rot 180:sc= 0.0369 USER MOD Set 2.1: A 9 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 11 MET CE :methyl 158:sc= -0.148 (180deg=-0.751) USER MOD Single : A 1 MET CE :methyl 153:sc= -0.24 (180deg=-0.99) USER MOD Single : A 1 MET N :NH3+ 130:sc= 0.0373 (180deg=-0.357) USER MOD Single : A 3 HIS :FLIP no HE2:sc= 0.149 F(o=-0.8,f=0.15) USER MOD Single : A 4 HIS : no HD1:sc= -0.0399 X(o=-0.04,f=-0.006) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.42 X(o=-0.42,f=-0.058) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.0005) USER MOD Single : A 10 HIS : no HE2:sc= -0.0598 K(o=-0.06,f=-0.93) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 45:sc= 0.139 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot -14:sc= 0.956 USER MOD Single : A 24 ASN :FLIP amide:sc= -2.27! C(o=-6.5!,f=-2.3!) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=-0.0079) USER MOD Single : A 34 LYS NZ :NH3+ -164:sc= -0.0254 (180deg=-0.226) USER MOD Single : A 35 HIS : no HE2:sc= -1.01 K(o=-1,f=-2.1!) USER MOD Single : A 37 GLN : amide:sc= 0.886 K(o=0.89,f=-0.57) USER MOD Single : A 40 TYR OH : rot 162:sc= 0.319 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot -59:sc= 0.89 USER MOD Single : A 51 HIS :FLIP no HD1:sc= 0.188 F(o=-0.68,f=0.19) USER MOD Single : A 59 GLN : amide:sc= -0.0803 K(o=-0.08,f=-0.81) USER MOD Single : A 65 LYS NZ :NH3+ -108:sc= 0.633 (180deg=0.000761) USER MOD Single : A 66 ASN : amide:sc= -1.71! C(o=-1.7!,f=-6.3!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -175:sc= -2.61! (180deg=-2.74!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -0.246 K(o=-0.25,f=-2.1) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -0.67 K(o=-0.67,f=-7.5!) USER MOD Single : A 100 GLN : amide:sc= 1.37 K(o=1.4,f=-5.8!) USER MOD Single : A 105 SER OG : rot 77:sc= 1.24 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 78:sc= 1.28 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= -0.396 X(o=-0.4,f=-0.4) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0.0496 USER MOD Single : A 139 MET CE :methyl -156:sc= -0.244 (180deg=-0.949) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 CYS SG : rot -50:sc= 0.962 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 30.832 3.744 12.981 1.00 0.00 N ATOM 2 CA MET A 1 30.713 5.002 13.753 1.00 0.00 C ATOM 3 C MET A 1 29.724 5.944 13.071 1.00 0.00 C ATOM 4 O MET A 1 29.370 5.747 11.907 1.00 0.00 O ATOM 5 CB MET A 1 32.090 5.671 13.908 1.00 0.00 C ATOM 6 CG MET A 1 32.744 6.091 12.598 1.00 0.00 C ATOM 7 SD MET A 1 32.187 7.705 12.014 1.00 0.00 S ATOM 8 CE MET A 1 32.801 8.766 13.322 1.00 0.00 C ATOM 0 H1 MET A 1 31.837 3.530 12.819 1.00 0.00 H new ATOM 0 H2 MET A 1 30.393 2.966 13.515 1.00 0.00 H new ATOM 0 H3 MET A 1 30.349 3.851 12.066 1.00 0.00 H new ATOM 0 HA MET A 1 30.337 4.770 14.749 1.00 0.00 H new ATOM 0 HB2 MET A 1 31.982 6.550 14.543 1.00 0.00 H new ATOM 0 HB3 MET A 1 32.757 4.983 14.427 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.826 6.112 12.729 1.00 0.00 H new ATOM 0 HG3 MET A 1 32.530 5.342 11.836 1.00 0.00 H new ATOM 0 HE1 MET A 1 32.979 9.766 12.926 1.00 0.00 H new ATOM 0 HE2 MET A 1 32.064 8.819 14.124 1.00 0.00 H new ATOM 0 HE3 MET A 1 33.734 8.359 13.713 1.00 0.00 H new ATOM 20 N GLY A 2 29.271 6.959 13.795 1.00 0.00 N ATOM 21 CA GLY A 2 28.340 7.911 13.226 1.00 0.00 C ATOM 22 C GLY A 2 27.686 8.771 14.285 1.00 0.00 C ATOM 23 O GLY A 2 27.785 8.475 15.474 1.00 0.00 O ATOM 0 H GLY A 2 29.532 7.139 14.765 1.00 0.00 H new ATOM 0 HA2 GLY A 2 28.864 8.549 12.515 1.00 0.00 H new ATOM 0 HA3 GLY A 2 27.571 7.376 12.668 1.00 0.00 H new ATOM 27 N HIS A 3 27.020 9.833 13.858 1.00 0.00 N ATOM 28 CA HIS A 3 26.357 10.741 14.785 1.00 0.00 C ATOM 29 C HIS A 3 25.203 11.479 14.117 1.00 0.00 C ATOM 30 O HIS A 3 25.398 12.227 13.161 1.00 0.00 O ATOM 31 CB HIS A 3 27.351 11.742 15.414 1.00 0.00 C ATOM 32 CG HIS A 3 28.340 12.382 14.467 1.00 0.00 C ATOM 33 ND1 HIS A 3 28.259 12.703 13.150 1.00 0.00 N flip ATOM 34 CD2 HIS A 3 29.595 12.783 14.872 1.00 0.00 C flip ATOM 35 CE1 HIS A 3 29.451 13.286 12.797 1.00 0.00 C flip ATOM 36 NE2 HIS A 3 30.238 13.322 13.852 1.00 0.00 N flip ATOM 0 H HIS A 3 26.924 10.088 12.875 1.00 0.00 H new ATOM 0 HA HIS A 3 25.946 10.128 15.588 1.00 0.00 H new ATOM 0 HB2 HIS A 3 26.780 12.533 15.900 1.00 0.00 H new ATOM 0 HB3 HIS A 3 27.909 11.226 16.195 1.00 0.00 H new ATOM 0 HD1 HIS A 3 27.460 12.541 12.536 1.00 0.00 H new ATOM 0 HD2 HIS A 3 29.992 12.673 15.870 1.00 0.00 H new ATOM 0 HE1 HIS A 3 29.702 13.655 11.814 1.00 0.00 H new ATOM 45 N HIS A 4 23.998 11.245 14.614 1.00 0.00 N ATOM 46 CA HIS A 4 22.815 11.957 14.142 1.00 0.00 C ATOM 47 C HIS A 4 21.895 12.281 15.308 1.00 0.00 C ATOM 48 O HIS A 4 20.985 11.513 15.627 1.00 0.00 O ATOM 49 CB HIS A 4 22.050 11.145 13.092 1.00 0.00 C ATOM 50 CG HIS A 4 22.646 11.201 11.722 1.00 0.00 C ATOM 51 ND1 HIS A 4 22.936 10.078 10.973 1.00 0.00 N ATOM 52 CD2 HIS A 4 22.985 12.260 10.954 1.00 0.00 C ATOM 53 CE1 HIS A 4 23.427 10.448 9.804 1.00 0.00 C ATOM 54 NE2 HIS A 4 23.464 11.766 9.769 1.00 0.00 N ATOM 0 H HIS A 4 23.811 10.563 15.349 1.00 0.00 H new ATOM 0 HA HIS A 4 23.153 12.883 13.676 1.00 0.00 H new ATOM 0 HB2 HIS A 4 22.006 10.105 13.415 1.00 0.00 H new ATOM 0 HB3 HIS A 4 21.023 11.508 13.045 1.00 0.00 H new ATOM 0 HD2 HIS A 4 22.895 13.302 11.224 1.00 0.00 H new ATOM 0 HE1 HIS A 4 23.744 9.785 9.013 1.00 0.00 H new ATOM 0 HE2 HIS A 4 23.796 12.328 8.985 1.00 0.00 H new ATOM 63 N HIS A 5 22.139 13.410 15.954 1.00 0.00 N ATOM 64 CA HIS A 5 21.344 13.806 17.107 1.00 0.00 C ATOM 65 C HIS A 5 20.151 14.635 16.654 1.00 0.00 C ATOM 66 O HIS A 5 20.097 15.846 16.872 1.00 0.00 O ATOM 67 CB HIS A 5 22.199 14.598 18.100 1.00 0.00 C ATOM 68 CG HIS A 5 21.651 14.607 19.496 1.00 0.00 C ATOM 69 ND1 HIS A 5 22.132 13.786 20.491 1.00 0.00 N ATOM 70 CD2 HIS A 5 20.662 15.341 20.064 1.00 0.00 C ATOM 71 CE1 HIS A 5 21.466 14.008 21.606 1.00 0.00 C ATOM 72 NE2 HIS A 5 20.571 14.947 21.377 1.00 0.00 N ATOM 0 H HIS A 5 22.878 14.066 15.702 1.00 0.00 H new ATOM 0 HA HIS A 5 20.980 12.909 17.608 1.00 0.00 H new ATOM 0 HB2 HIS A 5 23.204 14.177 18.117 1.00 0.00 H new ATOM 0 HB3 HIS A 5 22.290 15.626 17.748 1.00 0.00 H new ATOM 0 HD2 HIS A 5 20.060 16.093 19.576 1.00 0.00 H new ATOM 0 HE1 HIS A 5 21.627 13.505 22.548 1.00 0.00 H new ATOM 0 HE2 HIS A 5 19.916 15.321 22.064 1.00 0.00 H new ATOM 81 N HIS A 6 19.206 13.974 16.004 1.00 0.00 N ATOM 82 CA HIS A 6 18.039 14.653 15.458 1.00 0.00 C ATOM 83 C HIS A 6 16.981 14.886 16.534 1.00 0.00 C ATOM 84 O HIS A 6 16.800 14.057 17.429 1.00 0.00 O ATOM 85 CB HIS A 6 17.437 13.859 14.280 1.00 0.00 C ATOM 86 CG HIS A 6 17.007 12.450 14.605 1.00 0.00 C ATOM 87 ND1 HIS A 6 17.583 11.333 14.035 1.00 0.00 N ATOM 88 CD2 HIS A 6 16.035 11.981 15.428 1.00 0.00 C ATOM 89 CE1 HIS A 6 16.990 10.248 14.495 1.00 0.00 C ATOM 90 NE2 HIS A 6 16.049 10.612 15.341 1.00 0.00 N ATOM 0 H HIS A 6 19.223 12.967 15.841 1.00 0.00 H new ATOM 0 HA HIS A 6 18.369 15.624 15.088 1.00 0.00 H new ATOM 0 HB2 HIS A 6 16.575 14.405 13.898 1.00 0.00 H new ATOM 0 HB3 HIS A 6 18.172 13.821 13.476 1.00 0.00 H new ATOM 0 HD2 HIS A 6 15.372 12.576 16.039 1.00 0.00 H new ATOM 0 HE1 HIS A 6 17.235 9.232 14.223 1.00 0.00 H new ATOM 0 HE2 HIS A 6 15.431 9.979 15.849 1.00 0.00 H new ATOM 99 N HIS A 7 16.305 16.027 16.454 1.00 0.00 N ATOM 100 CA HIS A 7 15.184 16.325 17.339 1.00 0.00 C ATOM 101 C HIS A 7 14.299 17.401 16.724 1.00 0.00 C ATOM 102 O HIS A 7 14.597 18.588 16.814 1.00 0.00 O ATOM 103 CB HIS A 7 15.669 16.769 18.725 1.00 0.00 C ATOM 104 CG HIS A 7 14.552 16.949 19.715 1.00 0.00 C ATOM 105 ND1 HIS A 7 13.956 15.894 20.373 1.00 0.00 N ATOM 106 CD2 HIS A 7 13.911 18.065 20.141 1.00 0.00 C ATOM 107 CE1 HIS A 7 12.997 16.350 21.157 1.00 0.00 C ATOM 108 NE2 HIS A 7 12.948 17.663 21.034 1.00 0.00 N ATOM 0 H HIS A 7 16.515 16.765 15.782 1.00 0.00 H new ATOM 0 HA HIS A 7 14.603 15.411 17.462 1.00 0.00 H new ATOM 0 HB2 HIS A 7 16.372 16.030 19.111 1.00 0.00 H new ATOM 0 HB3 HIS A 7 16.215 17.708 18.628 1.00 0.00 H new ATOM 0 HD2 HIS A 7 14.119 19.080 19.835 1.00 0.00 H new ATOM 0 HE1 HIS A 7 12.361 15.751 21.791 1.00 0.00 H new ATOM 0 HE2 HIS A 7 12.300 18.280 21.523 1.00 0.00 H new ATOM 117 N HIS A 8 13.231 16.978 16.071 1.00 0.00 N ATOM 118 CA HIS A 8 12.274 17.907 15.492 1.00 0.00 C ATOM 119 C HIS A 8 10.941 17.780 16.210 1.00 0.00 C ATOM 120 O HIS A 8 10.213 16.807 16.018 1.00 0.00 O ATOM 121 CB HIS A 8 12.100 17.652 13.989 1.00 0.00 C ATOM 122 CG HIS A 8 13.292 18.051 13.171 1.00 0.00 C ATOM 123 ND1 HIS A 8 13.351 19.227 12.457 1.00 0.00 N ATOM 124 CD2 HIS A 8 14.473 17.424 12.955 1.00 0.00 C ATOM 125 CE1 HIS A 8 14.514 19.308 11.839 1.00 0.00 C ATOM 126 NE2 HIS A 8 15.214 18.228 12.126 1.00 0.00 N ATOM 0 H HIS A 8 13.003 15.994 15.928 1.00 0.00 H new ATOM 0 HA HIS A 8 12.654 18.921 15.616 1.00 0.00 H new ATOM 0 HB2 HIS A 8 11.898 16.593 13.830 1.00 0.00 H new ATOM 0 HB3 HIS A 8 11.227 18.200 13.635 1.00 0.00 H new ATOM 0 HD2 HIS A 8 14.775 16.469 13.360 1.00 0.00 H new ATOM 0 HE1 HIS A 8 14.838 20.121 11.206 1.00 0.00 H new ATOM 0 HE2 HIS A 8 16.154 18.023 11.787 1.00 0.00 H new ATOM 135 N SER A 9 10.637 18.751 17.053 1.00 0.00 N ATOM 136 CA SER A 9 9.435 18.694 17.861 1.00 0.00 C ATOM 137 C SER A 9 8.593 19.951 17.670 1.00 0.00 C ATOM 138 O SER A 9 8.950 21.036 18.135 1.00 0.00 O ATOM 139 CB SER A 9 9.798 18.511 19.338 1.00 0.00 C ATOM 140 OG SER A 9 8.646 18.286 20.130 1.00 0.00 O ATOM 0 H SER A 9 11.205 19.586 17.195 1.00 0.00 H new ATOM 0 HA SER A 9 8.843 17.838 17.537 1.00 0.00 H new ATOM 0 HB2 SER A 9 10.484 17.671 19.444 1.00 0.00 H new ATOM 0 HB3 SER A 9 10.321 19.397 19.698 1.00 0.00 H new ATOM 0 HG SER A 9 8.910 18.171 21.067 1.00 0.00 H new ATOM 146 N HIS A 10 7.482 19.795 16.970 1.00 0.00 N ATOM 147 CA HIS A 10 6.545 20.883 16.743 1.00 0.00 C ATOM 148 C HIS A 10 5.185 20.296 16.388 1.00 0.00 C ATOM 149 O HIS A 10 4.681 20.474 15.279 1.00 0.00 O ATOM 150 CB HIS A 10 7.046 21.804 15.625 1.00 0.00 C ATOM 151 CG HIS A 10 6.293 23.096 15.523 1.00 0.00 C ATOM 152 ND1 HIS A 10 5.127 23.235 14.803 1.00 0.00 N ATOM 153 CD2 HIS A 10 6.552 24.313 16.056 1.00 0.00 C ATOM 154 CE1 HIS A 10 4.702 24.479 14.895 1.00 0.00 C ATOM 155 NE2 HIS A 10 5.548 25.154 15.650 1.00 0.00 N ATOM 0 H HIS A 10 7.204 18.911 16.543 1.00 0.00 H new ATOM 0 HA HIS A 10 6.457 21.482 17.649 1.00 0.00 H new ATOM 0 HB2 HIS A 10 8.101 22.021 15.791 1.00 0.00 H new ATOM 0 HB3 HIS A 10 6.975 21.277 14.674 1.00 0.00 H new ATOM 0 HD1 HIS A 10 4.665 22.491 14.280 1.00 0.00 H new ATOM 0 HD2 HIS A 10 7.392 24.573 16.683 1.00 0.00 H new ATOM 0 HE1 HIS A 10 3.812 24.878 14.431 1.00 0.00 H new ATOM 164 N MET A 11 4.607 19.576 17.331 1.00 0.00 N ATOM 165 CA MET A 11 3.367 18.865 17.078 1.00 0.00 C ATOM 166 C MET A 11 2.202 19.510 17.812 1.00 0.00 C ATOM 167 O MET A 11 1.871 19.130 18.938 1.00 0.00 O ATOM 168 CB MET A 11 3.476 17.382 17.467 1.00 0.00 C ATOM 169 CG MET A 11 4.417 16.569 16.580 1.00 0.00 C ATOM 170 SD MET A 11 6.166 16.902 16.900 1.00 0.00 S ATOM 171 CE MET A 11 6.328 16.282 18.576 1.00 0.00 C ATOM 0 H MET A 11 4.974 19.468 18.276 1.00 0.00 H new ATOM 0 HA MET A 11 3.180 18.925 16.006 1.00 0.00 H new ATOM 0 HB2 MET A 11 3.818 17.313 18.500 1.00 0.00 H new ATOM 0 HB3 MET A 11 2.483 16.934 17.430 1.00 0.00 H new ATOM 0 HG2 MET A 11 4.222 15.507 16.733 1.00 0.00 H new ATOM 0 HG3 MET A 11 4.198 16.786 15.535 1.00 0.00 H new ATOM 0 HE1 MET A 11 7.374 16.050 18.779 1.00 0.00 H new ATOM 0 HE2 MET A 11 5.981 17.039 19.279 1.00 0.00 H new ATOM 0 HE3 MET A 11 5.728 15.379 18.690 1.00 0.00 H new ATOM 181 N ASP A 12 1.614 20.514 17.184 1.00 0.00 N ATOM 182 CA ASP A 12 0.387 21.117 17.673 1.00 0.00 C ATOM 183 C ASP A 12 -0.600 21.219 16.518 1.00 0.00 C ATOM 184 O ASP A 12 -0.234 21.619 15.410 1.00 0.00 O ATOM 185 CB ASP A 12 0.649 22.492 18.313 1.00 0.00 C ATOM 186 CG ASP A 12 1.192 23.531 17.344 1.00 0.00 C ATOM 187 OD1 ASP A 12 2.413 23.516 17.069 1.00 0.00 O ATOM 188 OD2 ASP A 12 0.407 24.390 16.882 1.00 0.00 O ATOM 0 H ASP A 12 1.972 20.932 16.325 1.00 0.00 H new ATOM 0 HA ASP A 12 -0.036 20.488 18.457 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -0.280 22.863 18.745 1.00 0.00 H new ATOM 0 HB3 ASP A 12 1.356 22.371 19.134 1.00 0.00 H new ATOM 193 N TYR A 13 -1.839 20.811 16.755 1.00 0.00 N ATOM 194 CA TYR A 13 -2.821 20.719 15.684 1.00 0.00 C ATOM 195 C TYR A 13 -4.076 21.522 16.008 1.00 0.00 C ATOM 196 O TYR A 13 -5.000 21.016 16.648 1.00 0.00 O ATOM 197 CB TYR A 13 -3.197 19.256 15.426 1.00 0.00 C ATOM 198 CG TYR A 13 -2.033 18.379 15.013 1.00 0.00 C ATOM 199 CD1 TYR A 13 -1.687 18.235 13.675 1.00 0.00 C ATOM 200 CD2 TYR A 13 -1.284 17.693 15.961 1.00 0.00 C ATOM 201 CE1 TYR A 13 -0.628 17.431 13.294 1.00 0.00 C ATOM 202 CE2 TYR A 13 -0.223 16.887 15.590 1.00 0.00 C ATOM 203 CZ TYR A 13 0.102 16.761 14.256 1.00 0.00 C ATOM 204 OH TYR A 13 1.160 15.960 13.883 1.00 0.00 O ATOM 0 H TYR A 13 -2.187 20.540 17.675 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.367 21.139 14.786 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -3.646 18.843 16.330 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -3.959 19.220 14.647 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -2.254 18.759 12.920 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -1.535 17.791 17.007 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -0.373 17.328 12.250 1.00 0.00 H new ATOM 0 HE2 TYR A 13 0.347 16.360 16.340 1.00 0.00 H new ATOM 0 HH TYR A 13 1.567 15.563 14.681 1.00 0.00 H new ATOM 214 N PRO A 14 -4.115 22.794 15.589 1.00 0.00 N ATOM 215 CA PRO A 14 -5.286 23.648 15.764 1.00 0.00 C ATOM 216 C PRO A 14 -6.413 23.236 14.821 1.00 0.00 C ATOM 217 O PRO A 14 -6.264 23.285 13.597 1.00 0.00 O ATOM 218 CB PRO A 14 -4.777 25.059 15.420 1.00 0.00 C ATOM 219 CG PRO A 14 -3.292 24.938 15.292 1.00 0.00 C ATOM 220 CD PRO A 14 -3.019 23.508 14.923 1.00 0.00 C ATOM 0 HA PRO A 14 -5.699 23.583 16.771 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -5.221 25.419 14.492 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -5.045 25.772 16.200 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -2.910 25.617 14.529 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -2.798 25.200 16.228 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -3.033 23.358 13.844 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -2.043 23.176 15.278 1.00 0.00 H new ATOM 228 N SER A 15 -7.527 22.803 15.390 1.00 0.00 N ATOM 229 CA SER A 15 -8.661 22.364 14.595 1.00 0.00 C ATOM 230 C SER A 15 -9.974 22.635 15.325 1.00 0.00 C ATOM 231 O SER A 15 -10.336 21.921 16.261 1.00 0.00 O ATOM 232 CB SER A 15 -8.521 20.873 14.261 1.00 0.00 C ATOM 233 OG SER A 15 -8.183 20.118 15.417 1.00 0.00 O ATOM 0 H SER A 15 -7.669 22.746 16.398 1.00 0.00 H new ATOM 0 HA SER A 15 -8.674 22.931 13.664 1.00 0.00 H new ATOM 0 HB2 SER A 15 -9.456 20.502 13.841 1.00 0.00 H new ATOM 0 HB3 SER A 15 -7.754 20.739 13.498 1.00 0.00 H new ATOM 0 HG SER A 15 -8.747 20.399 16.168 1.00 0.00 H new ATOM 239 N PHE A 16 -10.670 23.684 14.915 1.00 0.00 N ATOM 240 CA PHE A 16 -11.959 24.006 15.506 1.00 0.00 C ATOM 241 C PHE A 16 -12.965 24.393 14.431 1.00 0.00 C ATOM 242 O PHE A 16 -12.941 25.512 13.917 1.00 0.00 O ATOM 243 CB PHE A 16 -11.820 25.133 16.533 1.00 0.00 C ATOM 244 CG PHE A 16 -13.109 25.469 17.235 1.00 0.00 C ATOM 245 CD1 PHE A 16 -13.623 24.627 18.210 1.00 0.00 C ATOM 246 CD2 PHE A 16 -13.807 26.626 16.918 1.00 0.00 C ATOM 247 CE1 PHE A 16 -14.807 24.934 18.854 1.00 0.00 C ATOM 248 CE2 PHE A 16 -14.990 26.936 17.560 1.00 0.00 C ATOM 249 CZ PHE A 16 -15.491 26.088 18.528 1.00 0.00 C ATOM 0 H PHE A 16 -10.366 24.323 14.180 1.00 0.00 H new ATOM 0 HA PHE A 16 -12.325 23.116 16.017 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.075 24.847 17.276 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -11.445 26.026 16.032 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -13.093 23.722 18.469 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.421 27.292 16.160 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -15.197 24.271 19.612 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -15.523 27.840 17.305 1.00 0.00 H new ATOM 0 HZ PHE A 16 -16.417 26.327 19.030 1.00 0.00 H new ATOM 259 N ASP A 17 -13.826 23.449 14.083 1.00 0.00 N ATOM 260 CA ASP A 17 -14.916 23.684 13.140 1.00 0.00 C ATOM 261 C ASP A 17 -15.846 22.485 13.158 1.00 0.00 C ATOM 262 O ASP A 17 -15.389 21.344 13.063 1.00 0.00 O ATOM 263 CB ASP A 17 -14.391 23.905 11.714 1.00 0.00 C ATOM 264 CG ASP A 17 -15.449 24.475 10.781 1.00 0.00 C ATOM 265 OD1 ASP A 17 -16.412 23.757 10.440 1.00 0.00 O ATOM 266 OD2 ASP A 17 -15.314 25.652 10.381 1.00 0.00 O ATOM 0 H ASP A 17 -13.791 22.496 14.445 1.00 0.00 H new ATOM 0 HA ASP A 17 -15.447 24.586 13.443 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -13.538 24.582 11.746 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -14.031 22.958 11.313 1.00 0.00 H new ATOM 271 N LYS A 18 -17.137 22.733 13.314 1.00 0.00 N ATOM 272 CA LYS A 18 -18.113 21.656 13.356 1.00 0.00 C ATOM 273 C LYS A 18 -19.417 22.067 12.677 1.00 0.00 C ATOM 274 O LYS A 18 -20.108 22.983 13.125 1.00 0.00 O ATOM 275 CB LYS A 18 -18.366 21.225 14.810 1.00 0.00 C ATOM 276 CG LYS A 18 -18.775 22.362 15.736 1.00 0.00 C ATOM 277 CD LYS A 18 -18.948 21.893 17.169 1.00 0.00 C ATOM 278 CE LYS A 18 -19.470 23.011 18.055 1.00 0.00 C ATOM 279 NZ LYS A 18 -19.622 22.580 19.468 1.00 0.00 N ATOM 0 H LYS A 18 -17.532 23.668 13.413 1.00 0.00 H new ATOM 0 HA LYS A 18 -17.708 20.806 12.806 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -19.146 20.464 14.821 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -17.461 20.760 15.202 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -18.021 23.148 15.700 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -19.709 22.800 15.382 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -19.639 21.050 17.197 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -17.993 21.536 17.555 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -18.788 23.860 18.007 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -20.433 23.354 17.