USER MOD reduce.3.24.130724 H: found=0, std=0, add=823, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 822 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 Single : A 1 MET CE :methyl -134:sc= -0.225 (180deg=-1.88) USER MOD Single : A 1 MET N :NH3+ -113:sc= 0.0622 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -2.56! C(o=-2.6!,f=-5.1!) USER MOD Single : A 13 LYS NZ :NH3+ 161:sc= 0.576 (180deg=0.208) USER MOD Single : A 16 SER OG : rot -76:sc= 0.0494 USER MOD Single : A 17 TYR OH : rot 150:sc= -0.592 USER MOD Single : A 22 LYS NZ :NH3+ -161:sc= 0.955 (180deg=0.722) USER MOD Single : A 23 MET CE :methyl 165:sc= -1.85 (180deg=-2.52) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 34 MET CE :methyl 177:sc= -0.433 (180deg=-0.445) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN :FLIP amide:sc= -0.219 F(o=-2.5!,f=-0.22) USER MOD Single : A 47 LYS NZ :NH3+ -145:sc= -2.45! (180deg=-4.9!) USER MOD Single : A 48 GLN : amide:sc= -2.15 K(o=-2.2,f=-12!) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : B 101 MET CE :methyl -160:sc= -0.0092 (180deg=-0.608) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 105 ASN : amide:sc= -2.93! C(o=-2.9!,f=-5.9!) USER MOD Single : B 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 116 SER OG : rot -83:sc= 0.586 USER MOD Single : B 117 TYR OH : rot 180:sc= -0.19 USER MOD Single : B 122 LYS NZ :NH3+ 174:sc= 1.01 (180deg=0.955) USER MOD Single : B 123 MET CE :methyl 142:sc= -2.09 (180deg=-3.47!) USER MOD Single : B 126 THR OG1 : rot 94:sc= 0.00994 USER MOD Single : B 128 SER OG : rot 180:sc= 0.00753 USER MOD Single : B 134 MET CE :methyl 148:sc= -0.656 (180deg=-1.03) USER MOD Single : B 137 TYR OH : rot 180:sc= -0.857 USER MOD Single : B 141 ASN : amide:sc= 0.908 K(o=0.91,f=-0.11) USER MOD Single : B 147 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0681) USER MOD Single : B 148 GLN :FLIP amide:sc= -0.428 F(o=-5.1!,f=-0.43) USER MOD Single : B 149 THR OG1 : rot -41:sc= 0.994 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.918 13.534 11.611 1.00 0.00 N ATOM 2 CA MET A 1 -2.444 12.194 11.185 1.00 0.00 C ATOM 3 C MET A 1 -2.840 11.138 12.214 1.00 0.00 C ATOM 4 O MET A 1 -3.044 11.436 13.390 1.00 0.00 O ATOM 5 CB MET A 1 -0.925 12.203 10.979 1.00 0.00 C ATOM 6 CG MET A 1 -0.279 10.820 10.842 1.00 0.00 C ATOM 7 SD MET A 1 1.464 10.918 10.360 1.00 0.00 S ATOM 8 CE MET A 1 1.324 11.677 8.738 1.00 0.00 C ATOM 0 H1 MET A 1 -3.655 13.866 10.956 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.311 13.474 12.572 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.121 14.203 11.604 1.00 0.00 H new ATOM 0 HA MET A 1 -2.917 11.944 10.235 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.699 12.783 10.084 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.463 12.721 11.820 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.362 10.288 11.790 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.826 10.238 10.100 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.958 11.143 8.030 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.288 11.631 8.403 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.641 12.718 8.795 1.00 0.00 H new ATOM 18 N GLY A 2 -2.957 9.905 11.730 1.00 0.00 N ATOM 19 CA GLY A 2 -3.223 8.770 12.593 1.00 0.00 C ATOM 20 C GLY A 2 -2.350 7.594 12.209 1.00 0.00 C ATOM 21 O GLY A 2 -1.754 7.596 11.121 1.00 0.00 O ATOM 0 H GLY A 2 -2.871 9.671 10.741 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -3.037 9.044 13.631 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -4.274 8.489 12.520 1.00 0.00 H new ATOM 25 N SER A 3 -2.264 6.613 13.084 1.00 0.00 N ATOM 26 CA SER A 3 -1.455 5.425 12.840 1.00 0.00 C ATOM 27 C SER A 3 -2.317 4.163 12.834 1.00 0.00 C ATOM 28 O SER A 3 -3.278 4.031 13.590 1.00 0.00 O ATOM 29 CB SER A 3 -0.332 5.324 13.892 1.00 0.00 C ATOM 30 OG SER A 3 -0.829 5.564 15.193 1.00 0.00 O ATOM 0 H SER A 3 -2.748 6.611 13.982 1.00 0.00 H new ATOM 0 HA SER A 3 -0.999 5.514 11.854 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.122 4.334 13.850 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.453 6.044 13.661 1.00 0.00 H new ATOM 0 HG SER A 3 -0.097 5.492 15.841 1.00 0.00 H new ATOM 36 N ILE A 4 -1.984 3.251 11.919 1.00 0.00 N ATOM 37 CA ILE A 4 -2.721 1.997 11.748 1.00 0.00 C ATOM 38 C ILE A 4 -1.783 0.819 11.966 1.00 0.00 C ATOM 39 O ILE A 4 -0.561 1.007 12.037 1.00 0.00 O ATOM 40 CB ILE A 4 -3.374 1.918 10.338 1.00 0.00 C ATOM 41 CG1 ILE A 4 -2.326 1.823 9.198 1.00 0.00 C ATOM 42 CG2 ILE A 4 -4.301 3.123 10.115 1.00 0.00 C ATOM 43 CD1 ILE A 4 -1.941 0.406 8.811 1.00 0.00 C ATOM 0 H ILE A 4 -1.199 3.360 11.277 1.00 0.00 H new ATOM 0 HA ILE A 4 -3.521 1.961 12.487 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.959 0.999 10.307 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -2.719 2.332 8.318 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -1.427 2.360 9.502 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.752 3.057 9.125 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.085 3.124 10.872 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.724 4.045 10.190 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -1.205 0.436 8.008 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -1.515 -0.104 9.675 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -2.826 -0.132 8.472 1.00 0.00 H new ATOM 55 N ASN A 5 -2.341 -0.387 12.056 1.00 0.00 N ATOM 56 CA ASN A 5 -1.541 -1.601 12.224 1.00 0.00 C ATOM 57 C ASN A 5 -1.649 -2.422 10.955 1.00 0.00 C ATOM 58 O ASN A 5 -2.759 -2.771 10.530 1.00 0.00 O ATOM 59 CB ASN A 5 -2.024 -2.408 13.430 1.00 0.00 C ATOM 60 CG ASN A 5 -1.200 -3.672 13.644 1.00 0.00 C ATOM 61 OD1 ASN A 5 -0.265 -3.697 14.452 1.00 0.00 O ATOM 62 ND2 ASN A 5 -1.522 -4.729 12.915 1.00 0.00 N ATOM 0 H ASN A 5 -3.347 -0.551 12.015 1.00 0.00 H new ATOM 0 HA ASN A 5 -0.500 -1.333 12.406 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -1.973 -1.787 14.324 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -3.071 -2.678 13.289 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -0.993 -5.596 13.012 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -2.299 -4.677 12.257 1.00 0.00 H new ATOM 69 N LEU A 6 -0.509 -2.720 10.351 1.00 0.00 N ATOM 70 CA LEU A 6 -0.456 -3.548 9.157 1.00 0.00 C ATOM 71 C LEU A 6 0.175 -4.896 9.539 1.00 0.00 C ATOM 72 O LEU A 6 1.026 -4.940 10.432 1.00 0.00 O ATOM 73 CB LEU A 6 0.328 -2.790 8.075 1.00 0.00 C ATOM 74 CG LEU A 6 0.480 -3.463 6.691 1.00 0.00 C ATOM 75 CD1 LEU A 6 1.584 -4.504 6.684 1.00 0.00 C ATOM 76 CD2 LEU A 6 -0.849 -4.065 6.229 1.00 0.00 C ATOM 0 H LEU A 6 0.403 -2.396 10.674 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.445 -3.756 8.748 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -0.154 -1.824 7.927 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.327 -2.591 8.463 1.00 0.00 H new ATOM 0 HG LEU A 6 0.768 -2.687 5.982 1.00 0.00 H new ATOM 0 HD11 LEU A 6 1.656 -4.951 5.693 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.532 -4.030 6.938 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.358 -5.279 7.416 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -0.717 -4.533 5.253 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -1.179 -4.814 6.949 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.599 -3.278 6.155 1.00 0.00 H new ATOM 88 N ARG A 7 -0.216 -6.004 8.884 1.00 0.00 N ATOM 89 CA ARG A 7 0.238 -7.333 9.272 1.00 0.00 C ATOM 90 C ARG A 7 0.598 -8.126 8.024 1.00 0.00 C ATOM 91 O ARG A 7 -0.271 -8.404 7.200 1.00 0.00 O ATOM 92 CB ARG A 7 -0.822 -8.096 10.072 1.00 0.00 C ATOM 93 CG ARG A 7 -1.006 -7.613 11.511 1.00 0.00 C ATOM 94 CD ARG A 7 -1.272 -8.768 12.460 1.00 0.00 C ATOM 95 NE ARG A 7 -1.528 -8.300 13.825 1.00 0.00 N ATOM 96 CZ ARG A 7 -1.105 -8.889 14.953 1.00 0.00 C ATOM 97 NH1 ARG A 7 -0.420 -10.017 14.879 1.00 0.00 N ATOM 98 NH2 ARG A 7 -1.378 -8.348 16.125 1.00 0.00 N ATOM 0 H ARG A 7 -0.847 -5.995 8.083 1.00 0.00 H new ATOM 0 HA ARG A 7 1.111 -7.211 9.914 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -1.777 -8.017 9.552 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -0.554 -9.152 10.089 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -0.113 -7.076 11.832 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -1.835 -6.907 11.555 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -2.129 -9.341 12.105 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -0.416 -9.443 12.461 1.00 0.00 H new ATOM 0 HE ARG A 7 -2.079 -7.448 13.926 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -0.217 -10.432 13.969 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -0.094 -10.473 15.731 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -1.912 -7.480 16.174 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -1.055 -8.798 16.982 1.00 0.00 H new ATOM 112 N ILE A 8 1.868 -8.468 7.875 1.00 0.00 N ATOM 113 CA ILE A 8 2.312 -9.323 6.774 1.00 0.00 C ATOM 114 C ILE A 8 3.386 -10.262 7.321 1.00 0.00 C ATOM 115 O ILE A 8 3.818 -10.098 8.457 1.00 0.00 O ATOM 116 CB ILE A 8 2.915 -8.526 5.558 1.00 0.00 C ATOM 117 CG1 ILE A 8 4.266 -7.858 5.892 1.00 0.00 C ATOM 118 CG2 ILE A 8 1.901 -7.494 5.049 1.00 0.00 C ATOM 119 CD1 ILE A 8 4.240 -6.868 7.043 1.00 0.00 C ATOM 0 H ILE A 8 2.615 -8.168 8.502 1.00 0.00 H new ATOM 0 HA ILE A 8 1.438 -9.855 6.397 1.00 0.00 H new ATOM 0 HB ILE A 8 3.119 -9.248 4.767 1.00 0.00 H new ATOM 0 HG12 ILE A 8 4.990 -8.639 6.124 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.627 -7.343 5.001 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.328 -6.948 4.208 1.00 0.00 H new ATOM 0 HG22 ILE A 8 0.993 -8.004 4.727 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.660 -6.795 5.850 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.239 -6.458 7.193 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.547 -6.059 6.812 1.00 0.00 H new ATOM 0 HD13 ILE A 8 3.916 -7.375 7.952 1.00 0.00 H new ATOM 131 N ASP A 9 3.807 -11.235 6.533 1.00 0.00 N ATOM 132 CA ASP A 9 4.880 -12.106 6.982 1.00 0.00 C ATOM 133 C ASP A 9 6.155 -11.291 7.063 1.00 0.00 C ATOM 134 O ASP A 9 6.482 -10.533 6.137 1.00 0.00 O ATOM 135 CB ASP A 9 5.081 -13.312 6.073 1.00 0.00 C ATOM 136 CG ASP A 9 5.914 -14.387 6.750 1.00 0.00 C ATOM 137 OD1 ASP A 9 7.126 -14.165 6.968 1.00 0.00 O ATOM 138 OD2 ASP A 9 5.364 -15.425 7.109 1.00 0.00 O ATOM 0 H ASP A 9 3.436 -11.440 5.605 1.00 0.00 H new ATOM 0 HA ASP A 9 4.610 -12.503 7.961 1.00 0.00 H new ATOM 0 HB2 ASP A 9 4.111 -13.724 5.794 1.00 0.00 H new ATOM 0 HB3 ASP A 9 5.571 -12.997 5.152 1.00 0.00 H new ATOM 143 N ASP A 10 6.877 -11.436 8.168 1.00 0.00 N ATOM 144 CA ASP A 10 8.069 -10.636 8.444 1.00 0.00 C ATOM 145 C ASP A 10 9.103 -10.772 7.330 1.00 0.00 C ATOM 146 O ASP A 10 9.912 -9.856 7.113 1.00 0.00 O ATOM 147 CB ASP A 10 8.684 -11.061 9.794 1.00 0.00 C ATOM 148 CG ASP A 10 9.780 -10.120 10.275 1.00 0.00 C ATOM 149 OD1 ASP A 10 9.506 -8.917 10.481 1.00 0.00 O ATOM 150 OD2 ASP A 10 10.919 -10.591 10.496 1.00 0.00 O ATOM 0 H ASP A 10 6.654 -12.111 8.899 1.00 0.00 H new ATOM 0 HA ASP A 10 7.770 -9.589 8.495 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.897 -11.107 10.547 1.00 0.00 H new ATOM 0 HB3 ASP A 10 9.093 -12.067 9.699 1.00 0.00 H new ATOM 155 N GLU A 11 9.058 -11.878 6.598 1.00 0.00 N ATOM 156 CA GLU A 11 9.979 -12.099 5.492 1.00 0.00 C ATOM 157 C GLU A 11 9.757 -11.065 4.394 1.00 0.00 C ATOM 158 O GLU A 11 10.709 -10.506 3.851 1.00 0.00 O ATOM 159 CB GLU A 11 9.821 -13.526 4.896 1.00 0.00 C ATOM 160 CG GLU A 11 8.500 -13.764 4.177 1.00 0.00 C ATOM 161 CD GLU A 11 8.456 -15.086 3.431 1.00 0.00 C ATOM 162 OE1 GLU A 11 9.170 -15.221 2.420 1.00 0.00 O ATOM 163 OE2 GLU A 11 7.698 -15.997 3.844 1.00 0.00 O ATOM 0 H GLU A 11 8.393 -12.636 6.751 1.00 0.00 H new ATOM 0 HA GLU A 11 10.990 -11.998 5.887 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.638 -13.708 4.198 1.00 0.00 H new ATOM 0 HB3 GLU A 11 9.920 -14.255 5.700 1.00 0.00 H new ATOM 0 HG2 GLU A 11 7.688 -13.737 4.904 