USER MOD reduce.3.24.130724 H: found=0, std=0, add=947, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 945 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 38 SER OG : rot 43:sc= 1.24 USER MOD Set 1.2: A 70 LYS NZ :NH3+ -161:sc= 0.131 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -137:sc= 0.0128 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0168 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -150:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -3.29 K(o=-3.3,f=-4.6!) USER MOD Single : A 14 ASN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 17 ASN : amide:sc= 0.00244 X(o=0.0024,f=0) USER MOD Single : A 19 THR OG1 : rot 166:sc= 0.407 USER MOD Single : A 25 LYS NZ :NH3+ 161:sc= -0.0474 (180deg=-0.376) USER MOD Single : A 26 SER OG : rot -51:sc=0.000164 USER MOD Single : A 27 SER OG : rot -80:sc= -1.08 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -1:sc= 0.647 USER MOD Single : A 40 SER OG : rot 180:sc=-0.00937 USER MOD Single : A 51 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 54 SER OG : rot -81:sc= 0.722 USER MOD Single : A 56 ASN : amide:sc= -0.41 K(o=-0.41,f=-1.1!) USER MOD Single : A 57 TYR OH : rot -37:sc= 0.357 USER MOD Single : A 61 LYS NZ :NH3+ 177:sc= 0.586 (180deg=0.532) USER MOD Single : A 62 THR OG1 : rot -42:sc= 0.187 USER MOD Single : A 64 ASN : amide:sc= -0.0656 X(o=-0.066,f=0) USER MOD Single : A 66 ASN : amide:sc= -5.14! C(o=-5.1!,f=-7.9!) USER MOD Single : A 72 ASN : amide:sc= -0.605 X(o=-0.61,f=-0.56) USER MOD Single : A 73 ASN : amide:sc= -0.149 K(o=-0.15,f=-1.6!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= -0.968 USER MOD Single : A 80 MET CE :methyl 147:sc= -0.114 (180deg=-1.17) USER MOD Single : A 83 LYS NZ :NH3+ 167:sc= -0.025 (180deg=-0.184) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -1.65 K(o=-1.6,f=-7.8!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 MET CE :methyl -144:sc= -10.5! (180deg=-14.7!) USER MOD Single : A 104 MET CE :methyl -148:sc= 0 (180deg=-1.54!) USER MOD Single : A 105 THR OG1 : rot -150:sc= -2.2! USER MOD Single : A 109 CYS SG : rot -140:sc= -0.314 USER MOD Single : A 111 MET CE :methyl -157:sc= -6.42! (180deg=-6.73!) USER MOD Single : A 113 LYS NZ :NH3+ -159:sc= -0.0525 (180deg=-0.346) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 20.863 6.671 4.800 1.00 0.00 N ATOM 2 CA GLY A 1 19.524 6.984 5.265 1.00 0.00 C ATOM 3 C GLY A 1 19.300 6.568 6.706 1.00 0.00 C ATOM 4 O GLY A 1 20.193 6.700 7.543 1.00 0.00 O ATOM 0 H1 GLY A 1 21.237 7.473 4.253 1.00 0.00 H new ATOM 0 H2 GLY A 1 21.481 6.491 5.617 1.00 0.00 H new ATOM 0 H3 GLY A 1 20.832 5.824 4.197 1.00 0.00 H new ATOM 0 HA2 GLY A 1 19.350 8.056 5.168 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.795 6.484 4.628 1.00 0.00 H new ATOM 8 N SER A 2 18.104 6.066 6.996 1.00 0.00 N ATOM 9 CA SER A 2 17.764 5.635 8.347 1.00 0.00 C ATOM 10 C SER A 2 17.729 6.823 9.304 1.00 0.00 C ATOM 11 O SER A 2 18.162 6.722 10.452 1.00 0.00 O ATOM 12 CB SER A 2 18.770 4.596 8.843 1.00 0.00 C ATOM 13 OG SER A 2 18.871 3.511 7.938 1.00 0.00 O ATOM 0 H SER A 2 17.355 5.948 6.314 1.00 0.00 H new ATOM 0 HA SER A 2 16.772 5.184 8.318 1.00 0.00 H new ATOM 0 HB2 SER A 2 19.747 5.062 8.967 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.465 4.229 9.823 1.00 0.00 H new ATOM 0 HG SER A 2 19.522 2.862 8.277 1.00 0.00 H new ATOM 19 N SER A 3 17.210 7.948 8.822 1.00 0.00 N ATOM 20 CA SER A 3 17.122 9.158 9.632 1.00 0.00 C ATOM 21 C SER A 3 16.477 8.861 10.982 1.00 0.00 C ATOM 22 O SER A 3 15.255 8.775 11.094 1.00 0.00 O ATOM 23 CB SER A 3 16.319 10.233 8.896 1.00 0.00 C ATOM 24 OG SER A 3 17.149 10.980 8.025 1.00 0.00 O ATOM 0 H SER A 3 16.844 8.047 7.875 1.00 0.00 H new ATOM 0 HA SER A 3 18.134 9.525 9.804 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.516 9.766 8.326 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.850 10.901 9.619 1.00 0.00 H new ATOM 0 HG SER A 3 16.613 11.659 7.565 1.00 0.00 H new ATOM 30 N GLY A 4 17.310 8.705 12.008 1.00 0.00 N ATOM 31 CA GLY A 4 16.804 8.420 13.338 1.00 0.00 C ATOM 32 C GLY A 4 15.952 7.167 13.378 1.00 0.00 C ATOM 33 O GLY A 4 14.966 7.101 14.110 1.00 0.00 O ATOM 0 H GLY A 4 18.326 8.771 11.941 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.642 8.308 14.026 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.215 9.267 13.689 1.00 0.00 H new ATOM 37 N SER A 5 16.332 6.169 12.585 1.00 0.00 N ATOM 38 CA SER A 5 15.593 4.914 12.529 1.00 0.00 C ATOM 39 C SER A 5 16.453 3.754 13.020 1.00 0.00 C ATOM 40 O SER A 5 17.682 3.812 12.967 1.00 0.00 O ATOM 41 CB SER A 5 15.119 4.641 11.100 1.00 0.00 C ATOM 42 OG SER A 5 13.999 5.446 10.772 1.00 0.00 O ATOM 0 H SER A 5 17.147 6.206 11.973 1.00 0.00 H new ATOM 0 HA SER A 5 14.725 5.003 13.183 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.931 4.839 10.400 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.857 3.588 10.995 1.00 0.00 H new ATOM 0 HG SER A 5 13.436 4.975 10.122 1.00 0.00 H new ATOM 48 N SER A 6 15.798 2.702 13.501 1.00 0.00 N ATOM 49 CA SER A 6 16.502 1.529 14.006 1.00 0.00 C ATOM 50 C SER A 6 16.780 0.535 12.883 1.00 0.00 C ATOM 51 O SER A 6 17.888 0.015 12.759 1.00 0.00 O ATOM 52 CB SER A 6 15.684 0.853 15.109 1.00 0.00 C ATOM 53 OG SER A 6 15.451 1.742 16.189 1.00 0.00 O ATOM 0 H SER A 6 14.781 2.638 13.552 1.00 0.00 H new ATOM 0 HA SER A 6 17.455 1.859 14.419 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.732 0.512 14.703 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.212 -0.030 15.468 1.00 0.00 H new ATOM 0 HG SER A 6 14.925 1.287 16.880 1.00 0.00 H new ATOM 59 N GLY A 7 15.764 0.277 12.065 1.00 0.00 N ATOM 60 CA GLY A 7 15.919 -0.654 10.962 1.00 0.00 C ATOM 61 C GLY A 7 15.333 -0.122 9.669 1.00 0.00 C ATOM 62 O GLY A 7 15.596 1.015 9.282 1.00 0.00 O ATOM 0 H GLY A 7 14.837 0.695 12.146 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.978 -0.868 10.817 1.00 0.00 H new ATOM 0 HA3 GLY A 7 15.435 -1.597 11.216 1.00 0.00 H new ATOM 66 N ASN A 8 14.537 -0.948 8.998 1.00 0.00 N ATOM 67 CA ASN A 8 13.913 -0.555 7.740 1.00 0.00 C ATOM 68 C ASN A 8 12.526 0.034 7.980 1.00 0.00 C ATOM 69 O ASN A 8 11.526 -0.481 7.479 1.00 0.00 O ATOM 70 CB ASN A 8 13.812 -1.757 6.799 1.00 0.00 C ATOM 71 CG ASN A 8 15.143 -2.105 6.161 1.00 0.00 C ATOM 72 OD1 ASN A 8 16.197 -1.975 6.785 1.00 0.00 O ATOM 73 ND2 ASN A 8 15.102 -2.549 4.910 1.00 0.00 N ATOM 0 H ASN A 8 14.309 -1.894 9.304 1.00 0.00 H new ATOM 0 HA ASN A 8 14.538 0.209 7.278 1.00 0.00 H new ATOM 0 HB2 ASN A 8 13.442 -2.619 7.354 1.00 0.00 H new ATOM 0 HB3 ASN A 8 13.083 -1.543 6.018 1.00 0.00 H new ATOM 0 HD21 ASN A 8 15.966 -2.798 4.429 1.00 0.00 H new ATOM 0 HD22 ASN A 8 14.206 -2.641 4.431 1.00 0.00 H new ATOM 80 N ASP A 9 12.474 1.115 8.750 1.00 0.00 N ATOM 81 CA ASP A 9 11.210 1.776 9.056 1.00 0.00 C ATOM 82 C ASP A 9 10.961 2.940 8.102 1.00 0.00 C ATOM 83 O ASP A 9 9.825 3.196 7.702 1.00 0.00 O ATOM 84 CB ASP A 9 11.208 2.275 10.501 1.00 0.00 C ATOM 85 CG ASP A 9 11.110 1.143 11.505 1.00 0.00 C ATOM 86 OD1 ASP A 9 10.184 0.316 11.376 1.00 0.00 O ATOM 87 OD2 ASP A 9 11.960 1.084 12.419 1.00 0.00 O ATOM 0 H ASP A 9 13.292 1.553 9.174 1.00 0.00 H new ATOM 0 HA ASP A 9 10.408 1.049 8.930 1.00 0.00 H new ATOM 0 HB2 ASP A 9 12.119 2.844 10.687 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.371 2.958 10.645 1.00 0.00 H new ATOM 92 N ASP A 10 12.029 3.643 7.743 1.00 0.00 N ATOM 93 CA ASP A 10 11.927 4.781 6.836 1.00 0.00 C ATOM 94 C ASP A 10 11.836 4.314 5.386 1.00 0.00 C ATOM 95 O ASP A 10 11.067 4.862 4.595 1.00 0.00 O ATOM 96 CB ASP A 10 13.129 5.710 7.011 1.00 0.00 C ATOM 97 CG ASP A 10 12.945 7.035 6.300 1.00 0.00 C ATOM 98 OD1 ASP A 10 11.815 7.567 6.320 1.00 0.00 O ATOM 99 OD2 ASP A 10 13.930 7.541 5.722 1.00 0.00 O ATOM 0 H ASP A 10 12.976 3.445 8.066 1.00 0.00 H new ATOM 0 HA ASP A 10 11.017 5.328 7.081 1.00 0.00 H new ATOM 0 HB2 ASP A 10 13.293 5.891 8.073 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.024 5.218 6.630 1.00 0.00 H new ATOM 104 N ILE A 11 12.625 3.300 5.046 1.00 0.00 N ATOM 105 CA ILE A 11 12.633 2.760 3.692 1.00 0.00 C ATOM 106 C ILE A 11 11.232 2.340 3.259 1.00 0.00 C ATOM 107 O ILE A 11 10.956 2.198 2.068 1.00 0.00 O ATOM 108 CB ILE A 11 13.578 1.550 3.574 1.00 0.00 C ATOM 109 CG1 ILE A 11 13.735 1.140 2.109 1.00 0.00 C ATOM 110 CG2 ILE A 11 13.056 0.388 4.404 1.00 0.00 C ATOM 111 CD1 ILE A 11 14.985 0.331 1.838 1.00 0.00 C ATOM 0 H ILE A 11 13.267 2.836 5.689 1.00 0.00 H new ATOM 0 HA ILE A 11 12.990 3.555 3.038 1.00 0.00 H new ATOM 0 HB ILE A 11 14.558 1.833 3.959 1.00 0.00 H new ATOM 0 HG12 ILE A 11 12.863 0.559 1.807 1.00 0.00 H new ATOM 0 HG13 ILE A 11 13.751 2.036 1.489 1.00 0.00 H new ATOM 0 HG21 ILE A 11 13.735 -0.460 4.310 1.00 0.00 H new ATOM 0 HG22 ILE A 11 12.992 0.688 5.450 1.00 0.00 H new ATOM 0 HG23 ILE A 11 12.067 0.102 4.047 1.00 0.00 H new ATOM 0 HD11 ILE A 11 15.031 0.075 0.779 1.00 0.00 H new ATOM 0 HD12 ILE A 11 15.863 0.917 2.108 1.00 0.00 H new ATOM 0 HD13 ILE A 11 14.963 -0.583 2.431 1.00 0.00 H new ATOM 123 N ILE A 12 10.351 2.146 4.235 1.00 0.00 N ATOM 124 CA ILE A 12 8.977 1.745 3.954 1.00 0.00 C ATOM 125 C ILE A 12 8.363 2.615 2.864 1.00 0.00 C ATOM 126 O ILE A 12 7.623 2.128 2.009 1.00 0.00 O ATOM 127 CB ILE A 12 8.099 1.827 5.217 1.00 0.00 C ATOM 128 CG1 ILE A 12 8.701 0.980 6.339 1.00 0.00 C ATOM 129 CG2 ILE A 12 6.681 1.371 4.905 1.00 0.00 C ATOM 130 CD1 ILE A 12 7.934 1.068 7.641 1.00 0.00 C ATOM 0 H ILE A 12 10.563 2.260 5.226 1.00 0.00 H new ATOM 0 HA ILE A 12 9.013 0.711 3.612 1.00 0.00 H new ATOM 0 HB ILE A 12 8.063 2.864 5.550 1.00 0.00 H new ATOM 0 HG12 ILE A 12 8.737 -0.061 6.018 1.00 0.00 H new ATOM 0 HG13 ILE A 12 9.730 1.297 6.511 1.00 0.00 H new ATOM 0 HG21 ILE A 12 6.072 1.434 5.807 1.00 0.00 H new ATOM 0 HG22 ILE A 12 6.254 2.012 4.133 1.00 0.00 H new ATOM 0 HG23 ILE A 12 6.700 0.340 4.551 1.00 0.00 H new ATOM 0 HD11 ILE A 12 8.418 0.442 8.391 1.00 0.00 H new ATOM 0 HD12 ILE A 12 7.919 2.102 7.986 1.00 0.00 H new ATOM 0 HD13 ILE A 12 6.912 0.723 7.485 1.00 0.00 H new ATOM 142 N VAL A 13 8.675 3.907 2.899 1.00 0.00 N ATOM 143 CA VAL A 13 8.156 4.846 1.912 1.00 0.00 C ATOM 144 C VAL A 13 8.975 4.801 0.627 1.00 0.00 C ATOM 145 O VAL A 13 8.429 4.644 -0.464 1.00 0.00 O ATOM 146 CB VAL A 13 8.153 6.287 2.455 1.00 0.00 C ATOM 147 CG1 VAL A 13 7.675 7.260 1.388 1.00 0.00 C ATOM 148 CG2 VAL A 13 7.288 6.384 3.703 1.00 0.00 C ATOM 0 H VAL A 13 9.285 4.327 3.601 1.00 0.00 H new ATOM 0 HA VAL A 13 7.131 4.544 1.697 1.00 0.00 H new ATOM 0 HB VAL A 13 9.174 6.556 2.726 1.00 0.00 H new ATOM 0 HG11 VAL A 13 7.680 8.273 1.791 1.00 0.00 H new ATOM 0 HG12 VAL A 13 8.339 7.209 0.525 1.00 0.00 H new ATOM 0 HG13 VAL A 13 6.663 6.996 1.082 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.297 7.409 4.073 1.00 0.00 H new ATOM 0 HG22 VAL A 13 6.265 6.095 3.460 1.00 0.00 H new ATOM 0 HG23 VAL A 13 7.681 5.717 4.471 1.00 0.00 H new ATOM 158 N ASN A 14 10.290 4.940 0.764 1.00 0.00 N ATOM 159 CA ASN A 14 11.185 4.916 -0.387 1.00 0.00 C ATOM 160 C ASN A 14 10.888 3.716 -1.281 1.00 0.00 C ATOM 161 O ASN A 14 10.924 3.819 -2.508 1.00 0.00 O ATOM 162 CB ASN A 14 12.643 4.872 0.075 1.00 0.00 C ATOM 163 CG ASN A 14 13.570 4.315 -0.987 1.00 0.00 C ATOM 164 OD1 ASN A 14 13.967 3.151 -0.932 1.00 0.00 O ATOM 165 ND2 ASN A 14 13.920 5.146 -1.962 1.00 0.00 N ATOM 0 H ASN A 14 10.759 5.070 1.660 1.00 0.00 H new ATOM 0 HA ASN A 14 11.020 5.827 -0.963 1.00 0.00 H new ATOM 0 HB2 ASN A 14 12.966 5.878 0.344 1.00 0.00 H new ATOM 0 HB3 ASN A 14 12.718 4.261 0.975 1.00 0.00 H new ATOM 0 HD21 ASN A 14 14.542 4.827 -2.705 1.00 0.00 H new ATOM 0 HD22 ASN A 14 13.567 6.103 -1.968 1.00 0.00 H new ATOM 172 N TRP A 15 10.595 2.579 -0.660 1.00 0.00 N ATOM 173 CA TRP A 15 10.290 1.360 -1.400 1.00 0.00 C ATOM 174 C TRP A 15 9.056 1.548 -2.275 1.00 0.00 C ATOM 175 O TRP A 15 9.096 1.307 -3.482 1.00 0.00 O ATOM 176 CB TRP A 15 10.073 0.193 -0.434 1.00 0.00 C ATOM 177 CG TRP A 15 10.185 -1.150 -1.090 1.00 0.00 C ATOM 178 CD1 TRP A 15 11.335 -1.800 -1.437 1.00 0.00 C ATOM 179 CD2 TRP A 15 9.105 -2.005 -1.480 1.00 0.00 C ATOM 180 NE1 TRP A 15 11.035 -3.007 -2.019 1.00 0.00 N ATOM 181 CE2 TRP A 15 9.673 -3.157 -2.056 1.00 0.00 C ATOM 182 CE3 TRP A 15 7.713 -1.910 -1.396 1.00 0.00 C ATOM 183 CZ2 TRP A 15 8.897 -4.205 -2.546 1.00 0.00 C ATOM 184 CZ3 TRP A 15 6.945 -2.950 -1.883 1.00 0.00 C ATOM 185 CH2 TRP A 15 7.538 -4.085 -2.451 1.00 0.00 C ATOM 0 H TRP A 15 10.562 2.476 0.354 1.00 0.00 H new ATOM 0 HA TRP A 15 11.139 1.135 -2.046 1.00 0.00 H new ATOM 0 HB2 TRP A 15 10.804 0.258 0.372 1.00 0.00 H new ATOM 0 HB3 TRP A 15 9.087 0.286 0.021 1.00 0.00 H new ATOM 0 HD1 TRP A 15 12.333 -1.421 -1.277 1.00 0.00 H new ATOM 0 HE1 TRP A 15 11.715 -3.682 -2.367 1.00 0.00 H new ATOM 0 HE3 TRP A 15 7.246 -1.040 -0.959 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 9.352 -5.081 -2.985 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 5.868 -2.887 -1.825 1.00 0.00 H new ATOM 0 HH2 TRP A 15 6.909 -4.881 -2.821 1.00 0.00 H new ATOM 196 N VAL A 16 7.959 1.978 -1.659 1.00 0.00 N ATOM 197 CA VAL A 16 6.713 2.200 -2.382 1.00 0.00 C ATOM 198 C VAL A 16 6.941 3.060 -3.621 1.00 0.00 C ATOM 199 O VAL A 16 6.631 2.650 -4.739 1.00 0.00 O ATOM 200 CB VAL A 16 5.657 2.877 -1.489 1.00 0.00 C ATOM 201 CG1 VAL A 16 4.357 3.072 -2.253 1.00 0.00 C ATOM 202 CG2 VAL A 16 5.427 2.062 -0.226 1.00 0.00 C ATOM 0 H VAL A 16 7.908 2.179 -0.660 1.00 0.00 H new ATOM 0 HA VAL A 16 6.346 1.220 -2.686 1.00 0.00 H new ATOM 0 HB VAL A 16 6.028 3.859 -1.197 1.00 0.00 H new ATOM 0 HG11 VAL A 16 3.623 3.552 -1.606 1.00 0.00 H new ATOM 0 HG12 VAL A 16 4.538 3.701 -3.125 1.00 0.00 H new ATOM 0 HG13 VAL A 16 3.977 2.103 -2.577 1.00 0.00 H new ATOM 0 HG21 VAL A 16 4.678 2.555 0.394 1.00 0.00 H new ATOM 0 HG22 VAL A 16 5.077 1.065 -0.495 1.00 0.00 H new ATOM 0 HG23 VAL A 16 6.361 1.981 0.330 1.00 0.00 H new ATOM 212 N ASN A 17 7.489 4.253 -3.413 1.00 0.00 N ATOM 213 CA ASN A 17 7.760 5.171 -4.513 1.00 0.00 C ATOM 214 C ASN A 17 8.363 4.431 -5.704 1.00 0.00 C ATOM 215 O ASN A 17 7.850 4.508 -6.820 