USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 969 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 42 THR OG1 : rot 91:sc= 2.15 USER MOD Set 1.2: B 68 SER OG : rot -131:sc= 0.928 USER MOD Set 2.1: B 47 THR OG1 : rot -72:sc= 1.21 USER MOD Set 2.2: B 48 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 48 SER OG : rot -168:sc= 1.05 USER MOD Set 3.2: B 30 THR OG1 : rot -120:sc= 0.908 USER MOD Set 4.1: A 21 ASN : amide:sc= 0.211 K(o=1,f=-2.6) USER MOD Set 4.2: A 25 LYS NZ :NH3+ -112:sc= 0.829 (180deg=-1.51!) USER MOD Set 5.1: A 14 GLN : amide:sc= -0.011 K(o=1,f=0.24) USER MOD Set 5.2: B 26 HIS : no HD1:sc= 1.03 K(o=1,f=-6.1!) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 HIS : no HD1:sc= -0.741 K(o=-0.74,f=-3.3!) USER MOD Single : A 27 LYS NZ :NH3+ 158:sc= 1.18 (180deg=0.765) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 74:sc= 0.876 USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 40 MET CE :methyl -175:sc= 0 (180deg=-0.0282) USER MOD Single : A 43 ASN : amide:sc= -0.069 X(o=-0.069,f=-0.51!) USER MOD Single : A 46 ASN : amide:sc= -0.13 X(o=-0.13,f=-0.35!) USER MOD Single : A 47 THR OG1 : rot -81:sc= 1.26 USER MOD Single : A 53 GLN : amide:sc= -0.229 X(o=-0.23,f=-0.54) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 ASN : amide:sc= 0.149 K(o=0.15,f=-5!) USER MOD Single : A 60 SER OG : rot 31:sc= 0.794 USER MOD Single : A 66 GLN : amide:sc= -0.258 K(o=-0.26,f=-4.3!) USER MOD Single : A 67 SER OG : rot 68:sc= 0.675 USER MOD Single : A 68 SER OG : rot 73:sc= 0.938 USER MOD Single : B 8 SER OG : rot 36:sc= 0.178 USER MOD Single : B 11 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : B 14 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : B 21 ASN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : B 25 LYS NZ :NH3+ -150:sc= 1.28 (180deg=1.2) USER MOD Single : B 27 LYS NZ :NH3+ -119:sc= 0.765 (180deg=0.681) USER MOD Single : B 33 SER OG : rot 74:sc= 1.04 USER MOD Single : B 35 MET CE :methyl 156:sc= -0.23 (180deg=-0.937) USER MOD Single : B 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 40 MET CE :methyl -155:sc= -0.0743 (180deg=-0.579) USER MOD Single : B 42 THR OG1 : rot 85:sc= 1.19 USER MOD Single : B 43 ASN : amide:sc=-0.00153 X(o=-0.0015,f=-0.18) USER MOD Single : B 46 ASN : amide:sc= -0.194 K(o=-0.19,f=-2.7!) USER MOD Single : B 53 GLN : amide:sc= -0.0938 X(o=-0.094,f=-0.096) USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : B 59 ASN : amide:sc= 0.632 K(o=0.63,f=-4.2!) USER MOD Single : B 60 SER OG : rot 92:sc= 1.23 USER MOD Single : B 66 GLN : amide:sc= 0 K(o=0,f=-2.2!) USER MOD Single : B 67 SER OG : rot 80:sc= 1.13 USER MOD ----------------------------------------------------------------- ATOM 137 N ASP A 9 -11.980 7.738 13.452 1.00 0.00 N ATOM 138 CA ASP A 9 -12.342 7.456 12.063 1.00 0.00 C ATOM 139 C ASP A 9 -12.354 8.722 11.220 1.00 0.00 C ATOM 140 O ASP A 9 -11.711 8.786 10.175 1.00 0.00 O ATOM 141 CB ASP A 9 -13.723 6.799 11.989 1.00 0.00 C ATOM 142 CG ASP A 9 -13.834 5.558 12.847 1.00 0.00 C ATOM 143 OD1 ASP A 9 -14.083 5.700 14.064 1.00 0.00 O ATOM 144 OD2 ASP A 9 -13.694 4.439 12.310 1.00 0.00 O ATOM 0 HA ASP A 9 -11.587 6.777 11.667 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -14.479 7.519 12.302 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -13.940 6.538 10.953 1.00 0.00 H new ATOM 149 N GLU A 10 -13.068 9.735 11.694 1.00 0.00 N ATOM 150 CA GLU A 10 -13.246 10.973 10.944 1.00 0.00 C ATOM 151 C GLU A 10 -11.921 11.692 10.719 1.00 0.00 C ATOM 152 O GLU A 10 -11.791 12.475 9.785 1.00 0.00 O ATOM 153 CB GLU A 10 -14.222 11.909 11.660 1.00 0.00 C ATOM 154 CG GLU A 10 -15.543 11.255 12.023 1.00 0.00 C ATOM 155 CD GLU A 10 -15.568 10.751 13.450 1.00 0.00 C ATOM 156 OE1 GLU A 10 -14.673 9.966 13.833 1.00 0.00 O ATOM 157 OE2 GLU A 10 -16.476 11.154 14.207 1.00 0.00 O ATOM 0 H GLU A 10 -13.536 9.723 12.600 1.00 0.00 H new ATOM 0 HA GLU A 10 -13.658 10.700 9.972 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -13.751 12.284 12.569 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -14.417 12.772 11.023 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -16.351 11.972 11.880 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -15.732 10.423 11.344 1.00 0.00 H new ATOM 164 N GLN A 11 -10.943 11.429 11.574 1.00 0.00 N ATOM 165 CA GLN A 11 -9.623 12.024 11.420 1.00 0.00 C ATOM 166 C GLN A 11 -8.844 11.275 10.345 1.00 0.00 C ATOM 167 O GLN A 11 -8.158 11.875 9.513 1.00 0.00 O ATOM 168 CB GLN A 11 -8.862 11.990 12.747 1.00 0.00 C ATOM 169 CG GLN A 11 -7.520 12.702 12.701 1.00 0.00 C ATOM 170 CD GLN A 11 -6.773 12.609 14.013 1.00 0.00 C ATOM 171 OE1 GLN A 11 -6.939 13.451 14.897 1.00 0.00 O ATOM 172 NE2 GLN A 11 -5.944 11.589 14.151 1.00 0.00 N ATOM 0 H GLN A 11 -11.038 10.810 12.379 1.00 0.00 H new ATOM 0 HA GLN A 11 -9.738 13.065 11.118 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -9.479 12.446 13.521 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -8.702 10.952 13.038 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -6.910 12.271 11.907 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -7.677 13.751 12.449 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -5.836 10.914 13.394 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -5.412 11.477 15.014 1.00 0.00 H new ATOM 181 N VAL A 12 -8.973 9.956 10.364 1.00 0.00 N ATOM 182 CA VAL A 12 -8.332 9.105 9.374 1.00 0.00 C ATOM 183 C VAL A 12 -8.947 9.337 7.997 1.00 0.00 C ATOM 184 O VAL A 12 -8.236 9.529 7.010 1.00 0.00 O ATOM 185 CB VAL A 12 -8.461 7.613 9.752 1.00 0.00 C ATOM 186 CG1 VAL A 12 -7.814 6.729 8.697 1.00 0.00 C ATOM 187 CG2 VAL A 12 -7.840 7.353 11.117 1.00 0.00 C ATOM 0 H VAL A 12 -9.520 9.450 11.060 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.274 9.366 9.348 1.00 0.00 H new ATOM 0 HB VAL A 12 -9.521 7.366 9.800 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -7.918 5.683 8.985 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.304 6.891 7.737 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.756 6.979 8.612 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -7.940 6.297 11.367 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -6.784 7.622 11.093 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.351 7.954 11.869 1.00 0.00 H new ATOM 197 N GLU A 13 -10.275 9.338 7.948 1.00 0.00 N ATOM 198 CA GLU A 13 -10.999 9.547 6.701 1.00 0.00 C ATOM 199 C GLU A 13 -10.813 10.973 6.197 1.00 0.00 C ATOM 200 O GLU A 13 -10.924 11.231 5.003 1.00 0.00 O ATOM 201 CB GLU A 13 -12.484 9.242 6.887 1.00 0.00 C ATOM 202 CG GLU A 13 -12.760 7.805 7.293 1.00 0.00 C ATOM 203 CD GLU A 13 -14.234 7.539 7.508 1.00 0.00 C ATOM 204 OE1 GLU A 13 -14.746 7.848 8.601 1.00 0.00 O ATOM 205 OE2 GLU A 13 -14.894 7.035 6.575 1.00 0.00 O ATOM 0 H GLU A 13 -10.873 9.196 8.762 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.592 8.864 5.955 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -12.892 9.910 7.645 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -13.010 9.456 5.957 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -12.381 7.134 6.523 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -12.215 7.578 8.209 1.00 0.00 H new ATOM 212 N GLN A 14 -10.533 11.889 7.113 1.00 0.00 N ATOM 213 CA GLN A 14 -10.227 13.269 6.758 1.00 0.00 C ATOM 214 C GLN A 14 -8.983 13.314 5.882 1.00 0.00 C ATOM 215 O GLN A 14 -8.984 13.904 4.800 1.00 0.00 O ATOM 216 CB GLN A 14 -10.013 14.092 8.030 1.00 0.00 C ATOM 217 CG GLN A 14 -9.700 15.557 7.798 1.00 0.00 C ATOM 218 CD GLN A 14 -9.611 16.323 9.101 1.00 0.00 C ATOM 219 OE1 GLN A 14 -8.545 16.425 9.706 1.00 0.00 O ATOM 220 NE2 GLN A 14 -10.734 16.861 9.546 1.00 0.00 N ATOM 0 H GLN A 14 -10.511 11.700 8.115 1.00 0.00 H new ATOM 0 HA GLN A 14 -11.062 13.693 6.200 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -10.909 14.020 8.647 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -9.197 13.647 8.600 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -8.758 15.647 7.258 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -10.472 15.999 7.168 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -11.597 16.753 9.014 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -10.737 17.384 10.422 1.00 0.00 H new ATOM 229 N LEU A 15 -7.928 12.663 6.351 1.00 0.00 N ATOM 230 CA LEU A 15 -6.688 12.584 5.599 1.00 0.00 C ATOM 231 C LEU A 15 -6.891 11.717 4.358 1.00 0.00 C ATOM 232 O LEU A 15 -6.416 12.051 3.274 1.00 0.00 O ATOM 233 CB LEU A 15 -5.568 12.028 6.491 1.00 0.00 C ATOM 234 CG LEU A 15 -4.145 12.131 5.926 1.00 0.00 C ATOM 235 CD1 LEU A 15 -3.130 12.141 7.058 1.00 0.00 C ATOM 236 CD2 LEU A 15 -3.847 10.978 4.979 1.00 0.00 C ATOM 0 H LEU A 15 -7.908 12.182 7.250 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.394 13.582 5.273 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -5.597 12.552 7.446 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -5.781 10.979 6.696 1.00 0.00 H new ATOM 0 HG LEU A 15 -4.072 13.064 5.367 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -2.124 12.214 6.644 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -3.318 12.996 7.708 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.219 11.220 7.634 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.832 11.077 4.594 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.942 10.033 5.515 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.553 10.997 4.149 1.00 0.00 H new ATOM 248 N LEU A 16 -7.616 10.614 4.526 1.00 0.00 N ATOM 249 CA LEU A 16 -7.904 9.697 3.426 1.00 0.00 C ATOM 250 C LEU A 16 -8.620 10.414 2.283 1.00 0.00 C ATOM 251 O LEU A 16 -8.267 10.244 1.116 1.00 0.00 O ATOM 252 CB LEU A 16 -8.760 8.528 3.925 1.00 0.00 C ATOM 253 CG LEU A 16 -9.173 7.505 2.860 1.00 0.00 C ATOM 254 CD1 LEU A 16 -7.954 6.791 2.296 1.00 0.00 C ATOM 255 CD2 LEU A 16 -10.154 6.500 3.446 1.00 0.00 C ATOM 0 H LEU A 16 -8.017 10.332 5.420 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.955 9.315 3.049 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.210 8.007 4.709 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -9.662 8.932 4.384 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.663 8.037 2.045 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.271 6.070 1.542 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.283 7.520 1.841 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.433 6.271 3.100 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.439 5.780 2.679 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.685 5.977 4.279 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.042 7.023 3.800 1.00 0.00 H new ATOM 267 N ALA A 17 -9.620 11.218 2.628 1.00 0.00 N ATOM 268 CA ALA A 17 -10.388 11.961 1.637 1.00 0.00 C ATOM 269 C ALA A 17 -9.494 12.903 0.845 1.00 0.00 C ATOM 270 O ALA A 17 -9.566 12.951 -0.380 1.00 0.00 O ATOM 271 CB ALA A 17 -11.511 12.742 2.305 1.00 0.00 C ATOM 0 H ALA A 17 -9.918 11.372 3.591 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.824 11.241 0.945 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.073 13.290 1.549 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.177 12.051 2.822 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -11.088 13.445 3.023 1.00 0.00 H new ATOM 277 N GLU A 18 -8.644 13.642 1.547 1.00 0.00 N ATOM 278 CA GLU A 18 -7.734 14.575 0.895 1.00 0.00 C ATOM 279 C GLU A 18 -6.678 13.836 0.075 1.00 0.00 C ATOM 280 O GLU A 18 -6.277 14.300 -0.990 1.00 0.00 O ATOM 281 CB GLU A 18 -7.070 15.487 1.926 1.00 0.00 C ATOM 282 CG GLU A 18 -8.034 16.466 2.574 1.00 0.00 C ATOM 283 CD GLU A 18 -7.360 17.359 3.591 1.00 0.00 C ATOM 284 OE1 GLU A 18 -6.458 18.132 3.209 1.00 0.00 O ATOM 285 OE2 GLU A 18 -7.740 17.305 4.778 1.00 0.00 O ATOM 0 H GLU A 18 -8.566 13.614 2.564 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.319 15.190 0.212 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -6.611 14.873 2.701 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.267 16.044 1.444 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.493 17.083 1.802 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -8.838 15.912 3.059 1.00 0.00 H new ATOM 292 N LEU A 19 -6.241 12.683 0.566 1.00 0.00 N ATOM 293 CA LEU A 19 -5.268 11.864 -0.151 1.00 0.00 C ATOM 294 C LEU A 19 -5.886 11.361 -1.457 1.00 0.00 C ATOM 295 O LEU A 19 -5.284 11.462 -2.532 1.00 0.00 O ATOM 296 CB LEU A 19 -4.827 10.687 0.734 1.00 0.00 C ATOM 297 CG LEU A 19 -3.408 10.148 0.489 1.00 0.00 C ATOM 298 CD1 LEU A 19 -3.289 9.506 -0.885 1.00 0.00 C ATOM 299 CD2 LEU A 19 -2.380 11.262 0.650 1.00 0.00 C ATOM 0 H LEU A 19 -6.544 12.293 1.458 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.389 12.463 -0.390 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -4.901 10.996 1.777 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.533 9.869 0.593 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.209 9.378 1.234 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.274 9.135 -1.027 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.992 8.677 -0.961 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.516 10.246 -1.653 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.381 10.864 0.473 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.587 12.055 -0.069 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.436 11.665 1.661 1.00 0.00 H new ATOM 311 N LEU A 20 -7.102 10.840 -1.359 1.00 0.00 N ATOM 312 CA LEU A 20 -7.836 10.383 -2.531 1.00 0.00 C ATOM 313 C LEU A 20 -8.145 11.563 -3.449 1.00 0.00 C ATOM 314 O LEU A 20 -8.189 11.420 -4.671 1.00 0.00 O ATOM 315 CB LEU A 20 -9.130 9.680 -2.109 1.00 0.00 C ATOM 316 CG LEU A 20 -9.964 9.095 -3.252 1.00 0.00 C ATOM 317 CD1 LEU A 20 -9.182 8.022 -3.998 1.00 0.00 C ATOM 318 CD2 LEU A 20 -11.268 8.525 -2.717 1.00 0.00 C ATOM 0 H LEU A 20 -7.602 10.723 -0.477 1.00 0.00 H new ATOM 0 HA LEU A 20 -7.218 9.669 -3.076 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -8.878 8.876 -1.418 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -9.747 10.391 -1.559 1.00 0.00 H new ATOM 0 HG LEU A 20 -10.195 9.898 -3.952 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -9.794 7.621 -4.806 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -8.273 8.457 -4.414 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -8.918 