USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 846 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= 0.714 K(o=-1.8,f=-5.2!) USER MOD Set 1.2: B 369 GLN : amide:sc= -2.54 K(o=-1.8,f=-3.9) USER MOD Set 2.1: B 341 ASN :FLIP amide:sc= 0.33 F(o=0.96,f=1.5) USER MOD Set 2.2: B 349 TYR OH : rot -120:sc= 1.22 USER MOD Set 3.1: A 7 MET CE :methyl 142:sc= -2.76 (180deg=-6.12!) USER MOD Set 3.2: B 336 GLN :FLIP amide:sc= -1.33 F(o=-5.9,f=-4.1) USER MOD Single : A 8 ASN :FLIP amide:sc= 0.822 F(o=-2.3,f=0.82) USER MOD Single : A 10 GLN :FLIP amide:sc= -0.244 F(o=-1.8,f=-0.24) USER MOD Single : A 11 MET CE :methyl 179:sc= -1.07 (180deg=-1.08) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 295 SER OG : rot 180:sc= 0 USER MOD Single : B 297 GLN :FLIP amide:sc= 0 F(o=-0.8,f=0) USER MOD Single : B 298 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : B 299 ASN : amide:sc= -0.223 K(o=-0.22,f=-2.6) USER MOD Single : B 300 GLN : amide:sc= -0.595 K(o=-0.6,f=-2.6!) USER MOD Single : B 305 ASN : amide:sc= -0.0791 X(o=-0.079,f=-0.0092) USER MOD Single : B 306 HIS : no HD1:sc= -2.29! C(o=-2.3!,f=-2.3!) USER MOD Single : B 309 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : B 310 TYR OH : rot 32:sc= -0.73! USER MOD Single : B 312 ASN : amide:sc= -0.252 K(o=-0.25,f=-1.9) USER MOD Single : B 313 LYS NZ :NH3+ 146:sc= 0.496 (180deg=0.0864) USER MOD Single : B 315 LYS NZ :NH3+ 149:sc= 0.473 (180deg=-0.304) USER MOD Single : B 316 ASN : amide:sc= -0.0366 X(o=-0.037,f=-0.23) USER MOD Single : B 319 GLN : amide:sc= -0.178 X(o=-0.18,f=-0.18) USER MOD Single : B 321 GLN : amide:sc= -0.161 X(o=-0.16,f=-0.35) USER MOD Single : B 325 TYR OH : rot -178:sc= -1.59 USER MOD Single : B 326 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0772) USER MOD Single : B 333 HIS : no HD1:sc= -6.1! C(o=-6.1!,f=-6.2!) USER MOD Single : B 334 THR OG1 : rot 71:sc= 1.25 USER MOD Single : B 335 TYR OH : rot -160:sc= 0.765 USER MOD Single : B 337 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 339 GLN :FLIP amide:sc= -0.405 F(o=-1.5,f=-0.4) USER MOD Single : B 343 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 348 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : B 350 THR OG1 : rot 180:sc= 0 USER MOD Single : B 354 THR OG1 : rot 180:sc= -0.451 USER MOD Single : B 356 GLN :FLIP amide:sc= 0 F(o=-0.82,f=0) USER MOD Single : B 359 TYR OH : rot 180:sc= 0 USER MOD Single : B 361 GLN : amide:sc= -0.0394 K(o=-0.039,f=-1.4!) USER MOD Single : B 367 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 374 SER OG : rot -61:sc= 1.16 USER MOD Single : B 378 GLN :FLIP amide:sc= -0.0444 F(o=-1.5,f=-0.044) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 6 -1.547 13.766 -2.994 1.00 0.00 N ATOM 2 CA ARG A 6 -0.414 12.944 -3.517 1.00 0.00 C ATOM 3 C ARG A 6 -0.690 11.450 -3.350 1.00 0.00 C ATOM 4 O ARG A 6 -0.783 10.948 -2.227 1.00 0.00 O ATOM 5 CB ARG A 6 0.871 13.331 -2.774 1.00 0.00 C ATOM 6 CG ARG A 6 1.274 14.787 -2.965 1.00 0.00 C ATOM 7 CD ARG A 6 2.544 15.128 -2.199 1.00 0.00 C ATOM 8 NE ARG A 6 2.388 14.953 -0.753 1.00 0.00 N ATOM 9 CZ ARG A 6 3.344 15.219 0.141 1.00 0.00 C ATOM 10 NH1 ARG A 6 4.526 15.686 -0.254 1.00 0.00 N ATOM 11 NH2 ARG A 6 3.115 15.020 1.435 1.00 0.00 N ATOM 0 HA ARG A 6 -0.300 13.142 -4.583 1.00 0.00 H new ATOM 0 HB2 ARG A 6 0.737 13.137 -1.710 1.00 0.00 H new ATOM 0 HB3 ARG A 6 1.684 12.690 -3.115 1.00 0.00 H new ATOM 0 HG2 ARG A 6 1.425 14.986 -4.026 1.00 0.00 H new ATOM 0 HG3 ARG A 6 0.463 15.435 -2.632 1.00 0.00 H new ATOM 0 HD2 ARG A 6 3.359 14.497 -2.553 1.00 0.00 H new ATOM 0 HD3 ARG A 6 2.826 16.160 -2.409 1.00 0.00 H new ATOM 0 HE ARG A 6 1.493 14.606 -0.407 1.00 0.00 H new ATOM 0 HH11 ARG A 6 4.707 15.843 -1.245 1.00 0.00 H new ATOM 0 HH12 ARG A 6 5.251 15.887 0.435 1.00 0.00 H new ATOM 0 HH21 ARG A 6 2.210 14.665 1.744 1.00 0.00 H new ATOM 0 HH22 ARG A 6 3.844 15.223 2.119 1.00 0.00 H new ATOM 27 N MET A 7 -0.823 10.746 -4.475 1.00 0.00 N ATOM 28 CA MET A 7 -1.091 9.308 -4.457 1.00 0.00 C ATOM 29 C MET A 7 0.171 8.530 -4.098 1.00 0.00 C ATOM 30 O MET A 7 1.102 8.440 -4.902 1.00 0.00 O ATOM 31 CB MET A 7 -1.612 8.834 -5.821 1.00 0.00 C ATOM 32 CG MET A 7 -2.871 9.544 -6.305 1.00 0.00 C ATOM 33 SD MET A 7 -4.278 9.351 -5.191 1.00 0.00 S ATOM 34 CE MET A 7 -3.910 10.586 -3.948 1.00 0.00 C ATOM 0 H MET A 7 -0.749 11.148 -5.409 1.00 0.00 H new ATOM 0 HA MET A 7 -1.854 9.121 -3.701 1.00 0.00 H new ATOM 0 HB2 MET A 7 -0.826 8.972 -6.563 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.813 7.764 -5.766 1.00 0.00 H new ATOM 0 HG2 MET A 7 -2.656 10.606 -6.426 1.00 0.00 H new ATOM 0 HG3 MET A 7 -3.141 9.159 -7.288 1.00 0.00 H new ATOM 0 HE1 MET A 7 -4.834 11.069 -3.630 1.00 0.00 H new ATOM 0 HE2 MET A 7 -3.436 10.109 -3.090 1.00 0.00 H new ATOM 0 HE3 MET A 7 -3.236 11.333 -4.366 1.00 0.00 H new ATOM 44 N ASN A 8 0.203 7.968 -2.890 1.00 0.00 N ATOM 45 CA ASN A 8 1.357 7.198 -2.443 1.00 0.00 C ATOM 46 C ASN A 8 1.064 5.701 -2.510 1.00 0.00 C ATOM 47 O ASN A 8 1.666 4.983 -3.310 1.00 0.00 O ATOM 48 CB ASN A 8 1.760 7.596 -1.018 1.00 0.00 C ATOM 49 CG ASN A 8 3.121 7.048 -0.591 1.00 0.00 C ATOM 50 OD1 ASN A 8 3.863 6.429 -1.517 1.00 0.00 O flip ATOM 51 ND2 ASN A 8 3.512 7.191 0.566 1.00 0.00 N flip ATOM 0 H ASN A 8 -0.554 8.032 -2.209 1.00 0.00 H new ATOM 0 HA ASN A 8 2.189 7.420 -3.111 1.00 0.00 H new ATOM 0 HB2 ASN A 8 1.776 8.683 -0.944 1.00 0.00 H new ATOM 0 HB3 ASN A 8 1.000 7.241 -0.322 1.00 0.00 H new ATOM 0 HD21 ASN A 8 2.922 7.668 1.248 1.00 0.00 H new ATOM 0 HD22 ASN A 8 4.426 6.833 0.843 1.00 0.00 H new ATOM 58 N ILE A 9 0.131 5.235 -1.676 1.00 0.00 N ATOM 59 CA ILE A 9 -0.235 3.818 -1.666 1.00 0.00 C ATOM 60 C ILE A 9 -1.102 3.469 -2.843 1.00 0.00 C ATOM 61 O ILE A 9 -1.051 2.349 -3.338 1.00 0.00 O ATOM 62 CB ILE A 9 -1.002 3.385 -0.403 1.00 0.00 C ATOM 63 CG1 ILE A 9 -2.437 3.944 -0.368 1.00 0.00 C ATOM 64 CG2 ILE A 9 -0.245 3.802 0.819 1.00 0.00 C ATOM 65 CD1 ILE A 9 -2.534 5.432 -0.101 1.00 0.00 C ATOM 0 H ILE A 9 -0.379 5.811 -1.006 1.00 0.00 H new ATOM 0 HA ILE A 9 0.719 3.292 -1.701 1.00 0.00 H new ATOM 0 HB ILE A 9 -1.087 2.299 -0.425 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -2.919 3.728 -1.322 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -2.999 3.414 0.401 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -0.793 3.493 1.709 1.00 0.00 H new ATOM 0 HG22 ILE A 9 0.738 3.331 0.816 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -0.129 4.886 0.823 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -3.582 5.733 -0.095 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -2.086 5.658 0.867 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -2.004 5.977 -0.882 1.00 0.00 H new ATOM 77 N GLN A 10 -1.929 4.417 -3.268 1.00 0.00 N ATOM 78 CA GLN A 10 -2.825 4.161 -4.367 1.00 0.00 C ATOM 79 C GLN A 10 -2.051 3.661 -5.589 1.00 0.00 C ATOM 80 O GLN A 10 -2.544 2.828 -6.350 1.00 0.00 O ATOM 81 CB GLN A 10 -3.647 5.408 -4.716 1.00 0.00 C ATOM 82 CG GLN A 10 -4.617 5.201 -5.876 1.00 0.00 C ATOM 83 CD GLN A 10 -5.712 4.173 -5.599 1.00 0.00 C ATOM 84 OE1 GLN A 10 -5.887 3.772 -4.338 1.00 0.00 O flip ATOM 85 NE2 GLN A 10 -6.416 3.755 -6.518 1.00 0.00 N flip ATOM 0 H GLN A 10 -1.991 5.354 -2.869 1.00 0.00 H new ATOM 0 HA GLN A 10 -3.520 3.381 -4.058 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -4.209 5.719 -3.836 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -2.967 6.223 -4.964 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -5.083 6.156 -6.120 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -4.054 4.888 -6.755 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -6.257 4.081 -7.471 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -7.159 3.083 -6.326 1.00 0.00 H new ATOM 94 N MET A 11 -0.821 4.162 -5.749 1.00 0.00 N ATOM 95 CA MET A 11 0.047 3.762 -6.853 1.00 0.00 C ATOM 96 C MET A 11 0.468 2.296 -6.697 1.00 0.00 C ATOM 97 O MET A 11 0.593 1.565 -7.677 1.00 0.00 O ATOM 98 CB MET A 11 1.285 4.671 -6.890 1.00 0.00 C ATOM 99 CG MET A 11 2.281 4.325 -7.984 1.00 0.00 C ATOM 100 SD MET A 11 3.721 5.411 -7.980 1.00 0.00 S ATOM 101 CE MET A 11 4.404 5.071 -6.360 1.00 0.00 C ATOM 0 H MET A 11 -0.406 4.850 -5.121 1.00 0.00 H new ATOM 0 HA MET A 11 -0.500 3.864 -7.791 1.00 0.00 H new ATOM 0 HB2 MET A 11 0.960 5.703 -7.023 1.00 0.00 H new ATOM 0 HB3 MET A 11 1.789 4.618 -5.925 1.00 0.00 H new ATOM 0 HG2 MET A 11 2.609 3.293 -7.859 1.00 0.00 H new ATOM 0 HG3 MET A 11 1.786 4.387 -8.953 1.00 0.00 H new ATOM 0 HE1 MET A 11 5.312 5.657 -6.218 1.00 0.00 H new ATOM 0 HE2 MET A 11 3.675 5.338 -5.595 1.00 0.00 H new ATOM 0 HE3 MET A 11 4.641 4.010 -6.280 1.00 0.00 H new ATOM 111 N LEU A 12 0.667 1.877 -5.450 1.00 0.00 N ATOM 112 CA LEU A 12 1.048 0.504 -5.140 1.00 0.00 C ATOM 113 C LEU A 12 -0.182 -0.407 -5.139 1.00 0.00 C ATOM 114 O LEU A 12 -0.164 -1.482 -5.737 1.00 0.00 O ATOM 115 CB LEU A 12 1.784 0.478 -3.798 1.00 0.00 C ATOM 116 CG LEU A 12 1.589 -0.763 -2.923 1.00 0.00 C ATOM 117 CD1 LEU A 12 2.271 -1.971 -3.538 1.00 0.00 C ATOM 118 CD2 LEU A 12 2.117 -0.510 -1.519 1.00 0.00 C ATOM 0 H LEU A 12 0.569 2.477 -4.631 1.00 0.00 H new ATOM 0 HA LEU A 12 1.722 0.124 -5.907 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.850 0.590 -3.994 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.472 1.350 -3.223 1.00 0.00 H new ATOM 0 HG LEU A 12 0.521 -0.972 -2.861 1.00 0.00 H new ATOM 0 HD11 LEU A 12 2.118 -2.840 -2.898 1.00 0.00 H new ATOM 0 HD12 LEU A 12 1.846 -2.166 -4.523 1.00 0.00 H new ATOM 0 HD13 LEU A 12 3.339 -1.775 -3.636 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.971 -1.402 -0.909 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.180 -0.273 -1.567 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.579 0.327 -1.073 1.00 0.00 H new ATOM 130 N LEU A 13 -1.255 0.041 -4.482 1.00 0.00 N ATOM 131 CA LEU A 13 -2.507 -0.720 -4.427 1.00 0.00 C ATOM 132 C LEU A 13 -3.039 -0.994 -5.830 1.00 0.00 C ATOM 133 O LEU A 13 -3.411 -2.127 -6.145 1.00 0.00 O ATOM 134 CB LEU A 13 -3.563 0.056 -3.638 1.00 0.00 C ATOM 135 CG LEU A 13 -3.284 0.213 -2.146 1.00 0.00 C ATOM 136 CD1 LEU A 13 -4.190 1.272 -1.542 1.00 0.00 C ATOM 137 CD2 LEU A 13 -3.476 -1.120 -1.442 1.00 0.00 C ATOM 0 H LEU A 13 -1.282 0.928 -3.980 1.00 0.00 H new ATOM 0 HA LEU A 13 -2.299 -1.669 -3.932 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -3.663 1.048 -4.078 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -4.523 -0.445 -3.760 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.251 0.536 -2.013 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.976 1.370 -0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -4.013 2.227 -2.037 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -5.231 0.980 -1.678 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.275 -1.001 -0.377 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -4.502 -1.461 -1.582 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.789 -1.855 -1.861 1.00 0.00 H new ATOM 149 N GLU A 14 -3.073 0.048 -6.671 1.00 0.00 N ATOM 150 CA GLU A 14 -3.558 -0.086 -8.045 1.00 0.00 C ATOM 151 C GLU A 14 -2.836 -1.237 -8.754 1.00 0.00 C ATOM 152 O GLU A 14 -3.408 -1.896 -9.625 1.00 0.00 O ATOM 153 CB GLU A 14 -3.377 1.228 -8.820 1.00 0.00 C ATOM 154 CG GLU A 14 -1.938 1.552 -9.179 1.00 0.00 C ATOM 155 CD GLU A 14 -1.807 2.869 -9.922 1.00 0.00 C ATOM 156 OE1 GLU A 14 -2.173 3.917 -9.345 1.00 0.00 O ATOM 157 OE2 GLU A 14 -1.344 2.854 -11.081 1.00 0.00 O ATOM 0 H GLU A 14 -2.771 0.990 -6.422 1.00 0.00 H new ATOM 0 HA GLU A 14 -4.624 -0.313 -8.012 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -3.965 1.179 -9.737 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -3.783 2.046 -8.224 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -1.340 1.591 -8.269 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.531 0.749 -9.794 1.00 0.00 H new ATOM 164 N ALA A 15 -1.584 -1.483 -8.350 1.00 0.00 N ATOM 165 CA ALA A 15 -0.783 -2.566 -8.911 1.00 0.00 C ATOM 166 C ALA A 15 -1.498 -3.894 -8.775 1.00 0.00 C ATOM 167 O ALA A 15 -1.737 -4.578 -9.766 1.00 0.00 O ATOM 168 CB ALA A 15 0.553 -2.662 -8.202 1.00 0.00 C ATOM 0 H ALA A 15 -1.105 -0.940 -7.631 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.627 -2.344 -9.967 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.136 -3.475 -8.634 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.095 -1.724 -8.319 1.00 0.00 H new ATOM 0 HB3 ALA A 15 0.389 -2.856 -7.142 1.00 0.00 H new ATOM 174 N ALA A 