USER MOD reduce.3.24.130724 H: found=0, std=0, add=907, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 903 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: B 107 THR OG1 : rot -162:sc= 0.951 USER MOD Set 1.2: B 109 THR OG1 : rot -38:sc= 1.01 USER MOD Set 2.1: A 11 CYS SG : rot 136:sc= 0.025 USER MOD Set 2.2: A 14 CYS SG : rot -57:sc= -0.17 USER MOD Set 2.3: A 30 HIS :FLIP no HD1:sc= -0.485 F(o=-2.7,f=-0.57) USER MOD Set 2.4: A 34 CYS SG : rot 150:sc= 0.0571 USER MOD Set 3.1: A 29 SER OG : rot 73:sc= 1.26 USER MOD Set 3.2: B 168 HIS : no HD1:sc= -0.667 K(o=0.59,f=-0.1) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl 142:sc= -1.11 (180deg=-1.87) USER MOD Single : A 15 GLN : amide:sc= -0.0579 X(o=-0.058,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= -1.41 K(o=-1.4,f=-2.1!) USER MOD Single : A 33 GLN : amide:sc= -0.265 X(o=-0.27,f=0) USER MOD Single : A 38 SER OG : rot -62:sc= 1.2 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 99 SER OG : rot -33:sc= 0.0255 USER MOD Single : B 100 HIS : no HE2:sc= -0.867 X(o=-0.87,f=-1) USER MOD Single : B 101 MET CE :methyl -171:sc= -4.62! (180deg=-5.12!) USER MOD Single : B 102 GLN : amide:sc= -0.0131 X(o=-0.013,f=-0.014) USER MOD Single : B 106 LYS NZ :NH3+ -146:sc= 0 (180deg=-0.013) USER MOD Single : B 111 LYS NZ :NH3+ 170:sc= -2.22! (180deg=-2.49!) USER MOD Single : B 112 THR OG1 : rot 180:sc= 0 USER MOD Single : B 114 THR OG1 : rot -99:sc= 1.85 USER MOD Single : B 120 SER OG : rot 180:sc= 0.00898 USER MOD Single : B 122 THR OG1 : rot 173:sc= -0.738 USER MOD Single : B 125 ASN : amide:sc= -0.0578 X(o=-0.058,f=0) USER MOD Single : B 127 LYS NZ :NH3+ 140:sc= -0.314 (180deg=-2.09!) USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 131 GLN : amide:sc= -0.775 X(o=-0.78,f=-0.76) USER MOD Single : B 133 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0123) USER MOD Single : B 140 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.11) USER MOD Single : B 141 GLN : amide:sc= -2.91 K(o=-2.9,f=-4.2!) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 149 GLN : amide:sc= -1.41 X(o=-1.4,f=-0.98) USER MOD Single : B 155 THR OG1 : rot 180:sc= 0 USER MOD Single : B 157 SER OG : rot 180:sc= 0 USER MOD Single : B 159 TYR OH : rot 15:sc= -0.569 USER MOD Single : B 160 ASN : amide:sc= -0.257 X(o=-0.26,f=-0.086) USER MOD Single : B 162 GLN : amide:sc= -0.402 X(o=-0.4,f=-0.019) USER MOD Single : B 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 165 SER OG : rot 72:sc= 0.911 USER MOD Single : B 166 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 73 N ALA A 7 -11.552 -4.998 3.897 1.00 0.00 N ATOM 74 CA ALA A 7 -11.681 -4.399 5.220 1.00 0.00 C ATOM 75 C ALA A 7 -12.781 -3.343 5.239 1.00 0.00 C ATOM 76 O ALA A 7 -13.165 -2.851 6.301 1.00 0.00 O ATOM 77 CB ALA A 7 -10.356 -3.791 5.655 1.00 0.00 C ATOM 0 HA ALA A 7 -11.956 -5.185 5.923 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -10.467 -3.347 6.644 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.593 -4.568 5.689 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -10.058 -3.021 4.943 1.00 0.00 H new ATOM 83 N LEU A 8 -13.286 -3.000 4.059 1.00 0.00 N ATOM 84 CA LEU A 8 -14.342 -2.001 3.941 1.00 0.00 C ATOM 85 C LEU A 8 -15.199 -2.259 2.705 1.00 0.00 C ATOM 86 O LEU A 8 -14.694 -2.676 1.663 1.00 0.00 O ATOM 87 CB LEU A 8 -13.739 -0.597 3.872 1.00 0.00 C ATOM 88 CG LEU A 8 -12.402 -0.475 3.139 1.00 0.00 C ATOM 89 CD1 LEU A 8 -12.270 0.896 2.494 1.00 0.00 C ATOM 90 CD2 LEU A 8 -11.245 -0.732 4.093 1.00 0.00 C ATOM 0 H LEU A 8 -12.981 -3.399 3.171 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.977 -2.074 4.824 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -14.458 0.062 3.386 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -13.607 -0.230 4.890 1.00 0.00 H new ATOM 0 HG LEU A 8 -12.371 -1.228 2.352 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -11.313 0.964 1.977 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -13.080 1.041 1.779 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -12.323 1.667 3.263 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -10.302 -0.641 3.554 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -11.272 -0.003 4.903 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.331 -1.737 4.507 1.00 0.00 H new ATOM 102 N ARG A 9 -16.498 -2.006 2.830 1.00 0.00 N ATOM 103 CA ARG A 9 -17.425 -2.210 1.723 1.00 0.00 C ATOM 104 C ARG A 9 -17.782 -0.883 1.061 1.00 0.00 C ATOM 105 O ARG A 9 -18.304 -0.854 -0.054 1.00 0.00 O ATOM 106 CB ARG A 9 -18.697 -2.904 2.216 1.00 0.00 C ATOM 107 CG ARG A 9 -19.776 -3.022 1.154 1.00 0.00 C ATOM 108 CD ARG A 9 -20.585 -4.300 1.321 1.00 0.00 C ATOM 109 NE ARG A 9 -21.709 -4.120 2.236 1.00 0.00 N ATOM 110 CZ ARG A 9 -22.788 -3.403 1.944 1.00 0.00 C ATOM 111 NH1 ARG A 9 -22.889 -2.802 0.767 1.00 0.00 N ATOM 112 NH2 ARG A 9 -23.769 -3.288 2.829 1.00 0.00 N ATOM 0 H ARG A 9 -16.932 -1.660 3.686 1.00 0.00 H new ATOM 0 HA ARG A 9 -16.935 -2.845 0.985 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -18.441 -3.901 2.574 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -19.096 -2.352 3.067 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -20.440 -2.160 1.211 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -19.318 -3.007 0.165 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -20.957 -4.623 0.349 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -19.937 -5.093 1.694 1.00 0.00 H new ATOM 0 HE ARG A 9 -21.663 -4.570 3.150 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -22.137 -2.890 0.083 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -23.719 -2.252 0.545 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -23.695 -3.751 3.735 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -24.597 -2.737 2.604 1.00 0.00 H new ATOM 126 N SER A 10 -17.496 0.214 1.755 1.00 0.00 N ATOM 127 CA SER A 10 -17.791 1.545 1.236 1.00 0.00 C ATOM 128 C SER A 10 -16.633 2.502 1.506 1.00 0.00 C ATOM 129 O SER A 10 -16.212 2.676 2.650 1.00 0.00 O ATOM 130 CB SER A 10 -19.075 2.089 1.865 1.00 0.00 C ATOM 131 OG SER A 10 -19.821 1.051 2.479 1.00 0.00 O ATOM 0 H SER A 10 -17.061 0.208 2.677 1.00 0.00 H new ATOM 0 HA SER A 10 -17.930 1.465 0.158 1.00 0.00 H new ATOM 0 HB2 SER A 10 -18.827 2.850 2.605 1.00 0.00 H new ATOM 0 HB3 SER A 10 -19.682 2.574 1.100 1.00 0.00 H new ATOM 0 HG SER A 10 -20.636 1.424 2.875 1.00 0.00 H new ATOM 137 N CYS A 11 -16.125 3.119 0.446 1.00 0.00 N ATOM 138 CA CYS A 11 -15.016 4.059 0.567 1.00 0.00 C ATOM 139 C CYS A 11 -15.307 5.111 1.634 1.00 0.00 C ATOM 140 O CYS A 11 -16.120 6.015 1.443 1.00 0.00 O ATOM 141 CB CYS A 11 -14.749 4.740 -0.777 1.00 0.00 C ATOM 142 SG CYS A 11 -13.157 5.623 -0.861 1.00 0.00 S ATOM 0 H CYS A 11 -16.463 2.986 -0.507 1.00 0.00 H new ATOM 0 HA CYS A 11 -14.130 3.500 0.866 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -14.777 3.988 -1.565 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -15.555 5.445 -0.981 1.00 0.00 H new ATOM 0 HG CYS A 11 -12.574 5.359 -1.993 1.00 0.00 H new ATOM 147 N PRO A 12 -14.628 4.989 2.784 1.00 0.00 N ATOM 148 CA PRO A 12 -14.797 5.920 3.904 1.00 0.00 C ATOM 149 C PRO A 12 -14.228 7.302 3.599 1.00 0.00 C ATOM 150 O PRO A 12 -14.350 8.225 4.404 1.00 0.00 O ATOM 151 CB PRO A 12 -14.011 5.257 5.038 1.00 0.00 C ATOM 152 CG PRO A 12 -12.996 4.411 4.351 1.00 0.00 C ATOM 153 CD PRO A 12 -13.644 3.935 3.079 1.00 0.00 C ATOM 0 HA PRO A 12 -15.848 6.090 4.138 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.538 6.001 5.679 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -14.662 4.657 5.673 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -12.092 4.982 4.138 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -12.701 3.569 4.977 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -12.917 3.827 2.274 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -14.122 2.964 3.210 1.00 0.00 H new ATOM 161 N MET A 13 -13.607 7.437 2.433 1.00 0.00 N ATOM 162 CA MET A 13 -13.020 8.708 2.022 1.00 0.00 C ATOM 163 C MET A 13 -14.034 9.551 1.255 1.00 0.00 C ATOM 164 O MET A 13 -14.301 10.698 1.615 1.00 0.00 O ATOM 165 CB MET A 13 -11.782 8.467 1.157 1.00 0.00 C ATOM 166 CG MET A 13 -10.473 8.623 1.913 1.00 0.00 C ATOM 167 SD MET A 13 -9.779 7.041 2.435 1.00 0.00 S ATOM 168 CE MET A 13 -8.834 6.590 0.982 1.00 0.00 C ATOM 0 H MET A 13 -13.497 6.683 1.755 1.00 0.00 H new ATOM 0 HA MET A 13 -12.726 9.251 2.920 1.00 0.00 H new ATOM 0 HB2 MET A 13 -11.832 7.462 0.737 1.00 0.00 H new ATOM 0 HB3 MET A 13 -11.793 9.164 0.319 1.00 0.00 H new ATOM 0 HG2 MET A 13 -9.752 9.141 1.280 1.00 0.00 H new ATOM 0 HG3 MET A 13 -10.636 9.250 2.789 1.00 0.00 H new ATOM 0 HE1 MET A 13 -7.902 6.114 1.287 1.00 0.00 H new ATOM 0 HE2 MET A 13 -9.413 5.896 0.372 1.00 0.00 H new ATOM 0 HE3 MET A 13 -8.611 7.485 0.401 1.00 0.00 H new ATOM 178 N CYS A 14 -14.595 8.976 0.197 1.00 0.00 N ATOM 179 CA CYS A 14 -15.578 9.676 -0.622 1.00 0.00 C ATOM 180 C CYS A 14 -16.959 9.040 -0.477 1.00 0.00 C ATOM 181 O CYS A 14 -17.832 9.230 -1.321 1.00 0.00 O ATOM 182 CB CYS A 14 -15.152 9.663 -2.092 1.00 0.00 C ATOM 183 SG CYS A 14 -15.287 8.032 -2.891 1.00 0.00 S ATOM 0 H CYS A 14 -14.386 8.027 -0.114 1.00 0.00 H new ATOM 0 HA CYS A 14 -15.633 10.708 -0.275 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -15.764 10.377 -2.643 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -14.120 10.006 -2.163 1.00 0.00 H new ATOM 0 HG CYS A 14 -14.573 7.167 -2.234 1.00 0.00 H new ATOM 188 N GLN A 15 -17.144 8.284 0.601 1.00 0.00 N ATOM 189 CA GLN A 15 -18.417 7.621 0.857 1.00 0.00 C ATOM 190 C GLN A 15 -18.975 7.000 -0.420 1.00 0.00 C ATOM 191 O GLN A 15 -20.042 7.388 -0.896 1.00 0.00 O ATOM 192 CB GLN A 15 -19.426 8.611 1.439 1.00 0.00 C ATOM 193 CG GLN A 15 -19.355 8.734 2.954 1.00 0.00 C ATOM 194 CD GLN A 15 -20.465 7.976 3.654 1.00 0.00 C ATOM 195 OE1 GLN A 15 -21.110 8.498 4.564 1.00 0.00 O ATOM 196 NE2 GLN A 15 -20.694 6.738 3.231 1.00 0.00 N ATOM 0 H GLN A 15 -16.430 8.116 1.310 1.00 0.00 H new ATOM 0 HA GLN A 15 -18.242 6.825 1.581 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -19.257 9.592 0.995 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -20.432 8.301 1.155 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -18.391 8.361 3.300 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -19.408 9.787 3.232 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -20.134 6.346 2.474 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -21.429 6.179 3.664 1.00 0.00 H new ATOM 205 N LYS A 16 -18.246 6.036 -0.970 1.00 0.00 N ATOM 206 CA LYS A 16 -18.666 5.361 -2.193 1.00 0.00 C ATOM 207 C LYS A 16 -18.701 3.849 -1.995 1.00 0.00 C ATOM 208 O LYS A 16 -17.664 3.217 -1.796 1.00 0.00 O ATOM 209 CB LYS A 16 -17.724 5.714 -3.345 1.00 0.00 C ATOM 210 CG LYS A 16 -18.124 5.092 -4.671 1.00 0.00 C ATOM 211 CD LYS A 16 -18.163 6.124 -5.784 1.00 0.00 C ATOM 212 CE LYS A 16 -16.780 6.364 -6.371 1.00 0.00 C ATOM 213 NZ LYS A 16 -16.841 7.180 -7.616 1.00 0.00 N ATOM 0 H LYS A 16 -17.360 5.704 -0.588 1.00 0.00 H new ATOM 0 HA LYS A 16 -19.672 5.701 -2.439 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -17.691 6.798 -3.457 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -16.715 5.389 -3.091 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -17.419 4.303 -4.931 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -19.104 4.624 -4.573 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -18.839 5.788 -6.570 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -18.563 7.062 -5.398 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -16.156 6.870 -5.635 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -16.306 5.407 -6.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -15.879 7.322 -7.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -17.416 6.685 -8.