7.219 -3.310 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -11.850 8.113 -3.541 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -11.052 7.737 -1.996 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -11.838 9.316 -2.230 1.00 0.00 H new ATOM 330 N ASN A 21 -8.347 12.730 -2.844 1.00 0.00 N ATOM 331 CA ASN A 21 -8.570 13.961 -3.592 1.00 0.00 C ATOM 332 C ASN A 21 -7.374 14.268 -4.484 1.00 0.00 C ATOM 333 O ASN A 21 -7.535 14.719 -5.614 1.00 0.00 O ATOM 334 CB ASN A 21 -8.824 15.135 -2.642 1.00 0.00 C ATOM 335 CG ASN A 21 -8.954 16.452 -3.379 1.00 0.00 C ATOM 336 OD1 ASN A 21 -7.966 17.154 -3.601 1.00 0.00 O ATOM 337 ND2 ASN A 21 -10.172 16.802 -3.757 1.00 0.00 N ATOM 0 H ASN A 21 -8.361 12.848 -1.831 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.452 13.820 -4.217 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -9.734 14.948 -2.072 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -8.007 15.202 -1.924 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -10.319 17.682 -4.252 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -10.964 16.192 -3.554 1.00 0.00 H new ATOM 344 N VAL A 22 -6.176 14.014 -3.972 1.00 0.00 N ATOM 345 CA VAL A 22 -4.962 14.196 -4.755 1.00 0.00 C ATOM 346 C VAL A 22 -5.003 13.305 -5.992 1.00 0.00 C ATOM 347 O VAL A 22 -4.785 13.768 -7.114 1.00 0.00 O ATOM 348 CB VAL A 22 -3.697 13.866 -3.936 1.00 0.00 C ATOM 349 CG1 VAL A 22 -2.444 14.153 -4.746 1.00 0.00 C ATOM 350 CG2 VAL A 22 -3.679 14.644 -2.632 1.00 0.00 C ATOM 0 H VAL A 22 -6.020 13.682 -3.020 1.00 0.00 H new ATOM 0 HA VAL A 22 -4.916 15.245 -5.048 1.00 0.00 H new ATOM 0 HB VAL A 22 -3.716 12.803 -3.697 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -1.563 13.914 -4.150 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.448 13.544 -5.650 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.421 15.208 -5.020 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -2.778 14.395 -2.072 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -3.689 15.713 -2.846 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -4.557 14.384 -2.041 1.00 0.00 H new ATOM 360 N LEU A 23 -5.311 12.032 -5.776 1.00 0.00 N ATOM 361 CA LEU A 23 -5.416 11.063 -6.865 1.00 0.00 C ATOM 362 C LEU A 23 -6.432 11.538 -7.909 1.00 0.00 C ATOM 363 O LEU A 23 -6.146 11.551 -9.108 1.00 0.00 O ATOM 364 CB LEU A 23 -5.820 9.692 -6.289 1.00 0.00 C ATOM 365 CG LEU A 23 -5.674 8.480 -7.223 1.00 0.00 C ATOM 366 CD1 LEU A 23 -5.699 7.193 -6.413 1.00 0.00 C ATOM 367 CD2 LEU A 23 -6.782 8.445 -8.267 1.00 0.00 C ATOM 0 H LEU A 23 -5.494 11.643 -4.851 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.450 10.969 -7.360 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.221 9.508 -5.397 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.860 9.751 -5.968 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.719 8.572 -7.740 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.595 6.339 -7.083 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.875 7.196 -5.699 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.645 7.119 -5.876 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.648 7.575 -8.911 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.749 8.382 -7.769 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.743 9.352 -8.870 1.00 0.00 H new ATOM 379 N GLU A 24 -7.604 11.947 -7.441 1.00 0.00 N ATOM 380 CA GLU A 24 -8.689 12.353 -8.326 1.00 0.00 C ATOM 381 C GLU A 24 -8.377 13.672 -9.036 1.00 0.00 C ATOM 382 O GLU A 24 -8.565 13.790 -10.246 1.00 0.00 O ATOM 383 CB GLU A 24 -9.990 12.469 -7.525 1.00 0.00 C ATOM 384 CG GLU A 24 -11.210 12.830 -8.360 1.00 0.00 C ATOM 385 CD GLU A 24 -11.431 11.885 -9.526 1.00 0.00 C ATOM 386 OE1 GLU A 24 -11.444 10.654 -9.315 1.00 0.00 O ATOM 387 OE2 GLU A 24 -11.582 12.371 -10.665 1.00 0.00 O ATOM 0 H GLU A 24 -7.829 12.007 -6.448 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.804 11.590 -9.096 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.178 11.521 -7.020 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -9.859 13.223 -6.749 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -12.094 12.825 -7.723 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.096 13.846 -8.739 1.00 0.00 H new ATOM 394 N LYS A 25 -7.884 14.651 -8.285 1.00 0.00 N ATOM 395 CA LYS A 25 -7.628 15.982 -8.831 1.00 0.00 C ATOM 396 C LYS A 25 -6.499 15.958 -9.861 1.00 0.00 C ATOM 397 O LYS A 25 -6.538 16.687 -10.847 1.00 0.00 O ATOM 398 CB LYS A 25 -7.301 16.974 -7.704 1.00 0.00 C ATOM 399 CG LYS A 25 -7.121 18.410 -8.182 1.00 0.00 C ATOM 400 CD LYS A 25 -6.952 19.396 -7.027 1.00 0.00 C ATOM 401 CE LYS A 25 -5.675 19.153 -6.233 1.00 0.00 C ATOM 402 NZ LYS A 25 -5.854 18.145 -5.150 1.00 0.00 N ATOM 0 H LYS A 25 -7.653 14.549 -7.297 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.536 16.311 -9.337 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.100 16.945 -6.964 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.389 16.651 -7.202 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -6.249 18.466 -8.833 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.984 18.701 -8.780 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -6.943 20.413 -7.420 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -7.811 19.319 -6.360 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -4.889 18.817 -6.910 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -5.339 20.094 -5.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.777 18.613 -4.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.792 17.704 -5.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -5.119 17.414 -5.231 1.00 0.00 H new ATOM 416 N HIS A 26 -5.495 15.116 -9.639 1.00 0.00 N ATOM 417 CA HIS A 26 -4.383 15.006 -10.586 1.00 0.00 C ATOM 418 C HIS A 26 -4.724 14.022 -11.693 1.00 0.00 C ATOM 419 O HIS A 26 -4.075 14.002 -12.738 1.00 0.00 O ATOM 420 CB HIS A 26 -3.091 14.563 -9.890 1.00 0.00 C ATOM 421 CG HIS A 26 -2.531 15.575 -8.943 1.00 0.00 C ATOM 422 ND1 HIS A 26 -1.377 16.289 -9.190 1.00 0.00 N ATOM 423 CD2 HIS A 26 -2.959 15.973 -7.725 1.00 0.00 C ATOM 424 CE1 HIS A 26 -1.121 17.074 -8.162 1.00 0.00 C ATOM 425 NE2 HIS A 26 -2.069 16.900 -7.262 1.00 0.00 N ATOM 0 H HIS A 26 -5.425 14.506 -8.824 1.00 0.00 H new ATOM 0 HA HIS A 26 -4.221 15.996 -11.014 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.283 13.638 -9.345 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -2.341 14.337 -10.648 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -3.842 15.623 -7.212 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -0.279 17.745 -8.072 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -2.128 17.381 -6.364 1.00 0.00 H new ATOM 434 N LYS A 27 -5.750 13.214 -11.443 1.00 0.00 N ATOM 435 CA LYS A 27 -6.194 12.184 -12.373 1.00 0.00 C ATOM 436 C LYS A 27 -5.067 11.198 -12.661 1.00 0.00 C ATOM 437 O LYS A 27 -4.386 11.278 -13.686 1.00 0.00 O ATOM 438 CB LYS A 27 -6.733 12.805 -13.668 1.00 0.00 C ATOM 439 CG LYS A 27 -7.365 11.798 -14.623 1.00 0.00 C ATOM 440 CD LYS A 27 -8.461 10.984 -13.946 1.00 0.00 C ATOM 441 CE LYS A 27 -9.538 11.871 -13.343 1.00 0.00 C ATOM 442 NZ LYS A 27 -10.609 11.071 -12.698 1.00 0.00 N ATOM 0 H LYS A 27 -6.299 13.257 -10.584 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.012 11.635 -11.907 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.473 13.564 -13.414 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.918 13.315 -14.181 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -7.781 12.324 -15.482 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -6.596 11.126 -15.003 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -8.912 10.308 -14.673 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.022 10.364 -13.164 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -9.090 12.539 -12.608 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -9.971 12.499 -14.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -11.107 11.658 -11.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.283 10.746 -13.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -10.188 10.248 -12.222 1.00 0.00 H new ATOM 456 N ALA A 28 -4.855 10.292 -11.723 1.00 0.00 N ATOM 457 CA ALA A 28 -3.826 9.280 -11.860 1.00 0.00 C ATOM 458 C ALA A 28 -4.450 7.910 -12.075 1.00 0.00 C ATOM 459 O ALA A 28 -5.325 7.495 -11.315 1.00 0.00 O ATOM 460 CB ALA A 28 -2.928 9.266 -10.632 1.00 0.00 C ATOM 0 H ALA A 28 -5.386 10.238 -10.854 1.00 0.00 H new ATOM 0 HA ALA A 28 -3.218 9.523 -12.732 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -2.161 8.501 -10.751 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.454 10.241 -10.517 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -3.525 9.047 -9.747 1.00 0.00 H new ATOM 466 N PRO A 29 -4.031 7.204 -13.136 1.00 0.00 N ATOM 467 CA PRO A 29 -4.498 5.845 -13.413 1.00 0.00 C ATOM 468 C PRO A 29 -4.105 4.880 -12.298 1.00 0.00 C ATOM 469 O PRO A 29 -3.201 5.167 -11.509 1.00 0.00 O ATOM 470 CB PRO A 29 -3.793 5.471 -14.723 1.00 0.00 C ATOM 471 CG PRO A 29 -2.645 6.417 -14.835 1.00 0.00 C ATOM 472 CD PRO A 29 -3.083 7.681 -14.155 1.00 0.00 C ATOM 0 HA PRO A 29 -5.584 5.790 -13.482 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -3.450 4.437 -14.704 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -4.467 5.568 -15.574 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -1.754 6.007 -14.360 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.393 6.603 -15.879 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.242 8.209 -13.706 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.556 8.371 -14.854 1.00 0.00 H new ATOM 480 N THR A 30 -4.775 3.735 -12.243 1.00 0.00 N ATOM 481 CA THR A 30 -4.534 2.750 -11.194 1.00 0.00 C ATOM 482 C THR A 30 -3.063 2.330 -11.149 1.00 0.00 C ATOM 483 O THR A 30 -2.471 2.220 -10.073 1.00 0.00 O ATOM 484 CB THR A 30 -5.426 1.507 -11.396 1.00 0.00 C ATOM 485 OG1 THR A 30 -6.796 1.912 -11.500 1.00 0.00 O ATOM 486 CG2 THR A 30 -5.275 0.523 -10.241 1.00 0.00 C ATOM 0 H THR A 30 -5.493 3.465 -12.915 1.00 0.00 H new ATOM 0 HA THR A 30 -4.787 3.219 -10.243 1.00 0.00 H new ATOM 0 HB THR A 30 -5.112 1.009 -12.313 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.362 1.122 -11.630 1.00 0.00 H new ATOM 0 HG21 THR A 30 -5.916 -0.341 -10.413 1.00 0.00 H new ATOM 0 HG22 THR A 30 -4.237 0.197 -10.174 1.00 0.00 H new ATOM 0 HG23 THR A 30 -5.564 1.009 -9.309 1.00 0.00 H new ATOM 494 N ASP A 31 -2.471 2.127 -12.325 1.00 0.00 N ATOM 495 CA ASP A 31 -1.063 1.739 -12.423 1.00 0.00 C ATOM 496 C ASP A 31 -0.160 2.796 -11.793 1.00 0.00 C ATOM 497 O ASP A 31 0.705 2.480 -10.979 1.00 0.00 O ATOM 498 CB ASP A 31 -0.667 1.528 -13.887 1.00 0.00 C ATOM 499 CG ASP A 31 0.798 1.166 -14.050 1.00 0.00 C ATOM 500 OD1 ASP A 31 1.142 -0.022 -13.905 1.00 0.00 O ATOM 501 OD2 ASP A 31 1.611 2.071 -14.339 1.00 0.00 O ATOM 0 H ASP A 31 -2.944 2.225 -13.224 1.00 0.00 H new ATOM 0 HA ASP A 31 -0.936 0.803 -11.879 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -1.283 0.737 -14.315 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.878 2.437 -14.451 1.00 0.00 H new ATOM 506 N LEU A 32 -0.384 4.054 -12.161 1.00 0.00 N ATOM 507 CA LEU A 32 0.410 5.161 -11.635 1.00 0.00 C ATOM 508 C LEU A 32 0.213 5.295 -10.131 1.00 0.00 C ATOM 509 O LEU A 32 1.171 5.501 -9.387 1.00 0.00 O ATOM 510 CB LEU A 32 0.035 6.471 -12.336 1.00 0.00 C ATOM 511 CG LEU A 32 0.760 7.721 -11.828 1.00 0.00 C ATOM 512 CD1 LEU A 32 2.267 7.567 -11.965 1.00 0.00 C ATOM 513 CD2 LEU A 32 0.283 8.953 -12.581 1.00 0.00 C ATOM 0 H LEU A 32 -1.109 4.333 -12.822 1.00 0.00 H new ATOM 0 HA LEU A 32 1.461 4.949 -11.830 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.237 6.363 -13.402 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.039 6.626 -12.229 1.00 0.00 H new ATOM 0 HG LEU A 32 0.525 7.845 -10.771 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.760 8.467 -11.598 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.599 6.708 -11.382 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.523 7.415 -13.013 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.808 9.833 -12.208 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.488 8.831 -13.645 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.789 9.079 -12.430 1.00 0.00 H new ATOM 525 N SER A 33 -1.031 5.162 -9.692 1.00 0.00 N ATOM 526 CA SER A 33 -1.360 5.263 -8.279 1.00 0.00 C ATOM 527 C SER A 33 -0.615 4.206 -7.467 1.00 0.00 C ATOM 528 O SER A 33 0.037 4.524 -6.474 1.00 0.00 O ATOM 529 CB SER A 33 -2.869 5.122 -8.083 1.00 0.00 C ATOM 530 OG SER A 33 -3.569 6.095 -8.842 1.00 0.00 O ATOM 0 H SER A 33 -1.832 4.983 -10.298 1.00 0.00 H new ATOM 0 HA SER A 33 -1.046 6.244 -7.921 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.187 4.123 -8.382 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.115 5.232 -7.027 1.00 0.00 H new ATOM 0 HG SER A 33 -3.548 5.848 -9.790 1.00 0.00 H new ATOM 536 N LEU A 34 -0.690 2.953 -7.908 1.00 0.00 N ATOM 537 CA LEU A 34 -0.025 1.860 -7.208 1.00 0.00 C ATOM 538 C LEU A 34 1.490 2.024 -7.248 1.00 0.00 C ATOM 539 O LEU A 34 2.181 1.713 -6.279 1.00 0.00 O ATOM 540 CB LEU A 34 -0.423 0.511 -7.813 1.00 0.00 C ATOM 541 CG LEU A 34 -1.890 0.121 -7.619 1.00 0.00 C ATOM 542 CD1 LEU A 34 -2.183 -1.207 -8.295 1.00 0.00 C ATOM 543 CD2 LEU A 34 -2.229 0.051 -6.136 1.00 0.00 C ATOM 0 H LEU A 34 -1.203 2.671 -8.743 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.346 1.888 -6.167 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.207 0.531 -8.881 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.204 -0.265 -7.375 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.514 0.886 -8.081 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.231 -1.468 -8.146 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.977 -1.125 -9.362 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.551 -1.983 -7.862 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.276 -0.228 -6.015 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.597 -0.694 -5.653 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.057 1.025 -5.677 1.00 0.00 H new ATOM 555 N MET A 35 1.998 2.520 -8.370 1.00 0.00 N ATOM 556 CA MET A 35 3.428 2.750 -8.530 1.00 0.00 C ATOM 557 C MET A 35 3.914 3.790 -7.522 1.00 0.00 C ATOM 558 O MET A 35 