1.00 0.00 H new ATOM 0 HG3 GLU A 11 8.325 -12.951 3.473 1.00 0.00 H new ATOM 170 N LEU A 12 8.493 -10.763 4.120 1.00 0.00 N ATOM 171 CA LEU A 12 8.130 -9.873 3.019 1.00 0.00 C ATOM 172 C LEU A 12 8.439 -8.441 3.427 1.00 0.00 C ATOM 173 O LEU A 12 8.968 -7.649 2.638 1.00 0.00 O ATOM 174 CB LEU A 12 6.639 -10.014 2.678 1.00 0.00 C ATOM 175 CG LEU A 12 6.133 -9.134 1.527 1.00 0.00 C ATOM 176 CD1 LEU A 12 6.865 -9.467 0.221 1.00 0.00 C ATOM 177 CD2 LEU A 12 4.611 -9.297 1.355 1.00 0.00 C ATOM 0 H LEU A 12 7.697 -11.123 4.647 1.00 0.00 H new ATOM 0 HA LEU A 12 8.705 -10.140 2.133 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.439 -11.056 2.429 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.058 -9.782 3.570 1.00 0.00 H new ATOM 0 HG LEU A 12 6.343 -8.093 1.774 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.489 -8.830 -0.580 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.934 -9.296 0.349 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.693 -10.512 -0.036 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.268 -8.666 0.535 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.379 -10.339 1.133 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.107 -9.001 2.275 1.00 0.00 H new ATOM 189 N LYS A 13 8.107 -8.141 4.673 1.00 0.00 N ATOM 190 CA LYS A 13 8.376 -6.840 5.277 1.00 0.00 C ATOM 191 C LYS A 13 9.832 -6.460 5.105 1.00 0.00 C ATOM 192 O LYS A 13 10.156 -5.305 4.830 1.00 0.00 O ATOM 193 CB LYS A 13 7.961 -6.901 6.755 1.00 0.00 C ATOM 194 CG LYS A 13 8.401 -5.723 7.644 1.00 0.00 C ATOM 195 CD LYS A 13 9.823 -5.929 8.193 1.00 0.00 C ATOM 196 CE LYS A 13 9.980 -5.343 9.585 1.00 0.00 C ATOM 197 NZ LYS A 13 9.088 -6.016 10.576 1.00 0.00 N ATOM 0 H LYS A 13 7.640 -8.796 5.300 1.00 0.00 H new ATOM 0 HA LYS A 13 7.796 -6.062 4.780 1.00 0.00 H new ATOM 0 HB2 LYS A 13 6.875 -6.975 6.801 1.00 0.00 H new ATOM 0 HB3 LYS A 13 8.362 -7.820 7.184 1.00 0.00 H new ATOM 0 HG2 LYS A 13 8.363 -4.798 7.069 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.703 -5.612 8.473 1.00 0.00 H new ATOM 0 HD2 LYS A 13 10.052 -6.994 8.219 1.00 0.00 H new ATOM 0 HD3 LYS A 13 10.543 -5.465 7.520 1.00 0.00 H new ATOM 0 HE2 LYS A 13 11.017 -5.441 9.905 1.00 0.00 H new ATOM 0 HE3 LYS A 13 9.754 -4.277 9.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.436 -5.831 11.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 8.121 -5.645 10.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.085 -7.041 10.400 1.00 0.00 H new ATOM 211 N ALA A 14 10.716 -7.447 5.261 1.00 0.00 N ATOM 212 CA ALA A 14 12.153 -7.228 5.163 1.00 0.00 C ATOM 213 C ALA A 14 12.536 -6.725 3.764 1.00 0.00 C ATOM 214 O ALA A 14 13.220 -5.704 3.632 1.00 0.00 O ATOM 215 CB ALA A 14 12.897 -8.515 5.484 1.00 0.00 C ATOM 0 H ALA A 14 10.455 -8.413 5.457 1.00 0.00 H new ATOM 0 HA ALA A 14 12.436 -6.463 5.886 1.00 0.00 H new ATOM 0 HB1 ALA A 14 13.971 -8.343 5.409 1.00 0.00 H new ATOM 0 HB2 ALA A 14 12.651 -8.835 6.497 1.00 0.00 H new ATOM 0 HB3 ALA A 14 12.603 -9.291 4.777 1.00 0.00 H new ATOM 221 N ARG A 15 12.083 -7.435 2.725 1.00 0.00 N ATOM 222 CA ARG A 15 12.435 -7.094 1.341 1.00 0.00 C ATOM 223 C ARG A 15 11.860 -5.728 0.948 1.00 0.00 C ATOM 224 O ARG A 15 12.550 -4.922 0.333 1.00 0.00 O ATOM 225 CB ARG A 15 11.927 -8.163 0.354 1.00 0.00 C ATOM 226 CG ARG A 15 12.720 -9.467 0.352 1.00 0.00 C ATOM 227 CD ARG A 15 12.615 -10.244 1.663 1.00 0.00 C ATOM 228 NE ARG A 15 13.162 -11.597 1.559 1.00 0.00 N ATOM 229 CZ ARG A 15 13.216 -12.466 2.559 1.00 0.00 C ATOM 230 NH1 ARG A 15 12.790 -12.120 3.773 1.00 0.00 N ATOM 231 NH2 ARG A 15 13.714 -13.680 2.358 1.00 0.00 N ATOM 0 H ARG A 15 11.473 -8.248 2.815 1.00 0.00 H new ATOM 0 HA ARG A 15 13.523 -7.054 1.288 1.00 0.00 H new ATOM 0 HB2 ARG A 15 10.887 -8.388 0.589 1.00 0.00 H new ATOM 0 HB3 ARG A 15 11.943 -7.744 -0.652 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.367 -10.097 -0.464 1.00 0.00 H new ATOM 0 HG3 ARG A 15 13.768 -9.245 0.153 1.00 0.00 H new ATOM 0 HD2 ARG A 15 13.144 -9.701 2.446 1.00 0.00 H new ATOM 0 HD3 ARG A 15 11.569 -10.301 1.965 1.00 0.00 H new ATOM 0 HE ARG A 15 13.527 -11.892 0.654 1.00 0.00 H new ATOM 0 HH11 ARG A 15 12.420 -11.183 3.936 1.00 0.00 H new ATOM 0 HH12 ARG A 15 12.833 -12.792 4.539 1.00 0.00 H new ATOM 0 HH21 ARG A 15 14.055 -13.945 1.434 1.00 0.00 H new ATOM 0 HH22 ARG A 15 13.755 -14.348 3.128 1.00 0.00 H new ATOM 245 N SER A 16 10.595 -5.500 1.289 1.00 0.00 N ATOM 246 CA SER A 16 9.898 -4.275 0.929 1.00 0.00 C ATOM 247 C SER A 16 10.548 -3.057 1.563 1.00 0.00 C ATOM 248 O SER A 16 10.950 -2.115 0.872 1.00 0.00 O ATOM 249 CB SER A 16 8.430 -4.377 1.356 1.00 0.00 C ATOM 250 OG SER A 16 8.295 -4.661 2.742 1.00 0.00 O ATOM 0 H SER A 16 10.028 -6.159 1.822 1.00 0.00 H new ATOM 0 HA SER A 16 9.957 -4.152 -0.152 1.00 0.00 H new ATOM 0 HB2 SER A 16 7.920 -3.441 1.127 1.00 0.00 H new ATOM 0 HB3 SER A 16 7.938 -5.158 0.777 1.00 0.00 H new ATOM 0 HG SER A 16 8.496 -5.607 2.903 1.00 0.00 H new ATOM 256 N TYR A 17 10.666 -3.079 2.887 1.00 0.00 N ATOM 257 CA TYR A 17 11.291 -1.992 3.626 1.00 0.00 C ATOM 258 C TYR A 17 12.710 -1.760 3.142 1.00 0.00 C ATOM 259 O TYR A 17 13.126 -0.612 2.955 1.00 0.00 O ATOM 260 CB TYR A 17 11.271 -2.259 5.146 1.00 0.00 C ATOM 261 CG TYR A 17 9.936 -1.948 5.792 1.00 0.00 C ATOM 262 CD1 TYR A 17 8.797 -2.678 5.446 1.00 0.00 C ATOM 263 CD2 TYR A 17 9.812 -0.931 6.731 1.00 0.00 C ATOM 264 CE1 TYR A 17 7.569 -2.406 6.031 1.00 0.00 C ATOM 265 CE2 TYR A 17 8.596 -0.650 7.306 1.00 0.00 C ATOM 266 CZ TYR A 17 7.470 -1.385 6.965 1.00 0.00 C ATOM 267 OH TYR A 17 6.250 -1.094 7.559 1.00 0.00 O ATOM 0 H TYR A 17 10.333 -3.845 3.472 1.00 0.00 H new ATOM 0 HA TYR A 17 10.710 -1.089 3.440 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.520 -3.305 5.327 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.046 -1.660 5.623 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.873 -3.466 4.712 1.00 0.00 H new ATOM 0 HD2 TYR A 17 10.681 -0.355 7.012 1.00 0.00 H new ATOM 0 HE1 TYR A 17 6.697 -2.984 5.762 1.00 0.00 H new ATOM 0 HE2 TYR A 17 8.516 0.149 8.029 1.00 0.00 H new ATOM 0 HH TYR A 17 6.401 -0.742 8.461 1.00 0.00 H new ATOM 277 N ALA A 18 13.445 -2.835 2.895 1.00 0.00 N ATOM 278 CA ALA A 18 14.822 -2.759 2.414 1.00 0.00 C ATOM 279 C ALA A 18 14.904 -2.008 1.083 1.00 0.00 C ATOM 280 O ALA A 18 15.795 -1.184 0.875 1.00 0.00 O ATOM 281 CB ALA A 18 15.418 -4.167 2.271 1.00 0.00 C ATOM 0 H ALA A 18 13.105 -3.788 3.022 1.00 0.00 H new ATOM 0 HA ALA A 18 15.404 -2.204 3.150 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.444 -4.093 1.912 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.408 -4.666 3.240 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.825 -4.742 1.560 1.00 0.00 H new ATOM 287 N ALA A 19 13.952 -2.295 0.216 1.00 0.00 N ATOM 288 CA ALA A 19 13.875 -1.648 -1.096 1.00 0.00 C ATOM 289 C ALA A 19 13.691 -0.146 -0.963 1.00 0.00 C ATOM 290 O ALA A 19 14.416 0.632 -1.587 1.00 0.00 O ATOM 291 CB ALA A 19 12.719 -2.243 -1.902 1.00 0.00 C ATOM 0 H ALA A 19 13.213 -2.976 0.391 1.00 0.00 H new ATOM 0 HA ALA A 19 14.815 -1.828 -1.617 1.00 0.00 H new ATOM 0 HB1 ALA A 19 12.667 -1.758 -2.877 1.00 0.00 H new ATOM 0 HB2 ALA A 19 12.882 -3.312 -2.037 1.00 0.00 H new ATOM 0 HB3 ALA A 19 11.783 -2.084 -1.367 1.00 0.00 H new ATOM 297 N LEU A 20 12.744 0.289 -0.130 1.00 0.00 N ATOM 298 CA LEU A 20 12.370 1.692 -0.073 1.00 0.00 C ATOM 299 C LEU A 20 13.416 2.521 0.693 1.00 0.00 C ATOM 300 O LEU A 20 13.676 3.665 0.323 1.00 0.00 O ATOM 301 CB LEU A 20 10.949 1.834 0.535 1.00 0.00 C ATOM 302 CG LEU A 20 10.747 1.315 1.975 1.00 0.00 C ATOM 303 CD1 LEU A 20 11.210 2.350 3.008 1.00 0.00 C ATOM 304 CD2 LEU A 20 9.276 0.927 2.192 1.00 0.00 C ATOM 0 H LEU A 20 12.227 -0.313 0.511 1.00 0.00 H new ATOM 0 HA LEU A 20 12.344 2.092 -1.087 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.675 2.889 0.514 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.249 1.310 -0.115 1.00 0.00 H new ATOM 0 HG LEU A 20 11.362 0.426 2.113 1.00 0.00 H new ATOM 0 HD11 LEU A 20 11.055 1.956 4.012 1.00 0.00 H new ATOM 0 HD12 LEU A 20 12.269 2.563 2.861 1.00 0.00 H new ATOM 0 HD13 LEU A 20 10.635 3.268 2.886 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.142 0.562 3.210 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.642 1.800 2.033 1.00 0.00 H new ATOM 0 HD23 LEU A 20 8.998 0.144 1.487 1.00 0.00 H new ATOM 316 N GLU A 21 14.022 1.951 1.722 1.00 0.00 N ATOM 317 CA GLU A 21 15.042 2.669 2.494 1.00 0.00 C ATOM 318 C GLU A 21 16.319 2.789 1.676 1.00 0.00 C ATOM 319 O GLU A 21 17.115 3.706 1.849 1.00 0.00 O ATOM 320 CB GLU A 21 15.338 1.948 3.821 1.00 0.00 C ATOM 321 CG GLU A 21 15.844 0.516 3.630 1.00 0.00 C ATOM 322 CD GLU A 21 16.341 -0.089 4.934 1.00 0.00 C ATOM 323 OE1 GLU A 21 15.513 -0.390 5.813 1.00 0.00 O ATOM 324 OE2 GLU A 21 17.575 -0.277 5.077 1.00 0.00 O ATOM 0 H GLU A 21 13.833 1.002 2.046 1.00 0.00 H new ATOM 0 HA GLU A 21 14.661 3.664 2.722 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.081 2.518 4.378 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.432 1.928 4.426 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.042 -0.102 3.226 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.651 0.511 2.897 1.00 0.00 H new ATOM 331 N LYS A 22 16.454 1.870 0.744 1.00 0.00 N ATOM 332 CA LYS A 22 17.560 1.841 -0.205 1.00 0.00 C ATOM 333 C LYS A 22 17.347 2.961 -1.226 1.00 0.00 C ATOM 334 O LYS A 22 18.281 3.675 -1.577 1.00 0.00 O ATOM 335 CB LYS A 22 17.571 0.482 -0.894 1.00 0.00 C ATOM 336 CG LYS A 22 18.516 0.322 -2.064 1.00 0.00 C ATOM 337 CD LYS A 22 18.258 -1.024 -2.762 1.00 0.00 C ATOM 338 CE LYS A 22 18.667 -2.217 -1.907 1.00 0.00 C ATOM 339 NZ LYS A 22 18.319 -3.513 -2.553 1.00 0.00 N ATOM 0 H LYS A 22 15.790 1.106 0.618 1.00 0.00 H new ATOM 0 HA LYS A 22 18.516 1.991 0.297 1.00 0.00 H new ATOM 0 HB2 LYS A 22 17.819 -0.275 -0.150 1.00 0.00 H new ATOM 0 HB3 LYS A 22 16.560 0.268 -1.241 1.00 0.00 H new ATOM 0 HG2 LYS A 22 18.377 1.141 -2.770 1.00 0.00 H new ATOM 0 HG3 LYS A 22 19.549 0.371 -1.719 1.00 0.00 H new ATOM 0 HD2 LYS A 22 17.199 -1.104 -3.008 1.00 0.00 H new ATOM 0 HD3 LYS A 22 18.807 -1.052 -3.703 1.00 0.00 H new ATOM 0 HE2 LYS A 22 19.741 -2.180 -1.724 1.00 0.00 H new ATOM 0 HE3 LYS A 22 18.176 -2.153 -0.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 18.309 -4.266 -1.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 17.379 -3.441 -2.