16 -1.819 -4.254 -7.525 1.00 0.00 N ATOM 175 CA ALA A 16 -2.490 -5.513 -7.224 1.00 0.00 C ATOM 176 C ALA A 16 -3.514 -5.879 -8.290 1.00 0.00 C ATOM 177 O ALA A 16 -3.469 -6.973 -8.836 1.00 0.00 O ATOM 178 CB ALA A 16 -3.166 -5.464 -5.867 1.00 0.00 C ATOM 0 H ALA A 16 -1.620 -3.682 -6.704 1.00 0.00 H new ATOM 0 HA ALA A 16 -1.718 -6.282 -7.210 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -3.658 -6.417 -5.671 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -2.420 -5.275 -5.095 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -3.907 -4.665 -5.858 1.00 0.00 H new ATOM 184 N ASP A 17 -4.436 -4.951 -8.582 1.00 0.00 N ATOM 185 CA ASP A 17 -5.478 -5.176 -9.589 1.00 0.00 C ATOM 186 C ASP A 17 -4.892 -5.810 -10.853 1.00 0.00 C ATOM 187 O ASP A 17 -5.399 -6.820 -11.344 1.00 0.00 O ATOM 188 CB ASP A 17 -6.170 -3.850 -9.941 1.00 0.00 C ATOM 189 CG ASP A 17 -7.397 -4.020 -10.828 1.00 0.00 C ATOM 190 OD1 ASP A 17 -7.798 -5.175 -11.097 1.00 0.00 O ATOM 191 OD2 ASP A 17 -7.967 -2.990 -11.246 1.00 0.00 O ATOM 0 H ASP A 17 -4.480 -4.036 -8.133 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.212 -5.863 -9.169 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -6.465 -3.348 -9.020 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.455 -3.199 -10.444 1.00 0.00 H new ATOM 196 N TYR A 18 -3.814 -5.216 -11.363 1.00 0.00 N ATOM 197 CA TYR A 18 -3.143 -5.720 -12.557 1.00 0.00 C ATOM 198 C TYR A 18 -2.430 -7.036 -12.258 1.00 0.00 C ATOM 199 O TYR A 18 -2.489 -7.979 -13.052 1.00 0.00 O ATOM 200 CB TYR A 18 -2.153 -4.668 -13.081 1.00 0.00 C ATOM 201 CG TYR A 18 -1.348 -5.098 -14.291 1.00 0.00 C ATOM 202 CD1 TYR A 18 -0.348 -6.059 -14.186 1.00 0.00 C ATOM 203 CD2 TYR A 18 -1.590 -4.538 -15.539 1.00 0.00 C ATOM 204 CE1 TYR A 18 0.388 -6.447 -15.289 1.00 0.00 C ATOM 205 CE2 TYR A 18 -0.859 -4.924 -16.648 1.00 0.00 C ATOM 206 CZ TYR A 18 0.128 -5.876 -16.517 1.00 0.00 C ATOM 207 OH TYR A 18 0.860 -6.262 -17.619 1.00 0.00 O ATOM 0 H TYR A 18 -3.386 -4.381 -10.964 1.00 0.00 H new ATOM 0 HA TYR A 18 -3.889 -5.912 -13.328 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -2.706 -3.763 -13.333 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -1.464 -4.407 -12.278 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -0.143 -6.510 -13.226 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -2.361 -3.789 -15.645 1.00 0.00 H new ATOM 0 HE1 TYR A 18 1.162 -7.193 -15.190 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -1.061 -4.481 -17.612 1.00 0.00 H new ATOM 0 HH TYR A 18 0.552 -5.766 -18.406 1.00 0.00 H new ATOM 217 N LEU A 19 -1.770 -7.094 -11.105 1.00 0.00 N ATOM 218 CA LEU A 19 -1.052 -8.296 -10.684 1.00 0.00 C ATOM 219 C LEU A 19 -2.018 -9.465 -10.485 1.00 0.00 C ATOM 220 O LEU A 19 -1.644 -10.623 -10.679 1.00 0.00 O ATOM 221 CB LEU A 19 -0.295 -8.023 -9.389 1.00 0.00 C ATOM 222 CG LEU A 19 0.475 -6.706 -9.365 1.00 0.00 C ATOM 223 CD1 LEU A 19 1.003 -6.427 -7.977 1.00 0.00 C ATOM 224 CD2 LEU A 19 1.611 -6.715 -10.378 1.00 0.00 C ATOM 0 H LEU A 19 -1.717 -6.320 -10.442 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.343 -8.564 -11.467 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.005 -8.028 -8.562 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.405 -8.840 -9.214 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.214 -5.908 -9.642 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.550 -5.484 -7.978 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.170 -6.363 -7.277 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.671 -7.233 -7.673 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.142 -5.764 -10.338 1.00 0.00 H new ATOM 0 HD22 LEU A 19 2.301 -7.526 -10.144 1.00 0.00 H new ATOM 0 HD23 LEU A 19 1.205 -6.862 -11.379 1.00 0.00 H new ATOM 236 N GLU A 20 -3.263 -9.152 -10.093 1.00 0.00 N ATOM 237 CA GLU A 20 -4.286 -10.183 -9.868 1.00 0.00 C ATOM 238 C GLU A 20 -4.371 -11.153 -11.045 1.00 0.00 C ATOM 239 O GLU A 20 -4.509 -12.362 -10.851 1.00 0.00 O ATOM 240 CB GLU A 20 -5.662 -9.555 -9.622 1.00 0.00 C ATOM 241 CG GLU A 20 -5.798 -8.871 -8.269 1.00 0.00 C ATOM 242 CD GLU A 20 -7.205 -8.363 -8.009 1.00 0.00 C ATOM 243 OE1 GLU A 20 -7.699 -7.535 -8.804 1.00 0.00 O ATOM 244 OE2 GLU A 20 -7.815 -8.795 -7.007 1.00 0.00 O ATOM 0 H GLU A 20 -3.584 -8.198 -9.926 1.00 0.00 H new ATOM 0 HA GLU A 20 -3.986 -10.738 -8.979 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -5.863 -8.827 -10.408 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -6.424 -10.330 -9.704 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -5.518 -9.572 -7.482 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -5.099 -8.036 -8.216 1.00 0.00 H new ATOM 251 N ARG A 21 -4.285 -10.618 -12.265 1.00 0.00 N ATOM 252 CA ARG A 21 -4.350 -11.440 -13.470 1.00 0.00 C ATOM 253 C ARG A 21 -3.124 -12.349 -13.578 1.00 0.00 C ATOM 254 O ARG A 21 -1.989 -11.828 -13.493 1.00 0.00 O ATOM 255 CB ARG A 21 -4.456 -10.554 -14.716 1.00 0.00 C ATOM 256 CG ARG A 21 -4.766 -11.327 -15.989 1.00 0.00 C ATOM 257 CD ARG A 21 -4.749 -10.422 -17.211 1.00 0.00 C ATOM 258 NE ARG A 21 -3.401 -9.938 -17.520 1.00 0.00 N ATOM 259 CZ ARG A 21 -3.122 -9.088 -18.510 1.00 0.00 C ATOM 260 NH1 ARG A 21 -4.095 -8.593 -19.273 1.00 0.00 N ATOM 261 NH2 ARG A 21 -1.864 -8.725 -18.736 1.00 0.00 N ATOM 262 OXT ARG A 21 -3.310 -13.572 -13.743 1.00 0.00 O ATOM 0 H ARG A 21 -4.170 -9.620 -12.442 1.00 0.00 H new ATOM 0 HA ARG A 21 -5.239 -12.066 -13.403 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -5.234 -9.808 -14.556 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -3.519 -10.014 -14.848 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -4.036 -12.126 -16.117 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.744 -11.800 -15.899 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -5.144 -10.965 -18.069 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -5.409 -9.571 -17.041 1.00 0.00 H new ATOM 0 HE ARG A 21 -2.629 -10.271 -16.943 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -5.064 -8.863 -19.103 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -3.871 -7.944 -20.027 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -1.114 -9.096 -18.153 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -1.649 -8.075 -19.492 1.00 0.00 H new TER 276 ARG A 21 ATOM 277 N SER B 295 21.423 18.263 -10.505 1.00 0.00 N ATOM 278 CA SER B 295 20.073 17.910 -9.984 1.00 0.00 C ATOM 279 C SER B 295 19.528 16.649 -10.654 1.00 0.00 C ATOM 280 O SER B 295 19.950 16.287 -11.755 1.00 0.00 O ATOM 281 CB SER B 295 19.129 19.092 -10.230 1.00 0.00 C ATOM 282 OG SER B 295 17.836 18.832 -9.712 1.00 0.00 O ATOM 0 HA SER B 295 20.147 17.704 -8.916 1.00 0.00 H new ATOM 0 HB2 SER B 295 19.537 19.989 -9.764 1.00 0.00 H new ATOM 0 HB3 SER B 295 19.062 19.291 -11.300 1.00 0.00 H new ATOM 0 HG SER B 295 17.255 19.603 -9.881 1.00 0.00 H new ATOM 290 N LEU B 296 18.588 15.985 -9.982 1.00 0.00 N ATOM 291 CA LEU B 296 17.981 14.765 -10.508 1.00 0.00 C ATOM 292 C LEU B 296 16.504 14.988 -10.833 1.00 0.00 C ATOM 293 O LEU B 296 15.655 14.994 -9.938 1.00 0.00 O ATOM 294 CB LEU B 296 18.131 13.617 -9.502 1.00 0.00 C ATOM 295 CG LEU B 296 19.573 13.261 -9.130 1.00 0.00 C ATOM 296 CD1 LEU B 296 19.596 12.120 -8.122 1.00 0.00 C ATOM 297 CD2 LEU B 296 20.376 12.897 -10.372 1.00 0.00 C ATOM 0 H LEU B 296 18.231 16.273 -9.071 1.00 0.00 H new ATOM 0 HA LEU B 296 18.500 14.498 -11.429 1.00 0.00 H new ATOM 0 HB2 LEU B 296 17.592 13.880 -8.592 1.00 0.00 H new ATOM 0 HB3 LEU B 296 17.649 12.730 -9.913 1.00 0.00 H new ATOM 0 HG LEU B 296 20.035 14.135 -8.671 1.00 0.00 H new ATOM 0 HD11 LEU B 296 20.628 11.879 -7.868 1.00 0.00 H new ATOM 0 HD12 LEU B 296 19.061 12.420 -7.221 1.00 0.00 H new ATOM 0 HD13 LEU B 296 19.115 11.243 -8.554 1.00 0.00 H new ATOM 0 HD21 LEU B 296 21.397 12.648 -10.085 1.00 0.00 H new ATOM 0 HD22 LEU B 296 19.917 12.039 -10.863 1.00 0.00 H new ATOM 0 HD23 LEU B 296 20.389 13.744 -11.058 1.00 0.00 H new ATOM 309 N GLN B 297 16.206 15.169 -12.120 1.00 0.00 N ATOM 310 CA GLN B 297 14.833 15.391 -12.568 1.00 0.00 C ATOM 311 C GLN B 297 14.034 14.090 -12.531 1.00 0.00 C ATOM 312 O GLN B 297 14.484 13.060 -13.036 1.00 0.00 O ATOM 313 CB GLN B 297 14.814 15.975 -13.984 1.00 0.00 C ATOM 314 CG GLN B 297 15.502 17.331 -14.095 1.00 0.00 C ATOM 315 CD GLN B 297 15.481 17.924 -15.502 1.00 0.00 C ATOM 316 OE1 GLN B 297 14.872 17.225 -16.463 1.00 0.00 O flip ATOM 317 NE2 GLN B 297 16.012 19.011 -15.726 1.00 0.00 N flip ATOM 0 H GLN B 297 16.898 15.166 -12.870 1.00 0.00 H new ATOM 0 HA GLN B 297 14.370 16.105 -11.887 1.00 0.00 H new ATOM 0 HB2 GLN B 297 15.299 15.274 -14.663 1.00 0.00 H new ATOM 0 HB3 GLN B 297 13.780 16.074 -14.313 1.00 0.00 H new ATOM 0 HG2 GLN B 297 15.020 18.029 -13.410 1.00 0.00 H new ATOM 0 HG3 GLN B 297 16.537 17.229 -13.770 1.00 0.00 H new ATOM 0 HE21 GLN B 297 16.469 19.521 -14.970 1.00 0.00 H new ATOM 0 HE22 GLN B 297 15.995 19.403 -16.668 1.00 0.00 H new ATOM 326 N ASN B 298 12.848 14.145 -11.924 1.00 0.00 N ATOM 327 CA ASN B 298 11.983 12.970 -11.812 1.00 0.00 C ATOM 328 C ASN B 298 11.170 12.766 -13.088 1.00 0.00 C ATOM 329 O ASN B 298 10.574 13.709 -13.613 1.00 0.00 O ATOM 330 CB ASN B 298 11.042 13.107 -10.609 1.00 0.00 C ATOM 331 CG ASN B 298 11.759 13.167 -9.261 1.00 0.00 C ATOM 332 OD1 ASN B 298 13.074 12.934 -9.240 1.00 0.00 O flip ATOM 333 ND2 ASN B 298 11.127 13.407 -8.233 1.00 0.00 N flip ATOM 0 H ASN B 298 12.464 14.991 -11.502 1.00 0.00 H new ATOM 0 HA ASN B 298 12.621 12.098 -11.665 1.00 0.00 H new ATOM 0 HB2 ASN B 298 10.443 14.010 -10.731 1.00 0.00 H new ATOM 0 HB3 ASN B 298 10.351 12.264 -10.604 1.00 0.00 H new ATOM 0 HD21 ASN B 298 10.123 13.581 -8.280 1.00 0.00 H new ATOM 0 HD22 ASN B 298 11.607 13.432 -7.333 1.00 0.00 H new ATOM 340 N ASN B 299 11.153 11.529 -13.582 1.00 0.00 N ATOM 341 CA ASN B 299 10.416 11.193 -14.799 1.00 0.00 C ATOM 342 C ASN B 299 10.078 9.702 -14.847 1.00 0.00 C ATOM 343 O ASN B 299 10.761 8.883 -14.227 1.00 0.00 O ATOM 344 CB ASN B 299 11.226 11.592 -16.039 1.00 0.00 C ATOM 345 CG ASN B 299 12.574 10.891 -16.113 1.00 0.00 C ATOM 346 OD1 ASN B 299 12.646 9.669 -16.250 1.00 0.00 O ATOM 347 ND2 ASN B 299 13.653 11.663 -16.018 1.00 0.00 N ATOM 0 H ASN B 299 11.642 10.741 -13.157 1.00 0.00 H new ATOM 0 HA ASN B 299 9.480 11.752 -14.791 1.00 0.00 H new ATOM 0 HB2 ASN B 299 10.650 11.358 -16.934 1.00 0.00 H new ATOM 0 HB3 ASN B 299 11.382 12.671 -16.034 1.00 0.00 H new ATOM 0 HD21 ASN B 299 14.583 11.246 -16.058 1.00 0.00 H new ATOM 0 HD22 ASN B 299 13.550 12.672 -15.905 1.00 0.00 H new ATOM 354 N GLN B 300 9.021 9.361 -15.593 1.00 0.00 N ATOM 355 CA GLN B 300 8.577 7.971 -15.740 1.00 0.00 C ATOM 356 C GLN B 300 8.038 7.408 -14.422 1.00 0.00 C ATOM 357 O GLN B 300 8.379 7.892 -13.340 1.00 0.00 O ATOM 358 CB GLN B 300 9.724 7.088 -16.251 1.00 0.00 C ATOM 359 CG GLN B 300 10.276 7.510 -17.606 1.00 0.00 C ATOM 360 CD GLN B 300 9.266 7.359 -18.729 1.00 0.00 C ATOM 361 OE1 GLN B 300 8.218 8.007 -18.731 1.00 0.00 O ATOM 362 NE2 GLN B 300 9.573 6.497 -19.695 1.00 0.00 N ATOM 0 H GLN B 300 8.454 10.035 -16.108 1.00 0.00 H new ATOM 0 HA GLN B 300 7.767 7.965 -16.469 1.00 0.00 H new ATOM 0 HB2 GLN B 300 10.533 7.103 -15.520 1.00 0.00 H new ATOM 0 HB3 GLN B 300 9.373 6.058 -16.318 1.00 0.00 H new ATOM 0 HG2 GLN B 300 10.600 8.549 -17.553 1.00 0.00 H new ATOM 0 HG3 GLN B 300 11.158 6.913 -17.835 1.00 0.00 H new ATOM 0 HE21 GLN B 300 10.451 5.980 -19.657 1.00 0.00 H new ATOM 0 HE22 GLN B 300 8.930 6.354 -20.474 1.00 0.00 H new ATOM 371 N PRO B 301 7.185 6.366 -14.498 1.00 0.00 N ATOM 372 CA PRO B 301 6.601 5.732 -13.313 1.00 0.00 C ATOM 373 C PRO B 301 7.538 4.692 -12.689 1.00 0.00 C ATOM 374 O PRO B 301 7.157 3.538 -12.486 1.00 0.00 O ATOM 375 CB PRO B 301 5.346 5.070 -13.882 1.00 0.00 C ATOM 376 CG PRO B 301 5.716 4.700 -15.278 1.00 0.00 C ATOM 377 CD PRO B 301 6.721 5.724 -15.745 1.00 0.00 C ATOM 0 HA PRO B 301 6.404 6.439 -12.507 1.00 0.00 H new ATOM 0 HB2 PRO B 301 5.063 4.192 -13.301 1.00 0.00 H new ATOM 0 HB3 PRO B 301 4.496 5.752 -13.865 1.00 0.00 H new ATOM 0 HG2 PRO B 301 6.141 3.697 -15.313 1.00 0.00 H new ATOM 0 HG3 PRO B 301 4.838 4.697 -15.924 1.00 0.00 H new ATOM 0 HD2 PRO B 301 7.545 5.257 -16.284 1.00 0.00 H new ATOM 0 HD3 PRO B 301 6.268 6.448 -16.422 1.00 0.00 H new ATOM 385 N VAL B 302 8.767 5.115 -12.388 1.00 0.00 N ATOM 386 CA VAL B 302 9.766 4.232 -11.787 1.00 0.00 C ATOM 387 C VAL B 302 9.327 3.774 -10.395 1.00 0.00 C ATOM 388 O VAL