4.874 3.553 -6.783 1.00 0.00 O ATOM 559 CB MET A 35 3.727 3.202 -9.969 1.00 0.00 C ATOM 560 CG MET A 35 5.210 3.316 -10.308 1.00 0.00 C ATOM 561 SD MET A 35 5.981 4.821 -9.675 1.00 0.00 S ATOM 562 CE MET A 35 7.657 4.626 -10.283 1.00 0.00 C ATOM 0 H MET A 35 1.438 2.771 -9.185 1.00 0.00 H new ATOM 0 HA MET A 35 3.962 1.819 -8.341 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.264 2.498 -10.660 1.00 0.00 H new ATOM 0 HB3 MET A 35 3.255 4.170 -10.136 1.00 0.00 H new ATOM 0 HG2 MET A 35 5.735 2.451 -9.903 1.00 0.00 H new ATOM 0 HG3 MET A 35 5.330 3.284 -11.391 1.00 0.00 H new ATOM 0 HE1 MET A 35 8.258 5.480 -9.972 1.00 0.00 H new ATOM 0 HE2 MET A 35 8.088 3.711 -9.875 1.00 0.00 H new ATOM 0 HE3 MET A 35 7.645 4.568 -11.371 1.00 0.00 H new ATOM 572 N VAL A 36 3.228 4.928 -7.474 1.00 0.00 N ATOM 573 CA VAL A 36 3.600 6.010 -6.573 1.00 0.00 C ATOM 574 C VAL A 36 3.417 5.597 -5.115 1.00 0.00 C ATOM 575 O VAL A 36 4.301 5.823 -4.289 1.00 0.00 O ATOM 576 CB VAL A 36 2.794 7.297 -6.863 1.00 0.00 C ATOM 577 CG1 VAL A 36 3.116 8.389 -5.851 1.00 0.00 C ATOM 578 CG2 VAL A 36 3.076 7.787 -8.275 1.00 0.00 C ATOM 0 H VAL A 36 2.410 5.123 -8.051 1.00 0.00 H new ATOM 0 HA VAL A 36 4.655 6.223 -6.748 1.00 0.00 H new ATOM 0 HB VAL A 36 1.734 7.059 -6.775 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.534 9.281 -6.081 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.866 8.041 -4.849 1.00 0.00 H new ATOM 0 HG13 VAL A 36 4.179 8.627 -5.898 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.502 8.694 -8.467 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.140 8.001 -8.380 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.788 7.017 -8.991 1.00 0.00 H new ATOM 588 N LEU A 37 2.280 4.979 -4.804 1.00 0.00 N ATOM 589 CA LEU A 37 2.009 4.522 -3.443 1.00 0.00 C ATOM 590 C LEU A 37 3.039 3.487 -3.002 1.00 0.00 C ATOM 591 O LEU A 37 3.494 3.501 -1.858 1.00 0.00 O ATOM 592 CB LEU A 37 0.598 3.938 -3.333 1.00 0.00 C ATOM 593 CG LEU A 37 -0.544 4.945 -3.505 1.00 0.00 C ATOM 594 CD1 LEU A 37 -1.890 4.242 -3.415 1.00 0.00 C ATOM 595 CD2 LEU A 37 -0.450 6.047 -2.459 1.00 0.00 C ATOM 0 H LEU A 37 1.535 4.784 -5.472 1.00 0.00 H new ATOM 0 HA LEU A 37 2.079 5.386 -2.783 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.487 3.156 -4.084 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.495 3.461 -2.359 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.455 5.399 -4.492 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.690 4.971 -3.539 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.960 3.489 -4.200 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.985 3.761 -2.441 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.270 6.752 -2.598 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.513 5.609 -1.463 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.500 6.570 -2.566 1.00 0.00 H new ATOM 607 N GLY A 38 3.412 2.600 -3.918 1.00 0.00 N ATOM 608 CA GLY A 38 4.424 1.605 -3.623 1.00 0.00 C ATOM 609 C GLY A 38 5.754 2.236 -3.268 1.00 0.00 C ATOM 610 O GLY A 38 6.394 1.851 -2.287 1.00 0.00 O ATOM 0 H GLY A 38 3.030 2.553 -4.862 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.087 0.980 -2.796 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.552 0.951 -4.486 1.00 0.00 H new ATOM 614 N ASN A 39 6.167 3.215 -4.065 1.00 0.00 N ATOM 615 CA ASN A 39 7.400 3.947 -3.803 1.00 0.00 C ATOM 616 C ASN A 39 7.269 4.751 -2.514 1.00 0.00 C ATOM 617 O ASN A 39 8.211 4.842 -1.727 1.00 0.00 O ATOM 618 CB ASN A 39 7.731 4.880 -4.973 1.00 0.00 C ATOM 619 CG ASN A 39 9.036 5.634 -4.769 1.00 0.00 C ATOM 620 OD1 ASN A 39 9.970 5.133 -4.146 1.00 0.00 O ATOM 621 ND2 ASN A 39 9.107 6.849 -5.294 1.00 0.00 N ATOM 0 H ASN A 39 5.665 3.520 -4.899 1.00 0.00 H new ATOM 0 HA ASN A 39 8.212 3.228 -3.692 1.00 0.00 H new ATOM 0 HB2 ASN A 39 7.793 4.297 -5.892 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.919 5.595 -5.103 1.00 0.00 H new ATOM 0 HD21 ASN A 39 9.958 7.402 -5.187 1.00 0.00 H new ATOM 0 HD22 ASN A 39 8.311 7.231 -5.805 1.00 0.00 H new ATOM 628 N MET A 40 6.087 5.321 -2.302 1.00 0.00 N ATOM 629 CA MET A 40 5.797 6.085 -1.094 1.00 0.00 C ATOM 630 C MET A 40 6.008 5.227 0.149 1.00 0.00 C ATOM 631 O MET A 40 6.734 5.620 1.060 1.00 0.00 O ATOM 632 CB MET A 40 4.360 6.614 -1.132 1.00 0.00 C ATOM 633 CG MET A 40 3.966 7.418 0.097 1.00 0.00 C ATOM 634 SD MET A 40 2.262 7.998 0.024 1.00 0.00 S ATOM 635 CE MET A 40 2.132 8.862 1.585 1.00 0.00 C ATOM 0 H MET A 40 5.308 5.267 -2.958 1.00 0.00 H new ATOM 0 HA MET A 40 6.483 6.931 -1.051 1.00 0.00 H new ATOM 0 HB2 MET A 40 4.236 7.238 -2.017 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.676 5.772 -1.238 1.00 0.00 H new ATOM 0 HG2 MET A 40 4.100 6.804 0.987 1.00 0.00 H new ATOM 0 HG3 MET A 40 4.634 8.274 0.197 1.00 0.00 H new ATOM 0 HE1 MET A 40 1.107 9.203 1.728 1.00 0.00 H new ATOM 0 HE2 MET A 40 2.408 8.189 2.397 1.00 0.00 H new ATOM 0 HE3 MET A 40 2.803 9.721 1.582 1.00 0.00 H new ATOM 645 N VAL A 41 5.386 4.051 0.171 1.00 0.00 N ATOM 646 CA VAL A 41 5.538 3.123 1.286 1.00 0.00 C ATOM 647 C VAL A 41 7.000 2.707 1.442 1.00 0.00 C ATOM 648 O VAL A 41 7.538 2.706 2.550 1.00 0.00 O ATOM 649 CB VAL A 41 4.657 1.865 1.103 1.00 0.00 C ATOM 650 CG1 VAL A 41 4.872 0.877 2.241 1.00 0.00 C ATOM 651 CG2 VAL A 41 3.189 2.249 1.007 1.00 0.00 C ATOM 0 H VAL A 41 4.771 3.719 -0.572 1.00 0.00 H new ATOM 0 HA VAL A 41 5.211 3.642 2.187 1.00 0.00 H new ATOM 0 HB VAL A 41 4.952 1.381 0.172 1.00 0.00 H new ATOM 0 HG11 VAL A 41 4.240 0.002 2.087 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.918 0.570 2.264 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.612 1.350 3.188 1.00 0.00 H new ATOM 0 HG21 VAL A 41 2.586 1.350 0.879 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.887 2.762 1.920 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.041 2.911 0.153 1.00 0.00 H new ATOM 661 N THR A 42 7.638 2.383 0.322 1.00 0.00 N ATOM 662 CA THR A 42 9.039 1.974 0.324 1.00 0.00 C ATOM 663 C THR A 42 9.932 3.056 0.930 1.00 0.00 C ATOM 664 O THR A 42 10.711 2.790 1.845 1.00 0.00 O ATOM 665 CB THR A 42 9.532 1.656 -1.103 1.00 0.00 C ATOM 666 OG1 THR A 42 8.721 0.627 -1.690 1.00 0.00 O ATOM 667 CG2 THR A 42 10.986 1.206 -1.090 1.00 0.00 C ATOM 0 H THR A 42 7.206 2.396 -0.602 1.00 0.00 H new ATOM 0 HA THR A 42 9.104 1.073 0.934 1.00 0.00 H new ATOM 0 HB THR A 42 9.452 2.567 -1.696 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.974 1.036 -2.175 1.00 0.00 H new ATOM 0 HG21 THR A 42 11.309 0.988 -2.108 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.608 1.998 -0.674 1.00 0.00 H new ATOM 0 HG23 THR A 42 11.084 0.309 -0.479 1.00 0.00 H new ATOM 675 N ASN A 43 9.803 4.278 0.425 1.00 0.00 N ATOM 676 CA ASN A 43 10.648 5.384 0.862 1.00 0.00 C ATOM 677 C ASN A 43 10.345 5.747 2.315 1.00 0.00 C ATOM 678 O ASN A 43 11.255 6.039 3.093 1.00 0.00 O ATOM 679 CB ASN A 43 10.440 6.597 -0.053 1.00 0.00 C ATOM 680 CG ASN A 43 11.544 7.640 0.058 1.00 0.00 C ATOM 681 OD1 ASN A 43 12.144 7.836 1.115 1.00 0.00 O ATOM 682 ND2 ASN A 43 11.824 8.312 -1.047 1.00 0.00 N ATOM 0 H ASN A 43 9.119 4.528 -0.289 1.00 0.00 H new ATOM 0 HA ASN A 43 11.691 5.075 0.799 1.00 0.00 H new ATOM 0 HB2 ASN A 43 10.377 6.256 -1.086 1.00 0.00 H new ATOM 0 HB3 ASN A 43 9.485 7.064 0.188 1.00 0.00 H new ATOM 0 HD21 ASN A 43 12.558 9.020 -1.041 1.00 0.00 H new ATOM 0 HD22 ASN A 43 11.305 8.122 -1.905 1.00 0.00 H new ATOM 689 N LEU A 44 9.069 5.697 2.680 1.00 0.00 N ATOM 690 CA LEU A 44 8.643 6.004 4.042 1.00 0.00 C ATOM 691 C LEU A 44 9.267 5.025 5.034 1.00 0.00 C ATOM 692 O LEU A 44 9.854 5.432 6.035 1.00 0.00 O ATOM 693 CB LEU A 44 7.116 5.956 4.145 1.00 0.00 C ATOM 694 CG LEU A 44 6.536 6.351 5.507 1.00 0.00 C ATOM 695 CD1 LEU A 44 6.909 7.785 5.858 1.00 0.00 C ATOM 696 CD2 LEU A 44 5.025 6.176 5.508 1.00 0.00 C ATOM 0 H LEU A 44 8.308 5.446 2.049 1.00 0.00 H new ATOM 0 HA LEU A 44 8.981 7.010 4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.697 6.616 3.385 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.784 4.945 3.907 1.00 0.00 H new ATOM 0 HG LEU A 44 6.963 5.695 6.266 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.486 8.044 6.829 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.994 7.879 5.898 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.514 8.460 5.099 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.626 6.460 6.482 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.585 6.809 4.737 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.779 5.133 5.306 1.00 0.00 H new ATOM 708 N ILE A 45 9.157 3.737 4.740 1.00 0.00 N ATOM 709 CA ILE A 45 9.718 2.708 5.605 1.00 0.00 C ATOM 710 C ILE A 45 11.248 2.754 5.585 1.00 0.00 C ATOM 711 O ILE A 45 11.900 2.477 6.587 1.00 0.00 O ATOM 712 CB ILE A 45 9.215 1.301 5.199 1.00 0.00 C ATOM 713 CG1 ILE A 45 7.698 1.211 5.405 1.00 0.00 C ATOM 714 CG2 ILE A 45 9.929 0.212 5.990 1.00 0.00 C ATOM 715 CD1 ILE A 45 7.108 -0.135 5.036 1.00 0.00 C ATOM 0 H ILE A 45 8.685 3.380 3.910 1.00 0.00 H new ATOM 0 HA ILE A 45 9.379 2.909 6.621 1.00 0.00 H new ATOM 0 HB ILE A 45 9.440 1.145 4.144 1.00 0.00 H new ATOM 0 HG12 ILE A 45 7.470 1.423 6.450 1.00 0.00 H new ATOM 0 HG13 ILE A 45 7.214 1.985 4.809 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.555 -0.765 5.683 1.00 0.00 H new ATOM 0 HG22 ILE A 45 11.001 0.267 5.799 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.743 0.354 7.055 1.00 0.00 H new ATOM 0 HD11 ILE A 45 6.032 -0.120 5.209 1.00 0.00 H new ATOM 0 HD12 ILE A 45 7.304 -0.342 3.984 1.00 0.00 H new ATOM 0 HD13 ILE A 45 7.564 -0.912 5.649 1.00 0.00 H new ATOM 727 N ASN A 46 11.812 3.138 4.448 1.00 0.00 N ATOM 728 CA ASN A 46 13.266 3.207 4.300 1.00 0.00 C ATOM 729 C ASN A 46 13.847 4.347 5.146 1.00 0.00 C ATOM 730 O ASN A 46 14.960 4.250 5.663 1.00 0.00 O ATOM 731 CB ASN A 46 13.632 3.397 2.820 1.00 0.00 C ATOM 732 CG ASN A 46 15.089 3.083 2.505 1.00 0.00 C ATOM 733 OD1 ASN A 46 15.978 3.249 3.338 1.00 0.00 O ATOM 734 ND2 ASN A 46 15.348 2.632 1.287 1.00 0.00 N ATOM 0 H ASN A 46 11.289 3.407 3.614 1.00 0.00 H new ATOM 0 HA ASN A 46 13.696 2.271 4.655 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.992 2.758 2.212 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.421 4.427 2.532 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.307 2.412 1.018 1.00 0.00 H new ATOM 0 HD22 ASN A 46 14.589 2.505 0.618 1.00 0.00 H new ATOM 741 N THR A 47 13.085 5.420 5.307 1.00 0.00 N ATOM 742 CA THR A 47 13.565 6.583 6.039 1.00 0.00 C ATOM 743 C THR A 47 13.113 6.578 7.501 1.00 0.00 C ATOM 744 O THR A 47 13.909 6.849 8.405 1.00 0.00 O ATOM 745 CB THR A 47 13.105 7.891 5.367 1.00 0.00 C ATOM 746 OG1 THR A 47 11.710 7.814 5.043 1.00 0.00 O ATOM 747 CG2 THR A 47 13.912 8.166 4.108 1.00 0.00 C ATOM 0 H THR A 47 12.137 5.509 4.942 1.00 0.00 H new ATOM 0 HA THR A 47 14.653 6.528 6.020 1.00 0.00 H new ATOM 0 HB THR A 47 13.268 8.710 6.068 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.595 7.311 4.210 1.00 0.00 H new ATOM 0 HG21 THR A 47 13.569 9.094 3.651 1.00 0.00 H new ATOM 0 HG22 THR A 47 14.967 8.256 4.365 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.779 7.345 3.404 1.00 0.00 H new ATOM 755 N SER A 48 11.846 6.272 7.733 1.00 0.00 N ATOM 756 CA SER A 48 11.276 6.347 9.070 1.00 0.00 C ATOM 757 C SER A 48 11.553 5.075 9.870 1.00 0.00 C ATOM 758 O SER A 48 11.841 5.136 11.066 1.00 0.00 O ATOM 759 CB SER A 48 9.769 6.597 8.983 1.00 0.00 C ATOM 760 OG SER A 48 9.203 6.827 10.263 1.00 0.00 O ATOM 0 H SER A 48 11.192 5.969 7.012 1.00 0.00 H new ATOM 0 HA SER A 48 11.751 7.178 9.591 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.579 7.457 8.341 1.00 0.00 H new ATOM 0 HB3 SER A 48 9.283 5.739 8.519 1.00 0.00 H new ATOM 0 HG SER A 48 8.226 6.799 10.198 1.00 0.00 H new ATOM 766 N ILE A 49 11.474 3.929 9.213 1.00 0.00 N ATOM 767 CA ILE A 49 11.649 2.658 9.897 1.00 0.00 C ATOM 768 C ILE A 49 13.118 2.254 9.898 1.00 0.00 C ATOM 769 O ILE A 49 13.806 2.376 8.883 1.00 0.00 O ATOM 770 CB ILE A 49 10.798 1.541 9.249 1.00 0.00 C ATOM 771 CG1 ILE A 49 9.313 1.925 9.254 1.00 0.00 C ATOM 772 CG2 ILE A 49 11.004 0.213 9.966 1.00 0.00 C ATOM 773 CD1 ILE A 49 8.735 2.138 10.640 1.00 0.00 C ATOM 0 H ILE A 49 11.291 3.853 8.212 1.00 0.00 H new ATOM 0 HA ILE A 49 11.310 2.789 10.925 1.00 0.00 H new ATOM 0 HB ILE A 49 11.125 1.424 8.216 1.00 0.00 H new ATOM 0 HG12 ILE A 49 9.183 2.838 8.673 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.744 1.143 8.751 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.394 -0.555 9.491 1.00 0.00 H new ATOM 0 HG22 ILE A 49 12.055 -0.071 9.910 1.00 0.00 H new ATOM 0 HG23 ILE A 49 10.710 0.314 11.011 1.00 0.00 H new ATOM 0 HD11 ILE A 49 7.682 2.406 10.558 1.00 0.00 H new ATOM 0 HD12 ILE A 49 8.831 1.220 11.219 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.276 2.941 11.140 1.00 0.00 H new ATOM 785 N ALA A 50 13.593 1.795 11.051 1.00 0.00 N ATOM 786 CA ALA A 50 14.972 1.351 11.203 1.00 0.00 C ATOM 787 C ALA A 50 15.324 0.282 10.170 1.00 0.00 C ATOM 788 O ALA A 50 14.560 -0.662 9.954 1.00 0.00 O ATOM 789 CB ALA A 50 15.197 0.825 12.613 1.00 0.00 C ATOM 0 H ALA A 50 13.035 1.721 11.902 1.00 0.00 H new ATOM 0 HA ALA A 50 15.628 2.205 11.034 1.00 0.00 H new ATOM 0 HB1 ALA A 50 16.231 0.495 12.718 1.00 0.00 H new ATOM 0 HB2 ALA A 50 14.994 1.617 13.334 1.00 0.00 H new ATOM 0 HB3 ALA A 50 14.528 -0.015 12.799 1.00 0.00 H new ATOM 795 N PRO A 51 16.501 0.411 9.534 1.00 0.00 N ATOM 796 CA PRO A 51 16.945 -0.495 8.463 1.00 0.00 C ATOM 797 C PRO A 51 17.099 -1.943 8.927 1.00 0.00 C ATOM 798 O PRO A 51 17.232 -2.857 8.112 1.00 0.00 O ATOM 799 CB PRO A 51 18.306 0.074 8.043 1.00 0.00 C ATOM 800 CG PRO A 51 18.748 0.921 9.185 1.00 0.00 C ATOM 801 CD PRO A 51 17.494 1.468 9.802 1.00 0.00 C ATOM 0 HA PRO A 51 16.214 -0.537 7.656 1.00 0.00 H new ATOM 0 HB2 PRO A 51 19.022 -0.724 7.845 1.00 0.00 H new ATOM 0 HB3 PRO A 51 18.222 0.660 7.128 1.00 0.00 H new ATOM 0 HG2 PRO A 51 19.316 0.336 9.908 1.00 0.00 H new ATOM 0 HG3 PRO A 51 19.399 1.726 8.845 1.00 0.00 H new ATOM 0 HD2 PRO A 51 17.615 1.646 10.871 1.00 0.00 H new ATOM 0 HD3 PRO A 51 17.204 2.417 9.352 1.00 0.00 H new ATOM 809 N ALA A 52 17.068 -2.148 10.234 1.00 0.00 N ATOM 810 CA ALA A 52 17.230 -3.476 10.799 1.00 0.00 C ATOM 811 