USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1180 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 105 MET CE :methyl -120:sc=-0.00197 (180deg=-0.133) USER MOD Set 1.2: A 120 MET CE :methyl 169:sc= -0.0473 (180deg=-0.261) USER MOD Set 2.1: A 103 HIS : no HD1:sc= 0.274 K(o=0.54,f=-1.7) USER MOD Set 2.2: A 107 ASN : amide:sc= 0.261 K(o=0.54,f=-1.7!) USER MOD Set 3.1: A 56 ASN : amide:sc= 0.474 K(o=0.77,f=-5!) USER MOD Set 3.2: A 58 THR OG1 : rot 68:sc= 0.3 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot -78:sc= 1.64 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 54:sc= 1.23 USER MOD Single : A 32 MET CE :methyl 165:sc= 0 (180deg=-0.216) USER MOD Single : A 34 SER OG : rot -99:sc= 1.09 USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 38 ASN : amide:sc= -0.0473 K(o=-0.047,f=-1.8) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 MET CE :methyl 164:sc= -0.0603 (180deg=-0.427) USER MOD Single : A 49 ASN : amide:sc= -0.0144 K(o=-0.014,f=-1.9!) USER MOD Single : A 66 THR OG1 : rot 75:sc= 0.116 USER MOD Single : A 67 MET CE :methyl 175:sc= 0 (180deg=-0.0168) USER MOD Single : A 68 MET CE :methyl -173:sc= -0.0675 (180deg=-0.0844) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl -165:sc= -0.0229 (180deg=-0.375) USER MOD Single : A 73 LYS NZ :NH3+ -150:sc= 1.19 (180deg=1.12) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.0979 USER MOD Single : A 77 SER OG : rot 83:sc= 0.863 USER MOD Single : A 90 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0452) USER MOD Single : A 93 ASN : amide:sc= 0.0167 K(o=0.017,f=-1) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -75:sc= 1.21 USER MOD Single : A 106 THR OG1 : rot 88:sc= 0.743 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 133:sc= 0.424 USER MOD Single : A 131 GLN : amide:sc= 0.663 K(o=0.66,f=0) USER MOD Single : A 133 ASN : amide:sc= -0.315 K(o=-0.31,f=-3.7!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0.045) USER MOD Single : A 140 MET CE :methyl 180:sc= -0.838 (180deg=-0.838) USER MOD Single : A 141 MET CE :methyl -179:sc= -0.813 (180deg=-0.827) USER MOD Single : A 142 THR OG1 : rot -77:sc= 1 USER MOD Single : B 1 ARG N :NH3+ -164:sc= -0.0685 (180deg=-0.568) USER MOD Single : B 3 LYS NZ :NH3+ -160:sc= 2.25 (180deg=1.31) USER MOD Single : B 5 GLN : amide:sc= -0.0516 X(o=-0.052,f=-0.22) USER MOD Single : B 6 LYS NZ :NH3+ 162:sc= 1.18 (180deg=0.899) USER MOD Single : B 7 THR OG1 : rot 82:sc= 1.18 USER MOD Single : B 9 HIS : no HD1:sc= -0.214 X(o=-0.21,f=-0.48) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 2.576 1.323 17.951 1.00 0.00 N ATOM 30 CA GLU A 3 1.612 0.745 17.067 1.00 0.00 C ATOM 31 C GLU A 3 2.110 0.658 15.666 1.00 0.00 C ATOM 32 O GLU A 3 1.658 -0.230 14.945 1.00 0.00 O ATOM 33 CB GLU A 3 0.180 1.303 17.131 1.00 0.00 C ATOM 34 CG GLU A 3 -0.489 1.331 18.506 1.00 0.00 C ATOM 35 CD GLU A 3 -2.006 1.251 18.409 1.00 0.00 C ATOM 36 OE1 GLU A 3 -2.736 2.149 17.912 1.00 0.00 O ATOM 37 OE2 GLU A 3 -2.561 0.191 18.804 1.00 0.00 O ATOM 0 HA GLU A 3 1.502 -0.263 17.467 1.00 0.00 H new ATOM 0 HB2 GLU A 3 0.194 2.320 16.739 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -0.445 0.712 16.461 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -0.120 0.498 19.105 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -0.208 2.246 19.027 1.00 0.00 H new ATOM 44 N GLN A 4 2.932 1.598 15.165 1.00 0.00 N ATOM 45 CA GLN A 4 3.215 1.654 13.765 1.00 0.00 C ATOM 46 C GLN A 4 4.146 0.570 13.340 1.00 0.00 C ATOM 47 O GLN A 4 3.848 -0.254 12.478 1.00 0.00 O ATOM 48 CB GLN A 4 3.723 3.011 13.247 1.00 0.00 C ATOM 49 CG GLN A 4 2.557 3.999 13.189 1.00 0.00 C ATOM 50 CD GLN A 4 2.829 5.320 12.483 1.00 0.00 C ATOM 51 OE1 GLN A 4 3.988 5.652 12.240 1.00 0.00 O ATOM 52 NE2 GLN A 4 1.757 6.033 12.046 1.00 0.00 N ATOM 0 H GLN A 4 3.397 2.313 15.724 1.00 0.00 H new ATOM 0 HA GLN A 4 2.239 1.505 13.304 1.00 0.00 H new ATOM 0 HB2 GLN A 4 4.506 3.393 13.902 1.00 0.00 H new ATOM 0 HB3 GLN A 4 4.164 2.893 12.257 1.00 0.00 H new ATOM 0 HG2 GLN A 4 1.719 3.511 12.691 1.00 0.00 H new ATOM 0 HG3 GLN A 4 2.240 4.215 14.209 1.00 0.00 H new ATOM 0 HE21 GLN A 4 0.812 5.722 12.270 1.00 0.00 H new ATOM 0 HE22 GLN A 4 1.898 6.879 11.494 1.00 0.00 H new ATOM 61 N ILE A 5 5.281 0.526 14.060 1.00 0.00 N ATOM 62 CA ILE A 5 6.263 -0.510 13.977 1.00 0.00 C ATOM 63 C ILE A 5 5.718 -1.867 14.264 1.00 0.00 C ATOM 64 O ILE A 5 6.057 -2.836 13.587 1.00 0.00 O ATOM 65 CB ILE A 5 7.525 -0.292 14.758 1.00 0.00 C ATOM 66 CG1 ILE A 5 7.330 -0.269 16.284 1.00 0.00 C ATOM 67 CG2 ILE A 5 8.296 0.952 14.287 1.00 0.00 C ATOM 68 CD1 ILE A 5 8.558 -0.818 17.008 1.00 0.00 C ATOM 0 H ILE A 5 5.526 1.251 14.735 1.00 0.00 H new ATOM 0 HA ILE A 5 6.550 -0.455 12.927 1.00 0.00 H new ATOM 0 HB ILE A 5 8.130 -1.173 14.544 1.00 0.00 H new ATOM 0 HG12 ILE A 5 7.137 0.752 16.613 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.454 -0.860 16.550 1.00 0.00 H new ATOM 0 HG21 ILE A 5 9.201 1.066 14.883 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.565 0.837 13.237 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.669 1.836 14.406 1.00 0.00 H new ATOM 0 HD11 ILE A 5 8.389 -0.788 18.084 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.734 -1.848 16.696 1.00 0.00 H new ATOM 0 HD13 ILE A 5 9.428 -0.210 16.760 1.00 0.00 H new ATOM 80 N ALA A 6 4.812 -2.071 15.237 1.00 0.00 N ATOM 81 CA ALA A 6 3.984 -3.230 15.367 1.00 0.00 C ATOM 82 C ALA A 6 3.118 -3.757 14.274 1.00 0.00 C ATOM 83 O ALA A 6 3.099 -4.937 13.927 1.00 0.00 O ATOM 84 CB ALA A 6 3.087 -3.006 16.596 1.00 0.00 C ATOM 0 H ALA A 6 4.648 -1.387 15.976 1.00 0.00 H new ATOM 0 HA ALA A 6 4.743 -4.011 15.399 1.00 0.00 H new ATOM 0 HB1 ALA A 6 2.436 -3.869 16.733 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.709 -2.876 17.482 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.479 -2.114 16.445 1.00 0.00 H new ATOM 90 N GLU A 7 2.362 -2.852 13.628 1.00 0.00 N ATOM 91 CA GLU A 7 1.490 -3.262 12.572 1.00 0.00 C ATOM 92 C GLU A 7 2.183 -3.440 11.265 1.00 0.00 C ATOM 93 O GLU A 7 1.751 -4.200 10.400 1.00 0.00 O ATOM 94 CB GLU A 7 0.434 -2.148 12.477 1.00 0.00 C ATOM 95 CG GLU A 7 -0.524 -2.303 13.660 1.00 0.00 C ATOM 96 CD GLU A 7 -1.551 -1.186 13.784 1.00 0.00 C ATOM 97 OE1 GLU A 7 -1.959 -0.683 12.703 1.00 0.00 O ATOM 98 OE2 GLU A 7 -2.028 -0.894 14.913 1.00 0.00 O ATOM 0 H GLU A 7 2.353 -1.853 13.832 1.00 0.00 H new ATOM 0 HA GLU A 7 1.064 -4.241 12.792 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.911 -1.168 12.499 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -0.110 -2.217 11.535 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -1.048 -3.254 13.566 1.00 0.00 H new ATOM 0 HG3 GLU A 7 0.058 -2.350 14.580 1.00 0.00 H new ATOM 105 N PHE A 8 3.386 -2.852 11.137 1.00 0.00 N ATOM 106 CA PHE A 8 4.308 -3.135 10.081 1.00 0.00 C ATOM 107 C PHE A 8 5.092 -4.392 10.243 1.00 0.00 C ATOM 108 O PHE A 8 5.531 -5.026 9.285 1.00 0.00 O ATOM 109 CB PHE A 8 5.364 -2.050 9.808 1.00 0.00 C ATOM 110 CG PHE A 8 4.867 -0.833 9.108 1.00 0.00 C ATOM 111 CD1 PHE A 8 4.150 -0.847 7.935 1.00 0.00 C ATOM 112 CD2 PHE A 8 5.021 0.387 9.724 1.00 0.00 C ATOM 113 CE1 PHE A 8 3.579 0.275 7.382 1.00 0.00 C ATOM 114 CE2 PHE A 8 4.555 1.551 9.160 1.00 0.00 C ATOM 115 CZ PHE A 8 3.922 1.483 7.942 1.00 0.00 C ATOM 0 H PHE A 8 3.730 -2.152 11.795 1.00 0.00 H new ATOM 0 HA PHE A 8 3.605 -3.209 9.252 1.00 0.00 H new ATOM 0 HB2 PHE A 8 5.803 -1.747 10.759 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.165 -2.489 9.213 1.00 0.00 H new ATOM 0 HD1 PHE A 8 4.029 -1.789 7.421 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.523 0.432 10.679 1.00 0.00 H new ATOM 0 HE1 PHE A 8 2.895 0.211 6.549 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.684 2.498 9.663 1.00 0.00 H new ATOM 0 HZ PHE A 8 3.689 2.396 7.414 1.00 0.00 H new ATOM 125 N LYS A 9 5.285 -4.895 11.475 1.00 0.00 N ATOM 126 CA LYS A 9 5.826 -6.186 11.769 1.00 0.00 C ATOM 127 C LYS A 9 5.067 -7.361 11.256 1.00 0.00 C ATOM 128 O LYS A 9 5.674 -8.312 10.764 1.00 0.00 O ATOM 129 CB LYS A 9 6.103 -6.253 13.280 1.00 0.00 C ATOM 130 CG LYS A 9 6.803 -7.555 13.676 1.00 0.00 C ATOM 131 CD LYS A 9 7.079 -7.652 15.178 1.00 0.00 C ATOM 132 CE LYS A 9 8.011 -8.849 15.376 1.00 0.00 C ATOM 133 NZ LYS A 9 8.153 -9.016 16.840 1.00 0.00 N ATOM 0 H LYS A 9 5.049 -4.369 12.316 1.00 0.00 H new ATOM 0 HA LYS A 9 6.752 -6.278 11.202 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.722 -5.405 13.573 1.00 0.00 H new ATOM 0 HB3 LYS A 9 5.163 -6.166 13.825 1.00 0.00 H new ATOM 0 HG2 LYS A 9 6.186 -8.400 13.370 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.745 -7.634 13.133 1.00 0.00 H new ATOM 0 HD2 LYS A 9 7.541 -6.736 15.547 1.00 0.00 H new ATOM 0 HD3 LYS A 9 6.151 -7.787 15.734 1.00 0.00 H new ATOM 0 HE2 LYS A 9 7.595 -9.747 14.919 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.979 -8.672 14.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 8.781 -9.821 17.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 8.559 -8.151 17.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 7.219 -9.193 17.261 1.00 0.00 H new ATOM 147 N GLU A 10 3.725 -7.276 11.277 1.00 0.00 N ATOM 148 CA GLU A 10 2.821 -8.261 10.770 1.00 0.00 C ATOM 149 C GLU A 10 2.980 -8.357 9.292 1.00 0.00 C ATOM 150 O GLU A 10 2.957 -9.456 8.740 1.00 0.00 O ATOM 151 CB GLU A 10 1.369 -8.128 11.261 1.00 0.00 C ATOM 152 CG GLU A 10 1.205 -7.893 12.764 1.00 0.00 C ATOM 153 CD GLU A 10 -0.236 -7.726 13.222 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.675 -6.558 13.047 1.00 0.00 O ATOM 155 OE2 GLU A 10 -0.914 -8.642 13.761 1.00 0.00 O ATOM 0 H GLU A 10 3.242 -6.469 11.673 1.00 0.00 H new ATOM 0 HA GLU A 10 3.098 -9.223 11.201 1.00 0.00 H new ATOM 0 HB2 GLU A 10 0.897 -7.303 10.728 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.827 -9.034 10.991 1.00 0.00 H new ATOM 0 HG2 GLU A 10 1.649 -8.731 13.301 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.767 -7.002 13.043 1.00 0.00 H new ATOM 162 N ALA A 11 3.107 -7.168 8.676 1.00 0.00 N ATOM 163 CA ALA A 11 3.033 -6.854 7.283 1.00 0.00 C ATOM 164 C ALA A 11 4.236 -7.428 6.617 1.00 0.00 C ATOM 165 O ALA A 11 4.117 -7.891 5.484 1.00 0.00 O ATOM 166 CB ALA A 11 2.915 -5.349 6.988 1.00 0.00 C ATOM 0 H ALA A 11 3.283 -6.327 9.226 1.00 0.00 H new ATOM 0 HA ALA A 11 2.116 -7.292 6.890 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.864 -5.192 5.911 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.012 -4.956 7.455 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.786 -4.830 7.389 1.00 0.00 H new ATOM 172 N PHE A 12 5.387 -7.382 7.311 1.00 0.00 N ATOM 173 CA PHE A 12 6.628 -7.971 6.911 1.00 0.00 C ATOM 174 C PHE A 12 6.555 -9.428 6.609 1.00 0.00 C ATOM 175 O PHE A 12 7.152 -9.893 5.639 1.00 0.00 O ATOM 176 CB PHE A 12 7.502 -7.848 8.171 1.00 0.00 C ATOM 177 CG PHE A 12 8.954 -7.912 7.840 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.634 -9.106 7.870 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.730 -6.802 7.602 1.00 0.00 C ATOM 180 CE1 PHE A 12 10.962 -9.213 7.530 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.061 -6.926 7.283 1.00 0.00 C ATOM 182 CZ PHE A 12 11.715 -8.128 7.148 1.00 0.00 C ATOM 0 H PHE A 12 5.455 -6.903 8.209 1.00 0.00 H new ATOM 0 HA PHE A 12 6.980 -7.479 6.005 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.284 -6.906 8.675 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.251 -8.648 8.868 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.104 -9.997 8.173 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.287 -5.819 7.667 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.431 -10.185 7.564 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.630 -6.021 7.128 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.726 -8.212 6.777 1.00 0.00 H new ATOM 192 N SER A 13 5.913 -10.257 7.452 1.00 0.00 N ATOM 193 CA SER A 13 5.717 -11.672 7.392 1.00 0.00 C ATOM 194 C SER A 13 4.958 -12.205 6.225 1.00 0.00 C ATOM 195 O SER A 13 4.969 -13.383 5.873 1.00 0.00 O ATOM 196 CB SER A 13 4.945 -12.223 8.603 1.00 0.00 C ATOM 197 OG SER A 13 5.739 -11.981 9.754 1.00 0.00 O ATOM 0 H SER A 13 5.473 -9.876 8.289 1.00 0.00 H new ATOM 0 HA SER A 13 6.756 -11.998 7.337 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.975 -11.734 8.695 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.755 -13.290 8.485 1.00 0.00 H new ATOM 0 HG SER A 13 5.275 -12.319 10.548 1.00 0.00 H new ATOM 203 N LEU A 14 4.244 -11.280 5.558 1.00 0.00 N ATOM 204 CA LEU A 14 3.756 -11.469 4.228 1.00 0.00 C ATOM 205 C LEU A 14 4.879 -11.687 3.274 1.00 0.00 C ATOM 206 O LEU A 14 4.957 -12.716 2.603 1.00 0.00 O ATOM 207 CB LEU A 14 2.893 -10.305 3.711 1.00 0.00 C ATOM 208 CG LEU A 14 1.587 -9.927 4.430 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.647 -9.031 3.606 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.795 -11.155 4.910 1.00 0.00 C ATOM 0 H LEU A 14 3.999 -10.374 5.957 1.00 0.00 H new ATOM 0 HA LEU A 14 3.120 -12.353 4.283 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.524 -9.416 3.700 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.638 -10.528 2.675 1.00 0.00 H new ATOM 0 HG LEU A 14 1.932 -9.353 5.290 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.249 -8.812 4.187 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.156 -8.099 3.360 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.367 -9.546 2.687 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.117 -10.827 5.410 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.536 -11.778 4.054 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.404 -11.731 5.607 1.00 0.00 H new ATOM 222 N PHE A 15 5.835 -10.748 3.158 1.00 0.00 N ATOM 223 CA PHE A 15 6.935 -10.771 2.245 1.00 0.00 C ATOM 224 C PHE A 15 7.969 -11.778 2.613 1.00 0.00 C ATOM 225 O PHE A 15 8.330 -12.605 1.777 1.00 0.00 O ATOM 226 CB PHE A 15 7.542 -9.358 2.283 1.00 0.00 C ATOM 227 CG PHE A 15 6.655 -8.411 1.550 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.736 -8.237 0.188 1.00 0.00 C ATOM 229 CD2 PHE A 15 5.785 -7.597 2.235 1.00 0.00 C ATOM 230 CE1 PHE A 15 5.990 -7.286 -0.468 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.164 -6.507 1.672 1.00 0.00 C ATOM 232 CZ PHE A 15 5.217 -6.447 0.299 1.00 0.00 C ATOM 0 H PHE A 15 5.838 -9.914 3.745 1.00 0.00 H new ATOM 0 HA PHE A 15 6.586 -11.053 1.252 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.664 -9.032 3.316 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.534 -9.366 1.832 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.404 -8.865 -0.382 1.00 0.00 H new ATOM 0 HD2 PHE A 15 5.578 -7.825 3.270 1.00 0.00 H new ATOM 0 HE1 PHE A 15 6.011 -7.202 -1.544 1.00 0.00 H new ATOM 0 HE2 PHE A 15 4.670 -5.752 2.266 1.00 0.00 H new ATOM 0 HZ PHE A 15 4.619 -5.701 -0.203 1.00 0.00 H new ATOM 242 N ASP A 16 8.397 -11.864 3.885 1.00 0.00 N ATOM 243 CA ASP A 16 9.400 -12.679 4.498 1.00 0.00 C ATOM 244 C ASP A 16 8.982 -14.047 4.915 1.00 0.00 C ATOM 245 O ASP A 16 8.036 -14.152 5.695 1.00 0.00 O ATOM 246 CB ASP A 16 10.002 -11.980 5.729 1.00 0.00 C ATOM 247 CG ASP A 16 11.460 -12.346 5.966 1.00 0.00 C ATOM 248 OD1 ASP A 16 12.333 -11.897 5.176 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.751 -13.107 6.927 1.00 0.00 O ATOM 0 H ASP A 16 7.967 -11.264 4.589 1.00 0.00 H new ATOM 0 HA ASP A 16 10.127 -12.810 3.696 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.920 -10.900 5.603 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.419 -12.244 6.611 1.00 0.00 H new ATOM 254 N LYS A 17 9.711 -15.119 4.557 1.00 0.00 N ATOM 255 CA LYS A 17 9.355 -16.484 4.792 1.00 0.00 C ATOM 256 C LYS A 17 9.719 -16.858 6.188 1.00 0.00 C ATOM 257 O LYS A 17 8.925 -17.578 6.790 1.00 0.00 O ATOM 258 CB LYS A 17 9.948 -17.495 3.795 1.00 0.00 C ATOM 259 CG LYS A 17 9.337 -18.895 3.716 1.00 0.00 C ATOM 260 CD LYS A 17 7.829 -19.073 3.521 1.00 0.00 C ATOM 261 CE LYS A 17 7.382 -20.531 3.398 1.00 0.00 C ATOM 262 NZ LYS A 17 6.090 -20.685 2.693 1.00 0.00 N ATOM 0 H LYS A 17 10.604 -15.026 4.073 1.00 0.00 H new ATOM 0 HA LYS A 17 8.277 -16.541 4.639 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.889 -17.052 2.801 1.00 0.00 H new ATOM 0 HB3 LYS A 17 11.006 -17.609 4.030 1.00 0.00 H new ATOM 0 HG2 LYS A 17 9.831 -19.416 2.896 1.00 0.00 H new ATOM 0 HG3 LYS A 17 9.607 -19.416 4.634 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.308 -18.614 4.362 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.523 -18.534 2.624 1.00 0.00 H new ATOM 0 HE2 LYS A 17 8.148 -21.096 2.867 1.00 0.00 H new ATOM 0 HE3 LYS A 17 7.299 -20.965 4.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 5.841 -21.693 2.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.349 -20.171 3.