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 19.026 -3.738 -3.282 1.00 0.00 H new ATOM 353 N MET A 23 16.098 3.087 -1.673 1.00 0.00 N ATOM 354 CA MET A 23 15.662 4.194 -2.526 1.00 0.00 C ATOM 355 C MET A 23 15.788 5.529 -1.767 1.00 0.00 C ATOM 356 O MET A 23 15.711 6.599 -2.355 1.00 0.00 O ATOM 357 CB MET A 23 14.213 3.989 -2.959 1.00 0.00 C ATOM 358 CG MET A 23 14.003 2.796 -3.863 1.00 0.00 C ATOM 359 SD MET A 23 12.263 2.343 -4.027 1.00 0.00 S ATOM 360 CE MET A 23 11.545 3.942 -4.434 1.00 0.00 C ATOM 0 H MET A 23 15.357 2.422 -1.453 1.00 0.00 H new ATOM 0 HA MET A 23 16.299 4.221 -3.410 1.00 0.00 H new ATOM 0 HB2 MET A 23 13.592 3.872 -2.071 1.00 0.00 H new ATOM 0 HB3 MET A 23 13.868 4.886 -3.473 1.00 0.00 H new ATOM 0 HG2 MET A 23 14.411 3.017 -4.849 1.00 0.00 H new ATOM 0 HG3 MET A 23 14.560 1.945 -3.470 1.00 0.00 H new ATOM 0 HE1 MET A 23 10.538 3.800 -4.825 1.00 0.00 H new ATOM 0 HE2 MET A 23 11.502 4.560 -3.537 1.00 0.00 H new ATOM 0 HE3 MET A 23 12.160 4.436 -5.186 1.00 0.00 H new ATOM 370 N GLY A 24 15.968 5.422 -0.454 1.00 0.00 N ATOM 371 CA GLY A 24 16.094 6.603 0.386 1.00 0.00 C ATOM 372 C GLY A 24 14.760 7.264 0.632 1.00 0.00 C ATOM 373 O GLY A 24 14.695 8.476 0.851 1.00 0.00 O ATOM 0 H GLY A 24 16.029 4.535 0.046 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.542 6.324 1.340 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.770 7.315 -0.088 1.00 0.00 H new ATOM 377 N VAL A 25 13.695 6.474 0.579 1.00 0.00 N ATOM 378 CA VAL A 25 12.339 6.975 0.819 1.00 0.00 C ATOM 379 C VAL A 25 11.845 6.485 2.169 1.00 0.00 C ATOM 380 O VAL A 25 12.259 5.435 2.658 1.00 0.00 O ATOM 381 CB VAL A 25 11.363 6.480 -0.273 1.00 0.00 C ATOM 382 CG1 VAL A 25 9.989 7.172 -0.137 1.00 0.00 C ATOM 383 CG2 VAL A 25 11.946 6.673 -1.667 1.00 0.00 C ATOM 0 H VAL A 25 13.741 5.477 0.371 1.00 0.00 H new ATOM 0 HA VAL A 25 12.374 8.064 0.798 1.00 0.00 H new ATOM 0 HB VAL A 25 11.214 5.410 -0.129 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.319 6.808 -0.916 1.00 0.00 H new ATOM 0 HG12 VAL A 25 9.564 6.947 0.841 1.00 0.00 H new ATOM 0 HG13 VAL A 25 10.113 8.250 -0.240 1.00 0.00 H new ATOM 0 HG21 VAL A 25 11.235 6.315 -2.412 1.00 0.00 H new ATOM 0 HG22 VAL A 25 12.145 7.731 -1.835 1.00 0.00 H new ATOM 0 HG23 VAL A 25 12.876 6.111 -1.754 1.00 0.00 H new ATOM 393 N THR A 26 10.970 7.264 2.802 1.00 0.00 N ATOM 394 CA THR A 26 10.373 6.903 4.062 1.00 0.00 C ATOM 395 C THR A 26 9.313 5.801 3.869 1.00 0.00 C ATOM 396 O THR A 26 8.487 5.904 2.955 1.00 0.00 O ATOM 397 CB THR A 26 9.735 8.165 4.692 1.00 0.00 C ATOM 398 OG1 THR A 26 10.731 9.186 4.839 1.00 0.00 O ATOM 399 CG2 THR A 26 9.105 7.848 6.031 1.00 0.00 C ATOM 0 H THR A 26 10.661 8.167 2.443 1.00 0.00 H new ATOM 0 HA THR A 26 11.142 6.510 4.727 1.00 0.00 H new ATOM 0 HB THR A 26 8.947 8.522 4.029 1.00 0.00 H new ATOM 0 HG1 THR A 26 10.325 9.984 5.236 1.00 0.00 H new ATOM 0 HG21 THR A 26 8.665 8.753 6.450 1.00 0.00 H new ATOM 0 HG22 THR A 26 8.328 7.095 5.898 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.867 7.467 6.711 1.00 0.00 H new ATOM 407 N PRO A 27 9.325 4.735 4.699 1.00 0.00 N ATOM 408 CA PRO A 27 8.346 3.648 4.593 1.00 0.00 C ATOM 409 C PRO A 27 6.910 4.162 4.634 1.00 0.00 C ATOM 410 O PRO A 27 6.047 3.723 3.882 1.00 0.00 O ATOM 411 CB PRO A 27 8.646 2.744 5.803 1.00 0.00 C ATOM 412 CG PRO A 27 9.535 3.557 6.699 1.00 0.00 C ATOM 413 CD PRO A 27 10.285 4.498 5.789 1.00 0.00 C ATOM 0 HA PRO A 27 8.431 3.121 3.643 1.00 0.00 H new ATOM 0 HB2 PRO A 27 7.728 2.457 6.316 1.00 0.00 H new ATOM 0 HB3 PRO A 27 9.139 1.823 5.492 1.00 0.00 H new ATOM 0 HG2 PRO A 27 8.950 4.108 7.435 1.00 0.00 H new ATOM 0 HG3 PRO A 27 10.222 2.917 7.253 1.00 0.00 H new ATOM 0 HD2 PRO A 27 10.555 5.423 6.298 1.00 0.00 H new ATOM 0 HD3 PRO A 27 11.211 4.054 5.423 1.00 0.00 H new ATOM 421 N SER A 28 6.682 5.147 5.509 1.00 0.00 N ATOM 422 CA SER A 28 5.368 5.768 5.641 1.00 0.00 C ATOM 423 C SER A 28 4.928 6.412 4.321 1.00 0.00 C ATOM 424 O SER A 28 3.737 6.504 4.037 1.00 0.00 O ATOM 425 CB SER A 28 5.401 6.818 6.759 1.00 0.00 C ATOM 426 OG SER A 28 5.690 6.200 8.001 1.00 0.00 O ATOM 0 H SER A 28 7.392 5.528 6.134 1.00 0.00 H new ATOM 0 HA SER A 28 4.644 4.994 5.895 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.154 7.574 6.536 1.00 0.00 H new ATOM 0 HB3 SER A 28 4.441 7.331 6.814 1.00 0.00 H new ATOM 0 HG SER A 28 5.710 6.879 8.707 1.00 0.00 H new ATOM 432 N GLU A 29 5.906 6.830 3.505 1.00 0.00 N ATOM 433 CA GLU A 29 5.605 7.511 2.245 1.00 0.00 C ATOM 434 C GLU A 29 5.167 6.517 1.179 1.00 0.00 C ATOM 435 O GLU A 29 4.144 6.731 0.538 1.00 0.00 O ATOM 436 CB GLU A 29 6.802 8.325 1.762 1.00 0.00 C ATOM 437 CG GLU A 29 7.080 9.547 2.596 1.00 0.00 C ATOM 438 CD GLU A 29 5.863 10.469 2.720 1.00 0.00 C ATOM 439 OE1 GLU A 29 5.235 10.762 1.680 1.00 0.00 O ATOM 440 OE2 GLU A 29 5.542 10.893 3.855 1.00 0.00 O ATOM 0 H GLU A 29 6.901 6.709 3.695 1.00 0.00 H new ATOM 0 HA GLU A 29 4.779 8.199 2.428 1.00 0.00 H new ATOM 0 HB2 GLU A 29 7.686 7.688 1.761 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.629 8.632 0.730 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.399 9.237 3.591 1.00 0.00 H new ATOM 0 HG3 GLU A 29 7.908 10.102 2.155 1.00 0.00 H new ATOM 447 N ALA A 30 5.922 5.432 1.001 1.00 0.00 N ATOM 448 CA ALA A 30 5.565 4.398 0.015 1.00 0.00 C ATOM 449 C ALA A 30 4.162 3.847 0.249 1.00 0.00 C ATOM 450 O ALA A 30 3.410 3.591 -0.697 1.00 0.00 O ATOM 451 CB ALA A 30 6.599 3.285 0.030 1.00 0.00 C ATOM 0 H ALA A 30 6.779 5.242 1.520 1.00 0.00 H new ATOM 0 HA ALA A 30 5.561 4.862 -0.971 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.326 2.525 -0.702 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.578 3.694 -0.219 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.636 2.836 1.022 1.00 0.00 H new ATOM 457 N LEU A 31 3.806 3.649 1.522 1.00 0.00 N ATOM 458 CA LEU A 31 2.473 3.147 1.868 1.00 0.00 C ATOM 459 C LEU A 31 1.424 4.252 1.673 1.00 0.00 C ATOM 460 O LEU A 31 0.306 3.978 1.242 1.00 0.00 O ATOM 461 CB LEU A 31 2.455 2.621 3.317 1.00 0.00 C ATOM 462 CG LEU A 31 3.324 1.369 3.568 1.00 0.00 C ATOM 463 CD1 LEU A 31 3.167 0.861 5.005 1.00 0.00 C ATOM 464 CD2 LEU A 31 2.988 0.261 2.580 1.00 0.00 C ATOM 0 H LEU A 31 4.414 3.826 2.321 1.00 0.00 H new ATOM 0 HA LEU A 31 2.226 2.318 1.205 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.792 3.417 3.981 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.425 2.391 3.591 1.00 0.00 H new ATOM 0 HG LEU A 31 4.364 1.661 3.420 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.791 -0.021 5.149 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.474 1.641 5.702 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.124 0.601 5.187 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.615 -0.608 2.780 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.939 -0.016 2.687 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.169 0.612 1.564 1.00 0.00 H new ATOM 476 N ARG A 32 1.817 5.479 1.960 1.00 0.00 N ATOM 477 CA ARG A 32 0.923 6.638 1.817 1.00 0.00 C ATOM 478 C ARG A 32 0.479 6.794 0.364 1.00 0.00 C ATOM 479 O ARG A 32 -0.723 6.938 0.098 1.00 0.00 O ATOM 480 CB ARG A 32 1.602 7.922 2.342 1.00 0.00 C ATOM 481 CG ARG A 32 1.239 9.195 1.592 1.00 0.00 C ATOM 482 CD ARG A 32 2.308 9.564 0.577 1.00 0.00 C ATOM 483 NE ARG A 32 1.869 10.568 -0.389 1.00 0.00 N ATOM 484 CZ ARG A 32 2.677 11.448 -0.955 1.00 0.00 C ATOM 485 NH1 ARG A 32 3.957 11.525 -0.630 1.00 0.00 N ATOM 486 NH2 ARG A 32 2.204 12.274 -1.892 1.00 0.00 N ATOM 0 H ARG A 32 2.752 5.711 2.296 1.00 0.00 H new ATOM 0 HA ARG A 32 0.033 6.467 2.422 1.00 0.00 H new ATOM 0 HB2 ARG A 32 1.340 8.050 3.392 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.683 7.788 2.297 1.00 0.00 H new ATOM 0 HG2 ARG A 32 0.284 9.060 1.084 1.00 0.00 H new ATOM 0 HG3 ARG A 32 1.110 10.013 2.301 1.00 0.00 H new ATOM 0 HD2 ARG A 32 3.186 9.937 1.104 1.00 0.00 H new ATOM 0 HD3 ARG A 32 2.616 8.666 0.042 1.00 0.00 H new ATOM 0 HE ARG A 32 0.881 10.591 -0.642 1.00 0.00 H new ATOM 0 HH11 ARG A 32 4.343 10.896 0.073 1.00 0.00 H new ATOM 0 HH12 ARG A 32 4.558 12.214 -1.083 1.00 0.00 H new ATOM 0 HH21 ARG A 32 1.223 12.224 -2.168 1.00 0.00 H new ATOM 0 HH22 ARG A 32 2.823 12.955 -2.332 1.00 0.00 H new ATOM 500 N LEU A 33 1.422 6.734 -0.561 1.00 0.00 N ATOM 501 CA LEU A 33 1.116 6.903 -1.989 1.00 0.00 C ATOM 502 C LEU A 33 0.293 5.724 -2.512 1.00 0.00 C ATOM 503 O LEU A 33 -0.470 5.848 -3.483 1.00 0.00 O ATOM 504 CB LEU A 33 2.390 7.112 -2.820 1.00 0.00 C ATOM 505 CG LEU A 33 3.489 6.061 -2.639 1.00 0.00 C ATOM 506 CD1 LEU A 33 3.399 4.961 -3.711 1.00 0.00 C ATOM 507 CD2 LEU A 33 4.856 6.733 -2.652 1.00 0.00 C ATOM 0 H LEU A 33 2.408 6.570 -0.358 1.00 0.00 H new ATOM 0 HA LEU A 33 0.514 7.805 -2.095 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.112 7.141 -3.874 1.00 0.00 H new ATOM 0 HB3 LEU A 33 2.805 8.089 -2.573 1.00 0.00 H new ATOM 0 HG LEU A 33 3.347 5.577 -1.673 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.194 4.232 -3.552 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.432 4.464 -3.642 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.508 5.407 -4.700 1.00 0.00 H new ATOM 0 HD21 LEU A 33 5.633 5.980 -2.523 1.00 0.00 H new ATOM 0 HD22 LEU A 33 5.001 7.244 -3.604 1.00 0.00 H new ATOM 0 HD23 LEU A 33 4.913 7.457 -1.839 1.00 0.00 H new ATOM 519 N MET A 34 0.469 4.578 -1.873 1.00 0.00 N ATOM 520 CA MET A 34 -0.330 3.402 -2.192 1.00 0.00 C ATOM 521 C MET A 34 -1.794 3.654 -1.819 1.00 0.00 C ATOM 522 O MET A 34 -2.700 3.360 -2.620 1.00 0.00 O ATOM 523 CB MET A 34 0.207 2.156 -1.468 1.00 0.00 C ATOM 524 CG MET A 34 -0.768 0.975 -1.426 1.00 0.00 C ATOM 525 SD MET A 34 -2.103 1.207 -0.234 1.00 0.00 S ATOM 526 CE MET A 34 -3.043 -0.293 -0.485 1.00 0.00 C ATOM 0 H MET A 34 1.156 4.436 -1.132 1.00 0.00 H new ATOM 0 HA MET A 34 -0.263 3.217 -3.264 1.00 0.00 H new ATOM 0 HB2 MET A 34 1.126 1.835 -1.958 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.470 2.430 -0.446 1.00 0.00 H new ATOM 0 HG2 MET A 34 -1.195 0.828 -2.418 1.00 0.00 H new ATOM 0 HG3 MET A 34 -0.220 0.066 -1.177 1.00 0.00 H new ATOM 0 HE1 MET A 34 -3.874 -0.324 0.219 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.430 -0.314 -1.504 1.00 0.00 H new ATOM 0 HE3 MET A 34 -2.399 -1.157 -0.324 1.00 0.00 H new ATOM 536 N LEU A 35 -2.000 4.213 -0.634 1.00 0.00 N ATOM 537 CA LEU A 35 -3.342 4.479 -0.131 1.00 0.00 C ATOM 538 C LEU A 35 -4.075 5.414 -1.087 1.00 0.00 C ATOM 539 O LEU A 35 -5.299 5.342 -1.226 1.00 0.00 O ATOM 540 CB LEU A 35 -3.285 5.091 1.270 1.00 0.00 C ATOM 541 CG LEU A 35 -2.729 4.180 2.385 1.00 0.00 C ATOM 542 CD1 LEU A 35 -2.785 4.874 3.731 1.00 0.00 C ATOM 543 CD2 LEU A 35 -3.484 2.866 2.439 1.00 0.00 C ATOM 0 H LEU A 35 -1.251 4.492 -0.000 1.00 0.00 H new ATOM 0 HA LEU A 35 -3.884 3.536 -0.067 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -2.674 5.992 1.226 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.292 5.402 1.550 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.686 3.968 2.150 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.388 4.211 4.499 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.189 5.786 3.695 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -3.819 5.125 3.968 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.073 2.242 3.233 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.538 3.060 2.639 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.385 2.350 1.484 1.00 0.00 H new ATOM 555 N GLU A 36 -3.312 6.252 -1.755 1.00 0.00 N ATOM 556 CA GLU A 36 -3.880 7.185 -2.730 1.00 0.00 C ATOM 557 C GLU A 36 -4.405 6.456 -3.965 1.00 0.00 C ATOM 558 O GLU A 36 -5.523 6.715 -4.425 1.00 0.00 O ATOM 559 CB GLU A 36 -2.818 8.233 -3.124 1.00 0.00 C ATOM 560 CG GLU A 36 -2.115 8.841 -1.919 1.00 0.00 C ATOM 561 CD GLU A 36 -1.258 10.044 -2.265 1.00 0.00 C ATOM 562 OE1 GLU A 36 -1.810 11.173 -2.349 1.00 0.00 O ATOM 563 OE2 GLU A 36 -0.034 9.902 -2.448 1.00 0.00 O ATOM 0 H GLU A 36 -2.299 6.314 -1.648 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.729 7.690 -2.269 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.078 7.767 -3.774 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.293 9.027 -3.700 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.862 9.136 -1.183 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.489 8.081 -1.451 1.00 0.00 H new ATOM 570 N TYR A 37 -3.637 5.499 -4.495 1.00 0.00 N ATOM 571 CA TYR A 37 -4.014 4.836 -5.749 1.00 0.00 C ATOM 572 C TYR A 37 -5.167 3.853 -5.534 1.00 0.00 C ATOM 573 O TYR A 37 -5.988 3.648 -6.429 1.00 0.00 O ATOM 574 CB TYR A 37 -2.800 4.128 -6.413 1.00 0.00 C ATOM 575 CG TYR A 37 -2.528 2.686 -5.988 1.00 0.00 C ATOM 576 CD1 TYR A 37 -3.385 1.655 -6.364 1.00 0.00 C ATOM 577 CD2 TYR A 37 -1.409 2.358 -5.238 1.00 0.00 C ATOM 578 CE1 TYR A 37 -3.126 0.347 -6.001 1.00 0.00 C ATOM 579 CE2 TYR A 37 -1.158 1.040 -4.863 1.00 0.00 C ATOM 580 CZ TYR A 37 -2.020 0.048 -5.254 1.00 0.00 C ATOM 581 OH TYR A 37 -1.769 -1.264 -4.902 1.00 0.00 O ATOM 0 H TYR A 37 -2.764 5.169 -4.084 1.00 0.00 H new ATOM 0 HA TYR A 37 -4.356 5.613 -6.432 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -2.947 4.142 -7.493 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -1.907 4.718 -6.205 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -4.265 1.881 -6.948 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -0.722 3.136 -4.940 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.798 -0.441 -6.308 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -0.289 0.801 -4.268 1.00 0.00 H new ATOM 0 HH