B 302 9.515 2.613 -10.028 1.00 0.00 O ATOM 389 CB VAL B 302 11.144 4.923 -11.684 1.00 0.00 C ATOM 390 CG1 VAL B 302 12.196 3.957 -11.156 1.00 0.00 C ATOM 391 CG2 VAL B 302 11.565 5.492 -13.034 1.00 0.00 C ATOM 0 H VAL B 302 9.094 6.067 -12.552 1.00 0.00 H new ATOM 0 HA VAL B 302 9.856 3.364 -12.440 1.00 0.00 H new ATOM 0 HB VAL B 302 11.056 5.749 -10.978 1.00 0.00 H new ATOM 0 HG11 VAL B 302 13.158 4.466 -11.092 1.00 0.00 H new ATOM 0 HG12 VAL B 302 11.904 3.607 -10.166 1.00 0.00 H new ATOM 0 HG13 VAL B 302 12.280 3.106 -11.832 1.00 0.00 H new ATOM 0 HG21 VAL B 302 12.538 5.974 -12.938 1.00 0.00 H new ATOM 0 HG22 VAL B 302 11.630 4.686 -13.764 1.00 0.00 H new ATOM 0 HG23 VAL B 302 10.829 6.224 -13.366 1.00 0.00 H new ATOM 401 N GLU B 303 8.729 4.693 -9.635 1.00 0.00 N ATOM 402 CA GLU B 303 8.246 4.389 -8.288 1.00 0.00 C ATOM 403 C GLU B 303 7.081 3.400 -8.344 1.00 0.00 C ATOM 404 O GLU B 303 6.928 2.558 -7.457 1.00 0.00 O ATOM 405 CB GLU B 303 7.811 5.671 -7.561 1.00 0.00 C ATOM 406 CG GLU B 303 8.937 6.679 -7.339 1.00 0.00 C ATOM 407 CD GLU B 303 9.278 7.511 -8.570 1.00 0.00 C ATOM 408 OE1 GLU B 303 8.532 7.451 -9.573 1.00 0.00 O ATOM 409 OE2 GLU B 303 10.290 8.242 -8.523 1.00 0.00 O ATOM 0 H GLU B 303 8.568 5.656 -9.931 1.00 0.00 H new ATOM 0 HA GLU B 303 9.066 3.935 -7.732 1.00 0.00 H new ATOM 0 HB2 GLU B 303 7.018 6.150 -8.136 1.00 0.00 H new ATOM 0 HB3 GLU B 303 7.385 5.400 -6.595 1.00 0.00 H new ATOM 0 HG2 GLU B 303 8.655 7.349 -6.527 1.00 0.00 H new ATOM 0 HG3 GLU B 303 9.830 6.145 -7.016 1.00 0.00 H new ATOM 416 N PHE B 304 6.269 3.508 -9.399 1.00 0.00 N ATOM 417 CA PHE B 304 5.120 2.624 -9.593 1.00 0.00 C ATOM 418 C PHE B 304 5.571 1.170 -9.743 1.00 0.00 C ATOM 419 O PHE B 304 5.125 0.298 -9.000 1.00 0.00 O ATOM 420 CB PHE B 304 4.324 3.069 -10.828 1.00 0.00 C ATOM 421 CG PHE B 304 3.181 2.157 -11.197 1.00 0.00 C ATOM 422 CD1 PHE B 304 2.149 1.916 -10.305 1.00 0.00 C ATOM 423 CD2 PHE B 304 3.143 1.548 -12.440 1.00 0.00 C ATOM 424 CE1 PHE B 304 1.100 1.086 -10.648 1.00 0.00 C ATOM 425 CE2 PHE B 304 2.096 0.714 -12.787 1.00 0.00 C ATOM 426 CZ PHE B 304 1.074 0.483 -11.889 1.00 0.00 C ATOM 0 H PHE B 304 6.389 4.204 -10.135 1.00 0.00 H new ATOM 0 HA PHE B 304 4.479 2.688 -8.714 1.00 0.00 H new ATOM 0 HB2 PHE B 304 3.931 4.070 -10.650 1.00 0.00 H new ATOM 0 HB3 PHE B 304 5.004 3.140 -11.677 1.00 0.00 H new ATOM 0 HD1 PHE B 304 2.165 2.382 -9.331 1.00 0.00 H new ATOM 0 HD2 PHE B 304 3.940 1.726 -13.146 1.00 0.00 H new ATOM 0 HE1 PHE B 304 0.300 0.909 -9.945 1.00 0.00 H new ATOM 0 HE2 PHE B 304 2.078 0.244 -13.759 1.00 0.00 H new ATOM 0 HZ PHE B 304 0.255 -0.168 -12.157 1.00 0.00 H new ATOM 436 N ASN B 305 6.461 0.920 -10.706 1.00 0.00 N ATOM 437 CA ASN B 305 6.973 -0.430 -10.959 1.00 0.00 C ATOM 438 C ASN B 305 7.586 -1.056 -9.702 1.00 0.00 C ATOM 439 O ASN B 305 7.541 -2.276 -9.531 1.00 0.00 O ATOM 440 CB ASN B 305 8.011 -0.404 -12.084 1.00 0.00 C ATOM 441 CG ASN B 305 7.430 0.090 -13.399 1.00 0.00 C ATOM 442 OD1 ASN B 305 6.503 -0.510 -13.942 1.00 0.00 O ATOM 443 ND2 ASN B 305 7.972 1.188 -13.915 1.00 0.00 N ATOM 0 H ASN B 305 6.843 1.635 -11.325 1.00 0.00 H new ATOM 0 HA ASN B 305 6.125 -1.046 -11.259 1.00 0.00 H new ATOM 0 HB2 ASN B 305 8.842 0.239 -11.793 1.00 0.00 H new ATOM 0 HB3 ASN B 305 8.417 -1.406 -12.223 1.00 0.00 H new ATOM 0 HD21 ASN B 305 7.621 1.565 -14.795 1.00 0.00 H new ATOM 0 HD22 ASN B 305 8.739 1.654 -13.431 1.00 0.00 H new ATOM 450 N HIS B 306 8.153 -0.222 -8.826 1.00 0.00 N ATOM 451 CA HIS B 306 8.765 -0.706 -7.589 1.00 0.00 C ATOM 452 C HIS B 306 7.731 -1.412 -6.710 1.00 0.00 C ATOM 453 O HIS B 306 7.915 -2.573 -6.339 1.00 0.00 O ATOM 454 CB HIS B 306 9.413 0.459 -6.827 1.00 0.00 C ATOM 455 CG HIS B 306 10.145 0.055 -5.582 1.00 0.00 C ATOM 456 ND1 HIS B 306 9.523 -0.508 -4.485 1.00 0.00 N ATOM 457 CD2 HIS B 306 11.457 0.145 -5.260 1.00 0.00 C ATOM 458 CE1 HIS B 306 10.420 -0.742 -3.545 1.00 0.00 C ATOM 459 NE2 HIS B 306 11.599 -0.356 -3.990 1.00 0.00 N ATOM 0 H HIS B 306 8.200 0.789 -8.951 1.00 0.00 H new ATOM 0 HA HIS B 306 9.539 -1.429 -7.848 1.00 0.00 H new ATOM 0 HB2 HIS B 306 10.108 0.970 -7.493 1.00 0.00 H new ATOM 0 HB3 HIS B 306 8.639 1.179 -6.561 1.00 0.00 H new ATOM 0 HD2 HIS B 306 12.245 0.538 -5.886 1.00 0.00 H new ATOM 0 HE1 HIS B 306 10.221 -1.176 -2.576 1.00 0.00 H new ATOM 0 HE2 HIS B 306 12.476 -0.419 -3.473 1.00 0.00 H new ATOM 468 N ALA B 307 6.640 -0.711 -6.391 1.00 0.00 N ATOM 469 CA ALA B 307 5.574 -1.283 -5.568 1.00 0.00 C ATOM 470 C ALA B 307 4.917 -2.458 -6.275 1.00 0.00 C ATOM 471 O ALA B 307 4.557 -3.450 -5.650 1.00 0.00 O ATOM 472 CB ALA B 307 4.526 -0.236 -5.237 1.00 0.00 C ATOM 0 H ALA B 307 6.473 0.250 -6.689 1.00 0.00 H new ATOM 0 HA ALA B 307 6.025 -1.636 -4.641 1.00 0.00 H new ATOM 0 HB1 ALA B 307 3.744 -0.685 -4.625 1.00 0.00 H new ATOM 0 HB2 ALA B 307 4.991 0.583 -4.689 1.00 0.00 H new ATOM 0 HB3 ALA B 307 4.090 0.146 -6.160 1.00 0.00 H new ATOM 478 N ILE B 308 4.774 -2.329 -7.589 1.00 0.00 N ATOM 479 CA ILE B 308 4.177 -3.361 -8.416 1.00 0.00 C ATOM 480 C ILE B 308 4.860 -4.706 -8.196 1.00 0.00 C ATOM 481 O ILE B 308 4.239 -5.657 -7.717 1.00 0.00 O ATOM 482 CB ILE B 308 4.263 -2.942 -9.897 1.00 0.00 C ATOM 483 CG1 ILE B 308 3.032 -2.130 -10.284 1.00 0.00 C ATOM 484 CG2 ILE B 308 4.425 -4.143 -10.796 1.00 0.00 C ATOM 485 CD1 ILE B 308 2.618 -1.132 -9.228 1.00 0.00 C ATOM 0 H ILE B 308 5.071 -1.503 -8.108 1.00 0.00 H new ATOM 0 HA ILE B 308 3.130 -3.476 -8.134 1.00 0.00 H new ATOM 0 HB ILE B 308 5.146 -2.317 -10.027 1.00 0.00 H new ATOM 0 HG12 ILE B 308 3.233 -1.601 -11.215 1.00 0.00 H new ATOM 0 HG13 ILE B 308 2.202 -2.810 -10.476 1.00 0.00 H new ATOM 0 HG21 ILE B 308 4.483 -3.815 -11.834 1.00 0.00 H new ATOM 0 HG22 ILE B 308 5.339 -4.675 -10.532 1.00 0.00 H new ATOM 0 HG23 ILE B 308 3.570 -4.808 -10.672 1.00 0.00 H new ATOM 0 HD11 ILE B 308 1.736 -0.588 -9.567 1.00 0.00 H new ATOM 0 HD12 ILE B 308 2.386 -1.658 -8.302 1.00 0.00 H new ATOM 0 HD13 ILE B 308 3.432 -0.429 -9.052 1.00 0.00 H new ATOM 497 N ASN B 309 6.145 -4.769 -8.533 1.00 0.00 N ATOM 498 CA ASN B 309 6.922 -5.985 -8.352 1.00 0.00 C ATOM 499 C ASN B 309 6.948 -6.384 -6.873 1.00 0.00 C ATOM 500 O ASN B 309 7.018 -7.569 -6.543 1.00 0.00 O ATOM 501 CB ASN B 309 8.326 -5.776 -8.906 1.00 0.00 C ATOM 502 CG ASN B 309 8.409 -6.055 -10.395 1.00 0.00 C ATOM 503 OD1 ASN B 309 8.160 -7.174 -10.843 1.00 0.00 O ATOM 504 ND2 ASN B 309 8.756 -5.034 -11.172 1.00 0.00 N ATOM 0 H ASN B 309 6.668 -3.990 -8.933 1.00 0.00 H new ATOM 0 HA ASN B 309 6.457 -6.804 -8.901 1.00 0.00 H new ATOM 0 HB2 ASN B 309 8.640 -4.750 -8.713 1.00 0.00 H new ATOM 0 HB3 ASN B 309 9.022 -6.427 -8.378 1.00 0.00 H new ATOM 0 HD21 ASN B 309 8.824 -5.162 -12.182 1.00 0.00 H new ATOM 0 HD22 ASN B 309 8.954 -4.123 -10.759 1.00 0.00 H new ATOM 511 N TYR B 310 6.843 -5.383 -5.990 1.00 0.00 N ATOM 512 CA TYR B 310 6.799 -5.618 -4.549 1.00 0.00 C ATOM 513 C TYR B 310 5.537 -6.412 -4.206 1.00 0.00 C ATOM 514 O TYR B 310 5.595 -7.414 -3.492 1.00 0.00 O ATOM 515 CB TYR B 310 6.799 -4.281 -3.796 1.00 0.00 C ATOM 516 CG TYR B 310 6.608 -4.400 -2.297 1.00 0.00 C ATOM 517 CD1 TYR B 310 6.879 -5.583 -1.619 1.00 0.00 C ATOM 518 CD2 TYR B 310 6.149 -3.317 -1.562 1.00 0.00 C ATOM 519 CE1 TYR B 310 6.693 -5.682 -0.257 1.00 0.00 C ATOM 520 CE2 TYR B 310 5.958 -3.409 -0.200 1.00 0.00 C ATOM 521 CZ TYR B 310 6.229 -4.593 0.449 1.00 0.00 C ATOM 522 OH TYR B 310 6.029 -4.691 1.804 1.00 0.00 O ATOM 0 H TYR B 310 6.787 -4.399 -6.254 1.00 0.00 H new ATOM 0 HA TYR B 310 7.679 -6.186 -4.248 1.00 0.00 H new ATOM 0 HB2 TYR B 310 7.742 -3.770 -3.989 1.00 0.00 H new ATOM 0 HB3 TYR B 310 6.007 -3.651 -4.201 1.00 0.00 H new ATOM 0 HD1 TYR B 310 7.241 -6.439 -2.169 1.00 0.00 H new ATOM 0 HD2 TYR B 310 5.938 -2.385 -2.066 1.00 0.00 H new ATOM 0 HE1 TYR B 310 6.910 -6.608 0.254 1.00 0.00 H new ATOM 0 HE2 TYR B 310 5.597 -2.556 0.356 1.00 0.00 H new ATOM 0 HH TYR B 310 6.680 -5.316 2.186 1.00 0.00 H new ATOM 532 N VAL B 311 4.400 -5.959 -4.747 1.00 0.00 N ATOM 533 CA VAL B 311 3.118 -6.625 -4.527 1.00 0.00 C ATOM 534 C VAL B 311 3.188 -8.074 -5.003 1.00 0.00 C ATOM 535 O VAL B 311 2.592 -8.956 -4.394 1.00 0.00 O ATOM 536 CB VAL B 311 1.964 -5.923 -5.277 1.00 0.00 C ATOM 537 CG1 VAL B 311 0.626 -6.562 -4.942 1.00 0.00 C ATOM 538 CG2 VAL B 311 1.912 -4.438 -4.978 1.00 0.00 C ATOM 0 H VAL B 311 4.345 -5.132 -5.341 1.00 0.00 H new ATOM 0 HA VAL B 311 2.919 -6.581 -3.456 1.00 0.00 H new ATOM 0 HB VAL B 311 2.162 -6.047 -6.342 1.00 0.00 H new ATOM 0 HG11 VAL B 311 -0.168 -6.048 -5.484 1.00 0.00 H new ATOM 0 HG12 VAL B 311 0.642 -7.613 -5.232 1.00 0.00 H new ATOM 0 HG13 VAL B 311 0.444 -6.484 -3.870 1.00 0.00 H new ATOM 0 HG21 VAL B 311 1.086 -3.985 -5.526 1.00 0.00 H new ATOM 0 HG22 VAL B 311 1.764 -4.287 -3.909 1.00 0.00 H new ATOM 0 HG23 VAL B 311 2.849 -3.972 -5.284 1.00 0.00 H new ATOM 548 N ASN B 312 3.932 -8.315 -6.093 1.00 0.00 N ATOM 549 CA ASN B 312 4.089 -9.663 -6.637 1.00 0.00 C ATOM 550 C ASN B 312 4.645 -10.593 -5.561 1.00 0.00 C ATOM 551 O ASN B 312 4.056 -11.633 -5.272 1.00 0.00 O ATOM 552 CB ASN B 312 5.009 -9.646 -7.864 1.00 0.00 C ATOM 553 CG ASN B 312 5.141 -11.009 -8.521 1.00 0.00 C ATOM 554 OD1 ASN B 312 5.649 -11.956 -7.918 1.00 0.00 O ATOM 555 ND2 ASN B 312 4.683 -11.118 -9.765 1.00 0.00 N ATOM 0 H ASN B 312 4.432 -7.592 -6.611 1.00 0.00 H new ATOM 0 HA ASN B 312 3.113 -10.032 -6.952 1.00 0.00 H new ATOM 0 HB2 ASN B 312 4.622 -8.933 -8.592 1.00 0.00 H new ATOM 0 HB3 ASN B 312 5.997 -9.294 -7.567 1.00 0.00 H new ATOM 0 HD21 ASN B 312 4.745 -12.010 -10.255 1.00 0.00 H new ATOM 0 HD22 ASN B 312 4.269 -10.309 -10.229 1.00 0.00 H new ATOM 562 N LYS B 313 5.760 -10.187 -4.944 1.00 0.00 N ATOM 563 CA LYS B 313 6.374 -10.959 -3.860 1.00 0.00 C ATOM 564 C LYS B 313 5.321 -11.324 -2.828 1.00 0.00 C ATOM 565 O LYS B 313 5.213 -12.468 -2.390 1.00 0.00 O ATOM 566 CB LYS B 313 7.465 -10.128 -3.174 1.00 0.00 C ATOM 567 CG LYS B 313 8.744 -10.006 -3.982 1.00 0.00 C ATOM 568 CD LYS B 313 9.643 -8.890 -3.471 1.00 0.00 C ATOM 569 CE LYS B 313 10.390 -9.302 -2.212 1.00 0.00 C ATOM 570 NZ LYS B 313 11.190 -8.183 -1.643 1.00 0.00 N ATOM 0 H LYS B 313 6.256 -9.327 -5.178 1.00 0.00 H new ATOM 0 HA LYS B 313 6.812 -11.863 -4.283 1.00 0.00 H new ATOM 0 HB2 LYS B 313 7.076 -9.129 -2.975 1.00 0.00 H new ATOM 0 HB3 LYS B 313 7.698 -10.578 -2.209 1.00 0.00 H new ATOM 0 HG2 LYS B 313 9.286 -10.951 -3.947 1.00 0.00 H new ATOM 0 HG3 LYS B 313 8.495 -9.820 -5.027 1.00 0.00 H new ATOM 0 HD2 LYS B 313 10.359 -8.616 -4.246 1.00 0.00 H new ATOM 0 HD3 LYS B 313 9.042 -8.004 -3.264 1.00 0.00 H new ATOM 0 HE2 LYS B 313 9.677 -9.653 -1.466 1.00 0.00 H new ATOM 0 HE3 LYS B 313 11.050 -10.139 -2.440 1.00 0.00 H new ATOM 0 HZ1 LYS B 313 11.200 -8.256 -0.606 1.00 0.00 H new ATOM 0 HZ2 LYS B 313 12.164 -8.234 -2.003 1.00 0.00 H new ATOM 0 HZ3 LYS B 313 10.765 -7.276 -1.922 1.00 0.00 H new ATOM 584 N ILE B 314 4.554 -10.312 -2.458 1.00 0.00 N ATOM 585 CA ILE B 314 3.487 -10.429 -1.485 1.00 0.00 C ATOM 586 C ILE B 314 2.373 -11.357 -1.967 1.00 0.00 C ATOM 587 O ILE B 314 2.054 -12.344 -1.308 1.00 0.00 O ATOM 588 CB ILE B 314 2.949 -9.016 -1.196 1.00 0.00 C ATOM 589 CG1 ILE B 314 4.047 -8.229 -0.487 1.00 0.00 C ATOM 590 CG2 ILE B 314 1.664 -9.040 -0.387 1.00 0.00 C ATOM 591 CD1 ILE B 314 3.700 -6.796 -0.200 1.00 0.00 C ATOM 0 H ILE B 314 4.660 -9.370 -2.834 1.00 0.00 H new ATOM 0 HA ILE B 314 3.878 -10.876 -0.571 1.00 0.00 H new ATOM 0 HB ILE B 314 2.690 -8.530 -2.137 1.00 0.00 H new ATOM 0 HG12 ILE B 314 4.285 -8.727 0.453 1.00 0.00 H new ATOM 0 HG13 ILE B 314 4.949 -8.256 -1.099 1.00 0.00 H new ATOM 0 HG21 ILE B 314 1.326 -8.019 -0.210 1.00 0.00 H new ATOM 0 HG22 ILE B 314 0.898 -9.586 -0.938 1.00 0.00 H new ATOM 0 HG23 ILE B 314 1.845 -9.533 0.568 1.00 0.00 H new ATOM 0 HD11 ILE B 314 4.537 -6.313 0.305 1.00 0.00 H new ATOM 0 HD12 ILE B 314 3.493 -6.277 -1.136 1.00 0.00 H new ATOM 0 HD13 ILE B 314 2.818 -6.756 0.440 1.00 0.00 H new ATOM 603 N LYS B 315 1.803 -11.041 -3.125 1.00 0.00 N ATOM 604 CA LYS B 315 0.737 -11.849 -3.709 1.00 0.00 C ATOM 605 C LYS B 315 1.161 -13.316 -3.827 1.00 0.00 C ATOM 606 O LYS B 315 0.411 -14.219 -3.455 1.00 0.00 O ATOM 607 CB LYS B 315 0.358 -11.298 -5.083 1.00 0.00 C ATOM 608 CG LYS B 315 -0.783 -12.035 -5.737 1.00 0.00 C ATOM 609 CD LYS B 315 -1.237 -11.320 -6.990 1.00 0.00 C ATOM 610 CE LYS B 315 -2.393 -12.044 -7.643 1.00 0.00 C ATOM 611 NZ LYS B 315 -3.628 -12.020 -6.804 1.00 0.00 N ATOM 