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -19.980 23.374 20.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -20.293 21.787 19.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -18.699 22.277 19.840 1.00 0.00 H new ATOM 293 N PHE A 19 -19.747 21.398 11.585 1.00 0.00 N ATOM 294 CA PHE A 19 -20.998 21.633 10.906 1.00 0.00 C ATOM 295 C PHE A 19 -21.528 20.288 10.426 1.00 0.00 C ATOM 296 O PHE A 19 -22.624 19.894 10.822 1.00 0.00 O ATOM 297 CB PHE A 19 -20.840 22.651 9.766 1.00 0.00 C ATOM 298 CG PHE A 19 -22.143 23.170 9.216 1.00 0.00 C ATOM 299 CD1 PHE A 19 -22.793 22.511 8.186 1.00 0.00 C ATOM 300 CD2 PHE A 19 -22.712 24.324 9.729 1.00 0.00 C ATOM 301 CE1 PHE A 19 -23.985 22.993 7.677 1.00 0.00 C ATOM 302 CE2 PHE A 19 -23.903 24.811 9.225 1.00 0.00 C ATOM 303 CZ PHE A 19 -24.540 24.143 8.198 1.00 0.00 C ATOM 0 H PHE A 19 -19.159 20.686 11.153 1.00 0.00 H new ATOM 0 HA PHE A 19 -21.722 22.079 11.588 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.249 23.493 10.126 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -20.276 22.188 8.956 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -22.364 21.609 7.775 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -22.219 24.850 10.533 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -24.481 22.470 6.873 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -24.335 25.713 9.634 1.00 0.00 H new ATOM 0 HZ PHE A 19 -25.472 24.521 7.803 1.00 0.00 H new ATOM 313 N LEU A 20 -20.780 19.561 9.579 1.00 0.00 N ATOM 314 CA LEU A 20 -19.650 20.072 8.801 1.00 0.00 C ATOM 315 C LEU A 20 -20.108 20.267 7.362 1.00 0.00 C ATOM 316 O LEU A 20 -20.622 19.333 6.744 1.00 0.00 O ATOM 317 CB LEU A 20 -18.475 19.088 8.829 1.00 0.00 C ATOM 318 CG LEU A 20 -17.652 19.069 10.117 1.00 0.00 C ATOM 319 CD1 LEU A 20 -16.694 17.888 10.118 1.00 0.00 C ATOM 320 CD2 LEU A 20 -16.878 20.369 10.265 1.00 0.00 C ATOM 0 H LEU A 20 -20.955 18.570 9.415 1.00 0.00 H new ATOM 0 HA LEU A 20 -19.315 21.015 9.233 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -18.862 18.084 8.653 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -17.809 19.323 7.999 1.00 0.00 H new ATOM 0 HG LEU A 20 -18.333 18.966 10.962 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -16.116 17.889 11.042 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -17.261 16.960 10.046 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -16.018 17.967 9.267 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -16.296 20.343 11.186 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -16.207 20.492 9.415 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -17.576 21.206 10.300 1.00 0.00 H new ATOM 332 N GLY A 21 -19.927 21.463 6.825 1.00 0.00 N ATOM 333 CA GLY A 21 -20.497 21.765 5.529 1.00 0.00 C ATOM 334 C GLY A 21 -19.549 22.495 4.609 1.00 0.00 C ATOM 335 O GLY A 21 -19.045 23.567 4.949 1.00 0.00 O ATOM 0 H GLY A 21 -19.402 22.223 7.257 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -20.809 20.836 5.053 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -21.394 22.369 5.667 1.00 0.00 H new ATOM 339 N THR A 22 -19.296 21.899 3.450 1.00 0.00 N ATOM 340 CA THR A 22 -18.521 22.532 2.389 1.00 0.00 C ATOM 341 C THR A 22 -18.832 21.848 1.056 1.00 0.00 C ATOM 342 O THR A 22 -19.735 22.267 0.328 1.00 0.00 O ATOM 343 CB THR A 22 -16.995 22.470 2.660 1.00 0.00 C ATOM 344 OG1 THR A 22 -16.679 23.116 3.901 1.00 0.00 O ATOM 345 CG2 THR A 22 -16.209 23.129 1.533 1.00 0.00 C ATOM 0 H THR A 22 -19.623 20.961 3.219 1.00 0.00 H new ATOM 0 HA THR A 22 -18.806 23.584 2.354 1.00 0.00 H new ATOM 0 HB THR A 22 -16.713 21.419 2.716 1.00 0.00 H new ATOM 0 HG1 THR A 22 -17.447 23.647 4.198 1.00 0.00 H new ATOM 0 HG21 THR A 22 -15.143 23.070 1.751 1.00 0.00 H new ATOM 0 HG22 THR A 22 -16.417 22.614 0.595 1.00 0.00 H new ATOM 0 HG23 THR A 22 -16.505 24.175 1.446 1.00 0.00 H new ATOM 353 N GLU A 23 -18.115 20.761 0.788 1.00 0.00 N ATOM 354 CA GLU A 23 -18.270 19.973 -0.426 1.00 0.00 C ATOM 355 C GLU A 23 -17.622 18.618 -0.208 1.00 0.00 C ATOM 356 O GLU A 23 -17.097 18.343 0.871 1.00 0.00 O ATOM 357 CB GLU A 23 -17.619 20.664 -1.631 1.00 0.00 C ATOM 358 CG GLU A 23 -18.487 21.726 -2.286 1.00 0.00 C ATOM 359 CD GLU A 23 -17.770 22.462 -3.395 1.00 0.00 C ATOM 360 OE1 GLU A 23 -17.714 21.939 -4.524 1.00 0.00 O ATOM 361 OE2 GLU A 23 -17.261 23.575 -3.143 1.00 0.00 O ATOM 0 H GLU A 23 -17.400 20.399 1.419 1.00 0.00 H new ATOM 0 HA GLU A 23 -19.333 19.863 -0.639 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -16.684 21.123 -1.311 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -17.365 19.909 -2.375 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.386 21.258 -2.688 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -18.811 22.442 -1.530 1.00 0.00 H new ATOM 368 N ASN A 24 -17.656 17.780 -1.223 1.00 0.00 N ATOM 369 CA ASN A 24 -17.005 16.481 -1.161 1.00 0.00 C ATOM 370 C ASN A 24 -15.789 16.503 -2.082 1.00 0.00 C ATOM 371 O ASN A 24 -15.264 15.468 -2.489 1.00 0.00 O ATOM 372 CB ASN A 24 -17.995 15.389 -1.574 1.00 0.00 C ATOM 373 CG ASN A 24 -17.590 14.002 -1.107 1.00 0.00 C ATOM 374 OD1 ASN A 24 -16.910 13.256 -1.962 1.00 0.00 O flip ATOM 375 ND2 ASN A 24 -17.899 13.599 0.014 1.00 0.00 N flip ATOM 0 H ASN A 24 -18.129 17.973 -2.106 1.00 0.00 H new ATOM 0 HA ASN A 24 -16.675 16.266 -0.145 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -18.978 15.628 -1.169 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -18.089 15.386 -2.660 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -18.424 14.203 0.646 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -17.630 12.661 0.311 1.00 0.00 H new ATOM 382 N ALA A 25 -15.328 17.718 -2.367 1.00 0.00 N ATOM 383 CA ALA A 25 -14.260 17.951 -3.332 1.00 0.00 C ATOM 384 C ALA A 25 -12.975 17.222 -2.960 1.00 0.00 C ATOM 385 O ALA A 25 -12.361 16.574 -3.808 1.00 0.00 O ATOM 386 CB ALA A 25 -13.994 19.442 -3.460 1.00 0.00 C ATOM 0 H ALA A 25 -15.686 18.569 -1.934 1.00 0.00 H new ATOM 0 HA ALA A 25 -14.593 17.552 -4.290 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -13.195 19.608 -4.183 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.900 19.945 -3.798 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -13.696 19.843 -2.491 1.00 0.00 H new ATOM 392 N GLU A 26 -12.575 17.318 -1.694 1.00 0.00 N ATOM 393 CA GLU A 26 -11.322 16.718 -1.244 1.00 0.00 C ATOM 394 C GLU A 26 -11.372 15.200 -1.354 1.00 0.00 C ATOM 395 O GLU A 26 -10.398 14.567 -1.759 1.00 0.00 O ATOM 396 CB GLU A 26 -10.998 17.127 0.194 1.00 0.00 C ATOM 397 CG GLU A 26 -10.741 18.615 0.360 1.00 0.00 C ATOM 398 CD GLU A 26 -10.261 18.977 1.753 1.00 0.00 C ATOM 399 OE1 GLU A 26 -11.108 19.254 2.630 1.00 0.00 O ATOM 400 OE2 GLU A 26 -9.031 19.012 1.974 1.00 0.00 O ATOM 0 H GLU A 26 -13.098 17.803 -0.965 1.00 0.00 H new ATOM 0 HA GLU A 26 -10.531 17.089 -1.896 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -11.825 16.835 0.841 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.120 16.575 0.531 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.997 18.934 -0.370 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.657 19.164 0.142 1.00 0.00 H new ATOM 407 N LEU A 27 -12.512 14.625 -1.011 1.00 0.00 N ATOM 408 CA LEU A 27 -12.676 13.187 -1.047 1.00 0.00 C ATOM 409 C LEU A 27 -12.730 12.683 -2.491 1.00 0.00 C ATOM 410 O LEU A 27 -12.160 11.641 -2.815 1.00 0.00 O ATOM 411 CB LEU A 27 -13.939 12.797 -0.280 1.00 0.00 C ATOM 412 CG LEU A 27 -14.269 11.311 -0.295 1.00 0.00 C ATOM 413 CD1 LEU A 27 -13.152 10.504 0.349 1.00 0.00 C ATOM 414 CD2 LEU A 27 -15.586 11.050 0.414 1.00 0.00 C ATOM 0 H LEU A 27 -13.339 15.137 -0.704 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.817 12.718 -0.568 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.831 13.119 0.756 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.783 13.345 -0.698 1.00 0.00 H new ATOM 0 HG LEU A 27 -14.366 10.995 -1.334 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -13.409 9.445 0.327 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.224 10.664 -0.201 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.021 10.824 1.383 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -15.805 9.982 0.393 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -15.515 11.386 1.449 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -16.385 11.594 -0.090 1.00 0.00 H new ATOM 426 N VAL A 28 -13.399 13.436 -3.360 1.00 0.00 N ATOM 427 CA VAL A 28 -13.461 13.089 -4.778 1.00 0.00 C ATOM 428 C VAL A 28 -12.083 13.223 -5.427 1.00 0.00 C ATOM 429 O VAL A 28 -11.719 12.439 -6.306 1.00 0.00 O ATOM 430 CB VAL A 28 -14.485 13.964 -5.539 1.00 0.00 C ATOM 431 CG1 VAL A 28 -14.457 13.667 -7.029 1.00 0.00 C ATOM 432 CG2 VAL A 28 -15.888 13.748 -4.995 1.00 0.00 C ATOM 0 H VAL A 28 -13.904 14.286 -3.110 1.00 0.00 H new ATOM 0 HA VAL A 28 -13.789 12.051 -4.841 1.00 0.00 H new ATOM 0 HB VAL A 28 -14.205 15.007 -5.388 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -15.186 14.296 -7.539 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -13.462 13.873 -7.422 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -14.703 12.618 -7.196 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -16.592 14.373 -5.545 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -16.166 12.700 -5.111 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -15.914 14.015 -3.939 1.00 0.00 H new ATOM 442 N TYR A 29 -11.318 14.211 -4.976 1.00 0.00 N ATOM 443 CA TYR A 29 -9.958 14.429 -5.464 1.00 0.00 C ATOM 444 C TYR A 29 -9.084 13.201 -5.213 1.00 0.00 C ATOM 445 O TYR A 29 -8.173 12.904 -5.985 1.00 0.00 O ATOM 446 CB TYR A 29 -9.347 15.661 -4.781 1.00 0.00 C ATOM 447 CG TYR A 29 -7.881 15.888 -5.097 1.00 0.00 C ATOM 448 CD1 TYR A 29 -7.486 16.426 -6.316 1.00 0.00 C ATOM 449 CD2 TYR A 29 -6.894 15.559 -4.176 1.00 0.00 C ATOM 450 CE1 TYR A 29 -6.149 16.629 -6.606 1.00 0.00 C ATOM 451 CE2 TYR A 29 -5.558 15.758 -4.459 1.00 0.00 C ATOM 452 CZ TYR A 29 -5.190 16.292 -5.673 1.00 0.00 C ATOM 453 OH TYR A 29 -3.858 16.487 -5.957 1.00 0.00 O ATOM 0 H TYR A 29 -11.619 14.880 -4.267 1.00 0.00 H new ATOM 0 HA TYR A 29 -10.003 14.601 -6.539 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -9.912 16.544 -5.079 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -9.462 15.558 -3.702 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -8.235 16.690 -7.048 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -7.177 15.140 -3.222 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -5.857 17.049 -7.557 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -4.805 15.496 -3.731 1.00 0.00 H new ATOM 0 HH TYR A 29 -3.315 16.199 -5.194 1.00 0.00 H new ATOM 463 N VAL A 30 -9.367 12.498 -4.128 1.00 0.00 N ATOM 464 CA VAL A 30 -8.616 11.307 -3.769 1.00 0.00 C ATOM 465 C VAL A 30 -9.001 10.124 -4.659 1.00 0.00 C ATOM 466 O VAL A 30 -8.133 9.407 -5.159 1.00 0.00 O ATOM 467 CB VAL A 30 -8.842 10.935 -2.289 1.00 0.00 C ATOM 468 CG1 VAL A 30 -8.109 9.652 -1.935 1.00 0.00 C ATOM 469 CG2 VAL A 30 -8.401 12.067 -1.373 1.00 0.00 C ATOM 0 H VAL A 30 -10.116 12.734 -3.477 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.560 11.532 -3.920 1.00 0.00 H new ATOM 0 HB VAL A 30 -9.910 10.771 -2.144 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.284 9.411 -0.887 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -8.476 8.839 -2.561 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -7.040 9.785 -2.103 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -8.570 11.782 -0.335 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.341 12.267 -1.526 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -8.976 12.964 -1.601 1.00 0.00 H new ATOM 479 N LEU A 31 -10.302 9.948 -4.864 1.00 0.00 N ATOM 480 CA LEU A 31 -10.834 8.805 -5.605 1.00 0.00 C ATOM 481 C LEU A 31 -10.238 8.694 -7.008 1.00 0.00 C ATOM 482 O LEU A 31 -10.209 9.665 -7.766 1.00 0.00 O ATOM 483 CB LEU A 31 -12.358 8.903 -5.706 1.00 0.00 C ATOM 484 CG LEU A 31 -13.107 8.810 -4.376 1.00 0.00 C ATOM 485 CD1 LEU A 31 -14.594 9.033 -4.590 1.00 0.00 C ATOM 486 CD2 LEU A 31 -12.862 7.459 -3.724 1.00 0.00 C ATOM 0 H LEU A 31 -11.017 10.590 -4.523 1.00 0.00 H new ATOM 0 HA LEU A 31 -10.553 7.909 -5.052 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -12.614 9.849 -6.183 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -12.714 8.108 -6.361 1.00 0.00 H new ATOM 0 HG LEU A 31 -12.732 9.588 -3.711 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -15.114 8.964 -3.634 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -14.755 10.021 -5.020 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -14.982 8.274 -5.270 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -13.402 7.408 -2.778 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -13.213 6.667 -4.385 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -11.795 7.332 -3.540 1.00 0.00 H new ATOM 498 N ARG A 32 -9.774 7.495 -7.342 1.00 0.00 N ATOM 499 CA ARG A 32 -9.249 7.207 -8.671 1.00 0.00 C ATOM 500 C ARG A 32 -9.902 5.928 -9.200 1.00 0.00 C ATOM 501 O ARG A 32 -10.862 5.990 -9.967 1.00 0.00 O ATOM 502 CB ARG A 32 -7.717 7.058 -8.627 1.00 0.00 C ATOM 503 CG ARG A 32 -6.976 7.554 -9.872 1.00 0.00 C ATOM 504 CD ARG A 32 -7.216 6.682 -11.101 1.00 0.00 C ATOM 505 NE ARG A 32 -8.461 7.015 -11.796 1.00 0.00 N ATOM 506 CZ ARG A 32 -9.029 6.249 -12.730 1.00 0.00 C ATOM 507 NH1 ARG A 32 -8.447 5.120 -13.119 1.00 0.00 N ATOM 508 NH2 ARG A 32 -10.172 6.625 -13.291 1.00 0.00 N ATOM 0 H ARG A 32 -9.751 6.700 -6.703 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.483 8.035 -9.341 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -7.340 7.600 -7.760 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -7.475 6.006 -8.475 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.290 8.574 -10.091 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -5.907 7.588 -9.661 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -6.379 6.794 -11.790 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -7.242 5.635 -10.799 1.00 0.00 H new ATOM 0 HE ARG A 32 -8.925 7.890 -11.550 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -7.561 4.834 -12.703 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -8.887 4.539 -13.833 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -10.616 7.499 -13.008 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -10.606 6.040 -14.005 1.00 0.00 H new ATOM 522 N HIS A 33 -9.399 4.772 -8.764 1.00 0.00 N ATOM 523 CA HIS A 33 -9.963 3.488 -9.176 1.00 0.00 C ATOM 524 C HIS A 33 -9.350 2.352 -8.361 1.00 0.00 C ATOM 525 O HIS A 33 -8.147 2.353 -8.084 1.00 0.00 O ATOM 526 CB HIS A 33 -9.728 3.245 -10.673 1.00 0.00 C ATOM 527 CG HIS A 33 -10.481 2.072 -11.227 1.00 0.00 C ATOM 528 ND1 HIS A 33 -9.871 0.908 -11.649 1.00 0.00 N ATOM 529 CD2 HIS A 33 -11.809 1.893 -11.433 1.00 0.00 C ATOM 530 CE1 HIS A 33 -10.790 0.067 -12.086 1.00 0.00 C ATOM 531 NE2 HIS A 33 -11.971 0.640 -11.964 1.00 0.00 N ATOM 0 H HIS A 33 -8.605 4.700 -8.128 1.00 0.00 H new ATOM 0 HA HIS A 33 -11.037 3.515 -8.994 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -10.014 4.140 -11.225 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -8.662 3.092 -10.843 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -12.593 2.605 -11.219 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -10.606 -0.923 -12.477 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -12.863 0.218 -12.223 1.00 0.00 H new ATOM 540 N LYS A 34 -10.189 1.400 -7.974 1.00 0.00 N ATOM 541 CA LYS A 34 -9.758 0.225 -7.219 1.00 0.00 C ATOM 542 C LYS A 34 -8.743 -0.608 -8.010 1.00 0.00 C ATOM 543 O LYS A 34 -8.789 -0.663 -9.239 1.00 0.00 O ATOM 544 CB LYS A 34 -10.986 -0.619 -6.843 1.00 0.00 C ATOM 545 CG LYS A 34 -10.659 -1.966 -6.213 1.00 0.00 C ATOM 546 CD LYS A 34 -11.914 -2.667 -5.714 1.00 0.00 C ATOM 547 CE LYS A 34 -11.639 -4.121 -5.363 1.00 0.00 C ATOM 548 NZ LYS A 34 -11.381 -4.938 -6.578 1.00 0.00 N ATOM 0 H LYS A 34 -11.189 1.418 -8.174 1.00 0.00 H new ATOM 0 HA LYS A 34 -9.259 0.558 -6.309 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -11.604 -0.049 -6.150 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.584 -0.787 -7.739 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.154 -2.598 -6.944 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -9.967 -1.823 -5.383 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -12.298 -2.146 -4.837 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -12.689 -2.617 -6.479 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -10.779 -4.178 -4.696 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.491 -4.532 -4.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -11.466 -5.947 -6.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -12.075 -4.695 -7.