TYR A 37 -0.945 -1.309 -4.373 1.00 0.00 H new ATOM 591 N ILE A 38 -5.238 3.247 -4.350 1.00 0.00 N ATOM 592 CA ILE A 38 -6.356 2.360 -4.035 1.00 0.00 C ATOM 593 C ILE A 38 -7.633 3.173 -3.878 1.00 0.00 C ATOM 594 O ILE A 38 -8.702 2.771 -4.349 1.00 0.00 O ATOM 595 CB ILE A 38 -6.103 1.485 -2.775 1.00 0.00 C ATOM 596 CG1 ILE A 38 -7.396 0.796 -2.284 1.00 0.00 C ATOM 597 CG2 ILE A 38 -5.489 2.300 -1.665 1.00 0.00 C ATOM 598 CD1 ILE A 38 -8.015 -0.169 -3.278 1.00 0.00 C ATOM 0 H ILE A 38 -4.549 3.351 -3.605 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.462 1.668 -4.870 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.400 0.704 -3.064 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.177 0.257 -1.362 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -8.130 1.563 -2.038 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.323 1.664 -0.796 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -4.537 2.713 -2.000 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -6.163 3.114 -1.396 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.917 -0.605 -2.849 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -8.270 0.365 -4.193 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.303 -0.962 -3.507 1.00 0.00 H new ATOM 610 N ALA A 39 -7.511 4.343 -3.260 1.00 0.00 N ATOM 611 CA ALA A 39 -8.654 5.224 -3.042 1.00 0.00 C ATOM 612 C ALA A 39 -9.212 5.731 -4.367 1.00 0.00 C ATOM 613 O ALA A 39 -10.424 5.900 -4.525 1.00 0.00 O ATOM 614 CB ALA A 39 -8.250 6.386 -2.142 1.00 0.00 C ATOM 0 H ALA A 39 -6.628 4.705 -2.900 1.00 0.00 H new ATOM 0 HA ALA A 39 -9.442 4.656 -2.547 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.108 7.039 -1.984 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -7.906 6.000 -1.182 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.447 6.951 -2.615 1.00 0.00 H new ATOM 620 N ASP A 40 -8.311 6.020 -5.304 1.00 0.00 N ATOM 621 CA ASP A 40 -8.702 6.566 -6.597 1.00 0.00 C ATOM 622 C ASP A 40 -9.227 5.485 -7.553 1.00 0.00 C ATOM 623 O ASP A 40 -10.297 5.640 -8.157 1.00 0.00 O ATOM 624 CB ASP A 40 -7.507 7.291 -7.251 1.00 0.00 C ATOM 625 CG ASP A 40 -7.869 7.908 -8.595 1.00 0.00 C ATOM 626 OD1 ASP A 40 -8.686 8.856 -8.631 1.00 0.00 O ATOM 627 OD2 ASP A 40 -7.348 7.453 -9.637 1.00 0.00 O ATOM 0 H ASP A 40 -7.307 5.884 -5.190 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.513 7.271 -6.413 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -7.148 8.072 -6.581 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -6.687 6.585 -7.387 1.00 0.00 H new ATOM 632 N ASN A 41 -8.482 4.389 -7.657 1.00 0.00 N ATOM 633 CA ASN A 41 -8.779 3.337 -8.626 1.00 0.00 C ATOM 634 C ASN A 41 -9.827 2.376 -8.096 1.00 0.00 C ATOM 635 O ASN A 41 -10.670 1.871 -8.838 1.00 0.00 O ATOM 636 CB ASN A 41 -7.503 2.564 -9.001 1.00 0.00 C ATOM 637 CG ASN A 41 -6.462 3.404 -9.717 1.00 0.00 C ATOM 638 OD1 ASN A 41 -6.137 4.581 -9.175 1.00 0.00 O flip ATOM 639 ND2 ASN A 41 -5.914 2.984 -10.732 1.00 0.00 N flip ATOM 0 H ASN A 41 -7.663 4.205 -7.078 1.00 0.00 H new ATOM 0 HA ASN A 41 -9.176 3.820 -9.519 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -7.061 2.151 -8.094 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -7.774 1.721 -9.636 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -6.185 2.081 -11.121 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -5.188 3.538 -11.186 1.00 0.00 H new ATOM 646 N GLU A 42 -9.768 2.089 -6.790 1.00 0.00 N ATOM 647 CA GLU A 42 -10.694 1.156 -6.147 1.00 0.00 C ATOM 648 C GLU A 42 -10.709 -0.190 -6.877 1.00 0.00 C ATOM 649 O GLU A 42 -11.775 -0.769 -7.102 1.00 0.00 O ATOM 650 CB GLU A 42 -12.113 1.767 -6.125 1.00 0.00 C ATOM 651 CG GLU A 42 -12.170 3.171 -5.520 1.00 0.00 C ATOM 652 CD GLU A 42 -13.584 3.733 -5.504 1.00 0.00 C ATOM 653 OE1 GLU A 42 -14.100 4.123 -6.569 1.00 0.00 O ATOM 654 OE2 GLU A 42 -14.204 3.751 -4.418 1.00 0.00 O ATOM 0 H GLU A 42 -9.081 2.495 -6.155 1.00 0.00 H new ATOM 0 HA GLU A 42 -10.359 0.981 -5.125 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.498 1.804 -7.144 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.773 1.110 -5.558 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.781 3.142 -4.502 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -11.523 3.837 -6.090 1.00 0.00 H new ATOM 661 N ARG A 43 -9.514 -0.722 -7.190 1.00 0.00 N ATOM 662 CA ARG A 43 -9.402 -1.976 -7.936 1.00 0.00 C ATOM 663 C ARG A 43 -8.073 -2.699 -7.648 1.00 0.00 C ATOM 664 O ARG A 43 -8.041 -3.931 -7.629 1.00 0.00 O ATOM 665 CB ARG A 43 -9.524 -1.727 -9.445 1.00 0.00 C ATOM 666 CG ARG A 43 -8.403 -0.861 -10.020 1.00 0.00 C ATOM 667 CD ARG A 43 -8.657 -0.464 -11.470 1.00 0.00 C ATOM 668 NE ARG A 43 -9.931 0.229 -11.617 1.00 0.00 N ATOM 669 CZ ARG A 43 -10.097 1.444 -12.161 1.00 0.00 C ATOM 670 NH1 ARG A 43 -9.052 2.077 -12.695 1.00 0.00 N ATOM 671 NH2 ARG A 43 -11.295 2.001 -12.202 1.00 0.00 N ATOM 0 H ARG A 43 -8.620 -0.301 -6.937 1.00 0.00 H new ATOM 0 HA ARG A 43 -10.221 -2.613 -7.604 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -9.531 -2.686 -9.963 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -10.482 -1.248 -9.648 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -8.296 0.039 -9.414 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -7.460 -1.403 -9.955 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -7.849 0.179 -11.820 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -8.651 -1.354 -12.099 1.00 0.00 H new ATOM 0 HE ARG A 43 -10.766 -0.250 -11.278 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -8.132 1.637 -12.689 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -9.173 3.001 -13.110 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.101 1.507 -11.818 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.414 2.925 -12.617 1.00 0.00 H new ATOM 685 N LEU A 44 -7.001 -1.932 -7.409 1.00 0.00 N ATOM 686 CA LEU A 44 -5.641 -2.500 -7.196 1.00 0.00 C ATOM 687 C LEU A 44 -5.072 -3.020 -8.525 1.00 0.00 C ATOM 688 O LEU A 44 -5.821 -3.397 -9.416 1.00 0.00 O ATOM 689 CB LEU A 44 -5.635 -3.596 -6.128 1.00 0.00 C ATOM 690 CG LEU A 44 -5.993 -3.131 -4.696 1.00 0.00 C ATOM 691 CD1 LEU A 44 -6.104 -4.313 -3.737 1.00 0.00 C ATOM 692 CD2 LEU A 44 -4.968 -2.106 -4.198 1.00 0.00 C ATOM 0 H LEU A 44 -7.038 -0.914 -7.356 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.000 -1.699 -6.827 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -6.339 -4.373 -6.426 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.646 -4.053 -6.106 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.971 -2.651 -4.729 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.356 -3.951 -2.740 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.883 -4.992 -4.084 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.152 -4.842 -3.700 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -5.232 -1.788 -3.190 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.976 -2.559 -4.188 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.965 -1.242 -4.862 1.00 0.00 H new ATOM 704 N PRO A 45 -3.717 -3.036 -8.689 1.00 0.00 N ATOM 705 CA PRO A 45 -3.080 -3.425 -9.951 1.00 0.00 C ATOM 706 C PRO A 45 -3.423 -4.843 -10.410 1.00 0.00 C ATOM 707 O PRO A 45 -3.489 -5.115 -11.606 1.00 0.00 O ATOM 708 CB PRO A 45 -1.568 -3.310 -9.646 1.00 0.00 C ATOM 709 CG PRO A 45 -1.485 -3.336 -8.147 1.00 0.00 C ATOM 710 CD PRO A 45 -2.737 -2.664 -7.667 1.00 0.00 C ATOM 0 HA PRO A 45 -3.424 -2.791 -10.768 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -1.010 -4.135 -10.089 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -1.150 -2.388 -10.051 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -1.420 -4.358 -7.775 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -0.597 -2.811 -7.794 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -3.031 -3.015 -6.678 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.615 -1.583 -7.598 1.00 0.00 H new ATOM 718 N PHE A 46 -3.644 -5.737 -9.456 1.00 0.00 N ATOM 719 CA PHE A 46 -3.985 -7.129 -9.755 1.00 0.00 C ATOM 720 C PHE A 46 -5.087 -7.619 -8.817 1.00 0.00 C ATOM 721 O PHE A 46 -6.107 -8.160 -9.254 1.00 0.00 O ATOM 722 CB PHE A 46 -2.747 -8.013 -9.608 1.00 0.00 C ATOM 723 CG PHE A 46 -1.711 -7.779 -10.673 1.00 0.00 C ATOM 724 CD1 PHE A 46 -1.865 -8.301 -11.948 1.00 0.00 C ATOM 725 CD2 PHE A 46 -0.585 -7.020 -10.394 1.00 0.00 C ATOM 726 CE1 PHE A 46 -0.906 -8.084 -12.920 1.00 0.00 C ATOM 727 CE2 PHE A 46 0.379 -6.800 -11.362 1.00 0.00 C ATOM 728 CZ PHE A 46 0.215 -7.333 -12.631 1.00 0.00 C ATOM 0 H PHE A 46 -3.594 -5.525 -8.460 1.00 0.00 H new ATOM 0 HA PHE A 46 -4.346 -7.187 -10.782 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.298 -7.836 -8.631 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -3.052 -9.059 -9.633 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -2.743 -8.883 -12.185 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.459 -6.595 -9.409 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -1.034 -8.503 -13.907 1.00 0.00 H new ATOM 0 HE2 PHE A 46 1.256 -6.215 -11.130 1.00 0.00 H new ATOM 0 HZ PHE A 46 0.962 -7.161 -13.391 1.00 0.00 H new ATOM 738 N LYS A 47 -4.861 -7.438 -7.509 1.00 0.00 N ATOM 739 CA LYS A 47 -5.853 -7.796 -6.500 1.00 0.00 C ATOM 740 C LYS A 47 -6.040 -9.317 -6.423 1.00 0.00 C ATOM 741 O LYS A 47 -7.137 -9.822 -6.178 1.00 0.00 O ATOM 742 CB LYS A 47 -7.183 -7.104 -6.799 1.00 0.00 C ATOM 743 CG LYS A 47 -8.233 -7.272 -5.703 1.00 0.00 C ATOM 744 CD LYS A 47 -9.566 -6.609 -6.062 1.00 0.00 C ATOM 745 CE LYS A 47 -10.302 -7.350 -7.191 1.00 0.00 C ATOM 746 NZ LYS A 47 -9.637 -7.224 -8.506 1.00 0.00 N ATOM 0 H LYS A 47 -3.999 -7.046 -7.130 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.491 -7.456 -5.530 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.001 -6.040 -6.953 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.583 -7.497 -7.734 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -8.397 -8.334 -5.521 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -7.856 -6.843 -4.774 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -10.202 -6.575 -5.178 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.386 -5.577 -6.365 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -10.381 -8.406 -6.932 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -11.318 -6.963 -7.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -10.356 -7.183 -9.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -9.067 -6.355 -8.