USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 896 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 103 THR OG1 : rot -108:sc= 0.683 USER MOD Set 1.2: A 127 CYS SG : rot 154:sc= -0.835 USER MOD Set 2.1: A 105 THR OG1 : rot 134:sc= 1.08 USER MOD Set 2.2: A 108 THR OG1 : rot -76:sc= -1.25 USER MOD Set 3.1: A 9 ASN : amide:sc= -13.4! C(o=-21!,f=-15!) USER MOD Set 3.2: A 130 MET CE :methyl 178:sc= -7.62! (180deg=-6.3!) USER MOD Set 4.1: A 6 TYR OH : rot 118:sc= -4.92! USER MOD Set 4.2: A 133 HIS : no HD1:sc= -4.59! C(o=-9.5!,f=-9!) USER MOD Single : A 4 ASN : amide:sc= -0.0573 K(o=-0.057,f=-0.67) USER MOD Single : A 11 MET CE :methyl 165:sc= -6.32! (180deg=-7.34!) USER MOD Single : A 15 THR OG1 : rot 25:sc= 0.991 USER MOD Single : A 16 CYS SG : rot -89:sc= -5.35! USER MOD Single : A 17 GLN : amide:sc= -1.21 X(o=-1.2,f=-1.7) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -133:sc= -0.27 (180deg=-2.89!) USER MOD Single : A 27 SER OG : rot 43:sc= 0.311 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 15:sc= 1.07 USER MOD Single : A 41 ASN : amide:sc= -0.0194 X(o=-0.019,f=-0.17) USER MOD Single : A 43 THR OG1 : rot 180:sc= -1.77 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -5.02! C(o=-5!,f=-9!) USER MOD Single : A 64 THR OG1 : rot 180:sc= -3.61! USER MOD Single : A 68 GLN : amide:sc= -7.7! C(o=-7.7!,f=-4.3!) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot 53:sc= -6.64! USER MOD Single : A 71 SER OG : rot 51:sc= -4.16! USER MOD Single : A 76 SER OG : rot 140:sc= -2.26 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl -168:sc= -3.57! (180deg=-3.93!) USER MOD Single : A 89 THR OG1 : rot -16:sc= 0.936 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= -0.925 X(o=-0.93,f=-0.48!) USER MOD Single : A 101 THR OG1 : rot -120:sc= -0.154 USER MOD Single : A 104 LYS NZ :NH3+ 151:sc= -0.278 (180deg=-1.25!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= -1.72 X(o=-1.7,f=-2.2!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ -154:sc= -2.43 (180deg=-3.69!) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 64:sc= 0.219 USER MOD Single : A 137 SER OG : rot -40:sc= 0.0247 USER MOD Single : A 138 GLN : amide:sc=-0.00201 X(o=-0.002,f=0) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N TRP A 3 -16.566 14.377 1.158 1.00 0.00 N ATOM 21 CA TRP A 3 -16.391 13.154 0.295 1.00 0.00 C ATOM 22 C TRP A 3 -17.015 13.400 -1.089 1.00 0.00 C ATOM 23 O TRP A 3 -16.434 13.082 -2.087 1.00 0.00 O ATOM 24 CB TRP A 3 -17.114 11.975 0.888 1.00 0.00 C ATOM 25 CG TRP A 3 -16.272 11.174 1.841 1.00 0.00 C ATOM 26 CD1 TRP A 3 -16.714 10.033 2.362 1.00 0.00 C ATOM 27 CD2 TRP A 3 -14.907 11.373 2.394 1.00 0.00 C ATOM 28 NE1 TRP A 3 -15.766 9.500 3.201 1.00 0.00 N ATOM 29 CE2 TRP A 3 -14.636 10.277 3.258 1.00 0.00 C ATOM 30 CE3 TRP A 3 -13.883 12.360 2.253 1.00 0.00 C ATOM 31 CZ2 TRP A 3 -13.440 10.159 3.947 1.00 0.00 C ATOM 32 CZ3 TRP A 3 -12.679 12.221 2.956 1.00 0.00 C ATOM 33 CH2 TRP A 3 -12.462 11.123 3.797 1.00 0.00 C ATOM 0 HA TRP A 3 -15.322 12.953 0.224 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -18.003 12.329 1.410 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -17.455 11.325 0.082 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -17.677 9.590 2.156 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -15.887 8.630 3.720 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -14.037 13.211 1.606 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -13.273 9.315 4.600 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -11.909 12.970 2.848 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -11.527 11.029 4.330 1.00 0.00 H new ATOM 44 N ASN A 4 -18.248 13.923 -1.111 1.00 0.00 N ATOM 45 CA ASN A 4 -18.998 14.149 -2.410 1.00 0.00 C ATOM 46 C ASN A 4 -18.275 15.115 -3.335 1.00 0.00 C ATOM 47 O ASN A 4 -18.208 14.886 -4.527 1.00 0.00 O ATOM 48 CB ASN A 4 -20.394 14.688 -2.111 1.00 0.00 C ATOM 49 CG ASN A 4 -21.297 13.538 -1.656 1.00 0.00 C ATOM 50 OD1 ASN A 4 -21.311 12.486 -2.263 1.00 0.00 O ATOM 51 ND2 ASN A 4 -22.054 13.693 -0.605 1.00 0.00 N ATOM 0 H ASN A 4 -18.762 14.202 -0.275 1.00 0.00 H new ATOM 0 HA ASN A 4 -19.061 13.187 -2.919 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -20.342 15.453 -1.336 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -20.811 15.162 -3.000 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -22.657 12.931 -0.294 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -22.043 14.576 -0.094 1.00 0.00 H new ATOM 58 N ALA A 5 -17.731 16.174 -2.800 1.00 0.00 N ATOM 59 CA ALA A 5 -16.957 17.179 -3.663 1.00 0.00 C ATOM 60 C ALA A 5 -15.747 16.444 -4.251 1.00 0.00 C ATOM 61 O ALA A 5 -15.234 16.791 -5.317 1.00 0.00 O ATOM 62 CB ALA A 5 -16.491 18.355 -2.796 1.00 0.00 C ATOM 0 H ALA A 5 -17.776 16.406 -1.808 1.00 0.00 H new ATOM 0 HA ALA A 5 -17.588 17.573 -4.460 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -15.942 19.066 -3.413 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -17.358 18.849 -2.357 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -15.842 17.987 -2.002 1.00 0.00 H new ATOM 68 N TYR A 6 -15.316 15.400 -3.578 1.00 0.00 N ATOM 69 CA TYR A 6 -14.189 14.578 -4.073 1.00 0.00 C ATOM 70 C TYR A 6 -14.740 13.666 -5.116 1.00 0.00 C ATOM 71 O TYR A 6 -14.102 13.405 -6.104 1.00 0.00 O ATOM 72 CB TYR A 6 -13.586 13.830 -2.895 1.00 0.00 C ATOM 73 CG TYR A 6 -13.327 14.828 -1.761 1.00 0.00 C ATOM 74 CD1 TYR A 6 -13.114 16.205 -2.037 1.00 0.00 C ATOM 75 CD2 TYR A 6 -13.355 14.392 -0.465 1.00 0.00 C ATOM 76 CE1 TYR A 6 -12.938 17.106 -1.006 1.00 0.00 C ATOM 77 CE2 TYR A 6 -13.164 15.301 0.580 1.00 0.00 C ATOM 78 CZ TYR A 6 -12.962 16.662 0.302 1.00 0.00 C ATOM 79 OH TYR A 6 -12.807 17.556 1.322 1.00 0.00 O ATOM 0 H TYR A 6 -15.712 15.087 -2.692 1.00 0.00 H new ATOM 0 HA TYR A 6 -13.392 15.173 -4.518 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -14.263 13.044 -2.560 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -12.656 13.345 -3.191 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -13.090 16.549 -3.060 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -13.524 13.347 -0.249 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -12.782 18.153 -1.221 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -13.172 14.955 1.603 1.00 0.00 H new ATOM 0 HH TYR A 6 -13.614 17.561 1.878 1.00 0.00 H new ATOM 89 N ILE A 7 -15.989 13.269 -4.942 1.00 0.00 N ATOM 90 CA ILE A 7 -16.676 12.462 -5.989 1.00 0.00 C ATOM 91 C ILE A 7 -16.956 13.418 -7.168 1.00 0.00 C ATOM 92 O ILE A 7 -17.217 12.984 -8.277 1.00 0.00 O ATOM 93 CB ILE A 7 -18.006 11.915 -5.539 1.00 0.00 C ATOM 94 CG1 ILE A 7 -17.868 11.154 -4.216 1.00 0.00 C ATOM 95 CG2 ILE A 7 -18.546 10.989 -6.626 1.00 0.00 C ATOM 96 CD1 ILE A 7 -16.919 9.969 -4.383 1.00 0.00 C ATOM 0 H ILE A 7 -16.552 13.474 -4.117 1.00 0.00 H new ATOM 0 HA ILE A 7 -16.037 11.616 -6.241 1.00 0.00 H new ATOM 0 HB ILE A 7 -18.697 12.742 -5.374 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -17.493 11.823 -3.441 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -18.846 10.802 -3.887 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -19.509 10.585 -6.314 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -18.670 11.549 -7.553 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -17.845 10.171 -6.788 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -16.830 9.438 -3.435 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -17.311 9.293 -5.143 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -15.937 10.330 -4.690 1.00 0.00 H new ATOM 108 N ASP A 8 -16.905 14.735 -6.907 1.00 0.00 N ATOM 109 CA ASP A 8 -17.163 15.726 -7.945 1.00 0.00 C ATOM 110 C ASP A 8 -15.984 15.767 -8.874 1.00 0.00 C ATOM 111 O ASP A 8 -16.164 15.772 -10.060 1.00 0.00 O ATOM 112 CB ASP A 8 -17.496 17.070 -7.282 1.00 0.00 C ATOM 113 CG ASP A 8 -19.011 17.177 -7.071 1.00 0.00 C ATOM 114 OD1 ASP A 8 -19.741 16.967 -8.025 1.00 0.00 O ATOM 115 OD2 ASP A 8 -19.414 17.469 -5.954 1.00 0.00 O ATOM 0 H ASP A 8 -16.689 15.128 -5.991 1.00 0.00 H new ATOM 0 HA ASP A 8 -18.028 15.467 -8.555 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -16.979 17.154 -6.326 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.147 17.892 -7.907 1.00 0.00 H new ATOM 120 N ASN A 9 -14.762 15.673 -8.349 1.00 0.00 N ATOM 121 CA ASN A 9 -13.564 15.555 -9.229 1.00 0.00 C ATOM 122 C ASN A 9 -13.751 14.272 -9.942 1.00 0.00 C ATOM 123 O ASN A 9 -13.772 14.161 -11.090 1.00 0.00 O ATOM 124 CB ASN A 9 -12.258 15.348 -8.339 1.00 0.00 C ATOM 125 CG ASN A 9 -11.207 14.284 -9.094 1.00 0.00 C ATOM 126 OD1 ASN A 9 -10.350 14.709 -9.839 1.00 0.00 O ATOM 127 ND2 ASN A 9 -11.304 12.867 -8.874 1.00 0.00 N ATOM 0 H ASN A 9 -14.562 15.675 -7.349 1.00 0.00 H new ATOM 0 HA ASN A 9 -13.458 16.433 -9.867 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -11.764 16.306 -8.177 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -12.535 14.962 -7.358 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -10.657 12.233 -9.342 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -12.020 12.496 -8.250 1.00 0.00 H new ATOM 134 N LEU A 10 -13.818 13.316 -9.123 1.00 0.00 N ATOM 135 CA LEU A 10 -13.924 11.937 -9.424 1.00 0.00 C ATOM 136 C LEU A 10 -14.674 11.663 -10.680 1.00 0.00 C ATOM 137 O LEU A 10 -14.272 10.814 -11.451 1.00 0.00 O ATOM 138 CB LEU A 10 -14.516 11.352 -8.124 1.00 0.00 C ATOM 139 CG LEU A 10 -13.394 10.871 -7.108 1.00 0.00 C ATOM 140 CD1 LEU A 10 -14.051 10.161 -5.935 1.00 0.00 C ATOM 141 CD2 LEU A 10 -12.377 9.892 -7.745 1.00 0.00 C ATOM 0 H LEU A 10 -13.799 13.483 -8.117 1.00 0.00 H new ATOM 0 HA LEU A 10 -12.977 11.458 -9.670 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -15.140 12.105 -7.642 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -15.164 10.511 -8.370 1.00 0.00 H new ATOM 0 HG LEU A 10 -12.853 11.764 -6.794 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -13.284 9.829 -5.235 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -14.732 10.846 -5.430 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -14.609 9.298 -6.298 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -11.637 9.601 -7.000 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -12.900 9.005 -8.102 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -11.877 10.380 -8.582 1.00 0.00 H new ATOM 153 N MET A 11 -15.677 12.391 -10.920 1.00 0.00 N ATOM 154 CA MET A 11 -16.432 12.235 -12.197 1.00 0.00 C ATOM 155 C MET A 11 -16.025 13.435 -13.195 1.00 0.00 C ATOM 156 O MET A 11 -15.947 13.297 -14.399 1.00 0.00 O ATOM 157 CB MET A 11 -17.926 12.124 -11.835 1.00 0.00 C ATOM 158 CG MET A 11 -18.557 13.438 -11.733 1.00 0.00 C ATOM 159 SD MET A 11 -19.733 13.677 -13.118 1.00 0.00 S ATOM 160 CE MET A 11 -18.673 13.170 -14.536 1.00 0.00 C ATOM 0 H MET A 11 -16.035 13.110 -10.291 1.00 0.00 H new ATOM 0 HA MET A 11 -16.186 11.328 -12.749 1.00 0.00 H new ATOM 0 HB2 MET A 11 -18.440 11.531 -12.591 1.00 0.00 H new ATOM 0 HB3 MET A 11 -18.033 11.595 -10.888 1.00 0.00 H new ATOM 0 HG2 MET A 11 -19.081 13.526 -10.781 1.00 0.00 H new ATOM 0 HG3 MET A 11 -17.796 14.218 -11.752 1.00 0.00 H new ATOM 0 HE1 MET A 11 -19.297 12.999 -15.414 1.00 0.00 H new ATOM 0 HE2 MET A 11 -17.952 13.958 -14.751 1.00 0.00 H new ATOM 0 HE3 MET A 11 -18.143 12.252 -14.284 1.00 0.00 H new ATOM 170 N ALA A 12 -15.811 14.569 -12.621 1.00 0.00 N ATOM 171 CA ALA A 12 -15.414 15.845 -13.315 1.00 0.00 C ATOM 172 C ALA A 12 -13.879 16.007 -13.586 1.00 0.00 C ATOM 173 O ALA A 12 -13.468 17.107 -13.944 1.00 0.00 O ATOM 174 CB ALA A 12 -15.887 17.024 -12.466 1.00 0.00 C ATOM 0 H ALA A 12 -15.900 14.686 -11.612 1.00 0.00 H new ATOM 0 HA ALA A 12 -15.887 15.813 -14.297 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -15.608 17.958 -12.953 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.971 16.982 -12.356 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -15.420 16.974 -11.482 1.00 0.00 H new ATOM 180 N ASP A 13 -12.996 15.026 -13.265 1.00 0.00 N ATOM 181 CA ASP A 13 -11.483 15.336 -13.358 1.00 0.00 C ATOM 182 C ASP A 13 -11.092 15.798 -14.818 1.00 0.00 C ATOM 183 O ASP A 13 -9.938 16.099 -15.075 1.00 0.00 O ATOM 184 CB ASP A 13 -10.581 14.109 -12.825 1.00 0.00 C ATOM 185 CG ASP A 13 -10.064 13.125 -13.878 1.00 0.00 C ATOM 186 OD1 ASP A 13 -9.812 13.529 -14.957 1.00 0.00 O ATOM 187 OD2 ASP A 13 -9.824 11.980 -13.514 1.00 0.00 O ATOM 0 H ASP A 13 -13.240 14.083 -12.962 1.00 0.00 H new ATOM 0 HA ASP A 13 -11.269 16.171 -12.692 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -9.722 14.523 -12.296 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -11.166 13.549 -12.095 1.00 0.00 H new ATOM 192 N GLY A 14 -12.062 15.862 -15.777 1.00 0.00 N ATOM 193 CA GLY A 14 -11.725 16.316 -17.226 1.00 0.00 C ATOM 194 C GLY A 14 -10.746 15.305 -17.886 1.00 0.00 C ATOM 195 O GLY A 14 -10.106 15.584 -18.891 1.00 0.00 O ATOM 0 H GLY A 14 -13.042 15.626 -15.620 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -12.639 16.387 -17.815 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -11.278 17.310 -17.210 1.00 0.00 H new ATOM 199 N THR A 15 -10.642 14.168 -17.284 1.00 0.00 N ATOM 200 CA THR A 15 -9.754 13.072 -17.720 1.00 0.00 C ATOM 201 C THR A 15 -10.256 11.725 -17.067 1.00 0.00 C ATOM 202 O THR A 15 -9.735 10.668 -17.374 1.00 0.00 O ATOM 203 CB THR A 15 -8.299 13.425 -17.316 1.00 0.00 C ATOM 204 OG1 THR A 15 -7.738 14.286 -18.302 1.00 0.00 O ATOM 205 CG2 THR A 15 -7.490 12.170 -17.242 1.00 0.00 C ATOM 0 H THR A 15 -11.177 13.940 -16.446 1.00 0.00 H new ATOM 0 HA THR A 15 -9.775 12.942 -18.802 1.00 0.00 H new ATOM 0 HB THR A 15 -8.296 13.922 -16.346 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.457 14.762 -18.767 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.466 12.413 -16.958 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.923 11.501 -16.498 