USER MOD reduce.3.24.130724 H: found=0, std=0, add=922, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 924 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 TYR OH : rot -158:sc= 1.19 USER MOD Set 1.2: A 149 SER OG : rot -150:sc= 1.04 USER MOD Set 2.1: A 130 ASN : amide:sc= 0.381 X(o=0.65,f=0.7) USER MOD Set 2.2: A 135 THR OG1 : rot 180:sc= 0.265 USER MOD Set 3.1: A 82 GLN : amide:sc= 0.564 K(o=1.8,f=-0.72) USER MOD Set 3.2: A 114 GLN : amide:sc= 1.24 K(o=1.8,f=-2) USER MOD Set 4.1: A 29 GLN : amide:sc= 1.64 K(o=2.6,f=-2.2!) USER MOD Set 4.2: A 31 HIS : no HE2:sc= 0.922 K(o=2.6,f=-1.1!) USER MOD Single : A 27 THR OG1 : rot 86:sc= 1.11 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0.974 K(o=0.97,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 170:sc= 1.78 (180deg=1.6) USER MOD Single : A 56 THR OG1 : rot -160:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.0163 K(o=-0.016,f=-0.54) USER MOD Single : A 76 LYS NZ :NH3+ -146:sc= 1.26 (180deg=0.247) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -0.158 X(o=-0.16,f=-0.16) USER MOD Single : A 87 TYR OH : rot 179:sc= -1.43 USER MOD Single : A 101 CYS SG : rot -31:sc= -1.9! USER MOD Single : A 102 ASN : amide:sc= -0.0165 X(o=-0.017,f=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.0718 X(o=-0.072,f=-0.095) USER MOD Single : A 112 GLN : amide:sc= -0.0255 X(o=-0.025,f=-0.11) USER MOD Single : A 115 SER OG : rot -162:sc= 0.546 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 MET CE :methyl -165:sc= -0.0154 (180deg=-0.31) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot -91:sc= -0.0432 USER MOD Single : A 138 ASN : amide:sc= -0.498 K(o=-0.5,f=-3.9!) USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 THR OG1 : rot -57:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 4.378 -0.102 0.058 1.00 1.00 N ATOM 21 CA ALA A 2 5.814 0.190 -0.012 1.00 1.00 C ATOM 22 C ALA A 2 6.515 -0.568 -1.138 1.00 1.00 C ATOM 23 O ALA A 2 6.030 -1.591 -1.619 1.00 1.00 O ATOM 24 CB ALA A 2 6.468 -0.201 1.320 1.00 1.00 C ATOM 0 HA ALA A 2 5.919 1.256 -0.213 1.00 1.00 H new ATOM 0 HB1 ALA A 2 7.536 0.012 1.277 1.00 1.00 H new ATOM 0 HB2 ALA A 2 6.015 0.372 2.129 1.00 1.00 H new ATOM 0 HB3 ALA A 2 6.318 -1.265 1.501 1.00 1.00 H new ATOM 30 N GLU A 3 7.718 -0.103 -1.472 1.00 1.00 N ATOM 31 CA GLU A 3 8.637 -0.723 -2.425 1.00 1.00 C ATOM 32 C GLU A 3 9.965 -1.068 -1.742 1.00 1.00 C ATOM 33 O GLU A 3 10.610 -0.195 -1.158 1.00 1.00 O ATOM 34 CB GLU A 3 8.884 0.240 -3.590 1.00 1.00 C ATOM 35 CG GLU A 3 8.022 -0.095 -4.800 1.00 1.00 C ATOM 36 CD GLU A 3 7.996 1.038 -5.842 1.00 1.00 C ATOM 37 OE1 GLU A 3 7.388 2.103 -5.576 1.00 1.00 O ATOM 38 OE2 GLU A 3 8.579 0.867 -6.940 1.00 1.00 O1- ATOM 0 H GLU A 3 8.095 0.754 -1.068 1.00 1.00 H new ATOM 0 HA GLU A 3 8.193 -1.645 -2.800 1.00 1.00 H new ATOM 0 HB2 GLU A 3 8.675 1.260 -3.268 1.00 1.00 H new ATOM 0 HB3 GLU A 3 9.936 0.204 -3.873 1.00 1.00 H new ATOM 0 HG2 GLU A 3 8.398 -1.005 -5.268 1.00 1.00 H new ATOM 0 HG3 GLU A 3 7.004 -0.303 -4.470 1.00 1.00 H new ATOM 45 N ILE A 4 10.360 -2.341 -1.823 1.00 1.00 N ATOM 46 CA ILE A 4 11.566 -2.904 -1.224 1.00 1.00 C ATOM 47 C ILE A 4 12.474 -3.571 -2.249 1.00 1.00 C ATOM 48 O ILE A 4 12.168 -4.641 -2.772 1.00 1.00 O ATOM 49 CB ILE A 4 11.252 -3.898 -0.090 1.00 1.00 C ATOM 50 CG1 ILE A 4 10.214 -3.317 0.891 1.00 1.00 C ATOM 51 CG2 ILE A 4 12.524 -4.190 0.701 1.00 1.00 C ATOM 52 CD1 ILE A 4 8.900 -4.065 0.779 1.00 1.00 C ATOM 0 H ILE A 4 9.819 -3.039 -2.334 1.00 1.00 H new ATOM 0 HA ILE A 4 12.096 -2.052 -0.800 1.00 1.00 H new ATOM 0 HB ILE A 4 10.855 -4.805 -0.546 1.00 1.00 H new ATOM 0 HG12 ILE A 4 10.592 -3.384 1.911 1.00 1.00 H new ATOM 0 HG13 ILE A 4 10.056 -2.260 0.679 1.00 1.00 H new ATOM 0 HG21 ILE A 4 12.300 -4.893 1.503 1.00 1.00 H new ATOM 0 HG22 ILE A 4 13.274 -4.622 0.038 1.00 1.00 H new ATOM 0 HG23 ILE A 4 12.908 -3.263 1.128 1.00 1.00 H new ATOM 0 HD11 ILE A 4 8.179 -3.641 1.479 1.00 1.00 H new ATOM 0 HD12 ILE A 4 8.516 -3.975 -0.237 1.00 1.00 H new ATOM 0 HD13 ILE A 4 9.059 -5.117 1.015 1.00 1.00 H new ATOM 64 N GLY A 5 13.647 -2.993 -2.455 1.00 1.00 N ATOM 65 CA GLY A 5 14.699 -3.637 -3.240 1.00 1.00 C ATOM 66 C GLY A 5 15.599 -4.463 -2.346 1.00 1.00 C ATOM 67 O GLY A 5 16.145 -3.938 -1.385 1.00 1.00 O ATOM 0 H GLY A 5 13.899 -2.075 -2.089 1.00 1.00 H new ATOM 0 HA2 GLY A 5 14.253 -4.274 -4.004 1.00 1.00 H new ATOM 0 HA3 GLY A 5 15.288 -2.881 -3.759 1.00 1.00 H new ATOM 71 N ILE A 6 15.750 -5.752 -2.627 1.00 1.00 N ATOM 72 CA ILE A 6 16.577 -6.666 -1.845 1.00 1.00 C ATOM 73 C ILE A 6 17.857 -6.961 -2.601 1.00 1.00 C ATOM 74 O ILE A 6 17.829 -7.481 -3.712 1.00 1.00 O ATOM 75 CB ILE A 6 15.805 -7.937 -1.532 1.00 1.00 C ATOM 76 CG1 ILE A 6 