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -9.020 -8.046 -8.663 1.00 0.00 H new ATOM 760 N GLN A 48 -4.949 -10.044 -6.681 1.00 0.00 N ATOM 761 CA GLN A 48 -4.926 -11.502 -6.517 1.00 0.00 C ATOM 762 C GLN A 48 -5.553 -11.898 -5.157 1.00 0.00 C ATOM 763 O GLN A 48 -5.086 -11.465 -4.107 1.00 0.00 O ATOM 764 CB GLN A 48 -3.506 -12.069 -6.661 1.00 0.00 C ATOM 765 CG GLN A 48 -2.358 -11.147 -6.157 1.00 0.00 C ATOM 766 CD GLN A 48 -2.537 -10.691 -4.722 1.00 0.00 C ATOM 767 OE1 GLN A 48 -2.138 -11.363 -3.772 1.00 0.00 O ATOM 768 NE2 GLN A 48 -3.156 -9.527 -4.555 1.00 0.00 N ATOM 0 H GLN A 48 -4.068 -9.646 -7.005 1.00 0.00 H new ATOM 0 HA GLN A 48 -5.525 -11.940 -7.316 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -3.454 -13.013 -6.118 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -3.330 -12.296 -7.712 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -1.410 -11.678 -6.246 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -2.295 -10.272 -6.803 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -3.473 -8.997 -5.367 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -3.314 -9.164 -3.615 1.00 0.00 H new ATOM 777 N THR A 49 -6.595 -12.689 -5.181 1.00 0.00 N ATOM 778 CA THR A 49 -7.254 -13.122 -3.953 1.00 0.00 C ATOM 779 C THR A 49 -6.490 -14.306 -3.369 1.00 0.00 C ATOM 780 O THR A 49 -6.967 -15.442 -3.355 1.00 0.00 O ATOM 781 CB THR A 49 -8.734 -13.463 -4.191 1.00 0.00 C ATOM 782 OG1 THR A 49 -9.345 -12.397 -4.943 1.00 0.00 O ATOM 783 CG2 THR A 49 -9.493 -13.639 -2.880 1.00 0.00 C ATOM 0 H THR A 49 -7.015 -13.053 -6.036 1.00 0.00 H new ATOM 0 HA THR A 49 -7.242 -12.302 -3.235 1.00 0.00 H new ATOM 0 HB THR A 49 -8.779 -14.404 -4.739 1.00 0.00 H new ATOM 0 HG1 THR A 49 -10.289 -12.607 -5.101 1.00 0.00 H new ATOM 0 HG21 THR A 49 -10.535 -13.879 -3.092 1.00 0.00 H new ATOM 0 HG22 THR A 49 -9.044 -14.449 -2.305 1.00 0.00 H new ATOM 0 HG23 THR A 49 -9.444 -12.715 -2.304 1.00 0.00 H new ATOM 791 N LEU A 50 -5.262 -14.026 -2.945 1.00 0.00 N ATOM 792 CA LEU A 50 -4.372 -15.016 -2.395 1.00 0.00 C ATOM 793 C LEU A 50 -4.902 -15.535 -1.053 1.00 0.00 C ATOM 794 O LEU A 50 -4.884 -14.787 -0.062 1.00 0.00 O ATOM 795 CB LEU A 50 -2.968 -14.409 -2.224 1.00 0.00 C ATOM 796 CG LEU A 50 -1.885 -15.380 -1.732 1.00 0.00 C ATOM 797 CD1 LEU A 50 -1.714 -16.527 -2.723 1.00 0.00 C ATOM 798 CD2 LEU A 50 -0.564 -14.618 -1.541 1.00 0.00 C ATOM 799 OXT LEU A 50 -5.343 -16.704 -1.013 1.00 0.00 O ATOM 0 H LEU A 50 -4.861 -13.089 -2.979 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.314 -15.860 -3.082 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -2.652 -13.993 -3.181 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.033 -13.578 -1.521 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.186 -15.806 -0.775 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.943 -17.208 -2.362 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -2.656 -17.066 -2.822 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.420 -16.128 -3.694 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.206 -15.306 -1.192 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.256 -14.180 -2.491 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.704 -13.826 -0.805 1.00 0.00 H new TER 811 LEU A 50 ATOM 812 N MET B 101 4.308 -14.042 11.029 1.00 0.00 N ATOM 813 CA MET B 101 3.866 -12.688 10.660 1.00 0.00 C ATOM 814 C MET B 101 4.246 -11.675 11.734 1.00 0.00 C ATOM 815 O MET B 101 4.418 -12.041 12.901 1.00 0.00 O ATOM 816 CB MET B 101 2.350 -12.636 10.425 1.00 0.00 C ATOM 817 CG MET B 101 1.943 -12.973 9.006 1.00 0.00 C ATOM 818 SD MET B 101 0.229 -12.528 8.651 1.00 0.00 S ATOM 819 CE MET B 101 0.267 -12.589 6.858 1.00 0.00 C ATOM 0 HA MET B 101 4.374 -12.431 9.730 1.00 0.00 H new ATOM 0 HB2 MET B 101 1.861 -13.330 11.109 1.00 0.00 H new ATOM 0 HB3 MET B 101 1.987 -11.638 10.671 1.00 0.00 H new ATOM 0 HG2 MET B 101 2.601 -12.453 8.310 1.00 0.00 H new ATOM 0 HG3 MET B 101 2.080 -14.041 8.837 1.00 0.00 H new ATOM 0 HE1 MET B 101 -0.568 -12.015 6.457 1.00 0.00 H new ATOM 0 HE2 MET B 101 1.205 -12.165 6.499 1.00 0.00 H new ATOM 0 HE3 MET B 101 0.187 -13.625 6.527 1.00 0.00 H new ATOM 829 N GLY B 102 4.353 -10.423 11.320 1.00 0.00 N ATOM 830 CA GLY B 102 4.603 -9.335 12.246 1.00 0.00 C ATOM 831 C GLY B 102 3.737 -8.137 11.892 1.00 0.00 C ATOM 832 O GLY B 102 3.175 -8.088 10.793 1.00 0.00 O ATOM 0 H GLY B 102 4.270 -10.136 10.345 1.00 0.00 H new ATOM 0 HA2 GLY B 102 4.390 -9.659 13.265 1.00 0.00 H new ATOM 0 HA3 GLY B 102 5.656 -9.055 12.214 1.00 0.00 H new ATOM 836 N SER B 103 3.650 -7.189 12.804 1.00 0.00 N ATOM 837 CA SER B 103 2.852 -5.985 12.610 1.00 0.00 C ATOM 838 C SER B 103 3.707 -4.731 12.668 1.00 0.00 C ATOM 839 O SER B 103 4.636 -4.644 13.467 1.00 0.00 O ATOM 840 CB SER B 103 1.710 -5.929 13.643 1.00 0.00 C ATOM 841 OG SER B 103 2.171 -6.279 14.937 1.00 0.00 O ATOM 0 H SER B 103 4.130 -7.228 13.703 1.00 0.00 H new ATOM 0 HA SER B 103 2.414 -6.027 11.613 1.00 0.00 H new ATOM 0 HB2 SER B 103 1.285 -4.926 13.665 1.00 0.00 H new ATOM 0 HB3 SER B 103 0.911 -6.607 13.343 1.00 0.00 H new ATOM 0 HG SER B 103 1.427 -6.234 15.573 1.00 0.00 H new ATOM 847 N ILE B 104 3.390 -3.779 11.803 1.00 0.00 N ATOM 848 CA ILE B 104 4.129 -2.527 11.710 1.00 0.00 C ATOM 849 C ILE B 104 3.191 -1.356 11.954 1.00 0.00 C ATOM 850 O ILE B 104 1.975 -1.547 12.006 1.00 0.00 O ATOM 851 CB ILE B 104 4.796 -2.371 10.304 1.00 0.00 C ATOM 852 CG1 ILE B 104 3.740 -2.225 9.186 1.00 0.00 C ATOM 853 CG2 ILE B 104 5.697 -3.573 10.027 1.00 0.00 C ATOM 854 CD1 ILE B 104 3.402 -0.788 8.840 1.00 0.00 C ATOM 0 H ILE B 104 2.614 -3.852 11.146 1.00 0.00 H new ATOM 0 HA ILE B 104 4.913 -2.539 12.468 1.00 0.00 H new ATOM 0 HB ILE B 104 5.394 -1.460 10.311 1.00 0.00 H new ATOM 0 HG12 ILE B 104 4.103 -2.728 8.290 1.00 0.00 H new ATOM 0 HG13 ILE B 104 2.828 -2.738 9.492 1.00 0.00 H new ATOM 0 HG21 ILE B 104 6.161 -3.462 9.047 1.00 0.00 H new ATOM 0 HG22 ILE B 104 6.473 -3.630 10.791 1.00 0.00 H new ATOM 0 HG23 ILE B 104 5.102 -4.486 10.045 1.00 0.00 H new ATOM 0 HD11 ILE B 104 2.654 -0.771 8.047 1.00 0.00 H new ATOM 0 HD12 ILE B 104 3.007 -0.284 9.722 1.00 0.00 H new ATOM 0 HD13 ILE B 104 4.302 -0.274 8.501 1.00 0.00 H new ATOM 866 N ASN B 105 3.738 -0.162 12.124 1.00 0.00 N ATOM 867 CA ASN B 105 2.931 1.029 12.311 1.00 0.00 C ATOM 868 C ASN B 105 3.075 1.933 11.087 1.00 0.00 C ATOM 869 O ASN B 105 4.187 2.305 10.698 1.00 0.00 O ATOM 870 CB ASN B 105 3.376 1.790 13.571 1.00 0.00 C ATOM 871 CG ASN B 105 2.494 3.011 13.838 1.00 0.00 C ATOM 872 OD1 ASN B 105 1.505 2.950 14.565 1.00 0.00 O ATOM 873 ND2 ASN B 105 2.846 4.133 13.224 1.00 0.00 N ATOM 0 H ASN B 105 4.744 0.006 12.136 1.00 0.00 H new ATOM 0 HA ASN B 105 1.889 0.735 12.433 1.00 0.00 H new ATOM 0 HB2 ASN B 105 3.341 1.121 14.431 1.00 0.00 H new ATOM 0 HB3 ASN B 105 4.412 2.108 13.457 1.00 0.00 H new ATOM 0 HD21 ASN B 105 2.290 4.979 13.349 1.00 0.00 H new ATOM 0 HD22 ASN B 105 3.673 4.150 12.627 1.00 0.00 H new ATOM 880 N LEU B 106 1.957 2.266 10.481 1.00 0.00 N ATOM 881 CA LEU B 106 1.913 3.143 9.326 1.00 0.00 C ATOM 882 C LEU B 106 1.273 4.477 9.757 1.00 0.00 C ATOM 883 O LEU B 106 0.399 4.466 10.621 1.00 0.00 O ATOM 884 CB LEU B 106 1.144 2.440 8.185 1.00 0.00 C ATOM 885 CG LEU B 106 0.974 3.209 6.860 1.00 0.00 C ATOM 886 CD1 LEU B 106 -0.194 4.209 6.937 1.00 0.00 C ATOM 887 CD2 LEU B 106 2.260 3.916 6.445 1.00 0.00 C ATOM 0 H LEU B 106 1.040 1.933 10.778 1.00 0.00 H new ATOM 0 HA LEU B 106 2.910 3.362 8.945 1.00 0.00 H new ATOM 0 HB2 LEU B 106 1.652 1.501 7.966 1.00 0.00 H new ATOM 0 HB3 LEU B 106 0.151 2.186 8.556 1.00 0.00 H new ATOM 0 HG LEU B 106 0.740 2.470 6.093 1.00 0.00 H new ATOM 0 HD11 LEU B 106 -0.286 4.734 5.986 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -1.119 3.672 7.146 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -0.004 4.929 7.733 1.00 0.00 H new ATOM 0 HD21 LEU B 106 2.097 4.446 5.506 1.00 0.00 H new ATOM 0 HD22 LEU B 106 2.550 4.628 7.218 1.00 0.00 H new ATOM 0 HD23 LEU B 106 3.053 3.180 6.313 1.00 0.00 H new ATOM 899 N ARG B 107 1.697 5.603 9.174 1.00 0.00 N ATOM 900 CA ARG B 107 1.223 6.908 9.625 1.00 0.00 C ATOM 901 C ARG B 107 0.881 7.757 8.392 1.00 0.00 C ATOM 902 O ARG B 107 1.765 8.067 7.578 1.00 0.00 O ATOM 903 CB ARG B 107 2.262 7.651 10.456 1.00 0.00 C ATOM 904 CG ARG B 107 2.673 6.959 11.756 1.00 0.00 C ATOM 905 CD ARG B 107 3.081 7.963 12.810 1.00 0.00 C ATOM 906 NE ARG B 107 3.953 7.384 13.844 1.00 0.00 N ATOM 907 CZ ARG B 107 4.287 8.008 14.981 1.00 0.00 C ATOM 908 NH1 ARG B 107 3.681 9.155 15.318 1.00 0.00 N ATOM 909 NH2 ARG B 107 5.198 7.494 15.798 1.00 0.00 N ATOM 0 H ARG B 107 2.359 5.634 8.399 1.00 0.00 H new ATOM 0 HA ARG B 107 0.350 6.745 10.256 1.00 0.00 H new ATOM 0 HB2 ARG B 107 3.153 7.800 9.846 1.00 0.00 H new ATOM 0 HB3 ARG B 107 1.871 8.640 10.697 1.00 0.00 H new ATOM 0 HG2 ARG B 107 1.844 6.356 12.127 1.00 0.00 H new ATOM 0 HG3 ARG B 107 3.501 6.277 11.561 1.00 0.00 H new ATOM 0 HD2 ARG B 107 3.597 8.796 12.331 1.00 0.00 H new ATOM 0 HD3 ARG B 107 2.187 8.371 13.282 1.00 0.00 H new ATOM 0 HE ARG B 107 4.327 6.448 13.685 1.00 0.00 H new ATOM 0 HH11 ARG B 107 2.966 9.552 14.709 1.00 0.00 H new ATOM 0 HH12 ARG B 107 3.935 9.631 16.184 1.00 0.00 H new ATOM 0 HH21 ARG B 107 5.654 6.612 15.563 1.00 0.00 H new ATOM 0 HH22 ARG B 107 5.442 7.981 16.661 1.00 0.00 H new ATOM 923 N ILE B 108 -0.391 8.121 8.231 1.00 0.00 N ATOM 924 CA ILE B 108 -0.824 9.030 7.175 1.00 0.00 C ATOM 925 C ILE B 108 -1.891 9.944 7.729 1.00 0.00 C ATOM 926 O ILE B 108 -2.361 9.722 8.835 1.00 0.00 O ATOM 927 CB ILE B 108 -1.400 8.287 5.937 1.00 0.00 C ATOM 928 CG1 ILE B 108 -2.771 7.631 6.237 1.00 0.00 C ATOM 929 CG2 ILE B 108 -0.402 7.268 5.391 1.00 0.00 C ATOM 930 CD1 ILE B 108 -2.810 6.738 7.463 1.00 0.00 C ATOM 0 H ILE B 108 -1.149 7.793 8.830 1.00 0.00 H new ATOM 0 HA ILE B 108 0.053 9.587 6.844 1.00 0.00 H new ATOM 0 HB ILE B 108 -1.570 9.036 5.164 1.00 0.00 H new ATOM 0 HG12 ILE B 108 -3.513 8.420 6.359 1.00 0.00 H new ATOM 0 HG13 ILE B 108 -3.071 7.043 5.370 1.00 0.00 H new ATOM 0 HG21 ILE B 108 -0.833 6.764 4.526 1.00 0.00 H new ATOM 0 HG22 ILE B 108 0.514 7.779 5.095 1.00 0.00 H new ATOM 0 HG23 ILE B 108 -0.174 6.533 6.163 1.00 0.00 H new ATOM 0 HD11 ILE B 108 -3.813 6.329 7.584 1.00 0.00 H new ATOM 0 HD12 ILE B 108 -2.098 5.922 7.342 1.00 0.00 H new ATOM 0 HD13 ILE B 108 -2.547 7.321 8.346 1.00 0.00 H new ATOM 942 N ASP B 109 -2.293 10.960 6.985 1.00 0.00 N ATOM 943 CA ASP B 109 -3.377 11.796 7.448 1.00 0.00 C ATOM 944 C ASP B 109 -4.666 10.970 7.473 1.00 0.00 C ATOM 945 O ASP B 109 -4.973 10.259 6.503 1.00 0.00 O ATOM 946 CB ASP B 109 -3.566 13.041 6.561 1.00 0.00 C ATOM 947 CG ASP B 109 -4.399 14.118 7.244 1.00 0.00 C ATOM 948 OD1 ASP B 109 -5.556 13.855 7.622 1.00 0.00 O ATOM 949 OD2 ASP B 109 -3.889 15.258 7.391 1.00 0.00 O ATOM 0 H ASP B 109 -1.895 11.218 6.082 1.00 0.00 H new ATOM 0 HA ASP B 109 -3.133 12.149 8.450 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -2.590 13.450 6.301 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -4.048 12.749 5.628 1.00 0.00 H new ATOM 954 N ASP B 110 -5.409 11.058 8.576 1.00 0.00 N ATOM 955 CA ASP B 110 -6.613 10.264 8.790 1.00 0.00 C ATOM 956 C ASP B 110 -7.610 10.449 7.650 1.00 0.00 C ATOM 957 O ASP B 110 -8.413 9.552 7.381 1.00 0.00 O ATOM 958 CB ASP B 110 -7.257 10.614 10.148 1.00 0.00 C ATOM 959 CG ASP B 110 -8.615 9.959 10.372 1.00 0.00 C ATOM 960 OD1 ASP B 110 -8.654 8.763 10.725 1.00 0.00 O ATOM 961 OD2 ASP B 110 -9.644 10.639 10.212 1.00 0.00 O ATOM 0 H ASP B 110 -5.189 11.686 9.349 1.00 0.00 H new ATOM 0 HA ASP B 110 -6.325 9.213 8.806 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -6.582 10.312 10.948 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -7.370 11.696 10.218 1.00 0.00 H new ATOM 966 N GLU B 111 -7.544 11.593 6.967 1.00 0.00 N ATOM 967 CA GLU B 111 -8.444 11.876 5.857 1.00 0.00 C ATOM 968 C GLU B 111 -8.200 10.877 4.733 1.00 0.00 C ATOM 969 O GLU B 111 -9.143 10.340 4.135 1.00 0.00 O ATOM 970 CB GLU B 111 -8.280 13.308 5.341 1.00 0.00 C ATOM 971 CG GLU B 111 -6.926 13.604 4.698 1.00 0.00 C ATOM 972 CD GLU B 111 -6.888 14.962 4.038 1.00 0.00 C ATOM 973 OE1 GLU B 111 -6.569 15.965 4.722 1.00 0.00 O ATOM 974 OE2 GLU B 111 -7.170 15.046 2.827 1.00 0.00 O ATOM 0 H GLU B 111 -6.875 12.337 7.166 1.00 0.00 H new ATOM 0 HA GLU B 111 -9.467 11.777 6.219 1.00 0.00 H new ATOM 0 HB2 GLU B 111 -9.065 13.509 4.612 1.00 0.00 H new ATOM 0 HB3 GLU B 111 -8.431 13.998 6.171 1.00 0.00 H new ATOM 0 HG2 GLU B 111 -6.146 13.550 5.458 1.00 0.00 H new ATOM 0 HG3 GLU B 111 -6.703 12.836 3.957 1.00 0.00 H new ATOM 981 N LEU B 112 -6.937 10.590 4.450 1.00 0.00 N ATOM 982 CA LEU B 112 -6.565 9.751 3.325 1.00 0.00 C ATOM 983 C LEU B 112 -6.875 8.301 3.651 1.00 0.00 C ATOM 984 O LEU B 112 -7.377 7.542 2.827 1.00 0.00 O ATOM 985 CB LEU B 112 -5.074 9.909 3.013 1.00 0.00 C ATOM 986 CG LEU B 112 -4.552 9.049 1.844 1.00 0.00 C ATOM 987 CD1 LEU B 112 -5.302 9.381 0.545 1.00 0.00 C ATOM 988 CD2 LEU B 112 -3.053 9.234 1.670 1.00 0.00 C ATOM 0 H LEU B 112 -6.145 10.932 4.994 1.00 0.00 H new ATOM 0 HA LEU B 112 -7.137 10.057 2.449 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -4.875 10.957 2.789 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -4.504 9.661 3.908 1.00 0.00 H new ATOM 0 HG LEU B 112 -4.738 8.001 2.080 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -4.917 8.762 -0.266 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -6.366 9.184 0.678 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -5.156 