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.490 11.679 -18.215 1.00 0.00 H new ATOM 213 N CYS A 16 -11.218 11.783 -16.131 1.00 0.00 N ATOM 214 CA CYS A 16 -11.667 10.591 -15.438 1.00 0.00 C ATOM 215 C CYS A 16 -12.781 9.896 -16.281 1.00 0.00 C ATOM 216 O CYS A 16 -13.205 10.381 -17.320 1.00 0.00 O ATOM 217 CB CYS A 16 -12.288 11.054 -14.072 1.00 0.00 C ATOM 218 SG CYS A 16 -14.057 11.292 -14.223 1.00 0.00 S ATOM 0 H CYS A 16 -11.689 12.642 -15.847 1.00 0.00 H new ATOM 0 HA CYS A 16 -10.840 9.897 -15.285 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -12.081 10.310 -13.303 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -11.818 11.983 -13.751 1.00 0.00 H new ATOM 0 HG CYS A 16 -14.300 12.515 -14.592 1.00 0.00 H new ATOM 224 N GLN A 17 -13.308 8.849 -15.724 1.00 0.00 N ATOM 225 CA GLN A 17 -14.475 8.123 -16.283 1.00 0.00 C ATOM 226 C GLN A 17 -15.180 7.515 -15.068 1.00 0.00 C ATOM 227 O GLN A 17 -16.375 7.668 -14.875 1.00 0.00 O ATOM 228 CB GLN A 17 -14.044 7.064 -17.260 1.00 0.00 C ATOM 229 CG GLN A 17 -15.201 6.752 -18.218 1.00 0.00 C ATOM 230 CD GLN A 17 -16.365 6.115 -17.447 1.00 0.00 C ATOM 231 OE1 GLN A 17 -17.381 6.745 -17.233 1.00 0.00 O ATOM 232 NE2 GLN A 17 -16.262 4.882 -17.025 1.00 0.00 N ATOM 0 H GLN A 17 -12.956 8.446 -14.856 1.00 0.00 H new ATOM 0 HA GLN A 17 -15.136 8.783 -16.845 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.174 7.404 -17.822 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -13.746 6.161 -16.727 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -15.536 7.667 -18.707 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -14.862 6.077 -19.003 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -15.409 4.351 -17.204 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -17.034 4.451 -16.517 1.00 0.00 H new ATOM 241 N ASP A 18 -14.381 6.897 -14.190 1.00 0.00 N ATOM 242 CA ASP A 18 -14.902 6.342 -12.904 1.00 0.00 C ATOM 243 C ASP A 18 -14.151 7.040 -11.790 1.00 0.00 C ATOM 244 O ASP A 18 -13.294 7.895 -12.041 1.00 0.00 O ATOM 245 CB ASP A 18 -14.778 4.817 -12.850 1.00 0.00 C ATOM 246 CG ASP A 18 -15.891 4.213 -11.957 1.00 0.00 C ATOM 247 OD1 ASP A 18 -16.937 4.838 -11.805 1.00 0.00 O ATOM 248 OD2 ASP A 18 -15.680 3.127 -11.450 1.00 0.00 O ATOM 0 H ASP A 18 -13.380 6.762 -14.330 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.971 6.531 -12.801 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -14.848 4.405 -13.857 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -13.799 4.539 -12.459 1.00 0.00 H new ATOM 253 N ALA A 19 -14.553 6.813 -10.583 1.00 0.00 N ATOM 254 CA ALA A 19 -13.992 7.582 -9.440 1.00 0.00 C ATOM 255 C ALA A 19 -14.472 6.963 -8.129 1.00 0.00 C ATOM 256 O ALA A 19 -15.676 6.808 -7.984 1.00 0.00 O ATOM 257 CB ALA A 19 -14.640 8.896 -9.595 1.00 0.00 C ATOM 0 H ALA A 19 -15.256 6.119 -10.330 1.00 0.00 H new ATOM 0 HA ALA A 19 -12.902 7.611 -9.425 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -14.304 9.563 -8.801 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -14.374 9.321 -10.563 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -15.722 8.777 -9.536 1.00 0.00 H new ATOM 263 N ALA A 20 -13.620 6.607 -7.146 1.00 0.00 N ATOM 264 CA ALA A 20 -14.268 6.026 -5.883 1.00 0.00 C ATOM 265 C ALA A 20 -13.464 6.081 -4.604 1.00 0.00 C ATOM 266 O ALA A 20 -12.475 5.408 -4.451 1.00 0.00 O ATOM 267 CB ALA A 20 -14.629 4.580 -6.117 1.00 0.00 C ATOM 0 H ALA A 20 -12.603 6.684 -7.157 1.00 0.00 H new ATOM 0 HA ALA A 20 -15.127 6.678 -5.724 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -15.089 4.170 -5.218 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -15.331 4.510 -6.948 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -13.728 4.014 -6.354 1.00 0.00 H new ATOM 273 N ILE A 21 -14.014 6.778 -3.624 1.00 0.00 N ATOM 274 CA ILE A 21 -13.417 6.765 -2.251 1.00 0.00 C ATOM 275 C ILE A 21 -13.961 5.466 -1.628 1.00 0.00 C ATOM 276 O ILE A 21 -15.098 5.086 -1.911 1.00 0.00 O ATOM 277 CB ILE A 21 -13.848 7.986 -1.461 1.00 0.00 C ATOM 278 CG1 ILE A 21 -13.429 9.230 -2.266 1.00 0.00 C ATOM 279 CG2 ILE A 21 -13.142 7.962 -0.079 1.00 0.00 C ATOM 280 CD1 ILE A 21 -13.713 10.495 -1.479 1.00 0.00 C ATOM 0 H ILE A 21 -14.851 7.353 -3.723 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.327 6.796 -2.260 1.00 0.00 H new ATOM 0 HB ILE A 21 -14.926 7.999 -1.298 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.367 9.175 -2.505 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -13.968 9.256 -3.213 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -13.444 8.835 0.499 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -13.424 7.056 0.458 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.062 7.977 -0.222 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.410 11.363 -2.064 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.780 10.557 -1.263 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -13.154 10.475 -0.544 1.00 0.00 H new ATOM 292 N VAL A 22 -13.169 4.732 -0.860 1.00 0.00 N ATOM 293 CA VAL A 22 -13.672 3.413 -0.339 1.00 0.00 C ATOM 294 C VAL A 22 -13.168 3.122 1.100 1.00 0.00 C ATOM 295 O VAL A 22 -11.982 2.982 1.306 1.00 0.00 O ATOM 296 CB VAL A 22 -13.135 2.319 -1.291 1.00 0.00 C ATOM 297 CG1 VAL A 22 -13.644 0.929 -0.860 1.00 0.00 C ATOM 298 CG2 VAL A 22 -13.604 2.622 -2.733 1.00 0.00 C ATOM 0 H VAL A 22 -12.221 4.984 -0.580 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.761 3.433 -0.301 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.046 2.317 -1.249 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.256 0.172 -1.542 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.303 0.715 0.153 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.734 0.916 -0.886 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -13.227 1.853 -3.407 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.693 2.632 -2.767 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.222 3.595 -3.043 1.00 0.00 H new ATOM 308 N GLY A 23 -14.085 2.990 2.091 1.00 0.00 N ATOM 309 CA GLY A 23 -13.657 2.650 3.510 1.00 0.00 C ATOM 310 C GLY A 23 -13.179 1.183 3.516 1.00 0.00 C ATOM 311 O GLY A 23 -13.929 0.272 3.786 1.00 0.00 O ATOM 0 H GLY A 23 -15.091 3.104 1.964 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.857 3.314 3.838 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.488 2.785 4.203 1.00 0.00 H new ATOM 315 N TYR A 24 -11.934 0.988 3.165 1.00 0.00 N ATOM 316 CA TYR A 24 -11.300 -0.374 3.048 1.00 0.00 C ATOM 317 C TYR A 24 -10.869 -0.969 4.447 1.00 0.00 C ATOM 318 O TYR A 24 -9.938 -1.764 4.504 1.00 0.00 O ATOM 319 CB TYR A 24 -10.052 -0.185 2.122 1.00 0.00 C ATOM 320 CG TYR A 24 -8.836 0.215 2.957 1.00 0.00 C ATOM 321 CD1 TYR A 24 -8.856 1.388 3.723 1.00 0.00 C ATOM 322 CD2 TYR A 24 -7.722 -0.611 2.983 1.00 0.00 C ATOM 323 CE1 TYR A 24 -7.749 1.727 4.506 1.00 0.00 C ATOM 324 CE2 TYR A 24 -6.616 -0.278 3.758 1.00 0.00 C ATOM 325 CZ TYR A 24 -6.625 0.896 4.522 1.00 0.00 C ATOM 326 OH TYR A 24 -5.529 1.226 5.295 1.00 0.00 O ATOM 0 H TYR A 24 -11.296 1.752 2.943 1.00 0.00 H new ATOM 0 HA TYR A 24 -12.015 -1.088 2.639 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -9.845 -1.110 1.584 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.257 0.580 1.374 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -9.725 2.029 3.708 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -7.713 -1.519 2.398 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.762 2.630 5.098 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -5.751 -0.924 3.771 1.00 0.00 H new ATOM 0 HH TYR A 24 -4.837 0.540 5.191 1.00 0.00 H new ATOM 336 N LYS A 25 -11.524 -0.587 5.545 1.00 0.00 N ATOM 337 CA LYS A 25 -11.152 -1.120 6.892 1.00 0.00 C ATOM 338 C LYS A 25 -11.338 -2.644 6.886 1.00 0.00 C ATOM 339 O LYS A 25 -11.380 -3.264 5.835 1.00 0.00 O ATOM 340 CB LYS A 25 -12.057 -0.485 7.939 1.00 0.00 C ATOM 341 CG LYS A 25 -11.570 0.919 8.249 1.00 0.00 C ATOM 342 CD LYS A 25 -12.034 1.850 7.172 1.00 0.00 C ATOM 343 CE LYS A 25 -12.006 3.262 7.710 1.00 0.00 C ATOM 344 NZ LYS A 25 -12.967 3.397 8.845 1.00 0.00 N ATOM 0 H LYS A 25 -12.301 0.074 5.549 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.114 -0.884 7.126 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.084 -0.452 7.575 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.059 -1.089 8.847 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.952 1.244 9.217 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.482 0.933 8.315 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.390 1.766 6.296 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.042 1.587 6.853 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.999 3.512 8.044 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.264 3.966 6.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.538 4.257 8.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.593 2.567 8.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.441 3.461 9.740 1.00 0.00 H new ATOM 358 N ASP A 26 -11.475 -3.248 8.058 1.00 0.00 N ATOM 359 CA ASP A 26 -11.702 -4.762 8.161 1.00 0.00 C ATOM 360 C ASP A 26 -12.760 -5.167 7.142 1.00 0.00 C ATOM 361 O ASP A 26 -12.530 -5.993 6.268 1.00 0.00 O ATOM 362 CB ASP A 26 -12.204 -5.156 9.562 1.00 0.00 C ATOM 363 CG ASP A 26 -13.058 -4.038 10.199 1.00 0.00 C ATOM 364 OD1 ASP A 26 -12.480 -3.134 10.779 1.00 0.00 O ATOM 365 OD2 ASP A 26 -14.273 -4.112 10.095 1.00 0.00 O ATOM 0 H ASP A 26 -11.441 -2.765 8.956 1.00 0.00 H new ATOM 0 HA ASP A 26 -10.755 -5.267 7.972 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -12.794 -6.070 9.493 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -11.352 -5.374 10.206 1.00 0.00 H new ATOM 370 N SER A 27 -13.895 -4.527 7.233 1.00 0.00 N ATOM 371 CA SER A 27 -14.987 -4.747 6.296 1.00 0.00 C ATOM 372 C SER A 27 -14.957 -3.543 5.349 1.00 0.00 C ATOM 373 O SER A 27 -15.142 -2.422 5.803 1.00 0.00 O ATOM 374 CB SER A 27 -16.303 -4.796 7.053 1.00 0.00 C ATOM 375 OG SER A 27 -16.324 -3.775 8.051 1.00 0.00 O ATOM 0 H SER A 27 -14.098 -3.836 7.956 1.00 0.00 H new ATOM 0 HA SER A 27 -14.887 -5.686 5.752 1.00 0.00 H new ATOM 0 HB2 SER A 27 -17.136 -4.660 6.363 1.00 0.00 H new ATOM 0 HB3 SER A 27 -16.430 -5.774 7.517 1.00 0.00 H new ATOM 0 HG SER A 27 -15.957 -2.946 7.679 1.00 0.00 H new ATOM 381 N PRO A 28 -14.665 -3.780 4.065 1.00 0.00 N ATOM 382 CA PRO A 28 -14.543 -2.713 3.103 1.00 0.00 C ATOM 383 C PRO A 28 -15.899 -2.250 2.657 1.00 0.00 C ATOM 384 O PRO A 28 -16.879 -2.984 2.742 1.00 0.00 O ATOM 385 CB PRO A 28 -13.751 -3.325 1.964 1.00 0.00 C ATOM 386 CG PRO A 28 -13.928 -4.850 2.097 1.00 0.00 C ATOM 387 CD PRO A 28 -14.460 -5.117 3.490 1.00 0.00 C ATOM 0 HA PRO A 28 -14.050 -1.829 3.507 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -14.117 -2.972 1.000 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.699 -3.047 2.026 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -14.619 -5.225 1.342 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -12.979 -5.363 1.942 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -15.391 -5.683 3.458 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -13.753 -5.700 4.081 1.00 0.00 H new ATOM 395 N SER A 29 -15.963 -1.034 2.177 1.00 0.00 N ATOM 396 CA SER A 29 -17.229 -0.471 1.711 1.00 0.00 C ATOM 397 C SER A 29 -16.939 0.773 0.912 1.00 0.00 C ATOM 398 O SER A 29 -15.813 1.273 0.893 1.00 0.00 O ATOM 399 CB SER A 29 -18.122 -0.129 2.905 1.00 0.00 C ATOM 400 OG SER A 29 -17.479 0.851 3.711 1.00 0.00 O ATOM 0 H SER A 29 -15.162 -0.407 2.094 1.00 0.00 H new ATOM 0 HA SER A 29 -17.749 -1.198 1.088 1.00 0.00 H new ATOM 0 HB2 SER A 29 -19.085 0.245 2.557 1.00 0.00 H new ATOM 0 HB3 SER A 29 -18.321 -1.025 3.493 1.00 0.00 H new ATOM 0 HG SER A 29 -18.051 1.072 4.475 1.00 0.00 H new ATOM 406 N VAL A 30 -17.931 1.267 0.240 1.00 0.00 N ATOM 407 CA VAL A 30 -17.766 2.459 -0.581 1.00 0.00 C ATOM 408 C VAL A 30 -18.198 3.688 0.231 1.00 0.00 C ATOM 409 O VAL A 30 -19.382 3.947 0.408 1.00 0.00 O ATOM 410 CB VAL A 30 -18.596 2.250 -1.845 1.00 0.00 C ATOM 411 CG1 VAL A 30 -18.807 3.564 -2.609 1.00 0.00 C ATOM 412 CG2 VAL A 30 -17.830 1.264 -2.728 1.00 0.00 C ATOM 0 H VAL A 30 -18.872 0.873 0.234 1.00 0.00 H new ATOM 0 HA VAL A 30 -16.730 2.630 -0.873 1.00 0.00 H new ATOM 0 HB VAL A 30 -19.582 1.871 -1.576 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -19.402 3.374 -3.502 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -19.329 4.277 -1.970 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -17.840 3.976 -2.898 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -18.391 1.086 -3.646 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -16.853 1.679 -2.974 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -17.700 0.323 -2.194 1.00 0.00 H new ATOM 422 N TRP A 31 -17.227 4.445 0.711 1.00 0.00 N ATOM 423 CA TRP A 31 -17.519 5.679 1.509 1.00 0.00 C ATOM 424 C TRP A 31 -18.119 6.731 0.583 1.00 0.00 C ATOM 425 O TRP A 31 -18.941 7.543 0.981 1.00 0.00 O ATOM 426 CB TRP A 31 -16.201 6.184 2.133 1.00 0.00 C ATOM 427 CG TRP A 31 -15.978 5.493 3.459 1.00 0.00 C ATOM 428 CD1 TRP A 31 -16.639 4.381 3.878 1.00 0.00 C ATOM 429 CD2 TRP A 31 -15.058 5.839 4.538 1.00 0.00 C ATOM 430 NE1 TRP A 31 -16.213 4.048 5.119 1.00 0.00 N ATOM 431 CE2 TRP A 31 -15.238 4.912 5.585 1.00 0.00 C ATOM 432 CE3 TRP A 31 -14.103 6.860 4.715 1.00 0.00 C ATOM 433 CZ2 TRP A 31 -14.510 4.991 6.765 1.00 0.00 C ATOM 434 CZ3 TRP A 31 -13.360 6.940 5.907 1.00 0.00 C ATOM 435 CH2 TRP A 31 -13.571 6.011 6.932 1.00 0.00 C ATOM 0 H TRP A 31 -16.234 4.252 0.578 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.230 5.469 2.308 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -15.367 5.983 1.461 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -16.243 7.264 2.275 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -17.387 3.847 3.310 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -16.569 3.253 5.649 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -13.941 7.585 3.931 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -14.669 4.267 7.