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -10.421 -4.744 -6.929 1.00 0.00 H new ATOM 562 N HIS A 35 -7.817 -1.233 -7.292 1.00 0.00 N ATOM 563 CA HIS A 35 -6.767 -2.046 -7.902 1.00 0.00 C ATOM 564 C HIS A 35 -6.856 -3.495 -7.418 1.00 0.00 C ATOM 565 O HIS A 35 -7.872 -3.894 -6.843 1.00 0.00 O ATOM 566 CB HIS A 35 -5.388 -1.452 -7.581 1.00 0.00 C ATOM 567 CG HIS A 35 -4.988 -0.324 -8.483 1.00 0.00 C ATOM 568 ND1 HIS A 35 -5.734 0.825 -8.636 1.00 0.00 N ATOM 569 CD2 HIS A 35 -3.906 -0.176 -9.287 1.00 0.00 C ATOM 570 CE1 HIS A 35 -5.130 1.628 -9.490 1.00 0.00 C ATOM 571 NE2 HIS A 35 -4.019 1.047 -9.901 1.00 0.00 N ATOM 0 H HIS A 35 -7.771 -1.192 -6.274 1.00 0.00 H new ATOM 0 HA HIS A 35 -6.906 -2.042 -8.983 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -5.387 -1.098 -6.550 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.639 -2.241 -7.648 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -6.615 1.023 -8.163 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -3.105 -0.888 -9.420 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -5.485 2.599 -9.801 1.00 0.00 H new ATOM 580 N GLY A 36 -5.795 -4.270 -7.659 1.00 0.00 N ATOM 581 CA GLY A 36 -5.780 -5.689 -7.318 1.00 0.00 C ATOM 582 C GLY A 36 -5.954 -5.987 -5.834 1.00 0.00 C ATOM 583 O GLY A 36 -6.198 -5.091 -5.022 1.00 0.00 O ATOM 0 H GLY A 36 -4.934 -3.934 -8.091 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.574 -6.190 -7.871 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.837 -6.120 -7.653 1.00 0.00 H new ATOM 587 N GLN A 37 -5.809 -7.262 -5.487 1.00 0.00 N ATOM 588 CA GLN A 37 -6.078 -7.729 -4.134 1.00 0.00 C ATOM 589 C GLN A 37 -4.815 -7.694 -3.279 1.00 0.00 C ATOM 590 O GLN A 37 -4.843 -7.245 -2.138 1.00 0.00 O ATOM 591 CB GLN A 37 -6.645 -9.153 -4.170 1.00 0.00 C ATOM 592 CG GLN A 37 -7.135 -9.643 -2.815 1.00 0.00 C ATOM 593 CD GLN A 37 -7.649 -11.073 -2.849 1.00 0.00 C ATOM 594 OE1 GLN A 37 -8.134 -11.548 -3.874 1.00 0.00 O ATOM 595 NE2 GLN A 37 -7.565 -11.765 -1.721 1.00 0.00 N ATOM 0 H GLN A 37 -5.505 -7.993 -6.130 1.00 0.00 H new ATOM 0 HA GLN A 37 -6.813 -7.060 -3.686 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -7.470 -9.190 -4.881 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -5.877 -9.833 -4.538 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -6.321 -9.573 -2.094 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.930 -8.986 -2.463 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -7.156 -11.338 -0.890 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -7.909 -12.724 -1.684 1.00 0.00 H new ATOM 604 N PHE A 38 -3.717 -8.187 -3.830 1.00 0.00 N ATOM 605 CA PHE A 38 -2.434 -8.172 -3.135 1.00 0.00 C ATOM 606 C PHE A 38 -1.385 -7.496 -3.998 1.00 0.00 C ATOM 607 O PHE A 38 -0.704 -8.152 -4.792 1.00 0.00 O ATOM 608 CB PHE A 38 -1.970 -9.592 -2.790 1.00 0.00 C ATOM 609 CG PHE A 38 -2.787 -10.275 -1.731 1.00 0.00 C ATOM 610 CD1 PHE A 38 -2.644 -9.930 -0.398 1.00 0.00 C ATOM 611 CD2 PHE A 38 -3.691 -11.269 -2.068 1.00 0.00 C ATOM 612 CE1 PHE A 38 -3.387 -10.561 0.579 1.00 0.00 C ATOM 613 CE2 PHE A 38 -4.436 -11.905 -1.092 1.00 0.00 C ATOM 614 CZ PHE A 38 -4.283 -11.550 0.232 1.00 0.00 C ATOM 0 H PHE A 38 -3.686 -8.605 -4.760 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.564 -7.616 -2.206 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.993 -10.198 -3.696 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.932 -9.551 -2.460 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -1.942 -9.158 -0.119 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -3.815 -11.550 -3.103 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -3.267 -10.280 1.615 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -5.137 -12.679 -1.366 1.00 0.00 H new ATOM 0 HZ PHE A 38 -4.864 -12.046 0.996 1.00 0.00 H new ATOM 624 N ILE A 39 -1.260 -6.189 -3.853 1.00 0.00 N ATOM 625 CA ILE A 39 -0.381 -5.416 -4.715 1.00 0.00 C ATOM 626 C ILE A 39 0.731 -4.745 -3.915 1.00 0.00 C ATOM 627 O ILE A 39 0.477 -4.091 -2.899 1.00 0.00 O ATOM 628 CB ILE A 39 -1.166 -4.330 -5.487 1.00 0.00 C ATOM 629 CG1 ILE A 39 -2.377 -4.942 -6.204 1.00 0.00 C ATOM 630 CG2 ILE A 39 -0.260 -3.614 -6.481 1.00 0.00 C ATOM 631 CD1 ILE A 39 -2.021 -6.030 -7.195 1.00 0.00 C ATOM 0 H ILE A 39 -1.754 -5.641 -3.149 1.00 0.00 H new ATOM 0 HA ILE A 39 0.059 -6.117 -5.425 1.00 0.00 H new ATOM 0 HB ILE A 39 -1.530 -3.597 -4.767 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.058 -5.352 -5.459 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.915 -4.151 -6.726 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.832 -2.854 -7.013 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.563 -3.140 -5.947 1.00 0.00 H new ATOM 0 HG23 ILE A 39 0.138 -4.335 -7.195 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -2.931 -6.411 -7.659 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.365 -5.622 -7.964 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.511 -6.842 -6.676 1.00 0.00 H new ATOM 643 N TYR A 40 1.960 -4.924 -4.370 1.00 0.00 N ATOM 644 CA TYR A 40 3.095 -4.222 -3.802 1.00 0.00 C ATOM 645 C TYR A 40 3.714 -3.324 -4.866 1.00 0.00 C ATOM 646 O TYR A 40 4.078 -3.795 -5.947 1.00 0.00 O ATOM 647 CB TYR A 40 4.140 -5.211 -3.273 1.00 0.00 C ATOM 648 CG TYR A 40 5.238 -4.553 -2.464 1.00 0.00 C ATOM 649 CD1 TYR A 40 5.078 -4.339 -1.104 1.00 0.00 C ATOM 650 CD2 TYR A 40 6.430 -4.148 -3.055 1.00 0.00 C ATOM 651 CE1 TYR A 40 6.067 -3.738 -0.352 1.00 0.00 C ATOM 652 CE2 TYR A 40 7.426 -3.545 -2.308 1.00 0.00 C ATOM 653 CZ TYR A 40 7.238 -3.343 -0.955 1.00 0.00 C ATOM 654 OH TYR A 40 8.223 -2.746 -0.204 1.00 0.00 O ATOM 0 H TYR A 40 2.196 -5.554 -5.136 1.00 0.00 H new ATOM 0 HA TYR A 40 2.752 -3.615 -2.964 1.00 0.00 H new ATOM 0 HB2 TYR A 40 3.642 -5.958 -2.655 1.00 0.00 H new ATOM 0 HB3 TYR A 40 4.587 -5.740 -4.115 1.00 0.00 H new ATOM 0 HD1 TYR A 40 4.162 -4.649 -0.623 1.00 0.00 H new ATOM 0 HD2 TYR A 40 6.580 -4.307 -4.113 1.00 0.00 H new ATOM 0 HE1 TYR A 40 5.922 -3.579 0.706 1.00 0.00 H new ATOM 0 HE2 TYR A 40 8.346 -3.234 -2.781 1.00 0.00 H new ATOM 0 HH TYR A 40 9.074 -2.788 -0.688 1.00 0.00 H new ATOM 664 N VAL A 41 3.809 -2.035 -4.575 1.00 0.00 N ATOM 665 CA VAL A 41 4.401 -1.088 -5.508 1.00 0.00 C ATOM 666 C VAL A 41 5.559 -0.330 -4.860 1.00 0.00 C ATOM 667 O VAL A 41 5.360 0.578 -4.053 1.00 0.00 O ATOM 668 CB VAL A 41 3.353 -0.092 -6.064 1.00 0.00 C ATOM 669 CG1 VAL A 41 2.431 -0.784 -7.052 1.00 0.00 C ATOM 670 CG2 VAL A 41 2.540 0.536 -4.943 1.00 0.00 C ATOM 0 H VAL A 41 3.484 -1.621 -3.701 1.00 0.00 H new ATOM 0 HA VAL A 41 4.788 -1.668 -6.346 1.00 0.00 H new ATOM 0 HB VAL A 41 3.892 0.702 -6.580 1.00 0.00 H new ATOM 0 HG11 VAL A 41 1.702 -0.068 -7.432 1.00 0.00 H new ATOM 0 HG12 VAL A 41 3.017 -1.179 -7.881 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.911 -1.602 -6.553 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.813 1.230 -5.365 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.017 -0.245 -4.391 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.206 1.074 -4.268 1.00 0.00 H new ATOM 680 N TRP A 42 6.769 -0.728 -5.202 1.00 0.00 N ATOM 681 CA TRP A 42 7.959 -0.081 -4.674 1.00 0.00 C ATOM 682 C TRP A 42 8.382 1.058 -5.594 1.00 0.00 C ATOM 683 O TRP A 42 7.946 1.121 -6.742 1.00 0.00 O ATOM 684 CB TRP A 42 9.095 -1.099 -4.519 1.00 0.00 C ATOM 685 CG TRP A 42 9.559 -1.700 -5.816 1.00 0.00 C ATOM 686 CD1 TRP A 42 9.057 -2.810 -6.431 1.00 0.00 C ATOM 687 CD2 TRP A 42 10.629 -1.230 -6.651 1.00 0.00 C ATOM 688 NE1 TRP A 42 9.741 -3.053 -7.596 1.00 0.00 N ATOM 689 CE2 TRP A 42 10.707 -2.096 -7.755 1.00 0.00 C ATOM 690 CE3 TRP A 42 11.521 -0.154 -6.575 1.00 0.00 C ATOM 691 CZ2 TRP A 42 11.644 -1.925 -8.772 1.00 0.00 C ATOM 692 CZ3 TRP A 42 12.450 0.013 -7.584 1.00 0.00 C ATOM 693 CH2 TRP A 42 12.503 -0.866 -8.671 1.00 0.00 C ATOM 0 H TRP A 42 6.956 -1.498 -5.844 1.00 0.00 H new ATOM 0 HA TRP A 42 7.732 0.330 -3.690 1.00 0.00 H new ATOM 0 HB2 TRP A 42 9.941 -0.613 -4.033 1.00 0.00 H new ATOM 0 HB3 TRP A 42 8.764 -1.900 -3.857 1.00 0.00 H new ATOM 0 HD1 TRP A 42 8.241 -3.410 -6.056 1.00 0.00 H new ATOM 0 HE1 TRP A 42 9.559 -3.823 -8.240 1.00 0.00 H new ATOM 0 HE3 TRP A 42 11.484 0.533 -5.743 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 11.690 -2.605 -9.610 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 13.147 0.836 -7.533 1.00 0.00 H new ATOM 0 HH2 TRP A 42 13.237 -0.705 -9.446 1.00 0.00 H new ATOM 704 N GLY A 43 9.226 1.954 -5.098 1.00 0.00 N ATOM 705 CA GLY A 43 9.685 3.053 -5.920 1.00 0.00 C ATOM 706 C GLY A 43 9.976 4.308 -5.122 1.00 0.00 C ATOM 707 O GLY A 43 10.197 4.250 -3.912 1.00 0.00 O ATOM 0 H GLY A 43 9.598 1.939 -4.148 1.00 0.00 H new ATOM 0 HA2 GLY A 43 10.587 2.750 -6.452 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.930 3.275 -6.674 1.00 0.00 H new ATOM 711 N GLU A 44 9.965 5.444 -5.808 1.00 0.00 N ATOM 712 CA GLU A 44 10.304 6.723 -5.200 1.00 0.00 C ATOM 713 C GLU A 44 9.020 7.455 -4.786 1.00 0.00 C ATOM 714 O GLU A 44 7.952 7.213 -5.357 1.00 0.00 O ATOM 715 CB GLU A 44 11.112 7.558 -6.210 1.00 0.00 C ATOM 716 CG GLU A 44 12.109 8.536 -5.592 1.00 0.00 C ATOM 717 CD GLU A 44 11.445 9.704 -4.899 1.00 0.00 C ATOM 718 OE1 GLU A 44 10.843 10.548 -5.593 1.00 0.00 O ATOM 719 OE2 GLU A 44 11.492 9.769 -3.654 1.00 0.00 O ATOM 0 H GLU A 44 9.722 5.504 -6.797 1.00 0.00 H new ATOM 0 HA GLU A 44 10.909 6.566 -4.307 1.00 0.00 H new ATOM 0 HB2 GLU A 44 11.654 6.879 -6.868 1.00 0.00 H new ATOM 0 HB3 GLU A 44 10.416 8.119 -6.834 1.00 0.00 H new ATOM 0 HG2 GLU A 44 12.734 8.004 -4.875 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.770 8.913 -6.372 1.00 0.00 H new ATOM 726 N GLU A 45 9.134 8.346 -3.806 1.00 0.00 N ATOM 727 CA GLU A 45 7.996 9.105 -3.292 1.00 0.00 C ATOM 728 C GLU A 45 7.304 9.891 -4.404 1.00 0.00 C ATOM 729 O GLU A 45 6.079 9.924 -4.484 1.00 0.00 O ATOM 730 CB GLU A 45 8.471 10.062 -2.196 1.00 0.00 C ATOM 731 CG GLU A 45 7.371 10.944 -1.629 1.00 0.00 C ATOM 732 CD GLU A 45 7.899 11.998 -0.679 1.00 0.00 C ATOM 733 OE1 GLU A 45 8.379 13.045 -1.159 1.00 0.00 O ATOM 734 OE2 GLU A 45 7.836 11.788 0.550 1.00 0.00 O ATOM 0 H GLU A 45 10.018 8.563 -3.345 1.00 0.00 H new ATOM 0 HA GLU A 45 7.274 8.401 -2.879 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.911 9.481 -1.386 1.00 0.00 H new ATOM 0 HB3 GLU A 45 9.261 10.696 -2.599 1.00 0.00 H new ATOM 0 HG2 GLU A 45 6.843 11.431 -2.449 1.00 0.00 H new ATOM 0 HG3 GLU A 45 6.644 10.321 -1.107 1.00 0.00 H new ATOM 741 N GLY A 46 8.100 10.505 -5.273 1.00 0.00 N ATOM 742 CA GLY A 46 7.552 11.309 -6.348 1.00 0.00 C ATOM 743 C GLY A 46 6.892 10.471 -7.425 1.00 0.00 C ATOM 744 O GLY A 46 6.172 10.996 -8.277 1.00 0.00 O ATOM 0 H GLY A 46 9.119 10.459 -5.251 1.00 0.00 H new ATOM 0 HA2 GLY A 46 6.822 12.008 -5.939 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.349 11.905 -6.794 1.00 0.00 H new ATOM 748 N ALA A 47 7.134 9.168 -7.387 1.00 0.00 N ATOM 749 CA ALA A 47 6.556 8.253 -8.359 1.00 0.00 C ATOM 750 C ALA A 47 5.277 7.621 -7.819 1.00 0.00 C ATOM 751 O ALA A 47 4.285 7.491 -8.539 1.00 0.00 O ATOM 752 CB ALA A 47 7.564 7.179 -8.736 1.00 0.00 C ATOM 0 H ALA A 47 7.729 8.720 -6.690 1.00 0.00 H new ATOM 0 HA ALA A 47 6.300 8.821 -9.253 1.00 0.00 H new ATOM 0 HB1 ALA A 47 7.118 6.501 -9.464 1.00 0.00 H new ATOM 0 HB2 ALA A 47 8.448 7.646 -9.169 1.00 0.00 H new ATOM 0 HB3 ALA A 47 7.849 6.619 -7.845 1.00 0.00 H new ATOM 758 N GLY A 48 5.302 7.250 -6.547 1.00 0.00 N ATOM 759 CA GLY A 48 4.153 6.608 -5.938 1.00 0.00 C ATOM 760 C GLY A 48 3.110 7.602 -5.466 1.00 0.00 C ATOM 761 O GLY A 48 2.136 7.862 -6.177 1.00 0.00 O ATOM 0 H GLY A 48 6.099 7.382 -5.924 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.700 5.926 -6.657 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.484 6.006 -5.092 1.00 0.00 H new ATOM 765 N LYS A 49 3.332 8.158 -4.271 1.00 0.00 N ATOM 766 CA LYS A 49 2.402 9.093 -3.630 1.00 0.00 C ATOM 767 C LYS A 49 1.145 8.363 -3.157 1.00 0.00 C ATOM 768 O LYS A 49 0.572 7.543 -3.876 1.00 0.00 O ATOM 769 CB LYS A 49 2.042 10.269 -4.553 1.00 0.00 C ATOM 770 CG LYS A 49 3.241 11.132 -4.920 1.00 0.00 C ATOM 771 CD LYS A 49 2.853 12.349 -5.748 1.00 0.00 C ATOM 772 CE LYS A 49 1.967 13.305 -4.962 1.00 0.00 C ATOM 773 NZ LYS A 49 1.850 14.628 -5.630 1.00 0.00 N ATOM 0 H LYS A 49 4.168 7.971 -3.717 1.00 0.00 H new ATOM 0 HA LYS A 49 2.907 9.512 -2.760 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.589 9.881 -5.465 1.00 0.00 H new ATOM 0 HB3 LYS A 49 1.292 10.890 -4.064 1.00 0.00 H new ATOM 0 HG2 LYS A 49 3.740 11.461 -4.009 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.960 10.531 -5.478 1.00 0.00 H new ATOM 0 HD2 LYS A 49 3.753 12.871 -6.072 1.00 0.00 H new ATOM 0 HD3 LYS A 49 2.330 12.025 -6.648 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.975 12.868 -4.846 1.00 0.00 H new ATOM 0 HE3 LYS A 49 2.376 13.439 -3.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.239 15.250 -5.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 2.793 15.057 -5.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 1.436 14.504 -6.576 1.00 0.00 H new ATOM 787 N SER A 50 0.709 8.682 -1.948 1.00 0.00 N ATOM 788 CA SER A 50 -0.365 7.945 -1.294 1.00 0.00 C ATOM 789 C SER A 50 -1.743 8.343 -1.840 1.00 0.00 C ATOM 790 O SER A 50 -2.773 7.862 -1.364 1.00 0.00 O ATOM 791 CB SER A 50 -0.291 8.190 0.212 1.00 0.00 C ATOM 792 OG SER A 50 1.057 8.151 0.662 1.00 0.00 O ATOM 0 H SER A 50 1.085 9.452 -1.395 1.00 0.00 H new ATOM 0 HA SER A 50 -0.236 6.883 -1.502 1.00 0.00 H new ATOM 0 HB2 SER A 50 -0.731 9.158 0.450 1.00 0.00 H new ATOM 0 HB3 SER A 50 -0.877 7.436 0.737 1.00 0.00 H new ATOM 0 HG SER A 50 1.445 7.275 0.458 1.00 0.00 H new ATOM 798 N HIS A 51 -1.750 9.204 -2.855 1.00 0.00 N ATOM 799 CA HIS A 51 -2.986 9.631 -3.510 1.00 0.00 C ATOM 800 C HIS A 51 -3.781 8.428 -4.017 1.00 0.00 C ATOM 801 O HIS A 51 -4.986 8.334 -3.795 1.00 0.00 O ATOM 802 CB HIS A 51 -2.659 10.596 -4.664 1.00 0.00 C ATOM 803 CG HIS A 51 -3.730 10.713 -5.719 1.00 0.00 C ATOM 804 ND1 HIS A 51 -3.726 10.333 -7.021 1.00 0.00 N flip ATOM 805 CD2 HIS A 51 -4.974 11.269 -5.491 1.00 0.00 C flip ATOM 806 CE1 HIS A 51 -4.950 10.663 -7.547 1.00 0.00 C flip ATOM 807 NE2 HIS A 51 -5.684 11.224 -6.606 1.00 0.00 N flip ATOM 0 H HIS A 51 -0.906 9.623 -3.245 1.00 0.00 H new ATOM 0 HA HIS A 51 -3.605 10.152 -2.780 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -2.470 11.586 -4.248 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -1.735 10.269 -5.140 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -5.313 11.676 -4.550 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -5.262 10.491 -8.567 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -6.638 11.566 -6.719 1.00 0.00 H new ATOM 816 N LEU A 52 -3.101 7.513 -4.695 1.00 0.00 N ATOM 817 CA LEU A 52 -3.742 6.338 -5.239 1.00 0.00 C ATOM 818 C LEU A 52 -4.046 5.328 -4.131 1.00 0.00 C ATOM 819 O LEU A 52 -5.006 4.562 -4.217 1.00 0.00 O ATOM 820 CB LEU A 52 -2.833 5.723 -6.302 1.00 0.00 C ATOM 821 CG LEU A 52 -3.313 4.400 -6.868 1.00 0.00 C ATOM 822 CD1 LEU A 52 -4.611 4.584 -7.643 1.00 0.00 C ATOM 823 CD2 LEU A 52 -2.242 3.773 -7.745 1.00 0.00 C ATOM 0 H LEU A 52 -2.099 7.569 -4.879 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.690 6.620 -5.696 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -2.725 6.434 -7.121 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -1.842 5.579 -5.872 1.00 0.00 H new ATOM 0 HG LEU A 52 -3.510 3.723 -6.037 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -4.937 3.623 -8.040 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -5.378 4.981 -6.979 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -4.448 5.280 -8.466 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.605 2.825 -8.141 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -2.008 4.445 -8.570 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.343 3.598 -7.153 1.00 0.00 H new ATOM 835 N LEU A 53 -3.238 5.369 -3.080 1.00 0.00 N ATOM 836 CA LEU A 53 -3.364 4.441 -1.963 1.00 0.00 C ATOM 837 C LEU A 53 -4.664 4.684 -1.194 1.00 0.00 C ATOM 838 O LEU A 53 -5.364 3.744 -0.814 1.00 0.00 O ATOM 839 CB LEU A 53 -2.167 4.611 -1.022 1.00 0.00 C ATOM 840 CG LEU A 53 -2.063 3.585 0.108 1.00 0.00 C ATOM 841 CD1 LEU A 53 -1.649 2.227 -0.436 1.00 0.00 C ATOM 842 CD2 LEU A 53 -1.081 4.056 1.163 1.00 0.00 C ATOM 0 H LEU A 53 -2.480 6.043 -2.977 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.384 3.425 -2.356 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.253 4.566 -1.614 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.213 5.607 -0.581 1.00 0.00 H new ATOM 0 HG LEU A 53 -3.045 3.483 0.570 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.581 1.512 0.384 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.390 1.883 -1.157 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.679 2.311 -0.925 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -1.019 3.314 1.959 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.097 4.187 0.712 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.420 5.006 1.577 1.00 0.00 H new ATOM 854 N GLN A 54 -4.986 5.956 -0.982 1.00 0.00 N ATOM 855 CA GLN A 54 -6.168 6.335 -0.214 1.00 0.00 C ATOM 856 C GLN A 54 -7.445 6.061 -1.003 1.00 0.00 C ATOM 857 O GLN A 54 -8.477 5.706 -0.429 1.00 0.00 O ATOM 858 CB GLN A 54 -6.104 7.813 0.169 1.00 0.00 C ATOM 859 CG GLN A 54 -4.932 8.170 1.069 1.00 0.00 C ATOM 860 CD GLN A 54 -4.828 9.659 1.330 1.00 0.00 C ATOM 861 OE1 GLN A 54 -4.161 10.387 0.594 1.00 0.00 O ATOM 862 NE2 GLN A 54 -5.490 10.122 2.378 1.00 0.00 N ATOM 0 H GLN A 54 -4.443 6.745 -1.333 1.00 0.00 H new ATOM 0 HA GLN A 54 -6.185 5.731 0.693 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -6.045 8.411 -0.740 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -7.031 8.088 0.672 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -5.035 7.645 2.019 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -4.007 7.820 0.610 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -6.031 9.484 2.962 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -5.459 11.117 2.602 1.00 0.00 H new ATOM 871 N ALA A 55 -7.366 6.222 -2.320 1.00 0.00 N ATOM 872 CA ALA A 55 -8.512 6.003 -3.195 1.00 0.00 C ATOM 873 C ALA A 55 -8.992 4.562 -3.109 1.00 0.00 C ATOM 874 O ALA A 55 -10.191 4.287 -3.154 1.00 0.00 O ATOM 875 CB ALA A 55 -8.150 6.344 -4.629 1.00 0.00 C ATOM 0 H ALA A 55 -6.515 6.505 -2.807 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.320 6.656 -2.866 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.014 6.176 -5.272 