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 6.171 -20.299 1.731 1.00 0.00 H new ATOM 276 N ASP A 18 10.873 -16.342 6.646 1.00 0.00 N ATOM 277 CA ASP A 18 11.385 -16.573 7.961 1.00 0.00 C ATOM 278 C ASP A 18 10.591 -15.846 8.992 1.00 0.00 C ATOM 279 O ASP A 18 9.979 -16.446 9.874 1.00 0.00 O ATOM 280 CB ASP A 18 12.881 -16.222 8.017 1.00 0.00 C ATOM 281 CG ASP A 18 13.610 -16.826 6.826 1.00 0.00 C ATOM 282 OD1 ASP A 18 13.655 -18.084 6.771 1.00 0.00 O ATOM 283 OD2 ASP A 18 14.066 -16.058 5.938 1.00 0.00 O ATOM 0 H ASP A 18 11.472 -15.741 6.080 1.00 0.00 H new ATOM 0 HA ASP A 18 11.286 -17.633 8.192 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.008 -15.139 8.019 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.315 -16.595 8.945 1.00 0.00 H new ATOM 288 N GLY A 19 10.406 -14.516 8.904 1.00 0.00 N ATOM 289 CA GLY A 19 10.178 -13.655 10.022 1.00 0.00 C ATOM 290 C GLY A 19 11.348 -13.452 10.922 1.00 0.00 C ATOM 291 O GLY A 19 11.211 -13.407 12.144 1.00 0.00 O ATOM 0 H GLY A 19 10.416 -14.019 8.013 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.854 -12.683 9.650 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.355 -14.061 10.610 1.00 0.00 H new ATOM 295 N ASP A 20 12.443 -13.117 10.216 1.00 0.00 N ATOM 296 CA ASP A 20 13.640 -12.674 10.861 1.00 0.00 C ATOM 297 C ASP A 20 13.674 -11.192 11.003 1.00 0.00 C ATOM 298 O ASP A 20 13.212 -10.607 11.981 1.00 0.00 O ATOM 299 CB ASP A 20 14.851 -13.237 10.099 1.00 0.00 C ATOM 300 CG ASP A 20 14.837 -13.262 8.578 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.366 -12.336 7.865 1.00 0.00 O ATOM 302 OD2 ASP A 20 15.415 -14.230 8.014 1.00 0.00 O ATOM 0 H ASP A 20 12.499 -13.153 9.198 1.00 0.00 H new ATOM 0 HA ASP A 20 13.672 -13.057 11.881 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.725 -12.664 10.408 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.004 -14.261 10.441 1.00 0.00 H new ATOM 307 N GLY A 21 14.167 -10.524 9.945 1.00 0.00 N ATOM 308 CA GLY A 21 14.205 -9.104 9.775 1.00 0.00 C ATOM 309 C GLY A 21 14.738 -8.698 8.444 1.00 0.00 C ATOM 310 O GLY A 21 14.790 -7.494 8.199 1.00 0.00 O ATOM 0 H GLY A 21 14.570 -11.016 9.147 1.00 0.00 H new ATOM 0 HA2 GLY A 21 13.200 -8.701 9.898 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.823 -8.665 10.558 1.00 0.00 H new ATOM 314 N THR A 22 15.104 -9.623 7.540 1.00 0.00 N ATOM 315 CA THR A 22 15.699 -9.333 6.272 1.00 0.00 C ATOM 316 C THR A 22 15.065 -10.101 5.164 1.00 0.00 C ATOM 317 O THR A 22 15.049 -11.331 5.140 1.00 0.00 O ATOM 318 CB THR A 22 17.177 -9.585 6.308 1.00 0.00 C ATOM 319 OG1 THR A 22 17.519 -10.742 7.056 1.00 0.00 O ATOM 320 CG2 THR A 22 17.922 -8.416 6.976 1.00 0.00 C ATOM 0 H THR A 22 14.979 -10.622 7.701 1.00 0.00 H new ATOM 0 HA THR A 22 15.527 -8.275 6.073 1.00 0.00 H new ATOM 0 HB THR A 22 17.467 -9.710 5.265 1.00 0.00 H new ATOM 0 HG1 THR A 22 18.492 -10.862 7.047 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.992 -8.626 6.988 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.738 -7.500 6.415 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.565 -8.293 7.998 1.00 0.00 H new ATOM 328 N ILE A 23 14.540 -9.365 4.169 1.00 0.00 N ATOM 329 CA ILE A 23 13.814 -9.880 3.049 1.00 0.00 C ATOM 330 C ILE A 23 14.702 -10.040 1.864 1.00 0.00 C ATOM 331 O ILE A 23 15.083 -9.103 1.164 1.00 0.00 O ATOM 332 CB ILE A 23 12.639 -9.122 2.505 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.869 -8.490 3.677 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.738 -10.061 1.686 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.785 -7.514 3.222 1.00 0.00 C ATOM 0 H ILE A 23 14.628 -8.349 4.145 1.00 0.00 H new ATOM 0 HA ILE A 23 13.428 -10.793 3.501 1.00 0.00 H new ATOM 0 HB ILE A 23 12.980 -8.329 1.839 1.00 0.00 H new ATOM 0 HG12 ILE A 23 11.412 -9.280 4.272 1.00 0.00 H new ATOM 0 HG13 ILE A 23 12.571 -7.967 4.326 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.888 -9.501 1.296 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.308 -10.480 0.857 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.378 -10.868 2.324 1.00 0.00 H new ATOM 0 HD11 ILE A 23 10.277 -7.102 4.094 1.00 0.00 H new ATOM 0 HD12 ILE A 23 11.240 -6.705 2.651 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.063 -8.038 2.596 1.00 0.00 H new ATOM 347 N THR A 24 14.972 -11.316 1.537 1.00 0.00 N ATOM 348 CA THR A 24 15.764 -11.727 0.419 1.00 0.00 C ATOM 349 C THR A 24 15.099 -11.520 -0.898 1.00 0.00 C ATOM 350 O THR A 24 13.930 -11.140 -0.950 1.00 0.00 O ATOM 351 CB THR A 24 16.140 -13.172 0.555 1.00 0.00 C ATOM 352 OG1 THR A 24 15.015 -14.024 0.712 1.00 0.00 O ATOM 353 CG2 THR A 24 16.992 -13.323 1.827 1.00 0.00 C ATOM 0 H THR A 24 14.619 -12.103 2.082 1.00 0.00 H new ATOM 0 HA THR A 24 16.650 -11.092 0.433 1.00 0.00 H new ATOM 0 HB THR A 24 16.666 -13.458 -0.356 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.694 -13.975 1.637 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.280 -14.367 1.950 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.887 -12.708 1.740 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.413 -13.002 2.693 1.00 0.00 H new ATOM 361 N THR A 25 15.814 -11.650 -2.030 1.00 0.00 N ATOM 362 CA THR A 25 15.235 -11.876 -3.318 1.00 0.00 C ATOM 363 C THR A 25 14.303 -13.038 -3.286 1.00 0.00 C ATOM 364 O THR A 25 13.183 -12.930 -3.783 1.00 0.00 O ATOM 365 CB THR A 25 16.296 -12.063 -4.361 1.00 0.00 C ATOM 366 OG1 THR A 25 17.369 -12.913 -3.983 1.00 0.00 O ATOM 367 CG2 THR A 25 16.934 -10.727 -4.779 1.00 0.00 C ATOM 0 H THR A 25 16.832 -11.596 -2.049 1.00 0.00 H new ATOM 0 HA THR A 25 14.658 -10.991 -3.586 1.00 0.00 H new ATOM 0 HB THR A 25 15.748 -12.531 -5.179 1.00 0.00 H new ATOM 0 HG1 THR A 25 18.010 -12.978 -4.721 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.697 -10.909 -5.536 1.00 0.00 H new ATOM 0 HG22 THR A 25 16.167 -10.070 -5.188 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.391 -10.254 -3.910 1.00 0.00 H new ATOM 375 N LYS A 26 14.754 -14.196 -2.772 1.00 0.00 N ATOM 376 CA LYS A 26 14.042 -15.435 -2.717 1.00 0.00 C ATOM 377 C LYS A 26 12.676 -15.252 -2.150 1.00 0.00 C ATOM 378 O LYS A 26 11.676 -15.477 -2.829 1.00 0.00 O ATOM 379 CB LYS A 26 14.853 -16.437 -1.878 1.00 0.00 C ATOM 380 CG LYS A 26 16.232 -16.797 -2.435 1.00 0.00 C ATOM 381 CD LYS A 26 17.050 -17.808 -1.628 1.00 0.00 C ATOM 382 CE LYS A 26 18.448 -18.069 -2.192 1.00 0.00 C ATOM 383 NZ LYS A 26 19.286 -18.881 -1.281 1.00 0.00 N ATOM 0 H LYS A 26 15.686 -14.270 -2.365 1.00 0.00 H new ATOM 0 HA LYS A 26 13.918 -15.820 -3.729 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.981 -16.026 -0.876 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.271 -17.353 -1.775 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.101 -17.191 -3.443 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.814 -15.880 -2.524 1.00 0.00 H new ATOM 0 HD2 LYS A 26 17.144 -17.448 -0.603 1.00 0.00 H new ATOM 0 HD3 LYS A 26 16.504 -18.751 -1.586 1.00 0.00 H new ATOM 0 HE2 LYS A 26 18.360 -18.580 -3.151 1.00 0.00 H new ATOM 0 HE3 LYS A 26 18.943 -17.117 -2.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 20.222 -19.029 -1.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 19.395 -18.384 -0.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.830 -19.802 -1.118 1.00 0.00 H new ATOM 397 N GLU A 27 12.527 -14.653 -0.955 1.00 0.00 N ATOM 398 CA GLU A 27 11.305 -14.337 -0.283 1.00 0.00 C ATOM 399 C GLU A 27 10.437 -13.268 -0.852 1.00 0.00 C ATOM 400 O GLU A 27 9.275 -13.507 -1.177 1.00 0.00 O ATOM 401 CB GLU A 27 11.594 -14.007 1.191 1.00 0.00 C ATOM 402 CG GLU A 27 12.200 -15.150 2.009 1.00 0.00 C ATOM 403 CD GLU A 27 12.827 -14.506 3.237 1.00 0.00 C ATOM 404 OE1 GLU A 27 13.992 -14.038 3.133 1.00 0.00 O ATOM 405 OE2 GLU A 27 12.221 -14.479 4.341 1.00 0.00 O ATOM 0 H GLU A 27 13.339 -14.364 -0.410 1.00 0.00 H new ATOM 0 HA GLU A 27 10.718 -15.245 -0.419 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.273 -13.155 1.229 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.664 -13.695 1.666 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.435 -15.872 2.295 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.947 -15.691 1.428 1.00 0.00 H new ATOM 412 N LEU A 28 11.067 -12.154 -1.263 1.00 0.00 N ATOM 413 CA LEU A 28 10.430 -10.993 -1.803 1.00 0.00 C ATOM 414 C LEU A 28 9.841 -11.293 -3.138 1.00 0.00 C ATOM 415 O LEU A 28 8.750 -10.876 -3.524 1.00 0.00 O ATOM 416 CB LEU A 28 11.472 -9.879 -2.001 1.00 0.00 C ATOM 417 CG LEU A 28 11.012 -8.552 -2.627 1.00 0.00 C ATOM 418 CD1 LEU A 28 10.117 -7.783 -1.641 1.00 0.00 C ATOM 419 CD2 LEU A 28 12.343 -7.839 -2.917 1.00 0.00 C ATOM 0 H LEU A 28 12.081 -12.058 -1.215 1.00 0.00 H new ATOM 0 HA LEU A 28 9.649 -10.683 -1.108 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.907 -9.654 -1.027 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.273 -10.280 -2.623 1.00 0.00 H new ATOM 0 HG LEU A 28 10.403 -8.657 -3.525 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.797 -6.845 -2.095 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.242 -8.385 -1.398 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.677 -7.573 -0.730 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.144 -6.868 -3.371 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.891 -7.699 -1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.939 -8.444 -3.601 1.00 0.00 H new ATOM 431 N GLY A 29 10.547 -12.202 -3.836 1.00 0.00 N ATOM 432 CA GLY A 29 10.228 -12.887 -5.050 1.00 0.00 C ATOM 433 C GLY A 29 9.082 -13.830 -4.921 1.00 0.00 C ATOM 434 O GLY A 29 8.304 -14.010 -5.856 1.00 0.00 O ATOM 0 H GLY A 29 11.465 -12.491 -3.498 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.998 -12.152 -5.822 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.105 -13.439 -5.387 1.00 0.00 H new ATOM 438 N THR A 30 8.983 -14.513 -3.767 1.00 0.00 N ATOM 439 CA THR A 30 8.029 -15.547 -3.510 1.00 0.00 C ATOM 440 C THR A 30 6.608 -15.101 -3.554 1.00 0.00 C ATOM 441 O THR A 30 5.692 -15.651 -4.163 1.00 0.00 O ATOM 442 CB THR A 30 8.270 -16.485 -2.365 1.00 0.00 C ATOM 443 OG1 THR A 30 9.510 -17.158 -2.518 1.00 0.00 O ATOM 444 CG2 THR A 30 7.196 -17.587 -2.346 1.00 0.00 C ATOM 0 H THR A 30 9.599 -14.335 -2.974 1.00 0.00 H new ATOM 0 HA THR A 30 8.227 -16.171 -4.382 1.00 0.00 H new ATOM 0 HB THR A 30 8.254 -15.886 -1.454 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.226 -16.500 -2.640 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.382 -18.262 -1.510 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.211 -17.133 -2.234 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.233 -18.148 -3.280 1.00 0.00 H new ATOM 452 N VAL A 31 6.344 -13.989 -2.844 1.00 0.00 N ATOM 453 CA VAL A 31 5.009 -13.481 -2.775 1.00 0.00 C ATOM 454 C VAL A 31 4.481 -12.960 -4.067 1.00 0.00 C ATOM 455 O VAL A 31 3.291 -13.018 -4.374 1.00 0.00 O ATOM 456 CB VAL A 31 4.970 -12.418 -1.718 1.00 0.00 C ATOM 457 CG1 VAL A 31 5.983 -11.276 -1.907 1.00 0.00 C ATOM 458 CG2 VAL A 31 3.537 -11.900 -1.511 1.00 0.00 C ATOM 0 H VAL A 31 7.039 -13.451 -2.327 1.00 0.00 H new ATOM 0 HA VAL A 31 4.353 -14.315 -2.525 1.00 0.00 H new ATOM 0 HB VAL A 31 5.297 -12.908 -0.801 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.878 -10.558 -1.094 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.994 -11.682 -1.903 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.796 -10.777 -2.858 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.536 -11.130 -0.739 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.164 -11.479 -2.444 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.893 -12.724 -1.202 1.00 0.00 H new ATOM 468 N MET A 32 5.353 -12.482 -4.972 1.00 0.00 N ATOM 469 CA MET A 32 5.004 -12.179 -6.326 1.00 0.00 C ATOM 470 C MET A 32 4.542 -13.387 -7.065 1.00 0.00 C ATOM 471 O MET A 32 3.477 -13.358 -7.680 1.00 0.00 O ATOM 472 CB MET A 32 6.126 -11.489 -7.120 1.00 0.00 C ATOM 473 CG MET A 32 6.703 -10.268 -6.400 1.00 0.00 C ATOM 474 SD MET A 32 5.406 -9.287 -5.587 1.00 0.00 S ATOM 475 CE MET A 32 6.716 -8.320 -4.783 1.00 0.00 C ATOM 0 H MET A 32 6.333 -12.300 -4.755 1.00 0.00 H new ATOM 0 HA MET A 32 4.182 -11.468 -6.244 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.926 -12.206 -7.306 1.00 0.00 H new ATOM 0 HB3 MET A 32 5.740 -11.182 -8.092 1.00 0.00 H new ATOM 0 HG2 MET A 32 7.431 -10.595 -5.657 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.237 -9.643 -7.116 1.00 0.00 H new ATOM 0 HE1 MET A 32 6.291 -7.405 -4.370 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.162 -8.908 -3.981 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.482 -8.066 -5.515 1.00 0.00 H new ATOM 485 N ARG A 33 5.256 -14.526 -7.030 1.00 0.00 N ATOM 486 CA ARG A 33 4.905 -15.750 -7.681 1.00 0.00 C ATOM 487 C ARG A 33 3.643 -16.371 -7.189 1.00 0.00 C ATOM 488 O ARG A 33 2.829 -16.942 -7.912 1.00 0.00 O ATOM 489 CB ARG A 33 6.086 -16.715 -7.480 1.00 0.00 C ATOM 490 CG ARG A 33 6.128 -17.905 -8.441 1.00 0.00 C ATOM 491 CD ARG A 33 6.487 -17.566 -9.890 1.00 0.00 C ATOM 492 NE ARG A 33 7.863 -17.041 -10.115 1.00 0.00 N ATOM 493 CZ ARG A 33 8.551 -17.230 -11.278 1.00 0.00 C ATOM 494 NH1 ARG A 33 7.977 -17.804 -12.376 1.00 0.00 N ATOM 495 NH2 ARG A 33 9.878 -16.934 -11.396 1.00 0.00 N ATOM 0 H ARG A 33 6.133 -14.596 -6.515 1.00 0.00 H new ATOM 0 HA ARG A 33 4.714 -15.534 -8.732 1.00 0.00 H new ATOM 0 HB2 ARG A 33 7.014 -16.153 -7.582 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.054 -17.095 -6.459 1.00 0.00 H new ATOM 0 HG2 ARG A 33 6.851 -18.629 -8.065 1.00 0.00 H new ATOM 0 HG3 ARG A 33 5.154 -18.393 -8.431 1.00 0.00 H new ATOM 0 HD2 ARG A 33 6.358 -18.463 -10.495 1.00 0.00 H new ATOM 0 HD3 ARG A 33 5.773 -16.829 -10.258 1.00 0.00 H new ATOM 0 HE ARG A 33 8.312 -16.516 -9.365 1.00 0.00 H new ATOM 0 HH11 ARG A 33 7.004 -18.107 -12.343 1.00 0.00 H new ATOM 0 HH12 ARG A 33 8.522 -17.930 -13.229 1.00 0.00 H new ATOM 0 HH21 ARG A 33 10.390 -16.558 -10.598 1.00 0.00 H new ATOM 0 HH22 ARG A 33 10.358 -17.089 -12.282 1.00 0.00 H new ATOM 509 N SER A 34 3.520 -16.438 -5.851 1.00 0.00 N ATOM 510 CA SER A 34 2.361 -16.909 -5.158 1.00 0.00 C ATOM 511 C SER A 34 1.066 -16.292 -5.562 1.00 0.00 C ATOM 512 O SER A 34 -0.018 -16.863 -5.669 1.00 0.00 O ATOM 513 CB SER A 34 2.545 -16.665 -3.651 1.00 0.00 C ATOM 514 OG SER A 34 1.602 -17.358 -2.847 1.00 0.00 O ATOM 0 H SER A 34 4.268 -16.149 -5.221 1.00 0.00 H new ATOM 0 HA SER A 34 2.290 -17.964 -5.421 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.551 -16.969 -3.362 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.465 -15.596 -3.451 1.00 0.00 H new ATOM 0 HG SER A 34 0.880 -16.747 -2.590 1.00 0.00 H new ATOM 520 N LEU A 35 1.107 -15.012 -5.974 1.00 0.00 N ATOM 521 CA LEU A 35 0.049 -14.326 -6.647 1.00 0.00 C ATOM 522 C LEU A 35 0.000 -14.823 -8.051 1.00 0.00 C ATOM 523 O LEU A 35 -1.014 -15.426 -8.401 1.00 0.00 O ATOM 524 CB LEU A 35 0.173 -12.794 -6.584 1.00 0.00 C ATOM 525 CG LEU A 35 0.075 -12.160 -5.186 1.00 0.00 C ATOM 526 CD1 LEU A 35 0.531 -10.692 -5.173 1.00 0.00 C ATOM 527 CD2 LEU A 35 -1.424 -12.140 -4.844 1.00 0.00 C ATOM 0 H LEU A 35 1.927 -14.423 -5.828 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.888 -14.543 -6.135 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.130 -12.510 -7.022 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.606 -12.361 -7.211 1.00 0.00 H new ATOM 0 HG LEU A 35 0.701 -12.726 -4.496 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.442 -10.292 -4.163 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.570 -10.631 -5.497 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.095 -10.111 -5.850 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.566 -11.699 -3.857 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.959 -11.548 -5.587 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.811 -13.159 -4.845 1.00 0.00 H new ATOM 539 N GLY A 36 1.109 -14.675 -8.796 1.00 0.00 N ATOM 540 CA GLY A 36 1.153 -15.043 -10.177 1.00 0.00 C ATOM 541 C GLY A 36 1.780 -13.970 -10.999 1.00 0.00 C ATOM 542 O GLY A 36 1.324 -13.635 -12.091 1.00 0.00 O ATOM 0 H GLY A 36 1.985 -14.296 -8.437 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.716 -15.969 -10.292 1.00 0.00 H new ATOM 0 HA3 GLY A 36 0.143 -15.238 -10.537 1.00 0.00 H new ATOM 546 N GLN A 37 2.894 -13.423 -10.480 1.00 0.00 N ATOM 547 CA GLN A 37 3.563 -12.374 -11.185 1.00 0.00 C ATOM 548 C GLN A 37 4.960 -12.879 -11.066 1.00 0.00 C ATOM 549 O GLN A 37 5.264 -13.645 -10.153 1.00 0.00 O ATOM 550 CB GLN A 37 3.327 -10.981 -10.577 1.00 0.00 C ATOM 551 CG GLN A 37 1.850 -10.588 -10.502 1.00 0.00 C ATOM 552 CD GLN A 37 1.719 -9.164 -9.981 1.00 0.00 C ATOM 553 OE1 GLN A 37 2.451 -8.855 -9.043 1.00 0.00 O ATOM 554 NE2 GLN A 37 0.802 -8.324 -10.532 1.00 0.00 N ATOM 0 H GLN A 37 3.323 -13.697 -9.596 1.00 0.00 H new ATOM 0 HA GLN A 37 3.229 -12.198 -12.208 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.753 -10.955 -9.574 1.00 0.00 H new ATOM 0 HB3 GLN A 37 3.862 -10.239 -11.170 1.00 0.00 H new ATOM 0 HG2 GLN A 37 1.393 -10.667 -11.488 1.00 0.00 H new ATOM 0 HG3 GLN A 37 1.315 -11.275 -9.847 1.00 0.00 H new ATOM 0 HE21 GLN A 37 0.223 -8.640 -11.310 1.00 0.00 H new ATOM 0 HE22 GLN A 37 0.693 -7.378 -10.167 1.00 0.00 H new ATOM 563 N ASN A 38 5.802 -12.816 -12.113 1.00 0.00 N ATOM 564 CA ASN A 38 7.010 -13.578 -12.197 1.00 0.00 C ATOM 565 C ASN A 38 8.199 -12.684 -12.278 1.00 0.00 C ATOM 566 O ASN A 38 8.461 -12.324 -13.424 1.00 0.00 O ATOM 567 CB ASN A 38 7.034 -14.374 -13.513 1.00 0.00 C ATOM 568 CG ASN A 38 6.008 -15.494 -13.614 1.00 0.00 C ATOM 569 OD1 ASN A 38 5.522 -15.955 -12.583 1.00 0.00 O ATOM 570 ND2 ASN A 38 5.503 -15.779 -14.844 1.00 0.00 N ATOM 0 H ASN A 38 5.639 -12.219 -12.924 1.00 0.00 H new ATOM 0 HA ASN A 38 7.042 -14.216 -11.314 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.875 -13.682 -14.340 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.028 -14.802 -13.642 1.00 0.00 H new ATOM 0 HD21 ASN A 38 4.694 -16.394 -14.933 1.00 0.00 H new ATOM 0 HD22 ASN A 38 5.933 -15.378 -15.677 1.00 0.00 H new ATOM 577 N PRO A 39 8.874 -12.205 -11.275 1.00 0.00 N ATOM 578 CA PRO A 39 9.655 -11.034 -11.548 1.00 0.00 C ATOM 579 C PRO A 39 10.928 -11.239 -12.294 1.00 0.00 C ATOM 580 O PRO A 39 11.529 -12.300 -12.131 1.00 0.00 O ATOM 581 CB PRO A 39 10.045 -10.444 -10.195 1.00 0.00 C ATOM 582 CG PRO A 39 8.944 -10.979 -9.266 1.00 0.00 C ATOM 583 CD PRO A 39 8.617 -12.362 -9.852 1.00 0.00 C ATOM 0 HA PRO A 39 9.031 -10.407 -12.184 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.036 -10.772 -9.880 1.00 0.00 H new ATOM 0 HB3 PRO A 39 10.062 -9.354 -10.218 1.00 0.00 H new ATOM 0 HG2 PRO A 39 9.290 -11.052 -8.235 1.00 0.00 H new ATOM 0 HG3 PRO A 39 8.070 -10.328 -9.264 1.00 0.00 H new ATOM 0 HD2 PRO A 39 9.244 -13.140 -9.416 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.581 -12.643 -9.661 1.00 0.00 H new ATOM 591 N THR A 40 11.301 -10.318 -13.200 1.00 0.00 N ATOM 592 CA THR A 40 12.610 -10.368 -13.775 1.00 0.00 C ATOM 593 C THR A 40 13.623 -10.057 -12.728 1.00 0.00 C ATOM 594 O THR A 40 13.315 -9.200 -11.902 1.00 0.00 O ATOM 595 CB THR A 40 12.728 -9.327 -14.848 1.00 0.00 C ATOM 596 OG1 THR A 40 11.874 -9.710 -15.917 1.00 0.00 O ATOM 597 CG2 THR A 40 14.121 -9.370 -15.499 1.00 0.00 C ATOM 0 H THR A 40 10.711 -9.554 -13.529 1.00 0.00 H new ATOM 0 HA THR A 40 12.776 -11.363 -14.188 1.00 0.00 H new ATOM 0 HB THR A 40 12.507 -8.359 -14.399 1.00 0.00 H new ATOM 0 HG1 THR A 40 11.929 -9.045 -16.634 1.00 0.00 H new ATOM 0 HG21 THR A 40 14.184 -8.606 -16.274 1.00 0.00 H new ATOM 0 HG22 THR A 40 14.882 -9.182 -14.742 1.00 0.00 H new ATOM 0 HG23 THR A 40 14.285 -10.352 -15.943 1.00 0.00 H new ATOM 605 N GLU A 41 14.721 -10.825 -12.612 1.00 0.00 N ATOM 606 CA GLU A 41 15.524 -10.887 -11.430 1.00 0.00 C ATOM 607 C GLU A 41 16.486 -9.753 -11.346 1.00 0.00 C ATOM 608 O GLU A 41 16.747 -9.158 -10.301 1.00 0.00 O ATOM 609 CB GLU A 41 16.207 -12.249 -11.213 1.00 0.00 C ATOM 610 CG GLU A 41 16.793 -12.367 -9.805 1.00 0.00 C ATOM 611 CD GLU A 41 17.058 -13.825 -9.458 1.00 0.00 C ATOM 612 OE1 GLU A 41 16.124 -14.668 -9.535 1.00 0.00 O ATOM 613 OE2 GLU A 41 18.201 -14.223 -9.109 1.00 0.00 O ATOM 0 H GLU A 41 15.061 -11.422 -13.365 1.00 0.00 H new ATOM 0 HA GLU A 41 14.826 -10.781 -10.599 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.485 -13.049 -11.375 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.999 -12.381 -11.950 1.00 0.00 H new ATOM 0 HG2 GLU A 41 17.720 -11.798 -9.742 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.103 -11.934 -9.080 1.00 0.00 H new ATOM 620 N ALA A 42 16.917 -9.295 -12.535 1.00 0.00 N ATOM 621 CA ALA A 42 17.629 -8.063 -12.682 1.00 0.00 C ATOM 622 C ALA A 42 16.976 -6.831 -12.157 1.00 0.00 C ATOM 623 O ALA A 42 17.609 -6.034 -11.467 1.00 0.00 O ATOM 624 CB ALA A 42 17.933 -7.823 -14.171 1.00 0.00 C ATOM 0 H ALA A 42 16.768 -9.791 -13.413 1.00 0.00 H new ATOM 0 HA ALA A 42 18.516 -8.209 -12.066 1.00 0.00 H new ATOM 0 HB1 ALA A 42 18.476 -6.885 -14.285 1.00 0.00 H new ATOM 0 HB2 ALA A 42 18.541 -8.642 -14.555 1.00 0.00 H new ATOM 0 HB3 ALA A 42 16.998 -7.772 -14.730 1.00 0.00 H new ATOM 630 N GLU A 43 15.668 -6.753 -12.459 1.00 0.00 N ATOM 631 CA GLU A 43 14.789 -5.694 -12.069 1.00 0.00 C ATOM 632 C GLU A 43 14.514 -5.883 -10.616 1.00 0.00 C ATOM 