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -17.270 8.103 -7.405 1.00 0.00 H new ATOM 227 N GLU A 17 -19.899 3.276 -2.053 1.00 0.00 N ATOM 228 CA GLU A 17 -20.066 1.838 -1.880 1.00 0.00 C ATOM 229 C GLU A 17 -19.325 1.069 -2.970 1.00 0.00 C ATOM 230 O GLU A 17 -19.598 1.237 -4.160 1.00 0.00 O ATOM 231 CB GLU A 17 -21.551 1.468 -1.901 1.00 0.00 C ATOM 232 CG GLU A 17 -22.341 2.059 -0.745 1.00 0.00 C ATOM 233 CD GLU A 17 -23.790 2.327 -1.105 1.00 0.00 C ATOM 234 OE1 GLU A 17 -24.484 1.375 -1.517 1.00 0.00 O ATOM 235 OE2 GLU A 17 -24.228 3.489 -0.973 1.00 0.00 O ATOM 0 H GLU A 17 -20.767 3.785 -2.218 1.00 0.00 H new ATOM 0 HA GLU A 17 -19.644 1.563 -0.913 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -21.988 1.807 -2.840 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -21.647 0.382 -1.878 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -22.302 1.376 0.104 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -21.871 2.990 -0.427 1.00 0.00 H new ATOM 242 N PHE A 18 -18.385 0.226 -2.557 1.00 0.00 N ATOM 243 CA PHE A 18 -17.602 -0.567 -3.497 1.00 0.00 C ATOM 244 C PHE A 18 -18.456 -1.665 -4.124 1.00 0.00 C ATOM 245 O PHE A 18 -19.434 -2.120 -3.533 1.00 0.00 O ATOM 246 CB PHE A 18 -16.393 -1.186 -2.792 1.00 0.00 C ATOM 247 CG PHE A 18 -15.412 -0.170 -2.282 1.00 0.00 C ATOM 248 CD1 PHE A 18 -14.755 0.680 -3.158 1.00 0.00 C ATOM 249 CD2 PHE A 18 -15.145 -0.063 -0.926 1.00 0.00 C ATOM 250 CE1 PHE A 18 -13.852 1.616 -2.692 1.00 0.00 C ATOM 251 CE2 PHE A 18 -14.243 0.871 -0.454 1.00 0.00 C ATOM 252 CZ PHE A 18 -13.596 1.712 -1.338 1.00 0.00 C ATOM 0 H PHE A 18 -18.147 0.074 -1.577 1.00 0.00 H new ATOM 0 HA PHE A 18 -17.252 0.095 -4.289 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -16.741 -1.794 -1.957 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -15.883 -1.856 -3.484 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -14.951 0.610 -4.218 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -15.648 -0.718 -0.230 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -13.347 2.272 -3.386 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -14.044 0.943 0.605 1.00 0.00 H new ATOM 0 HZ PHE A 18 -12.891 2.443 -0.971 1.00 0.00 H new ATOM 262 N ALA A 19 -18.078 -2.087 -5.327 1.00 0.00 N ATOM 263 CA ALA A 19 -18.806 -3.132 -6.034 1.00 0.00 C ATOM 264 C ALA A 19 -18.823 -4.429 -5.232 1.00 0.00 C ATOM 265 O ALA A 19 -17.912 -4.719 -4.457 1.00 0.00 O ATOM 266 CB ALA A 19 -18.194 -3.365 -7.407 1.00 0.00 C ATOM 0 H ALA A 19 -17.271 -1.720 -5.832 1.00 0.00 H new ATOM 0 HA ALA A 19 -19.837 -2.801 -6.160 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -18.748 -4.148 -7.924 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -18.241 -2.444 -7.987 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -17.154 -3.670 -7.295 1.00 0.00 H new ATOM 272 N PRO A 20 -19.883 -5.229 -5.421 1.00 0.00 N ATOM 273 CA PRO A 20 -20.043 -6.508 -4.724 1.00 0.00 C ATOM 274 C PRO A 20 -19.045 -7.557 -5.199 1.00 0.00 C ATOM 275 O PRO A 20 -18.339 -7.353 -6.188 1.00 0.00 O ATOM 276 CB PRO A 20 -21.471 -6.930 -5.080 1.00 0.00 C ATOM 277 CG PRO A 20 -21.756 -6.250 -6.374 1.00 0.00 C ATOM 278 CD PRO A 20 -21.006 -4.946 -6.330 1.00 0.00 C ATOM 0 HA PRO A 20 -19.866 -6.412 -3.653 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -21.551 -8.013 -5.176 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -22.178 -6.625 -4.308 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -21.429 -6.860 -7.216 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -22.826 -6.081 -6.499 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -20.657 -4.649 -7.319 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -21.631 -4.135 -5.956 1.00 0.00 H new ATOM 286 N ARG A 21 -18.989 -8.680 -4.490 1.00 0.00 N ATOM 287 CA ARG A 21 -18.075 -9.760 -4.840 1.00 0.00 C ATOM 288 C ARG A 21 -16.717 -9.208 -5.264 1.00 0.00 C ATOM 289 O ARG A 21 -16.082 -9.729 -6.183 1.00 0.00 O ATOM 290 CB ARG A 21 -18.666 -10.612 -5.966 1.00 0.00 C ATOM 291 CG ARG A 21 -18.797 -9.871 -7.286 1.00 0.00 C ATOM 292 CD ARG A 21 -18.902 -10.834 -8.458 1.00 0.00 C ATOM 293 NE ARG A 21 -17.620 -11.020 -9.131 1.00 0.00 N ATOM 294 CZ ARG A 21 -17.483 -11.649 -10.293 1.00 0.00 C ATOM 295 NH1 ARG A 21 -18.546 -12.149 -10.908 1.00 0.00 N ATOM 296 NH2 ARG A 21 -16.283 -11.777 -10.842 1.00 0.00 N ATOM 0 H ARG A 21 -19.566 -8.865 -3.670 1.00 0.00 H new ATOM 0 HA ARG A 21 -17.934 -10.384 -3.957 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -18.038 -11.491 -6.113 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -19.649 -10.970 -5.661 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -19.679 -9.231 -7.259 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -17.935 -9.219 -7.426 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -19.268 -11.797 -8.104 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -19.635 -10.457 -9.172 1.00 0.00 H new ATOM 0 HE ARG A 21 -16.783 -10.646 -8.684 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -19.471 -12.051 -10.489 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -18.439 -12.632 -11.800 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -15.464 -11.392 -10.372 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -16.179 -12.260 -11.734 1.00 0.00 H new ATOM 310 N LEU A 22 -16.278 -8.150 -4.591 1.00 0.00 N ATOM 311 CA LEU A 22 -14.996 -7.527 -4.898 1.00 0.00 C ATOM 312 C LEU A 22 -13.854 -8.256 -4.199 1.00 0.00 C ATOM 313 O LEU A 22 -14.063 -9.278 -3.544 1.00 0.00 O ATOM 314 CB LEU A 22 -15.008 -6.055 -4.479 1.00 0.00 C ATOM 315 CG LEU A 22 -15.585 -5.757 -3.095 1.00 0.00 C ATOM 316 CD1 LEU A 22 -14.819 -6.516 -2.023 1.00 0.00 C ATOM 317 CD2 LEU A 22 -15.557 -4.261 -2.816 1.00 0.00 C ATOM 0 H LEU A 22 -16.791 -7.706 -3.829 1.00 0.00 H new ATOM 0 HA LEU A 22 -14.838 -7.591 -5.975 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -13.985 -5.680 -4.513 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -15.579 -5.492 -5.218 1.00 0.00 H new ATOM 0 HG LEU A 22 -16.623 -6.090 -3.075 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -15.244 -6.292 -1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -14.892 -7.587 -2.213 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -13.772 -6.214 -2.042 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -15.971 -4.068 -1.827 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -14.528 -3.903 -2.855 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -16.151 -3.740 -3.567 1.00 0.00 H new ATOM 329 N THR A 23 -12.643 -7.725 -4.340 1.00 0.00 N ATOM 330 CA THR A 23 -11.467 -8.324 -3.723 1.00 0.00 C ATOM 331 C THR A 23 -10.631 -7.275 -2.998 1.00 0.00 C ATOM 332 O THR A 23 -10.777 -6.077 -3.242 1.00 0.00 O ATOM 333 CB THR A 23 -10.587 -9.037 -4.765 1.00 0.00 C ATOM 334 OG1 THR A 23 -10.253 -8.134 -5.824 1.00 0.00 O ATOM 335 CG2 THR A 23 -11.298 -10.254 -5.334 1.00 0.00 C ATOM 0 H THR A 23 -12.452 -6.879 -4.877 1.00 0.00 H new ATOM 0 HA THR A 23 -11.828 -9.057 -3.002 1.00 0.00 H new ATOM 0 HB THR A 23 -9.674 -9.369 -4.270 1.00 0.00 H new ATOM 0 HG1 THR A 23 -9.692 -8.595 -6.482 1.00 0.00 H new ATOM 0 HG21 THR A 23 -10.656 -10.741 -6.068 1.00 0.00 H new ATOM 0 HG22 THR A 23 -11.523 -10.953 -4.529 1.00 0.00 H new ATOM 0 HG23 THR A 23 -12.226 -9.942 -5.814 1.00 0.00 H new ATOM 343 N GLN A 24 -9.756 -7.733 -2.109 1.00 0.00 N ATOM 344 CA GLN A 24 -8.897 -6.831 -1.350 1.00 0.00 C ATOM 345 C GLN A 24 -8.167 -5.866 -2.278 1.00 0.00 C ATOM 346 O GLN A 24 -7.862 -4.733 -1.899 1.00 0.00 O ATOM 347 CB GLN A 24 -7.886 -7.630 -0.527 1.00 0.00 C ATOM 348 CG GLN A 24 -8.437 -8.126 0.800 1.00 0.00 C ATOM 349 CD GLN A 24 -8.050 -7.233 1.963 1.00 0.00 C ATOM 350 OE1 GLN A 24 -7.382 -7.671 2.900 1.00 0.00 O ATOM 351 NE2 GLN A 24 -8.469 -5.975 1.909 1.00 0.00 N ATOM 0 H GLN A 24 -9.623 -8.722 -1.896 1.00 0.00 H new ATOM 0 HA GLN A 24 -9.526 -6.251 -0.675 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -7.548 -8.485 -1.113 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -7.011 -7.008 -0.338 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -9.524 -8.185 0.738 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -8.072 -9.136 0.986 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -9.020 -5.655 1.113 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -8.240 -5.328 2.664 1.00 0.00 H new ATOM 360 N LEU A 25 -7.886 -6.320 -3.494 1.00 0.00 N ATOM 361 CA LEU A 25 -7.191 -5.497 -4.477 1.00 0.00 C ATOM 362 C LEU A 25 -8.101 -4.393 -5.006 1.00 0.00 C ATOM 363 O LEU A 25 -7.656 -3.272 -5.252 1.00 0.00 O ATOM 364 CB LEU A 25 -6.695 -6.362 -5.637 1.00 0.00 C ATOM 365 CG LEU A 25 -5.975 -5.623 -6.766 1.00 0.00 C ATOM 366 CD1 LEU A 25 -4.500 -5.453 -6.437 1.00 0.00 C ATOM 367 CD2 LEU A 25 -6.147 -6.365 -8.083 1.00 0.00 C ATOM 0 H LEU A 25 -8.129 -7.254 -3.823 1.00 0.00 H new ATOM 0 HA LEU A 25 -6.336 -5.033 -3.985 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.020 -7.119 -5.237 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.549 -6.889 -6.062 1.00 0.00 H new ATOM 0 HG LEU A 25 -6.420 -4.633 -6.868 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.004 -4.925 -7.252 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.396 -4.879 -5.516 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.041 -6.433 -6.307 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.628 -5.825 -8.875 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.729 -7.368 -7.993 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -7.207 -6.435 -8.326 1.00 0.00 H new ATOM 379 N ASP A 26 -9.378 -4.717 -5.175 1.00 0.00 N ATOM 380 CA ASP A 26 -10.353 -3.753 -5.671 1.00 0.00 C ATOM 381 C ASP A 26 -10.452 -2.551 -4.736 1.00 0.00 C ATOM 382 O ASP A 26 -10.203 -1.415 -5.139 1.00 0.00 O ATOM 383 CB ASP A 26 -11.725 -4.413 -5.821 1.00 0.00 C ATOM 384 CG ASP A 26 -12.372 -4.106 -7.157 1.00 0.00 C ATOM 385 OD1 ASP A 26 -12.766 -2.941 -7.371 1.00 0.00 O ATOM 386 OD2 ASP A 26 -12.485 -5.032 -7.989 1.00 0.00 O ATOM 0 H ASP A 26 -9.762 -5.641 -4.976 1.00 0.00 H new ATOM 0 HA ASP A 26 -10.018 -3.405 -6.648 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -11.620 -5.492 -5.711 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -12.378 -4.073 -5.017 1.00 0.00 H new ATOM 391 N VAL A 27 -10.820 -2.810 -3.484 1.00 0.00 N ATOM 392 CA VAL A 27 -10.952 -1.751 -2.492 1.00 0.00 C ATOM 393 C VAL A 27 -9.669 -0.935 -2.385 1.00 0.00 C ATOM 394 O VAL A 27 -9.700 0.297 -2.412 1.00 0.00 O ATOM 395 CB VAL A 27 -11.302 -2.321 -1.105 1.00 0.00 C ATOM 396 CG1 VAL A 27 -11.613 -1.198 -0.127 1.00 0.00 C ATOM 397 CG2 VAL A 27 -12.472 -3.288 -1.207 1.00 0.00 C ATOM 0 H VAL A 27 -11.032 -3.744 -3.134 1.00 0.00 H new ATOM 0 HA VAL A 27 -11.764 -1.104 -2.826 1.00 0.00 H new ATOM 0 HB VAL A 27 -10.438 -2.868 -0.729 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.858 -1.621 0.847 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.744 -0.547 -0.032 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -12.461 -0.620 -0.495 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.706 -3.681 -0.218 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -13.342 -2.766 -1.605 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -12.207 -4.111 -1.871 1.00 0.00 H new ATOM 407 N ASP A 28 -8.542 -1.627 -2.264 1.00 0.00 N ATOM 408 CA ASP A 28 -7.247 -0.967 -2.154 1.00 0.00 C ATOM 409 C ASP A 28 -6.965 -0.115 -3.388 1.00 0.00 C ATOM 410 O ASP A 28 -6.488 1.014 -3.279 1.00 0.00 O ATOM 411 CB ASP A 28 -6.136 -2.003 -1.969 1.00 0.00 C ATOM 412 CG ASP A 28 -6.275 -2.774 -0.671 1.00 0.00 C ATOM 413 OD1 ASP A 28 -7.221 -2.486 0.093 1.00 0.00 O ATOM 414 OD2 ASP A 28 -5.439 -3.667 -0.421 1.00 0.00 O ATOM 0 H ASP A 28 -8.499 -2.646 -2.240 1.00 0.00 H new ATOM 0 HA ASP A 28 -7.273 -0.314 -1.282 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -6.151 -2.701 -2.806 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.168 -1.502 -1.989 1.00 0.00 H new ATOM 419 N SER A 29 -7.261 -0.666 -4.561 1.00 0.00 N ATOM 420 CA SER A 29 -7.034 0.041 -5.816 1.00 0.00 C ATOM 421 C SER A 29 -7.670 1.427 -5.781 1.00 0.00 C ATOM 422 O SER A 29 -7.039 2.422 -6.141 1.00 0.00 O ATOM 423 CB SER A 29 -7.601 -0.763 -6.988 1.00 0.00 C ATOM 424 OG SER A 29 -6.795 -1.895 -7.267 1.00 0.00 O ATOM 0 H SER A 29 -7.658 -1.599 -4.668 1.00 0.00 H new ATOM 0 HA SER A 29 -5.959 0.157 -5.950 1.00 0.00 H new ATOM 0 HB2 SER A 29 -8.616 -1.084 -6.756 1.00 0.00 H new ATOM 0 HB3 SER A 29 -7.662 -0.129 -7.873 1.00 0.00 H new ATOM 0 HG SER A 29 -6.924 -2.569 -6.567 1.00 0.00 H new ATOM 430 N HIS A 30 -8.923 1.486 -5.343 1.00 0.00 N ATOM 431 CA HIS A 30 -9.646 2.750 -5.259 1.00 0.00 C ATOM 432 C HIS A 30 -9.169 3.571 -4.065 1.00 0.00 C ATOM 433 O HIS A 30 -9.013 4.789 -4.158 1.00 0.00 O ATOM 434 CB HIS A 30 -11.150 2.496 -5.150 1.00 0.00 C ATOM 435 CG HIS A 30 -11.967 3.750 -5.101 1.00 0.00 C ATOM 436 ND1 HIS A 30 -11.961 4.776 -4.217 1.00 0.00 N flip ATOM 437 CD2 HIS A 30 -12.930 4.059 -6.038 1.00 0.00 C flip ATOM 438 CE1 HIS A 30 -12.910 5.677 -4.634 1.00 0.00 C flip ATOM 439 NE2 HIS A 30 -13.481 5.221 -5.735 1.00 0.00 N flip ATOM 0 H HIS A 30 -9.459 0.673 -5.040 1.00 0.00 H new ATOM 0 HA HIS A 30 -9.446 3.315 -6.169 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -11.471 1.896 -6.001 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -11.347 1.909 -4.253 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -13.193 3.446 -6.888 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -13.151 6.608 -4.142 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -14.221 5.686 -6.261 1.00 0.00 H new ATOM 447 N LEU A 31 -8.939 2.896 -2.944 1.00 0.00 N ATOM 448 CA LEU A 31 -8.480 3.563 -1.730 1.00 0.00 C ATOM 449 C LEU A 31 -7.172 4.307 -1.979 1.00 0.00 C ATOM 450 O LEU A 31 -6.884 5.311 -1.329 1.00 0.00 O ATOM 451 CB LEU A 31 -8.294 2.545 -0.604 1.00 0.00 C ATOM 452 CG LEU A 31 -9.569 2.096 0.112 1.00 0.00 C ATOM 453 CD1 LEU A 31 -9.244 1.070 1.186 1.00 0.00 C ATOM 454 CD2 LEU A 31 -10.290 3.293 0.715 1.00 0.00 C ATOM 0 H LEU A 31 -9.063 1.888 -2.850 1.00 0.00 H new ATOM 0 HA LEU A 31 -9.239 4.288 -1.434 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.803 1.663 -1.016 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.616 2.971 0.136 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.230 1.629 -0.619 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.163 0.762 1.685 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -8.771 0.201 0.728 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -8.565 1.510 1.916 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -11.195 2.956 1.221 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -9.636 3.788 1.433 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -10.556 3.994 -0.076 1.00 0.00 H new