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.850 7.390 -4.690 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -7.325 5.711 -4.957 1.00 0.00 H new ATOM 881 N TRP A 56 -8.039 3.656 -2.966 1.00 0.00 N ATOM 882 CA TRP A 56 -8.323 2.230 -2.886 1.00 0.00 C ATOM 883 C TRP A 56 -9.094 1.912 -1.609 1.00 0.00 C ATOM 884 O TRP A 56 -9.969 1.046 -1.594 1.00 0.00 O ATOM 885 CB TRP A 56 -6.999 1.466 -2.936 1.00 0.00 C ATOM 886 CG TRP A 56 -7.126 -0.022 -2.998 1.00 0.00 C ATOM 887 CD1 TRP A 56 -7.514 -0.771 -4.071 1.00 0.00 C ATOM 888 CD2 TRP A 56 -6.822 -0.945 -1.951 1.00 0.00 C ATOM 889 NE1 TRP A 56 -7.482 -2.107 -3.749 1.00 0.00 N ATOM 890 CE2 TRP A 56 -7.062 -2.237 -2.448 1.00 0.00 C ATOM 891 CE3 TRP A 56 -6.382 -0.798 -0.633 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -6.863 -3.378 -1.677 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -6.184 -1.930 0.132 1.00 0.00 C ATOM 894 CH2 TRP A 56 -6.426 -3.205 -0.389 1.00 0.00 C ATOM 0 H TRP A 56 -7.047 3.886 -2.902 1.00 0.00 H new ATOM 0 HA TRP A 56 -8.946 1.926 -3.727 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -6.436 1.803 -3.806 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -6.413 1.728 -2.055 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -7.804 -0.372 -5.032 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -7.729 -2.875 -4.373 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -6.200 0.183 -0.220 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -7.046 -4.364 -2.078 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -5.836 -1.829 1.150 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.265 -4.071 0.236 1.00 0.00 H new ATOM 905 N VAL A 57 -8.782 2.645 -0.552 1.00 0.00 N ATOM 906 CA VAL A 57 -9.449 2.469 0.728 1.00 0.00 C ATOM 907 C VAL A 57 -10.853 3.064 0.699 1.00 0.00 C ATOM 908 O VAL A 57 -11.820 2.403 1.079 1.00 0.00 O ATOM 909 CB VAL A 57 -8.632 3.109 1.869 1.00 0.00 C ATOM 910 CG1 VAL A 57 -9.383 3.037 3.188 1.00 0.00 C ATOM 911 CG2 VAL A 57 -7.283 2.430 1.993 1.00 0.00 C ATOM 0 H VAL A 57 -8.066 3.372 -0.556 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.527 1.398 0.913 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.478 4.160 1.626 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.783 3.496 3.974 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -10.330 3.569 3.097 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.576 1.994 3.441 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -6.716 2.891 2.802 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.427 1.371 2.209 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.734 2.538 1.058 1.00 0.00 H new ATOM 921 N ALA A 58 -10.964 4.301 0.225 1.00 0.00 N ATOM 922 CA ALA A 58 -12.245 5.001 0.196 1.00 0.00 C ATOM 923 C ALA A 58 -13.273 4.252 -0.647 1.00 0.00 C ATOM 924 O ALA A 58 -14.443 4.162 -0.274 1.00 0.00 O ATOM 925 CB ALA A 58 -12.058 6.418 -0.322 1.00 0.00 C ATOM 0 H ALA A 58 -10.181 4.841 -0.145 1.00 0.00 H new ATOM 0 HA ALA A 58 -12.627 5.046 1.216 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -13.021 6.929 -0.339 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -11.372 6.957 0.332 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -11.647 6.385 -1.331 1.00 0.00 H new ATOM 931 N GLN A 59 -12.826 3.692 -1.765 1.00 0.00 N ATOM 932 CA GLN A 59 -13.712 2.929 -2.639 1.00 0.00 C ATOM 933 C GLN A 59 -14.270 1.719 -1.891 1.00 0.00 C ATOM 934 O GLN A 59 -15.452 1.392 -2.002 1.00 0.00 O ATOM 935 CB GLN A 59 -12.957 2.469 -3.889 1.00 0.00 C ATOM 936 CG GLN A 59 -13.854 1.885 -4.973 1.00 0.00 C ATOM 937 CD GLN A 59 -14.776 2.918 -5.592 1.00 0.00 C ATOM 938 OE1 GLN A 59 -14.446 4.101 -5.666 1.00 0.00 O ATOM 939 NE2 GLN A 59 -15.934 2.473 -6.051 1.00 0.00 N ATOM 0 H GLN A 59 -11.860 3.751 -2.088 1.00 0.00 H new ATOM 0 HA GLN A 59 -14.539 3.570 -2.945 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -12.409 3.316 -4.302 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -12.218 1.721 -3.601 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -13.234 1.444 -5.753 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -14.452 1.079 -4.548 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -16.169 1.484 -5.970 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -16.592 3.119 -6.486 1.00 0.00 H new ATOM 948 N ALA A 60 -13.408 1.073 -1.113 1.00 0.00 N ATOM 949 CA ALA A 60 -13.798 -0.095 -0.332 1.00 0.00 C ATOM 950 C ALA A 60 -14.690 0.288 0.848 1.00 0.00 C ATOM 951 O ALA A 60 -15.535 -0.499 1.280 1.00 0.00 O ATOM 952 CB ALA A 60 -12.565 -0.831 0.157 1.00 0.00 C ATOM 0 H ALA A 60 -12.430 1.341 -1.006 1.00 0.00 H new ATOM 0 HA ALA A 60 -14.375 -0.753 -0.982 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -12.868 -1.701 0.739 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -11.972 -1.155 -0.698 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -11.968 -0.166 0.782 1.00 0.00 H new ATOM 958 N LEU A 61 -14.493 1.497 1.365 1.00 0.00 N ATOM 959 CA LEU A 61 -15.292 2.002 2.479 1.00 0.00 C ATOM 960 C LEU A 61 -16.754 2.137 2.073 1.00 0.00 C ATOM 961 O LEU A 61 -17.651 1.670 2.777 1.00 0.00 O ATOM 962 CB LEU A 61 -14.749 3.354 2.954 1.00 0.00 C ATOM 963 CG LEU A 61 -13.376 3.306 3.623 1.00 0.00 C ATOM 964 CD1 LEU A 61 -12.936 4.705 4.018 1.00 0.00 C ATOM 965 CD2 LEU A 61 -13.410 2.395 4.840 1.00 0.00 C ATOM 0 H LEU A 61 -13.784 2.149 1.029 1.00 0.00 H new ATOM 0 HA LEU A 61 -15.225 1.288 3.300 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.695 4.027 2.098 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.462 3.788 3.655 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.655 2.902 2.912 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -11.956 4.658 4.494 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -12.878 5.333 3.129 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -13.658 5.130 4.715 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.424 2.372 5.305 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -14.140 2.772 5.556 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -13.690 1.387 4.533 1.00 0.00 H new ATOM 977 N GLU A 62 -16.988 2.751 0.918 1.00 0.00 N ATOM 978 CA GLU A 62 -18.344 2.947 0.421 1.00 0.00 C ATOM 979 C GLU A 62 -18.893 1.657 -0.175 1.00 0.00 C ATOM 980 O GLU A 62 -20.081 1.552 -0.489 1.00 0.00 O ATOM 981 CB GLU A 62 -18.380 4.083 -0.598 1.00 0.00 C ATOM 982 CG GLU A 62 -17.965 5.411 0.003 1.00 0.00 C ATOM 983 CD GLU A 62 -18.067 6.558 -0.976 1.00 0.00 C ATOM 984 OE1 GLU A 62 -19.029 6.585 -1.776 1.00 0.00 O ATOM 985 OE2 GLU A 62 -17.197 7.452 -0.941 1.00 0.00 O ATOM 0 H GLU A 62 -16.257 3.121 0.310 1.00 0.00 H new ATOM 0 HA GLU A 62 -18.983 3.224 1.260 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -17.719 3.842 -1.431 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -19.387 4.170 -1.005 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -18.591 5.623 0.870 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -16.938 5.337 0.362 1.00 0.00 H new ATOM 992 N ALA A 63 -18.019 0.673 -0.322 1.00 0.00 N ATOM 993 CA ALA A 63 -18.433 -0.659 -0.742 1.00 0.00 C ATOM 994 C ALA A 63 -19.105 -1.390 0.416 1.00 0.00 C ATOM 995 O ALA A 63 -19.779 -2.401 0.222 1.00 0.00 O ATOM 996 CB ALA A 63 -17.244 -1.452 -1.261 1.00 0.00 C ATOM 0 H ALA A 63 -17.017 0.771 -0.157 1.00 0.00 H new ATOM 0 HA ALA A 63 -19.153 -0.560 -1.554 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -17.575 -2.444 -1.569 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -16.806 -0.934 -2.114 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -16.498 -1.547 -0.472 1.00 0.00 H new ATOM 1002 N GLY A 64 -18.902 -0.874 1.624 1.00 0.00 N ATOM 1003 CA GLY A 64 -19.564 -1.420 2.791 1.00 0.00 C ATOM 1004 C GLY A 64 -18.675 -2.369 3.560 1.00 0.00 C ATOM 1005 O GLY A 64 -19.152 -3.171 4.362 1.00 0.00 O ATOM 0 H GLY A 64 -18.287 -0.083 1.814 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -19.874 -0.605 3.445 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -20.469 -1.943 2.482 1.00 0.00 H new ATOM 1009 N LYS A 65 -17.380 -2.295 3.298 1.00 0.00 N ATOM 1010 CA LYS A 65 -16.423 -3.172 3.946 1.00 0.00 C ATOM 1011 C LYS A 65 -15.555 -2.401 4.928 1.00 0.00 C ATOM 1012 O LYS A 65 -15.752 -1.203 5.148 1.00 0.00 O ATOM 1013 CB LYS A 65 -15.536 -3.860 2.903 1.00 0.00 C ATOM 1014 CG LYS A 65 -16.201 -5.025 2.185 1.00 0.00 C ATOM 1015 CD LYS A 65 -17.460 -4.603 1.451 1.00 0.00 C ATOM 1016 CE LYS A 65 -18.151 -5.778 0.780 1.00 0.00 C ATOM 1017 NZ LYS A 65 -19.470 -5.390 0.218 1.00 0.00 N ATOM 0 H LYS A 65 -16.968 -1.634 2.639 1.00 0.00 H new ATOM 0 HA LYS A 65 -16.983 -3.929 4.496 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -15.226 -3.122 2.163 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -14.631 -4.219 3.393 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -15.498 -5.461 1.475 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.448 -5.802 2.908 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -18.148 -4.131 2.153 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -17.208 -3.854 0.700 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -17.516 -6.168 -0.016 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -18.286 -6.583 1.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -20.229 -5.804 0.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.558 -4.354 0.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -19.548 -5.741 -0.758 1.00 0.00 H new ATOM 1031 N ASN A 66 -14.598 -3.099 5.514 1.00 0.00 N ATOM 1032 CA ASN A 66 -13.657 -2.479 6.436 1.00 0.00 C ATOM 1033 C ASN A 66 -12.345 -2.224 5.713 1.00 0.00 C ATOM 1034 O ASN A 66 -11.818 -3.107 5.032 1.00 0.00 O ATOM 1035 CB ASN A 66 -13.417 -3.378 7.655 1.00 0.00 C ATOM 1036 CG ASN A 66 -12.814 -2.636 8.839 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -12.102 -1.646 8.677 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -13.093 -3.117 10.039 1.00 0.00 N ATOM 0 H ASN A 66 -14.450 -4.098 5.369 1.00 0.00 H new ATOM 0 HA ASN A 66 -14.075 -1.535 6.787 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -14.363 -3.826 7.959 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -12.754 -4.195 7.371 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -12.714 -2.665 10.871 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -13.688 -3.940 10.133 1.00 0.00 H new ATOM 1045 N ALA A 67 -11.814 -1.029 5.878 1.00 0.00 N ATOM 1046 CA ALA A 67 -10.615 -0.622 5.166 1.00 0.00 C ATOM 1047 C ALA A 67 -9.897 0.491 5.910 1.00 0.00 C ATOM 1048 O ALA A 67 -10.535 1.325 6.556 1.00 0.00 O ATOM 1049 CB ALA A 67 -10.968 -0.169 3.760 1.00 0.00 C ATOM 0 H ALA A 67 -12.195 -0.318 6.502 1.00 0.00 H new ATOM 0 HA ALA A 67 -9.946 -1.480 5.104 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -10.061 0.133 3.237 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.441 -0.990 3.221 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -11.656 0.675 3.812 1.00 0.00 H new ATOM 1055 N ALA A 68 -8.575 0.503 5.815 1.00 0.00 N ATOM 1056 CA ALA A 68 -7.776 1.510 6.493 1.00 0.00 C ATOM 1057 C ALA A 68 -6.427 1.683 5.811 1.00 0.00 C ATOM 1058 O ALA A 68 -5.826 0.711 5.346 1.00 0.00 O ATOM 1059 CB ALA A 68 -7.584 1.137 7.959 1.00 0.00 C ATOM 0 H ALA A 68 -8.035 -0.173 5.275 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.309 2.459 6.439 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -6.984 1.901 8.453 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.556 1.068 8.447 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.075 0.176 8.026 1.00 0.00 H new ATOM 1065 N TYR A 69 -5.957 2.918 5.744 1.00 0.00 N ATOM 1066 CA TYR A 69 -4.636 3.192 5.219 1.00 0.00 C ATOM 1067 C TYR A 69 -3.760 3.768 6.316 1.00 0.00 C ATOM 1068 O TYR A 69 -4.202 4.598 7.112 1.00 0.00 O ATOM 1069 CB TYR A 69 -4.676 4.137 4.010 1.00 0.00 C ATOM 1070 CG TYR A 69 -5.304 5.493 4.274 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -6.669 5.701 4.098 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -4.528 6.571 4.688 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -7.238 6.939 4.329 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -5.091 7.809 4.923 1.00 0.00 C ATOM 1075 CZ TYR A 69 -6.444 7.988 4.743 1.00 0.00 C ATOM 1076 OH TYR A 69 -7.005 9.223 4.968 1.00 0.00 O ATOM 0 H TYR A 69 -6.473 3.744 6.047 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.214 2.250 4.871 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -3.657 4.289 3.653 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.226 3.649 3.205 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -7.294 4.881 3.776 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -3.466 6.437 4.828 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.299 7.084 4.186 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -4.473 8.633 5.247 1.00 0.00 H new ATOM 0 HH TYR A 69 -6.309 9.851 5.255 1.00 0.00 H new ATOM 1086 N ILE A 70 -2.529 3.303 6.362 1.00 0.00 N ATOM 1087 CA ILE A 70 -1.593 3.714 7.392 1.00 0.00 C ATOM 1088 C ILE A 70 -0.302 4.254 6.782 1.00 0.00 C ATOM 1089 O ILE A 70 0.376 3.571 6.010 1.00 0.00 O ATOM 1090 CB ILE A 70 -1.257 2.546 8.348 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -2.533 2.037 9.026 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -0.244 2.996 9.392 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -2.314 0.841 9.925 1.00 0.00 C ATOM 0 H ILE A 70 -2.149 2.634 5.692 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.077 4.508 7.961 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.821 1.731 7.770 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -2.968 2.846 9.613 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.260 1.774 8.258 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -0.016 2.165 10.059 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.669 3.324 8.895 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.659 3.822 9.970 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.263 0.540 10.368 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.909 0.015 9.340 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.612 1.104 10.716 1.00 0.00 H new ATOM 1105 N ASP A 71 0.021 5.490 7.122 1.00 0.00 N ATOM 1106 CA ASP A 71 1.276 6.094 6.714 1.00 0.00 C ATOM 1107 C ASP A 71 2.329 5.764 7.753 1.00 0.00 C ATOM 1108 O ASP A 71 2.315 6.320 8.847 1.00 0.00 O ATOM 1109 CB ASP A 71 1.140 7.615 6.596 1.00 0.00 C ATOM 1110 CG ASP A 71 0.094 8.046 5.588 1.00 0.00 C ATOM 1111 OD1 ASP A 71 -1.105 8.064 5.941 1.00 0.00 O ATOM 1112 OD2 ASP A 71 0.468 8.386 4.447 1.00 0.00 O ATOM 0 H ASP A 71 -0.574 6.098 7.684 1.00 0.00 H new ATOM 0 HA ASP A 71 1.560 5.700 5.738 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.885 8.027 7.572 1.00 0.00 H new ATOM 0 HB3 ASP A 71 2.104 8.038 6.313 1.00 0.00 H new ATOM 1117 N ALA A 72 3.237 4.865 7.416 1.00 0.00 N ATOM 1118 CA ALA A 72 4.219 4.362 8.380 1.00 0.00 C ATOM 1119 C ALA A 72 5.097 5.473 8.961 1.00 0.00 C ATOM 1120 O ALA A 72 5.726 5.293 10.005 1.00 0.00 O ATOM 1121 CB ALA A 72 5.080 3.286 7.747 1.00 0.00 C ATOM 0 H ALA A 72 3.320 4.463 6.482 1.00 0.00 H new ATOM 0 HA ALA A 72 3.657 3.933 9.210 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.804 2.923 8.477 1.00 0.00 H new ATOM 0 HB2 ALA A 72 4.448 2.460 7.421 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.607 3.701 6.888 1.00 0.00 H new ATOM 1127 N ALA A 73 5.144 6.619 8.297 1.00 0.00 N ATOM 1128 CA ALA A 73 5.952 7.730 8.778 1.00 0.00 C ATOM 1129 C ALA A 73 5.090 8.841 9.369 1.00 0.00 C ATOM 1130 O ALA A 73 5.541 9.977 9.519 1.00 0.00 O ATOM 1131 CB ALA A 73 6.821 8.267 7.656 1.00 0.00 C ATOM 0 H ALA A 73 4.637 6.803 7.431 1.00 0.00 H new ATOM 0 HA ALA A 73 6.593 7.357 9.577 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.421 9.098 8.027 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.479 7.476 7.295 1.00 0.00 H new ATOM 0 HB3 ALA A 73 6.188 8.613 6.839 1.00 0.00 H new ATOM 1137 N SER A 74 3.859 8.504 9.718 1.00 0.00 N ATOM 1138 CA SER A 74 2.948 9.468 10.318 1.00 0.00 C ATOM 1139 C SER A 74 2.053 8.797 11.360 1.00 0.00 C ATOM 1140 O SER A 74 1.744 9.385 12.399 1.00 0.00 O ATOM 1141 CB SER A 74 2.099 10.131 9.228 1.00 0.00 C ATOM 1142 OG SER A 74 1.199 11.085 9.770 1.00 0.00 O ATOM 0 H SER A 74 3.467 7.570 9.597 1.00 0.00 H new ATOM 0 HA SER A 74 3.536 10.234 10.824 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.752 10.618 8.504 1.00 0.00 H new ATOM 0 HB3 SER A 74 1.538 9.367 8.689 1.00 0.00 H new ATOM 0 HG SER A 74 0.675 11.489 9.047 1.00 0.00 H new ATOM 1148 N MET A 75 1.665 7.557 11.091 1.00 0.00 N ATOM 1149 CA MET A 75 0.729 6.836 11.945 1.00 0.00 C ATOM 1150 C MET A 75 1.265 5.447 12.277 1.00 0.00 C ATOM 1151 O MET A 75 1.935 4.821 11.454 1.00 0.00 O ATOM 1152 CB MET A 75 -0.641 6.723 11.256 1.00 0.00 C ATOM 1153 CG MET A 75 -1.325 8.064 11.024 1.00 0.00 C ATOM 1154 SD MET A 75 -2.977 7.905 10.310 1.00 0.00 S ATOM 1155 CE MET A 75 -2.615 7.045 8.781 1.00 0.00 C ATOM 0 H MET A 75 1.987 7.026 10.282 1.00 0.00 H new ATOM 0 HA MET A 75 0.612 7.393 12.874 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.515 6.219 10.298 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.292 6.094 11.863 1.00 0.00 H new ATOM 0 HG2 MET A 75 -1.396 8.598 11.972 1.00 0.00 H new ATOM 0 HG3 MET A 75 -0.707 8.670 10.362 1.00 0.00 H new ATOM 0 HE1 MET A 75 -3.526 6.955 8.190 1.00 0.00 H new ATOM 0 HE2 MET A 75 -1.870 7.605 8.216 1.00 0.00 H new ATOM 0 HE3 MET A 75 -2.228 6.051 9.005 1.00 0.00 H new ATOM 1165 N PRO A 76 0.998 4.955 13.496 1.00 0.00 N ATOM 1166 CA PRO A 76 1.443 3.632 13.930 1.00 0.00 C ATOM 1167 C PRO A 76 0.477 2.524 13.518 1.00 0.00 C ATOM 1168 O PRO A 76 -0.559 2.785 12.905 1.00 0.00 O ATOM 1169 CB PRO A 76 1.472 3.781 15.449 1.00 0.00 C ATOM 1170 CG PRO A 76 0.366 4.736 15.751 1.00 0.00 C ATOM 1171 CD PRO A 76 0.250 5.655 14.558 1.00 0.00 C ATOM 0 HA PRO