C ALA A 52 15.892 -4.206 10.908 1.00 0.00 C ATOM 812 O ALA A 52 15.856 -5.408 11.163 1.00 0.00 O ATOM 813 CB ALA A 52 17.903 -3.386 12.161 1.00 0.00 C ATOM 0 H ALA A 52 16.932 -1.409 10.924 1.00 0.00 H new ATOM 0 HA ALA A 52 17.865 -4.053 10.127 1.00 0.00 H new ATOM 0 HB1 ALA A 52 18.020 -4.387 12.576 1.00 0.00 H new ATOM 0 HB2 ALA A 52 18.883 -2.922 12.053 1.00 0.00 H new ATOM 0 HB3 ALA A 52 17.289 -2.785 12.831 1.00 0.00 H new ATOM 819 N GLN A 53 14.791 -3.485 10.715 1.00 0.00 N ATOM 820 CA GLN A 53 13.469 -4.096 10.826 1.00 0.00 C ATOM 821 C GLN A 53 12.547 -3.660 9.689 1.00 0.00 C ATOM 822 O GLN A 53 11.376 -4.035 9.658 1.00 0.00 O ATOM 823 CB GLN A 53 12.828 -3.738 12.169 1.00 0.00 C ATOM 824 CG GLN A 53 12.503 -2.259 12.312 1.00 0.00 C ATOM 825 CD GLN A 53 11.861 -1.918 13.642 1.00 0.00 C ATOM 826 OE1 GLN A 53 11.159 -2.735 14.237 1.00 0.00 O ATOM 827 NE2 GLN A 53 12.102 -0.706 14.113 1.00 0.00 N ATOM 0 H GLN A 53 14.786 -2.491 10.484 1.00 0.00 H new ATOM 0 HA GLN A 53 13.604 -5.176 10.760 1.00 0.00 H new ATOM 0 HB2 GLN A 53 11.912 -4.316 12.291 1.00 0.00 H new ATOM 0 HB3 GLN A 53 13.501 -4.033 12.974 1.00 0.00 H new ATOM 0 HG2 GLN A 53 13.419 -1.679 12.198 1.00 0.00 H new ATOM 0 HG3 GLN A 53 11.834 -1.960 11.505 1.00 0.00 H new ATOM 0 HE21 GLN A 53 12.690 -0.061 13.585 1.00 0.00 H new ATOM 0 HE22 GLN A 53 11.699 -0.416 15.004 1.00 0.00 H new ATOM 836 N ARG A 54 13.080 -2.883 8.750 1.00 0.00 N ATOM 837 CA ARG A 54 12.265 -2.321 7.673 1.00 0.00 C ATOM 838 C ARG A 54 11.626 -3.415 6.817 1.00 0.00 C ATOM 839 O ARG A 54 10.454 -3.322 6.453 1.00 0.00 O ATOM 840 CB ARG A 54 13.085 -1.359 6.803 1.00 0.00 C ATOM 841 CG ARG A 54 14.323 -1.974 6.165 1.00 0.00 C ATOM 842 CD ARG A 54 15.055 -0.956 5.305 1.00 0.00 C ATOM 843 NE ARG A 54 16.304 -1.483 4.759 1.00 0.00 N ATOM 844 CZ ARG A 54 17.361 -0.727 4.457 1.00 0.00 C ATOM 845 NH1 ARG A 54 17.343 0.579 4.699 1.00 0.00 N ATOM 846 NH2 ARG A 54 18.444 -1.285 3.929 1.00 0.00 N ATOM 0 H ARG A 54 14.067 -2.628 8.711 1.00 0.00 H new ATOM 0 HA ARG A 54 11.459 -1.755 8.140 1.00 0.00 H new ATOM 0 HB2 ARG A 54 12.443 -0.968 6.014 1.00 0.00 H new ATOM 0 HB3 ARG A 54 13.392 -0.510 7.414 1.00 0.00 H new ATOM 0 HG2 ARG A 54 14.991 -2.346 6.942 1.00 0.00 H new ATOM 0 HG3 ARG A 54 14.035 -2.831 5.555 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.407 -0.643 4.486 1.00 0.00 H new ATOM 0 HD3 ARG A 54 15.268 -0.068 5.900 1.00 0.00 H new ATOM 0 HE ARG A 54 16.372 -2.488 4.599 1.00 0.00 H new ATOM 0 HH11 ARG A 54 16.518 1.009 5.118 1.00 0.00 H new ATOM 0 HH12 ARG A 54 18.154 1.152 4.466 1.00 0.00 H new ATOM 0 HH21 ARG A 54 18.467 -2.290 3.755 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.253 -0.709 3.697 1.00 0.00 H new ATOM 860 N GLN A 55 12.383 -4.461 6.514 1.00 0.00 N ATOM 861 CA GLN A 55 11.855 -5.562 5.722 1.00 0.00 C ATOM 862 C GLN A 55 10.865 -6.380 6.544 1.00 0.00 C ATOM 863 O GLN A 55 9.878 -6.889 6.018 1.00 0.00 O ATOM 864 CB GLN A 55 12.986 -6.459 5.213 1.00 0.00 C ATOM 865 CG GLN A 55 12.496 -7.628 4.372 1.00 0.00 C ATOM 866 CD GLN A 55 13.621 -8.523 3.893 1.00 0.00 C ATOM 867 OE1 GLN A 55 14.010 -9.472 4.576 1.00 0.00 O ATOM 868 NE2 GLN A 55 14.143 -8.236 2.712 1.00 0.00 N ATOM 0 H GLN A 55 13.356 -4.570 6.802 1.00 0.00 H new ATOM 0 HA GLN A 55 11.336 -5.142 4.861 1.00 0.00 H new ATOM 0 HB2 GLN A 55 13.677 -5.859 4.621 1.00 0.00 H new ATOM 0 HB3 GLN A 55 13.547 -6.843 6.065 1.00 0.00 H new ATOM 0 HG2 GLN A 55 11.792 -8.220 4.957 1.00 0.00 H new ATOM 0 HG3 GLN A 55 11.951 -7.245 3.509 1.00 0.00 H new ATOM 0 HE21 GLN A 55 13.791 -7.441 2.179 1.00 0.00 H new ATOM 0 HE22 GLN A 55 14.897 -8.810 2.335 1.00 0.00 H new ATOM 877 N ALA A 56 11.120 -6.474 7.843 1.00 0.00 N ATOM 878 CA ALA A 56 10.284 -7.265 8.734 1.00 0.00 C ATOM 879 C ALA A 56 8.890 -6.656 8.862 1.00 0.00 C ATOM 880 O ALA A 56 7.886 -7.359 8.744 1.00 0.00 O ATOM 881 CB ALA A 56 10.935 -7.393 10.102 1.00 0.00 C ATOM 0 H ALA A 56 11.903 -6.010 8.303 1.00 0.00 H new ATOM 0 HA ALA A 56 10.180 -8.261 8.303 1.00 0.00 H new ATOM 0 HB1 ALA A 56 10.296 -7.987 10.755 1.00 0.00 H new ATOM 0 HB2 ALA A 56 11.904 -7.882 10.000 1.00 0.00 H new ATOM 0 HB3 ALA A 56 11.073 -6.402 10.534 1.00 0.00 H new ATOM 887 N ILE A 57 8.832 -5.346 9.086 1.00 0.00 N ATOM 888 CA ILE A 57 7.560 -4.660 9.247 1.00 0.00 C ATOM 889 C ILE A 57 6.769 -4.675 7.935 1.00 0.00 C ATOM 890 O ILE A 57 5.545 -4.819 7.937 1.00 0.00 O ATOM 891 CB ILE A 57 7.761 -3.205 9.749 1.00 0.00 C ATOM 892 CG1 ILE A 57 6.418 -2.556 10.073 1.00 0.00 C ATOM 893 CG2 ILE A 57 8.521 -2.364 8.736 1.00 0.00 C ATOM 894 CD1 ILE A 57 5.712 -3.185 11.254 1.00 0.00 C ATOM 0 H ILE A 57 9.651 -4.742 9.159 1.00 0.00 H new ATOM 0 HA ILE A 57 6.987 -5.196 10.003 1.00 0.00 H new ATOM 0 HB ILE A 57 8.358 -3.253 10.660 1.00 0.00 H new ATOM 0 HG12 ILE A 57 6.575 -1.497 10.276 1.00 0.00 H new ATOM 0 HG13 ILE A 57 5.772 -2.620 9.197 1.00 0.00 H new ATOM 0 HG21 ILE A 57 8.643 -1.352 9.122 1.00 0.00 H new ATOM 0 HG22 ILE A 57 9.502 -2.805 8.559 1.00 0.00 H new ATOM 0 HG23 ILE A 57 7.964 -2.331 7.800 1.00 0.00 H new ATOM 0 HD11 ILE A 57 4.765 -2.674 11.426 1.00 0.00 H new ATOM 0 HD12 ILE A 57 5.523 -4.238 11.046 1.00 0.00 H new ATOM 0 HD13 ILE A 57 6.339 -3.097 12.142 1.00 0.00 H new ATOM 906 N ALA A 58 7.479 -4.562 6.816 1.00 0.00 N ATOM 907 CA ALA A 58 6.848 -4.612 5.504 1.00 0.00 C ATOM 908 C ALA A 58 6.327 -6.012 5.208 1.00 0.00 C ATOM 909 O ALA A 58 5.277 -6.183 4.588 1.00 0.00 O ATOM 910 CB ALA A 58 7.831 -4.180 4.430 1.00 0.00 C ATOM 0 H ALA A 58 8.491 -4.435 6.793 1.00 0.00 H new ATOM 0 HA ALA A 58 6.002 -3.924 5.505 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.346 -4.222 3.455 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.161 -3.160 4.628 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.693 -4.847 4.436 1.00 0.00 H new ATOM 916 N ASN A 59 7.065 -7.010 5.672 1.00 0.00 N ATOM 917 CA ASN A 59 6.707 -8.405 5.458 1.00 0.00 C ATOM 918 C ASN A 59 5.383 -8.738 6.148 1.00 0.00 C ATOM 919 O ASN A 59 4.550 -9.474 5.609 1.00 0.00 O ATOM 920 CB ASN A 59 7.823 -9.307 5.987 1.00 0.00 C ATOM 921 CG ASN A 59 7.648 -10.758 5.596 1.00 0.00 C ATOM 922 OD1 ASN A 59 7.078 -11.069 4.552 1.00 0.00 O ATOM 923 ND2 ASN A 59 8.140 -11.653 6.438 1.00 0.00 N ATOM 0 H ASN A 59 7.925 -6.877 6.205 1.00 0.00 H new ATOM 0 HA ASN A 59 6.582 -8.576 4.389 1.00 0.00 H new ATOM 0 HB2 ASN A 59 8.781 -8.948 5.611 1.00 0.00 H new ATOM 0 HB3 ASN A 59 7.859 -9.231 7.074 1.00 0.00 H new ATOM 0 HD21 ASN A 59 8.054 -12.648 6.232 1.00 0.00 H new ATOM 0 HD22 ASN A 59 8.605 -11.347 7.293 1.00 0.00 H new ATOM 930 N SER A 60 5.189 -8.183 7.339 1.00 0.00 N ATOM 931 CA SER A 60 3.944 -8.365 8.071 1.00 0.00 C ATOM 932 C SER A 60 2.828 -7.512 7.471 1.00 0.00 C ATOM 933 O SER A 60 1.653 -7.867 7.553 1.00 0.00 O ATOM 934 CB SER A 60 4.151 -8.034 9.552 1.00 0.00 C ATOM 935 OG SER A 60 5.011 -6.917 9.715 1.00 0.00 O ATOM 0 H SER A 60 5.879 -7.603 7.817 1.00 0.00 H new ATOM 0 HA SER A 60 3.642 -9.409 7.988 1.00 0.00 H new ATOM 0 HB2 SER A 60 3.188 -7.826 10.018 1.00 0.00 H new ATOM 0 HB3 SER A 60 4.573 -8.898 10.065 1.00 0.00 H new ATOM 0 HG SER A 60 4.909 -6.312 8.951 1.00 0.00 H new ATOM 941 N PHE A 61 3.204 -6.396 6.851 1.00 0.00 N ATOM 942 CA PHE A 61 2.239 -5.540 6.169 1.00 0.00 C ATOM 943 C PHE A 61 1.668 -6.266 4.955 1.00 0.00 C ATOM 944 O PHE A 61 0.464 -6.232 4.706 1.00 0.00 O ATOM 945 CB PHE A 61 2.895 -4.220 5.742 1.00 0.00 C ATOM 946 CG PHE A 61 1.974 -3.295 4.994 1.00 0.00 C ATOM 947 CD1 PHE A 61 1.043 -2.522 5.670 1.00 0.00 C ATOM 948 CD2 PHE A 61 2.045 -3.195 3.614 1.00 0.00 C ATOM 949 CE1 PHE A 61 0.198 -1.671 4.983 1.00 0.00 C ATOM 950 CE2 PHE A 61 1.204 -2.346 2.921 1.00 0.00 C ATOM 951 CZ PHE A 61 0.280 -1.582 3.607 1.00 0.00 C ATOM 0 H PHE A 61 4.168 -6.065 6.807 1.00 0.00 H new ATOM 0 HA PHE A 61 1.427 -5.310 6.859 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.267 -3.707 6.629 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.759 -4.441 5.116 1.00 0.00 H new ATOM 0 HD1 PHE A 61 0.977 -2.585 6.746 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.767 -3.788 3.073 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.525 -1.076 5.521 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.269 -2.280 1.845 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.378 -0.916 3.068 1.00 0.00 H new ATOM 961 N ALA A 62 2.545 -6.935 4.214 1.00 0.00 N ATOM 962 CA ALA A 62 2.131 -7.737 3.070 1.00 0.00 C ATOM 963 C ALA A 62 1.195 -8.856 3.515 1.00 0.00 C ATOM 964 O ALA A 62 0.228 -9.187 2.827 1.00 0.00 O ATOM 965 CB ALA A 62 3.347 -8.310 2.360 1.00 0.00 C ATOM 0 H ALA A 62 3.550 -6.937 4.387 1.00 0.00 H new ATOM 0 HA ALA A 62 1.593 -7.096 2.372 1.00 0.00 H new ATOM 0 HB1 ALA A 62 3.023 -8.907 1.507 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.983 -7.496 2.012 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.909 -8.939 3.051 1.00 0.00 H new ATOM 971 N ARG A 63 1.490 -9.427 4.678 1.00 0.00 N ATOM 972 CA ARG A 63 0.644 -10.453 5.268 1.00 0.00 C ATOM 973 C ARG A 63 -0.736 -9.889 5.597 1.00 0.00 C ATOM 974 O ARG A 63 -1.757 -10.490 5.260 1.00 0.00 O ATOM 975 CB ARG A 63 1.303 -10.992 6.533 1.00 0.00 C ATOM 976 CG ARG A 63 1.464 -12.498 6.540 1.00 0.00 C ATOM 977 CD ARG A 63 2.908 -12.891 6.790 1.00 0.00 C ATOM 978 NE ARG A 63 3.793 -12.485 5.698 1.00 0.00 N ATOM 979 CZ ARG A 63 4.312 -13.332 4.808 1.00 0.00 C ATOM 980 NH1 ARG A 63 4.002 -14.623 4.850 1.00 0.00 N ATOM 981 NH2 ARG A 63 5.151 -12.887 3.885 1.00 0.00 N ATOM 0 H ARG A 63 2.314 -9.193 5.232 1.00 0.00 H new ATOM 0 HA ARG A 63 0.521 -11.263 4.549 1.00 0.00 H new ATOM 0 HB2 ARG A 63 2.284 -10.530 6.647 1.00 0.00 H new ATOM 0 HB3 ARG A 63 0.709 -10.695 7.397 1.00 0.00 H new ATOM 0 HG2 ARG A 63 0.827 -12.931 7.311 1.00 0.00 H new ATOM 0 HG3 ARG A 63 1.132 -12.907 5.586 1.00 0.00 H new ATOM 0 HD2 ARG A 63 3.250 -12.436 7.720 1.00 0.00 H new ATOM 0 HD3 ARG A 63 2.970 -13.971 6.922 1.00 0.00 H new ATOM 0 HE ARG A 63 4.027 -11.496 5.612 1.00 0.00 H new ATOM 0 HH11 ARG A 63 3.364 -14.971 5.566 1.00 0.00 H new ATOM 0 HH12 ARG A 63 4.402 -15.266 4.167 1.00 0.00 H new ATOM 0 HH21 ARG A 63 5.399 -11.898 3.856 1.00 0.00 H new ATOM 0 HH22 ARG A 63 5.549 -13.533 3.203 1.00 0.00 H new ATOM 995 N ALA A 64 -0.755 -8.726 6.242 1.00 0.00 N ATOM 996 CA ALA A 64 -2.001 -8.070 6.627 1.00 0.00 C ATOM 997 C ALA A 64 -2.816 -7.677 5.401 1.00 0.00 C ATOM 998 O ALA A 64 -4.049 -7.676 5.435 1.00 0.00 O ATOM 999 CB ALA A 64 -1.709 -6.847 7.483 1.00 0.00 C ATOM 0 H ALA A 64 0.086 -8.215 6.511 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.590 -8.777 7.211 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -2.647 -6.367 7.763 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.174 -7.152 8.383 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.097 -6.145 6.917 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.122 -7.344 4.318 1.00 0.00 N ATOM 1006 CA LEU A 65 -2.775 -7.039 3.054 1.00 0.00 C ATOM 1007 C LEU A 65 -3.611 -8.231 2.602 1.00 0.00 C ATOM 1008 O LEU A 65 -4.799 -8.094 2.313 1.00 0.00 O ATOM 1009 CB LEU A 65 -1.733 -6.686 1.988 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.300 -6.284 0.624 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.129 -5.016 0.743 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.175 -6.097 -0.383 1.00 0.00 C ATOM 0 H LEU A 65 -1.104 -7.279 4.292 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.431 -6.180 3.194 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.118 -5.868 2.362 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.074 -7.543 1.850 1.00 0.00 H new ATOM 0 HG LEU A 65 -2.950 -7.084 0.270 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.524 -4.746 -0.237 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.956 -5.185 1.433 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.503 -4.206 1.118 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.594 -5.811 -1.348 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.501 -5.315 -0.034 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.623 -7.031 -0.489 1.00 0.00 H new ATOM 1024 N GLN A 66 -2.988 -9.406 2.582 1.00 0.00 N ATOM 1025 CA GLN A 66 -3.673 -10.639 2.200 1.00 0.00 C ATOM 1026 C GLN A 66 -4.820 -10.951 3.160 1.00 0.00 C ATOM 1027 O GLN A 66 -5.848 -11.499 2.757 1.00 0.00 O ATOM 1028 CB GLN A 66 -2.688 -11.810 2.167 1.00 0.00 C ATOM 1029 CG GLN A 66 -1.694 -11.739 1.019 1.00 0.00 C ATOM 1030 CD GLN A 66 -2.358 -11.873 -0.339 1.00 0.00 C ATOM 1031 OE1 GLN A 66 -3.384 -12.538 -0.483 1.00 0.00 O ATOM 1032 NE2 GLN A 66 -1.779 -11.239 -1.346 1.00 0.00 N ATOM 0 H GLN A 66 -2.006 -9.531 2.827 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.088 -10.495 1.203 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -2.140 -11.840 3.109 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -3.248 -12.742 2.094 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -1.159 -10.791 1.065 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -0.953 -12.529 1.136 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -0.929 -10.698 -1.187 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -2.182 -11.292 -2.281 1.00 0.00 H new ATOM 1041 N SER A 67 -4.638 -10.597 4.425 1.00 0.00 N ATOM 1042 CA SER A 67 -5.663 -10.810 5.437 1.00 0.00 C ATOM 1043 C SER A 67 -6.892 -9.939 5.168 1.00 0.00 C ATOM 1044 O SER A 67 -8.023 -10.336 5.456 1.00 0.00 O ATOM 1045 CB SER A 67 -5.092 -10.502 6.822 1.00 0.00 C ATOM 1046 OG SER A 67 -3.918 -11.258 7.067 1.00 0.00 O ATOM 0 H SER A 67 -3.786 -10.159 4.776 1.00 0.00 H new ATOM 0 HA SER A 67 -5.975 -11.854 5.397 1.00 0.00 H new ATOM 0 HB2 SER A 67 -4.866 -9.438 6.898 1.00 0.00 H new ATOM 0 HB3 SER A 67 -5.838 -10.725 7.585 1.00 0.00 H new ATOM 0 HG SER A 67 -3.199 -10.946 6.478 1.00 0.00 H new ATOM 1052 N SER A 68 -6.665 -8.757 4.605 1.00 0.00 N ATOM 1053 CA SER A 68 -7.745 -7.817 4.329 1.00 0.00 C ATOM 1054 C SER A 68 -8.394 -8.117 2.976 1.00 0.00 C ATOM 1055 O SER A 68 -9.580 -7.846 2.763 1.00 0.00 O ATOM 1056 CB SER A 68 -7.198 -6.389 4.355 1.00 0.00 C ATOM 1057 OG SER A 68 -6.451 -6.157 5.540 1.00 0.00 O ATOM 0 H SER A 68 -5.740 -8.427 4.330 1.00 0.00 H new ATOM 0 HA SER A 68 -8.510 -7.923 5.098 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.566 -6.221 3.483 