14.575 -7.550 -0.700 1.00 1.00 C ATOM 77 CG2 ILE A 6 16.647 -8.940 -0.729 1.00 1.00 C ATOM 78 CD1 ILE A 6 13.410 -8.422 -1.063 1.00 1.00 C ATOM 0 H ILE A 6 15.292 -6.201 -3.420 1.00 1.00 H new ATOM 0 HA ILE A 6 16.841 -6.202 -0.895 1.00 1.00 H new ATOM 0 HB ILE A 6 15.526 -8.414 -2.472 1.00 1.00 H new ATOM 0 HG12 ILE A 6 14.798 -7.652 0.362 1.00 1.00 H new ATOM 0 HG13 ILE A 6 14.324 -6.504 -0.874 1.00 1.00 H new ATOM 0 HG21 ILE A 6 16.055 -9.833 -0.528 1.00 1.00 H new ATOM 0 HG22 ILE A 6 17.533 -9.213 -1.303 1.00 1.00 H new ATOM 0 HG23 ILE A 6 16.951 -8.487 0.214 1.00 1.00 H new ATOM 0 HD11 ILE A 6 12.543 -8.138 -0.466 1.00 1.00 H new ATOM 0 HD12 ILE A 6 13.179 -8.298 -2.121 1.00 1.00 H new ATOM 0 HD13 ILE A 6 13.660 -9.464 -0.866 1.00 1.00 H new ATOM 90 N PHE A 7 18.979 -6.667 -1.971 1.00 1.00 N ATOM 91 CA PHE A 7 20.298 -6.670 -2.579 1.00 1.00 C ATOM 92 C PHE A 7 21.116 -7.775 -1.936 1.00 1.00 C ATOM 93 O PHE A 7 21.453 -7.699 -0.751 1.00 1.00 O ATOM 94 CB PHE A 7 20.911 -5.275 -2.414 1.00 1.00 C ATOM 95 CG PHE A 7 20.255 -4.269 -3.339 1.00 1.00 C ATOM 96 CD1 PHE A 7 18.978 -3.744 -3.058 1.00 1.00 C ATOM 97 CD2 PHE A 7 20.900 -3.912 -4.532 1.00 1.00 C ATOM 98 CE1 PHE A 7 18.343 -2.908 -3.988 1.00 1.00 C ATOM 99 CE2 PHE A 7 20.262 -3.084 -5.467 1.00 1.00 C ATOM 100 CZ PHE A 7 18.970 -2.602 -5.201 1.00 1.00 C ATOM 0 H PHE A 7 18.998 -6.410 -0.984 1.00 1.00 H new ATOM 0 HA PHE A 7 20.263 -6.877 -3.649 1.00 1.00 H new ATOM 0 HB2 PHE A 7 20.800 -4.947 -1.380 1.00 1.00 H new ATOM 0 HB3 PHE A 7 21.980 -5.319 -2.621 1.00 1.00 H new ATOM 0 HD1 PHE A 7 18.488 -3.985 -2.126 1.00 1.00 H new ATOM 0 HD2 PHE A 7 21.896 -4.278 -4.732 1.00 1.00 H new ATOM 0 HE1 PHE A 7 17.368 -2.499 -3.767 1.00 1.00 H new ATOM 0 HE2 PHE A 7 20.762 -2.818 -6.387 1.00 1.00 H new ATOM 0 HZ PHE A 7 18.460 -1.994 -5.934 1.00 1.00 H new ATOM 110 N VAL A 8 21.365 -8.840 -2.705 1.00 1.00 N ATOM 111 CA VAL A 8 22.014 -10.041 -2.180 1.00 1.00 C ATOM 112 C VAL A 8 23.533 -9.976 -2.376 1.00 1.00 C ATOM 113 O VAL A 8 24.005 -9.603 -3.450 1.00 1.00 O ATOM 114 CB VAL A 8 21.360 -11.313 -2.749 1.00 1.00 C ATOM 115 CG1 VAL A 8 21.807 -11.668 -4.167 1.00 1.00 C ATOM 116 CG2 VAL A 8 21.630 -12.509 -1.838 1.00 1.00 C ATOM 0 H VAL A 8 21.125 -8.893 -3.695 1.00 1.00 H new ATOM 0 HA VAL A 8 21.860 -10.088 -1.102 1.00 1.00 H new ATOM 0 HB VAL A 8 20.294 -11.088 -2.795 1.00 1.00 H new ATOM 0 HG11 VAL A 8 21.299 -12.576 -4.492 1.00 1.00 H new ATOM 0 HG12 VAL A 8 21.556 -10.851 -4.843 1.00 1.00 H new ATOM 0 HG13 VAL A 8 22.885 -11.831 -4.179 1.00 1.00 H new ATOM 0 HG21 VAL A 8 21.160 -13.399 -2.257 1.00 1.00 H new ATOM 0 HG22 VAL A 8 22.705 -12.670 -1.758 1.00 1.00 H new ATOM 0 HG23 VAL A 8 21.218 -12.313 -0.848 1.00 1.00 H new ATOM 236 N LEU A 17 19.439 -17.767 -0.770 1.00 1.00 N ATOM 237 CA LEU A 17 18.049 -18.125 -0.405 1.00 1.00 C ATOM 238 C LEU A 17 17.263 -17.032 0.331 1.00 1.00 C ATOM 239 O LEU A 17 16.171 -16.659 -0.081 1.00 1.00 O ATOM 240 CB LEU A 17 18.073 -19.465 0.355 1.00 1.00 C ATOM 241 CG LEU A 17 16.760 -19.857 1.051 1.00 1.00 C ATOM 242 CD1 LEU A 17 15.641 -20.148 0.056 1.00 1.00 C ATOM 243 CD2 LEU A 17 17.038 -21.077 1.916 1.00 1.00 C ATOM 0 HA LEU A 17 17.485 -18.233 -1.332 1.00 1.00 H new ATOM 0 HB2 LEU A 17 18.342 -20.255 -0.346 1.00 1.00 H new ATOM 0 HB3 LEU A 17 18.863 -19.423 1.105 1.00 1.00 H new ATOM 0 HG LEU A 17 16.416 -19.021 1.659 1.00 1.00 H new ATOM 0 HD11 LEU A 17 14.735 -20.420 0.597 1.00 1.00 H new ATOM 0 HD12 LEU A 17 15.451 -19.260 -0.547 1.00 1.00 H new ATOM 0 HD13 LEU A 17 15.937 -20.972 -0.594 1.00 1.00 H new ATOM 0 HD21 LEU A 17 16.122 -21.379 2.424 1.00 1.00 H new ATOM 0 HD22 LEU A 17 17.392 -21.895 1.288 1.00 1.00 H new ATOM 0 HD23 LEU A 17 17.800 -20.832 2.656 1.00 1.00 H new ATOM 255 N VAL A 18 17.819 -16.493 1.411 1.00 1.00 N ATOM 256 CA VAL A 18 17.191 -15.509 2.304 1.00 1.00 C ATOM 257 C VAL A 18 16.669 -14.289 1.552 1.00 1.00 C ATOM 258 O VAL A 18 15.621 -13.770 1.903 1.00 1.00 O ATOM 259 CB VAL A 18 18.178 -15.054 3.392 1.00 1.00 C ATOM 260 CG1 VAL A 18 17.567 -13.943 4.256 1.00 1.00 C ATOM 261 CG2 VAL A 18 18.593 -16.234 4.278 1.00 1.00 C ATOM 0 H VAL A 18 18.764 -16.738 1.707 1.00 1.00 H new ATOM 0 HA VAL A 18 16.339 -16.009 2.765 1.00 1.00 H new ATOM 0 HB VAL A 18 19.064 -14.661 2.893 1.00 1.00 H new ATOM 0 HG11 VAL A 18 18.284 -13.638 5.018 1.00 1.00 H new ATOM 0 HG12 VAL A 18 17.320 -13.087 3.627 1.00 1.00 H new ATOM 0 HG13 VAL A 18 16.662 -14.313 4.737 1.00 1.00 H new ATOM 0 HG21 VAL A 18 19.291 -15.889 5.040 1.00 1.00 H new ATOM 0 HG22 VAL A 18 17.710 -16.656 4.759 1.00 1.00 H new ATOM 0 HG23 VAL A 18 19.073 -16.998 3.666 1.00 1.00 H new ATOM 271 N ALA A 19 17.338 -13.831 0.494 1.00 1.00 N ATOM 272 