A 76 2.396 3.345 13.486 1.00 0.00 H new ATOM 0 HB2 PRO A 76 1.316 2.823 15.945 1.00 0.00 H new ATOM 0 HB3 PRO A 76 2.433 4.165 15.792 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -0.570 4.203 15.922 1.00 0.00 H new ATOM 0 HG3 PRO A 76 0.580 5.303 16.657 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -0.791 5.813 14.276 1.00 0.00 H new ATOM 0 HD3 PRO A 76 0.676 6.636 14.767 1.00 0.00 H new ATOM 1179 N LEU A 77 0.818 1.290 13.865 1.00 0.00 N ATOM 1180 CA LEU A 77 -0.021 0.147 13.540 1.00 0.00 C ATOM 1181 C LEU A 77 -0.857 -0.259 14.751 1.00 0.00 C ATOM 1182 O LEU A 77 -0.401 -0.168 15.895 1.00 0.00 O ATOM 1183 CB LEU A 77 0.840 -1.033 13.068 1.00 0.00 C ATOM 1184 CG LEU A 77 0.062 -2.283 12.640 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -0.812 -1.987 11.433 1.00 0.00 C ATOM 1186 CD2 LEU A 77 1.013 -3.423 12.333 1.00 0.00 C ATOM 0 H LEU A 77 1.671 1.056 14.372 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.694 0.431 12.731 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.452 -0.702 12.229 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.522 -1.308 13.872 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.583 -2.580 13.467 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.355 -2.888 11.147 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.523 -1.199 11.683 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.186 -1.661 10.602 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.443 -4.301 12.031 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.683 -3.130 11.525 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.598 -3.658 13.222 1.00 0.00 H new ATOM 1198 N THR A 78 -2.076 -0.701 14.494 1.00 0.00 N ATOM 1199 CA THR A 78 -2.982 -1.118 15.545 1.00 0.00 C ATOM 1200 C THR A 78 -3.513 -2.519 15.265 1.00 0.00 C ATOM 1201 O THR A 78 -3.545 -2.965 14.116 1.00 0.00 O ATOM 1202 CB THR A 78 -4.165 -0.137 15.674 1.00 0.00 C ATOM 1203 OG1 THR A 78 -4.741 0.102 14.381 1.00 0.00 O ATOM 1204 CG2 THR A 78 -3.723 1.186 16.287 1.00 0.00 C ATOM 0 H THR A 78 -2.463 -0.780 13.553 1.00 0.00 H new ATOM 0 HA THR A 78 -2.425 -1.123 16.482 1.00 0.00 H new ATOM 0 HB THR A 78 -4.907 -0.588 16.333 1.00 0.00 H new ATOM 0 HG1 THR A 78 -5.493 0.724 14.468 1.00 0.00 H new ATOM 0 HG21 THR A 78 -4.580 1.855 16.364 1.00 0.00 H new ATOM 0 HG22 THR A 78 -3.311 1.007 17.280 1.00 0.00 H new ATOM 0 HG23 THR A 78 -2.961 1.643 15.655 1.00 0.00 H new ATOM 1212 N ASP A 79 -3.928 -3.210 16.315 1.00 0.00 N ATOM 1213 CA ASP A 79 -4.513 -4.539 16.176 1.00 0.00 C ATOM 1214 C ASP A 79 -5.892 -4.439 15.532 1.00 0.00 C ATOM 1215 O ASP A 79 -6.436 -5.429 15.055 1.00 0.00 O ATOM 1216 CB ASP A 79 -4.618 -5.237 17.536 1.00 0.00 C ATOM 1217 CG ASP A 79 -5.591 -4.559 18.480 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -5.196 -3.564 19.123 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -6.751 -5.018 18.586 1.00 0.00 O ATOM 0 H ASP A 79 -3.871 -2.873 17.276 1.00 0.00 H new ATOM 0 HA ASP A 79 -3.861 -5.134 15.536 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -4.929 -6.270 17.384 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -3.632 -5.266 18.000 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.445 -3.228 15.516 1.00 0.00 N ATOM 1225 CA ALA A 80 -7.717 -2.966 14.849 1.00 0.00 C ATOM 1226 C ALA A 80 -7.619 -3.252 13.354 1.00 0.00 C ATOM 1227 O ALA A 80 -8.616 -3.572 12.706 1.00 0.00 O ATOM 1228 CB ALA A 80 -8.157 -1.529 15.077 1.00 0.00 C ATOM 0 H ALA A 80 -6.029 -2.409 15.960 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.463 -3.634 15.280 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -9.107 -1.355 14.572 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.276 -1.350 16.146 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.404 -0.850 14.678 1.00 0.00 H new ATOM 1234 N ALA A 81 -6.406 -3.145 12.816 1.00 0.00 N ATOM 1235 CA ALA A 81 -6.154 -3.412 11.403 1.00 0.00 C ATOM 1236 C ALA A 81 -6.415 -4.876 11.070 1.00 0.00 C ATOM 1237 O ALA A 81 -6.524 -5.241 9.904 1.00 0.00 O ATOM 1238 CB ALA A 81 -4.722 -3.038 11.044 1.00 0.00 C ATOM 0 H ALA A 81 -5.576 -2.873 13.343 1.00 0.00 H new ATOM 0 HA ALA A 81 -6.838 -2.801 10.814 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.547 -3.242 9.988 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.563 -1.978 11.240 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.030 -3.626 11.647 1.00 0.00 H new ATOM 1244 N PHE A 82 -6.520 -5.705 12.105 1.00 0.00 N ATOM 1245 CA PHE A 82 -6.796 -7.122 11.929 1.00 0.00 C ATOM 1246 C PHE A 82 -8.250 -7.327 11.519 1.00 0.00 C ATOM 1247 O PHE A 82 -8.598 -8.335 10.908 1.00 0.00 O ATOM 1248 CB PHE A 82 -6.525 -7.871 13.232 1.00 0.00 C ATOM 1249 CG PHE A 82 -5.769 -9.154 13.056 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -6.408 -10.303 12.621 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -4.417 -9.204 13.331 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -5.704 -11.482 12.459 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -3.708 -10.374 13.174 1.00 0.00 C ATOM 1254 CZ PHE A 82 -4.350 -11.518 12.736 1.00 0.00 C ATOM 0 H PHE A 82 -6.417 -5.415 13.077 1.00 0.00 H new ATOM 0 HA PHE A 82 -6.145 -7.510 11.146 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -5.964 -7.220 13.902 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -7.476 -8.086 13.719 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -7.466 -10.278 12.406 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -3.909 -8.315 13.673 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -6.211 -12.372 12.117 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -2.651 -10.398 13.393 1.00 0.00 H new ATOM 0 HZ PHE A 82 -3.796 -12.436 12.611 1.00 0.00 H new ATOM 1264 N GLU A 83 -9.093 -6.361 11.866 1.00 0.00 N ATOM 1265 CA GLU A 83 -10.513 -6.440 11.569 1.00 0.00 C ATOM 1266 C GLU A 83 -10.787 -5.985 10.146 1.00 0.00 C ATOM 1267 O GLU A 83 -11.755 -6.413 9.514 1.00 0.00 O ATOM 1268 CB GLU A 83 -11.305 -5.572 12.535 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.043 -5.894 13.988 1.00 0.00 C ATOM 1270 CD GLU A 83 -11.913 -5.083 14.920 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -11.755 -3.844 14.969 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -12.757 -5.682 15.617 1.00 0.00 O ATOM 0 H GLU A 83 -8.813 -5.511 12.356 1.00 0.00 H new ATOM 0 HA GLU A 83 -10.824 -7.479 11.678 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.062 -4.525 12.353 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -12.369 -5.692 12.330 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -11.220 -6.956 14.160 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -9.994 -5.705 14.217 1.00 0.00 H new ATOM 1279 N ALA A 84 -9.928 -5.109 9.655 1.00 0.00 N ATOM 1280 CA ALA A 84 -10.072 -4.552 8.327 1.00 0.00 C ATOM 1281 C ALA A 84 -9.784 -5.608 7.278 1.00 0.00 C ATOM 1282 O ALA A 84 -8.883 -6.427 7.437 1.00 0.00 O ATOM 1283 CB ALA A 84 -9.146 -3.358 8.157 1.00 0.00 C ATOM 0 H ALA A 84 -9.114 -4.766 10.166 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.100 -4.213 8.197 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.263 -2.947 7.154 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.397 -2.595 8.894 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -8.113 -3.675 8.301 1.00 0.00 H new ATOM 1289 N GLU A 85 -10.573 -5.599 6.223 1.00 0.00 N ATOM 1290 CA GLU A 85 -10.374 -6.534 5.129 1.00 0.00 C ATOM 1291 C GLU A 85 -9.470 -5.917 4.063 1.00 0.00 C ATOM 1292 O GLU A 85 -8.811 -6.626 3.310 1.00 0.00 O ATOM 1293 CB GLU A 85 -11.716 -6.937 4.518 1.00 0.00 C ATOM 1294 CG GLU A 85 -11.771 -8.400 4.108 1.00 0.00 C ATOM 1295 CD GLU A 85 -11.656 -9.336 5.299 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -12.640 -9.454 6.060 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -10.590 -9.957 5.484 1.00 0.00 O ATOM 0 H GLU A 85 -11.356 -4.958 6.098 1.00 0.00 H new ATOM 0 HA GLU A 85 -9.891 -7.429 5.522 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.510 -6.738 5.237 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -11.913 -6.314 3.645 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -12.708 -8.594 3.585 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -10.965 -8.609 3.405 1.00 0.00 H new ATOM 1304 N TYR A 86 -9.456 -4.587 4.003 1.00 0.00 N ATOM 1305 CA TYR A 86 -8.604 -3.864 3.065 1.00 0.00 C ATOM 1306 C TYR A 86 -7.524 -3.093 3.819 1.00 0.00 C ATOM 1307 O TYR A 86 -7.813 -2.088 4.474 1.00 0.00 O ATOM 1308 CB TYR A 86 -9.425 -2.883 2.221 1.00 0.00 C ATOM 1309 CG TYR A 86 -10.413 -3.523 1.269 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -11.581 -4.116 1.734 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -10.189 -3.508 -0.103 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -12.493 -4.675 0.862 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -11.095 -4.071 -0.982 1.00 0.00 C ATOM 1314 CZ TYR A 86 -12.246 -4.652 -0.494 1.00 0.00 C ATOM 1315 OH TYR A 86 -13.153 -5.207 -1.368 1.00 0.00 O ATOM 0 H TYR A 86 -10.029 -3.987 4.597 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.140 -4.596 2.404 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -9.969 -2.218 2.892 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -8.739 -2.262 1.645 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -11.778 -4.140 2.796 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -9.291 -3.048 -0.489 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -13.397 -5.129 1.241 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.902 -4.056 -2.045 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.827 -5.105 -2.286 1.00 0.00 H new ATOM 1325 N LEU A 87 -6.290 -3.566 3.737 1.00 0.00 N ATOM 1326 CA LEU A 87 -5.175 -2.905 4.406 1.00 0.00 C ATOM 1327 C LEU A 87 -4.253 -2.231 3.403 1.00 0.00 C ATOM 1328 O LEU A 87 -3.686 -2.882 2.524 1.00 0.00 O ATOM 1329 CB LEU A 87 -4.369 -3.890 5.261 1.00 0.00 C ATOM 1330 CG LEU A 87 -5.008 -4.295 6.593 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -5.454 -3.066 7.371 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -6.169 -5.250 6.374 1.00 0.00 C ATOM 0 H LEU A 87 -6.033 -4.404 3.215 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.604 -2.145 5.059 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.194 -4.792 4.675 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.394 -3.449 5.467 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.255 -4.817 7.184 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.905 -3.376 8.314 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -4.592 -2.431 7.573 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.185 -2.510 6.785 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.604 -5.521 7.336 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -6.926 -4.767 5.757 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.811 -6.149 5.872 1.00 0.00 H new ATOM 1344 N ALA A 88 -4.104 -0.925 3.543 1.00 0.00 N ATOM 1345 CA ALA A 88 -3.204 -0.166 2.695 1.00 0.00 C ATOM 1346 C ALA A 88 -2.154 0.539 3.544 1.00 0.00 C ATOM 1347 O ALA A 88 -2.475 1.429 4.330 1.00 0.00 O ATOM 1348 CB ALA A 88 -3.980 0.839 1.861 1.00 0.00 C ATOM 0 H ALA A 88 -4.598 -0.367 4.240 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.699 -0.854 2.017 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.289 1.399 1.231 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.699 0.313 1.233 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.510 1.527 2.520 1.00 0.00 H new ATOM 1354 N VAL A 89 -0.903 0.136 3.400 1.00 0.00 N ATOM 1355 CA VAL A 89 0.174 0.705 4.202 1.00 0.00 C ATOM 1356 C VAL A 89 1.297 1.208 3.307 1.00 0.00 C ATOM 1357 O VAL A 89 1.814 0.471 2.466 1.00 0.00 O ATOM 1358 CB VAL A 89 0.743 -0.320 5.212 1.00 0.00 C ATOM 1359 CG1 VAL A 89 1.847 0.301 6.060 1.00 0.00 C ATOM 1360 CG2 VAL A 89 -0.363 -0.868 6.099 1.00 0.00 C ATOM 0 H VAL A 89 -0.606 -0.581 2.738 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.250 1.538 4.762 1.00 0.00 H new ATOM 0 HB VAL A 89 1.175 -1.145 4.645 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.229 -0.441 6.761 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.656 0.639 5.413 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.446 1.150 6.614 1.00 0.00 H new ATOM 0 HG21 VAL A 89 0.057 -1.587 6.802 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -0.826 -0.050 6.650 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -1.114 -1.361 5.482 1.00 0.00 H new ATOM 1370 N ASP A 90 1.666 2.465 3.484 1.00 0.00 N ATOM 1371 CA ASP A 90 2.730 3.066 2.691 1.00 0.00 C ATOM 1372 C ASP A 90 3.983 3.215 3.538 1.00 0.00 C ATOM 1373 O ASP A 90 3.915 3.146 4.767 1.00 0.00 O ATOM 1374 CB ASP A 90 2.299 4.446 2.171 1.00 0.00 C ATOM 1375 CG ASP A 90 3.131 4.938 0.998 1.00 0.00 C ATOM 1376 OD1 ASP A 90 4.026 4.199 0.537 1.00 0.00 O ATOM 1377 OD2 ASP A 90 2.890 6.071 0.530 1.00 0.00 O ATOM 0 H ASP A 90 1.245 3.092 4.170 1.00 0.00 H new ATOM 0 HA ASP A 90 2.938 2.416 1.841 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.252 4.402 1.871 1.00 0.00 H new ATOM 0 HB3 ASP A 90 2.367 5.169 2.984 1.00 0.00 H new ATOM 1382 N GLN A 91 5.117 3.414 2.871 1.00 0.00 N ATOM 1383 CA GLN A 91 6.381 3.746 3.530 1.00 0.00 C ATOM 1384 C GLN A 91 6.830 2.632 4.472 1.00 0.00 C ATOM 1385 O GLN A 91 7.399 2.901 5.535 1.00 0.00 O ATOM 1386 CB GLN A 91 6.234 5.057 4.316 1.00 0.00 C ATOM 1387 CG GLN A 91 5.334 6.076 3.634 1.00 0.00 C ATOM 1388 CD GLN A 91 5.060 7.285 4.496 1.00 0.00 C ATOM 1389 OE1 GLN A 91 4.161 7.272 5.336 1.00 0.00 O ATOM 1390 NE2 GLN A 91 5.805 8.352 4.273 1.00 0.00 N ATOM 0 H GLN A 91 5.187 3.350 1.855 1.00 0.00 H new ATOM 0 HA GLN A 91 7.140 3.863 2.756 1.00 0.00 H new ATOM 0 HB2 GLN A 91 5.834 4.835 5.305 1.00 0.00 H new ATOM 0 HB3 GLN A 91 7.221 5.496 4.462 1.00 0.00 H new ATOM 0 HG2 GLN A 91 5.799 6.398 2.702 1.00 0.00 H new ATOM 0 HG3 GLN A 91 4.389 5.601 3.372 1.00 0.00 H new ATOM 0 HE21 GLN A 91 6.541 8.322 3.567 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.645 9.206 4.807 1.00 0.00 H new ATOM 1399 N VAL A 92 6.593 1.384 4.083 1.00 0.00 N ATOM 1400 CA VAL A 92 6.964 0.262 4.931 1.00 0.00 C ATOM 1401 C VAL A 92 8.483 0.151 5.033 1.00 0.00 C ATOM 1402 O VAL A 92 9.176 -0.056 4.043 1.00 0.00 O ATOM 1403 CB VAL A 92 6.352 -1.066 4.417 1.00 0.00 C ATOM 1404 CG1 VAL A 92 6.677 -1.298 2.947 1.00 0.00 C ATOM 1405 CG2 VAL A 92 6.821 -2.241 5.262 1.00 0.00 C ATOM 0 H VAL A 92 6.152 1.128 3.199 1.00 0.00 H new ATOM 0 HA VAL A 92 6.559 0.448 5.926 1.00 0.00 H new ATOM 0 HB VAL A 92 5.269 -0.986 4.509 1.00 0.00 H new ATOM 0 HG11 VAL A 92 6.232 -2.238 2.620 1.00 0.00 H new ATOM 0 HG12 VAL A 92 6.273 -0.479 2.352 1.00 0.00 H new ATOM 0 HG13 VAL A 92 7.758 -1.343 2.816 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.378 -3.162 4.882 1.00 0.00 H new ATOM 0 HG22 VAL A 92 7.907 -2.314 5.213 1.00 0.00 H new ATOM 0 HG23 VAL A 92 6.514 -2.091 6.297 1.00 0.00 H new ATOM 1415 N GLU A 93 8.966 0.276 6.262 1.00 0.00 N ATOM 1416 CA GLU A 93 10.390 0.236 6.585 1.00 0.00 C ATOM 1417 C GLU A 93 10.561 0.593 8.054 1.00 0.00 C ATOM 1418 O GLU A 93 11.450 0.094 8.741 1.00 0.00 O ATOM 1419 CB GLU A 93 11.211 1.216 5.730 1.00 0.00 C ATOM 1420 CG GLU A 93 10.874 2.679 5.974 1.00 0.00 C ATOM 1421 CD GLU A 93 11.943 3.624 5.462 1.00 0.00 C ATOM 1422 OE1 GLU A 93 13.098 3.530 5.928 1.00 0.00 O ATOM 1423 OE2 GLU A 93 11.634 4.473 4.600 1.00 0.00 O ATOM 0 H GLU A 93 8.370 0.411 7.079 1.00 0.00 H new ATOM 0 HA GLU A 93 10.757 -0.768 6.374 1.00 0.00 H new ATOM 0 HB2 GLU A 93 12.271 1.059 5.932 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.050 0.987 4.677 1.00 0.00 H new ATOM 0 HG2 GLU A 93 9.926 2.914 5.490 1.00 0.00 H new ATOM 0 HG3 GLU A 93 10.735 2.841 7.043 1.00 0.00 H new ATOM 1430 N LYS A 94 9.671 1.467 8.519 1.00 0.00 N ATOM 1431 CA LYS A 94 9.728 2.005 9.870 1.00 0.00 C ATOM 1432 C LYS A 94 9.246 0.992 10.900 1.00 0.00 C ATOM 1433 O LYS A 94 9.379 1.217 12.102 1.00 0.00 O ATOM 1434 CB LYS A 94 8.873 3.266 9.961 1.00 0.00 C ATOM 1435 CG LYS A 94 9.215 4.307 8.910 1.00 0.00 C ATOM 1436 CD LYS A 94 10.668 4.744 9.013 1.00 0.00 C ATOM 1437 CE LYS A 94 10.913 5.604 10.241 1.00 0.00 C ATOM 1438 NZ LYS A 94 12.296 6.142 10.271 1.00 0.00 N ATOM 0 H LYS A 94 8.890 1.821 7.966 1.00 0.00 H new ATOM 0 HA LYS A 94 10.769 2.242 10.089 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.823 2.991 9.861 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.994 3.707 10.950 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.026 3.899 7.917 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.564 5.173 9.028 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.310 3.864 9.051 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.944 5.301 8.118 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.202 6.430 10.254 1.00 0.00 H new ATOM 0 HE3 LYS A 94 10.733 5.014 11.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.424 6.723 11.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 12.975 5.354 10.