0 H LYS B 315 2.063 -10.226 -3.681 1.00 0.00 H new ATOM 0 HA LYS B 315 -0.130 -11.799 -3.051 1.00 0.00 H new ATOM 0 HB2 LYS B 315 0.089 -10.247 -4.982 1.00 0.00 H new ATOM 0 HB3 LYS B 315 1.230 -11.343 -5.736 1.00 0.00 H new ATOM 0 HG2 LYS B 315 -0.472 -13.050 -5.985 1.00 0.00 H new ATOM 0 HG3 LYS B 315 -1.616 -12.118 -5.039 1.00 0.00 H new ATOM 0 HD2 LYS B 315 -1.535 -10.301 -6.743 1.00 0.00 H new ATOM 0 HD3 LYS B 315 -0.406 -11.248 -7.692 1.00 0.00 H new ATOM 0 HE2 LYS B 315 -2.605 -11.587 -8.609 1.00 0.00 H new ATOM 0 HE3 LYS B 315 -2.108 -13.078 -7.835 1.00 0.00 H new ATOM 0 HZ1 LYS B 315 -4.466 -12.026 -7.420 1.00 0.00 H new ATOM 0 HZ2 LYS B 315 -3.645 -12.858 -6.188 1.00 0.00 H new ATOM 0 HZ3 LYS B 315 -3.634 -11.160 -6.219 1.00 0.00 H new ATOM 625 N ASN B 316 2.370 -13.534 -4.348 1.00 0.00 N ATOM 626 CA ASN B 316 2.913 -14.880 -4.522 1.00 0.00 C ATOM 627 C ASN B 316 3.166 -15.555 -3.176 1.00 0.00 C ATOM 628 O ASN B 316 2.714 -16.677 -2.948 1.00 0.00 O ATOM 629 CB ASN B 316 4.208 -14.823 -5.340 1.00 0.00 C ATOM 630 CG ASN B 316 3.955 -14.531 -6.810 1.00 0.00 C ATOM 631 OD1 ASN B 316 3.372 -13.504 -7.160 1.00 0.00 O ATOM 632 ND2 ASN B 316 4.391 -15.436 -7.679 1.00 0.00 N ATOM 0 H ASN B 316 2.994 -12.789 -4.658 1.00 0.00 H new ATOM 0 HA ASN B 316 2.176 -15.475 -5.061 1.00 0.00 H new ATOM 0 HB2 ASN B 316 4.861 -14.054 -4.927 1.00 0.00 H new ATOM 0 HB3 ASN B 316 4.735 -15.773 -5.247 1.00 0.00 H new ATOM 0 HD21 ASN B 316 4.247 -15.294 -8.679 1.00 0.00 H new ATOM 0 HD22 ASN B 316 4.869 -16.273 -7.347 1.00 0.00 H new ATOM 639 N ARG B 317 3.882 -14.864 -2.287 1.00 0.00 N ATOM 640 CA ARG B 317 4.182 -15.400 -0.959 1.00 0.00 C ATOM 641 C ARG B 317 2.893 -15.766 -0.220 1.00 0.00 C ATOM 642 O ARG B 317 2.834 -16.790 0.464 1.00 0.00 O ATOM 643 CB ARG B 317 4.991 -14.389 -0.139 1.00 0.00 C ATOM 644 CG ARG B 317 5.460 -14.927 1.205 1.00 0.00 C ATOM 645 CD ARG B 317 6.433 -16.087 1.034 1.00 0.00 C ATOM 646 NE ARG B 317 6.814 -16.685 2.315 1.00 0.00 N ATOM 647 CZ ARG B 317 5.984 -17.388 3.094 1.00 0.00 C ATOM 648 NH1 ARG B 317 4.733 -17.630 2.709 1.00 0.00 N ATOM 649 NH2 ARG B 317 6.414 -17.864 4.258 1.00 0.00 N ATOM 0 H ARG B 317 4.264 -13.935 -2.462 1.00 0.00 H new ATOM 0 HA ARG B 317 4.779 -16.303 -1.086 1.00 0.00 H new ATOM 0 HB2 ARG B 317 5.860 -14.077 -0.719 1.00 0.00 H new ATOM 0 HB3 ARG B 317 4.383 -13.500 0.028 1.00 0.00 H new ATOM 0 HG2 ARG B 317 5.940 -14.128 1.770 1.00 0.00 H new ATOM 0 HG3 ARG B 317 4.599 -15.256 1.787 1.00 0.00 H new ATOM 0 HD2 ARG B 317 5.979 -16.849 0.400 1.00 0.00 H new ATOM 0 HD3 ARG B 317 7.327 -15.736 0.519 1.00 0.00 H new ATOM 0 HE ARG B 317 7.774 -16.557 2.634 1.00 0.00 H new ATOM 0 HH11 ARG B 317 4.398 -17.278 1.812 1.00 0.00 H new ATOM 0 HH12 ARG B 317 4.109 -18.167 3.311 1.00 0.00 H new ATOM 0 HH21 ARG B 317 7.375 -17.693 4.555 1.00 0.00 H new ATOM 0 HH22 ARG B 317 5.783 -18.400 4.854 1.00 0.00 H new ATOM 663 N PHE B 318 1.863 -14.926 -0.368 1.00 0.00 N ATOM 664 CA PHE B 318 0.574 -15.167 0.279 1.00 0.00 C ATOM 665 C PHE B 318 -0.419 -15.784 -0.712 1.00 0.00 C ATOM 666 O PHE B 318 -1.602 -15.437 -0.716 1.00 0.00 O ATOM 667 CB PHE B 318 0.009 -13.858 0.865 1.00 0.00 C ATOM 668 CG PHE B 318 1.039 -13.026 1.568 1.00 0.00 C ATOM 669 CD1 PHE B 318 1.857 -13.578 2.534 1.00 0.00 C ATOM 670 CD2 PHE B 318 1.187 -11.691 1.255 1.00 0.00 C ATOM 671 CE1 PHE B 318 2.812 -12.809 3.172 1.00 0.00 C ATOM 672 CE2 PHE B 318 2.135 -10.918 1.891 1.00 0.00 C ATOM 673 CZ PHE B 318 2.950 -11.473 2.847 1.00 0.00 C ATOM 0 H PHE B 318 1.899 -14.075 -0.930 1.00 0.00 H new ATOM 0 HA PHE B 318 0.727 -15.872 1.096 1.00 0.00 H new ATOM 0 HB2 PHE B 318 -0.435 -13.271 0.061 1.00 0.00 H new ATOM 0 HB3 PHE B 318 -0.792 -14.098 1.564 1.00 0.00 H new ATOM 0 HD1 PHE B 318 1.749 -14.621 2.794 1.00 0.00 H new ATOM 0 HD2 PHE B 318 0.553 -11.246 0.503 1.00 0.00 H new ATOM 0 HE1 PHE B 318 3.449 -13.252 3.923 1.00 0.00 H new ATOM 0 HE2 PHE B 318 2.237 -9.873 1.637 1.00 0.00 H new ATOM 0 HZ PHE B 318 3.695 -10.868 3.342 1.00 0.00 H new ATOM 683 N GLN B 319 0.077 -16.702 -1.557 1.00 0.00 N ATOM 684 CA GLN B 319 -0.745 -17.378 -2.557 1.00 0.00 C ATOM 685 C GLN B 319 -2.044 -17.897 -1.945 1.00 0.00 C ATOM 686 O GLN B 319 -3.134 -17.583 -2.427 1.00 0.00 O ATOM 687 CB GLN B 319 0.042 -18.535 -3.173 1.00 0.00 C ATOM 688 CG GLN B 319 -0.227 -18.723 -4.649 1.00 0.00 C ATOM 689 CD GLN B 319 -1.674 -19.075 -4.947 1.00 0.00 C ATOM 690 OE1 GLN B 319 -2.177 -20.105 -4.501 1.00 0.00 O ATOM 691 NE2 GLN B 319 -2.353 -18.215 -5.701 1.00 0.00 N ATOM 0 H GLN B 319 1.055 -16.991 -1.562 1.00 0.00 H new ATOM 0 HA GLN B 319 -1.003 -16.657 -3.333 1.00 0.00 H new ATOM 0 HB2 GLN B 319 1.108 -18.360 -3.024 1.00 0.00 H new ATOM 0 HB3 GLN B 319 -0.207 -19.456 -2.645 1.00 0.00 H new ATOM 0 HG2 GLN B 319 0.036 -17.808 -5.180 1.00 0.00 H new ATOM 0 HG3 GLN B 319 0.420 -19.512 -5.033 1.00 0.00 H new ATOM 0 HE21 GLN B 319 -1.897 -17.372 -6.050 1.00 0.00 H new ATOM 0 HE22 GLN B 319 -3.330 -18.398 -5.930 1.00 0.00 H new ATOM 700 N GLY B 320 -1.919 -18.679 -0.867 1.00 0.00 N ATOM 701 CA GLY B 320 -3.087 -19.210 -0.189 1.00 0.00 C ATOM 702 C GLY B 320 -3.479 -18.352 0.998 1.00 0.00 C ATOM 703 O GLY B 320 -3.968 -18.859 2.009 1.00 0.00 O ATOM 0 H GLY B 320 -1.026 -18.951 -0.455 1.00 0.00 H new ATOM 0 HA2 GLY B 320 -3.921 -19.267 -0.889 1.00 0.00 H new ATOM 0 HA3 GLY B 320 -2.883 -20.227 0.147 1.00 0.00 H new ATOM 707 N GLN B 321 -3.251 -17.046 0.865 1.00 0.00 N ATOM 708 CA GLN B 321 -3.557 -16.087 1.912 1.00 0.00 C ATOM 709 C GLN B 321 -4.342 -14.913 1.342 1.00 0.00 C ATOM 710 O GLN B 321 -3.791 -13.830 1.122 1.00 0.00 O ATOM 711 CB GLN B 321 -2.264 -15.575 2.537 1.00 0.00 C ATOM 712 CG GLN B 321 -1.554 -16.569 3.430 1.00 0.00 C ATOM 713 CD GLN B 321 -2.428 -17.069 4.566 1.00 0.00 C ATOM 714 OE1 GLN B 321 -2.895 -16.288 5.396 1.00 0.00 O ATOM 715 NE2 GLN B 321 -2.654 -18.378 4.613 1.00 0.00 N ATOM 0 H GLN B 321 -2.849 -16.628 0.026 1.00 0.00 H new ATOM 0 HA GLN B 321 -4.160 -16.583 2.673 1.00 0.00 H new ATOM 0 HB2 GLN B 321 -1.585 -15.275 1.739 1.00 0.00 H new ATOM 0 HB3 GLN B 321 -2.487 -14.680 3.118 1.00 0.00 H new ATOM 0 HG2 GLN B 321 -1.224 -17.418 2.831 1.00 0.00 H new ATOM 0 HG3 GLN B 321 -0.659 -16.104 3.844 1.00 0.00 H new ATOM 0 HE21 GLN B 321 -2.249 -18.991 3.906 1.00 0.00 H new ATOM 0 HE22 GLN B 321 -3.233 -18.769 5.356 1.00 0.00 H new ATOM 724 N PRO B 322 -5.649 -15.102 1.112 1.00 0.00 N ATOM 725 CA PRO B 322 -6.510 -14.045 0.593 1.00 0.00 C ATOM 726 C PRO B 322 -6.709 -12.950 1.633 1.00 0.00 C ATOM 727 O PRO B 322 -6.950 -11.794 1.293 1.00 0.00 O ATOM 728 CB PRO B 322 -7.843 -14.745 0.293 1.00 0.00 C ATOM 729 CG PRO B 322 -7.605 -16.206 0.500 1.00 0.00 C ATOM 730 CD PRO B 322 -6.392 -16.339 1.373 1.00 0.00 C ATOM 0 HA PRO B 322 -6.084 -13.563 -0.287 1.00 0.00 H new ATOM 0 HB2 PRO B 322 -8.630 -14.382 0.954 1.00 0.00 H new ATOM 0 HB3 PRO B 322 -8.166 -14.545 -0.728 1.00 0.00 H new ATOM 0 HG2 PRO B 322 -8.470 -16.674 0.970 1.00 0.00 H new ATOM 0 HG3 PRO B 322 -7.449 -16.709 -0.454 1.00 0.00 H new ATOM 0 HD2 PRO B 322 -6.662 -16.431 2.425 1.00 0.00 H new ATOM 0 HD3 PRO B 322 -5.806 -17.222 1.116 1.00 0.00 H new ATOM 738 N ASP B 323 -6.584 -13.334 2.906 1.00 0.00 N ATOM 739 CA ASP B 323 -6.728 -12.403 4.014 1.00 0.00 C ATOM 740 C ASP B 323 -5.579 -11.402 4.034 1.00 0.00 C ATOM 741 O ASP B 323 -5.765 -10.255 4.431 1.00 0.00 O ATOM 742 CB ASP B 323 -6.787 -13.158 5.344 1.00 0.00 C ATOM 743 CG ASP B 323 -7.948 -14.134 5.408 1.00 0.00 C ATOM 744 OD1 ASP B 323 -9.111 -13.685 5.323 1.00 0.00 O ATOM 745 OD2 ASP B 323 -7.693 -15.351 5.539 1.00 0.00 O ATOM 0 H ASP B 323 -6.382 -14.293 3.190 1.00 0.00 H new ATOM 0 HA ASP B 323 -7.661 -11.857 3.876 1.00 0.00 H new ATOM 0 HB2 ASP B 323 -5.853 -13.700 5.492 1.00 0.00 H new ATOM 0 HB3 ASP B 323 -6.873 -12.442 6.161 1.00 0.00 H new ATOM 750 N ILE B 324 -4.386 -11.842 3.612 1.00 0.00 N ATOM 751 CA ILE B 324 -3.220 -10.975 3.600 1.00 0.00 C ATOM 752 C ILE B 324 -3.297 -9.944 2.489 1.00 0.00 C ATOM 753 O ILE B 324 -3.140 -8.746 2.725 1.00 0.00 O ATOM 754 CB ILE B 324 -1.924 -11.762 3.432 1.00 0.00 C ATOM 755 CG1 ILE B 324 -1.808 -12.801 4.541 1.00 0.00 C ATOM 756 CG2 ILE B 324 -0.739 -10.796 3.433 1.00 0.00 C ATOM 757 CD1 ILE B 324 -0.585 -13.658 4.403 1.00 0.00 C ATOM 0 H ILE B 324 -4.212 -12.790 3.278 1.00 0.00 H new ATOM 0 HA ILE B 324 -3.216 -10.473 4.567 1.00 0.00 H new ATOM 0 HB ILE B 324 -1.926 -12.292 2.479 1.00 0.00 H new ATOM 0 HG12 ILE B 324 -1.786 -12.296 5.506 1.00 0.00 H new ATOM 0 HG13 ILE B 324 -2.694 -13.435 4.534 1.00 0.00 H new ATOM 0 HG21 ILE B 324 0.188 -11.357 3.313 1.00 0.00 H new ATOM 0 HG22 ILE B 324 -0.845 -10.090 2.610 1.00 0.00 H new ATOM 0 HG23 ILE B 324 -0.714 -10.252 4.377 1.00 0.00 H new ATOM 0 HD11 ILE B 324 -0.553 -14.380 5.219 1.00 0.00 H new ATOM 0 HD12 ILE B 324 -0.617 -14.188 3.451 1.00 0.00 H new ATOM 0 HD13 ILE B 324 0.305 -13.030 4.439 1.00 0.00 H new ATOM 769 N TYR B 325 -3.516 -10.428 1.275 1.00 0.00 N ATOM 770 CA TYR B 325 -3.591 -9.551 0.112 1.00 0.00 C ATOM 771 C TYR B 325 -4.724 -8.539 0.288 1.00 0.00 C ATOM 772 O TYR B 325 -4.530 -7.343 0.082 1.00 0.00 O ATOM 773 CB TYR B 325 -3.828 -10.378 -1.157 1.00 0.00 C ATOM 774 CG TYR B 325 -3.264 -9.761 -2.423 1.00 0.00 C ATOM 775 CD1 TYR B 325 -2.054 -9.070 -2.414 1.00 0.00 C ATOM 776 CD2 TYR B 325 -3.934 -9.893 -3.633 1.00 0.00 C ATOM 777 CE1 TYR B 325 -1.539 -8.524 -3.580 1.00 0.00 C ATOM 778 CE2 TYR B 325 -3.423 -9.353 -4.796 1.00 0.00 C ATOM 779 CZ TYR B 325 -2.228 -8.671 -4.766 1.00 0.00 C ATOM 780 OH TYR B 325 -1.712 -8.132 -5.925 1.00 0.00 O ATOM 0 H TYR B 325 -3.645 -11.419 1.068 1.00 0.00 H new ATOM 0 HA TYR B 325 -2.647 -9.015 0.017 1.00 0.00 H new ATOM 0 HB2 TYR B 325 -3.386 -11.365 -1.020 1.00 0.00 H new ATOM 0 HB3 TYR B 325 -4.900 -10.524 -1.285 1.00 0.00 H new ATOM 0 HD1 TYR B 325 -1.511 -8.958 -1.487 1.00 0.00 H new ATOM 0 HD2 TYR B 325 -4.872 -10.428 -3.664 1.00 0.00 H new ATOM 0 HE1 TYR B 325 -0.603 -7.986 -3.560 1.00 0.00 H new ATOM 0 HE2 TYR B 325 -3.959 -9.465 -5.727 1.00 0.00 H new ATOM 0 HH TYR B 325 -2.332 -8.296 -6.666 1.00 0.00 H new ATOM 790 N LYS B 326 -5.895 -9.024 0.698 1.00 0.00 N ATOM 791 CA LYS B 326 -7.044 -8.186 0.933 1.00 0.00 C ATOM 792 C LYS B 326 -6.779 -7.186 2.066 1.00 0.00 C ATOM 793 O LYS B 326 -7.019 -5.987 1.916 1.00 0.00 O ATOM 794 CB LYS B 326 -8.224 -9.096 1.260 1.00 0.00 C ATOM 795 CG LYS B 326 -9.361 -8.402 1.950 1.00 0.00 C ATOM 796 CD LYS B 326 -10.083 -7.426 1.031 1.00 0.00 C ATOM 797 CE LYS B 326 -10.665 -8.123 -0.193 1.00 0.00 C ATOM 798 NZ LYS B 326 -11.677 -9.157 0.171 1.00 0.00 N ATOM 0 H LYS B 326 -6.062 -10.015 0.874 1.00 0.00 H new ATOM 0 HA LYS B 326 -7.265 -7.594 0.045 1.00 0.00 H new ATOM 0 HB2 LYS B 326 -8.592 -9.542 0.336 1.00 0.00 H new ATOM 0 HB3 LYS B 326 -7.875 -9.913 1.891 1.00 0.00 H new ATOM 0 HG2 LYS B 326 -10.069 -9.145 2.316 1.00 0.00 H new ATOM 0 HG3 LYS B 326 -8.983 -7.866 2.821 1.00 0.00 H new ATOM 0 HD2 LYS B 326 -10.883 -6.932 1.582 1.00 0.00 H new ATOM 0 HD3 LYS B 326 -9.390 -6.648 0.711 1.00 0.00 H new ATOM 0 HE2 LYS B 326 -11.125 -7.381 -0.846 1.00 0.00 H new ATOM 0 HE3 LYS B 326 -9.859 -8.590 -0.760 1.00 0.00 H new ATOM 0 HZ1 LYS B 326 -12.141 -9.507 -0.691 1.00 0.00 H new ATOM 0 HZ2 LYS B 326 -11.207 -9.947 0.656 1.00 0.00 H new ATOM 0 HZ3 LYS B 326 -12.390 -8.738 0.802 1.00 0.00 H new ATOM 812 N ALA B 327 -6.290 -7.700 3.200 1.00 0.00 N ATOM 813 CA ALA B 327 -5.995 -6.874 4.373 1.00 0.00 C ATOM 814 C ALA B 327 -4.986 -5.772 4.064 1.00 0.00 C ATOM 815 O ALA B 327 -5.274 -4.594 4.260 1.00 0.00 O ATOM 816 CB ALA B 327 -5.477 -7.740 5.512 1.00 0.00 C ATOM 0 H ALA B 327 -6.089 -8.692 3.329 1.00 0.00 H new ATOM 0 HA ALA B 327 -6.928 -6.395 4.670 1.00 0.00 H new ATOM 0 HB1 ALA B 327 -5.262 -7.113 6.377 1.00 0.00 H new ATOM 0 HB2 ALA B 327 -6.232 -8.480 5.779 1.00 0.00 H new ATOM 0 HB3 ALA B 327 -4.566 -8.249 5.197 1.00 0.00 H new ATOM 822 N PHE B 328 -3.802 -6.165 3.584 1.00 0.00 N ATOM 823 CA PHE B 328 -2.741 -5.209 3.259 1.00 0.00 C ATOM 824 C PHE B 328 -3.263 -4.102 2.349 1.00 0.00 C ATOM 825 O PHE B 328 -2.987 -2.926 2.580 1.00 0.00 O ATOM 826 CB PHE B 328 -1.562 -5.936 2.600 1.00 0.00 C ATOM 827 CG PHE B 328 -0.433 -5.036 2.176 1.00 0.00 C ATOM 828 CD1 PHE B 328 -0.512 -4.300 1.004 1.00 0.00 C ATOM 829 CD2 PHE B 328 0.706 -4.927 2.952 1.00 0.00 C ATOM 830 CE1 PHE B 328 0.530 -3.476 0.617 1.00 0.00 C ATOM 831 CE2 PHE B 328 1.747 -4.104 2.573 1.00 0.00 C ATOM 832 CZ PHE B 328 