USER MOD reduce.3.24.130724 H: found=0, std=0, add=620, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 623 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 368 ASN : amide:sc= 0.315 K(o=-3,f=-9.5!) USER MOD Set 1.2: B 369 GLN : amide:sc= -3.33 K(o=-3,f=-7.9!) USER MOD Set 2.1: B 312 ASN : amide:sc= -0.112 K(o=-4.7,f=-15!) USER MOD Set 2.2: B 315 LYS NZ :NH3+ -154:sc= -4.46! (180deg=-6.84!) USER MOD Set 2.3: B 316 ASN : amide:sc= -0.0948 K(o=-4.7,f=-7) USER MOD Set 3.1: A 10 GLN : amide:sc=-0.00448 X(o=-3.2,f=-3.2) USER MOD Set 3.2: B 336 GLN : amide:sc= -3.2! C(o=-3.2!,f=-3.7!) USER MOD Single : A 11 MET CE :methyl -135:sc= -4.66! (180deg=-8.6!) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 305 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : B 306 HIS : no HD1:sc= -0.0179 X(o=-0.018,f=-0.31) USER MOD Single : B 309 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : B 310 TYR OH : rot 33:sc= -0.281 USER MOD Single : B 313 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.178) USER MOD Single : B 319 GLN : amide:sc= -0.876 X(o=-0.88,f=-0.47) USER MOD Single : B 321 GLN : amide:sc= -0.102 K(o=-0.1,f=-5.1!) USER MOD Single : B 325 TYR OH : rot -156:sc= -4.14! USER MOD Single : B 326 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 333 HIS :FLIP no HD1:sc= -5.01! C(o=-6.7!,f=-5!) USER MOD Single : B 334 THR OG1 : rot 68:sc= 0.279 USER MOD Single : B 335 TYR OH : rot 180:sc= 0 USER MOD Single : B 337 LYS NZ :NH3+ 136:sc= -2.62! (180deg=-4.92!) USER MOD Single : B 354 THR OG1 : rot -57:sc= 0.428 USER MOD Single : B 356 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 359 TYR OH : rot 180:sc= 0 USER MOD Single : B 361 GLN : amide:sc= -1.39 K(o=-1.4,f=-3.5!) USER MOD Single : B 367 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0418) USER MOD Single : B 374 SER OG : rot 180:sc= 0 USER MOD Single : B 378 GLN : amide:sc= 0.427 K(o=0.43,f=-0.088) USER MOD ----------------------------------------------------------------- ATOM 58 N ILE A 9 1.377 4.652 -1.124 1.00 0.00 N ATOM 59 CA ILE A 9 0.516 3.467 -1.122 1.00 0.00 C ATOM 60 C ILE A 9 -0.271 3.335 -2.400 1.00 0.00 C ATOM 61 O ILE A 9 -0.404 2.237 -2.944 1.00 0.00 O ATOM 62 CB ILE A 9 -0.515 3.471 0.015 1.00 0.00 C ATOM 63 CG1 ILE A 9 -1.280 4.799 0.088 1.00 0.00 C ATOM 64 CG2 ILE A 9 0.154 3.161 1.320 1.00 0.00 C ATOM 65 CD1 ILE A 9 -2.458 4.760 1.035 1.00 0.00 C ATOM 0 HA ILE A 9 1.211 2.637 -0.997 1.00 0.00 H new ATOM 0 HB ILE A 9 -1.249 2.693 -0.195 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -0.596 5.587 0.402 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -1.633 5.062 -0.909 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -0.587 3.167 2.119 1.00 0.00 H new ATOM 0 HG22 ILE A 9 0.621 2.178 1.265 1.00 0.00 H new ATOM 0 HG23 ILE A 9 0.916 3.913 1.526 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -2.954 5.731 1.039 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -3.162 3.994 0.709 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -2.109 4.527 2.041 1.00 0.00 H new ATOM 77 N GLN A 10 -0.826 4.450 -2.854 1.00 0.00 N ATOM 78 CA GLN A 10 -1.640 4.449 -4.046 1.00 0.00 C ATOM 79 C GLN A 10 -0.901 3.761 -5.193 1.00 0.00 C ATOM 80 O GLN A 10 -1.500 3.052 -6.003 1.00 0.00 O ATOM 81 CB GLN A 10 -2.033 5.877 -4.439 1.00 0.00 C ATOM 82 CG GLN A 10 -2.769 6.633 -3.345 1.00 0.00 C ATOM 83 CD GLN A 10 -3.086 8.068 -3.733 1.00 0.00 C ATOM 84 OE1 GLN A 10 -3.762 8.317 -4.731 1.00 0.00 O ATOM 85 NE2 GLN A 10 -2.601 9.019 -2.941 1.00 0.00 N ATOM 0 H GLN A 10 -0.723 5.363 -2.410 1.00 0.00 H new ATOM 0 HA GLN A 10 -2.553 3.892 -3.837 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -1.133 6.430 -4.708 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -2.662 5.839 -5.328 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -3.697 6.111 -3.110 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -2.164 6.632 -2.438 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -2.045 8.768 -2.124 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -2.785 10.000 -3.151 1.00 0.00 H new ATOM 94 N MET A 11 0.415 3.970 -5.224 1.00 0.00 N ATOM 95 CA MET A 11 1.292 3.376 -6.225 1.00 0.00 C ATOM 96 C MET A 11 1.134 1.853 -6.253 1.00 0.00 C ATOM 97 O MET A 11 0.903 1.265 -7.312 1.00 0.00 O ATOM 98 CB MET A 11 2.734 3.763 -5.888 1.00 0.00 C ATOM 99 CG MET A 11 3.795 3.136 -6.772 1.00 0.00 C ATOM 100 SD MET A 11 5.454 3.548 -6.205 1.00 0.00 S ATOM 101 CE MET A 11 6.453 2.637 -7.371 1.00 0.00 C ATOM 0 H MET A 11 0.903 4.560 -4.550 1.00 0.00 H new ATOM 0 HA MET A 11 1.028 3.748 -7.215 1.00 0.00 H new ATOM 0 HB2 MET A 11 2.826 4.847 -5.951 1.00 0.00 H new ATOM 0 HB3 MET A 11 2.935 3.485 -4.853 1.00 0.00 H new ATOM 0 HG2 MET A 11 3.670 2.053 -6.780 1.00 0.00 H new ATOM 0 HG3 MET A 11 3.664 3.479 -7.798 1.00 0.00 H new ATOM 0 HE1 MET A 11 7.250 2.118 -6.839 1.00 0.00 H new ATOM 0 HE2 MET A 11 5.831 1.910 -7.893 1.00 0.00 H new ATOM 0 HE3 MET A 11 6.888 3.327 -8.094 1.00 0.00 H new ATOM 111 N LEU A 12 1.249 1.223 -5.080 1.00 0.00 N ATOM 112 CA LEU A 12 1.105 -0.229 -4.968 1.00 0.00 C ATOM 113 C LEU A 12 -0.344 -0.652 -5.180 1.00 0.00 C ATOM 114 O LEU A 12 -0.621 -1.548 -5.972 1.00 0.00 O ATOM 115 CB LEU A 12 1.552 -0.723 -3.596 1.00 0.00 C ATOM 116 CG LEU A 12 3.012 -0.469 -3.226 1.00 0.00 C ATOM 117 CD1 LEU A 12 3.123 -0.044 -1.766 1.00 0.00 C ATOM 118 CD2 LEU A 12 3.827 -1.727 -3.473 1.00 0.00 C ATOM 0 H LEU A 12 1.441 1.696 -4.197 1.00 0.00 H new ATOM 0 HA LEU A 12 1.736 -0.670 -5.740 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.921 -0.253 -2.841 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.367 -1.796 -3.542 1.00 0.00 H new ATOM 0 HG LEU A 12 3.402 0.336 -3.848 1.00 0.00 H new ATOM 0 HD11 LEU A 12 4.169 0.133 -1.517 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.552 0.871 -1.609 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.727 -0.833 -1.126 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.868 -1.544 -3.208 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.435 -2.540 -2.862 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.763 -2.001 -4.526 1.00 0.00 H new ATOM 130 N LEU A 13 -1.261 -0.015 -4.444 1.00 0.00 N ATOM 131 CA LEU A 13 -2.689 -0.333 -4.532 1.00 0.00 C ATOM 132 C LEU A 13 -3.155 -0.440 -5.982 1.00 0.00 C ATOM 133 O LEU A 13 -3.636 -1.492 -6.407 1.00 0.00 O ATOM 134 CB LEU A 13 -3.517 0.735 -3.809 1.00 0.00 C ATOM 135 CG LEU A 13 -3.284 0.838 -2.304 1.00 0.00 C ATOM 136 CD1 LEU A 13 -3.936 2.099 -1.751 1.00 0.00 C ATOM 137 CD2 LEU A 13 -3.825 -0.399 -1.603 1.00 0.00 C ATOM 0 H LEU A 13 -1.038 0.726 -3.779 1.00 0.00 H new ATOM 0 HA LEU A 13 -2.837 -1.301 -4.053 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -3.302 1.704 -4.260 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -4.573 0.530 -3.983 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.212 0.899 -2.118 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.761 2.158 -0.677 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -3.506 2.974 -2.237 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -5.009 2.068 -1.943 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.653 -0.314 -0.530 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -4.895 -0.486 -1.793 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -3.316 -1.285 -1.983 1.00 0.00 H new ATOM 149 N GLU A 14 -3.004 0.654 -6.737 1.00 0.00 N ATOM 150 CA GLU A 14 -3.401 0.683 -8.146 1.00 0.00 C ATOM 151 C GLU A 14 -2.812 -0.512 -8.895 1.00 0.00 C ATOM 152 O GLU A 14 -3.458 -1.089 -9.771 1.00 0.00 O ATOM 153 CB GLU A 14 -2.953 1.992 -8.805 1.00 0.00 C ATOM 154 CG GLU A 14 -3.683 3.228 -8.292 1.00 0.00 C ATOM 155 CD GLU A 14 -5.166 3.226 -8.627 1.00 0.00 C ATOM 156 OE1 GLU A 14 -5.900 2.365 -8.096 1.00 0.00 O ATOM 157 OE2 GLU A 14 -5.595 4.089 -9.422 1.00 0.00 O ATOM 0 H GLU A 14 -2.610 1.530 -6.394 1.00 0.00 H new ATOM 0 HA GLU A 14 -4.488 0.623 -8.194 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -1.883 2.121 -8.642 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -3.104 1.915 -9.882 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -3.561 3.292 -7.211 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -3.221 4.119 -8.718 1.00 0.00 H new ATOM 164 N ALA A 15 -1.589 -0.883 -8.521 1.00 0.00 N ATOM 165 CA ALA A 15 -0.904 -2.016 -9.125 1.00 0.00 C ATOM 166 C ALA A 15 -1.537 -3.331 -8.702 1.00 0.00 C ATOM 167 O ALA A 15 -1.904 -4.135 -9.551 1.00 0.00 O ATOM 168 CB ALA A 15 0.557 -2.001 -8.748 1.00 0.00 C ATOM 0 H ALA A 15 -1.051 -0.408 -7.796 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.997 -1.928 -10.207 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.060 -2.853 -9.205 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.015 -1.077 -9.102 1.00 0.00 H new ATOM 0 HB3 ALA A 15 0.654 -2.062 -7.664 1.00 0.00 H new ATOM 174 N ALA A 16 -1.656 -3.548 -7.383 1.00 0.00 N ATOM 175 CA ALA A 16 -2.237 -4.783 -6.858 1.00 0.00 C ATOM 176 C ALA A 16 -3.493 -5.180 -7.623 1.00 0.00 C ATOM 177 O ALA A 16 -3.642 -6.333 -8.019 1.00 0.00 O ATOM 178 CB ALA A 16 -2.570 -4.671 -5.383 1.00 0.00 C ATOM 0 H ALA A 16 -1.358 -2.885 -6.667 1.00 0.00 H new ATOM 0 HA ALA A 16 -1.478 -5.555 -6.989 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.999 -5.610 -5.035 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -1.662 -4.456 -4.820 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -3.289 -3.866 -5.232 1.00 0.00 H new ATOM 184 N ASP A 17 -4.394 -4.211 -7.828 1.00 0.00 N ATOM 185 CA ASP A 17 -5.638 -4.454 -8.558 1.00 0.00 C ATOM 186 C ASP A 17 -5.332 -5.102 -9.906 1.00 0.00 C ATOM 187 O ASP A 17 -5.974 -6.078 -10.297 1.00 0.00 O ATOM 188 CB ASP A 17 -6.401 -3.136 -8.755 1.00 0.00 C ATOM 189 CG ASP A 17 -7.762 -3.328 -9.406 1.00 0.00 C ATOM 190 OD1 ASP A 17 -7.810 -3.737 -10.585 1.00 0.00 O ATOM 191 OD2 ASP A 17 -8.780 -3.067 -8.732 1.00 0.00 O ATOM 0 H ASP A 17 -4.282 -3.253 -7.497 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.264 -5.132 -7.979 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -6.532 -2.651 -7.788 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.802 -2.464 -9.370 1.00 0.00 H new ATOM 196 N TYR A 18 -4.326 -4.563 -10.595 1.00 0.00 N ATOM 197 CA TYR A 18 -3.902 -5.093 -11.884 1.00 0.00 C ATOM 198 C TYR A 18 -3.192 -6.428 -11.697 1.00 0.00 C ATOM 199 O TYR A 18 -3.430 -7.373 -12.447 1.00 0.00 O ATOM 200 CB TYR A 18 -2.994 -4.082 -12.603 1.00 0.00 C ATOM 201 CG TYR A 18 -2.481 -4.548 -13.951 1.00 0.00 C ATOM 202 CD1 TYR A 18 -1.559 -5.585 -14.048 1.00 0.00 C ATOM 203 CD2 TYR A 18 -2.922 -3.951 -15.125 1.00 0.00 C ATOM 204 CE1 TYR A 18 -1.091 -6.011 -15.276 1.00 0.00 C ATOM 205 CE2 TYR A 18 -2.458 -4.373 -16.357 1.00 0.00 C ATOM 206 CZ TYR A 18 -1.544 -5.403 -16.429 1.00 0.00 C ATOM 207 OH TYR A 18 -1.083 -5.823 -17.657 1.00 0.00 O ATOM 0 H TYR A 18 -3.789 -3.756 -10.277 1.00 0.00 H new ATOM 0 HA TYR A 18 -4.782 -5.260 -12.505 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -3.544 -3.151 -12.740 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -2.142 -3.857 -11.962 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -1.203 -6.065 -13.148 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -3.639 -3.145 -15.075 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -0.374 -6.816 -15.333 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -2.810 -3.897 -17.260 1.00 0.00 H new ATOM 0 HH TYR A 18 -1.504 -5.290 -18.364 1.00 0.00 H new ATOM 217 N LEU A 19 -2.344 -6.507 -10.671 1.00 0.00 N ATOM 218 CA LEU A 19 -1.628 -7.740 -10.361 1.00 0.00 C ATOM 219 C LEU A 19 -2.639 -8.856 -10.108 1.00 0.00 C ATOM 220 O LEU A 19 -2.431 -10.002 -10.509 1.00 0.00 O ATOM 221 CB LEU A 19 -0.735 -7.546 -9.130 1.00 0.00 C ATOM 222 CG LEU A 19 0.192 -6.330 -9.191 1.00 0.00 C ATOM 223 CD1 LEU A 19 0.917 -6.135 -7.869 1.00 0.00 C ATOM 224 CD2 LEU A 19 1.191 -6.465 -10.331 1.00 0.00 C ATOM 0 H LEU A 19 -2.138 -5.731 -10.042 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.992 -8.008 -11.204 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.370 -7.456 -8.249 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -0.128 -8.441 -8.995 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.423 -5.450 -9.378 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.570 -5.265 -7.937 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.188 -5.980 -7.074 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.514 -7.020 -7.647 1.00 0.00 H new ATOM 0 HD21 LEU A 19 1.838 -5.588 -10.353 1.00 0.00 H new ATOM 0 HD22 LEU A 19 1.796 -7.359 -10.181 1.00 0.00 H new ATOM 0 HD23 LEU A 19 0.655 -6.544 -11.277 1.00 0.00 H new ATOM 236 N GLU A 20 -3.753 -8.493 -9.463 1.00 0.00 N ATOM 237 CA GLU A 20 -4.825 -9.448 -9.174 1.00 0.00 C ATOM 238 C GLU A 20 -5.501 -9.915 -10.461 1.00 0.00 C ATOM 239 O GLU A 20 -5.676 -11.115 -10.679 1.00 0.00 O ATOM 240 CB GLU A 20 -5.874 -8.827 -8.244 1.00 0.00 C ATOM 241 CG GLU A 20 -5.450 -8.752 -6.787 1.00 0.00 C ATOM 242 CD GLU A 20 -5.390 -10.116 -6.119 1.00 0.00 C ATOM 243 OE1 GLU A 20 -4.539 -10.941 -6.514 1.00 0.00 O ATOM 244 OE2 GLU A 20 -6.199 -10.360 -5.199 1.00 0.00 O ATOM 0 H GLU A 20 -3.934 -7.545 -9.132 1.00 0.00 H new ATOM 0 HA GLU A 20 -4.373 -10.307 -8.678 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -6.105 -7.821 -8.596 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -6.794 -9.408 -8.313 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -4.471 -8.278 -6.722 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -6.148 -8.116 -6.243 1.00 0.00 H new ATOM 416 N PHE B 304 7.720 2.594 -10.716 1.00 0.00 N ATOM 417 CA PHE B 304 6.404 1.996 -10.495 1.00 0.00 C ATOM 418 C PHE B 304 6.514 0.478 -10.380 1.00 0.00 C ATOM 419 O PHE B 304 5.950 -0.124 -9.467 1.00 0.00 O ATOM 420 CB PHE B 304 5.457 2.367 -11.644 1.00 0.00 C ATOM 421 CG PHE B 304 4.050 1.857 -11.474 1.00 0.00 C ATOM 422 CD1 PHE B 304 3.255 2.305 -10.430 1.00 0.00 C ATOM 423 CD2 PHE B 304 3.524 0.935 -12.364 1.00 0.00 C ATOM 424 CE1 PHE B 304 1.961 1.841 -10.278 1.00 0.00 C ATOM 425 CE2 PHE B 304 2.232 0.466 -12.215 1.00 0.00 C ATOM 426 CZ PHE B 304 1.449 0.920 -11.172 1.00 0.00 C ATOM 0 HA PHE B 304 6.002 2.386 -9.560 1.00 0.00 H new ATOM 0 HB2 PHE B 304 5.429 3.452 -11.741 1.00 0.00 H new ATOM 0 HB3 PHE B 304 5.864 1.975 -12.576 1.00 0.00 H new ATOM 0 HD1 PHE B 304 3.651 3.024 -9.728 1.00 0.00 H new ATOM 0 HD2 PHE B 304 4.130 0.578 -13.184 1.00 0.00 H new ATOM 0 HE1 PHE B 304 1.351 2.198 -9.461 1.00 0.00 H new ATOM 0 HE2 PHE B 304 1.835 -0.255 -12.914 1.00 0.00 H new ATOM 0 HZ PHE B 304 0.439 0.556 -11.055 1.00 0.00 H new ATOM 436 N ASN B 305 7.254 -0.134 -11.307 1.00 0.00 N ATOM 437 CA ASN B 305 7.449 -1.582 -11.308 1.00 0.00 C ATOM 438 C ASN B 305 8.081 -2.074 -10.003 1.00 0.00 C ATOM 439 O ASN B 305 7.833 -3.201 -9.586 1.00 0.00 O ATOM 440 CB ASN B 305 8.316 -2.009 -12.497 1.00 0.00 C ATOM 441 CG ASN B 305 7.588 -1.897 -13.824 1.00 0.00 C ATOM 442 OD1 ASN B 305 7.101 -0.828 -14.192 1.00 0.00 O ATOM 443 ND2 ASN B 305 7.514 -3.003 -14.558 1.00 0.00 N ATOM 0 H ASN B 305 7.728 0.353 -12.067 1.00 0.00 H new ATOM 0 HA ASN B 305 6.463 -2.038 -11.398 1.00 0.00 H new ATOM 0 HB2 ASN B 305 9.214 -1.392 -12.527 1.00 0.00 H new ATOM 0 HB3 ASN B 305 8.642 -3.039 -12.352 1.00 0.00 H new ATOM 0 HD21 ASN B 305 7.041 -2.985 -15.461 1.00 0.00 H new ATOM 0 HD22 ASN B 305 7.931 -3.870 -14.218 1.00 0.00 H new ATOM 450 N HIS B 306 8.900 -1.231 -9.366 1.00 0.00 N ATOM 451 CA HIS B 306 9.557 -1.606 -8.112 1.00 0.00 C ATOM 452 C HIS B 306 8.524 -1.993 -7.052 1.00 0.00 C ATOM 453 O HIS B 306 8.550 -3.114 -6.542 1.00 0.00 O ATOM 454 CB HIS B 306 10.445 -0.467 -7.611 1.00 0.00 C ATOM 455 CG HIS B 306 11.411 -0.890 -6.551 1.00 0.00 C ATOM 456 ND1 HIS B 306 12.384 -1.847 -6.755 1.00 0.00 N ATOM 457 CD2 HIS B 306 11.554 -0.480 -5.273 1.00 0.00 C ATOM 458 CE1 HIS B 306 13.083 -2.006 -5.645 1.00 0.00 C ATOM 459 NE2 HIS B 306 12.599 -1.187 -4.731 1.00 0.00 N ATOM 0 H HIS B 306 9.122 -0.292 -9.696 1.00 0.00 H new ATOM 0 HA HIS B 306 10.187 -2.475 -8.303 1.00 0.00 H new ATOM 0 HB2 HIS B 306 10.999 -0.051 -8.452 1.00 0.00 H new ATOM 0 HB3 HIS B 306 9.814 0.331 -7.220 1.00 0.00 H new ATOM 0 HD2 HIS B 306 10.957 0.266 -4.770 1.00 0.00 H new ATOM 0 HE1 HIS B 306 13.909 -2.689 -5.509 1.00 0.00 H new ATOM 0 HE2 HIS B 306 12.945 -1.094 -3.776 1.00 0.00 H new ATOM 468 N ALA B 307 7.598 -1.077 -6.746 1.00 0.00 N ATOM 469 CA ALA B 307 6.541 -1.360 -5.772 1.00 0.00 C ATOM 470 C ALA B 307 5.629 -2.452 -6.306 1.00 0.00 C ATOM 471 O ALA B 307 5.245 -3.366 -5.585 1.00 0.00 O ATOM 472 CB ALA B 307 5.718 -0.115 -5.474 1.00 0.00 C ATOM 0 H ALA B 307 7.560 -0.143 -7.155 1.00 0.00 H new ATOM 0 HA ALA B 307 7.014 -1.690 -4.847 1.00 0.00 H new ATOM 0 HB1 ALA B 307 4.942 -0.357 -4.748 1.00 0.00 H new ATOM 0 HB2 ALA B 307 6.366 0.661 -5.067 1.00 0.00 H new ATOM 0 HB3 ALA B 307 5.256 0.244 -6.393 1.00 0.00 H new ATOM 478 N ILE B 308 5.303 -2.334 -7.589 1.00 0.00 N ATOM 479 CA ILE B 308 4.446 -3.284 -8.285 1.00 0.00 C ATOM 480 C ILE B 308 4.934 -4.712 -8.114 1.00 0.00 C ATOM 481 O ILE B 308 4.243 -5.545 -7.527 1.00 0.00 O ATOM 482 CB ILE B 308 4.383 -2.919 -9.781 1.00 0.00 C ATOM 483 CG1 ILE B 308 3.310 -1.858 -10.006 1.00 0.00 C ATOM 484 CG2 ILE B 308 4.128 -4.147 -10.630 1.00 0.00 C ATOM 485 CD1 ILE B 308 3.121 -0.943 -8.813 1.00 0.00 C ATOM 0 H ILE B 308 5.630 -1.569 -8.179 1.00 0.00 H new ATOM 0 HA ILE B 308 3.449 -3.225 -7.849 1.00 0.00 H new ATOM 0 HB ILE B 308 5.347 -2.511 -10.086 1.00 0.00 H new ATOM 0 HG12 ILE B 308 3.576 -1.259 -10.877 1.00 0.00 H new ATOM 0 HG13 ILE B 308 2.364 -2.349 -10.234 1.00 0.00 H new ATOM 0 HG21 ILE B 308 4.088 -3.861 -11.681 1.00 0.00 H new ATOM 0 HG22 ILE B 308 4.933 -4.867 -10.480 1.00 0.00 H new ATOM 0 HG23 ILE B 308 3.179 -4.599 -10.341 1.00 0.00 H new ATOM 0 HD11 ILE B 308 2.345 -0.211 -9.035 1.00 0.00 H new ATOM 0 HD12 ILE B 308 2.825 -1.533 -7.945 1.00 0.00 H new ATOM 0 HD13 ILE B 308 4.057 -0.426 -8.599 1.00 0.00 H new ATOM 497 N ASN B 309 6.133 -4.979 -8.611 1.00 0.00 N ATOM 498 CA ASN B 309 6.724 -6.296 -8.495 1.00 0.00 C ATOM 499 C ASN B 309 6.881 -6.668 -7.018 1.00 0.00 C ATOM 500 O ASN B 309 6.797 -7.840 -6.657 1.00 0.00 O ATOM 501 CB ASN B 309 8.047 -6.329 -9.247 1.00 0.00 C ATOM 502 CG ASN B 309 7.880 -6.766 -10.691 1.00 