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.460 6.726 9.426 1.00 0.00 H new ATOM 1452 N LEU A 95 8.670 -0.107 10.430 1.00 0.00 N ATOM 1453 CA LEU A 95 8.133 -1.120 11.325 1.00 0.00 C ATOM 1454 C LEU A 95 9.253 -1.753 12.147 1.00 0.00 C ATOM 1455 O LEU A 95 10.279 -2.168 11.603 1.00 0.00 O ATOM 1456 CB LEU A 95 7.397 -2.195 10.520 1.00 0.00 C ATOM 1457 CG LEU A 95 6.280 -1.681 9.606 1.00 0.00 C ATOM 1458 CD1 LEU A 95 5.599 -2.841 8.899 1.00 0.00 C ATOM 1459 CD2 LEU A 95 5.266 -0.873 10.402 1.00 0.00 C ATOM 0 H LEU A 95 8.564 -0.318 9.438 1.00 0.00 H new ATOM 0 HA LEU A 95 7.428 -0.644 12.007 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.125 -2.730 9.910 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.971 -2.918 11.216 1.00 0.00 H new ATOM 0 HG LEU A 95 6.723 -1.028 8.854 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.808 -2.460 8.253 1.00 0.00 H new ATOM 0 HD12 LEU A 95 6.330 -3.380 8.297 1.00 0.00 H new ATOM 0 HD13 LEU A 95 5.170 -3.516 9.639 1.00 0.00 H new ATOM 0 HD21 LEU A 95 4.481 -0.517 9.735 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.827 -1.502 11.176 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.763 -0.021 10.865 1.00 0.00 H new ATOM 1471 N GLY A 96 9.033 -1.848 13.448 1.00 0.00 N ATOM 1472 CA GLY A 96 10.053 -2.355 14.341 1.00 0.00 C ATOM 1473 C GLY A 96 9.893 -3.830 14.640 1.00 0.00 C ATOM 1474 O GLY A 96 10.451 -4.674 13.941 1.00 0.00 O ATOM 0 H GLY A 96 8.161 -1.581 13.904 1.00 0.00 H new ATOM 0 HA2 GLY A 96 11.034 -2.183 13.899 1.00 0.00 H new ATOM 0 HA3 GLY A 96 10.022 -1.794 15.275 1.00 0.00 H new ATOM 1478 N ASN A 97 9.130 -4.145 15.672 1.00 0.00 N ATOM 1479 CA ASN A 97 8.986 -5.527 16.118 1.00 0.00 C ATOM 1480 C ASN A 97 7.518 -5.890 16.319 1.00 0.00 C ATOM 1481 O ASN A 97 7.026 -6.860 15.738 1.00 0.00 O ATOM 1482 CB ASN A 97 9.788 -5.770 17.412 1.00 0.00 C ATOM 1483 CG ASN A 97 9.408 -4.841 18.560 1.00 0.00 C ATOM 1484 OD1 ASN A 97 9.023 -3.687 18.355 1.00 0.00 O ATOM 1485 ND2 ASN A 97 9.502 -5.343 19.780 1.00 0.00 N ATOM 0 H ASN A 97 8.600 -3.466 16.219 1.00 0.00 H new ATOM 0 HA ASN A 97 9.388 -6.173 15.338 1.00 0.00 H new ATOM 0 HB2 ASN A 97 9.642 -6.802 17.730 1.00 0.00 H new ATOM 0 HB3 ASN A 97 10.850 -5.650 17.197 1.00 0.00 H new ATOM 0 HD21 ASN A 97 9.252 -4.772 20.587 1.00 0.00 H new ATOM 0 HD22 ASN A 97 9.824 -6.302 19.914 1.00 0.00 H new ATOM 1492 N GLU A 98 6.822 -5.097 17.121 1.00 0.00 N ATOM 1493 CA GLU A 98 5.418 -5.339 17.422 1.00 0.00 C ATOM 1494 C GLU A 98 4.586 -5.277 16.145 1.00 0.00 C ATOM 1495 O GLU A 98 3.724 -6.125 15.899 1.00 0.00 O ATOM 1496 CB GLU A 98 4.919 -4.302 18.433 1.00 0.00 C ATOM 1497 CG GLU A 98 5.752 -4.247 19.706 1.00 0.00 C ATOM 1498 CD GLU A 98 5.411 -3.061 20.581 1.00 0.00 C ATOM 1499 OE1 GLU A 98 6.024 -1.988 20.396 1.00 0.00 O ATOM 1500 OE2 GLU A 98 4.538 -3.195 21.462 1.00 0.00 O ATOM 0 H GLU A 98 7.211 -4.273 17.579 1.00 0.00 H new ATOM 0 HA GLU A 98 5.313 -6.334 17.854 1.00 0.00 H new ATOM 0 HB2 GLU A 98 4.921 -3.318 17.964 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.885 -4.528 18.694 1.00 0.00 H new ATOM 0 HG2 GLU A 98 5.601 -5.166 20.273 1.00 0.00 H new ATOM 0 HG3 GLU A 98 6.809 -4.205 19.441 1.00 0.00 H new ATOM 1507 N GLU A 99 4.877 -4.278 15.326 1.00 0.00 N ATOM 1508 CA GLU A 99 4.171 -4.066 14.073 1.00 0.00 C ATOM 1509 C GLU A 99 4.399 -5.232 13.114 1.00 0.00 C ATOM 1510 O GLU A 99 3.474 -5.680 12.438 1.00 0.00 O ATOM 1511 CB GLU A 99 4.623 -2.760 13.409 1.00 0.00 C ATOM 1512 CG GLU A 99 4.719 -1.571 14.355 1.00 0.00 C ATOM 1513 CD GLU A 99 6.080 -1.467 15.022 1.00 0.00 C ATOM 1514 OE1 GLU A 99 6.318 -2.172 16.028 1.00 0.00 O ATOM 1515 OE2 GLU A 99 6.921 -0.690 14.533 1.00 0.00 O ATOM 0 H GLU A 99 5.609 -3.592 15.512 1.00 0.00 H new ATOM 0 HA GLU A 99 3.107 -4.000 14.301 1.00 0.00 H new ATOM 0 HB2 GLU A 99 5.597 -2.920 12.947 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.927 -2.515 12.607 1.00 0.00 H new ATOM 0 HG2 GLU A 99 4.518 -0.654 13.802 1.00 0.00 H new ATOM 0 HG3 GLU A 99 3.948 -1.657 15.121 1.00 0.00 H new ATOM 1522 N GLN A 100 5.632 -5.730 13.064 1.00 0.00 N ATOM 1523 CA GLN A 100 5.975 -6.813 12.147 1.00 0.00 C ATOM 1524 C GLN A 100 5.302 -8.117 12.572 1.00 0.00 C ATOM 1525 O GLN A 100 4.887 -8.911 11.731 1.00 0.00 O ATOM 1526 CB GLN A 100 7.494 -6.998 12.055 1.00 0.00 C ATOM 1527 CG GLN A 100 8.218 -5.820 11.412 1.00 0.00 C ATOM 1528 CD GLN A 100 9.662 -6.136 11.066 1.00 0.00 C ATOM 1529 OE1 GLN A 100 10.005 -7.281 10.775 1.00 0.00 O ATOM 1530 NE2 GLN A 100 10.521 -5.125 11.090 1.00 0.00 N ATOM 0 H GLN A 100 6.405 -5.403 13.643 1.00 0.00 H new ATOM 0 HA GLN A 100 5.606 -6.541 11.158 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.893 -7.155 13.057 1.00 0.00 H new ATOM 0 HB3 GLN A 100 7.707 -7.900 11.482 1.00 0.00 H new ATOM 0 HG2 GLN A 100 7.688 -5.524 10.506 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.190 -4.968 12.091 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.200 -4.189 11.336 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.502 -5.284 10.862 1.00 0.00 H new ATOM 1539 N ALA A 101 5.177 -8.321 13.878 1.00 0.00 N ATOM 1540 CA ALA A 101 4.495 -9.499 14.399 1.00 0.00 C ATOM 1541 C ALA A 101 3.015 -9.465 14.030 1.00 0.00 C ATOM 1542 O ALA A 101 2.431 -10.481 13.645 1.00 0.00 O ATOM 1543 CB ALA A 101 4.670 -9.591 15.907 1.00 0.00 C ATOM 0 H ALA A 101 5.537 -7.689 14.593 1.00 0.00 H new ATOM 0 HA ALA A 101 4.941 -10.385 13.948 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.155 -10.476 16.280 1.00 0.00 H new ATOM 0 HB2 ALA A 101 5.731 -9.661 16.147 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.250 -8.702 16.377 1.00 0.00 H new ATOM 1549 N LEU A 102 2.424 -8.281 14.136 1.00 0.00 N ATOM 1550 CA LEU A 102 1.028 -8.079 13.774 1.00 0.00 C ATOM 1551 C LEU A 102 0.852 -8.306 12.270 1.00 0.00 C ATOM 1552 O LEU A 102 -0.028 -9.053 11.840 1.00 0.00 O ATOM 1553 CB LEU A 102 0.603 -6.656 14.168 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.901 -6.417 14.370 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.669 -6.510 13.060 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -1.466 -7.398 15.386 1.00 0.00 C ATOM 0 H LEU A 102 2.895 -7.441 14.472 1.00 0.00 H new ATOM 0 HA LEU A 102 0.396 -8.791 14.306 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.117 -6.391 15.092 1.00 0.00 H new ATOM 0 HB3 LEU A 102 0.956 -5.970 13.398 1.00 0.00 H new ATOM 0 HG LEU A 102 -1.022 -5.403 14.752 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.729 -6.335 13.246 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.294 -5.759 12.364 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.535 -7.502 12.630 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -2.532 -7.213 15.516 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -1.315 -8.417 15.031 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.956 -7.267 16.341 1.00 0.00 H new ATOM 1568 N LEU A 103 1.715 -7.669 11.487 1.00 0.00 N ATOM 1569 CA LEU A 103 1.690 -7.784 10.031 1.00 0.00 C ATOM 1570 C LEU A 103 1.796 -9.248 9.592 1.00 0.00 C ATOM 1571 O LEU A 103 1.027 -9.711 8.750 1.00 0.00 O ATOM 1572 CB LEU A 103 2.844 -6.980 9.431 1.00 0.00 C ATOM 1573 CG LEU A 103 2.492 -6.103 8.227 1.00 0.00 C ATOM 1574 CD1 LEU A 103 1.897 -6.930 7.099 1.00 0.00 C ATOM 1575 CD2 LEU A 103 1.537 -4.993 8.636 1.00 0.00 C ATOM 0 H LEU A 103 2.451 -7.059 11.842 1.00 0.00 H new ATOM 0 HA LEU A 103 0.740 -7.388 9.672 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.261 -6.343 10.211 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.629 -7.675 9.133 1.00 0.00 H new ATOM 0 HG LEU A 103 3.414 -5.651 7.861 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.657 -6.279 6.258 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.618 -7.683 6.781 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.989 -7.421 7.448 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.298 -4.380 7.767 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.621 -5.429 9.035 1.00 0.00 H new ATOM 0 HD23 LEU A 103 2.006 -4.373 9.400 1.00 0.00 H new ATOM 1587 N PHE A 104 2.759 -9.964 10.165 1.00 0.00 N ATOM 1588 CA PHE A 104 2.943 -11.389 9.884 1.00 0.00 C ATOM 1589 C PHE A 104 1.649 -12.157 10.122 1.00 0.00 C ATOM 1590 O PHE A 104 1.248 -12.998 9.315 1.00 0.00 O ATOM 1591 CB PHE A 104 4.058 -11.958 10.767 1.00 0.00 C ATOM 1592 CG PHE A 104 4.340 -13.417 10.535 1.00 0.00 C ATOM 1593 CD1 PHE A 104 5.114 -13.827 9.461 1.00 0.00 C ATOM 1594 CD2 PHE A 104 3.837 -14.376 11.397 1.00 0.00 C ATOM 1595 CE1 PHE A 104 5.376 -15.166 9.250 1.00 0.00 C ATOM 1596 CE2 PHE A 104 4.094 -15.717 11.191 1.00 0.00 C ATOM 1597 CZ PHE A 104 4.866 -16.112 10.115 1.00 0.00 C ATOM 0 H PHE A 104 3.429 -9.580 10.831 1.00 0.00 H new ATOM 0 HA PHE A 104 3.223 -11.500 8.836 1.00 0.00 H new ATOM 0 HB2 PHE A 104 4.972 -11.390 10.591 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.788 -11.813 11.813 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.517 -13.091 8.781 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.236 -14.072 12.241 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.980 -15.473 8.409 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.693 -16.455 11.869 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.070 -17.160 9.951 1.00 0.00 H new ATOM 1607 N SER A 105 0.995 -11.845 11.228 1.00 0.00 N ATOM 1608 CA SER A 105 -0.255 -12.476 11.588 1.00 0.00 C ATOM 1609 C SER A 105 -1.346 -12.184 10.551 1.00 0.00 C ATOM 1610 O SER A 105 -2.205 -13.028 10.281 1.00 0.00 O ATOM 1611 CB SER A 105 -0.675 -11.977 12.960 1.00 0.00 C ATOM 1612 OG SER A 105 0.328 -12.252 13.926 1.00 0.00 O ATOM 0 H SER A 105 1.318 -11.148 11.898 1.00 0.00 H new ATOM 0 HA SER A 105 -0.115 -13.557 11.613 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.863 -10.904 12.920 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.610 -12.453 13.255 1.00 0.00 H new ATOM 0 HG SER A 105 1.062 -11.610 13.827 1.00 0.00 H new ATOM 1618 N ILE A 106 -1.305 -10.988 9.976 1.00 0.00 N ATOM 1619 CA ILE A 106 -2.228 -10.608 8.908 1.00 0.00 C ATOM 1620 C ILE A 106 -2.014 -11.491 7.679 1.00 0.00 C ATOM 1621 O ILE A 106 -2.974 -11.950 7.056 1.00 0.00 O ATOM 1622 CB ILE A 106 -2.056 -9.121 8.513 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -2.343 -8.213 9.712 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -2.965 -8.762 7.346 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -2.126 -6.741 9.428 1.00 0.00 C ATOM 0 H ILE A 106 -0.639 -10.259 10.232 1.00 0.00 H new ATOM 0 HA ILE A 106 -3.241 -10.749 9.285 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.023 -8.969 8.200 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -3.374 -8.364 10.032 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.704 -8.511 10.543 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -2.827 -7.712 7.086 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.716 -9.384 6.486 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -4.004 -8.932 7.628 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -2.349 -6.161 10.323 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -1.089 -6.576 9.138 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.784 -6.426 8.618 1.00 0.00 H new ATOM 1637 N PHE A 107 -0.752 -11.742 7.347 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.415 -12.613 6.229 1.00 0.00 C ATOM 1639 C PHE A 107 -0.943 -14.024 6.456 1.00 0.00 C ATOM 1640 O PHE A 107 -1.455 -14.655 5.534 1.00 0.00 O ATOM 1641 CB PHE A 107 1.095 -12.660 6.010 1.00 0.00 C ATOM 1642 CG PHE A 107 1.635 -11.482 5.255 1.00 0.00 C ATOM 1643 CD1 PHE A 107 1.260 -11.265 3.939 1.00 0.00 C ATOM 1644 CD2 PHE A 107 2.513 -10.593 5.853 1.00 0.00 C ATOM 1645 CE1 PHE A 107 1.749 -10.184 3.234 1.00 0.00 C ATOM 1646 CE2 PHE A 107 3.007 -9.510 5.151 1.00 0.00 C ATOM 1647 CZ PHE A 107 2.624 -9.306 3.841 1.00 0.00 C ATOM 0 H PHE A 107 0.054 -11.354 7.837 1.00 0.00 H new ATOM 0 HA PHE A 107 -0.889 -12.199 5.339 1.00 0.00 H new ATOM 0 HB2 PHE A 107 1.591 -12.717 6.979 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.346 -13.572 5.469 1.00 0.00 H new ATOM 0 HD1 PHE A 107 0.577 -11.950 3.459 1.00 0.00 H new ATOM 0 HD2 PHE A 107 2.815 -10.748 6.878 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.448 -10.025 2.209 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.692 -8.824 5.627 1.00 0.00 H new ATOM 0 HZ PHE A 107 3.009 -8.460 3.291 1.00 0.00 H new ATOM 1657 N ASN A 108 -0.818 -14.509 7.686 1.00 0.00 N ATOM 1658 CA ASN A 108 -1.295 -15.846 8.037 1.00 0.00 C ATOM 1659 C ASN A 108 -2.814 -15.929 7.908 1.00 0.00 C ATOM 1660 O ASN A 108 -3.361 -16.988 7.625 1.00 0.00 O ATOM 1661 CB ASN A 108 -0.860 -16.214 9.461 1.00 0.00 C ATOM 1662 CG ASN A 108 -1.238 -17.636 9.838 1.00 0.00 C ATOM 1663 OD1 ASN A 108 -0.522 -18.584 9.512 1.00 0.00 O ATOM 1664 ND2 ASN A 108 -2.340 -17.792 10.556 1.00 0.00 N ATOM 0 H ASN A 108 -0.391 -13.998 8.459 1.00 0.00 H new ATOM 0 HA ASN A 108 -0.852 -16.559 7.342 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.220 -16.093 9.550 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -1.317 -15.521 10.167 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.623 -18.724 10.860 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -2.906 -16.981 10.805 1.00 0.00 H new ATOM 1671 N ARG A 109 -3.478 -14.802 8.107 1.00 0.00 N ATOM 1672 CA ARG A 109 -4.926 -14.722 7.945 1.00 0.00 C ATOM 1673 C ARG A 109 -5.317 -14.705 6.467 1.00 0.00 C ATOM 1674 O ARG A 109 -6.067 -15.566 6.001 1.00 0.00 O ATOM 1675 CB ARG A 109 -5.467 -13.469 8.647 1.00 0.00 C ATOM 1676 CG ARG A 109 -6.882 -13.096 8.229 1.00 0.00 C ATOM 1677 CD ARG A 109 -7.364 -11.835 8.925 1.00 0.00 C ATOM 1678 NE ARG A 109 -8.532 -11.255 8.263 1.00 0.00 N ATOM 1679 CZ ARG A 109 -9.610 -10.803 8.905 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -9.706 -10.915 10.229 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -10.595 -10.242 8.220 1.00 0.00 N ATOM 0 H ARG A 109 -3.037 -13.924 8.382 1.00 0.00 H new ATOM 0 HA ARG A 109 -5.367 -15.608 8.402 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -5.447 -13.630 9.725 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -4.803 -12.631 8.437 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -6.915 -12.950 7.149 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.558 -13.919 8.460 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.612 -12.065 9.961 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.558 -11.102 8.946 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.521 -11.192 7.245 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -8.951 -11.349 10.760 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -10.534 -10.566 10.712 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.527 -10.157 7.206 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -11.421 -9.895 8.707 1.00 0.00 H new ATOM 1695 N PHE A 110 -4.791 -13.734 5.733 1.00 0.00 N ATOM 1696 CA PHE A 110 -5.166 -13.531 4.337 1.00 0.00 C ATOM 1697 C PHE A 110 -4.801 -14.735 3.473 1.00 0.00 C ATOM 1698 O PHE A 110 -5.645 -15.285 2.766 1.00 0.00 O ATOM 1699 CB PHE A 110 -4.493 -12.274 3.781 1.00 0.00 C ATOM 1700 CG PHE A 110 -5.057 -10.979 4.307 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -6.085 -10.973 5.237 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -4.559 -9.764 3.862 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -6.602 -9.784 5.713 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -5.075 -8.571 4.334 1.00 0.00 C ATOM 1705 CZ PHE A 110 -6.097 -8.582 5.260 1.00 0.00 C ATOM 0 H PHE A 110 -4.099 -13.070 6.082 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.249 -13.408 4.306 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -3.429 -12.314 4.014 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -4.582 -12.280 2.695 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -6.487 -11.910 5.594 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.758 -9.749 3.138 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -7.401 -9.795 6.439 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -4.678 -7.632 3.978 1.00 0.00 H new ATOM 0 HZ PHE A 110 -6.502 -7.652 5.630 1.00 0.00 H new ATOM 1715 N ARG A 111 -3.547 -15.155 3.559 1.00 0.00 N ATOM 1716 CA ARG A 111 -3.025 -16.217 2.701 1.00 0.00 C ATOM 1717 C ARG A 111 -3.600 -17.578 3.077 1.00 0.00 C ATOM 1718 O ARG A 111 -3.537 -18.523 2.289 1.00 0.00 O ATOM 1719 CB ARG A 111 -1.499 -16.247 2.783 1.00 0.00 C ATOM 1720 CG ARG A 111 -0.856 -14.967 2.285 1.00 0.00 C ATOM 1721 CD ARG A 111 -0.903 -14.873 0.766 1.00 0.00 C ATOM 1722 NE ARG A 111 -0.560 -13.535 0.269 1.00 0.00 N ATOM 1723 CZ ARG A 111 0.579 -12.885 0.532 1.00 0.00 C ATOM 1724 NH1 ARG A 111 1.504 -13.427 1.314 1.00 0.00 N ATOM 1725 NH2 ARG A 111 0.795 -11.689 -0.006 1.00 0.00 N ATOM 0 H ARG A 111 -2.866 -14.776 4.217 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.330 -16.003 1.677 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -1.199 -16.420 3.817 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.125 -17.087 2.198 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -1.368 -14.108 2.720 1.00 0.00 H new ATOM 0 HG3 ARG A 111 0.180 -14.924 2.621 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -0.214 -15.602 0.340 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -1.902 -15.139 0.421 1.00 0.00 H new ATOM 0 HE ARG A 111 -1.244 -13.064 -0.323 1.00 0.00 H new ATOM 0 HH11 ARG A 111 1.350 -14.349 1.722 1.00 0.00 H new ATOM 0 HH12 ARG A 111 2.369 -12.921 1.507 1.00 0.00 H new ATOM 0 HH21 ARG A 111 0.094 -11.270 -0.617 1.00 0.00 H new ATOM 0 HH22 ARG A 111 1.662 -11.190 0.192 1.00 0.00 H new ATOM 1739 N ASN A 112 -4.152 -17.669 4.278 1.00 0.00 N ATOM 1740 CA ASN A 112 -4.709 -18.920 4.784 1.00 0.00 C ATOM 1741 C ASN A 112 -5.833 -19.413 3.882 1.00 0.00 C ATOM 1742 O ASN A 112 -5.754 -20.494 3.297 1.00 0.00 O ATOM 1743 CB ASN A 112 -5.247 -18.722 6.200 1.00 0.00 C ATOM 1744 CG ASN A 112 -5.179 -19.983 7.032 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -6.098 -20.803 7.023 1.00 0.00 O ATOM 1746 ND2 ASN A 112 -4.086 -20.135 7.767 1.00 0.00 N ATOM 0 H ASN A 112 -4.227 -16.886 4.927 1.00 0.00 H new ATOM 0 HA ASN A 112 -3.913 -19.665 4.797 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.677 -17.935 6.694 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -6.281 -18.382 6.147 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -3.980 -20.959 8.358 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -3.351 -19.428 7.741 1.00 0.00 H new ATOM 1753 N SER A 113 -6.870 -18.597 3.761 1.00 0.00 N ATOM 1754 CA SER A 113 -8.030 -18.952 2.965 1.00 0.00 C ATOM 1755 C SER A 113 -7.946 -18.327 1.573 1.00 0.00 C ATOM 1756 O SER A 113 -8.467 -18.878 0.603 1.00 0.00 O ATOM 1757 CB SER A 113 -9.307 -18.503 3.681 1.00 0.00 C ATOM 1758 OG SER A 113 -10.464 -18.937 2.991 1.00 0.00 O ATOM 0 H SER A 113 -6.929 -17.682 4.207 1.00 0.00 H new ATOM 0 HA SER A 113 -8.053 -20.035 2.845 1.00 0.00 H new ATOM 0 HB2 SER A 113 -9.316 -18.900 4.696 1.00 0.00 H new ATOM 0 HB3 SER A 113 -9.317 -17.416 3.764 1.00 0.00 H new ATOM 0 HG SER A 113 -11.263 -18.637 3.472 1.00 0.00 H new ATOM 1764 N GLY A 114 -7.263 -17.192 1.469 1.00 0.00 N ATOM 1765 CA GLY A 114 -7.189 -16.485 0.203 1.00 0.00 C ATOM 1766 C GLY A 114 -8.082 -15.260 0.190 1.00 0.00 C ATOM 1767 O GLY A 114 -8.469 -14.767 -0.870 1.00 0.00 O ATOM 0 H GLY A 114 -6.760 -16.749 2.238 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -6.158 -16.186 0.013 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.480 -17.156 -0.606 1.00 0.00 H new ATOM 1771 N LYS A 115 -8.416 -14.772 1.377 1.00 0.00 N ATOM 1772 CA LYS A 115 -9.266 -13.609 1.518 1.00 0.00 C ATOM 1773 C LYS A 115 -8.417 -12.430 1.965 1.00 0.00 C ATOM 1774 O LYS A 115 -7.237 -12.592 2.263 1.00 0.00 O ATOM 1775 CB LYS A 115 -10.369 -13.904 2.545 1.00 0.00 C ATOM 1776 CG LYS A 115 -11.511 -12.897 2.560 1.00 0.00 C ATOM 1777 CD LYS A 115 -12.576 -13.269 3.580 1.00 0.00 C ATOM 1778 CE LYS A 115 -12.052 -13.144 5.003 1.00 0.00 C ATOM 1779 NZ LYS A 115 -13.098 -13.468 6.007 1.00 0.00 N ATOM 0 H LYS A 115 -8.105 -15.172 2.262 1.00 0.00 H new ATOM 0 HA LYS A 115 -9.737 -13.367 0.565 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -10.778 -14.894 2.344 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -9.921 -13.940 3.538 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -11.119 -11.906 2.788 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -11.960 -12.842 1.568 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -13.445 -12.623 3.453 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -12.910 -14.291 3.403 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -11.201 -13.812 5.137 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -11.691 -12.129 5.