ATOM 466 N ALA A 32 -6.385 3.809 -2.927 1.00 0.00 N ATOM 467 CA ALA A 32 -5.110 4.428 -3.265 1.00 0.00 C ATOM 468 C ALA A 32 -5.318 5.726 -4.039 1.00 0.00 C ATOM 469 O ALA A 32 -4.761 6.765 -3.688 1.00 0.00 O ATOM 470 CB ALA A 32 -4.250 3.464 -4.069 1.00 0.00 C ATOM 0 H ALA A 32 -6.609 2.978 -3.475 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.594 4.668 -2.335 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.301 3.941 -4.314 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.064 2.565 -3.481 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -4.769 3.194 -4.989 1.00 0.00 H new ATOM 476 N GLN A 33 -6.122 5.656 -5.095 1.00 0.00 N ATOM 477 CA GLN A 33 -6.402 6.825 -5.920 1.00 0.00 C ATOM 478 C GLN A 33 -7.234 7.847 -5.152 1.00 0.00 C ATOM 479 O GLN A 33 -7.080 9.045 -5.383 1.00 0.00 O ATOM 480 CB GLN A 33 -7.133 6.411 -7.198 1.00 0.00 C ATOM 481 CG GLN A 33 -8.577 5.994 -6.964 1.00 0.00 C ATOM 482 CD GLN A 33 -9.327 5.738 -8.256 1.00 0.00 C ATOM 483 OE1 GLN A 33 -10.463 6.181 -8.427 1.00 0.00 O ATOM 484 NE2 GLN A 33 -8.693 5.020 -9.177 1.00 0.00 N ATOM 0 H GLN A 33 -6.591 4.803 -5.399 1.00 0.00 H new ATOM 0 HA GLN A 33 -5.451 7.285 -6.187 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -7.113 7.242 -7.904 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -6.595 5.585 -7.663 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -8.596 5.092 -6.352 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -9.089 6.773 -6.399 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -7.752 4.672 -8.994 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -9.148 4.817 -10.067 1.00 0.00 H new ATOM 493 N CYS A 34 -8.088 7.358 -4.265 1.00 0.00 N ATOM 494 CA CYS A 34 -8.932 8.238 -3.475 1.00 0.00 C ATOM 495 C CYS A 34 -8.053 8.951 -2.446 1.00 0.00 C ATOM 496 O CYS A 34 -8.097 10.171 -2.283 1.00 0.00 O ATOM 497 CB CYS A 34 -10.082 7.475 -2.813 1.00 0.00 C ATOM 498 SG CYS A 34 -11.535 8.572 -2.624 1.00 0.00 S ATOM 0 H CYS A 34 -8.214 6.364 -4.076 1.00 0.00 H new ATOM 0 HA CYS A 34 -9.400 8.977 -4.125 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -10.348 6.607 -3.416 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -9.768 7.102 -1.838 1.00 0.00 H new ATOM 0 HG CYS A 34 -12.623 7.863 -2.674 1.00 0.00 H new ATOM 503 N LEU A 35 -7.248 8.157 -1.749 1.00 0.00 N ATOM 504 CA LEU A 35 -6.348 8.686 -0.730 1.00 0.00 C ATOM 505 C LEU A 35 -5.496 9.820 -1.291 1.00 0.00 C ATOM 506 O LEU A 35 -5.365 10.876 -0.671 1.00 0.00 O ATOM 507 CB LEU A 35 -5.445 7.573 -0.193 1.00 0.00 C ATOM 508 CG LEU A 35 -4.449 7.982 0.893 1.00 0.00 C ATOM 509 CD1 LEU A 35 -5.065 7.817 2.273 1.00 0.00 C ATOM 510 CD2 LEU A 35 -3.169 7.167 0.777 1.00 0.00 C ATOM 0 H LEU A 35 -7.200 7.145 -1.871 1.00 0.00 H new ATOM 0 HA LEU A 35 -6.954 9.081 0.085 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -6.078 6.779 0.203 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.887 7.150 -1.029 1.00 0.00 H new ATOM 0 HG LEU A 35 -4.200 9.034 0.753 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -4.341 8.113 3.032 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -5.952 8.445 2.353 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.344 6.774 2.425 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -2.472 7.471 1.558 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -3.401 6.108 0.890 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -2.717 7.337 -0.200 1.00 0.00 H new ATOM 522 N ALA A 36 -4.920 9.595 -2.467 1.00 0.00 N ATOM 523 CA ALA A 36 -4.084 10.600 -3.113 1.00 0.00 C ATOM 524 C ALA A 36 -4.865 11.887 -3.358 1.00 0.00 C ATOM 525 O ALA A 36 -4.329 12.985 -3.212 1.00 0.00 O ATOM 526 CB ALA A 36 -3.528 10.060 -4.421 1.00 0.00 C ATOM 0 H ALA A 36 -5.017 8.726 -2.992 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.253 10.831 -2.446 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.906 10.820 -4.893 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.928 9.172 -4.222 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.351 9.800 -5.087 1.00 0.00 H new ATOM 532 N GLU A 37 -6.132 11.744 -3.733 1.00 0.00 N ATOM 533 CA GLU A 37 -6.984 12.896 -4.000 1.00 0.00 C ATOM 534 C GLU A 37 -7.391 13.585 -2.701 1.00 0.00 C ATOM 535 O GLU A 37 -7.533 14.806 -2.651 1.00 0.00 O ATOM 536 CB GLU A 37 -8.232 12.467 -4.775 1.00 0.00 C ATOM 537 CG GLU A 37 -8.005 12.335 -6.271 1.00 0.00 C ATOM 538 CD GLU A 37 -7.698 13.665 -6.933 1.00 0.00 C ATOM 539 OE1 GLU A 37 -8.594 14.533 -6.967 1.00 0.00 O ATOM 540 OE2 GLU A 37 -6.560 13.836 -7.419 1.00 0.00 O ATOM 0 H GLU A 37 -6.591 10.842 -3.859 1.00 0.00 H new ATOM 0 HA GLU A 37 -6.415 13.603 -4.604 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.582 11.512 -4.384 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.026 13.193 -4.599 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.180 11.645 -6.450 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -8.891 11.899 -6.732 1.00 0.00 H new ATOM 547 N SER A 38 -7.576 12.792 -1.650 1.00 0.00 N ATOM 548 CA SER A 38 -7.970 13.324 -0.352 1.00 0.00 C ATOM 549 C SER A 38 -6.886 14.236 0.214 1.00 0.00 C ATOM 550 O SER A 38 -5.737 14.204 -0.229 1.00 0.00 O ATOM 551 CB SER A 38 -8.253 12.182 0.627 1.00 0.00 C ATOM 552 OG SER A 38 -7.073 11.785 1.303 1.00 0.00 O ATOM 0 H SER A 38 -7.459 11.779 -1.673 1.00 0.00 H new ATOM 0 HA SER A 38 -8.879 13.910 -0.489 1.00 0.00 H new ATOM 0 HB2 SER A 38 -9.002 12.498 1.353 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.670 11.332 0.088 1.00 0.00 H new ATOM 0 HG SER A 38 -6.421 11.448 0.653 1.00 0.00 H new ATOM 558 N THR A 39 -7.259 15.050 1.197 1.00 0.00 N ATOM 559 CA THR A 39 -6.320 15.971 1.824 1.00 0.00 C ATOM 560 C THR A 39 -5.951 15.510 3.229 1.00 0.00 C ATOM 561 O THR A 39 -4.886 15.850 3.743 1.00 0.00 O ATOM 562 CB THR A 39 -6.898 17.397 1.899 1.00 0.00 C ATOM 563 OG1 THR A 39 -8.048 17.415 2.752 1.00 0.00 O ATOM 564 CG2 THR A 39 -7.278 17.901 0.515 1.00 0.00 C ATOM 0 H THR A 39 -8.205 15.090 1.576 1.00 0.00 H new ATOM 0 HA THR A 39 -5.425 15.981 1.202 1.00 0.00 H new ATOM 0 HB THR A 39 -6.132 18.055 2.309 1.00 0.00 H new ATOM 0 HG1 THR A 39 -8.409 18.325 2.796 1.00 0.00 H new ATOM 0 HG21 THR A 39 -7.684 18.910 0.594 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.394 17.914 -0.123 1.00 0.00 H new ATOM 0 HG23 THR A 39 -8.029 17.241 0.081 1.00 0.00 H new ATOM 572 N GLU A 40 -6.837 14.733 3.844 1.00 0.00 N ATOM 573 CA GLU A 40 -6.603 14.226 5.191 1.00 0.00 C ATOM 574 C GLU A 40 -6.208 12.753 5.156 1.00 0.00 C ATOM 575 O GLU A 40 -6.916 11.923 4.586 1.00 0.00 O ATOM 576 CB GLU A 40 -7.853 14.411 6.054 1.00 0.00 C ATOM 577 CG GLU A 40 -8.255 15.864 6.242 1.00 0.00 C ATOM 578 CD GLU A 40 -7.573 16.508 7.433 1.00 0.00 C ATOM 579 OE1 GLU A 40 -6.347 16.324 7.586 1.00 0.00 O ATOM 580 OE2 GLU A 40 -8.265 17.195 8.213 1.00 0.00 O ATOM 0 H GLU A 40 -7.723 14.441 3.431 1.00 0.00 H new ATOM 0 HA GLU A 40 -5.782 14.794 5.628 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -8.682 13.870 5.598 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.679 13.962 7.032 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -8.009 16.425 5.340 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -9.336 15.924 6.370 1.00 0.00 H new ATOM 587 N ASP A 41 -5.073 12.436 5.769 1.00 0.00 N ATOM 588 CA ASP A 41 -4.583 11.063 5.810 1.00 0.00 C ATOM 589 C ASP A 41 -5.031 10.364 7.089 1.00 0.00 C ATOM 590 O ASP A 41 -4.206 9.911 7.882 1.00 0.00 O ATOM 591 CB ASP A 41 -3.057 11.040 5.708 1.00 0.00 C ATOM 592 CG ASP A 41 -2.571 11.087 4.273 1.00 0.00 C ATOM 593 OD1 ASP A 41 -2.554 12.190 3.689 1.00 0.00 O ATOM 594 OD2 ASP A 41 -2.208 10.020 3.734 1.00 0.00 O ATOM 0 H ASP A 41 -4.475 13.111 6.245 1.00 0.00 H new ATOM 0 HA ASP A 41 -5.004 10.528 4.959 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -2.647 11.889 6.255 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -2.677 10.138 6.188 1.00 0.00 H new ATOM 599 N VAL A 42 -6.343 10.279 7.283 1.00 0.00 N ATOM 600 CA VAL A 42 -6.902 9.635 8.466 1.00 0.00 C ATOM 601 C VAL A 42 -6.778 8.118 8.376 1.00 0.00 C ATOM 602 O VAL A 42 -6.794 7.546 7.285 1.00 0.00 O ATOM 603 CB VAL A 42 -8.383 10.007 8.661 1.00 0.00 C ATOM 604 CG1 VAL A 42 -8.539 11.512 8.823 1.00 0.00 C ATOM 605 CG2 VAL A 42 -9.218 9.498 7.496 1.00 0.00 C ATOM 0 H VAL A 42 -7.039 10.648 6.636 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.330 9.994 9.322 1.00 0.00 H new ATOM 0 HB VAL A 42 -8.743 9.529 9.572 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -9.593 11.756 8.960 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -7.974 11.845 9.693 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -8.163 12.015 7.932 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.262 9.770 7.651 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -8.860 9.945 6.569 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -9.131 8.413 7.433 1.00 0.00 H new ATOM 615 N THR A 43 -6.654 7.470 9.530 1.00 0.00 N ATOM 616 CA THR A 43 -6.527 6.019 9.581 1.00 0.00 C ATOM 617 C THR A 43 -7.868 5.360 9.882 1.00 0.00 C ATOM 618 O THR A 43 -8.405 5.497 10.980 1.00 0.00 O ATOM 619 CB THR A 43 -5.503 5.582 10.646 1.00 0.00 C ATOM 620 OG1 THR A 43 -4.245 6.223 10.408 1.00 0.00 O ATOM 621 CG2 THR A 43 -5.320 4.073 10.634 1.00 0.00 C ATOM 0 H THR A 43 -6.639 7.927 10.442 1.00 0.00 H new ATOM 0 HA THR A 43 -6.179 5.697 8.599 1.00 0.00 H new ATOM 0 HB THR A 43 -5.881 5.878 11.625 1.00 0.00 H new ATOM 0 HG1 THR A 43 -3.600 5.941 11.090 1.00 0.00 H new ATOM 0 HG21 THR A 43 -4.593 3.789 11.394 1.00 0.00 H new ATOM 0 HG22 THR A 43 -6.274 3.589 10.845 1.00 0.00 H new ATOM 0 HG23 THR A 43 -4.962 3.758 9.654 1.00 0.00 H new ATOM 629 N TRP A 44 -8.403 4.644 8.899 1.00 0.00 N ATOM 630 CA TRP A 44 -9.683 3.963 9.060 1.00 0.00 C ATOM 631 C TRP A 44 -9.486 2.455 9.178 1.00 0.00 C ATOM 632 O TRP A 44 -8.759 1.879 8.370 1.00 0.00 O ATOM 633 CB TRP A 44 -10.603 4.278 7.879 1.00 0.00 C ATOM 634 CG TRP A 44 -10.112 3.721 6.577 1.00 0.00 C ATOM 635 CD1 TRP A 44 -10.488 2.543 5.996 1.00 0.00 C ATOM 636 CD2 TRP A 44 -9.154 4.317 5.697 1.00 0.00 C ATOM 637 NE1 TRP A 44 -9.820 2.372 4.807 1.00 0.00 N ATOM 638 CE2 TRP A 44 -8.997 3.447 4.601 1.00 0.00 C ATOM 639 CE3 TRP A 44 -8.415 5.503 5.726 1.00 0.00 C ATOM 640 CZ2 TRP A 44 -8.131 3.726 3.547 1.00 0.00 C ATOM 641 CZ3 TRP A 44 -7.556 5.778 4.680 1.00 0.00 C ATOM 642 CH2 TRP A 44 -7.421 4.894 3.602 1.00 0.00 C ATOM 0 H TRP A 44 -7.971 4.520 7.983 1.00 0.00 H new ATOM 0 HA TRP A 44 -10.146 4.324 9.979 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -11.596 3.879 8.085 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -10.707 5.359 7.787 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -11.204 1.849 6.410 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -9.921 1.574 4.180 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -8.514 6.192 6.552 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -8.024 3.045 2.716 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -6.978 6.690 4.694 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -6.743 5.139 2.798 1.00 0.00 H new ATOM 654 N SER B 99 15.694 -14.661 7.323 1.00 0.00 N ATOM 655 CA SER B 99 14.683 -14.874 6.293 1.00 0.00 C ATOM 656 C SER B 99 14.236 -13.547 5.688 1.00 0.00 C ATOM 657 O SER B 99 13.928 -12.595 6.407 1.00 0.00 O ATOM 658 CB SER B 99 13.477 -15.612 6.879 1.00 0.00 C ATOM 659 OG SER B 99 12.836 -14.833 7.874 1.00 0.00 O ATOM 0 HA SER B 99 15.125 -15.482 5.504 1.00 0.00 H new ATOM 0 HB2 SER B 99 12.769 -15.846 6.084 1.00 0.00 H new ATOM 0 HB3 SER B 99 13.800 -16.561 7.308 1.00 0.00 H new ATOM 0 HG SER B 99 13.504 -14.296 8.349 1.00 0.00 H new ATOM 665 N HIS B 100 14.203 -13.491 4.360 1.00 0.00 N ATOM 666 CA HIS B 100 13.794 -12.281 3.656 1.00 0.00 C ATOM 667 C HIS B 100 12.616 -12.564 2.728 1.00 0.00 C ATOM 668 O HIS B 100 12.680 -13.459 1.885 1.00 0.00 O ATOM 669 CB HIS B 100 14.964 -11.711 2.854 1.00 0.00 C ATOM 670 CG HIS B 100 14.926 -10.220 2.716 1.00 0.00 C ATOM 671 ND1 HIS B 100 16.045 -9.424 2.844 1.00 0.00 N ATOM 672 CD2 HIS B 100 13.896 -9.381 2.457 1.00 0.00 C ATOM 673 CE1 HIS B 100 15.705 -8.160 2.672 1.00 0.00 C ATOM 674 NE2 HIS B 100 14.405 -8.106 2.435 1.00 0.00 N ATOM 0 H HIS B 100 14.454 -14.269 3.750 1.00 0.00 H new ATOM 0 HA HIS B 100 13.481 -11.547 4.399 1.00 0.00 H new ATOM 0 HB2 HIS B 100 15.898 -11.999 3.335 1.00 0.00 H new ATOM 0 HB3 HIS B 100 14.966 -12.160 1.861 1.00 0.00 H new ATOM 0 HD1 HIS B 100 16.988 -9.759 3.041 1.00 0.00 H new ATOM 0 HD2 HIS B 100 12.866 -9.662 2.297 1.00 0.00 H new ATOM 0 HE1 HIS B 100 16.375 -7.314 2.717 1.00 0.00 H new ATOM 682 N MET B 101 11.543 -11.797 2.891 1.00 0.00 N ATOM 683 CA MET B 101 10.352 -11.966 2.067 1.00 0.00 C ATOM 684 C MET B 101 10.292 -10.905 0.973 1.00 0.00 C ATOM 685 O MET B 101 10.871 -9.828 1.109 1.00 0.00 O ATOM 686 CB MET B 101 9.093 -11.894 2.933 1.00 0.00 C ATOM 687 CG MET B 101 8.890 -10.544 3.599 1.00 0.00 C ATOM 688 SD MET B 101 7.276 -10.394 4.389 1.00 0.00 S ATOM 689 CE MET B 101 6.979 -8.635 4.224 1.00 0.00 C ATOM 0 H MET B 101 11.474 -11.053 3.585 1.00 0.00 H new ATOM 0 HA MET B 101 10.404 -12.947 1.594 1.00 0.00 H new ATOM 0 HB2 MET B 101 8.224 -12.119 2.315 1.00 0.00 H new ATOM 0 HB3 MET B 101 9.146 -12.665 3.702 1.00 0.00 H new ATOM 0 HG2 MET B 101 