1.00 0.00 O ATOM 216 CB ASN A 17 8.706 6.282 -4.056 1.00 0.00 C ATOM 217 CG ASN A 17 7.964 7.483 -3.503 1.00 0.00 C ATOM 218 OD1 ASN A 17 7.658 8.427 -4.231 1.00 0.00 O ATOM 219 ND2 ASN A 17 7.672 7.452 -2.208 1.00 0.00 N ATOM 0 H ASN A 17 7.754 4.606 -2.494 1.00 0.00 H new ATOM 0 HA ASN A 17 6.814 5.614 -4.825 1.00 0.00 H new ATOM 0 HB2 ASN A 17 9.379 5.891 -3.293 1.00 0.00 H new ATOM 0 HB3 ASN A 17 9.325 6.596 -4.896 1.00 0.00 H new ATOM 0 HD21 ASN A 17 7.174 8.232 -1.779 1.00 0.00 H new ATOM 0 HD22 ASN A 17 7.945 6.648 -1.643 1.00 0.00 H new ATOM 226 N GLU A 18 9.455 3.714 -5.457 1.00 0.00 N ATOM 227 CA GLU A 18 10.128 2.961 -6.508 1.00 0.00 C ATOM 228 C GLU A 18 9.189 1.927 -7.123 1.00 0.00 C ATOM 229 O GLU A 18 8.998 1.889 -8.339 1.00 0.00 O ATOM 230 CB GLU A 18 11.373 2.267 -5.952 1.00 0.00 C ATOM 231 CG GLU A 18 12.617 3.139 -5.977 1.00 0.00 C ATOM 232 CD GLU A 18 13.893 2.341 -5.787 1.00 0.00 C ATOM 233 OE1 GLU A 18 14.095 1.360 -6.534 1.00 0.00 O ATOM 234 OE2 GLU A 18 14.689 2.697 -4.894 1.00 0.00 O ATOM 0 H GLU A 18 9.892 3.639 -4.538 1.00 0.00 H new ATOM 0 HA GLU A 18 10.429 3.663 -7.286 1.00 0.00 H new ATOM 0 HB2 GLU A 18 11.178 1.956 -4.926 1.00 0.00 H new ATOM 0 HB3 GLU A 18 11.562 1.362 -6.529 1.00 0.00 H new ATOM 0 HG2 GLU A 18 12.664 3.671 -6.927 1.00 0.00 H new ATOM 0 HG3 GLU A 18 12.544 3.892 -5.193 1.00 0.00 H new ATOM 241 N THR A 19 8.603 1.088 -6.273 1.00 0.00 N ATOM 242 CA THR A 19 7.686 0.053 -6.732 1.00 0.00 C ATOM 243 C THR A 19 6.658 0.621 -7.704 1.00 0.00 C ATOM 244 O THR A 19 6.241 -0.054 -8.647 1.00 0.00 O ATOM 245 CB THR A 19 6.948 -0.607 -5.551 1.00 0.00 C ATOM 246 OG1 THR A 19 7.884 -1.290 -4.710 1.00 0.00 O ATOM 247 CG2 THR A 19 5.896 -1.587 -6.049 1.00 0.00 C ATOM 0 H THR A 19 8.748 1.106 -5.263 1.00 0.00 H new ATOM 0 HA THR A 19 8.288 -0.699 -7.242 1.00 0.00 H new ATOM 0 HB THR A 19 6.450 0.176 -4.979 1.00 0.00 H new ATOM 0 HG1 THR A 19 7.457 -1.510 -3.856 1.00 0.00 H new ATOM 0 HG21 THR A 19 5.389 -2.040 -5.197 1.00 0.00 H new ATOM 0 HG22 THR A 19 5.169 -1.058 -6.665 1.00 0.00 H new ATOM 0 HG23 THR A 19 6.376 -2.366 -6.642 1.00 0.00 H new ATOM 255 N LEU A 20 6.253 1.864 -7.471 1.00 0.00 N ATOM 256 CA LEU A 20 5.274 2.523 -8.328 1.00 0.00 C ATOM 257 C LEU A 20 5.943 3.114 -9.565 1.00 0.00 C ATOM 258 O LEU A 20 5.410 3.028 -10.672 1.00 0.00 O ATOM 259 CB LEU A 20 4.547 3.624 -7.552 1.00 0.00 C ATOM 260 CG LEU A 20 3.629 3.155 -6.423 1.00 0.00 C ATOM 261 CD1 LEU A 20 3.438 4.260 -5.396 1.00 0.00 C ATOM 262 CD2 LEU A 20 2.287 2.703 -6.980 1.00 0.00 C ATOM 0 H LEU A 20 6.587 2.436 -6.696 1.00 0.00 H new ATOM 0 HA LEU A 20 4.550 1.776 -8.652 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.293 4.297 -7.130 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.954 4.207 -8.257 1.00 0.00 H new ATOM 0 HG LEU A 20 4.099 2.305 -5.928 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.782 3.908 -4.600 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.404 4.536 -4.974 1.00 0.00 H new ATOM 0 HD13 LEU A 20 2.991 5.130 -5.877 1.00 0.00 H new ATOM 0 HD21 LEU A 20 1.646 2.373 -6.162 1.00 0.00 H new ATOM 0 HD22 LEU A 20 1.811 3.534 -7.501 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.441 1.879 -7.676 1.00 0.00 H new ATOM 274 N ARG A 21 7.114 3.712 -9.370 1.00 0.00 N ATOM 275 CA ARG A 21 7.856 4.315 -10.469 1.00 0.00 C ATOM 276 C ARG A 21 8.209 3.271 -11.526 1.00 0.00 C ATOM 277 O ARG A 21 7.927 3.454 -12.710 1.00 0.00 O ATOM 278 CB ARG A 21 9.132 4.980 -9.948 1.00 0.00 C ATOM 279 CG ARG A 21 9.901 5.742 -11.015 1.00 0.00 C ATOM 280 CD ARG A 21 10.855 6.753 -10.397 1.00 0.00 C ATOM 281 NE ARG A 21 10.173 7.986 -10.014 1.00 0.00 N ATOM 282 CZ ARG A 21 10.805 9.127 -9.764 1.00 0.00 C ATOM 283 NH1 ARG A 21 12.125 9.192 -9.856 1.00 0.00 N ATOM 284 NH2 ARG A 21 10.114 10.208 -9.421 1.00 0.00 N ATOM 0 H ARG A 21 7.569 3.791 -8.460 1.00 0.00 H new ATOM 0 HA ARG A 21 7.221 5.072 -10.929 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.871 5.665 -9.141 1.00 0.00 H new ATOM 0 HB3 ARG A 21 9.781 4.216 -9.520 1.00 0.00 H new ATOM 0 HG2 ARG A 21 10.462 5.040 -11.632 1.00 0.00 H new ATOM 0 HG3 ARG A 21 9.200 6.256 -11.673 1.00 0.00 H new ATOM 0 HD2 ARG A 21 11.330 6.314 -9.520 1.00 0.00 H new ATOM 0 HD3 ARG A 21 11.649 6.984 -11.107 1.00 0.00 H new ATOM 0 HE ARG A 21 9.156 7.970 -9.934 1.00 0.00 H new ATOM 0 HH11 ARG A 21 12.659 8.364 -10.120 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.607 10.070 -9.663 1.00 0.00 H new ATOM 0 HH21 ARG A 21 9.098 10.162 -9.349 1.00 0.00 H new ATOM 0 HH22 ARG A 21 10.600 11.084 -9.229 1.00 0.00 H new ATOM 298 N GLU A 22 8.825 2.178 -11.087 1.00 0.00 N ATOM 299 CA GLU A 22 9.217 1.107 -11.995 1.00 0.00 C ATOM 300 C GLU A 22 8.017 0.602 -12.791 1.00 0.00 C ATOM 301 O GLU A 22 8.149 0.200 -13.947 1.00 0.00 O ATOM 302 CB GLU A 22 9.847 -0.049 -11.214 1.00 0.00 C ATOM 303 CG GLU A 22 8.865 -0.784 -10.317 1.00 0.00 C ATOM 304 CD GLU A 22 9.435 -2.077 -9.768 1.00 0.00 C ATOM 305 OE1 GLU A 22 10.048 -2.834 -10.548 1.00 0.00 O ATOM 306 OE2 GLU A 22 9.266 -2.333 -8.556 1.00 0.00 O ATOM 0 H GLU A 22 9.063 2.011 -10.109 1.00 0.00 H new ATOM 0 HA GLU A 22 9.952 1.508 -12.693 1.00 0.00 H new ATOM 0 HB2 GLU A 22 10.283 -0.757 -11.918 1.00 0.00 H new ATOM 0 HB3 GLU A 22 10.664 0.338 -10.604 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.580 -0.136 -9.488 1.00 0.00 H new ATOM 0 HG3 GLU A 22 7.957 -1.001 -10.879 1.00 0.00 H new ATOM 313 N ALA A 23 6.845 0.628 -12.163 1.00 0.00 N ATOM 314 CA ALA A 23 5.621 0.175 -12.813 1.00 0.00 C ATOM 315 C ALA A 23 4.975 1.301 -13.612 1.00 0.00 C ATOM 316 O ALA A 23 4.060 1.068 -14.401 1.00 0.00 O ATOM 317 CB ALA A 23 4.646 -0.370 -11.780 1.00 0.00 C ATOM 0 H ALA A 23 6.718 0.958 -11.206 1.00 0.00 H new ATOM 0 HA ALA A 23 5.881 -0.624 -13.507 1.00 0.00 H new ATOM 0 HB1 ALA A 23 3.737 -0.705 -12.279 1.00 0.00 H new ATOM 0 HB2 ALA A 23 5.103 -1.210 -11.256 1.00 0.00 H new ATOM 0 HB3 ALA A 23 4.399 0.414 -11.064 1.00 0.00 H new ATOM 323 N GLU A 24 5.456 2.521 -13.401 1.00 0.00 N ATOM 324 CA GLU A 24 4.923 3.684 -14.102 1.00 0.00 C ATOM 325 C GLU A 24 3.538 4.049 -13.575 1.00 0.00 C ATOM 326 O GLU A 24 2.609 4.286 -14.347 1.00 0.00 O ATOM 327 CB GLU A 24 4.852 3.412 -15.606 1.00 0.00 C ATOM 328 CG GLU A 24 6.107 2.765 -16.168 1.00 0.00 C ATOM 329 CD GLU A 24 7.132 3.783 -16.628 1.00 0.00 C ATOM 330 OE1 GLU A 24 7.045 4.228 -17.791 1.00 0.00 O ATOM 331 OE2 GLU A 24 8.022 4.134 -15.826 1.00 0.00 O ATOM 0 H GLU A 24 6.213 2.731 -12.751 1.00 0.00 H new ATOM 0 HA GLU A 24 5.595 4.524 -13.923 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.998 2.766 -15.810 1.00 0.00 H new ATOM 0 HB3 GLU A 24 4.673 4.352 -16.128 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.553 2.124 -15.407 1.00 0.00 H new ATOM 0 HG3 GLU A 24 5.836 2.123 -17.006 1.00 0.00 H new ATOM 338 N LYS A 25 3.407 4.091 -12.254 1.00 0.00 N ATOM 339 CA LYS A 25 2.138 4.428 -11.620 1.00 0.00 C ATOM 340 C LYS A 25 2.025 5.932 -11.393 1.00 0.00 C ATOM 341 O LYS A 25 3.021 6.607 -11.130 1.00 0.00 O ATOM 342 CB LYS A 25 1.997 3.689 -10.287 1.00 0.00 C ATOM 343 CG LYS A 25 1.291 2.349 -10.407 1.00 0.00 C ATOM 344 CD LYS A 25 1.950 1.463 -11.450 1.00 0.00 C ATOM 345 CE LYS A 25 1.114 0.225 -11.739 1.00 0.00 C ATOM 346 NZ LYS A 25 -0.198 0.573 -12.351 1.00 0.00 N ATOM 0 H LYS A 25 4.165 3.896 -11.600 1.00 0.00 H new ATOM 0 HA LYS A 25 1.334 4.117 -12.288 1.00 0.00 H new ATOM 0 HB2 LYS A 25 2.988 3.531 -9.862 1.00 0.00 H new ATOM 0 HB3 LYS A 25 1.447 4.319 -9.588 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.300 1.844 -9.441 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.246 2.510 -10.673 1.00 0.00 H new ATOM 0 HD2 LYS A 25 2.095 2.029 -12.370 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.938 1.163 -11.102 1.00 0.00 H new ATOM 0 HE2 LYS A 25 1.664 -0.436 -12.409 1.00 0.00 H new ATOM 0 HE3 LYS A 25 0.948 -0.326 -10.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -0.595 -0.265 -12.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -0.852 0.896 -11.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.065 1.331 -13.050 1.00 0.00 H new ATOM 360 N SER A 26 0.806 6.451 -11.495 1.00 0.00 N ATOM 361 CA SER A 26 0.564 7.876 -11.303 1.00 0.00 C ATOM 362 C SER A 26 0.271 8.186 -9.838 1.00 0.00 C ATOM 363 O SER A 26 -0.149 9.292 -9.498 1.00 0.00 O ATOM 364 CB SER A 26 -0.605 8.339 -12.176 1.00 0.00 C ATOM 365 OG SER A 26 -0.489 9.713 -12.498 1.00 0.00 O ATOM 0 H SER A 26 -0.029 5.906 -11.709 1.00 0.00 H new ATOM 0 HA SER A 26 1.465 8.414 -11.597 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.635 7.749 -13.092 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.545 8.163 -11.653 1.00 0.00 H new ATOM 0 HG SER A 26 -0.341 10.230 -11.678 1.00 0.00 H new ATOM 371 N SER A 27 0.497 7.199 -8.975 1.00 0.00 N ATOM 372 CA SER A 27 0.255 7.364 -7.547 1.00 0.00 C ATOM 373 C SER A 27 1.567 7.568 -6.794 1.00 0.00 C ATOM 374 O SER A 27 2.650 7.374 -7.347 1.00 0.00 O ATOM 375 CB SER A 27 -0.481 6.145 -6.990 1.00 0.00 C ATOM 376 OG SER A 27 -1.244 6.488 -5.845 1.00 0.00 O ATOM 0 H SER A 27 0.847 6.278 -9.240 1.00 0.00 H new ATOM 0 HA SER A 27 -0.365 8.249 -7.408 1.00 0.00 H new ATOM 0 HB2 SER A 27 -1.136 5.730 -7.756 1.00 0.00 H new ATOM 0 HB3 SER A 27 0.239 5.368 -6.732 1.00 0.00 H new ATOM 0 HG SER A 27 -0.657 6.530 -5.061 1.00 0.00 H new ATOM 382 N SER A 28 1.461 7.959 -5.529 1.00 0.00 N ATOM 383 CA SER A 28 2.637 8.193 -4.699 1.00 0.00 C ATOM 384 C SER A 28 2.233 8.528 -3.266 1.00 0.00 C ATOM 385 O SER A 28 1.063 8.787 -2.983 1.00 0.00 O ATOM 386 CB SER A 28 3.480 9.329 -5.282 1.00 0.00 C ATOM 387 OG SER A 28 2.722 10.521 -5.398 1.00 0.00 O ATOM 0 H SER A 28 0.572 8.121 -5.056 1.00 0.00 H new ATOM 0 HA SER A 28 3.230 7.279 -4.686 1.00 0.00 H new ATOM 0 HB2 SER A 28 4.347 9.506 -4.645 1.00 0.00 H new ATOM 0 HB3 SER A 28 3.859 9.039 -6.262 1.00 0.00 H new ATOM 0 HG SER A 28 3.285 11.231 -5.771 1.00 0.00 H new ATOM 393 N ILE A 29 3.211 8.524 -2.367 1.00 0.00 N ATOM 394 CA ILE A 29 2.959 8.828 -0.963 1.00 0.00 C ATOM 395 C ILE A 29 4.097 9.649 -0.367 1.00 0.00 C ATOM 396 O ILE A 29 5.267 9.288 -0.489 1.00 0.00 O ATOM 397 CB ILE A 29 2.776 7.544 -0.133 1.00 0.00 C ATOM 398 CG1 ILE A 29 3.854 6.519 -0.494 1.00 0.00 C ATOM 399 CG2 ILE A 29 1.389 6.962 -0.355 1.00 0.00 C ATOM 400 CD1 ILE A 29 4.234 5.611 0.654 1.00 0.00 C ATOM 0 H ILE A 29 4.185 8.314 -2.585 1.00 0.00 H new ATOM 0 HA ILE A 29 2.037 9.408 -0.925 1.00 0.00 H new ATOM 0 HB ILE A 29 2.878 7.795 0.923 1.00 0.00 H new ATOM 0 HG12 ILE A 29 3.501 5.910 -1.326 1.00 0.00 H new ATOM 0 HG13 ILE A 29 4.743 7.046 -0.839 1.00 0.00 H new ATOM 0 HG21 ILE A 29 1.276 6.055 0.239 1.00 0.00 H new ATOM 0 HG22 ILE A 29 0.636 7.690 -0.053 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.259 6.723 -1.411 1.00 0.00 H new ATOM 0 HD11 ILE A 29 5.002 4.911 0.325 1.00 0.00 H new ATOM 0 HD12 ILE A 29 4.618 6.210 1.480 1.00 0.00 H new ATOM 0 HD13 ILE A 29 3.356 5.057 0.985 1.00 0.00 H new ATOM 412 N SER A 30 3.744 10.755 0.282 1.00 0.00 N ATOM 413 CA SER A 30 4.736 11.629 0.897 1.00 0.00 C ATOM 414 C SER A 30 5.207 11.061 2.233 1.00 0.00 C ATOM 415 O SER A 30 6.387 11.144 2.573 1.00 0.00 O ATOM 416 CB SER A 30 4.155 13.029 1.102 1.00 0.00 C ATOM 417 OG SER A 30 5.184 13.996 1.222 1.00 0.00 O ATOM 0 H SER A 30 2.779 11.066 0.395 1.00 0.00 H new ATOM 0 HA SER A 30 5.593 11.693 0.227 1.00 0.00 H new ATOM 0 HB2 SER A 30 3.508 13.284 0.263 1.00 0.00 H new ATOM 0 HB3 SER A 30 3.534 13.041 1.998 1.00 0.00 H new ATOM 0 HG SER A 30 4.786 14.882 1.351 1.00 0.00 H new ATOM 423 N SER A 31 4.275 10.484 2.985 1.00 0.00 N ATOM 424 CA SER A 31 4.592 9.905 4.285 1.00 0.00 C ATOM 425 C SER A 31 3.377 9.196 4.875 1.00 0.00 C ATOM 426 O SER A 31 2.257 9.351 4.389 1.00 0.00 O ATOM 427 CB SER A 31 5.079 10.993 5.245 1.00 0.00 C ATOM 428 OG SER A 31 5.902 10.444 6.261 1.00 0.00 O ATOM 0 H SER A 31 3.294 10.405 2.716 1.00 0.00 H new ATOM 0 HA SER A 31 5.386 9.171 4.145 1.00 0.00 H new ATOM 0 HB2 SER A 31 5.635 11.749 4.691 1.00 0.00 H new ATOM 0 HB3 SER A 31 4.223 11.494 5.697 1.00 0.00 H new ATOM 0 HG SER A 31 6.202 11.159 6.861 1.00 0.00 H new ATOM 434 N PHE A 32 3.608 8.418 5.927 1.00 0.00 N ATOM 435 CA PHE A 32 2.533 7.683 6.585 1.00 0.00 C ATOM 436 C PHE A 32 1.310 8.573 6.785 1.00 0.00 C ATOM 437 O PHE A 32 0.181 8.088 6.863 1.00 0.00 O ATOM 438 CB PHE A 32 3.009 7.139 7.932 1.00 0.00 C ATOM 439 CG PHE A 32 4.248 6.294 7.835 1.00 0.00 C ATOM 440 CD1 PHE A 32 4.445 5.453 6.752 1.00 0.00 C ATOM 441 CD2 PHE A 32 5.215 6.342 8.826 1.00 0.00 C ATOM 442 CE1 PHE A 32 5.583 4.675 6.660 1.00 0.00 C ATOM 443 CE2 PHE A 32 6.355 5.566 8.739 1.00 0.00 C ATOM 444 CZ PHE A 32 6.540 4.732 7.654 1.00 0.00 C ATOM 0 H PHE A 32 4.529 8.280 6.342 1.00 0.00 H new ATOM 0 HA PHE A 32 2.251 6.848 5.944 1.00 0.00 H new ATOM 0 HB2 PHE A 32 3.201 7.975 8.605 1.00 0.00 H new ATOM 0 HB3 PHE A 32 2.210 6.547 8.379 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.701 5.405 5.971 1.00 0.00 H new ATOM 0 HD2 PHE A 32 5.076 6.993 9.676 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.724 4.022 5.811 1.00 0.00 H new ATOM 0 HE2 PHE A 32 7.101 5.612 9.519 1.00 0.00 H new ATOM 0 HZ PHE A 32 7.431 4.126 7.583 1.00 0.00 H new ATOM 454 N LYS A 33 1.543 9.878 6.870 1.00 0.00 N ATOM 455 CA LYS A 33 0.462 10.837 7.062 1.00 0.00 C ATOM 456 C LYS A 33 0.107 11.526 5.748 1.00 0.00 C ATOM 457 O LYS A 33 -0.149 12.731 5.717 1.00 0.00 O ATOM 458 CB LYS A 33 0.859 11.883 8.107 1.00 0.00 C ATOM 459 CG LYS A 33 0.871 11.348 9.528 1.00 0.00 C ATOM 460 CD LYS A 33 1.075 12.462 10.542 1.00 0.00 C ATOM 461 CE LYS A 33 1.273 11.910 11.945 1.00 0.00 C ATOM 462 NZ LYS A 33 2.016 12.861 12.816 1.00 0.00 N ATOM 0 H LYS A 33 2.471 10.296 6.809 1.00 0.00 H new ATOM 0 HA LYS A 33 -0.414 10.293 7.416 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.849 12.269 7.865 1.00 0.00 H new ATOM 0 HB3 LYS A 33 0.167 12.723 8.050 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.069 10.836 9.733 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.666 10.609 9.633 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.942 13.059 10.259 1.00 0.00 H new ATOM 0 HD3 LYS A 33 0.212 13.128 10.530 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.302 11.693 12.390 1.00 0.00 H new ATOM 0 HE3 LYS A 33 1.817 10.967 11.