1.661 -3.379 1.403 1.00 0.00 C ATOM 0 H PHE B 328 -3.555 -7.140 3.412 1.00 0.00 H new ATOM 0 HA PHE B 328 -2.398 -4.748 4.185 1.00 0.00 H new ATOM 0 HB2 PHE B 328 -1.175 -6.680 3.296 1.00 0.00 H new ATOM 0 HB3 PHE B 328 -1.927 -6.476 1.727 1.00 0.00 H new ATOM 0 HD1 PHE B 328 -1.396 -4.370 0.387 1.00 0.00 H new ATOM 0 HD2 PHE B 328 0.782 -5.494 3.868 1.00 0.00 H new ATOM 0 HE1 PHE B 328 0.459 -2.909 -0.299 1.00 0.00 H new ATOM 0 HE2 PHE B 328 2.628 -4.028 3.192 1.00 0.00 H new ATOM 0 HZ PHE B 328 2.476 -2.737 1.102 1.00 0.00 H new ATOM 842 N LEU B 329 -4.023 -4.484 1.327 1.00 0.00 N ATOM 843 CA LEU B 329 -4.587 -3.508 0.394 1.00 0.00 C ATOM 844 C LEU B 329 -5.505 -2.518 1.115 1.00 0.00 C ATOM 845 O LEU B 329 -5.307 -1.306 1.022 1.00 0.00 O ATOM 846 CB LEU B 329 -5.336 -4.201 -0.748 1.00 0.00 C ATOM 847 CG LEU B 329 -4.451 -4.986 -1.724 1.00 0.00 C ATOM 848 CD1 LEU B 329 -5.294 -5.616 -2.822 1.00 0.00 C ATOM 849 CD2 LEU B 329 -3.377 -4.085 -2.322 1.00 0.00 C ATOM 0 H LEU B 329 -4.262 -5.454 1.123 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.755 -2.949 -0.035 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -6.071 -4.883 -0.319 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -5.889 -3.448 -1.309 1.00 0.00 H new ATOM 0 HG LEU B 329 -3.957 -5.784 -1.170 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -4.648 -6.169 -3.505 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -6.020 -6.297 -2.378 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -5.819 -4.834 -3.372 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -2.761 -4.662 -3.011 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -3.850 -3.263 -2.859 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -2.752 -3.685 -1.524 1.00 0.00 H new ATOM 861 N GLU B 330 -6.500 -3.039 1.842 1.00 0.00 N ATOM 862 CA GLU B 330 -7.438 -2.190 2.586 1.00 0.00 C ATOM 863 C GLU B 330 -6.703 -1.265 3.555 1.00 0.00 C ATOM 864 O GLU B 330 -7.123 -0.131 3.774 1.00 0.00 O ATOM 865 CB GLU B 330 -8.445 -3.043 3.365 1.00 0.00 C ATOM 866 CG GLU B 330 -9.462 -3.755 2.485 1.00 0.00 C ATOM 867 CD GLU B 330 -10.503 -4.533 3.278 1.00 0.00 C ATOM 868 OE1 GLU B 330 -10.364 -4.638 4.519 1.00 0.00 O ATOM 869 OE2 GLU B 330 -11.456 -5.045 2.658 1.00 0.00 O ATOM 0 H GLU B 330 -6.676 -4.040 1.931 1.00 0.00 H new ATOM 0 HA GLU B 330 -7.970 -1.581 1.855 1.00 0.00 H new ATOM 0 HB2 GLU B 330 -7.902 -3.786 3.949 1.00 0.00 H new ATOM 0 HB3 GLU B 330 -8.975 -2.406 4.073 1.00 0.00 H new ATOM 0 HG2 GLU B 330 -9.967 -3.020 1.858 1.00 0.00 H new ATOM 0 HG3 GLU B 330 -8.939 -4.439 1.817 1.00 0.00 H new ATOM 876 N ILE B 331 -5.598 -1.757 4.122 1.00 0.00 N ATOM 877 CA ILE B 331 -4.793 -0.976 5.055 1.00 0.00 C ATOM 878 C ILE B 331 -4.302 0.306 4.393 1.00 0.00 C ATOM 879 O ILE B 331 -4.501 1.405 4.913 1.00 0.00 O ATOM 880 CB ILE B 331 -3.598 -1.805 5.554 1.00 0.00 C ATOM 881 CG1 ILE B 331 -4.097 -2.938 6.447 1.00 0.00 C ATOM 882 CG2 ILE B 331 -2.595 -0.937 6.297 1.00 0.00 C ATOM 883 CD1 ILE B 331 -3.036 -3.955 6.770 1.00 0.00 C ATOM 0 H ILE B 331 -5.242 -2.697 3.948 1.00 0.00 H new ATOM 0 HA ILE B 331 -5.417 -0.710 5.909 1.00 0.00 H new ATOM 0 HB ILE B 331 -3.086 -2.229 4.690 1.00 0.00 H new ATOM 0 HG12 ILE B 331 -4.481 -2.516 7.376 1.00 0.00 H new ATOM 0 HG13 ILE B 331 -4.931 -3.438 5.955 1.00 0.00 H new ATOM 0 HG21 ILE B 331 -1.762 -1.553 6.637 1.00 0.00 H new ATOM 0 HG22 ILE B 331 -2.223 -0.159 5.630 1.00 0.00 H new ATOM 0 HG23 ILE B 331 -3.080 -0.476 7.157 1.00 0.00 H new ATOM 0 HD11 ILE B 331 -3.458 -4.732 7.408 1.00 0.00 H new ATOM 0 HD12 ILE B 331 -2.669 -4.403 5.847 1.00 0.00 H new ATOM 0 HD13 ILE B 331 -2.211 -3.468 7.290 1.00 0.00 H new ATOM 895 N LEU B 332 -3.685 0.147 3.225 1.00 0.00 N ATOM 896 CA LEU B 332 -3.188 1.282 2.453 1.00 0.00 C ATOM 897 C LEU B 332 -4.354 2.168 2.040 1.00 0.00 C ATOM 898 O LEU B 332 -4.319 3.387 2.201 1.00 0.00 O ATOM 899 CB LEU B 332 -2.465 0.794 1.199 1.00 0.00 C ATOM 900 CG LEU B 332 -1.537 -0.402 1.395 1.00 0.00 C ATOM 901 CD1 LEU B 332 -0.967 -0.845 0.063 1.00 0.00 C ATOM 902 CD2 LEU B 332 -0.431 -0.065 2.377 1.00 0.00 C ATOM 0 H LEU B 332 -3.517 -0.761 2.791 1.00 0.00 H new ATOM 0 HA LEU B 332 -2.492 1.848 3.072 1.00 0.00 H new ATOM 0 HB2 LEU B 332 -3.212 0.532 0.450 1.00 0.00 H new ATOM 0 HB3 LEU B 332 -1.882 1.621 0.793 1.00 0.00 H new ATOM 0 HG LEU B 332 -2.113 -1.228 1.812 1.00 0.00 H new ATOM 0 HD11 LEU B 332 -0.307 -1.699 0.216 1.00 0.00 H new ATOM 0 HD12 LEU B 332 -1.780 -1.130 -0.604 1.00 0.00 H new ATOM 0 HD13 LEU B 332 -0.403 -0.025 -0.382 1.00 0.00 H new ATOM 0 HD21 LEU B 332 0.220 -0.930 2.503 1.00 0.00 H new ATOM 0 HD22 LEU B 332 0.151 0.774 1.996 1.00 0.00 H new ATOM 0 HD23 LEU B 332 -0.868 0.204 3.339 1.00 0.00 H new ATOM 914 N HIS B 333 -5.391 1.524 1.502 1.00 0.00 N ATOM 915 CA HIS B 333 -6.598 2.222 1.051 1.00 0.00 C ATOM 916 C HIS B 333 -7.196 3.091 2.161 1.00 0.00 C ATOM 917 O HIS B 333 -7.700 4.181 1.886 1.00 0.00 O ATOM 918 CB HIS B 333 -7.650 1.219 0.561 1.00 0.00 C ATOM 919 CG HIS B 333 -7.357 0.640 -0.788 1.00 0.00 C ATOM 920 ND1 HIS B 333 -7.255 1.403 -1.931 1.00 0.00 N ATOM 921 CD2 HIS B 333 -7.148 -0.640 -1.175 1.00 0.00 C ATOM 922 CE1 HIS B 333 -6.998 0.619 -2.963 1.00 0.00 C ATOM 923 NE2 HIS B 333 -6.926 -0.626 -2.529 1.00 0.00 N ATOM 0 H HIS B 333 -5.420 0.513 1.367 1.00 0.00 H new ATOM 0 HA HIS B 333 -6.306 2.872 0.227 1.00 0.00 H new ATOM 0 HB2 HIS B 333 -7.728 0.407 1.284 1.00 0.00 H new ATOM 0 HB3 HIS B 333 -8.621 1.713 0.530 1.00 0.00 H new ATOM 0 HD2 HIS B 333 -7.155 -1.511 -0.536 1.00 0.00 H new ATOM 0 HE1 HIS B 333 -6.869 0.941 -3.986 1.00 0.00 H new ATOM 0 HE2 HIS B 333 -6.736 -1.445 -3.107 1.00 0.00 H new ATOM 932 N THR B 334 -7.123 2.624 3.414 1.00 0.00 N ATOM 933 CA THR B 334 -7.646 3.393 4.545 1.00 0.00 C ATOM 934 C THR B 334 -6.906 4.727 4.624 1.00 0.00 C ATOM 935 O THR B 334 -7.516 5.772 4.824 1.00 0.00 O ATOM 936 CB THR B 334 -7.490 2.609 5.862 1.00 0.00 C ATOM 937 OG1 THR B 334 -8.122 1.345 5.769 1.00 0.00 O ATOM 938 CG2 THR B 334 -8.077 3.316 7.072 1.00 0.00 C ATOM 0 H THR B 334 -6.711 1.726 3.667 1.00 0.00 H new ATOM 0 HA THR B 334 -8.710 3.574 4.394 1.00 0.00 H new ATOM 0 HB THR B 334 -6.414 2.515 6.005 1.00 0.00 H new ATOM 0 HG1 THR B 334 -7.612 0.768 5.163 1.00 0.00 H new ATOM 0 HG21 THR B 334 -7.928 2.702 7.960 1.00 0.00 H new ATOM 0 HG22 THR B 334 -7.581 4.277 7.208 1.00 0.00 H new ATOM 0 HG23 THR B 334 -9.144 3.477 6.917 1.00 0.00 H new ATOM 946 N TYR B 335 -5.589 4.673 4.425 1.00 0.00 N ATOM 947 CA TYR B 335 -4.743 5.864 4.433 1.00 0.00 C ATOM 948 C TYR B 335 -5.207 6.869 3.379 1.00 0.00 C ATOM 949 O TYR B 335 -5.525 8.010 3.708 1.00 0.00 O ATOM 950 CB TYR B 335 -3.288 5.447 4.186 1.00 0.00 C ATOM 951 CG TYR B 335 -2.307 6.591 4.048 1.00 0.00 C ATOM 952 CD1 TYR B 335 -2.280 7.376 2.904 1.00 0.00 C ATOM 953 CD2 TYR B 335 -1.400 6.875 5.059 1.00 0.00 C ATOM 954 CE1 TYR B 335 -1.379 8.411 2.773 1.00 0.00 C ATOM 955 CE2 TYR B 335 -0.495 7.909 4.938 1.00 0.00 C ATOM 956 CZ TYR B 335 -0.487 8.674 3.790 1.00 0.00 C ATOM 957 OH TYR B 335 0.413 9.707 3.661 1.00 0.00 O ATOM 0 H TYR B 335 -5.081 3.805 4.254 1.00 0.00 H new ATOM 0 HA TYR B 335 -4.818 6.352 5.405 1.00 0.00 H new ATOM 0 HB2 TYR B 335 -2.965 4.809 5.008 1.00 0.00 H new ATOM 0 HB3 TYR B 335 -3.248 4.843 3.279 1.00 0.00 H new ATOM 0 HD1 TYR B 335 -2.976 7.173 2.104 1.00 0.00 H new ATOM 0 HD2 TYR B 335 -1.403 6.275 5.957 1.00 0.00 H new ATOM 0 HE1 TYR B 335 -1.372 9.014 1.877 1.00 0.00 H new ATOM 0 HE2 TYR B 335 0.202 8.118 5.736 1.00 0.00 H new ATOM 0 HH TYR B 335 1.161 9.568 4.279 1.00 0.00 H new ATOM 967 N GLN B 336 -5.229 6.436 2.116 1.00 0.00 N ATOM 968 CA GLN B 336 -5.627 7.282 0.994 1.00 0.00 C ATOM 969 C GLN B 336 -6.965 7.992 1.222 1.00 0.00 C ATOM 970 O GLN B 336 -7.079 9.196 0.982 1.00 0.00 O ATOM 971 CB GLN B 336 -5.713 6.431 -0.274 1.00 0.00 C ATOM 972 CG GLN B 336 -5.249 7.161 -1.513 1.00 0.00 C ATOM 973 CD GLN B 336 -6.144 8.332 -1.874 1.00 0.00 C ATOM 974 OE1 GLN B 336 -5.640 9.545 -1.681 1.00 0.00 O flip ATOM 975 NE2 GLN B 336 -7.283 8.148 -2.304 1.00 0.00 N flip ATOM 0 H GLN B 336 -4.971 5.487 1.845 1.00 0.00 H new ATOM 0 HA GLN B 336 -4.868 8.058 0.892 1.00 0.00 H new ATOM 0 HB2 GLN B 336 -5.110 5.532 -0.142 1.00 0.00 H new ATOM 0 HB3 GLN B 336 -6.744 6.106 -0.416 1.00 0.00 H new ATOM 0 HG2 GLN B 336 -4.232 7.521 -1.358 1.00 0.00 H new ATOM 0 HG3 GLN B 336 -5.216 6.463 -2.350 1.00 0.00 H new ATOM 0 HE21 GLN B 336 -7.631 7.198 -2.437 1.00 0.00 H new ATOM 0 HE22 GLN B 336 -7.879 8.945 -2.527 1.00 0.00 H new ATOM 984 N LYS B 337 -7.974 7.245 1.667 1.00 0.00 N ATOM 985 CA LYS B 337 -9.306 7.809 1.901 1.00 0.00 C ATOM 986 C LYS B 337 -9.277 8.951 2.914 1.00 0.00 C ATOM 987 O LYS B 337 -9.782 10.038 2.644 1.00 0.00 O ATOM 988 CB LYS B 337 -10.265 6.722 2.392 1.00 0.00 C ATOM 989 CG LYS B 337 -10.504 5.612 1.383 1.00 0.00 C ATOM 990 CD LYS B 337 -11.451 4.558 1.932 1.00 0.00 C ATOM 991 CE LYS B 337 -10.880 3.880 3.170 1.00 0.00 C ATOM 992 NZ LYS B 337 -11.803 2.849 3.725 1.00 0.00 N ATOM 0 H LYS B 337 -7.897 6.249 1.873 1.00 0.00 H new ATOM 0 HA LYS B 337 -9.654 8.210 0.949 1.00 0.00 H new ATOM 0 HB2 LYS B 337 -9.867 6.287 3.309 1.00 0.00 H new ATOM 0 HB3 LYS B 337 -11.220 7.181 2.646 1.00 0.00 H new ATOM 0 HG2 LYS B 337 -10.918 6.034 0.467 1.00 0.00 H new ATOM 0 HG3 LYS B 337 -9.554 5.148 1.119 1.00 0.00 H new ATOM 0 HD2 LYS B 337 -12.407 5.020 2.178 1.00 0.00 H new ATOM 0 HD3 LYS B 337 -11.647 3.809 1.164 1.00 0.00 H new ATOM 0 HE2 LYS B 337 -9.927 3.415 2.920 1.00 0.00 H new ATOM 0 HE3 LYS B 337 -10.677 4.632 3.933 1.00 0.00 H new ATOM 0 HZ1 LYS B 337 -11.373 2.414 4.566 1.00 0.00 H new ATOM 0 HZ2 LYS B 337 -12.704 3.296 3.989 1.00 0.00 H new ATOM 0 HZ3 LYS B 337 -11.977 2.116 3.008 1.00 0.00 H new ATOM 1006 N GLU B 338 -8.699 8.690 4.084 1.00 0.00 N ATOM 1007 CA GLU B 338 -8.625 9.688 5.155 1.00 0.00 C ATOM 1008 C GLU B 338 -7.940 10.984 4.699 1.00 0.00 C ATOM 1009 O GLU B 338 -8.317 12.067 5.147 1.00 0.00 O ATOM 1010 CB GLU B 338 -7.895 9.101 6.372 1.00 0.00 C ATOM 1011 CG GLU B 338 -8.459 7.764 6.843 1.00 0.00 C ATOM 1012 CD GLU B 338 -9.904 7.833 7.315 1.00 0.00 C ATOM 1013 OE1 GLU B 338 -10.408 8.950 7.543 1.00 0.00 O ATOM 1014 OE2 GLU B 338 -10.520 6.760 7.479 1.00 0.00 O ATOM 0 H GLU B 338 -8.273 7.793 4.318 1.00 0.00 H new ATOM 0 HA GLU B 338 -9.648 9.945 5.431 1.00 0.00 H new ATOM 0 HB2 GLU B 338 -6.841 8.973 6.125 1.00 0.00 H new ATOM 0 HB3 GLU B 338 -7.945 9.816 7.194 1.00 0.00 H new ATOM 0 HG2 GLU B 338 -8.388 7.044 6.028 1.00 0.00 H new ATOM 0 HG3 GLU B 338 -7.840 7.386 7.657 1.00 0.00 H new ATOM 1021 N GLN B 339 -6.944 10.877 3.810 1.00 0.00 N ATOM 1022 CA GLN B 339 -6.235 12.065 3.312 1.00 0.00 C ATOM 1023 C GLN B 339 -7.196 12.966 2.546 1.00 0.00 C ATOM 1024 O GLN B 339 -7.343 14.149 2.863 1.00 0.00 O ATOM 1025 CB GLN B 339 -5.066 11.685 2.393 1.00 0.00 C ATOM 1026 CG GLN B 339 -4.179 10.573 2.930 1.00 0.00 C ATOM 1027 CD GLN B 339 -3.545 10.872 4.286 1.00 0.00 C ATOM 1028 OE1 GLN B 339 -3.490 12.146 4.678 1.00 0.00 O flip ATOM 1029 NE2 GLN B 339 -3.079 9.959 4.968 1.00 0.00 N flip ATOM 0 H GLN B 339 -6.613 9.993 3.424 1.00 0.00 H new ATOM 0 HA GLN B 339 -5.836 12.592 4.178 1.00 0.00 H new ATOM 0 HB2 GLN B 339 -5.465 11.379 1.426 1.00 0.00 H new ATOM 0 HB3 GLN B 339 -4.454 12.570 2.220 1.00 0.00 H new ATOM 0 HG2 GLN B 339 -4.770 9.661 3.012 1.00 0.00 H new ATOM 0 HG3 GLN B 339 -3.387 10.376 2.208 1.00 0.00 H new ATOM 0 HE21 GLN B 339 -3.138 8.995 4.639 1.00 0.00 H new ATOM 0 HE22 GLN B 339 -2.634 10.166 5.862 1.00 0.00 H new ATOM 1038 N ARG B 340 -7.848 12.390 1.536 1.00 0.00 N ATOM 1039 CA ARG B 340 -8.806 13.124 0.710 1.00 0.00 C ATOM 1040 C ARG B 340 -9.999 13.603 1.533 1.00 0.00 C ATOM 1041 O ARG B 340 -10.457 14.734 1.372 1.00 0.00 O ATOM 1042 CB ARG B 340 -9.283 12.257 -0.447 1.00 0.00 C ATOM 1043 CG ARG B 340 -8.209 12.047 -1.494 1.00 0.00 C ATOM 1044 CD ARG B 340 -8.731 11.255 -2.670 1.00 0.00 C ATOM 1045 NE ARG B 340 -9.768 11.975 -3.414 1.00 0.00 N ATOM 1046 CZ ARG B 340 -10.381 11.494 -4.498 1.00 0.00 C ATOM 1047 NH1 ARG B 340 -10.070 10.290 -4.973 1.00 0.00 N ATOM 1048 NH2 ARG B 340 -11.310 12.219 -5.111 1.00 0.00 N ATOM 0 H ARG B 340 -7.729 11.413 1.270 1.00 0.00 H new ATOM 0 HA ARG B 340 -8.297 14.001 0.312 1.00 0.00 H new ATOM 0 HB2 ARG B 340 -9.606 11.289 -0.063 1.00 0.00 H new ATOM 0 HB3 ARG B 340 -10.153 12.722 -0.911 1.00 0.00 H new ATOM 0 HG2 ARG B 340 -7.842 13.013 -1.839 1.00 0.00 H new ATOM 0 HG3 ARG B 340 -7.362 