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -12.624 7.721 6.031 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -13.008 6.083 7.851 1.00 0.00 H new ATOM 446 N ALA A 32 -17.722 6.682 -0.662 1.00 0.00 N ATOM 447 CA ALA A 32 -18.234 7.609 -1.701 1.00 0.00 C ATOM 448 C ALA A 32 -17.803 7.022 -3.053 1.00 0.00 C ATOM 449 O ALA A 32 -16.734 6.462 -3.151 1.00 0.00 O ATOM 450 CB ALA A 32 -17.621 9.032 -1.503 1.00 0.00 C ATOM 0 H ALA A 32 -17.038 6.009 -1.008 1.00 0.00 H new ATOM 0 HA ALA A 32 -19.318 7.711 -1.644 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -18.004 9.703 -2.271 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -17.895 9.413 -0.519 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -16.535 8.974 -1.580 1.00 0.00 H new ATOM 456 N ALA A 33 -18.626 7.126 -4.094 1.00 0.00 N ATOM 457 CA ALA A 33 -18.218 6.550 -5.441 1.00 0.00 C ATOM 458 C ALA A 33 -19.235 6.907 -6.515 1.00 0.00 C ATOM 459 O ALA A 33 -20.433 6.885 -6.274 1.00 0.00 O ATOM 460 CB ALA A 33 -18.139 5.022 -5.353 1.00 0.00 C ATOM 0 H ALA A 33 -19.542 7.574 -4.071 1.00 0.00 H new ATOM 0 HA ALA A 33 -17.247 6.971 -5.701 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -17.846 4.616 -6.321 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -17.401 4.738 -4.603 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -19.114 4.623 -5.072 1.00 0.00 H new ATOM 466 N VAL A 34 -18.758 7.192 -7.729 1.00 0.00 N ATOM 467 CA VAL A 34 -19.688 7.505 -8.863 1.00 0.00 C ATOM 468 C VAL A 34 -20.614 6.256 -9.052 1.00 0.00 C ATOM 469 O VAL A 34 -20.135 5.206 -9.444 1.00 0.00 O ATOM 470 CB VAL A 34 -18.857 7.814 -10.145 1.00 0.00 C ATOM 471 CG1 VAL A 34 -19.808 8.153 -11.295 1.00 0.00 C ATOM 472 CG2 VAL A 34 -17.960 9.033 -9.855 1.00 0.00 C ATOM 0 H VAL A 34 -17.767 7.218 -7.968 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.300 8.384 -8.660 1.00 0.00 H new ATOM 0 HB VAL A 34 -18.250 6.951 -10.420 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -19.230 8.370 -12.193 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -20.468 7.306 -11.483 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -20.405 9.025 -11.028 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -17.368 9.268 -10.740 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -18.583 9.890 -9.597 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -17.294 8.805 -9.023 1.00 0.00 H new ATOM 482 N PRO A 35 -21.918 6.387 -8.686 1.00 0.00 N ATOM 483 CA PRO A 35 -22.867 5.255 -8.734 1.00 0.00 C ATOM 484 C PRO A 35 -23.304 4.918 -10.155 1.00 0.00 C ATOM 485 O PRO A 35 -23.453 5.790 -11.002 1.00 0.00 O ATOM 486 CB PRO A 35 -24.064 5.737 -7.902 1.00 0.00 C ATOM 487 CG PRO A 35 -23.996 7.291 -7.901 1.00 0.00 C ATOM 488 CD PRO A 35 -22.532 7.660 -8.223 1.00 0.00 C ATOM 0 HA PRO A 35 -22.415 4.340 -8.353 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -25.003 5.389 -8.333 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -24.015 5.345 -6.886 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -24.675 7.711 -8.643 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -24.294 7.693 -6.933 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -22.477 8.430 -8.993 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -22.019 8.051 -7.344 1.00 0.00 H new ATOM 496 N GLY A 36 -23.522 3.633 -10.407 1.00 0.00 N ATOM 497 CA GLY A 36 -23.965 3.169 -11.758 1.00 0.00 C ATOM 498 C GLY A 36 -22.757 2.697 -12.585 1.00 0.00 C ATOM 499 O GLY A 36 -22.927 2.118 -13.653 1.00 0.00 O ATOM 0 H GLY A 36 -23.407 2.888 -9.720 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -24.682 2.355 -11.653 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -24.476 3.979 -12.278 1.00 0.00 H new ATOM 503 N LYS A 37 -21.531 2.963 -12.115 1.00 0.00 N ATOM 504 CA LYS A 37 -20.319 2.561 -12.879 1.00 0.00 C ATOM 505 C LYS A 37 -19.824 1.167 -12.457 1.00 0.00 C ATOM 506 O LYS A 37 -20.157 0.184 -13.104 1.00 0.00 O ATOM 507 CB LYS A 37 -19.226 3.593 -12.651 1.00 0.00 C ATOM 508 CG LYS A 37 -19.406 4.730 -13.646 1.00 0.00 C ATOM 509 CD LYS A 37 -20.617 5.581 -13.248 1.00 0.00 C ATOM 510 CE LYS A 37 -21.848 5.148 -14.054 1.00 0.00 C ATOM 511 NZ LYS A 37 -22.166 6.188 -15.073 1.00 0.00 N ATOM 0 H LYS A 37 -21.343 3.442 -11.234 1.00 0.00 H new ATOM 0 HA LYS A 37 -20.574 2.513 -13.938 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -19.274 3.974 -11.631 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -18.244 3.136 -12.775 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -18.509 5.348 -13.672 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -19.546 4.329 -14.650 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -20.814 5.473 -12.181 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -20.406 6.635 -13.428 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -21.659 4.192 -14.542 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -22.699 5.003 -13.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -23.001 5.895 -15.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -22.364 7.091 -14.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -21.356 6.305 -15.714 1.00 0.00 H new ATOM 525 N THR A 38 -18.994 1.068 -11.401 1.00 0.00 N ATOM 526 CA THR A 38 -18.452 -0.282 -11.003 1.00 0.00 C ATOM 527 C THR A 38 -17.769 -0.249 -9.590 1.00 0.00 C ATOM 528 O THR A 38 -17.810 -1.232 -8.863 1.00 0.00 O ATOM 529 CB THR A 38 -17.439 -0.690 -12.114 1.00 0.00 C ATOM 530 OG1 THR A 38 -18.152 -1.259 -13.203 1.00 0.00 O ATOM 531 CG2 THR A 38 -16.394 -1.709 -11.620 1.00 0.00 C ATOM 0 H THR A 38 -18.686 1.850 -10.823 1.00 0.00 H new ATOM 0 HA THR A 38 -19.259 -1.009 -10.917 1.00 0.00 H new ATOM 0 HB THR A 38 -16.905 0.211 -12.415 1.00 0.00 H new ATOM 0 HG1 THR A 38 -19.105 -1.048 -13.116 1.00 0.00 H new ATOM 0 HG21 THR A 38 -15.714 -1.957 -12.435 1.00 0.00 H new ATOM 0 HG22 THR A 38 -15.828 -1.278 -10.794 1.00 0.00 H new ATOM 0 HG23 THR A 38 -16.899 -2.613 -11.281 1.00 0.00 H new ATOM 539 N PHE A 39 -17.114 0.847 -9.239 1.00 0.00 N ATOM 540 CA PHE A 39 -16.376 0.937 -7.906 1.00 0.00 C ATOM 541 C PHE A 39 -17.296 0.851 -6.718 1.00 0.00 C ATOM 542 O PHE A 39 -16.956 0.251 -5.726 1.00 0.00 O ATOM 543 CB PHE A 39 -15.667 2.256 -7.827 1.00 0.00 C ATOM 544 CG PHE A 39 -14.669 2.428 -8.979 1.00 0.00 C ATOM 545 CD1 PHE A 39 -14.339 1.352 -9.845 1.00 0.00 C ATOM 546 CD2 PHE A 39 -14.067 3.671 -9.168 1.00 0.00 C ATOM 547 CE1 PHE A 39 -13.428 1.542 -10.868 1.00 0.00 C ATOM 548 CE2 PHE A 39 -13.157 3.852 -10.187 1.00 0.00 C ATOM 549 CZ PHE A 39 -12.835 2.784 -11.044 1.00 0.00 C ATOM 0 H PHE A 39 -17.055 1.687 -9.814 1.00 0.00 H new ATOM 0 HA PHE A 39 -15.688 0.092 -7.871 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -16.397 3.065 -7.853 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -15.142 2.331 -6.875 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -14.800 0.385 -9.705 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -14.314 4.494 -8.514 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -13.179 0.725 -11.529 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -12.690 4.816 -10.328 1.00 0.00 H new ATOM 0 HZ PHE A 39 -12.123 2.931 -11.843 1.00 0.00 H new ATOM 559 N VAL A 40 -18.435 1.475 -6.803 1.00 0.00 N ATOM 560 CA VAL A 40 -19.420 1.473 -5.669 1.00 0.00 C ATOM 561 C VAL A 40 -19.800 0.015 -5.336 1.00 0.00 C ATOM 562 O VAL A 40 -20.236 -0.285 -4.227 1.00 0.00 O ATOM 563 CB VAL A 40 -20.663 2.298 -6.060 1.00 0.00 C ATOM 564 CG1 VAL A 40 -21.098 1.914 -7.464 1.00 0.00 C ATOM 565 CG2 VAL A 40 -21.803 2.038 -5.055 1.00 0.00 C ATOM 0 H VAL A 40 -18.738 1.999 -7.624 1.00 0.00 H new ATOM 0 HA VAL A 40 -18.977 1.929 -4.784 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.419 3.360 -6.039 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.977 2.495 -7.744 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -20.289 2.119 -8.165 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -21.341 0.852 -7.492 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -22.678 2.624 -5.337 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -22.059 0.978 -5.061 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -21.480 2.328 -4.055 1.00 0.00 H new ATOM 575 N ASN A 41 -19.601 -0.897 -6.277 1.00 0.00 N ATOM 576 CA ASN A 41 -19.894 -2.318 -6.019 1.00 0.00 C ATOM 577 C ASN A 41 -18.592 -2.988 -5.531 1.00 0.00 C ATOM 578 O ASN A 41 -18.371 -4.177 -5.746 1.00 0.00 O ATOM 579 CB ASN A 41 -20.385 -2.977 -7.296 1.00 0.00 C ATOM 580 CG ASN A 41 -21.915 -2.867 -7.381 1.00 0.00 C ATOM 581 OD1 ASN A 41 -22.617 -3.331 -6.503 1.00 0.00 O ATOM 582 ND2 ASN A 41 -22.462 -2.275 -8.407 1.00 0.00 N ATOM 0 H ASN A 41 -19.245 -0.695 -7.211 1.00 0.00 H new ATOM 0 HA ASN A 41 -20.672 -2.422 -5.262 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -19.928 -2.499 -8.162 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -20.085 -4.025 -7.315 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.477 -2.202 -8.472 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -21.874 -1.885 -9.144 1.00 0.00 H new ATOM 589 N ILE A 42 -17.716 -2.209 -4.864 1.00 0.00 N ATOM 590 CA ILE A 42 -16.443 -2.751 -4.362 1.00 0.00 C ATOM 591 C ILE A 42 -16.745 -3.670 -3.144 1.00 0.00 C ATOM 592 O ILE A 42 -17.778 -3.578 -2.502 1.00 0.00 O ATOM 593 CB ILE A 42 -15.479 -1.556 -4.022 1.00 0.00 C ATOM 594 CG1 ILE A 42 -14.676 -1.222 -5.301 1.00 0.00 C ATOM 595 CG2 ILE A 42 -14.493 -1.914 -2.879 1.00 0.00 C ATOM 596 CD1 ILE A 42 -14.107 0.199 -5.231 1.00 0.00 C ATOM 0 H ILE A 42 -17.865 -1.220 -4.664 1.00 0.00 H new ATOM 0 HA ILE A 42 -15.936 -3.361 -5.110 1.00 0.00 H new ATOM 0 HB ILE A 42 -16.073 -0.706 -3.686 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.863 -1.938 -5.423 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.320 -1.318 -6.175 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -13.846 -1.061 -2.676 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -15.055 -2.165 -1.979 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.885 -2.768 -3.177 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.546 0.412 -6.141 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.924 0.914 -5.133 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.445 0.284 -4.369 1.00 0.00 H new ATOM 608 N THR A 43 -15.849 -4.561 -2.906 1.00 0.00 N ATOM 609 CA THR A 43 -15.954 -5.595 -1.822 1.00 0.00 C ATOM 610 C THR A 43 -14.513 -5.865 -1.285 1.00 0.00 C ATOM 611 O THR A 43 -13.587 -5.261 -1.781 1.00 0.00 O ATOM 612 CB THR A 43 -16.525 -6.851 -2.518 1.00 0.00 C ATOM 613 OG1 THR A 43 -15.791 -7.102 -3.709 1.00 0.00 O ATOM 614 CG2 THR A 43 -17.997 -6.607 -2.875 1.00 0.00 C ATOM 0 H THR A 43 -14.986 -4.631 -3.446 1.00 0.00 H new ATOM 0 HA THR A 43 -16.584 -5.295 -0.985 1.00 0.00 H new ATOM 0 HB THR A 43 -16.446 -7.708 -1.849 1.00 0.00 H new ATOM 0 HG1 THR A 43 -16.150 -7.899 -4.153 1.00 0.00 H new ATOM 0 HG21 THR A 43 -18.404 -7.491 -3.366 1.00 0.00 H new ATOM 0 HG22 THR A 43 -18.563 -6.404 -1.966 1.00 0.00 H new ATOM 0 HG23 THR A 43 -18.072 -5.752 -3.547 1.00 0.00 H new ATOM 622 N PRO A 44 -14.335 -6.789 -0.302 1.00 0.00 N ATOM 623 CA PRO A 44 -12.983 -7.105 0.215 1.00 0.00 C ATOM 624 C PRO A 44 -12.164 -7.926 -0.785 1.00 0.00 C ATOM 625 O PRO A 44 -11.004 -8.242 -0.541 1.00 0.00 O ATOM 626 CB PRO A 44 -13.237 -7.864 1.492 1.00 0.00 C ATOM 627 CG PRO A 44 -14.684 -8.422 1.406 1.00 0.00 C ATOM 628 CD PRO A 44 -15.417 -7.570 0.349 1.00 0.00 C ATOM 0 HA PRO A 44 -12.389 -6.207 0.383 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.517 -8.674 1.609 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -13.126 -7.211 2.358 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.678 -9.474 1.121 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -15.184 -8.356 2.372 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -15.945 -8.196 -0.371 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -16.159 -6.917 0.808 1.00 0.00 H new ATOM 636 N ALA A 45 -12.744 -8.223 -1.914 1.00 0.00 N ATOM 637 CA ALA A 45 -12.033 -8.970 -2.985 1.00 0.00 C ATOM 638 C ALA A 45 -11.254 -7.956 -3.796 1.00 0.00 C ATOM 639 O ALA A 45 -10.008 -7.925 -3.800 1.00 0.00 O ATOM 640 CB ALA A 45 -13.064 -9.654 -3.880 1.00 0.00 C ATOM 0 H ALA A 45 -13.706 -7.972 -2.143 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.367 -9.725 -2.567 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.552 -10.205 -4.669 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.662 -10.344 -3.285 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.715 -8.902 -4.326 1.00 0.00 H new ATOM 646 N GLU A 46 -11.986 -7.105 -4.465 1.00 0.00 N ATOM 647 CA GLU A 46 -11.345 -6.016 -5.301 1.00 0.00 C ATOM 648 C GLU A 46 -10.471 -5.136 -4.392 1.00 0.00 C ATOM 649 O GLU A 46 -9.436 -4.630 -4.809 1.00 0.00 O ATOM 650 CB GLU A 46 -12.404 -5.146 -6.055 1.00 0.00 C ATOM 651 CG GLU A 46 -13.713 -5.061 -5.300 1.00 0.00 C ATOM 652 CD GLU A 46 -14.763 -5.961 -5.967 1.00 0.00 C ATOM 653 OE1 GLU A 46 -14.571 -7.167 -5.963 1.00 0.00 O ATOM 654 OE2 GLU A 46 -15.737 -5.426 -6.473 1.00 0.00 O ATOM 0 H GLU A 46 -13.006 -7.108 -4.476 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.730 -6.490 -6.066 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -12.007 -4.142 -6.205 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -12.583 -5.569 -7.043 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -13.565 -5.366 -4.264 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -14.065 -4.030 -5.281 1.00 0.00 H new ATOM 661 N VAL A 47 -10.860 -5.007 -3.134 1.00 0.00 N ATOM 662 CA VAL A 47 -10.067 -4.235 -2.138 1.00 0.00 C ATOM 663 C VAL A 47 -9.001 -5.113 -1.487 1.00 0.00 C ATOM 664 O VAL A 47 -8.005 -4.606 -1.011 1.00 0.00 O ATOM 665 CB VAL A 47 -11.040 -3.544 -1.142 1.00 0.00 C ATOM 666 CG1 VAL A 47 -10.507 -3.470 0.238 1.00 0.00 C ATOM 667 CG2 VAL A 47 -11.145 -2.086 -1.541 1.00 0.00 C ATOM 0 H VAL A 47 -11.715 -5.419 -2.760 1.00 0.00 H new ATOM 0 HA VAL A 47 -9.503 -3.440 -2.626 1.00 0.00 H new ATOM 0 HB VAL A 47 -11.966 -4.118 -1.170 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.234 -2.977 0.883 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.317 -4.477 0.609 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.577 -2.901 0.239 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.822 -1.570 -0.860 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -10.159 -1.623 -1.492 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.529 -2.014 -2.559 1.00 0.00 H new ATOM 677 N GLY A 48 -9.175 -6.415 -1.501 1.00 0.00 N ATOM 678 CA GLY A 48 -8.130 -7.327 -0.920 1.00 0.00 C ATOM 679 C GLY A 48 -6.828 -7.134 -1.684 1.00 0.00 C ATOM 680 O GLY A 48 -5.748 -7.310 -1.142 1.00 0.00 O ATOM 0 H GLY A 48 -9.993 -6.886 -1.888 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -7.983 -7.107 0.137 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.456 -8.365 -0.987 1.00 0.00 H new ATOM 684 N VAL A 49 -6.935 -6.778 -2.947 1.00 0.00 N ATOM 685 CA VAL A 49 -5.709 -6.559 -3.799 1.00 0.00 C ATOM 686 C VAL A 49 -5.313 -5.073 -3.812 1.00 0.00 C ATOM 687 O VAL A 49 -4.136 -4.735 -3.737 1.00 0.00 O ATOM 688 CB VAL A 49 -5.962 -7.066 -5.227 1.00 0.00 C ATOM 689 CG1 VAL A 49 -6.948 -6.160 -5.981 1.00 0.00 C ATOM 690 CG2 VAL A 49 -4.640 -7.092 -5.961 1.00 0.00 C ATOM 0 H VAL A 49 -7.822 -6.628 -3.429 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.881 -7.124 -3.370 1.00 0.00 H new ATOM 0 HB VAL A 49 -6.401 -8.063 -5.176 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -7.103 -6.549 -6.987 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.900 -6.137 -5.450 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.541 -5.150 -6.041 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.796 -7.449 -6.979 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -4.220 -6.087 -5.990 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.950 -7.759 -5.444 1.00 0.00 H new ATOM 700 N LEU A 50 -6.288 -4.202 -3.859 1.00 0.00 N ATOM 701 CA LEU A 50 -6.032 -2.730 -3.825 1.00 0.00 C ATOM 702 C LEU A 50 -5.376 -2.326 -2.513 1.00 0.00 C ATOM 703 O LEU A 50 -4.806 -1.245 -2.401 1.00 0.00 O ATOM 704 CB LEU A 50 -7.369 -2.029 -3.921 1.00 0.00 C ATOM 705 CG LEU A 50 -7.753 -1.676 -5.337 1.00 0.00 C ATOM 706 CD1 LEU A 50 -9.282 -1.603 -5.415 1.00 0.00 C ATOM 707 CD2 LEU A 50 -7.178 -0.298 -5.663 1.00 0.00 C ATOM 0 H LEU A 50 -7.274 -4.456 -3.921 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.371 -2.459 -4.648 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -8.140 -2.669 -3.491 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -7.339 -1.119 -3.322 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.372 -2.419 -6.037 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -9.583 -1.349 -6.431 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.707 -2.569 -5.142 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -9.645 -0.839 -4.727 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.445 -0.025 -6.684 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.586 0.439 -4.971 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -6.093 -0.325 -5.567 1.00 0.00 H new ATOM 719 N VAL A 51 -5.512 -3.153 -1.517 1.00 0.00 N ATOM 720 CA VAL A 51 -4.975 -2.823 -0.162 1.00 0.00 C ATOM 721 C VAL A 51 -4.217 -4.039 0.439 1.00 0.00 C ATOM 722 O VAL A 51 -3.546 -3.904 1.450 1.00 0.00 O ATOM 723 CB VAL A 51 -6.199 -2.366 0.725 1.00 0.00 C ATOM 724 CG1 VAL A 51 -7.171 -1.512 -0.117 1.00 0.00 C ATOM 725 CG2 VAL A 51 -6.970 -3.582 1.279 1.00 0.00 C ATOM 0 H VAL A 51 -5.979 -4.058 -1.582 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.244 -2.016 -0.209 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.805 -1.783 1.557 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -8.012 -1.201 0.502 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.650 -0.630 -0.491 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.538 -2.101 -0.958 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.807 -3.236 1.886 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.346 -4.183 0.451 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.303 -4.187 1.893 1.00 0.00 H new ATOM 735 N GLY A 52 -4.308 -5.223 -0.199 1.00 0.00 N ATOM 736 CA GLY A 52 -3.581 -6.452 0.295 1.00 0.00 C ATOM 737 C GLY A 52 -2.147 -6.085 0.703 1.00 0.00 C ATOM 738 O GLY A 52 -1.427 -5.413 -0.025 1.00 0.00 O ATOM 0 H GLY A 52 -4.861 -5.373 -1.043 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -4.111 -6.881 1.145 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -3.562 -7.212 -0.486 1.00 0.00 H new ATOM 822 N PHE A 58 0.102 -8.702 -6.795 1.00 0.00 N ATOM 823 CA PHE A 58 -0.696 -7.829 -7.747 1.00 0.00 C ATOM 824 C PHE A 58 0.099 -6.766 -8.509 1.00 0.00 C ATOM 825 O PHE A 58 -0.381 -6.301 -9.529 1.00 0.00 O ATOM 826 CB PHE A 58 -1.866 -7.203 -7.037 1.00 0.00 C ATOM 827 CG PHE A 58 -1.425 -6.380 -5.872 1.00 0.00 C ATOM 828 CD1 PHE A 58 -1.297 -6.972 -4.615 1.00 0.00 C ATOM 829 CD2 PHE A 58 -1.174 -5.018 -6.036 1.00 0.00 C ATOM 830 CE1 PHE A 58 -0.911 -6.201 -3.521 1.00 0.00 C ATOM 831 CE2 PHE A 58 -0.794 -4.246 -4.941 1.00 0.00 C ATOM 832 CZ PHE A 58 -0.661 -4.838 -3.683 1.00 0.00 C ATOM 0 HA PHE A 58 -1.040 -8.517 -8.519 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.424 -6.578 -7.734 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -2.545 -7.984 -6.695 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -1.497 -8.026 -4.491 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.274 -4.563 -7.010 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -0.805 -6.658 -2.548 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -0.602 -3.190 -5.064 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.364 -4.240 -2.834 1.00 0.00 H new ATOM 842 N TYR A 59 1.284 -6.337 -8.070 1.00 0.00 N ATOM 843 CA TYR A 59 2.004 -5.277 -8.876 1.00 0.00 C ATOM 844 C TYR A 59 2.322 -5.753 -10.302 1.00 0.00 C ATOM 845 O TYR A 59 2.819 -4.975 -11.113 1.00 0.00 O ATOM 846 CB TYR A 59 3.296 -4.788 -8.204 1.00 0.00 C ATOM 847 CG TYR A 59 3.057 -4.328 -6.793 1.00 0.00 C ATOM 848 CD1 TYR A 59 2.057 -3.404 -6.531 1.00 0.00 C ATOM 849 CD2 TYR A 59 3.880 -4.785 -5.757 1.00 0.00 C ATOM 850 CE1 TYR A 59 1.868 -2.925 -5.225 1.00 0.00 C ATOM 851 CE2 TYR A 59 3.687 -4.317 -4.452 1.00 0.00 C ATOM 852 CZ TYR A 59 2.684 -3.385 -4.187 1.00 0.00 C ATOM 853 OH TYR A 59 2.499 -2.916 -2.899 1.00 0.00 O ATOM 0 H TYR A 59 1.760 -6.660 -7.228 1.00 0.00 H new ATOM 0 HA TYR A 59 1.310 -4.438 -8.927 1.00 0.00 H new ATOM 0 HB2 TYR A 59 4.031 -5.593 -8.203 1.00 0.00 H new ATOM 0 HB3 TYR A 59 3.720 -3.969 -8.785 1.00 0.00 H new ATOM 0 HD1 TYR A 59 1.423 -3.053 -7.332 1.00 0.00 H new ATOM 0 HD2 TYR A 59 4.664 -5.499 -5.965 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.092 -2.201 -5.022 1.00 0.00 H new ATOM 0 HE2 TYR A 59 4.315 -4.678 -3.651 1.00 0.00 H new ATOM 0 HH TYR A 59 3.150 -3.339 -2.300 1.00 0.00 H new ATOM 863 N VAL A 60 2.059 -7.002 -10.613 1.00 0.00 N ATOM 864 CA VAL A 60 2.353 -7.531 -11.967 1.00 0.00 C ATOM 865 C VAL A 60 1.076 -8.054 -12.643 1.00 0.00 C ATOM 866 O VAL A 60 0.953 -7.966 -13.862 1.00 0.00 O ATOM 867 CB VAL A 60 3.375 -8.671 -11.869 1.00 0.00 C ATOM 868 CG1 VAL A 60 4.780 -8.087 -11.968 1.00 0.00 C ATOM 869 CG2 VAL A 60 3.235 -9.426 -10.532 1.00 0.00 C ATOM 0 H VAL A 60 1.647 -7.679 -9.971 1.00 0.00 H new ATOM 0 HA VAL A 60 2.759 -6.718 -12.568 1.00 0.00 H new ATOM 0 HB VAL A 60 3.194 -9.373 -12.683 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.514 -8.890 -11.899 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.894 -7.572 -12.922 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.938 -7.380 -11.153 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.971 -10.229 -10.489 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.402 -8.736 -9.705 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.233 -9.848 -10.456 1.00 0.00 H new ATOM 879 N ASN A 61 0.118 -8.610 -11.878 1.00 0.00 N ATOM 880 CA ASN A 61 -1.116 -9.132 -12.510 1.00 0.00 C ATOM 881 C ASN A 61 -2.131 -8.004 -12.663 1.00 0.00 C ATOM 882 O ASN A 61 -2.789 -7.893 -13.694 1.00 0.00 O ATOM 883 CB ASN A 61 -1.689 -10.300 -11.697 1.00 0.00 C ATOM 884 CG ASN A 61 -1.947 -9.922 -10.255 1.00 0.00 C ATOM 885 OD1 ASN A 61 -2.704 -9.018 -9.967 1.00 0.00 O ATOM 886 ND2 ASN A 61 -1.355 -10.604 -9.319 1.00 0.00 N ATOM 0 H ASN A 61 0.164 -8.709 -10.864 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.877 -9.515 -13.502 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.619 -10.637 -12.154 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -0.995 -11.140 -11.732 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -1.526 -10.380 -8.339 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -0.720 -11.363 -9.565 1.00 0.00 H new ATOM 893 N GLY A 62 -2.240 -7.144 -11.661 1.00 0.00 N ATOM 894 CA GLY A 62 -3.170 -6.000 -11.742 1.00 0.00 C ATOM 895 C GLY A 62 -4.135 -5.987 -10.546 1.00 0.00 C ATOM 896 O GLY A 62 -4.539 -7.031 -10.050 1.00 0.00 O ATOM 0 H GLY A 62 -1.711 -7.204 -10.791 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -2.605 -5.069 -11.767 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -3.738 -6.054 -12.671 1.00 0.00 H new ATOM 900 N LEU A 63 -4.532 -4.789 -10.096 1.00 0.00 N ATOM 901 CA LEU A 63 -5.520 -4.690 -8.928 1.00 0.00 C ATOM 902 C LEU A 63 -6.903 -5.008 -9.458 1.00 0.00 C ATOM 903 O LEU A 63 -7.034 -5.561 -10.534 1.00 0.00 O ATOM 904 CB LEU A 63 -5.571 -3.266 -8.285 1.00 0.00 C ATOM 905 CG LEU A 63 -4.237 -2.807 -7.792 1.00 0.00 C ATOM 906 CD1 LEU A 63 -4.430 -1.380 -7.294 1.00 0.00 C ATOM 907 CD2 LEU A 63 -3.791 -3.697 -6.635 1.00 0.00 C ATOM 0 H LEU A 63 -4.223 -3.895 -10.477 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.190 -5.388 -8.159 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.947 -2.554 -9.019 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -6.278 -3.272 -7.455 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.482 -2.855 -8.576 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.482 -0.994 -6.921 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.780 -0.753 -8.114 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.167 -1.371 -6.491 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.818 -3.364 -6.274 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.519 -3.634 -5.826 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.717 -4.729 -6.978 1.00 0.00 H new ATOM 919 N THR A 64 -7.942 -4.641 -8.711 1.00 0.00 N ATOM 920 CA THR A 64 -9.311 -4.899 -9.125 1.00 0.00 C ATOM 921 C THR A 64 -10.198 -3.998 -8.330 1.00 0.00 C ATOM 922 O THR A 64 -10.165 -4.019 -7.115 1.00 0.00 O ATOM 923 CB THR A 64 -9.671 -6.346 -8.825 1.00 0.00 C ATOM 924 OG1 THR A 64 -9.215 -6.685 -7.528 1.00 0.00 O ATOM 925 CG2 THR A 64 -9.001 -7.239 -9.830 1.00 0.00 C ATOM 0 H THR A 64 -7.857 -4.163 -7.814 1.00 0.00 H new ATOM 0 HA THR A 64 -9.428 -4.719 -10.194 1.00 0.00 H new ATOM 0 HB THR A 64 -10.752 -6.472 -8.878 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.448 -7.617 -7.333 1.00 0.00 H new ATOM 0 HG21 THR A 64 -9.255 -8.278 -9.620 1.00 0.00 H new ATOM 0 HG22 THR A 64 -9.340 -6.978 -10.832 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.920 -7.110 -9.768 1.00 0.00 H new ATOM 933 N LEU A 65 -10.972 -3.208 -9.000 1.00 0.00 N ATOM 934 CA LEU A 65 -11.912 -2.269 -8.301 1.00 0.00 C ATOM 935 C LEU A 65 -13.280 -2.394 -8.935 1.00 0.00 C ATOM 936 O LEU A 65 -13.513 -1.925 -10.043 1.00 0.00 O ATOM 937 CB LEU A 65 -11.433 -0.821 -8.361 1.00 0.00 C ATOM 938 CG LEU A 65 -10.718 -0.506 -9.673 1.00 0.00 C ATOM 939 CD1 LEU A 65 -10.696 1.017 -9.868 1.00 0.00 C ATOM 940 CD2 LEU A 65 -9.277 -1.032 -9.606 1.00 0.00 C ATOM 0 H LEU A 65 -11.003 -3.163 -10.019 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.953 -2.543 -7.247 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.286 -0.152 -8.244 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.759 -0.628 -7.526 1.00 0.00 H new ATOM 0 HG LEU A 65 -11.238 -0.981 -10.505 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.188 1.257 -10.802 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.718 1.394 -9.904 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.166 1.483 -9.037 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.764 -0.808 -10.542 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -8.752 -0.551 -8.781 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.290 -2.110 -9.448 1.00 0.00 H new ATOM 952 N GLY A 66 -14.183 -3.068 -8.245 1.00 0.00 N ATOM 953 CA GLY A 66 -15.552 -3.294 -8.774 1.00 0.00 C ATOM 954 C GLY A 66 -15.489 -4.410 -9.821 1.00 0.00 C ATOM 955 O GLY A 66 -16.327 -4.490 -10.710 1.00 0.00 O ATOM 0 H GLY A 66 -14.013 -3.472 -7.324 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -16.230 -3.570 -7.966 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -15.942 -2.379 -9.219 1.00 0.00 H new ATOM 959 N GLY A 67 -14.479 -5.279 -9.722 1.00 0.00 N ATOM 960 CA GLY A 67 -14.326 -6.383 -10.699 1.00 0.00 C ATOM 961 C GLY A 67 -13.534 -5.889 -11.918 1.00 0.00 C ATOM 962 O GLY A 67 -13.443 -6.594 -12.917 1.00 0.00 O ATOM 0 H GLY A 67 -13.764 -5.250 -8.995 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -13.811 -7.224 -10.235 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -15.306 -6.743 -11.012 1.00 0.00 H new ATOM 966 N GLN A 68 -12.941 -4.671 -11.852 1.00 0.00 N ATOM 967 CA GLN A 68 -12.146 -4.163 -13.041 1.00 0.00 C ATOM 968 C GLN A 68 -10.661 -4.309 -12.757 1.00 0.00 C ATOM 969 O GLN A 68 -10.084 -3.563 -11.977 1.00 0.00 O ATOM 970 CB GLN A 68 -12.494 -2.709 -13.334 1.00 0.00 C ATOM 971 CG GLN A 68 -11.447 -2.002 -14.290 1.00 0.00 C ATOM 972 CD GLN A 68 -10.923 -2.966 -15.400 1.00 0.00 C ATOM 973 OE1 GLN A 68 -11.689 -3.699 -15.996 1.00 0.00 O ATOM 974 NE2 GLN A 68 -9.625 -2.989 -15.687 1.00 0.00 N ATOM 0 H GLN A 68 -12.981 -4.042 -11.050 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.401 -4.755 -13.920 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.483 -2.663 -13.790 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -12.550 -2.158 -12.395 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -11.911 -1.132 -14.755 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.606 -1.638 -13.700 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -8.981 -2.375 -15.188 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.273 -3.621 -16.406 1.00 0.00 H new ATOM 983 N LYS A 69 -10.054 -5.269 -13.391 1.00 0.00 N ATOM 984 CA LYS A 69 -8.621 -5.531 -13.207 1.00 0.00 C ATOM 985 C LYS A 69 -7.754 -4.445 -13.860 1.00 0.00 C ATOM 986 O LYS A 69 -7.568 -4.443 -15.074 1.00 0.00 O ATOM 987 CB LYS A 69 -8.302 -6.879 -13.850 1.00 0.00 C ATOM 988 CG LYS A 69 -7.403 -7.691 -12.929 1.00 0.00 C ATOM 989 CD LYS A 69 -7.775 -9.155 -13.056 1.00 0.00 C ATOM 990 CE LYS A 69 -6.605 -10.033 -12.585 1.00 0.00 C ATOM 991 NZ LYS A 69 -6.858 -10.490 -11.190 1.00 0.00 N ATOM 0 H LYS A 69 -10.516 -5.898 -14.048 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.399 -5.534 -12.140 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -9.224 -7.425 -14.047 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.811 -6.726 -14.811 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -6.356 -7.542 -13.195 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -7.520 -7.359 -11.897 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -8.663 -9.367 -12.461 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -8.023 -9.388 -14.092 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -6.492 -10.892 -13.246 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.672 -9.471 -12.