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -12.702 -13.371 6.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -13.900 -12.815 5.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -13.425 -14.445 5.865 1.00 0.00 H new ATOM 1793 N GLY A 116 -9.015 -11.262 2.010 1.00 0.00 N ATOM 1794 CA GLY A 116 -8.310 -10.085 2.469 1.00 0.00 C ATOM 1795 C GLY A 116 -7.616 -9.359 1.339 1.00 0.00 C ATOM 1796 O GLY A 116 -7.166 -9.977 0.373 1.00 0.00 O ATOM 0 H GLY A 116 -9.984 -11.100 1.736 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.013 -9.409 2.956 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.574 -10.374 3.219 1.00 0.00 H new ATOM 1800 N PHE A 117 -7.533 -8.047 1.461 1.00 0.00 N ATOM 1801 CA PHE A 117 -6.914 -7.212 0.450 1.00 0.00 C ATOM 1802 C PHE A 117 -5.764 -6.425 1.065 1.00 0.00 C ATOM 1803 O PHE A 117 -5.881 -5.903 2.176 1.00 0.00 O ATOM 1804 CB PHE A 117 -7.944 -6.250 -0.151 1.00 0.00 C ATOM 1805 CG PHE A 117 -9.025 -6.915 -0.963 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -10.036 -7.638 -0.347 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -9.036 -6.802 -2.344 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -11.033 -8.237 -1.093 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -10.032 -7.400 -3.096 1.00 0.00 C ATOM 1810 CZ PHE A 117 -11.031 -8.117 -2.468 1.00 0.00 C ATOM 0 H PHE A 117 -7.893 -7.531 2.264 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.528 -7.850 -0.345 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.410 -5.686 0.657 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -7.424 -5.530 -0.783 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.044 -7.734 0.729 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -8.258 -6.240 -2.840 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -11.813 -8.799 -0.601 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -10.028 -7.306 -4.172 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.810 -8.584 -3.052 1.00 0.00 H new ATOM 1820 N LEU A 118 -4.659 -6.339 0.343 1.00 0.00 N ATOM 1821 CA LEU A 118 -3.474 -5.658 0.835 1.00 0.00 C ATOM 1822 C LEU A 118 -2.842 -4.822 -0.268 1.00 0.00 C ATOM 1823 O LEU A 118 -2.769 -5.238 -1.427 1.00 0.00 O ATOM 1824 CB LEU A 118 -2.453 -6.670 1.352 1.00 0.00 C ATOM 1825 CG LEU A 118 -1.260 -6.080 2.109 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -1.714 -5.404 3.394 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -0.239 -7.167 2.410 1.00 0.00 C ATOM 0 H LEU A 118 -4.558 -6.735 -0.592 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.776 -5.003 1.652 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.966 -7.373 2.009 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -2.075 -7.243 0.505 1.00 0.00 H new ATOM 0 HG LEU A 118 -0.792 -5.325 1.478 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -0.849 -4.993 3.914 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.410 -4.600 3.156 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -2.209 -6.134 4.034 1.00 0.00 H new ATOM 0 HD21 LEU A 118 0.604 -6.735 2.948 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -0.702 -7.941 3.022 1.00 0.00 H new ATOM 0 HD23 LEU A 118 0.113 -7.605 1.476 1.00 0.00 H new ATOM 1839 N LEU A 119 -2.378 -3.653 0.113 1.00 0.00 N ATOM 1840 CA LEU A 119 -1.718 -2.740 -0.803 1.00 0.00 C ATOM 1841 C LEU A 119 -0.592 -2.015 -0.078 1.00 0.00 C ATOM 1842 O LEU A 119 -0.833 -1.261 0.866 1.00 0.00 O ATOM 1843 CB LEU A 119 -2.726 -1.737 -1.381 1.00 0.00 C ATOM 1844 CG LEU A 119 -2.153 -0.729 -2.383 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -1.493 -1.444 -3.550 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -3.249 0.199 -2.887 1.00 0.00 C ATOM 0 H LEU A 119 -2.446 -3.304 1.069 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.296 -3.308 -1.632 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.526 -2.293 -1.869 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.178 -1.186 -0.556 1.00 0.00 H new ATOM 0 HG LEU A 119 -1.396 -0.134 -1.872 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.094 -0.709 -4.248 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.682 -2.072 -3.181 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.229 -2.065 -4.059 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.826 0.909 -3.598 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.025 -0.388 -3.378 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.682 0.741 -2.046 1.00 0.00 H new ATOM 1858 N LEU A 120 0.636 -2.269 -0.501 1.00 0.00 N ATOM 1859 CA LEU A 120 1.802 -1.682 0.145 1.00 0.00 C ATOM 1860 C LEU A 120 2.617 -0.872 -0.857 1.00 0.00 C ATOM 1861 O LEU A 120 2.703 -1.236 -2.033 1.00 0.00 O ATOM 1862 CB LEU A 120 2.677 -2.777 0.762 1.00 0.00 C ATOM 1863 CG LEU A 120 1.979 -3.689 1.777 1.00 0.00 C ATOM 1864 CD1 LEU A 120 2.929 -4.779 2.251 1.00 0.00 C ATOM 1865 CD2 LEU A 120 1.461 -2.885 2.958 1.00 0.00 C ATOM 0 H LEU A 120 0.853 -2.878 -1.290 1.00 0.00 H new ATOM 0 HA LEU A 120 1.456 -1.017 0.936 1.00 0.00 H new ATOM 0 HB2 LEU A 120 3.074 -3.396 -0.042 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.529 -2.304 1.251 1.00 0.00 H new ATOM 0 HG LEU A 120 1.127 -4.159 1.285 1.00 0.00 H new ATOM 0 HD11 LEU A 120 2.419 -5.418 2.971 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.251 -5.377 1.399 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.799 -4.323 2.723 1.00 0.00 H new ATOM 0 HD21 LEU A 120 0.969 -3.553 3.665 1.00 0.00 H new ATOM 0 HD22 LEU A 120 2.294 -2.384 3.451 1.00 0.00 H new ATOM 0 HD23 LEU A 120 0.747 -2.140 2.606 1.00 0.00 H new ATOM 1877 N GLY A 121 3.215 0.216 -0.392 1.00 0.00 N ATOM 1878 CA GLY A 121 3.975 1.072 -1.279 1.00 0.00 C ATOM 1879 C GLY A 121 5.311 1.500 -0.698 1.00 0.00 C ATOM 1880 O GLY A 121 5.579 1.277 0.488 1.00 0.00 O ATOM 0 H GLY A 121 3.187 0.520 0.581 1.00 0.00 H new ATOM 0 HA2 GLY A 121 4.146 0.549 -2.220 1.00 0.00 H new ATOM 0 HA3 GLY A 121 3.386 1.959 -1.510 1.00 0.00 H new ATOM 1884 N SER A 122 6.140 2.110 -1.554 1.00 0.00 N ATOM 1885 CA SER A 122 7.450 2.655 -1.171 1.00 0.00 C ATOM 1886 C SER A 122 8.498 1.553 -0.970 1.00 0.00 C ATOM 1887 O SER A 122 8.195 0.362 -1.093 1.00 0.00 O ATOM 1888 CB SER A 122 7.338 3.533 0.082 1.00 0.00 C ATOM 1889 OG SER A 122 6.487 4.649 -0.145 1.00 0.00 O ATOM 0 H SER A 122 5.919 2.241 -2.541 1.00 0.00 H new ATOM 0 HA SER A 122 7.789 3.278 -1.999 1.00 0.00 H new ATOM 0 HB2 SER A 122 6.951 2.940 0.911 1.00 0.00 H new ATOM 0 HB3 SER A 122 8.329 3.882 0.374 1.00 0.00 H new ATOM 0 HG SER A 122 5.551 4.361 -0.104 1.00 0.00 H new ATOM 1895 N GLU A 123 9.738 1.978 -0.690 1.00 0.00 N ATOM 1896 CA GLU A 123 10.872 1.069 -0.495 1.00 0.00 C ATOM 1897 C GLU A 123 11.211 0.301 -1.767 1.00 0.00 C ATOM 1898 O GLU A 123 10.819 0.695 -2.868 1.00 0.00 O ATOM 1899 CB GLU A 123 10.616 0.099 0.657 1.00 0.00 C ATOM 1900 CG GLU A 123 11.247 0.546 1.963 1.00 0.00 C ATOM 1901 CD GLU A 123 12.747 0.737 1.850 1.00 0.00 C ATOM 1902 OE1 GLU A 123 13.465 -0.249 1.576 1.00 0.00 O ATOM 1903 OE2 GLU A 123 13.218 1.880 2.023 1.00 0.00 O ATOM 0 H GLU A 123 9.981 2.964 -0.593 1.00 0.00 H new ATOM 0 HA GLU A 123 11.731 1.690 -0.240 1.00 0.00 H new ATOM 0 HB2 GLU A 123 9.541 -0.012 0.799 1.00 0.00 H new ATOM 0 HB3 GLU A 123 11.005 -0.884 0.390 1.00 0.00 H new ATOM 0 HG2 GLU A 123 10.788 1.482 2.282 1.00 0.00 H new ATOM 0 HG3 GLU A 123 11.036 -0.193 2.736 1.00 0.00 H new ATOM 1910 N TYR A 124 11.987 -0.763 -1.603 1.00 0.00 N ATOM 1911 CA TYR A 124 12.389 -1.614 -2.715 1.00 0.00 C ATOM 1912 C TYR A 124 11.661 -2.949 -2.654 1.00 0.00 C ATOM 1913 O TYR A 124 10.664 -3.089 -1.949 1.00 0.00 O ATOM 1914 CB TYR A 124 13.904 -1.844 -2.695 1.00 0.00 C ATOM 1915 CG TYR A 124 14.717 -0.615 -3.024 1.00 0.00 C ATOM 1916 CD1 TYR A 124 15.029 -0.303 -4.341 1.00 0.00 C ATOM 1917 CD2 TYR A 124 15.170 0.233 -2.023 1.00 0.00 C ATOM 1918 CE1 TYR A 124 15.770 0.819 -4.651 1.00 0.00 C ATOM 1919 CE2 TYR A 124 15.912 1.360 -2.325 1.00 0.00 C ATOM 1920 CZ TYR A 124 16.210 1.647 -3.642 1.00 0.00 C ATOM 1921 OH TYR A 124 16.942 2.770 -3.956 1.00 0.00 O ATOM 0 H TYR A 124 12.354 -1.059 -0.699 1.00 0.00 H new ATOM 0 HA TYR A 124 12.122 -1.110 -3.644 1.00 0.00 H new ATOM 0 HB2 TYR A 124 14.193 -2.205 -1.708 1.00 0.00 H new ATOM 0 HB3 TYR A 124 14.151 -2.632 -3.407 1.00 0.00 H new ATOM 0 HD1 TYR A 124 14.686 -0.949 -5.135 1.00 0.00 H new ATOM 0 HD2 TYR A 124 14.939 0.009 -0.992 1.00 0.00 H new ATOM 0 HE1 TYR A 124 16.004 1.047 -5.680 1.00 0.00 H new ATOM 0 HE2 TYR A 124 16.256 2.012 -1.536 1.00 0.00 H new ATOM 0 HH TYR A 124 17.176 3.249 -3.133 1.00 0.00 H new ATOM 1931 N THR A 125 12.159 -3.926 -3.400 1.00 0.00 N ATOM 1932 CA THR A 125 11.536 -5.234 -3.453 1.00 0.00 C ATOM 1933 C THR A 125 11.664 -5.967 -2.117 1.00 0.00 C ATOM 1934 O THR A 125 12.600 -5.723 -1.348 1.00 0.00 O ATOM 1935 CB THR A 125 12.167 -6.086 -4.569 1.00 0.00 C ATOM 1936 OG1 THR A 125 13.590 -6.127 -4.409 1.00 0.00 O ATOM 1937 CG2 THR A 125 11.825 -5.524 -5.940 1.00 0.00 C ATOM 0 H THR A 125 12.995 -3.833 -3.977 1.00 0.00 H new ATOM 0 HA THR A 125 10.477 -5.084 -3.665 1.00 0.00 H new ATOM 0 HB THR A 125 11.762 -7.095 -4.496 1.00 0.00 H new ATOM 0 HG1 THR A 125 13.984 -6.672 -5.122 1.00 0.00 H new ATOM 0 HG21 THR A 125 12.282 -6.143 -6.712 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.743 -5.520 -6.072 1.00 0.00 H new ATOM 0 HG23 THR A 125 12.204 -4.505 -6.021 1.00 0.00 H new ATOM 1945 N PRO A 126 10.725 -6.889 -1.828 1.00 0.00 N ATOM 1946 CA PRO A 126 10.734 -7.679 -0.589 1.00 0.00 C ATOM 1947 C PRO A 126 12.003 -8.507 -0.440 1.00 0.00 C ATOM 1948 O PRO A 126 12.396 -8.880 0.663 1.00 0.00 O ATOM 1949 CB PRO A 126 9.520 -8.601 -0.736 1.00 0.00 C ATOM 1950 CG PRO A 126 8.639 -7.924 -1.727 1.00 0.00 C ATOM 1951 CD PRO A 126 9.562 -7.213 -2.675 1.00 0.00 C ATOM 0 HA PRO A 126 10.698 -7.041 0.294 1.00 0.00 H new ATOM 0 HB2 PRO A 126 9.816 -9.591 -1.083 1.00 0.00 H new ATOM 0 HB3 PRO A 126 9.010 -8.737 0.218 1.00 0.00 H new ATOM 0 HG2 PRO A 126 8.017 -8.646 -2.255 1.00 0.00 H new ATOM 0 HG3 PRO A 126 7.965 -7.222 -1.236 1.00 0.00 H new ATOM 0 HD2 PRO A 126 9.841 -7.846 -3.518 1.00 0.00 H new ATOM 0 HD3 PRO A 126 9.102 -6.316 -3.089 1.00 0.00 H new ATOM 1959 N GLN A 127 12.645 -8.771 -1.565 1.00 0.00 N ATOM 1960 CA GLN A 127 13.858 -9.574 -1.602 1.00 0.00 C ATOM 1961 C GLN A 127 15.022 -8.846 -0.938 1.00 0.00 C ATOM 1962 O GLN A 127 15.955 -9.475 -0.440 1.00 0.00 O ATOM 1963 CB GLN A 127 14.212 -9.925 -3.041 1.00 0.00 C ATOM 1964 CG GLN A 127 13.443 -11.122 -3.584 1.00 0.00 C ATOM 1965 CD GLN A 127 11.938 -10.997 -3.436 1.00 0.00 C ATOM 1966 OE1 GLN A 127 11.265 -10.405 -4.278 1.00 0.00 O ATOM 1967 NE2 GLN A 127 11.401 -11.583 -2.378 1.00 0.00 N ATOM 0 H GLN A 127 12.341 -8.435 -2.479 1.00 0.00 H new ATOM 0 HA GLN A 127 13.672 -10.492 -1.045 1.00 0.00 H new ATOM 0 HB2 GLN A 127 14.017 -9.060 -3.675 1.00 0.00 H new ATOM 0 HB3 GLN A 127 15.280 -10.132 -3.103 1.00 0.00 H new ATOM 0 HG2 GLN A 127 13.686 -11.251 -4.639 1.00 0.00 H new ATOM 0 HG3 GLN A 127 13.777 -12.022 -3.067 1.00 0.00 H new ATOM 0 HE21 GLN A 127 11.997 -12.064 -1.704 1.00 0.00 H new ATOM 0 HE22 GLN A 127 10.391 -11.554 -2.237 1.00 0.00 H new ATOM 1976 N GLN A 128 14.957 -7.519 -0.925 1.00 0.00 N ATOM 1977 CA GLN A 128 16.042 -6.711 -0.384 1.00 0.00 C ATOM 1978 C GLN A 128 15.625 -5.986 0.894 1.00 0.00 C ATOM 1979 O GLN A 128 16.413 -5.231 1.469 1.00 0.00 O ATOM 1980 CB GLN A 128 16.513 -5.694 -1.423 1.00 0.00 C ATOM 1981 CG GLN A 128 17.068 -6.329 -2.687 1.00 0.00 C ATOM 1982 CD GLN A 128 17.732 -5.320 -3.604 1.00 0.00 C ATOM 1983 OE1 GLN A 128 17.104 -4.759 -4.503 1.00 0.00 O ATOM 1984 NE2 GLN A 128 19.007 -5.077 -3.368 1.00 0.00 N ATOM 0 H GLN A 128 14.167 -6.982 -1.282 1.00 0.00 H new ATOM 0 HA GLN A 128 16.861 -7.387 -0.137 1.00 0.00 H new ATOM 0 HB2 GLN A 128 15.678 -5.045 -1.689 1.00 0.00 H new ATOM 0 HB3 GLN A 128 17.280 -5.061 -0.978 1.00 0.00 H new ATOM 0 HG2 GLN A 128 17.791 -7.098 -2.415 1.00 0.00 H new ATOM 0 HG3 GLN A 128 16.260 -6.826 -3.224 1.00 0.00 H new ATOM 0 HE21 GLN A 128 19.488 -5.565 -2.612 1.00 0.00 H new ATOM 0 HE22 GLN A 128 19.512 -4.401 -3.941 1.00 0.00 H new ATOM 1993 N LEU A 129 14.395 -6.213 1.335 1.00 0.00 N ATOM 1994 CA LEU A 129 13.902 -5.577 2.551 1.00 0.00 C ATOM 1995 C LEU A 129 14.529 -6.205 3.794 1.00 0.00 C ATOM 1996 O LEU A 129 14.600 -7.431 3.917 1.00 0.00 O ATOM 1997 CB LEU A 129 12.376 -5.677 2.635 1.00 0.00 C ATOM 1998 CG LEU A 129 11.602 -4.760 1.684 1.00 0.00 C ATOM 1999 CD1 LEU A 129 10.106 -5.012 1.802 1.00 0.00 C ATOM 2000 CD2 LEU A 129 11.915 -3.302 1.989 1.00 0.00 C ATOM 0 H LEU A 129 13.724 -6.828 0.874 1.00 0.00 H new ATOM 0 HA LEU A 129 14.187 -4.526 2.511 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.085 -6.708 2.434 1.00 0.00 H new ATOM 0 HB3 LEU A 129 12.070 -5.453 3.657 1.00 0.00 H new ATOM 0 HG LEU A 129 11.911 -4.980 0.662 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.571 -4.352 1.119 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.891 -6.050 1.547 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.783 -4.815 2.824 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.359 -2.660 1.306 1.00 0.00 H new ATOM 0 HD22 LEU A 129 11.628 -3.075 3.016 1.00 0.00 H new ATOM 0 HD23 LEU A 129 12.983 -3.125 1.864 1.00 0.00 H new ATOM 2012 N VAL A 130 14.982 -5.357 4.709 1.00 0.00 N ATOM 2013 CA VAL A 130 15.552 -5.816 5.965 1.00 0.00 C ATOM 2014 C VAL A 130 14.480 -5.843 7.050 1.00 0.00 C ATOM 2015 O VAL A 130 14.231 -4.846 7.732 1.00 0.00 O ATOM 2016 CB VAL A 130 16.734 -4.933 6.420 1.00 0.00 C ATOM 2017 CG1 VAL A 130 17.355 -5.488 7.700 1.00 0.00 C ATOM 2018 CG2 VAL A 130 17.783 -4.821 5.316 1.00 0.00 C ATOM 0 H VAL A 130 14.964 -4.343 4.602 1.00 0.00 H new ATOM 0 HA VAL A 130 15.933 -6.824 5.801 1.00 0.00 H new ATOM 0 HB VAL A 130 16.353 -3.933 6.628 1.00 0.00 H new ATOM 0 HG11 VAL A 130 18.186 -4.853 8.006 1.00 0.00 H new ATOM 0 HG12 VAL A 130 16.604 -5.508 8.490 1.00 0.00 H new ATOM 0 HG13 VAL A 130 17.718 -6.500 7.519 1.00 0.00 H new ATOM 0 HG21 VAL A 130 18.606 -4.194 5.659 1.00 0.00 H new ATOM 0 HG22 VAL A 130 18.160 -5.814 5.071 1.00 0.00 H new ATOM 0 HG23 VAL A 130 17.332 -4.375 4.430 1.00 0.00 H new ATOM 2028 N ILE A 131 13.834 -6.987 7.175 1.00 0.00 N ATOM 2029 CA ILE A 131 12.751 -7.181 8.128 1.00 0.00 C ATOM 2030 C ILE A 131 12.830 -8.592 8.694 1.00 0.00 C ATOM 2031 O ILE A 131 13.795 -9.307 8.429 1.00 0.00 O ATOM 2032 CB ILE A 131 11.362 -6.986 7.473 1.00 0.00 C ATOM 2033 CG1 ILE A 131 11.242 -7.847 6.210 1.00 0.00 C ATOM 2034 CG2 ILE A 131 11.112 -5.516 7.155 1.00 0.00 C ATOM 2035 CD1 ILE A 131 9.891 -7.752 5.534 1.00 0.00 C ATOM 0 H ILE A 131 14.045 -7.814 6.616 1.00 0.00 H new ATOM 0 HA ILE A 131 12.864 -6.436 8.916 1.00 0.00 H new ATOM 0 HB ILE A 131 10.599 -7.308 8.182 1.00 0.00 H new ATOM 0 HG12 ILE A 131 12.014 -7.547 5.502 1.00 0.00 H new ATOM 0 HG13 ILE A 131 11.435 -8.888 6.471 1.00 0.00 H new ATOM 0 HG21 ILE A 131 10.130 -5.405 6.696 1.00 0.00 H new ATOM 0 HG22 ILE A 131 11.150 -4.933 8.075 1.00 0.00 H new ATOM 0 HG23 ILE A 131 11.877 -5.157 6.466 1.00 0.00 H new ATOM 0 HD11 ILE A 131 9.882 -8.388 4.649 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.115 -8.080 6.225 1.00 0.00 H new ATOM 0 HD13 ILE A 131 9.703 -6.719 5.241 1.00 0.00 H new ATOM 2047 N ARG A 132 11.841 -8.979 9.491 1.00 0.00 N ATOM 2048 CA ARG A 132 11.728 -10.361 9.934 1.00 0.00 C ATOM 2049 C ARG A 132 11.721 -11.280 8.725 1.00 0.00 C ATOM 2050 O ARG A 132 10.878 -11.143 7.839 1.00 0.00 O ATOM 2051 CB ARG A 132 10.446 -10.569 10.740 1.00 0.00 C ATOM 2052 CG ARG A 132 10.194 -12.012 11.139 1.00 0.00 C ATOM 2053 CD ARG A 132 11.111 -12.460 12.264 1.00 0.00 C ATOM 2054 NE ARG A 132 10.515 -12.244 13.578 1.00 