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.130 12.447 13.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 2.953 13.049 12.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 1.485 13.752 12.889 1.00 0.00 H new ATOM 476 N ASP A 34 0.091 10.755 4.667 1.00 0.00 N ATOM 477 CA ASP A 34 -0.236 11.290 3.350 1.00 0.00 C ATOM 478 C ASP A 34 -1.741 11.257 3.108 1.00 0.00 C ATOM 479 O ASP A 34 -2.432 10.306 3.474 1.00 0.00 O ATOM 480 CB ASP A 34 0.487 10.498 2.259 1.00 0.00 C ATOM 481 CG ASP A 34 -0.090 10.752 0.880 1.00 0.00 C ATOM 482 OD1 ASP A 34 -1.221 10.292 0.617 1.00 0.00 O ATOM 483 OD2 ASP A 34 0.589 11.410 0.065 1.00 0.00 O ATOM 0 H ASP A 34 0.301 9.757 4.676 1.00 0.00 H new ATOM 0 HA ASP A 34 0.096 12.327 3.315 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.544 10.763 2.262 1.00 0.00 H new ATOM 0 HB3 ASP A 34 0.425 9.434 2.485 1.00 0.00 H new ATOM 488 N PRO A 35 -2.264 12.320 2.478 1.00 0.00 N ATOM 489 CA PRO A 35 -3.693 12.435 2.174 1.00 0.00 C ATOM 490 C PRO A 35 -4.137 11.454 1.095 1.00 0.00 C ATOM 491 O PRO A 35 -5.179 10.809 1.218 1.00 0.00 O ATOM 492 CB PRO A 35 -3.834 13.876 1.676 1.00 0.00 C ATOM 493 CG PRO A 35 -2.485 14.230 1.152 1.00 0.00 C ATOM 494 CD PRO A 35 -1.500 13.489 2.013 1.00 0.00 C ATOM 0 HA PRO A 35 -4.314 12.205 3.040 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -4.594 13.953 0.898 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -4.134 14.546 2.482 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -2.384 13.941 0.106 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -2.316 15.306 1.203 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -0.616 13.192 1.448 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -1.155 14.101 2.846 1.00 0.00 H new ATOM 502 N LYS A 36 -3.341 11.344 0.037 1.00 0.00 N ATOM 503 CA LYS A 36 -3.651 10.439 -1.064 1.00 0.00 C ATOM 504 C LYS A 36 -4.028 9.057 -0.542 1.00 0.00 C ATOM 505 O LYS A 36 -4.955 8.424 -1.050 1.00 0.00 O ATOM 506 CB LYS A 36 -2.455 10.330 -2.013 1.00 0.00 C ATOM 507 CG LYS A 36 -1.972 11.669 -2.542 1.00 0.00 C ATOM 508 CD LYS A 36 -2.967 12.274 -3.518 1.00 0.00 C ATOM 509 CE LYS A 36 -2.320 13.351 -4.377 1.00 0.00 C ATOM 510 NZ LYS A 36 -2.016 14.578 -3.591 1.00 0.00 N ATOM 0 H LYS A 36 -2.476 11.871 -0.082 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.503 10.846 -1.608 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.634 9.837 -1.493 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.727 9.693 -2.855 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.814 12.355 -1.710 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.009 11.540 -3.036 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -3.372 11.491 -4.159 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -3.805 12.701 -2.967 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.400 12.963 -4.815 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.984 13.604 -5.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.576 15.288 -4.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -2.897 14.963 -3.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.362 14.342 -2.818 1.00 0.00 H new ATOM 524 N ILE A 37 -3.307 8.596 0.474 1.00 0.00 N ATOM 525 CA ILE A 37 -3.569 7.290 1.065 1.00 0.00 C ATOM 526 C ILE A 37 -5.046 7.128 1.409 1.00 0.00 C ATOM 527 O ILE A 37 -5.584 6.022 1.378 1.00 0.00 O ATOM 528 CB ILE A 37 -2.730 7.069 2.337 1.00 0.00 C ATOM 529 CG1 ILE A 37 -1.237 7.129 2.006 1.00 0.00 C ATOM 530 CG2 ILE A 37 -3.082 5.735 2.979 1.00 0.00 C ATOM 531 CD1 ILE A 37 -0.343 6.897 3.203 1.00 0.00 C ATOM 0 H ILE A 37 -2.537 9.107 0.905 1.00 0.00 H new ATOM 0 HA ILE A 37 -3.288 6.545 0.320 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.958 7.864 3.047 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.012 6.382 1.244 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.008 8.103 1.575 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -2.481 5.593 3.877 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -4.139 5.727 3.245 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.879 4.928 2.275 1.00 0.00 H new ATOM 0 HD11 ILE A 37 0.701 6.954 2.894 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.540 7.659 3.957 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.544 5.911 3.622 1.00 0.00 H new ATOM 543 N SER A 38 -5.697 8.240 1.737 1.00 0.00 N ATOM 544 CA SER A 38 -7.112 8.223 2.089 1.00 0.00 C ATOM 545 C SER A 38 -7.923 7.471 1.039 1.00 0.00 C ATOM 546 O SER A 38 -8.877 6.761 1.364 1.00 0.00 O ATOM 547 CB SER A 38 -7.641 9.651 2.233 1.00 0.00 C ATOM 548 OG SER A 38 -8.962 9.657 2.746 1.00 0.00 O ATOM 0 H SER A 38 -5.267 9.164 1.766 1.00 0.00 H new ATOM 0 HA SER A 38 -7.218 7.707 3.043 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.988 10.219 2.896 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.622 10.149 1.263 1.00 0.00 H new ATOM 0 HG SER A 38 -9.033 9.006 3.475 1.00 0.00 H new ATOM 554 N THR A 39 -7.539 7.631 -0.224 1.00 0.00 N ATOM 555 CA THR A 39 -8.231 6.969 -1.322 1.00 0.00 C ATOM 556 C THR A 39 -7.667 5.574 -1.566 1.00 0.00 C ATOM 557 O THR A 39 -8.247 4.780 -2.308 1.00 0.00 O ATOM 558 CB THR A 39 -8.129 7.786 -2.624 1.00 0.00 C ATOM 559 OG1 THR A 39 -6.769 8.170 -2.856 1.00 0.00 O ATOM 560 CG2 THR A 39 -9.007 9.027 -2.554 1.00 0.00 C ATOM 0 H THR A 39 -6.752 8.213 -0.511 1.00 0.00 H new ATOM 0 HA THR A 39 -9.279 6.889 -1.033 1.00 0.00 H new ATOM 0 HB THR A 39 -8.475 7.161 -3.447 1.00 0.00 H new ATOM 0 HG1 THR A 39 -6.206 7.838 -2.126 1.00 0.00 H new ATOM 0 HG21 THR A 39 -8.919 9.588 -3.484 1.00 0.00 H new ATOM 0 HG22 THR A 39 -10.045 8.730 -2.406 1.00 0.00 H new ATOM 0 HG23 THR A 39 -8.687 9.653 -1.721 1.00 0.00 H new ATOM 568 N SER A 40 -6.533 5.281 -0.939 1.00 0.00 N ATOM 569 CA SER A 40 -5.889 3.982 -1.090 1.00 0.00 C ATOM 570 C SER A 40 -5.298 3.828 -2.489 1.00 0.00 C ATOM 571 O SER A 40 -5.183 2.717 -3.009 1.00 0.00 O ATOM 572 CB SER A 40 -6.891 2.857 -0.822 1.00 0.00 C ATOM 573 OG SER A 40 -7.698 3.152 0.306 1.00 0.00 O ATOM 0 H SER A 40 -6.041 5.926 -0.321 1.00 0.00 H new ATOM 0 HA SER A 40 -5.080 3.919 -0.363 1.00 0.00 H new ATOM 0 HB2 SER A 40 -7.523 2.712 -1.698 1.00 0.00 H new ATOM 0 HB3 SER A 40 -6.357 1.921 -0.657 1.00 0.00 H new ATOM 0 HG SER A 40 -8.331 2.419 0.456 1.00 0.00 H new ATOM 579 N LEU A 41 -4.925 4.951 -3.093 1.00 0.00 N ATOM 580 CA LEU A 41 -4.346 4.943 -4.431 1.00 0.00 C ATOM 581 C LEU A 41 -2.962 4.302 -4.422 1.00 0.00 C ATOM 582 O LEU A 41 -2.675 3.376 -5.183 1.00 0.00 O ATOM 583 CB LEU A 41 -4.256 6.369 -4.977 1.00 0.00 C ATOM 584 CG LEU A 41 -5.529 6.926 -5.614 1.00 0.00 C ATOM 585 CD1 LEU A 41 -5.383 8.416 -5.884 1.00 0.00 C ATOM 586 CD2 LEU A 41 -5.854 6.179 -6.899 1.00 0.00 C ATOM 0 H LEU A 41 -5.013 5.878 -2.677 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.995 4.353 -5.078 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -3.962 7.031 -4.162 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -3.458 6.403 -5.719 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.354 6.783 -4.916 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -6.299 8.795 -6.338 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -5.199 8.939 -4.946 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -4.546 8.583 -6.562 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -6.763 6.589 -7.338 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.029 6.290 -7.603 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.003 5.122 -6.678 1.00 0.00 H new ATOM 598 N PRO A 42 -2.083 4.800 -3.540 1.00 0.00 N ATOM 599 CA PRO A 42 -0.716 4.289 -3.410 1.00 0.00 C ATOM 600 C PRO A 42 -0.676 2.889 -2.805 1.00 0.00 C ATOM 601 O PRO A 42 0.255 2.122 -3.049 1.00 0.00 O ATOM 602 CB PRO A 42 -0.049 5.295 -2.469 1.00 0.00 C ATOM 603 CG PRO A 42 -1.171 5.878 -1.680 1.00 0.00 C ATOM 604 CD PRO A 42 -2.357 5.903 -2.603 1.00 0.00 C ATOM 0 HA PRO A 42 -0.222 4.196 -4.377 1.00 0.00 H new ATOM 0 HB2 PRO A 42 0.679 4.808 -1.821 1.00 0.00 H new ATOM 0 HB3 PRO A 42 0.485 6.065 -3.026 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -1.378 5.278 -0.794 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -0.925 6.882 -1.334 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -3.291 5.748 -2.062 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -2.443 6.858 -3.121 1.00 0.00 H new ATOM 612 N VAL A 43 -1.694 2.562 -2.014 1.00 0.00 N ATOM 613 CA VAL A 43 -1.776 1.253 -1.377 1.00 0.00 C ATOM 614 C VAL A 43 -2.280 0.196 -2.352 1.00 0.00 C ATOM 615 O VAL A 43 -1.870 -0.963 -2.295 1.00 0.00 O ATOM 616 CB VAL A 43 -2.704 1.286 -0.147 1.00 0.00 C ATOM 617 CG1 VAL A 43 -2.512 0.037 0.699 1.00 0.00 C ATOM 618 CG2 VAL A 43 -2.455 2.540 0.675 1.00 0.00 C ATOM 0 H VAL A 43 -2.472 3.185 -1.799 1.00 0.00 H new ATOM 0 HA VAL A 43 -0.767 0.993 -1.056 1.00 0.00 H new ATOM 0 HB VAL A 43 -3.737 1.306 -0.493 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.175 0.077 1.563 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -2.746 -0.845 0.103 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -1.477 -0.017 1.038 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -3.119 2.546 1.539 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -1.419 2.554 1.013 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.648 3.421 0.063 1.00 0.00 H new ATOM 628 N LEU A 44 -3.171 0.605 -3.249 1.00 0.00 N ATOM 629 CA LEU A 44 -3.732 -0.308 -4.241 1.00 0.00 C ATOM 630 C LEU A 44 -2.773 -0.496 -5.412 1.00 0.00 C ATOM 631 O LEU A 44 -2.464 -1.623 -5.799 1.00 0.00 O ATOM 632 CB LEU A 44 -5.076 0.221 -4.746 1.00 0.00 C ATOM 633 CG LEU A 44 -6.251 0.103 -3.776 1.00 0.00 C ATOM 634 CD1 LEU A 44 -7.353 1.083 -4.150 1.00 0.00 C ATOM 635 CD2 LEU A 44 -6.786 -1.322 -3.758 1.00 0.00 C ATOM 0 H LEU A 44 -3.520 1.561 -3.310 1.00 0.00 H new ATOM 0 HA LEU A 44 -3.886 -1.276 -3.763 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -4.954 1.271 -5.011 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -5.332 -0.311 -5.662 1.00 0.00 H new ATOM 0 HG LEU A 44 -5.897 0.350 -2.775 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.181 0.984 -3.448 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.964 2.100 -4.111 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.705 0.867 -5.159 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -7.622 -1.388 -3.062 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -7.123 -1.597 -4.757 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.996 -2.003 -3.442 1.00 0.00 H new ATOM 647 N ASP A 45 -2.304 0.615 -5.970 1.00 0.00 N ATOM 648 CA ASP A 45 -1.377 0.573 -7.094 1.00 0.00 C ATOM 649 C ASP A 45 -0.093 -0.158 -6.714 1.00 0.00 C ATOM 650 O ASP A 45 0.514 -0.841 -7.539 1.00 0.00 O ATOM 651 CB ASP A 45 -1.051 1.990 -7.568 1.00 0.00 C ATOM 652 CG ASP A 45 -2.059 2.511 -8.573 1.00 0.00 C ATOM 653 OD1 ASP A 45 -3.202 2.011 -8.580 1.00 0.00 O ATOM 654 OD2 ASP A 45 -1.703 3.418 -9.355 1.00 0.00 O ATOM 0 H ASP A 45 -2.551 1.555 -5.662 1.00 0.00 H new ATOM 0 HA ASP A 45 -1.856 0.028 -7.907 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -1.020 2.659 -6.708 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -0.057 2.000 -8.016 1.00 0.00 H new ATOM 659 N LEU A 46 0.316 -0.008 -5.459 1.00 0.00 N ATOM 660 CA LEU A 46 1.530 -0.653 -4.967 1.00 0.00 C ATOM 661 C LEU A 46 1.406 -2.171 -5.038 1.00 0.00 C ATOM 662 O LEU A 46 2.320 -2.858 -5.496 1.00 0.00 O ATOM 663 CB LEU A 46 1.815 -0.219 -3.529 1.00 0.00 C ATOM 664 CG LEU A 46 2.817 -1.076 -2.756 1.00 0.00 C ATOM 665 CD1 LEU A 46 4.086 -1.278 -3.570 1.00 0.00 C ATOM 666 CD2 LEU A 46 3.140 -0.437 -1.412 1.00 0.00 C ATOM 0 H LEU A 46 -0.174 0.554 -4.763 1.00 0.00 H new ATOM 0 HA LEU A 46 2.360 -0.345 -5.603 1.00 0.00 H new ATOM 0 HB2 LEU A 46 2.182 0.807 -3.546 1.00 0.00 H new ATOM 0 HB3 LEU A 46 0.874 -0.211 -2.980 1.00 0.00 H new ATOM 0 HG LEU A 46 2.367 -2.052 -2.574 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.788 -1.890 -3.004 1.00 0.00 H new ATOM 0 HD12 LEU A 46 3.841 -1.778 -4.507 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.539 -0.310 -3.783 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.855 -1.061 -0.875 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.570 0.552 -1.573 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.227 -0.344 -0.824 1.00 0.00 H new ATOM 678 N ILE A 47 0.270 -2.689 -4.584 1.00 0.00 N ATOM 679 CA ILE A 47 0.026 -4.126 -4.598 1.00 0.00 C ATOM 680 C ILE A 47 0.027 -4.669 -6.024 1.00 0.00 C ATOM 681 O ILE A 47 0.705 -5.653 -6.324 1.00 0.00 O ATOM 682 CB ILE A 47 -1.316 -4.477 -3.929 1.00 0.00 C ATOM 683 CG1 ILE A 47 -1.319 -4.013 -2.471 1.00 0.00 C ATOM 684 CG2 ILE A 47 -1.577 -5.972 -4.016 1.00 0.00 C ATOM 685 CD1 ILE A 47 -2.706 -3.882 -1.882 1.00 0.00 C ATOM 0 H ILE A 47 -0.496 -2.135 -4.202 1.00 0.00 H new ATOM 0 HA ILE A 47 0.835 -4.589 -4.033 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.116 -3.959 -4.458 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -0.744 -4.719 -1.872 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -0.812 -3.051 -2.403 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -2.529 -6.204 -3.539 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -1.613 -6.275 -5.062 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.777 -6.511 -3.509 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -2.632 -3.549 -0.847 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.278 -3.154 -2.457 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.209 -4.848 -1.917 1.00 0.00 H new ATOM 697 N ASP A 48 -0.734 -4.021 -6.898 1.00 0.00 N ATOM 698 CA ASP A 48 -0.819 -4.436 -8.294 1.00 0.00 C ATOM 699 C ASP A 48 0.564 -4.476 -8.934 1.00 0.00 C ATOM 700 O ASP A 48 0.910 -5.431 -9.630 1.00 0.00 O ATOM 701 CB ASP A 48 -1.729 -3.488 -9.076 1.00 0.00 C ATOM 702 CG ASP A 48 -1.556 -3.625 -10.576 1.00 0.00 C ATOM 703 OD1 ASP A 48 -1.857 -4.712 -11.111 1.00 