9.670 -10.390 4.344 1.00 0.00 H new ATOM 0 HG3 MET B 101 9.000 -9.756 2.854 1.00 0.00 H new ATOM 0 HE1 MET B 101 6.098 -8.359 4.803 1.00 0.00 H new ATOM 0 HE2 MET B 101 7.844 -8.084 4.594 1.00 0.00 H new ATOM 0 HE3 MET B 101 6.815 -8.391 3.175 1.00 0.00 H new ATOM 699 N GLN B 102 9.589 -11.218 -0.111 1.00 0.00 N ATOM 700 CA GLN B 102 9.456 -10.290 -1.228 1.00 0.00 C ATOM 701 C GLN B 102 8.081 -9.631 -1.227 1.00 0.00 C ATOM 702 O GLN B 102 7.117 -10.184 -0.697 1.00 0.00 O ATOM 703 CB GLN B 102 9.684 -11.019 -2.554 1.00 0.00 C ATOM 704 CG GLN B 102 10.073 -10.095 -3.697 1.00 0.00 C ATOM 705 CD GLN B 102 10.935 -10.784 -4.736 1.00 0.00 C ATOM 706 OE1 GLN B 102 12.073 -11.164 -4.461 1.00 0.00 O ATOM 707 NE2 GLN B 102 10.395 -10.949 -5.938 1.00 0.00 N ATOM 0 H GLN B 102 9.103 -12.106 -0.239 1.00 0.00 H new ATOM 0 HA GLN B 102 10.212 -9.513 -1.114 1.00 0.00 H new ATOM 0 HB2 GLN B 102 10.467 -11.766 -2.419 1.00 0.00 H new ATOM 0 HB3 GLN B 102 8.775 -11.556 -2.825 1.00 0.00 H new ATOM 0 HG2 GLN B 102 9.170 -9.714 -4.174 1.00 0.00 H new ATOM 0 HG3 GLN B 102 10.610 -9.235 -3.297 1.00 0.00 H new ATOM 0 HE21 GLN B 102 9.448 -10.618 -6.121 1.00 0.00 H new ATOM 0 HE22 GLN B 102 10.927 -11.407 -6.678 1.00 0.00 H new ATOM 716 N ILE B 103 7.998 -8.446 -1.822 1.00 0.00 N ATOM 717 CA ILE B 103 6.741 -7.712 -1.890 1.00 0.00 C ATOM 718 C ILE B 103 6.648 -6.897 -3.176 1.00 0.00 C ATOM 719 O ILE B 103 7.664 -6.534 -3.768 1.00 0.00 O ATOM 720 CB ILE B 103 6.573 -6.768 -0.685 1.00 0.00 C ATOM 721 CG1 ILE B 103 7.710 -5.745 -0.649 1.00 0.00 C ATOM 722 CG2 ILE B 103 6.531 -7.566 0.610 1.00 0.00 C ATOM 723 CD1 ILE B 103 7.464 -4.601 0.309 1.00 0.00 C ATOM 0 H ILE B 103 8.787 -7.974 -2.264 1.00 0.00 H new ATOM 0 HA ILE B 103 5.943 -8.454 -1.874 1.00 0.00 H new ATOM 0 HB ILE B 103 5.630 -6.232 -0.790 1.00 0.00 H new ATOM 0 HG12 ILE B 103 8.634 -6.251 -0.368 1.00 0.00 H new ATOM 0 HG13 ILE B 103 7.858 -5.343 -1.651 1.00 0.00 H new ATOM 0 HG21 ILE B 103 6.412 -6.885 1.453 1.00 0.00 H new ATOM 0 HG22 ILE B 103 5.691 -8.260 0.583 1.00 0.00 H new ATOM 0 HG23 ILE B 103 7.460 -8.125 0.723 1.00 0.00 H new ATOM 0 HD11 ILE B 103 8.311 -3.915 0.282 1.00 0.00 H new ATOM 0 HD12 ILE B 103 6.558 -4.070 0.017 1.00 0.00 H new ATOM 0 HD13 ILE B 103 7.346 -4.992 1.320 1.00 0.00 H new ATOM 735 N PHE B 104 5.422 -6.611 -3.602 1.00 0.00 N ATOM 736 CA PHE B 104 5.196 -5.838 -4.818 1.00 0.00 C ATOM 737 C PHE B 104 4.368 -4.591 -4.523 1.00 0.00 C ATOM 738 O PHE B 104 3.462 -4.616 -3.690 1.00 0.00 O ATOM 739 CB PHE B 104 4.490 -6.697 -5.869 1.00 0.00 C ATOM 740 CG PHE B 104 5.203 -7.984 -6.170 1.00 0.00 C ATOM 741 CD1 PHE B 104 5.029 -9.093 -5.357 1.00 0.00 C ATOM 742 CD2 PHE B 104 6.047 -8.086 -7.264 1.00 0.00 C ATOM 743 CE1 PHE B 104 5.683 -10.280 -5.630 1.00 0.00 C ATOM 744 CE2 PHE B 104 6.703 -9.270 -7.542 1.00 0.00 C ATOM 745 CZ PHE B 104 6.521 -10.367 -6.725 1.00 0.00 C ATOM 0 H PHE B 104 4.570 -6.903 -3.123 1.00 0.00 H new ATOM 0 HA PHE B 104 6.165 -5.525 -5.206 1.00 0.00 H new ATOM 0 HB2 PHE B 104 3.481 -6.922 -5.524 1.00 0.00 H new ATOM 0 HB3 PHE B 104 4.391 -6.122 -6.790 1.00 0.00 H new ATOM 0 HD1 PHE B 104 4.375 -9.029 -4.500 1.00 0.00 H new ATOM 0 HD2 PHE B 104 6.194 -7.231 -7.907 1.00 0.00 H new ATOM 0 HE1 PHE B 104 5.539 -11.137 -4.989 1.00 0.00 H new ATOM 0 HE2 PHE B 104 7.358 -9.337 -8.398 1.00 0.00 H new ATOM 0 HZ PHE B 104 7.033 -11.293 -6.941 1.00 0.00 H new ATOM 755 N VAL B 105 4.686 -3.500 -5.213 1.00 0.00 N ATOM 756 CA VAL B 105 3.972 -2.243 -5.026 1.00 0.00 C ATOM 757 C VAL B 105 3.702 -1.561 -6.362 1.00 0.00 C ATOM 758 O VAL B 105 4.627 -1.129 -7.051 1.00 0.00 O ATOM 759 CB VAL B 105 4.761 -1.278 -4.120 1.00 0.00 C ATOM 760 CG1 VAL B 105 3.954 -0.017 -3.852 1.00 0.00 C ATOM 761 CG2 VAL B 105 5.142 -1.965 -2.817 1.00 0.00 C ATOM 0 H VAL B 105 5.433 -3.462 -5.906 1.00 0.00 H new ATOM 0 HA VAL B 105 3.024 -2.486 -4.547 1.00 0.00 H new ATOM 0 HB VAL B 105 5.678 -0.990 -4.635 1.00 0.00 H new ATOM 0 HG11 VAL B 105 4.527 0.652 -3.211 1.00 0.00 H new ATOM 0 HG12 VAL B 105 3.736 0.483 -4.796 1.00 0.00 H new ATOM 0 HG13 VAL B 105 3.019 -0.281 -3.357 1.00 0.00 H new ATOM 0 HG21 VAL B 105 5.699 -1.270 -2.188 1.00 0.00 H new ATOM 0 HG22 VAL B 105 4.239 -2.282 -2.295 1.00 0.00 H new ATOM 0 HG23 VAL B 105 5.762 -2.836 -3.032 1.00 0.00 H new ATOM 771 N LYS B 106 2.427 -1.465 -6.725 1.00 0.00 N ATOM 772 CA LYS B 106 2.033 -0.833 -7.978 1.00 0.00 C ATOM 773 C LYS B 106 1.572 0.601 -7.743 1.00 0.00 C ATOM 774 O LYS B 106 1.001 0.918 -6.699 1.00 0.00 O ATOM 775 CB LYS B 106 0.915 -1.636 -8.648 1.00 0.00 C ATOM 776 CG LYS B 106 0.263 -0.916 -9.815 1.00 0.00 C ATOM 777 CD LYS B 106 -0.314 -1.894 -10.823 1.00 0.00 C ATOM 778 CE LYS B 106 -1.660 -1.422 -11.350 1.00 0.00 C ATOM 779 NZ LYS B 106 -1.918 -1.912 -12.733 1.00 0.00 N ATOM 0 H LYS B 106 1.649 -1.817 -6.168 1.00 0.00 H new ATOM 0 HA LYS B 106 2.902 -0.813 -8.635 1.00 0.00 H new ATOM 0 HB2 LYS B 106 1.321 -2.585 -8.999 1.00 0.00 H new ATOM 0 HB3 LYS B 106 0.153 -1.871 -7.905 1.00 0.00 H new ATOM 0 HG2 LYS B 106 -0.529 -0.265 -9.445 1.00 0.00 H new ATOM 0 HG3 LYS B 106 0.998 -0.278 -10.306 1.00 0.00 H new ATOM 0 HD2 LYS B 106 0.381 -2.014 -11.654 1.00 0.00 H new ATOM 0 HD3 LYS B 106 -0.427 -2.873 -10.358 1.00 0.00 H new ATOM 0 HE2 LYS B 106 -2.452 -1.771 -10.687 1.00 0.00 H new ATOM 0 HE3 LYS B 106 -1.692 -0.333 -11.339 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 -2.459 -1.197 -13.259 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 -1.013 -2.085 -13.215 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 -2.463 -2.797 -12.692 1.00 0.00 H new ATOM 793 N THR B 107 1.823 1.466 -8.722 1.00 0.00 N ATOM 794 CA THR B 107 1.434 2.867 -8.621 1.00 0.00 C ATOM 795 C THR B 107 0.146 3.137 -9.392 1.00 0.00 C ATOM 796 O THR B 107 -0.420 2.234 -10.010 1.00 0.00 O ATOM 797 CB THR B 107 2.541 3.797 -9.152 1.00 0.00 C ATOM 798 OG1 THR B 107 2.770 3.542 -10.543 1.00 0.00 O ATOM 799 CG2 THR B 107 3.833 3.598 -8.376 1.00 0.00 C ATOM 0 H THR B 107 2.294 1.220 -9.593 1.00 0.00 H new ATOM 0 HA THR B 107 1.272 3.074 -7.563 1.00 0.00 H new ATOM 0 HB THR B 107 2.212 4.828 -9.021 1.00 0.00 H new ATOM 0 HG1 THR B 107 3.639 3.912 -10.805 1.00 0.00 H new ATOM 0 HG21 THR B 107 4.600 4.265 -8.769 1.00 0.00 H new ATOM 0 HG22 THR B 107 3.663 3.821 -7.323 1.00 0.00 H new ATOM 0 HG23 THR B 107 4.164 2.565 -8.479 1.00 0.00 H new ATOM 807 N LEU B 108 -0.311 4.383 -9.352 1.00 0.00 N ATOM 808 CA LEU B 108 -1.533 4.772 -10.048 1.00 0.00 C ATOM 809 C LEU B 108 -1.304 4.834 -11.555 1.00 0.00 C ATOM 810 O LEU B 108 -2.250 4.965 -12.332 1.00 0.00 O ATOM 811 CB LEU B 108 -2.023 6.129 -9.539 1.00 0.00 C ATOM 812 CG LEU B 108 -3.037 6.089 -8.394 1.00 0.00 C ATOM 813 CD1 LEU B 108 -2.355 5.698 -7.092 1.00 0.00 C ATOM 814 CD2 LEU B 108 -3.731 7.435 -8.251 1.00 0.00 C ATOM 0 H LEU B 108 0.146 5.141 -8.845 1.00 0.00 H new ATOM 0 HA LEU B 108 -2.294 4.018 -9.845 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -1.158 6.706 -9.212 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -2.469 6.669 -10.374 1.00 0.00 H new ATOM 0 HG LEU B 108 -3.791 5.336 -8.626 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -3.091 5.675 -6.288 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -1.904 4.712 -7.200 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -1.581 6.427 -6.854 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -4.449 7.389 -7.432 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -2.990 8.206 -8.041 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -4.252 7.676 -9.177 1.00 0.00 H new ATOM 826 N THR B 109 -0.043 4.736 -11.962 1.00 0.00 N ATOM 827 CA THR B 109 0.310 4.781 -13.375 1.00 0.00 C ATOM 828 C THR B 109 0.329 3.382 -13.981 1.00 0.00 C ATOM 829 O THR B 109 0.374 3.224 -15.200 1.00 0.00 O ATOM 830 CB THR B 109 1.686 5.439 -13.590 1.00 0.00 C ATOM 831 OG1 THR B 109 2.714 4.626 -13.014 1.00 0.00 O ATOM 832 CG2 THR B 109 1.724 6.828 -12.972 1.00 0.00 C ATOM 0 H THR B 109 0.752 4.625 -11.332 1.00 0.00 H new ATOM 0 HA THR B 109 -0.453 5.380 -13.872 1.00 0.00 H new ATOM 0 HB THR B 109 1.856 5.531 -14.663 1.00 0.00 H new ATOM 0 HG1 THR B 109 2.390 4.234 -12.176 1.00 0.00 H new ATOM 0 HG21 THR B 109 2.705 7.273 -13.137 1.00 0.00 H new ATOM 0 HG22 THR B 109 0.960 7.453 -13.435 1.00 0.00 H new ATOM 0 HG23 THR B 109 1.534 6.755 -11.901 1.00 0.00 H new ATOM 840 N GLY B 110 0.291 2.369 -13.121 1.00 0.00 N ATOM 841 CA GLY B 110 0.303 0.996 -13.591 1.00 0.00 C ATOM 842 C GLY B 110 1.635 0.312 -13.349 1.00 0.00 C ATOM 843 O GLY B 110 1.711 -0.915 -13.301 1.00 0.00 O ATOM 0 H GLY B 110 0.252 2.475 -12.107 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -0.486 0.436 -13.089 1.00 0.00 H new ATOM 0 HA3 GLY B 110 0.077 0.978 -14.657 1.00 0.00 H new ATOM 847 N LYS B 111 2.687 1.108 -13.198 1.00 0.00 N ATOM 848 CA LYS B 111 4.023 0.574 -12.960 1.00 0.00 C ATOM 849 C LYS B 111 4.016 -0.411 -11.797 1.00 0.00 C ATOM 850 O LYS B 111 3.318 -0.209 -10.802 1.00 0.00 O ATOM 851 CB LYS B 111 5.007 1.711 -12.674 1.00 0.00 C ATOM 852 CG LYS B 111 6.427 1.237 -12.419 1.00 0.00 C ATOM 853 CD LYS B 111 7.429 2.369 -12.575 1.00 0.00 C ATOM 854 CE LYS B 111 7.198 3.464 -11.546 1.00 0.00 C ATOM 855 NZ LYS B 111 7.152 2.922 -10.160 1.00 0.00 N ATOM 0 H LYS B 111 2.641 2.126 -13.236 1.00 0.00 H new ATOM 0 HA LYS B 111 4.340 0.045 -13.859 1.00 0.00 H new ATOM 0 HB2 LYS B 111 5.009 2.400 -13.519 1.00 0.00 H new ATOM 0 HB3 LYS B 111 4.659 2.272 -11.807 1.00 0.00 H new ATOM 0 HG2 LYS B 111 6.498 0.823 -11.413 1.00 0.00 H new ATOM 0 HG3 LYS B 111 6.674 0.433 -13.113 1.00 0.00 H new ATOM 0 HD2 LYS B 111 8.441 1.978 -12.470 1.00 0.00 H new ATOM 0 HD3 LYS B 111 7.352 2.789 -13.578 1.00 0.00 H new ATOM 0 HE2 LYS B 111 7.994 4.205 -11.620 1.00 0.00 H new ATOM 0 HE3 LYS B 111 6.262 3.978 -11.766 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 7.163 3.708 -9.479 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 6.282 2.367 -10.033 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 7.979 2.312 -9.998 1.00 0.00 H new ATOM 869 N THR B 112 4.798 -1.479 -11.926 1.00 0.00 N ATOM 870 CA THR B 112 4.881 -2.495 -10.884 1.00 0.00 C ATOM 871 C THR B 112 6.301 -2.610 -10.340 1.00 0.00 C ATOM 872 O THR B 112 7.229 -2.955 -11.071 1.00 0.00 O ATOM 873 CB THR B 112 4.431 -3.873 -11.406 1.00 0.00 C ATOM 874 OG1 THR B 112 3.233 -3.736 -12.178 1.00 0.00 O ATOM 875 CG2 THR B 112 4.192 -4.836 -10.254 1.00 0.00 C ATOM 0 H THR B 112 5.382 -1.662 -12.742 1.00 0.00 H new ATOM 0 HA THR B 112 4.212 -2.181 -10.083 1.00 0.00 H new ATOM 0 HB THR B 112 5.224 -4.276 -12.036 1.00 0.00 H new ATOM 0 HG1 THR B 112 2.954 -4.616 -12.508 1.00 0.00 H new ATOM 0 HG21 THR B 112 3.875 -5.802 -10.647 1.00 0.00 H new ATOM 0 HG22 THR B 112 5.114 -4.960 -9.686 1.00 0.00 H new ATOM 0 HG23 THR B 112 3.415 -4.437 -9.602 1.00 0.00 H new ATOM 883 N ILE B 113 6.462 -2.318 -9.054 1.00 0.00 N ATOM 884 CA ILE B 113 7.768 -2.390 -8.412 1.00 0.00 C ATOM 885 C ILE B 113 7.904 -3.662 -7.581 1.00 0.00 C ATOM 886 O ILE B 113 6.999 -4.025 -6.828 1.00 0.00 O ATOM 887 CB ILE B 113 8.019 -1.170 -7.506 1.00 0.00 C ATOM 888 CG1 ILE B 113 7.837 0.126 -8.298 1.00 0.00 C ATOM 889 CG2 ILE B 113 9.414 -1.237 -6.902 1.00 0.00 C ATOM 890 CD1 ILE B 113 8.054 1.374 -7.472 1.00 0.00 C ATOM 0 H ILE B 113 5.704 -2.029 -8.436 1.00 0.00 H new ATOM 0 HA ILE B 113 8.510 -2.399 -9.210 1.00 0.00 H new ATOM 0 HB ILE B 113 7.292 -1.183 -6.694 1.00 0.00 H new ATOM 0 HG12 ILE B 113 8.532 0.130 -9.137 1.00 0.00 H new ATOM 0 HG13 ILE B 113 6.831 0.148 -8.717 1.00 0.00 H new ATOM 0 HG21 ILE B 113 9.576 -0.368 -6.264 1.00 0.00 H new ATOM 0 HG22 ILE B 113 9.510 -2.146 -6.308 1.00 0.00 H new ATOM 0 HG23 ILE B 113 10.156 -1.245 -7.700 1.00 0.00 H new ATOM 0 HD11 ILE B 113 7.909 2.254 -8.098 1.00 0.00 H new ATOM 0 HD12 ILE B 113 7.341 1.393 -6.648 1.00 0.00 H new ATOM 0 HD13 ILE B 113 9.069 1.375 -7.074 1.00 0.00 H new ATOM 902 N THR B 114 9.041 -4.337 -7.722 1.00 0.00 N ATOM 903 CA THR B 114 9.295 -5.568 -6.985 1.00 0.00 C ATOM 904 C THR B 114 10.517 -5.427 -6.085 1.00 0.00 C ATOM 905 O THR B 114 11.649 -5.352 -6.565 1.00 0.00 O ATOM 906 CB THR B 114 9.509 -6.760 -7.938 1.00 0.00 C ATOM 907 OG1 THR B 114 8.342 -6.957 -8.744 1.00 0.00 O ATOM 908 CG2 THR B 114 9.812 -8.029 -7.158 1.00 0.00 C ATOM 0 H THR B 114 9.800 -4.051 -8.340 1.00 0.00 H new ATOM 0 HA THR B 114 8.414 -5.756 -6.371 1.00 0.00 H new ATOM 0 HB THR B 114 10.361 -6.535 -8.580 1.00 0.00 H new ATOM 0 HG1 THR B 114 7.801 -7.681 -8.365 1.00 0.00 H new ATOM 0 HG21 THR B 114 9.959 -8.856 -7.852 1.00 0.00 H new ATOM 0 HG22 THR B 114 10.717 -7.886 -6.567 1.00 0.00 H new ATOM 0 HG23 THR B 114 8.978 -8.256 -6.494 1.00 0.00 H new ATOM 916 N LEU B 115 10.282 -5.391 -4.778 1.00 0.00 N ATOM 917 CA LEU B 115 11.365 -5.259 -3.810 1.00 0.00 C ATOM 918 C LEU B 115 11.201 -6.260 -2.670 1.00 0.00 C ATOM 919 O LEU B 115 10.164 -6.911 -2.549 1.00 0.00 O ATOM 920 CB LEU B 115 11.408 -3.836 -3.251 1.00 0.00 C ATOM 921 CG LEU B 115 12.151 -2.804 -4.100 1.00 0.00 C ATOM 922 CD1 LEU B 115 11.877 -1.397 -3.591 1.00 0.00 C ATOM 923 CD2 LEU B 115 13.645 -3.092 -4.102 1.00 0.00 C ATOM 0 H LEU B 115 9.352 -5.451 -4.364 1.00 0.00 H new ATOM 0 HA LEU B 115 12.304 -5.469 -4.323 1.00 0.00 H new ATOM 0 HB2 LEU B 115 10.384 -3.491 -3.110 1.00 0.00 H new ATOM 0 HB3 LEU B 115 11.872 -3.868 -2.265 1.00 0.00 H new ATOM 0 HG LEU B 115 11.787 -2.874 -5.125 1.00 0.00 H new ATOM 0 HD11 LEU B 115 12.414 -0.676 -4.207 1.00 0.00 H new ATOM 0 HD12 LEU B 115 10.807 -1.193 -3.643 1.00 0.00 H new ATOM 0 HD13 LEU B 115 12.213 -1.312 -2.558 1.00 0.00 H new ATOM 0 HD21 LEU B 115 14.158 -2.348 -4.711 1.00 0.00 H new ATOM 0 HD22 LEU B 115 14.025 -3.050 -3.081 1.00 0.00 H new ATOM 0 HD23 LEU B 115 13.824 -4.085 -4.515 1.00 0.00 H new ATOM 935 N GLU B 116 12.230 -6.374 -1.837 1.00 0.00 N ATOM 936 CA GLU B 116 12.198 -7.295 -0.706 1.00 0.00 C ATOM 937 C GLU B 116 12.140 -6.532 0.615 1.00 0.00 C ATOM 938 O GLU B 116 12.675 -5.430 0.733 1.00 0.00 O ATOM 939 CB GLU B 116 13.427 -8.206 -0.727 1.00 0.00 C ATOM 940 CG GLU B 116 13.728 -8.791 -2.097 1.00 0.00 C ATOM 941 CD GLU B 116 14.666 -9.980 -2.030 1.00 0.00 C ATOM 942 OE1 GLU B 116 14.179 -11.107 -1.798 1.00 0.00 O ATOM 943 OE2 GLU B 116 15.886 -9.785 -2.208 1.00 0.00 O ATOM 0 H GLU B 116 13.095 -5.841 -1.923 1.00 0.00 H new ATOM 0 HA GLU B 116 11.300 -7.906 -0.793 1.00 0.00 H new ATOM 0 HB2 GLU B 116 14.294 -7.641 -0.384 1.00 0.00 H new ATOM 0 HB3 GLU B 116 13.277 -9.021 -0.018 1.00 0.00 H new ATOM 0 HG2 GLU B 116 12.795 -9.095 -2.571 1.00 0.00 H new ATOM 0 HG3 GLU B 116 14.169 -8.020 -2.728 1.00 0.00 H new ATOM 950 N VAL B 117 11.485 -7.127 1.606 1.00 0.00 N ATOM 951 CA VAL B 117 11.355 -6.506 2.919 1.00 0.00 C ATOM 952 C VAL B 117 11.372 -7.553 4.026 1.00 0.00 C ATOM 953 O VAL B 117 11.146 -8.736 3.779 1.00 0.00 O ATOM 954 CB VAL B 117 10.058 -5.682 3.025 1.00 0.00 C ATOM 955 CG1 VAL B 117 10.120 -4.467 2.112 1.00 0.00 C ATOM 956 CG2 VAL B 117 8.851 -6.546 2.694 1.00 0.00 C ATOM 0 H VAL B 117 11.036 -8.039 1.525 1.00 0.00 H new ATOM 0 HA VAL B 117 12.209 -5.840 3.040 1.00 0.00 H new ATOM 0 HB VAL B 117 9.955 -5.330 4.051 1.00 0.00 H new ATOM 0 HG11 VAL B 117 9.195 -3.898 2.201 1.00 0.00 H new ATOM 0 HG12 VAL B 117 10.962 -3.838 2.400 1.00 0.00 H new ATOM 0 HG13 VAL B 117 10.247 -4.794 1.080 1.00 0.00 H new ATOM 0 HG21 VAL B 117 7.943 -5.948 2.774 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.945 -6.929 1.678 1.00 0.00 H new ATOM 0 HG23 VAL B 117 8.798 -7.381 3.393 1.00 0.00 H new ATOM 966 N GLU B 118 11.642 -7.108 5.251 1.00 0.00 N ATOM 967 CA GLU B 118 11.688 -8.008 6.397 1.00 0.00 C ATOM 968 C GLU B 118 10.437 -7.855 7.258 1.00 0.00 C ATOM 969 O GLU B 118 9.723 -6.856 7.189 1.00 0.00 O ATOM 970 CB GLU B 118 12.936 -7.734 7.237 1.00 0.00 C ATOM 971 CG GLU B 118 14.127 -8.598 6.856 1.00 0.00 C ATOM 972 CD GLU B 118 15.065 -8.845 8.022 1.00 0.00 C ATOM 973 OE1 GLU B 118 15.012 -8.070 9.001 1.00 0.00 O ATOM 974 OE2 GLU B 118 15.854 -9.811 7.956 1.00 0.00 O ATOM 0 H GLU B 118 11.832 -6.131 5.474 1.00 0.00 H new ATOM 0 HA GLU B 118 11.728 -9.031 6.023 1.00 0.00 H new ATOM 0 HB2 GLU B 118 13.211 -6.684 7.133 1.00 0.00 H new ATOM 0 HB3 GLU B 118 12.700 -7.899 8.288 1.00 0.00 H new ATOM 0 HG2 GLU B 118 13.770 -9.554 6.473 1.00 0.00 H new ATOM 0 HG3 GLU B 118 14.677 -8.116 6.048 1.00 0.00 H new ATOM 981 N PRO B 119 10.167 -8.871 8.092 1.00 0.00 N ATOM 982 CA PRO B 119 9.003 -8.874 8.984 1.00 0.00 C ATOM 983 C PRO B 119 9.133 -7.855 10.111 1.00 0.00 C ATOM 984 O PRO B 119 8.136 -7.416 10.682 1.00 0.00 O ATOM 985 CB PRO B 119 8.993 -10.298 9.548 1.00 0.00 C ATOM 986 CG PRO B 119 10.408 -10.752 9.455 1.00 0.00 C ATOM 987 CD PRO B 119 10.975 -10.094 8.228 1.00 0.00 C ATOM 0 HA PRO B 119 8.087 -8.602 8.460 1.00 0.00 H new ATOM 0 HB2 PRO B 119 8.639 -10.313 10.579 1.00 0.00 H new ATOM 0 HB3 PRO B 119 8.331 -10.946 8.974 1.00 0.00 H new ATOM 0 HG2 PRO B 119 10.969 -10.466 10.345 1.00 0.00 H new ATOM 0 HG3 PRO B 119 10.465 -11.838 9.377 1.00 0.00 H new ATOM 0 HD2 PRO B 119 12.034 -9.865 8.348 1.00 0.00 H new ATOM 0 HD3 PRO B 119 10.885 -10.735 7.351 1.00 0.00 H new ATOM 995 N SER B 120 10.370 -7.484 10.426 1.00 0.00 N ATOM 996 CA SER B 120 10.631 -6.519 11.488 1.00 0.00 C ATOM 997 C SER B 120 10.739 -5.106 10.923 1.00 0.00 C ATOM 998 O SER B 120 10.774 -4.127 11.671 1.00 0.00 O ATOM 999 CB SER B 120 11.917 -6.883 12.232 1.00 0.00 C ATOM 1000 OG SER B 120 12.976 -7.137 11.325 1.00 0.00 O ATOM 0 H SER B 120 11.207 -7.837 9.961 1.00 0.00 H new ATOM 0 HA SER B 120 9.795 -6.549 12.187 1.00 0.00 H new ATOM 0 HB2 SER B 120 12.195 -6.070 12.903 1.00 0.00 H new ATOM 0 HB3 SER B 120 11.746 -7.763 12.852 1.00 0.00 H new ATOM 0 HG SER B 120 13.787 -7.366 11.825 1.00 0.00 H new ATOM 1006 N ASP B 121 10.792 -5.007 9.599 1.00 0.00 N ATOM 1007 CA ASP B 121 10.895 -3.715 8.932 1.00 0.00 C ATOM 1008 C ASP B 121 9.626 -2.894 9.138 1.00 0.00 C ATOM 1009 O ASP B 121 8.716 -3.308 9.857 1.00 0.00 O ATOM 1010 CB ASP B 121 11.159 -3.907 7.438 1.00 0.00 C ATOM 1011 CG ASP B 121 12.598 -4.281 7.147 1.00 0.00 C ATOM 1012 OD1 ASP B 121 13.412 -4.285 8.093 1.00 0.00 O ATOM 1013 OD2 ASP B 121 12.910 -4.568 5.971 1.00 0.00 O ATOM 0 H ASP B 121 10.765 -5.807 8.967 1.00 0.00 H new ATOM 0 HA ASP B 121 11.731 -3.172 9.372 1.00 0.00 H new ATOM 0 HB2 ASP B 121 10.500 -4.685 7.053 1.00 0.00 H new ATOM 0 HB3 ASP B 121 10.911 -2.988 6.907 1.00 0.00 H new ATOM 1018 N THR B 122 9.571 -1.728 8.501 1.00 0.00 N ATOM 1019 CA THR B 122 8.415 -0.849 8.615 1.00 0.00 C ATOM 1020 C THR B 122 7.972 -0.343 7.246 1.00 0.00 C ATOM 1021 O THR B 122 8.708 -0.454 6.266 1.00 0.00 O ATOM 1022 CB THR B 122 8.713 0.358 9.524 1.00 0.00 C ATOM 1023 OG1 THR B 122 9.900 1.025 9.079 1.00 0.00 O ATOM 1024 CG2 THR B 122 8.886 -0.083 10.969 1.00 0.00 C ATOM 0 H THR B 122 10.314 -1.371 7.901 1.00 0.00 H new ATOM 0 HA THR B 122 7.613 -1.439 9.059 1.00 0.00 H new ATOM 0 HB THR B 122 7.868 1.044 9.468 1.00 0.00 H new ATOM 0 HG1 THR B 122 10.020 1.853 9.589 1.00 0.00 H new ATOM 0 HG21 THR B 122 9.096 0.786 11.592 1.00 0.00 H new ATOM 0 HG22 THR B 122 7.971 -0.565 11.314 1.00 0.00 H new ATOM 0 HG23 THR B 122 9.715 -0.787 11.038 1.00 0.00 H new ATOM 1032 N ILE B 123 6.766 0.213 7.188 1.00 0.00 N ATOM 1033 CA ILE B 123 6.228 0.738 5.940 1.00 0.00 C ATOM 1034 C ILE B 123 7.174 1.758 5.319 1.00 0.00 C ATOM 1035 O ILE B 123 7.482 1.690 4.129 1.00 0.00 O ATOM 1036 CB ILE B 123 4.851 1.394 6.153 1.00 0.00 C ATOM 1037 CG1 ILE B 123 3.919 0.444 6.908 1.00 0.00 C ATOM 1038 CG2 ILE B 123 4.241 1.792 4.817 1.00 0.00 C ATOM 1039 CD1 ILE B 123 3.793 -0.918 6.262 1.00 0.00 C ATOM 0 H ILE B 123 6.144 0.311 7.990 1.00 0.00 H new ATOM 0 HA ILE B 123 6.117 -0.109 5.263 1.00 0.00 H new ATOM 0 HB ILE B 123 4.984 2.295 6.753 1.00 0.00 H new ATOM 0 HG12 ILE B 123 4.286 0.321 7.927 1.00 0.00 H new ATOM 0 HG13 ILE B 123 2.930 0.897 6.978 1.00 0.00 H new ATOM 0 HG21 ILE B 123 3.268 2.254 4.984 1.00 0.00 H new ATOM 0 HG22 ILE B 123 4.898 2.501 4.314 1.00 0.00 H new ATOM 0 HG23 ILE B 123 4.119 0.906 4.194 1.00 0.00 H new ATOM 0 HD11 ILE B 123 3.117 -1.539 6.851 1.00 0.00 H new ATOM 0 HD12 ILE B 123 3.397 -0.807 5.253 1.00 0.00 H new ATOM 0 HD13 ILE B 123 4.774 -1.391 6.217 1.00 0.00 H new ATOM 1051 N GLU B 124 7.634 2.704 6.132 1.00 0.00 N ATOM 1052 CA GLU B 124 8.548 3.738 5.661 1.00 0.00 C ATOM 1053 C GLU B 124 9.782 3.119 5.010 1.00 0.00 C ATOM 1054 O GLU B 124 10.330 3.665 4.054 1.00 0.00 O ATOM 1055 CB GLU B 124 8.970 4.643 6.821 1.00 0.00 C ATOM 1056 CG GLU B 124 9.882 3.960 7.826 1.00 0.00 C ATOM 1057 CD GLU B 124 11.345 4.289 7.603 1.00 0.00 C ATOM 1058 OE1 GLU B 124 11.720 5.469 7.770 1.00 0.00 O ATOM 1059 OE2 GLU B 124 12.116 3.368 7.262 1.00 0.00 O ATOM 0 H GLU B 124 7.389 2.776 7.119 1.00 0.00 H new ATOM 0 HA GLU B 124 8.026 4.336 4.914 1.00 0.00 H new ATOM 0 HB2 GLU B 124 9.478 5.520 6.420 1.00 0.00 H new ATOM 0 HB3 GLU B 124 8.078 4.999 7.336 1.00 0.00 H new ATOM 0 HG2 GLU B 124 9.595 4.260 8.834 1.00 0.00 H new ATOM 0 HG3 GLU B 124 9.742 2.881 7.763 1.00 0.00 H new ATOM 1066 N ASN B 125 10.212 1.977 5.537 1.00 0.00 N ATOM 1067 CA ASN B 125 11.381 1.284 5.009 1.00 0.00 C ATOM 1068 C ASN B 125 11.136 0.818 3.577 1.00 0.00 C ATOM 1069 O ASN B 125 11.998 0.959 2.710 1.00 0.00 O ATOM 1070 CB ASN B 125 11.733 0.087 5.893 1.00 0.00 C ATOM 1071 CG ASN B 125 13.226 -0.181 5.938 1.00 0.00 C ATOM 1072 OD1 ASN B 125 13.868 -0.007 6.973 1.00 0.00 O ATOM 1073 ND2 ASN B 125 13.783 -0.604 4.809 1.00 0.00 N ATOM 0 H ASN B 125 9.768 1.512 6.329 1.00 0.00 H new ATOM 0 HA ASN B 125 12.217 1.984 5.007 1.00 0.00 H new ATOM 0 HB2 ASN B 125 11.368 0.266 6.904 1.00 0.00 H new ATOM 0 HB3 ASN B 125 11.219 -0.799 5.521 1.00 0.00 H new ATOM 0 HD21 ASN B 125 14.784 -0.799 4.776 1.00 0.00 H new ATOM 0 HD22 ASN B 125 13.210 -0.734 3.975 1.00 0.00 H new ATOM 1080 N VAL B 126 9.953 0.261 3.336 1.00 0.00 N ATOM 1081 CA VAL B 126 9.592 -0.225 2.010 1.00 0.00 C ATOM 1082 C VAL B 126 9.699 0.884 0.970 1.00 0.00 C ATOM 1083 O VAL B 126 10.025 0.635 -0.190 1.00 0.00 O ATOM 1084 CB VAL B 126 8.162 -0.796 1.991 1.00 0.00 C ATOM 1085 CG1 VAL B 126 7.846 -1.400 0.631 1.00 0.00 C ATOM 1086 CG2 VAL B 126 7.985 -1.827 3.095 1.00 0.00 C ATOM 0 H VAL B 126 9.228 0.135 4.043 1.00 0.00 H new ATOM 0 HA VAL B 126 10.295 -1.020 1.762 1.00 0.00 H new ATOM 0 HB VAL B 126 7.462 0.020 2.171 1.00 0.00 H new ATOM 0 HG11 VAL B 126 6.831 -1.798 0.637 1.00 0.00 H new ATOM 0 HG12 VAL B 126 7.930 -0.631 -0.137 1.00 0.00 H new ATOM 0 HG13 VAL B 126 8.550 -2.204 0.417 1.00 0.00 H new ATOM 0 HG21 VAL B 126 6.969 -2.220 3.066 1.00 0.00 H new ATOM 0 HG22 VAL B 126 8.693 -2.642 2.948 1.00 0.00 H new ATOM 0 HG23 VAL B 126 8.166 -1.359 4.063 1.00 0.00 H new ATOM 1096 N LYS B 127 9.421 2.113 1.394 1.00 0.00 N ATOM 1097 CA LYS B 127 9.487 3.264 0.500 1.00 0.00 C ATOM 1098 C LYS B 127 10.930 3.716 0.301 1.00 0.00 C ATOM 1099 O LYS B 127 11.280 4.266 -0.743 1.00 0.00 O ATOM 1100 CB LYS B 127 8.652 4.419 1.061 1.00 0.00 C ATOM 1101 CG LYS B 127 7.206 4.046 1.337 1.00 0.00 C ATOM 1102 CD LYS B 127 6.595 4.934 2.407 1.00 0.00 C ATOM 1103 CE LYS B 127 5.463 4.228 3.137 1.00 0.00 C ATOM 1104 NZ LYS B 127 4.554 5.194 3.816 1.00 0.00 N ATOM 0 H LYS B 127 9.148 2.337 2.351 1.00 0.00 H new ATOM 0 HA LYS B 127 9.082 2.966 -0.467 1.00 0.00 H new ATOM 0 HB2 LYS B 127 9.110 4.772 1.985 1.00 0.00 H new ATOM 0 HB3 LYS B 127 8.676 5.250 0.356 1.00 0.00 H new ATOM 0 HG2 LYS B 127 6.626 4.131 0.418 1.00 0.00 H new ATOM 0 HG3 LYS B 127 7.152 3.004 1.653 1.00 0.00 H new ATOM 0 HD2 LYS B 127 7.364 5.226 3.122 1.00 0.00 H new ATOM 0 HD3 LYS B 127 6.220 5.850 1.951 1.00 0.00 H new ATOM 0 HE2 LYS B 127 4.892 3.628 2.428 1.00 0.00 H new ATOM 0 HE3 LYS B 127 5.879 3.541 3.874 1.00 0.00 H new ATOM 0 HZ1 LYS B 127 3.569 4.880 3.706 1.00 0.00 H new ATOM 0 HZ2 LYS B 127 4.791 5.242 4.828 1.00 0.00 H new ATOM 0 HZ3 LYS B 127 4.667 6.136 3.389 1.00 0.00 H new ATOM 1118 N ALA B 128 11.764 3.480 1.309 1.00 0.00 N ATOM 1119 CA ALA B 128 13.170 3.860 1.243 1.00 0.00 C ATOM 1120 C ALA B 128 13.852 3.232 0.031 1.00 0.00 C ATOM 1121 O ALA B 128 14.498 3.922 -0.757 1.00 0.00 O ATOM 1122 CB ALA B 128 13.886 3.456 2.522 1.00 0.00 C ATOM 0 H ALA B 128 11.490 3.027 2.181 1.00 0.00 H new ATOM 0 HA ALA B 128 13.224 4.943 1.136 1.00 0.00 H new ATOM 0 HB1 ALA B 128 14.935 3.746 2.459 1.00 0.00 H new ATOM 0 HB2 ALA B 128 13.422 3.956 3.372 1.00 0.00 H new ATOM 0 HB3 ALA B 128 13.815 2.376 2.653 1.00 0.00 H new ATOM 1128 N LYS B 129 13.702 1.920 -0.111 1.00 0.00 N ATOM 1129 CA LYS B 129 14.302 1.198 -1.227 1.00 0.00 C ATOM 1130 C LYS B 129 13.577 1.511 -2.531 1.00 0.00 C ATOM 1131 O LYS B 129 14.200 1.622 -3.587 1.00 0.00 O ATOM 1132 CB LYS B 129 14.270 -0.309 -0.963 1.00 0.00 C ATOM 1133 CG LYS B 129 12.964 -0.792 -0.354 1.00 0.00 C ATOM 1134 CD LYS B 129 13.150 -1.226 1.090 1.00 0.00 C ATOM 1135 CE LYS B 129 13.510 -2.701 1.187 1.00 0.00 C ATOM 1136 NZ LYS B 129 14.590 -2.944 2.183 1.00 0.00 N ATOM 0 H LYS B 129 13.170 1.334 0.533 1.00 0.00 H new ATOM 0 HA LYS B 129 15.338 1.523 -1.321 1.00 0.00 H new ATOM 0 HB2 LYS B 129 14.441 -0.837 -1.901 1.00 0.00 H new ATOM 0 HB3 LYS B 129 15.091 -0.570 -0.295 1.00 0.00 H new ATOM 0 HG2 LYS B 129 12.222 0.005 -0.403 1.00 0.00 H new ATOM 0 HG3 LYS B 129 12.575 -1.626 -0.938 1.00 0.00 H new ATOM 0 HD2 LYS B 129 13.935 -0.628 1.553 1.00 0.00 H new ATOM 0 HD3 LYS B 129 12.234 -1.037 1.649 1.00 0.00 H new ATOM 0 HE2 LYS B 129 12.625 -3.273 1.464 1.00 0.00 H new ATOM 0 HE3 LYS B 129 13.830 -3.062 0.209 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 14.806 -3.961 2.219 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 15.443 -2.418 1.905 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 14.276 -2.623 3.121 1.00 0.00 H new ATOM 1150 N ILE B 130 12.259 1.655 -2.451 1.00 0.00 N ATOM 1151 CA ILE B 130 11.450 1.959 -3.624 1.00 0.00 C ATOM 1152 C ILE B 130 11.855 3.294 -4.240 1.00 0.00 C ATOM 1153 O ILE B 130 11.717 3.498 -5.446 1.00 0.00 O ATOM 1154 CB ILE B 130 9.949 1.999 -3.280 1.00 0.00 C ATOM 1155 CG1 ILE B 130 9.426 0.585 -3.015 1.00 0.00 C ATOM 1156 CG2 ILE B 130 9.165 2.658 -4.405 1.00 0.00 C ATOM 1157 CD1 ILE B 130 8.077 0.559 -2.334 1.00 0.00 C ATOM 0 H ILE B 130 11.728 1.566 -1.585 1.00 0.00 H new ATOM 0 HA ILE B 130 11.627 1.160 -4.344 1.00 0.00 H new ATOM 0 HB ILE B 130 9.814 2.591 -2.375 1.00 0.00 H new ATOM 0 HG12 ILE B 130 9.357 0.048 -3.961 1.00 0.00 H new ATOM 0 HG13 ILE B 130 10.147 0.050 -2.397 1.00 0.00 H new ATOM 0 HG21 ILE B 130 8.106 2.679 -4.147 1.00 0.00 H new ATOM 0 HG22 