11.524 -1.049 1.00 0.00 H new ATOM 0 HD2 ARG B 340 -7.905 11.019 -3.341 1.00 0.00 H new ATOM 0 HD3 ARG B 340 -9.135 10.307 -2.315 1.00 0.00 H new ATOM 0 HE ARG B 340 -10.038 12.901 -3.083 1.00 0.00 H new ATOM 0 HH11 ARG B 340 -9.358 9.727 -4.508 1.00 0.00 H new ATOM 0 HH12 ARG B 340 -10.544 9.931 -5.802 1.00 0.00 H new ATOM 0 HH21 ARG B 340 -11.554 13.142 -4.753 1.00 0.00 H new ATOM 0 HH22 ARG B 340 -11.779 11.852 -5.939 1.00 0.00 H new ATOM 1062 N ASN B 341 -10.489 12.737 2.422 1.00 0.00 N ATOM 1063 CA ASN B 341 -11.626 13.058 3.283 1.00 0.00 C ATOM 1064 C ASN B 341 -11.377 14.329 4.097 1.00 0.00 C ATOM 1065 O ASN B 341 -12.191 15.254 4.073 1.00 0.00 O ATOM 1066 CB ASN B 341 -11.923 11.879 4.215 1.00 0.00 C ATOM 1067 CG ASN B 341 -12.775 10.809 3.550 1.00 0.00 C ATOM 1068 OD1 ASN B 341 -13.916 10.500 4.155 1.00 0.00 O flip ATOM 1069 ND2 ASN B 341 -12.412 10.268 2.505 1.00 0.00 N flip ATOM 0 H ASN B 341 -10.111 11.800 2.564 1.00 0.00 H new ATOM 0 HA ASN B 341 -12.490 13.241 2.645 1.00 0.00 H new ATOM 0 HB2 ASN B 341 -10.983 11.437 4.546 1.00 0.00 H new ATOM 0 HB3 ASN B 341 -12.435 12.244 5.106 1.00 0.00 H new ATOM 0 HD21 ASN B 341 -11.528 10.535 2.073 1.00 0.00 H new ATOM 0 HD22 ASN B 341 -12.996 9.553 2.072 1.00 0.00 H new ATOM 1076 N ALA B 342 -10.250 14.371 4.812 1.00 0.00 N ATOM 1077 CA ALA B 342 -9.892 15.532 5.629 1.00 0.00 C ATOM 1078 C ALA B 342 -9.881 16.826 4.811 1.00 0.00 C ATOM 1079 O ALA B 342 -10.268 17.881 5.310 1.00 0.00 O ATOM 1080 CB ALA B 342 -8.542 15.318 6.294 1.00 0.00 C ATOM 0 H ALA B 342 -9.569 13.612 4.841 1.00 0.00 H new ATOM 0 HA ALA B 342 -10.657 15.636 6.399 1.00 0.00 H new ATOM 0 HB1 ALA B 342 -8.291 16.190 6.897 1.00 0.00 H new ATOM 0 HB2 ALA B 342 -8.587 14.436 6.933 1.00 0.00 H new ATOM 0 HB3 ALA B 342 -7.779 15.174 5.529 1.00 0.00 H new ATOM 1086 N LYS B 343 -9.431 16.736 3.558 1.00 0.00 N ATOM 1087 CA LYS B 343 -9.368 17.904 2.677 1.00 0.00 C ATOM 1088 C LYS B 343 -10.767 18.349 2.242 1.00 0.00 C ATOM 1089 O LYS B 343 -11.069 19.544 2.242 1.00 0.00 O ATOM 1090 CB LYS B 343 -8.512 17.594 1.445 1.00 0.00 C ATOM 1091 CG LYS B 343 -8.369 18.772 0.491 1.00 0.00 C ATOM 1092 CD LYS B 343 -7.506 18.419 -0.709 1.00 0.00 C ATOM 1093 CE LYS B 343 -7.344 19.606 -1.645 1.00 0.00 C ATOM 1094 NZ LYS B 343 -6.499 19.274 -2.827 1.00 0.00 N ATOM 0 H LYS B 343 -9.106 15.869 3.131 1.00 0.00 H new ATOM 0 HA LYS B 343 -8.910 18.720 3.237 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -7.521 17.279 1.771 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -8.953 16.754 0.908 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -9.355 19.087 0.150 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -7.929 19.618 1.020 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -6.526 18.086 -0.368 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -7.955 17.586 -1.250 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -8.326 19.938 -1.983 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -6.896 20.438 -1.101 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -6.414 20.111 -3.439 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -5.554 18.982 -2.507 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -6.939 18.498 -3.361 1.00 0.00 H new ATOM 1108 N GLU B 344 -11.610 17.384 1.869 1.00 0.00 N ATOM 1109 CA GLU B 344 -12.977 17.675 1.425 1.00 0.00 C ATOM 1110 C GLU B 344 -13.743 18.496 2.464 1.00 0.00 C ATOM 1111 O GLU B 344 -14.379 19.496 2.124 1.00 0.00 O ATOM 1112 CB GLU B 344 -13.738 16.376 1.129 1.00 0.00 C ATOM 1113 CG GLU B 344 -13.144 15.552 -0.010 1.00 0.00 C ATOM 1114 CD GLU B 344 -13.230 16.233 -1.372 1.00 0.00 C ATOM 1115 OE1 GLU B 344 -13.828 17.328 -1.468 1.00 0.00 O ATOM 1116 OE2 GLU B 344 -12.702 15.660 -2.348 1.00 0.00 O ATOM 0 H GLU B 344 -11.371 16.392 1.865 1.00 0.00 H new ATOM 0 HA GLU B 344 -12.902 18.264 0.511 1.00 0.00 H new ATOM 0 HB2 GLU B 344 -13.759 15.766 2.032 1.00 0.00 H new ATOM 0 HB3 GLU B 344 -14.772 16.621 0.885 1.00 0.00 H new ATOM 0 HG2 GLU B 344 -12.099 15.340 0.214 1.00 0.00 H new ATOM 0 HG3 GLU B 344 -13.660 14.593 -0.060 1.00 0.00 H new ATOM 1123 N ALA B 345 -13.681 18.070 3.727 1.00 0.00 N ATOM 1124 CA ALA B 345 -14.375 18.771 4.808 1.00 0.00 C ATOM 1125 C ALA B 345 -13.574 19.979 5.298 1.00 0.00 C ATOM 1126 O ALA B 345 -14.136 21.054 5.511 1.00 0.00 O ATOM 1127 CB ALA B 345 -14.652 17.818 5.962 1.00 0.00 C ATOM 0 H ALA B 345 -13.159 17.246 4.025 1.00 0.00 H new ATOM 0 HA ALA B 345 -15.323 19.138 4.413 1.00 0.00 H new ATOM 0 HB1 ALA B 345 -15.169 18.352 6.759 1.00 0.00 H new ATOM 0 HB2 ALA B 345 -15.276 16.995 5.613 1.00 0.00 H new ATOM 0 HB3 ALA B 345 -13.710 17.423 6.342 1.00 0.00 H new ATOM 1133 N GLY B 346 -12.263 19.792 5.469 1.00 0.00 N ATOM 1134 CA GLY B 346 -11.400 20.870 5.930 1.00 0.00 C ATOM 1135 C GLY B 346 -11.873 21.492 7.234 1.00 0.00 C ATOM 1136 O GLY B 346 -12.059 22.709 7.310 1.00 0.00 O ATOM 0 H GLY B 346 -11.783 18.909 5.295 1.00 0.00 H new ATOM 0 HA2 GLY B 346 -10.388 20.487 6.062 1.00 0.00 H new ATOM 0 HA3 GLY B 346 -11.350 21.642 5.162 1.00 0.00 H new ATOM 1140 N GLY B 347 -12.070 20.661 8.257 1.00 0.00 N ATOM 1141 CA GLY B 347 -12.525 21.159 9.547 1.00 0.00 C ATOM 1142 C GLY B 347 -12.146 20.245 10.699 1.00 0.00 C ATOM 1143 O GLY B 347 -10.996 19.817 10.807 1.00 0.00 O ATOM 0 H GLY B 347 -11.923 19.653 8.216 1.00 0.00 H new ATOM 0 HA2 GLY B 347 -12.101 22.148 9.719 1.00 0.00 H new ATOM 0 HA3 GLY B 347 -13.608 21.277 9.524 1.00 0.00 H new ATOM 1147 N ASN B 348 -13.121 19.945 11.562 1.00 0.00 N ATOM 1148 CA ASN B 348 -12.895 19.073 12.721 1.00 0.00 C ATOM 1149 C ASN B 348 -12.993 17.586 12.349 1.00 0.00 C ATOM 1150 O ASN B 348 -13.309 16.750 13.201 1.00 0.00 O ATOM 1151 CB ASN B 348 -13.905 19.398 13.833 1.00 0.00 C ATOM 1152 CG ASN B 348 -13.756 20.801 14.420 1.00 0.00 C ATOM 1153 OD1 ASN B 348 -12.700 21.526 14.046 1.00 0.00 O flip ATOM 1154 ND2 ASN B 348 -14.586 21.225 15.224 1.00 0.00 N flip ATOM 0 H ASN B 348 -14.076 20.293 11.481 1.00 0.00 H new ATOM 0 HA ASN B 348 -11.882 19.261 13.078 1.00 0.00 H new ATOM 0 HB2 ASN B 348 -14.914 19.287 13.436 1.00 0.00 H new ATOM 0 HB3 ASN B 348 -13.795 18.667 14.634 1.00 0.00 H new ATOM 0 HD21 ASN B 348 -15.382 20.645 15.489 1.00 0.00 H new ATOM 0 HD22 ASN B 348 -14.478 22.156 15.625 1.00 0.00 H new ATOM 1161 N TYR B 349 -12.720 17.254 11.084 1.00 0.00 N ATOM 1162 CA TYR B 349 -12.780 15.870 10.625 1.00 0.00 C ATOM 1163 C TYR B 349 -11.542 15.087 11.055 1.00 0.00 C ATOM 1164 O TYR B 349 -11.642 14.145 11.839 1.00 0.00 O ATOM 1165 CB TYR B 349 -12.904 15.816 9.099 1.00 0.00 C ATOM 1166 CG TYR B 349 -12.785 14.415 8.535 1.00 0.00 C ATOM 1167 CD1 TYR B 349 -13.859 13.537 8.571 1.00 0.00 C ATOM 1168 CD2 TYR B 349 -11.587 13.967 7.987 1.00 0.00 C ATOM 1169 CE1 TYR B 349 -13.747 12.254 8.074 1.00 0.00 C ATOM 1170 CE2 TYR B 349 -11.465 12.688 7.486 1.00 0.00 C ATOM 1171 CZ TYR B 349 -12.552 11.832 7.531 1.00 0.00 C ATOM 1172 OH TYR B 349 -12.450 10.553 7.033 1.00 0.00 O ATOM 0 H TYR B 349 -12.456 17.926 10.363 1.00 0.00 H new ATOM 0 HA TYR B 349 -13.659 15.414 11.081 1.00 0.00 H new ATOM 0 HB2 TYR B 349 -13.865 16.238 8.805 1.00 0.00 H new ATOM 0 HB3 TYR B 349 -12.131 16.445 8.657 1.00 0.00 H new ATOM 0 HD1 TYR B 349 -14.798 13.863 8.995 1.00 0.00 H new ATOM 0 HD2 TYR B 349 -10.737 14.633 7.953 1.00 0.00 H new ATOM 0 HE1 TYR B 349 -14.593 11.583 8.110 1.00 0.00 H new ATOM 0 HE2 TYR B 349 -10.529 12.357 7.062 1.00 0.00 H new ATOM 0 HH TYR B 349 -11.747 10.069 7.515 1.00 0.00 H new ATOM 1182 N THR B 350 -10.389 15.479 10.500 1.00 0.00 N ATOM 1183 CA THR B 350 -9.103 14.829 10.758 1.00 0.00 C ATOM 1184 C THR B 350 -9.126 13.384 10.245 1.00 0.00 C ATOM 1185 O THR B 350 -10.078 12.638 10.483 1.00 0.00 O ATOM 1186 CB THR B 350 -8.715 14.887 12.243 1.00 0.00 C ATOM 1187 OG1 THR B 350 -7.306 14.964 12.377 1.00 0.00 O ATOM 1188 CG2 THR B 350 -9.141 13.674 13.020 1.00 0.00 C ATOM 0 H THR B 350 -10.324 16.265 9.853 1.00 0.00 H new ATOM 0 HA THR B 350 -8.337 15.380 10.213 1.00 0.00 H new ATOM 0 HB THR B 350 -9.224 15.766 12.638 1.00 0.00 H new ATOM 0 HG1 THR B 350 -7.069 15.002 13.327 1.00 0.00 H new ATOM 0 HG21 THR B 350 -8.835 13.782 14.060 1.00 0.00 H new ATOM 0 HG22 THR B 350 -10.225 13.572 12.969 1.00 0.00 H new ATOM 0 HG23 THR B 350 -8.673 12.786 12.595 1.00 0.00 H new ATOM 1196 N PRO B 351 -8.081 12.974 9.508 1.00 0.00 N ATOM 1197 CA PRO B 351 -7.984 11.627 8.938 1.00 0.00 C ATOM 1198 C PRO B 351 -7.786 10.548 9.998 1.00 0.00 C ATOM 1199 O PRO B 351 -7.059 10.743 10.974 1.00 0.00 O ATOM 1200 CB PRO B 351 -6.757 11.705 8.018 1.00 0.00 C ATOM 1201 CG PRO B 351 -6.473 13.159 7.870 1.00 0.00 C ATOM 1202 CD PRO B 351 -6.919 13.791 9.153 1.00 0.00 C ATOM 0 HA PRO B 351 -8.903 11.348 8.422 1.00 0.00 H new ATOM 0 HB2 PRO B 351 -5.906 11.179 8.451 1.00 0.00 H new ATOM 0 HB3 PRO B 351 -6.959 11.243 7.052 1.00 0.00 H new ATOM 0 HG2 PRO B 351 -5.412 13.335 7.695 1.00 0.00 H new ATOM 0 HG3 PRO B 351 -7.010 13.578 7.019 1.00 0.00 H new ATOM 0 HD2 PRO B 351 -6.144 13.752 9.918 1.00 0.00 H new ATOM 0 HD3 PRO B 351 -7.183 14.840 9.021 1.00 0.00 H new ATOM 1210 N ALA B 352 -8.438 9.403 9.790 1.00 0.00 N ATOM 1211 CA ALA B 352 -8.341 8.275 10.712 1.00 0.00 C ATOM 1212 C ALA B 352 -7.219 7.304 10.315 1.00 0.00 C ATOM 1213 O ALA B 352 -7.198 6.162 10.772 1.00 0.00 O ATOM 1214 CB ALA B 352 -9.674 7.541 10.785 1.00 0.00 C ATOM 0 H ALA B 352 -9.042 9.234 8.986 1.00 0.00 H new ATOM 0 HA ALA B 352 -8.094 8.674 11.696 1.00 0.00 H new ATOM 0 HB1 ALA B 352 -9.590 6.702 11.475 1.00 0.00 H new ATOM 0 HB2 ALA B 352 -10.447 8.224 11.137 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -9.940 7.171 9.795 1.00 0.00 H new ATOM 1220 N LEU B 353 -6.281 7.776 9.483 1.00 0.00 N ATOM 1221 CA LEU B 353 -5.144 6.967 9.033 1.00 0.00 C ATOM 1222 C LEU B 353 -3.988 7.850 8.608 1.00 0.00 C ATOM 1223 O LEU B 353 -4.168 8.960 8.103 1.00 0.00 O ATOM 1224 CB LEU B 353 -5.469 6.117 7.801 1.00 0.00 C ATOM 1225 CG LEU B 353 -5.522 4.594 7.955 1.00 0.00 C ATOM 1226 CD1 LEU B 353 -4.140 3.990 7.774 1.00 0.00 C ATOM 1227 CD2 LEU B 353 -6.129 4.187 9.287 1.00 0.00 C ATOM 0 H LEU B 353 -6.290 8.724 9.106 1.00 0.00 H new ATOM 0 HA LEU B 353 -4.898 6.333 9.885 1.00 0.00 H new ATOM 0 HB2 LEU B 353 -6.435 6.445 7.418 1.00 0.00 H new ATOM 0 HB3 LEU B 353 -4.728 6.347 7.035 1.00 0.00 H new ATOM 0 HG LEU B 353 -6.171 4.202 7.172 1.00 0.00 H new ATOM 0 HD11 LEU B 353 -4.198 2.907 7.887 1.00 0.00 H new ATOM 0 HD12 LEU B 353 -3.765 4.231 6.779 1.00 0.00 H new ATOM 0 HD13 LEU B 353 -3.464 4.397 8.525 1.00 0.00 H new ATOM 0 HD21 LEU B 353 -6.150 3.100 9.360 1.00 0.00 H new ATOM 0 HD22 LEU B 353 -5.528 4.594 10.100 1.00 0.00 H new ATOM 0 HD23 LEU B 353 -7.145 4.575 9.358 1.00 0.00 H new ATOM 1239 N THR B 354 -2.812 7.295 8.768 1.00 0.00 N ATOM 1240 CA THR B 354 -1.570 7.922 8.371 1.00 0.00 C ATOM 1241 C THR B 354 -0.575 6.803 8.128 1.00 0.00 C ATOM 1242 O THR B 354 -0.932 5.630 8.266 1.00 0.00 O ATOM 1243 CB THR B 354 -1.060 8.878 9.458 1.00 0.00 C ATOM 1244 OG1 THR B 354 -0.941 8.209 10.702 1.00 0.00 O ATOM 1245 CG2 THR B 354 -1.950 10.086 9.668 1.00 0.00 C ATOM 0 H THR B 354 -2.686 6.374 9.187 1.00 0.00 H new ATOM 0 HA THR B 354 -1.712 8.521 7.472 1.00 0.00 H new ATOM 0 HB THR B 354 -0.090 9.223 9.101 1.00 0.00 H new ATOM 0 HG1 THR B 354 -0.613 8.836 11.380 1.00 0.00 H new ATOM 0 HG21 THR B 354 -1.528 10.717 10.450 1.00 0.00 H new ATOM 0 HG22 THR B 354 -2.017 10.654 8.740 1.00 0.00 H new ATOM 0 HG23 THR B 354 -2.946 9.757 9.965 1.00 0.00 H new ATOM 1253 N GLU B 355 0.670 7.132 7.821 1.00 0.00 N ATOM 1254 CA GLU B 355 1.668 6.086 7.647 1.00 0.00 C ATOM 1255 C GLU B 355 1.661 5.203 8.903 1.00 0.00 C ATOM 1256 O GLU B 355 2.033 4.028 8.864 1.00 0.00 O ATOM 1257 CB GLU B 355 3.056 6.690 7.418 1.00 0.00 C ATOM 1258 CG GLU B 355 3.167 7.526 6.150 1.00 0.00 C ATOM 1259 CD GLU B 355 2.731 8.976 6.329 1.00 0.00 C ATOM 1260 OE1 GLU B 355 2.373 9.370 7.462 1.00 0.00 O ATOM 1261 OE2 GLU B 355 2.758 9.724 5.329 1.00 0.00 O ATOM 0 H GLU B 355 1.008 8.085 7.690 1.00 0.00 H new ATOM 0 HA GLU B 355 1.427 5.487 6.769 1.00 0.00 H new ATOM 0 HB2 GLU B 355 3.316 7.312 8.275 1.00 0.00 H new ATOM 0 HB3 GLU B 355 3.789 5.884 7.375 1.00 0.00 H new ATOM 0 HG2 GLU B 355 4.200 7.507 5.803 1.00 0.00 H new ATOM 0 HG3 GLU B 355 2.560 7.068 5.369 1.00 0.00 H new ATOM 1268 N GLN B 356 1.207 5.807 10.015 1.00 0.00 N ATOM 1269 CA GLN B 356 1.098 5.142 11.310 1.00 0.00 C ATOM 1270 C GLN B 356 0.111 3.970 11.289 1.00 0.00 C