CA ALA A 19 16.812 -12.746 -0.329 1.00 1.00 C ATOM 273 C ALA A 19 15.440 -13.074 -0.923 1.00 1.00 C ATOM 274 O ALA A 19 14.521 -12.260 -0.882 1.00 1.00 O ATOM 275 CB ALA A 19 17.783 -12.527 -1.480 1.00 1.00 C ATOM 0 H ALA A 19 18.241 -14.194 0.189 1.00 1.00 H new ATOM 0 HA ALA A 19 16.701 -11.863 0.301 1.00 1.00 H new ATOM 0 HB1 ALA A 19 17.418 -11.720 -2.116 1.00 1.00 H new ATOM 0 HB2 ALA A 19 18.763 -12.261 -1.084 1.00 1.00 H new ATOM 0 HB3 ALA A 19 17.865 -13.442 -2.066 1.00 1.00 H new ATOM 281 N GLU A 20 15.319 -14.285 -1.463 1.00 1.00 N ATOM 282 CA GLU A 20 14.105 -14.791 -2.104 1.00 1.00 C ATOM 283 C GLU A 20 13.002 -15.036 -1.064 1.00 1.00 C ATOM 284 O GLU A 20 11.821 -14.831 -1.341 1.00 1.00 O ATOM 285 CB GLU A 20 14.386 -16.101 -2.879 1.00 1.00 C ATOM 286 CG GLU A 20 15.783 -16.192 -3.516 1.00 1.00 C ATOM 287 CD GLU A 20 15.970 -17.432 -4.417 1.00 1.00 C ATOM 288 OE1 GLU A 20 15.128 -17.682 -5.315 1.00 1.00 O ATOM 289 OE2 GLU A 20 16.991 -18.145 -4.251 1.00 1.00 O1- ATOM 0 H GLU A 20 16.083 -14.961 -1.467 1.00 1.00 H new ATOM 0 HA GLU A 20 13.768 -14.032 -2.810 1.00 1.00 H new ATOM 0 HB2 GLU A 20 14.258 -16.943 -2.198 1.00 1.00 H new ATOM 0 HB3 GLU A 20 13.637 -16.209 -3.664 1.00 1.00 H new ATOM 0 HG2 GLU A 20 15.964 -15.294 -4.106 1.00 1.00 H new ATOM 0 HG3 GLU A 20 16.533 -16.211 -2.726 1.00 1.00 H new ATOM 296 N GLU A 21 13.405 -15.393 0.159 1.00 1.00 N ATOM 297 CA GLU A 21 12.506 -15.475 1.305 1.00 1.00 C ATOM 298 C GLU A 21 12.011 -14.088 1.654 1.00 1.00 C ATOM 299 O GLU A 21 10.816 -13.874 1.806 1.00 1.00 O ATOM 300 CB GLU A 21 13.192 -16.068 2.542 1.00 1.00 C ATOM 301 CG GLU A 21 13.600 -17.527 2.341 1.00 1.00 C ATOM 302 CD GLU A 21 12.365 -18.440 2.501 1.00 1.00 C ATOM 303 OE1 GLU A 21 11.883 -18.612 3.650 1.00 1.00 O1- ATOM 304 OE2 GLU A 21 11.849 -18.942 1.473 1.00 1.00 O ATOM 0 H GLU A 21 14.371 -15.634 0.379 1.00 1.00 H new ATOM 0 HA GLU A 21 11.682 -16.131 1.024 1.00 1.00 H new ATOM 0 HB2 GLU A 21 14.076 -15.477 2.782 1.00 1.00 H new ATOM 0 HB3 GLU A 21 12.519 -15.997 3.396 1.00 1.00 H new ATOM 0 HG2 GLU A 21 14.036 -17.659 1.351 1.00 1.00 H new ATOM 0 HG3 GLU A 21 14.365 -17.804 3.066 1.00 1.00 H new ATOM 311 N ALA A 22 12.925 -13.127 1.746 1.00 1.00 N ATOM 312 CA ALA A 22 12.614 -11.798 2.207 1.00 1.00 C ATOM 313 C ALA A 22 11.675 -11.053 1.270 1.00 1.00 C ATOM 314 O ALA A 22 10.701 -10.447 1.713 1.00 1.00 O ATOM 315 CB ALA A 22 13.916 -11.036 2.410 1.00 1.00 C ATOM 0 H ALA A 22 13.906 -13.260 1.499 1.00 1.00 H new ATOM 0 HA ALA A 22 12.079 -11.878 3.153 1.00 1.00 H new ATOM 0 HB1 ALA A 22 13.696 -10.027 2.759 1.00 1.00 H new ATOM 0 HB2 ALA A 22 14.528 -11.551 3.151 1.00 1.00 H new ATOM 0 HB3 ALA A 22 14.458 -10.983 1.466 1.00 1.00 H new ATOM 321 N GLU A 23 11.930 -11.170 -0.026 1.00 1.00 N ATOM 322 CA GLU A 23 11.031 -10.712 -1.068 1.00 1.00 C ATOM 323 C GLU A 23 9.634 -11.316 -0.873 1.00 1.00 C ATOM 324 O GLU A 23 8.640 -10.594 -0.839 1.00 1.00 O ATOM 325 CB GLU A 23 11.639 -11.201 -2.392 1.00 1.00 C ATOM 326 CG GLU A 23 10.895 -10.746 -3.639 1.00 1.00 C ATOM 327 CD GLU A 23 11.206 -11.608 -4.879 1.00 1.00 C ATOM 328 OE1 GLU A 23 10.748 -12.773 -4.940 1.00 1.00 O ATOM 329 OE2 GLU A 23 11.893 -11.108 -5.804 1.00 1.00 O1- ATOM 0 H GLU A 23 12.785 -11.595 -0.386 1.00 1.00 H new ATOM 0 HA GLU A 23 10.920 -9.628 -1.051 1.00 1.00 H new ATOM 0 HB2 GLU A 23 12.670 -10.853 -2.453 1.00 1.00 H new ATOM 0 HB3 GLU A 23 11.670 -12.290 -2.381 1.00 1.00 H new ATOM 0 HG2 GLU A 23 9.823 -10.773 -3.445 1.00 1.00 H new ATOM 0 HG3 GLU A 23 11.154 -9.709 -3.851 1.00 1.00 H new ATOM 336 N ALA A 24 9.562 -12.632 -0.675 1.00 1.00 N ATOM 337 CA ALA A 24 8.305 -13.359 -0.591 1.00 1.00 C ATOM 338 C ALA A 24 7.551 -13.077 0.712 1.00 1.00 C ATOM 339 O ALA A 24 6.336 -12.913 0.681 1.00 1.00 O ATOM 340 CB ALA A 24 8.569 -14.853 -0.792 1.00 1.00 C ATOM 0 H ALA A 24 10.385 -13.225 -0.568 1.00 1.00 H new ATOM 0 HA ALA A 24 7.650 -13.007 -1.388 1.00 1.00 H new ATOM 0 HB1 ALA A 24 7.628 -15.400 -0.729 1.00 1.00 H new ATOM 0 HB2 ALA A 24 9.018 -15.014 -1.772 1.00 1.00 H new ATOM 0 HB3 ALA A 24 9.248 -15.210 -0.018 1.00 1.00 H new ATOM 346 N ILE A 25 8.245 -12.920 1.840 1.00 1.00 N ATOM 347 CA ILE A 25 7.647 -12.554 3.107 1.00 1.00 C ATOM 348 C ILE A 25 7.101 -11.147 3.011 1.00 1.00 C ATOM 349 O ILE A 25 5.948 -10.918 3.370 1.00 1.00 O ATOM 350 CB ILE A 25 8.669 -12.697 4.225 1.00 1.00 C ATOM 351 CG1 ILE A 25 8.904 -14.192 4.522 1.00 1.00 C ATOM 352 CG2 ILE A 25 8.185 -12.015 5.503 1.00 1.00 C ATOM 353 CD1 ILE A 25 10.349 -14.394 4.928 1.00 1.00 C ATOM 0 H ILE A 25 9.256 -13.048 1.891 1.00 1.00 H new ATOM 0 HA ILE A 25 6.818 -13.222 3.340 1.00 1.00 H new ATOM 0 HB ILE A 25 9.595 -12.222 3.899 1.00 1.00 H new