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.022 -5.678 4.294 1.00 0.00 H new ATOM 0 HG SER A 68 -5.594 -6.628 5.484 1.00 0.00 H new ATOM 1063 N ILE A 69 -7.601 -8.679 2.072 1.00 0.00 N ATOM 1064 CA ILE A 69 -8.073 -9.080 0.749 1.00 0.00 C ATOM 1065 C ILE A 69 -9.169 -10.138 0.856 1.00 0.00 C ATOM 1066 O ILE A 69 -10.174 -10.093 0.137 1.00 0.00 O ATOM 1067 CB ILE A 69 -6.895 -9.629 -0.095 1.00 0.00 C ATOM 1068 CG1 ILE A 69 -5.996 -8.479 -0.555 1.00 0.00 C ATOM 1069 CG2 ILE A 69 -7.383 -10.438 -1.288 1.00 0.00 C ATOM 1070 CD1 ILE A 69 -6.689 -7.497 -1.476 1.00 0.00 C ATOM 0 H ILE A 69 -6.612 -8.870 2.234 1.00 0.00 H new ATOM 0 HA ILE A 69 -8.489 -8.200 0.258 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.317 -10.302 0.538 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -5.628 -7.945 0.321 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.126 -8.891 -1.066 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -6.527 -10.805 -1.854 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -7.975 -11.283 -0.937 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -7.998 -9.806 -1.929 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.991 -6.710 -1.761 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -7.033 -8.017 -2.370 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -7.543 -7.056 -0.961 1.00 0.00 H new ATOM 1442 N SER B 8 5.586 11.186 -16.704 1.00 0.00 N ATOM 1443 CA SER B 8 6.259 12.469 -16.596 1.00 0.00 C ATOM 1444 C SER B 8 6.752 12.694 -15.171 1.00 0.00 C ATOM 1445 O SER B 8 5.977 12.603 -14.217 1.00 0.00 O ATOM 1446 CB SER B 8 5.305 13.587 -17.012 1.00 0.00 C ATOM 1447 OG SER B 8 4.748 13.320 -18.289 1.00 0.00 O ATOM 0 HA SER B 8 7.123 12.473 -17.261 1.00 0.00 H new ATOM 0 HB2 SER B 8 4.508 13.685 -16.275 1.00 0.00 H new ATOM 0 HB3 SER B 8 5.838 14.538 -17.033 1.00 0.00 H new ATOM 0 HG SER B 8 4.604 12.356 -18.388 1.00 0.00 H new ATOM 1453 N ASP B 9 8.043 12.976 -15.035 1.00 0.00 N ATOM 1454 CA ASP B 9 8.664 13.151 -13.724 1.00 0.00 C ATOM 1455 C ASP B 9 7.939 14.221 -12.919 1.00 0.00 C ATOM 1456 O ASP B 9 7.636 14.023 -11.748 1.00 0.00 O ATOM 1457 CB ASP B 9 10.140 13.521 -13.882 1.00 0.00 C ATOM 1458 CG ASP B 9 10.884 13.575 -12.562 1.00 0.00 C ATOM 1459 OD1 ASP B 9 11.096 12.508 -11.949 1.00 0.00 O ATOM 1460 OD2 ASP B 9 11.295 14.677 -12.151 1.00 0.00 O ATOM 0 H ASP B 9 8.684 13.089 -15.820 1.00 0.00 H new ATOM 0 HA ASP B 9 8.591 12.207 -13.184 1.00 0.00 H new ATOM 0 HB2 ASP B 9 10.623 12.794 -14.535 1.00 0.00 H new ATOM 0 HB3 ASP B 9 10.215 14.491 -14.374 1.00 0.00 H new ATOM 1465 N GLU B 10 7.639 15.338 -13.573 1.00 0.00 N ATOM 1466 CA GLU B 10 6.932 16.446 -12.938 1.00 0.00 C ATOM 1467 C GLU B 10 5.564 15.991 -12.435 1.00 0.00 C ATOM 1468 O GLU B 10 5.132 16.374 -11.347 1.00 0.00 O ATOM 1469 CB GLU B 10 6.748 17.614 -13.913 1.00 0.00 C ATOM 1470 CG GLU B 10 7.976 17.930 -14.754 1.00 0.00 C ATOM 1471 CD GLU B 10 8.055 17.084 -16.009 1.00 0.00 C ATOM 1472 OE1 GLU B 10 7.503 17.505 -17.043 1.00 0.00 O ATOM 1473 OE2 GLU B 10 8.657 15.990 -15.965 1.00 0.00 O ATOM 0 H GLU B 10 7.877 15.501 -14.551 1.00 0.00 H new ATOM 0 HA GLU B 10 7.536 16.781 -12.095 1.00 0.00 H new ATOM 0 HB2 GLU B 10 5.915 17.388 -14.579 1.00 0.00 H new ATOM 0 HB3 GLU B 10 6.471 18.504 -13.347 1.00 0.00 H new ATOM 0 HG2 GLU B 10 7.961 18.984 -15.031 1.00 0.00 H new ATOM 0 HG3 GLU B 10 8.873 17.770 -14.155 1.00 0.00 H new ATOM 1480 N GLN B 11 4.895 15.165 -13.235 1.00 0.00 N ATOM 1481 CA GLN B 11 3.587 14.629 -12.875 1.00 0.00 C ATOM 1482 C GLN B 11 3.701 13.780 -11.612 1.00 0.00 C ATOM 1483 O GLN B 11 2.882 13.891 -10.698 1.00 0.00 O ATOM 1484 CB GLN B 11 3.019 13.793 -14.030 1.00 0.00 C ATOM 1485 CG GLN B 11 1.674 13.148 -13.731 1.00 0.00 C ATOM 1486 CD GLN B 11 1.189 12.264 -14.866 1.00 0.00 C ATOM 1487 OE1 GLN B 11 1.990 11.697 -15.612 1.00 0.00 O ATOM 1488 NE2 GLN B 11 -0.120 12.140 -15.010 1.00 0.00 N ATOM 0 H GLN B 11 5.240 14.851 -14.142 1.00 0.00 H new ATOM 0 HA GLN B 11 2.907 15.458 -12.681 1.00 0.00 H new ATOM 0 HB2 GLN B 11 2.916 14.430 -14.908 1.00 0.00 H new ATOM 0 HB3 GLN B 11 3.735 13.012 -14.285 1.00 0.00 H new ATOM 0 HG2 GLN B 11 1.754 12.554 -12.821 1.00 0.00 H new ATOM 0 HG3 GLN B 11 0.936 13.927 -13.540 1.00 0.00 H new ATOM 0 HE21 GLN B 11 -0.751 12.625 -14.372 1.00 0.00 H new ATOM 0 HE22 GLN B 11 -0.498 11.559 -15.759 1.00 0.00 H new ATOM 1497 N VAL B 12 4.736 12.946 -11.565 1.00 0.00 N ATOM 1498 CA VAL B 12 4.995 12.111 -10.401 1.00 0.00 C ATOM 1499 C VAL B 12 5.344 12.978 -9.195 1.00 0.00 C ATOM 1500 O VAL B 12 4.854 12.739 -8.087 1.00 0.00 O ATOM 1501 CB VAL B 12 6.140 11.108 -10.668 1.00 0.00 C ATOM 1502 CG1 VAL B 12 6.390 10.235 -9.449 1.00 0.00 C ATOM 1503 CG2 VAL B 12 5.827 10.248 -11.885 1.00 0.00 C ATOM 0 H VAL B 12 5.409 12.832 -12.323 1.00 0.00 H new ATOM 0 HA VAL B 12 4.087 11.546 -10.192 1.00 0.00 H new ATOM 0 HB VAL B 12 7.047 11.677 -10.872 1.00 0.00 H new ATOM 0 HG11 VAL B 12 7.200 9.537 -9.661 1.00 0.00 H new ATOM 0 HG12 VAL B 12 6.665 10.863 -8.602 1.00 0.00 H new ATOM 0 HG13 VAL B 12 5.485 9.678 -9.209 1.00 0.00 H new ATOM 0 HG21 VAL B 12 6.645 9.548 -12.056 1.00 0.00 H new ATOM 0 HG22 VAL B 12 4.905 9.693 -11.711 1.00 0.00 H new ATOM 0 HG23 VAL B 12 5.706 10.886 -12.760 1.00 0.00 H new ATOM 1513 N GLU B 13 6.181 13.992 -9.421 1.00 0.00 N ATOM 1514 CA GLU B 13 6.557 14.931 -8.369 1.00 0.00 C ATOM 1515 C GLU B 13 5.324 15.573 -7.759 1.00 0.00 C ATOM 1516 O GLU B 13 5.102 15.474 -6.562 1.00 0.00 O ATOM 1517 CB GLU B 13 7.465 16.038 -8.899 1.00 0.00 C ATOM 1518 CG GLU B 13 8.822 15.567 -9.383 1.00 0.00 C ATOM 1519 CD GLU B 13 9.731 16.728 -9.719 1.00 0.00 C ATOM 1520 OE1 GLU B 13 9.421 17.480 -10.665 1.00 0.00 O ATOM 1521 OE2 GLU B 13 10.760 16.901 -9.033 1.00 0.00 O ATOM 0 H GLU B 13 6.611 14.182 -10.326 1.00 0.00 H new ATOM 0 HA GLU B 13 7.096 14.359 -7.614 1.00 0.00 H new ATOM 0 HB2 GLU B 13 6.957 16.544 -9.720 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.612 16.777 -8.111 1.00 0.00 H new ATOM 0 HG2 GLU B 13 9.288 14.950 -8.615 1.00 0.00 H new ATOM 0 HG3 GLU B 13 8.696 14.937 -10.264 1.00 0.00 H new ATOM 1528 N GLN B 14 4.529 16.225 -8.598 1.00 0.00 N ATOM 1529 CA GLN B 14 3.342 16.946 -8.144 1.00 0.00 C ATOM 1530 C GLN B 14 2.373 16.031 -7.398 1.00 0.00 C ATOM 1531 O GLN B 14 1.780 16.427 -6.392 1.00 0.00 O ATOM 1532 CB GLN B 14 2.634 17.591 -9.333 1.00 0.00 C ATOM 1533 CG GLN B 14 3.434 18.701 -9.995 1.00 0.00 C ATOM 1534 CD GLN B 14 2.770 19.221 -11.253 1.00 0.00 C ATOM 1535 OE1 GLN B 14 1.548 19.165 -11.389 1.00 0.00 O ATOM 1536 NE2 GLN B 14 3.562 19.739 -12.176 1.00 0.00 N ATOM 0 H GLN B 14 4.685 16.270 -9.605 1.00 0.00 H new ATOM 0 HA GLN B 14 3.672 17.719 -7.450 1.00 0.00 H new ATOM 0 HB2 GLN B 14 2.415 16.822 -10.074 1.00 0.00 H new ATOM 0 HB3 GLN B 14 1.678 17.994 -9.000 1.00 0.00 H new ATOM 0 HG2 GLN B 14 3.563 19.522 -9.290 1.00 0.00 H new ATOM 0 HG3 GLN B 14 4.430 18.331 -10.239 1.00 0.00 H new ATOM 0 HE21 GLN B 14 4.570 19.767 -12.025 1.00 0.00 H new ATOM 0 HE22 GLN B 14 3.165 20.111 -13.039 1.00 0.00 H new ATOM 1545 N LEU B 15 2.215 14.809 -7.894 1.00 0.00 N ATOM 1546 CA LEU B 15 1.323 13.842 -7.269 1.00 0.00 C ATOM 1547 C LEU B 15 1.841 13.453 -5.885 1.00 0.00 C ATOM 1548 O LEU B 15 1.102 13.494 -4.904 1.00 0.00 O ATOM 1549 CB LEU B 15 1.182 12.601 -8.158 1.00 0.00 C ATOM 1550 CG LEU B 15 0.185 11.548 -7.667 1.00 0.00 C ATOM 1551 CD1 LEU B 15 -1.218 12.129 -7.593 1.00 0.00 C ATOM 1552 CD2 LEU B 15 0.204 10.335 -8.581 1.00 0.00 C ATOM 0 H LEU B 15 2.693 14.465 -8.727 1.00 0.00 H new ATOM 0 HA LEU B 15 0.341 14.299 -7.151 1.00 0.00 H new ATOM 0 HB2 LEU B 15 0.882 12.922 -9.156 1.00 0.00 H new ATOM 0 HB3 LEU B 15 2.161 12.132 -8.255 1.00 0.00 H new ATOM 0 HG LEU B 15 0.482 11.237 -6.665 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -1.911 11.364 -7.242 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -1.227 12.971 -6.901 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -1.524 12.469 -8.583 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -0.510 9.595 -8.219 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -0.068 10.637 -9.592 1.00 0.00 H new ATOM 0 HD23 LEU B 15 1.204 9.901 -8.589 1.00 0.00 H new ATOM 1564 N LEU B 16 3.122 13.108 -5.811 1.00 0.00 N ATOM 1565 CA LEU B 16 3.737 12.688 -4.557 1.00 0.00 C ATOM 1566 C LEU B 16 3.852 13.865 -3.588 1.00 0.00 C ATOM 1567 O LEU B 16 3.682 13.705 -2.379 1.00 0.00 O ATOM 1568 CB LEU B 16 5.114 12.065 -4.838 1.00 0.00 C ATOM 1569 CG LEU B 16 5.846 11.465 -3.630 1.00 0.00 C ATOM 1570 CD1 LEU B 16 6.706 10.289 -4.066 1.00 0.00 C ATOM 1571 CD2 LEU B 16 6.719 12.513 -2.953 1.00 0.00 C ATOM 0 H LEU B 16 3.757 13.111 -6.609 1.00 0.00 H new ATOM 0 HA LEU B 16 3.104 11.936 -4.086 1.00 0.00 H new ATOM 0 HB2 LEU B 16 4.990 11.282 -5.586 1.00 0.00 H new ATOM 0 HB3 LEU B 16 5.752 12.830 -5.280 1.00 0.00 H new ATOM 0 HG LEU B 16 5.097 11.119 -2.918 1.00 0.00 H new ATOM 0 HD11 LEU B 16 7.220 9.873 -3.199 1.00 0.00 H new ATOM 0 HD12 LEU B 16 6.074 9.523 -4.516 1.00 0.00 H new ATOM 0 HD13 LEU B 16 7.442 10.627 -4.796 1.00 0.00 H new ATOM 0 HD21 LEU B 16 7.228 12.066 -2.099 1.00 0.00 H new ATOM 0 HD22 LEU B 16 7.458 12.885 -3.663 1.00 0.00 H new ATOM 0 HD23 LEU B 16 6.096 13.340 -2.611 1.00 0.00 H new ATOM 1583 N ALA B 17 4.125 15.045 -4.128 1.00 0.00 N ATOM 1584 CA ALA B 17 4.260 16.252 -3.324 1.00 0.00 C ATOM 1585 C ALA B 17 2.968 16.561 -2.586 1.00 0.00 C ATOM 1586 O ALA B 17 2.986 16.852 -1.395 1.00 0.00 O ATOM 1587 CB ALA B 17 4.663 17.438 -4.191 1.00 0.00 C ATOM 0 H ALA B 17 4.258 15.192 -5.128 1.00 0.00 H new ATOM 0 HA ALA B 17 5.045 16.075 -2.589 1.00 0.00 H new ATOM 0 HB1 ALA B 17 4.758 18.328 -3.569 1.00 0.00 H new ATOM 0 HB2 ALA B 17 5.618 17.229 -4.673 1.00 0.00 H new ATOM 0 HB3 ALA B 17 3.902 17.607 -4.953 1.00 0.00 H new ATOM 1593 N GLU B 18 1.843 16.482 -3.288 1.00 0.00 N ATOM 1594 CA GLU B 18 0.557 16.763 -2.671 1.00 0.00 C ATOM 1595 C GLU B 18 0.122 15.590 -1.792 1.00 0.00 C ATOM 1596 O GLU B 18 -0.606 15.771 -0.816 1.00 0.00 O ATOM 1597 CB GLU B 18 -0.501 17.089 -3.728 1.00 0.00 C ATOM 1598 CG GLU B 18 -1.785 17.644 -3.137 1.00 0.00 C ATOM 1599 CD GLU B 18 -2.723 18.194 -4.187 1.00 0.00 C ATOM 1600 OE1 GLU B 18 -3.320 17.396 -4.938 1.00 0.00 O ATOM 1601 OE2 GLU B 18 -2.875 19.429 -4.263 1.00 0.00 O ATOM 0 H GLU B 18 1.797 16.228 -4.275 1.00 0.00 H new ATOM 0 HA GLU B 18 0.664 17.642 -2.036 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.091 17.812 -4.433 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -0.730 16.186 -4.295 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -2.293 16.857 -2.579 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -1.541 18.433 -2.425 1.00 0.00 H new ATOM 1608 N LEU B 19 0.586 14.388 -2.130 1.00 0.00 N ATOM 1609 CA LEU B 19 0.389 13.224 -1.271 1.00 0.00 C ATOM 1610 C LEU B 19 1.021 13.483 0.092 1.00 0.00 C ATOM 1611 O LEU B 19 0.389 13.309 1.136 1.00 0.00 O ATOM 1612 CB LEU B 19 1.018 11.977 -1.905 1.00 0.00 C ATOM 1613 CG LEU B 19 0.044 10.856 -2.276 1.00 0.00 C ATOM 1614 CD1 LEU B 19 -0.978 11.343 -3.290 1.00 0.00 C ATOM 1615 CD2 LEU B 19 0.803 9.659 -2.826 1.00 0.00 C ATOM 0 H LEU B 19 1.099 14.196 -2.990 1.00 0.00 H new ATOM 0 HA LEU B 19 -0.681 13.052 -1.151 1.00 0.00 H new ATOM 0 HB2 LEU B 19 1.553 12.280 -2.805 1.00 0.00 H new ATOM 0 HB3 LEU B 19 1.759 11.575 -1.214 1.00 0.00 H new ATOM 0 HG LEU B 19 -0.487 10.552 -1.374 1.00 0.00 H new ATOM 0 HD11 LEU B 19 -1.660 10.530 -3.539 1.00 0.00 H new ATOM 0 HD12 LEU B 19 -1.543 12.174 -2.867 1.00 0.00 H new ATOM 0 HD13 LEU B 19 -0.465 11.676 -4.192 1.00 0.00 H new ATOM 0 HD21 LEU B 19 0.098 8.869 -3.086 1.00 0.00 H new ATOM 0 HD22 LEU B 19 1.358 9.957 -3.716 1.00 0.00 H new ATOM 0 HD23 LEU B 19 1.498 9.291 -2.071 1.00 0.00 H new ATOM 1627 N LEU B 20 2.274 13.923 0.066 1.00 0.00 N ATOM 1628 CA LEU B 20 2.992 14.275 1.284 1.00 0.00 C ATOM 1629 C LEU B 20 2.449 15.574 1.875 1.00 0.00 C ATOM 1630 O LEU B 20 2.554 15.803 3.073 1.00 0.00 O ATOM 1631 CB LEU B 20 4.497 14.402 1.011 1.00 0.00 C ATOM 1632 CG LEU B 20 5.310 13.105 1.141 1.00 0.00 C ATOM 1633 CD1 LEU B 20 5.281 12.603 2.574 1.00 0.00 C ATOM 1634 CD2 LEU B 20 4.790 12.031 0.196 1.00 0.00 C ATOM 0 H LEU B 20 2.815 14.045 -0.790 1.00 0.00 H new ATOM 0 HA LEU B 20 2.839 13.475 2.009 1.00 0.00 H new ATOM 0 HB2 LEU B 20 4.633 14.795 0.003 1.00 0.00 H new ATOM 0 HB3 LEU B 20 4.911 15.139 1.699 1.00 0.00 H new ATOM 0 HG LEU B 20 6.341 13.327 0.865 1.00 0.00 H new ATOM 0 HD11 LEU B 20 5.862 11.684 2.649 1.00 0.00 H new ATOM 0 HD12 LEU B 20 5.710 13.358 3.233 1.00 0.00 H new ATOM 0 HD13 LEU B 20 4.250 12.407 2.870 1.00 0.00 H new ATOM 0 HD21 LEU B 20 5.386 11.125 0.311 1.00 0.00 H new ATOM 0 HD22 LEU B 20 3.748 11.813 0.431 1.00 0.00 H new ATOM 0 HD23 LEU B 20 4.863 12.385 -0.832 1.00 0.00 H new ATOM 1646 N ASN B 21 1.870 16.414 1.027 1.00 0.00 N ATOM 1647 CA ASN B 21 1.249 17.658 1.477 1.00 0.00 C ATOM 1648 C ASN B 21 0.104 17.366 2.433 1.00 0.00 C ATOM 1649 O ASN B 21 -0.001 17.985 3.487 1.00 0.00 O ATOM 1650 CB ASN B 21 0.740 18.473 0.283 1.00 0.00 C ATOM 1651 CG ASN B 21 0.005 19.737 0.696 1.00 0.00 C ATOM 1652 OD1 ASN B 21 -1.218 19.742 0.844 1.00 0.00 O ATOM 1653 ND2 ASN B 21 0.747 20.813 0.894 1.00 0.00 N ATOM 0 H ASN B 21 1.816 16.258 0.020 1.00 0.00 H new ATOM 0 HA ASN B 21 2.005 18.243 2.001 1.00 0.00 H new ATOM 0 HB2 ASN B 21 1.584 18.741 -0.353 1.00 0.00 H new ATOM 0 HB3 ASN B 21 0.074 17.852 -0.316 1.00 0.00 H new ATOM 0 HD21 ASN B 21 0.309 21.689 1.180 1.00 0.00 H new ATOM 0 HD22 ASN B 21 1.757 20.767 0.761 1.00 0.00 H new ATOM 1660 N VAL B 22 -0.744 16.414 2.067 1.00 0.00 N ATOM 1661 CA VAL B 22 -1.849 16.005 2.926 1.00 0.00 C ATOM 1662 C VAL B 22 -1.320 15.361 4.204 1.00 0.00 C ATOM 1663 O VAL B 22 -1.823 15.618 5.305 1.00 0.00 O ATOM 1664 CB VAL B 22 -2.791 15.019 2.204 1.00 0.00 C ATOM 1665 CG1 VAL B 22 -3.909 14.556 3.128 1.00 0.00 C ATOM 1666 CG2 VAL B 22 -3.365 15.657 0.950 1.00 0.00 C ATOM 0 H VAL B 22 -0.689 15.910 1.182 1.00 0.00 H new ATOM 0 HA VAL B 22 -2.416 16.901 3.178 1.00 0.00 H new ATOM 0 HB VAL B 22 -2.209 14.144 1.915 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -4.558 13.862 2.594 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -3.480 14.056 3.996 