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.067 -11.084 -10.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -6.945 -9.664 -10.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.739 -11.041 -11.160 1.00 0.00 H new ATOM 1005 N CYS A 70 -7.154 -3.564 -13.057 1.00 0.00 N ATOM 1006 CA CYS A 70 -6.218 -2.535 -13.634 1.00 0.00 C ATOM 1007 C CYS A 70 -4.804 -3.047 -13.378 1.00 0.00 C ATOM 1008 O CYS A 70 -4.632 -4.185 -13.013 1.00 0.00 O ATOM 1009 CB CYS A 70 -6.447 -1.165 -13.009 1.00 0.00 C ATOM 1010 SG CYS A 70 -6.422 -1.281 -11.220 1.00 0.00 S ATOM 0 H CYS A 70 -7.276 -3.521 -12.045 1.00 0.00 H new ATOM 0 HA CYS A 70 -6.390 -2.402 -14.702 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -5.676 -0.472 -13.345 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -7.404 -0.763 -13.340 1.00 0.00 H new ATOM 0 HG CYS A 70 -5.330 -1.874 -10.839 1.00 0.00 H new ATOM 1016 N SER A 71 -3.803 -2.252 -13.615 1.00 0.00 N ATOM 1017 CA SER A 71 -2.371 -2.754 -13.450 1.00 0.00 C ATOM 1018 C SER A 71 -1.432 -1.729 -12.841 1.00 0.00 C ATOM 1019 O SER A 71 -1.128 -0.715 -13.442 1.00 0.00 O ATOM 1020 CB SER A 71 -1.873 -3.089 -14.798 1.00 0.00 C ATOM 1021 OG SER A 71 -1.887 -1.889 -15.566 1.00 0.00 O ATOM 0 H SER A 71 -3.890 -1.281 -13.914 1.00 0.00 H new ATOM 0 HA SER A 71 -2.391 -3.606 -12.770 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.864 -3.499 -14.744 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.502 -3.849 -15.262 1.00 0.00 H new ATOM 0 HG SER A 71 -1.424 -1.180 -15.073 1.00 0.00 H new ATOM 1027 N VAL A 72 -0.951 -2.016 -11.677 1.00 0.00 N ATOM 1028 CA VAL A 72 -0.006 -1.092 -10.981 1.00 0.00 C ATOM 1029 C VAL A 72 1.198 -0.725 -11.840 1.00 0.00 C ATOM 1030 O VAL A 72 2.043 -1.547 -12.178 1.00 0.00 O ATOM 1031 CB VAL A 72 0.514 -1.687 -9.706 1.00 0.00 C ATOM 1032 CG1 VAL A 72 1.144 -0.578 -8.868 1.00 0.00 C ATOM 1033 CG2 VAL A 72 -0.615 -2.317 -8.924 1.00 0.00 C ATOM 0 H VAL A 72 -1.171 -2.867 -11.160 1.00 0.00 H new ATOM 0 HA VAL A 72 -0.590 -0.195 -10.773 1.00 0.00 H new ATOM 0 HB VAL A 72 1.253 -2.453 -9.941 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.526 -0.998 -7.937 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.963 -0.122 -9.424 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.393 0.179 -8.643 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -0.224 -2.745 -8.001 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -1.360 -1.558 -8.685 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -1.077 -3.103 -9.521 1.00 0.00 H new ATOM 1043 N ILE A 73 1.284 0.535 -12.102 1.00 0.00 N ATOM 1044 CA ILE A 73 2.347 1.136 -12.808 1.00 0.00 C ATOM 1045 C ILE A 73 2.978 2.182 -11.796 1.00 0.00 C ATOM 1046 O ILE A 73 2.803 3.366 -11.877 1.00 0.00 O ATOM 1047 CB ILE A 73 1.800 1.787 -14.082 1.00 0.00 C ATOM 1048 CG1 ILE A 73 1.489 0.678 -15.138 1.00 0.00 C ATOM 1049 CG2 ILE A 73 2.819 2.781 -14.667 1.00 0.00 C ATOM 1050 CD1 ILE A 73 0.127 0.933 -15.833 1.00 0.00 C ATOM 0 H ILE A 73 0.571 1.204 -11.810 1.00 0.00 H new ATOM 0 HA ILE A 73 3.111 0.431 -13.136 1.00 0.00 H new ATOM 0 HB ILE A 73 0.888 2.330 -13.833 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.282 0.651 -15.885 1.00 0.00 H new ATOM 0 HG13 ILE A 73 1.475 -0.297 -14.652 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.410 3.232 -15.571 1.00 0.00 H new ATOM 0 HG22 ILE A 73 3.028 3.561 -13.935 1.00 0.00 H new ATOM 0 HG23 ILE A 73 3.742 2.255 -14.910 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.062 0.145 -16.562 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.667 0.935 -15.087 1.00 0.00 H new ATOM 0 HD13 ILE A 73 0.152 1.898 -16.339 1.00 0.00 H new ATOM 1062 N ARG A 74 3.630 1.646 -10.823 1.00 0.00 N ATOM 1063 CA ARG A 74 4.333 2.409 -9.682 1.00 0.00 C ATOM 1064 C ARG A 74 3.442 2.456 -8.466 1.00 0.00 C ATOM 1065 O ARG A 74 2.433 3.122 -8.463 1.00 0.00 O ATOM 1066 CB ARG A 74 4.748 3.845 -10.085 1.00 0.00 C ATOM 1067 CG ARG A 74 6.166 4.139 -9.560 1.00 0.00 C ATOM 1068 CD ARG A 74 7.175 3.175 -10.208 1.00 0.00 C ATOM 1069 NE ARG A 74 8.023 3.922 -11.179 1.00 0.00 N ATOM 1070 CZ ARG A 74 7.584 4.149 -12.387 1.00 0.00 C ATOM 1071 NH1 ARG A 74 6.738 5.117 -12.604 1.00 0.00 N ATOM 1072 NH2 ARG A 74 7.986 3.405 -13.378 1.00 0.00 N ATOM 0 H ARG A 74 3.731 0.635 -10.736 1.00 0.00 H new ATOM 0 HA ARG A 74 5.249 1.863 -9.454 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.721 3.951 -11.169 1.00 0.00 H new ATOM 0 HB3 ARG A 74 4.041 4.567 -9.676 1.00 0.00 H new ATOM 0 HG2 ARG A 74 6.440 5.170 -9.784 1.00 0.00 H new ATOM 0 HG3 ARG A 74 6.191 4.031 -8.476 1.00 0.00 H new ATOM 0 HD2 ARG A 74 7.799 2.716 -9.441 1.00 0.00 H new ATOM 0 HD3 ARG A 74 6.648 2.367 -10.716 1.00 0.00 H new ATOM 0 HE ARG A 74 8.946 4.256 -10.900 1.00 0.00 H new ATOM 0 HH11 ARG A 74 6.418 5.698 -11.829 1.00 0.00 H new ATOM 0 HH12 ARG A 74 6.396 5.293 -13.549 1.00 0.00 H new ATOM 0 HH21 ARG A 74 8.644 2.644 -13.210 1.00 0.00 H new ATOM 0 HH22 ARG A 74 7.642 3.583 -14.322 1.00 0.00 H new ATOM 1086 N ASP A 75 3.812 1.733 -7.415 1.00 0.00 N ATOM 1087 CA ASP A 75 2.971 1.716 -6.189 1.00 0.00 C ATOM 1088 C ASP A 75 3.552 2.597 -5.085 1.00 0.00 C ATOM 1089 O ASP A 75 4.525 2.257 -4.426 1.00 0.00 O ATOM 1090 CB ASP A 75 2.733 0.234 -5.733 1.00 0.00 C ATOM 1091 CG ASP A 75 2.565 0.107 -4.199 1.00 0.00 C ATOM 1092 OD1 ASP A 75 3.572 0.028 -3.518 1.00 0.00 O ATOM 1093 OD2 ASP A 75 1.433 0.091 -3.746 1.00 0.00 O ATOM 0 H ASP A 75 4.657 1.163 -7.369 1.00 0.00 H new ATOM 0 HA ASP A 75 1.999 2.152 -6.420 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.843 -0.156 -6.227 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.573 -0.382 -6.056 1.00 0.00 H new ATOM 1098 N SER A 76 2.878 3.705 -4.856 1.00 0.00 N ATOM 1099 CA SER A 76 3.260 4.644 -3.757 1.00 0.00 C ATOM 1100 C SER A 76 2.027 4.792 -2.793 1.00 0.00 C ATOM 1101 O SER A 76 2.077 5.497 -1.807 1.00 0.00 O ATOM 1102 CB SER A 76 3.660 6.012 -4.338 1.00 0.00 C ATOM 1103 OG SER A 76 4.793 6.499 -3.633 1.00 0.00 O ATOM 0 H SER A 76 2.065 3.999 -5.397 1.00 0.00 H new ATOM 0 HA SER A 76 4.117 4.254 -3.208 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.889 5.918 -5.400 1.00 0.00 H new ATOM 0 HB3 SER A 76 2.832 6.715 -4.251 1.00 0.00 H new ATOM 0 HG SER A 76 5.414 6.922 -4.263 1.00 0.00 H new ATOM 1109 N LEU A 77 0.925 4.073 -3.100 1.00 0.00 N ATOM 1110 CA LEU A 77 -0.351 4.069 -2.271 1.00 0.00 C ATOM 1111 C LEU A 77 -0.060 4.038 -0.808 1.00 0.00 C ATOM 1112 O LEU A 77 -0.838 4.575 -0.015 1.00 0.00 O ATOM 1113 CB LEU A 77 -1.093 2.797 -2.667 1.00 0.00 C ATOM 1114 CG LEU A 77 -2.502 2.789 -2.134 1.00 0.00 C ATOM 1115 CD1 LEU A 77 -3.449 3.286 -3.209 1.00 0.00 C ATOM 1116 CD2 LEU A 77 -2.887 1.351 -1.753 1.00 0.00 C ATOM 0 H LEU A 77 0.871 3.473 -3.923 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.931 4.973 -2.458 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.114 2.710 -3.753 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.555 1.928 -2.288 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.567 3.436 -1.259 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.469 3.281 -2.826 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.174 4.301 -3.495 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.385 2.634 -4.080 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.906 1.337 -1.366 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.825 0.712 -2.634 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.204 0.982 -0.988 1.00 0.00 H new ATOM 1128 N LEU A 78 1.040 3.468 -0.423 1.00 0.00 N ATOM 1129 CA LEU A 78 1.385 3.456 0.992 1.00 0.00 C ATOM 1130 C LEU A 78 2.354 4.611 1.237 1.00 0.00 C ATOM 1131 O LEU A 78 3.282 4.805 0.504 1.00 0.00 O ATOM 1132 CB LEU A 78 1.907 2.096 1.352 1.00 0.00 C ATOM 1133 CG LEU A 78 0.782 1.040 1.051 1.00 0.00 C ATOM 1134 CD1 LEU A 78 1.359 -0.200 0.358 1.00 0.00 C ATOM 1135 CD2 LEU A 78 0.092 0.610 2.362 1.00 0.00 C ATOM 0 H LEU A 78 1.710 3.011 -1.041 1.00 0.00 H new ATOM 0 HA LEU A 78 0.530 3.619 1.648 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.804 1.869 0.777 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.187 2.063 2.405 1.00 0.00 H new ATOM 0 HG LEU A 78 0.056 1.508 0.387 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.558 -0.913 0.162 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.823 0.092 -0.584 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.107 -0.662 1.003 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.685 -0.121 2.141 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.828 0.166 3.032 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.355 1.481 2.841 1.00 0.00 H new ATOM 1183 N GLU A 82 3.766 9.741 -0.541 1.00 0.00 N ATOM 1184 CA GLU A 82 2.998 9.753 -1.801 1.00 0.00 C ATOM 1185 C GLU A 82 1.539 9.218 -1.684 1.00 0.00 C ATOM 1186 O GLU A 82 0.609 9.836 -2.178 1.00 0.00 O ATOM 1187 CB GLU A 82 3.721 8.830 -2.750 1.00 0.00 C ATOM 1188 CG GLU A 82 4.759 9.572 -3.584 1.00 0.00 C ATOM 1189 CD GLU A 82 6.131 9.502 -2.902 1.00 0.00 C ATOM 1190 OE1 GLU A 82 6.515 8.420 -2.488 1.00 0.00 O ATOM 1191 OE2 GLU A 82 6.777 10.534 -2.815 1.00 0.00 O ATOM 0 HA GLU A 82 2.929 10.792 -2.124 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.210 8.037 -2.184 1.00 0.00 H new ATOM 0 HB3 GLU A 82 2.999 8.351 -3.411 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.817 9.134 -4.580 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.459 10.612 -3.710 1.00 0.00 H new ATOM 1198 N PHE A 83 1.375 8.011 -1.154 1.00 0.00 N ATOM 1199 CA PHE A 83 0.016 7.317 -1.134 1.00 0.00 C ATOM 1200 C PHE A 83 -0.686 7.463 -2.515 1.00 0.00 C ATOM 1201 O PHE A 83 -1.861 7.792 -2.607 1.00 0.00 O ATOM 1202 CB PHE A 83 -0.931 7.754 -0.026 1.00 0.00 C ATOM 1203 CG PHE A 83 -0.576 9.092 0.571 1.00 0.00 C ATOM 1204 CD1 PHE A 83 0.343 9.167 1.616 1.00 0.00 C ATOM 1205 CD2 PHE A 83 -1.186 10.255 0.085 1.00 0.00 C ATOM 1206 CE1 PHE A 83 0.661 10.412 2.181 1.00 0.00 C ATOM 1207 CE2 PHE A 83 -0.872 11.497 0.646 1.00 0.00 C ATOM 1208 CZ PHE A 83 0.052 11.578 1.694 1.00 0.00 C ATOM 0 H PHE A 83 2.129 7.470 -0.730 1.00 0.00 H new ATOM 0 HA PHE A 83 0.245 6.273 -0.919 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.946 7.799 -0.422 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -0.929 7.001 0.762 1.00 0.00 H new ATOM 0 HD1 PHE A 83 0.810 8.268 1.991 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -1.899 10.193 -0.724 1.00 0.00 H new ATOM 0 HE1 PHE A 83 1.374 10.472 2.990 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -1.343 12.394 0.270 1.00 0.00 H new ATOM 0 HZ PHE A 83 0.296 12.537 2.127 1.00 0.00 H new ATOM 1218 N SER A 84 0.046 7.197 -3.576 1.00 0.00 N ATOM 1219 CA SER A 84 -0.517 7.275 -4.964 1.00 0.00 C ATOM 1220 C SER A 84 0.126 6.182 -5.776 1.00 0.00 C ATOM 1221 O SER A 84 1.324 5.970 -5.725 1.00 0.00 O ATOM 1222 CB SER A 84 -0.238 8.637 -5.563 1.00 0.00 C ATOM 1223 OG SER A 84 1.167 8.836 -5.650 1.00 0.00 O ATOM 0 H SER A 84 1.028 6.924 -3.535 1.00 0.00 H new ATOM 0 HA SER A 84 -1.599 7.141 -4.954 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.689 8.710 -6.553 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.689 9.416 -4.949 1.00 0.00 H new ATOM 0 HG SER A 84 1.349 9.717 -6.039 1.00 0.00 H new ATOM 1229 N MET A 85 -0.687 5.464 -6.476 1.00 0.00 N ATOM 1230 CA MET A 85 -0.248 4.317 -7.274 1.00 0.00 C ATOM 1231 C MET A 85 -0.823 4.483 -8.648 1.00 0.00 C ATOM 1232 O MET A 85 -1.952 4.921 -8.770 1.00 0.00 O ATOM 1233 CB MET A 85 -0.896 3.102 -6.593 1.00 0.00 C ATOM 1234 CG MET A 85 -0.205 1.805 -6.944 1.00 0.00 C ATOM 1235 SD MET A 85 -1.413 0.615 -7.522 1.00 0.00 S ATOM 1236 CE MET A 85 -1.189 -0.598 -6.230 1.00 0.00 C ATOM 0 H MET A 85 -1.690 5.641 -6.525 1.00 0.00 H new ATOM 0 HA MET A 85 0.835 4.216 -7.344 1.00 0.00 H new ATOM 0 HB2 MET A 85 -0.874 3.241 -5.512 1.00 0.00 H new ATOM 0 HB3 MET A 85 -1.944 3.042 -6.885 1.00 0.00 H