ATOM 0 HG12 ILE A 25 8.239 -14.526 5.318 1.00 1.00 H new ATOM 0 HG13 ILE A 25 8.673 -14.791 3.641 1.00 1.00 H new ATOM 0 HG21 ILE A 25 8.935 -12.133 6.285 1.00 1.00 H new ATOM 0 HG22 ILE A 25 8.025 -10.954 5.311 1.00 1.00 H new ATOM 0 HG23 ILE A 25 7.249 -12.470 5.826 1.00 1.00 H new ATOM 0 HD11 ILE A 25 10.523 -15.449 5.140 1.00 1.00 H new ATOM 0 HD12 ILE A 25 11.003 -14.074 4.117 1.00 1.00 H new ATOM 0 HD13 ILE A 25 10.562 -13.805 5.820 1.00 1.00 H new ATOM 365 N LEU A 26 7.880 -10.205 2.476 1.00 1.00 N ATOM 366 CA LEU A 26 7.416 -8.839 2.429 1.00 1.00 C ATOM 367 C LEU A 26 6.227 -8.704 1.463 1.00 1.00 C ATOM 368 O LEU A 26 5.256 -8.002 1.740 1.00 1.00 O ATOM 369 CB LEU A 26 8.591 -7.902 2.098 1.00 1.00 C ATOM 370 CG LEU A 26 9.448 -7.445 3.301 1.00 1.00 C ATOM 371 CD1 LEU A 26 9.529 -5.932 3.422 1.00 1.00 C ATOM 372 CD2 LEU A 26 8.953 -7.893 4.674 1.00 1.00 C ATOM 0 H LEU A 26 8.807 -10.366 2.083 1.00 1.00 H new ATOM 0 HA LEU A 26 7.040 -8.538 3.407 1.00 1.00 H new ATOM 0 HB2 LEU A 26 9.242 -8.405 1.383 1.00 1.00 H new ATOM 0 HB3 LEU A 26 8.196 -7.016 1.601 1.00 1.00 H new ATOM 0 HG LEU A 26 10.403 -7.915 3.068 1.00 1.00 H new ATOM 0 HD11 LEU A 26 10.143 -5.668 4.283 1.00 1.00 H new ATOM 0 HD12 LEU A 26 9.975 -5.518 2.518 1.00 1.00 H new ATOM 0 HD13 LEU A 26 8.527 -5.523 3.552 1.00 1.00 H new ATOM 0 HD21 LEU A 26 9.627 -7.518 5.444 1.00 1.00 H new ATOM 0 HD22 LEU A 26 7.951 -7.500 4.846 1.00 1.00 H new ATOM 0 HD23 LEU A 26 8.927 -8.982 4.714 1.00 1.00 H new ATOM 384 N THR A 27 6.242 -9.479 0.383 1.00 1.00 N ATOM 385 CA THR A 27 5.134 -9.652 -0.539 1.00 1.00 C ATOM 386 C THR A 27 3.893 -10.275 0.108 1.00 1.00 C ATOM 387 O THR A 27 2.780 -9.820 -0.145 1.00 1.00 O ATOM 388 CB THR A 27 5.633 -10.448 -1.731 1.00 1.00 C ATOM 389 OG1 THR A 27 6.612 -9.721 -2.447 1.00 1.00 O ATOM 390 CG2 THR A 27 4.519 -10.763 -2.693 1.00 1.00 C ATOM 0 H THR A 27 7.062 -10.025 0.119 1.00 1.00 H new ATOM 0 HA THR A 27 4.793 -8.670 -0.868 1.00 1.00 H new ATOM 0 HB THR A 27 6.052 -11.371 -1.330 1.00 1.00 H new ATOM 0 HG1 THR A 27 7.492 -9.872 -2.043 1.00 1.00 H new ATOM 0 HG21 THR A 27 4.914 -11.334 -3.533 1.00 1.00 H new ATOM 0 HG22 THR A 27 3.754 -11.349 -2.184 1.00 1.00 H new ATOM 0 HG23 THR A 27 4.081 -9.834 -3.059 1.00 1.00 H new ATOM 398 N ALA A 28 4.070 -11.263 0.985 1.00 1.00 N ATOM 399 CA ALA A 28 2.987 -11.917 1.713 1.00 1.00 C ATOM 400 C ALA A 28 2.336 -10.979 2.748 1.00 1.00 C ATOM 401 O ALA A 28 1.124 -11.034 2.971 1.00 1.00 O ATOM 402 CB ALA A 28 3.538 -13.193 2.364 1.00 1.00 C ATOM 0 H ALA A 28 4.991 -11.638 1.213 1.00 1.00 H new ATOM 0 HA ALA A 28 2.193 -12.181 1.014 1.00 1.00 H new ATOM 0 HB1 ALA A 28 2.741 -13.695 2.913 1.00 1.00 H new ATOM 0 HB2 ALA A 28 3.922 -13.859 1.591 1.00 1.00 H new ATOM 0 HB3 ALA A 28 4.343 -12.932 3.051 1.00 1.00 H new ATOM 408 N GLN A 29 3.134 -10.079 3.332 1.00 1.00 N ATOM 409 CA GLN A 29 2.668 -8.987 4.191 1.00 1.00 C ATOM 410 C GLN A 29 1.921 -7.889 3.417 1.00 1.00 C ATOM 411 O GLN A 29 0.999 -7.271 3.952 1.00 1.00 O ATOM 412 CB GLN A 29 3.857 -8.413 4.971 1.00 1.00 C ATOM 413 CG GLN A 29 4.349 -9.466 5.970 1.00 1.00 C ATOM 414 CD GLN A 29 5.165 -8.907 7.119 1.00 1.00 C ATOM 415 OE1 GLN A 29 5.528 -7.746 7.207 1.00 1.00 O ATOM 416 NE2 GLN A 29 5.471 -9.756 8.056 1.00 1.00 N ATOM 0 H GLN A 29 4.147 -10.091 3.217 1.00 1.00 H new ATOM 0 HA GLN A 29 1.939 -9.399 4.889 1.00 1.00 H new ATOM 0 HB2 GLN A 29 4.660 -8.138 4.287 1.00 1.00 H new ATOM 0 HB3 GLN A 29 3.561 -7.505 5.496 1.00 1.00 H new ATOM 0 HG2 GLN A 29 3.487 -9.994 6.376 1.00 1.00 H new ATOM 0 HG3 GLN A 29 4.951 -10.201 5.437 1.00 1.00 H new ATOM 0 HE21 GLN A 29 5.168 -10.727 7.983 1.00 1.00 H new ATOM 0 HE22 GLN A 29 6.014 -9.450 8.864 1.00 1.00 H new ATOM 425 N GLY A 30 2.282 -7.695 2.145 1.00 1.00 N ATOM 426 CA GLY A 30 1.550 -6.849 1.191 1.00 1.00 C ATOM 427 C GLY A 30 2.361 -5.686 0.620 1.00 1.00 C ATOM 428 O GLY A 30 1.776 -4.691 0.186 1.00 1.00 O ATOM 0 H GLY A 30 3.110 -8.131 1.738 1.00 1.00 H new ATOM 0 HA2 GLY A 30 1.202 -7.471 0.367 1.00 1.00 H new ATOM 0 HA3 GLY A 30 0.664 -6.449 1.685 1.00 1.00 H new ATOM 432 N HIS A 31 3.692 -5.793 0.630 1.00 1.00 N ATOM 433 CA HIS A 31 4.606 -4.777 0.108 1.00 1.00 C ATOM 434 C HIS A 31 5.268 -5.290 -1.177 1.00 1.00 C ATOM 435 O HIS A 31 5.479 -6.490 -1.343 1.00 1.00 O ATOM 436 CB HIS A 31 5.652 -4.401 1.167 1.00 1.00 C ATOM 437 CG HIS A 31 5.153 -4.316 2.589 1.00 1.00 C ATOM 438 ND1 HIS A 31 4.534 -3.259 3.225 1.00 1.00 N ATOM 439 CD2 HIS A 31 5.265 -5.318 3.512 1.00 1.00 C ATOM 440 CE1 HIS A 31 4.268 -3.631 4.489 1.00 1.00 C ATOM 441 NE2 HIS A 31 4.689 -4.889 4.711 1.00 1.00 N ATOM 0 H HIS A 31 4.174 -6.608 1.010 1.00 1.00 H new ATOM 0 HA HIS A 31 4.044 -3.874 -0.132 1.00 