ATOM 1271 O GLN B 356 0.463 2.873 11.723 1.00 0.00 O ATOM 1272 CB GLN B 356 0.661 6.143 12.385 1.00 0.00 C ATOM 1273 CG GLN B 356 1.561 7.368 12.493 1.00 0.00 C ATOM 1274 CD GLN B 356 1.103 8.380 13.541 1.00 0.00 C ATOM 1275 OE1 GLN B 356 0.005 8.096 14.242 1.00 0.00 O flip ATOM 1276 NE2 GLN B 356 1.738 9.420 13.716 1.00 0.00 N flip ATOM 0 H GLN B 356 0.904 6.781 10.032 1.00 0.00 H new ATOM 0 HA GLN B 356 2.086 4.744 11.541 1.00 0.00 H new ATOM 0 HB2 GLN B 356 -0.356 6.470 12.170 1.00 0.00 H new ATOM 0 HB3 GLN B 356 0.636 5.637 13.350 1.00 0.00 H new ATOM 0 HG2 GLN B 356 2.573 7.043 12.733 1.00 0.00 H new ATOM 0 HG3 GLN B 356 1.606 7.860 11.522 1.00 0.00 H new ATOM 0 HE21 GLN B 356 2.574 9.606 13.162 1.00 0.00 H new ATOM 0 HE22 GLN B 356 1.428 10.095 14.415 1.00 0.00 H new ATOM 1285 N GLU B 357 -1.130 4.186 10.800 1.00 0.00 N ATOM 1286 CA GLU B 357 -2.110 3.100 10.774 1.00 0.00 C ATOM 1287 C GLU B 357 -1.790 2.093 9.676 1.00 0.00 C ATOM 1288 O GLU B 357 -2.086 0.904 9.804 1.00 0.00 O ATOM 1289 CB GLU B 357 -3.524 3.641 10.567 1.00 0.00 C ATOM 1290 CG GLU B 357 -4.119 4.370 11.758 1.00 0.00 C ATOM 1291 CD GLU B 357 -3.960 3.611 13.062 1.00 0.00 C ATOM 1292 OE1 GLU B 357 -4.507 2.493 13.172 1.00 0.00 O ATOM 1293 OE2 GLU B 357 -3.281 4.133 13.972 1.00 0.00 O ATOM 0 H GLU B 357 -1.462 5.077 10.431 1.00 0.00 H new ATOM 0 HA GLU B 357 -2.058 2.598 11.740 1.00 0.00 H new ATOM 0 HB2 GLU B 357 -3.515 4.319 9.714 1.00 0.00 H new ATOM 0 HB3 GLU B 357 -4.179 2.810 10.306 1.00 0.00 H new ATOM 0 HG2 GLU B 357 -3.644 5.346 11.853 1.00 0.00 H new ATOM 0 HG3 GLU B 357 -5.179 4.548 11.575 1.00 0.00 H new ATOM 1300 N VAL B 358 -1.196 2.583 8.589 1.00 0.00 N ATOM 1301 CA VAL B 358 -0.850 1.738 7.454 1.00 0.00 C ATOM 1302 C VAL B 358 0.208 0.704 7.829 1.00 0.00 C ATOM 1303 O VAL B 358 -0.047 -0.498 7.769 1.00 0.00 O ATOM 1304 CB VAL B 358 -0.332 2.604 6.291 1.00 0.00 C ATOM 1305 CG1 VAL B 358 -0.066 1.770 5.055 1.00 0.00 C ATOM 1306 CG2 VAL B 358 -1.320 3.711 5.987 1.00 0.00 C ATOM 0 H VAL B 358 -0.945 3.565 8.473 1.00 0.00 H new ATOM 0 HA VAL B 358 -1.752 1.209 7.147 1.00 0.00 H new ATOM 0 HB VAL B 358 0.615 3.049 6.596 1.00 0.00 H new ATOM 0 HG11 VAL B 358 0.298 2.413 4.254 1.00 0.00 H new ATOM 0 HG12 VAL B 358 0.684 1.012 5.282 1.00 0.00 H new ATOM 0 HG13 VAL B 358 -0.989 1.284 4.739 1.00 0.00 H new ATOM 0 HG21 VAL B 358 -0.944 4.318 5.163 1.00 0.00 H new ATOM 0 HG22 VAL B 358 -2.280 3.276 5.709 1.00 0.00 H new ATOM 0 HG23 VAL B 358 -1.448 4.337 6.870 1.00 0.00 H new ATOM 1316 N TYR B 359 1.386 1.175 8.236 1.00 0.00 N ATOM 1317 CA TYR B 359 2.469 0.282 8.641 1.00 0.00 C ATOM 1318 C TYR B 359 2.038 -0.609 9.808 1.00 0.00 C ATOM 1319 O TYR B 359 2.463 -1.761 9.908 1.00 0.00 O ATOM 1320 CB TYR B 359 3.722 1.085 9.013 1.00 0.00 C ATOM 1321 CG TYR B 359 4.931 0.223 9.321 1.00 0.00 C ATOM 1322 CD1 TYR B 359 5.011 -0.501 10.505 1.00 0.00 C ATOM 1323 CD2 TYR B 359 5.984 0.126 8.420 1.00 0.00 C ATOM 1324 CE1 TYR B 359 6.105 -1.298 10.782 1.00 0.00 C ATOM 1325 CE2 TYR B 359 7.083 -0.666 8.692 1.00 0.00 C ATOM 1326 CZ TYR B 359 7.141 -1.376 9.874 1.00 0.00 C ATOM 1327 OH TYR B 359 8.232 -2.170 10.151 1.00 0.00 O ATOM 0 H TYR B 359 1.614 2.168 8.294 1.00 0.00 H new ATOM 0 HA TYR B 359 2.709 -0.361 7.794 1.00 0.00 H new ATOM 0 HB2 TYR B 359 3.967 1.759 8.192 1.00 0.00 H new ATOM 0 HB3 TYR B 359 3.500 1.707 9.880 1.00 0.00 H new ATOM 0 HD1 TYR B 359 4.204 -0.439 11.220 1.00 0.00 H new ATOM 0 HD2 TYR B 359 5.943 0.678 7.493 1.00 0.00 H new ATOM 0 HE1 TYR B 359 6.149 -1.857 11.705 1.00 0.00 H new ATOM 0 HE2 TYR B 359 7.894 -0.729 7.982 1.00 0.00 H new ATOM 0 HH TYR B 359 8.872 -2.116 9.411 1.00 0.00 H new ATOM 1337 N ALA B 360 1.195 -0.062 10.690 1.00 0.00 N ATOM 1338 CA ALA B 360 0.713 -0.799 11.859 1.00 0.00 C ATOM 1339 C ALA B 360 -0.092 -2.036 11.460 1.00 0.00 C ATOM 1340 O ALA B 360 0.228 -3.151 11.874 1.00 0.00 O ATOM 1341 CB ALA B 360 -0.122 0.106 12.752 1.00 0.00 C ATOM 0 H ALA B 360 0.833 0.889 10.615 1.00 0.00 H new ATOM 0 HA ALA B 360 1.588 -1.138 12.413 1.00 0.00 H new ATOM 0 HB1 ALA B 360 -0.472 -0.458 13.616 1.00 0.00 H new ATOM 0 HB2 ALA B 360 0.486 0.946 13.089 1.00 0.00 H new ATOM 0 HB3 ALA B 360 -0.979 0.480 12.192 1.00 0.00 H new ATOM 1347 N GLN B 361 -1.138 -1.830 10.661 1.00 0.00 N ATOM 1348 CA GLN B 361 -1.990 -2.930 10.214 1.00 0.00 C ATOM 1349 C GLN B 361 -1.230 -3.898 9.309 1.00 0.00 C ATOM 1350 O GLN B 361 -1.454 -5.108 9.365 1.00 0.00 O ATOM 1351 CB GLN B 361 -3.221 -2.390 9.480 1.00 0.00 C ATOM 1352 CG GLN B 361 -4.140 -1.549 10.352 1.00 0.00 C ATOM 1353 CD GLN B 361 -5.350 -1.035 9.596 1.00 0.00 C ATOM 1354 OE1 GLN B 361 -5.220 -0.284 8.627 1.00 0.00 O ATOM 1355 NE2 GLN B 361 -6.540 -1.441 10.030 1.00 0.00 N ATOM 0 H GLN B 361 -1.415 -0.913 10.311 1.00 0.00 H new ATOM 0 HA GLN B 361 -2.311 -3.476 11.101 1.00 0.00 H new ATOM 0 HB2 GLN B 361 -2.892 -1.790 8.632 1.00 0.00 H new ATOM 0 HB3 GLN B 361 -3.788 -3.229 9.076 1.00 0.00 H new ATOM 0 HG2 GLN B 361 -4.473 -2.144 11.202 1.00 0.00 H new ATOM 0 HG3 GLN B 361 -3.581 -0.704 10.754 1.00 0.00 H new ATOM 0 HE21 GLN B 361 -6.604 -2.063 10.836 1.00 0.00 H new ATOM 0 HE22 GLN B 361 -7.389 -1.130 9.557 1.00 0.00 H new ATOM 1364 N VAL B 362 -0.329 -3.364 8.477 1.00 0.00 N ATOM 1365 CA VAL B 362 0.461 -4.189 7.561 1.00 0.00 C ATOM 1366 C VAL B 362 1.398 -5.127 8.318 1.00 0.00 C ATOM 1367 O VAL B 362 1.633 -6.254 7.884 1.00 0.00 O ATOM 1368 CB VAL B 362 1.293 -3.323 6.593 1.00 0.00 C ATOM 1369 CG1 VAL B 362 2.229 -4.190 5.762 1.00 0.00 C ATOM 1370 CG2 VAL B 362 0.385 -2.503 5.686 1.00 0.00 C ATOM 0 H VAL B 362 -0.130 -2.365 8.420 1.00 0.00 H new ATOM 0 HA VAL B 362 -0.252 -4.782 6.987 1.00 0.00 H new ATOM 0 HB VAL B 362 1.896 -2.637 7.188 1.00 0.00 H new ATOM 0 HG11 VAL B 362 2.806 -3.559 5.086 1.00 0.00 H new ATOM 0 HG12 VAL B 362 2.908 -4.730 6.423 1.00 0.00 H new ATOM 0 HG13 VAL B 362 1.644 -4.903 5.181 1.00 0.00 H new ATOM 0 HG21 VAL B 362 0.993 -1.900 5.012 1.00 0.00 H new ATOM 0 HG22 VAL B 362 -0.248 -3.172 5.103 1.00 0.00 H new ATOM 0 HG23 VAL B 362 -0.241 -1.849 6.293 1.00 0.00 H new ATOM 1380 N ALA B 363 1.926 -4.664 9.454 1.00 0.00 N ATOM 1381 CA ALA B 363 2.823 -5.482 10.267 1.00 0.00 C ATOM 1382 C ALA B 363 2.164 -6.816 10.623 1.00 0.00 C ATOM 1383 O ALA B 363 2.835 -7.845 10.718 1.00 0.00 O ATOM 1384 CB ALA B 363 3.235 -4.734 11.527 1.00 0.00 C ATOM 0 H ALA B 363 1.748 -3.732 9.828 1.00 0.00 H new ATOM 0 HA ALA B 363 3.720 -5.690 9.683 1.00 0.00 H new ATOM 0 HB1 ALA B 363 3.903 -5.359 12.119 1.00 0.00 H new ATOM 0 HB2 ALA B 363 3.749 -3.813 11.252 1.00 0.00 H new ATOM 0 HB3 ALA B 363 2.348 -4.493 12.113 1.00 0.00 H new ATOM 1390 N ARG B 364 0.838 -6.788 10.801 1.00 0.00 N ATOM 1391 CA ARG B 364 0.073 -7.990 11.128 1.00 0.00 C ATOM 1392 C ARG B 364 0.048 -8.955 9.942 1.00 0.00 C ATOM 1393 O ARG B 364 0.069 -10.173 10.117 1.00 0.00 O ATOM 1394 CB ARG B 364 -1.356 -7.614 11.519 1.00 0.00 C ATOM 1395 CG ARG B 364 -1.802 -8.253 12.815 1.00 0.00 C ATOM 1396 CD ARG B 364 -3.236 -7.883 13.162 1.00 0.00 C ATOM 1397 NE ARG B 364 -3.676 -8.503 14.413 1.00 0.00 N ATOM 1398 CZ ARG B 364 -3.176 -8.207 15.617 1.00 0.00 C ATOM 1399 NH1 ARG B 364 -2.254 -7.256 15.756 1.00 0.00 N ATOM 1400 NH2 ARG B 364 -3.613 -8.854 16.692 1.00 0.00 N ATOM 0 H ARG B 364 0.274 -5.942 10.723 1.00 0.00 H new ATOM 0 HA ARG B 364 0.557 -8.485 11.970 1.00 0.00 H new ATOM 0 HB2 ARG B 364 -1.428 -6.530 11.611 1.00 0.00 H new ATOM 0 HB3 ARG B 364 -2.036 -7.912 10.721 1.00 0.00 H new ATOM 0 HG2 ARG B 364 -1.715 -9.337 12.735 1.00 0.00 H new ATOM 0 HG3 ARG B 364 -1.140 -7.939 13.622 1.00 0.00 H new ATOM 0 HD2 ARG B 364 -3.321 -6.799 13.245 1.00 0.00 H new ATOM 0 HD3 ARG B 364 -3.896 -8.193 12.352 1.00 0.00 H new ATOM 0 HE ARG B 364 -4.412 -9.207 14.363 1.00 0.00 H new ATOM 0 HH11 ARG B 364 -1.922 -6.744 14.939 1.00 0.00 H new ATOM 0 HH12 ARG B 364 -1.880 -7.039 16.680 1.00 0.00 H new ATOM 0 HH21 ARG B 364 -4.328 -9.575 16.598 1.00 0.00 H new ATOM 0 HH22 ARG B 364 -3.233 -8.630 17.612 1.00 0.00 H new ATOM 1414 N LEU B 365 0.008 -8.396 8.736 1.00 0.00 N ATOM 1415 CA LEU B 365 -0.004 -9.191 7.512 1.00 0.00 C ATOM 1416 C LEU B 365 1.300 -9.973 7.344 1.00 0.00 C ATOM 1417 O LEU B 365 1.292 -11.171 7.057 1.00 0.00 O ATOM 1418 CB LEU B 365 -0.187 -8.290 6.287 1.00 0.00 C ATOM 1419 CG LEU B 365 -1.596 -7.753 6.048 1.00 0.00 C ATOM 1420 CD1 LEU B 365 -2.585 -8.884 5.869 1.00 0.00 C ATOM 1421 CD2 LEU B 365 -2.032 -6.832 7.169 1.00 0.00 C ATOM 0 H LEU B 365 -0.017 -7.388 8.580 1.00 0.00 H new ATOM 0 HA LEU B 365 -0.837 -9.890 7.592 1.00 0.00 H new ATOM 0 HB2 LEU B 365 0.491 -7.442 6.382 1.00 0.00 H new ATOM 0 HB3 LEU B 365 0.121 -8.848 5.403 1.00 0.00 H new ATOM 0 HG LEU B 365 -1.574 -7.171 5.126 1.00 0.00 H new ATOM 0 HD11 LEU B 365 -3.581 -8.473 5.700 1.00 0.00 H new ATOM 0 HD12 LEU B 365 -2.293 -9.491 5.012 1.00 0.00 H new ATOM 0 HD13 LEU B 365 -2.595 -9.504 6.766 1.00 0.00 H new ATOM 0 HD21 LEU B 365 -3.039 -6.467 6.969 1.00 0.00 H new ATOM 0 HD22 LEU B 365 -2.025 -7.378 8.112 1.00 0.00 H new ATOM 0 HD23 LEU B 365 -1.346 -5.987 7.234 1.00 0.00 H new ATOM 1433 N PHE B 366 2.414 -9.250 7.459 1.00 0.00 N ATOM 1434 CA PHE B 366 3.747 -9.809 7.259 1.00 0.00 C ATOM 1435 C PHE B 366 4.440 -10.265 8.548 1.00 0.00 C ATOM 1436 O PHE B 366 5.660 -10.130 8.673 1.00 0.00 O ATOM 1437 CB PHE B 366 4.592 -8.766 6.532 1.00 0.00 C ATOM 1438 CG PHE B 366 4.015 -8.395 5.194 1.00 0.00 C ATOM 1439 CD1 PHE B 366 2.728 -7.887 5.097 1.00 0.00 C ATOM 1440 CD2 PHE B 366 4.739 -8.587 4.039 1.00 0.00 C ATOM 1441 CE1 PHE B 366 2.177 -7.583 3.877 1.00 0.00 C ATOM 1442 CE2 PHE B 366 4.197 -8.274 2.811 1.00 0.00 C ATOM 1443 CZ PHE B 366 2.909 -7.774 2.730 1.00 0.00 C ATOM 0 H PHE B 366 2.415 -8.257 7.694 1.00 0.00 H new ATOM 0 HA PHE B 366 3.638 -10.717 6.666 1.00 0.00 H new ATOM 0 HB2 PHE B 366 4.673 -7.872 7.151 1.00 0.00 H new ATOM 0 HB3 PHE B 366 5.602 -9.152 6.395 1.00 0.00 H new ATOM 0 HD1 PHE B 366 2.150 -7.728 5.996 1.00 0.00 H new ATOM 0 HD2 PHE B 366 5.741 -8.987 4.096 1.00 0.00 H new ATOM 0 HE1 PHE B 366 1.171 -7.195 3.819 1.00 0.00 H new ATOM 0 HE2 PHE B 366 4.777 -8.419 1.912 1.00 0.00 H new ATOM 0 HZ PHE B 366 2.481 -7.535 1.768 1.00 0.00 H new ATOM 1453 N LYS B 367 3.680 -10.813 9.497 1.00 0.00 N ATOM 1454 CA LYS B 367 4.263 -11.291 10.752 1.00 0.00 C ATOM 1455 C LYS B 367 5.443 -12.240 10.505 1.00 0.00 C ATOM 1456 O LYS B 367 6.571 -11.951 10.907 1.00 0.00 O ATOM 1457 CB LYS B 367 3.206 -11.973 11.626 1.00 0.00 C ATOM 1458 CG LYS B 367 2.161 -11.013 12.167 1.00 0.00 C ATOM 1459 CD LYS B 367 1.136 -11.722 13.039 1.00 0.00 C ATOM 1460 CE LYS B 367 1.755 -12.230 14.332 1.00 0.00 C ATOM 1461 NZ LYS B 367 0.751 -12.884 15.218 1.00 0.00 N ATOM 0 H LYS B 367 2.670 -10.936 9.423 1.00 0.00 H new ATOM 0 HA LYS B 367 4.641 -10.417 11.283 1.00 0.00 H new ATOM 0 HB2 LYS B 367 2.709 -12.749 11.044 1.00 0.00 H new ATOM 0 HB3 LYS B 367 3.701 -12.469 12.461 1.00 0.00 H new ATOM 0 HG2 LYS B 367 2.652 -10.231 12.747 1.00 0.00 H new ATOM 0 HG3 LYS B 367 1.654 -10.523 11.336 1.00 0.00 H new ATOM 0 HD2 LYS B 367 0.319 -11.038 13.270 1.00 0.00 H new ATOM 0 HD3 LYS B 367 0.705 -12.558 12.488 1.00 0.00 H new ATOM 0 HE2 LYS B 367 2.548 -12.940 14.099 1.00 0.00 H new ATOM 0 HE3 LYS B 367 2.218 -11.398 14.