new ATOM 0 HG2 MET A 85 0.546 1.979 -7.715 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.318 1.413 -6.072 1.00 0.00 H new ATOM 0 HE1 MET A 85 -1.693 -1.523 -6.508 1.00 0.00 H new ATOM 0 HE2 MET A 85 -0.125 -0.791 -6.093 1.00 0.00 H new ATOM 0 HE3 MET A 85 -1.612 -0.220 -5.299 1.00 0.00 H new ATOM 1246 N ASP A 86 -0.110 4.126 -9.704 1.00 0.00 N ATOM 1247 CA ASP A 86 -0.725 4.238 -11.025 1.00 0.00 C ATOM 1248 C ASP A 86 -1.219 2.875 -11.327 1.00 0.00 C ATOM 1249 O ASP A 86 -0.508 1.989 -11.197 1.00 0.00 O ATOM 1250 CB ASP A 86 0.296 4.620 -12.029 1.00 0.00 C ATOM 1251 CG ASP A 86 0.429 6.137 -12.076 1.00 0.00 C ATOM 1252 OD1 ASP A 86 -0.565 6.789 -12.348 1.00 0.00 O ATOM 1253 OD2 ASP A 86 1.519 6.624 -11.833 1.00 0.00 O ATOM 0 H ASP A 86 0.847 3.773 -9.684 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.514 4.990 -11.048 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.255 4.169 -11.776 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.014 4.240 -13.011 1.00 0.00 H new ATOM 1258 N LEU A 87 -2.447 2.691 -11.664 1.00 0.00 N ATOM 1259 CA LEU A 87 -2.934 1.343 -11.946 1.00 0.00 C ATOM 1260 C LEU A 87 -3.958 1.461 -13.020 1.00 0.00 C ATOM 1261 O LEU A 87 -4.939 2.167 -12.886 1.00 0.00 O ATOM 1262 CB LEU A 87 -3.395 0.580 -10.671 1.00 0.00 C ATOM 1263 CG LEU A 87 -4.083 1.434 -9.563 1.00 0.00 C ATOM 1264 CD1 LEU A 87 -3.215 2.599 -9.130 1.00 0.00 C ATOM 1265 CD2 LEU A 87 -5.428 1.934 -10.044 1.00 0.00 C ATOM 0 H LEU A 87 -3.142 3.432 -11.756 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.126 0.707 -12.308 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.086 -0.206 -10.975 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.526 0.089 -10.234 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.229 0.791 -8.695 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.730 3.169 -8.357 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.271 2.223 -8.735 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.018 3.244 -9.986 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.897 2.529 -9.260 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.291 2.549 -10.933 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.067 1.084 -10.286 1.00 0.00 H new ATOM 1277 N ARG A 88 -3.659 0.867 -14.161 1.00 0.00 N ATOM 1278 CA ARG A 88 -4.555 1.045 -15.356 1.00 0.00 C ATOM 1279 C ARG A 88 -5.097 -0.248 -15.956 1.00 0.00 C ATOM 1280 O ARG A 88 -4.402 -1.243 -16.083 1.00 0.00 O ATOM 1281 CB ARG A 88 -3.733 1.796 -16.467 1.00 0.00 C ATOM 1282 CG ARG A 88 -2.891 0.807 -17.343 1.00 0.00 C ATOM 1283 CD ARG A 88 -2.018 1.606 -18.296 1.00 0.00 C ATOM 1284 NE ARG A 88 -0.994 0.709 -18.913 1.00 0.00 N ATOM 1285 CZ ARG A 88 -0.116 1.195 -19.755 1.00 0.00 C ATOM 1286 NH1 ARG A 88 0.965 1.776 -19.310 1.00 0.00 N ATOM 1287 NH2 ARG A 88 -0.320 1.098 -21.040 1.00 0.00 N ATOM 0 H ARG A 88 -2.843 0.274 -14.313 1.00 0.00 H new ATOM 0 HA ARG A 88 -5.425 1.602 -15.008 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.415 2.356 -17.107 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -3.068 2.521 -15.998 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.272 0.175 -16.706 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -3.552 0.145 -17.903 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.633 2.061 -19.073 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -1.528 2.419 -17.761 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.979 -0.283 -18.678 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.127 1.852 -18.306 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.648 2.154 -19.967 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -1.164 0.644 -21.390 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.364 1.477 -21.695 1.00 0.00 H new ATOM 1301 N THR A 89 -6.320 -0.159 -16.457 1.00 0.00 N ATOM 1302 CA THR A 89 -6.934 -1.278 -17.211 1.00 0.00 C ATOM 1303 C THR A 89 -6.071 -1.385 -18.460 1.00 0.00 C ATOM 1304 O THR A 89 -6.139 -0.521 -19.332 1.00 0.00 O ATOM 1305 CB THR A 89 -8.407 -0.921 -17.610 1.00 0.00 C ATOM 1306 OG1 THR A 89 -8.434 -0.035 -18.714 1.00 0.00 O ATOM 1307 CG2 THR A 89 -9.131 -0.258 -16.437 1.00 0.00 C ATOM 0 H THR A 89 -6.915 0.664 -16.364 1.00 0.00 H new ATOM 0 HA THR A 89 -6.976 -2.203 -16.636 1.00 0.00 H new ATOM 0 HB THR A 89 -8.907 -1.851 -17.880 1.00 0.00 H new ATOM 0 HG1 THR A 89 -7.547 0.363 -18.836 1.00 0.00 H new ATOM 0 HG21 THR A 89 -10.153 -0.016 -16.730 1.00 0.00 H new ATOM 0 HG22 THR A 89 -9.149 -0.941 -15.588 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.608 0.656 -16.156 1.00 0.00 H new ATOM 1315 N LYS A 90 -5.203 -2.344 -18.520 1.00 0.00 N ATOM 1316 CA LYS A 90 -4.288 -2.401 -19.648 1.00 0.00 C ATOM 1317 C LYS A 90 -4.944 -3.039 -20.845 1.00 0.00 C ATOM 1318 O LYS A 90 -6.038 -3.582 -20.777 1.00 0.00 O ATOM 1319 CB LYS A 90 -3.015 -3.163 -19.306 1.00 0.00 C ATOM 1320 CG LYS A 90 -2.655 -3.072 -17.835 1.00 0.00 C ATOM 1321 CD LYS A 90 -1.137 -3.380 -17.706 1.00 0.00 C ATOM 1322 CE LYS A 90 -0.940 -4.773 -17.089 1.00 0.00 C ATOM 1323 NZ LYS A 90 -0.694 -5.764 -18.174 1.00 0.00 N ATOM 0 H LYS A 90 -5.097 -3.087 -17.829 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.022 -1.372 -19.888 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.138 -4.210 -19.581 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.191 -2.772 -19.902 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.879 -2.079 -17.446 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.241 -3.782 -17.252 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.663 -3.336 -18.687 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.655 -2.625 -17.085 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.099 -4.760 -16.396 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.822 -5.057 -16.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -0.560 -6.708 -17.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.510 -5.782 -18.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.160 -5.495 -18.703 1.00 0.00 H new ATOM 1434 N ASN A 99 -6.915 4.413 -17.774 1.00 0.00 N ATOM 1435 CA ASN A 99 -5.932 4.507 -16.631 1.00 0.00 C ATOM 1436 C ASN A 99 -6.519 5.143 -15.391 1.00 0.00 C ATOM 1437 O ASN A 99 -7.223 6.138 -15.427 1.00 0.00 O ATOM 1438 CB ASN A 99 -4.621 5.232 -17.073 1.00 0.00 C ATOM 1439 CG ASN A 99 -4.284 4.935 -18.561 1.00 0.00 C ATOM 1440 OD1 ASN A 99 -4.803 4.006 -19.156 1.00 0.00 O ATOM 1441 ND2 ASN A 99 -3.411 5.687 -19.174 1.00 0.00 N ATOM 0 HA ASN A 99 -5.683 3.482 -16.357 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.732 6.307 -16.931 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -3.794 4.910 -16.440 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -3.166 5.496 -20.146 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -2.973 6.466 -18.681 1.00 0.00 H new ATOM 1448 N VAL A 100 -6.207 4.516 -14.285 1.00 0.00 N ATOM 1449 CA VAL A 100 -6.675 4.939 -12.947 1.00 0.00 C ATOM 1450 C VAL A 100 -5.466 5.340 -12.103 1.00 0.00 C ATOM 1451 O VAL A 100 -4.328 5.032 -12.426 1.00 0.00 O ATOM 1452 CB VAL A 100 -7.334 3.715 -12.208 1.00 0.00 C ATOM 1453 CG1 VAL A 100 -8.222 4.183 -11.065 1.00 0.00 C ATOM 1454 CG2 VAL A 100 -8.178 2.854 -13.166 1.00 0.00 C ATOM 0 H VAL A 100 -5.615 3.686 -14.265 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.381 5.760 -13.067 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.515 3.111 -11.817 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.665 3.318 -10.571 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -7.625 4.745 -10.347 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -9.013 4.822 -11.457 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.615 2.020 -12.617 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.974 3.462 -13.596 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.543 2.469 -13.964 1.00 0.00 H new ATOM 1464 N THR A 101 -5.744 5.942 -10.993 1.00 0.00 N ATOM 1465 CA THR A 101 -4.722 6.311 -9.999 1.00 0.00 C ATOM 1466 C THR A 101 -5.395 6.033 -8.683 1.00 0.00 C ATOM 1467 O THR A 101 -6.521 6.445 -8.490 1.00 0.00 O ATOM 1468 CB THR A 101 -4.337 7.771 -10.077 1.00 0.00 C ATOM 1469 OG1 THR A 101 -3.801 8.054 -11.365 1.00 0.00 O ATOM 1470 CG2 THR A 101 -3.281 8.052 -8.994 1.00 0.00 C ATOM 0 H THR A 101 -6.692 6.206 -10.724 1.00 0.00 H new ATOM 0 HA THR A 101 -3.796 5.757 -10.154 1.00 0.00 H new ATOM 0 HB THR A 101 -5.211 8.402 -9.916 1.00 0.00 H new ATOM 0 HG1 THR A 101 -2.882 8.382 -11.272 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.990 9.102 -9.034 1.00 0.00 H new ATOM 0 HG22 THR A 101 -3.698 7.828 -8.012 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.406 7.426 -9.168 1.00 0.00 H new ATOM 1478 N VAL A 102 -4.765 5.321 -7.798 1.00 0.00 N ATOM 1479 CA VAL A 102 -5.425 4.977 -6.536 1.00 0.00 C ATOM 1480 C VAL A 102 -4.539 5.382 -5.388 1.00 0.00 C ATOM 1481 O VAL A 102 -3.393 4.988 -5.302 1.00 0.00 O ATOM 1482 CB VAL A 102 -5.732 3.461 -6.581 1.00 0.00 C ATOM 1483 CG1 VAL A 102 -5.947 2.874 -5.171 1.00 0.00 C ATOM 1484 CG2 VAL A 102 -6.989 3.262 -7.419 1.00 0.00 C ATOM 0 H VAL A 102 -3.815 4.965 -7.904 1.00 0.00 H new ATOM 0 HA VAL A 102 -6.365 5.509 -6.393 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.880 2.940 -7.018 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -6.160 1.808 -5.249 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -5.047 3.022 -4.574 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -6.787 3.377 -4.692 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -7.229 2.200 -7.468 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -7.819 3.801 -6.963 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.819 3.642 -8.426 1.00 0.00 H new ATOM 1494 N THR A 103 -5.083 6.198 -4.524 1.00 0.00 N ATOM 1495 CA THR A 103 -4.323 6.699 -3.343 1.00 0.00 C ATOM 1496 C THR A 103 -4.901 6.081 -2.068 1.00 0.00 C ATOM 1497 O THR A 103 -6.046 5.647 -2.052 1.00 0.00 O ATOM 1498 CB THR A 103 -4.451 8.220 -3.274 1.00 0.00 C ATOM 1499 OG1 THR A 103 -5.819 8.585 -3.417 1.00 0.00 O ATOM 1500 CG2 THR A 103 -3.628 8.860 -4.399 1.00 0.00 C ATOM 0 H THR A 103 -6.040 6.544 -4.589 1.00 0.00 H new ATOM 0 HA THR A 103 -3.273 6.423 -3.436 1.00 0.00 H new ATOM 0 HB THR A 103 -4.078 8.572 -2.312 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.959 8.992 -4.298 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.722 9.945 -4.347 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.580 8.581 -4.288 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.996 8.510 -5.363 1.00 0.00 H new ATOM 1508 N LYS A 104 -4.119 6.040 -0.992 1.00 0.00 N ATOM 1509 CA LYS A 104 -4.629 5.452 0.307 1.00 0.00 C ATOM 1510 C LYS A 104 -4.099 6.248 1.485 1.00 0.00 C ATOM 1511 O LYS A 104 -2.956 6.678 1.502 1.00 0.00 O ATOM 1512 CB LYS A 104 -4.161 3.990 0.456 1.00 0.00 C ATOM 1513 CG LYS A 104 -4.723 3.376 1.765 1.00 0.00 C ATOM 1514 CD LYS A 104 -5.780 2.322 1.444 1.00 0.00 C ATOM 1515 CE LYS A 104 -5.115 1.063 0.886 1.00 0.00 C ATOM 1516 NZ LYS A 104 -3.977 0.652 1.760 1.00 0.00 N ATOM 0 H LYS A 104 -3.160 6.386 -0.961 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.718 5.491 0.290 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -4.495 3.405 -0.401 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -3.072 3.949 0.465 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -3.914 2.926 2.340 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -5.158 4.160 2.385 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -6.344 2.076 2.344 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -6.492 2.718 0.720 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -5.844 0.255 0.822 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -4.757 1.250 -0.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -3.850 -0.379 1.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -3.107 1.126 1.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -4.180 0.922 2.744 1.00 0.00 H new ATOM 1530 N THR A 105 -4.925 6.399 2.488 1.00 0.00 N ATOM 1531 CA THR A 105 -4.515 7.115 3.729 1.00 0.00 C ATOM 1532 C THR A 105 -4.223 6.042 4.795 1.00 0.00 C ATOM 1533 O THR A 105 -3.762 4.955 4.456 1.00 0.00 O ATOM 1534 CB THR A 105 -5.655 8.038 4.177 1.00 0.00 C ATOM 1535 OG1 THR A 105 -6.777 7.252 4.554 1.00 0.00 O ATOM 1536 CG2 THR A 105 -6.035 8.983 3.027 1.00 0.00 C ATOM 0 H THR A 105 -5.883 6.049 2.497 1.00 0.00 H new ATOM 0 HA THR A 105 -3.629 7.730 3.567 1.00 0.00 H new ATOM 0 HB THR A 105 -5.331 8.633 5.031 1.00 0.00 H new ATOM 0 HG1 THR A 105 -7.140 7.585 5.401 1.00 0.00 H new ATOM 0 HG21 THR A 105 -6.845 9.638 3.347 1.00 0.00 H new ATOM 0 HG22 THR A 105 -5.170 9.585 2.750 1.00 0.00 H new ATOM 0 HG23 THR A 105 -6.360 8.397 2.167 1.00 0.00 H new ATOM 1544 N ASP A 106 -4.497 6.315 6.068 1.00 0.00 N ATOM 1545 CA ASP A 106 -4.249 5.297 7.130 1.00 0.00 C ATOM 1546 C ASP A 106 -5.545 4.519 7.401 1.00 0.00 C ATOM 1547 O ASP A 106 -5.512 3.446 7.994 1.00 0.00 O ATOM 1548 CB ASP A 106 -3.789 5.991 8.405 1.00 0.00 C ATOM 1549 CG ASP A 106 -3.165 4.966 9.349 1.00 0.00 C ATOM 1550 OD1 ASP A 106 -3.897 4.132 9.853 1.00 0.00 O ATOM 1551 OD2 ASP A 106 -1.965 5.033 9.552 1.00 0.00 O ATOM 0 H ASP A 106 -4.880 7.200 6.401 1.00 0.00 H new ATOM 0 HA ASP A 106 -3.474 4.606 6.799 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -3.064 6.769 8.166 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -4.634 6.480 8.890 1.00 0.00 H new ATOM 1556 N LYS A 107 -6.703 5.056 6.973 1.00 0.00 N ATOM 1557 CA LYS A 107 -8.007 4.347 7.218 1.00 0.00 C ATOM 1558 C LYS A 107 -8.985 4.556 6.030 1.00 0.00 C ATOM 1559 O LYS A 107 -10.161 4.329 6.169 1.00 0.00 O ATOM 1560 CB LYS A 107 -8.653 4.897 8.510 1.00 0.00 C ATOM 1561 CG LYS A 107 -7.611 4.974 9.630 1.00 0.00 C ATOM 1562 CD LYS A 107 -8.311 4.938 10.997 1.00 0.00 C ATOM 1563 CE LYS A 107 -7.314 5.344 12.090 1.00 0.00 C ATOM 1564 NZ LYS A 107 -7.958 5.220 13.430 1.00 0.00 N ATOM 0 H LYS A 107 -6.781 5.942 6.474 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.806 3.280 7.320 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -9.071 5.886 8.324 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -9.479 4.254 8.815 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.913 4.141 9.547 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -7.028 5.890 9.534 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.165 5.615 10.999 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -8.697 3.938 11.194 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -6.429 4.710 12.041 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -6.981 6.369 11.