1.00 H new ATOM 0 HB2 HIS A 31 6.458 -5.134 1.129 1.00 1.00 H new ATOM 0 HB3 HIS A 31 6.084 -3.438 0.896 1.00 1.00 H new ATOM 0 HD1 HIS A 31 4.316 -2.354 2.809 1.00 1.00 H new ATOM 0 HD2 HIS A 31 5.723 -6.281 3.343 1.00 1.00 H new ATOM 0 HE1 HIS A 31 3.783 -3.006 5.225 1.00 1.00 H new ATOM 449 N LYS A 32 5.656 -4.392 -2.083 1.00 1.00 N ATOM 450 CA LYS A 32 6.241 -4.718 -3.381 1.00 1.00 C ATOM 451 C LYS A 32 7.739 -4.916 -3.204 1.00 1.00 C ATOM 452 O LYS A 32 8.526 -3.979 -3.313 1.00 1.00 O ATOM 453 CB LYS A 32 5.854 -3.615 -4.383 1.00 1.00 C ATOM 454 CG LYS A 32 6.384 -3.827 -5.805 1.00 1.00 C ATOM 455 CD LYS A 32 5.778 -5.054 -6.511 1.00 1.00 C ATOM 456 CE LYS A 32 6.258 -5.116 -7.969 1.00 1.00 C ATOM 457 NZ LYS A 32 5.659 -6.266 -8.704 1.00 1.00 N1+ ATOM 0 H LYS A 32 5.569 -3.388 -1.928 1.00 1.00 H new ATOM 0 HA LYS A 32 5.857 -5.653 -3.790 1.00 1.00 H new ATOM 0 HB2 LYS A 32 4.767 -3.544 -4.422 1.00 1.00 H new ATOM 0 HB3 LYS A 32 6.223 -2.659 -4.011 1.00 1.00 H new ATOM 0 HG2 LYS A 32 6.175 -2.937 -6.398 1.00 1.00 H new ATOM 0 HG3 LYS A 32 7.468 -3.938 -5.767 1.00 1.00 H new ATOM 0 HD2 LYS A 32 6.067 -5.965 -5.986 1.00 1.00 H new ATOM 0 HD3 LYS A 32 4.690 -5.000 -6.480 1.00 1.00 H new ATOM 0 HE2 LYS A 32 5.999 -4.187 -8.476 1.00 1.00 H new ATOM 0 HE3 LYS A 32 7.345 -5.198 -7.990 1.00 1.00 H new ATOM 0 HZ1 LYS A 32 6.008 -6.272 -9.684 1.00 1.00 H new ATOM 0 HZ2 LYS A 32 5.927 -7.155 -8.235 1.00 1.00 H new ATOM 0 HZ3 LYS A 32 4.623 -6.175 -8.707 1.00 1.00 H new ATOM 471 N ALA A 33 8.118 -6.131 -2.836 1.00 1.00 N ATOM 472 CA ALA A 33 9.504 -6.503 -2.616 1.00 1.00 C ATOM 473 C ALA A 33 10.065 -7.278 -3.815 1.00 1.00 C ATOM 474 O ALA A 33 9.350 -8.063 -4.440 1.00 1.00 O ATOM 475 CB ALA A 33 9.604 -7.248 -1.292 1.00 1.00 C ATOM 0 H ALA A 33 7.461 -6.895 -2.680 1.00 1.00 H new ATOM 0 HA ALA A 33 10.133 -5.616 -2.540 1.00 1.00 H new ATOM 0 HB1 ALA A 33 10.640 -7.534 -1.113 1.00 1.00 H new ATOM 0 HB2 ALA A 33 9.261 -6.602 -0.484 1.00 1.00 H new ATOM 0 HB3 ALA A 33 8.982 -8.142 -1.330 1.00 1.00 H new ATOM 481 N THR A 34 11.352 -7.074 -4.105 1.00 1.00 N ATOM 482 CA THR A 34 12.040 -7.686 -5.251 1.00 1.00 C ATOM 483 C THR A 34 13.499 -7.972 -4.961 1.00 1.00 C ATOM 484 O THR A 34 14.189 -7.121 -4.413 1.00 1.00 O ATOM 485 CB THR A 34 11.978 -6.795 -6.494 1.00 1.00 C ATOM 486 OG1 THR A 34 10.644 -6.495 -6.862 1.00 1.00 O ATOM 487 CG2 THR A 34 12.620 -7.572 -7.638 1.00 1.00 C ATOM 0 H THR A 34 11.956 -6.472 -3.545 1.00 1.00 H new ATOM 0 HA THR A 34 11.514 -8.623 -5.435 1.00 1.00 H new ATOM 0 HB THR A 34 12.491 -5.857 -6.283 1.00 1.00 H new ATOM 0 HG1 THR A 34 10.645 -5.923 -7.658 1.00 1.00 H new ATOM 0 HG21 THR A 34 12.596 -6.969 -8.546 1.00 1.00 H new ATOM 0 HG22 THR A 34 13.654 -7.805 -7.384 1.00 1.00 H new ATOM 0 HG23 THR A 34 12.070 -8.498 -7.803 1.00 1.00 H new ATOM 495 N VAL A 35 13.997 -9.126 -5.405 1.00 1.00 N ATOM 496 CA VAL A 35 15.410 -9.492 -5.374 1.00 1.00 C ATOM 497 C VAL A 35 16.226 -9.028 -6.584 1.00 1.00 C ATOM 498 O VAL A 35 15.836 -9.226 -7.737 1.00 1.00 O ATOM 499 CB VAL A 35 15.578 -11.010 -5.195 1.00 1.00 C ATOM 500 CG1 VAL A 35 17.049 -11.436 -5.065 1.00 1.00 C ATOM 501 CG2 VAL A 35 14.843 -11.482 -3.950 1.00 1.00 C ATOM 0 H VAL A 35 13.408 -9.854 -5.809 1.00 1.00 H new ATOM 0 HA VAL A 35 15.813 -8.956 -4.515 1.00 1.00 H new ATOM 0 HB VAL A 35 15.162 -11.466 -6.093 1.00 1.00 H new ATOM 0 HG11 VAL A 35 17.105 -12.517 -4.941 1.00 1.00 H new ATOM 0 HG12 VAL A 35 17.593 -11.145 -5.964 1.00 1.00 H new ATOM 0 HG13 VAL A 35 17.494 -10.948 -4.198 1.00 1.00 H new ATOM 0 HG21 VAL A 35 14.972 -12.559 -3.838 1.00 1.00 H new ATOM 0 HG22 VAL A 35 15.248 -10.975 -3.074 1.00 1.00 H new ATOM 0 HG23 VAL A 35 13.782 -11.251 -4.045 1.00 1.00 H new ATOM 511 N PHE A 36 17.416 -8.504 -6.287 1.00 1.00 N ATOM 512 CA PHE A 36 18.485 -8.183 -7.237 1.00 1.00 C ATOM 513 C PHE A 36 19.699 -9.101 -6.995 1.00 1.00 C ATOM 514 O PHE A 36 20.337 -9.030 -5.944 1.00 1.00 O ATOM 515 CB PHE A 36 18.844 -6.690 -7.123 1.00 1.00 C ATOM 516 CG PHE A 36 17.704 -5.770 -7.514 1.00 1.00 C ATOM 517 CD1 PHE A 36 17.482 -5.482 -8.875 1.00 1.00 C ATOM 518 CD2 PHE A 36 16.848 -5.231 -6.533 1.00 1.00 C ATOM 519 CE1 PHE A 36 16.407 -4.661 -9.254 1.00 1.00 C ATOM 520 CE2 PHE A 36 15.767 -4.416 -6.917 1.00 1.00 C ATOM 521 CZ PHE A 36 15.544 -4.134 -8.278 1.00 1.00 C ATOM 0 H PHE A 36 17.675 -8.280 -5.326 1.00 1.00 H new ATOM 0 HA PHE A 36 18.147 -8.363 -8.257 1.00 1.00 H new ATOM 0 HB2 PHE A 36 19.143 -6.472 -6.098 1.00 1.00 H new ATOM 0 HB3 PHE A 36 19.705 -6.481 -7.757 1.00 1.00 H new ATOM 0 HD1 PHE A 36 18.139 -5.893 -9.628 1.00 1.00 H new ATOM 0 HD2 PHE A 36 17.021 -5.443 -5.488 1.00 1.00 H new ATOM 0 HE1 PHE A 36 16.243 -4.434 -10.297 1.00 