0.00 C ATOM 503 OD1 ASN B 309 7.195 -6.108 -11.475 1.00 0.00 O ATOM 504 ND2 ASN B 309 8.506 -7.882 -11.052 1.00 0.00 N ATOM 0 H ASN B 309 6.713 -4.297 -9.099 1.00 0.00 H new ATOM 0 HA ASN B 309 6.071 -7.043 -8.947 1.00 0.00 H new ATOM 0 HB2 ASN B 309 8.502 -5.339 -9.220 1.00 0.00 H new ATOM 0 HB3 ASN B 309 8.733 -7.009 -8.741 1.00 0.00 H new ATOM 0 HD21 ASN B 309 8.429 -8.223 -12.010 1.00 0.00 H new ATOM 0 HD22 ASN B 309 9.064 -8.397 -10.371 1.00 0.00 H new ATOM 511 N TYR B 310 7.035 -5.649 -6.159 1.00 0.00 N ATOM 512 CA TYR B 310 7.110 -5.875 -4.719 1.00 0.00 C ATOM 513 C TYR B 310 5.759 -6.411 -4.243 1.00 0.00 C ATOM 514 O TYR B 310 5.702 -7.366 -3.467 1.00 0.00 O ATOM 515 CB TYR B 310 7.488 -4.583 -3.976 1.00 0.00 C ATOM 516 CG TYR B 310 6.993 -4.528 -2.546 1.00 0.00 C ATOM 517 CD1 TYR B 310 7.282 -5.546 -1.645 1.00 0.00 C ATOM 518 CD2 TYR B 310 6.230 -3.456 -2.102 1.00 0.00 C ATOM 519 CE1 TYR B 310 6.821 -5.498 -0.345 1.00 0.00 C ATOM 520 CE2 TYR B 310 5.770 -3.398 -0.802 1.00 0.00 C ATOM 521 CZ TYR B 310 6.065 -4.421 0.072 1.00 0.00 C ATOM 522 OH TYR B 310 5.602 -4.370 1.366 1.00 0.00 O ATOM 0 H TYR B 310 7.109 -4.671 -6.439 1.00 0.00 H new ATOM 0 HA TYR B 310 7.890 -6.605 -4.501 1.00 0.00 H new ATOM 0 HB2 TYR B 310 8.573 -4.479 -3.978 1.00 0.00 H new ATOM 0 HB3 TYR B 310 7.085 -3.730 -4.522 1.00 0.00 H new ATOM 0 HD1 TYR B 310 7.877 -6.388 -1.967 1.00 0.00 H new ATOM 0 HD2 TYR B 310 5.993 -2.654 -2.785 1.00 0.00 H new ATOM 0 HE1 TYR B 310 7.051 -6.299 0.342 1.00 0.00 H new ATOM 0 HE2 TYR B 310 5.182 -2.555 -0.472 1.00 0.00 H new ATOM 0 HH TYR B 310 6.250 -4.799 1.963 1.00 0.00 H new ATOM 532 N VAL B 311 4.670 -5.818 -4.757 1.00 0.00 N ATOM 533 CA VAL B 311 3.326 -6.280 -4.424 1.00 0.00 C ATOM 534 C VAL B 311 3.187 -7.723 -4.896 1.00 0.00 C ATOM 535 O VAL B 311 2.580 -8.551 -4.222 1.00 0.00 O ATOM 536 CB VAL B 311 2.206 -5.448 -5.095 1.00 0.00 C ATOM 537 CG1 VAL B 311 0.856 -5.816 -4.518 1.00 0.00 C ATOM 538 CG2 VAL B 311 2.415 -3.963 -4.941 1.00 0.00 C ATOM 0 H VAL B 311 4.699 -5.025 -5.398 1.00 0.00 H new ATOM 0 HA VAL B 311 3.208 -6.177 -3.345 1.00 0.00 H new ATOM 0 HB VAL B 311 2.241 -5.685 -6.158 1.00 0.00 H new ATOM 0 HG11 VAL B 311 0.080 -5.222 -5.001 1.00 0.00 H new ATOM 0 HG12 VAL B 311 0.663 -6.875 -4.691 1.00 0.00 H new ATOM 0 HG13 VAL B 311 0.852 -5.617 -3.446 1.00 0.00 H new ATOM 0 HG21 VAL B 311 1.601 -3.428 -5.430 1.00 0.00 H new ATOM 0 HG22 VAL B 311 2.433 -3.706 -3.882 1.00 0.00 H new ATOM 0 HG23 VAL B 311 3.362 -3.679 -5.400 1.00 0.00 H new ATOM 548 N ASN B 312 3.788 -8.011 -6.063 1.00 0.00 N ATOM 549 CA ASN B 312 3.773 -9.351 -6.636 1.00 0.00 C ATOM 550 C ASN B 312 4.354 -10.347 -5.641 1.00 0.00 C ATOM 551 O ASN B 312 3.838 -11.451 -5.491 1.00 0.00 O ATOM 552 CB ASN B 312 4.568 -9.382 -7.949 1.00 0.00 C ATOM 553 CG ASN B 312 4.477 -10.718 -8.662 1.00 0.00 C ATOM 554 OD1 ASN B 312 3.421 -11.091 -9.172 1.00 0.00 O ATOM 555 ND2 ASN B 312 5.584 -11.452 -8.697 1.00 0.00 N ATOM 0 H ASN B 312 4.291 -7.323 -6.624 1.00 0.00 H new ATOM 0 HA ASN B 312 2.742 -9.629 -6.853 1.00 0.00 H new ATOM 0 HB2 ASN B 312 4.200 -8.597 -8.610 1.00 0.00 H new ATOM 0 HB3 ASN B 312 5.614 -9.158 -7.740 1.00 0.00 H new ATOM 0 HD21 ASN B 312 5.579 -12.361 -9.159 1.00 0.00 H new ATOM 0 HD22 ASN B 312 6.439 -11.106 -8.262 1.00 0.00 H new ATOM 562 N LYS B 313 5.414 -9.934 -4.938 1.00 0.00 N ATOM 563 CA LYS B 313 6.043 -10.782 -3.928 1.00 0.00 C ATOM 564 C LYS B 313 5.004 -11.187 -2.890 1.00 0.00 C ATOM 565 O LYS B 313 4.817 -12.367 -2.611 1.00 0.00 O ATOM 566 CB LYS B 313 7.188 -10.032 -3.231 1.00 0.00 C ATOM 567 CG LYS B 313 8.276 -9.549 -4.174 1.00 0.00 C ATOM 568 CD LYS B 313 9.349 -8.751 -3.447 1.00 0.00 C ATOM 569 CE LYS B 313 10.307 -9.657 -2.684 1.00 0.00 C ATOM 570 NZ LYS B 313 11.304 -8.881 -1.894 1.00 0.00 N ATOM 0 H LYS B 313 5.851 -9.019 -5.052 1.00 0.00 H new ATOM 0 HA LYS B 313 6.448 -11.668 -4.418 1.00 0.00 H new ATOM 0 HB2 LYS B 313 6.776 -9.175 -2.699 1.00 0.00 H new ATOM 0 HB3 LYS B 313 7.635 -10.687 -2.483 1.00 0.00 H new ATOM 0 HG2 LYS B 313 8.734 -10.406 -4.668 1.00 0.00 H new ATOM 0 HG3 LYS B 313 7.831 -8.931 -4.954 1.00 0.00 H new ATOM 0 HD2 LYS B 313 9.909 -8.154 -4.167 1.00 0.00 H new ATOM 0 HD3 LYS B 313 8.877 -8.055 -2.754 1.00 0.00 H new ATOM 0 HE2 LYS B 313 9.739 -10.303 -2.015 1.00 0.00 H new ATOM 0 HE3 LYS B 313 10.829 -10.306 -3.387 1.00 0.00 H new ATOM 0 HZ1 LYS B 313 11.739 -9.500 -1.181 1.00 0.00 H new ATOM 0 HZ2 LYS B 313 12.041 -8.514 -2.530 1.00 0.00 H new ATOM 0 HZ3 LYS B 313 10.829 -8.087 -1.419 1.00 0.00 H new ATOM 584 N ILE B 314 4.325 -10.185 -2.339 1.00 0.00 N ATOM 585 CA ILE B 314 3.281 -10.395 -1.342 1.00 0.00 C ATOM 586 C ILE B 314 2.101 -11.162 -1.938 1.00 0.00 C ATOM 587 O ILE B 314 1.665 -12.173 -1.399 1.00 0.00 O ATOM 588 CB ILE B 314 2.797 -9.046 -0.777 1.00 0.00 C ATOM 589 CG1 ILE B 314 3.988 -8.286 -0.189 1.00 0.00 C ATOM 590 CG2 ILE B 314 1.711 -9.252 0.272 1.00 0.00 C ATOM 591 CD1 ILE B 314 3.686 -6.848 0.150 1.00 0.00 C ATOM 0 H ILE B 314 4.483 -9.205 -2.571 1.00 0.00 H new ATOM 0 HA ILE B 314 3.706 -10.988 -0.532 1.00 0.00 H new ATOM 0 HB ILE B 314 2.362 -8.457 -1.585 1.00 0.00 H new ATOM 0 HG12 ILE B 314 4.325 -8.799 0.712 1.00 0.00 H new ATOM 0 HG13 ILE B 314 4.813 -8.316 -0.901 1.00 0.00 H new ATOM 0 HG21 ILE B 314 1.387 -8.284 0.655 1.00 0.00 H new ATOM 0 HG22 ILE B 314 0.863 -9.767 -0.179 1.00 0.00 H new ATOM 0 HG23 ILE B 314 2.106 -9.853 1.091 1.00 0.00 H new ATOM 0 HD11 ILE B 314 4.578 -6.376 0.561 1.00 0.00 H new ATOM 0 HD12 ILE B 314 3.378 -6.318 -0.752 1.00 0.00 H new ATOM 0 HD13 ILE B 314 2.883 -6.809 0.886 1.00 0.00 H new ATOM 603 N LYS B 315 1.590 -10.676 -3.060 1.00 0.00 N ATOM 604 CA LYS B 315 0.471 -11.319 -3.735 1.00 0.00 C ATOM 605 C LYS B 315 0.771 -12.799 -3.991 1.00 0.00 C ATOM 606 O LYS B 315 -0.042 -13.669 -3.678 1.00 0.00 O ATOM 607 CB LYS B 315 0.176 -10.583 -5.043 1.00 0.00 C ATOM 608 CG LYS B 315 -1.027 -11.118 -5.800 1.00 0.00 C ATOM 609 CD LYS B 315 -1.298 -10.305 -7.058 1.00 0.00 C ATOM 610 CE LYS B 315 -0.402 -10.728 -8.213 1.00 0.00 C ATOM 611 NZ LYS B 315 1.015 -10.328 -8.003 1.00 0.00 N ATOM 0 H LYS B 315 1.934 -9.835 -3.524 1.00 0.00 H new ATOM 0 HA LYS B 315 -0.411 -11.269 -3.096 1.00 0.00 H new ATOM 0 HB2 LYS B 315 0.014 -9.528 -4.824 1.00 0.00 H new ATOM 0 HB3 LYS B 315 1.053 -10.644 -5.687 1.00 0.00 H new ATOM 0 HG2 LYS B 315 -0.856 -12.160 -6.069 1.00 0.00 H new ATOM 0 HG3 LYS B 315 -1.905 -11.095 -5.154 1.00 0.00 H new ATOM 0 HD2 LYS B 315 -2.342 -10.422 -7.347 1.00 0.00 H new ATOM 0 HD3 LYS B 315 -1.142 -9.247 -6.847 1.00 0.00 H new ATOM 0 HE2 LYS B 315 -0.458 -11.810 -8.336 1.00 0.00 H new ATOM 0 HE3 LYS B 315 -0.770 -10.283 -9.137 1.00 0.00 H new ATOM 0 HZ1 LYS B 315 1.486 -10.222 -8.924 1.00 0.00 H new ATOM 0 HZ2 LYS B 315 1.048 -9.423 -7.491 1.00 0.00 H new ATOM 0 HZ3 LYS B 315 1.503 -11.059 -7.447 1.00 0.00 H new ATOM 625 N ASN B 316 1.952 -13.065 -4.550 1.00 0.00 N ATOM 626 CA ASN B 316 2.395 -14.428 -4.845 1.00 0.00 C ATOM 627 C ASN B 316 2.687 -15.220 -3.568 1.00 0.00 C ATOM 628 O ASN B 316 2.118 -16.289 -3.345 1.00 0.00 O ATOM 629 CB ASN B 316 3.644 -14.388 -5.734 1.00 0.00 C ATOM 630 CG ASN B 316 3.319 -14.023 -7.172 1.00 0.00 C ATOM 631 OD1 ASN B 316 2.677 -13.008 -7.436 1.00 0.00 O ATOM 632 ND2 ASN B 316 3.768 -14.849 -8.111 1.00 0.00 N ATOM 0 H ASN B 316 2.626 -12.345 -4.810 1.00 0.00 H new ATOM 0 HA ASN B 316 1.586 -14.935 -5.370 1.00 0.00 H new ATOM 0 HB2 ASN B 316 4.352 -13.665 -5.329 1.00 0.00 H new ATOM 0 HB3 ASN B 316 4.135 -15.361 -5.711 1.00 0.00 H new ATOM 0 HD21 ASN B 316 3.584 -14.651 -9.095 1.00 0.00 H new ATOM 0 HD22 ASN B 316 4.297 -15.681 -7.848 1.00 0.00 H new ATOM 639 N ARG B 317 3.597 -14.698 -2.747 1.00 0.00 N ATOM 640 CA ARG B 317 3.991 -15.355 -1.499 1.00 0.00 C ATOM 641 C ARG B 317 2.793 -15.609 -0.577 1.00 0.00 C ATOM 642 O ARG B 317 2.727 -16.654 0.073 1.00 0.00 O ATOM 643 CB ARG B 317 5.061 -14.525 -0.777 1.00 0.00 C ATOM 644 CG ARG B 317 5.850 -15.304 0.267 1.00 0.00 C ATOM 645 CD ARG B 317 5.111 -15.407 1.596 1.00 0.00 C ATOM 646 NE ARG B 317 5.770 -16.329 2.524 1.00 0.00 N ATOM 647 CZ ARG B 317 7.005 -16.160 3.010 1.00 0.00 C ATOM 648 NH1 ARG B 317 7.712 -15.073 2.714 1.00 0.00 N ATOM 649 NH2 ARG B 317 7.529 -17.082 3.812 1.00 0.00 N ATOM 0 H ARG B 317 4.079 -13.817 -2.924 1.00 0.00 H new ATOM 0 HA ARG B 317 4.408 -16.328 -1.758 1.00 0.00 H new ATOM 0 HB2 ARG B 317 5.754 -14.123 -1.516 1.00 0.00 H new ATOM 0 HB3 ARG B 317 4.581 -13.674 -0.294 1.00 0.00 H new ATOM 0 HG2 ARG B 317 6.056 -16.306 -0.110 1.00 0.00 H new ATOM 0 HG3 ARG B 317 6.813 -14.820 0.427 1.00 0.00 H new ATOM 0 HD2 ARG B 317 5.047 -14.419 2.052 1.00 0.00 H new ATOM 0 HD3 ARG B 317 4.089 -15.742 1.417 1.00 0.00 H new ATOM 0 HE ARG B 317 5.252 -17.156 2.820 1.00 0.00 H new ATOM 0 HH11 ARG B 317 7.314 -14.355 2.109 1.00 0.00 H new ATOM 0 HH12 ARG B 317 8.652 -14.958 3.092 1.00 0.00 H new ATOM 0 HH21 ARG B 317 6.990 -17.913 4.054 1.00 0.00 H new ATOM 0 HH22 ARG B 317 8.470 -16.958 4.185 1.00 0.00 H new ATOM 663 N PHE B 318 1.848 -14.663 -0.518 1.00 0.00 N ATOM 664 CA PHE B 318 0.673 -14.821 0.339 1.00 0.00 