633 O GLU A 43 14.319 -4.861 -9.959 1.00 0.00 O ATOM 634 CB GLU A 43 13.594 -5.554 -13.027 1.00 0.00 C ATOM 635 CG GLU A 43 14.090 -5.290 -14.450 1.00 0.00 C ATOM 636 CD GLU A 43 12.997 -5.152 -15.500 1.00 0.00 C ATOM 637 OE1 GLU A 43 11.839 -4.780 -15.171 1.00 0.00 O ATOM 638 OE2 GLU A 43 13.319 -5.205 -16.717 1.00 0.00 O ATOM 0 H GLU A 43 15.196 -7.472 -13.008 1.00 0.00 H new ATOM 0 HA GLU A 43 15.232 -4.703 -12.170 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.992 -6.463 -13.006 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.950 -4.738 -12.701 1.00 0.00 H new ATOM 0 HG2 GLU A 43 14.686 -4.378 -14.447 1.00 0.00 H new ATOM 0 HG3 GLU A 43 14.754 -6.103 -14.744 1.00 0.00 H new ATOM 645 N LEU A 44 14.384 -7.097 -10.054 1.00 0.00 N ATOM 646 CA LEU A 44 14.147 -7.302 -8.659 1.00 0.00 C ATOM 647 C LEU A 44 15.250 -6.901 -7.741 1.00 0.00 C ATOM 648 O LEU A 44 14.986 -6.287 -6.709 1.00 0.00 O ATOM 649 CB LEU A 44 13.803 -8.768 -8.348 1.00 0.00 C ATOM 650 CG LEU A 44 13.473 -9.238 -6.921 1.00 0.00 C ATOM 651 CD1 LEU A 44 11.973 -9.084 -6.619 1.00 0.00 C ATOM 652 CD2 LEU A 44 13.843 -10.727 -6.815 1.00 0.00 C ATOM 0 H LEU A 44 14.446 -7.964 -10.587 1.00 0.00 H new ATOM 0 HA LEU A 44 13.306 -6.636 -8.465 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.949 -9.031 -8.972 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.645 -9.369 -8.691 1.00 0.00 H new ATOM 0 HG LEU A 44 14.033 -8.633 -6.208 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.770 -9.424 -5.604 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.688 -8.036 -6.715 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.397 -9.683 -7.324 1.00 0.00 H new ATOM 0 HD21 LEU A 44 13.619 -11.087 -5.811 1.00 0.00 H new ATOM 0 HD22 LEU A 44 13.266 -11.298 -7.542 1.00 0.00 H new ATOM 0 HD23 LEU A 44 14.907 -10.853 -7.016 1.00 0.00 H new ATOM 664 N GLN A 45 16.486 -7.044 -8.252 1.00 0.00 N ATOM 665 CA GLN A 45 17.659 -6.603 -7.563 1.00 0.00 C ATOM 666 C GLN A 45 17.812 -5.124 -7.659 1.00 0.00 C ATOM 667 O GLN A 45 18.110 -4.564 -6.606 1.00 0.00 O ATOM 668 CB GLN A 45 18.926 -7.317 -8.064 1.00 0.00 C ATOM 669 CG GLN A 45 18.812 -8.777 -7.623 1.00 0.00 C ATOM 670 CD GLN A 45 20.154 -9.488 -7.727 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.522 -10.062 -8.751 1.00 0.00 O ATOM 672 NE2 GLN A 45 20.966 -9.411 -6.639 1.00 0.00 N ATOM 0 H GLN A 45 16.674 -7.473 -9.158 1.00 0.00 H new ATOM 0 HA GLN A 45 17.531 -6.868 -6.513 1.00 0.00 H new ATOM 0 HB2 GLN A 45 19.007 -7.246 -9.149 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.821 -6.855 -7.647 1.00 0.00 H new ATOM 0 HG2 GLN A 45 18.452 -8.822 -6.595 1.00 0.00 H new ATOM 0 HG3 GLN A 45 18.076 -9.291 -8.242 1.00 0.00 H new ATOM 0 HE21 GLN A 45 20.647 -8.932 -5.797 1.00 0.00 H new ATOM 0 HE22 GLN A 45 21.894 -9.833 -6.665 1.00 0.00 H new ATOM 681 N ASP A 46 17.537 -4.469 -8.801 1.00 0.00 N ATOM 682 CA ASP A 46 17.442 -3.045 -8.898 1.00 0.00 C ATOM 683 C ASP A 46 16.480 -2.389 -7.968 1.00 0.00 C ATOM 684 O ASP A 46 16.719 -1.314 -7.421 1.00 0.00 O ATOM 685 CB ASP A 46 17.244 -2.842 -10.409 1.00 0.00 C ATOM 686 CG ASP A 46 17.660 -1.458 -10.889 1.00 0.00 C ATOM 687 OD1 ASP A 46 18.870 -1.127 -10.765 1.00 0.00 O ATOM 688 OD2 ASP A 46 16.827 -0.696 -11.447 1.00 0.00 O ATOM 0 H ASP A 46 17.375 -4.947 -9.687 1.00 0.00 H new ATOM 0 HA ASP A 46 18.324 -2.518 -8.535 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.819 -3.594 -10.948 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.195 -3.005 -10.656 1.00 0.00 H new ATOM 693 N MET A 47 15.309 -3.013 -7.746 1.00 0.00 N ATOM 694 CA MET A 47 14.215 -2.638 -6.905 1.00 0.00 C ATOM 695 C MET A 47 14.580 -2.721 -5.463 1.00 0.00 C ATOM 696 O MET A 47 14.322 -1.814 -4.673 1.00 0.00 O ATOM 697 CB MET A 47 12.954 -3.480 -7.165 1.00 0.00 C ATOM 698 CG MET A 47 11.755 -3.055 -6.315 1.00 0.00 C ATOM 699 SD MET A 47 11.297 -4.244 -5.018 1.00 0.00 S ATOM 700 CE MET A 47 10.572 -5.569 -6.026 1.00 0.00 C ATOM 0 H MET A 47 15.109 -3.894 -8.220 1.00 0.00 H new ATOM 0 HA MET A 47 13.987 -1.602 -7.157 1.00 0.00 H new ATOM 0 HB2 MET A 47 12.687 -3.406 -8.219 1.00 0.00 H new ATOM 0 HB3 MET A 47 13.178 -4.528 -6.966 1.00 0.00 H new ATOM 0 HG2 MET A 47 11.977 -2.095 -5.849 1.00 0.00 H new ATOM 0 HG3 MET A 47 10.897 -2.901 -6.969 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.501 -6.480 -5.432 1.00 0.00 H new ATOM 0 HE2 MET A 47 9.576 -5.272 -6.356 1.00 0.00 H new ATOM 0 HE3 MET A 47 11.203 -5.751 -6.896 1.00 0.00 H new ATOM 710 N ILE A 48 15.305 -3.795 -5.104 1.00 0.00 N ATOM 711 CA ILE A 48 16.012 -3.956 -3.871 1.00 0.00 C ATOM 712 C ILE A 48 16.992 -2.841 -3.744 1.00 0.00 C ATOM 713 O ILE A 48 17.010 -2.105 -2.759 1.00 0.00 O ATOM 714 CB ILE A 48 16.647 -5.298 -3.657 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.573 -6.390 -3.515 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.568 -5.362 -2.427 1.00 0.00 C ATOM 717 CD1 ILE A 48 16.203 -7.768 -3.321 1.00 0.00 C ATOM 0 H ILE A 48 15.404 -4.605 -5.716 1.00 0.00 H new ATOM 0 HA ILE A 48 15.272 -3.913 -3.072 1.00 0.00 H new ATOM 0 HB ILE A 48 17.263 -5.467 -4.540 1.00 0.00 H new ATOM 0 HG12 ILE A 48 14.928 -6.160 -2.667 1.00 0.00 H new ATOM 0 HG13 ILE A 48 14.941 -6.399 -4.403 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.989 -6.364 -2.340 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.375 -4.638 -2.538 1.00 0.00 H new ATOM 0 HG23 ILE A 48 16.994 -5.130 -1.530 1.00 0.00 H new ATOM 0 HD11 ILE A 48 15.417 -8.517 -3.224 1.00 0.00 H new ATOM 0 HD12 ILE A 48 16.828 -8.007 -4.182 1.00 0.00 H new ATOM 0 HD13 ILE A 48 16.814 -7.765 -2.419 1.00 0.00 H new ATOM 729 N ASN A 49 17.930 -2.561 -4.666 1.00 0.00 N ATOM 730 CA ASN A 49 18.979 -1.602 -4.512 1.00 0.00 C ATOM 731 C ASN A 49 18.492 -0.196 -4.425 1.00 0.00 C ATOM 732 O ASN A 49 19.136 0.689 -3.863 1.00 0.00 O ATOM 733 CB ASN A 49 20.002 -1.602 -5.660 1.00 0.00 C ATOM 734 CG ASN A 49 20.867 -2.854 -5.665 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.069 -3.420 -4.592 1.00 0.00 O ATOM 736 ND2 ASN A 49 21.492 -3.167 -6.832 1.00 0.00 N ATOM 0 H ASN A 49 17.957 -3.031 -5.571 1.00 0.00 H new ATOM 0 HA ASN A 49 19.442 -1.922 -3.579 1.00 0.00 H new ATOM 0 HB2 ASN A 49 19.476 -1.523 -6.612 1.00 0.00 H new ATOM 0 HB3 ASN A 49 20.640 -0.723 -5.574 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.182 -3.918 -6.856 1.00 0.00 H new ATOM 0 HD22 ASN A 49 21.271 -2.651 -7.683 1.00 0.00 H new ATOM 743 N GLU A 50 17.319 0.137 -4.992 1.00 0.00 N ATOM 744 CA GLU A 50 16.739 1.438 -4.865 1.00 0.00 C ATOM 745 C GLU A 50 16.234 1.787 -3.508 1.00 0.00 C ATOM 746 O GLU A 50 16.362 2.959 -3.156 1.00 0.00 O ATOM 747 CB GLU A 50 15.690 1.438 -5.990 1.00 0.00 C ATOM 748 CG GLU A 50 15.239 2.855 -6.353 1.00 0.00 C ATOM 749 CD GLU A 50 14.128 2.754 -7.389 1.00 0.00 C ATOM 750 OE1 GLU A 50 14.251 2.224 -8.526 1.00 0.00 O ATOM 751 OE2 GLU A 50 13.033 3.266 -7.037 1.00 0.00 O ATOM 0 H GLU A 50 16.762 -0.510 -5.550 1.00 0.00 H new ATOM 0 HA GLU A 50 17.470 2.240 -4.973 1.00 0.00 H new ATOM 0 HB2 GLU A 50 16.105 0.952 -6.873 1.00 0.00 H new ATOM 0 HB3 GLU A 50 14.826 0.851 -5.680 1.00 0.00 H new ATOM 0 HG2 GLU A 50 14.884 3.379 -5.466 1.00 0.00 H new ATOM 0 HG3 GLU A 50 16.076 3.430 -6.749 1.00 0.00 H new ATOM 758 N VAL A 51 15.615 0.831 -2.792 1.00 0.00 N ATOM 759 CA VAL A 51 15.233 0.941 -1.418 1.00 0.00 C ATOM 760 C VAL A 51 16.344 0.823 -0.432 1.00 0.00 C ATOM 761 O VAL A 51 16.256 1.401 0.650 1.00 0.00 O ATOM 762 CB VAL A 51 14.251 -0.139 -1.076 1.00 0.00 C ATOM 763 CG1 VAL A 51 13.727 -0.255 0.366 1.00 0.00 C ATOM 764 CG2 VAL A 51 13.045 0.070 -2.008 1.00 0.00 C ATOM 0 H VAL A 51 15.367 -0.072 -3.197 1.00 0.00 H new ATOM 0 HA VAL A 51 14.822 1.947 -1.337 1.00 0.00 H new ATOM 0 HB VAL A 51 14.809 -1.067 -1.199 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.028 -1.088 0.433 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.563 -0.427 1.044 1.00 0.00 H new ATOM 0 HG13 VAL A 51 13.219 0.668 0.644 1.00 0.00 H new ATOM 0 HG21 VAL A 51 12.292 -0.691 -1.805 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.618 1.058 -1.835 1.00 0.00 H new ATOM 0 HG23 VAL A 51 13.369 -0.008 -3.046 1.00 0.00 H new ATOM 774 N ASP A 52 17.322 -0.074 -0.650 1.00 0.00 N ATOM 775 CA ASP A 52 18.458 -0.416 0.150 1.00 0.00 C ATOM 776 C ASP A 52 19.278 0.799 0.415 1.00 0.00 C ATOM 777 O ASP A 52 19.249 1.819 -0.272 1.00 0.00 O ATOM 778 CB ASP A 52 19.128 -1.589 -0.586 1.00 0.00 C ATOM 779 CG ASP A 52 20.360 -2.252 0.012 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.257 -3.163 0.876 1.00 0.00 O ATOM 781 OD2 ASP A 52 21.476 -1.942 -0.485 1.00 0.00 O ATOM 0 H ASP A 52 17.310 -0.632 -1.504 1.00 0.00 H new ATOM 0 HA ASP A 52 18.232 -0.759 1.160 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.373 -2.364 -0.717 1.00 0.00 H new ATOM 0 HB3 ASP A 52 19.399 -1.236 -1.581 1.00 0.00 H new ATOM 786 N ALA A 53 19.952 0.837 1.578 1.00 0.00 N ATOM 787 CA ALA A 53 20.868 1.839 2.027 1.00 0.00 C ATOM 788 C ALA A 53 22.240 1.260 1.987 1.00 0.00 C ATOM 789 O ALA A 53 23.175 1.774 1.375 1.00 0.00 O ATOM 790 CB ALA A 53 20.432 2.462 3.364 1.00 0.00 C ATOM 0 H ALA A 53 19.844 0.094 2.268 1.00 0.00 H new ATOM 0 HA ALA A 53 20.872 2.702 1.361 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.157 3.218 3.667 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.452 2.925 3.247 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.378 1.685 4.127 1.00 0.00 H new ATOM 796 N ASP A 54 22.436 0.196 2.787 1.00 0.00 N ATOM 797 CA ASP A 54 23.689 -0.404 3.128 1.00 0.00 C ATOM 798 C ASP A 54 24.475 -1.037 2.032 1.00 0.00 C ATOM 799 O ASP A 54 25.587 -0.573 1.786 1.00 0.00 O ATOM 800 CB ASP A 54 23.506 -1.384 4.299 1.00 0.00 C ATOM 801 CG ASP A 54 22.331 -2.333 4.111 1.00 0.00 C ATOM 802 OD1 ASP A 54 22.300 -3.070 3.090 1.00 0.00 O ATOM 803 OD2 ASP A 54 21.378 -2.395 4.933 1.00 0.00 O ATOM 0 H ASP A 54 21.652 -0.283 3.231 1.00 0.00 H new ATOM 0 HA ASP A 54 24.308 0.448 3.410 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.419 -1.967 4.422 1.00 0.00 H new ATOM 0 HB3 ASP A 54 23.363 -0.817 5.219 1.00 0.00 H new ATOM 808 N GLY A 55 23.948 -1.972 1.221 1.00 0.00 N ATOM 809 CA GLY A 55 24.606 -2.705 0.184 1.00 0.00 C ATOM 810 C GLY A 55 24.644 -4.166 0.473 1.00 0.00 C ATOM 811 O GLY A 55 25.328 -4.912 -0.226 1.00 0.00 O ATOM 0 H GLY A 55 22.967 -2.239 1.301 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.092 -2.536 -0.762 1.00 0.00 H new ATOM 0 HA3 GLY A 55 25.623 -2.332 0.065 1.00 0.00 H new ATOM 815 N ASN A 56 23.824 -4.608 1.443 1.00 0.00 N ATOM 816 CA ASN A 56 23.837 -5.994 1.795 1.00 0.00 C ATOM 817 C ASN A 56 23.114 -6.926 0.885 1.00 0.00 C ATOM 818 O ASN A 56 23.341 -8.135 0.865 1.00 0.00 O ATOM 819 CB ASN A 56 23.560 -6.367 3.261 1.00 0.00 C ATOM 820 CG ASN A 56 22.182 -6.026 3.811 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.367 -5.707 2.947 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.983 -6.100 5.154 1.00 0.00 N ATOM 0 H ASN A 56 23.171 -4.027 1.969 1.00 0.00 H new ATOM 0 HA ASN A 56 24.904 -6.154 1.643 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.713 -7.440 3.373 1.00 0.00 H new ATOM 0 HB3 ASN A 56 24.305 -5.872 3.883 1.00 0.00 H new ATOM 0 HD21 ASN A 56 21.069 -5.875 5.547 1.00 0.00 H new ATOM 0 HD22 ASN A 56 22.748 -6.380 5.768 1.00 0.00 H new ATOM 829 N GLY A 57 22.210 -6.388 0.047 1.00 0.00 N ATOM 830 CA GLY A 57 21.402 -7.075 -0.913 1.00 0.00 C ATOM 831 C GLY A 57 20.104 -7.576 -0.380 1.00 0.00 C ATOM 832 O GLY A 57 19.467 -8.350 -1.094 1.00 0.00 O ATOM 0 H GLY A 57 22.030 -5.384 0.042 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.203 -6.404 -1.749 1.00 0.00 H new ATOM 0 HA3 GLY A 57 21.968 -7.918 -1.309 1.00 0.00 H new ATOM 836 N THR A 58 19.626 -7.215 0.824 1.00 0.00 N ATOM 837 CA THR A 58 18.311 -7.496 1.310 1.00 0.00 C ATOM 838 C THR A 58 17.575 -6.232 1.597 1.00 0.00 C ATOM 839 O THR A 58 18.175 -5.263 2.058 1.00 0.00 O ATOM 840 CB THR A 58 18.328 -8.285 2.586 1.00 0.00 C ATOM 841 OG1 THR A 58 19.319 -7.867 3.513 1.00 0.00 O ATOM 842 CG2 THR A 58 18.730 -9.724 2.220 1.00 0.00 C ATOM 0 H THR A 58 20.191 -6.697 1.497 1.00 0.00 H new ATOM 0 HA THR A 58 17.823 -8.075 0.526 1.00 0.00 H new ATOM 0 HB THR A 58 17.344 -8.165 3.038 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.091 -6.978 3.857 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.755 -10.335 3.122 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.003 -10.138 1.521 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.717 -9.720 1.757 1.00 0.00 H new ATOM 850 N ILE A 59 16.230 -6.265 1.587 1.00 0.00 N ATOM 851 CA ILE A 59 15.491 -5.244 2.262 1.00 0.00 C ATOM 852 C ILE A 59 15.341 -5.522 3.719 1.00 0.00 C ATOM 853 O ILE A 59 14.800 -6.512 4.208 1.00 0.00 O ATOM 854 CB ILE A 59 14.116 -4.928 1.753 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.934 -5.104 0.236 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.876 -3.447 2.092 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.449 -5.140 -0.122 1.00 0.00 C ATOM 0 H ILE A 59 15.666 -6.978 1.125 1.00 0.00 H new ATOM 0 HA ILE A 59 16.119 -4.378 2.054 1.00 0.00 H new ATOM 0 HB ILE A 59 13.416 -5.623 2.218 1.00 0.00 H new ATOM 0 HG12 ILE A 59 14.422 -4.285 -0.293 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.416 -6.026 -0.090 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.886 -3.150 1.746 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.941 -3.306 3.171 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.631 -2.834 1.600 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.337 -5.265 -1.199 1.00 0.00 H new ATOM 0 HD12 ILE A 59 11.971 -5.974 0.392 1.00 0.00 H new ATOM 0 HD13 ILE A 59 11.978 -4.207 0.186 1.00 0.00 H new ATOM 869 N ASP A 60 15.937 -4.648 4.549 1.00 0.00 N ATOM 870 CA ASP A 60 16.079 -4.866 5.955 1.00 0.00 C ATOM 871 C ASP A 60 14.900 -4.193 6.570 1.00 0.00 C ATOM 872 O ASP A 60 14.138 -3.462 5.939 1.00 0.00 O ATOM 873 CB ASP A 60 17.383 -4.251 6.492 1.00 0.00 C ATOM 874 CG ASP A 60 18.639 -4.943 5.983 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.825 -5.094 4.746 1.00 0.00 O ATOM 876 OD2 ASP A 60 19.521 -5.285 6.815 1.00 0.00 O ATOM 0 H ASP A 60 16.332 -3.763 4.232 1.00 0.00 H new ATOM 0 HA ASP A 60 16.124 -5.929 6.190 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.420 -3.198 6.213 1.00 0.00 H new ATOM 0 HB3 ASP A 60 17.372 -4.292 7.581 1.00 0.00 H new ATOM 881 N PHE A 61 14.734 -4.271 7.902 1.00 0.00 N ATOM 882 CA PHE A 61 13.656 -3.708 8.656 1.00 0.00 C ATOM 883 C PHE A 61 13.635 -2.219 8.597 1.00 0.00 C ATOM 884 O PHE A 61 12.589 -1.618 8.356 1.00 0.00 O ATOM 885 CB PHE A 61 13.572 -4.399 10.027 1.00 0.00 C ATOM 886 CG PHE A 61 12.285 -4.055 10.695 1.00 0.00 C ATOM 887 CD1 PHE A 61 11.165 -4.727 10.265 1.00 0.00 C ATOM 888 CD2 PHE A 61 12.235 -3.175 11.750 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.924 -4.321 10.697 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.982 -2.843 12.208 1.00 0.00 C ATOM 891 CZ PHE A 61 9.825 -3.348 11.663 1.00 0.00 C ATOM 0 H PHE A 61 15.402 -4.764 8.495 1.00 0.00 H new ATOM 0 HA PHE A 61 12.692 -3.928 8.198 1.00 0.00 H new ATOM 0 HB2 PHE A 61 13.650 -5.479 9.904 1.00 0.00 H new ATOM 0 HB3 PHE A 61 14.410 -4.088 10.652 1.00 0.00 H new ATOM 0 HD1 PHE A 61 11.259 -5.567 9.593 1.00 0.00 H new ATOM 0 HD2 PHE A 61 13.131 -2.767 12.195 1.00 0.00 H new ATOM 0 HE1 PHE A 61 9.032 -4.764 10.280 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.903 -2.153 13.035 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.860 -2.988 11.987 1.00 0.00 H new ATOM 901 N PRO A 62 14.625 -1.449 8.939 1.00 0.00 N ATOM 902 CA PRO A 62 14.614 -0.024 8.778 1.00 0.00 C ATOM 903 C PRO A 62 14.505 0.534 7.400 1.00 0.00 C ATOM 904 O PRO A 62 14.024 1.644 7.176 1.00 0.00 O ATOM 905 CB PRO A 62 15.909 0.454 9.430 1.00 0.00 C ATOM 906 CG PRO A 62 16.372 -0.721 10.306 1.00 0.00 C ATOM 907 CD PRO A 62 15.961 -1.852 9.350 1.00 0.00 C ATOM 0 HA PRO A 62 13.691 0.337 9.232 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.659 0.706 8.680 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.742 1.350 10.028 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.442 -0.704 10.515 1.00 0.00 H new ATOM 0 HG3 PRO A 62 15.860 -0.766 11.267 1.00 0.00 H new ATOM 0 HD2 PRO A 62 16.640 -1.932 8.501 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.957 -2.822 9.847 1.00 0.00 H new ATOM 915 N GLU A 63 14.770 -0.336 6.409 1.00 0.00 N ATOM 916 CA GLU A 63 14.691 -0.003 5.021 1.00 0.00 C ATOM 917 C GLU A 63 13.281 -0.175 4.573 1.00 0.00 C ATOM 918 O GLU A 63 12.732 0.792 4.047 1.00 0.00 O ATOM 919 CB GLU A 63 15.597 -0.857 4.118 1.00 0.00 C ATOM 920 CG GLU A 63 17.039 -0.354 4.030 1.00 0.00 C ATOM 921 CD GLU A 63 18.022 -1.415 3.555 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.731 -2.640 3.502 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.213 -1.113 3.274 1.00 0.00 O ATOM 0 H GLU A 63 15.048 -1.302 6.579 1.00 0.00 H new ATOM 0 HA GLU A 63 15.036 1.027 4.926 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.602 -1.881 4.491 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.171 -0.885 3.115 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.078 0.497 3.350 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.351 0.006 5.010 1.00 0.00 H new ATOM 930 N PHE A 64 12.657 -1.319 4.908 1.00 0.00 N ATOM 931 CA PHE A 64 11.283 -1.678 4.745 1.00 0.00 C ATOM 932 C PHE A 64 10.421 -0.654 5.402 1.00 0.00 C ATOM 933 O PHE A 64 9.504 -0.119 4.781 1.00 0.00 O ATOM 934 CB PHE A 64 11.046 -3.079 5.333 1.00 0.00 C ATOM 935 CG PHE A 64 9.618 -3.498 5.256 1.00 0.00 C ATOM 936 CD1 PHE A 64 9.135 -4.223 4.192 1.00 0.00 C ATOM 937 CD2 PHE A 64 8.875 -3.373 6.407 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.872 -4.766 4.164 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.614 -3.918 6.446 1.00 0.00 C ATOM 940 CZ PHE A 64 7.174 -4.602 5.337 1.00 0.00 C ATOM 0 H PHE A 64 13.181 -2.078 5.344 1.00 0.00 H new ATOM 0 HA PHE A 64 11.024 -1.708 3.687 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.662 -3.802 4.799 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.369 -3.092 6.374 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.778 -4.373 3.338 1.00 0.00 H new ATOM 0 HD2 PHE A 64 9.276 -2.855 7.266 1.00 0.00 H new ATOM 0 HE1 PHE A 64 7.466 -5.274 3.301 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.988 -3.812 7.320 1.00 0.00 H new ATOM 0 HZ PHE A 64 6.193 -5.050 5.393 1.00 0.00 H new ATOM 950 N LEU A 65 10.641 -0.260 6.668 1.00 0.00 N ATOM 951 CA LEU A 65 9.918 0.774 7.344 1.00 0.00 C ATOM 952 C LEU A 65 9.906 2.052 6.579 1.00 0.00 C ATOM 953 O LEU A 65 8.831 2.636 6.442 1.00 0.00 O ATOM 954 CB LEU A 65 10.362 1.039 8.792 1.00 0.00 C ATOM 955 CG LEU A 65 9.902 0.024 9.852 1.00 0.00 C ATOM 956 CD1 LEU A 65 10.540 0.453 11.184 1.00 0.00 C ATOM 957 CD2 LEU A 65 8.380 -0.112 10.030 1.00 0.00 C ATOM 0 H LEU A 65 11.361 -0.685 7.252 1.00 0.00 H new ATOM 0 HA LEU A 65 8.905 0.377 7.401 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.451 