1.00 H new ATOM 0 HE2 PHE A 36 15.107 -4.006 -6.166 1.00 1.00 H new ATOM 0 HZ PHE A 36 14.711 -3.513 -8.572 1.00 1.00 H new ATOM 531 N GLU A 37 20.000 -9.976 -7.962 1.00 1.00 N ATOM 532 CA GLU A 37 21.112 -10.931 -7.948 1.00 1.00 C ATOM 533 C GLU A 37 22.350 -10.340 -8.644 1.00 1.00 C ATOM 534 O GLU A 37 22.224 -9.702 -9.692 1.00 1.00 O ATOM 535 CB GLU A 37 20.705 -12.260 -8.606 1.00 1.00 C ATOM 536 CG GLU A 37 19.586 -12.987 -7.848 1.00 1.00 C ATOM 537 CD GLU A 37 19.258 -14.329 -8.529 1.00 1.00 C ATOM 538 OE1 GLU A 37 19.922 -15.350 -8.221 1.00 1.00 O ATOM 539 OE2 GLU A 37 18.339 -14.378 -9.384 1.00 1.00 O1- ATOM 0 H GLU A 37 19.447 -10.039 -8.817 1.00 1.00 H new ATOM 0 HA GLU A 37 21.367 -11.131 -6.907 1.00 1.00 H new ATOM 0 HB2 GLU A 37 20.378 -12.068 -9.628 1.00 1.00 H new ATOM 0 HB3 GLU A 37 21.577 -12.911 -8.667 1.00 1.00 H new ATOM 0 HG2 GLU A 37 19.891 -13.161 -6.816 1.00 1.00 H new ATOM 0 HG3 GLU A 37 18.694 -12.361 -7.816 1.00 1.00 H new ATOM 546 N ASP A 38 23.539 -10.559 -8.062 1.00 1.00 N ATOM 547 CA ASP A 38 24.801 -9.891 -8.455 1.00 1.00 C ATOM 548 C ASP A 38 24.578 -8.375 -8.725 1.00 1.00 C ATOM 549 O ASP A 38 24.860 -7.875 -9.825 1.00 1.00 O ATOM 550 CB ASP A 38 25.448 -10.660 -9.620 1.00 1.00 C ATOM 551 CG ASP A 38 26.849 -10.131 -9.974 1.00 1.00 C ATOM 552 OD1 ASP A 38 27.645 -9.839 -9.049 1.00 1.00 O1- ATOM 553 OD2 ASP A 38 27.183 -10.060 -11.182 1.00 1.00 O ATOM 0 H ASP A 38 23.658 -11.216 -7.291 1.00 1.00 H new ATOM 0 HA ASP A 38 25.513 -9.920 -7.631 1.00 1.00 H new ATOM 0 HB2 ASP A 38 25.518 -11.716 -9.359 1.00 1.00 H new ATOM 0 HB3 ASP A 38 24.805 -10.591 -10.498 1.00 1.00 H new ATOM 558 N PRO A 39 24.013 -7.640 -7.743 1.00 1.00 N ATOM 559 CA PRO A 39 23.518 -6.281 -7.932 1.00 1.00 C ATOM 560 C PRO A 39 24.563 -5.187 -8.206 1.00 1.00 C ATOM 561 O PRO A 39 25.611 -5.106 -7.559 1.00 1.00 O ATOM 562 CB PRO A 39 22.777 -5.948 -6.640 1.00 1.00 C ATOM 563 CG PRO A 39 23.519 -6.763 -5.578 1.00 1.00 C ATOM 564 CD PRO A 39 23.856 -8.036 -6.345 1.00 1.00 C ATOM 0 HA PRO A 39 22.912 -6.279 -8.838 1.00 1.00 H new ATOM 0 HB2 PRO A 39 22.811 -4.881 -6.422 1.00 1.00 H new ATOM 0 HB3 PRO A 39 21.725 -6.228 -6.698 1.00 1.00 H new ATOM 0 HG2 PRO A 39 24.413 -6.252 -5.220 1.00 1.00 H new ATOM 0 HG3 PRO A 39 22.896 -6.963 -4.706 1.00 1.00 H new ATOM 0 HD2 PRO A 39 24.771 -8.490 -5.964 1.00 1.00 H new ATOM 0 HD3 PRO A 39 23.064 -8.777 -6.237 1.00 1.00 H new ATOM 572 N GLU A 40 24.217 -4.277 -9.117 1.00 1.00 N ATOM 573 CA GLU A 40 24.943 -3.033 -9.348 1.00 1.00 C ATOM 574 C GLU A 40 24.360 -1.875 -8.547 1.00 1.00 C ATOM 575 O GLU A 40 23.200 -1.873 -8.138 1.00 1.00 O ATOM 576 CB GLU A 40 24.814 -2.577 -10.805 1.00 1.00 C ATOM 577 CG GLU A 40 25.754 -3.285 -11.748 1.00 1.00 C ATOM 578 CD GLU A 40 27.250 -3.105 -11.403 1.00 1.00 C ATOM 579 OE1 GLU A 40 27.632 -2.082 -10.784 1.00 1.00 O1- ATOM 580 OE2 GLU A 40 28.059 -3.992 -11.767 1.00 1.00 O ATOM 0 H GLU A 40 23.407 -4.389 -9.726 1.00 1.00 H new ATOM 0 HA GLU A 40 25.972 -3.251 -9.063 1.00 1.00 H new ATOM 0 HB2 GLU A 40 23.789 -2.740 -11.138 1.00 1.00 H new ATOM 0 HB3 GLU A 40 25.000 -1.504 -10.858 1.00 1.00 H new ATOM 0 HG2 GLU A 40 25.518 -4.349 -11.748 1.00 1.00 H new ATOM 0 HG3 GLU A 40 25.579 -2.920 -12.760 1.00 1.00 H new ATOM 587 N LEU A 41 25.134 -0.803 -8.419 1.00 1.00 N ATOM 588 CA LEU A 41 24.621 0.444 -7.921 1.00 1.00 C ATOM 589 C LEU A 41 23.607 1.050 -8.909 1.00 1.00 C ATOM 590 O LEU A 41 22.701 1.758 -8.472 1.00 1.00 O ATOM 591 CB LEU A 41 25.857 1.298 -7.615 1.00 1.00 C ATOM 592 CG LEU A 41 25.581 2.628 -6.929 1.00 1.00 C ATOM 593 CD1 LEU A 41 25.355 3.725 -7.961 1.00 1.00 C ATOM 594 CD2 LEU A 41 24.525 2.517 -5.835 1.00 1.00 C ATOM 0 H LEU A 41 26.125 -0.785 -8.658 1.00 1.00 H new ATOM 0 HA LEU A 41 24.036 0.348 -7.007 1.00 1.00 H new ATOM 0 HB2 LEU A 41 26.531 0.717 -6.985 1.00 1.00 H new ATOM 0 HB3 LEU A 41 26.383 1.493 -8.550 1.00 1.00 H new ATOM 0 HG LEU A 41 26.469 2.933 -6.376 1.00 1.00 H new ATOM 0 HD11 LEU A 41 25.159 4.669 -7.452 1.00 1.00 H new ATOM 0 HD12 LEU A 41 26.243 3.827 -8.584 1.00 1.00 H new ATOM 0 HD13 LEU A 41 24.501 3.466 -8.586 1.00 1.00 H new ATOM 0 HD21 LEU A 41 24.368 3.495 -5.380 1.00 1.00 H new ATOM 0 HD22 LEU A 41 23.589 2.164 -6.267 1.00 1.00 H new ATOM 0 HD23 LEU A 41 24.862 1.813 -5.074 1.00 1.00 H new ATOM 606 N SER A 42 23.639 0.696 -10.205 1.00 1.00 N ATOM 607 CA SER A 42 22.591 1.107 -11.137 1.00 1.00 C ATOM 608 C SER A 42 21.245 0.424 -10.843 1.00 1.00 C ATOM 609 O SER A 42 20.199 0.939 -11.241 1.00 1.00 O ATOM 610 CB SER A 42 23.027 0.875 -12.586 1.00 1.00 C ATOM 611 OG SER A 42 23.361 -0.490 -12.786 1.00 1.00 O ATOM 0 H SER A 42 24.377 0.130 -10.623 1.00 1.00 H new ATOM 0 HA SER A 42 22.437 