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -4.490 15.418 3.456 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -4.027 14.949 0.452 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -3.927 16.551 1.221 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -2.553 15.930 0.276 1.00 0.00 H new ATOM 1676 N LEU B 23 -0.287 14.540 4.050 1.00 0.00 N ATOM 1677 CA LEU B 23 0.333 13.863 5.182 1.00 0.00 C ATOM 1678 C LEU B 23 0.956 14.871 6.145 1.00 0.00 C ATOM 1679 O LEU B 23 0.814 14.750 7.355 1.00 0.00 O ATOM 1680 CB LEU B 23 1.394 12.872 4.692 1.00 0.00 C ATOM 1681 CG LEU B 23 2.028 12.009 5.783 1.00 0.00 C ATOM 1682 CD1 LEU B 23 0.967 11.174 6.484 1.00 0.00 C ATOM 1683 CD2 LEU B 23 3.107 11.114 5.196 1.00 0.00 C ATOM 0 H LEU B 23 0.140 14.327 3.148 1.00 0.00 H new ATOM 0 HA LEU B 23 -0.442 13.314 5.717 1.00 0.00 H new ATOM 0 HB2 LEU B 23 0.941 12.216 3.949 1.00 0.00 H new ATOM 0 HB3 LEU B 23 2.183 13.429 4.186 1.00 0.00 H new ATOM 0 HG LEU B 23 2.490 12.668 6.518 1.00 0.00 H new ATOM 0 HD11 LEU B 23 1.435 10.566 7.258 1.00 0.00 H new ATOM 0 HD12 LEU B 23 0.227 11.833 6.939 1.00 0.00 H new ATOM 0 HD13 LEU B 23 0.477 10.524 5.759 1.00 0.00 H new ATOM 0 HD21 LEU B 23 3.547 10.507 5.988 1.00 0.00 H new ATOM 0 HD22 LEU B 23 2.668 10.462 4.441 1.00 0.00 H new ATOM 0 HD23 LEU B 23 3.881 11.730 4.738 1.00 0.00 H new ATOM 1695 N GLU B 24 1.634 15.869 5.596 1.00 0.00 N ATOM 1696 CA GLU B 24 2.280 16.906 6.398 1.00 0.00 C ATOM 1697 C GLU B 24 1.249 17.899 6.932 1.00 0.00 C ATOM 1698 O GLU B 24 1.457 18.536 7.964 1.00 0.00 O ATOM 1699 CB GLU B 24 3.332 17.630 5.548 1.00 0.00 C ATOM 1700 CG GLU B 24 4.120 18.697 6.292 1.00 0.00 C ATOM 1701 CD GLU B 24 4.882 18.152 7.483 1.00 0.00 C ATOM 1702 OE1 GLU B 24 5.608 17.148 7.330 1.00 0.00 O ATOM 1703 OE2 GLU B 24 4.766 18.730 8.584 1.00 0.00 O ATOM 0 H GLU B 24 1.753 15.985 4.590 1.00 0.00 H new ATOM 0 HA GLU B 24 2.769 16.438 7.253 1.00 0.00 H new ATOM 0 HB2 GLU B 24 4.029 16.893 5.150 1.00 0.00 H new ATOM 0 HB3 GLU B 24 2.836 18.092 4.695 1.00 0.00 H new ATOM 0 HG2 GLU B 24 4.822 19.168 5.604 1.00 0.00 H new ATOM 0 HG3 GLU B 24 3.436 19.475 6.631 1.00 0.00 H new ATOM 1710 N LYS B 25 0.132 18.019 6.222 1.00 0.00 N ATOM 1711 CA LYS B 25 -0.929 18.944 6.602 1.00 0.00 C ATOM 1712 C LYS B 25 -1.509 18.576 7.964 1.00 0.00 C ATOM 1713 O LYS B 25 -1.609 19.416 8.854 1.00 0.00 O ATOM 1714 CB LYS B 25 -2.037 18.948 5.543 1.00 0.00 C ATOM 1715 CG LYS B 25 -3.053 20.066 5.717 1.00 0.00 C ATOM 1716 CD LYS B 25 -4.180 19.968 4.695 1.00 0.00 C ATOM 1717 CE LYS B 25 -3.665 20.052 3.263 1.00 0.00 C ATOM 1718 NZ LYS B 25 -4.770 19.950 2.271 1.00 0.00 N ATOM 0 H LYS B 25 -0.062 17.484 5.376 1.00 0.00 H new ATOM 0 HA LYS B 25 -0.499 19.943 6.669 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -1.582 19.034 4.556 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -2.557 17.990 5.572 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -3.470 20.026 6.723 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -2.554 21.030 5.617 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -4.713 19.027 4.833 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -4.897 20.770 4.869 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -3.136 20.994 3.122 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -2.945 19.253 3.088 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -4.413 19.513 1.398 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -5.536 19.365 2.663 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -5.134 20.901 2.058 1.00 0.00 H new ATOM 1732 N HIS B 26 -1.880 17.316 8.125 1.00 0.00 N ATOM 1733 CA HIS B 26 -2.472 16.859 9.379 1.00 0.00 C ATOM 1734 C HIS B 26 -1.425 16.183 10.251 1.00 0.00 C ATOM 1735 O HIS B 26 -1.598 16.067 11.464 1.00 0.00 O ATOM 1736 CB HIS B 26 -3.640 15.908 9.104 1.00 0.00 C ATOM 1737 CG HIS B 26 -4.758 16.549 8.341 1.00 0.00 C ATOM 1738 ND1 HIS B 26 -5.605 17.482 8.895 1.00 0.00 N ATOM 1739 CD2 HIS B 26 -5.149 16.410 7.051 1.00 0.00 C ATOM 1740 CE1 HIS B 26 -6.467 17.889 7.984 1.00 0.00 C ATOM 1741 NE2 HIS B 26 -6.212 17.254 6.857 1.00 0.00 N ATOM 0 H HIS B 26 -1.784 16.594 7.411 1.00 0.00 H new ATOM 0 HA HIS B 26 -2.854 17.727 9.916 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -3.274 15.047 8.545 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -4.025 15.532 10.052 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -4.706 15.757 6.314 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -7.249 18.618 8.135 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -6.723 17.372 5.982 1.00 0.00 H new ATOM 1750 N LYS B 27 -0.341 15.762 9.609 1.00 0.00 N ATOM 1751 CA LYS B 27 0.784 15.097 10.264 1.00 0.00 C ATOM 1752 C LYS B 27 0.374 13.759 10.867 1.00 0.00 C ATOM 1753 O LYS B 27 -0.104 13.682 11.998 1.00 0.00 O ATOM 1754 CB LYS B 27 1.434 15.996 11.320 1.00 0.00 C ATOM 1755 CG LYS B 27 2.734 15.431 11.872 1.00 0.00 C ATOM 1756 CD LYS B 27 3.479 16.455 12.714 1.00 0.00 C ATOM 1757 CE LYS B 27 3.887 17.663 11.884 1.00 0.00 C ATOM 1758 NZ LYS B 27 4.808 17.297 10.776 1.00 0.00 N ATOM 0 H LYS B 27 -0.215 15.874 8.603 1.00 0.00 H new ATOM 0 HA LYS B 27 1.528 14.899 9.492 1.00 0.00 H new ATOM 0 HB2 LYS B 27 1.628 16.976 10.884 1.00 0.00 H new ATOM 0 HB3 LYS B 27 0.733 16.146 12.141 1.00 0.00 H new ATOM 0 HG2 LYS B 27 2.520 14.549 12.476 1.00 0.00 H new ATOM 0 HG3 LYS B 27 3.369 15.106 11.048 1.00 0.00 H new ATOM 0 HD2 LYS B 27 2.847 16.777 13.542 1.00 0.00 H new ATOM 0 HD3 LYS B 27 4.366 15.995 13.150 1.00 0.00 H new ATOM 0 HE2 LYS B 27 2.996 18.137 11.472 1.00 0.00 H new ATOM 0 HE3 LYS B 27 4.370 18.398 12.528 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 5.713 17.795 10.898 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 4.973 16.270 10.787 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 4.383 17.570 9.867 1.00 0.00 H new ATOM 1772 N ALA B 28 0.560 12.706 10.091 1.00 0.00 N ATOM 1773 CA ALA B 28 0.279 11.361 10.552 1.00 0.00 C ATOM 1774 C ALA B 28 1.555 10.531 10.545 1.00 0.00 C ATOM 1775 O ALA B 28 2.291 10.523 9.559 1.00 0.00 O ATOM 1776 CB ALA B 28 -0.786 10.711 9.686 1.00 0.00 C ATOM 0 H ALA B 28 0.907 12.759 9.133 1.00 0.00 H new ATOM 0 HA ALA B 28 -0.099 11.413 11.573 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -0.983 9.702 10.048 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -1.702 11.299 9.734 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -0.438 10.665 8.654 1.00 0.00 H new ATOM 1782 N PRO B 29 1.849 9.847 11.659 1.00 0.00 N ATOM 1783 CA PRO B 29 3.035 8.995 11.780 1.00 0.00 C ATOM 1784 C PRO B 29 2.993 7.814 10.814 1.00 0.00 C ATOM 1785 O PRO B 29 1.928 7.458 10.300 1.00 0.00 O ATOM 1786 CB PRO B 29 2.985 8.497 13.229 1.00 0.00 C ATOM 1787 CG PRO B 29 2.048 9.420 13.931 1.00 0.00 C ATOM 1788 CD PRO B 29 1.056 9.864 12.898 1.00 0.00 C ATOM 0 HA PRO B 29 3.949 9.538 11.539 1.00 0.00 H new ATOM 0 HB2 PRO B 29 2.633 7.467 13.279 1.00 0.00 H new ATOM 0 HB3 PRO B 29 3.974 8.518 13.686 1.00 0.00 H new ATOM 0 HG2 PRO B 29 1.550 8.915 14.759 1.00 0.00 H new ATOM 0 HG3 PRO B 29 2.582 10.272 14.352 1.00 0.00 H new ATOM 0 HD2 PRO B 29 0.202 9.190 12.841 1.00 0.00 H new ATOM 0 HD3 PRO B 29 0.664 10.858 13.114 1.00 0.00 H new ATOM 1796 N THR B 30 4.152 7.209 10.580 1.00 0.00 N ATOM 1797 CA THR B 30 4.273 6.076 9.670 1.00 0.00 C ATOM 1798 C THR B 30 3.302 4.954 10.036 1.00 0.00 C ATOM 1799 O THR B 30 2.658 4.380 9.161 1.00 0.00 O ATOM 1800 CB THR B 30 5.717 5.541 9.667 1.00 0.00 C ATOM 1801 OG1 THR B 30 6.614 6.611 9.350 1.00 0.00 O ATOM 1802 CG2 THR B 30 5.889 4.412 8.659 1.00 0.00 C ATOM 0 H THR B 30 5.032 7.489 11.014 1.00 0.00 H new ATOM 0 HA THR B 30 4.019 6.429 8.671 1.00 0.00 H new ATOM 0 HB THR B 30 5.940 5.144 10.657 1.00 0.00 H new ATOM 0 HG1 THR B 30 7.112 6.390 8.535 1.00 0.00 H new ATOM 0 HG21 THR B 30 6.919 4.057 8.682 1.00 0.00 H new ATOM 0 HG22 THR B 30 5.217 3.592 8.913 1.00 0.00 H new ATOM 0 HG23 THR B 30 5.654 4.778 7.659 1.00 0.00 H new ATOM 1810 N ASP B 31 3.188 4.665 11.331 1.00 0.00 N ATOM 1811 CA ASP B 31 2.264 3.636 11.821 1.00 0.00 C ATOM 1812 C ASP B 31 0.849 3.866 11.287 1.00 0.00 C ATOM 1813 O ASP B 31 0.263 2.992 10.636 1.00 0.00 O ATOM 1814 CB ASP B 31 2.244 3.635 13.354 1.00 0.00 C ATOM 1815 CG ASP B 31 1.300 2.596 13.933 1.00 0.00 C ATOM 1816 OD1 ASP B 31 1.723 1.436 14.107 1.00 0.00 O ATOM 1817 OD2 ASP B 31 0.136 2.940 14.236 1.00 0.00 O ATOM 0 H ASP B 31 3.724 5.129 12.064 1.00 0.00 H new ATOM 0 HA ASP B 31 2.614 2.669 11.461 1.00 0.00 H new ATOM 0 HB2 ASP B 31 3.252 3.449 13.725 1.00 0.00 H new ATOM 0 HB3 ASP B 31 1.950 4.623 13.709 1.00 0.00 H new ATOM 1822 N LEU B 32 0.319 5.058 11.537 1.00 0.00 N ATOM 1823 CA LEU B 32 -1.018 5.412 11.081 1.00 0.00 C ATOM 1824 C LEU B 32 -1.076 5.455 9.557 1.00 0.00 C ATOM 1825 O LEU B 32 -2.043 4.992 8.955 1.00 0.00 O ATOM 1826 CB LEU B 32 -1.440 6.763 11.663 1.00 0.00 C ATOM 1827 CG LEU B 32 -2.827 7.254 11.233 1.00 0.00 C ATOM 1828 CD1 LEU B 32 -3.897 6.242 11.613 1.00 0.00 C ATOM 1829 CD2 LEU B 32 -3.128 8.607 11.861 1.00 0.00 C ATOM 0 H LEU B 32 0.797 5.796 12.054 1.00 0.00 H new ATOM 0 HA LEU B 32 -1.711 4.647 11.431 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -1.417 6.695 12.751 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -0.702 7.511 11.375 1.00 0.00 H new ATOM 0 HG LEU B 32 -2.831 7.365 10.149 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -4.874 6.610 11.299 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -3.691 5.292 11.119 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -3.894 6.098 12.693 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -4.116 8.942 11.546 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -3.104 8.517 12.947 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -2.380 9.332 11.540 1.00 0.00 H new ATOM 1841 N SER B 33 -0.029 5.994 8.942 1.00 0.00 N ATOM 1842 CA SER B 33 0.042 6.101 7.490 1.00 0.00 C ATOM 1843 C SER B 33 -0.044 4.728 6.831 1.00 0.00 C ATOM 1844 O SER B 33 -0.710 4.566 5.810 1.00 0.00 O ATOM 1845 CB SER B 33 1.332 6.804 7.077 1.00 0.00 C ATOM 1846 OG SER B 33 1.400 8.099 7.645 1.00 0.00 O ATOM 0 H SER B 33 0.786 6.365 9.430 1.00 0.00 H new ATOM 0 HA SER B 33 -0.810 6.691 7.152 1.00 0.00 H new ATOM 0 HB2 SER B 33 2.192 6.215 7.398 1.00 0.00 H new ATOM 0 HB3 SER B 33 1.382 6.875 5.990 1.00 0.00 H new ATOM 0 HG SER B 33 1.600 8.027 8.602 1.00 0.00 H new ATOM 1852 N LEU B 34 0.618 3.740 7.427 1.00 0.00 N ATOM 1853 CA LEU B 34 0.574 2.376 6.916 1.00 0.00 C ATOM 1854 C LEU B 34 -0.849 1.835 6.971 1.00 0.00 C ATOM 1855 O LEU B 34 -1.304 1.168 6.043 1.00 0.00 O ATOM 1856 CB LEU B 34 1.514 1.465 7.711 1.00 0.00 C ATOM 1857 CG LEU B 34 3.001 1.811 7.607 1.00 0.00 C ATOM 1858 CD1 LEU B 34 3.829 0.854 8.451 1.00 0.00 C ATOM 1859 CD2 LEU B 34 3.462 1.773 6.158 1.00 0.00 C ATOM 0 H LEU B 34 1.190 3.860 8.263 1.00 0.00 H new ATOM 0 HA LEU B 34 0.906 2.392 5.878 1.00 0.00 H new ATOM 0 HB2 LEU B 34 1.223 1.497 8.761 1.00 0.00 H new ATOM 0 HB3 LEU B 34 1.372 0.439 7.372 1.00 0.00 H new ATOM 0 HG LEU B 34 3.144 2.823 7.986 1.00 0.00 H new ATOM 0 HD11 LEU B 34 4.884 1.114 8.366 1.00 0.00 H new ATOM 0 HD12 LEU B 34 3.520 0.928 9.494 1.00 0.00 H new ATOM 0 HD13 LEU B 34 3.677 -0.166 8.099 1.00 0.00 H new ATOM 0 HD21 LEU B 34 4.522 2.022 6.107 1.00 0.00 H new ATOM 0 HD22 LEU B 34 3.304 0.774 5.752 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.891 2.496 5.575 1.00 0.00 H new ATOM 1871 N MET B 35 -1.555 2.141 8.055 1.00 0.00 N ATOM 1872 CA MET B 35 -2.951 1.738 8.189 1.00 0.00 C ATOM 1873 C MET B 35 -3.811 2.417 7.125 1.00 0.00 C ATOM 1874 O MET B 35 -4.617 1.765 6.460 1.00 0.00 O ATOM 1875 CB MET B 35 -3.493 2.074 9.581 1.00 0.00 C ATOM 1876 CG MET B 35 -2.793 1.340 10.711 1.00 0.00 C ATOM 1877 SD MET B 35 -3.585 1.614 12.310 1.00 0.00 S ATOM 1878 CE MET B 35 -5.193 0.876 12.023 1.00 0.00 C ATOM 0 H MET B 35 -1.186 2.664 8.849 1.00 0.00 H new ATOM 0 HA MET B 35 -2.997 0.658 8.050 1.00 0.00 H new ATOM 0 HB2 MET B 35 -3.400 3.147 9.746 1.00 0.00 H new ATOM 0 HB3 MET B 35 -4.557 1.838 9.612 1.00 0.00 H new ATOM 0 HG2 MET B 35 -2.781 0.272 10.494 1.00 0.00 H new ATOM 0 HG3 MET B 35 -1.754 1.666 10.763 1.00 0.00 H new ATOM 0 HE1 MET B 35 -5.632 0.578 12.975 1.00 0.00 H new ATOM 0 HE2 MET B 35 -5.844 1.601 11.535 1.00 0.00 H new ATOM 0 HE3 MET B 35 -5.082 -0.000 11.384 1.00 0.00 H new ATOM 1888 N VAL B 36 -3.625 3.725 6.963 1.00 0.00 N ATOM 1889 CA VAL B 36 -4.383 4.494 5.980 1.00 0.00 C ATOM 1890 C VAL B 36 -4.137 3.973 4.568 1.00 0.00 C ATOM 1891 O VAL B 36 -5.077 3.626 3.851 1.00 0.00 O ATOM 1892 CB VAL B 36 -4.025 5.996 6.030 1.00 0.00 C ATOM 1893 CG1 VAL B 36 -4.836 6.782 5.010 1.00 0.00 C ATOM 1894 CG2 VAL B 36 -4.246 6.554 7.426 1.00 0.00 C ATOM 0 H VAL B 36 -2.955 4.275 7.501 1.00 0.00 H new ATOM 0 HA VAL B 36 -5.436 4.374 6.234 1.00 0.00 H new ATOM 0 HB VAL B 36 -2.969 6.099 5.779 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -4.566 7.837 5.065 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -4.625 6.405 4.009 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -5.899 6.668 5.224 1.00 0.00 H new ATOM 0 HG21 VAL B 36 -3.988 7.613 7.440 1.00 0.00 H new ATOM 0 HG22 VAL B 36 -5.293 6.432 7.705 1.00 0.00 H new ATOM 0 HG23 VAL B 36 -3.616 6.018 8.136 1.00 0.00 H new ATOM 1904 N LEU B 37 -2.867 3.900 4.185 1.00 0.00 N ATOM 1905 CA LEU B 37 -2.492 3.454 2.848 1.00 0.00 C ATOM 1906 C LEU B 37 -2.913 2.009 2.617 1.00 0.00 C ATOM 1907 O LEU B 37 -3.421 1.673 1.551 1.00 0.00 O ATOM 1908 CB LEU B 37 -0.982 3.601 2.635 1.00 0.00 C ATOM 1909 CG LEU B 37 -0.448 5.034 2.723 1.00 0.00 C ATOM 1910 CD1 LEU B 37 1.061 5.053 2.543 1.00 0.00 C ATOM 1911 CD2 LEU B 37 -1.121 5.921 1.683 1.00 0.00 C ATOM 0 H LEU B 37 -2.078 4.145 4.783 1.00 0.00 H new ATOM 0 HA LEU B 37 -3.013 4.084 2.127 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.466 2.992 3.377 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.728 3.195 1.656 1.00 0.00 H new ATOM 0 HG LEU B 37 -0.681 5.427 3.713 1.00 0.00 H new ATOM 0 HD11 LEU B 37 1.422 6.079 2.609 1.00 0.00 H new ATOM 0 HD12 LEU B 37 1.528 4.453 3.324 1.00 0.00 H new ATOM 0 HD13 LEU B 37 1.316 4.640 1.567 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -0.729 6.935 1.761 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -0.920 