ILE B 130 9.523 3.677 -4.550 1.00 0.00 H new ATOM 0 HG23 ILE B 130 9.303 2.091 -5.326 1.00 0.00 H new ATOM 0 HD11 ILE B 130 7.768 -0.475 -2.177 1.00 0.00 H new ATOM 0 HD12 ILE B 130 8.145 1.067 -1.372 1.00 0.00 H new ATOM 0 HD13 ILE B 130 7.343 1.066 -2.961 1.00 0.00 H new ATOM 1169 N GLN B 131 12.356 4.196 -3.404 1.00 0.00 N ATOM 1170 CA GLN B 131 12.783 5.512 -3.867 1.00 0.00 C ATOM 1171 C GLN B 131 13.865 5.389 -4.935 1.00 0.00 C ATOM 1172 O GLN B 131 13.834 6.087 -5.947 1.00 0.00 O ATOM 1173 CB GLN B 131 13.298 6.346 -2.694 1.00 0.00 C ATOM 1174 CG GLN B 131 14.167 7.520 -3.117 1.00 0.00 C ATOM 1175 CD GLN B 131 14.044 8.706 -2.180 1.00 0.00 C ATOM 1176 OE1 GLN B 131 14.276 8.587 -0.977 1.00 0.00 O ATOM 1177 NE2 GLN B 131 13.677 9.858 -2.728 1.00 0.00 N ATOM 0 H GLN B 131 12.477 4.041 -2.403 1.00 0.00 H new ATOM 0 HA GLN B 131 11.920 6.012 -4.307 1.00 0.00 H new ATOM 0 HB2 GLN B 131 12.448 6.721 -2.125 1.00 0.00 H new ATOM 0 HB3 GLN B 131 13.871 5.703 -2.026 1.00 0.00 H new ATOM 0 HG2 GLN B 131 15.208 7.200 -3.157 1.00 0.00 H new ATOM 0 HG3 GLN B 131 13.889 7.828 -4.125 1.00 0.00 H new ATOM 0 HE21 GLN B 131 13.495 9.911 -3.730 1.00 0.00 H new ATOM 0 HE22 GLN B 131 13.577 10.690 -2.147 1.00 0.00 H new ATOM 1186 N ASP B 132 14.822 4.497 -4.700 1.00 0.00 N ATOM 1187 CA ASP B 132 15.915 4.282 -5.641 1.00 0.00 C ATOM 1188 C ASP B 132 15.416 3.581 -6.900 1.00 0.00 C ATOM 1189 O ASP B 132 16.130 3.497 -7.901 1.00 0.00 O ATOM 1190 CB ASP B 132 17.023 3.455 -4.987 1.00 0.00 C ATOM 1191 CG ASP B 132 18.337 3.553 -5.738 1.00 0.00 C ATOM 1192 OD1 ASP B 132 18.561 4.581 -6.411 1.00 0.00 O ATOM 1193 OD2 ASP B 132 19.141 2.601 -5.653 1.00 0.00 O ATOM 0 H ASP B 132 14.863 3.911 -3.866 1.00 0.00 H new ATOM 0 HA ASP B 132 16.317 5.255 -5.923 1.00 0.00 H new ATOM 0 HB2 ASP B 132 17.168 3.793 -3.961 1.00 0.00 H new ATOM 0 HB3 ASP B 132 16.713 2.411 -4.938 1.00 0.00 H new ATOM 1198 N LYS B 133 14.187 3.080 -6.846 1.00 0.00 N ATOM 1199 CA LYS B 133 13.592 2.386 -7.981 1.00 0.00 C ATOM 1200 C LYS B 133 12.866 3.365 -8.899 1.00 0.00 C ATOM 1201 O LYS B 133 13.276 3.582 -10.038 1.00 0.00 O ATOM 1202 CB LYS B 133 12.618 1.310 -7.496 1.00 0.00 C ATOM 1203 CG LYS B 133 13.216 -0.086 -7.473 1.00 0.00 C ATOM 1204 CD LYS B 133 14.317 -0.205 -6.432 1.00 0.00 C ATOM 1205 CE LYS B 133 15.048 -1.534 -6.542 1.00 0.00 C ATOM 1206 NZ LYS B 133 15.986 -1.557 -7.698 1.00 0.00 N ATOM 0 H LYS B 133 13.583 3.142 -6.027 1.00 0.00 H new ATOM 0 HA LYS B 133 14.396 1.913 -8.545 1.00 0.00 H new ATOM 0 HB2 LYS B 133 12.276 1.566 -6.493 1.00 0.00 H new ATOM 0 HB3 LYS B 133 11.740 1.309 -8.141 1.00 0.00 H new ATOM 0 HG2 LYS B 133 12.433 -0.814 -7.261 1.00 0.00 H new ATOM 0 HG3 LYS B 133 13.617 -0.327 -8.457 1.00 0.00 H new ATOM 0 HD2 LYS B 133 15.027 0.613 -6.557 1.00 0.00 H new ATOM 0 HD3 LYS B 133 13.888 -0.106 -5.435 1.00 0.00 H new ATOM 0 HE2 LYS B 133 15.601 -1.721 -5.622 1.00 0.00 H new ATOM 0 HE3 LYS B 133 14.322 -2.340 -6.647 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 16.526 -2.446 -7.689 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 15.446 -1.488 -8.584 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 16.642 -0.753 -7.629 1.00 0.00 H new ATOM 1220 N GLU B 134 11.788 3.956 -8.392 1.00 0.00 N ATOM 1221 CA GLU B 134 11.007 4.913 -9.166 1.00 0.00 C ATOM 1222 C GLU B 134 11.647 6.298 -9.124 1.00 0.00 C ATOM 1223 O GLU B 134 11.752 6.977 -10.144 1.00 0.00 O ATOM 1224 CB GLU B 134 9.575 4.985 -8.634 1.00 0.00 C ATOM 1225 CG GLU B 134 9.492 5.254 -7.141 1.00 0.00 C ATOM 1226 CD GLU B 134 8.063 5.339 -6.642 1.00 0.00 C ATOM 1227 OE1 GLU B 134 7.155 5.541 -7.474 1.00 0.00 O ATOM 1228 OE2 GLU B 134 7.853 5.203 -5.418 1.00 0.00 O ATOM 0 H GLU B 134 11.436 3.789 -7.449 1.00 0.00 H new ATOM 0 HA GLU B 134 10.986 4.573 -10.201 1.00 0.00 H new ATOM 0 HB2 GLU B 134 9.038 5.770 -9.166 1.00 0.00 H new ATOM 0 HB3 GLU B 134 9.067 4.046 -8.854 1.00 0.00 H new ATOM 0 HG2 GLU B 134 10.014 4.462 -6.603 1.00 0.00 H new ATOM 0 HG3 GLU B 134 10.008 6.187 -6.915 1.00 0.00 H new ATOM 1235 N GLY B 135 12.073 6.711 -7.934 1.00 0.00 N ATOM 1236 CA GLY B 135 12.697 8.013 -7.779 1.00 0.00 C ATOM 1237 C GLY B 135 11.826 8.984 -7.007 1.00 0.00 C ATOM 1238 O GLY B 135 11.812 10.180 -7.298 1.00 0.00 O ATOM 0 H GLY B 135 11.997 6.167 -7.074 1.00 0.00 H new ATOM 0 HA2 GLY B 135 13.651 7.897 -7.264 1.00 0.00 H new ATOM 0 HA3 GLY B 135 12.915 8.428 -8.763 1.00 0.00 H new ATOM 1242 N ILE B 136 11.097 8.470 -6.023 1.00 0.00 N ATOM 1243 CA ILE B 136 10.220 9.301 -5.208 1.00 0.00 C ATOM 1244 C ILE B 136 10.540 9.147 -3.725 1.00 0.00 C ATOM 1245 O ILE B 136 10.841 8.057 -3.239 1.00 0.00 O ATOM 1246 CB ILE B 136 8.739 8.953 -5.441 1.00 0.00 C ATOM 1247 CG1 ILE B 136 8.120 9.916 -6.456 1.00 0.00 C ATOM 1248 CG2 ILE B 136 7.971 8.993 -4.128 1.00 0.00 C ATOM 1249 CD1 ILE B 136 6.882 9.368 -7.133 1.00 0.00 C ATOM 0 H ILE B 136 11.096 7.482 -5.771 1.00 0.00 H new ATOM 0 HA ILE B 136 10.393 10.334 -5.509 1.00 0.00 H new ATOM 0 HB ILE B 136 8.678 7.942 -5.843 1.00 0.00 H new ATOM 0 HG12 ILE B 136 7.866 10.848 -5.952 1.00 0.00 H new ATOM 0 HG13 ILE B 136 8.863 10.157 -7.216 1.00 0.00 H new ATOM 0 HG21 ILE B 136 6.925 8.745 -4.310 1.00 0.00 H new ATOM 0 HG22 ILE B 136 8.400 8.271 -3.434 1.00 0.00 H new ATOM 0 HG23 ILE B 136 8.037 9.993 -3.698 1.00 0.00 H new ATOM 0 HD11 ILE B 136 6.497 10.104 -7.839 1.00 0.00 H new ATOM 0 HD12 ILE B 136 7.134 8.451 -7.666 1.00 0.00 H new ATOM 0 HD13 ILE B 136 6.122 9.153 -6.382 1.00 0.00 H new ATOM 1261 N PRO B 137 10.470 10.265 -2.985 1.00 0.00 N ATOM 1262 CA PRO B 137 10.745 10.279 -1.546 1.00 0.00 C ATOM 1263 C PRO B 137 9.666 9.563 -0.741 1.00 0.00 C ATOM 1264 O PRO B 137 8.479 9.624 -1.058 1.00 0.00 O ATOM 1265 CB PRO B 137 10.765 11.771 -1.204 1.00 0.00 C ATOM 1266 CG PRO B 137 9.916 12.411 -2.249 1.00 0.00 C ATOM 1267 CD PRO B 137 10.116 11.599 -3.499 1.00 0.00 C ATOM 0 HA PRO B 137 11.672 9.759 -1.304 1.00 0.00 H new ATOM 0 HB2 PRO B 137 10.368 11.954 -0.205 1.00 0.00 H new ATOM 0 HB3 PRO B 137 11.780 12.168 -1.221 1.00 0.00 H new ATOM 0 HG2 PRO B 137 8.868 12.416 -1.951 1.00 0.00 H new ATOM 0 HG3 PRO B 137 10.208 13.449 -2.407 1.00 0.00 H new ATOM 0 HD2 PRO B 137 9.212 11.569 -4.108 1.00 0.00 H new ATOM 0 HD3 PRO B 137 10.908 12.012 -4.124 1.00 0.00 H new ATOM 1275 N PRO B 138 10.086 8.868 0.326 1.00 0.00 N ATOM 1276 CA PRO B 138 9.171 8.127 1.199 1.00 0.00 C ATOM 1277 C PRO B 138 8.285 9.051 2.027 1.00 0.00 C ATOM 1278 O PRO B 138 7.307 8.611 2.631 1.00 0.00 O ATOM 1279 CB PRO B 138 10.111 7.332 2.108 1.00 0.00 C ATOM 1280 CG PRO B 138 11.377 8.119 2.123 1.00 0.00 C ATOM 1281 CD PRO B 138 11.487 8.752 0.763 1.00 0.00 C ATOM 0 HA PRO B 138 8.480 7.505 0.630 1.00 0.00 H new ATOM 0 HB2 PRO B 138 9.698 7.228 3.111 1.00 0.00 H new ATOM 0 HB3 PRO B 138 10.275 6.325 1.724 1.00 0.00 H new ATOM 0 HG2 PRO B 138 11.356 8.877 2.906 1.00 0.00 H new ATOM 0 HG3 PRO B 138 12.234 7.476 2.325 1.00 0.00 H new ATOM 0 HD2 PRO B 138 11.975 9.726 0.811 1.00 0.00 H new ATOM 0 HD3 PRO B 138 12.071 8.136 0.079 1.00 0.00 H new ATOM 1289 N ASP B 139 8.632 10.333 2.049 1.00 0.00 N ATOM 1290 CA ASP B 139 7.867 11.320 2.803 1.00 0.00 C ATOM 1291 C ASP B 139 6.664 11.804 1.999 1.00 0.00 C ATOM 1292 O ASP B 139 5.877 12.621 2.475 1.00 0.00 O ATOM 1293 CB ASP B 139 8.755 12.507 3.179 1.00 0.00 C ATOM 1294 CG ASP B 139 8.100 13.421 4.197 1.00 0.00 C ATOM 1295 OD1 ASP B 139 8.010 13.026 5.377 1.00 0.00 O ATOM 1296 OD2 ASP B 139 7.679 14.530 3.811 1.00 0.00 O ATOM 0 H ASP B 139 9.438 10.713 1.553 1.00 0.00 H new ATOM 0 HA ASP B 139 7.505 10.844 3.714 1.00 0.00 H new ATOM 0 HB2 ASP B 139 9.699 12.138 3.581 1.00 0.00 H new ATOM 0 HB3 ASP B 139 8.992 13.078 2.282 1.00 0.00 H new ATOM 1301 N GLN B 140 6.531 11.295 0.778 1.00 0.00 N ATOM 1302 CA GLN B 140 5.425 11.676 -0.092 1.00 0.00 C ATOM 1303 C GLN B 140 4.612 10.455 -0.507 1.00 0.00 C ATOM 1304 O GLN B 140 3.386 10.517 -0.601 1.00 0.00 O ATOM 1305 CB GLN B 140 5.952 12.399 -1.333 1.00 0.00 C ATOM 1306 CG GLN B 140 5.974 13.912 -1.192 1.00 0.00 C ATOM 1307 CD GLN B 140 7.115 14.554 -1.957 1.00 0.00 C ATOM 1308 OE1 GLN B 140 7.845 15.388 -1.422 1.00 0.00 O ATOM 1309 NE2 GLN B 140 7.275 14.166 -3.216 1.00 0.00 N ATOM 0 H GLN B 140 7.175 10.618 0.369 1.00 0.00 H new ATOM 0 HA GLN B 140 4.774 12.350 0.464 1.00 0.00 H new ATOM 0 HB2 GLN B 140 6.961 12.048 -1.547 1.00 0.00 H new ATOM 0 HB3 GLN B 140 5.333 12.131 -2.189 1.00 0.00 H new ATOM 0 HG2 GLN B 140 5.028 14.320 -1.548 1.00 0.00 H new ATOM 0 HG3 GLN B 140 6.057 14.173 -0.137 1.00 0.00 H new ATOM 0 HE21 GLN B 140 6.646 13.471 -3.619 1.00 0.00 H new ATOM 0 HE22 GLN B 140 8.027 14.562 -3.780 1.00 0.00 H new ATOM 1318 N GLN B 141 5.303 9.347 -0.755 1.00 0.00 N ATOM 1319 CA GLN B 141 4.644 8.111 -1.161 1.00 0.00 C ATOM 1320 C GLN B 141 4.138 7.339 0.052 1.00 0.00 C ATOM 1321 O GLN B 141 4.735 7.393 1.127 1.00 0.00 O ATOM 1322 CB GLN B 141 5.604 7.239 -1.972 1.00 0.00 C ATOM 1323 CG GLN B 141 6.801 6.749 -1.174 1.00 0.00 C ATOM 1324 CD GLN B 141 7.546 5.627 -1.870 1.00 0.00 C ATOM 1325 OE1 GLN B 141 7.057 4.500 -1.954 1.00 0.00 O ATOM 1326 NE2 GLN B 141 8.737 5.929 -2.373 1.00 0.00 N ATOM 0 H GLN B 141 6.318 9.280 -0.682 1.00 0.00 H new ATOM 0 HA GLN B 141 3.789 8.373 -1.784 1.00 0.00 H new ATOM 0 HB2 GLN B 141 5.060 6.378 -2.361 1.00 0.00 H new ATOM 0 HB3 GLN B 141 5.959 7.807 -2.832 1.00 0.00 H new ATOM 0 HG2 GLN B 141 7.483 7.581 -1.002 1.00 0.00 H new ATOM 0 HG3 GLN B 141 6.465 6.405 -0.196 1.00 0.00 H new ATOM 0 HE21 GLN B 141 9.104 6.876 -2.281 1.00 0.00 H new ATOM 0 HE22 GLN B 141 9.285 5.214 -2.852 1.00 0.00 H new ATOM 1335 N ARG B 142 3.033 6.622 -0.127 1.00 0.00 N ATOM 1336 CA ARG B 142 2.447 5.840 0.955 1.00 0.00 C ATOM 1337 C ARG B 142 2.111 4.428 0.485 1.00 0.00 C ATOM 1338 O ARG B 142 2.285 4.094 -0.688 1.00 0.00 O ATOM 1339 CB ARG B 142 1.185 6.526 1.483 1.00 0.00 C ATOM 1340 CG ARG B 142 1.354 8.020 1.706 1.00 0.00 C ATOM 1341 CD ARG B 142 2.337 8.310 2.829 1.00 0.00 C ATOM 1342 NE ARG B 142 1.685 8.333 4.136 1.00 0.00 N ATOM 1343 CZ ARG B 142 1.013 9.378 4.602 1.00 0.00 C ATOM 1344 NH1 ARG B 142 0.905 10.481 3.873 1.00 0.00 N ATOM 1345 NH2 ARG B 142 0.446 9.324 5.801 1.00 0.00 N ATOM 0 H ARG B 142 2.526 6.567 -1.010 1.00 0.00 H new ATOM 0 HA ARG B 142 3.180 5.773 1.759 1.00 0.00 H new ATOM 0 HB2 ARG B 142 0.370 6.362 0.778 1.00 0.00 H new ATOM 0 HB3 ARG B 142 0.893 6.057 2.423 1.00 0.00 H new ATOM 0 HG2 ARG B 142 1.703 8.489 0.786 1.00 0.00 H new ATOM 0 HG3 ARG B 142 0.388 8.465 1.944 1.00 0.00 H new ATOM 0 HD2 ARG B 142 3.121 7.553 2.829 1.00 0.00 H new ATOM 0 HD3 ARG B 142 2.821 9.270 2.648 1.00 0.00 H new ATOM 0 HE ARG B 142 1.750 7.501 4.722 1.00 0.00 H new ATOM 0 HH11 ARG B 142 1.339 10.528 2.951 1.00 0.00 H new ATOM 0 HH12 ARG B 142 0.388 11.282 4.234 1.00 0.00 H new ATOM 0 HH21 ARG B 142 0.527 8.478 6.366 1.00 0.00 H new ATOM 0 HH22 ARG B 142 -0.070 10.128 6.158 1.00 0.00 H new ATOM 1359 N LEU B 143 1.630 3.601 1.407 1.00 0.00 N ATOM 1360 CA LEU B 143 1.271 2.224 1.088 1.00 0.00 C ATOM 1361 C LEU B 143 -0.169 1.929 1.495 1.00 0.00 C ATOM 1362 O LEU B 143 -0.673 2.480 2.475 1.00 0.00 O ATOM 1363 CB LEU B 143 2.221 1.252 1.790 1.00 0.00 C ATOM 1364 CG LEU B 143 3.545 0.976 1.077 1.00 0.00 C ATOM 1365 CD1 LEU B 143 4.412 0.041 1.906 1.00 0.00 C ATOM 1366 CD2 LEU B 143 3.295 0.389 -0.304 1.00 0.00 C ATOM 0 H LEU B 143 1.480 3.861 2.382 1.00 0.00 H new ATOM 0 HA LEU B 143 1.359 2.092 0.010 1.00 0.00 H new ATOM 0 HB2 LEU B 143 2.441 1.644 2.783 1.00 0.00 H new ATOM 0 HB3 LEU B 143 1.701 0.304 1.929 1.00 0.00 H new ATOM 0 HG LEU B 143 4.075 1.921 0.958 1.00 0.00 H new ATOM 0 HD11 LEU B 143 5.350 -0.144 1.383 1.00 0.00 H new ATOM 0 HD12 LEU B 143 4.620 0.499 2.873 1.00 0.00 H new ATOM 0 HD13 LEU B 143 3.888 -0.903 2.057 1.00 0.00 H new ATOM 0 HD21 LEU B 143 4.249 0.199 -0.797 1.00 0.00 H new ATOM 0 HD22 LEU B 143 2.744 -0.546 -0.207 1.00 0.00 H new ATOM 0 HD23 LEU B 143 2.713 1.093 -0.899 1.00 0.00 H new ATOM 1378 N ILE B 144 -0.825 1.056 0.739 1.00 0.00 N ATOM 1379 CA ILE B 144 -2.206 0.686 1.023 1.00 0.00 C ATOM 1380 C ILE B 144 -2.401 -0.824 0.926 1.00 0.00 C ATOM 1381 O ILE B 144 -2.140 -1.429 -0.114 1.00 0.00 O ATOM 1382 CB ILE B 144 -3.186 1.381 0.059 1.00 0.00 C ATOM 1383 CG1 ILE B 144 -2.876 2.877 -0.026 1.00 0.00 C ATOM 1384 CG2 ILE B 144 -4.621 1.156 0.509 1.00 0.00 C ATOM 1385 CD1 ILE B 144 -3.093 3.613 1.278 1.00 0.00 C ATOM 0 H ILE B 144 -0.423 0.591 -0.075 1.00 0.00 H new ATOM 0 HA ILE B 144 -2.417 1.014 2.041 1.00 0.00 H new ATOM 0 HB ILE B 144 -3.066 0.947 -0.934 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -1.841 3.008 -0.340 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -3.502 3.327 -0.796 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -5.301 1.653 -0.182 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -4.835 0.087 0.523 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -4.757 1.566 1.510 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -2.854 4.668 1.144 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -4.134 3.513 1.584 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -2.447 3.189 2.047 1.00 0.00 H new ATOM 1397 N PHE B 145 -2.864 -1.426 2.017 1.00 0.00 N ATOM 1398 CA PHE B 145 -3.096 -2.865 2.056 1.00 0.00 C ATOM 