0.00 O ATOM 704 OD2 ASP A 48 -1.120 -2.645 -11.214 1.00 0.00 O ATOM 0 H ASP A 48 -1.301 -3.206 -6.665 1.00 0.00 H new ATOM 0 HA ASP A 48 -1.242 -5.440 -8.323 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.768 -3.687 -8.813 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.517 -2.460 -8.781 1.00 0.00 H new ATOM 709 N ALA A 49 1.353 -3.433 -8.695 1.00 0.00 N ATOM 710 CA ALA A 49 2.699 -3.350 -9.247 1.00 0.00 C ATOM 711 C ALA A 49 3.408 -4.697 -9.172 1.00 0.00 C ATOM 712 O ALA A 49 4.098 -5.100 -10.109 1.00 0.00 O ATOM 713 CB ALA A 49 3.504 -2.285 -8.516 1.00 0.00 C ATOM 0 H ALA A 49 1.082 -2.634 -8.122 1.00 0.00 H new ATOM 0 HA ALA A 49 2.618 -3.071 -10.298 1.00 0.00 H new ATOM 0 HB1 ALA A 49 4.507 -2.234 -8.938 1.00 0.00 H new ATOM 0 HB2 ALA A 49 3.013 -1.318 -8.627 1.00 0.00 H new ATOM 0 HB3 ALA A 49 3.568 -2.540 -7.458 1.00 0.00 H new ATOM 719 N ILE A 50 3.233 -5.390 -8.051 1.00 0.00 N ATOM 720 CA ILE A 50 3.857 -6.693 -7.854 1.00 0.00 C ATOM 721 C ILE A 50 3.093 -7.785 -8.594 1.00 0.00 C ATOM 722 O ILE A 50 3.651 -8.478 -9.447 1.00 0.00 O ATOM 723 CB ILE A 50 3.935 -7.060 -6.361 1.00 0.00 C ATOM 724 CG1 ILE A 50 4.552 -5.909 -5.562 1.00 0.00 C ATOM 725 CG2 ILE A 50 4.741 -8.336 -6.170 1.00 0.00 C ATOM 726 CD1 ILE A 50 4.363 -6.040 -4.067 1.00 0.00 C ATOM 0 H ILE A 50 2.665 -5.071 -7.266 1.00 0.00 H new ATOM 0 HA ILE A 50 4.868 -6.623 -8.256 1.00 0.00 H new ATOM 0 HB ILE A 50 2.924 -7.234 -5.992 1.00 0.00 H new ATOM 0 HG12 ILE A 50 5.618 -5.856 -5.782 1.00 0.00 H new ATOM 0 HG13 ILE A 50 4.111 -4.969 -5.895 1.00 0.00 H new ATOM 0 HG21 ILE A 50 4.787 -8.582 -5.109 1.00 0.00 H new ATOM 0 HG22 ILE A 50 4.263 -9.153 -6.712 1.00 0.00 H new ATOM 0 HG23 ILE A 50 5.751 -8.189 -6.552 1.00 0.00 H new ATOM 0 HD11 ILE A 50 4.826 -5.190 -3.566 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.298 -6.062 -3.835 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.829 -6.963 -3.721 1.00 0.00 H new ATOM 738 N GLN A 51 1.813 -7.933 -8.264 1.00 0.00 N ATOM 739 CA GLN A 51 0.973 -8.940 -8.900 1.00 0.00 C ATOM 740 C GLN A 51 -0.068 -8.290 -9.805 1.00 0.00 C ATOM 741 O GLN A 51 -1.123 -7.841 -9.356 1.00 0.00 O ATOM 742 CB GLN A 51 0.280 -9.798 -7.840 1.00 0.00 C ATOM 743 CG GLN A 51 -0.505 -10.965 -8.419 1.00 0.00 C ATOM 744 CD GLN A 51 0.378 -12.148 -8.763 1.00 0.00 C ATOM 745 OE1 GLN A 51 1.102 -12.129 -9.758 1.00 0.00 O ATOM 746 NE2 GLN A 51 0.322 -13.188 -7.937 1.00 0.00 N ATOM 0 H GLN A 51 1.336 -7.369 -7.561 1.00 0.00 H new ATOM 0 HA GLN A 51 1.612 -9.576 -9.512 1.00 0.00 H new ATOM 0 HB2 GLN A 51 1.030 -10.183 -7.149 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -0.395 -9.169 -7.260 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.264 -11.279 -7.702 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.030 -10.636 -9.315 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -0.293 -13.161 -7.124 1.00 0.00 H new ATOM 0 HE22 GLN A 51 0.894 -14.013 -8.117 1.00 0.00 H new ATOM 755 N PRO A 52 0.235 -8.235 -11.111 1.00 0.00 N ATOM 756 CA PRO A 52 -0.662 -7.640 -12.107 1.00 0.00 C ATOM 757 C PRO A 52 -1.915 -8.479 -12.332 1.00 0.00 C ATOM 758 O PRO A 52 -1.832 -9.653 -12.690 1.00 0.00 O ATOM 759 CB PRO A 52 0.193 -7.604 -13.376 1.00 0.00 C ATOM 760 CG PRO A 52 1.192 -8.692 -13.192 1.00 0.00 C ATOM 761 CD PRO A 52 1.475 -8.750 -11.716 1.00 0.00 C ATOM 0 HA PRO A 52 -1.028 -6.662 -11.795 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -0.413 -7.770 -14.266 1.00 0.00 H new ATOM 0 HB3 PRO A 52 0.680 -6.636 -13.498 1.00 0.00 H new ATOM 0 HG2 PRO A 52 0.803 -9.644 -13.552 1.00 0.00 H new ATOM 0 HG3 PRO A 52 2.102 -8.486 -13.756 1.00 0.00 H new ATOM 0 HD2 PRO A 52 1.690 -9.767 -11.388 1.00 0.00 H new ATOM 0 HD3 PRO A 52 2.337 -8.139 -11.448 1.00 0.00 H new ATOM 769 N GLY A 53 -3.077 -7.868 -12.120 1.00 0.00 N ATOM 770 CA GLY A 53 -4.331 -8.574 -12.305 1.00 0.00 C ATOM 771 C GLY A 53 -5.207 -8.535 -11.068 1.00 0.00 C ATOM 772 O GLY A 53 -6.433 -8.582 -11.165 1.00 0.00 O ATOM 0 H GLY A 53 -3.172 -6.897 -11.823 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -4.872 -8.134 -13.143 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -4.125 -9.612 -12.568 1.00 0.00 H new ATOM 776 N SER A 54 -4.576 -8.451 -9.901 1.00 0.00 N ATOM 777 CA SER A 54 -5.306 -8.412 -8.639 1.00 0.00 C ATOM 778 C SER A 54 -6.234 -7.203 -8.585 1.00 0.00 C ATOM 779 O SER A 54 -7.455 -7.347 -8.509 1.00 0.00 O ATOM 780 CB SER A 54 -4.329 -8.372 -7.462 1.00 0.00 C ATOM 781 OG SER A 54 -3.385 -7.326 -7.617 1.00 0.00 O ATOM 0 H SER A 54 -3.562 -8.409 -9.803 1.00 0.00 H new ATOM 0 HA SER A 54 -5.911 -9.316 -8.570 1.00 0.00 H new ATOM 0 HB2 SER A 54 -4.881 -8.233 -6.532 1.00 0.00 H new ATOM 0 HB3 SER A 54 -3.809 -9.327 -7.385 1.00 0.00 H new ATOM 0 HG SER A 54 -2.671 -7.617 -8.222 1.00 0.00 H new ATOM 787 N ILE A 55 -5.647 -6.012 -8.627 1.00 0.00 N ATOM 788 CA ILE A 55 -6.421 -4.777 -8.585 1.00 0.00 C ATOM 789 C ILE A 55 -7.035 -4.466 -9.945 1.00 0.00 C ATOM 790 O ILE A 55 -6.473 -4.809 -10.985 1.00 0.00 O ATOM 791 CB ILE A 55 -5.553 -3.584 -8.142 1.00 0.00 C ATOM 792 CG1 ILE A 55 -4.812 -3.917 -6.845 1.00 0.00 C ATOM 793 CG2 ILE A 55 -6.412 -2.341 -7.964 1.00 0.00 C ATOM 794 CD1 ILE A 55 -5.733 -4.202 -5.679 1.00 0.00 C ATOM 0 H ILE A 55 -4.638 -5.876 -8.690 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.217 -4.928 -7.856 1.00 0.00 H new ATOM 0 HB ILE A 55 -4.815 -3.383 -8.918 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -4.173 -4.784 -7.013 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -4.158 -3.085 -6.586 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.784 -1.507 -7.651 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -6.897 -2.096 -8.909 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -7.171 -2.529 -7.205 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -5.139 -4.430 -4.794 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -6.354 -3.328 -5.484 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.370 -5.054 -5.918 1.00 0.00 H new ATOM 806 N ASN A 56 -8.193 -3.814 -9.929 1.00 0.00 N ATOM 807 CA ASN A 56 -8.886 -3.455 -11.163 1.00 0.00 C ATOM 808 C ASN A 56 -9.550 -2.089 -11.035 1.00 0.00 C ATOM 809 O ASN A 56 -10.569 -1.942 -10.359 1.00 0.00 O ATOM 810 CB ASN A 56 -9.933 -4.515 -11.510 1.00 0.00 C ATOM 811 CG ASN A 56 -10.282 -4.521 -12.986 1.00 0.00 C ATOM 812 OD1 ASN A 56 -9.426 -4.289 -13.839 1.00 0.00 O ATOM 813 ND2 ASN A 56 -11.547 -4.786 -13.293 1.00 0.00 N ATOM 0 H ASN A 56 -8.672 -3.523 -9.076 1.00 0.00 H new ATOM 0 HA ASN A 56 -8.149 -3.406 -11.965 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -9.559 -5.498 -11.224 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.836 -4.335 -10.927 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -11.842 -4.803 -14.269 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -12.223 -4.973 -12.552 1.00 0.00 H new ATOM 820 N TYR A 57 -8.968 -1.091 -11.691 1.00 0.00 N ATOM 821 CA TYR A 57 -9.503 0.266 -11.650 1.00 0.00 C ATOM 822 C TYR A 57 -10.991 0.274 -11.985 1.00 0.00 C ATOM 823 O TYR A 57 -11.770 1.011 -11.381 1.00 0.00 O ATOM 824 CB TYR A 57 -8.742 1.165 -12.627 1.00 0.00 C ATOM 825 CG TYR A 57 -7.541 1.846 -12.014 1.00 0.00 C ATOM 826 CD1 TYR A 57 -6.683 1.156 -11.166 1.00 0.00 C ATOM 827 CD2 TYR A 57 -7.263 3.181 -12.278 1.00 0.00 C ATOM 828 CE1 TYR A 57 -5.584 1.774 -10.602 1.00 0.00 C ATOM 829 CE2 TYR A 57 -6.166 3.808 -11.721 1.00 0.00 C ATOM 830 CZ TYR A 57 -5.330 3.100 -10.883 1.00 0.00 C ATOM 831 OH TYR A 57 -4.236 3.721 -10.324 1.00 0.00 O ATOM 0 H TYR A 57 -8.126 -1.196 -12.257 1.00 0.00 H new ATOM 0 HA TYR A 57 -9.376 0.651 -10.638 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -8.415 0.567 -13.478 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -9.422 1.925 -13.013 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -6.879 0.117 -10.944 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -7.917 3.739 -12.931 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -4.928 1.222 -9.945 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -5.964 4.846 -11.940 1.00 0.00 H new ATOM 0 HH TYR A 57 -4.106 3.394 -9.409 1.00 0.00 H new ATOM 841 N ASP A 58 -11.378 -0.550 -12.953 1.00 0.00 N ATOM 842 CA ASP A 58 -12.773 -0.640 -13.368 1.00 0.00 C ATOM 843 C ASP A 58 -13.695 -0.733 -12.157 1.00 0.00 C ATOM 844 O ASP A 58 -14.769 -0.129 -12.133 1.00 0.00 O ATOM 845 CB ASP A 58 -12.979 -1.852 -14.278 1.00 0.00 C ATOM 846 CG ASP A 58 -14.093 -1.638 -15.283 1.00 0.00 C ATOM 847 OD1 ASP A 58 -15.072 -0.939 -14.946 1.00 0.00 O ATOM 848 OD2 ASP A 58 -13.988 -2.170 -16.408 1.00 0.00 O ATOM 0 H ASP A 58 -10.745 -1.165 -13.465 1.00 0.00 H new ATOM 0 HA ASP A 58 -13.022 0.266 -13.921 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -12.051 -2.066 -14.808 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -13.207 -2.726 -13.668 1.00 0.00 H new ATOM 853 N LEU A 59 -13.272 -1.494 -11.155 1.00 0.00 N ATOM 854 CA LEU A 59 -14.061 -1.668 -9.940 1.00 0.00 C ATOM 855 C LEU A 59 -13.796 -0.536 -8.952 1.00 0.00 C ATOM 856 O LEU A 59 -14.702 -0.087 -8.249 1.00 0.00 O ATOM 857 CB LEU A 59 -13.740 -3.014 -9.288 1.00 0.00 C ATOM 858 CG LEU A 59 -13.691 -4.219 -10.227 1.00 0.00 C ATOM 859 CD1 LEU A 59 -13.294 -5.473 -9.465 1.00 0.00 C ATOM 860 CD2 LEU A 59 -15.034 -4.414 -10.916 1.00 0.00 C ATOM 0 H LEU A 59 -12.387 -2.001 -11.159 1.00 0.00 H new ATOM 0 HA LEU A 59 -15.116 -1.647 -10.215 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -12.776 -2.931 -8.785 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -14.486 -3.209 -8.518 1.00 0.00 H new ATOM 0 HG LEU A 59 -12.938 -4.029 -10.991 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -13.264 -6.321 -10.150 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -12.309 -5.332 -9.020 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -14.023 -5.667 -8.679 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -14.980 -5.276 -11.581 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -15.807 -4.582 -10.166 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -15.278 -3.524 -11.496 1.00 0.00 H new ATOM 872 N LEU A 60 -12.550 -0.077 -8.905 1.00 0.00 N ATOM 873 CA LEU A 60 -12.166 1.004 -8.005 1.00 0.00 C ATOM 874 C LEU A 60 -12.935 2.281 -8.329 1.00 0.00 C ATOM 875 O LEU A 60 -13.509 2.417 -9.410 1.00 0.00 O ATOM 876 CB LEU A 60 -10.661 1.264 -8.102 1.00 0.00 C ATOM 877 CG LEU A 60 -9.755 0.058 -7.852 1.00 0.00 C ATOM 878 CD1 LEU A 60 -8.303 0.413 -8.136 1.00 0.00 C ATOM 879 CD2 LEU A 60 -9.914 -0.442 -6.424 1.00 0.00 C ATOM 0 H LEU A 60 -11.788 -0.437 -9.480 1.00 0.00 H new ATOM 0 HA LEU A 60 -12.412 0.701 -6.987 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.444 1.657 -9.095 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -10.400 2.044 -7.386 1.00 0.00 H new ATOM 0 HG LEU A 60 -10.052 -0.742 -8.531 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -7.673 -0.457 -7.953 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -8.201 0.722 -9.176 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -7.993 1.229 -7.483 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -9.262 -1.301 -6.264 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -9.645 0.353 -5.728 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -10.950 -0.737 -6.255 1.00 0.00 H new ATOM 891 N LYS A 61 -12.941 3.217 -7.386 1.00 0.00 N ATOM 892 CA LYS A 61 -13.637 4.485 -7.571 1.00 0.00 C ATOM 893 C LYS A 61 -12.651 5.606 -7.884 1.00 0.00 C ATOM 894 O LYS A 61 -12.734 6.246 -8.933 1.00 0.00 O ATOM 895 CB LYS A 61 -14.442 4.836 -6.318 1.00 0.00 C ATOM 896 CG LYS A 61 -15.826 4.209 -6.288 1.00 0.00 C ATOM 897 CD LYS A 61 -15.783 2.792 -5.741 1.00 0.00 C ATOM 898 CE LYS A 61 -16.959 1.966 -6.243 1.00 0.00 C ATOM 899 NZ LYS A 61 -16.877 1.719 -7.709 1.00 0.00 N ATOM 0 H LYS A 61 -12.472 3.121 -6.486 1.00 0.00 H new ATOM 0 HA LYS A 61 -14.318 4.377 -8.415 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -13.887 4.513 -5.437 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -14.542 5.919 -6.252 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -16.489 4.818 -5.673 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -16.244 4.199 -7.295 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -14.849 2.315 -6.037 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -15.795 2.821 -4.651 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -16.985 1.013 -5.715 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -17.891 2.483 -6.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -17.668 1.111 -8.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -16.929 2.625 -8.