C ATOM 665 C PHE B 318 -0.540 -15.303 -0.465 1.00 0.00 C ATOM 666 O PHE B 318 -1.681 -15.081 -0.054 1.00 0.00 O ATOM 667 CB PHE B 318 0.305 -13.516 1.072 1.00 0.00 C ATOM 668 CG PHE B 318 1.442 -12.816 1.784 1.00 0.00 C ATOM 669 CD1 PHE B 318 2.624 -12.504 1.134 1.00 0.00 C ATOM 670 CD2 PHE B 318 1.295 -12.422 3.100 1.00 0.00 C ATOM 671 CE1 PHE B 318 3.629 -11.816 1.777 1.00 0.00 C ATOM 672 CE2 PHE B 318 2.302 -11.740 3.755 1.00 0.00 C ATOM 673 CZ PHE B 318 3.470 -11.431 3.088 1.00 0.00 C ATOM 0 H PHE B 318 1.875 -13.791 -1.047 1.00 0.00 H new ATOM 0 HA PHE B 318 0.939 -15.572 1.083 1.00 0.00 H new ATOM 0 HB2 PHE B 318 -0.126 -12.824 0.348 1.00 0.00 H new ATOM 0 HB3 PHE B 318 -0.473 -13.739 1.802 1.00 0.00 H new ATOM 0 HD1 PHE B 318 2.760 -12.805 0.106 1.00 0.00 H new ATOM 0 HD2 PHE B 318 0.379 -12.651 3.625 1.00 0.00 H new ATOM 0 HE1 PHE B 318 4.542 -11.579 1.252 1.00 0.00 H new ATOM 0 HE2 PHE B 318 2.175 -11.449 4.787 1.00 0.00 H new ATOM 0 HZ PHE B 318 4.256 -10.889 3.593 1.00 0.00 H new ATOM 683 N GLN B 319 -0.300 -15.969 -1.603 1.00 0.00 N ATOM 684 CA GLN B 319 -1.390 -16.489 -2.436 1.00 0.00 C ATOM 685 C GLN B 319 -2.383 -17.305 -1.609 1.00 0.00 C ATOM 686 O GLN B 319 -3.583 -17.308 -1.895 1.00 0.00 O ATOM 687 CB GLN B 319 -0.845 -17.334 -3.592 1.00 0.00 C ATOM 688 CG GLN B 319 -0.370 -16.505 -4.777 1.00 0.00 C ATOM 689 CD GLN B 319 0.281 -17.324 -5.889 1.00 0.00 C ATOM 690 OE1 GLN B 319 0.728 -16.765 -6.890 1.00 0.00 O ATOM 691 NE2 GLN B 319 0.341 -18.648 -5.733 1.00 0.00 N ATOM 0 H GLN B 319 0.634 -16.159 -1.965 1.00 0.00 H new ATOM 0 HA GLN B 319 -1.917 -15.631 -2.852 1.00 0.00 H new ATOM 0 HB2 GLN B 319 -0.017 -17.942 -3.228 1.00 0.00 H new ATOM 0 HB3 GLN B 319 -1.622 -18.021 -3.927 1.00 0.00 H new ATOM 0 HG2 GLN B 319 -1.220 -15.961 -5.190 1.00 0.00 H new ATOM 0 HG3 GLN B 319 0.343 -15.760 -4.423 1.00 0.00 H new ATOM 0 HE21 GLN B 319 -0.039 -19.080 -4.891 1.00 0.00 H new ATOM 0 HE22 GLN B 319 0.767 -19.228 -6.456 1.00 0.00 H new ATOM 700 N GLY B 320 -1.881 -17.982 -0.569 1.00 0.00 N ATOM 701 CA GLY B 320 -2.742 -18.771 0.293 1.00 0.00 C ATOM 702 C GLY B 320 -3.495 -17.904 1.283 1.00 0.00 C ATOM 703 O GLY B 320 -4.538 -18.306 1.798 1.00 0.00 O ATOM 0 H GLY B 320 -0.894 -17.994 -0.313 1.00 0.00 H new ATOM 0 HA2 GLY B 320 -3.453 -19.329 -0.316 1.00 0.00 H new ATOM 0 HA3 GLY B 320 -2.142 -19.503 0.834 1.00 0.00 H new ATOM 707 N GLN B 321 -2.957 -16.709 1.548 1.00 0.00 N ATOM 708 CA GLN B 321 -3.568 -15.767 2.474 1.00 0.00 C ATOM 709 C GLN B 321 -4.266 -14.635 1.723 1.00 0.00 C ATOM 710 O GLN B 321 -3.727 -13.527 1.634 1.00 0.00 O ATOM 711 CB GLN B 321 -2.518 -15.139 3.393 1.00 0.00 C ATOM 712 CG GLN B 321 -1.422 -16.069 3.864 1.00 0.00 C ATOM 713 CD GLN B 321 -1.938 -17.223 4.707 1.00 0.00 C ATOM 714 OE1 GLN B 321 -2.721 -18.050 4.238 1.00 0.00 O ATOM 715 NE2 GLN B 321 -1.503 -17.282 5.962 1.00 0.00 N ATOM 0 H GLN B 321 -2.091 -16.375 1.126 1.00 0.00 H new ATOM 0 HA GLN B 321 -4.292 -16.330 3.063 1.00 0.00 H new ATOM 0 HB2 GLN B 321 -2.058 -14.300 2.870 1.00 0.00 H new ATOM 0 HB3 GLN B 321 -3.024 -14.731 4.268 1.00 0.00 H new ATOM 0 HG2 GLN B 321 -0.895 -16.468 2.997 1.00 0.00 H new ATOM 0 HG3 GLN B 321 -0.696 -15.500 4.444 1.00 0.00 H new ATOM 0 HE21 GLN B 321 -0.854 -16.576 6.311 1.00 0.00 H new ATOM 0 HE22 GLN B 321 -1.818 -18.033 6.576 1.00 0.00 H new ATOM 724 N PRO B 322 -5.481 -14.857 1.195 1.00 0.00 N ATOM 725 CA PRO B 322 -6.214 -13.800 0.497 1.00 0.00 C ATOM 726 C PRO B 322 -6.507 -12.633 1.444 1.00 0.00 C ATOM 727 O PRO B 322 -6.717 -11.501 1.006 1.00 0.00 O ATOM 728 CB PRO B 322 -7.514 -14.483 0.055 1.00 0.00 C ATOM 729 CG PRO B 322 -7.646 -15.679 0.936 1.00 0.00 C ATOM 730 CD PRO B 322 -6.243 -16.114 1.260 1.00 0.00 C ATOM 0 HA PRO B 322 -5.656 -13.380 -0.340 1.00 0.00 H new ATOM 0 HB2 PRO B 322 -8.368 -13.815 0.167 1.00 0.00 H new ATOM 0 HB3 PRO B 322 -7.470 -14.771 -0.995 1.00 0.00 H new ATOM 0 HG2 PRO B 322 -8.198 -15.436 1.844 1.00 0.00 H new ATOM 0 HG3 PRO B 322 -8.195 -16.475 0.433 1.00 0.00 H new ATOM 0 HD2 PRO B 322 -6.181 -16.573 2.247 1.00 0.00 H new ATOM 0 HD3 PRO B 322 -5.873 -16.847 0.544 1.00 0.00 H new ATOM 738 N ASP B 323 -6.500 -12.928 2.750 1.00 0.00 N ATOM 739 CA ASP B 323 -6.744 -11.931 3.783 1.00 0.00 C ATOM 740 C ASP B 323 -5.596 -10.927 3.883 1.00 0.00 C ATOM 741 O ASP B 323 -5.820 -9.770 4.223 1.00 0.00 O ATOM 742 CB ASP B 323 -6.958 -12.610 5.141 1.00 0.00 C ATOM 743 CG ASP B 323 -8.150 -13.550 5.151 1.00 0.00 C ATOM 744 OD1 ASP B 323 -8.120 -14.561 4.416 1.00 0.00 O ATOM 745 OD2 ASP B 323 -9.116 -13.275 5.893 1.00 0.00 O ATOM 0 H ASP B 323 -6.325 -13.865 3.113 1.00 0.00 H new ATOM 0 HA ASP B 323 -7.646 -11.386 3.503 1.00 0.00 H new ATOM 0 HB2 ASP B 323 -6.060 -13.167 5.408 1.00 0.00 H new ATOM 0 HB3 ASP B 323 -7.098 -11.846 5.905 1.00 0.00 H new ATOM 750 N ILE B 324 -4.364 -11.372 3.599 1.00 0.00 N ATOM 751 CA ILE B 324 -3.201 -10.493 3.679 1.00 0.00 C ATOM 752 C ILE B 324 -3.219 -9.466 2.576 1.00 0.00 C ATOM 753 O ILE B 324 -3.000 -8.278 2.806 1.00 0.00 O ATOM 754 CB ILE B 324 -1.878 -11.269 3.567 1.00 0.00 C ATOM 755 CG1 ILE B 324 -1.865 -12.424 4.560 1.00 0.00 C ATOM 756 CG2 ILE B 324 -0.707 -10.313 3.774 1.00 0.00 C ATOM 757 CD1 ILE B 324 -2.275 -12.030 5.945 1.00 0.00 C ATOM 0 H ILE B 324 -4.153 -12.329 3.314 1.00 0.00 H new ATOM 0 HA ILE B 324 -3.260 -10.010 4.655 1.00 0.00 H new ATOM 0 HB ILE B 324 -1.780 -11.701 2.571 1.00 0.00 H new ATOM 0 HG12 ILE B 324 -2.533 -13.207 4.202 1.00 0.00 H new ATOM 0 HG13 ILE B 324 -0.863 -12.851 4.595 1.00 0.00 H new ATOM 0 HG21 ILE B 324 0.230 -10.863 3.695 1.00 0.00 H new ATOM 0 HG22 ILE B 324 -0.735 -9.533 3.013 1.00 0.00 H new ATOM 0 HG23 ILE B 324 -0.778 -9.859 4.762 1.00 0.00 H new ATOM 0 HD11 ILE B 324 -2.242 -12.903 6.597 1.00 0.00 H new ATOM 0 HD12 ILE B 324 -1.593 -11.269 6.324 1.00 0.00 H new ATOM 0 HD13 ILE B 324 -3.289 -11.631 5.925 1.00 0.00 H new ATOM 769 N TYR B 325 -3.458 -9.948 1.375 1.00 0.00 N ATOM 770 CA TYR B 325 -3.483 -9.088 0.204 1.00 0.00 C ATOM 771 C TYR B 325 -4.622 -8.083 0.302 1.00 0.00 C ATOM 772 O TYR B 325 -4.413 -6.881 0.133 1.00 0.00 O ATOM 773 CB TYR B 325 -3.626 -9.913 -1.071 1.00 0.00 C ATOM 774 CG TYR B 325 -2.959 -9.275 -2.264 1.00 0.00 C ATOM 775 CD1 TYR B 325 -1.745 -8.607 -2.129 1.00 0.00 C ATOM 776 CD2 TYR B 325 -3.524 -9.358 -3.526 1.00 0.00 C ATOM 777 CE1 TYR B 325 -1.125 -8.036 -3.223 1.00 0.00 C ATOM 778 CE2 TYR B 325 -2.909 -8.792 -4.620 1.00 0.00 C ATOM 779 CZ TYR B 325 -1.717 -8.134 -4.465 1.00 0.00 C ATOM 780 OH TYR B 325 -1.109 -7.583 -5.564 1.00 0.00 O ATOM 0 H TYR B 325 -3.639 -10.933 1.180 1.00 0.00 H new ATOM 0 HA TYR B 325 -2.538 -8.547 0.165 1.00 0.00 H new ATOM 0 HB2 TYR B 325 -3.197 -10.902 -0.907 1.00 0.00 H new ATOM 0 HB3 TYR B 325 -4.685 -10.057 -1.287 1.00 0.00 H new ATOM 0 HD1 TYR B 325 -1.282 -8.534 -1.156 1.00 0.00 H new ATOM 0 HD2 TYR B 325 -4.463 -9.876 -3.654 1.00 0.00 H new ATOM 0 HE1 TYR B 325 -0.185 -7.517 -3.107 1.00 0.00 H new ATOM 0 HE2 TYR B 325 -3.364 -8.866 -5.597 1.00 0.00 H new ATOM 0 HH TYR B 325 -1.782 -7.396 -6.251 1.00 0.00 H new ATOM 790 N LYS B 326 -5.826 -8.577 0.597 1.00 0.00 N ATOM 791 CA LYS B 326 -6.991 -7.712 0.739 1.00 0.00 C ATOM 792 C LYS B 326 -6.778 -6.733 1.891 1.00 0.00 C ATOM 793 O LYS B 326 -6.972 -5.530 1.732 1.00 0.00 O ATOM 794 CB LYS B 326 -8.258 -8.540 0.971 1.00 0.00 C ATOM 795 CG LYS B 326 -8.618 -9.439 -0.203 1.00 0.00 C ATOM 796 CD LYS B 326 -9.853 -10.278 0.086 1.00 0.00 C ATOM 797 CE LYS B 326 -11.089 -9.410 0.282 1.00 0.00 C ATOM 798 NZ LYS B 326 -12.310 -10.223 0.549 1.00 0.00 N ATOM 0 H LYS B 326 -6.016 -9.569 0.741 1.00 0.00 H new ATOM 0 HA LYS B 326 -7.118 -7.149 -0.185 1.00 0.00 H new ATOM 0 HB2 LYS B 326 -8.123 -9.154 1.861 1.00 0.00 H new ATOM 0 HB3 LYS B 326 -9.091 -7.866 1.172 1.00 0.00 H new ATOM 0 HG2 LYS B 326 -8.793 -8.828 -1.088 1.00 0.00 H new ATOM 0 HG3 LYS B 326 -7.778 -10.095 -0.429 1.00 0.00 H new ATOM 0 HD2 LYS B 326 -10.022 -10.972 -0.737 1.00 0.00 H new ATOM 0 HD3 LYS B 326 -9.684 -10.879 0.980 1.00 0.00 H new ATOM 0 HE2 LYS B 326 -10.922 -8.725 1.113 1.00 0.00 H new ATOM 0 HE3 LYS B 326 -11.248 -8.800 -0.607 1.00 0.00 H new ATOM 0 HZ1 LYS B 326 -13.127 -9.592 0.676 1.00 0.00 H new ATOM 0 HZ2 LYS B 326 -12.486 -10.859 -0.255 1.00 0.00 H new ATOM 0 HZ3 LYS B 326 -12.170 -10.786 1.412 1.00 0.00 H new ATOM 812 N ALA B 327 -6.358 -7.258 3.045 1.00 0.00 N ATOM 813 CA ALA B 327 -6.094 -6.430 4.219 1.00 0.00 C ATOM 814 C ALA B 327 -5.043 -5.369 3.916 1.00 0.00 C ATOM 815 O ALA B 327 -5.267 -4.189 4.152 1.00 0.00 O ATOM 816 CB ALA B 327 -5.650 -7.287 5.397 1.00 0.00 C ATOM 0 H ALA B 327 -6.194 -8.254 3.189 1.00 0.00 H new ATOM 0 HA ALA B 327 -7.024 -5.927 4.485 1.00 0.00 H new ATOM 0 HB1 ALA B 327 -5.459 -6.649 6.260 1.00 0.00 H new ATOM 0 HB2 ALA B 327 -6.434 -8.003 5.642 1.00 0.00 H new ATOM 0 HB3 ALA B 327 -4.738 -7.823 5.134 1.00 0.00 H new ATOM 822 N PHE B 328 -3.896 -5.802 3.380 1.00 0.00 N ATOM 823 CA PHE B 328 -2.802 -4.889 3.038 1.00 0.00 C ATOM 824 C PHE B 328 -3.309 -3.735 2.178 1.00 0.00 C ATOM 825 O PHE B 328 -3.112 -2.571 2.518 1.00 0.00 O ATOM 826 CB PHE B 328 -1.694 -5.648 2.296 1.00 0.00 C ATOM 827 CG PHE B 328 -0.514 -4.797 1.913 1.00 0.00 C ATOM 828 CD1 PHE B 328 0.269 -4.201 2.887 1.00 0.00 C ATOM 829 CD2 PHE B 328 -0.188 -4.592 0.581 1.00 0.00 C ATOM 830 CE1 PHE B 328 1.353 -3.417 2.543 1.00 0.00 C ATOM 831 CE2 PHE B 328 0.896 -3.808 0.231 1.00 0.00 C ATOM 832 CZ PHE B 328 1.667 -3.221 1.215 1.00 0.00 C ATOM 0 H PHE B 328 -3.702 -6.782 3.174 1.00 0.00 H new ATOM 0 HA PHE B 328 -2.397 -4.478 3.963 1.00 0.00 H new ATOM 0 HB2 PHE B 328 -1.347 -6.468 2.924 1.00 0.00 H new ATOM 0 HB3 PHE B 328 -2.115 -6.093 1.394 1.00 0.00 H new ATOM 0 HD1 PHE B 328 0.029 -4.351 3.929 1.00 0.00 H new ATOM 0 HD2 PHE B 328 -0.787 -5.050 -0.192 1.00 0.00 H new ATOM 0 HE1 PHE B 328 1.954 -2.958 3.314 1.00 0.00 H new ATOM 0 HE2 PHE B 328 1.139 -3.655 -0.810 1.00 0.00 H new ATOM 0 HZ PHE B 328 2.515 -2.609 0.944 1.00 0.00 H new ATOM 842 N LEU B 329 -3.970 -4.067 1.071 1.00 0.00 N ATOM 843 CA LEU B 329 -4.518 -3.053 0.175 1.00 0.00 C ATOM 844 C LEU B 329 -5.538 -2.175 0.903 1.00 0.00 C ATOM 845 O LEU B 329 -5.460 -0.951 0.843 1.00 0.00 O ATOM 846 CB LEU B 329 -5.147 -3.707 -1.057 1.00 0.00 C ATOM 847 CG LEU B 329 -4.173 -4.505 -1.930 1.00 0.00 C ATOM 848 CD1 LEU B 329 -4.906 -5.162 -3.089 1.00 0.00 C ATOM 849 CD2 LEU B 329 -3.054 -3.605 -2.443 1.00 0.00 C ATOM 0 H LEU B 329 -4.138 -5.028 0.774 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.699 -2.414 -0.156 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -5.947 -4.371 -0.730 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -5.607 -2.930 -1.668 1.00 0.00 H new ATOM 0 HG LEU B 329 -3.729 -5.290 -1.318 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -4.197 -5.724 -3.697 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -5.667 -5.839 -2.701 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -5.380 -4.395 -3.701 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -2.372 -4.189 -3.061 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -3.481 -2.797 -3.037 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -2.509 -3.185 -1.598 1.00 0.00 H new ATOM 861 N GLU B 330 -6.477 -2.814 1.607 1.00 0.00 N ATOM 862 CA GLU B 330 -7.502 -2.089 2.366 1.00 0.00 C ATOM 863 C GLU B 330 -6.864 -1.198 3.433 1.00 0.00 C ATOM 864 O GLU B 330 -7.373 -0.117 3.731 1.00 0.00 O ATOM 865 CB GLU B 330 -8.486 -3.067 3.012 1.00 0.00 C ATOM 866 CG GLU B 330 -9.360 -3.804 2.005 1.00 0.00 C ATOM 867 CD GLU B 330 -10.235 -4.878 2.636 1.00 0.00 C ATOM 868 OE1 GLU B 330 -10.172 -5.060 3.873 1.00 0.00 O ATOM 869 OE2 GLU B 330 -10.983 -5.542 1.888 1.00 0.00 O ATOM 0 H GLU B 330 -6.549 -3.830 1.668 1.00 0.00 H new ATOM 0 HA GLU B 330 -8.048 -1.453 1.670 1.00 0.00 H new ATOM 0 HB2 GLU B 330 -7.928 -3.796 3.599 1.00 0.00 H new ATOM 0 HB3 GLU B 330 -9.126 -2.521 3.706 1.00 0.00 H new ATOM 0 HG2 GLU B 330 -9.996 -3.083 1.491 1.00 0.00 H new ATOM 0 HG3 GLU B 330 -8.723 -4.263 1.249 1.00 0.00 H new ATOM 876 N ILE B 331 -5.729 -1.644 3.980 1.00 0.00 N ATOM 877 CA ILE B 331 -4.997 -0.872 4.980 1.00 0.00 C ATOM 878 C ILE B 331 -4.621 0.477 4.382 1.00 0.00 C ATOM 879 O ILE B 331 -4.913 1.532 4.949 1.00 0.00 O ATOM 880 CB ILE B 331 -3.724 -1.622 5.430 1.00 0.00 C ATOM 881 CG1 ILE B 331 -4.096 -2.775 6.359 1.00 0.00 C ATOM 882 CG2 ILE B 331 -2.738 -0.687 6.112 1.00 0.00 C ATOM 883 CD1 ILE B 331 -2.974 -3.763 6.555 1.00 0.00 C ATOM 0 H ILE B 331 -5.299 -2.538 3.744 1.00 0.00 H new ATOM 0 HA ILE B 331 -5.631 -0.729 5.855 1.00 0.00 H new ATOM 0 HB ILE B 331 -3.237 -2.023 4.541 1.00 0.00 H new ATOM 0 HG12 ILE B 331 -4.391 -2.372 7.328 1.00 0.00 H new ATOM 0 HG13 ILE B 331 -4.963 -3.295 5.953 1.00 0.00 H new ATOM 0 HG21 ILE B 331 -1.854 -1.248 6.415 1.00 0.00 H new ATOM 0 HG22 ILE B 331 -2.446 0.102 5.419 1.00 0.00 H new ATOM 0 HG23 ILE B 331 -3.206 -0.244 6.991 1.00 0.00 H new ATOM 0 HD11 ILE B 331 -3.302 -4.558 7.225 1.00 0.00 H new ATOM 0 HD12 ILE B 331 -2.695 -4.192 5.593 1.00 0.00 H new ATOM 0 HD13 ILE B 331 -2.113 -3.255 6.989 1.00 0.00 H new ATOM 895 N LEU B 332 -4.003 0.418 3.203 1.00 0.00 N ATOM 896 CA LEU B 332 -3.611 1.612 2.465 1.00 0.00 C ATOM 897 C LEU B 332 -4.857 2.401 2.085 1.00 0.00 C ATOM 898 O LEU B 332 -4.893 3.627 2.186 1.00 0.00 O ATOM 899 CB LEU B 332 -2.849 1.229 1.194 1.00 0.00 C ATOM 900 CG LEU B 332 -1.925 0.015 1.314 1.00 0.00 C ATOM 901 CD1 LEU B 332 -1.070 -0.136 0.069 1.00 0.00 C ATOM 902 CD2 LEU B 332 -1.067 0.117 2.563 1.00 0.00 C ATOM 0 H LEU B 332 -3.762 -0.456 2.736 1.00 0.00 H new ATOM 0 HA LEU B 332 -2.962 2.219 3.096 1.00 0.00 H new ATOM 0 HB2 LEU B 332 -3.573 1.034 0.403 1.00 0.00 H new ATOM 0 HB3 LEU B 332 -2.254 2.086 0.877 1.00 0.00 H new ATOM 0 HG LEU B 332 -2.541 -0.879 1.404 1.00 0.00 H new ATOM 0 HD11 LEU B 332 -0.421 -1.005 0.176 1.00 0.00 H new ATOM 0 HD12 LEU B 332 -1.714 -0.269 -0.801 1.00 0.00 H new ATOM 0 HD13 LEU B 332 -0.460 0.758 -0.064 1.00 0.00 H new ATOM 0 HD21 LEU B 332 -0.417 -0.755 2.630 1.00 0.00 H new ATOM 0 HD22 LEU B 332 -0.458 1.020 2.514 1.00 0.00 H new ATOM 0 HD23 LEU B 332 -1.709 0.160 3.443 1.00 0.00 H new ATOM 914 N HIS B 333 -5.876 1.664 1.644 1.00 0.00 N ATOM 915 CA HIS B 333 -7.155 2.253 1.232 1.00 0.00 C ATOM 916 C HIS B 333 -7.731 3.149 2.324 1.00 0.00 C ATOM 917 O HIS B 333 -8.130 4.280 2.048 1.00 0.00 O ATOM 918 CB HIS B 333 -8.176 1.158 0.889 1.00 0.00 C ATOM 919 CG HIS B 333 -7.870 0.395 -0.364 1.00 0.00 C ATOM 920 ND1 HIS B 333 -6.939 0.600 -1.321 1.00 0.00 N flip ATOM 921 CD2 HIS B 333 -8.577 -0.724 -0.754 1.00 0.00 C flip ATOM 922 CE1 HIS B 333 -7.097 -0.386 -2.263 1.00 0.00 C flip ATOM 923 NE2 HIS B 333 -8.092 -1.173 -1.898 1.00 0.00 N flip ATOM 0 H HIS B 333 -5.842 0.648 1.562 1.00 0.00 H new ATOM 0 HA HIS B 333 -6.960 2.857 0.346 1.00 0.00 H new ATOM 0 HB2 HIS B 333 -8.232 0.457 1.722 1.00 0.00 H new ATOM 0 HB3 HIS B 333 -9.161 1.615 0.790 1.00 0.00 H new ATOM 0 HD2 HIS B 333 -9.399 -1.164 -0.209 1.00 0.00 H new ATOM 0 HE1 HIS B 333 -6.503 -0.499 -3.158 1.00 0.00 H new ATOM 0 HE2 HIS B 333 -8.429 -1.988 -2.411 1.00 0.00 H new ATOM 932 N THR B 334 -7.762 2.653 3.564 1.00 0.00 N ATOM 933 CA THR B 334 -8.286 3.435 4.682 1.00 0.00 C ATOM 934 C THR B 334 -7.459 4.708 4.847 1.00 0.00 C ATOM 935 O THR B 334 -8.010 5.804 4.932 1.00 0.00 O ATOM 936 CB THR B 334 -8.280 2.615 5.980 1.00 0.00 C ATOM 937 OG1 THR B 334 -9.025 1.420 5.820 1.00 0.00 O ATOM 938 CG2 THR B 334 -8.862 3.358 7.170 1.00 0.00 C ATOM 0 H THR B 334 -7.433 1.721 3.816 1.00 0.00 H new ATOM 0 HA THR B 334 -9.320 3.704 4.466 1.00 0.00 H new ATOM 0 HB THR B 334 -7.229 2.408 6.181 1.00 0.00 H new ATOM 0 HG1 THR B 334 -8.558 0.824 5.198 1.00 0.00 H new ATOM 0 HG21 THR B 334 -8.825 2.718 8.052 1.00 0.00 H new ATOM 0 HG22 THR B 334 -8.282 4.262 7.354 1.00 0.00 H new ATOM 0 HG23 THR B 334 -9.897 3.627 6.960 1.00 0.00 H new ATOM 946 N TYR B 335 -6.133 4.553 4.850 1.00 0.00 N ATOM 947 CA TYR B 335 -5.219 5.689 4.961 1.00 0.00 C ATOM 948 C TYR B 335 -5.558 6.729 3.894 1.00 0.00 C ATOM 949 O TYR B 335 -5.859 7.878 4.211 1.00 0.00 O ATOM 950 CB TYR B 335 -3.775 5.205 4.786 1.00 0.00 C ATOM 951 CG TYR B 335 -2.719 6.294 4.829 1.00 0.00 C ATOM 952 CD1 TYR B 335 -2.305 6.855 6.032 1.00 0.00 C ATOM 953 CD2 TYR B 335 -2.124 6.747 3.658 1.00 0.00 C ATOM 954 CE1 TYR B 335 -1.327 7.837 6.062 1.00 0.00 C ATOM 955 CE2 TYR B 335 -1.152 7.727 3.681 1.00 0.00 C ATOM 956 CZ TYR B 335 -0.756 8.267 4.885 1.00 0.00 C ATOM 957 OH TYR B 335 0.216 9.242 4.912 1.00 0.00 O ATOM 0 H TYR B 335 -5.668 3.648 4.776 1.00 0.00 H new ATOM 0 HA TYR B 335 -5.324 6.145 5.945 1.00 0.00 H new ATOM 0 HB2 TYR B 335 -3.555 4.477 5.567 1.00 0.00 H new ATOM 0 HB3 TYR B 335 -3.697 4.683 3.833 1.00 0.00 H new ATOM 0 HD1 TYR B 335 -2.752 6.521 6.957 1.00 0.00 H new ATOM 0 HD2 TYR B 335 -2.428 6.324 2.712 1.00 0.00 H new ATOM 0 HE1 TYR B 335 -1.014 8.263 7.004 1.00 0.00 H new ATOM 0 HE2 TYR B 335 -0.704 8.069 2.760 1.00 0.00 H new ATOM 0 HH TYR B 335 0.516 9.431 3.998 1.00 0.00 H new ATOM 967 N GLN B 336 -5.509 6.295 2.629 1.00 0.00 N ATOM 968 CA GLN B 336 -5.802 7.135 1.488 1.00 0.00 C ATOM 969 C GLN B 336 -7.131 7.875 1.636 1.00 0.00 C ATOM 970 O GLN B 336 -7.194 9.086 1.429 1.00 0.00 O ATOM 971 CB GLN B 336 -5.851 6.259 0.242 1.00 0.00 C ATOM 972 CG GLN B 336 -5.574 7.023 -1.024 1.00 0.00 C ATOM 973 CD GLN B 336 -5.904 6.256 -2.300 1.00 0.00 C ATOM 974 OE1 GLN B 336 -5.882 6.825 -3.391 1.00 0.00 O ATOM 975 NE2 GLN B 336 -6.201 4.960 -2.186 1.00 0.00 N ATOM 0 H GLN B 336 -5.261 5.338 2.378 1.00 0.00 H new ATOM 0 HA GLN B 336 -5.018 7.888 1.412 1.00 0.00 H new ATOM 0 HB2 GLN B 336 -5.122 5.454 0.341 1.00 0.00 H new ATOM 0 HB3 GLN B 336 -6.834 5.792 0.171 1.00 0.00 H new ATOM 0 HG2 GLN B 336 -6.150 7.949 -1.010 1.00 0.00 H new ATOM 0 HG3 GLN B 336 -4.521 7.303 -1.043 1.00 0.00 H new ATOM 0 HE21 GLN B 336 -6.211 4.518 -1.267 1.00 0.00 H new ATOM 0 HE22 GLN B 336 -6.418 4.411 -3.018 1.00 0.00 H new ATOM 984 N LYS B 337 -8.193 7.139 1.977 1.00 0.00 N ATOM 985 CA LYS B 337 -9.524 7.732 2.123 1.00 0.00 C ATOM 986 C LYS B 337 -9.522 8.862 3.142 1.00 0.00 C ATOM 987 O LYS B 337 -10.032 9.944 2.865 1.00 0.00 O ATOM 988 CB LYS B 337 -10.553 6.676 2.540 1.00 0.00 C ATOM 989 CG LYS