0.00 N ATOM 2055 CZ ARG A 132 10.098 -13.230 14.372 1.00 0.00 C ATOM 2056 NH1 ARG A 132 10.201 -14.496 13.970 1.00 0.00 N ATOM 2057 NH2 ARG A 132 9.572 -12.951 15.559 1.00 0.00 N ATOM 0 H ARG A 132 11.111 -8.359 9.841 1.00 0.00 H new ATOM 0 HA ARG A 132 12.581 -10.593 10.572 1.00 0.00 H new ATOM 0 HB2 ARG A 132 10.492 -9.957 11.641 1.00 0.00 H new ATOM 0 HB3 ARG A 132 9.599 -10.212 10.154 1.00 0.00 H new ATOM 0 HG2 ARG A 132 9.156 -12.126 11.451 1.00 0.00 H new ATOM 0 HG3 ARG A 132 10.340 -12.658 10.273 1.00 0.00 H new ATOM 0 HD2 ARG A 132 11.344 -13.518 12.142 1.00 0.00 H new ATOM 0 HD3 ARG A 132 12.054 -11.917 12.200 1.00 0.00 H new ATOM 0 HE ARG A 132 10.412 -11.284 13.908 1.00 0.00 H new ATOM 0 HH11 ARG A 132 10.599 -14.710 13.055 1.00 0.00 H new ATOM 0 HH12 ARG A 132 9.882 -15.251 14.577 1.00 0.00 H new ATOM 0 HH21 ARG A 132 9.487 -11.981 15.864 1.00 0.00 H new ATOM 0 HH22 ARG A 132 9.253 -13.706 16.166 1.00 0.00 H new ATOM 2071 N GLU A 133 12.652 -12.213 8.694 1.00 0.00 N ATOM 2072 CA GLU A 133 12.812 -13.093 7.544 1.00 0.00 C ATOM 2073 C GLU A 133 11.636 -14.051 7.419 1.00 0.00 C ATOM 2074 O GLU A 133 11.366 -14.580 6.338 1.00 0.00 O ATOM 2075 CB GLU A 133 14.134 -13.855 7.625 1.00 0.00 C ATOM 2076 CG GLU A 133 15.340 -12.933 7.644 1.00 0.00 C ATOM 2077 CD GLU A 133 16.645 -13.662 7.431 1.00 0.00 C ATOM 2078 OE1 GLU A 133 17.264 -14.086 8.428 1.00 0.00 O ATOM 2079 OE2 GLU A 133 17.071 -13.786 6.262 1.00 0.00 O ATOM 0 H GLU A 133 13.313 -12.385 9.452 1.00 0.00 H new ATOM 0 HA GLU A 133 12.832 -12.474 6.647 1.00 0.00 H new ATOM 0 HB2 GLU A 133 14.139 -14.472 8.524 1.00 0.00 H new ATOM 0 HB3 GLU A 133 14.212 -14.531 6.774 1.00 0.00 H new ATOM 0 HG2 GLU A 133 15.223 -12.175 6.869 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.375 -12.409 8.599 1.00 0.00 H new ATOM 2086 N ASP A 134 10.922 -14.250 8.519 1.00 0.00 N ATOM 2087 CA ASP A 134 9.708 -15.059 8.499 1.00 0.00 C ATOM 2088 C ASP A 134 8.630 -14.318 7.719 1.00 0.00 C ATOM 2089 O ASP A 134 7.823 -14.918 7.013 1.00 0.00 O ATOM 2090 CB ASP A 134 9.208 -15.342 9.923 1.00 0.00 C ATOM 2091 CG ASP A 134 10.241 -16.027 10.796 1.00 0.00 C ATOM 2092 OD1 ASP A 134 10.295 -17.271 10.808 1.00 0.00 O ATOM 2093 OD2 ASP A 134 11.001 -15.317 11.485 1.00 0.00 O ATOM 0 H ASP A 134 11.160 -13.865 9.433 1.00 0.00 H new ATOM 0 HA ASP A 134 9.932 -16.013 8.021 1.00 0.00 H new ATOM 0 HB2 ASP A 134 8.913 -14.403 10.390 1.00 0.00 H new ATOM 0 HB3 ASP A 134 8.316 -15.966 9.870 1.00 0.00 H new ATOM 2098 N LEU A 135 8.641 -13.000 7.852 1.00 0.00 N ATOM 2099 CA LEU A 135 7.689 -12.140 7.165 1.00 0.00 C ATOM 2100 C LEU A 135 8.159 -11.881 5.732 1.00 0.00 C ATOM 2101 O LEU A 135 7.351 -11.802 4.808 1.00 0.00 O ATOM 2102 CB LEU A 135 7.538 -10.825 7.947 1.00 0.00 C ATOM 2103 CG LEU A 135 6.305 -9.967 7.621 1.00 0.00 C ATOM 2104 CD1 LEU A 135 6.049 -8.971 8.739 1.00 0.00 C ATOM 2105 CD2 LEU A 135 6.482 -9.218 6.310 1.00 0.00 C ATOM 0 H LEU A 135 9.308 -12.498 8.438 1.00 0.00 H new ATOM 0 HA LEU A 135 6.716 -12.629 7.115 1.00 0.00 H new ATOM 0 HB2 LEU A 135 7.516 -11.062 9.011 1.00 0.00 H new ATOM 0 HB3 LEU A 135 8.429 -10.221 7.773 1.00 0.00 H new ATOM 0 HG LEU A 135 5.452 -10.638 7.524 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.173 -8.369 8.497 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.874 -9.508 9.671 1.00 0.00 H new ATOM 0 HD13 LEU A 135 6.916 -8.321 8.852 1.00 0.00 H new ATOM 0 HD21 LEU A 135 5.592 -8.621 6.109 1.00 0.00 H new ATOM 0 HD22 LEU A 135 7.350 -8.563 6.380 1.00 0.00 H new ATOM 0 HD23 LEU A 135 6.630 -9.932 5.500 1.00 0.00 H new ATOM 2117 N ARG A 136 9.477 -11.771 5.559 1.00 0.00 N ATOM 2118 CA ARG A 136 10.077 -11.459 4.258 1.00 0.00 C ATOM 2119 C ARG A 136 9.628 -12.457 3.193 1.00 0.00 C ATOM 2120 O ARG A 136 9.391 -12.088 2.045 1.00 0.00 O ATOM 2121 CB ARG A 136 11.604 -11.482 4.353 1.00 0.00 C ATOM 2122 CG ARG A 136 12.293 -10.633 3.293 1.00 0.00 C ATOM 2123 CD ARG A 136 13.745 -11.037 3.095 1.00 0.00 C ATOM 2124 NE ARG A 136 13.874 -12.166 2.172 1.00 0.00 N ATOM 2125 CZ ARG A 136 14.958 -12.937 2.067 1.00 0.00 C ATOM 2126 NH1 ARG A 136 15.998 -12.759 2.870 1.00 0.00 N ATOM 2127 NH2 ARG A 136 14.998 -13.894 1.153 1.00 0.00 N ATOM 0 H ARG A 136 10.156 -11.894 6.310 1.00 0.00 H new ATOM 0 HA ARG A 136 9.743 -10.461 3.973 1.00 0.00 H new ATOM 0 HB2 ARG A 136 11.904 -11.130 5.340 1.00 0.00 H new ATOM 0 HB3 ARG A 136 11.950 -12.512 4.263 1.00 0.00 H new ATOM 0 HG2 ARG A 136 11.758 -10.728 2.348 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.245 -9.583 3.582 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.310 -10.187 2.711 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.183 -11.302 4.057 1.00 0.00 H new ATOM 0 HE ARG A 136 13.080 -12.378 1.567 1.00 0.00 H new ATOM 0 HH11 ARG A 136 15.976 -12.026 3.579 1.00 0.00 H new ATOM 0 HH12 ARG A 136 16.820 -13.355 2.779 1.00 0.00 H new ATOM 0 HH21 ARG A 136 14.202 -14.040 0.532 1.00 0.00 H new ATOM 0 HH22 ARG A 136 15.825 -14.485 1.070 1.00 0.00 H new ATOM 2141 N THR A 137 9.514 -13.718 3.580 1.00 0.00 N ATOM 2142 CA THR A 137 9.086 -14.761 2.662 1.00 0.00 C ATOM 2143 C THR A 137 7.608 -14.615 2.313 1.00 0.00 C ATOM 2144 O THR A 137 7.199 -14.864 1.181 1.00 0.00 O ATOM 2145 CB THR A 137 9.354 -16.153 3.257 1.00 0.00 C ATOM 2146 OG1 THR A 137 9.043 -16.145 4.655 1.00 0.00 O ATOM 2147 CG2 THR A 137 10.805 -16.558 3.062 1.00 0.00 C ATOM 0 H THR A 137 9.713 -14.044 4.526 1.00 0.00 H new ATOM 0 HA THR A 137 9.666 -14.654 1.746 1.00 0.00 H new ATOM 0 HB THR A 137 8.722 -16.875 2.740 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.213 -17.033 5.033 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.968 -17.546 3.492 1.00 0.00 H new ATOM 0 HG22 THR A 137 11.036 -16.583 1.997 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.454 -15.836 3.557 1.00 0.00 H new ATOM 2155 N ARG A 138 6.817 -14.174 3.286 1.00 0.00 N ATOM 2156 CA ARG A 138 5.386 -13.972 3.088 1.00 0.00 C ATOM 2157 C ARG A 138 5.136 -12.796 2.144 1.00 0.00 C ATOM 2158 O ARG A 138 4.053 -12.655 1.574 1.00 0.00 O ATOM 2159 CB ARG A 138 4.710 -13.714 4.436 1.00 0.00 C ATOM 2160 CG ARG A 138 5.001 -14.784 5.473 1.00 0.00 C ATOM 2161 CD ARG A 138 4.300 -16.092 5.146 1.00 0.00 C ATOM 2162 NE ARG A 138 4.790 -17.195 5.971 1.00 0.00 N ATOM 2163 CZ ARG A 138 4.038 -17.899 6.818 1.00 0.00 C ATOM 2164 NH1 ARG A 138 2.764 -17.584 7.011 1.00 0.00 N ATOM 2165 NH2 ARG A 138 4.564 -18.919 7.484 1.00 0.00 N ATOM 0 H ARG A 138 7.146 -13.949 4.225 1.00 0.00 H new ATOM 0 HA ARG A 138 4.964 -14.871 2.639 1.00 0.00 H new ATOM 0 HB2 ARG A 138 5.039 -12.748 4.820 1.00 0.00 H new ATOM 0 HB3 ARG A 138 3.632 -13.647 4.286 1.00 0.00 H new ATOM 0 HG2 ARG A 138 6.076 -14.952 5.530 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.681 -14.435 6.455 1.00 0.00 H new ATOM 0 HD2 ARG A 138 3.227 -15.976 5.296 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.451 -16.331 4.093 1.00 0.00 H new ATOM 0 HE ARG A 138 5.776 -17.444 5.893 1.00 0.00 H new ATOM 0 HH11 ARG A 138 2.352 -16.797 6.510 1.00 0.00 H new ATOM 0 HH12 ARG A 138 2.197 -18.128 7.661 1.00 0.00 H new ATOM 0 HH21 ARG A 138 5.544 -19.165 7.348 1.00 0.00 H new ATOM 0 HH22 ARG A 138 3.988 -19.457 8.132 1.00 0.00 H new ATOM 2179 N MET A 139 6.154 -11.962 1.985 1.00 0.00 N ATOM 2180 CA MET A 139 6.086 -10.798 1.110 1.00 0.00 C ATOM 2181 C MET A 139 6.238 -11.193 -0.354 1.00 0.00 C ATOM 2182 O MET A 139 5.873 -10.438 -1.249 1.00 0.00 O ATOM 2183 CB MET A 139 7.186 -9.807 1.482 1.00 0.00 C ATOM 2184 CG MET A 139 6.971 -9.125 2.817 1.00 0.00 C ATOM 2185 SD MET A 139 5.597 -7.959 2.787 1.00 0.00 S ATOM 2186 CE MET A 139 6.188 -6.775 1.582 1.00 0.00 C ATOM 0 H MET A 139 7.051 -12.072 2.458 1.00 0.00 H new ATOM 0 HA MET A 139 5.107 -10.337 1.242 1.00 0.00 H new ATOM 0 HB2 MET A 139 8.142 -10.331 1.502 1.00 0.00 H new ATOM 0 HB3 MET A 139 7.255 -9.047 0.704 1.00 0.00 H new ATOM 0 HG2 MET A 139 6.785 -9.880 3.581 1.00 0.00 H new ATOM 0 HG3 MET A 139 7.882 -8.600 3.103 1.00 0.00 H new ATOM 0 HE1 MET A 139 5.701 -5.814 1.747 1.00 0.00 H new ATOM 0 HE2 MET A 139 7.267 -6.658 1.686 1.00 0.00 H new ATOM 0 HE3 MET A 139 5.956 -7.131 0.578 1.00 0.00 H new ATOM 2196 N ALA A 140 6.773 -12.383 -0.589 1.00 0.00 N ATOM 2197 CA ALA A 140 7.060 -12.834 -1.951 1.00 0.00 C ATOM 2198 C ALA A 140 5.841 -13.483 -2.608 1.00 0.00 C ATOM 2199 O ALA A 140 5.900 -13.899 -3.763 1.00 0.00 O ATOM 2200 CB ALA A 140 8.238 -13.797 -1.948 1.00 0.00 C ATOM 0 H ALA A 140 7.018 -13.054 0.140 1.00 0.00 H new ATOM 0 HA ALA A 140 7.317 -11.955 -2.542 1.00 0.00 H new ATOM 0 HB1 ALA A 140 8.442 -14.126 -2.967 1.00 0.00 H new ATOM 0 HB2 ALA A 140 9.118 -13.294 -1.546 1.00 0.00 H new ATOM 0 HB3 ALA A 140 7.999 -14.662 -1.329 1.00 0.00 H new ATOM 2206 N TYR A 141 4.734 -13.549 -1.876 1.00 0.00 N ATOM 2207 CA TYR A 141 3.533 -14.215 -2.369 1.00 0.00 C ATOM 2208 C TYR A 141 2.577 -13.247 -3.072 1.00 0.00 C ATOM 2209 O TYR A 141 1.537 -13.665 -3.580 1.00 0.00 O ATOM 2210 CB TYR A 141 2.784 -14.887 -1.219 1.00 0.00 C ATOM 2211 CG TYR A 141 3.463 -16.107 -0.630 1.00 0.00 C ATOM 2212 CD1 TYR A 141 3.240 -17.372 -1.162 1.00 0.00 C ATOM 2213 CD2 TYR A 141 4.303 -16.000 0.471 1.00 0.00 C ATOM 2214 CE1 TYR A 141 3.841 -18.493 -0.616 1.00 0.00 C ATOM 2215 CE2 TYR A 141 4.904 -17.116 1.025 1.00 0.00 C ATOM 2216 CZ TYR A 141 4.671 -18.359 0.478 1.00 0.00 C ATOM 2217 OH TYR A 141 5.267 -19.473 1.030 1.00 0.00 O ATOM 0 H TYR A 141 4.643 -13.151 -0.941 1.00 0.00 H new ATOM 0 HA TYR A 141 3.867 -14.959 -3.093 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.637 -14.154 -0.425 1.00 0.00 H new ATOM 0 HB3 TYR A 141 1.794 -15.177 -1.572 1.00 0.00 H new ATOM 0 HD1 TYR A 141 2.587 -17.482 -2.015 1.00 0.00 H new ATOM 0 HD2 TYR A 141 4.490 -15.028 0.902 1.00 0.00 H new ATOM 0 HE1 TYR A 141 3.661 -19.468 -1.044 1.00 0.00 H new ATOM 0 HE2 TYR A 141 5.553 -17.013 1.882 1.00 0.00 H new ATOM 0 HH TYR A 141 5.821 -19.204 1.793 1.00 0.00 H new ATOM 2227 N CYS A 142 2.904 -11.961 -3.098 1.00 0.00 N ATOM 2228 CA CYS A 142 1.996 -10.978 -3.663 1.00 0.00 C ATOM 2229 C CYS A 142 2.491 -10.495 -5.016 1.00 0.00 C ATOM 2230 O CYS A 142 3.591 -10.841 -5.455 1.00 0.00 O ATOM 2231 CB CYS A 142 1.817 -9.793 -2.708 1.00 0.00 C ATOM 2232 SG CYS A 142 3.352 -8.947 -2.272 1.00 0.00 S ATOM 0 H CYS A 142 3.780 -11.580 -2.739 1.00 0.00 H new ATOM 0 HA CYS A 142 1.028 -11.459 -3.804 1.00 0.00 H new ATOM 0 HB2 CYS A 142 1.137 -9.074 -3.165 1.00 0.00 H new ATOM 0 HB3 CYS A 142 1.340 -10.147 -1.794 1.00 0.00 H new ATOM 0 HG CYS A 142 4.231 -9.819 -1.876 1.00 0.00 H new ATOM 2238 N LEU A 143 1.671 -9.693 -5.667 1.00 0.00 N ATOM 2239 CA LEU A 143 1.993 -9.170 -6.982 1.00 0.00 C ATOM 2240 C LEU A 143 2.824 -7.906 -6.852 1.00 0.00 C ATOM 2241 O LEU A 143 2.735 -7.192 -5.850 1.00 0.00 O ATOM 2242 CB LEU A 143 0.720 -8.869 -7.788 1.00 0.00 C ATOM 2243 CG LEU A 143 -0.120 -10.081 -8.194 1.00 0.00 C ATOM 2244 CD1 LEU A 143 -0.894 -10.644 -7.009 1.00 0.00 C ATOM 2245 CD2 LEU A 143 -1.068 -9.719 -9.330 1.00 0.00 C ATOM 0 H LEU A 143 0.769 -9.387 -5.303 1.00 0.00 H new ATOM 0 HA LEU A 143 2.565 -9.930 -7.514 1.00 0.00 H new ATOM 0 HB2 LEU A 143 0.093 -8.198 -7.201 1.00 0.00 H new ATOM 0 HB3 LEU A 143 1.005 -8.331 -8.692 1.00 0.00 H new ATOM 0 HG LEU A 143 0.562 -10.856 -8.543 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -1.480 -11.504 -7.333 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -0.195 -10.953 -6.232 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -1.561 -9.878 -6.613 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.657 -10.594 -9.605 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -1.735 -8.920 -9.007 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.491 -9.384 -10.192 1.00 0.00 H new ATOM 2257 N VAL A 144 3.620 -7.622 -7.872 1.00 0.00 N ATOM 2258 CA VAL A 144 4.491 -6.462 -7.861 1.00 0.00 C ATOM 2259 C VAL A 144 4.314 -5.658 -9.140 1.00 0.00 C ATOM 2260 O VAL A 144 4.538 -6.164 -10.240 1.00 0.00 O ATOM 2261 CB VAL A 144 5.979 -6.863 -7.713 1.00 0.00 C ATOM 2262 CG1 VAL A 144 6.866 -5.629 -7.659 1.00 0.00 C ATOM 2263 CG2 VAL A 144 6.189 -7.720 -6.475 1.00 0.00 C ATOM 0 H VAL A 144 3.679 -8.184 -8.721 1.00 0.00 H new ATOM 0 HA VAL A 144 4.211 -5.855 -7.000 1.00 0.00 H new ATOM 0 HB VAL A 144 6.257 -7.451 -8.588 1.00 0.00 H new ATOM 0 HG11 VAL A 144 7.907 -5.934 -7.555 1.00 0.00 H new ATOM 0 HG12 VAL A 144 6.746 -5.054 -8.577 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.581 -5.013 -6.806 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.242 -7.989 -6.393 1.00 0.00 H new ATOM 0 HG22 VAL A 144 5.887 -7.160 -5.590 1.00 0.00 H new ATOM 0 HG23 VAL A 144 5.588 -8.626 -6.554 1.00 0.00 H new ATOM 2273 N TYR A 145 3.883 -4.419 -8.989 1.00 0.00 N ATOM 2274 CA TYR A 145 3.738 -3.517 -10.121 1.00 0.00 C ATOM 2275 C TYR A 145 4.894 -2.531 -10.140 1.00 0.00 C ATOM 2276 O TYR A 145 5.096 -1.782 -9.185 1.00 0.00 O ATOM 2277 CB TYR A 145 2.410 -2.755 -10.058 1.00 0.00 C ATOM 2278 CG TYR A 145 1.201 -3.562 -10.472 1.00 0.00 C ATOM 2279 CD1 TYR A 145 0.767 -4.647 -9.725 1.00 0.00 C ATOM 2280 CD2 TYR A 145 0.483 -3.223 -11.612 1.00 0.00 C ATOM 2281 CE1 TYR A 145 -0.347 -5.371 -10.100 1.00 0.00 C ATOM 2282 CE2 TYR A 145 -0.635 -3.938 -11.990 1.00 0.00 C ATOM 2283 CZ TYR A 145 -1.045 -5.013 -11.232 1.00 0.00 C ATOM 2284 OH TYR A 145 -2.165 -5.723 -11.595 1.00 0.00 O ATOM 0 H TYR A 145 3.626 -4.011 -8.090 1.00 0.00 H new ATOM 0 HA TYR A 145 3.745 -4.112 -11.034 1.00 0.00 H new ATOM 0 HB2 TYR A 145 2.260 -2.397 -9.040 1.00 0.00 H new ATOM 0 HB3 TYR A 145 2.480 -1.876 -10.698 1.00 0.00 H new ATOM 0 HD1 TYR A 145 1.310 -4.930 -8.835 1.00 0.00 H new ATOM 0 HD2 TYR A 145 0.805 -2.385 -12.213 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -0.670 -6.215 -9.508 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -1.186 -3.656 -12.875 1.00 0.00 H new ATOM 0 HH TYR A 145 -2.542 -5.342 -12.416 1.00 0.00 H new ATOM 2294 N GLU A 146 5.656 -2.544 -11.219 1.00 0.00 N ATOM 2295 CA GLU A 146 6.776 -1.631 -11.362 1.00 0.00 C ATOM 2296 C GLU A 146 6.267 -0.240 -11.719 1.00 0.00 C ATOM 2297 O GLU A 146 5.669 -0.039 -12.779 1.00 0.00 O ATOM 2298 CB GLU A 146 7.743 -2.141 -12.433 1.00 0.00 C ATOM 2299 CG GLU A 146 9.025 -1.333 -12.539 1.00 0.00 C ATOM 2300 CD GLU A 146 9.985 -1.909 -13.559 1.00 0.00 C ATOM 2301 OE1 GLU A 146 10.536 -3.003 -13.309 1.00 0.00 O ATOM 2302 OE2 GLU A 146 10.201 -1.273 -14.611 1.00 0.00 O ATOM 0 H GLU A 146 5.520 -3.176 -12.008 1.00 0.00 H new ATOM 0 HA GLU A 146 7.313 -1.575 -10.415 1.00 0.00 H new ATOM 0 HB2 GLU A 146 7.996 -3.179 -12.216 1.00 0.00 H new ATOM 0 HB3 GLU A 146 7.238 -2.131 -13.399 1.00 0.00 H new ATOM 0 HG2 GLU A 146 8.783 -0.306 -12.811 1.00 0.00 H new ATOM 0 HG3 GLU A 146 9.512 -1.298 -11.564 1.00 0.00 H new ATOM 2309 N VAL A 147 6.479 0.710 -10.822 1.00 0.00 N ATOM 2310 CA VAL A 147 6.032 2.072 -11.050 1.00 0.00 C ATOM 2311 C VAL A 147 6.935 2.761 -12.069 1.00 0.00 C ATOM 2312 O VAL A 147 8.162 2.698 -11.968 1.00 0.00 O ATOM 2313 CB VAL A 147 5.977 2.890 -9.735 1.00 0.00 C ATOM 2314 CG1 VAL A 147 7.362 3.055 -9.119 1.00 0.00 C ATOM 2315 CG2 VAL A 147 5.322 4.245 -9.971 1.00 0.00 C ATOM 0 H VAL A 147 6.956 0.562 -9.933 1.00 0.00 H new ATOM 0 HA VAL A 147 5.018 2.024 -11.447 1.00 0.00 H new ATOM 0 HB VAL A 147 5.367 2.333 -9.024 1.00 0.00 H new ATOM 0 HG11 VAL A 147 7.284 3.634 -8.199 1.00 0.00 H new ATOM 0 HG12 VAL A 147 7.780 2.073 -8.896 1.00 0.00 H new ATOM 0 HG13 VAL A 147 8.013 3.576 -9.821 1.00 0.00 H new ATOM 0 HG21 VAL A 147 5.293 4.803 -9.035 1.00 0.00 H new ATOM 0 HG22 VAL A 147 5.897 4.804 -10.709 1.00 0.00 H new ATOM 0 HG23 VAL A 147 4.306 4.099 -10.338 1.00 0.00 H new ATOM 2325 N LYS A 148 6.308 3.393 -13.056 1.00 0.00 N ATOM 2326 CA LYS A 148 7.017 4.074 -14.131 1.00 0.00 C ATOM 2327 C LYS A 148 7.896 3.094 -14.912 1.00 0.00 C ATOM 2328 O LYS A 148 9.084 2.933 -14.625 1.00 0.00 O ATOM 2329 CB LYS A 148 7.852 5.245 -13.587 1.00 0.00 C ATOM 2330 CG LYS A 148 8.497 6.083 -14.677 1.00 0.00 C ATOM 2331 CD LYS A 148 7.455 6.625 -15.639 1.00 0.00 C ATOM 2332 CE LYS A 148 8.095 7.329 -16.817 1.00 0.00 C ATOM 2333 NZ LYS A 148 7.084 7.736 -17.824 1.00 0.00 N ATOM 0 H LYS A 148 5.292 3.447 -13.132 1.00 0.00 H new ATOM 0 HA LYS A 148 6.274 4.482 -14.816 1.00 0.00 H new ATOM 0 HB2 LYS A 148 7.214 5.884 -12.977 1.00 0.00 H new ATOM 0 HB3 LYS A 148 8.630 4.853 -12.932 1.00 0.00 H new ATOM 0 HG2 LYS A 148 9.046 6.910 -14.227 1.00 0.00 H new ATOM 0 HG3 LYS A 148 9.222 5.479 -15.223 1.00 0.00 H new ATOM 0 HD2 LYS A 148 6.831 5.807 -15.999 1.00 0.00 H new ATOM 0 HD3 LYS A 148 6.799 7.319 -15.113 1.00 0.00 H new ATOM 0 HE2 LYS A 148 8.635 8.209 -16.467 1.00 0.00 H new ATOM 0 HE3 LYS A 148 8.828 6.669 -17.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 7.557 8.215 -18.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 6.586 6.894 -18.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 6.400 8.385 -17.386 1.00 0.00 H new ATOM 2347 N PRO A 149 7.309 2.407 -15.900 1.00 0.00 N ATOM 2348 CA PRO A 149 8.016 1.423 -16.710 1.00 0.00 C ATOM 2349 C PRO A 149 8.868 2.080 -17.794 1.00 0.00 C ATOM 2350 O PRO A 149 8.341 2.345 -18.899 1.00 0.00 O ATOM 2351 CB PRO A 149 6.889 0.583 -17.335 1.00 0.00 C ATOM 2352 CG PRO A 149 5.604 1.131 -16.787 1.00 0.00 C ATOM 2353 CD PRO A 149 5.906 2.520 -16.305 1.00 0.00 C ATOM 2354 OXT PRO A 149 10.058 2.344 -17.534 1.00 0.00 O ATOM 0 HA PRO A 149 8.714 0.832 -16.117 1.00 0.00 H new ATOM 0 HB2 PRO A 149 6.909 0.653 -18.423 1.00 0.00 H new ATOM 0 HB3 PRO A 149 7.002 -0.471 -17.081 1.00 0.00 H new ATOM 0 HG2 PRO A 149 4.830 1.146 -17.554 1.00 0.00 H new ATOM 0 HG3 PRO A 149 5.233 0.509 -15.972 1.00 0.00 H new ATOM 0 HD2 PRO A 149 5.767 3.263 -17.090 1.00 0.00 H new ATOM 0 HD3 PRO A 149 5.264 2.811 -15.474 1.00 0.00 H new TER 2362 PRO A 149