1.082 8.812 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.999 2.024 9.084 1.00 0.00 H new ATOM 0 HG LEU A 65 10.221 -0.962 9.513 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.241 -0.240 11.970 1.00 0.00 H new ATOM 0 HD12 LEU A 65 11.626 0.445 11.087 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.206 1.458 11.440 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.169 -0.853 10.801 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.961 0.850 10.326 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.931 -0.429 9.089 1.00 0.00 H new ATOM 969 N THR A 66 11.029 2.460 5.962 1.00 0.00 N ATOM 970 CA THR A 66 11.088 3.615 5.121 1.00 0.00 C ATOM 971 C THR A 66 10.353 3.324 3.858 1.00 0.00 C ATOM 972 O THR A 66 9.639 4.227 3.425 1.00 0.00 O ATOM 973 CB THR A 66 12.456 4.070 4.707 1.00 0.00 C ATOM 974 OG1 THR A 66 13.230 4.430 5.842 1.00 0.00 O ATOM 975 CG2 THR A 66 12.662 5.329 3.848 1.00 0.00 C ATOM 0 H THR A 66 11.921 1.973 6.050 1.00 0.00 H new ATOM 0 HA THR A 66 10.659 4.411 5.730 1.00 0.00 H new ATOM 0 HB THR A 66 12.722 3.193 4.117 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.515 3.620 6.314 1.00 0.00 H new ATOM 0 HG21 THR A 66 13.727 5.475 3.665 1.00 0.00 H new ATOM 0 HG22 THR A 66 12.144 5.209 2.897 1.00 0.00 H new ATOM 0 HG23 THR A 66 12.262 6.197 4.372 1.00 0.00 H new ATOM 983 N MET A 67 10.429 2.155 3.195 1.00 0.00 N ATOM 984 CA MET A 67 9.753 1.750 2.002 1.00 0.00 C ATOM 985 C MET A 67 8.272 1.839 2.137 1.00 0.00 C ATOM 986 O MET A 67 7.615 2.205 1.164 1.00 0.00 O ATOM 987 CB MET A 67 10.189 0.302 1.716 1.00 0.00 C ATOM 988 CG MET A 67 10.011 -0.069 0.243 1.00 0.00 C ATOM 989 SD MET A 67 10.172 -1.864 -0.002 1.00 0.00 S ATOM 990 CE MET A 67 8.726 -2.657 0.759 1.00 0.00 C ATOM 0 H MET A 67 11.036 1.411 3.539 1.00 0.00 H new ATOM 0 HA MET A 67 10.018 2.415 1.180 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.234 0.176 1.998 1.00 0.00 H new ATOM 0 HB3 MET A 67 9.607 -0.381 2.335 1.00 0.00 H new ATOM 0 HG2 MET A 67 9.032 0.262 -0.103 1.00 0.00 H new ATOM 0 HG3 MET A 67 10.755 0.452 -0.359 1.00 0.00 H new ATOM 0 HE1 MET A 67 8.747 -3.727 0.552 1.00 0.00 H new ATOM 0 HE2 MET A 67 8.747 -2.495 1.837 1.00 0.00 H new ATOM 0 HE3 MET A 67 7.815 -2.225 0.345 1.00 0.00 H new ATOM 1000 N MET A 68 7.728 1.342 3.263 1.00 0.00 N ATOM 1001 CA MET A 68 6.335 1.234 3.566 1.00 0.00 C ATOM 1002 C MET A 68 5.848 2.597 3.921 1.00 0.00 C ATOM 1003 O MET A 68 4.837 3.050 3.388 1.00 0.00 O ATOM 1004 CB MET A 68 5.933 0.386 4.785 1.00 0.00 C ATOM 1005 CG MET A 68 6.207 -1.118 4.734 1.00 0.00 C ATOM 1006 SD MET A 68 5.754 -2.046 3.238 1.00 0.00 S ATOM 1007 CE MET A 68 3.983 -2.148 3.627 1.00 0.00 C ATOM 0 H MET A 68 8.311 0.988 4.021 1.00 0.00 H new ATOM 0 HA MET A 68 5.916 0.758 2.679 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.447 0.790 5.657 1.00 0.00 H new ATOM 0 HB3 MET A 68 4.865 0.526 4.952 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.274 -1.264 4.901 1.00 0.00 H new ATOM 0 HG3 MET A 68 5.687 -1.576 5.575 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.488 -2.794 2.902 1.00 0.00 H new ATOM 0 HE2 MET A 68 3.853 -2.560 4.628 1.00 0.00 H new ATOM 0 HE3 MET A 68 3.543 -1.151 3.585 1.00 0.00 H new ATOM 1017 N ALA A 69 6.487 3.313 4.863 1.00 0.00 N ATOM 1018 CA ALA A 69 5.730 4.300 5.570 1.00 0.00 C ATOM 1019 C ALA A 69 5.711 5.626 4.890 1.00 0.00 C ATOM 1020 O ALA A 69 4.914 6.507 5.209 1.00 0.00 O ATOM 1021 CB ALA A 69 6.385 4.500 6.947 1.00 0.00 C ATOM 0 H ALA A 69 7.468 3.220 5.125 1.00 0.00 H new ATOM 0 HA ALA A 69 4.703 3.940 5.630 1.00 0.00 H new ATOM 0 HB1 ALA A 69 5.828 5.249 7.510 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.379 3.557 7.493 1.00 0.00 H new ATOM 0 HB3 ALA A 69 7.413 4.836 6.815 1.00 0.00 H new ATOM 1027 N ARG A 70 6.631 5.760 3.918 1.00 0.00 N ATOM 1028 CA ARG A 70 6.889 7.025 3.302 1.00 0.00 C ATOM 1029 C ARG A 70 5.774 7.526 2.450 1.00 0.00 C ATOM 1030 O ARG A 70 5.058 6.770 1.796 1.00 0.00 O ATOM 1031 CB ARG A 70 8.235 7.022 2.558 1.00 0.00 C ATOM 1032 CG ARG A 70 8.266 6.150 1.300 1.00 0.00 C ATOM 1033 CD ARG A 70 9.629 6.083 0.608 1.00 0.00 C ATOM 1034 NE ARG A 70 9.882 7.331 -0.166 1.00 0.00 N ATOM 1035 CZ ARG A 70 9.746 7.325 -1.524 1.00 0.00 C ATOM 1036 NH1 ARG A 70 9.082 6.343 -2.201 1.00 0.00 N ATOM 1037 NH2 ARG A 70 10.389 8.303 -2.226 1.00 0.00 N ATOM 0 H ARG A 70 7.197 4.992 3.558 1.00 0.00 H new ATOM 0 HA ARG A 70 6.959 7.744 4.119 1.00 0.00 H new ATOM 0 HB2 ARG A 70 8.484 8.046 2.280 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.012 6.679 3.241 1.00 0.00 H new ATOM 0 HG2 ARG A 70 7.958 5.139 1.566 1.00 0.00 H new ATOM 0 HG3 ARG A 70 7.531 6.531 0.591 1.00 0.00 H new ATOM 0 HD2 ARG A 70 10.414 5.943 1.351 1.00 0.00 H new ATOM 0 HD3 ARG A 70 9.663 5.221 -0.058 1.00 0.00 H new ATOM 0 HE ARG A 70 10.156 8.186 0.317 1.00 0.00 H new ATOM 0 HH11 ARG A 70 8.660 5.568 -1.690 1.00 0.00 H new ATOM 0 HH12 ARG A 70 9.008 6.385 -3.217 1.00 0.00 H new ATOM 0 HH21 ARG A 70 10.945 9.002 -1.734 1.00 0.00 H new ATOM 0 HH22 ARG A 70 10.313 8.335 -3.243 1.00 0.00 H new ATOM 1051 N LYS A 71 5.796 8.861 2.288 1.00 0.00 N ATOM 1052 CA LYS A 71 5.009 9.662 1.402 1.00 0.00 C ATOM 1053 C LYS A 71 5.654 9.761 0.062 1.00 0.00 C ATOM 1054 O LYS A 71 6.836 10.100 0.040 1.00 0.00 O ATOM 1055 CB LYS A 71 4.725 11.082 1.921 1.00 0.00 C ATOM 1056 CG LYS A 71 3.806 10.921 3.133 1.00 0.00 C ATOM 1057 CD LYS A 71 3.475 12.313 3.675 1.00 0.00 C ATOM 1058 CE LYS A 71 2.589 13.178 2.776 1.00 0.00 C ATOM 1059 NZ LYS A 71 1.213 12.644 2.676 1.00 0.00 N ATOM 0 H LYS A 71 6.434 9.437 2.837 1.00 0.00 H new ATOM 0 HA LYS A 71 4.051 9.147 1.333 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.650 11.586 2.199 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.250 11.690 1.151 1.00 0.00 H new ATOM 0 HG2 LYS A 71 2.893 10.397 2.850 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.293 10.321 3.901 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.982 12.200 4.640 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.409 12.845 3.855 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.556 14.194 3.169 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.029 13.235 1.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.646 13.259 2.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.241 11.684 2.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.783 12.613 3.622 1.00 0.00 H new ATOM 1073 N MET A 72 4.978 9.505 -1.073 1.00 0.00 N ATOM 1074 CA MET A 72 5.447 9.744 -2.402 1.00 0.00 C ATOM 1075 C MET A 72 4.726 10.991 -2.783 1.00 0.00 C ATOM 1076 O MET A 72 3.823 11.441 -2.081 1.00 0.00 O ATOM 1077 CB MET A 72 5.140 8.598 -3.381 1.00 0.00 C ATOM 1078 CG MET A 72 5.692 7.276 -2.845 1.00 0.00 C ATOM 1079 SD MET A 72 5.636 6.030 -4.168 1.00 0.00 S ATOM 1080 CE MET A 72 3.840 5.763 -4.146 1.00 0.00 C ATOM 0 H MET A 72 4.040 9.104 -1.059 1.00 0.00 H new ATOM 0 HA MET A 72 6.533 9.825 -2.442 1.00 0.00 H new ATOM 0 HB2 MET A 72 4.063 8.516 -3.529 1.00 0.00 H new ATOM 0 HB3 MET A 72 5.580 8.815 -4.354 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.716 7.409 -2.497 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.105 6.943 -1.989 1.00 0.00 H new ATOM 0 HE1 MET A 72 3.601 4.849 -4.690 1.00 0.00 H new ATOM 0 HE2 MET A 72 3.498 5.671 -3.115 1.00 0.00 H new ATOM 0 HE3 MET A 72 3.341 6.608 -4.620 1.00 0.00 H new ATOM 1090 N LYS A 73 5.093 11.525 -3.962 1.00 0.00 N ATOM 1091 CA LYS A 73 4.464 12.731 -4.405 1.00 0.00 C ATOM 1092 C LYS A 73 3.256 12.468 -5.236 1.00 0.00 C ATOM 1093 O LYS A 73 2.811 11.323 -5.302 1.00 0.00 O ATOM 1094 CB LYS A 73 5.469 13.566 -5.216 1.00 0.00 C ATOM 1095 CG LYS A 73 5.845 12.928 -6.555 1.00 0.00 C ATOM 1096 CD LYS A 73 7.071 13.555 -7.222 1.00 0.00 C ATOM 1097 CE LYS A 73 7.406 13.028 -8.619 1.00 0.00 C ATOM 1098 NZ LYS A 73 8.239 11.813 -8.479 1.00 0.00 N ATOM 0 H LYS A 73 5.799 11.139 -4.589 1.00 0.00 H new ATOM 0 HA LYS A 73 4.141 13.276 -3.518 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.046 14.554 -5.398 1.00 0.00 H new ATOM 0 HB3 LYS A 73 6.373 13.710 -4.624 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.033 11.866 -6.399 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.996 13.006 -7.234 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.916 14.632 -7.287 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.935 13.396 -6.576 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.491 12.799 -9.166 1.00 0.00 H new ATOM 0 HE3 LYS A 73 7.938 13.787 -9.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 8.874 11.731 -9.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 8.804 11.878 -7.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 7.625 10.975 -8.432 1.00 0.00 H new ATOM 1112 N ASP A 74 2.617 13.481 -5.849 1.00 0.00 N ATOM 1113 CA ASP A 74 1.275 13.429 -6.339 1.00 0.00 C ATOM 1114 C ASP A 74 1.108 12.429 -7.431 1.00 0.00 C ATOM 1115 O ASP A 74 0.126 11.696 -7.539 1.00 0.00 O ATOM 1116 CB ASP A 74 0.927 14.874 -6.734 1.00 0.00 C ATOM 1117 CG ASP A 74 0.659 15.655 -5.455 1.00 0.00 C ATOM 1118 OD1 ASP A 74 0.131 15.105 -4.452 1.00 0.00 O ATOM 1119 OD2 ASP A 74 1.193 16.796 -5.451 1.00 0.00 O ATOM 0 H ASP A 74 3.062 14.385 -6.011 1.00 0.00 H new ATOM 0 HA ASP A 74 0.574 13.073 -5.584 1.00 0.00 H new ATOM 0 HB2 ASP A 74 1.747 15.325 -7.292 1.00 0.00 H new ATOM 0 HB3 ASP A 74 0.052 14.892 -7.383 1.00 0.00 H new ATOM 1124 N THR A 75 2.086 12.381 -8.353 1.00 0.00 N ATOM 1125 CA THR A 75 2.078 11.600 -9.552 1.00 0.00 C ATOM 1126 C THR A 75 2.183 10.147 -9.239 1.00 0.00 C ATOM 1127 O THR A 75 1.409 9.346 -9.760 1.00 0.00 O ATOM 1128 CB THR A 75 3.107 11.935 -10.590 1.00 0.00 C ATOM 1129 OG1 THR A 75 4.446 11.817 -10.133 1.00 0.00 O ATOM 1130 CG2 THR A 75 2.877 13.332 -11.191 1.00 0.00 C ATOM 0 H THR A 75 2.942 12.926 -8.253 1.00 0.00 H new ATOM 0 HA THR A 75 1.119 11.859 -10.000 1.00 0.00 H new ATOM 0 HB THR A 75 2.973 11.184 -11.368 1.00 0.00 H new ATOM 0 HG1 THR A 75 5.061 12.048 -10.860 1.00 0.00 H new ATOM 0 HG21 THR A 75 3.643 13.537 -11.939 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.894 13.369 -11.660 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.931 14.081 -10.401 1.00 0.00 H new ATOM 1138 N ASP A 76 3.157 9.859 -8.358 1.00 0.00 N ATOM 1139 CA ASP A 76 3.452 8.550 -7.862 1.00 0.00 C ATOM 1140 C ASP A 76 2.431 7.831 -7.049 1.00 0.00 C ATOM 1141 O ASP A 76 2.280 6.615 -6.946 1.00 0.00 O ATOM 1142 CB ASP A 76 4.797 8.605 -7.120 1.00 0.00 C ATOM 1143 CG ASP A 76 5.984 8.981 -7.996 1.00 0.00 C ATOM 1144 OD1 ASP A 76 6.002 8.462 -9.144 1.00 0.00 O ATOM 1145 OD2 ASP A 76 6.831 9.794 -7.540 1.00 0.00 O ATOM 0 H ASP A 76 3.771 10.576 -7.972 1.00 0.00 H new ATOM 0 HA ASP A 76 3.474 7.933 -8.760 1.00 0.00 H new ATOM 0 HB2 ASP A 76 4.720 9.325 -6.306 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.989 7.632 -6.668 1.00 0.00 H new ATOM 1150 N SER A 77 1.662 8.736 -6.418 1.00 0.00 N ATOM 1151 CA SER A 77 0.644 8.365 -5.485 1.00 0.00 C ATOM 1152 C SER A 77 -0.625 8.044 -6.196 1.00 0.00 C ATOM 1153 O SER A 77 -1.507 7.339 -5.707 1.00 0.00 O ATOM 1154 CB SER A 77 0.381 9.424 -4.401 1.00 0.00 C ATOM 1155 OG SER A 77 1.508 9.563 -3.549 1.00 0.00 O ATOM 0 H SER A 77 1.748 9.743 -6.558 1.00 0.00 H new ATOM 0 HA SER A 77 1.020 7.480 -4.971 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.153 10.382 -4.869 1.00 0.00 H new ATOM 0 HB3 SER A 77 -0.492 9.141 -3.813 1.00 0.00 H new ATOM 0 HG SER A 77 2.158 10.169 -3.962 1.00 0.00 H new ATOM 1161 N GLU A 78 -0.759 8.667 -7.380 1.00 0.00 N ATOM 1162 CA GLU A 78 -1.893 8.492 -8.235 1.00 0.00 C ATOM 1163 C GLU A 78 -1.837 7.168 -8.917 1.00 0.00 C ATOM 1164 O GLU A 78 -2.695 6.292 -8.815 1.00 0.00 O ATOM 1165 CB GLU A 78 -2.053 9.612 -9.276 1.00 0.00 C ATOM 1166 CG GLU A 78 -3.266 9.355 -10.173 1.00 0.00 C ATOM 1167 CD GLU A 78 -3.393 10.479 -11.192 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -3.432 11.662 -10.762 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -3.603 10.249 -12.413 1.00 0.00 O ATOM 0 H GLU A 78 -0.061 9.310 -7.754 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.768 8.537 -7.587 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.167 10.571 -8.770 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.152 9.678 -9.886 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -3.158 8.398 -10.683 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -4.171 9.294 -9.569 1.00 0.00 H new ATOM 1176 N GLU A 79 -0.691 6.932 -9.579 1.00 0.00 N ATOM 1177 CA GLU A 79 -0.303 5.638 -10.048 1.00 0.00 C ATOM 1178 C GLU A 79 -0.218 4.476 -9.120 1.00 0.00 C ATOM 1179 O GLU A 79 -0.389 3.363 -9.614 1.00 0.00 O ATOM 1180 CB GLU A 79 1.021 5.793 -10.817 1.00 0.00 C ATOM 1181 CG GLU A 79 0.786 6.843 -11.904 1.00 0.00 C ATOM 1182 CD GLU A 79 1.795 6.650 -13.027 1.00 0.00 C ATOM 1183 OE1 GLU A 79 1.807 5.619 -13.752 1.00 0.00 O ATOM 1184 OE2 GLU A 79 2.583 7.600 -13.280 1.00 0.00 O ATOM 0 H GLU A 79 -0.013 7.663 -9.795 1.00 0.00 H new ATOM 0 HA GLU A 79 -1.162 5.338 -10.648 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.822 6.104 -10.147 1.00 0.00 H new ATOM 0 HB3 GLU A 79 1.325 4.843 -11.257 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -0.228 6.757 -12.294 1.00 0.00 H new ATOM 0 HG3 GLU A 79 0.882 7.844 -11.484 1.00 0.00 H new ATOM 1191 N GLU A 80 0.022 4.607 -7.803 1.00 0.00 N ATOM 1192 CA GLU A 80 0.009 3.633 -6.757 1.00 0.00 C ATOM 1193 C GLU A 80 -1.328 2.990 -6.619 1.00 0.00 C ATOM 1194 O GLU A 80 -1.359 1.764 -6.714 1.00 0.00 O ATOM 1195 CB GLU A 80 0.340 4.235 -5.381 1.00 0.00 C ATOM 1196 CG GLU A 80 0.098 3.413 -4.113 1.00 0.00 C ATOM 1197 CD GLU A 80 0.624 4.159 -2.895 1.00 0.00 C ATOM 1198 OE1 GLU A 80 0.264 5.364 -2.813 1.00 0.00 O ATOM 1199 OE2 GLU A 80 1.246 3.622 -1.940 1.00 0.00 O ATOM 0 H GLU A 80 0.257 5.525 -7.426 1.00 0.00 H new ATOM 0 HA GLU A 80 0.770 2.908 -7.046 1.00 0.00 H new ATOM 0 HB2 GLU A 80 1.394 4.512 -5.392 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.231 5.158 -5.284 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.968 3.217 -3.996 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.593 2.446 -4.198 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.382 3.820 -6.521 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.688 3.298 -6.264 1.00 0.00 C ATOM 1208 C ILE A 81 -4.169 2.465 -7.402 1.00 0.00 C ATOM 1209 O ILE A 81 -4.676 1.348 -7.317 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.683 4.408 -6.099 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -4.385 5.340 -4.912 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -6.071 3.775 -5.904 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -4.212 4.575 -3.600 1.00 0.00 C ATOM 0 H ILE A 81 -2.333 4.834 -6.618 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.609 2.702 -5.355 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.631 5.028 -6.994 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -3.479 5.910 -5.119 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -5.197 6.059 -4.806 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.816 4.562 -5.781 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.321 3.171 -6.776 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.061 3.143 -5.016 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.003 5.278 -2.794 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.127 4.026 -3.375 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -3.382 3.874 -3.694 1.00 0.00 H new ATOM 1225 N ARG A 82 -3.746 2.901 -8.602 1.00 0.00 N ATOM 1226 CA ARG A 82 -4.130 2.256 -9.819 1.00 0.00 C ATOM 1227 C ARG A 82 -3.615 0.861 -9.919 1.00 0.00 C ATOM 1228 O ARG A 82 -4.358 -0.098 -10.119 1.00 0.00 O ATOM 1229 CB ARG A 82 -3.525 3.090 -10.961 1.00 0.00 C ATOM 1230 CG ARG A 82 -4.173 2.886 -12.331 1.00 0.00 C ATOM 1231 CD ARG A 82 -3.395 1.883 -13.186 1.00 0.00 C ATOM 1232 NE ARG A 82 -4.114 1.809 -14.489 1.00 0.00 N ATOM 1233 CZ ARG A 82 -3.606 1.255 -15.628 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -2.395 0.627 -15.577 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -4.236 1.362 -16.834 1.00 0.00 N ATOM 0 H ARG A 82 -3.133 3.706 -8.729 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.217 2.194 -9.864 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.597 4.145 -10.696 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.464 2.853 -11.040 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.196 2.535 -12.200 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -4.228 3.842 -12.852 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -2.364 2.208 -13.327 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -3.358 0.906 -12.705 1.00 0.00 H new ATOM 0 HE ARG A 82 -5.055 2.201 -14.533 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -1.883 0.577 -14.696 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -2.002 0.208 -16.420 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -5.118 1.870 -16.906 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -3.825 0.934 -17.664 1.00 0.00 H new ATOM 1249 N GLU A 83 -2.303 0.643 -9.717 1.00 0.00 N ATOM 1250 CA GLU A 83 -1.694 -0.639 -9.895 1.00 0.00 C ATOM 1251 C GLU A 83 -2.080 -1.606 -8.829 1.00 0.00 C ATOM 1252 O GLU A 83 -2.278 -2.811 -8.979 1.00 0.00 O ATOM 1253 CB GLU A 83 -0.165 -0.532 -10.022 1.00 0.00 C ATOM 1254 CG GLU A 83 0.311 0.042 -11.358 1.00 0.00 C ATOM 1255 CD GLU A 83 -0.260 -0.710 -12.552 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -0.319 -1.967 -12.506 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -0.719 -0.045 -13.519 1.00 0.00 O ATOM 0 H GLU A 83 -1.652 1.372 -9.424 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.078 -1.033 -10.836 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.213 0.094 -9.214 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.270 -1.522 -9.888 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.023 1.091 -11.422 1.00 0.00 H new ATOM 0 HG3 GLU A 83 1.400 0.007 -11.398 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.319 -1.059 -7.624 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.832 -1.704 -6.456 1.00 0.00 C ATOM 1266 C ALA A 84 -4.137 -2.395 -6.659 1.00 0.00 C ATOM 1267 O ALA A 84 -4.291 -3.571 -6.336 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.839 -0.754 -5.246 1.00 0.00 C ATOM 0 H ALA A 84 -2.135 -0.070 -7.454 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.136 -2.512 -6.233 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.235 -1.277 -4.375 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.822 -0.422 -5.038 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.465 0.111 -5.466 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.078 -1.575 -7.160 1.00 0.00 N ATOM 1275 CA PHE A 85 -6.312 -2.038 -7.714 1.00 0.00 C ATOM 1276 C PHE A 85 -6.172 -3.213 -8.619 1.00 0.00 C ATOM 1277 O PHE A 85 -6.829 -4.247 -8.506 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.020 -0.766 -8.209 1.00 0.00 C ATOM 1279 CG PHE A 85 -8.483 -1.034 -8.299 