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -15.977 1.248 -7.932 1.00 0.00 H new ATOM 913 N THR A 62 -11.714 5.838 -6.969 1.00 0.00 N ATOM 914 CA THR A 62 -10.712 6.880 -7.148 1.00 0.00 C ATOM 915 C THR A 62 -11.338 8.156 -7.700 1.00 0.00 C ATOM 916 O THR A 62 -10.667 8.953 -8.355 1.00 0.00 O ATOM 917 CB THR A 62 -9.588 6.422 -8.095 1.00 0.00 C ATOM 918 OG1 THR A 62 -8.606 7.456 -8.226 1.00 0.00 O ATOM 919 CG2 THR A 62 -10.144 6.067 -9.465 1.00 0.00 C ATOM 0 H THR A 62 -11.629 5.317 -6.096 1.00 0.00 H new ATOM 0 HA THR A 62 -10.288 7.083 -6.165 1.00 0.00 H new ATOM 0 HB THR A 62 -9.124 5.533 -7.668 1.00 0.00 H new ATOM 0 HG1 THR A 62 -9.054 8.323 -8.315 1.00 0.00 H new ATOM 0 HG21 THR A 62 -9.331 5.746 -10.116 1.00 0.00 H new ATOM 0 HG22 THR A 62 -10.869 5.259 -9.365 1.00 0.00 H new ATOM 0 HG23 THR A 62 -10.632 6.941 -9.897 1.00 0.00 H new ATOM 927 N GLU A 63 -12.627 8.342 -7.432 1.00 0.00 N ATOM 928 CA GLU A 63 -13.342 9.522 -7.905 1.00 0.00 C ATOM 929 C GLU A 63 -14.220 10.103 -6.801 1.00 0.00 C ATOM 930 O GLU A 63 -15.148 9.451 -6.323 1.00 0.00 O ATOM 931 CB GLU A 63 -14.199 9.172 -9.123 1.00 0.00 C ATOM 932 CG GLU A 63 -15.307 8.176 -8.823 1.00 0.00 C ATOM 933 CD GLU A 63 -15.824 7.485 -10.070 1.00 0.00 C ATOM 934 OE1 GLU A 63 -15.012 6.856 -10.781 1.00 0.00 O ATOM 935 OE2 GLU A 63 -17.041 7.573 -10.335 1.00 0.00 O ATOM 0 H GLU A 63 -13.197 7.692 -6.891 1.00 0.00 H new ATOM 0 HA GLU A 63 -12.605 10.272 -8.192 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -14.641 10.086 -9.520 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -13.557 8.764 -9.903 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -14.937 7.426 -8.124 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -16.131 8.692 -8.330 1.00 0.00 H new ATOM 942 N ASN A 64 -13.922 11.335 -6.402 1.00 0.00 N ATOM 943 CA ASN A 64 -14.683 12.005 -5.354 1.00 0.00 C ATOM 944 C ASN A 64 -15.156 11.005 -4.303 1.00 0.00 C ATOM 945 O ASN A 64 -16.319 11.021 -3.894 1.00 0.00 O ATOM 946 CB ASN A 64 -15.884 12.737 -5.956 1.00 0.00 C ATOM 947 CG ASN A 64 -15.544 13.430 -7.261 1.00 0.00 C ATOM 948 OD1 ASN A 64 -15.172 14.602 -7.275 1.00 0.00 O ATOM 949 ND2 ASN A 64 -15.670 12.703 -8.366 1.00 0.00 N ATOM 0 H ASN A 64 -13.159 11.890 -6.789 1.00 0.00 H new ATOM 0 HA ASN A 64 -14.029 12.731 -4.871 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -16.692 12.025 -6.125 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -16.252 13.474 -5.242 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -15.455 13.114 -9.274 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -15.982 11.734 -8.306 1.00 0.00 H new ATOM 956 N LEU A 65 -14.249 10.137 -3.867 1.00 0.00 N ATOM 957 CA LEU A 65 -14.574 9.131 -2.863 1.00 0.00 C ATOM 958 C LEU A 65 -15.142 9.779 -1.606 1.00 0.00 C ATOM 959 O LEU A 65 -15.076 10.997 -1.438 1.00 0.00 O ATOM 960 CB LEU A 65 -13.330 8.313 -2.512 1.00 0.00 C ATOM 961 CG LEU A 65 -12.802 7.389 -3.609 1.00 0.00 C ATOM 962 CD1 LEU A 65 -11.298 7.206 -3.475 1.00 0.00 C ATOM 963 CD2 LEU A 65 -13.511 6.043 -3.559 1.00 0.00 C ATOM 0 H LEU A 65 -13.283 10.110 -4.193 1.00 0.00 H new ATOM 0 HA LEU A 65 -15.332 8.468 -3.281 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.534 9.003 -2.231 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.553 7.709 -1.633 1.00 0.00 H new ATOM 0 HG LEU A 65 -13.007 7.850 -4.575 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.940 6.545 -4.264 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -10.805 8.174 -3.561 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.070 6.767 -2.504 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -13.123 5.398 -4.347 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -13.338 5.576 -2.589 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -14.581 6.190 -3.705 1.00 0.00 H new ATOM 975 N ASN A 66 -15.699 8.958 -0.721 1.00 0.00 N ATOM 976 CA ASN A 66 -16.278 9.452 0.522 1.00 0.00 C ATOM 977 C ASN A 66 -16.245 8.375 1.603 1.00 0.00 C ATOM 978 O ASN A 66 -15.806 7.251 1.360 1.00 0.00 O ATOM 979 CB ASN A 66 -17.718 9.915 0.292 1.00 0.00 C ATOM 980 CG ASN A 66 -18.699 8.759 0.274 1.00 0.00 C ATOM 981 OD1 ASN A 66 -19.467 8.567 1.218 1.00 0.00 O ATOM 982 ND2 ASN A 66 -18.681 7.983 -0.804 1.00 0.00 N ATOM 0 H ASN A 66 -15.761 7.947 -0.842 1.00 0.00 H new ATOM 0 HA ASN A 66 -15.681 10.300 0.859 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -18.001 10.617 1.077 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -17.777 10.454 -0.654 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -19.320 7.191 -0.873 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -18.028 8.179 -1.563 1.00 0.00 H new ATOM 989 N ASP A 67 -16.713 8.727 2.795 1.00 0.00 N ATOM 990 CA ASP A 67 -16.739 7.790 3.913 1.00 0.00 C ATOM 991 C ASP A 67 -17.268 6.430 3.470 1.00 0.00 C ATOM 992 O ASP A 67 -16.909 5.399 4.038 1.00 0.00 O ATOM 993 CB ASP A 67 -17.604 8.342 5.048 1.00 0.00 C ATOM 994 CG ASP A 67 -16.928 9.478 5.791 1.00 0.00 C ATOM 995 OD1 ASP A 67 -15.719 9.360 6.082 1.00 0.00 O ATOM 996 OD2 ASP A 67 -17.606 10.485 6.081 1.00 0.00 O ATOM 0 H ASP A 67 -17.079 9.654 3.013 1.00 0.00 H new ATOM 0 HA ASP A 67 -15.718 7.663 4.273 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -18.553 8.692 4.641 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -17.834 7.539 5.749 1.00 0.00 H new ATOM 1001 N ASP A 68 -18.123 6.435 2.453 1.00 0.00 N ATOM 1002 CA ASP A 68 -18.702 5.202 1.934 1.00 0.00 C ATOM 1003 C ASP A 68 -17.757 4.536 0.939 1.00 0.00 C ATOM 1004 O ASP A 68 -17.238 3.449 1.193 1.00 0.00 O ATOM 1005 CB ASP A 68 -20.048 5.487 1.266 1.00 0.00 C ATOM 1006 CG ASP A 68 -21.191 5.522 2.261 1.00 0.00 C ATOM 1007 OD1 ASP A 68 -21.405 4.507 2.956 1.00 0.00 O ATOM 1008 OD2 ASP A 68 -21.874 6.565 2.344 1.00 0.00 O ATOM 0 H ASP A 68 -18.430 7.280 1.972 1.00 0.00 H new ATOM 0 HA ASP A 68 -18.858 4.522 2.771 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -19.996 6.442 0.743 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -20.247 4.722 0.515 1.00 0.00 H new ATOM 1013 N GLU A 69 -17.539 5.194 -0.195 1.00 0.00 N ATOM 1014 CA GLU A 69 -16.658 4.664 -1.229 1.00 0.00 C ATOM 1015 C GLU A 69 -15.260 4.406 -0.674 1.00 0.00 C ATOM 1016 O GLU A 69 -14.729 3.301 -0.786 1.00 0.00 O ATOM 1017 CB GLU A 69 -16.579 5.634 -2.409 1.00 0.00 C ATOM 1018 CG GLU A 69 -17.936 6.016 -2.976 1.00 0.00 C ATOM 1019 CD GLU A 69 -18.418 5.046 -4.037 1.00 0.00 C ATOM 1020 OE1 GLU A 69 -18.532 3.841 -3.730 1.00 0.00 O ATOM 1021 OE2 GLU A 69 -18.681 5.492 -5.173 1.00 0.00 O ATOM 0 H GLU A 69 -17.960 6.095 -0.421 1.00 0.00 H new ATOM 0 HA GLU A 69 -17.073 3.717 -1.573 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -16.060 6.538 -2.091 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.978 5.183 -3.199 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -18.666 6.056 -2.167 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -17.879 7.017 -3.403 1.00 0.00 H new ATOM 1028 N LYS A 70 -14.670 5.434 -0.072 1.00 0.00 N ATOM 1029 CA LYS A 70 -13.335 5.321 0.503 1.00 0.00 C ATOM 1030 C LYS A 70 -13.164 3.988 1.223 1.00 0.00 C ATOM 1031 O LYS A 70 -12.192 3.266 0.995 1.00 0.00 O ATOM 1032 CB LYS A 70 -13.077 6.475 1.474 1.00 0.00 C ATOM 1033 CG LYS A 70 -12.996 7.832 0.797 1.00 0.00 C ATOM 1034 CD LYS A 70 -12.445 8.892 1.737 1.00 0.00 C ATOM 1035 CE LYS A 70 -11.807 10.040 0.970 1.00 0.00 C ATOM 1036 NZ LYS A 70 -11.522 11.206 1.851 1.00 0.00 N ATOM 0 H LYS A 70 -15.096 6.355 0.030 1.00 0.00 H new ATOM 0 HA LYS A 70 -12.611 5.370 -0.310 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -13.872 6.497 2.219 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -12.145 6.288 2.008 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.361 7.762 -0.086 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -13.987 8.128 0.454 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -13.249 9.275 2.366 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -11.707 8.442 2.401 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -10.880 9.698 0.509 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -12.470 10.349 0.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -11.397 12.059 1.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -12.316 11.348 2.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -10.653 11.027 2.393 1.00 0.00 H new ATOM 1050 N LEU A 71 -14.115 3.664 2.094 1.00 0.00 N ATOM 1051 CA LEU A 71 -14.071 2.417 2.848 1.00 0.00 C ATOM 1052 C LEU A 71 -13.881 1.224 1.916 1.00 0.00 C ATOM 1053 O LEU A 71 -12.875 0.520 1.989 1.00 0.00 O ATOM 1054 CB LEU A 71 -15.355 2.243 3.661 1.00 0.00 C ATOM 1055 CG LEU A 71 -15.526 0.898 4.366 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -14.376 0.649 5.331 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -16.858 0.845 5.099 1.00 0.00 C ATOM 0 H LEU A 71 -14.926 4.249 2.295 1.00 0.00 H new ATOM 0 HA LEU A 71 -13.221 2.463 3.529 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -15.395 3.032 4.412 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -16.205 2.393 2.996 1.00 0.00 H new ATOM 0 HG LEU A 71 -15.517 0.112 3.611 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -14.516 -0.313 5.823 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -13.435 0.642 4.781 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -14.352 1.440 6.081 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -16.962 -0.120 5.595 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -16.896 1.641 5.843 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -17.671 0.976 4.385 1.00 0.00 H new ATOM 1069 N ASN A 72 -14.855 1.004 1.039 1.00 0.00 N ATOM 1070 CA ASN A 72 -14.794 -0.102 0.090 1.00 0.00 C ATOM 1071 C ASN A 72 -13.391 -0.247 -0.489 1.00 0.00 C ATOM 1072 O ASN A 72 -12.879 -1.356 -0.632 1.00 0.00 O ATOM 1073 CB ASN A 72 -15.804 0.112 -1.040 1.00 0.00 C ATOM 1074 CG ASN A 72 -17.237 0.120 -0.541 1.00 0.00 C ATOM 1075 OD1 ASN A 72 -17.926 -0.899 -0.582 1.00 0.00 O ATOM 1076 ND2 ASN A 72 -17.691 1.274 -0.067 1.00 0.00 N ATOM 0 H ASN A 72 -15.696 1.577 0.966 1.00 0.00 H new ATOM 0 HA ASN A 72 -15.044 -1.019 0.624 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -15.591 1.057 -1.540 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -15.685 -0.676 -1.784 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -18.647 1.341 0.283 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -17.084 2.094 -0.052 1.00 0.00 H new ATOM 1083 N ASN A 73 -12.773 0.883 -0.818 1.00 0.00 N ATOM 1084 CA ASN A 73 -11.427 0.882 -1.380 1.00 0.00 C ATOM 1085 C ASN A 73 -10.416 0.344 -0.373 1.00 0.00 C ATOM 1086 O ASN A 73 -9.555 -0.466 -0.715 1.00 0.00 O ATOM 1087 CB ASN A 73 -11.031 2.297 -1.811 1.00 0.00 C ATOM 1088 CG ASN A 73 -11.516 2.632 -3.208 1.00 0.00 C ATOM 1089 OD1 ASN A 73 -12.232 1.850 -3.834 1.00 0.00 O ATOM 1090 ND2 ASN A 73 -11.126 3.801 -3.704 1.00 0.00 N ATOM 0 H ASN A 73 -13.182 1.810 -0.705 1.00 0.00 H new ATOM 0 HA ASN A 73 -11.426 0.229 -2.253 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -11.442 3.018 -1.104 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -9.946 2.396 -1.772 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -11.420 4.082 -4.639 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -10.532 4.418 -3.149 1.00 0.00 H new ATOM 1097 N ALA A 74 -10.528 0.800 0.870 1.00 0.00 N ATOM 1098 CA ALA A 74 -9.627 0.362 1.928 1.00 0.00 C ATOM 1099 C ALA A 74 -9.747 -1.140 2.166 1.00 0.00 C ATOM 1100 O ALA A 74 -8.745 -1.854 2.212 1.00 0.00 O ATOM 1101 CB ALA A 74 -9.910 1.126 3.214 1.00 0.00 C ATOM 0 H ALA A 74 -11.234 1.473 1.169 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.606 0.573 1.610 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.229 0.788 3.995 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.765 2.193 3.043 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.939 0.945 3.526 1.00 0.00 H new ATOM 1107 N LYS A 75 -10.979 -1.613 2.317 1.00 0.00 N ATOM 1108 CA LYS A 75 -11.231 -3.031 2.549 1.00 0.00 C ATOM 1109 C LYS A 75 -10.752 -3.870 1.369 1.00 0.00 C ATOM 1110 O LYS A 75 -10.383 -5.033 1.530 1.00 0.00 O ATOM 1111 CB LYS A 75 -12.723 -3.272 2.788 1.00 0.00 C ATOM 1112 CG LYS A 75 -13.267 -2.555 4.011 1.00 0.00 C ATOM 1113 CD LYS A 75 -14.733 -2.193 3.838 1.00 0.00 C ATOM 1114 CE LYS A 75 -15.612 -3.432 3.790 1.00 0.00 C ATOM 1115 NZ LYS A 75 -15.863 -3.987 5.149 1.00 0.00 N ATOM 0 H LYS A 75 -11.819 -1.036 2.283 1.00 0.00 H new ATOM 0 HA LYS A 75 -10.674 -3.333 3.436 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -13.280 -2.947 1.909 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -12.896 -4.342 2.898 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -13.149 -3.190 4.889 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -12.687 -1.650 4.192 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -15.050 -1.553 4.661 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -14.861 -1.619 2.920 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -16.563 -3.185 3.317 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -15.136 -4.191 3.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -16.466 -4.831 5.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -14.958 -4.247 5.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -16.341 -3.271 5.733 1.00 0.00 H new ATOM 1129 N TYR A 76 -10.758 -3.271 0.183 1.00 0.00 N ATOM 1130 CA TYR A 76 -10.325 -3.963 -1.026 1.00 0.00 C ATOM 1131 C TYR A 76 -8.818 -4.202 -1.006 1.00 0.00 C ATOM 1132 O TYR A 76 -8.350 -5.311 -1.261 1.00 0.00 O ATOM 1133 CB TYR A 76 -10.709 -3.156 -2.267 1.00 0.00 C ATOM 1134 CG TYR A 76 -10.617 -3.944 -3.554 1.00 0.00 C ATOM 1135 CD1 TYR A 76 -11.512 -4.972 -3.827 1.00 0.00 C ATOM 1136 CD2 TYR A 76 -9.635 -3.661 -4.496 1.00 0.00 C ATOM 1137 CE1 TYR A 76 -11.431 -5.694 -5.002 1.00 0.00 C ATOM 1138 CE2 TYR A 76 -9.549 -4.378 -5.673 1.00 0.00 C ATOM 1139 CZ TYR A 76 -10.448 -5.394 -5.922 1.00 0.00 C ATOM 1140 OH TYR A 76 -10.364 -6.111 -7.093 1.00 0.00 O ATOM 0 H TYR A 76 -11.058 -2.308 0.033 1.00 0.00 H new ATOM 0 HA TYR A 76 -10.828 -4.930 -1.061 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -11.728 -2.787 -2.149 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -10.060 -2.283 -2.338 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -12.283 -5.210 -3.109 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -8.928 -2.868 -4.304 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -12.134 -6.490 -5.199 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -8.781 -4.144 -6.396 1.00 0.00 H new ATOM 0 HH TYR A 76 -9.618 -5.773 -7.631 1.00 0.00 H new ATOM 1150 N ALA A 77 -8.063 -3.151 -0.702 1.00 0.00 N ATOM 1151 CA ALA A 77 -6.609 -3.245 -0.646 1.00 0.00 C ATOM 1152 C ALA A 77 -6.165 -4.279 0.384 1.00 0.00 C ATOM 1153 O ALA A 77 -5.365 -5.164 0.082 1.00 0.00 O ATOM 1154 CB ALA A 77 -6.005 -1.886 -0.327 1.00 0.00 C ATOM 0 H ALA A 77 -8.434 -2.225 -0.491 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.252 -3.569 -1.624 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -4.919 -1.971 -0.288 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -6.286 -1.172 -1.101 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.377 -1.540 0.637 1.00 0.00 H new ATOM 1160 N ILE A 78 -6.690 -4.160 1.599 1.00 0.00 N ATOM 1161 CA ILE A 78 -6.348 -5.085 2.672 1.00 0.00 C ATOM 1162 C ILE A 78 -6.733 -6.515 2.310 1.00 0.00 C ATOM 1163 O ILE A 78 -5.996 -7.459 2.596 1.00 0.00 O ATOM 1164 CB ILE A 78 -7.040 -4.697 3.992 1.00 0.00 C ATOM 1165 CG1 ILE A 78 -6.658 -3.271 4.395 1.00 0.00 C ATOM 1166 CG2 ILE A 78 -6.672 -5.682 5.092 