B 337 -10.838 5.633 1.471 1.00 0.00 C ATOM 990 CD LYS B 337 -11.948 4.672 1.888 1.00 0.00 C ATOM 991 CE LYS B 337 -11.593 3.883 3.147 1.00 0.00 C ATOM 992 NZ LYS B 337 -11.697 4.706 4.390 1.00 0.00 N ATOM 0 H LYS B 337 -8.157 6.136 2.156 1.00 0.00 H new ATOM 0 HA LYS B 337 -9.800 8.138 1.150 1.00 0.00 H new ATOM 0 HB2 LYS B 337 -10.197 6.172 3.439 1.00 0.00 H new ATOM 0 HB3 LYS B 337 -11.485 7.176 2.803 1.00 0.00 H new ATOM 0 HG2 LYS B 337 -11.121 6.132 0.544 1.00 0.00 H new ATOM 0 HG3 LYS B 337 -9.929 5.068 1.264 1.00 0.00 H new ATOM 0 HD2 LYS B 337 -12.865 5.234 2.062 1.00 0.00 H new ATOM 0 HD3 LYS B 337 -12.149 3.978 1.072 1.00 0.00 H new ATOM 0 HE2 LYS B 337 -12.255 3.021 3.230 1.00 0.00 H new ATOM 0 HE3 LYS B 337 -10.578 3.497 3.055 1.00 0.00 H new ATOM 0 HZ1 LYS B 337 -12.175 4.156 5.132 1.00 0.00 H new ATOM 0 HZ2 LYS B 337 -10.744 4.968 4.713 1.00 0.00 H new ATOM 0 HZ3 LYS B 337 -12.244 5.568 4.191 1.00 0.00 H new ATOM 1006 N GLU B 338 -8.949 8.609 4.317 1.00 0.00 N ATOM 1007 CA GLU B 338 -8.892 9.620 5.372 1.00 0.00 C ATOM 1008 C GLU B 338 -8.174 10.889 4.895 1.00 0.00 C ATOM 1009 O GLU B 338 -8.442 11.981 5.401 1.00 0.00 O ATOM 1010 CB GLU B 338 -8.213 9.053 6.624 1.00 0.00 C ATOM 1011 CG GLU B 338 -8.849 7.762 7.138 1.00 0.00 C ATOM 1012 CD GLU B 338 -10.319 7.903 7.510 1.00 0.00 C ATOM 1013 OE1 GLU B 338 -10.831 9.045 7.552 1.00 0.00 O ATOM 1014 OE2 GLU B 338 -10.957 6.864 7.780 1.00 0.00 O ATOM 0 H GLU B 338 -8.519 7.717 4.562 1.00 0.00 H new ATOM 0 HA GLU B 338 -9.916 9.895 5.625 1.00 0.00 H new ATOM 0 HB2 GLU B 338 -7.162 8.867 6.403 1.00 0.00 H new ATOM 0 HB3 GLU B 338 -8.245 9.803 7.415 1.00 0.00 H new ATOM 0 HG2 GLU B 338 -8.750 6.991 6.374 1.00 0.00 H new ATOM 0 HG3 GLU B 338 -8.295 7.418 8.011 1.00 0.00 H new ATOM 1220 N LEU B 353 -6.972 7.644 10.126 1.00 0.00 N ATOM 1221 CA LEU B 353 -5.793 6.817 9.880 1.00 0.00 C ATOM 1222 C LEU B 353 -4.599 7.676 9.508 1.00 0.00 C ATOM 1223 O LEU B 353 -4.736 8.825 9.081 1.00 0.00 O ATOM 1224 CB LEU B 353 -5.996 5.825 8.726 1.00 0.00 C ATOM 1225 CG LEU B 353 -6.096 4.353 9.109 1.00 0.00 C ATOM 1226 CD1 LEU B 353 -7.387 4.049 9.856 1.00 0.00 C ATOM 1227 CD2 LEU B 353 -5.946 3.471 7.879 1.00 0.00 C ATOM 0 HA LEU B 353 -5.622 6.272 10.809 1.00 0.00 H new ATOM 0 HB2 LEU B 353 -6.905 6.102 8.193 1.00 0.00 H new ATOM 0 HB3 LEU B 353 -5.168 5.941 8.026 1.00 0.00 H new ATOM 0 HG LEU B 353 -5.276 4.130 9.792 1.00 0.00 H new ATOM 0 HD11 LEU B 353 -7.419 2.990 10.111 1.00 0.00 H new ATOM 0 HD12 LEU B 353 -7.428 4.643 10.769 1.00 0.00 H new ATOM 0 HD13 LEU B 353 -8.240 4.296 9.224 1.00 0.00 H new ATOM 0 HD21 LEU B 353 -6.020 2.424 8.171 1.00 0.00 H new ATOM 0 HD22 LEU B 353 -6.736 3.705 7.165 1.00 0.00 H new ATOM 0 HD23 LEU B 353 -4.975 3.651 7.418 1.00 0.00 H new ATOM 1239 N THR B 354 -3.435 7.073 9.646 1.00 0.00 N ATOM 1240 CA THR B 354 -2.172 7.700 9.311 1.00 0.00 C ATOM 1241 C THR B 354 -1.171 6.603 8.981 1.00 0.00 C ATOM 1242 O THR B 354 -1.514 5.419 9.025 1.00 0.00 O ATOM 1243 CB THR B 354 -1.656 8.560 10.479 1.00 0.00 C ATOM 1244 OG1 THR B 354 -1.533 7.797 11.672 1.00 0.00 O ATOM 1245 CG2 THR B 354 -2.538 9.751 10.787 1.00 0.00 C ATOM 0 H THR B 354 -3.339 6.121 9.999 1.00 0.00 H new ATOM 0 HA THR B 354 -2.307 8.360 8.454 1.00 0.00 H new ATOM 0 HB THR B 354 -0.683 8.921 10.146 1.00 0.00 H new ATOM 0 HG1 THR B 354 -2.399 7.395 11.894 1.00 0.00 H new ATOM 0 HG21 THR B 354 -2.114 10.312 11.620 1.00 0.00 H new ATOM 0 HG22 THR B 354 -2.599 10.395 9.910 1.00 0.00 H new ATOM 0 HG23 THR B 354 -3.537 9.405 11.053 1.00 0.00 H new ATOM 1253 N GLU B 355 0.062 6.978 8.679 1.00 0.00 N ATOM 1254 CA GLU B 355 1.090 5.988 8.389 1.00 0.00 C ATOM 1255 C GLU B 355 1.172 4.973 9.533 1.00 0.00 C ATOM 1256 O GLU B 355 1.536 3.814 9.325 1.00 0.00 O ATOM 1257 CB GLU B 355 2.431 6.676 8.190 1.00 0.00 C ATOM 1258 CG GLU B 355 2.616 7.278 6.812 1.00 0.00 C ATOM 1259 CD GLU B 355 3.891 8.085 6.714 1.00 0.00 C ATOM 1260 OE1 GLU B 355 3.898 9.251 7.162 1.00 0.00 O ATOM 1261 OE2 GLU B 355 4.894 7.536 6.225 1.00 0.00 O ATOM 0 H GLU B 355 0.374 7.948 8.628 1.00 0.00 H new ATOM 0 HA GLU B 355 0.831 5.459 7.471 1.00 0.00 H new ATOM 0 HB2 GLU B 355 2.538 7.463 8.936 1.00 0.00 H new ATOM 0 HB3 GLU B 355 3.228 5.955 8.370 1.00 0.00 H new ATOM 0 HG2 GLU B 355 2.632 6.482 6.068 1.00 0.00 H new ATOM 0 HG3 GLU B 355 1.764 7.916 6.578 1.00 0.00 H new ATOM 1268 N GLN B 356 0.807 5.427 10.739 1.00 0.00 N ATOM 1269 CA GLN B 356 0.805 4.581 11.928 1.00 0.00 C ATOM 1270 C GLN B 356 -0.189 3.429 11.780 1.00 0.00 C ATOM 1271 O GLN B 356 0.130 2.292 12.122 1.00 0.00 O ATOM 1272 CB GLN B 356 0.462 5.406 13.171 1.00 0.00 C ATOM 1273 CG GLN B 356 1.442 6.539 13.440 1.00 0.00 C ATOM 1274 CD GLN B 356 1.076 7.349 14.669 1.00 0.00 C ATOM 1275 OE1 GLN B 356 1.036 6.824 15.783 1.00 0.00 O ATOM 1276 NE2 GLN B 356 0.801 8.635 14.475 1.00 0.00 N ATOM 0 H GLN B 356 0.507 6.386 10.912 1.00 0.00 H new ATOM 0 HA GLN B 356 1.805 4.163 12.042 1.00 0.00 H new ATOM 0 HB2 GLN B 356 -0.539 5.822 13.056 1.00 0.00 H new ATOM 0 HB3 GLN B 356 0.435 4.747 14.038 1.00 0.00 H new ATOM 0 HG2 GLN B 356 2.443 6.126 13.567 1.00 0.00 H new ATOM 0 HG3 GLN B 356 1.477 7.198 12.572 1.00 0.00 H new ATOM 0 HE21 GLN B 356 0.846 9.030 13.536 1.00 0.00 H new ATOM 0 HE22 GLN B 356 0.545 9.227 15.265 1.00 0.00 H new ATOM 1285 N GLU B 357 -1.391 3.719 11.255 1.00 0.00 N ATOM 1286 CA GLU B 357 -2.403 2.688 11.060 1.00 0.00 C ATOM 1287 C GLU B 357 -1.995 1.756 9.925 1.00 0.00 C ATOM 1288 O GLU B 357 -2.220 0.546 9.978 1.00 0.00 O ATOM 1289 CB GLU B 357 -3.744 3.322 10.690 1.00 0.00 C ATOM 1290 CG GLU B 357 -4.526 3.989 11.823 1.00 0.00 C ATOM 1291 CD GLU B 357 -3.710 4.976 12.642 1.00 0.00 C ATOM 1292 OE1 GLU B 357 -2.850 4.531 13.434 1.00 0.00 O ATOM 1293 OE2 GLU B 357 -3.928 6.196 12.491 1.00 0.00 O ATOM 0 H GLU B 357 -1.677 4.654 10.963 1.00 0.00 H new ATOM 0 HA GLU B 357 -2.496 2.130 11.992 1.00 0.00 H new ATOM 0 HB2 GLU B 357 -3.565 4.068 9.915 1.00 0.00 H new ATOM 0 HB3 GLU B 357 -4.375 2.550 10.250 1.00 0.00 H new ATOM 0 HG2 GLU B 357 -5.386 4.508 11.400 1.00 0.00 H new ATOM 0 HG3 GLU B 357 -4.914 3.216 12.486 1.00 0.00 H new ATOM 1300 N VAL B 358 -1.428 2.353 8.880 1.00 0.00 N ATOM 1301 CA VAL B 358 -1.013 1.622 7.688 1.00 0.00 C ATOM 1302 C VAL B 358 0.070 0.592 7.991 1.00 0.00 C ATOM 1303 O VAL B 358 -0.148 -0.609 7.829 1.00 0.00 O ATOM 1304 CB VAL B 358 -0.497 2.618 6.630 1.00 0.00 C ATOM 1305 CG1 VAL B 358 -0.136 1.922 5.325 1.00 0.00 C ATOM 1306 CG2 VAL B 358 -1.530 3.708 6.403 1.00 0.00 C ATOM 0 H VAL B 358 -1.244 3.355 8.836 1.00 0.00 H new ATOM 0 HA VAL B 358 -1.882 1.083 7.311 1.00 0.00 H new ATOM 0 HB VAL B 358 0.419 3.072 7.008 1.00 0.00 H new ATOM 0 HG11 VAL B 358 0.223 2.659 4.607 1.00 0.00 H new ATOM 0 HG12 VAL B 358 0.645 1.185 5.510 1.00 0.00 H new ATOM 0 HG13 VAL B 358 -1.018 1.423 4.923 1.00 0.00 H new ATOM 0 HG21 VAL B 358 -1.161 4.409 5.655 1.00 0.00 H new ATOM 0 HG22 VAL B 358 -2.460 3.260 6.053 1.00 0.00 H new ATOM 0 HG23 VAL B 358 -1.712 4.238 7.338 1.00 0.00 H new ATOM 1316 N TYR B 359 1.229 1.059 8.445 1.00 0.00 N ATOM 1317 CA TYR B 359 2.334 0.168 8.781 1.00 0.00 C ATOM 1318 C TYR B 359 1.952 -0.816 9.890 1.00 0.00 C ATOM 1319 O TYR B 359 2.442 -1.945 9.924 1.00 0.00 O ATOM 1320 CB TYR B 359 3.572 0.978 9.182 1.00 0.00 C ATOM 1321 CG TYR B 359 4.799 0.128 9.430 1.00 0.00 C ATOM 1322 CD1 TYR B 359 4.915 -0.646 10.580 1.00 0.00 C ATOM 1323 CD2 TYR B 359 5.835 0.088 8.505 1.00 0.00 C ATOM 1324 CE1 TYR B 359 6.029 -1.433 10.799 1.00 0.00 C ATOM 1325 CE2 TYR B 359 6.953 -0.697 8.719 1.00 0.00 C ATOM 1326 CZ TYR B 359 7.045 -1.455 9.865 1.00 0.00 C ATOM 1327 OH TYR B 359 8.155 -2.240 10.079 1.00 0.00 O ATOM 0 H TYR B 359 1.427 2.049 8.589 1.00 0.00 H new ATOM 0 HA TYR B 359 2.569 -0.417 7.891 1.00 0.00 H new ATOM 0 HB2 TYR B 359 3.793 1.700 8.396 1.00 0.00 H new ATOM 0 HB3 TYR B 359 3.347 1.547 10.084 1.00 0.00 H new ATOM 0 HD1 TYR B 359 4.122 -0.631 11.313 1.00 0.00 H new ATOM 0 HD2 TYR B 359 5.766 0.680 7.604 1.00 0.00 H new ATOM 0 HE1 TYR B 359 6.105 -2.028 11.697 1.00 0.00 H new ATOM 0 HE2 TYR B 359 7.750 -0.716 7.991 1.00 0.00 H new ATOM 0 HH TYR B 359 8.775 -2.142 9.326 1.00 0.00 H new ATOM 1337 N ALA B 360 1.087 -0.370 10.805 1.00 0.00 N ATOM 1338 CA ALA B 360 0.656 -1.200 11.934 1.00 0.00 C ATOM 1339 C ALA B 360 -0.058 -2.478 11.492 1.00 0.00 C ATOM 1340 O ALA B 360 0.352 -3.579 11.867 1.00 0.00 O ATOM 1341 CB ALA B 360 -0.236 -0.398 12.869 1.00 0.00 C ATOM 0 H ALA B 360 0.671 0.561 10.786 1.00 0.00 H new ATOM 0 HA ALA B 360 1.559 -1.506 12.462 1.00 0.00 H new ATOM 0 HB1 ALA B 360 -0.548 -1.027 13.703 1.00 0.00 H new ATOM 0 HB2 ALA B 360 0.316 0.461 13.250 1.00 0.00 H new ATOM 0 HB3 ALA B 360 -1.116 -0.053 12.326 1.00 0.00 H new ATOM 1347 N GLN B 361 -1.130 -2.334 10.711 1.00 0.00 N ATOM 1348 CA GLN B 361 -1.898 -3.490 10.245 1.00 0.00 C ATOM 1349 C GLN B 361 -1.073 -4.374 9.307 1.00 0.00 C ATOM 1350 O GLN B 361 -1.178 -5.600 9.355 1.00 0.00 O ATOM 1351 CB GLN B 361 -3.190 -3.045 9.548 1.00 0.00 C ATOM 1352 CG GLN B 361 -4.318 -2.648 10.496 1.00 0.00 C ATOM 1353 CD GLN B 361 -4.018 -1.405 11.316 1.00 0.00 