5.530 0.686 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -2.197 5.934 1.857 1.00 0.00 H new ATOM 1923 N GLY B 38 -2.711 1.163 3.621 1.00 0.00 N ATOM 1924 CA GLY B 38 -3.101 -0.231 3.510 1.00 0.00 C ATOM 1925 C GLY B 38 -4.585 -0.391 3.251 1.00 0.00 C ATOM 1926 O GLY B 38 -4.994 -1.150 2.369 1.00 0.00 O ATOM 0 H GLY B 38 -2.283 1.418 4.511 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.540 -0.700 2.702 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.836 -0.755 4.428 1.00 0.00 H new ATOM 1930 N ASN B 39 -5.392 0.339 4.010 1.00 0.00 N ATOM 1931 CA ASN B 39 -6.841 0.316 3.839 1.00 0.00 C ATOM 1932 C ASN B 39 -7.218 0.895 2.478 1.00 0.00 C ATOM 1933 O ASN B 39 -8.101 0.378 1.792 1.00 0.00 O ATOM 1934 CB ASN B 39 -7.512 1.113 4.966 1.00 0.00 C ATOM 1935 CG ASN B 39 -9.030 1.079 4.907 1.00 0.00 C ATOM 1936 OD1 ASN B 39 -9.661 0.163 5.437 1.00 0.00 O ATOM 1937 ND2 ASN B 39 -9.627 2.090 4.289 1.00 0.00 N ATOM 0 H ASN B 39 -5.067 0.957 4.753 1.00 0.00 H new ATOM 0 HA ASN B 39 -7.189 -0.716 3.884 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -7.184 0.716 5.927 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -7.177 2.149 4.918 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -10.645 2.128 4.240 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -9.068 2.829 3.863 1.00 0.00 H new ATOM 1944 N MET B 40 -6.518 1.954 2.087 1.00 0.00 N ATOM 1945 CA MET B 40 -6.747 2.612 0.806 1.00 0.00 C ATOM 1946 C MET B 40 -6.454 1.670 -0.362 1.00 0.00 C ATOM 1947 O MET B 40 -7.269 1.531 -1.274 1.00 0.00 O ATOM 1948 CB MET B 40 -5.875 3.865 0.703 1.00 0.00 C ATOM 1949 CG MET B 40 -6.009 4.607 -0.615 1.00 0.00 C ATOM 1950 SD MET B 40 -4.947 6.063 -0.690 1.00 0.00 S ATOM 1951 CE MET B 40 -5.283 6.638 -2.350 1.00 0.00 C ATOM 0 H MET B 40 -5.779 2.379 2.646 1.00 0.00 H new ATOM 0 HA MET B 40 -7.798 2.896 0.752 1.00 0.00 H new ATOM 0 HB2 MET B 40 -6.134 4.542 1.517 1.00 0.00 H new ATOM 0 HB3 MET B 40 -4.832 3.581 0.844 1.00 0.00 H new ATOM 0 HG2 MET B 40 -5.759 3.934 -1.435 1.00 0.00 H new ATOM 0 HG3 MET B 40 -7.047 4.909 -0.756 1.00 0.00 H new ATOM 0 HE1 MET B 40 -4.434 7.218 -2.713 1.00 0.00 H new ATOM 0 HE2 MET B 40 -5.445 5.782 -3.006 1.00 0.00 H new ATOM 0 HE3 MET B 40 -6.175 7.265 -2.344 1.00 0.00 H new ATOM 1961 N VAL B 41 -5.294 1.024 -0.324 1.00 0.00 N ATOM 1962 CA VAL B 41 -4.897 0.095 -1.376 1.00 0.00 C ATOM 1963 C VAL B 41 -5.869 -1.078 -1.459 1.00 0.00 C ATOM 1964 O VAL B 41 -6.329 -1.433 -2.543 1.00 0.00 O ATOM 1965 CB VAL B 41 -3.459 -0.432 -1.156 1.00 0.00 C ATOM 1966 CG1 VAL B 41 -3.102 -1.497 -2.183 1.00 0.00 C ATOM 1967 CG2 VAL B 41 -2.459 0.712 -1.220 1.00 0.00 C ATOM 0 H VAL B 41 -4.610 1.127 0.426 1.00 0.00 H new ATOM 0 HA VAL B 41 -4.920 0.645 -2.317 1.00 0.00 H new ATOM 0 HB VAL B 41 -3.416 -0.885 -0.166 1.00 0.00 H new ATOM 0 HG11 VAL B 41 -2.086 -1.849 -2.004 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -3.796 -2.333 -2.097 1.00 0.00 H new ATOM 0 HG13 VAL B 41 -3.168 -1.073 -3.185 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -1.452 0.324 -1.063 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -2.516 1.190 -2.198 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -2.691 1.442 -0.445 1.00 0.00 H new ATOM 1977 N THR B 42 -6.197 -1.655 -0.307 1.00 0.00 N ATOM 1978 CA THR B 42 -7.138 -2.769 -0.247 1.00 0.00 C ATOM 1979 C THR B 42 -8.484 -2.377 -0.861 1.00 0.00 C ATOM 1980 O THR B 42 -9.071 -3.136 -1.636 1.00 0.00 O ATOM 1981 CB THR B 42 -7.350 -3.240 1.207 1.00 0.00 C ATOM 1982 OG1 THR B 42 -6.088 -3.561 1.804 1.00 0.00 O ATOM 1983 CG2 THR B 42 -8.262 -4.461 1.261 1.00 0.00 C ATOM 0 H THR B 42 -5.825 -1.369 0.599 1.00 0.00 H new ATOM 0 HA THR B 42 -6.710 -3.590 -0.822 1.00 0.00 H new ATOM 0 HB THR B 42 -7.824 -2.429 1.760 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.683 -2.747 2.170 1.00 0.00 H new ATOM 0 HG21 THR B 42 -8.394 -4.771 2.298 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.232 -4.210 0.831 1.00 0.00 H new ATOM 0 HG23 THR B 42 -7.813 -5.276 0.693 1.00 0.00 H new ATOM 1991 N ASN B 43 -8.953 -1.176 -0.529 1.00 0.00 N ATOM 1992 CA ASN B 43 -10.200 -0.656 -1.080 1.00 0.00 C ATOM 1993 C ASN B 43 -10.099 -0.505 -2.595 1.00 0.00 C ATOM 1994 O ASN B 43 -10.976 -0.948 -3.333 1.00 0.00 O ATOM 1995 CB ASN B 43 -10.534 0.701 -0.449 1.00 0.00 C ATOM 1996 CG ASN B 43 -11.802 1.315 -1.014 1.00 0.00 C ATOM 1997 OD1 ASN B 43 -11.775 2.007 -2.032 1.00 0.00 O ATOM 1998 ND2 ASN B 43 -12.920 1.087 -0.347 1.00 0.00 N ATOM 0 H ASN B 43 -8.486 -0.544 0.121 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.995 -1.365 -0.850 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -10.644 0.579 0.629 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -9.701 1.386 -0.609 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -13.799 1.490 -0.672 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -12.904 0.508 0.493 1.00 0.00 H new ATOM 2005 N LEU B 44 -9.011 0.111 -3.044 1.00 0.00 N ATOM 2006 CA LEU B 44 -8.795 0.385 -4.461 1.00 0.00 C ATOM 2007 C LEU B 44 -8.849 -0.899 -5.289 1.00 0.00 C ATOM 2008 O LEU B 44 -9.445 -0.928 -6.370 1.00 0.00 O ATOM 2009 CB LEU B 44 -7.441 1.075 -4.657 1.00 0.00 C ATOM 2010 CG LEU B 44 -7.127 1.516 -6.089 1.00 0.00 C ATOM 2011 CD1 LEU B 44 -8.083 2.608 -6.536 1.00 0.00 C ATOM 2012 CD2 LEU B 44 -5.690 1.996 -6.193 1.00 0.00 C ATOM 0 H LEU B 44 -8.256 0.434 -2.439 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.593 1.043 -4.805 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.402 1.951 -4.009 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.656 0.397 -4.324 1.00 0.00 H new ATOM 0 HG LEU B 44 -7.255 0.657 -6.747 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.842 2.907 -7.556 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -9.106 2.233 -6.499 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.988 3.468 -5.874 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -5.483 2.306 -7.217 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -5.539 2.841 -5.521 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -5.015 1.186 -5.915 1.00 0.00 H new ATOM 2024 N ILE B 45 -8.239 -1.956 -4.769 1.00 0.00 N ATOM 2025 CA ILE B 45 -8.180 -3.236 -5.467 1.00 0.00 C ATOM 2026 C ILE B 45 -9.571 -3.857 -5.618 1.00 0.00 C ATOM 2027 O ILE B 45 -9.910 -4.387 -6.674 1.00 0.00 O ATOM 2028 CB ILE B 45 -7.252 -4.234 -4.735 1.00 0.00 C ATOM 2029 CG1 ILE B 45 -5.832 -3.672 -4.646 1.00 0.00 C ATOM 2030 CG2 ILE B 45 -7.245 -5.581 -5.447 1.00 0.00 C ATOM 2031 CD1 ILE B 45 -4.876 -4.550 -3.865 1.00 0.00 C ATOM 0 H ILE B 45 -7.775 -1.953 -3.861 1.00 0.00 H new ATOM 0 HA ILE B 45 -7.774 -3.034 -6.458 1.00 0.00 H new ATOM 0 HB ILE B 45 -7.633 -4.381 -3.725 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.442 -3.533 -5.654 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.869 -2.687 -4.180 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -6.587 -6.269 -4.917 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -8.256 -5.988 -5.466 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -6.887 -5.451 -6.468 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -3.890 -4.086 -3.845 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -5.242 -4.669 -2.845 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -4.808 -5.528 -4.342 1.00 0.00 H new ATOM 2043 N ASN B 46 -10.377 -3.771 -4.571 1.00 0.00 N ATOM 2044 CA ASN B 46 -11.695 -4.398 -4.573 1.00 0.00 C ATOM 2045 C ASN B 46 -12.716 -3.561 -5.342 1.00 0.00 C ATOM 2046 O ASN B 46 -13.739 -4.078 -5.791 1.00 0.00 O ATOM 2047 CB ASN B 46 -12.189 -4.618 -3.139 1.00 0.00 C ATOM 2048 CG ASN B 46 -11.366 -5.637 -2.372 1.00 0.00 C ATOM 2049 OD1 ASN B 46 -10.817 -6.577 -2.945 1.00 0.00 O ATOM 2050 ND2 ASN B 46 -11.286 -5.461 -1.059 1.00 0.00 N ATOM 0 H ASN B 46 -10.145 -3.275 -3.710 1.00 0.00 H new ATOM 0 HA ASN B 46 -11.594 -5.361 -5.074 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -12.168 -3.668 -2.605 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.228 -4.946 -3.166 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -10.755 -6.118 -0.488 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -11.756 -4.668 -0.621 1.00 0.00 H new ATOM 2057 N THR B 47 -12.441 -2.273 -5.497 1.00 0.00 N ATOM 2058 CA THR B 47 -13.392 -1.370 -6.128 1.00 0.00 C ATOM 2059 C THR B 47 -13.059 -1.113 -7.598 1.00 0.00 C ATOM 2060 O THR B 47 -13.826 -1.474 -8.492 1.00 0.00 O ATOM 2061 CB THR B 47 -13.466 -0.024 -5.378 1.00 0.00 C ATOM 2062 OG1 THR B 47 -12.149 0.525 -5.219 1.00 0.00 O ATOM 2063 CG2 THR B 47 -14.117 -0.198 -4.014 1.00 0.00 C ATOM 0 H THR B 47 -11.572 -1.832 -5.196 1.00 0.00 H new ATOM 0 HA THR B 47 -14.362 -1.865 -6.079 1.00 0.00 H new ATOM 0 HB THR B 47 -14.075 0.661 -5.968 1.00 0.00 H new ATOM 0 HG1 THR B 47 -11.654 0.001 -4.555 1.00 0.00 H new ATOM 0 HG21 THR B 47 -14.158 0.765 -3.505 1.00 0.00 H new ATOM 0 HG22 THR B 47 -15.128 -0.585 -4.140 1.00 0.00 H new ATOM 0 HG23 THR B 47 -13.532 -0.899 -3.418 1.00 0.00 H new ATOM 2071 N SER B 48 -11.910 -0.500 -7.845 1.00 0.00 N ATOM 2072 CA SER B 48 -11.548 -0.072 -9.188 1.00 0.00 C ATOM 2073 C SER B 48 -11.030 -1.241 -10.021 1.00 0.00 C ATOM 2074 O SER B 48 -11.128 -1.235 -11.248 1.00 0.00 O ATOM 2075 CB SER B 48 -10.502 1.039 -9.113 1.00 0.00 C ATOM 2076 OG SER B 48 -10.966 2.110 -8.301 1.00 0.00 O ATOM 0 H SER B 48 -11.212 -0.288 -7.132 1.00 0.00 H new ATOM 0 HA SER B 48 -12.442 0.312 -9.679 1.00 0.00 H new ATOM 0 HB2 SER B 48 -9.572 0.643 -8.705 1.00 0.00 H new ATOM 0 HB3 SER B 48 -10.280 1.405 -10.115 1.00 0.00 H new ATOM 0 HG SER B 48 -10.283 2.811 -8.263 1.00 0.00 H new ATOM 2082 N ILE B 49 -10.487 -2.242 -9.350 1.00 0.00 N ATOM 2083 CA ILE B 49 -9.993 -3.429 -10.025 1.00 0.00 C ATOM 2084 C ILE B 49 -11.033 -4.544 -9.906 1.00 0.00 C ATOM 2085 O ILE B 49 -11.931 -4.467 -9.064 1.00 0.00 O ATOM 2086 CB ILE B 49 -8.640 -3.883 -9.422 1.00 0.00 C ATOM 2087 CG1 ILE B 49 -7.678 -2.694 -9.330 1.00 0.00 C ATOM 2088 CG2 ILE B 49 -8.018 -4.998 -10.256 1.00 0.00 C ATOM 2089 CD1 ILE B 49 -6.358 -3.025 -8.667 1.00 0.00 C ATOM 0 H ILE B 49 -10.377 -2.256 -8.336 1.00 0.00 H new ATOM 0 HA ILE B 49 -9.827 -3.198 -11.077 1.00 0.00 H new ATOM 0 HB ILE B 49 -8.826 -4.270 -8.420 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -7.485 -2.317 -10.334 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -8.161 -1.890 -8.775 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -7.069 -5.299 -9.812 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -8.694 -5.853 -10.282 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -7.846 -4.640 -11.271 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -5.731 -2.134 -8.639 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -6.539 -3.373 -7.650 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -5.852 -3.807 -9.234 1.00 0.00 H new ATOM 2101 N ALA B 50 -10.946 -5.542 -10.775 1.00 0.00 N ATOM 2102 CA ALA B 50 -11.836 -6.692 -10.712 1.00 0.00 C ATOM 2103 C ALA B 50 -11.644 -7.447 -9.395 1.00 0.00 C ATOM 2104 O ALA B 50 -10.572 -7.992 -9.130 1.00 0.00 O ATOM 2105 CB ALA B 50 -11.591 -7.609 -11.899 1.00 0.00 C ATOM 0 H ALA B 50 -10.266 -5.578 -11.534 1.00 0.00 H new ATOM 0 HA ALA B 50 -12.867 -6.340 -10.754 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -12.262 -8.466 -11.841 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.777 -7.064 -12.824 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.558 -7.956 -11.884 1.00 0.00 H new ATOM 2111 N PRO B 51 -12.697 -7.508 -8.566 1.00 0.00 N ATOM 2112 CA PRO B 51 -12.609 -8.046 -7.204 1.00 0.00 C ATOM 2113 C PRO B 51 -12.389 -9.557 -7.164 1.00 0.00 C ATOM 2114 O PRO B 51 -12.186 -10.131 -6.095 1.00 0.00 O ATOM 2115 CB PRO B 51 -13.965 -7.688 -6.590 1.00 0.00 C ATOM 2116 CG PRO B 51 -14.890 -7.575 -7.751 1.00 0.00 C ATOM 2117 CD PRO B 51 -14.062 -7.054 -8.893 1.00 0.00 C ATOM 0 HA PRO B 51 -11.754 -7.632 -6.670 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -14.298 -8.456 -5.892 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -13.913 -6.752 -6.033 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -15.328 -8.543 -7.996 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -15.715 -6.899 -7.528 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -14.400 -7.455 -9.849 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -14.117 -5.968 -8.965 1.00 0.00 H new ATOM 2125 N ALA B 52 -12.428 -10.199 -8.320 1.00 0.00 N ATOM 2126 CA ALA B 52 -12.205 -11.637 -8.392 1.00 0.00 C ATOM 2127 C ALA B 52 -10.713 -11.952 -8.441 1.00 0.00 C ATOM 2128 O ALA B 52 -10.277 -13.014 -7.999 1.00 0.00 O ATOM 2129 CB ALA B 52 -12.919 -12.230 -9.594 1.00 0.00 C ATOM 0 H ALA B 52 -12.611 -9.752 -9.218 1.00 0.00 H new ATOM 0 HA ALA B 52 -12.618 -12.091 -7.491 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -12.740 -13.305 -9.630 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -13.990 -12.043 -9.510 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -12.541 -11.769 -10.506 1.00 0.00 H new ATOM 2135 N GLN B 53 -9.931 -11.018 -8.964 1.00 0.00 N ATOM 2136 CA GLN B 53 -8.487 -11.198 -9.064 1.00 0.00 C ATOM 2137 C GLN B 53 -7.780 -10.328 -8.034 1.00 0.00 C ATOM 2138 O GLN B 53 -6.595 -10.017 -8.168 1.00 0.00 O ATOM 2139 CB GLN B 53 -8.001 -10.855 -10.475 1.00 0.00 C ATOM 2140 CG GLN B 53 -8.265 -9.416 -10.887 1.00 0.00 C ATOM 2141 CD GLN B 53 -7.878 -9.149 -12.325 1.00 0.00 C ATOM 2142 OE1 GLN B 53 -6.748 -8.761 -12.617 1.00 0.00 O ATOM 2143 NE2 GLN B 53 -8.812 -9.368 -13.235 1.00 0.00 N ATOM 0 H GLN B 53 -10.271 -10.127 -9.326 1.00 0.00 H new ATOM 0 HA GLN B 53 -8.250 -12.243 -8.863 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -6.930 -11.049 -10.537 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -8.487 -11.521 -11.188 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -9.322 -9.190 -10.750 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -7.708 -8.745 -10.233 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -9.737 -9.690 -12.949 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -8.608 -9.215 -14.223 1.00 0.00 H new ATOM 2152 N ARG B 54 -8.518 -9.967 -6.991 1.00 0.00 N ATOM 2153 CA ARG B 54 -8.016 -9.088 -5.944 1.00 0.00 C ATOM 2154 C ARG B 54 -6.733 -9.642 -5.316 1.00 0.00 C ATOM 2155 O ARG B 54 -5.816 -8.887 -4.988 1.00 