1.00 0.00 C ATOM 1167 CD1 ILE A 78 -7.128 -2.888 5.780 1.00 0.00 C ATOM 0 H ILE A 78 -7.354 -3.432 1.865 1.00 0.00 H new ATOM 0 HA ILE A 78 -5.268 -5.026 2.806 1.00 0.00 H new ATOM 0 HB ILE A 78 -8.119 -4.734 3.844 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.574 -3.166 4.346 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -7.079 -2.573 3.671 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -7.169 -5.395 6.019 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -6.991 -6.684 4.805 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.592 -5.674 5.241 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -6.822 -1.865 5.998 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -8.215 -2.960 5.828 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -6.687 -3.563 6.514 1.00 0.00 H new ATOM 1179 N SER A 79 -7.891 -6.667 1.676 1.00 0.00 N ATOM 1180 CA SER A 79 -8.377 -7.983 1.276 1.00 0.00 C ATOM 1181 C SER A 79 -7.434 -8.624 0.261 1.00 0.00 C ATOM 1182 O SER A 79 -7.064 -9.790 0.393 1.00 0.00 O ATOM 1183 CB SER A 79 -9.782 -7.872 0.683 1.00 0.00 C ATOM 1184 OG SER A 79 -10.276 -9.145 0.299 1.00 0.00 O ATOM 0 H SER A 79 -8.510 -5.895 1.428 1.00 0.00 H new ATOM 0 HA SER A 79 -8.413 -8.615 2.163 1.00 0.00 H new ATOM 0 HB2 SER A 79 -10.454 -7.423 1.414 1.00 0.00 H new ATOM 0 HB3 SER A 79 -9.764 -7.209 -0.182 1.00 0.00 H new ATOM 0 HG SER A 79 -11.176 -9.047 -0.076 1.00 0.00 H new ATOM 1190 N MET A 80 -7.050 -7.852 -0.750 1.00 0.00 N ATOM 1191 CA MET A 80 -6.149 -8.343 -1.787 1.00 0.00 C ATOM 1192 C MET A 80 -4.862 -8.886 -1.176 1.00 0.00 C ATOM 1193 O MET A 80 -4.364 -9.934 -1.585 1.00 0.00 O ATOM 1194 CB MET A 80 -5.825 -7.227 -2.781 1.00 0.00 C ATOM 1195 CG MET A 80 -7.019 -6.785 -3.610 1.00 0.00 C ATOM 1196 SD MET A 80 -7.232 -7.774 -5.103 1.00 0.00 S ATOM 1197 CE MET A 80 -8.401 -9.004 -4.530 1.00 0.00 C ATOM 0 H MET A 80 -7.348 -6.884 -0.874 1.00 0.00 H new ATOM 0 HA MET A 80 -6.650 -9.155 -2.315 1.00 0.00 H new ATOM 0 HB2 MET A 80 -5.434 -6.368 -2.235 1.00 0.00 H new ATOM 0 HB3 MET A 80 -5.034 -7.566 -3.450 1.00 0.00 H new ATOM 0 HG2 MET A 80 -7.922 -6.851 -3.003 1.00 0.00 H new ATOM 0 HG3 MET A 80 -6.897 -5.738 -3.887 1.00 0.00 H new ATOM 0 HE1 MET A 80 -9.058 -9.292 -5.351 1.00 0.00 H new ATOM 0 HE2 MET A 80 -7.861 -9.881 -4.173 1.00 0.00 H new ATOM 0 HE3 MET A 80 -8.997 -8.589 -3.717 1.00 0.00 H new ATOM 1207 N ALA A 81 -4.328 -8.166 -0.194 1.00 0.00 N ATOM 1208 CA ALA A 81 -3.099 -8.577 0.474 1.00 0.00 C ATOM 1209 C ALA A 81 -3.126 -10.065 0.805 1.00 0.00 C ATOM 1210 O ALA A 81 -2.184 -10.796 0.500 1.00 0.00 O ATOM 1211 CB ALA A 81 -2.886 -7.757 1.737 1.00 0.00 C ATOM 0 H ALA A 81 -4.727 -7.295 0.156 1.00 0.00 H new ATOM 0 HA ALA A 81 -2.267 -8.398 -0.207 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -1.965 -8.074 2.226 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.814 -6.701 1.477 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.727 -7.907 2.414 1.00 0.00 H new ATOM 1217 N ARG A 82 -4.212 -10.507 1.431 1.00 0.00 N ATOM 1218 CA ARG A 82 -4.361 -11.909 1.806 1.00 0.00 C ATOM 1219 C ARG A 82 -4.500 -12.791 0.568 1.00 0.00 C ATOM 1220 O ARG A 82 -3.949 -13.890 0.510 1.00 0.00 O ATOM 1221 CB ARG A 82 -5.577 -12.090 2.714 1.00 0.00 C ATOM 1222 CG ARG A 82 -5.582 -13.407 3.472 1.00 0.00 C ATOM 1223 CD ARG A 82 -6.692 -13.450 4.510 1.00 0.00 C ATOM 1224 NE ARG A 82 -7.144 -14.813 4.773 1.00 0.00 N ATOM 1225 CZ ARG A 82 -8.315 -15.106 5.327 1.00 0.00 C ATOM 1226 NH1 ARG A 82 -9.149 -14.136 5.674 1.00 0.00 N ATOM 1227 NH2 ARG A 82 -8.654 -16.372 5.534 1.00 0.00 N ATOM 0 H ARG A 82 -5.002 -9.915 1.689 1.00 0.00 H new ATOM 0 HA ARG A 82 -3.465 -12.211 2.348 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -5.610 -11.269 3.430 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -6.483 -12.024 2.111 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.707 -14.231 2.770 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -4.619 -13.549 3.962 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.338 -13.000 5.438 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.534 -12.849 4.165 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.526 -15.583 4.517 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.892 -13.162 5.516 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -10.048 -14.364 6.099 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -8.015 -17.121 5.268 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -9.554 -16.596 5.960 1.00 0.00 H new ATOM 1241 N LYS A 83 -5.241 -12.301 -0.420 1.00 0.00 N ATOM 1242 CA LYS A 83 -5.454 -13.043 -1.658 1.00 0.00 C ATOM 1243 C LYS A 83 -4.124 -13.404 -2.311 1.00 0.00 C ATOM 1244 O LYS A 83 -3.910 -14.547 -2.715 1.00 0.00 O ATOM 1245 CB LYS A 83 -6.305 -12.222 -2.629 1.00 0.00 C ATOM 1246 CG LYS A 83 -7.796 -12.476 -2.495 1.00 0.00 C ATOM 1247 CD LYS A 83 -8.404 -11.650 -1.373 1.00 0.00 C ATOM 1248 CE LYS A 83 -9.895 -11.916 -1.230 1.00 0.00 C ATOM 1249 NZ LYS A 83 -10.171 -13.325 -0.839 1.00 0.00 N ATOM 0 H LYS A 83 -5.704 -11.393 -0.388 1.00 0.00 H new ATOM 0 HA LYS A 83 -5.981 -13.965 -1.414 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -6.109 -11.162 -2.464 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -5.997 -12.448 -3.650 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -8.293 -12.236 -3.435 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -7.970 -13.535 -2.304 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -7.900 -11.882 -0.435 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -8.240 -10.591 -1.569 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -10.314 -11.243 -0.482 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -10.395 -11.696 -2.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -11.163 -13.414 -0.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -9.997 -13.951 -1.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -9.546 -13.596 -0.053 1.00 0.00 H new ATOM 1263 N ILE A 84 -3.233 -12.423 -2.410 1.00 0.00 N ATOM 1264 CA ILE A 84 -1.923 -12.639 -3.011 1.00 0.00 C ATOM 1265 C ILE A 84 -0.995 -13.383 -2.056 1.00 0.00 C ATOM 1266 O ILE A 84 0.038 -13.912 -2.463 1.00 0.00 O ATOM 1267 CB ILE A 84 -1.263 -11.308 -3.417 1.00 0.00 C ATOM 1268 CG1 ILE A 84 -1.167 -10.373 -2.210 1.00 0.00 C ATOM 1269 CG2 ILE A 84 -2.046 -10.650 -4.543 1.00 0.00 C ATOM 1270 CD1 ILE A 84 -0.152 -9.265 -2.383 1.00 0.00 C ATOM 0 H ILE A 84 -3.395 -11.471 -2.082 1.00 0.00 H new ATOM 0 HA ILE A 84 -2.082 -13.244 -3.904 1.00 0.00 H new ATOM 0 HB ILE A 84 -0.254 -11.514 -3.775 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -2.146 -9.932 -2.024 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -0.908 -10.958 -1.327 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -1.567 -9.710 -4.819 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.067 -11.314 -5.407 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -3.065 -10.454 -4.211 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -0.138 -8.641 -1.489 1.00 0.00 H new ATOM 0 HD12 ILE A 84 0.836 -9.698 -2.539 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -0.422 -8.656 -3.246 1.00 0.00 H new ATOM 1282 N GLY A 85 -1.374 -13.422 -0.782 1.00 0.00 N ATOM 1283 CA GLY A 85 -0.566 -14.104 0.212 1.00 0.00 C ATOM 1284 C GLY A 85 -0.321 -13.256 1.443 1.00 0.00 C ATOM 1285 O GLY A 85 -0.957 -13.455 2.478 1.00 0.00 O ATOM 0 H GLY A 85 -2.226 -12.993 -0.421 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.062 -15.029 0.505 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.391 -14.381 -0.230 1.00 0.00 H new ATOM 1289 N ALA A 86 0.603 -12.308 1.333 1.00 0.00 N ATOM 1290 CA ALA A 86 0.930 -11.426 2.447 1.00 0.00 C ATOM 1291 C ALA A 86 -0.315 -11.083 3.258 1.00 0.00 C ATOM 1292 O ALA A 86 -1.298 -10.574 2.718 1.00 0.00 O ATOM 1293 CB ALA A 86 1.597 -10.157 1.937 1.00 0.00 C ATOM 0 H ALA A 86 1.139 -12.131 0.483 1.00 0.00 H new ATOM 0 HA ALA A 86 1.626 -11.950 3.102 1.00 0.00 H new ATOM 0 HB1 ALA A 86 1.836 -9.508 2.779 1.00 0.00 H new ATOM 0 HB2 ALA A 86 2.514 -10.416 1.407 1.00 0.00 H new ATOM 0 HB3 ALA A 86 0.920 -9.637 1.259 1.00 0.00 H new ATOM 1299 N ARG A 87 -0.267 -11.364 4.556 1.00 0.00 N ATOM 1300 CA ARG A 87 -1.391 -11.086 5.441 1.00 0.00 C ATOM 1301 C ARG A 87 -1.131 -9.834 6.275 1.00 0.00 C ATOM 1302 O ARG A 87 -0.146 -9.760 7.009 1.00 0.00 O ATOM 1303 CB ARG A 87 -1.651 -12.280 6.361 1.00 0.00 C ATOM 1304 CG ARG A 87 -2.841 -12.088 7.287 1.00 0.00 C ATOM 1305 CD ARG A 87 -3.187 -13.372 8.023 1.00 0.00 C ATOM 1306 NE ARG A 87 -3.521 -14.458 7.105 1.00 0.00 N ATOM 1307 CZ ARG A 87 -2.617 -15.265 6.562 1.00 0.00 C ATOM 1308 NH1 ARG A 87 -1.332 -15.112 6.844 1.00 0.00 N ATOM 1309 NH2 ARG A 87 -3.000 -16.230 5.735 1.00 0.00 N ATOM 0 H ARG A 87 0.539 -11.784 5.018 1.00 0.00 H new ATOM 0 HA ARG A 87 -2.272 -10.913 4.824 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -1.816 -13.168 5.751 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -0.760 -12.466 6.961 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.618 -11.302 8.009 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.703 -11.755 6.709 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -2.344 -13.671 8.646 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -4.029 -13.191 8.691 1.00 0.00 H new ATOM 0 HE ARG A 87 -4.502 -14.604 6.868 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -1.034 -14.372 7.480 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -0.640 -15.734 6.425 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -3.989 -16.352 5.516 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -2.305 -16.850 5.318 1.00 0.00 H new ATOM 1323 N VAL A 88 -2.021 -8.854 6.154 1.00 0.00 N ATOM 1324 CA VAL A 88 -1.888 -7.606 6.897 1.00 0.00 C ATOM 1325 C VAL A 88 -2.861 -7.559 8.070 1.00 0.00 C ATOM 1326 O VAL A 88 -4.057 -7.799 7.908 1.00 0.00 O ATOM 1327 CB VAL A 88 -2.133 -6.386 5.990 1.00 0.00 C ATOM 1328 CG1 VAL A 88 -1.042 -6.274 4.937 1.00 0.00 C ATOM 1329 CG2 VAL A 88 -3.506 -6.472 5.341 1.00 0.00 C ATOM 0 H VAL A 88 -2.841 -8.900 5.549 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.866 -7.569 7.275 1.00 0.00 H new ATOM 0 HB VAL A 88 -2.103 -5.487 6.605 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -1.233 -5.406 4.306 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.074 -6.161 5.426 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -1.035 -7.174 4.323 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -3.662 -5.602 4.704 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -3.568 -7.379 4.739 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.273 -6.497 6.115 1.00 0.00 H new ATOM 1339 N TYR A 89 -2.339 -7.248 9.251 1.00 0.00 N ATOM 1340 CA TYR A 89 -3.161 -7.170 10.453 1.00 0.00 C ATOM 1341 C TYR A 89 -3.607 -5.735 10.716 1.00 0.00 C ATOM 1342 O TYR A 89 -3.474 -5.225 11.828 1.00 0.00 O ATOM 1343 CB TYR A 89 -2.387 -7.704 11.660 1.00 0.00 C ATOM 1344 CG TYR A 89 -3.263 -8.393 12.683 1.00 0.00 C ATOM 1345 CD1 TYR A 89 -4.388 -7.762 13.200 1.00 0.00 C ATOM 1346 CD2 TYR A 89 -2.964 -9.673 13.134 1.00 0.00 C ATOM 1347 CE1 TYR A 89 -5.191 -8.387 14.134 1.00 0.00 C ATOM 1348 CE2 TYR A 89 -3.761 -10.305 14.068 1.00 0.00 C ATOM 1349 CZ TYR A 89 -4.873 -9.658 14.565 1.00 0.00 C ATOM 1350 OH TYR A 89 -5.669 -10.284 15.497 1.00 0.00 O ATOM 0 H TYR A 89 -1.351 -7.046 9.402 1.00 0.00 H new ATOM 0 HA TYR A 89 -4.048 -7.784 10.297 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -1.627 -8.405 11.313 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -1.863 -6.877 12.140 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -4.639 -6.766 12.866 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -2.094 -10.182 12.747 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -6.063 -7.883 14.525 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -3.515 -11.300 14.407 1.00 0.00 H new ATOM 0 HH TYR A 89 -5.307 -11.174 15.692 1.00 0.00 H new ATOM 1360 N ALA A 90 -4.139 -5.090 9.683 1.00 0.00 N ATOM 1361 CA ALA A 90 -4.610 -3.715 9.801 1.00 0.00 C ATOM 1362 C ALA A 90 -6.109 -3.623 9.547 1.00 0.00 C ATOM 1363 O ALA A 90 -6.716 -4.548 9.003 1.00 0.00 O ATOM 1364 CB ALA A 90 -3.852 -2.813 8.838 1.00 0.00 C ATOM 0 H ALA A 90 -4.255 -5.497 8.755 1.00 0.00 H new ATOM 0 HA ALA A 90 -4.421 -3.379 10.821 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -4.214 -1.790 8.937 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -2.788 -2.846 9.070 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -4.011 -3.157 7.816 1.00 0.00 H new ATOM 1370 N LEU A 91 -6.705 -2.504 9.942 1.00 0.00 N ATOM 1371 CA LEU A 91 -8.137 -2.291 9.757 1.00 0.00 C ATOM 1372 C LEU A 91 -8.396 -1.208 8.715 1.00 0.00 C ATOM 1373 O LEU A 91 -7.827 -0.118 8.763 1.00 0.00 O ATOM 1374 CB LEU A 91 -8.792 -1.907 11.085 1.00 0.00 C ATOM 1375 CG LEU A 91 -10.320 -1.839 11.085 1.00 0.00 C ATOM 1376 CD1 LEU A 91 -10.915 -3.236 11.165 1.00 0.00 C ATOM 1377 CD2 LEU A 91 -10.815 -0.979 12.238 1.00 0.00 C ATOM 0 H LEU A 91 -6.219 -1.729 10.393 1.00 0.00 H new ATOM 0 HA LEU A 91 -8.575 -3.223 9.401 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -8.480 -2.626 11.842 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -8.405 -0.935 11.390 1.00 0.00 H new ATOM 0 HG LEU A 91 -10.645 -1.381 10.151 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -12.003 -3.169 11.164 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -10.587 -3.821 10.306 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -10.582 -3.721 12.083 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -11.904 -0.942 12.223 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -10.480 -1.408 13.182 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -10.416 0.030 12.137 1.00 0.00 H new ATOM 1389 N PRO A 92 -9.278 -1.512 7.752 1.00 0.00 N ATOM 1390 CA PRO A 92 -9.636 -0.576 6.682 1.00 0.00 C ATOM 1391 C PRO A 92 -10.454 0.605 7.194 1.00 0.00 C ATOM 1392 O PRO A 92 -10.187 1.754 6.843 1.00 0.00 O ATOM 1393 CB PRO A 92 -10.473 -1.431 5.727 1.00 0.00 C ATOM 1394 CG PRO A 92 -11.034 -2.514 6.582 1.00 0.00 C ATOM 1395 CD PRO A 92 -9.996 -2.793 7.633 1.00 0.00 C ATOM 0 HA PRO A 92 -8.755 -0.132 6.218 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -11.265 -0.844 5.261 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -9.862 -1.839 4.922 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -11.975 -2.204 7.036 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -11.243 -3.407 5.993 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.451 -3.088 8.579 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.329 -3.601 7.334 1.00 0.00 H new ATOM 1403 N GLU A 93 -11.450 0.313 8.025 1.00 0.00 N ATOM 1404 CA GLU A 93 -12.305 1.353 8.584 1.00 0.00 C ATOM 1405 C GLU A 93 -11.477 2.544 9.056 1.00 0.00 C ATOM 1406 O GLU A 93 -11.985 3.660 9.172 1.00 0.00 O ATOM 1407 CB GLU A 93 -13.127 0.795 9.748 1.00 0.00 C ATOM 1408 CG GLU A 93 -14.465 0.214 9.325 1.00 0.00 C ATOM 1409 CD GLU A 93 -15.466 0.163 10.464 1.00 0.00 C ATOM 1410 OE1 GLU A 93 -15.432 -0.814 11.241 1.00 0.00 O ATOM 1411 OE2 GLU A 93 -16.284 1.101 10.578 1.00 0.00 O ATOM 0 H GLU A 93 -11.684 -0.633 8.325 1.00 0.00 H new ATOM 0 HA GLU A 93 -12.981 1.693 7.800 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -12.548 0.022 10.253 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -13.299 1.590 10.474 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.876 0.812 8.512 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.313 -0.792 8.935 1.00 0.00 H new ATOM 1418 N ASP A 94 -10.200 2.299 9.327 1.00 0.00 N ATOM 1419 CA ASP A 94 -9.300 3.350 9.786 1.00 0.00 C ATOM 1420 C ASP A 94 -8.528 3.953 8.617 1.00 0.00 C ATOM 1421 O ASP A 94 -8.300 5.163 8.567 1.00 0.00 O ATOM 1422 CB ASP A 94 -8.326 2.799 10.827 1.00 0.00 C ATOM 1423 CG ASP A 94 -8.893 2.843 12.233 1.00 0.00 C ATOM 1424 OD1 ASP A 94 -10.124 2.996 12.370 1.00 0.00 O ATOM 1425 OD2 ASP A 94 -8.105 2.725 13.195 1.00 0.00 O ATOM 0 H ASP A 94 -9.765 1.381 9.237 1.00 0.00 H new ATOM 0 HA ASP A 94 -9.902 4.135 10.244 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -8.072 1.770 10.573 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -7.400 3.374 10.794 1.00 0.00 H new ATOM 1430 N LEU A 95 -8.125 3.103 7.679 1.00 0.00 N ATOM 1431 CA LEU A 95 -7.377 3.551 6.510 1.00 0.00 C ATOM 1432 C LEU A 95 -8.083 4.718 5.827 1.00 0.00 C ATOM 1433 O LEU A 95 -7.441 5.668 5.377 1.00 0.00 O ATOM 1434 CB LEU A 95 -7.199 2.398 5.521 1.00 0.00 C ATOM 1435 CG LEU A 95 -6.734 2.784 4.117 1.00 0.00 C ATOM 1436 CD1 LEU A 95 -5.507 3.680 4.188 1.00 0.00 C ATOM 1437 CD2 LEU A 95 -6.440 1.539 3.291 1.00 0.00 C ATOM 0 H LEU A 95 -8.304 2.099 7.705 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.396 3.889 6.844 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -6.479 1.694 5.940 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -8.148 1.870 5.435 1.00 0.00 H new ATOM 0 HG LEU A 95 -7.536 3.339 3.630 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -5.191 3.944 3.179 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -5.750 4.587 4.741 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -4.699 3.152 4.695 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -6.110 1.833 2.295 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -5.656 0.957 3.776 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -7.343 0.934 3.211 1.00 0.00 H new ATOM 1449 N VAL A 96 -9.407 4.641 5.752 1.00 0.00 N ATOM 1450 CA VAL A 96 -10.201 5.692 5.127 1.00 0.00 C ATOM 1451 C VAL A 96 -9.747 7.072 5.588 1.00 0.00 C ATOM 1452 O VAL A 96 -9.759 8.030 4.816 1.00 0.00 O ATOM 1453 CB VAL A 96 -11.700 5.526 5.441 1.00 0.00 C ATOM 1454 CG1 VAL A 96 -12.498 6.684 4.862 1.00 0.00 C ATOM 1455 CG2 VAL A 96 -12.211 4.196 4.906 1.00 0.00 C ATOM 0 H VAL A 96 -9.953 3.861 6.117 1.00 0.00 H new ATOM 0 HA VAL A 96 -10.051 5.604 4.051 1.00 0.00 H new ATOM 0 HB VAL A 96 -11.830 5.531 6.523 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -13.555 6.550 5.094 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -12.148 7.620 5.296 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -12.365 6.713 3.781 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -13.272 4.095 5.136 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -12.069 4.160 3.826 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -11.659 3.380 5.372 1.00 0.00 H new ATOM 1465 N GLU A 97 -9.346 7.165 6.853 1.00 0.00 N ATOM 1466 CA GLU A 97 -8.887 8.429 7.416 1.00 0.00 C ATOM 1467 C GLU A 97 -7.370 8.438 7.570 1.00 0.00 C ATOM 1468 O GLU A 97 -6.833 9.007 8.521 1.00 0.00 O ATOM 1469 CB GLU A 97 -9.549 8.677 8.774 1.00 0.00 C ATOM 1470 CG GLU A 97 -11.064 8.778 8.703 1.00 0.00 C ATOM 1471 CD GLU A 97 -11.675 9.288 9.994 1.00 0.00 C ATOM 1472 OE1 GLU A 97 -11.682 8.532 10.987 1.00 0.00 O ATOM 1473 OE2 GLU A 97 -12.147 10.444 10.010 1.00 0.00 O ATOM 0 H GLU A 97 -9.330 6.381 7.506 1.00 0.00 H new ATOM 0 HA GLU A 97 -9.170 9.227 6.729 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -9.279 7.869 9.454 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.151 9.598 9.200 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -11.342 9.443 7.886 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -11.479 7.797 8.471 1.00 0.00 H new ATOM 1480 N VAL A 98 -6.681 7.802 6.626 1.00 0.00 N ATOM 1481 CA VAL A 98 -5.226 7.736 6.656 1.00 0.00 C ATOM 1482 C VAL A 98 -4.713 7.518 8.074 1.00 0.00 C ATOM 1483 O VAL A 98 -3.887 8.283 8.571 1.00 0.00 O ATOM 1484 CB VAL A 98 -4.594 9.021 6.085 1.00 0.00 C ATOM 1485 CG1 VAL A 98 -3.092 8.850 5.921 1.00 0.00 C ATOM 1486 CG2 VAL A 98 -5.245 9.391 4.762 1.00 0.00 C ATOM 0 H VAL A 98 -7.108 7.326 5.832 1.00 0.00 H new ATOM 0 HA VAL A 98 -4.936 6.889 6.035 1.00 0.00 H new ATOM 0 HB VAL A 98 -4.767 9.835 6.789 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -2.663 9.767 5.517 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -2.642 8.636 6.890 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -2.892 8.024 5.238 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -4.787 10.300 4.373 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -5.104 8.580 4.048 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -6.311 9.559 4.915 1.00 0.00 H new ATOM 1496 N ASN A 99 -5.209 6.468 8.722 1.00 0.00 N ATOM 1497 CA ASN A 99 -4.801 6.148 10.085 1.00 0.00 C ATOM 1498 C ASN A 99 -3.454 5.432 10.097 1.00 0.00 C ATOM 1499 O ASN A 99 -3.326 4.291 9.654 1.00 0.00 O ATOM 1500 CB ASN A 99 -5.859 5.279 10.766 1.00 0.00 C ATOM 1501 CG ASN A 99 -5.929 5.516 12.261 1.00 0.00 C ATOM 1502 OD1 ASN A 99 -4.905 5.564 12.942 1.00 0.00 O ATOM 1503 ND2 ASN A 99 -7.142 5.666 12.781 1.00 0.00 N ATOM 0 H ASN A 99 -5.894 5.825 8.325 1.00 0.00 H new ATOM 0 HA ASN A 99 -4.700 7.083 10.635 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -6.833 5.484 10.323 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -5.638 4.228 10.578 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -7.251 5.828 13.782 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -7.964 5.619 12.179 1.00 0.00 H new ATOM 1510 N PRO A 100 -2.423 6.117 10.615 1.00 0.00 N ATOM 1511 CA PRO A 100 -1.068 5.566 10.697 1.00 0.00 C ATOM 1512 C PRO A 100 -0.962 4.441 11.720 1.00 0.00 C ATOM 1513 O PRO A 100 0.089 3.813 11.861 1.00 0.00 O ATOM 1514 CB PRO A 100 -0.223 6.766 11.132 1.00 0.00 C ATOM 1515 CG PRO A 100 -1.176 7.662 11.844 1.00 0.00 C ATOM 1516 CD PRO A 100 -2.504 7.483 11.160 1.00 0.00 C ATOM 0 HA PRO A 100 -0.750 5.123 9.753 1.00 0.00 H new ATOM 0 HB2 PRO A 100 0.594 6.459 11.784 1.00 0.00 H new ATOM 0 HB3 PRO A 100 0.225 7.267 10.274 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -1.243 7.400 12.900 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -0.848 8.700 11.793 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -3.334 7.589 11.859 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -2.654 8.222 10.373 1.00 0.00 H new ATOM 1524 N LYS A 101 -2.054 4.189 12.434 1.00 0.00 N ATOM 1525 CA LYS A 101 -2.085 3.138 13.443 1.00 0.00 C ATOM 1526 C LYS A 101 -2.182 1.762 12.793 1.00 0.00 C ATOM 1527 O LYS A 101 -1.543 0.809 13.236 1.00 0.00 O ATOM 1528 CB LYS A 101 -3.265 3.349 14.393 1.00 0.00 C ATOM 1529 CG LYS A 101 -3.260 4.706 15.076 1.00 0.00 C ATOM 1530 CD LYS A 101 -2.081 4.849 16.025 1.00 0.00 C ATOM 1531 CE LYS A 101 -2.232 3.948 17.240 1.00 0.00 C ATOM 1532 NZ LYS A 101 -1.132 4.154 18.222 1.00 0.00 N ATOM 0 H LYS A 101 -2.931 4.700 12.332 1.00 0.00 H new ATOM 0 HA LYS A 101 -1.156 3.187 14.011 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -4.195 3.236 13.835 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.252 2.568 15.154 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -3.220 5.493 14.323 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.191 4.840 15.628 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -1.158 4.602 15.500 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.996 5.887 16.348 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -3.190 4.144 17.721 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -2.243 2.906 16.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -1.270 3.522 19.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -0.219 3.942 17.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -1.137 5.142 18.546 1.00 0.00 H new ATOM 1546 N MET A 102 -2.986 1.666 11.738 1.00 0.00 N ATOM 1547 CA MET A 102 -3.165 0.407 11.025 1.00 0.00 C ATOM 1548 C MET A 102 -2.176 0.292 9.868 1.00 0.00 C ATOM 1549 O MET A 102 -1.587 -0.766 9.645 1.00 0.00 O ATOM 1550 CB MET A 102 -4.597 0.292 10.500 1.00 0.00 C ATOM 1551 CG MET A 102 -4.982 1.402 9.537 1.00 0.00 C ATOM 1552 SD MET A 102 -4.497 1.046 7.837 1.00 0.00 S ATOM 1553 CE MET A 102 -5.581 -0.328 7.456 1.00 0.00 C ATOM 0 H MET A 102 -3.524 2.445 11.359 1.00 0.00 H new ATOM 0 HA MET A 102 -2.976 -0.407 11.724 1.00 0.00 H new ATOM 0 HB2 MET A 102 -4.716 -0.669 10.000 1.00 0.00 H new ATOM 0 HB3 MET A 102 -5.286 0.299 11.344 1.00 0.00 H new ATOM 0 HG2 MET A 102 -6.060 1.556 9.578 1.00 0.00 H new ATOM 0 HG3 MET A 102 -4.515 2.333 9.857 1.00 0.00 H new ATOM 0 HE1 MET A 102 -5.058 -1.038 6.815 1.00 0.00 H new ATOM 0 HE2 MET A 102 -5.878 -0.824 8.380 1.00 0.00 H new ATOM 0 HE3 MET A 102 -6.468 0.040 6.941 1.00 0.00 H new ATOM 1563 N VAL A 103 -2.000 1.387 9.136 1.00 0.00 N ATOM 1564 CA VAL A 103 -1.082 1.408 8.003 1.00 0.00 C ATOM 1565 C VAL A 103 0.214 0.676 8.331 1.00 0.00 C ATOM 1566 O VAL A 103 0.839 0.077 7.456 1.00 0.00 O ATOM 1567 CB VAL A 103 -0.750 2.851 7.577 1.00 0.00 C ATOM 1568 CG1 VAL A 103 0.188 2.853 6.379 1.00 0.00 C ATOM 1569 CG2 VAL A 103 -2.025 3.621 7.267 1.00 0.00 C ATOM 0 H VAL A 103 -2.480 2.270 9.307 1.00 0.00 H new ATOM 0 HA VAL A 103 -1.584 0.900 7.180 1.00 0.00 H new ATOM 0 HB VAL A 103 -0.244 3.348 8.405 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.411 3.881 6.093 1.00 0.00 H new ATOM 0 HG12 VAL A 103 1.114 2.340 6.641 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -0.288 2.339 5.544 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -1.772 4.638 6.968 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.560 3.127 6.456 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.657 3.650 8.154 1.00 0.00 H new ATOM 1579 N MET A 104 0.612 0.728 9.597 1.00 0.00 N ATOM 1580 CA MET A 104 1.834 0.068 10.043 1.00 0.00 C ATOM 1581 C MET A 104 2.073 -1.218 9.257 1.00 0.00 C ATOM 1582 O MET A 104 3.145 -1.420 8.686 1.00 0.00 O ATOM 1583 CB MET A 104 1.757 -0.242 11.539 1.00 0.00 C ATOM 1584 CG MET A 104 2.513 -1.499 11.939 1.00 0.00 C ATOM 1585 SD MET A 104 2.196 -1.985 13.647 1.00 0.00 S ATOM 1586 CE MET A 104 0.730 -2.994 13.444 1.00 0.00 C ATOM 0 H MET A 104 0.106 1.221 10.333 1.00 0.00 H new ATOM 0 HA MET A 104 2.669 0.745 9.864 1.00 0.00 H new ATOM 0 HB2 MET A 104 2.155 0.605 12.098 1.00 0.00 H new ATOM 0 HB3 MET A 104 0.711 -0.350 11.826 1.00 0.00 H new ATOM 0 HG2 MET A 104 2.230 -2.315 11.274 1.00 0.00 H new ATOM 0 HG3 MET A 104 3.582 -1.334 11.805 1.00 0.00 H new ATOM 0 HE1 MET A 104 0.100 -2.903 14.329 1.00 0.00 H new ATOM 0 HE2 MET A 104 0.175 -2.658 12.568 1.00 0.00 H new ATOM 0 HE3 MET A 104 1.021 -4.036 13.311 1.00 0.00 H new ATOM 1596 N THR A 105 1.068 -2.088 9.234 1.00 0.00 N ATOM 1597 CA THR A 105 1.169 -3.355 8.520 1.00 0.00 C ATOM 1598 C THR A 105 0.909 -3.169 7.029 1.00 0.00 C ATOM 1599 O THR A 105 1.581 -3.771 6.192 1.00 0.00 O ATOM 1600 CB THR A 105 0.178 -4.394 9.077 1.00 0.00 C ATOM 1601 OG1 THR A 105 -1.008 -3.740 9.542 1.00 0.00 O ATOM 1602 CG2 THR A 105 0.806 -5.186 10.214 1.00 0.00 C ATOM 0 H THR A 105 0.174 -1.938 9.702 1.00 0.00 H new ATOM 0 HA THR A 105 2.186 -3.719 8.665 1.00 0.00 H new ATOM 0 HB THR A 105 -0.080 -5.084 8.274 1.00 0.00 H new ATOM 0 HG1 THR A 105 -1.397 -4.254 10.280 1.00 0.00 H new ATOM 0 HG21 THR A 105 0.087 -5.913 10.591 1.00 0.00 H new ATOM 0 HG22 THR A 105 1.692 -5.706 9.849 1.00 0.00 H new ATOM 0 HG23 THR A 105 1.090 -4.506 11.017 1.00 0.00 H new ATOM 1610 N VAL A 106 -0.069 -2.330 6.705 1.00 0.00 N ATOM 1611 CA VAL A 106 -0.416 -2.063 5.314 1.00 0.00 C ATOM 1612 C VAL A 106 0.829 -2.013 4.436 1.00 0.00 C ATOM 1613 O VAL A 106 0.886 -2.651 3.384 1.00 0.00 O ATOM 1614 CB VAL A 106 -1.185 -0.736 5.172 1.00 0.00 C ATOM 1615 CG1 VAL A 106 -1.339 -0.361 3.706 1.00 0.00 C ATOM 1616 CG2 VAL A 106 -2.543 -0.831 5.852 1.00 0.00 C ATOM 0 H VAL A 106 -0.635 -1.824 7.386 1.00 0.00 H new ATOM 0 HA VAL A 106 -1.056 -2.882 4.985 1.00 0.00 H new ATOM 0 HB VAL A 106 -0.612 0.049 5.665 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -1.885 0.579 3.626 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -0.354 -0.248 3.254 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -1.889 -1.145 3.186 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -3.072 0.115 5.742 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -3.126 -1.628 5.391 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -2.405 -1.048 6.911 1.00 0.00 H new ATOM 1626 N PHE A 107 1.826 -1.251 4.875 1.00 0.00 N ATOM 1627 CA PHE A 107 3.071 -1.117 4.128 1.00 0.00 C ATOM 1628 C PHE A 107 4.097 -2.147 4.593 1.00 0.00 C ATOM 1629 O PHE A 107 4.617 -2.924 3.794 1.00 0.00 O ATOM 1630 CB PHE A 107 3.638 0.295 