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 1.218 -13.214 16.087 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 0.007 -12.200 15.463 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 0.327 -13.694 14.723 1.00 0.00 H new ATOM 1475 N ASN B 368 5.175 -13.379 9.847 1.00 0.00 N ATOM 1476 CA ASN B 368 6.225 -14.367 9.560 1.00 0.00 C ATOM 1477 C ASN B 368 7.007 -14.055 8.270 1.00 0.00 C ATOM 1478 O ASN B 368 7.745 -14.910 7.774 1.00 0.00 O ATOM 1479 CB ASN B 368 5.640 -15.788 9.499 1.00 0.00 C ATOM 1480 CG ASN B 368 4.533 -15.945 8.471 1.00 0.00 C ATOM 1481 OD1 ASN B 368 3.446 -15.389 8.624 1.00 0.00 O ATOM 1482 ND2 ASN B 368 4.804 -16.706 7.415 1.00 0.00 N ATOM 0 H ASN B 368 4.249 -13.637 9.507 1.00 0.00 H new ATOM 0 HA ASN B 368 6.935 -14.307 10.385 1.00 0.00 H new ATOM 0 HB2 ASN B 368 6.440 -16.492 9.270 1.00 0.00 H new ATOM 0 HB3 ASN B 368 5.252 -16.055 10.482 1.00 0.00 H new ATOM 0 HD21 ASN B 368 4.097 -16.847 6.693 1.00 0.00 H new ATOM 0 HD22 ASN B 368 5.719 -17.149 7.327 1.00 0.00 H new ATOM 1489 N GLN B 369 6.871 -12.832 7.744 1.00 0.00 N ATOM 1490 CA GLN B 369 7.595 -12.427 6.535 1.00 0.00 C ATOM 1491 C GLN B 369 8.040 -10.964 6.625 1.00 0.00 C ATOM 1492 O GLN B 369 7.837 -10.180 5.696 1.00 0.00 O ATOM 1493 CB GLN B 369 6.761 -12.658 5.265 1.00 0.00 C ATOM 1494 CG GLN B 369 5.283 -12.328 5.407 1.00 0.00 C ATOM 1495 CD GLN B 369 4.475 -13.497 5.948 1.00 0.00 C ATOM 1496 OE1 GLN B 369 4.515 -14.598 5.400 1.00 0.00 O ATOM 1497 NE2 GLN B 369 3.723 -13.261 7.016 1.00 0.00 N ATOM 0 H GLN B 369 6.268 -12.108 8.136 1.00 0.00 H new ATOM 0 HA GLN B 369 8.483 -13.056 6.467 1.00 0.00 H new ATOM 0 HB2 GLN B 369 7.178 -12.055 4.458 1.00 0.00 H new ATOM 0 HB3 GLN B 369 6.859 -13.702 4.967 1.00 0.00 H new ATOM 0 HG2 GLN B 369 5.167 -11.472 6.072 1.00 0.00 H new ATOM 0 HG3 GLN B 369 4.885 -12.034 4.436 1.00 0.00 H new ATOM 0 HE21 GLN B 369 3.718 -12.334 7.441 1.00 0.00 H new ATOM 0 HE22 GLN B 369 3.150 -14.007 7.412 1.00 0.00 H new ATOM 1506 N GLU B 370 8.660 -10.615 7.758 1.00 0.00 N ATOM 1507 CA GLU B 370 9.161 -9.257 7.998 1.00 0.00 C ATOM 1508 C GLU B 370 10.052 -8.748 6.852 1.00 0.00 C ATOM 1509 O GLU B 370 10.229 -7.539 6.693 1.00 0.00 O ATOM 1510 CB GLU B 370 9.927 -9.198 9.322 1.00 0.00 C ATOM 1511 CG GLU B 370 9.065 -9.522 10.534 1.00 0.00 C ATOM 1512 CD GLU B 370 9.833 -9.452 11.841 1.00 0.00 C ATOM 1513 OE1 GLU B 370 10.332 -8.358 12.181 1.00 0.00 O ATOM 1514 OE2 GLU B 370 9.933 -10.493 12.525 1.00 0.00 O ATOM 0 H GLU B 370 8.828 -11.261 8.529 1.00 0.00 H new ATOM 0 HA GLU B 370 8.291 -8.602 8.049 1.00 0.00 H new ATOM 0 HB2 GLU B 370 10.762 -9.898 9.282 1.00 0.00 H new ATOM 0 HB3 GLU B 370 10.352 -8.202 9.443 1.00 0.00 H new ATOM 0 HG2 GLU B 370 8.227 -8.827 10.573 1.00 0.00 H new ATOM 0 HG3 GLU B 370 8.645 -10.521 10.418 1.00 0.00 H new ATOM 1521 N ASP B 371 10.610 -9.671 6.058 1.00 0.00 N ATOM 1522 CA ASP B 371 11.474 -9.302 4.938 1.00 0.00 C ATOM 1523 C ASP B 371 10.681 -8.525 3.894 1.00 0.00 C ATOM 1524 O ASP B 371 11.079 -7.431 3.504 1.00 0.00 O ATOM 1525 CB ASP B 371 12.100 -10.552 4.301 1.00 0.00 C ATOM 1526 CG ASP B 371 13.026 -11.312 5.244 1.00 0.00 C ATOM 1527 OD1 ASP B 371 13.226 -10.862 6.395 1.00 0.00 O ATOM 1528 OD2 ASP B 371 13.557 -12.361 4.825 1.00 0.00 O ATOM 0 H ASP B 371 10.477 -10.676 6.173 1.00 0.00 H new ATOM 0 HA ASP B 371 12.276 -8.669 5.318 1.00 0.00 H new ATOM 0 HB2 ASP B 371 11.304 -11.219 3.969 1.00 0.00 H new ATOM 0 HB3 ASP B 371 12.660 -10.257 3.413 1.00 0.00 H new ATOM 1533 N LEU B 372 9.541 -9.076 3.468 1.00 0.00 N ATOM 1534 CA LEU B 372 8.686 -8.393 2.498 1.00 0.00 C ATOM 1535 C LEU B 372 8.346 -6.982 2.990 1.00 0.00 C ATOM 1536 O LEU B 372 8.245 -6.050 2.194 1.00 0.00 O ATOM 1537 CB LEU B 372 7.397 -9.187 2.242 1.00 0.00 C ATOM 1538 CG LEU B 372 7.551 -10.452 1.388 1.00 0.00 C ATOM 1539 CD1 LEU B 372 6.214 -11.177 1.272 1.00 0.00 C ATOM 1540 CD2 LEU B 372 8.092 -10.104 0.005 1.00 0.00 C ATOM 0 H LEU B 372 9.193 -9.984 3.777 1.00 0.00 H new ATOM 0 HA LEU B 372 9.234 -8.320 1.558 1.00 0.00 H new ATOM 0 HB2 LEU B 372 6.970 -9.471 3.204 1.00 0.00 H new ATOM 0 HB3 LEU B 372 6.677 -8.528 1.756 1.00 0.00 H new ATOM 0 HG LEU B 372 8.265 -11.115 1.877 1.00 0.00 H new ATOM 0 HD11 LEU B 372 6.337 -12.073 0.663 1.00 0.00 H new ATOM 0 HD12 LEU B 372 5.865 -11.459 2.266 1.00 0.00 H new ATOM 0 HD13 LEU B 372 5.482 -10.518 0.804 1.00 0.00 H new ATOM 0 HD21 LEU B 372 8.194 -11.015 -0.585 1.00 0.00 H new ATOM 0 HD22 LEU B 372 7.403 -9.423 -0.494 1.00 0.00 H new ATOM 0 HD23 LEU B 372 9.066 -9.625 0.105 1.00 0.00 H new ATOM 1552 N LEU B 373 8.192 -6.831 4.316 1.00 0.00 N ATOM 1553 CA LEU B 373 7.878 -5.533 4.924 1.00 0.00 C ATOM 1554 C LEU B 373 8.995 -4.515 4.707 1.00 0.00 C ATOM 1555 O LEU B 373 8.736 -3.312 4.657 1.00 0.00 O ATOM 1556 CB LEU B 373 7.625 -5.688 6.428 1.00 0.00 C ATOM 1557 CG LEU B 373 6.184 -6.008 6.816 1.00 0.00 C ATOM 1558 CD1 LEU B 373 6.076 -6.270 8.314 1.00 0.00 C ATOM 1559 CD2 LEU B 373 5.267 -4.866 6.403 1.00 0.00 C ATOM 0 H LEU B 373 8.281 -7.595 4.986 1.00 0.00 H new ATOM 0 HA LEU B 373 6.977 -5.165 4.434 1.00 0.00 H new ATOM 0 HB2 LEU B 373 8.271 -6.479 6.809 1.00 0.00 H new ATOM 0 HB3 LEU B 373 7.922 -4.766 6.927 1.00 0.00 H new ATOM 0 HG LEU B 373 5.874 -6.912 6.292 1.00 0.00 H new ATOM 0 HD11 LEU B 373 5.041 -6.496 8.570 1.00 0.00 H new ATOM 0 HD12 LEU B 373 6.709 -7.116 8.582 1.00 0.00 H new ATOM 0 HD13 LEU B 373 6.400 -5.386 8.862 1.00 0.00 H new ATOM 0 HD21 LEU B 373 4.241 -5.103 6.684 1.00 0.00 H new ATOM 0 HD22 LEU B 373 5.578 -3.950 6.905 1.00 0.00 H new ATOM 0 HD23 LEU B 373 5.324 -4.725 5.324 1.00 0.00 H new ATOM 1571 N SER B 374 10.234 -4.993 4.574 1.00 0.00 N ATOM 1572 CA SER B 374 11.375 -4.109 4.356 1.00 0.00 C ATOM 1573 C SER B 374 11.114 -3.199 3.150 1.00 0.00 C ATOM 1574 O SER B 374 11.360 -1.993 3.206 1.00 0.00 O ATOM 1575 CB SER B 374 12.655 -4.928 4.145 1.00 0.00 C ATOM 1576 OG SER B 374 12.699 -5.501 2.847 1.00 0.00 O ATOM 0 H SER B 374 10.470 -5.985 4.614 1.00 0.00 H new ATOM 0 HA SER B 374 11.509 -3.486 5.240 1.00 0.00 H new ATOM 0 HB2 SER B 374 13.525 -4.288 4.291 1.00 0.00 H new ATOM 0 HB3 SER B 374 12.710 -5.718 4.894 1.00 0.00 H new ATOM 0 HG SER B 374 11.938 -6.108 2.731 1.00 0.00 H new ATOM 1582 N GLU B 375 10.598 -3.794 2.069 1.00 0.00 N ATOM 1583 CA GLU B 375 10.281 -3.056 0.847 1.00 0.00 C ATOM 1584 C GLU B 375 9.168 -2.029 1.090 1.00 0.00 C ATOM 1585 O GLU B 375 9.162 -0.958 0.481 1.00 0.00 O ATOM 1586 CB GLU B 375 9.871 -4.028 -0.266 1.00 0.00 C ATOM 1587 CG GLU B 375 9.792 -3.382 -1.638 1.00 0.00 C ATOM 1588 CD GLU B 375 9.847 -4.383 -2.785 1.00 0.00 C ATOM 1589 OE1 GLU B 375 9.809 -5.607 -2.524 1.00 0.00 O ATOM 1590 OE2 GLU B 375 9.926 -3.940 -3.950 1.00 0.00 O ATOM 0 H GLU B 375 10.391 -4.791 2.019 1.00 0.00 H new ATOM 0 HA GLU B 375 11.176 -2.516 0.538 1.00 0.00 H new ATOM 0 HB2 GLU B 375 10.586 -4.850 -0.301 1.00 0.00 H new ATOM 0 HB3 GLU B 375 8.901 -4.460 -0.021 1.00 0.00 H new ATOM 0 HG2 GLU B 375 8.867 -2.811 -1.709 1.00 0.00 H new ATOM 0 HG3 GLU B 375 10.613 -2.673 -1.745 1.00 0.00 H new ATOM 1597 N PHE B 376 8.227 -2.368 1.978 1.00 0.00 N ATOM 1598 CA PHE B 376 7.101 -1.488 2.307 1.00 0.00 C ATOM 1599 C PHE B 376 7.577 -0.098 2.734 1.00 0.00 C ATOM 1600 O PHE B 376 7.060 0.917 2.260 1.00 0.00 O ATOM 1601 CB PHE B 376 6.264 -2.095 3.438 1.00 0.00 C ATOM 1602 CG PHE B 376 4.970 -1.376 3.698 1.00 0.00 C ATOM 1603 CD1 PHE B 376 4.420 -0.531 2.746 1.00 0.00 C ATOM 1604 CD2 PHE B 376 4.296 -1.558 4.895 1.00 0.00 C ATOM 1605 CE1 PHE B 376 3.228 0.119 2.984 1.00 0.00 C ATOM 1606 CE2 PHE B 376 3.103 -0.911 5.136 1.00 0.00 C ATOM 1607 CZ PHE B 376 2.569 -0.071 4.179 1.00 0.00 C ATOM 0 H PHE B 376 8.224 -3.253 2.485 1.00 0.00 H new ATOM 0 HA PHE B 376 6.496 -1.388 1.406 1.00 0.00 H new ATOM 0 HB2 PHE B 376 6.047 -3.136 3.197 1.00 0.00 H new ATOM 0 HB3 PHE B 376 6.856 -2.097 4.353 1.00 0.00 H new ATOM 0 HD1 PHE B 376 4.932 -0.380 1.807 1.00 0.00 H new ATOM 0 HD2 PHE B 376 4.710 -2.214 5.647 1.00 0.00 H new ATOM 0 HE1 PHE B 376 2.811 0.776 2.235 1.00 0.00 H new ATOM 0 HE2 PHE B 376 2.586 -1.061 6.073 1.00 0.00 H new ATOM 0 HZ PHE B 376 1.635 0.437 4.367 1.00 0.00 H new ATOM 1617 N GLY B 377 8.548 -0.068 3.649 1.00 0.00 N ATOM 1618 CA GLY B 377 9.077 1.188 4.162 1.00 0.00 C ATOM 1619 C GLY B 377 9.565 2.162 3.086 1.00 0.00 C ATOM 1620 O GLY B 377 9.782 3.339 3.378 1.00 0.00 O ATOM 0 H GLY B 377 8.981 -0.901 4.047 1.00 0.00 H new ATOM 0 HA2 GLY B 377 8.303 1.678 4.753 1.00 0.00 H new ATOM 0 HA3 GLY B 377 9.904 0.970 4.838 1.00 0.00 H new ATOM 1624 N GLN B 378 9.750 1.679 1.851 1.00 0.00 N ATOM 1625 CA GLN B 378 10.226 2.525 0.750 1.00 0.00 C ATOM 1626 C GLN B 378 9.221 3.624 0.389 1.00 0.00 C ATOM 1627 O GLN B 378 9.615 4.724 -0.002 1.00 0.00 O ATOM 1628 CB GLN B 378 10.511 1.670 -0.492 1.00 0.00 C ATOM 1629 CG GLN B 378 11.616 0.637 -0.296 1.00 0.00 C ATOM 1630 CD GLN B 378 13.009 1.236 -0.106 1.00 0.00 C ATOM 1631 OE1 GLN B 378 13.160 2.544 -0.325 1.00 0.00 O flip ATOM 1632 NE2 GLN B 378 13.952 0.517 0.218 1.00 0.00 N flip ATOM 0 H GLN B 378 9.578 0.708 1.590 1.00 0.00 H new ATOM 0 HA GLN B 378 11.143 3.006 1.090 1.00 0.00 H new ATOM 0 HB2 GLN B 378 9.595 1.156 -0.784 1.00 0.00 H new ATOM 0 HB3 GLN B 378 10.785 2.327 -1.317 1.00 0.00 H new ATOM 0 HG2 GLN B 378 11.375 0.024 0.573 1.00 0.00 H new ATOM 0 HG3 GLN B 378 11.634 -0.028 -1.160 1.00 0.00 H new ATOM 0 HE21 GLN B 378 13.802 -0.479 0.378 1.00 0.00 H new ATOM 0 HE22 GLN B 378 14.884 0.917 0.327 1.00 0.00 H new ATOM 1641 N PHE B 379 7.927 3.321 0.511 1.00 0.00 N ATOM 1642 CA PHE B 379 6.872 4.284 0.186 1.00 0.00 C ATOM 1643 C PHE B 379 6.470 5.091 1.415 1.00 0.00 C ATOM 1644 O PHE B 379 6.171 6.282 1.320 1.00 0.00 O ATOM 1645 CB PHE B 379 5.662 3.543 -0.383 1.00 0.00 C ATOM 1646 CG PHE B 379 6.022 2.662 -1.540 1.00 0.00 C ATOM 1647 CD1 PHE B 379 6.540 3.207 -2.704 1.00 0.00 C ATOM 1648 CD2 PHE B 379 5.869 1.289 -1.456 1.00 0.00 C ATOM 1649 CE1 PHE B 379 6.898 2.398 -3.762 1.00 0.00 C ATOM 1650 CE2 PHE B 379 6.223 0.476 -2.512 1.00 0.00 C ATOM 1651 CZ PHE B 379 6.738 1.033 -3.666 1.00 0.00 C ATOM 0 H PHE B 379 7.584 2.416 0.833 1.00 0.00 H new ATOM 0 HA PHE B 379 7.253 4.981 -0.560 1.00 0.00 H new ATOM 0 HB2 PHE B 379 5.208 2.939 0.402 1.00 0.00 H new ATOM 0 HB3 PHE B 379 4.913 4.268 -0.701 1.00 0.00 H new ATOM 0 HD1 PHE B 379 6.665 4.277 -2.784 1.00 0.00 H new ATOM 0 HD2 PHE B 379 5.468 0.850 -0.554 1.00 0.00 H new ATOM 0 HE1 PHE B 379 7.303 2.833 -4.664 1.00 0.00 H new ATOM 0 HE2 PHE B 379 6.098 -0.594 -2.437 1.00 0.00 H new ATOM 0 HZ PHE B 379 7.016 0.398 -4.494 1.00 0.00 H new ATOM 1661 N LEU B 380 6.460 4.424 2.564 1.00 0.00 N ATOM 1662 CA LEU B 380 6.094 5.042 3.821 1.00 0.00 C ATOM 1663 C LEU B 380 6.940 4.452 4.947 1.00 0.00 C ATOM 1664 O LEU B 380 7.184 3.251 4.971 1.00 0.00 O ATOM 1665 CB LEU B 380 4.600 4.813 4.053 1.00 0.00 C ATOM 1666 CG LEU B 380 4.171 3.399 4.378 1.00 0.00 C ATOM 1667 CD1 LEU B 380 4.505 3.032 5.819 1.00 0.00 C ATOM 1668 CD2 LEU B 380 2.685 3.227 4.103 1.00 0.00 C ATOM 0 H LEU B 380 6.707 3.438 2.644 1.00 0.00 H new ATOM 0 HA LEU B 380 6.284 6.115 3.798 1.00 0.00 H new ATOM 0 HB2 LEU B 380 4.279 5.462 4.868 1.00 0.00 H new ATOM 0 HB3 LEU B 380 4.064 5.134 3.160 1.00 0.00 H new ATOM 0 HG LEU B 380 4.727 2.718 3.733 1.00 0.00 H new ATOM 0 HD11 LEU B 380 4.183 2.010 6.018 1.00 0.00 H new ATOM 0 HD12 LEU B 380 5.581 3.110 5.974 1.00 0.00 H new ATOM 0 HD13 LEU B 380 3.990 3.713 6.497 1.00 0.00 H new ATOM 0 HD21 LEU B 380 2.387 2.206 4.340 1.00 0.00 H new ATOM 0 HD22 LEU B 380 2.118 3.923 4.721 1.00 0.00 H new ATOM 0 HD23 LEU B 380 2.484 3.428 3.051 1.00 0.00 H new ATOM 1680 N PRO B 381 7.418 5.286 5.887 1.00 0.00 N ATOM 1681 CA PRO B 381 8.257 4.821 6.998 1.00 0.00 C ATOM 1682 C PRO B 381 7.440 4.077 8.057 1.00 0.00 C ATOM 1683 O PRO B 381 6.418 3.469 7.745 1.00 0.00 O ATOM 1684 CB PRO B 381 8.849 6.126 7.543 1.00 0.00 C ATOM 1685 CG PRO B 381 7.822 7.157 7.241 1.00 0.00 C ATOM 1686 CD PRO B 381 7.191 6.743 5.941 1.00 0.00 C ATOM 0 HA PRO B 381 9.016 4.101 6.691 1.00 0.00 H new ATOM 0 HB2 PRO B 381 9.040 6.058 8.614 1.00 0.00 H new ATOM 0 HB3 PRO B 381 9.800 6.361 7.064 1.00 0.00 H new ATOM 0 HG2 PRO B 381 7.078 7.212 8.036 1.00 0.00 H new ATOM 0 HG3 PRO B 381 8.274 8.146 7.158 1.00 0.00 H new ATOM 0 HD2 PRO B 381 6.128 6.983 5.918 1.00 0.00 H new ATOM 0 HD3 PRO B 381 7.651 7.251 5.093 1.00 0.00 H new ATOM 1694 N ASP B 382 7.880 4.135 9.307 1.00 0.00 N ATOM 1695 CA ASP B 382 7.166 3.473 10.392 1.00 0.00 C ATOM 1696 C ASP B 382 6.006 4.350 10.843 1.00 0.00 C ATOM 1697 O ASP B 382 4.881 3.871 10.995 1.00 0.00 O ATOM 1698 CB ASP B 382 8.104 3.182 11.566 1.00 0.00 C ATOM 1699 CG ASP B 382 9.228 2.233 11.188 1.00 0.00 C ATOM 1700 OD1 ASP B 382 8.931 1.082 10.805 1.00 0.00 O ATOM 1701 OD2 ASP B 382 10.405 2.644 11.273 1.00 0.00 O ATOM 0 H ASP B 382 8.724 4.631 9.595 1.00 0.00 H new ATOM 0 HA ASP B 382 6.780 2.520 10.030 1.00 0.00 H new ATOM 0 HB2 ASP B 382 8.529 4.118 11.929 1.00 0.00 H new ATOM 0 HB3 ASP B 382 7.531 2.753 12.388 1.00 0.00 H new ATOM 1706 N ALA B 383 6.291 5.645 11.023 1.00 0.00 N ATOM 1707 CA ALA B 383 5.281 6.619 11.424 1.00 0.00 C ATOM 1708 C ALA B 383 4.862 6.434 12.884 1.00 0.00 C ATOM 1709 O ALA B 383 5.144 7.341 13.696 1.00 0.00 O ATOM 1710 CB ALA B 383 4.079 6.544 10.489 1.00 0.00 C ATOM 1711 OXT ALA B 383 4.255 5.389 13.207 1.00 0.00 O ATOM 0 H ALA B 383 7.222 6.041 10.895 1.00 0.00 H new ATOM 0 HA ALA B 383 5.720 7.613 11.345 1.00 0.00 H new ATOM 0 HB1 ALA B 383 3.332 7.275 10.798 1.00 0.00 H new ATOM 0 HB2 ALA B 383 4.397 6.759 9.469 1.00 0.00 H new ATOM 0 HB3 ALA B 383 3.647 5.544 10.531 1.00 0.00 H new TER 1717 ALA B 383