C ATOM 1354 OE1 GLN B 361 -3.145 -1.412 12.184 1.00 0.00 O ATOM 1355 NE2 GLN B 361 -4.743 -0.324 11.043 1.00 0.00 N ATOM 0 H GLN B 361 -1.485 -1.433 10.389 1.00 0.00 H new ATOM 0 HA GLN B 361 -2.158 -4.079 11.124 1.00 0.00 H new ATOM 0 HB2 GLN B 361 -2.964 -2.199 8.898 1.00 0.00 H new ATOM 0 HB3 GLN B 361 -3.539 -3.855 8.907 1.00 0.00 H new ATOM 0 HG2 GLN B 361 -5.226 -2.480 9.916 1.00 0.00 H new ATOM 0 HG3 GLN B 361 -4.521 -3.478 11.172 1.00 0.00 H new ATOM 0 HE21 GLN B 361 -5.457 -0.359 10.316 1.00 0.00 H new ATOM 0 HE22 GLN B 361 -4.585 0.540 11.561 1.00 0.00 H new ATOM 1364 N VAL B 362 -0.249 -3.751 8.461 1.00 0.00 N ATOM 1365 CA VAL B 362 0.596 -4.497 7.527 1.00 0.00 C ATOM 1366 C VAL B 362 1.631 -5.333 8.280 1.00 0.00 C ATOM 1367 O VAL B 362 1.858 -6.494 7.942 1.00 0.00 O ATOM 1368 CB VAL B 362 1.312 -3.557 6.531 1.00 0.00 C ATOM 1369 CG1 VAL B 362 2.259 -4.337 5.627 1.00 0.00 C ATOM 1370 CG2 VAL B 362 0.290 -2.792 5.702 1.00 0.00 C ATOM 0 H VAL B 362 -0.149 -2.737 8.404 1.00 0.00 H new ATOM 0 HA VAL B 362 -0.058 -5.161 6.962 1.00 0.00 H new ATOM 0 HB VAL B 362 1.906 -2.843 7.102 1.00 0.00 H new ATOM 0 HG11 VAL B 362 2.750 -3.651 4.936 1.00 0.00 H new ATOM 0 HG12 VAL B 362 3.011 -4.839 6.235 1.00 0.00 H new ATOM 0 HG13 VAL B 362 1.694 -5.079 5.062 1.00 0.00 H new ATOM 0 HG21 VAL B 362 0.807 -2.133 5.004 1.00 0.00 H new ATOM 0 HG22 VAL B 362 -0.328 -3.497 5.146 1.00 0.00 H new ATOM 0 HG23 VAL B 362 -0.342 -2.197 6.362 1.00 0.00 H new ATOM 1380 N ALA B 363 2.239 -4.742 9.312 1.00 0.00 N ATOM 1381 CA ALA B 363 3.233 -5.440 10.127 1.00 0.00 C ATOM 1382 C ALA B 363 2.669 -6.748 10.691 1.00 0.00 C ATOM 1383 O ALA B 363 3.401 -7.726 10.856 1.00 0.00 O ATOM 1384 CB ALA B 363 3.720 -4.544 11.259 1.00 0.00 C ATOM 0 H ALA B 363 2.059 -3.781 9.602 1.00 0.00 H new ATOM 0 HA ALA B 363 4.078 -5.686 9.484 1.00 0.00 H new ATOM 0 HB1 ALA B 363 4.459 -5.080 11.855 1.00 0.00 H new ATOM 0 HB2 ALA B 363 4.173 -3.645 10.842 1.00 0.00 H new ATOM 0 HB3 ALA B 363 2.877 -4.266 11.891 1.00 0.00 H new ATOM 1390 N ARG B 364 1.361 -6.758 10.973 1.00 0.00 N ATOM 1391 CA ARG B 364 0.691 -7.943 11.509 1.00 0.00 C ATOM 1392 C ARG B 364 0.583 -9.037 10.448 1.00 0.00 C ATOM 1393 O ARG B 364 0.794 -10.215 10.738 1.00 0.00 O ATOM 1394 CB ARG B 364 -0.710 -7.581 12.017 1.00 0.00 C ATOM 1395 CG ARG B 364 -0.726 -6.509 13.097 1.00 0.00 C ATOM 1396 CD ARG B 364 0.050 -6.938 14.331 1.00 0.00 C ATOM 1397 NE ARG B 364 -0.060 -5.962 15.416 1.00 0.00 N ATOM 1398 CZ ARG B 364 0.541 -6.088 16.603 1.00 0.00 C ATOM 1399 NH1 ARG B 364 1.311 -7.142 16.862 1.00 0.00 N ATOM 1400 NH2 ARG B 364 0.371 -5.154 17.533 1.00 0.00 N ATOM 0 H ARG B 364 0.746 -5.955 10.838 1.00 0.00 H new ATOM 0 HA ARG B 364 1.290 -8.318 12.339 1.00 0.00 H new ATOM 0 HB2 ARG B 364 -1.313 -7.241 11.175 1.00 0.00 H new ATOM 0 HB3 ARG B 364 -1.186 -8.481 12.407 1.00 0.00 H new ATOM 0 HG2 ARG B 364 -0.298 -5.588 12.701 1.00 0.00 H new ATOM 0 HG3 ARG B 364 -1.757 -6.288 13.375 1.00 0.00 H new ATOM 0 HD2 ARG B 364 -0.320 -7.904 14.674 1.00 0.00 H new ATOM 0 HD3 ARG B 364 1.100 -7.073 14.070 1.00 0.00 H new ATOM 0 HE ARG B 364 -0.632 -5.133 15.256 1.00 0.00 H new ATOM 0 HH11 ARG B 364 1.446 -7.862 16.152 1.00 0.00 H new ATOM 0 HH12 ARG B 364 1.766 -7.230 17.771 1.00 0.00 H new ATOM 0 HH21 ARG B 364 -0.217 -4.343 17.340 1.00 0.00 H new ATOM 0 HH22 ARG B 364 0.829 -5.248 18.440 1.00 0.00 H new ATOM 1414 N LEU B 365 0.242 -8.635 9.221 1.00 0.00 N ATOM 1415 CA LEU B 365 0.094 -9.573 8.108 1.00 0.00 C ATOM 1416 C LEU B 365 1.385 -10.345 7.845 1.00 0.00 C ATOM 1417 O LEU B 365 1.350 -11.546 7.573 1.00 0.00 O ATOM 1418 CB LEU B 365 -0.317 -8.835 6.829 1.00 0.00 C ATOM 1419 CG LEU B 365 -1.600 -8.008 6.924 1.00 0.00 C ATOM 1420 CD1 LEU B 365 -1.930 -7.376 5.580 1.00 0.00 C ATOM 1421 CD2 LEU B 365 -2.760 -8.863 7.419 1.00 0.00 C ATOM 0 H LEU B 365 0.063 -7.662 8.974 1.00 0.00 H new ATOM 0 HA LEU B 365 -0.685 -10.281 8.390 1.00 0.00 H new ATOM 0 HB2 LEU B 365 0.498 -8.174 6.535 1.00 0.00 H new ATOM 0 HB3 LEU B 365 -0.437 -9.568 6.031 1.00 0.00 H new ATOM 0 HG LEU B 365 -1.438 -7.208 7.647 1.00 0.00 H new ATOM 0 HD11 LEU B 365 -2.846 -6.792 5.668 1.00 0.00 H new ATOM 0 HD12 LEU B 365 -1.112 -6.724 5.274 1.00 0.00 H new ATOM 0 HD13 LEU B 365 -2.069 -8.159 4.834 1.00 0.00 H new ATOM 0 HD21 LEU B 365 -3.662 -8.254 7.479 1.00 0.00 H new ATOM 0 HD22 LEU B 365 -2.925 -9.688 6.727 1.00 0.00 H new ATOM 0 HD23 LEU B 365 -2.524 -9.260 8.407 1.00 0.00 H new ATOM 1433 N PHE B 366 2.521 -9.648 7.910 1.00 0.00 N ATOM 1434 CA PHE B 366 3.809 -10.262 7.662 1.00 0.00 C ATOM 1435 C PHE B 366 4.385 -10.845 8.960 1.00 0.00 C ATOM 1436 O PHE B 366 3.635 -11.415 9.751 1.00 0.00 O ATOM 1437 CB PHE B 366 4.742 -9.226 7.012 1.00 0.00 C ATOM 1438 CG PHE B 366 4.229 -8.703 5.691 1.00 0.00 C ATOM 1439 CD1 PHE B 366 2.979 -8.105 5.599 1.00 0.00 C ATOM 1440 CD2 PHE B 366 4.990 -8.822 4.541 1.00 0.00 C ATOM 1441 CE1 PHE B 366 2.501 -7.640 4.392 1.00 0.00 C ATOM 1442 CE2 PHE B 366 4.515 -8.353 3.329 1.00 0.00 C ATOM 1443 CZ PHE B 366 3.268 -7.765 3.256 1.00 0.00 C ATOM 0 H PHE B 366 2.566 -8.654 8.134 1.00 0.00 H new ATOM 0 HA PHE B 366 3.701 -11.097 6.970 1.00 0.00 H new ATOM 0 HB2 PHE B 366 4.878 -8.390 7.698 1.00 0.00 H new ATOM 0 HB3 PHE B 366 5.723 -9.676 6.860 1.00 0.00 H new ATOM 0 HD1 PHE B 366 2.372 -8.003 6.486 1.00 0.00 H new ATOM 0 HD2 PHE B 366 5.964 -9.286 4.590 1.00 0.00 H new ATOM 0 HE1 PHE B 366 1.526 -7.178 4.338 1.00 0.00 H new ATOM 0 HE2 PHE B 366 5.120 -8.447 2.439 1.00 0.00 H new ATOM 0 HZ PHE B 366 2.895 -7.404 2.309 1.00 0.00 H new ATOM 1453 N LYS B 367 5.710 -10.713 9.146 1.00 0.00 N ATOM 1454 CA LYS B 367 6.444 -11.222 10.323 1.00 0.00 C ATOM 1455 C LYS B 367 7.394 -12.337 9.896 1.00 0.00 C ATOM 1456 O LYS B 367 8.591 -12.287 10.180 1.00 0.00 O ATOM 1457 CB LYS B 367 5.529 -11.711 11.459 1.00 0.00 C ATOM 1458 CG LYS B 367 4.750 -10.595 12.149 1.00 0.00 C ATOM 1459 CD LYS B 367 5.676 -9.566 12.787 1.00 0.00 C ATOM 1460 CE LYS B 367 6.570 -10.186 13.856 1.00 0.00 C ATOM 1461 NZ LYS B 367 5.790 -10.701 15.019 1.00 0.00 N ATOM 0 H LYS B 367 6.313 -10.242 8.472 1.00 0.00 H new ATOM 0 HA LYS B 367 7.005 -10.380 10.727 1.00 0.00 H new ATOM 0 HB2 LYS B 367 4.824 -12.438 11.057 1.00 0.00 H new ATOM 0 HB3 LYS B 367 6.134 -12.231 12.201 1.00 0.00 H new ATOM 0 HG2 LYS B 367 4.104 -10.101 11.423 1.00 0.00 H new ATOM 0 HG3 LYS B 367 4.102 -11.024 12.913 1.00 0.00 H new ATOM 0 HD2 LYS B 367 6.296 -9.109 12.016 1.00 0.00 H new ATOM 0 HD3 LYS B 367 5.080 -8.768 13.231 1.00 0.00 H new ATOM 0 HE2 LYS B 367 7.145 -11.002 13.417 1.00 0.00 H new ATOM 0 HE3 LYS B 367 7.287 -9.442 14.203 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 6.444 -11.004 15.769 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 5.171 -9.948 15.383 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 5.210 -11.510 14.717 1.00 0.00 H new ATOM 1475 N ASN B 368 6.850 -13.330 9.186 1.00 0.00 N ATOM 1476 CA ASN B 368 7.651 -14.451 8.686 1.00 0.00 C ATOM 1477 C ASN B 368 8.421 -14.052 7.418 1.00 0.00 C ATOM 1478 O ASN B 368 9.232 -14.829 6.905 1.00 0.00 O ATOM 1479 CB ASN B 368 6.764 -15.673 8.411 1.00 0.00 C ATOM 1480 CG ASN B 368 5.643 -15.391 7.423 1.00 0.00 C ATOM 1481 OD1 ASN B 368 4.747 -14.591 7.696 1.00 0.00 O ATOM 1482 ND2 ASN B 368 5.689 -16.048 6.269 1.00 0.00 N ATOM 0 H ASN B 368 5.860 -13.380 8.945 1.00 0.00 H new ATOM 0 HA ASN B 368 8.375 -14.716 9.457 1.00 0.00 H new ATOM 0 HB2 ASN B 368 7.383 -16.484 8.026 1.00 0.00 H new ATOM 0 HB3 ASN B 368 6.333 -16.019 9.350 1.00 0.00 H new ATOM 0 HD21 ASN B 368 4.964 -15.899 5.568 1.00 0.00 H new ATOM 0 HD22 ASN B 368 6.450 -16.702 6.084 1.00 0.00 H new ATOM 1489 N GLN B 369 8.173 -12.831 6.928 1.00 0.00 N ATOM 1490 CA GLN B 369 8.842 -12.305 5.744 1.00 0.00 C ATOM 1491 C GLN B 369 9.127 -10.815 5.935 1.00 0.00 C ATOM 1492 O GLN B 369 8.681 -9.969 5.155 1.00 0.00 O ATOM 1493 CB GLN B 369 8.008 -12.551 4.473 1.00 0.00 C ATOM 1494 CG GLN B 369 6.627 -11.898 4.457 1.00 0.00 C ATOM 1495 CD GLN B 369 5.651 -12.513 5.445 1.00 0.00 C ATOM 1496 OE1 GLN B 369 5.703 -12.241 6.640 1.00 0.00 O ATOM 1497 NE2 GLN B 369 4.760 -13.365 4.947 1.00 0.00 N ATOM 0 H GLN B 369 7.503 -12.185 7.345 1.00 0.00 H new ATOM 0 HA GLN B 369 9.787 -12.832 5.614 1.00 0.00 H new ATOM 0 HB2 GLN B 369 8.572 -12.189 3.613 1.00 0.00 H new ATOM 0 HB3 GLN B 369 7.884 -13.626 4.343 1.00 0.00 H new ATOM 0 HG2 GLN B 369 6.734 -10.836 4.678 1.00 0.00 H new ATOM 0 HG3 GLN B 369 6.210 -11.974 3.453 1.00 0.00 H new ATOM 0 HE21 GLN B 369 4.749 -13.565 3.947 1.00 0.00 H new ATOM 0 HE22 GLN B 369 4.087 -13.819 5.565 1.00 0.00 H new ATOM 1506 N GLU B 370 9.877 -10.511 6.999 1.00 0.00 N ATOM 1507 CA GLU B 370 10.247 -9.135 7.346 1.00 0.00 C ATOM 1508 C GLU B 370 10.864 -8.377 6.165 1.00 0.00 C ATOM 1509 O GLU B 370 10.870 -7.145 6.158 1.00 0.00 O ATOM 1510 CB GLU B 370 11.218 -9.131 8.530 1.00 0.00 C ATOM 1511 CG GLU B 370 10.640 -9.747 9.796 1.00 0.00 C ATOM 1512 CD GLU B 370 11.634 -9.775 10.944 1.00 0.00 C ATOM 1513 OE1 GLU B 370 12.685 -10.437 10.804 1.00 0.00 O ATOM 1514 OE2 GLU B 370 11.359 -9.138 11.982 1.00 0.00 O ATOM 0 H