10.433 0.299 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -2.704 8.619 0.840 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -2.838 10.282 1.460 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -2.541 8.934 2.584 1.00 0.00 H new ATOM 1000 N LYS B 113 -6.568 7.953 4.892 1.00 0.00 N ATOM 1001 CA LYS B 113 -6.837 6.622 5.400 1.00 0.00 C ATOM 1002 C LYS B 113 -8.313 6.247 5.205 1.00 0.00 C ATOM 1003 O LYS B 113 -8.632 5.100 4.894 1.00 0.00 O ATOM 1004 CB LYS B 113 -6.474 6.545 6.902 1.00 0.00 C ATOM 1005 CG LYS B 113 -6.558 5.123 7.471 1.00 0.00 C ATOM 1006 CD LYS B 113 -7.936 4.765 8.016 1.00 0.00 C ATOM 1007 CE LYS B 113 -8.288 5.545 9.284 1.00 0.00 C ATOM 1008 NZ LYS B 113 -9.617 5.147 9.813 1.00 0.00 N ATOM 0 H LYS B 113 -6.130 8.580 5.567 1.00 0.00 H new ATOM 0 HA LYS B 113 -6.224 5.915 4.841 1.00 0.00 H new ATOM 0 HB2 LYS B 113 -5.463 6.928 7.045 1.00 0.00 H new ATOM 0 HB3 LYS B 113 -7.144 7.195 7.465 1.00 0.00 H new ATOM 0 HG2 LYS B 113 -6.289 4.412 6.690 1.00 0.00 H new ATOM 0 HG3 LYS B 113 -5.822 5.015 8.268 1.00 0.00 H new ATOM 0 HD2 LYS B 113 -8.688 4.963 7.252 1.00 0.00 H new ATOM 0 HD3 LYS B 113 -7.972 3.697 8.229 1.00 0.00 H new ATOM 0 HE2 LYS B 113 -7.526 5.371 10.043 1.00 0.00 H new ATOM 0 HE3 LYS B 113 -8.286 6.613 9.068 1.00 0.00 H new ATOM 0 HZ1 LYS B 113 -9.826 5.694 10.673 1.00 0.00 H new ATOM 0 HZ2 LYS B 113 -10.347 5.336 9.096 1.00 0.00 H new ATOM 0 HZ3 LYS B 113 -9.610 4.132 10.041 1.00 0.00 H new ATOM 1022 N ALA B 114 -9.190 7.219 5.392 1.00 0.00 N ATOM 1023 CA ALA B 114 -10.618 7.004 5.252 1.00 0.00 C ATOM 1024 C ALA B 114 -10.977 6.571 3.839 1.00 0.00 C ATOM 1025 O ALA B 114 -11.644 5.552 3.638 1.00 0.00 O ATOM 1026 CB ALA B 114 -11.371 8.281 5.634 1.00 0.00 C ATOM 0 H ALA B 114 -8.933 8.173 5.644 1.00 0.00 H new ATOM 0 HA ALA B 114 -10.914 6.199 5.925 1.00 0.00 H new ATOM 0 HB1 ALA B 114 -12.443 8.117 5.528 1.00 0.00 H new ATOM 0 HB2 ALA B 114 -11.144 8.542 6.668 1.00 0.00 H new ATOM 0 HB3 ALA B 114 -11.062 9.095 4.979 1.00 0.00 H new ATOM 1032 N ARG B 115 -10.509 7.325 2.844 1.00 0.00 N ATOM 1033 CA ARG B 115 -10.832 7.050 1.439 1.00 0.00 C ATOM 1034 C ARG B 115 -10.249 5.710 0.991 1.00 0.00 C ATOM 1035 O ARG B 115 -10.915 4.923 0.321 1.00 0.00 O ATOM 1036 CB ARG B 115 -10.320 8.165 0.497 1.00 0.00 C ATOM 1037 CG ARG B 115 -11.114 9.478 0.589 1.00 0.00 C ATOM 1038 CD ARG B 115 -10.833 10.204 1.894 1.00 0.00 C ATOM 1039 NE ARG B 115 -11.575 11.472 2.030 1.00 0.00 N ATOM 1040 CZ ARG B 115 -11.004 12.660 2.221 1.00 0.00 C ATOM 1041 NH1 ARG B 115 -9.687 12.810 2.170 1.00 0.00 N ATOM 1042 NH2 ARG B 115 -11.770 13.726 2.460 1.00 0.00 N ATOM 0 H ARG B 115 -9.903 8.134 2.983 1.00 0.00 H new ATOM 0 HA ARG B 115 -11.919 7.013 1.375 1.00 0.00 H new ATOM 0 HB2 ARG B 115 -9.274 8.368 0.727 1.00 0.00 H new ATOM 0 HB3 ARG B 115 -10.356 7.803 -0.530 1.00 0.00 H new ATOM 0 HG2 ARG B 115 -10.854 10.122 -0.251 1.00 0.00 H new ATOM 0 HG3 ARG B 115 -12.180 9.267 0.510 1.00 0.00 H new ATOM 0 HD2 ARG B 115 -11.090 9.550 2.728 1.00 0.00 H new ATOM 0 HD3 ARG B 115 -9.765 10.407 1.965 1.00 0.00 H new ATOM 0 HE ARG B 115 -12.593 11.436 1.974 1.00 0.00 H new ATOM 0 HH11 ARG B 115 -9.089 12.006 1.981 1.00 0.00 H new ATOM 0 HH12 ARG B 115 -9.272 13.730 2.320 1.00 0.00 H new ATOM 0 HH21 ARG B 115 -12.785 13.627 2.495 1.00 0.00 H new ATOM 0 HH22 ARG B 115 -11.341 14.640 2.607 1.00 0.00 H new ATOM 1056 N SER B 116 -8.993 5.457 1.358 1.00 0.00 N ATOM 1057 CA SER B 116 -8.293 4.257 0.949 1.00 0.00 C ATOM 1058 C SER B 116 -8.947 3.010 1.513 1.00 0.00 C ATOM 1059 O SER B 116 -9.319 2.091 0.767 1.00 0.00 O ATOM 1060 CB SER B 116 -6.838 4.344 1.397 1.00 0.00 C ATOM 1061 OG SER B 116 -6.749 4.757 2.758 1.00 0.00 O ATOM 0 H SER B 116 -8.440 6.081 1.946 1.00 0.00 H new ATOM 0 HA SER B 116 -8.338 4.184 -0.138 1.00 0.00 H new ATOM 0 HB2 SER B 116 -6.357 3.373 1.275 1.00 0.00 H new ATOM 0 HB3 SER B 116 -6.300 5.048 0.763 1.00 0.00 H new ATOM 0 HG SER B 116 -6.815 5.733 2.808 1.00 0.00 H new ATOM 1067 N TYR B 117 -9.095 2.967 2.825 1.00 0.00 N ATOM 1068 CA TYR B 117 -9.736 1.846 3.500 1.00 0.00 C ATOM 1069 C TYR B 117 -11.146 1.636 2.979 1.00 0.00 C ATOM 1070 O TYR B 117 -11.562 0.506 2.725 1.00 0.00 O ATOM 1071 CB TYR B 117 -9.757 2.039 5.024 1.00 0.00 C ATOM 1072 CG TYR B 117 -8.508 1.544 5.723 1.00 0.00 C ATOM 1073 CD1 TYR B 117 -7.261 2.148 5.512 1.00 0.00 C ATOM 1074 CD2 TYR B 117 -8.575 0.482 6.610 1.00 0.00 C ATOM 1075 CE1 TYR B 117 -6.138 1.691 6.171 1.00 0.00 C ATOM 1076 CE2 TYR B 117 -7.440 0.026 7.267 1.00 0.00 C ATOM 1077 CZ TYR B 117 -6.228 0.631 7.038 1.00 0.00 C ATOM 1078 OH TYR B 117 -5.106 0.190 7.710 1.00 0.00 O ATOM 0 H TYR B 117 -8.776 3.704 3.454 1.00 0.00 H new ATOM 0 HA TYR B 117 -9.145 0.957 3.282 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -9.889 3.098 5.244 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -10.622 1.518 5.434 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -7.178 2.979 4.827 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -9.525 0.001 6.793 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -5.184 2.169 6.004 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -7.510 -0.802 7.956 1.00 0.00 H new ATOM 0 HH TYR B 117 -5.345 -0.567 8.284 1.00 0.00 H new ATOM 1088 N ALA B 118 -11.853 2.738 2.784 1.00 0.00 N ATOM 1089 CA ALA B 118 -13.233 2.686 2.265 1.00 0.00 C ATOM 1090 C ALA B 118 -13.278 1.984 0.913 1.00 0.00 C ATOM 1091 O ALA B 118 -14.175 1.179 0.650 1.00 0.00 O ATOM 1092 CB ALA B 118 -13.827 4.095 2.168 1.00 0.00 C ATOM 0 H ALA B 118 -11.507 3.679 2.972 1.00 0.00 H new ATOM 0 HA ALA B 118 -13.838 2.109 2.964 1.00 0.00 H new ATOM 0 HB1 ALA B 118 -14.845 4.035 1.783 1.00 0.00 H new ATOM 0 HB2 ALA B 118 -13.839 4.554 3.157 1.00 0.00 H new ATOM 0 HB3 ALA B 118 -13.220 4.700 1.495 1.00 0.00 H new ATOM 1098 N ALA B 119 -12.317 2.310 0.058 1.00 0.00 N ATOM 1099 CA ALA B 119 -12.214 1.730 -1.278 1.00 0.00 C ATOM 1100 C ALA B 119 -12.053 0.214 -1.218 1.00 0.00 C ATOM 1101 O ALA B 119 -12.761 -0.524 -1.900 1.00 0.00 O ATOM 1102 CB ALA B 119 -11.071 2.358 -2.034 1.00 0.00 C ATOM 0 H ALA B 119 -11.584 2.986 0.271 1.00 0.00 H new ATOM 0 HA ALA B 119 -13.143 1.941 -1.808 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -11.006 1.916 -3.028 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -11.240 3.431 -2.124 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -10.139 2.182 -1.497 1.00 0.00 H new ATOM 1108 N LEU B 120 -11.125 -0.250 -0.385 1.00 0.00 N ATOM 1109 CA LEU B 120 -10.742 -1.653 -0.370 1.00 0.00 C ATOM 1110 C LEU B 120 -11.789 -2.521 0.322 1.00 0.00 C ATOM 1111 O LEU B 120 -12.054 -3.643 -0.108 1.00 0.00 O ATOM 1112 CB LEU B 120 -9.343 -1.825 0.267 1.00 0.00 C ATOM 1113 CG LEU B 120 -9.134 -1.216 1.664 1.00 0.00 C ATOM 1114 CD1 LEU B 120 -9.698 -2.139 2.758 1.00 0.00 C ATOM 1115 CD2 LEU B 120 -7.649 -0.910 1.901 1.00 0.00 C ATOM 0 H LEU B 120 -10.625 0.330 0.289 1.00 0.00 H new ATOM 0 HA LEU B 120 -10.688 -1.997 -1.403 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -9.126 -2.892 0.326 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -8.607 -1.387 -0.407 1.00 0.00 H new ATOM 0 HG LEU B 120 -9.683 -0.276 1.714 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -9.537 -1.685 3.736 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -10.766 -2.284 2.597 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -9.191 -3.103 2.718 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -7.520 -0.480 2.894 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -7.071 -1.831 1.827 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -7.299 -0.201 1.150 1.00 0.00 H new ATOM 1127 N GLU B 121 -12.439 -1.981 1.360 1.00 0.00 N ATOM 1128 CA GLU B 121 -13.457 -2.742 2.093 1.00 0.00 C ATOM 1129 C GLU B 121 -14.708 -2.833 1.240 1.00 0.00 C ATOM 1130 O GLU B 121 -15.514 -3.755 1.382 1.00 0.00 O ATOM 1131 CB GLU B 121 -13.773 -2.095 3.447 1.00 0.00 C ATOM 1132 CG GLU B 121 -14.252 -0.643 3.346 1.00 0.00 C ATOM 1133 CD GLU B 121 -14.662 -0.077 4.695 1.00 0.00 C ATOM 1134 OE1 GLU B 121 -15.739 -0.455 5.184 1.00 0.00 O ATOM 1135 OE2 GLU B 121 -13.900 0.743 5.261 1.00 0.00 O ATOM 0 H GLU B 121 -12.282 -1.035 1.707 1.00 0.00 H new ATOM 0 HA GLU B 121 -13.074 -3.742 2.296 1.00 0.00 H new ATOM 0 HB2 GLU B 121 -14.538 -2.685 3.951 1.00 0.00 H new ATOM 0 HB3 GLU B 121 -12.881 -2.130 4.072 1.00 0.00 H new ATOM 0 HG2 GLU B 121 -13.457 -0.029 2.923 1.00 0.00 H new ATOM 0 HG3 GLU B 121 -15.097 -0.588 2.659 1.00 0.00 H new ATOM 1142 N LYS B 122 -14.828 -1.878 0.335 1.00 0.00 N ATOM 1143 CA LYS B 122 -15.912 -1.819 -0.620 1.00 0.00 C ATOM 1144 C LYS B 122 -15.696 -2.881 -1.684 1.00 0.00 C ATOM 1145 O LYS B 122 -16.628 -3.586 -2.094 1.00 0.00 O ATOM 1146 CB LYS B 122 -15.942 -0.424 -1.244 1.00 0.00 C ATOM 1147 CG LYS B 122 -17.164 -0.169 -2.094 1.00 0.00 C ATOM 1148 CD LYS B 122 -17.542 1.300 -2.022 1.00 0.00 C ATOM 1149 CE LYS B 122 -16.492 2.205 -2.661 1.00 0.00 C ATOM 1150 NZ LYS B 122 -16.278 1.908 -4.109 1.00 0.00 N ATOM 0 H LYS B 122 -14.162 -1.111 0.244 1.00 0.00 H new ATOM 0 HA LYS B 122 -16.867 -2.008 -0.129 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -15.900 0.321 -0.450 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -15.050 -0.289 -1.855 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -16.965 -0.453 -3.127 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -17.994 -0.785 -1.748 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -18.499 1.451 -2.521 1.00 0.00 H new ATOM 0 HD3 LYS B 122 -17.678 1.586 -0.979 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -16.798 3.245 -2.549 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -15.548 2.092 -2.128 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -15.633 2.614 -4.517 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -15.863 0.960 -4.211 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -17.189 1.942 -4.609 1.00 0.00 H new ATOM 1164 N MET B 123 -14.451 -2.986 -2.122 1.00 0.00 N ATOM 1165 CA MET B 123 -13.993 -4.054 -3.012 1.00 0.00 C ATOM 1166 C MET B 123 -14.127 -5.400 -2.314 1.00 0.00 C ATOM 1167 O MET B 123 -14.027 -6.454 -2.952 1.00 0.00 O ATOM 1168 CB MET B 123 -12.535 -3.819 -3.394 1.00 0.00 C ATOM 1169 CG MET B 123 -12.304 -2.552 -4.203 1.00 0.00 C ATOM 1170 SD MET B 123 -10.592 -2.011 -4.191 1.00 0.00 S ATOM 1171 CE MET B 123 -9.732 -3.533 -4.574 1.00 0.00 C ATOM 0 H MET B 123 -13.716 -2.325 -1.869 1.00 0.00 H new ATOM 0 HA MET B 123 -14.606 -4.053 -3.913 1.00 0.00 H new ATOM 0 HB2 MET B 123 -11.935 -3.772 -2.485 1.00 0.00 H new ATOM 0 HB3 MET B 123 -12.178 -4.674 -3.968 1.00 0.00 H new ATOM 0 HG2 MET B 123 -12.617 -2.723 -5.233 1.00 0.00 H new ATOM 0 HG3 MET B 123 -12.933 -1.755 -3.807 1.00 0.00 H new ATOM 0 HE1 MET B 123 -8.887 -3.319 -5.228 1.00 0.00 H new ATOM 0 HE2 MET B 123 -9.371 -3.989 -3.652 1.00 0.00 H new ATOM 0 HE3 MET B 123 -10.414 -4.220 -5.076 1.00 0.00 H new ATOM 1181 N GLY B 124 -14.371 -5.361 -0.991 1.00 0.00 N ATOM 1182 CA GLY B 124 -14.486 -6.582 -0.214 1.00 0.00 C ATOM 1183 C GLY B 124 -13.146 -7.257 0.011 1.00 0.00 C ATOM 1184 O GLY B 124 -13.073 -8.484 0.163 1.00 0.00 O ATOM 0 H GLY B 124 -14.489 -4.502 -0.454 1.00 0.00 H new ATOM 0 HA2 GLY B 124 -14.940 -6.354 0.750 1.00 0.00 H new ATOM 0 HA3 GLY B 124 -15.156 -7.273 -0.726 1.00 0.00 H new ATOM 1188 N VAL B 125 -12.073 -6.469 0.030 1.00 0.00 N ATOM 1189 CA VAL B 125 -10.740 -6.985 0.271 1.00 0.00 C ATOM 1190 C VAL B 125 -10.249 -6.553 1.658 1.00 0.00 C ATOM 1191 O VAL B 125 -10.675 -5.514 2.183 1.00 0.00 O ATOM 1192 CB VAL B 125 -9.725 -6.527 -0.818 1.00 0.00 C ATOM 1193 CG1 VAL B 125 -9.507 -5.018 -0.814 1.00 0.00 C ATOM 1194 CG2 VAL B 125 -8.394 -7.251 -0.675 1.00 0.00 C ATOM 0 H VAL B 125 -12.109 -5.461 -0.121 1.00 0.00 H new ATOM 0 HA VAL B 125 -10.801 -8.072 0.225 1.00 0.00 H new ATOM 0 HB VAL B 125 -10.167 -6.792 -1.779 1.00 0.00 H new ATOM 0 HG11 VAL B 125 -8.791 -4.752 -1.592 1.00 0.00 H new ATOM 0 HG12 VAL B 125 -10.454 -4.513 -1.004 1.00 0.00 H new ATOM 0 HG13 VAL B 125 -9.120 -4.709 0.157 1.00 0.00 H new ATOM 0 HG21 VAL B 125 -7.708 -6.908 -1.450 1.00 0.00 H new ATOM 0 HG22 VAL B 125 -7.968 -7.039 0.306 1.00 0.00 H new ATOM 0 HG23 VAL B 125 -8.551 -8.325 -0.778 1.00 0.00 H new ATOM 1204 N THR B 126 -9.385 -7.366 2.259 1.00 0.00 N ATOM 1205 CA THR B 126 -8.815 -7.062 3.556 1.00 0.00 C ATOM 1206 C THR B 126 -7.747 -5.958 3.426 1.00 0.00 C ATOM 1207 O THR B 126 -6.903 -6.008 2.527 1.00 0.00 O ATOM 1208 CB THR B 126 -8.184 -8.328 4.162 1.00 0.00 C ATOM 1209 OG1 THR B 126 -9.186 -9.349 4.269 1.00 0.00 O ATOM 1210 CG2 THR B 126 -7.576 -8.051 5.511 1.00 0.00 C ATOM 0 H THR B 126 -9.065 -8.248 1.859 1.00 0.00 H new ATOM 0 HA THR B 126 -9.610 -6.708 4.212 1.00 0.00 H new ATOM 0 HB THR B 126 -7.382 -8.664 3.505 1.00 0.00 H new ATOM 0 HG1 THR B 126 -9.160 -9.917 3.471 1.00 0.00 H new ATOM 0 HG21 THR B 126 -7.140 -8.967 5.909 1.00 0.00 H new ATOM 0 HG22 THR B 126 -6.799 -7.293 5.411 1.00 0.00 H new ATOM 0 HG23 THR B 126 -8.348 -7.692 6.191 1.00 0.00 H new ATOM 1218 N PRO B 127 -7.769 -4.925 4.307 1.00 0.00 N ATOM 1219 CA PRO B 127 -6.798 -3.841 4.270 1.00 0.00 C ATOM 1220 C PRO B 127 -5.366 -4.357 4.303 1.00 0.00 C ATOM 1221 O PRO B 127 -4.487 -3.884 3.580 1.00 0.00 O ATOM 1222 CB PRO B 127 -7.117 -2.990 5.519 1.00 0.00 C ATOM 1223 CG PRO B 127 -8.024 -3.844 6.354 1.00 0.00 C ATOM 1224 CD PRO B 127 -8.769 -4.715 5.373 1.00 0.00 C ATOM 0 HA PRO B 127 -6.870 -3.266 3.347 1.00 0.00 H new ATOM 0 HB2 PRO B 127 -6.208 -2.732 6.063 1.00 0.00 H new ATOM 0 HB3 PRO B 127 -7.601 -2.053 5.244 1.00 0.00 H new ATOM 0 HG2 PRO B 127 -7.455 -4.447 7.061 1.00 0.00 H new ATOM 0 HG3 PRO B 127 -8.712 -3.233 6.938 1.00 0.00 H new ATOM 0 HD2 PRO B 127 -9.085 -5.656 5.824 1.00 0.00 H new ATOM 0 HD3 PRO B 127 -9.667 -4.225 4.996 1.00 0.00 H new ATOM 1232 N SER B 128 -5.147 -5.375 5.136 1.00 0.00 N ATOM 1233 CA SER B 128 -3.847 -6.010 5.271 1.00 0.00 C ATOM 1234 C SER B 128 -3.367 -6.575 3.930 1.00 0.00 C ATOM 1235 O SER B 128 -2.173 -6.652 3.663 1.00 0.00 O ATOM 1236 CB SER B 128 -3.922 -7.127 6.325 1.00 0.00 C ATOM 1237 OG SER B 128 -4.632 -6.677 7.469 1.00 0.00 O ATOM 0 H SER B 128 -5.869 -5.778 5.733 1.00 0.00 H new ATOM 0 HA SER B 128 -3.127 -5.258 5.594 1.00 0.00 H new ATOM 0 HB2 SER B 128 -4.416 -8.002 5.903 1.00 0.00 H new ATOM 0 HB3 SER B 128 -2.916 -7.435 6.611 1.00 0.00 H new ATOM 0 HG SER B 128 -4.674 -7.397 8.132 1.00 0.00 H new ATOM 1243 N GLU B 129 -4.330 -6.939 3.072 1.00 0.00 N ATOM 1244 CA GLU B 129 -4.013 -7.572 1.803 1.00 0.00 C ATOM 1245 C GLU B 129 -3.554 -6.546 0.787 1.00 0.00 C ATOM 1246 O GLU B 129 -2.527 -6.715 0.137 1.00 0.00 O ATOM 1247 CB GLU B 129 -5.193 -8.367 1.250 1.00 0.00 C ATOM 1248 CG GLU B 129 -5.607 -9.535 2.143 1.00 0.00 C ATOM 1249 CD GLU B 129 -6.660 -10.414 1.501 1.00 0.00 C ATOM 1250 OE1 GLU B 129 -7.851 -10.031 1.526 1.00 0.00 O ATOM 1251 OE2 GLU B 129 -6.324 -11.502 1.000 1.00 0.00 O ATOM 0 H GLU B 129 -5.327 -6.803 3.240 1.00 0.00 H new ATOM 0 HA GLU B 129 -3.199 -8.272 1.992 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -6.044 -7.698 1.121 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -4.934 -8.748 0.262 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -4.729 -10.138 2.377 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -5.989 -9.148 3.088 1.00 0.00 H new ATOM 1258 N ALA B 130 -4.305 -5.448 0.649 1.00 0.00 N ATOM 1259 CA ALA B 130 -3.945 -4.385 -0.289 1.00 0.00 C ATOM 1260 C ALA B 130 -2.531 -3.836 0.000 1.00 0.00 C ATOM 1261 O ALA B 130 -1.756 -3.543 -0.917 1.00 0.00 O ATOM 1262 CB ALA B 130 -4.974 -3.258 -0.235 1.00 0.00 C ATOM 0 H ALA B 130 -5.162 -5.275 1.174 1.00 0.00 H new ATOM 0 HA ALA B 130 -3.940 -4.811 -1.292 1.00 0.00 H new ATOM 0 HB1 ALA B 130 -4.693 -2.474 -0.938 1.00 0.00 H new ATOM 0 HB2 ALA B 130 -5.956 -3.649 -0.501 1.00 0.00 H new ATOM 0 HB3 ALA B 130 -5.009 -2.845 0.773 1.00 0.00 H new ATOM 1268 N LEU B 131 -2.194 -3.697 1.279 1.00 0.00 N ATOM 1269 CA LEU B 131 -0.876 -3.211 1.675 1.00 0.00 C ATOM 1270 C LEU B 131 0.173 -4.305 1.438 1.00 0.00 C ATOM 1271 O LEU B 131 1.300 -4.025 1.054 1.00 0.00 O ATOM 1272 CB LEU B 131 -0.879 -2.760 3.153 1.00 0.00 C ATOM 1273 CG LEU B 131 -1.481 -1.368 3.445 1.00 0.00 C ATOM 1274 CD1 LEU B 131 -0.708 -0.287 2.711 1.00 0.00 C ATOM 1275 CD2 LEU B 131 -2.967 -1.319 3.091 1.00 0.00 C ATOM 0 H LEU B 131 -2.815 -3.914 2.059 1.00 0.00 H new ATOM 0 HA LEU B 131 -0.622 -2.344 1.065 1.00 0.00 H new ATOM 0 HB2 LEU B 131 -1.430 -3.499 3.735 1.00 0.00 H new ATOM 0 HB3 LEU B 131 0.149 -2.771 3.516 1.00 0.00 H new ATOM 0 HG LEU B 131 -1.394 -1.182 4.515 1.00 0.00 H new ATOM 0 HD11 LEU B 131 -1.147 0.686 2.929 1.00 0.00 H new ATOM 0 HD12 LEU B 131 0.332 -0.297 3.038 1.00 0.00 H new ATOM 0 HD13 LEU B 131 -0.753 -0.473 1.638 1.00 0.00 H new ATOM 0 HD21 LEU B 131 -3.360 -0.326 3.308 1.00 0.00 H new ATOM 0 HD22 LEU B 131 -3.096 -1.536 2.031 1.00 0.00 H new ATOM 0 HD23 LEU B 131 -3.506 -2.060 3.681 1.00 0.00 H new ATOM 1287 N ARG B 132 -0.218 -5.560 1.664 1.00 0.00 N ATOM 1288 CA ARG B 132 0.674 -6.695 1.504 1.00 0.00 C ATOM 1289 C ARG B 132 1.165 -6.794 0.063 1.00 0.00 C ATOM 1290 O ARG B 132 2.362 -6.925 -0.195 1.00 0.00 O ATOM 1291 CB ARG B 132 -0.017 -7.993 1.953 1.00 0.00 C ATOM 1292 CG ARG B 132 0.860 -9.244 1.893 1.00 0.00 C ATOM 1293 CD ARG B 132 0.761 -9.960 0.555 1.00 0.00 C ATOM 1294 NE ARG B 132 -0.572 -10.524 0.330 1.00 0.00 N ATOM 1295 CZ ARG B 132 -1.067 -10.836 -0.868 1.00 0.00 C ATOM 1296 NH1 ARG B 132 -0.355 -10.647 -1.965 1.00 0.00 N ATOM 1297 NH2 ARG B 132 -2.295 -11.359 -0.972 1.00 0.00 N ATOM 0 H ARG B 132 -1.161 -5.811 1.962 1.00 0.00 H new ATOM 0 HA ARG B 132 1.545 -6.545 2.141 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -0.371 -7.864 2.976 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -0.897 -8.154 1.329 1.00 0.00 H new ATOM 0 HG2 ARG B 132 1.898 -8.966 2.077 1.00 0.00 H new ATOM 0 HG3 ARG B 132 0.567 -9.928 2.690 1.00 0.00 H new ATOM 0 HD2 ARG B 132 0.999 -9.262 -0.248 1.00 0.00 H new ATOM 0 HD3 ARG B 132 1.503 -10.757 0.515 1.00 0.00 H new ATOM 0 HE ARG B 132 -1.162 -10.689 1.146 1.00 0.00 H new ATOM 0 HH11 ARG B 132 0.586 -10.258 -1.902 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -0.746 -10.890 -2.875 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -2.854 -11.519 -0.134 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -2.672 -11.597 -1.889 1.00 0.00 H new ATOM 1311 N LEU B 133 0.234 -6.688 -0.900 1.00 0.00 N ATOM 1312 CA LEU B 133 0.563 -6.788 -2.319 1.00 0.00 C ATOM 1313 C LEU B 133 1.382 -5.588 -2.778 1.00 0.00 C ATOM 1314 O LEU B 133 2.183 -5.679 -3.721 1.00 0.00 O ATOM 1315 CB LEU B 133 -0.692 -6.948 -3.191 1.00 0.00 C ATOM 1316 CG LEU B 133 -1.797 -5.910 -3.001 1.00 0.00 C ATOM 1317 CD1 LEU B 133 -1.688 -4.753 -3.981 1.00 0.00 C ATOM 1318 CD2 LEU B 133 -3.151 -6.591 -3.098 1.00 0.00 C ATOM 0 H LEU B 133 -0.756 -6.532 -0.713 1.00 0.00 H new ATOM 0 HA LEU B 133 1.166 -7.687 -2.442 1.00 0.00 H new ATOM 0 HB2 LEU B 133 -0.384 -6.930 -4.237 1.00 0.00 H new ATOM 0 HB3 LEU B 133 -1.115 -7.934 -3.000 1.00 0.00 H new ATOM 0 HG LEU B 133 -1.682 -5.473 -2.009 1.00 0.00 H new ATOM 0 HD11 LEU B 133 -2.498 -4.046 -3.801 1.00 0.00 H new ATOM 0 HD12 LEU B 133 -0.730 -4.250 -3.845 1.00 0.00 H new ATOM 0 HD13 LEU B 133 -1.757 -5.132 -5.001 1.00 0.00 H new ATOM 0 HD21 LEU B 133 -3.941 -5.852 -2.963 1.00 0.00 H new ATOM 0 HD22 LEU B 133 -3.254 -7.057 -4.078 1.00 0.00 H new ATOM 0 HD23 LEU B 133 -3.231 -7.353 -2.323 1.00 0.00 H new ATOM 1330 N MET B 134 1.209 -4.460 -2.075 1.00 0.00 N ATOM 1331 CA MET B 134 2.007 -3.279 -2.332 1.00 0.00 C ATOM 1332 C MET B 134 3.460 -3.540 -1.951 1.00 0.00 C ATOM 1333 O MET B 134 4.386 -3.227 -2.701 1.00 0.00 O ATOM 1334 CB MET B 134 1.449 -2.063 -1.570 1.00 0.00 C ATOM 1335 CG MET B 134 2.417 -0.888 -1.475 1.00 0.00 C ATOM 1336 SD MET B 134 3.761 -1.177 -0.303 1.00 0.00 S ATOM 1337 CE MET B 134 4.737 0.310 -0.524 1.00 0.00 C ATOM 0 H MET B 134 0.522 -4.352 -1.328 1.00 0.00 H new ATOM 0 HA MET B 134 1.961 -3.052 -3.397 1.00 0.00 H new ATOM 0 HB2 MET B 134 0.535 -1.728 -2.061 1.00 0.00 H new ATOM 0 HB3 MET B 134 1.173 -2.375 -0.563 1.00 0.00 H new ATOM 0 HG2 MET B 134 2.838 -0.690 -2.461 1.00 0.00 H new ATOM 0 HG3 MET B 134 1.868 0.005 -1.177 1.00 0.00 H new ATOM 0 HE1 MET B 134 5.215 0.575 0.419 1.00 0.00 H new ATOM 0 HE2 MET B 134 5.501 0.135 -1.281 1.00 0.00 H new ATOM 0 HE3 MET B 134 4.089 1.126 -0.844 1.00 0.00 H new ATOM 1347 N LEU B 135 3.651 -4.161 -0.783 1.00 0.00 N ATOM 1348 CA LEU B 135 4.983 -4.462 -0.270 1.00 0.00 C ATOM 1349 C LEU B 135 5.734 -5.339 -1.256 1.00 0.00 C ATOM 1350 O LEU B 135 6.955 -5.273 -1.378 1.00 0.00 O ATOM 1351 CB LEU B 135 4.902 -5.140 1.107 1.00 0.00 C ATOM 1352 CG LEU B 135 4.328 -4.260 2.236 1.00 0.00 C ATOM 1353 CD1 LEU B 135 4.296 -5.036 3.554 1.00 0.00 C ATOM 1354 CD2 LEU B 135 5.118 -2.966 2.389 1.00 0.00 C ATOM 0 H LEU B 135 2.891 -4.465 -0.174 1.00 0.00 H new ATOM 0 HA LEU B 135 5.526 -3.525 -0.149 1.00 0.00 H new ATOM 0 HB2 LEU B 135 4.288 -6.036 1.018 1.00 0.00 H new ATOM 0 HB3 LEU B 135 5.902 -5.466 1.394 1.00 0.00 H new ATOM 0 HG LEU B 135 3.307 -3.991 1.966 1.00 0.00 H new ATOM 0 HD11 LEU B 135 3.888 -4.401 4.340 1.00 0.00 H new ATOM 0 HD12 LEU B 135 3.669 -5.920 3.440 1.00 0.00 H new ATOM 0 HD13 LEU B 135 5.308 -5.340 3.822 1.00 0.00 H new ATOM 0 HD21 LEU B 135 4.687 -2.369 3.193 1.00 0.00 H new ATOM 0 HD22 LEU B 135 6.156 -3.199 2.627 1.00 0.00 H new ATOM 0 HD23 LEU B 135 5.077 -2.402 1.457 1.00 0.00 H new ATOM 1366 N GLU B 136 4.982 -6.153 -1.985 1.00 0.00 N ATOM 1367 CA GLU B 136 5.560 -7.040 -2.968 1.00 0.00 C ATOM 1368 C GLU B 136 6.117 -6.251 -4.162 1.00 0.00 C ATOM 1369 O GLU B 136 7.228 -6.516 -4.624 1.00 0.00 O ATOM 1370 CB GLU B 136 4.518 -8.074 -3.450 1.00 0.00 C ATOM 1371 CG GLU B 136 3.771 -8.732 -2.304 1.00 0.00 C ATOM 1372 CD GLU B 136 2.955 -9.933 -2.743 1.00 0.00 C ATOM 1373 OE1 GLU B 136 1.804 -9.739 -3.213 1.00 0.00 O ATOM 1374 OE2 GLU B 136 3.446 -11.076 -2.622 1.00 0.00 O ATOM 0 H GLU B 136 3.967 -6.212 -1.908 1.00 0.00 H new ATOM 0 HA GLU B 136 6.385 -7.572 -2.494 1.00 0.00 H new ATOM 0 HB2 GLU B 136 3.803 -7.582 -4.110 1.00 0.00 H new ATOM 0 HB3 GLU B 136 5.020 -8.842 -4.039 1.00 0.00 H new ATOM 0 HG2 GLU B 136 4.486 -9.044 -1.542 1.00 0.00 H new ATOM 0 HG3 GLU B 136 3.110 -8.000 -1.840 1.00 0.00 H new ATOM 1381 N TYR B 137 5.349 -5.263 -4.673 1.00 0.00 N ATOM 1382 CA TYR B 137 5.753 -4.547 -5.876 1.00 0.00 C ATOM 1383 C TYR B 137 6.901 -3.578 -5.587 1.00 0.00 C ATOM 1384 O TYR B 137 7.718 -3.310 -6.459 1.00 0.00 O ATOM 1385 CB TYR B 137 4.548 -3.826 -6.521 1.00 0.00 C ATOM 1386 CG TYR B 137 4.439 -2.327 -6.239 1.00 0.00 C ATOM 1387 CD1 TYR B 137 5.132 -1.408 -7.033 1.00 0.00 C ATOM 1388 CD2 TYR B 137 3.636 -1.842 -5.214 1.00 0.00 C ATOM 1389 CE1 TYR B 137 5.018 -0.052 -6.796 1.00 0.00 C ATOM 1390 CE2 TYR B 137 3.520 -0.490 -4.974 1.00 0.00 C ATOM 1391 CZ TYR B 137 4.215 0.408 -5.768 1.00 0.00 C ATOM 1392 OH TYR B 137 4.092 1.772 -5.519 1.00 0.00 O ATOM 0 H TYR B 137 4.463 -4.956 -4.271 1.00 0.00 H new ATOM 0 HA TYR B 137 6.122 -5.279 -6.594 1.00 0.00 H new ATOM 0 HB2 TYR B 137 4.598 -3.971 -7.600 1.00 0.00 H new ATOM 0 HB3 TYR B 137 3.633 -4.309 -6.177 1.00 0.00 H new ATOM 0 HD1 TYR B 137 5.761 -1.761 -7.837 1.00 0.00 H new ATOM 0 HD2 TYR B 137 3.092 -2.538 -4.593 1.00 0.00 H new ATOM 0 HE1 TYR B 137 5.557 0.650 -7.415 1.00 0.00 H new ATOM 0 HE2 TYR B 137 2.891 -0.133 -4.172 1.00 0.00 H new ATOM 0 HH TYR B 137 3.487 1.913 -4.761 1.00 0.00 H new ATOM 1402 N ILE B 138 6.948 -3.019 -4.371 1.00 0.00 N ATOM 1403 CA ILE B 138 8.056 -2.149 -4.011 1.00 0.00 C ATOM 1404 C ILE B 138 9.336 -2.974 -3.862 1.00 0.00 C ATOM 1405 O ILE B 138 10.408 -2.553 -4.280 1.00 0.00 O ATOM 1406 CB ILE B 138 7.778 -1.334 -2.703 1.00 0.00 C ATOM 1407 CG1 ILE B 138 9.059 -0.667 -2.158 1.00 0.00 C ATOM 1408 CG2 ILE B 138 7.148 -2.216 -1.642 1.00 0.00 C ATOM 1409 CD1 ILE B 138 9.746 0.277 -3.110 1.00 0.00 C ATOM 0 H ILE B 138 6.247 -3.153 -3.642 1.00 0.00 H new ATOM 0 HA ILE B 138 8.177 -1.424 -4.816 1.00 0.00 H new ATOM 0 HB ILE B 138 7.077 -0.540 -2.960 1.00 0.00 H new ATOM 0 HG12 ILE B 138 8.806 -0.121 -1.249 1.00 0.00 H new ATOM 0 HG13 ILE B 138 9.764 -1.449 -1.875 1.00 0.00 H new ATOM 0 HG21 ILE B 138 6.964 -1.628 -0.743 1.00 0.00 H new ATOM 0 HG22 ILE B 138 6.204 -2.615 -2.014 1.00 0.00 H new ATOM 0 HG23 ILE B 138 7.822 -3.039 -1.406 1.00 0.00 H new ATOM 0 HD11 ILE B 138 10.634 0.693 -2.633 1.00 0.00 H new ATOM 0 HD12 ILE B 138 10.037 -0.263 -4.011 1.00 0.00 H new ATOM 0 HD13 ILE B 138 9.065 1.085 -3.376 1.00 0.00 H new ATOM 1421 N ALA B 139 9.197 -4.177 -3.302 1.00 0.00 N ATOM 1422 CA ALA B 139 10.343 -5.060 -3.103 1.00 0.00 C ATOM 1423 C ALA B 139 10.931 -5.521 -4.444 1.00 0.00 C ATOM 1424 O ALA B 139 12.143 -5.668 -4.596 1.00 0.00 O ATOM 1425 CB ALA B 139 9.922 -6.254 -2.279 1.00 0.00 C ATOM 0 H ALA B 139 8.307 -4.559 -2.981 1.00 0.00 H new ATOM 0 HA ALA B 139 11.118 -4.506 -2.574 1.00 0.00 H new ATOM 0 HB1 ALA B 139 10.777 -6.913 -2.130 1.00 0.00 H new ATOM 0 HB2 ALA B 139 9.552 -5.916 -1.311 1.00 0.00 H new ATOM 0 HB3 ALA B 139 9.133 -6.796 -2.800 1.00 0.00 H new ATOM 1431 N ASP B 140 10.051 -5.742 -5.410 1.00 0.00 N ATOM 1432 CA ASP B 140 10.453 -6.238 -6.730 1.00 0.00 C ATOM 1433 C ASP B 140 11.007 -5.120 -7.612 1.00 0.00 C ATOM 1434 O ASP B 140 12.076 -5.243 -8.198 1.00 0.00 O ATOM 1435 CB ASP B 140 9.251 -6.917 -7.410 1.00 0.00 C ATOM 1436 CG ASP B 140 9.552 -7.424 -8.819 1.00 0.00 C ATOM 1437 OD1 ASP B 140 10.101 -8.532 -8.949 1.00 0.00 O ATOM 1438 OD2 ASP B 140 9.209 -6.723 -9.792 1.00 0.00 O ATOM 0 H ASP B 140 9.048 -5.587 -5.309 1.00 0.00 H new ATOM 0 HA ASP B 140 11.254 -6.965 -6.593 1.00 0.00 H new ATOM 0 HB2 ASP B 140 8.921 -7.754 -6.794 1.00 0.00 H new ATOM 0 HB3 ASP B 140 8.423 -6.210 -7.457 1.00 0.00 H new ATOM 1443 N ASN B 141 10.267 -4.014 -7.689 1.00 0.00 N ATOM 1444 CA ASN B 141 10.586 -2.917 -8.601 1.00 0.00 C ATOM 1445 C ASN B 141 11.618 -1.988 -7.990 1.00 0.00 C ATOM 1446 O ASN B 141 12.467 -1.447 -8.709 1.00 0.00 O ATOM 1447 CB ASN B 141 9.320 -2.125 -8.948 1.00 0.00 C ATOM 1448 CG ASN B 141 8.379 -2.900 -9.848 1.00 0.00 C ATOM 1449 OD1 ASN B 141 8.433 -2.758 -11.081 1.00 0.00 O ATOM 1450 ND2 ASN B 141 7.502 -3.709 -9.267 1.00 0.00 N ATOM 0 H ASN B 141 9.433 -3.854 -7.123 1.00 0.00 H new ATOM 0 HA ASN B 141 11.000 -3.348 -9.512 1.00 0.00 H new ATOM 0 HB2 ASN B 141 8.800 -1.857 -8.029 1.00 0.00 H new ATOM 0 HB3 ASN B 141 9.601 -1.193 -9.438 1.00 0.00 H new ATOM 0 HD21 ASN B 141 6.843 -4.240 -9.836 1.00 0.00 H new ATOM 0 HD22 ASN B 141 7.487 -3.800 -8.251 1.00 0.00 H new ATOM 1457 N GLU B 142 11.532 -1.792 -6.668 1.00 0.00 N ATOM 1458 CA GLU B 142 12.440 -0.915 -5.942 1.00 0.00 C ATOM 1459 C GLU B 142 12.561 0.464 -6.609 1.00 0.00 C ATOM 1460 O GLU B 142 13.677 0.990 -6.773 1.00 0.00 O ATOM 1461 CB GLU B 142 13.829 -1.576 -5.797 1.00 0.00 C ATOM 1462 CG GLU B 142 13.787 -2.955 -5.166 1.00 0.00 C ATOM 1463 CD GLU B 142 15.177 -3.507 -4.853 1.00 0.00 C ATOM 1464 OE1 GLU B 142 15.776 -4.167 -5.730 1.00 0.00 O ATOM 1465 OE2 GLU B 142 15.676 -3.289 -3.728 1.00 0.00 O ATOM 0 H GLU B 142 10.830 -2.239 -6.079 1.00 0.00 H new ATOM 0 HA GLU B 142 12.020 -0.758 -4.948 1.00 0.00 H new ATOM 0 HB2 GLU B 142 14.290 -1.651 -6.782 1.00 0.00 H new ATOM 0 HB3 GLU B 142 14.468 -0.930 -5.194 1.00 0.00 H new ATOM 0 HG2 GLU B 142 13.203 -2.911 -4.246 1.00 0.00 H new ATOM 0 HG3 GLU B 142 13.272 -3.641 -5.838 1.00 0.00 H new ATOM 1472 N ARG B 143 11.424 1.055 -6.959 1.00 0.00 N ATOM 1473 CA ARG B 143 11.425 2.364 -7.643 1.00 0.00 C ATOM 1474 C ARG B 143 10.119 3.112 -7.426 1.00 0.00 C ATOM 1475 O ARG B 143 10.120 4.338 -7.276 1.00 0.00 O ATOM 1476 CB ARG B 143 11.711 2.198 -9.142 1.00 0.00 C ATOM 1477 CG ARG B 143 10.766 1.243 -9.861 1.00 0.00 C ATOM 1478 CD ARG B 143 11.054 1.178 -11.357 1.00 0.00 C ATOM 1479 NE ARG B 143 10.219 0.216 -12.051 1.00 0.00 N ATOM 1480 CZ ARG B 143 9.264 0.537 -12.934 1.00 0.00 C ATOM 1481 NH1 ARG B 143 8.966 1.801 -13.157 1.00 0.00 N ATOM 1482 NH2 ARG B 143 8.594 -0.423 -13.555 1.00 0.00 N ATOM 0 H ARG B 143 10.497 0.664 -6.788 1.00 0.00 H new ATOM 0 HA ARG B 143 12.224 2.961 -7.203 1.00 0.00 H new ATOM 0 HB2 ARG B 143 11.654 3.176 -9.621 1.00 0.00 H new ATOM 0 HB3 ARG B 143 12.733 1.841 -9.267 1.00 0.00 H new ATOM 0 HG2 ARG B 143 10.859 0.246 -9.430 1.00 0.00 H new ATOM 0 HG3 ARG B 143 9.736 1.564 -9.703 1.00 0.00 H new ATOM 0 HD2 ARG B 143 10.903 2.165 -11.794 1.00 0.00 H new ATOM 0 HD3 ARG B 143 12.102 0.919 -11.509 1.00 0.00 H new ATOM 0 HE ARG B 143 10.369 -0.773 -11.853 1.00 0.00 H new ATOM 0 HH11 ARG B 143 9.463 2.538 -12.657 1.00 0.00 H new ATOM 0 HH12 ARG B 143 8.238 2.042 -13.830 1.00 0.00 H new ATOM 0 HH21 ARG B 143 8.806 -1.401 -13.360 1.00 0.00 H new ATOM 0 HH22 ARG B 143 7.866 -0.184 -14.228 1.00 0.00 H new ATOM 1496 N LEU B 144 9.004 2.383 -7.401 1.00 0.00 N ATOM 1497 CA LEU B 144 7.667 2.977 -7.243 1.00 0.00 C ATOM 1498 C LEU B 144 7.317 3.820 -8.484 1.00 0.00 C ATOM 1499 O LEU B 144 8.207 4.212 -9.254 1.00 0.00 O ATOM 1500 CB LEU B 144 7.616 3.862 -5.979 1.00 0.00 C ATOM 1501 CG LEU B 144 7.915 3.131 -4.638 1.00 0.00 C ATOM 1502 CD1 LEU B 144 7.933 4.123 -3.474 1.00 0.00 C ATOM 1503 CD2 LEU B 144 6.916 2.010 -4.391 1.00 0.00 C ATOM 0 H LEU B 144 8.996 1.367 -7.489 1.00 0.00 H new ATOM 0 HA LEU B 144 6.939 2.172 -7.137 1.00 0.00 H new ATOM 0 HB2 LEU B 144 8.332 4.675 -6.097 1.00 0.00 H new ATOM 0 HB3 LEU B 144 6.627 4.315 -5.913 1.00 0.00 H new ATOM 0 HG LEU B 144 8.905 2.680 -4.711 1.00 0.00 H new ATOM 0 HD11 LEU B 144 8.144 3.591 -2.546 1.00 0.00 H new ATOM 0 HD12 LEU B 144 8.706 4.872 -3.646 1.00 0.00 H new ATOM 0 HD13 LEU B 144 6.962 4.613 -3.399 1.00 0.00 H new ATOM 0 HD21 LEU B 144 7.149 1.517 -3.447 1.00 0.00 H new ATOM 0 HD22 LEU B 144 5.909 2.424 -4.345 1.00 0.00 H new ATOM 0 HD23 LEU B 144 6.974 1.285 -5.203 1.00 0.00 H new ATOM 1515 N PRO B 145 6.016 4.082 -8.732 1.00 0.00 N ATOM 1516 CA PRO B 145 5.580 4.946 -9.849 1.00 0.00 C ATOM 1517 C PRO B 145 5.916 6.420 -9.571 1.00 0.00 C ATOM 1518 O PRO B 145 6.321 7.156 -10.475 1.00 0.00 O ATOM 1519 CB PRO B 145 4.058 4.724 -9.912 1.00 0.00 C ATOM 1520 CG PRO B 145 3.672 4.309 -8.534 1.00 0.00 C ATOM 1521 CD PRO B 145 4.857 3.544 -7.971 1.00 0.00 C ATOM 0 HA PRO B 145 6.078 4.705 -10.788 1.00 0.00 H new ATOM 0 HB2 PRO B 145 3.538 5.635 -10.210 1.00 0.00 H new ATOM 0 HB3 PRO B 145 3.801 3.957 -10.642 1.00 0.00 H new ATOM 0 HG2 PRO B 145 3.441 5.177 -7.917 1.00 0.00 H new ATOM 0 HG3 PRO B 145 2.779 3.684 -8.552 1.00 0.00 H new ATOM 0 HD2 PRO B 145 4.969 3.711 -6.900 1.00 0.00 H new ATOM 0 HD3 PRO B 145 4.746 2.469 -8.117 1.00 0.00 H new ATOM 1529 N PHE B 146 5.713 6.825 -8.316 1.00 0.00 N ATOM 1530 CA PHE B 146 5.984 8.175 -7.862 1.00 0.00 C ATOM 1531 C PHE B 146 6.431 8.095 -6.419 1.00 0.00 C ATOM 1532 O PHE B 146 5.616 8.048 -5.510 1.00 0.00 O ATOM 1533 CB PHE B 146 4.748 9.068 -7.985 1.00 0.00 C ATOM 1534 CG PHE B 146 4.290 9.294 -9.401 1.00 0.00 C ATOM 1535 CD1 PHE B 146 4.950 10.204 -10.226 1.00 0.00 C ATOM 1536 CD2 PHE B 146 3.193 8.607 -9.915 1.00 0.00 C ATOM 1537 CE1 PHE B 146 4.525 10.418 -11.532 1.00 0.00 C ATOM 1538 CE2 PHE B 146 2.772 8.821 -11.214 1.00 0.00 C ATOM 1539 CZ PHE B 146 3.440 9.729 -12.023 1.00 0.00 C ATOM 0 H PHE B 146 5.352 6.213 -7.585 1.00 0.00 H new ATOM 0 HA PHE B 146 6.761 8.620 -8.484 1.00 0.00 H new ATOM 0 HB2 PHE B 146 3.932 8.620 -7.418 1.00 0.00 H new ATOM 0 HB3 PHE B 146 4.963 10.033 -7.526 1.00 0.00 H new ATOM 0 HD1 PHE B 146 5.801 10.749 -9.846 1.00 0.00 H new ATOM 0 HD2 PHE B 146 2.666 7.900 -9.292 1.00 0.00 H new ATOM 0 HE1 PHE B 146 5.046 11.125 -12.161 1.00 0.00 H new ATOM 0 HE2 PHE B 146 1.921 8.280 -11.600 1.00 0.00 H new ATOM 0 HZ PHE B 146 3.109 9.895 -13.037 1.00 0.00 H new ATOM 1549 N LYS B 147 7.740 7.992 -6.216 1.00 0.00 N ATOM 1550 CA LYS B 147 8.312 7.801 -4.886 1.00 0.00 C ATOM 1551 C LYS B 147 8.378 9.122 -4.149 1.00 0.00 C ATOM 1552 O LYS B 147 8.437 9.168 -2.912 1.00 0.00 O ATOM 1553 CB LYS B 147 9.716 7.186 -4.998 1.00 0.00 C ATOM 1554 CG LYS B 147 10.700 8.042 -5.802 1.00 0.00 C ATOM 1555 CD LYS B 147 12.028 7.309 -6.021 1.00 0.00 C ATOM 1556 CE LYS B 147 13.017 8.169 -6.810 1.00 0.00 C ATOM 1557 NZ LYS B 147 13.473 9.345 -6.031 1.00 0.00 N ATOM 0 H LYS B 147 8.432 8.038 -6.964 1.00 0.00 H new ATOM 0 HA LYS B 147 7.673 7.119 -4.324 1.00 0.00 H new ATOM 0 HB2 LYS B 147 10.117 7.032 -3.996 1.00 0.00 H new ATOM 0 HB3 LYS B 147 9.637 6.204 -5.464 1.00 0.00 H new ATOM 0 HG2 LYS B 147 10.260 8.297 -6.766 1.00 0.00 H new ATOM 0 HG3 LYS B 147 10.882 8.980 -5.277 1.00 0.00 H new ATOM 0 HD2 LYS B 147 12.462 7.044 -5.057 1.00 0.00 H new ATOM 0 HD3 LYS B 147 11.847 6.377 -6.556 1.00 0.00 H new ATOM 0 HE2 LYS B 147 13.879 7.564 -7.092 1.00 0.00 H new ATOM 0 HE3 LYS B 147 12.548 8.506 -7.734 1.00 0.00 H new ATOM 0 HZ1 LYS B 147 14.251 9.815 -6.536 1.00 0.00 H new ATOM 0 HZ2 LYS B 147 12.683 10.011 -5.914 1.00 0.00 H new ATOM 0 HZ3 LYS B 147 13.805 9.034 -5.096 1.00 0.00 H new ATOM 1571 N GLN B 148 8.350 10.210 -4.929 1.00 0.00 N ATOM 1572 CA GLN B 148 8.504 11.571 -4.400 1.00 0.00 C ATOM 1573 C GLN B 148 9.785 11.674 -3.552 1.00 0.00 C ATOM 1574 O GLN B 148 10.658 10.795 -3.628 1.00 0.00 O ATOM 1575 CB GLN B 148 7.259 11.972 -3.579 1.00 0.00 C ATOM 1576 CG GLN B 148 5.965 12.040 -4.406 1.00 0.00 C ATOM 1577 CD GLN B 148 4.932 10.963 -4.071 1.00 0.00 C ATOM 1578 OE1 GLN B 148 5.401 9.844 -3.551 1.00 0.00 O flip ATOM 1579 NE2 GLN B 148 3.733 11.166 -4.228 1.00 0.00 N flip ATOM 0 H GLN B 148 8.221 10.172 -5.940 1.00 0.00 H new ATOM 0 HA GLN B 148 8.595 12.265 -5.235 1.00 0.00 H new ATOM 0 HB2 GLN B 148 7.124 11.256 -2.769 1.00 0.00 H new ATOM 0 HB3 GLN B 148 7.436 12.944 -3.119 1.00 0.00 H new ATOM 0 HG2 GLN B 148 5.509 13.019 -4.260 1.00 0.00 H new ATOM 0 HG3 GLN B 148 6.221 11.962 -5.463 1.00 0.00 H new ATOM 0 HE21 GLN B 148 3.414 12.046 -4.634 1.00 0.00 H new ATOM 0 HE22 GLN B 148 3.055 10.455 -3.953 1.00 0.00 H new ATOM 1588 N THR B 149 9.915 12.738 -2.760 1.00 0.00 N ATOM 1589 CA THR B 149 11.064 12.901 -1.863 1.00 0.00 C ATOM 1590 C THR B 149 10.638 13.513 -0.543 1.00 0.00 C ATOM 1591 O THR B 149 11.434 14.165 0.138 1.00 0.00 O ATOM 1592 CB THR B 149 12.178 13.750 -2.542 1.00 0.00 C ATOM 1593 OG1 THR B 149 13.318 13.857 -1.690 1.00 0.00 O ATOM 1594 CG2 THR B 149 11.675 15.142 -2.889 1.00 0.00 C ATOM 0 H THR B 149 9.240 13.501 -2.720 1.00 0.00 H new ATOM 0 HA THR B 149 11.475 11.913 -1.654 1.00 0.00 H new ATOM 0 HB THR B 149 12.462 13.241 -3.463 1.00 0.00 H new ATOM 0 HG1 THR B 149 13.024 14.002 -0.767 1.00 0.00 H new ATOM 0 HG21 THR B 149 12.476 15.711 -3.362 1.00 0.00 H new ATOM 0 HG22 THR B 149 10.832 15.064 -3.575 1.00 0.00 H new ATOM 0 HG23 THR B 149 11.357 15.651 -1.979 1.00 0.00 H new ATOM 1602 N LEU B 150 9.379 13.286 -0.159 1.00 0.00 N ATOM 1603 CA LEU B 150 8.848 13.831 1.095 1.00 0.00 C ATOM 1604 C LEU B 150 9.545 13.184 2.294 1.00 0.00 C ATOM 1605 O LEU B 150 10.340 13.859 2.970 1.00 0.00 O ATOM 1606 CB LEU B 150 7.317 13.649 1.172 1.00 0.00 C ATOM 1607 CG LEU B 150 6.485 14.601 0.316 1.00 0.00 C ATOM 1608 CD1 LEU B 150 6.780 14.429 -1.176 1.00 0.00 C ATOM 1609 CD2 LEU B 150 4.990 14.448 0.592 1.00 0.00 C ATOM 1610 OXT LEU B 150 9.317 11.986 2.557 1.00 0.00 O ATOM 0 H LEU B 150 8.711 12.732 -0.695 1.00 0.00 H new ATOM 0 HA LEU B 150 9.053 14.901 1.120 1.00 0.00 H new ATOM 0 HB2 LEU B 150 7.078 12.626 0.880 1.00 0.00 H new ATOM 0 HB3 LEU B 150 7.009 13.764 2.211 1.00 0.00 H new ATOM 0 HG LEU B 150 6.776 15.613 0.599 1.00 0.00 H new ATOM 0 HD11 LEU B 150 6.168 15.124 -1.750 1.00 0.00 H new ATOM 0 HD12 LEU B 150 7.834 14.633 -1.364 1.00 0.00 H new ATOM 0 HD13 LEU B 150 6.548 13.407 -1.477 1.00 0.00 H new ATOM 0 HD21 LEU B 150 4.431 15.142 -0.036 1.00 0.00 H new ATOM 0 HD22 LEU B 150 4.681 13.427 0.368 1.00 0.00 H new ATOM 0 HD23 LEU B 150 4.789 14.666 1.641 1.00 0.00 H new TER 1622 LEU B 150