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -9.055 -1.865 -9.233 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.288 -0.663 -7.248 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.416 -2.050 -9.285 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -10.657 -0.791 -7.251 1.00 0.00 C ATOM 1284 CZ PHE A 85 -11.195 -1.530 -8.278 1.00 0.00 C ATOM 0 H PHE A 85 -4.977 -0.560 -7.180 1.00 0.00 H new ATOM 0 HA PHE A 85 -6.973 -2.520 -6.993 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.829 0.062 -7.526 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -6.630 -0.472 -9.183 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.423 -2.382 -9.939 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.818 -0.247 -6.369 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -10.866 -2.594 -10.102 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.274 -0.337 -6.490 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.260 -1.707 -8.294 1.00 0.00 H new ATOM 1294 N ARG A 86 -5.275 -3.152 -9.620 1.00 0.00 N ATOM 1295 CA ARG A 86 -5.206 -4.147 -10.645 1.00 0.00 C ATOM 1296 C ARG A 86 -4.638 -5.465 -10.243 1.00 0.00 C ATOM 1297 O ARG A 86 -4.934 -6.474 -10.882 1.00 0.00 O ATOM 1298 CB ARG A 86 -4.426 -3.759 -11.912 1.00 0.00 C ATOM 1299 CG ARG A 86 -4.685 -2.339 -12.419 1.00 0.00 C ATOM 1300 CD ARG A 86 -4.271 -2.165 -13.882 1.00 0.00 C ATOM 1301 NE ARG A 86 -2.801 -2.391 -13.965 1.00 0.00 N ATOM 1302 CZ ARG A 86 -2.132 -2.846 -15.065 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -2.662 -2.959 -16.318 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -0.794 -3.024 -14.867 1.00 0.00 N ATOM 0 H ARG A 86 -4.589 -2.403 -9.719 1.00 0.00 H new ATOM 0 HA ARG A 86 -6.273 -4.228 -10.851 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.360 -3.869 -11.713 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -4.676 -4.464 -12.705 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -5.744 -2.104 -12.312 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.137 -1.628 -11.801 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.804 -2.873 -14.517 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.525 -1.166 -14.235 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.249 -2.189 -13.132 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.632 -2.693 -16.487 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -2.088 -3.310 -17.085 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.382 -2.820 -13.957 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.206 -3.361 -15.629 1.00 0.00 H new ATOM 1318 N VAL A 87 -3.868 -5.530 -9.143 1.00 0.00 N ATOM 1319 CA VAL A 87 -3.424 -6.732 -8.509 1.00 0.00 C ATOM 1320 C VAL A 87 -4.664 -7.421 -8.053 1.00 0.00 C ATOM 1321 O VAL A 87 -4.841 -8.616 -8.283 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.430 -6.583 -7.395 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.130 -7.987 -6.845 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.111 -5.877 -7.750 1.00 0.00 C ATOM 0 H VAL A 87 -3.535 -4.691 -8.667 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.848 -7.305 -9.235 1.00 0.00 H new ATOM 0 HB VAL A 87 -2.895 -5.924 -6.662 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.408 -7.913 -6.031 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.051 -8.437 -6.473 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -1.718 -8.609 -7.640 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.475 -5.829 -6.866 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.600 -6.434 -8.535 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.322 -4.867 -8.101 1.00 0.00 H new ATOM 1334 N PHE A 88 -5.584 -6.722 -7.364 1.00 0.00 N ATOM 1335 CA PHE A 88 -6.773 -7.251 -6.772 1.00 0.00 C ATOM 1336 C PHE A 88 -7.797 -7.649 -7.778 1.00 0.00 C ATOM 1337 O PHE A 88 -8.285 -8.778 -7.796 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.407 -6.236 -5.806 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.169 -6.492 -4.358 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.852 -7.503 -3.725 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.408 -5.642 -3.590 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -7.638 -7.775 -2.394 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.207 -5.868 -2.249 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.833 -6.939 -1.656 1.00 0.00 C ATOM 0 H PHE A 88 -5.489 -5.718 -7.211 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.459 -8.144 -6.232 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.027 -5.244 -6.049 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.483 -6.217 -5.982 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.567 -8.092 -4.281 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -5.957 -4.776 -4.052 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -8.098 -8.637 -1.933 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.569 -5.216 -1.671 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.691 -7.125 -0.602 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.146 -6.803 -8.765 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.163 -7.093 -9.728 1.00 0.00 C ATOM 1356 C ASP A 89 -8.668 -8.010 -10.793 1.00 0.00 C ATOM 1357 O ASP A 89 -7.665 -7.816 -11.479 1.00 0.00 O ATOM 1358 CB ASP A 89 -9.533 -5.709 -10.285 1.00 0.00 C ATOM 1359 CG ASP A 89 -10.830 -5.733 -11.083 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -11.569 -6.746 -10.964 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.218 -4.685 -11.666 1.00 0.00 O ATOM 0 H ASP A 89 -7.708 -5.891 -8.897 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.019 -7.613 -9.297 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -9.630 -5.002 -9.461 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.725 -5.348 -10.921 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.371 -9.136 -11.008 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.023 -10.234 -11.855 1.00 0.00 C ATOM 1368 C LYS A 90 -9.027 -9.901 -13.307 1.00 0.00 C ATOM 1369 O LYS A 90 -8.039 -9.866 -14.039 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.705 -11.587 -11.586 1.00 0.00 C ATOM 1371 CG LYS A 90 -9.214 -12.705 -12.508 1.00 0.00 C ATOM 1372 CD LYS A 90 -9.789 -14.090 -12.209 1.00 0.00 C ATOM 1373 CE LYS A 90 -9.261 -15.252 -13.054 1.00 0.00 C ATOM 1374 NZ LYS A 90 -7.805 -15.426 -12.855 1.00 0.00 N ATOM 0 H LYS A 90 -10.266 -9.290 -10.544 1.00 0.00 H new ATOM 0 HA LYS A 90 -7.992 -10.402 -11.545 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.528 -11.876 -10.550 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.782 -11.473 -11.706 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.459 -12.441 -13.537 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -8.127 -12.758 -12.443 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.598 -14.318 -11.160 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.871 -14.043 -12.333 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -9.782 -16.170 -12.784 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -9.469 -15.066 -14.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -7.486 -16.279 -13.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -7.302 -14.596 -13.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -7.603 -15.525 -11.840 1.00 0.00 H new ATOM 1388 N ASP A 91 -10.272 -9.569 -13.693 1.00 0.00 N ATOM 1389 CA ASP A 91 -10.549 -9.013 -14.981 1.00 0.00 C ATOM 1390 C ASP A 91 -10.044 -7.641 -15.267 1.00 0.00 C ATOM 1391 O ASP A 91 -9.080 -7.419 -15.996 1.00 0.00 O ATOM 1392 CB ASP A 91 -12.028 -9.248 -15.334 1.00 0.00 C ATOM 1393 CG ASP A 91 -12.987 -8.732 -14.271 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -12.648 -8.097 -13.237 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.199 -8.894 -14.575 1.00 0.00 O ATOM 0 H ASP A 91 -11.096 -9.688 -13.104 1.00 0.00 H new ATOM 0 HA ASP A 91 -9.923 -9.567 -15.681 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.250 -8.760 -16.283 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.195 -10.315 -15.478 1.00 0.00 H new ATOM 1400 N GLY A 92 -10.637 -6.641 -14.590 1.00 0.00 N ATOM 1401 CA GLY A 92 -10.306 -5.264 -14.790 1.00 0.00 C ATOM 1402 C GLY A 92 -11.537 -4.513 -15.165 1.00 0.00 C ATOM 1403 O GLY A 92 -11.641 -3.914 -16.234 1.00 0.00 O ATOM 0 H GLY A 92 -11.362 -6.792 -13.889 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -9.873 -4.846 -13.881 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -9.555 -5.168 -15.574 1.00 0.00 H new ATOM 1407 N ASN A 93 -12.562 -4.499 -14.294 1.00 0.00 N ATOM 1408 CA ASN A 93 -13.811 -3.822 -14.459 1.00 0.00 C ATOM 1409 C ASN A 93 -14.036 -2.706 -13.499 1.00 0.00 C ATOM 1410 O ASN A 93 -14.957 -1.918 -13.711 1.00 0.00 O ATOM 1411 CB ASN A 93 -14.958 -4.846 -14.498 1.00 0.00 C ATOM 1412 CG ASN A 93 -15.205 -5.769 -13.313 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -14.520 -5.864 -12.295 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -16.239 -6.636 -13.481 1.00 0.00 N ATOM 0 H ASN A 93 -12.512 -5.000 -13.407 1.00 0.00 H new ATOM 0 HA ASN A 93 -13.780 -3.311 -15.422 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -15.880 -4.291 -14.672 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -14.796 -5.478 -15.371 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -16.431 -7.344 -12.772 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -16.822 -6.579 -14.316 1.00 0.00 H new ATOM 1421 N GLY A 94 -13.279 -2.618 -12.391 1.00 0.00 N ATOM 1422 CA GLY A 94 -13.461 -1.587 -11.417 1.00 0.00 C ATOM 1423 C GLY A 94 -14.169 -2.122 -10.220 1.00 0.00 C ATOM 1424 O GLY A 94 -14.535 -1.361 -9.326 1.00 0.00 O ATOM 0 H GLY A 94 -12.529 -3.272 -12.168 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -12.493 -1.180 -11.123 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.034 -0.766 -11.849 1.00 0.00 H new ATOM 1428 N TYR A 95 -14.330 -3.455 -10.142 1.00 0.00 N ATOM 1429 CA TYR A 95 -14.973 -4.100 -9.040 1.00 0.00 C ATOM 1430 C TYR A 95 -14.265 -5.262 -8.432 1.00 0.00 C ATOM 1431 O TYR A 95 -14.085 -6.226 -9.175 1.00 0.00 O ATOM 1432 CB TYR A 95 -16.378 -4.644 -9.350 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.377 -3.549 -9.500 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -17.795 -2.834 -8.403 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -17.745 -3.115 -10.752 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -18.646 -1.766 -8.563 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -18.499 -1.989 -10.984 1.00 0.00 C ATOM 1438 CZ TYR A 95 -18.833 -1.299 -9.842 1.00 0.00 C ATOM 1439 OH TYR A 95 -19.511 -0.068 -9.970 1.00 0.00 O ATOM 0 H TYR A 95 -14.005 -4.100 -10.862 1.00 0.00 H new ATOM 0 HA TYR A 95 -14.987 -3.260 -8.345 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -16.345 -5.233 -10.266 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -16.692 -5.315 -8.550 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -17.455 -3.111 -7.416 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -17.422 -3.694 -11.605 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -19.146 -1.313 -7.720 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -18.801 -1.675 -11.972 1.00 0.00 H new ATOM 0 HH TYR A 95 -19.586 0.167 -10.918 1.00 0.00 H new ATOM 1449 N ILE A 96 -13.836 -5.126 -7.165 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.221 -6.259 -6.548 1.00 0.00 C ATOM 1451 C ILE A 96 -14.299 -6.937 -5.773 1.00 0.00 C ATOM 1452 O ILE A 96 -14.818 -6.470 -4.761 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.060 -5.887 -5.674 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.176 -4.689 -6.059 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.164 -7.125 -5.498 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -10.215 -4.151 -4.999 1.00 0.00 C ATOM 0 H ILE A 96 -13.907 -4.283 -6.595 1.00 0.00 H new ATOM 0 HA ILE A 96 -12.794 -6.919 -7.303 1.00 0.00 H new ATOM 0 HB ILE A 96 -12.546 -5.540 -4.762 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.589 -4.971 -6.933 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -11.830 -3.873 -6.365 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.314 -6.872 -4.864 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -11.738 -7.926 -5.032 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -10.804 -7.455 -6.472 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.657 -3.309 -5.408 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -10.781 -3.822 -4.128 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.521 -4.938 -4.705 1.00 0.00 H new ATOM 1468 N SER A 97 -14.665 -8.138 -6.255 1.00 0.00 N ATOM 1469 CA SER A 97 -15.635 -8.966 -5.609 1.00 0.00 C ATOM 1470 C SER A 97 -15.055 -9.680 -4.437 1.00 0.00 C ATOM 1471 O SER A 97 -13.847 -9.770 -4.223 1.00 0.00 O ATOM 1472 CB SER A 97 -16.334 -9.902 -6.610 1.00 0.00 C ATOM 1473 OG SER A 97 -15.446 -10.874 -7.142 1.00 0.00 O ATOM 0 H SER A 97 -14.280 -8.541 -7.109 1.00 0.00 H new ATOM 0 HA SER A 97 -16.415 -8.319 -5.207 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.166 -10.404 -6.116 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.755 -9.312 -7.424 1.00 0.00 H new ATOM 0 HG SER A 97 -14.857 -10.452 -7.802 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.913 -10.191 -3.537 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.551 -10.969 -2.393 1.00 0.00 C ATOM 1481 C ALA A 98 -14.750 -12.215 -2.547 1.00 0.00 C ATOM 1482 O ALA A 98 -13.921 -12.638 -1.742 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.844 -11.220 -1.599 1.00 0.00 C ATOM 0 H ALA A 98 -16.921 -10.052 -3.613 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.809 -10.361 -1.876 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -16.617 -11.813 -0.713 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.276 -10.266 -1.297 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.556 -11.759 -2.224 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.996 -12.890 -3.684 1.00 0.00 N ATOM 1490 CA ALA A 99 -14.218 -13.982 -4.181 1.00 0.00 C ATOM 1491 C ALA A 99 -12.865 -13.528 -4.611 1.00 0.00 C ATOM 1492 O ALA A 99 -11.887 -14.120 -4.157 1.00 0.00 O ATOM 1493 CB ALA A 99 -15.054 -14.604 -5.312 1.00 0.00 C ATOM 0 H ALA A 99 -15.783 -12.660 -4.291 1.00 0.00 H new ATOM 0 HA ALA A 99 -14.015 -14.732 -3.417 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.516 -15.450 -5.740 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -16.009 -14.946 -4.913 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.231 -13.858 -6.086 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.683 -12.446 -5.389 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.501 -11.757 -5.805 1.00 0.00 C ATOM 1501 C GLU A 100 -10.712 -11.357 -4.605 1.00 0.00 C ATOM 1502 O GLU A 100 -9.578 -11.780 -4.387 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.769 -10.557 -6.728 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.164 -11.034 -8.127 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.713 -9.927 -9.016 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.745 -9.320 -8.622 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.154 -9.683 -10.118 1.00 0.00 O ATOM 0 H GLU A 100 -13.502 -11.986 -5.786 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.922 -12.453 -6.413 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.564 -9.940 -6.310 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.878 -9.931 -6.789 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.293 -11.478 -8.610 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.913 -11.820 -8.036 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.298 -10.608 -3.654 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.701 -10.349 -2.381 1.00 0.00 C ATOM 1516 C LEU A 101 -10.244 -11.547 -1.621 1.00 0.00 C ATOM 1517 O LEU A 101 -9.100 -11.591 -1.171 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.772 -9.622 -1.551 1.00 0.00 C ATOM 1519 CG LEU A 101 -12.075 -8.178 -1.984 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -13.346 -7.697 -1.263 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -10.934 -7.200 -1.659 1.00 0.00 C ATOM 0 H LEU A 101 -12.212 -10.171 -3.774 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.793 -9.773 -2.560 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -12.696 -10.198 -1.597 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -11.454 -9.612 -0.508 1.00 0.00 H new ATOM 0 HG LEU A 101 -12.202 -8.189 -3.067 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -13.569 -6.673 -1.564 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -14.182 -8.344 -1.529 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -13.188 -7.732 -0.185 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.209 -6.198 -1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -10.757 -7.192 -0.584 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -10.027 -7.516 -2.174 1.00 0.00 H new ATOM 1533 N ARG A 102 -11.102 -12.574 -1.490 1.00 0.00 N ATOM 1534 CA ARG A 102 -10.742 -13.787 -0.823 1.00 0.00 C ATOM 1535 C ARG A 102 -9.595 -14.525 -1.424 1.00 0.00 C ATOM 1536 O ARG A 102 -8.631 -14.972 -0.805 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.950 -14.739 -0.840 1.00 0.00 C ATOM 1538 CG ARG A 102 -11.808 -15.998 0.017 1.00 0.00 C ATOM 1539 CD ARG A 102 -13.122 -16.716 0.334 1.00 0.00 C ATOM 1540 NE ARG A 102 -12.836 -17.986 1.059 1.00 0.00 N ATOM 1541 CZ ARG A 102 -13.691 -18.692 1.856 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -15.023 -18.408 1.950 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -13.217 -19.754 2.570 1.00 0.00 N ATOM 0 H ARG A 102 -12.056 -12.563 -1.851 1.00 0.00 H new ATOM 0 HA ARG A 102 -10.438 -13.484 0.179 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -12.829 -14.189 -0.504 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -12.138 -15.041 -1.870 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -11.145 -16.695 -0.495 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -11.323 -15.728 0.955 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -13.761 -16.075 0.941 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -13.665 -16.926 -0.588 1.00 0.00 H new ATOM 0 HE ARG A 102 -11.898 -18.371 0.948 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -15.420 -17.639 1.410 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -15.621 -18.965 2.560 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -12.233 -20.014 2.505 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.847 -20.288 3.168 1.00 0.00 H new ATOM 1557 N HIS A 103 -9.590 -14.814 -2.737 1.00 0.00 N ATOM 1558 CA HIS A 103 -8.553 -15.396 -3.531 1.00 0.00 C ATOM 1559 C HIS A 103 -7.260 -14.673 -3.372 1.00 0.00 C ATOM 1560 O HIS A 103 -6.213 -15.269 -3.122 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.963 -15.408 -5.014 1.00 0.00 C ATOM 1562 CG HIS A 103 -8.101 -16.230 -5.926 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -7.984 -17.594 -5.753 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -7.320 -15.910 -6.993 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -7.159 -18.039 -6.739 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -6.765 -17.055 -7.525 1.00 0.00 N ATOM 0 H HIS A 103 -10.413 -14.614 -3.306 1.00 0.00 H new ATOM 0 HA HIS A 103 -8.410 -16.419 -3.182 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.987 -15.775 -5.085 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -8.967 -14.381 -5.378 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -7.159 -14.910 -7.367 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -6.863 -19.070 -6.863 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -6.174 -17.126 -8.353 1.00 0.00 H new ATOM 1574 N VAL A 104 -7.287 -13.339 -3.545 1.00 0.00 N ATOM 1575 CA VAL A 104 -6.139 -12.487 -3.587 1.00 0.00 C ATOM 1576 C VAL A 104 -5.417 -12.462 -2.284 1.00 0.00 C ATOM 1577 O VAL A 104 -4.251 -12.842 -2.181 1.00 0.00 O ATOM 1578 CB VAL A 104 -6.531 -11.123 -4.071 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -5.444 -10.053 -3.873 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -6.820 -11.206 -5.580 1.00 0.00 C ATOM 0 H VAL A 104 -8.161 -12.826 -3.662 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.425 -12.894 -4.303 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.399 -10.825 -3.483 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.804 -9.095 -4.248 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.211 -9.963 -2.812 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -4.546 -10.342 -4.418 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -7.107 -10.222 -5.950 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -5.926 -11.544 -6.104 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.632 -11.911 -5.757 1.00 0.00 H new ATOM 1590 N MET A 105 -6.127 -12.121 -1.194 1.00 0.00 N ATOM 1591 CA MET A 105 -5.815 -12.203 0.200 1.00 0.00 C ATOM 1592 C MET A 105 -5.223 -13.533 0.522 1.00 0.00 C ATOM 1593 O MET A 105 -4.206 -13.623 1.207 1.00 0.00 O ATOM 1594 CB MET A 105 -7.014 -11.823 1.084 1.00 0.00 C ATOM 1595 CG MET A 105 -7.365 -10.334 1.071 1.00 0.00 C ATOM 1596 SD MET A 105 -8.742 -9.947 2.194 1.00 0.00 S ATOM 1597 CE MET A 105 -8.726 -8.179 1.779 1.00 0.00 C ATOM 0 H MET A 105 -7.061 -11.729 -1.316 1.00 0.00 H new ATOM 0 HA MET A 105 -5.054 -11.458 0.432 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.885 -12.391 0.757 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.803 -12.125 2.110 1.00 0.00 H new ATOM 0 HG2 MET A 105 -6.489 -9.753 1.358 1.00 0.00 H new ATOM 0 HG3 MET A 105 -7.629 -10.033 0.057 1.00 0.00 H new ATOM 0 HE1 MET A 105 -8.533 -7.596 2.679 1.00 0.00 H new ATOM 0 HE2 MET A 105 -7.943 -7.984 1.046 1.00 0.00 H new ATOM 0 HE3 MET A 105 -9.692 -7.894 1.362 1.00 0.00 H new ATOM 1607 N THR A 106 -5.830 -14.673 0.147 1.00 0.00 N ATOM 1608 CA THR A 106 -5.267 -15.967 0.375 1.00 0.00 C ATOM 1609 C THR A 106 -4.000 -16.257 -0.353 1.00 0.00 C ATOM 1610 O THR A 106 -3.001 -16.636 0.256 1.00 0.00 O ATOM 1611 CB THR A 106 -6.197 -17.074 -0.028 1.00 0.00 C ATOM 1612 OG1 THR A 106 -7.423 -16.926 0.672 1.00 0.00 O ATOM 1613 CG2 THR A 106 -5.661 -18.490 0.242 1.00 0.00 C ATOM 0 H THR A 106 -6.733 -14.696 -0.326 1.00 0.00 H new ATOM 0 HA THR A 106 -5.076 -15.935 1.448 1.00 0.00 H new ATOM 0 HB THR A 106 -6.317 -16.983 -1.108 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.024 -16.345 0.160 1.00 0.00 H new ATOM 0 HG21 THR A 106 -6.398 -19.226 -0.080 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.734 -18.640 -0.311 1.00 0.00 H new ATOM 0 HG23 THR A 106 -5.471 -18.610 1.309 1.00 0.00 H new ATOM 1621 N ASN A 107 -3.879 -15.914 -1.648 1.00 0.00 N ATOM 1622 CA ASN A 107 -2.681 -15.977 -2.426 1.00 0.00 C ATOM 1623 C ASN A 107 -1.546 -15.123 -1.975 1.00 0.00 C ATOM 1624 O ASN A 107 -0.395 -15.528 -2.129 1.00 0.00 O ATOM 1625 CB ASN A 107 -3.015 -15.585 -3.875 1.00 0.00 C ATOM 1626 CG ASN A 107 -3.884 -16.621 -4.572 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -4.284 -17.597 -3.939 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -4.223 -16.293 -5.848 1.00 0.00 N ATOM 0 H ASN A 107 -4.673 -15.569 -2.187 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.335 -17.005 -2.313 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.528 -14.623 -3.879 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.089 -15.455 -4.436 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.869 -16.884 -6.372 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.831 -15.457 -6.281 1.00 0.00 H new ATOM 1635 N LEU A 108 -1.804 -13.903 -1.472 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.939 -12.997 -0.782 1.00 0.00 C ATOM 1637 C LEU A 108 -0.283 -13.564 0.430 1.00 0.00 C ATOM 1638 O LEU A 108 0.944 -13.568 0.514 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.766 -11.778 -0.341 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.988 -10.655 0.365 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -0.114 -9.754 -0.523 1.00 0.00 C ATOM 1642 CD2 LEU A 108 -2.034 -9.718 0.991 1.00 0.00 C ATOM 0 H LEU A 108 -2.739 -13.506 -1.563 1.00 0.00 H new ATOM 0 HA LEU A 108 -0.142 -12.746 -1.482 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.254 -11.358 -1.220 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.555 -12.122 0.328 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.313 -11.163 1.053 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.380 -9.004 0.094 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.637 -10.360 -1.029 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.739 -9.258 -1.265 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -1.529 -8.901 1.506 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.674 -9.312 0.208 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -2.642 -10.276 1.704 1.00 0.00 H new ATOM 1654 N GLY A 109 -1.059 -14.017 1.430 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.548 -14.516 2.669 1.00 0.00 C ATOM 1656 C GLY A 109 -1.475 -15.161 3.641 1.00 0.00 C ATOM 1657 O GLY A 109 -0.988 -16.054 4.333 1.00 0.00 O ATOM 0 H GLY A 109 -2.077 -14.037 1.375 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.232 -15.240 2.432 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -0.065 -13.684 3.182 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.727 -14.708 3.830 1.00 0.00 N ATOM 1662 CA GLU A 110 -3.636 -15.127 4.851 1.00 0.00 C ATOM 1663 C GLU A 110 -4.057 -16.553 4.754 1.00 0.00 C ATOM 1664 O GLU A 110 -4.201 -17.212 3.725 1.00 0.00 O ATOM 1665 CB GLU A 110 -4.896 -14.254 4.731 1.00 0.00 C ATOM 1666 CG GLU A 110 -4.612 -12.755 4.850 1.00 0.00 C ATOM 1667 CD GLU A 110 -4.312 -12.293 6.269 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -4.366 -13.132 7.207 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -3.907 -11.110 6.425 1.00 0.00 O ATOM 0 H GLU A 110 -3.133 -13.996 3.223 1.00 0.00 H new ATOM 0 HA GLU A 110 -3.118 -15.020 5.804 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -5.375 -14.450 3.772 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -5.605 -14.544 5.506 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -3.766 -12.504 4.210 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.472 -12.202 4.473 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.359 -17.187 5.901 1.00 0.00 N ATOM 1677 CA LYS A 111 -5.010 -18.456 6.002 1.00 0.00 C ATOM 1678 C LYS A 111 -6.391 -18.256 6.522 1.00 0.00 C ATOM 1679 O LYS A 111 -6.663 -18.291 7.721 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.247 -19.388 6.959 1.00 0.00 C ATOM 1681 CG LYS A 111 -2.776 -19.443 6.542 1.00 0.00 C ATOM 1682 CD LYS A 111 -2.129 -20.653 7.220 1.00 0.00 C ATOM 1683 CE LYS A 111 -0.643 -20.914 6.970 1.00 0.00 C ATOM 1684 NZ LYS A 111 -0.381 -21.044 5.519 1.00 0.00 N ATOM 0 H LYS A 111 -4.135 -16.789 6.813 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.036 -18.913 5.013 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.334 -19.026 7.984 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.682 -20.387 6.936 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -2.691 -19.525 5.458 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.264 -18.526 6.833 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.272 -20.548 8.295 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.680 -21.541 6.911 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -0.049 -20.098 7.382 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.335 -21.824 7.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 0.632 -21.221 5.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -0.934 -21.837 5.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -0.657 -20.165 5.036 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.303 -17.898 5.600 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.540 -17.237 5.883 1.00 0.00 C ATOM 1700 C LEU A 112 -9.498 -18.297 6.305 1.00 0.00 C ATOM 1701 O LEU A 112 -9.568 -19.388 5.740 1.00 0.00 O ATOM 1702 CB LEU A 112 -9.073 -16.502 4.642 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.501 -15.103 4.355 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.782 -14.701 2.897 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -8.952 -14.102 5.431 1.00 0.00 C ATOM 0 H LEU A 112 -7.170 -18.079 4.605 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.405 -16.486 6.662 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.885 -17.129 3.771 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.155 -16.411 4.742 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.414 -15.107 4.434 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.372 -13.709 2.708 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.315 -15.421 2.225 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.858 -14.688 2.724 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.537 -13.119 5.210 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.040 -14.043 5.440 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.599 -14.434 6.407 1.00 0.00 H new ATOM 1717 N THR A 113 -10.427 -17.967 7.220 1.00 0.00 N ATOM 1718 CA THR A 113 -11.617 -18.727 7.445 1.00 0.00 C ATOM 1719 C THR A 113 -12.752 -18.097 6.714 1.00 0.00 C ATOM 1720 O THR A 113 -12.684 -16.985 6.192 1.00 0.00 O ATOM 1721 CB THR A 113 -11.968 -18.821 8.900 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.161 -17.522 9.441 1.00 0.00 O ATOM 1723 CG2 THR A 113 -10.714 -19.446 9.535 1.00 0.00 C ATOM 0 H THR A 113 -10.348 -17.147 7.821 1.00 0.00 H new ATOM 0 HA THR A 113 -11.432 -19.737 7.080 1.00 0.00 H new ATOM 0 HB THR A 113 -12.880 -19.391 9.076 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.988 -17.506 9.967 1.00 0.00 H new ATOM 0 HG21 THR A 113 -10.867 -19.559 10.608 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.530 -20.424 9.090 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.855 -18.799 9.358 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.928 -18.748 6.659 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.082 -18.170 6.044 1.00 0.00 C ATOM 1733 C ASP A 114 -15.545 -16.996 6.837 1.00 0.00 C ATOM 1734 O ASP A 114 -15.909 -15.915 6.376 1.00 0.00 O ATOM 1735 CB ASP A 114 -16.095 -19.307 5.830 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.579 -20.231 4.736 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -14.514 -20.899 4.823 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -16.277 -20.225 3.688 1.00 0.00 O ATOM 0 H ASP A 114 -14.080 -19.681 7.043 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.888 -17.744 5.060 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.238 -19.863 6.756 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -17.066 -18.898 5.551 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.517 -17.122 8.176 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.976 -16.124 9.093 1.00 0.00 C ATOM 1745 C GLU A 115 -15.111 -14.912 9.036 1.00 0.00 C ATOM 1746 O GLU A 115 -15.586 -13.787 9.183 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.031 -16.669 10.530 1.00 0.00 C ATOM 1748 CG GLU A 115 -17.029 -17.733 10.992 1.00 0.00 C ATOM 1749 CD GLU A 115 -16.888 -18.281 12.404 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -16.282 -17.562 13.242 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -17.343 -19.430 12.652 1.00 0.00 O ATOM 0 H GLU A 115 -15.159 -17.956 8.640 1.00 0.00 H new ATOM 0 HA GLU A 115 -16.987 -15.846 8.795 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.039 -17.065 10.746 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.179 -15.807 11.180 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -18.031 -17.315 10.895 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -16.965 -18.573 10.300 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.777 -15.039 8.919 1.00 0.00 N ATOM 1759 CA GLU A 116 -12.921 -13.896 8.839 1.00 0.00 C ATOM 1760 C GLU A 116 -13.108 -13.080 7.606 1.00 0.00 C ATOM 1761 O GLU A 116 -13.113 -11.851 7.658 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.481 -14.282 9.216 1.00 0.00 C ATOM 1763 CG GLU A 116 -10.463 -13.154 9.032 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.077 -13.393 9.613 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -8.216 -13.924 8.861 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -8.724 -12.940 10.734 1.00 0.00 O ATOM 0 H GLU A 116 -13.290 -15.935 8.880 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.226 -13.173 9.596 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.464 -14.606 10.257 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.175 -15.135 8.611 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.357 -12.960 7.965 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -10.871 -12.249 9.482 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.262 -13.761 6.457 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.716 -13.123 5.261 1.00 0.00 C ATOM 1775 C VAL A 117 -14.972 -12.343 5.441 1.00 0.00 C ATOM 1776 O VAL A 117 -15.080 -11.139 5.213 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.829 -13.932 4.003 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.396 -13.041 2.885 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.390 -14.358 3.671 1.00 0.00 C ATOM 0 H VAL A 117 -13.071 -14.758 6.356 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.862 -12.467 5.092 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.488 -14.794 4.110 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.482 -13.621 1.966 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.380 -12.674 3.176 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.728 -12.196 2.720 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.389 -14.956 2.760 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.773 -13.472 3.524 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -11.987 -14.949 4.493 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.041 -13.044 5.861 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.282 -12.486 6.299 1.00 0.00 C ATOM 1791 C ASP A 118 -17.227 -11.228 7.096 1.00 0.00 C ATOM 1792 O ASP A 118 -17.842 -10.218 6.757 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.174 -13.579 6.913 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.618 -13.100 6.859 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.073 -12.619 5.787 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.286 -13.152 7.925 1.00 0.00 O ATOM 0 H ASP A 118 -16.037 -14.063 5.896 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.754 -12.114 5.389 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.063 -14.514 6.363 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.878 -13.778 7.943 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.428 -11.295 8.176 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.128 -10.224 9.074 1.00 0.00 C ATOM 1803 C GLU A 119 -15.419 -9.142 8.334 1.00 0.00 C ATOM 1804 O GLU A 119 -15.654 -7.970 8.625 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.319 -10.743 10.274 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.504 -9.669 11.348 1.00 0.00 C ATOM 1807 CD GLU A 119 -14.861 -10.050 12.674 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -13.633 -10.332 12.675 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -15.558 -9.996 13.722 1.00 0.00 O ATOM 0 H GLU A 119 -15.958 -12.161 8.439 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.050 -9.804 9.475 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -15.687 -11.712 10.613 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.267 -10.873 10.018 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -15.074 -8.731 10.996 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -16.569 -9.494 11.502 1.00 0.00 H new ATOM 1816 N MET A 120 -14.474 -9.485 7.440 1.00 0.00 N ATOM 1817 CA MET A 120 -13.650 -8.528 6.769 1.00 0.00 C ATOM 1818 C MET A 120 -14.543 -7.745 5.869 1.00 0.00 C ATOM 1819 O MET A 120 -14.469 -6.517 5.848 1.00 0.00 O ATOM 1820 CB MET A 120 -12.490 -9.103 5.938 1.00 0.00 C ATOM 1821 CG MET A 120 -11.295 -9.412 6.842 1.00 0.00 C ATOM 1822 SD MET A 120 -9.865 -10.264 6.111 1.00 0.00 S ATOM 1823 CE MET A 120 -8.854 -8.804 5.730 1.00 0.00 C ATOM 0 H MET A 120 -14.278 -10.451 7.177 1.00 0.00 H new ATOM 0 HA MET A 120 -13.166 -7.934 7.544 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.813 -10.010 5.428 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.197 -8.390 5.167 1.00 0.00 H new ATOM 0 HG2 MET A 120 -10.943 -8.470 7.262 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.654 -10.018 7.674 1.00 0.00 H new ATOM 0 HE1 MET A 120 -7.849 -9.120 5.452 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.304 -8.256 4.902 1.00 0.00 H new ATOM 0 HE3 MET A 120 -8.802 -8.159 6.607 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.489 -8.354 5.132 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.385 -7.793 4.170 1.00 0.00 C ATOM 1835 C ILE A 121 -17.358 -6.894 4.854 1.00 0.00 C ATOM 1836 O ILE A 121 -17.593 -5.757 4.448 1.00 0.00 O ATOM 1837 CB ILE A 121 -17.118 -8.842 3.387 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -16.185 -9.747 2.566 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.155 -8.193 2.455 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.242 -9.025 1.605 1.00 0.00 C ATOM 0 H ILE A 121 -15.640 -9.358 5.225 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.786 -7.224 3.459 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.618 -9.474 4.121 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.586 -10.342 3.256 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.796 -10.443 1.992 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.677 -8.969 1.895 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.874 -7.628 3.048 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.650 -7.522 1.760 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.630 -9.757 1.078 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -15.826 -8.453 0.884 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.597 -8.350 2.167 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.873 -7.299 6.029 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.714 -6.539 6.900 1.00 0.00 C ATOM 1854 C ARG A 122 -18.153 -5.333 7.570 1.00 0.00 C ATOM 1855 O ARG A 122 -18.758 -4.264 7.644 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.342 -7.473 7.949 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.470 -6.915 8.818 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.344 -7.943 9.541 1.00 0.00 C ATOM 1859 NE ARG A 122 -20.370 -8.931 10.086 1.00 0.00 N ATOM 1860 CZ ARG A 122 -20.238 -10.215 9.644 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -21.000 -10.715 8.627 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -19.389 -11.109 10.231 1.00 0.00 N ATOM 0 H ARG A 122 -17.685 -8.232 6.397 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.444 -6.108 6.215 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.723 -8.352 7.429 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.547 -7.815 8.612 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -20.031 -6.254 9.565 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.114 -6.301 8.189 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -21.929 -7.480 10.336 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -22.051 -8.415 8.859 1.00 0.00 H new ATOM 0 HE ARG A 122 -19.759 -8.625 10.843 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -21.695 -10.123 8.172 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -20.874 -11.680 8.322 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -18.824 -10.826 11.031 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -19.320 -12.060 9.869 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.891 -5.368 8.033 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.186 -4.216 8.502 1.00 0.00 C ATOM 1878 C GLU A 123 -16.066 -3.193 7.425 1.00 0.00 C ATOM 1879 O GLU A 123 -16.464 -2.042 7.593 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.795 -4.576 9.048 1.00 0.00 C ATOM 1881 CG GLU A 123 -13.951 -3.476 9.696 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.509 -3.878 9.970 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.262 -4.436 11.073 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -11.560 -3.690 9.163 1.00 0.00 O ATOM 0 H GLU A 123 -16.343 -6.227 8.083 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.768 -3.798 9.324 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.924 -5.370 9.784 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -14.216 -4.995 8.225 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -13.956 -2.600 9.047 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -14.419 -3.180 10.635 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.541 -3.686 6.288 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.311 -2.773 5.211 1.00 0.00 C ATOM 1893 C ALA A 124 -16.445 -2.226 4.414 1.00 0.00 C ATOM 1894 O ALA A 124 -16.612 -1.022 4.227 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.316 -3.376 4.205 1.00 0.00 C ATOM 0 H ALA A 124 -15.288 -4.659 6.117 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.954 -1.912 5.777 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.150 -2.671 3.390 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.370 -3.580 4.707 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -14.722 -4.305 3.804 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.371 -3.077 3.938 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.395 -2.704 3.012 1.00 0.00 C ATOM 1903 C ASP A 125 -19.646 -2.212 3.653 1.00 0.00 C ATOM 1904 O ASP A 125 -20.544 -2.971 4.016 1.00 0.00 O ATOM 1905 CB ASP A 125 -18.576 -3.892 2.052 1.00 0.00 C ATOM 1906 CG ASP A 125 -19.107 -3.305 0.752 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -18.253 -2.770 -0.004 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -20.297 -3.358 0.342 1.00 0.00 O ATOM 0 H ASP A 125 -17.408 -4.060 4.207 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.093 -1.824 2.444 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -17.630 -4.409 1.889 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.272 -4.623 2.463 1.00 0.00 H new ATOM 1913 N ILE A 126 -19.659 -0.906 3.973 1.00 0.00 N ATOM 1914 CA ILE A 126 -20.726 -0.216 4.628 1.00 0.00 C ATOM 1915 C ILE A 126 -21.999 -0.211 3.854 1.00 0.00 C ATOM 1916 O ILE A 126 -23.052 -0.438 4.449 1.00 0.00 O ATOM 1917 CB ILE A 126 -20.264 1.148 5.049 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -21.275 1.789 6.014 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -19.899 2.120 3.914 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -20.761 2.819 7.018 1.00 0.00 C ATOM 0 H ILE A 126 -18.872 -0.293 3.760 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.984 -0.772 5.529 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.317 0.966 5.557 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -22.051 2.266 5.415 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -21.754 0.987 6.575 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -19.580 3.072 4.339 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.089 1.698 3.320 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.770 2.280 3.278 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -21.590 3.179 7.627 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -20.012 2.358 7.662 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -20.313 3.657 6.483 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.040 -0.016 2.524 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.173 -0.262 1.686 1.00 0.00 C ATOM 1934 C ASP A 127 -23.785 -1.620 1.685 1.00 0.00 C ATOM 1935 O ASP A 127 -24.990 -1.821 1.542 1.00 0.00 O ATOM 1936 CB ASP A 127 -22.916 0.314 0.283 1.00 0.00 C ATOM 1937 CG ASP A 127 -21.679 -0.272 -0.382 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -20.567 -0.342 0.205 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.825 -0.644 -1.577 1.00 0.00 O ATOM 0 H ASP A 127 -21.235 0.334 2.004 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.986 0.279 2.171 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -23.785 0.124 -0.347 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -22.805 1.396 0.355 1.00 0.00 H new ATOM 1944 N GLY A 128 -22.933 -2.648 1.849 1.00 0.00 N ATOM 1945 CA GLY A 128 -23.444 -3.983 1.885 1.00 0.00 C ATOM 1946 C GLY A 128 -23.552 -4.755 0.615 1.00 0.00 C ATOM 1947 O GLY A 128 -24.278 -5.748 0.600 1.00 0.00 O ATOM 0 H GLY A 128 -21.922 -2.562 1.954 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -22.815 -4.557 2.565 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -24.438 -3.942 2.329 1.00 0.00 H new ATOM 1951 N ASP A 129 -22.839 -4.352 -0.452 1.00 0.00 N ATOM 1952 CA ASP A 129 -22.895 -5.070 -1.687 1.00 0.00 C ATOM 1953 C ASP A 129 -21.734 -6.004 -1.703 1.00 0.00 C ATOM 1954 O ASP A 129 -21.762 -6.960 -2.476 1.00 0.00 O ATOM 1955 CB ASP A 129 -22.990 -4.156 -2.920 1.00 0.00 C ATOM 1956 CG ASP A 129 -21.748 -3.404 -3.378 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -20.685 -3.393 -2.702 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -21.770 -2.808 -4.488 1.00 0.00 O ATOM 0 H ASP A 129 -22.228 -3.535 -0.460 1.00 0.00 H new ATOM 0 HA ASP A 129 -23.819 -5.644 -1.750 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.333 -4.766 -3.756 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -23.768 -3.418 -2.724 1.00 0.00 H new ATOM 1963 N GLY A 130 -20.731 -5.755 -0.842 1.00 0.00 N ATOM 1964 CA GLY A 130 -19.529 -6.519 -0.719 1.00 0.00 C ATOM 1965 C GLY A 130 -18.615 -6.452 -1.893 1.00 0.00 C ATOM 1966 O GLY A 130 -17.822 -7.383 -2.024 1.00 0.00 O ATOM 0 H GLY A 130 -20.763 -4.970 -0.191 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -18.988 -6.177 0.163 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -19.796 -7.561 -0.545 1.00 0.00 H new ATOM 1970 N GLN A 131 -18.849 -5.518 -2.833 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.040 -5.161 -3.957 1.00 0.00 C ATOM 1972 C GLN A 131 -17.305 -3.910 -3.617 1.00 0.00 C ATOM 1973 O GLN A 131 -17.815 -2.930 -3.077 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.872 -4.829 -5.208 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.948 -5.880 -5.485 1.00 0.00 C ATOM 1976 CD GLN A 131 -20.576 -5.439 -6.800 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -20.126 -5.866 -7.861 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -21.585 -4.528 -6.742 1.00 0.00 N ATOM 0 H GLN A 131 -19.698 -4.954 -2.798 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.392 -6.012 -4.169 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.343 -3.855 -5.080 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -18.211 -4.752 -6.071 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -19.518 -6.878 -5.565 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -20.686 -5.914 -4.684 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.926 -4.202 -5.838 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -22.000 -4.171 -7.603 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.004 -3.875 -3.954 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.140 -2.773 -3.664 1.00 0.00 C ATOM 1989 C VAL A 132 -14.950 -2.064 -4.960 1.00 0.00 C ATOM 1990 O VAL A 132 -14.566 -2.642 -5.976 1.00 0.00 O ATOM 1991 CB VAL A 132 -13.781 -3.260 -3.257 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -12.856 -2.083 -2.903 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -13.860 -4.015 -1.919 1.00 0.00 C ATOM 0 H VAL A 132 -15.538 -4.638 -4.444 1.00 0.00 H new ATOM 0 HA VAL A 132 -15.565 -2.159 -2.870 1.00 0.00 H new ATOM 0 HB VAL A 132 -13.422 -3.863 -4.091 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -11.877 -2.464 -2.611 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.748 -1.432 -3.770 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -13.286 -1.518 -2.076 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -12.866 -4.362 -1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -14.244 -3.348 -1.147 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -14.527 -4.871 -2.023 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.270 -0.759 -5.031 1.00 0.00 N ATOM 2004 CA ASN A 133 -14.896 0.022 -6.169 1.00 0.00 C ATOM 2005 C ASN A 133 -13.672 0.821 -5.876 1.00 0.00 C ATOM 2006 O ASN A 133 -13.031 0.775 -4.828 1.00 0.00 O ATOM 2007 CB ASN A 133 -16.048 0.895 -6.696 1.00 0.00 C ATOM 2008 CG ASN A 133 -16.743 1.734 -5.634 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.186 2.690 -5.097 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -17.941 1.211 -5.259 1.00 0.00 N ATOM 0 H ASN A 133 -15.781 -0.250 -4.310 1.00 0.00 H new ATOM 0 HA ASN A 133 -14.661 -0.671 -6.977 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -15.659 1.559 -7.468 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -16.787 0.250 -7.172 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.451 1.616 -4.474 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -18.330 0.414 -5.763 1.00 0.00 H new ATOM 2017 N TYR A 134 -13.279 1.698 -6.817 1.00 0.00 N ATOM 2018 CA TYR A 134 -12.275 2.714 -6.753 1.00 0.00 C ATOM 2019 C TYR A 134 -12.336 3.648 -5.593 1.00 0.00 C ATOM 2020 O TYR A 134 -11.368 3.750 -4.841 1.00 0.00 O ATOM 2021 CB TYR A 134 -12.150 3.525 -8.054 1.00 0.00 C ATOM 2022 CG TYR A 134 -11.008 4.478 -8.128 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -9.773 3.969 -8.456 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -11.223 5.816 -7.895 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -8.742 4.873 -8.557 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -10.183 6.705 -8.029 1.00 0.00 C ATOM 2027 CZ TYR A 134 -8.945 6.221 -8.380 1.00 0.00 C ATOM 2028 OH TYR A 134 -7.821 7.049 -8.587 1.00 0.00 O ATOM 0 H TYR A 134 -13.723 1.690 -7.735 1.00 0.00 H new ATOM 0 HA TYR A 134 -11.378 2.113 -6.601 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -12.068 2.826 -8.887 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.074 4.085 -8.198 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -9.621 2.913 -8.626 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -12.203 6.167 -7.608 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -7.748 4.515 -8.781 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -10.335 7.761 -7.862 1.00 0.00 H new ATOM 0 HH TYR A 134 -8.072 7.984 -8.438 1.00 0.00 H new ATOM 2038 N GLU A 135 -13.408 4.424 -5.355 1.00 0.00 N ATOM 2039 CA GLU A 135 -13.656 5.315 -4.264 1.00 0.00 C ATOM 2040 C GLU A 135 -13.664 4.630 -2.941 1.00 0.00 C ATOM 2041 O GLU A 135 -13.015 5.099 -2.007 1.00 0.00 O ATOM 2042 CB GLU A 135 -14.964 6.121 -4.340 1.00 0.00 C ATOM 2043 CG GLU A 135 -15.037 7.212 -3.269 1.00 0.00 C ATOM 2044 CD GLU A 135 -16.149 8.228 -3.489 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -17.306 7.948 -3.075 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -15.851 9.387 -3.883 1.00 0.00 O ATOM 0 H GLU A 135 -14.192 4.424 -6.007 1.00 0.00 H new ATOM 0 HA GLU A 135 -12.816 6.003 -4.357 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -15.050 6.577 -5.326 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -15.812 5.445 -4.226 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -15.177 6.741 -2.296 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.082 7.737 -3.235 1.00 0.00 H new ATOM 2053 N GLU A 136 -14.271 3.445 -2.750 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.287 2.698 -1.531 1.00 0.00 C ATOM 2055 C GLU A 136 -12.932 2.272 -1.083 1.00 0.00 C ATOM 2056 O GLU A 136 -12.559 2.294 0.089 1.00 0.00 O ATOM 2057 CB GLU A 136 -15.267 1.517 -1.427 1.00 0.00 C ATOM 2058 CG GLU A 136 -16.692 1.924 -1.806 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.708 0.803 -1.645 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.362 -0.346 -1.259 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -18.929 1.034 -1.857 1.00 0.00 O ATOM 0 H GLU A 136 -14.785 2.979 -3.498 1.00 0.00 H new ATOM 0 HA GLU A 136 -14.687 3.447 -0.848 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -14.934 0.710 -2.080 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -15.259 1.127 -0.409 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -16.996 2.770 -1.189 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -16.701 2.265 -2.841 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.098 1.850 -2.051 1.00 0.00 N ATOM 2069 CA PHE A 137 -10.763 1.350 -1.934 1.00 0.00 C ATOM 2070 C PHE A 137 -9.899 2.434 -1.387 1.00 0.00 C ATOM 2071 O PHE A 137 -9.168 2.217 -0.422 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.277 0.838 -3.301 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.008 0.059 -3.248 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -8.921 -1.109 -2.529 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -7.893 0.419 -3.968 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -7.791 -1.890 -2.587 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -6.739 -0.327 -4.021 1.00 0.00 C ATOM 2078 CZ PHE A 137 -6.690 -1.507 -3.317 1.00 0.00 C ATOM 0 H PHE A 137 -12.397 1.862 -3.026 1.00 0.00 H new ATOM 0 HA PHE A 137 -10.720 0.504 -1.248 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.055 0.213 -3.739 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.139 1.690 -3.967 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -9.751 -1.417 -1.910 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -7.926 1.343 -4.525 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.767 -2.825 -2.047 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -5.891 0.006 -4.602 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.803 -2.122 -3.337 1.00 0.00 H new ATOM 2088 N VAL A 138 -10.055 3.641 -1.958 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.345 4.833 -1.611 1.00 0.00 C ATOM 2090 C VAL A 138 -9.722 5.202 -0.218 1.00 0.00 C ATOM 2091 O VAL A 138 -8.862 5.509 0.606 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.524 6.054 -2.464 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -9.046 7.399 -1.891 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -8.665 5.700 -3.690 1.00 0.00 C ATOM 0 H VAL A 138 -10.723 3.794 -2.714 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.301 4.559 -1.760 1.00 0.00 H new ATOM 0 HB VAL A 138 -10.587 6.236 -2.619 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -9.238 8.191 -2.614 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.584 7.613 -0.967 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -7.977 7.347 -1.685 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.704 6.518 -4.410 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -7.633 5.540 -3.377 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -9.049 4.791 -4.153 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.035 5.427 -0.031 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.594 5.782 1.236 1.00 0.00 C ATOM 2106 C GLN A 139 -11.203 4.927 2.392 1.00 0.00 C ATOM 2107 O GLN A 139 -10.848 5.458 3.444 1.00 0.00 O ATOM 2108 CB GLN A 139 -13.126 5.876 1.141 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.943 6.205 2.393 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.601 7.623 2.829 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -12.783 7.932 3.694 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -14.460 8.541 2.309 1.00 0.00 N ATOM 0 H GLN A 139 -11.725 5.360 -0.779 1.00 0.00 H new ATOM 0 HA GLN A 139 -11.156 6.755 1.456 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -13.360 6.631 0.391 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -13.488 4.922 0.757 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -15.009 6.119 2.184 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -13.717 5.498 3.191 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -15.131 8.263 1.592 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -14.433 9.507 2.636 1.00 0.00 H new ATOM 2121 N MET A 140 -11.106 3.588 2.309 1.00 0.00 N ATOM 2122 CA MET A 140 -10.548 2.707 3.288 1.00 0.00 C ATOM 2123 C MET A 140 -9.117 2.806 3.690 1.00 0.00 C ATOM 2124 O MET A 140 -8.703 2.711 4.844 1.00 0.00 O ATOM 2125 CB MET A 140 -10.958 1.342 2.710 1.00 0.00 C ATOM 2126 CG MET A 140 -10.565 0.158 3.595 1.00 0.00 C ATOM 2127 SD MET A 140 -11.598 -1.237 3.057 1.00 0.00 S ATOM 2128 CE MET A 140 -10.636 -1.585 1.557 1.00 0.00 C ATOM 0 H MET A 140 -11.446 3.082 1.491 1.00 0.00 H new ATOM 0 HA MET A 140 -10.928 2.964 4.277 1.00 0.00 H new ATOM 0 HB2 MET A 140 -12.038 1.330 2.560 1.00 0.00 H new ATOM 0 HB3 MET A 140 -10.499 1.220 1.729 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.506 -0.076 3.485 1.00 0.00 H new ATOM 0 HG3 MET A 140 -10.734 0.385 4.648 1.00 0.00 H new ATOM 0 HE1 MET A 140 -11.079 -2.429 1.028 1.00 0.00 H new ATOM 0 HE2 MET A 140 -10.641 -0.708 0.910 1.00 0.00 H new ATOM 0 HE3 MET A 140 -9.609 -1.827 1.831 1.00 0.00 H new ATOM 2138 N MET A 141 -8.200 3.058 2.739 1.00 0.00 N ATOM 2139 CA MET A 141 -6.785 3.085 2.942 1.00 0.00 C ATOM 2140 C MET A 141 -6.204 4.429 3.218 1.00 0.00 C ATOM 2141 O MET A 141 -5.145 4.542 3.833 1.00 0.00 O ATOM 2142 CB MET A 141 -6.048 2.398 1.780 1.00 0.00 C ATOM 2143 CG MET A 141 -6.516 0.955 