2.176 -10.994 1.00 1.00 H new ATOM 0 HB2 SER A 42 22.225 1.164 -13.265 1.00 1.00 H new ATOM 0 HB3 SER A 42 23.885 1.505 -12.820 1.00 1.00 H new ATOM 0 HG SER A 42 23.637 -0.626 -13.717 1.00 1.00 H new ATOM 617 N ASP A 43 21.256 -0.681 -10.090 1.00 1.00 N ATOM 618 CA ASP A 43 20.062 -1.313 -9.548 1.00 1.00 C ATOM 619 C ASP A 43 19.588 -0.644 -8.244 1.00 1.00 C ATOM 620 O ASP A 43 18.394 -0.696 -7.952 1.00 1.00 O ATOM 621 CB ASP A 43 20.295 -2.814 -9.332 1.00 1.00 C ATOM 622 CG ASP A 43 20.630 -3.585 -10.620 1.00 1.00 C ATOM 623 OD1 ASP A 43 19.883 -3.462 -11.623 1.00 1.00 O1- ATOM 624 OD2 ASP A 43 21.623 -4.355 -10.616 1.00 1.00 O ATOM 0 H ASP A 43 22.117 -1.167 -9.838 1.00 1.00 H new ATOM 0 HA ASP A 43 19.268 -1.182 -10.283 1.00 1.00 H new ATOM 0 HB2 ASP A 43 21.109 -2.946 -8.619 1.00 1.00 H new ATOM 0 HB3 ASP A 43 19.403 -3.249 -8.882 1.00 1.00 H new ATOM 629 N TRP A 44 20.477 0.017 -7.478 1.00 1.00 N ATOM 630 CA TRP A 44 20.135 0.650 -6.192 1.00 1.00 C ATOM 631 C TRP A 44 19.667 2.101 -6.313 1.00 1.00 C ATOM 632 O TRP A 44 18.791 2.520 -5.557 1.00 1.00 O ATOM 633 CB TRP A 44 21.356 0.547 -5.281 1.00 1.00 C ATOM 634 CG TRP A 44 21.246 1.156 -3.919 1.00 1.00 C ATOM 635 CD1 TRP A 44 21.235 2.480 -3.624 1.00 1.00 C ATOM 636 CD2 TRP A 44 21.141 0.458 -2.641 1.00 1.00 C ATOM 637 NE1 TRP A 44 21.154 2.641 -2.248 1.00 1.00 N ATOM 638 CE2 TRP A 44 21.105 1.424 -1.599 1.00 1.00 C ATOM 639 CE3 TRP A 44 21.069 -0.899 -2.259 1.00 1.00 C ATOM 640 CZ2 TRP A 44 21.044 1.063 -0.247 1.00 1.00 C ATOM 641 CZ3 TRP A 44 21.005 -1.277 -0.904 1.00 1.00 C ATOM 642 CH2 TRP A 44 20.999 -0.298 0.106 1.00 1.00 C ATOM 0 H TRP A 44 21.458 0.127 -7.736 1.00 1.00 H new ATOM 0 HA TRP A 44 19.280 0.118 -5.774 1.00 1.00 H new ATOM 0 HB2 TRP A 44 21.599 -0.509 -5.160 1.00 1.00 H new ATOM 0 HB3 TRP A 44 22.199 1.012 -5.792 1.00 1.00 H new ATOM 0 HD1 TRP A 44 21.282 3.282 -4.346 1.00 1.00 H new ATOM 0 HE1 TRP A 44 21.133 3.545 -1.776 1.00 1.00 H new ATOM 0 HE3 TRP A 44 21.063 -1.663 -3.022 1.00 1.00 H new ATOM 0 HZ2 TRP A 44 21.032 1.824 0.519 1.00 1.00 H new ATOM 0 HZ3 TRP A 44 20.960 -2.323 -0.639 1.00 1.00 H new ATOM 0 HH2 TRP A 44 20.960 -0.589 1.145 1.00 1.00 H new ATOM 653 N LEU A 45 20.199 2.878 -7.268 1.00 1.00 N ATOM 654 CA LEU A 45 19.791 4.278 -7.485 1.00 1.00 C ATOM 655 C LEU A 45 18.255 4.487 -7.543 1.00 1.00 C ATOM 656 O LEU A 45 17.787 5.453 -6.934 1.00 1.00 O ATOM 657 CB LEU A 45 20.437 4.821 -8.787 1.00 1.00 C ATOM 658 CG LEU A 45 21.932 5.159 -8.700 1.00 1.00 C ATOM 659 CD1 LEU A 45 22.503 5.339 -10.105 1.00 1.00 C ATOM 660 CD2 LEU A 45 22.152 6.460 -7.934 1.00 1.00 C ATOM 0 H LEU A 45 20.922 2.557 -7.911 1.00 1.00 H new ATOM 0 HA LEU A 45 20.145 4.832 -6.616 1.00 1.00 H new ATOM 0 HB2 LEU A 45 20.296 4.082 -9.576 1.00 1.00 H new ATOM 0 HB3 LEU A 45 19.898 5.718 -9.091 1.00 1.00 H new ATOM 0 HG LEU A 45 22.430 4.339 -8.182 1.00 1.00 H new ATOM 0 HD11 LEU A 45 23.564 5.579 -10.038 1.00 1.00 H new ATOM 0 HD12 LEU A 45 22.374 4.416 -10.671 1.00 1.00 H new ATOM 0 HD13 LEU A 45 21.979 6.150 -10.610 1.00 1.00 H new ATOM 0 HD21 LEU A 45 23.219 6.678 -7.886 1.00 1.00 H new ATOM 0 HD22 LEU A 45 21.638 7.274 -8.445 1.00 1.00 H new ATOM 0 HD23 LEU A 45 21.757 6.359 -6.923 1.00 1.00 H new ATOM 672 N PRO A 46 17.450 3.588 -8.154 1.00 1.00 N ATOM 673 CA PRO A 46 15.981 3.668 -8.160 1.00 1.00 C ATOM 674 C PRO A 46 15.273 3.609 -6.788 1.00 1.00 C ATOM 675 O PRO A 46 14.054 3.781 -6.740 1.00 1.00 O ATOM 676 CB PRO A 46 15.514 2.504 -9.051 1.00 1.00 C ATOM 677 CG PRO A 46 16.704 2.241 -9.969 1.00 1.00 C ATOM 678 CD PRO A 46 17.877 2.506 -9.040 1.00 1.00 C ATOM 0 HA PRO A 46 15.705 4.657 -8.525 1.00 1.00 H new ATOM 0 HB2 PRO A 46 15.264 1.623 -8.459 1.00 1.00 H new ATOM 0 HB3 PRO A 46 14.622 2.769 -9.619 1.00 1.00 H new ATOM 0 HG2 PRO A 46 16.708 1.220 -10.351 1.00 1.00 H new ATOM 0 HG3 PRO A 46 16.709 2.905 -10.833 1.00 1.00 H new ATOM 0 HD2 PRO A 46 18.134 1.613 -8.470 1.00 1.00 H new ATOM 0 HD3 PRO A 46 18.765 2.790 -9.604 1.00 1.00 H new ATOM 686 N TYR A 47 15.997 3.350 -5.687 1.00 1.00 N ATOM 687 CA TYR A 47 15.466 3.191 -4.327 1.00 1.00 C ATOM 688 C TYR A 47 15.894 4.252 -3.307 1.00 1.00 C ATOM 689 O TYR A 47 15.498 4.185 -2.151 1.00 1.00 O ATOM 690 CB TYR A 47 15.723 1.760 -3.819 1.00 1.00 C ATOM 691 CG TYR A 47 14.950 0.680 -4.555 1.00 1.00 C ATOM 692 CD1 TYR A 47 15.461 0.125 -5.745 1.00 1.00 C ATOM 693 CD2 TYR A 47 13.709 0.234 -4.058 1.00 1.00 C ATOM 694 CE1 TYR A 47 14.717 -0.840 -6.451 1.00 1.00 C ATOM 695 CE2 TYR A 47 12.955 -0.719 -4.765 1.00 1.00 C ATOM 696 CZ TYR A 47 13.454 -1.253 -5.970 1.00 1.00 C ATOM 697 OH TYR A 47 12.707 -2.168 -6.649 1.00 1.00 O ATOM 0 H TYR A 47 17.011 3.241 -5.724 1.00 1.00 H new ATOM 0 HA TYR