1399 C PHE B 145 -4.098 -3.225 3.148 1.00 0.00 C ATOM 1400 O PHE B 145 -4.124 -2.606 4.211 1.00 0.00 O ATOM 1401 CB PHE B 145 -1.779 -3.609 2.291 1.00 0.00 C ATOM 1402 CG PHE B 145 -1.886 -5.093 2.091 1.00 0.00 C ATOM 1403 CD1 PHE B 145 -1.871 -5.638 0.817 1.00 0.00 C ATOM 1404 CD2 PHE B 145 -2.001 -5.945 3.178 1.00 0.00 C ATOM 1405 CE1 PHE B 145 -1.969 -7.004 0.630 1.00 0.00 C ATOM 1406 CE2 PHE B 145 -2.097 -7.312 2.997 1.00 0.00 C ATOM 1407 CZ PHE B 145 -2.083 -7.841 1.721 1.00 0.00 C ATOM 0 H PHE B 145 -3.086 -0.939 2.886 1.00 0.00 H new ATOM 0 HA PHE B 145 -3.510 -3.167 1.094 1.00 0.00 H new ATOM 0 HB2 PHE B 145 -1.021 -3.213 1.615 1.00 0.00 H new ATOM 0 HB3 PHE B 145 -1.435 -3.411 3.306 1.00 0.00 H new ATOM 0 HD1 PHE B 145 -1.782 -4.987 -0.040 1.00 0.00 H new ATOM 0 HD2 PHE B 145 -2.016 -5.536 4.178 1.00 0.00 H new ATOM 0 HE1 PHE B 145 -1.956 -7.416 -0.368 1.00 0.00 H new ATOM 0 HE2 PHE B 145 -2.183 -7.966 3.852 1.00 0.00 H new ATOM 0 HZ PHE B 145 -2.161 -8.909 1.577 1.00 0.00 H new ATOM 1417 N ALA B 146 -4.924 -4.230 2.876 1.00 0.00 N ATOM 1418 CA ALA B 146 -5.928 -4.675 3.835 1.00 0.00 C ATOM 1419 C ALA B 146 -6.939 -3.571 4.122 1.00 0.00 C ATOM 1420 O ALA B 146 -7.524 -3.517 5.203 1.00 0.00 O ATOM 1421 CB ALA B 146 -5.261 -5.131 5.124 1.00 0.00 C ATOM 0 H ALA B 146 -4.918 -4.751 1.999 1.00 0.00 H new ATOM 0 HA ALA B 146 -6.464 -5.518 3.399 1.00 0.00 H new ATOM 0 HB1 ALA B 146 -6.022 -5.460 5.831 1.00 0.00 H new ATOM 0 HB2 ALA B 146 -4.583 -5.957 4.910 1.00 0.00 H new ATOM 0 HB3 ALA B 146 -4.699 -4.303 5.556 1.00 0.00 H new ATOM 1427 N GLY B 147 -7.141 -2.690 3.146 1.00 0.00 N ATOM 1428 CA GLY B 147 -8.081 -1.597 3.315 1.00 0.00 C ATOM 1429 C GLY B 147 -7.677 -0.651 4.428 1.00 0.00 C ATOM 1430 O GLY B 147 -8.528 -0.024 5.059 1.00 0.00 O ATOM 0 H GLY B 147 -6.670 -2.714 2.241 1.00 0.00 H new ATOM 0 HA2 GLY B 147 -8.159 -1.041 2.381 1.00 0.00 H new ATOM 0 HA3 GLY B 147 -9.070 -2.002 3.528 1.00 0.00 H new ATOM 1434 N LYS B 148 -6.375 -0.549 4.673 1.00 0.00 N ATOM 1435 CA LYS B 148 -5.859 0.327 5.717 1.00 0.00 C ATOM 1436 C LYS B 148 -4.638 1.097 5.227 1.00 0.00 C ATOM 1437 O LYS B 148 -3.906 0.629 4.356 1.00 0.00 O ATOM 1438 CB LYS B 148 -5.496 -0.487 6.960 1.00 0.00 C ATOM 1439 CG LYS B 148 -6.482 -1.601 7.268 1.00 0.00 C ATOM 1440 CD LYS B 148 -6.537 -1.902 8.757 1.00 0.00 C ATOM 1441 CE LYS B 148 -5.603 -3.043 9.128 1.00 0.00 C ATOM 1442 NZ LYS B 148 -6.242 -4.372 8.923 1.00 0.00 N ATOM 0 H LYS B 148 -5.658 -1.063 4.162 1.00 0.00 H new ATOM 0 HA LYS B 148 -6.639 1.043 5.974 1.00 0.00 H new ATOM 0 HB2 LYS B 148 -4.504 -0.918 6.824 1.00 0.00 H new ATOM 0 HB3 LYS B 148 -5.438 0.183 7.818 1.00 0.00 H new ATOM 0 HG2 LYS B 148 -7.474 -1.317 6.916 1.00 0.00 H new ATOM 0 HG3 LYS B 148 -6.196 -2.501 6.724 1.00 0.00 H new ATOM 0 HD2 LYS B 148 -6.265 -1.009 9.320 1.00 0.00 H new ATOM 0 HD3 LYS B 148 -7.558 -2.159 9.040 1.00 0.00 H new ATOM 0 HE2 LYS B 148 -4.696 -2.980 8.527 1.00 0.00 H new ATOM 0 HE3 LYS B 148 -5.302 -2.942 10.171 1.00 0.00 H new ATOM 0 HZ1 LYS B 148 -5.573 -5.123 9.187 1.00 0.00 H new ATOM 0 HZ2 LYS B 148 -7.094 -4.443 9.515 1.00 0.00 H new ATOM 0 HZ3 LYS B 148 -6.506 -4.480 7.923 1.00 0.00 H new ATOM 1456 N GLN B 149 -4.424 2.281 5.794 1.00 0.00 N ATOM 1457 CA GLN B 149 -3.290 3.116 5.413 1.00 0.00 C ATOM 1458 C GLN B 149 -2.020 2.668 6.130 1.00 0.00 C ATOM 1459 O GLN B 149 -1.881 2.848 7.341 1.00 0.00 O ATOM 1460 CB GLN B 149 -3.580 4.583 5.732 1.00 0.00 C ATOM 1461 CG GLN B 149 -2.829 5.560 4.842 1.00 0.00 C ATOM 1462 CD GLN B 149 -2.712 6.940 5.456 1.00 0.00 C ATOM 1463 OE1 GLN B 149 -1.630 7.362 5.866 1.00 0.00 O ATOM 1464 NE2 GLN B 149 -3.831 7.653 5.526 1.00 0.00 N ATOM 0 H GLN B 149 -5.020 2.683 6.518 1.00 0.00 H new ATOM 0 HA GLN B 149 -3.136 3.009 4.339 1.00 0.00 H new ATOM 0 HB2 GLN B 149 -4.650 4.763 5.632 1.00 0.00 H new ATOM 0 HB3 GLN B 149 -3.319 4.778 6.772 1.00 0.00 H new ATOM 0 HG2 GLN B 149 -1.831 5.170 4.643 1.00 0.00 H new ATOM 0 HG3 GLN B 149 -3.339 5.636 3.882 1.00 0.00 H new ATOM 0 HE21 GLN B 149 -4.706 7.265 5.174 1.00 0.00 H new ATOM 0 HE22 GLN B 149 -3.815 8.589 5.932 1.00 0.00 H new ATOM 1473 N LEU B 150 -1.095 2.084 5.376 1.00 0.00 N ATOM 1474 CA LEU B 150 0.164 1.610 5.939 1.00 0.00 C ATOM 1475 C LEU B 150 1.173 2.748 6.052 1.00 0.00 C ATOM 1476 O LEU B 150 1.480 3.416 5.066 1.00 0.00 O ATOM 1477 CB LEU B 150 0.740 0.486 5.077 1.00 0.00 C ATOM 1478 CG LEU B 150 -0.278 -0.464 4.444 1.00 0.00 C ATOM 1479 CD1 LEU B 150 0.427 -1.643 3.790 1.00 0.00 C ATOM 1480 CD2 LEU B 150 -1.275 -0.948 5.486 1.00 0.00 C ATOM 0 H LEU B 150 -1.194 1.927 4.373 1.00 0.00 H new ATOM 0 HA LEU B 150 -0.036 1.226 6.939 1.00 0.00 H new ATOM 0 HB2 LEU B 150 1.333 0.934 4.280 1.00 0.00 H new ATOM 0 HB3 LEU B 150 1.423 -0.102 5.691 1.00 0.00 H new ATOM 0 HG LEU B 150 -0.824 0.080 3.673 1.00 0.00 H new ATOM 0 HD11 LEU B 150 -0.313 -2.308 3.345 1.00 0.00 H new ATOM 0 HD12 LEU B 150 1.101 -1.279 3.014 1.00 0.00 H new ATOM 0 HD13 LEU B 150 0.999 -2.187 4.541 1.00 0.00 H new ATOM 0 HD21 LEU B 150 -1.992 -1.623 5.018 1.00 0.00 H new ATOM 0 HD22 LEU B 150 -0.745 -1.475 6.279 1.00 0.00 H new ATOM 0 HD23 LEU B 150 -1.804 -0.093 5.908 1.00 0.00 H new ATOM 1492 N GLU B 151 1.685 2.961 7.260 1.00 0.00 N ATOM 1493 CA GLU B 151 2.660 4.018 7.500 1.00 0.00 C ATOM 1494 C GLU B 151 3.731 3.557 8.486 1.00 0.00 C ATOM 1495 O GLU B 151 3.681 2.437 8.993 1.00 0.00 O ATOM 1496 CB GLU B 151 1.965 5.272 8.034 1.00 0.00 C ATOM 1497 CG GLU B 151 0.995 4.993 9.170 1.00 0.00 C ATOM 1498 CD GLU B 151 0.608 6.247 9.929 1.00 0.00 C ATOM 1499 OE1 GLU B 151 -0.347 6.929 9.503 1.00 0.00 O ATOM 1500 OE2 GLU B 151 1.263 6.548 10.949 1.00 0.00 O ATOM 0 H GLU B 151 1.441 2.416 8.087 1.00 0.00 H new ATOM 0 HA GLU B 151 3.142 4.255 6.551 1.00 0.00 H new ATOM 0 HB2 GLU B 151 2.721 5.978 8.378 1.00 0.00 H new ATOM 0 HB3 GLU B 151 1.427 5.754 7.218 1.00 0.00 H new ATOM 0 HG2 GLU B 151 0.097 4.524 8.769 1.00 0.00 H new ATOM 0 HG3 GLU B 151 1.445 4.280 9.860 1.00 0.00 H new ATOM 1507 N ASP B 152 4.697 4.429 8.751 1.00 0.00 N ATOM 1508 CA ASP B 152 5.778 4.113 9.676 1.00 0.00 C ATOM 1509 C ASP B 152 5.234 3.823 11.071 1.00 0.00 C ATOM 1510 O ASP B 152 5.909 3.212 11.898 1.00 0.00 O ATOM 1511 CB ASP B 152 6.781 5.267 9.736 1.00 0.00 C ATOM 1512 CG ASP B 152 6.356 6.353 10.703 1.00 0.00 C ATOM 1513 OD1 ASP B 152 5.576 7.239 10.296 1.00 0.00 O ATOM 1514 OD2 ASP B 152 6.804 6.318 11.868 1.00 0.00 O ATOM 0 H ASP B 152 4.753 5.360 8.338 1.00 0.00 H new ATOM 0 HA ASP B 152 6.285 3.220 9.311 1.00 0.00 H new ATOM 0 HB2 ASP B 152 7.756 4.882 10.033 1.00 0.00 H new ATOM 0 HB3 ASP B 152 6.897 5.696 8.741 1.00 0.00 H new ATOM 1519 N GLY B 153 4.007 4.269 11.327 1.00 0.00 N ATOM 1520 CA GLY B 153 3.394 4.050 12.623 1.00 0.00 C ATOM 1521 C GLY B 153 3.303 2.579 12.980 1.00 0.00 C ATOM 1522 O GLY B 153 3.163 2.226 14.151 1.00 0.00 O ATOM 0 H GLY B 153 3.428 4.778 10.659 1.00 0.00 H new ATOM 0 HA2 GLY B 153 3.971 4.571 13.387 1.00 0.00 H new ATOM 0 HA3 GLY B 153 2.394 4.484 12.627 1.00 0.00 H new ATOM 1526 N ARG B 154 3.382 1.720 11.970 1.00 0.00 N ATOM 1527 CA ARG B 154 3.305 0.280 12.183 1.00 0.00 C ATOM 1528 C ARG B 154 4.337 -0.451 11.330 1.00 0.00 C ATOM 1529 O ARG B 154 4.940 0.132 10.428 1.00 0.00 O ATOM 1530 CB ARG B 154 1.902 -0.231 11.855 1.00 0.00 C ATOM 1531 CG ARG B 154 0.792 0.703 12.307 1.00 0.00 C ATOM 1532 CD ARG B 154 -0.462 -0.066 12.693 1.00 0.00 C ATOM 1533 NE ARG B 154 -1.660 0.764 12.610 1.00 0.00 N ATOM 1534 CZ ARG B 154 -2.892 0.298 12.789 1.00 0.00 C ATOM 1535 NH1 ARG B 154 -3.084 -0.986 13.059 1.00 0.00 N ATOM 1536 NH2 ARG B 154 -3.932 1.115 12.697 1.00 0.00 N ATOM 0 H ARG B 154 3.499 1.996 10.995 1.00 0.00 H new ATOM 0 HA ARG B 154 3.520 0.081 13.233 1.00 0.00 H new ATOM 0 HB2 ARG B 154 1.822 -0.382 10.778 1.00 0.00 H new ATOM 0 HB3 ARG B 154 1.760 -1.204 12.325 1.00 0.00 H new ATOM 0 HG2 ARG B 154 1.135 1.292 13.158 1.00 0.00 H new ATOM 0 HG3 ARG B 154 0.558 1.405 11.507 1.00 0.00 H new ATOM 0 HD2 ARG B 154 -0.573 -0.930 12.038 1.00 0.00 H new ATOM 0 HD3 ARG B 154 -0.355 -0.448 13.708 1.00 0.00 H new ATOM 0 HE ARG B 154 -1.545 1.756 12.403 1.00 0.00 H new ATOM 0 HH11 ARG B 154 -2.286 -1.617 13.130 1.00 0.00 H new ATOM 0 HH12 ARG B 154 -4.030 -1.342 13.196 1.00 0.00 H new ATOM 0 HH21 ARG B 154 -3.788 2.103 12.489 1.00 0.00 H new ATOM 0 HH22 ARG B 154 -4.877 0.756 12.835 1.00 0.00 H new ATOM 1550 N THR B 155 4.537 -1.733 11.620 1.00 0.00 N ATOM 1551 CA THR B 155 5.496 -2.544 10.882 1.00 0.00 C ATOM 1552 C THR B 155 4.791 -3.478 9.905 1.00 0.00 C ATOM 1553 O THR B 155 3.562 -3.485 9.815 1.00 0.00 O ATOM 1554 CB THR B 155 6.373 -3.381 11.832 1.00 0.00 C ATOM 1555 OG1 THR B 155 5.547 -4.207 12.661 1.00 0.00 O ATOM 1556 CG2 THR B 155 7.238 -2.482 12.704 1.00 0.00 C ATOM 0 H THR B 155 4.046 -2.232 12.362 1.00 0.00 H new ATOM 0 HA THR B 155 6.131 -1.854 10.326 1.00 0.00 H new ATOM 0 HB THR B 155 7.026 -4.011 11.228 1.00 0.00 H new ATOM 0 HG1 THR B 155 6.112 -4.737 13.261 1.00 0.00 H new ATOM 0 HG21 THR B 155 7.848 -3.096 13.366 1.00 0.00 H new ATOM 0 HG22 THR B 155 7.886 -1.876 12.071 1.00 0.00 H new ATOM 0 HG23 THR B 155 6.600 -1.830 13.300 1.00 0.00 H new ATOM 1564 N LEU B 156 5.573 -4.265 9.177 1.00 0.00 N ATOM 1565 CA LEU B 156 5.023 -5.205 8.206 1.00 0.00 C ATOM 1566 C LEU B 156 4.158 -6.256 8.895 1.00 0.00 C ATOM 1567 O LEU B 156 3.038 -6.532 8.464 1.00 0.00 O ATOM 1568 CB LEU B 156 6.151 -5.887 7.430 1.00 0.00 C ATOM 1569 CG LEU B 156 6.758 -5.079 6.282 1.00 0.00 C ATOM 1570 CD1 LEU B 156 5.690 -4.709 5.265 1.00 0.00 C ATOM 1571 CD2 LEU B 156 7.446 -3.830 6.813 1.00 0.00 C ATOM 0 H LEU B 156 6.591 -4.272 9.240 1.00 0.00 H new ATOM 0 HA LEU B 156 4.398 -4.645 7.510 1.00 0.00 H new ATOM 0 HB2 LEU B 156 6.947 -6.139 8.131 1.00 0.00 H new ATOM 0 HB3 LEU B 156 5.772 -6.826 7.027 1.00 0.00 H new ATOM 0 HG LEU B 156 7.505 -5.698 5.785 1.00 0.00 H new ATOM 0 HD11 LEU B 156 6.141 -4.135 4.456 1.00 0.00 H new ATOM 0 HD12 LEU B 156 5.243 -5.617 4.860 1.00 0.00 H new ATOM 0 HD13 LEU B 156 4.919 -4.110 5.749 1.00 0.00 H new ATOM 0 HD21 LEU B 156 7.872 -3.268 5.982 1.00 0.00 H new ATOM 0 HD22 LEU B 156 6.719 -3.209 7.337 1.00 0.00 H new ATOM 0 HD23 LEU B 156 8.241 -4.117 7.502 1.00 0.00 H new ATOM 1583 N SER B 157 4.684 -6.836 9.969 1.00 0.00 N ATOM 1584 CA SER B 157 3.960 -7.857 10.717 1.00 0.00 C ATOM 1585 C SER B 157 2.672 -7.289 11.305 1.00 0.00 C ATOM 1586 O SER B 157 1.762 -8.034 11.668 1.00 0.00 O ATOM 1587 CB SER B 157 4.840 -8.419 11.835 1.00 0.00 C ATOM 1588 OG SER B 157 4.129 -9.362 12.619 1.00 0.00 O ATOM 0 H SER B 157 5.608 -6.616 10.340 1.00 0.00 H new ATOM 0 HA SER B 157 3.700 -8.661 10.029 1.00 0.00 H new ATOM 0 HB2 SER B 157 5.723 -8.891 11.404 1.00 0.00 H new ATOM 0 HB3 SER B 157 5.191 -7.605 12.469 1.00 0.00 H new ATOM 0 HG SER B 157 4.714 -9.707 13.325 1.00 0.00 H new ATOM 1594 N ASP B 158 2.604 -5.965 11.397 1.00 0.00 N ATOM 1595 CA ASP B 158 1.428 -5.296 11.939 1.00 0.00 C ATOM 1596 C ASP B 158 0.248 -5.407 10.980 1.00 0.00 C ATOM 1597 O ASP B 158 -0.899 -5.547 11.403 1.00 0.00 O ATOM 1598 CB ASP B 158 1.737 -3.824 12.221 1.00 0.00 C ATOM 1599 CG ASP B 158 0.990 -3.297 13.430 1.00 0.00 C ATOM 1600 OD1 ASP B 158 -0.194 -2.932 13.283 1.00 0.00 O ATOM 1601 OD2 ASP B 158 1.592 -3.249 14.524 1.00 0.00 O ATOM 0 H ASP B 158 3.350 -5.334 11.103 1.00 0.00 H new ATOM 0 HA ASP B 158 1.159 -5.788 12.874 1.00 0.00 H new ATOM 0 HB2 ASP B 158 2.809 -3.705 12.379 1.00 0.00 H new ATOM 0 HB3 ASP B 158 1.475 -3.227 11.347 1.00 0.00 H new ATOM 1606 N TYR B 159 0.537 -5.342 9.685 1.00 0.00 N ATOM 1607 CA TYR B 159 -0.500 -5.431 8.665 1.00 0.00 C ATOM 1608 C TYR B 159 -0.551 -6.832 8.061 1.00 0.00 C ATOM 1609 O TYR B 159 -1.142 -7.042 7.002 1.00 0.00 O ATOM 1610 CB TYR B 159 -0.253 -4.398 7.564 1.00 0.00 C ATOM 1611 CG TYR B 159 -0.278 -2.969 8.059 1.00 0.00 C ATOM 1612 CD1 TYR B 159 -1.441 -2.414 8.580 1.00 0.00 C ATOM 1613 CD2 TYR B 159 0.860 -2.175 8.006 1.00 0.00 C ATOM 1614 CE1 TYR B 159 -1.469 -1.109 9.032 1.00 0.00 C ATOM 1615 CE2 TYR B 159 0.842 -0.869 8.458 1.00 0.00 C ATOM 1616 CZ TYR B 159 -0.324 -0.341 8.970 1.00 0.00 C ATOM 1617 OH TYR B 159 -0.348 0.958 9.420 1.00 0.00 O ATOM 0 H TYR B 159 1.481 -5.228 9.317 1.00 0.00 H new ATOM 0 HA TYR B 159 -1.459 -5.224 9.140 1.00 0.00 H new ATOM 0 HB2 TYR B 159 0.714 -4.597 7.101 1.00 0.00 H new ATOM 0 HB3 TYR B 159 -1.009 -4.518 6.788 1.00 0.00 H new ATOM 0 HD1 TYR B 159 -2.338 -3.013 8.632 1.00 0.00 H new ATOM 0 HD2 TYR B 159 1.775 -2.585 7.605 1.00 0.00 H new ATOM 0 HE1 TYR B 159 -2.382 -0.692 9.432 1.00 0.00 H new ATOM 0 HE2 TYR B 159 1.736 -0.266 8.410 1.00 0.00 H new ATOM 0 HH TYR B 159 -1.154 1.103 9.958 1.00 0.00 H new ATOM 1627 N ASN B 160 0.075 -7.786 8.741 1.00 0.00 N ATOM 1628 CA ASN B 160 0.101 -9.167 8.274 1.00 0.00 C ATOM 1629 C ASN B 160 0.588 -9.242 6.830 1.00 0.00 C ATOM 1630 O ASN B 160 0.115 -10.066 6.047 1.00 0.00 O ATOM 1631 CB ASN B 160 -1.290 -9.793 8.388 1.00 0.00 C ATOM 1632 CG ASN B 160 -1.242 -11.308 8.404 1.00 0.00 C ATOM 1633 OD1 ASN B 160 -0.886 -11.920 9.411 1.00 0.00 O ATOM 1634 ND2 ASN B 160 -1.600 -11.923 7.283 1.00 0.00 N ATOM 0 H ASN B 160 0.571 -7.628 9.618 1.00 0.00 H new ATOM 0 HA ASN B 160 0.795 -9.725 8.903 1.00 0.00 H new ATOM 0 HB2 ASN B 160 -1.772 -9.438 9.299 