1.585 1.00 0.00 C ATOM 2144 SD MET A 141 -5.818 0.029 0.185 1.00 0.00 S ATOM 2145 CE MET A 141 -5.580 1.345 -1.044 1.00 0.00 C ATOM 0 H MET A 141 -8.462 3.254 1.773 1.00 0.00 H new ATOM 0 HA MET A 141 -6.629 2.521 3.862 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.213 2.961 0.861 1.00 0.00 H new ATOM 0 HB3 MET A 141 -4.975 2.409 1.973 1.00 0.00 H new ATOM 0 HG2 MET A 141 -6.293 0.403 2.498 1.00 0.00 H new ATOM 0 HG3 MET A 141 -7.600 0.965 1.475 1.00 0.00 H new ATOM 0 HE1 MET A 141 -5.174 0.918 -1.961 1.00 0.00 H new ATOM 0 HE2 MET A 141 -6.537 1.820 -1.258 1.00 0.00 H new ATOM 0 HE3 MET A 141 -4.886 2.088 -0.652 1.00 0.00 H new ATOM 2155 N THR A 142 -6.869 5.505 2.762 1.00 0.00 N ATOM 2156 CA THR A 142 -6.364 6.808 3.066 1.00 0.00 C ATOM 2157 C THR A 142 -6.626 7.412 4.438 1.00 0.00 C ATOM 2158 O THR A 142 -7.384 6.811 5.245 1.00 0.00 O ATOM 2159 CB THR A 142 -6.856 7.784 2.038 1.00 0.00 C ATOM 2160 OG1 THR A 142 -8.271 7.887 1.967 1.00 0.00 O ATOM 2161 CG2 THR A 142 -6.285 7.353 0.677 1.00 0.00 C ATOM 0 H THR A 142 -7.723 5.480 2.205 1.00 0.00 H new ATOM 0 HA THR A 142 -5.288 6.636 3.061 1.00 0.00 H new ATOM 0 HB THR A 142 -6.512 8.777 2.327 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.632 7.112 1.488 1.00 0.00 H new ATOM 0 HG21 THR A 142 -6.624 8.043 -0.095 1.00 0.00 H new ATOM 0 HG22 THR A 142 -5.196 7.363 0.720 1.00 0.00 H new ATOM 0 HG23 THR A 142 -6.629 6.346 0.440 1.00 0.00 H new ATOM 2170 N ARG B 1 -8.295 -0.447 12.959 1.00 0.00 N ATOM 2171 CA ARG B 1 -8.387 -1.614 12.054 1.00 0.00 C ATOM 2172 C ARG B 1 -7.112 -2.372 11.914 1.00 0.00 C ATOM 2173 O ARG B 1 -6.028 -1.802 11.803 1.00 0.00 O ATOM 2174 CB ARG B 1 -8.848 -1.156 10.659 1.00 0.00 C ATOM 2175 CG ARG B 1 -10.124 -0.313 10.707 1.00 0.00 C ATOM 2176 CD ARG B 1 -10.837 0.157 9.437 1.00 0.00 C ATOM 2177 NE ARG B 1 -11.129 -1.031 8.587 1.00 0.00 N ATOM 2178 CZ ARG B 1 -11.772 -0.930 7.387 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -12.066 0.263 6.793 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -12.145 -2.083 6.759 1.00 0.00 N ATOM 0 H1 ARG B 1 -9.252 -0.135 13.221 1.00 0.00 H new ATOM 0 H2 ARG B 1 -7.770 -0.713 13.817 1.00 0.00 H new ATOM 0 H3 ARG B 1 -7.798 0.329 12.476 1.00 0.00 H new ATOM 0 HA ARG B 1 -9.111 -2.290 12.509 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -8.052 -0.577 10.190 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -9.019 -2.031 10.032 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -10.854 -0.881 11.284 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -9.888 0.581 11.283 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -11.761 0.676 9.692 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -10.213 0.866 8.894 1.00 0.00 H new ATOM 0 HE ARG B 1 -10.838 -1.953 8.913 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -11.803 1.137 7.247 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -12.549 0.280 5.895 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -11.942 -2.986 7.188 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -12.627 -2.042 5.861 1.00 0.00 H new ATOM 2193 N ARG B 2 -7.217 -3.713 11.895 1.00 0.00 N ATOM 2194 CA ARG B 2 -6.106 -4.591 11.697 1.00 0.00 C ATOM 2195 C ARG B 2 -5.869 -4.996 10.283 1.00 0.00 C ATOM 2196 O ARG B 2 -5.052 -4.460 9.536 1.00 0.00 O ATOM 2197 CB ARG B 2 -6.264 -5.785 12.654 1.00 0.00 C ATOM 2198 CG ARG B 2 -6.292 -5.493 14.155 1.00 0.00 C ATOM 2199 CD ARG B 2 -5.269 -4.426 14.551 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.899 -5.010 14.571 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.912 -4.719 15.468 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -3.102 -3.708 16.365 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -1.670 -5.252 15.275 1.00 0.00 N ATOM 0 H ARG B 2 -8.103 -4.202 12.021 1.00 0.00 H new ATOM 0 HA ARG B 2 -5.195 -4.042 11.935 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -7.188 -6.302 12.395 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -5.446 -6.479 12.462 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -7.290 -5.162 14.441 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -6.090 -6.411 14.707 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -5.308 -3.595 13.847 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -5.515 -4.023 15.533 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.677 -5.692 13.846 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -3.974 -3.179 16.360 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -2.372 -3.481 17.040 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -1.493 -5.855 14.472 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -0.919 -5.047 15.934 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.398 -6.150 9.838 1.00 0.00 N ATOM 2218 CA LYS B 3 -5.968 -6.816 8.648 1.00 0.00 C ATOM 2219 C LYS B 3 -6.153 -6.085 7.363 1.00 0.00 C ATOM 2220 O LYS B 3 -5.344 -6.223 6.446 1.00 0.00 O ATOM 2221 CB LYS B 3 -6.549 -8.233 8.507 1.00 0.00 C ATOM 2222 CG LYS B 3 -6.097 -9.306 9.499 1.00 0.00 C ATOM 2223 CD LYS B 3 -6.364 -10.762 9.112 1.00 0.00 C ATOM 2224 CE LYS B 3 -5.739 -11.781 10.067 1.00 0.00 C ATOM 2225 NZ LYS B 3 -5.812 -13.147 9.502 1.00 0.00 N ATOM 0 H LYS B 3 -7.152 -6.636 10.324 1.00 0.00 H new ATOM 0 HA LYS B 3 -4.891 -6.863 8.812 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -7.634 -8.155 8.574 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -6.316 -8.589 7.504 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -5.025 -9.189 9.661 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -6.586 -9.113 10.454 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -7.441 -10.926 9.075 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -5.980 -10.937 8.107 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -4.699 -11.517 10.257 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -6.256 -11.752 11.026 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -5.707 -13.845 10.266 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -6.731 -13.281 9.035 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -5.049 -13.277 8.808 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.126 -5.159 7.305 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.335 -4.293 6.186 1.00 0.00 C ATOM 2241 C TRP B 4 -6.424 -3.130 5.994 1.00 0.00 C ATOM 2242 O TRP B 4 -6.062 -2.813 4.862 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.780 -3.766 6.200 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.932 -4.602 5.696 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.877 -5.283 6.406 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -10.239 -4.885 4.318 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.681 -6.042 5.597 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.330 -5.762 4.297 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.626 -4.488 3.161 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.961 -6.092 3.129 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -10.210 -4.884 1.981 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.380 -5.607 1.981 1.00 0.00 C ATOM 0 H TRP B 4 -7.791 -5.007 8.064 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.105 -4.949 5.347 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -9.010 -3.500 7.232 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.785 -2.841 5.624 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.979 -5.230 7.480 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.405 -6.693 5.902 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.726 -3.892 3.174 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.857 -6.694 3.110 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.744 -4.624 1.042 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.865 -5.803 1.036 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.895 -2.640 7.129 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.822 -1.708 7.286 1.00 0.00 C ATOM 2265 C GLN B 5 -3.546 -2.302 6.795 1.00 0.00 C ATOM 2266 O GLN B 5 -3.033 -1.918 5.745 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.554 -1.203 8.713 1.00 0.00 C ATOM 2268 CG GLN B 5 -3.736 0.087 8.802 1.00 0.00 C ATOM 2269 CD GLN B 5 -4.311 1.385 8.253 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -4.591 1.716 7.102 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -4.416 2.369 9.186 1.00 0.00 N ATOM 0 H GLN B 5 -6.262 -2.931 8.035 1.00 0.00 H new ATOM 0 HA GLN B 5 -5.155 -0.849 6.704 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -5.510 -1.043 9.211 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -4.033 -1.984 9.266 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -3.504 0.253 9.854 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -2.790 -0.092 8.291 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -4.200 2.171 10.163 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -4.711 3.305 8.909 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.141 -3.427 7.411 1.00 0.00 N ATOM 2281 CA LYS B 6 -2.038 -4.236 6.993 1.00 0.00 C ATOM 2282 C LYS B 6 -1.927 -4.573 5.546 1.00 0.00 C ATOM 2283 O LYS B 6 -0.937 -4.215 4.909 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.047 -5.532 7.822 1.00 0.00 C ATOM 2285 CG LYS B 6 -0.742 -6.329 7.776 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.046 -7.701 8.380 1.00 0.00 C ATOM 2287 CE LYS B 6 -1.773 -8.618 7.395 1.00 0.00 C ATOM 2288 NZ LYS B 6 -1.831 -9.984 7.963 1.00 0.00 N ATOM 0 H LYS B 6 -3.607 -3.791 8.243 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.163 -3.610 7.168 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.268 -5.282 8.860 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -2.858 -6.168 7.468 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -0.384 -6.428 6.751 1.00 0.00 H new ATOM 0 HG3 LYS B 6 0.041 -5.822 8.340 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.115 -8.173 8.693 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -1.656 -7.575 9.275 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -2.780 -8.245 7.206 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -1.253 -8.630 6.437 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.565 -10.533 7.472 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -0.909 -10.450 7.841 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.060 -9.929 8.976 1.00 0.00 H new ATOM 2302 N THR B 7 -2.974 -5.233 5.020 1.00 0.00 N ATOM 2303 CA THR B 7 -3.143 -5.546 3.635 1.00 0.00 C ATOM 2304 C THR B 7 -3.233 -4.343 2.761 1.00 0.00 C ATOM 2305 O THR B 7 -2.707 -4.256 1.652 1.00 0.00 O ATOM 2306 CB THR B 7 -4.328 -6.412 3.325 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.268 -7.452 4.290 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.186 -7.070 1.943 1.00 0.00 C ATOM 0 H THR B 7 -3.747 -5.567 5.595 1.00 0.00 H new ATOM 0 HA THR B 7 -2.233 -6.104 3.417 1.00 0.00 H new ATOM 0 HB THR B 7 -5.250 -5.831 3.338 1.00 0.00 H new ATOM 0 HG1 THR B 7 -4.664 -7.141 5.131 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.059 -7.692 1.745 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.110 -6.297 1.178 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.288 -7.688 1.925 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.861 -3.274 3.282 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.768 -2.012 2.615 1.00 0.00 C ATOM 2318 C GLY B 8 -2.426 -1.496 2.222 1.00 0.00 C ATOM 2319 O GLY B 8 -2.124 -1.062 1.111 1.00 0.00 O ATOM 0 H GLY B 8 -4.416 -3.279 4.137 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -4.374 -2.073 1.711 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -4.231 -1.265 3.260 1.00 0.00 H new ATOM 2323 N HIS B 9 -1.565 -1.500 3.255 1.00 0.00 N ATOM 2324 CA HIS B 9 -0.209 -1.064 3.132 1.00 0.00 C ATOM 2325 C HIS B 9 0.626 -1.925 2.246 1.00 0.00 C ATOM 2326 O HIS B 9 1.520 -1.531 1.500 1.00 0.00 O ATOM 2327 CB HIS B 9 0.389 -1.124 4.547 1.00 0.00 C ATOM 2328 CG HIS B 9 -0.168 -0.044 5.427 1.00 0.00 C ATOM 2329 ND1 HIS B 9 -0.052 1.301 5.142 1.00 0.00 N ATOM 2330 CD2 HIS B 9 -0.537 -0.100 6.735 1.00 0.00 C ATOM 2331 CE1 HIS B 9 -0.412 1.986 6.260 1.00 0.00 C ATOM 2332 NE2 HIS B 9 -0.700 1.168 7.254 1.00 0.00 N ATOM 0 H HIS B 9 -1.815 -1.812 4.193 1.00 0.00 H new ATOM 0 HA HIS B 9 -0.210 -0.069 2.687 1.00 0.00 H new ATOM 0 HB2 HIS B 9 0.181 -2.098 4.990 1.00 0.00 H new ATOM 0 HB3 HIS B 9 1.473 -1.025 4.489 1.00 0.00 H new ATOM 0 HD2 HIS B 9 -0.683 -1.014 7.292 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -0.457 3.063 6.326 1.00 0.00 H new ATOM 0 HE2 HIS B 9 -0.982 1.419 8.202 1.00 0.00 H new ATOM 2340 N ALA B 10 0.273 -3.222 2.275 1.00 0.00 N ATOM 2341 CA ALA B 10 0.832 -4.263 1.468 1.00 0.00 C ATOM 2342 C ALA B 10 0.555 -4.296 0.005 1.00 0.00 C ATOM 2343 O ALA B 10 1.427 -4.312 -0.862 1.00 0.00 O ATOM 2344 CB ALA B 10 0.494 -5.671 1.984 1.00 0.00 C ATOM 0 H ALA B 10 -0.452 -3.566 2.905 1.00 0.00 H new ATOM 0 HA ALA B 10 1.881 -3.986 1.577 1.00 0.00 H new ATOM 0 HB1 ALA B 10 0.946 -6.416 1.330 1.00 0.00 H new ATOM 0 HB2 ALA B 10 0.883 -5.791 2.995 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.588 -5.805 1.994 1.00 0.00 H new ATOM 2350 N VAL B 11 -0.697 -4.155 -0.465 1.00 0.00 N ATOM 2351 CA VAL B 11 -1.032 -4.003 -1.847 1.00 0.00 C ATOM 2352 C VAL B 11 -0.524 -2.736 -2.445 1.00 0.00 C ATOM 2353 O VAL B 11 -0.272 -2.739 -3.649 1.00 0.00 O ATOM 2354 CB VAL B 11 -2.503 -4.228 -2.036 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -3.308 -3.043 -1.479 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.761 -4.552 -3.518 1.00 0.00 C ATOM 0 H VAL B 11 -1.513 -4.147 0.147 1.00 0.00 H new ATOM 0 HA VAL B 11 -0.507 -4.771 -2.415 1.00 0.00 H new ATOM 0 HB VAL B 11 -2.852 -5.086 -1.462 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -4.373 -3.225 -1.626 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -3.102 -2.932 -0.414 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -3.021 -2.130 -2.001 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.827 -4.719 -3.674 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -2.430 -3.717 -4.136 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -2.209 -5.450 -3.796 1.00 0.00 H new ATOM 2366 N ARG B 12 -0.398 -1.687 -1.613 1.00 0.00 N ATOM 2367 CA ARG B 12 0.064 -0.419 -2.088 1.00 0.00 C ATOM 2368 C ARG B 12 1.529 -0.523 -2.335 1.00 0.00 C ATOM 2369 O ARG B 12 2.078 0.268 -3.099 1.00 0.00 O ATOM 2370 CB ARG B 12 -0.159 0.681 -1.036 1.00 0.00 C ATOM 2371 CG ARG B 12 -1.583 1.233 -0.942 1.00 0.00 C ATOM 2372 CD ARG B 12 -1.855 2.338 0.080 1.00 0.00 C ATOM 2373 NE ARG B 12 -1.046 3.570 -0.140 1.00 0.00 N ATOM 2374 CZ ARG B 12 -1.248 4.777 0.465 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -2.316 4.962 1.295 1.00 0.00 N ATOM 2376 NH2 ARG B 12 -0.561 5.891 0.079 1.00 0.00 N ATOM 0 H ARG B 12 -0.615 -1.715 -0.617 1.00 0.00 H new ATOM 0 HA ARG B 12 -0.486 -0.162 -2.994 1.00 0.00 H new ATOM 0 HB2 ARG B 12 0.123 0.286 -0.060 1.00 0.00 H new ATOM 0 HB3 ARG B 12 0.517 1.508 -1.253 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -1.861 1.611 -1.926 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -2.251 0.400 -0.720 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -2.913 2.598 0.048 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -1.652 1.954 1.080 1.00 0.00 H new ATOM 0 HE ARG B 12 -0.272 3.506 -0.802 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -2.968 4.196 1.466 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -2.462 5.866 1.744 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.121 5.833 -0.677 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -0.730 6.782 0.547 1.00 0.00 H new ATOM 2390 N ALA B 13 2.201 -1.450 -1.627 1.00 0.00 N ATOM 2391 CA ALA B 13 3.531 -1.796 -2.020 1.00 0.00 C ATOM 2392 C ALA B 13 3.619 -2.587 -3.280 1.00 0.00 C ATOM 2393 O ALA B 13 4.301 -2.198 -4.227 1.00 0.00 O ATOM 2394 CB ALA B 13 4.205 -2.480 -0.819 1.00 0.00 C ATOM 0 H ALA B 13 1.839 -1.944 -0.811 1.00 0.00 H new ATOM 0 HA ALA B 13 4.069 -0.885 -2.282 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.225 -2.759 -1.084 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.225 -1.793 0.027 1.00 0.00 H new ATOM 0 HB3 ALA B 13 3.644 -3.374 -0.547 1.00 0.00 H new ATOM 2400 N ILE B 14 2.889 -3.716 -3.317 1.00 0.00 N ATOM 2401 CA ILE B 14 3.092 -4.725 -4.309 1.00 0.00 C ATOM 2402 C ILE B 14 2.666 -4.234 -5.650 1.00 0.00 C ATOM 2403 O ILE B 14 3.244 -4.545 -6.690 1.00 0.00 O ATOM 2404 CB ILE B 14 2.380 -5.956 -3.831 1.00 0.00 C ATOM 2405 CG1 ILE B 14 3.195 -6.621 -2.709 1.00 0.00 C ATOM 2406 CG2 ILE B 14 2.059 -6.940 -4.969 1.00 0.00 C ATOM 2407 CD1 ILE B 14 2.606 -7.870 -2.054 1.00 0.00 C ATOM 0 H ILE B 14 2.148 -3.931 -2.650 1.00 0.00 H new ATOM 0 HA ILE B 14 4.145 -4.976 -4.440 1.00 0.00 H new ATOM 0 HB ILE B 14 1.413 -5.650 -3.431 1.00 0.00 H new ATOM 0 HG12 ILE B 14 4.173 -6.883 -3.113 1.00 0.00 H new ATOM 0 HG13 ILE B 14 3.361 -5.878 -1.929 1.00 0.00 H new ATOM 0 HG21 ILE B 14 1.544 -7.811 -4.563 1.00 0.00 H new ATOM 0 HG22 ILE B 14 1.420 -6.451 -5.704 1.00 0.00 H new ATOM 0 HG23 ILE B 14 2.985 -7.257 -5.448 1.00 0.00 H new ATOM 0 HD11 ILE B 14 3.286 -8.231 -1.282 1.00 0.00 H new ATOM 0 HD12 ILE B 14 1.644 -7.626 -1.604 1.00 0.00 H new ATOM 0 HD13 ILE B 14 2.468 -8.645 -2.808 1.00 0.00 H new ATOM 2419 N GLY B 15 1.620 -3.390 -5.700 1.00 0.00 N ATOM 2420 CA GLY B 15 1.137 -2.836 -6.927 1.00 0.00 C ATOM 2421 C GLY B 15 2.192 -1.948 -7.493 1.00 0.00 C ATOM 2422 O GLY B 15 2.474 -1.902 -8.689 1.00 0.00 O ATOM 0 H GLY B 15 1.101 -3.087 -4.876 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.893 -3.631 -7.632 1.00 0.00 H new ATOM 0 HA3 GLY B 15 0.221 -2.272 -6.753 1.00 0.00 H new ATOM 2426 N ARG B 16 2.898 -1.149 -6.673 1.00 0.00 N ATOM 2427 CA ARG B 16 3.837 -0.158 -7.098 1.00 0.00 C ATOM 2428 C ARG B 16 5.188 -0.672 -7.461 1.00 0.00 C ATOM 2429 O ARG B 16 5.814 -0.268 -8.439 1.00 0.00 O ATOM 2430 CB ARG B 16 3.967 0.940 -6.029 1.00 0.00 C ATOM 2431 CG ARG B 16 4.913 2.103 -6.337 1.00 0.00 C ATOM 2432 CD ARG B 16 4.504 2.868 -7.597 1.00 0.00 C ATOM 2433 NE ARG B 16 5.539 3.903 -7.879 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.404 4.936 -8.761 1.00 0.00 C ATOM 2435 NH1 ARG B 16 4.285 5.020 -9.538 1.00 0.00 N ATOM 2436 NH2 ARG B 16 6.442 5.794 -8.981 1.00 0.00 N ATOM 0 H ARG B 16 2.808 -1.198 -5.658 1.00 0.00 H new ATOM 0 HA ARG B 16 3.424 0.243 -8.024 1.00 0.00 H new ATOM 0 HB2 ARG B 16 2.975 1.351 -5.843 1.00 0.00 H new ATOM 0 HB3 ARG B 16 4.297 0.472 -5.101 1.00 0.00 H new ATOM 0 HG2 ARG B 16 4.931 2.788 -5.489 1.00 0.00 H new ATOM 0 HG3 ARG B 16 5.926 1.721 -6.460 1.00 0.00 H new ATOM 0 HD2 ARG B 16 4.411 2.185 -8.441 1.00 0.00 H new ATOM 0 HD3 ARG B 16 3.529 3.335 -7.457 1.00 0.00 H new ATOM 0 HE ARG B 16 6.421 3.834 -7.371 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.554 4.313 -9.458 1.00 0.00 H new ATOM 0 HH12 ARG B 16 4.179 5.790 -10.199 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.324 5.665 -8.485 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.336 6.564 -9.641 1.00 0.00 H new