4.292 1.00 0.00 C ATOM 1631 CG PHE A 107 3.031 1.299 3.355 1.00 0.00 C ATOM 1632 CD1 PHE A 107 2.876 1.003 2.010 1.00 0.00 C ATOM 1633 CD2 PHE A 107 2.615 2.536 3.817 1.00 0.00 C ATOM 1634 CE1 PHE A 107 2.317 1.925 1.144 1.00 0.00 C ATOM 1635 CE2 PHE A 107 2.056 3.462 2.956 1.00 0.00 C ATOM 1636 CZ PHE A 107 1.906 3.155 1.618 1.00 0.00 C ATOM 0 H PHE A 107 1.796 -0.717 5.744 1.00 0.00 H new ATOM 0 HA PHE A 107 2.856 -1.295 3.074 1.00 0.00 H new ATOM 0 HB2 PHE A 107 3.478 0.625 5.318 1.00 0.00 H new ATOM 0 HB3 PHE A 107 4.716 0.266 4.131 1.00 0.00 H new ATOM 0 HD1 PHE A 107 3.195 0.042 1.634 1.00 0.00 H new ATOM 0 HD2 PHE A 107 2.729 2.781 4.863 1.00 0.00 H new ATOM 0 HE1 PHE A 107 2.202 1.683 0.098 1.00 0.00 H new ATOM 0 HE2 PHE A 107 1.737 4.424 3.329 1.00 0.00 H new ATOM 0 HZ PHE A 107 1.468 3.876 0.943 1.00 0.00 H new ATOM 1646 N ALA A 108 4.382 -2.145 5.891 1.00 0.00 N ATOM 1647 CA ALA A 108 5.343 -3.080 6.463 1.00 0.00 C ATOM 1648 C ALA A 108 5.251 -4.444 5.788 1.00 0.00 C ATOM 1649 O ALA A 108 6.255 -4.988 5.327 1.00 0.00 O ATOM 1650 CB ALA A 108 5.121 -3.214 7.962 1.00 0.00 C ATOM 0 H ALA A 108 3.961 -1.507 6.566 1.00 0.00 H new ATOM 0 HA ALA A 108 6.344 -2.685 6.289 1.00 0.00 H new ATOM 0 HB1 ALA A 108 5.846 -3.915 8.376 1.00 0.00 H new ATOM 0 HB2 ALA A 108 5.246 -2.241 8.437 1.00 0.00 H new ATOM 0 HB3 ALA A 108 4.112 -3.582 8.149 1.00 0.00 H new ATOM 1656 N CYS A 109 4.042 -4.992 5.733 1.00 0.00 N ATOM 1657 CA CYS A 109 3.820 -6.293 5.115 1.00 0.00 C ATOM 1658 C CYS A 109 4.288 -6.294 3.663 1.00 0.00 C ATOM 1659 O CYS A 109 4.818 -7.291 3.170 1.00 0.00 O ATOM 1660 CB CYS A 109 2.339 -6.669 5.186 1.00 0.00 C ATOM 1661 SG CYS A 109 1.843 -7.422 6.754 1.00 0.00 S ATOM 0 H CYS A 109 3.201 -4.555 6.109 1.00 0.00 H new ATOM 0 HA CYS A 109 4.402 -7.032 5.665 1.00 0.00 H new ATOM 0 HB2 CYS A 109 1.740 -5.774 5.019 1.00 0.00 H new ATOM 0 HB3 CYS A 109 2.111 -7.361 4.375 1.00 0.00 H new ATOM 0 HG CYS A 109 1.010 -8.393 6.525 1.00 0.00 H new ATOM 1667 N LEU A 110 4.087 -5.171 2.983 1.00 0.00 N ATOM 1668 CA LEU A 110 4.487 -5.041 1.586 1.00 0.00 C ATOM 1669 C LEU A 110 5.968 -4.693 1.474 1.00 0.00 C ATOM 1670 O LEU A 110 6.768 -5.489 0.983 1.00 0.00 O ATOM 1671 CB LEU A 110 3.646 -3.969 0.892 1.00 0.00 C ATOM 1672 CG LEU A 110 2.133 -4.184 0.914 1.00 0.00 C ATOM 1673 CD1 LEU A 110 1.404 -2.886 0.601 1.00 0.00 C ATOM 1674 CD2 LEU A 110 1.734 -5.272 -0.072 1.00 0.00 C ATOM 0 H LEU A 110 3.650 -4.337 3.376 1.00 0.00 H new ATOM 0 HA LEU A 110 4.320 -6.000 1.095 1.00 0.00 H new ATOM 0 HB2 LEU A 110 3.863 -3.008 1.358 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.968 -3.900 -0.147 1.00 0.00 H new ATOM 0 HG LEU A 110 1.846 -4.506 1.915 1.00 0.00 H new ATOM 0 HD11 LEU A 110 0.328 -3.059 0.621 1.00 0.00 H new ATOM 0 HD12 LEU A 110 1.665 -2.134 1.345 1.00 0.00 H new ATOM 0 HD13 LEU A 110 1.696 -2.534 -0.388 1.00 0.00 H new ATOM 0 HD21 LEU A 110 0.653 -5.411 -0.042 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.035 -4.979 -1.078 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.228 -6.206 0.197 1.00 0.00 H new ATOM 1686 N MET A 111 6.327 -3.499 1.933 1.00 0.00 N ATOM 1687 CA MET A 111 7.714 -3.047 1.887 1.00 0.00 C ATOM 1688 C MET A 111 8.655 -4.129 2.406 1.00 0.00 C ATOM 1689 O MET A 111 9.852 -4.111 2.124 1.00 0.00 O ATOM 1690 CB MET A 111 7.883 -1.769 2.712 1.00 0.00 C ATOM 1691 CG MET A 111 7.724 -1.985 4.208 1.00 0.00 C ATOM 1692 SD MET A 111 9.184 -2.729 4.961 1.00 0.00 S ATOM 1693 CE MET A 111 10.449 -1.559 4.475 1.00 0.00 C ATOM 0 H MET A 111 5.678 -2.827 2.341 1.00 0.00 H new ATOM 0 HA MET A 111 7.968 -2.837 0.848 1.00 0.00 H new ATOM 0 HB2 MET A 111 8.869 -1.348 2.517 1.00 0.00 H new ATOM 0 HB3 MET A 111 7.151 -1.033 2.380 1.00 0.00 H new ATOM 0 HG2 MET A 111 7.519 -1.029 4.689 1.00 0.00 H new ATOM 0 HG3 MET A 111 6.860 -2.625 4.389 1.00 0.00 H new ATOM 0 HE1 MET A 111 11.423 -2.048 4.492 1.00 0.00 H new ATOM 0 HE2 MET A 111 10.242 -1.197 3.468 1.00 0.00 H new ATOM 0 HE3 MET A 111 10.453 -0.718 5.169 1.00 0.00 H new ATOM 1703 N GLY A 112 8.105 -5.071 3.167 1.00 0.00 N ATOM 1704 CA GLY A 112 8.912 -6.147 3.713 1.00 0.00 C ATOM 1705 C GLY A 112 9.891 -6.709 2.702 1.00 0.00 C ATOM 1706 O GLY A 112 11.011 -7.082 3.051 1.00 0.00 O ATOM 0 H GLY A 112 7.116 -5.108 3.415 1.00 0.00 H new ATOM 0 HA2 GLY A 112 9.461 -5.781 4.581 1.00 0.00 H new ATOM 0 HA3 GLY A 112 8.258 -6.946 4.063 1.00 0.00 H new ATOM 1710 N LYS A 113 9.468 -6.771 1.444 1.00 0.00 N ATOM 1711 CA LYS A 113 10.314 -7.293 0.376 1.00 0.00 C ATOM 1712 C LYS A 113 11.655 -6.566 0.342 1.00 0.00 C ATOM 1713 O LYS A 113 12.698 -7.178 0.117 1.00 0.00 O ATOM 1714 CB LYS A 113 9.611 -7.152 -0.975 1.00 0.00 C ATOM 1715 CG LYS A 113 8.442 -8.107 -1.155 1.00 0.00 C ATOM 1716 CD LYS A 113 8.888 -9.424 -1.767 1.00 0.00 C ATOM 1717 CE LYS A 113 9.087 -9.302 -3.269 1.00 0.00 C ATOM 1718 NZ LYS A 113 7.799 -9.079 -3.983 1.00 0.00 N ATOM 0 H LYS A 113 8.544 -6.466 1.138 1.00 0.00 H new ATOM 0 HA LYS A 113 10.497 -8.349 0.574 1.00 0.00 H new ATOM 0 HB2 LYS A 113 9.253 -6.128 -1.084 1.00 0.00 H new ATOM 0 HB3 LYS A 113 10.335 -7.323 -1.772 1.00 0.00 H new ATOM 0 HG2 LYS A 113 7.972 -8.294 -0.190 1.00 0.00 H new ATOM 0 HG3 LYS A 113 7.688 -7.645 -1.793 1.00 0.00 H new ATOM 0 HD2 LYS A 113 9.819 -9.746 -1.301 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.144 -10.193 -1.559 1.00 0.00 H new ATOM 0 HE2 LYS A 113 9.767 -8.476 -3.479 1.00 0.00 H new ATOM 0 HE3 LYS A 113 9.560 -10.208 -3.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 7.904 -9.350 -4.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 7.054 -9.657 -3.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 7.538 -8.074 -3.923 1.00 0.00 H new ATOM 1732 N GLY A 114 11.619 -5.256 0.568 1.00 0.00 N ATOM 1733 CA GLY A 114 12.837 -4.469 0.559 1.00 0.00 C ATOM 1734 C GLY A 114 13.660 -4.659 1.819 1.00 0.00 C ATOM 1735 O GLY A 114 14.125 -3.690 2.416 1.00 0.00 O ATOM 0 H GLY A 114 10.768 -4.727 0.757 1.00 0.00 H new ATOM 0 HA2 GLY A 114 13.437 -4.744 -0.308 1.00 0.00 H new ATOM 0 HA3 GLY A 114 12.584 -3.414 0.450 1.00 0.00 H new ATOM 1739 N MET A 115 13.840 -5.912 2.221 1.00 0.00 N ATOM 1740 CA MET A 115 14.612 -6.227 3.418 1.00 0.00 C ATOM 1741 C MET A 115 16.002 -6.734 3.051 1.00 0.00 C ATOM 1742 O MET A 115 16.352 -6.822 1.873 1.00 0.00 O ATOM 1743 CB MET A 115 13.881 -7.273 4.262 1.00 0.00 C ATOM 1744 CG MET A 115 12.934 -6.672 5.289 1.00 0.00 C ATOM 1745 SD MET A 115 13.751 -6.293 6.851 1.00 0.00 S ATOM 1746 CE MET A 115 12.377 -5.657 7.806 1.00 0.00 C ATOM 0 H MET A 115 13.462 -6.726 1.736 1.00 0.00 H new ATOM 0 HA MET A 115 14.721 -5.312 4.001 1.00 0.00 H new ATOM 0 HB2 MET A 115 13.317 -7.931 3.601 1.00 0.00 H new ATOM 0 HB3 MET A 115 14.617 -7.892 4.776 1.00 0.00 H new ATOM 0 HG2 MET A 115 12.495 -5.761 4.883 1.00 0.00 H new ATOM 0 HG3 MET A 115 12.114 -7.367 5.472 1.00 0.00 H new ATOM 0 HE1 MET A 115 12.724 -5.378 8.801 1.00 0.00 H new ATOM 0 HE2 MET A 115 11.962 -4.781 7.308 1.00 0.00 H new ATOM 0 HE3 MET A 115 11.607 -6.424 7.892 1.00 0.00 H new ATOM 1756 N LYS A 116 16.794 -7.066 4.065 1.00 0.00 N ATOM 1757 CA LYS A 116 18.147 -7.566 3.849 1.00 0.00 C ATOM 1758 C LYS A 116 19.013 -6.513 3.168 1.00 0.00 C ATOM 1759 O LYS A 116 19.739 -6.810 2.219 1.00 0.00 O ATOM 1760 CB LYS A 116 18.113 -8.839 3.000 1.00 0.00 C ATOM 1761 CG LYS A 116 17.342 -9.979 3.643 1.00 0.00 C ATOM 1762 CD LYS A 116 17.813 -11.330 3.131 1.00 0.00 C ATOM 1763 CE LYS A 116 17.236 -12.471 3.957 1.00 0.00 C ATOM 1764 NZ LYS A 116 15.832 -12.781 3.569 1.00 0.00 N ATOM 0 H LYS A 116 16.522 -6.998 5.046 1.00 0.00 H new ATOM 0 HA LYS A 116 18.582 -7.796 4.822 1.00 0.00 H new ATOM 0 HB2 LYS A 116 17.666 -8.609 2.033 1.00 0.00 H new ATOM 0 HB3 LYS A 116 19.135 -9.165 2.809 1.00 0.00 H new ATOM 0 HG2 LYS A 116 17.464 -9.937 4.725 1.00 0.00 H new ATOM 0 HG3 LYS A 116 16.278 -9.862 3.437 1.00 0.00 H new ATOM 0 HD2 LYS A 116 17.518 -11.448 2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 116 18.902 -11.372 3.161 1.00 0.00 H new ATOM 0 HE2 LYS A 116 17.853 -13.360 3.829 1.00 0.00 H new ATOM 0 HE3 LYS A 116 17.271 -12.208 5.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 15.475 -13.563 4.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 15.238 -11.940 3.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 15.802 -13.057 2.567 1.00 0.00 H new ATOM 1778 N ARG A 117 18.935 -5.280 3.660 1.00 0.00 N ATOM 1779 CA ARG A 117 19.714 -4.183 3.100 1.00 0.00 C ATOM 1780 C ARG A 117 21.209 -4.434 3.269 1.00 0.00 C ATOM 1781 O ARG A 117 21.619 -5.474 3.785 1.00 0.00 O ATOM 1782 CB ARG A 117 19.329 -2.862 3.770 1.00 0.00 C ATOM 1783 CG ARG A 117 18.106 -2.201 3.156 1.00 0.00 C ATOM 1784 CD ARG A 117 17.623 -1.031 3.999 1.00 0.00 C ATOM 1785 NE ARG A 117 18.662 -0.018 4.174 1.00 0.00 N ATOM 1786 CZ ARG A 117 18.660 0.872 5.160 1.00 0.00 C ATOM 1787 NH1 ARG A 117 17.682 0.874 6.055 1.00 0.00 N ATOM 1788 NH2 ARG A 117 19.640 1.763 5.252 1.00 0.00 N ATOM 0 H ARG A 117 18.340 -5.017 4.445 1.00 0.00 H new ATOM 0 HA ARG A 117 19.492 -4.121 2.035 1.00 0.00 H new ATOM 0 HB2 ARG A 117 19.141 -3.043 4.828 1.00 0.00 H new ATOM 0 HB3 ARG A 117 20.172 -2.174 3.709 1.00 0.00 H new ATOM 0 HG2 ARG A 117 18.345 -1.853 2.151 1.00 0.00 H new ATOM 0 HG3 ARG A 117 17.306 -2.934 3.057 1.00 0.00 H new ATOM 0 HD2 ARG A 117 16.751 -0.579 3.526 1.00 0.00 H new ATOM 0 HD3 ARG A 117 17.303 -1.395 4.975 1.00 0.00 H new ATOM 0 HE ARG A 117 19.430 0.007 3.503 1.00 0.00 H new ATOM 0 HH11 ARG A 117 16.928 0.191 5.988 1.00 0.00 H new ATOM 0 HH12 ARG A 117 17.684 1.559 6.811 1.00 0.00 H new ATOM 0 HH21 ARG A 117 20.394 1.764 4.566 1.00 0.00 H new ATOM 0 HH22 ARG A 117 19.638 2.446 6.009 1.00 0.00 H new ATOM 1802 N VAL A 118 22.019 -3.477 2.829 1.00 0.00 N ATOM 1803 CA VAL A 118 23.468 -3.594 2.931 1.00 0.00 C ATOM 1804 C VAL A 118 23.902 -3.797 4.379 1.00 0.00 C ATOM 1805 O VAL A 118 24.697 -4.689 4.679 1.00 0.00 O ATOM 1806 CB VAL A 118 24.174 -2.346 2.367 1.00 0.00 C ATOM 1807 CG1 VAL A 118 25.683 -2.474 2.514 1.00 0.00 C ATOM 1808 CG2 VAL A 118 23.789 -2.131 0.910 1.00 0.00 C ATOM 0 H VAL A 118 21.696 -2.611 2.398 1.00 0.00 H new ATOM 0 HA VAL A 118 23.757 -4.464 2.341 1.00 0.00 H new ATOM 0 HB VAL A 118 23.850 -1.476 2.938 1.00 0.00 H new ATOM 0 HG11 VAL A 118 26.165 -1.583 2.110 1.00 0.00 H new ATOM 0 HG12 VAL A 118 25.938 -2.578 3.569 1.00 0.00 H new ATOM 0 HG13 VAL A 118 26.029 -3.352 1.969 1.00 0.00 H new ATOM 0 HG21 VAL A 118 24.296 -1.246 0.527 1.00 0.00 H new ATOM 0 HG22 VAL A 118 24.084 -3.001 0.323 1.00 0.00 H new ATOM 0 HG23 VAL A 118 22.710 -1.992 0.835 1.00 0.00 H new ATOM 1818 N SER A 119 23.374 -2.966 5.271 1.00 0.00 N ATOM 1819 CA SER A 119 23.709 -3.053 6.688 1.00 0.00 C ATOM 1820 C SER A 119 22.542 -2.586 7.552 1.00 0.00 C ATOM 1821 O SER A 119 21.588 -1.987 7.056 1.00 0.00 O ATOM 1822 CB SER A 119 24.952 -2.212 6.992 1.00 0.00 C ATOM 1823 OG SER A 119 24.700 -0.835 6.780 1.00 0.00 O ATOM 0 H SER A 119 22.713 -2.225 5.038 1.00 0.00 H new ATOM 0 HA SER A 119 23.918 -4.097 6.923 1.00 0.00 H new ATOM 0 HB2 SER A 119 25.261 -2.374 8.025 1.00 0.00 H new ATOM 0 HB3 SER A 119 25.778 -2.536 6.358 1.00 0.00 H new ATOM 0 HG SER A 119 25.508 -0.320 6.983 1.00 0.00 H new ATOM 1829 N GLY A 120 22.625 -2.865 8.849 1.00 0.00 N ATOM 1830 CA GLY A 120 21.570 -2.468 9.762 1.00 0.00 C ATOM 1831 C GLY A 120 21.995 -2.560 11.214 1.00 0.00 C ATOM 1832 O GLY A 120 23.171 -2.426 11.550 1.00 0.00 O ATOM 0 H GLY A 120 23.404 -3.359 9.284 1.00 0.00 H new ATOM 0 HA2 GLY A 120 21.267 -1.445 9.539 1.00 0.00 H new ATOM 0 HA3 GLY A 120 20.697 -3.101 9.601 1.00 0.00 H new ATOM 1836 N PRO A 121 21.021 -2.794 12.107 1.00 0.00 N ATOM 1837 CA PRO A 121 21.275 -2.908 13.546 1.00 0.00 C ATOM 1838 C PRO A 121 22.038 -4.180 13.900 1.00 0.00 C ATOM 1839 O PRO A 121 22.367 -4.414 15.063 1.00 0.00 O ATOM 1840 CB PRO A 121 19.870 -2.941 14.153 1.00 0.00 C ATOM 1841 CG PRO A 121 19.000 -3.467 13.065 1.00 0.00 C ATOM 1842 CD PRO A 121 19.595 -2.965 11.779 1.00 0.00 C ATOM 0 HA PRO A 121 21.895 -2.092 13.917 1.00 0.00 H new ATOM 0 HB2 PRO A 121 19.834 -3.582 15.034 1.00 0.00 H new ATOM 0 HB3 PRO A 121 19.552 -1.948 14.469 1.00 0.00 H new ATOM 0 HG2 PRO A 121 18.970 -4.556 13.082 1.00 0.00 H new ATOM 0 HG3 PRO A 121 17.974 -3.118 13.183 1.00 0.00 H new ATOM 0 HD2 PRO A 121 19.452 -3.676 10.965 1.00 0.00 H new ATOM 0 HD3 PRO A 121 19.139 -2.026 11.465 1.00 0.00 H new ATOM 1850 N SER A 122 22.319 -4.997 12.890 1.00 0.00 N ATOM 1851 CA SER A 122 23.041 -6.247 13.096 1.00 0.00 C ATOM 1852 C SER A 122 24.536 -5.990 13.263 1.00 0.00 C ATOM 1853 O SER A 122 25.120 -5.174 12.549 1.00 0.00 O ATOM 1854 CB SER A 122 22.804 -7.197 11.921 1.00 0.00 C ATOM 1855 OG SER A 122 23.345 -6.671 10.722 1.00 0.00 O ATOM 0 H SER A 122 22.058 -4.816 11.921 1.00 0.00 H new ATOM 0 HA SER A 122 22.665 -6.709 14.009 1.00 0.00 H new ATOM 0 HB2 SER A 122 23.258 -8.165 12.135 1.00 0.00 H new ATOM 0 HB3 SER A 122 21.735 -7.367 11.797 1.00 0.00 H new ATOM 0 HG SER A 122 23.182 -7.298 9.987 1.00 0.00 H new ATOM 1861 N SER A 123 25.149 -6.691 14.211 1.00 0.00 N ATOM 1862 CA SER A 123 26.574 -6.537 14.475 1.00 0.00 C ATOM 1863 C SER A 123 27.397 -6.890 13.240 1.00 0.00 C ATOM 1864 O SER A 123 28.241 -6.111 12.800 1.00 0.00 O ATOM 1865 CB SER A 123 26.994 -7.420 15.652 1.00 0.00 C ATOM 1866 OG SER A 123 28.185 -6.938 16.251 1.00 0.00 O ATOM 0 H SER A 123 24.681 -7.371 14.809 1.00 0.00 H new ATOM 0 HA SER A 123 26.761 -5.493 14.728 1.00 0.00 H new ATOM 0 HB2 SER A 123 26.195 -7.447 16.393 1.00 0.00 H new ATOM 0 HB3 SER A 123 27.144 -8.443 15.308 1.00 0.00 H new ATOM 0 HG SER A 123 28.432 -7.518 17.001 1.00 0.00 H new ATOM 1872 N GLY A 124 27.143 -8.071 12.686 1.00 0.00 N ATOM 1873 CA GLY A 124 27.868 -8.507 11.506 1.00 0.00 C ATOM 1874 C GLY A 124 28.224 -9.980 11.558 1.00 0.00 C ATOM 1875 O GLY A 124 27.527 -10.816 10.982 1.00 0.00 O ATOM 0 H GLY A 124 26.449 -8.733 13.032 1.00 0.00 H new ATOM 0 HA2 GLY A 124 27.264 -8.313 10.620 1.00 0.00 H new ATOM 0 HA3 GLY A 124 28.780 -7.919 11.405 1.00 0.00 H new TER 1879 GLY A 124