1.00 0.00 H new ATOM 0 HB3 ASN B 160 -1.905 -9.460 7.552 1.00 0.00 H new ATOM 0 HD21 ASN B 160 -1.587 -12.942 7.234 1.00 0.00 H new ATOM 0 HD22 ASN B 160 -1.889 -11.377 6.471 1.00 0.00 H new ATOM 1641 N ILE B 161 1.537 -8.378 6.485 1.00 0.00 N ATOM 1642 CA ILE B 161 2.089 -8.348 5.136 1.00 0.00 C ATOM 1643 C ILE B 161 3.044 -9.515 4.908 1.00 0.00 C ATOM 1644 O ILE B 161 4.192 -9.486 5.350 1.00 0.00 O ATOM 1645 CB ILE B 161 2.834 -7.028 4.862 1.00 0.00 C ATOM 1646 CG1 ILE B 161 1.852 -5.854 4.862 1.00 0.00 C ATOM 1647 CG2 ILE B 161 3.577 -7.104 3.536 1.00 0.00 C ATOM 1648 CD1 ILE B 161 2.529 -4.501 4.864 1.00 0.00 C ATOM 0 H ILE B 161 1.940 -7.690 7.121 1.00 0.00 H new ATOM 0 HA ILE B 161 1.248 -8.430 4.448 1.00 0.00 H new ATOM 0 HB ILE B 161 3.563 -6.868 5.656 1.00 0.00 H new ATOM 0 HG12 ILE B 161 1.209 -5.928 3.985 1.00 0.00 H new ATOM 0 HG13 ILE B 161 1.207 -5.930 5.737 1.00 0.00 H new ATOM 0 HG21 ILE B 161 4.098 -6.164 3.357 1.00 0.00 H new ATOM 0 HG22 ILE B 161 4.300 -7.919 3.570 1.00 0.00 H new ATOM 0 HG23 ILE B 161 2.866 -7.284 2.730 1.00 0.00 H new ATOM 0 HD11 ILE B 161 1.773 -3.716 4.864 1.00 0.00 H new ATOM 0 HD12 ILE B 161 3.150 -4.406 5.755 1.00 0.00 H new ATOM 0 HD13 ILE B 161 3.152 -4.405 3.975 1.00 0.00 H new ATOM 1660 N GLN B 162 2.562 -10.539 4.212 1.00 0.00 N ATOM 1661 CA GLN B 162 3.374 -11.715 3.922 1.00 0.00 C ATOM 1662 C GLN B 162 4.098 -11.563 2.589 1.00 0.00 C ATOM 1663 O GLN B 162 4.096 -10.487 1.988 1.00 0.00 O ATOM 1664 CB GLN B 162 2.500 -12.971 3.900 1.00 0.00 C ATOM 1665 CG GLN B 162 1.518 -13.049 5.059 1.00 0.00 C ATOM 1666 CD GLN B 162 2.208 -13.203 6.399 1.00 0.00 C ATOM 1667 OE1 GLN B 162 3.029 -14.100 6.588 1.00 0.00 O ATOM 1668 NE2 GLN B 162 1.876 -12.326 7.339 1.00 0.00 N ATOM 0 H GLN B 162 1.614 -10.578 3.838 1.00 0.00 H new ATOM 0 HA GLN B 162 4.120 -11.813 4.710 1.00 0.00 H new ATOM 0 HB2 GLN B 162 1.946 -13.001 2.962 1.00 0.00 H new ATOM 0 HB3 GLN B 162 3.143 -13.851 3.919 1.00 0.00 H new ATOM 0 HG2 GLN B 162 0.905 -12.148 5.072 1.00 0.00 H new ATOM 0 HG3 GLN B 162 0.844 -13.891 4.903 1.00 0.00 H new ATOM 0 HE21 GLN B 162 1.190 -11.598 7.138 1.00 0.00 H new ATOM 0 HE22 GLN B 162 2.307 -12.380 8.262 1.00 0.00 H new ATOM 1677 N LYS B 163 4.718 -12.644 2.131 1.00 0.00 N ATOM 1678 CA LYS B 163 5.447 -12.632 0.868 1.00 0.00 C ATOM 1679 C LYS B 163 4.491 -12.470 -0.310 1.00 0.00 C ATOM 1680 O LYS B 163 3.387 -13.015 -0.305 1.00 0.00 O ATOM 1681 CB LYS B 163 6.255 -13.922 0.709 1.00 0.00 C ATOM 1682 CG LYS B 163 7.184 -13.914 -0.492 1.00 0.00 C ATOM 1683 CD LYS B 163 8.440 -14.728 -0.231 1.00 0.00 C ATOM 1684 CE LYS B 163 9.514 -14.446 -1.270 1.00 0.00 C ATOM 1685 NZ LYS B 163 9.383 -15.335 -2.458 1.00 0.00 N ATOM 0 H LYS B 163 4.731 -13.541 2.616 1.00 0.00 H new ATOM 0 HA LYS B 163 6.130 -11.782 0.879 1.00 0.00 H new ATOM 0 HB2 LYS B 163 6.843 -14.086 1.612 1.00 0.00 H new ATOM 0 HB3 LYS B 163 5.567 -14.763 0.620 1.00 0.00 H new ATOM 0 HG2 LYS B 163 6.662 -14.317 -1.360 1.00 0.00 H new ATOM 0 HG3 LYS B 163 7.459 -12.887 -0.734 1.00 0.00 H new ATOM 0 HD2 LYS B 163 8.824 -14.497 0.763 1.00 0.00 H new ATOM 0 HD3 LYS B 163 8.195 -15.790 -0.239 1.00 0.00 H new ATOM 0 HE2 LYS B 163 9.449 -13.405 -1.586 1.00 0.00 H new ATOM 0 HE3 LYS B 163 10.498 -14.582 -0.821 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 10.133 -15.112 -3.143 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 9.470 -16.328 -2.160 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 8.454 -15.187 -2.901 1.00 0.00 H new ATOM 1699 N GLU B 164 4.924 -11.720 -1.318 1.00 0.00 N ATOM 1700 CA GLU B 164 4.105 -11.488 -2.503 1.00 0.00 C ATOM 1701 C GLU B 164 2.829 -10.732 -2.144 1.00 0.00 C ATOM 1702 O GLU B 164 1.724 -11.174 -2.457 1.00 0.00 O ATOM 1703 CB GLU B 164 3.752 -12.818 -3.174 1.00 0.00 C ATOM 1704 CG GLU B 164 4.936 -13.758 -3.325 1.00 0.00 C ATOM 1705 CD GLU B 164 4.821 -14.649 -4.546 1.00 0.00 C ATOM 1706 OE1 GLU B 164 3.689 -15.057 -4.880 1.00 0.00 O ATOM 1707 OE2 GLU B 164 5.865 -14.937 -5.170 1.00 0.00 O ATOM 0 H GLU B 164 5.836 -11.263 -1.339 1.00 0.00 H new ATOM 0 HA GLU B 164 4.683 -10.880 -3.199 1.00 0.00 H new ATOM 0 HB2 GLU B 164 2.977 -13.315 -2.591 1.00 0.00 H new ATOM 0 HB3 GLU B 164 3.330 -12.617 -4.159 1.00 0.00 H new ATOM 0 HG2 GLU B 164 5.853 -13.173 -3.392 1.00 0.00 H new ATOM 0 HG3 GLU B 164 5.018 -14.379 -2.433 1.00 0.00 H new ATOM 1714 N SER B 165 2.992 -9.589 -1.484 1.00 0.00 N ATOM 1715 CA SER B 165 1.854 -8.773 -1.078 1.00 0.00 C ATOM 1716 C SER B 165 1.530 -7.726 -2.140 1.00 0.00 C ATOM 1717 O SER B 165 2.423 -7.064 -2.670 1.00 0.00 O ATOM 1718 CB SER B 165 2.143 -8.088 0.259 1.00 0.00 C ATOM 1719 OG SER B 165 2.001 -8.995 1.338 1.00 0.00 O ATOM 0 H SER B 165 3.900 -9.208 -1.220 1.00 0.00 H new ATOM 0 HA SER B 165 0.990 -9.428 -0.963 1.00 0.00 H new ATOM 0 HB2 SER B 165 3.155 -7.682 0.252 1.00 0.00 H new ATOM 0 HB3 SER B 165 1.463 -7.247 0.395 1.00 0.00 H new ATOM 0 HG SER B 165 2.747 -9.631 1.331 1.00 0.00 H new ATOM 1725 N THR B 166 0.245 -7.581 -2.445 1.00 0.00 N ATOM 1726 CA THR B 166 -0.199 -6.616 -3.444 1.00 0.00 C ATOM 1727 C THR B 166 -0.497 -5.263 -2.808 1.00 0.00 C ATOM 1728 O THR B 166 -1.604 -5.022 -2.326 1.00 0.00 O ATOM 1729 CB THR B 166 -1.457 -7.111 -4.183 1.00 0.00 C ATOM 1730 OG1 THR B 166 -1.467 -8.542 -4.228 1.00 0.00 O ATOM 1731 CG2 THR B 166 -1.508 -6.553 -5.597 1.00 0.00 C ATOM 0 H THR B 166 -0.507 -8.119 -2.015 1.00 0.00 H new ATOM 0 HA THR B 166 0.615 -6.506 -4.160 1.00 0.00 H new ATOM 0 HB THR B 166 -2.334 -6.759 -3.639 1.00 0.00 H new ATOM 0 HG1 THR B 166 -2.270 -8.849 -4.698 1.00 0.00 H new ATOM 0 HG21 THR B 166 -2.405 -6.916 -6.099 1.00 0.00 H new ATOM 0 HG22 THR B 166 -1.530 -5.464 -5.558 1.00 0.00 H new ATOM 0 HG23 THR B 166 -0.626 -6.879 -6.149 1.00 0.00 H new ATOM 1739 N LEU B 167 0.498 -4.383 -2.807 1.00 0.00 N ATOM 1740 CA LEU B 167 0.343 -3.053 -2.230 1.00 0.00 C ATOM 1741 C LEU B 167 0.245 -1.993 -3.323 1.00 0.00 C ATOM 1742 O LEU B 167 0.662 -2.218 -4.460 1.00 0.00 O ATOM 1743 CB LEU B 167 1.516 -2.738 -1.302 1.00 0.00 C ATOM 1744 CG LEU B 167 1.685 -3.661 -0.095 1.00 0.00 C ATOM 1745 CD1 LEU B 167 2.638 -4.800 -0.424 1.00 0.00 C ATOM 1746 CD2 LEU B 167 2.183 -2.878 1.111 1.00 0.00 C ATOM 0 H LEU B 167 1.421 -4.567 -3.200 1.00 0.00 H new ATOM 0 HA LEU B 167 -0.582 -3.040 -1.653 1.00 0.00 H new ATOM 0 HB2 LEU B 167 2.435 -2.768 -1.888 1.00 0.00 H new ATOM 0 HB3 LEU B 167 1.402 -1.716 -0.939 1.00 0.00 H new ATOM 0 HG LEU B 167 0.712 -4.087 0.151 1.00 0.00 H new ATOM 0 HD11 LEU B 167 2.746 -5.447 0.447 1.00 0.00 H new ATOM 0 HD12 LEU B 167 2.240 -5.378 -1.258 1.00 0.00 H new ATOM 0 HD13 LEU B 167 3.612 -4.393 -0.697 1.00 0.00 H new ATOM 0 HD21 LEU B 167 2.297 -3.552 1.960 1.00 0.00 H new ATOM 0 HD22 LEU B 167 3.145 -2.423 0.877 1.00 0.00 H new ATOM 0 HD23 LEU B 167 1.464 -2.098 1.361 1.00 0.00 H new ATOM 1758 N HIS B 168 -0.307 -0.836 -2.970 1.00 0.00 N ATOM 1759 CA HIS B 168 -0.457 0.261 -3.921 1.00 0.00 C ATOM 1760 C HIS B 168 0.434 1.438 -3.537 1.00 0.00 C ATOM 1761 O HIS B 168 1.008 1.466 -2.447 1.00 0.00 O ATOM 1762 CB HIS B 168 -1.917 0.711 -3.986 1.00 0.00 C ATOM 1763 CG HIS B 168 -2.693 0.070 -5.095 1.00 0.00 C ATOM 1764 ND1 HIS B 168 -3.197 -1.212 -5.018 1.00 0.00 N ATOM 1765 CD2 HIS B 168 -3.051 0.540 -6.313 1.00 0.00 C ATOM 1766 CE1 HIS B 168 -3.830 -1.502 -6.140 1.00 0.00 C ATOM 1767 NE2 HIS B 168 -3.757 -0.454 -6.942 1.00 0.00 N ATOM 0 H HIS B 168 -0.657 -0.634 -2.034 1.00 0.00 H new ATOM 0 HA HIS B 168 -0.151 -0.098 -4.904 1.00 0.00 H new ATOM 0 HB2 HIS B 168 -2.401 0.484 -3.036 1.00 0.00 H new ATOM 0 HB3 HIS B 168 -1.950 1.794 -4.109 1.00 0.00 H new ATOM 0 HD2 HIS B 168 -2.823 1.516 -6.715 1.00 0.00 H new ATOM 0 HE1 HIS B 168 -4.323 -2.436 -6.364 1.00 0.00 H new ATOM 0 HE2 HIS B 168 -4.160 -0.394 -7.877 1.00 0.00 H new ATOM 1775 N LEU B 169 0.546 2.407 -4.439 1.00 0.00 N ATOM 1776 CA LEU B 169 1.368 3.587 -4.195 1.00 0.00 C ATOM 1777 C LEU B 169 0.534 4.860 -4.281 1.00 0.00 C ATOM 1778 O LEU B 169 -0.187 5.078 -5.256 1.00 0.00 O ATOM 1779 CB LEU B 169 2.518 3.648 -5.201 1.00 0.00 C ATOM 1780 CG LEU B 169 3.804 4.319 -4.712 1.00 0.00 C ATOM 1781 CD1 LEU B 169 3.544 5.773 -4.354 1.00 0.00 C ATOM 1782 CD2 LEU B 169 4.376 3.567 -3.519 1.00 0.00 C ATOM 0 H LEU B 169 0.078 2.399 -5.345 1.00 0.00 H new ATOM 0 HA LEU B 169 1.778 3.512 -3.188 1.00 0.00 H new ATOM 0 HB2 LEU B 169 2.758 2.631 -5.510 1.00 0.00 H new ATOM 0 HB3 LEU B 169 2.170 4.177 -6.088 1.00 0.00 H new ATOM 0 HG LEU B 169 4.536 4.291 -5.519 1.00 0.00 H new ATOM 0 HD11 LEU B 169 4.469 6.234 -4.008 1.00 0.00 H new ATOM 0 HD12 LEU B 169 3.180 6.305 -5.233 1.00 0.00 H new ATOM 0 HD13 LEU B 169 2.796 5.825 -3.563 1.00 0.00 H new ATOM 0 HD21 LEU B 169 5.290 4.057 -3.184 1.00 0.00 H new ATOM 0 HD22 LEU B 169 3.648 3.564 -2.708 1.00 0.00 H new ATOM 0 HD23 LEU B 169 4.600 2.541 -3.809 1.00 0.00 H new ATOM 1794 N VAL B 170 0.636 5.701 -3.257 1.00 0.00 N ATOM 1795 CA VAL B 170 -0.108 6.955 -3.219 1.00 0.00 C ATOM 1796 C VAL B 170 0.794 8.116 -2.816 1.00 0.00 C ATOM 1797 O VAL B 170 1.389 8.109 -1.738 1.00 0.00 O ATOM 1798 CB VAL B 170 -1.293 6.874 -2.238 1.00 0.00 C ATOM 1799 CG1 VAL B 170 -2.106 8.159 -2.278 1.00 0.00 C ATOM 1800 CG2 VAL B 170 -2.166 5.670 -2.555 1.00 0.00 C ATOM 0 H VAL B 170 1.227 5.537 -2.442 1.00 0.00 H new ATOM 0 HA VAL B 170 -0.490 7.128 -4.225 1.00 0.00 H new ATOM 0 HB VAL B 170 -0.900 6.752 -1.229 1.00 0.00 H new ATOM 0 HG11 VAL B 170 -2.939 8.084 -1.579 1.00 0.00 H new ATOM 0 HG12 VAL B 170 -1.471 9.000 -1.998 1.00 0.00 H new ATOM 0 HG13 VAL B 170 -2.491 8.315 -3.286 1.00 0.00 H new ATOM 0 HG21 VAL B 170 -2.998 5.629 -1.852 1.00 0.00 H new ATOM 0 HG22 VAL B 170 -2.553 5.758 -3.570 1.00 0.00 H new ATOM 0 HG23 VAL B 170 -1.574 4.759 -2.470 1.00 0.00 H new ATOM 1810 N LEU B 171 0.891 9.113 -3.689 1.00 0.00 N ATOM 1811 CA LEU B 171 1.720 10.283 -3.424 1.00 0.00 C ATOM 1812 C LEU B 171 0.860 11.493 -3.073 1.00 0.00 C ATOM 1813 O LEU B 171 0.037 11.936 -3.876 1.00 0.00 O ATOM 1814 CB LEU B 171 2.593 10.601 -4.640 1.00 0.00 C ATOM 1815 CG LEU B 171 4.038 10.105 -4.576 1.00 0.00 C ATOM 1816 CD1 LEU B 171 4.182 8.783 -5.316 1.00 0.00 C ATOM 1817 CD2 LEU B 171 4.985 11.147 -5.153 1.00 0.00 C ATOM 0 H LEU B 171 0.406 9.134 -4.586 1.00 0.00 H new ATOM 0 HA LEU B 171 2.361 10.056 -2.572 1.00 0.00 H new ATOM 0 HB2 LEU B 171 2.121 10.171 -5.524 1.00 0.00 H new ATOM 0 HB3 LEU B 171 2.607 11.682 -4.780 1.00 0.00 H new ATOM 0 HG LEU B 171 4.301 9.943 -3.531 1.00 0.00 H new ATOM 0 HD11 LEU B 171 5.217 8.445 -5.260 1.00 0.00 H new ATOM 0 HD12 LEU B 171 3.532 8.037 -4.859 1.00 0.00 H new ATOM 0 HD13 LEU B 171 3.901 8.918 -6.360 1.00 0.00 H new ATOM 0 HD21 LEU B 171 6.009 10.777 -5.099 1.00 0.00 H new ATOM 0 HD22 LEU B 171 4.723 11.340 -6.193 1.00 0.00 H new ATOM 0 HD23 LEU B 171 4.902 12.071 -4.580 1.00 0.00 H new ATOM 1829 N ARG B 172 1.055 12.023 -1.870 1.00 0.00 N ATOM 1830 CA ARG B 172 0.297 13.181 -1.414 1.00 0.00 C ATOM 1831 C ARG B 172 1.196 14.409 -1.302 1.00 0.00 C ATOM 1832 O ARG B 172 1.609 14.792 -0.206 1.00 0.00 O ATOM 1833 CB ARG B 172 -0.356 12.890 -0.062 1.00 0.00 C ATOM 1834 CG ARG B 172 -1.753 12.301 -0.175 1.00 0.00 C ATOM 1835 CD ARG B 172 -2.719 13.282 -0.820 1.00 0.00 C ATOM 1836 NE ARG B 172 -2.619 14.616 -0.233 1.00 0.00 N ATOM 1837 CZ ARG B 172 -3.043 14.915 0.989 1.00 0.00 C ATOM 1838 NH1 ARG B 172 -3.594 13.980 1.751 1.00 0.00 N ATOM 1839 NH2 ARG B 172 -2.917 16.152 1.452 1.00 0.00 N ATOM 0 H ARG B 172 1.732 11.669 -1.194 1.00 0.00 H new ATOM 0 HA ARG B 172 -0.481 13.387 -2.149 1.00 0.00 H new ATOM 0 HB2 ARG B 172 0.276 12.200 0.496 1.00 0.00 H new ATOM 0 HB3 ARG B 172 -0.406 13.814 0.514 1.00 0.00 H new ATOM 0 HG2 ARG B 172 -1.716 11.384 -0.763 1.00 0.00 H new ATOM 0 HG3 ARG B 172 -2.116 12.029 0.816 1.00 0.00 H new ATOM 0 HD2 ARG B 172 -2.516 13.341 -1.889 1.00 0.00 H new ATOM 0 HD3 ARG B 172 -3.739 12.913 -0.709 1.00 0.00 H new ATOM 0 HE ARG B 172 -2.200 15.359 -0.793 1.00 0.00 H new ATOM 0 HH11 ARG B 172 -3.693 13.028 1.399 1.00 0.00 H new ATOM 0 HH12 ARG B 172 -3.919 14.213 2.689 1.00 0.00 H new ATOM 0 HH21 ARG B 172 -2.494 16.874 0.869 1.00 0.00 H new ATOM 0 HH22 ARG B 172 -3.243 16.381 2.391 1.00 0.00 H new ATOM 1853 N LEU B 173 1.496 15.022 -2.442 1.00 0.00 N ATOM 1854 CA LEU B 173 2.347 16.207 -2.472 1.00 0.00 C ATOM 1855 C LEU B 173 1.846 17.263 -1.492 1.00 0.00 C ATOM 1856 O LEU B 173 0.640 17.460 -1.340 1.00 0.00 O ATOM 1857 CB LEU B 173 2.392 16.789 -3.886 1.00 0.00 C ATOM 1858 CG LEU B 173 3.424 16.174 -4.832 1.00 0.00 C ATOM 1859 CD1 LEU B 173 2.968 16.300 -6.277 1.00 0.00 C ATOM 1860 CD2 LEU B 173 4.783 16.832 -4.641 1.00 0.00 C ATOM 0 H LEU B 173 1.163 14.719 -3.357 1.00 0.00 H new ATOM 0 HA LEU B 173 3.353 15.910 -2.174 1.00 0.00 H new ATOM 0 HB2 LEU B 173 1.405 16.677 -4.335 1.00 0.00 H new ATOM 0 HB3 LEU B 173 2.589 17.858 -3.811 1.00 0.00 H new ATOM 0 HG LEU B 173 3.519 15.115 -4.594 1.00 0.00 H new ATOM 0 HD11 LEU B 173 3.716 15.857 -6.934 1.00 0.00 H new ATOM 0 HD12 LEU B 173 2.018 15.781 -6.405 1.00 0.00 H new ATOM 0 HD13 LEU B 173 2.843 17.353 -6.528 1.00 0.00 H new ATOM 0 HD21 LEU B 173 5.504 16.381 -5.323 1.00 0.00 H new ATOM 0 HD22 LEU B 173 4.703 17.899 -4.850 1.00 0.00 H new ATOM 0 HD23 LEU B 173 5.116 16.688 -3.613 1.00 0.00 H new