GLU B 370 10.244 -11.211 7.643 1.00 0.00 H new ATOM 0 HA GLU B 370 9.328 -8.618 7.620 1.00 0.00 H new ATOM 0 HB2 GLU B 370 12.120 -9.675 8.251 1.00 0.00 H new ATOM 0 HB3 GLU B 370 11.517 -8.104 8.740 1.00 0.00 H new ATOM 0 HG2 GLU B 370 9.758 -9.183 10.099 1.00 0.00 H new ATOM 0 HG3 GLU B 370 10.310 -10.764 9.582 1.00 0.00 H new ATOM 1521 N ASP B 371 11.371 -9.107 5.164 1.00 0.00 N ATOM 1522 CA ASP B 371 11.968 -8.474 3.990 1.00 0.00 C ATOM 1523 C ASP B 371 10.897 -7.675 3.253 1.00 0.00 C ATOM 1524 O ASP B 371 11.041 -6.467 3.056 1.00 0.00 O ATOM 1525 CB ASP B 371 12.578 -9.534 3.060 1.00 0.00 C ATOM 1526 CG ASP B 371 13.323 -8.945 1.867 1.00 0.00 C ATOM 1527 OD1 ASP B 371 13.454 -7.703 1.782 1.00 0.00 O ATOM 1528 OD2 ASP B 371 13.784 -9.735 1.017 1.00 0.00 O ATOM 0 H ASP B 371 11.378 -10.127 5.146 1.00 0.00 H new ATOM 0 HA ASP B 371 12.766 -7.803 4.309 1.00 0.00 H new ATOM 0 HB2 ASP B 371 13.264 -10.157 3.634 1.00 0.00 H new ATOM 0 HB3 ASP B 371 11.784 -10.186 2.696 1.00 0.00 H new ATOM 1533 N LEU B 372 9.811 -8.353 2.879 1.00 0.00 N ATOM 1534 CA LEU B 372 8.692 -7.702 2.202 1.00 0.00 C ATOM 1535 C LEU B 372 8.199 -6.500 3.014 1.00 0.00 C ATOM 1536 O LEU B 372 7.829 -5.471 2.450 1.00 0.00 O ATOM 1537 CB LEU B 372 7.550 -8.695 1.968 1.00 0.00 C ATOM 1538 CG LEU B 372 7.872 -9.834 0.994 1.00 0.00 C ATOM 1539 CD1 LEU B 372 6.729 -10.835 0.944 1.00 0.00 C ATOM 1540 CD2 LEU B 372 8.157 -9.280 -0.396 1.00 0.00 C ATOM 0 H LEU B 372 9.684 -9.353 3.034 1.00 0.00 H new ATOM 0 HA LEU B 372 9.040 -7.345 1.233 1.00 0.00 H new ATOM 0 HB2 LEU B 372 7.262 -9.127 2.926 1.00 0.00 H new ATOM 0 HB3 LEU B 372 6.685 -8.149 1.592 1.00 0.00 H new ATOM 0 HG LEU B 372 8.764 -10.350 1.351 1.00 0.00 H new ATOM 0 HD11 LEU B 372 6.977 -11.636 0.247 1.00 0.00 H new ATOM 0 HD12 LEU B 372 6.569 -11.255 1.937 1.00 0.00 H new ATOM 0 HD13 LEU B 372 5.820 -10.333 0.612 1.00 0.00 H new ATOM 0 HD21 LEU B 372 8.384 -10.101 -1.076 1.00 0.00 H new ATOM 0 HD22 LEU B 372 7.282 -8.740 -0.759 1.00 0.00 H new ATOM 0 HD23 LEU B 372 9.009 -8.602 -0.350 1.00 0.00 H new ATOM 1552 N LEU B 373 8.215 -6.633 4.348 1.00 0.00 N ATOM 1553 CA LEU B 373 7.786 -5.549 5.234 1.00 0.00 C ATOM 1554 C LEU B 373 8.698 -4.334 5.086 1.00 0.00 C ATOM 1555 O LEU B 373 8.217 -3.206 4.964 1.00 0.00 O ATOM 1556 CB LEU B 373 7.770 -6.006 6.698 1.00 0.00 C ATOM 1557 CG LEU B 373 6.399 -6.411 7.241 1.00 0.00 C ATOM 1558 CD1 LEU B 373 6.489 -6.713 8.730 1.00 0.00 C ATOM 1559 CD2 LEU B 373 5.378 -5.312 6.973 1.00 0.00 C ATOM 0 H LEU B 373 8.519 -7.477 4.832 1.00 0.00 H new ATOM 0 HA LEU B 373 6.773 -5.270 4.943 1.00 0.00 H new ATOM 0 HB2 LEU B 373 8.449 -6.852 6.805 1.00 0.00 H new ATOM 0 HB3 LEU B 373 8.164 -5.200 7.317 1.00 0.00 H new ATOM 0 HG LEU B 373 6.071 -7.315 6.728 1.00 0.00 H new ATOM 0 HD11 LEU B 373 5.506 -7.000 9.103 1.00 0.00 H new ATOM 0 HD12 LEU B 373 7.192 -7.530 8.894 1.00 0.00 H new ATOM 0 HD13 LEU B 373 6.834 -5.826 9.261 1.00 0.00 H new ATOM 0 HD21 LEU B 373 4.407 -5.614 7.365 1.00 0.00 H new ATOM 0 HD22 LEU B 373 5.697 -4.392 7.463 1.00 0.00 H new ATOM 0 HD23 LEU B 373 5.299 -5.143 5.899 1.00 0.00 H new ATOM 1571 N SER B 374 10.011 -4.572 5.085 1.00 0.00 N ATOM 1572 CA SER B 374 10.983 -3.492 4.933 1.00 0.00 C ATOM 1573 C SER B 374 10.720 -2.724 3.639 1.00 0.00 C ATOM 1574 O SER B 374 10.778 -1.493 3.618 1.00 0.00 O ATOM 1575 CB SER B 374 12.411 -4.048 4.933 1.00 0.00 C ATOM 1576 OG SER B 374 13.367 -3.015 4.765 1.00 0.00 O ATOM 0 H SER B 374 10.423 -5.500 5.187 1.00 0.00 H new ATOM 0 HA SER B 374 10.876 -2.811 5.777 1.00 0.00 H new ATOM 0 HB2 SER B 374 12.599 -4.572 5.870 1.00 0.00 H new ATOM 0 HB3 SER B 374 12.519 -4.779 4.132 1.00 0.00 H new ATOM 0 HG SER B 374 14.268 -3.399 4.771 1.00 0.00 H new ATOM 1582 N GLU B 375 10.413 -3.464 2.569 1.00 0.00 N ATOM 1583 CA GLU B 375 10.122 -2.867 1.269 1.00 0.00 C ATOM 1584 C GLU B 375 8.911 -1.934 1.349 1.00 0.00 C ATOM 1585 O GLU B 375 8.880 -0.893 0.693 1.00 0.00 O ATOM 1586 CB GLU B 375 9.879 -3.963 0.224 1.00 0.00 C ATOM 1587 CG GLU B 375 9.563 -3.434 -1.169 1.00 0.00 C ATOM 1588 CD GLU B 375 10.693 -2.634 -1.802 1.00 0.00 C ATOM 1589 OE1 GLU B 375 11.786 -2.541 -1.200 1.00 0.00 O ATOM 1590 OE2 GLU B 375 10.481 -2.103 -2.910 1.00 0.00 O ATOM 0 H GLU B 375 10.360 -4.483 2.582 1.00 0.00 H new ATOM 0 HA GLU B 375 10.986 -2.275 0.968 1.00 0.00 H new ATOM 0 HB2 GLU B 375 10.762 -4.599 0.168 1.00 0.00 H new ATOM 0 HB3 GLU B 375 9.054 -4.592 0.558 1.00 0.00 H new ATOM 0 HG2 GLU B 375 9.320 -4.275 -1.819 1.00 0.00 H new ATOM 0 HG3 GLU B 375 8.674 -2.806 -1.114 1.00 0.00 H new ATOM 1597 N PHE B 376 7.917 -2.313 2.161 1.00 0.00 N ATOM 1598 CA PHE B 376 6.710 -1.503 2.334 1.00 0.00 C ATOM 1599 C PHE B 376 7.070 -0.071 2.732 1.00 0.00 C ATOM 1600 O PHE B 376 6.688 0.886 2.057 1.00 0.00 O ATOM 1601 CB PHE B 376 5.801 -2.112 3.410 1.00 0.00 C ATOM 1602 CG PHE B 376 4.485 -1.400 3.569 1.00 0.00 C ATOM 1603 CD1 PHE B 376 3.912 -0.717 2.505 1.00 0.00 C ATOM 1604 CD2 PHE B 376 3.818 -1.420 4.782 1.00 0.00 C ATOM 1605 CE1 PHE B 376 2.701 -0.069 2.651 1.00 0.00 C ATOM 1606 CE2 PHE B 376 2.608 -0.773 4.934 1.00 0.00 C ATOM 1607 CZ PHE B 376 2.049 -0.096 3.867 1.00 0.00 C ATOM 0 H PHE B 376 7.927 -3.175 2.707 1.00 0.00 H new ATOM 0 HA PHE B 376 6.181 -1.487 1.381 1.00 0.00 H new ATOM 0 HB2 PHE B 376 5.611 -3.156 3.163 1.00 0.00 H new ATOM 0 HB3 PHE B 376 6.327 -2.101 4.365 1.00 0.00 H new ATOM 0 HD1 PHE B 376 4.419 -0.692 1.552 1.00 0.00 H new ATOM 0 HD2 PHE B 376 4.249 -1.948 5.619 1.00 0.00 H new ATOM 0 HE1 PHE B 376 2.265 0.458 1.815 1.00 0.00 H new ATOM 0 HE2 PHE B 376 2.099 -0.796 5.886 1.00 0.00 H new ATOM 0 HZ PHE B 376 1.103 0.411 3.985 1.00 0.00 H new ATOM 1617 N GLY B 377 7.803 0.057 3.843 1.00 0.00 N ATOM 1618 CA GLY B 377 8.208 1.367 4.339 1.00 0.00 C ATOM 1619 C GLY B 377 9.152 2.128 3.410 1.00 0.00 C ATOM 1620 O GLY B 377 9.474 3.285 3.681 1.00 0.00 O ATOM 0 H GLY B 377 8.124 -0.728 4.410 1.00 0.00 H new ATOM 0 HA2 GLY B 377 7.316 1.971 4.505 1.00 0.00 H new ATOM 0 HA3 GLY B 377 8.693 1.242 5.307 1.00 0.00 H new ATOM 1624 N GLN B 378 9.599 1.497 2.320 1.00 0.00 N ATOM 1625 CA GLN B 378 10.504 2.153 1.374 1.00 0.00 C ATOM 1626 C GLN B 378 9.789 3.244 0.574 1.00 0.00 C ATOM 1627 O GLN B 378 10.419 4.208 0.137 1.00 0.00 O ATOM 1628 CB GLN B 378 11.118 1.132 0.409 1.00 0.00 C ATOM 1629 CG GLN B 378 11.928 0.044 1.096 1.00 0.00 C ATOM 1630 CD GLN B 378 13.088 0.594 1.906 1.00 0.00 C ATOM 1631 OE1 GLN B 378 13.987 1.237 1.364 1.00 0.00 O ATOM 1632 NE2 GLN B 378 13.073 0.347 3.212 1.00 0.00 N ATOM 0 H GLN B 378 9.351 0.539 2.073 1.00 0.00 H new ATOM 0 HA GLN B 378 11.297 2.617 1.960 1.00 0.00 H new ATOM 0 HB2 GLN B 378 10.319 0.667 -0.168 1.00 0.00 H new ATOM 0 HB3 GLN B 378 11.759 1.656 -0.299 1.00 0.00 H new ATOM 0 HG2 GLN B 378 11.273 -0.530 1.752 1.00 0.00 H new ATOM 0 HG3 GLN B 378 12.311 -0.646 0.344 1.00 0.00 H new ATOM 0 HE21 GLN B 378 12.308 -0.190 3.621 1.00 0.00 H new ATOM 0 HE22 GLN B 378 13.826 0.695 3.806 1.00 0.00 H new ATOM 1641 N PHE B 379 8.478 3.083 0.372 1.00 0.00 N ATOM 1642 CA PHE B 379 7.696 4.056 -0.390 1.00 0.00 C ATOM 1643 C PHE B 379 7.055 5.090 0.531 1.00 0.00 C ATOM 1644 O PHE B 379 7.152 6.293 0.278 1.00 0.00 O ATOM 1645 CB PHE B 379 6.635 3.345 -1.235 1.00 0.00 C ATOM 1646 CG PHE B 379 7.214 2.269 -2.113 1.00 0.00 C ATOM 1647 CD1 PHE B 379 7.534 1.026 -1.587 1.00 0.00 C ATOM 1648 CD2 PHE B 379 7.466 2.511 -3.453 1.00 0.00 C ATOM 1649 CE1 PHE B 379 8.091 0.044 -2.383 1.00 0.00 C ATOM 1650 CE2 PHE B 379 8.022 1.530 -4.254 1.00 0.00 C ATOM 1651 CZ PHE B 379 8.335 0.297 -3.718 1.00 0.00 C ATOM 0 H PHE B 379 7.940 2.292 0.724 1.00 0.00 H new ATOM 0 HA PHE B 379 8.373 4.585 -1.061 1.00 0.00 H new ATOM 0 HB2 PHE B 379 5.886 2.906 -0.576 1.00 0.00 H new ATOM 0 HB3 PHE B 379 6.121 4.078 -1.857 1.00 0.00 H new ATOM 0 HD1 PHE B 379 7.345 0.824 -0.543 1.00 0.00 H new ATOM 0 HD2 PHE B 379 7.226 3.475 -3.877 1.00 0.00 H new ATOM 0 HE1 PHE B 379 8.335 -0.920 -1.962 1.00 0.00 H new ATOM 0 HE2 PHE B 379 8.211 1.729 -5.299 1.00 0.00 H new ATOM 0 HZ PHE B 379 8.770 -0.469 -4.343 1.00 0.00 H new ATOM 1661 N LEU B 380 6.424 4.627 1.613 1.00 0.00 N ATOM 1662 CA LEU B 380 5.804 5.538 2.571 1.00 0.00 C ATOM 1663 C LEU B 380 6.849 5.979 3.599 1.00 0.00 C ATOM 1664 O LEU B 380 7.712 5.189 3.981 1.00 0.00 O ATOM 1665 CB LEU B 380 4.576 4.887 3.245 1.00 0.00 C ATOM 1666 CG LEU B 380 4.846 3.723 4.180 1.00 0.00 C ATOM 1667 CD1 LEU B 380 4.954 4.202 5.624 1.00 0.00 C ATOM 1668 CD2 LEU B 380 3.761 2.665 4.039 1.00 0.00 C ATOM 0 H LEU B 380 6.331 3.638 1.844 1.00 0.00 H new ATOM 0 HA LEU B 380 5.440 6.420 2.045 1.00 0.00 H new ATOM 0 HB2 LEU B 380 4.048 5.658 3.806 1.00 0.00 H new ATOM 0 HB3 LEU B 380 3.900 4.544 2.461 1.00 0.00 H new ATOM 0 HG LEU B 380 5.800 3.274 3.903 1.00 0.00 H new ATOM 0 HD11 LEU B 380 5.148 3.350 6.276 1.00 0.00 H new ATOM 0 HD12 LEU B 380 5.771 4.918 5.710 1.00 0.00 H new ATOM 0 HD13 LEU B 380 4.020 4.680 5.919 1.00 0.00 H new ATOM 0 HD21 LEU B 380 3.970 1.837 4.717 1.00 0.00 H new ATOM 0 HD22 LEU B 380 2.793 3.101 4.286 1.00 0.00 H new ATOM 0 HD23 LEU B 380 3.742 2.298 3.013 1.00 0.00 H new