0.00 O ATOM 2156 CB ARG B 54 -9.089 -8.886 -4.864 1.00 0.00 C ATOM 2157 CG ARG B 54 -9.396 -10.144 -4.067 1.00 0.00 C ATOM 2158 CD ARG B 54 -10.419 -9.892 -2.972 1.00 0.00 C ATOM 2159 NE ARG B 54 -11.792 -9.986 -3.459 1.00 0.00 N ATOM 2160 CZ ARG B 54 -12.859 -10.054 -2.664 1.00 0.00 C ATOM 2161 NH1 ARG B 54 -12.717 -9.985 -1.343 1.00 0.00 N ATOM 2162 NH2 ARG B 54 -14.073 -10.188 -3.188 1.00 0.00 N ATOM 0 H ARG B 54 -9.480 -10.275 -6.848 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.778 -8.126 -6.399 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -8.761 -8.104 -4.180 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -10.006 -8.533 -5.336 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.768 -10.917 -4.740 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.476 -10.524 -3.623 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.272 -10.613 -2.168 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.255 -8.902 -2.546 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.943 -10.000 -4.468 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -11.788 -9.880 -0.935 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -13.537 -10.037 -0.739 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -14.189 -10.239 -4.200 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.889 -10.240 -2.578 1.00 0.00 H new ATOM 2176 N GLN B 55 -6.659 -10.963 -5.174 1.00 0.00 N ATOM 2177 CA GLN B 55 -5.505 -11.594 -4.548 1.00 0.00 C ATOM 2178 C GLN B 55 -4.290 -11.509 -5.457 1.00 0.00 C ATOM 2179 O GLN B 55 -3.176 -11.296 -4.989 1.00 0.00 O ATOM 2180 CB GLN B 55 -5.803 -13.053 -4.209 1.00 0.00 C ATOM 2181 CG GLN B 55 -4.658 -13.752 -3.495 1.00 0.00 C ATOM 2182 CD GLN B 55 -5.002 -15.173 -3.099 1.00 0.00 C ATOM 2183 OE1 GLN B 55 -5.771 -15.855 -3.779 1.00 0.00 O ATOM 2184 NE2 GLN B 55 -4.452 -15.624 -1.985 1.00 0.00 N ATOM 0 H GLN B 55 -7.382 -11.613 -5.483 1.00 0.00 H new ATOM 0 HA GLN B 55 -5.289 -11.059 -3.623 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -6.694 -13.098 -3.583 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -6.032 -13.593 -5.128 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -3.782 -13.761 -4.143 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -4.390 -13.185 -2.604 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -3.820 -15.028 -1.450 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -4.659 -16.568 -1.660 1.00 0.00 H new ATOM 2193 N ALA B 56 -4.517 -11.657 -6.757 1.00 0.00 N ATOM 2194 CA ALA B 56 -3.437 -11.602 -7.733 1.00 0.00 C ATOM 2195 C ALA B 56 -2.778 -10.230 -7.719 1.00 0.00 C ATOM 2196 O ALA B 56 -1.551 -10.113 -7.782 1.00 0.00 O ATOM 2197 CB ALA B 56 -3.961 -11.931 -9.124 1.00 0.00 C ATOM 0 H ALA B 56 -5.441 -11.816 -7.159 1.00 0.00 H new ATOM 0 HA ALA B 56 -2.687 -12.346 -7.464 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -3.142 -11.886 -9.842 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -4.388 -12.934 -9.124 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -4.729 -11.210 -9.404 1.00 0.00 H new ATOM 2203 N ILE B 57 -3.598 -9.192 -7.617 1.00 0.00 N ATOM 2204 CA ILE B 57 -3.096 -7.827 -7.550 1.00 0.00 C ATOM 2205 C ILE B 57 -2.316 -7.613 -6.256 1.00 0.00 C ATOM 2206 O ILE B 57 -1.184 -7.126 -6.274 1.00 0.00 O ATOM 2207 CB ILE B 57 -4.244 -6.798 -7.632 1.00 0.00 C ATOM 2208 CG1 ILE B 57 -5.079 -7.029 -8.897 1.00 0.00 C ATOM 2209 CG2 ILE B 57 -3.692 -5.377 -7.604 1.00 0.00 C ATOM 2210 CD1 ILE B 57 -4.292 -6.910 -10.188 1.00 0.00 C ATOM 0 H ILE B 57 -4.614 -9.270 -7.579 1.00 0.00 H new ATOM 0 HA ILE B 57 -2.437 -7.678 -8.405 1.00 0.00 H new ATOM 0 HB ILE B 57 -4.890 -6.930 -6.764 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -5.527 -8.021 -8.847 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -5.898 -6.310 -8.915 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -4.516 -4.665 -7.663 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -3.141 -5.219 -6.677 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -3.024 -5.229 -8.453 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -4.954 -7.087 -11.035 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -3.866 -5.910 -10.263 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -3.490 -7.648 -10.194 1.00 0.00 H new ATOM 2222 N ALA B 58 -2.924 -8.004 -5.141 1.00 0.00 N ATOM 2223 CA ALA B 58 -2.299 -7.861 -3.833 1.00 0.00 C ATOM 2224 C ALA B 58 -0.997 -8.651 -3.753 1.00 0.00 C ATOM 2225 O ALA B 58 -0.008 -8.178 -3.202 1.00 0.00 O ATOM 2226 CB ALA B 58 -3.256 -8.313 -2.743 1.00 0.00 C ATOM 0 H ALA B 58 -3.853 -8.424 -5.118 1.00 0.00 H new ATOM 0 HA ALA B 58 -2.062 -6.807 -3.685 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.778 -8.202 -1.770 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -4.159 -7.703 -2.776 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.519 -9.359 -2.900 1.00 0.00 H new ATOM 2232 N ASN B 59 -1.005 -9.854 -4.313 1.00 0.00 N ATOM 2233 CA ASN B 59 0.176 -10.711 -4.322 1.00 0.00 C ATOM 2234 C ASN B 59 1.307 -10.071 -5.118 1.00 0.00 C ATOM 2235 O ASN B 59 2.464 -10.092 -4.694 1.00 0.00 O ATOM 2236 CB ASN B 59 -0.177 -12.092 -4.887 1.00 0.00 C ATOM 2237 CG ASN B 59 1.044 -12.910 -5.264 1.00 0.00 C ATOM 2238 OD1 ASN B 59 1.716 -13.483 -4.407 1.00 0.00 O ATOM 2239 ND2 ASN B 59 1.311 -13.008 -6.555 1.00 0.00 N ATOM 0 H ASN B 59 -1.821 -10.261 -4.770 1.00 0.00 H new ATOM 0 HA ASN B 59 0.521 -10.835 -3.295 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -0.761 -12.641 -4.149 1.00 0.00 H new ATOM 0 HB3 ASN B 59 -0.809 -11.968 -5.766 1.00 0.00 H new ATOM 0 HD21 ASN B 59 2.098 -13.574 -6.871 1.00 0.00 H new ATOM 0 HD22 ASN B 59 0.730 -12.517 -7.235 1.00 0.00 H new ATOM 2246 N SER B 60 0.967 -9.484 -6.258 1.00 0.00 N ATOM 2247 CA SER B 60 1.952 -8.803 -7.087 1.00 0.00 C ATOM 2248 C SER B 60 2.527 -7.595 -6.352 1.00 0.00 C ATOM 2249 O SER B 60 3.738 -7.379 -6.345 1.00 0.00 O ATOM 2250 CB SER B 60 1.315 -8.369 -8.408 1.00 0.00 C ATOM 2251 OG SER B 60 0.726 -9.475 -9.073 1.00 0.00 O ATOM 0 H SER B 60 0.017 -9.466 -6.629 1.00 0.00 H new ATOM 0 HA SER B 60 2.767 -9.495 -7.300 1.00 0.00 H new ATOM 0 HB2 SER B 60 0.558 -7.608 -8.219 1.00 0.00 H new ATOM 0 HB3 SER B 60 2.071 -7.914 -9.049 1.00 0.00 H new ATOM 0 HG SER B 60 -0.217 -9.547 -8.816 1.00 0.00 H new ATOM 2257 N PHE B 61 1.648 -6.826 -5.717 1.00 0.00 N ATOM 2258 CA PHE B 61 2.060 -5.647 -4.965 1.00 0.00 C ATOM 2259 C PHE B 61 2.924 -6.041 -3.768 1.00 0.00 C ATOM 2260 O PHE B 61 3.949 -5.415 -3.502 1.00 0.00 O ATOM 2261 CB PHE B 61 0.829 -4.862 -4.494 1.00 0.00 C ATOM 2262 CG PHE B 61 1.158 -3.604 -3.734 1.00 0.00 C ATOM 2263 CD1 PHE B 61 1.546 -2.454 -4.405 1.00 0.00 C ATOM 2264 CD2 PHE B 61 1.083 -3.574 -2.350 1.00 0.00 C ATOM 2265 CE1 PHE B 61 1.848 -1.298 -3.710 1.00 0.00 C ATOM 2266 CE2 PHE B 61 1.383 -2.420 -1.650 1.00 0.00 C ATOM 2267 CZ PHE B 61 1.769 -1.282 -2.331 1.00 0.00 C ATOM 0 H PHE B 61 0.643 -6.999 -5.709 1.00 0.00 H new ATOM 0 HA PHE B 61 2.654 -5.012 -5.622 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.223 -4.602 -5.362 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.220 -5.507 -3.861 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.613 -2.462 -5.483 1.00 0.00 H new ATOM 0 HD2 PHE B 61 0.787 -4.463 -1.812 1.00 0.00 H new ATOM 0 HE1 PHE B 61 2.145 -0.408 -4.245 1.00 0.00 H new ATOM 0 HE2 PHE B 61 1.316 -2.408 -0.572 1.00 0.00 H new ATOM 0 HZ PHE B 61 2.009 -0.381 -1.786 1.00 0.00 H new ATOM 2277 N ALA B 62 2.508 -7.087 -3.061 1.00 0.00 N ATOM 2278 CA ALA B 62 3.232 -7.565 -1.890 1.00 0.00 C ATOM 2279 C ALA B 62 4.654 -7.978 -2.251 1.00 0.00 C ATOM 2280 O ALA B 62 5.614 -7.550 -1.611 1.00 0.00 O ATOM 2281 CB ALA B 62 2.491 -8.728 -1.246 1.00 0.00 C ATOM 0 H ALA B 62 1.668 -7.622 -3.281 1.00 0.00 H new ATOM 0 HA ALA B 62 3.291 -6.745 -1.174 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.045 -9.073 -0.373 1.00 0.00 H new ATOM 0 HB2 ALA B 62 1.497 -8.401 -0.940 1.00 0.00 H new ATOM 0 HB3 ALA B 62 2.400 -9.543 -1.964 1.00 0.00 H new ATOM 2287 N ARG B 63 4.783 -8.793 -3.292 1.00 0.00 N ATOM 2288 CA ARG B 63 6.092 -9.270 -3.725 1.00 0.00 C ATOM 2289 C ARG B 63 6.942 -8.125 -4.257 1.00 0.00 C ATOM 2290 O ARG B 63 8.163 -8.104 -4.067 1.00 0.00 O ATOM 2291 CB ARG B 63 5.952 -10.374 -4.777 1.00 0.00 C ATOM 2292 CG ARG B 63 5.979 -11.773 -4.185 1.00 0.00 C ATOM 2293 CD ARG B 63 4.837 -11.994 -3.207 1.00 0.00 C ATOM 2294 NE ARG B 63 5.192 -12.968 -2.179 1.00 0.00 N ATOM 2295 CZ ARG B 63 4.351 -13.857 -1.657 1.00 0.00 C ATOM 2296 NH1 ARG B 63 3.109 -13.964 -2.111 1.00 0.00 N ATOM 2297 NH2 ARG B 63 4.766 -14.659 -0.687 1.00 0.00 N ATOM 0 H ARG B 63 4.001 -9.136 -3.850 1.00 0.00 H new ATOM 0 HA ARG B 63 6.597 -9.691 -2.856 1.00 0.00 H new ATOM 0 HB2 ARG B 63 5.017 -10.234 -5.319 1.00 0.00 H new ATOM 0 HB3 ARG B 63 6.759 -10.279 -5.504 1.00 0.00 H new ATOM 0 HG2 ARG B 63 5.918 -12.508 -4.987 1.00 0.00 H new ATOM 0 HG3 ARG B 63 6.929 -11.934 -3.676 1.00 0.00 H new ATOM 0 HD2 ARG B 63 4.572 -11.047 -2.736 1.00 0.00 H new ATOM 0 HD3 ARG B 63 3.956 -12.339 -3.748 1.00 0.00 H new ATOM 0 HE ARG B 63 6.153 -12.967 -1.837 1.00 0.00 H new ATOM 0 HH11 ARG B 63 2.789 -13.361 -2.869 1.00 0.00 H new ATOM 0 HH12 ARG B 63 2.474 -14.650 -1.702 1.00 0.00 H new ATOM 0 HH21 ARG B 63 5.725 -14.592 -0.345 1.00 0.00 H new ATOM 0 HH22 ARG B 63 4.127 -15.343 -0.282 1.00 0.00 H new ATOM 2311 N ALA B 64 6.295 -7.166 -4.908 1.00 0.00 N ATOM 2312 CA ALA B 64 6.985 -5.980 -5.386 1.00 0.00 C ATOM 2313 C ALA B 64 7.496 -5.157 -4.211 1.00 0.00 C ATOM 2314 O ALA B 64 8.606 -4.634 -4.246 1.00 0.00 O ATOM 2315 CB ALA B 64 6.067 -5.141 -6.264 1.00 0.00 C ATOM 0 H ALA B 64 5.297 -7.188 -5.115 1.00 0.00 H new ATOM 0 HA ALA B 64 7.837 -6.296 -5.987 1.00 0.00 H new ATOM 0 HB1 ALA B 64 6.603 -4.258 -6.611 1.00 0.00 H new ATOM 0 HB2 ALA B 64 5.745 -5.731 -7.122 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.195 -4.833 -5.688 1.00 0.00 H new ATOM 2321 N LEU B 65 6.687 -5.072 -3.160 1.00 0.00 N ATOM 2322 CA LEU B 65 7.050 -4.326 -1.961 1.00 0.00 C ATOM 2323 C LEU B 65 8.239 -4.974 -1.256 1.00 0.00 C ATOM 2324 O LEU B 65 9.199 -4.294 -0.890 1.00 0.00 O ATOM 2325 CB LEU B 65 5.854 -4.244 -1.008 1.00 0.00 C ATOM 2326 CG LEU B 65 6.048 -3.335 0.208 1.00 0.00 C ATOM 2327 CD1 LEU B 65 6.201 -1.886 -0.228 1.00 0.00 C ATOM 2328 CD2 LEU B 65 4.884 -3.484 1.175 1.00 0.00 C ATOM 0 H LEU B 65 5.769 -5.514 -3.115 1.00 0.00 H new ATOM 0 HA LEU B 65 7.337 -3.318 -2.260 1.00 0.00 H new ATOM 0 HB2 LEU B 65 4.987 -3.894 -1.568 1.00 0.00 H new ATOM 0 HB3 LEU B 65 5.621 -5.249 -0.656 1.00 0.00 H new ATOM 0 HG LEU B 65 6.961 -3.636 0.722 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.338 -1.254 0.650 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.068 -1.792 -0.881 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.306 -1.571 -0.765 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.038 -2.831 2.034 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.956 -3.210 0.673 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.822 -4.518 1.513 1.00 0.00 H new ATOM 2340 N GLN B 66 8.178 -6.295 -1.087 1.00 0.00 N ATOM 2341 CA GLN B 66 9.251 -7.044 -0.429 1.00 0.00 C ATOM 2342 C GLN B 66 10.577 -6.859 -1.162 1.00 0.00 C ATOM 2343 O GLN B 66 11.643 -6.820 -0.546 1.00 0.00 O ATOM 2344 CB GLN B 66 8.908 -8.535 -0.372 1.00 0.00 C ATOM 2345 CG GLN B 66 7.639 -8.856 0.399 1.00 0.00 C ATOM 2346 CD GLN B 66 7.308 -10.336 0.378 1.00 0.00 C ATOM 2347 OE1 GLN B 66 6.624 -10.821 -0.522 1.00 0.00 O ATOM 2348 NE2 GLN B 66 7.789 -11.066 1.373 1.00 0.00 N ATOM 0 H GLN B 66 7.395 -6.871 -1.397 1.00 0.00 H new ATOM 0 HA GLN B 66 9.351 -6.656 0.585 1.00 0.00 H new ATOM 0 HB2 GLN B 66 8.806 -8.911 -1.390 1.00 0.00 H new ATOM 0 HB3 GLN B 66 9.741 -9.070 0.084 1.00 0.00 H new ATOM 0 HG2 GLN B 66 7.752 -8.526 1.432 1.00 0.00 H new ATOM 0 HG3 GLN B 66 6.807 -8.294 -0.026 1.00 0.00 H new ATOM 0 HE21 GLN B 66 8.353 -10.627 2.101 1.00 0.00 H new ATOM 0 HE22 GLN B 66 7.596 -12.067 1.411 1.00 0.00 H new ATOM 2357 N SER B 67 10.505 -6.751 -2.480 1.00 0.00 N ATOM 2358 CA SER B 67 11.698 -6.587 -3.296 1.00 0.00 C ATOM 2359 C SER B 67 12.119 -5.120 -3.352 1.00 0.00 C ATOM 2360 O SER B 67 13.303 -4.802 -3.496 1.00 0.00 O ATOM 2361 CB SER B 67 11.429 -7.118 -4.701 1.00 0.00 C ATOM 2362 OG SER B 67 10.872 -8.423 -4.646 1.00 0.00 O ATOM 0 H SER B 67 9.632 -6.774 -3.007 1.00 0.00 H new ATOM 0 HA SER B 67 12.514 -7.153 -2.847 1.00 0.00 H new ATOM 0 HB2 SER B 67 10.747 -6.448 -5.224 1.00 0.00 H new ATOM 0 HB3 SER B 67 12.357 -7.137 -5.272 1.00 0.00 H new ATOM 0 HG SER B 67 9.915 -8.362 -4.442 1.00 0.00 H new ATOM 2368 N SER B 68 11.142 -4.232 -3.230 1.00 0.00 N ATOM 2369 CA SER B 68 11.393 -2.802 -3.268 1.00 0.00 C ATOM 2370 C SER B 68 12.126 -2.362 -2.004 1.00 0.00 C ATOM 2371 O SER B 68 13.112 -1.622 -2.073 1.00 0.00 O ATOM 2372 CB SER B 68 10.069 -2.043 -3.415 1.00 0.00 C ATOM 2373 OG SER B 68 10.284 -0.661 -3.635 1.00 0.00 O ATOM 0 H SER B 68 10.161 -4.482 -3.103 1.00 0.00 H new ATOM 0 HA SER B 68 12.023 -2.574 -4.128 1.00 0.00 H new ATOM 0 HB2 SER B 68 9.500 -2.460 -4.246 1.00 0.00 H new ATOM 0 HB3 SER B 68 9.468 -2.180 -2.516 1.00 0.00 H new ATOM 0 HG SER B 68 9.727 -0.141 -3.019 1.00 0.00 H new ATOM 2379 N ILE B 69 11.660 -2.839 -0.853 1.00 0.00 N ATOM 2380 CA ILE B 69 12.287 -2.507 0.419 1.00 0.00 C ATOM 2381 C ILE B 69 13.450 -3.462 0.697 1.00 0.00 C ATOM 2382 O ILE B 69 13.501 -4.161 1.712 1.00 0.00 O ATOM 2383 CB ILE B 69 11.269 -2.529 1.582 1.00 0.00 C ATOM 2384 CG1 ILE B 69 10.028 -1.719 1.196 1.00 0.00 C ATOM 2385 CG2 ILE B 69 11.892 -1.964 2.855 1.00 0.00 C ATOM 2386 CD1 ILE B 69 8.970 -1.669 2.276 1.00 0.00 C ATOM 0 H ILE B 69 10.851 -3.456 -0.777 1.00 0.00 H new ATOM 0 HA ILE B 69 12.673 -1.490 0.348 1.00 0.00 H new ATOM 0 HB ILE B 69 10.979 -3.562 1.774 1.00 0.00 H new ATOM 0 HG12 ILE B 69 10.332 -0.701 0.951 1.00 0.00 H new ATOM 0 HG13 ILE B 69 9.592 -2.148 0.293 1.00 0.00 H new ATOM 0 HG21 ILE B 69 11.159 -1.989 3.661 1.00 0.00 H new ATOM 0 HG22 ILE B 69 12.758 -2.564 3.134 1.00 0.00 H new ATOM 0 HG23 ILE B 69 12.205 -0.935 2.681 1.00 0.00 H new ATOM 0 HD11 ILE B 69 8.123 -1.078 1.928 1.00 0.00 H new ATOM 0 HD12 ILE B 69 8.636 -2.681 2.506 1.00 0.00 H new ATOM 0 HD13 ILE B 69 9.387 -1.212 3.173 1.00 0.00 H new