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -7.279 5.496 14.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -8.790 5.843 13.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -8.254 4.235 13.583 1.00 0.00 H new ATOM 1578 N THR A 108 -8.502 4.976 4.857 1.00 0.00 N ATOM 1579 CA THR A 108 -9.420 5.181 3.681 1.00 0.00 C ATOM 1580 C THR A 108 -8.697 4.705 2.403 1.00 0.00 C ATOM 1581 O THR A 108 -7.492 4.471 2.413 1.00 0.00 O ATOM 1582 CB THR A 108 -9.809 6.666 3.590 1.00 0.00 C ATOM 1583 OG1 THR A 108 -8.716 7.423 3.109 1.00 0.00 O ATOM 1584 CG2 THR A 108 -10.218 7.166 4.995 1.00 0.00 C ATOM 0 H THR A 108 -7.519 5.181 4.676 1.00 0.00 H new ATOM 0 HA THR A 108 -10.336 4.602 3.799 1.00 0.00 H new ATOM 0 HB THR A 108 -10.645 6.783 2.901 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.058 7.539 3.826 1.00 0.00 H new ATOM 0 HG21 THR A 108 -10.496 8.219 4.940 1.00 0.00 H new ATOM 0 HG22 THR A 108 -11.067 6.585 5.355 1.00 0.00 H new ATOM 0 HG23 THR A 108 -9.380 7.047 5.682 1.00 0.00 H new ATOM 1592 N LEU A 109 -9.433 4.529 1.330 1.00 0.00 N ATOM 1593 CA LEU A 109 -8.836 4.024 0.039 1.00 0.00 C ATOM 1594 C LEU A 109 -9.456 4.837 -1.133 1.00 0.00 C ATOM 1595 O LEU A 109 -10.506 4.471 -1.649 1.00 0.00 O ATOM 1596 CB LEU A 109 -9.253 2.538 -0.093 1.00 0.00 C ATOM 1597 CG LEU A 109 -8.211 1.648 -0.815 1.00 0.00 C ATOM 1598 CD1 LEU A 109 -8.955 0.601 -1.612 1.00 0.00 C ATOM 1599 CD2 LEU A 109 -7.353 2.439 -1.756 1.00 0.00 C ATOM 0 H LEU A 109 -10.435 4.715 1.288 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.751 4.128 0.022 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.433 2.133 0.903 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.198 2.484 -0.634 1.00 0.00 H new ATOM 0 HG LEU A 109 -7.563 1.200 -0.062 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -8.240 -0.038 -2.130 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.563 -0.005 -0.939 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.600 1.090 -2.342 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -6.637 1.775 -2.240 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -7.981 2.910 -2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.817 3.208 -1.200 1.00 0.00 H new ATOM 1611 N VAL A 110 -8.834 5.946 -1.556 1.00 0.00 N ATOM 1612 CA VAL A 110 -9.425 6.761 -2.645 1.00 0.00 C ATOM 1613 C VAL A 110 -9.011 6.183 -4.002 1.00 0.00 C ATOM 1614 O VAL A 110 -7.916 5.682 -4.157 1.00 0.00 O ATOM 1615 CB VAL A 110 -8.925 8.236 -2.496 1.00 0.00 C ATOM 1616 CG1 VAL A 110 -9.252 9.043 -3.758 1.00 0.00 C ATOM 1617 CG2 VAL A 110 -9.612 8.907 -1.277 1.00 0.00 C ATOM 0 H VAL A 110 -7.953 6.297 -1.182 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.513 6.743 -2.583 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.845 8.218 -2.349 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.897 10.067 -3.637 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.761 8.588 -4.618 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -10.330 9.049 -3.917 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.259 9.934 -1.180 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.692 8.907 -1.423 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.368 8.352 -0.371 1.00 0.00 H new ATOM 1627 N LEU A 111 -9.883 6.302 -4.991 1.00 0.00 N ATOM 1628 CA LEU A 111 -9.561 5.839 -6.352 1.00 0.00 C ATOM 1629 C LEU A 111 -9.930 6.974 -7.305 1.00 0.00 C ATOM 1630 O LEU A 111 -10.791 7.790 -7.023 1.00 0.00 O ATOM 1631 CB LEU A 111 -10.338 4.550 -6.747 1.00 0.00 C ATOM 1632 CG LEU A 111 -10.457 3.598 -5.557 1.00 0.00 C ATOM 1633 CD1 LEU A 111 -11.405 2.451 -5.899 1.00 0.00 C ATOM 1634 CD2 LEU A 111 -9.108 3.010 -5.192 1.00 0.00 C ATOM 0 H LEU A 111 -10.813 6.709 -4.889 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.502 5.586 -6.403 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -11.332 4.816 -7.106 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.826 4.049 -7.569 1.00 0.00 H new ATOM 0 HG LEU A 111 -10.841 4.170 -4.713 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -11.484 1.777 -5.046 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -12.390 2.852 -6.137 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.019 1.904 -6.759 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -9.222 2.337 -4.342 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -8.710 2.457 -6.043 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.420 3.813 -4.928 1.00 0.00 H new ATOM 1646 N LEU A 112 -9.261 7.028 -8.390 1.00 0.00 N ATOM 1647 CA LEU A 112 -9.484 8.095 -9.430 1.00 0.00 C ATOM 1648 C LEU A 112 -9.437 7.400 -10.781 1.00 0.00 C ATOM 1649 O LEU A 112 -8.367 7.082 -11.267 1.00 0.00 O ATOM 1650 CB LEU A 112 -8.304 9.061 -9.342 1.00 0.00 C ATOM 1651 CG LEU A 112 -8.553 10.467 -9.966 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -9.757 10.490 -10.964 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -8.753 11.459 -8.821 1.00 0.00 C ATOM 0 H LEU A 112 -8.531 6.359 -8.634 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.427 8.623 -9.290 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.036 9.188 -8.293 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.445 8.608 -9.837 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.686 10.746 -10.565 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.879 11.497 -11.364 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.565 9.795 -11.782 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.667 10.194 -10.443 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.930 12.454 -9.229 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.611 11.155 -8.222 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.861 11.477 -8.195 1.00 0.00 H new ATOM 1665 N MET A 113 -10.555 7.130 -11.385 1.00 0.00 N ATOM 1666 CA MET A 113 -10.495 6.378 -12.718 1.00 0.00 C ATOM 1667 C MET A 113 -10.632 7.287 -13.869 1.00 0.00 C ATOM 1668 O MET A 113 -11.337 8.263 -13.813 1.00 0.00 O ATOM 1669 CB MET A 113 -11.561 5.323 -12.795 1.00 0.00 C ATOM 1670 CG MET A 113 -11.243 4.314 -13.911 1.00 0.00 C ATOM 1671 SD MET A 113 -12.547 4.371 -15.163 1.00 0.00 S ATOM 1672 CE MET A 113 -12.821 2.585 -15.302 1.00 0.00 C ATOM 0 H MET A 113 -11.487 7.375 -11.051 1.00 0.00 H new ATOM 0 HA MET A 113 -9.514 5.905 -12.762 1.00 0.00 H new ATOM 0 HB2 MET A 113 -11.637 4.805 -11.839 1.00 0.00 H new ATOM 0 HB3 MET A 113 -12.528 5.789 -12.983 1.00 0.00 H new ATOM 0 HG2 MET A 113 -10.279 4.547 -14.363 1.00 0.00 H new ATOM 0 HG3 MET A 113 -11.166 3.309 -13.496 1.00 0.00 H new ATOM 0 HE1 MET A 113 -13.603 2.393 -16.037 1.00 0.00 H new ATOM 0 HE2 MET A 113 -11.898 2.099 -15.618 1.00 0.00 H new ATOM 0 HE3 MET A 113 -13.127 2.187 -14.334 1.00 0.00 H new ATOM 1682 N GLY A 114 -9.942 6.945 -14.938 1.00 0.00 N ATOM 1683 CA GLY A 114 -9.982 7.745 -16.162 1.00 0.00 C ATOM 1684 C GLY A 114 -9.960 6.841 -17.395 1.00 0.00 C ATOM 1685 O GLY A 114 -9.223 5.859 -17.471 1.00 0.00 O ATOM 0 H GLY A 114 -9.345 6.120 -14.992 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -10.881 8.361 -16.172 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.130 8.425 -16.187 1.00 0.00 H new ATOM 1773 N GLY A 121 -1.530 10.871 -15.448 1.00 0.00 N ATOM 1774 CA GLY A 121 -0.587 11.713 -14.618 1.00 0.00 C ATOM 1775 C GLY A 121 -1.372 12.857 -13.975 1.00 0.00 C ATOM 1776 O GLY A 121 -1.082 13.277 -12.863 1.00 0.00 O ATOM 0 HA2 GLY A 121 -0.115 11.102 -13.849 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.212 12.110 -15.244 1.00 0.00 H new ATOM 1780 N LEU A 122 -2.393 13.334 -14.666 1.00 0.00 N ATOM 1781 CA LEU A 122 -3.269 14.437 -14.119 1.00 0.00 C ATOM 1782 C LEU A 122 -4.168 13.804 -13.113 1.00 0.00 C ATOM 1783 O LEU A 122 -4.421 14.356 -12.073 1.00 0.00 O ATOM 1784 CB LEU A 122 -4.142 15.063 -15.220 1.00 0.00 C ATOM 1785 CG LEU A 122 -3.376 15.200 -16.548 1.00 0.00 C ATOM 1786 CD1 LEU A 122 -4.318 14.854 -17.700 1.00 0.00 C ATOM 1787 CD2 LEU A 122 -2.876 16.638 -16.695 1.00 0.00 C ATOM 0 H LEU A 122 -2.659 13.003 -15.594 1.00 0.00 H new ATOM 0 HA LEU A 122 -2.646 15.225 -13.695 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.029 14.449 -15.374 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.487 16.045 -14.896 1.00 0.00 H new ATOM 0 HG LEU A 122 -2.522 14.523 -16.562 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -3.785 14.948 -18.646 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -4.674 13.830 -17.584 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -5.168 15.537 -17.693 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.333 16.740 -17.634 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.726 17.321 -16.691 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.213 16.879 -15.864 1.00 0.00 H new ATOM 1799 N ILE A 123 -4.624 12.606 -13.423 1.00 0.00 N ATOM 1800 CA ILE A 123 -5.479 11.831 -12.500 1.00 0.00 C ATOM 1801 C ILE A 123 -4.614 11.506 -11.285 1.00 0.00 C ATOM 1802 O ILE A 123 -5.076 11.534 -10.166 1.00 0.00 O ATOM 1803 CB ILE A 123 -5.880 10.542 -13.226 1.00 0.00 C ATOM 1804 CG1 ILE A 123 -6.831 10.850 -14.414 1.00 0.00 C ATOM 1805 CG2 ILE A 123 -6.570 9.537 -12.287 1.00 0.00 C ATOM 1806 CD1 ILE A 123 -6.944 9.593 -15.260 1.00 0.00 C ATOM 0 H ILE A 123 -4.425 12.134 -14.305 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.376 12.369 -12.193 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.956 10.096 -13.594 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.812 11.153 -14.049 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.443 11.677 -15.009 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.836 8.640 -12.846 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.892 9.272 -11.476 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.472 9.987 -11.873 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -7.608 9.781 -16.104 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.957 9.313 -15.630 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -7.348 8.782 -14.654 1.00 0.00 H new ATOM 1818 N ASN A 124 -3.333 11.223 -11.527 1.00 0.00 N ATOM 1819 CA ASN A 124 -2.387 10.930 -10.410 1.00 0.00 C ATOM 1820 C ASN A 124 -2.209 12.190 -9.577 1.00 0.00 C ATOM 1821 O ASN A 124 -1.915 12.124 -8.391 1.00 0.00 O ATOM 1822 CB ASN A 124 -1.038 10.491 -10.977 1.00 0.00 C ATOM 1823 CG ASN A 124 -0.144 9.974 -9.844 1.00 0.00 C ATOM 1824 OD1 ASN A 124 0.017 10.628 -8.833 1.00 0.00 O ATOM 1825 ND2 ASN A 124 0.449 8.817 -9.974 1.00 0.00 N ATOM 0 H ASN A 124 -2.918 11.187 -12.458 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.785 10.128 -9.788 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -1.183 9.710 -11.723 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -0.555 11.328 -11.481 1.00 0.00 H new ATOM 0 HD21 ASN A 124 1.047 8.463 -9.227 1.00 0.00 H new ATOM 0 HD22 ASN A 124 0.314 8.267 -10.823 1.00 0.00 H new ATOM 1832 N LYS A 125 -2.402 13.339 -10.194 1.00 0.00 N ATOM 1833 CA LYS A 125 -2.269 14.645 -9.457 1.00 0.00 C ATOM 1834 C LYS A 125 -3.599 14.957 -8.740 1.00 0.00 C ATOM 1835 O LYS A 125 -3.624 15.650 -7.722 1.00 0.00 O ATOM 1836 CB LYS A 125 -1.972 15.763 -10.473 1.00 0.00 C ATOM 1837 CG LYS A 125 -0.546 15.623 -10.994 1.00 0.00 C ATOM 1838 CD LYS A 125 0.410 16.348 -10.047 1.00 0.00 C ATOM 1839 CE LYS A 125 1.803 16.409 -10.678 1.00 0.00 C ATOM 1840 NZ LYS A 125 2.491 17.686 -10.297 1.00 0.00 N ATOM 0 H LYS A 125 -2.647 13.428 -11.180 1.00 0.00 H new ATOM 0 HA LYS A 125 -1.462 14.580 -8.727 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.678 15.711 -11.302 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.103 16.738 -10.003 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -0.275 14.570 -11.067 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -0.470 16.042 -11.997 1.00 0.00 H new ATOM 0 HD2 LYS A 125 0.046 17.355 -9.846 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.455 15.828 -9.090 1.00 0.00 H new ATOM 0 HE2 LYS A 125 2.396 15.556 -10.349 1.00 0.00 H new ATOM 0 HE3 LYS A 125 1.722 16.341 -11.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.435 17.715 -10.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 1.931 18.496 -10.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 2.585 17.735 -9.262 1.00 0.00 H new ATOM 1854 N LYS A 126 -4.708 14.452 -9.276 1.00 0.00 N ATOM 1855 CA LYS A 126 -6.053 14.716 -8.672 1.00 0.00 C ATOM 1856 C LYS A 126 -6.420 13.632 -7.649 1.00 0.00 C ATOM 1857 O LYS A 126 -7.331 13.811 -6.853 1.00 0.00 O ATOM 1858 CB LYS A 126 -7.079 14.762 -9.801 1.00 0.00 C ATOM 1859 CG LYS A 126 -6.883 16.068 -10.577 1.00 0.00 C ATOM 1860 CD LYS A 126 -7.928 16.180 -11.682 1.00 0.00 C ATOM 1861 CE LYS A 126 -7.514 15.306 -12.874 1.00 0.00 C ATOM 1862 NZ LYS A 126 -6.487 16.023 -13.674 1.00 0.00 N ATOM 0 H LYS A 126 -4.725 13.866 -10.111 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.038 15.667 -8.140 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -6.954 13.905 -10.463 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -8.090 14.708 -9.397 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -6.965 16.919 -9.900 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -5.882 16.098 -11.007 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.902 15.865 -11.308 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -8.028 17.219 -11.997 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -7.118 14.354 -12.521 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -8.382 15.080 -13.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -6.518 15.689 -14.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -6.679 17.045 -13.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -5.545 15.838 -13.275 1.00 0.00 H new ATOM 1876 N CYS A 127 -5.683 12.535 -7.631 1.00 0.00 N ATOM 1877 CA CYS A 127 -5.934 11.449 -6.635 1.00 0.00 C ATOM 1878 C CYS A 127 -5.053 11.732 -5.458 1.00 0.00 C ATOM 1879 O CYS A 127 -5.435 11.556 -4.323 1.00 0.00 O ATOM 1880 CB CYS A 127 -5.545 10.092 -7.218 1.00 0.00 C ATOM 1881 SG CYS A 127 -6.394 8.772 -6.312 1.00 0.00 S ATOM 0 H CYS A 127 -4.913 12.352 -8.274 1.00 0.00 H new ATOM 0 HA CYS A 127 -6.989 11.421 -6.362 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.810 10.050 -8.274 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.466 9.954 -7.154 1.00 0.00 H new ATOM 0 HG CYS A 127 -6.526 7.733 -7.082 1.00 0.00 H new ATOM 1887 N TYR A 128 -3.846 12.175 -5.749 1.00 0.00 N ATOM 1888 CA TYR A 128 -2.861 12.507 -4.705 1.00 0.00 C ATOM 1889 C TYR A 128 -3.402 13.692 -3.901 1.00 0.00 C ATOM 1890 O TYR A 128 -3.249 13.752 -2.684 1.00 0.00 O ATOM 1891 CB TYR A 128 -1.548 12.868 -5.423 1.00 0.00 C ATOM 1892 CG TYR A 128 -0.500 13.352 -4.462 1.00 0.00 C ATOM 1893 CD1 TYR A 128 -0.299 12.708 -3.233 1.00 0.00 C ATOM 1894 CD2 TYR A 128 0.285 14.446 -4.820 1.00 0.00 C ATOM 1895 CE1 TYR A 128 0.692 13.162 -2.362 1.00 0.00 C ATOM 1896 CE2 TYR A 128 1.279 14.906 -3.950 1.00 0.00 C ATOM 1897 CZ TYR A 128 1.484 14.264 -2.718 1.00 0.00 C ATOM 1898 OH TYR A 128 2.469 14.716 -1.860 1.00 0.00 O ATOM 0 H TYR A 128 -3.510 12.318 -6.701 1.00 0.00 H new ATOM 0 HA TYR A 128 -2.682 11.679 -4.018 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -1.175 11.995 -5.958 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -1.742 13.640 -6.168 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -0.911 11.861 -2.961 1.00 0.00 H new ATOM 0 HD2 TYR A 128 0.126 14.938 -5.768 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.849 12.666 -1.416 1.00 0.00 H new ATOM 0 HE2 TYR A 128 1.888 15.754 -4.226 1.00 0.00 H new ATOM 0 HH TYR A 128 2.924 15.486 -2.261 1.00 0.00 H new ATOM 1908 N GLU A 129 -4.066 14.625 -4.579 1.00 0.00 N ATOM 1909 CA GLU A 129 -4.658 15.813 -3.870 1.00 0.00 C ATOM 1910 C GLU A 129 -5.941 15.379 -3.142 1.00 0.00 C ATOM 1911 O GLU A 129 -6.264 15.875 -2.054 1.00 0.00 O ATOM 1912 CB GLU A 129 -4.985 16.903 -4.888 1.00 0.00 C ATOM 1913 CG GLU A 129 -3.746 17.772 -5.125 1.00 0.00 C ATOM 1914 CD GLU A 129 -3.562 18.732 -3.949 1.00 0.00 C ATOM 1915 OE1 GLU A 129 -4.514 19.417 -3.614 1.00 0.00 O ATOM 1916 OE2 GLU A 129 -2.470 18.767 -3.402 1.00 0.00 O ATOM 0 H GLU A 129 -4.218 14.607 -5.587 1.00 0.00 H new ATOM 0 HA GLU A 129 -3.943 16.203 -3.145 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -5.311 16.453 -5.826 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -5.809 17.518 -4.526 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -2.863 17.142 -5.235 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -3.855 18.334 -6.053 1.00 0.00 H new ATOM 1923 N MET A 130 -6.684 14.452 -3.729 1.00 0.00 N ATOM 1924 CA MET A 130 -7.946 13.980 -3.078 1.00 0.00 C ATOM 1925 C MET A 130 -7.588 13.325 -1.747 1.00 0.00 C ATOM 1926 O MET A 130 -8.296 13.479 -0.763 1.00 0.00 O ATOM 1927 CB MET A 130 -8.651 12.976 -3.984 1.00 0.00 C ATOM 1928 CG MET A 130 -10.164 13.070 -3.772 1.00 0.00 C ATOM 1929 SD MET A 130 -10.761 14.718 -4.302 1.00 0.00 S ATOM 1930 CE MET A 130 -10.436 14.564 -6.070 1.00 0.00 C ATOM 0 H MET A 130 -6.466 14.011 -4.623 1.00 0.00 H new ATOM 0 HA MET A 130 -8.617 14.822 -2.907 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.406 13.177 -5.027 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.305 11.966 -3.764 1.00 0.00 H new ATOM 0 HG2 MET A 130 -10.670 12.289 -4.340 1.00 0.00 H new ATOM 0 HG3 MET A 130 -10.405 12.906 -2.722 1.00 0.00 H new ATOM 0 HE1 MET A 130 -10.770 15.467 -6.581 1.00 0.00 H new ATOM 0 HE2 MET A 130 -9.367 14.429 -6.233 1.00 0.00 H new ATOM 0 HE3 MET A 130 -10.975 13.703 -6.465 1.00 0.00 H new ATOM 1940 N ALA A 131 -6.462 12.631 -1.705 1.00 0.00 N ATOM 1941 CA ALA A 131 -6.000 11.989 -0.433 1.00 0.00 C ATOM 1942 C ALA A 131 -5.438 13.062 0.455 1.00 0.00 C ATOM 1943 O ALA A 131 -5.439 12.913 1.657 1.00 0.00 O ATOM 1944 CB ALA A 131 -4.936 10.932 -0.718 1.00 0.00 C ATOM 0 H ALA A 131 -5.846 12.486 -2.505 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.839 11.493 0.056 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -4.614 10.478 0.219 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.352 10.163 -1.370 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.081 11.399 -1.207 1.00 0.00 H new ATOM 1950 N SER A 132 -4.987 14.196 -0.123 1.00 0.00 N ATOM 1951 CA SER A 132 -4.483 15.309 0.735 1.00 0.00 C ATOM 1952 C SER A 132 -5.651 15.733 1.634 1.00 0.00 C ATOM 1953 O SER A 132 -5.440 16.163 2.757 1.00 0.00 O ATOM 1954 CB SER A 132 -3.985 16.490 -0.112 1.00 0.00 C ATOM 1955 OG SER A 132 -2.750 16.135 -0.725 1.00 0.00 O ATOM 0 H SER A 132 -4.957 14.370 -1.128 1.00 0.00 H new ATOM 0 HA SER A 132 -3.631 14.979 1.329 1.00 0.00 H new ATOM 0 HB2 SER A 132 -4.723 16.745 -0.873 1.00 0.00 H new ATOM 0 HB3 SER A 132 -3.854 17.373 0.514 1.00 0.00 H new ATOM 0 HG SER A 132 -2.894 15.387 -1.341 1.00 0.00 H new ATOM 1961 N HIS A 133 -6.919 15.555 1.157 1.00 0.00 N ATOM 1962 CA HIS A 133 -8.095 15.893 2.046 1.00 0.00 C ATOM 1963 C HIS A 133 -8.269 14.780 3.038 1.00 0.00 C ATOM 1964 O HIS A 133 -8.531 15.028 4.189 1.00 0.00 O ATOM 1965 CB HIS A 133 -9.418 16.074 1.293 1.00 0.00 C ATOM 1966 CG HIS A 133 -10.313 16.891 2.185 1.00 0.00 C ATOM 1967 ND1 HIS A 133 -11.201 16.301 3.082 1.00 0.00 N ATOM 1968 CD2 HIS A 133 -10.416 18.244 2.392 1.00 0.00 C ATOM 1969 CE1 HIS A 133 -11.787 17.291 3.784 1.00 0.00 C ATOM 1970 NE2 HIS A 133 -11.345 18.495 3.401 1.00 0.00 N ATOM 0 H HIS A 133 -7.155 15.205 0.229 1.00 0.00 H new ATOM 0 HA HIS A 133 -7.868 16.849 2.518 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -9.256 16.578 0.341 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -9.871 15.108 1.069 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -9.862 18.999 1.855 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -12.522 17.133 4.559 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -11.628 19.403 3.769 1.00 0.00 H new ATOM 1978 N LEU A 134 -8.126 13.532 2.592 1.00 0.00 N ATOM 1979 CA LEU A 134 -8.273 12.370 3.521 1.00 0.00 C ATOM 1980 C LEU A 134 -7.149 12.363 4.558 1.00 0.00 C ATOM 1981 O LEU A 134 -7.253 11.708 5.590 1.00 0.00 O ATOM 1982 CB LEU A 134 -8.288 11.093 2.695 1.00 0.00 C ATOM 1983 CG LEU A 134 -9.661 10.967 2.040 1.00 0.00 C ATOM 1984 CD1 LEU A 134 -9.641 11.557 0.646 1.00 0.00 C ATOM 1985 CD2 LEU A 134 -10.069 9.502 1.969 1.00 0.00 C ATOM 0 H LEU A 134 -7.915 13.285 1.625 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.209 12.446 4.074 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -7.506 11.121 1.936 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.087 10.228 3.328 1.00 0.00 H new ATOM 0 HG LEU A 134 -10.384 11.516 2.643 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -10.628 11.458 0.195 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -9.371 12.612 0.701 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -8.909 11.027 0.037 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -11.050 9.420 1.500 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -9.338 8.949 1.380 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -10.112 9.087 2.976 1.00 0.00 H new ATOM 1997 N ARG A 135 -6.120 13.133 4.325 1.00 0.00 N ATOM 1998 CA ARG A 135 -5.006 13.259 5.322 1.00 0.00 C ATOM 1999 C ARG A 135 -5.408 14.379 6.256 1.00 0.00 C ATOM 2000 O ARG A 135 -5.245 14.289 7.466 1.00 0.00 O ATOM 2001 CB ARG A 135 -3.688 13.601 4.615 1.00 0.00 C ATOM 2002 CG ARG A 135 -2.952 12.310 4.231 1.00 0.00 C ATOM 2003 CD ARG A 135 -1.930 11.959 5.314 1.00 0.00 C ATOM 2004 NE ARG A 135 -0.790 12.916 5.251 1.00 0.00 N ATOM 2005 CZ ARG A 135 0.155 12.868 6.151 1.00 0.00 C ATOM 2006 NH1 ARG A 135 -0.139 13.019 7.413 1.00 0.00 N ATOM 2007 NH2 ARG A 135 1.393 12.664 5.790 1.00 0.00 N ATOM 0 H ARG A 135 -5.999 13.688 3.478 1.00 0.00 H new ATOM 0 HA ARG A 135 -4.848 12.325 5.861 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -3.887 14.196 3.723 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -3.061 14.207 5.269 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -3.665 11.495 4.112 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -2.451 12.437 3.271 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -2.398 11.999 6.297 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -1.571 10.940 5.173 1.00 0.00 H new ATOM 0 HE ARG A 135 -0.748 13.609 4.504 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -1.106 13.174 7.696 1.00 0.00 H new ATOM 0 HH12 ARG A 135 0.599 12.982 8.117 1.00 0.00 H new ATOM 0 HH21 ARG A 135 1.623 12.542 4.804 1.00 0.00 H new ATOM 0 HH22 ARG A 135 2.130 12.627 6.494 1.00 0.00 H new ATOM 2021 N ARG A 136 -6.016 15.419 5.689 1.00 0.00 N ATOM 2022 CA ARG A 136 -6.534 16.543 6.507 1.00 0.00 C ATOM 2023 C ARG A 136 -7.906 16.127 7.096 1.00 0.00 C ATOM 2024 O ARG A 136 -8.513 16.862 7.864 1.00 0.00 O ATOM 2025 CB ARG A 136 -6.703 17.772 5.618 1.00 0.00 C ATOM 2026 CG ARG A 136 -5.321 18.286 5.183 1.00 0.00 C ATOM 2027 CD ARG A 136 -5.375 19.805 4.955 1.00 0.00 C ATOM 2028 NE ARG A 136 -5.017 20.109 3.539 1.00 0.00 N ATOM 2029 CZ ARG A 136 -5.953 20.215 2.637 1.00 0.00 C ATOM 2030 NH1 ARG A 136 -6.626 19.160 2.266 1.00 0.00 N ATOM 2031 NH2 ARG A 136 -6.219 21.376 2.105 1.00 0.00 N ATOM 0 H ARG A 136 -6.166 15.518 4.685 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.841 16.780 7.315 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -7.301 17.521 4.742 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -7.240 18.553 6.157 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -4.579 18.050 5.946 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -5.008 17.783 4.268 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -6.373 20.182 5.178 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -4.686 20.310 5.632 1.00 0.00 H new ATOM 0 HE ARG A 136 -4.039 20.234 3.276 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -6.420 18.252 2.682 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -7.358 19.244 1.560 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -5.695 22.202 2.394 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.951 21.458 1.400 1.00 0.00 H new ATOM 2045 N SER A 137 -8.383 14.929 6.734 1.00 0.00 N ATOM 2046 CA SER A 137 -9.675 14.413 7.235 1.00 0.00 C ATOM 2047 C SER A 137 -9.449 13.727 8.603 1.00 0.00 C ATOM 2048 O SER A 137 -10.397 13.452 9.321 1.00 0.00 O ATOM 2049 CB SER A 137 -10.233 13.395 6.201 1.00 0.00 C ATOM 2050 OG SER A 137 -9.555 12.147 6.325 1.00 0.00 O ATOM 0 H SER A 137 -7.899 14.296 6.098 1.00 0.00 H new ATOM 0 HA SER A 137 -10.391 15.225 7.365 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.302 13.254 6.359 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.109 13.786 5.191 1.00 0.00 H new ATOM 0 HG SER A 137 -8.600 12.307 6.474 1.00 0.00 H new ATOM 2056 N GLN A 138 -8.172 13.432 8.955 1.00 0.00 N ATOM 2057 CA GLN A 138 -7.851 12.745 10.271 1.00 0.00 C ATOM 2058 C GLN A 138 -8.107 11.237 10.121 1.00 0.00 C ATOM 2059 O GLN A 138 -8.437 10.546 11.081 1.00 0.00 O ATOM 2060 CB GLN A 138 -8.721 13.326 11.424 1.00 0.00 C ATOM 2061 CG GLN A 138 -7.830 13.678 12.624 1.00 0.00 C ATOM 2062 CD GLN A 138 -8.310 14.990 13.261 1.00 0.00 C ATOM 2063 OE1 GLN A 138 -7.529 15.894 13.473 1.00 0.00 O ATOM 2064 NE2 GLN A 138 -9.570 15.129 13.579 1.00 0.00 N ATOM 0 H GLN A 138 -7.357 13.644 8.379 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.804 12.919 10.521 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -9.250 14.215 11.080 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -9.477 12.600 11.722 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -7.860 12.874 13.359 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -6.793 13.777 12.302 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -10.228 14.370 13.401 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -9.896 15.997 14.005 1.00 0.00 H new ATOM 2073 N TYR A 139 -7.943 10.724 8.905 1.00 0.00 N ATOM 2074 CA TYR A 139 -8.157 9.262 8.645 1.00 0.00 C ATOM 2075 C TYR A 139 -6.926 8.696 7.937 1.00 0.00 C ATOM 2076 O TYR A 139 -6.425 7.683 8.381 1.00 0.00 O ATOM 2077 CB TYR A 139 -9.384 9.068 7.749 1.00 0.00 C ATOM 2078 CG TYR A 139 -10.641 9.420 8.508 1.00 0.00 C ATOM 2079 CD1 TYR A 139 -10.944 8.765 9.708 1.00 0.00 C ATOM 2080 CD2 TYR A 139 -11.508 10.398 8.006 1.00 0.00 C ATOM 2081 CE1 TYR A 139 -12.113 9.088 10.405 1.00 0.00 C ATOM 2082 CE2 TYR A 139 -12.677 10.721 8.702 1.00 0.00 C ATOM 2083 CZ TYR A 139 -12.980 10.066 9.902 1.00 0.00 C ATOM 2084 OH TYR A 139 -14.131 10.385 10.591 1.00 0.00 O ATOM 2085 OXT TYR A 139 -6.506 9.290 6.956 1.00 0.00 O ATOM 0 H TYR A 139 -7.669 11.266 8.086 1.00 0.00 H new ATOM 0 HA TYR A 139 -8.316 8.745 9.592 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.298 9.694 6.861 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -9.434 8.034 7.406 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -10.275 8.011 10.095 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -11.274 10.903 7.081 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -12.347 8.583 11.331 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -13.346 11.475 8.314 1.00 0.00 H new ATOM 0 HH TYR A 139 -14.619 11.083 10.107 1.00 0.00 H new