A 47 14.393 3.362 -4.419 1.00 1.00 H new ATOM 0 HB2 TYR A 47 16.789 1.545 -3.901 1.00 1.00 H new ATOM 0 HB3 TYR A 47 15.468 1.713 -2.760 1.00 1.00 H new ATOM 0 HD1 TYR A 47 16.425 0.440 -6.116 1.00 1.00 H new ATOM 0 HD2 TYR A 47 13.334 0.628 -3.125 1.00 1.00 H new ATOM 0 HE1 TYR A 47 15.112 -1.265 -7.362 1.00 1.00 H new ATOM 0 HE2 TYR A 47 11.996 -1.041 -4.386 1.00 1.00 H new ATOM 0 HH TYR A 47 11.870 -2.330 -6.166 1.00 1.00 H new ATOM 707 N GLN A 48 16.599 5.291 -3.751 1.00 1.00 N ATOM 708 CA GLN A 48 16.955 6.510 -2.984 1.00 1.00 C ATOM 709 C GLN A 48 15.754 7.174 -2.275 1.00 1.00 C ATOM 710 O GLN A 48 15.902 7.821 -1.239 1.00 1.00 O ATOM 711 CB GLN A 48 17.537 7.546 -3.960 1.00 1.00 C ATOM 712 CG GLN A 48 18.988 7.242 -4.342 1.00 1.00 C ATOM 713 CD GLN A 48 19.454 8.209 -5.426 1.00 1.00 C ATOM 714 OE1 GLN A 48 20.150 9.183 -5.180 1.00 1.00 O ATOM 715 NE2 GLN A 48 19.052 7.990 -6.659 1.00 1.00 N ATOM 0 H GLN A 48 16.962 5.319 -4.704 1.00 1.00 H new ATOM 0 HA GLN A 48 17.663 6.198 -2.216 1.00 1.00 H new ATOM 0 HB2 GLN A 48 16.926 7.574 -4.862 1.00 1.00 H new ATOM 0 HB3 GLN A 48 17.484 8.536 -3.508 1.00 1.00 H new ATOM 0 HG2 GLN A 48 19.630 7.329 -3.465 1.00 1.00 H new ATOM 0 HG3 GLN A 48 19.072 6.215 -4.698 1.00 1.00 H new ATOM 0 HE21 GLN A 48 18.471 7.178 -6.869 1.00 1.00 H new ATOM 0 HE22 GLN A 48 19.321 8.632 -7.405 1.00 1.00 H new ATOM 724 N ASP A 49 14.567 7.017 -2.861 1.00 1.00 N ATOM 725 CA ASP A 49 13.273 7.571 -2.449 1.00 1.00 C ATOM 726 C ASP A 49 12.339 6.521 -1.809 1.00 1.00 C ATOM 727 O ASP A 49 11.160 6.793 -1.575 1.00 1.00 O ATOM 728 CB ASP A 49 12.623 8.210 -3.694 1.00 1.00 C ATOM 729 CG ASP A 49 12.350 7.177 -4.814 1.00 1.00 C ATOM 730 OD1 ASP A 49 13.324 6.592 -5.342 1.00 1.00 O ATOM 731 OD2 ASP A 49 11.173 6.918 -5.168 1.00 1.00 O1- ATOM 0 H ASP A 49 14.476 6.453 -3.706 1.00 1.00 H new ATOM 0 HA ASP A 49 13.439 8.315 -1.670 1.00 1.00 H new ATOM 0 HB2 ASP A 49 11.686 8.686 -3.407 1.00 1.00 H new ATOM 0 HB3 ASP A 49 13.275 8.995 -4.078 1.00 1.00 H new ATOM 736 N LYS A 50 12.866 5.314 -1.562 1.00 1.00 N ATOM 737 CA LYS A 50 12.144 4.102 -1.178 1.00 1.00 C ATOM 738 C LYS A 50 12.788 3.381 0.008 1.00 1.00 C ATOM 739 O LYS A 50 13.583 3.961 0.753 1.00 1.00 O ATOM 740 CB LYS A 50 12.128 3.194 -2.420 1.00 1.00 C ATOM 741 CG LYS A 50 11.407 3.792 -3.621 1.00 1.00 C ATOM 742 CD LYS A 50 11.428 2.750 -4.735 1.00 1.00 C ATOM 743 CE LYS A 50 10.622 3.187 -5.957 1.00 1.00 C ATOM 744 NZ LYS A 50 11.218 4.400 -6.593 1.00 1.00 N1+ ATOM 0 H LYS A 50 13.871 5.152 -1.630 1.00 1.00 H new ATOM 0 HA LYS A 50 11.137 4.361 -0.850 1.00 1.00 H new ATOM 0 HB2 LYS A 50 13.156 2.967 -2.703 1.00 1.00 H new ATOM 0 HB3 LYS A 50 11.653 2.248 -2.159 1.00 1.00 H new ATOM 0 HG2 LYS A 50 10.382 4.054 -3.361 1.00 1.00 H new ATOM 0 HG3 LYS A 50 11.898 4.709 -3.945 1.00 1.00 H new ATOM 0 HD2 LYS A 50 12.459 2.561 -5.032 1.00 1.00 H new ATOM 0 HD3 LYS A 50 11.028 1.809 -4.357 1.00 1.00 H new ATOM 0 HE2 LYS A 50 10.586 2.374 -6.682 1.00 1.00 H new ATOM 0 HE3 LYS A 50 9.594 3.396 -5.662 1.00 1.00 H new ATOM 0 HZ1 LYS A 50 10.757 4.574 -7.509 1.00 1.00 H new ATOM 0 HZ2 LYS A 50 11.077 5.222 -5.972 1.00 1.00 H new ATOM 0 HZ3 LYS A 50 12.236 4.249 -6.742 1.00 1.00 H new ATOM 758 N TYR A 51 12.431 2.102 0.162 1.00 1.00 N ATOM 759 CA TYR A 51 13.052 1.186 1.114 1.00 1.00 C ATOM 760 C TYR A 51 13.869 0.115 0.392 1.00 1.00 C ATOM 761 O TYR A 51 13.675 -0.204 -0.783 1.00 1.00 O ATOM 762 CB TYR A 51 12.020 0.588 2.085 1.00 1.00 C ATOM 763 CG TYR A 51 11.030 1.586 2.649 1.00 1.00 C ATOM 764 CD1 TYR A 51 11.446 2.852 3.101 1.00 1.00 C ATOM 765 CD2 TYR A 51 9.671 1.240 2.696 1.00 1.00 C ATOM 766 CE1 TYR A 51 10.508 3.765 3.614 1.00 1.00 C ATOM 767 CE2 TYR A 51 8.732 2.126 3.257 1.00 1.00 C ATOM 768 CZ TYR A 51 9.151 3.396 3.717 1.00 1.00 C ATOM 769 OH TYR A 51 8.261 4.272 4.252 1.00 1.00 O ATOM 0 H TYR A 51 11.687 1.669 -0.385 1.00 1.00 H new ATOM 0 HA TYR A 51 13.749 1.759 1.726 1.00 1.00 H new ATOM 0 HB2 TYR A 51 11.469 -0.198 1.569 1.00 1.00 H new ATOM 0 HB3 TYR A 51 12.550 0.116 2.912 1.00 1.00 H new ATOM 0 HD1 TYR A 51 12.490 3.123 3.054 1.00 1.00 H new ATOM 0 HD2 TYR A 51 9.344 0.290 2.300 1.00 1.00 H new ATOM 0 HE1 TYR A 51 10.826 4.748 3.929 1.00 1.00 H new ATOM 0 HE2 TYR A 51 7.694 1.837 3.336 1.00 1.00 H new ATOM 0 HH TYR A 51 7.476 3.783 4.576 1.00 1.00 H new ATOM 779 N VAL A 52 14.812 -0.445 1.131 1.00 1.00 N ATOM 780 CA VAL A 52 15.827 -1.374 0.632 1.00 1.00 C ATOM 781 C VAL A 52 16.106 -2.403 1.716 1.00 1.00 C ATOM 782 O VAL A 52 15.894 -2.150 2.899 1.00 1.00 O ATOM 783 CB VAL A 52 17.126 -0.651 0.191 1.00 1.00 C ATOM 784 CG1 VAL A 52 17.331 -0.762 -1.318 1.00 1.00 C ATOM 785 CG2 VAL A 52 17.162 0.843 0.518 1.00 1.00 C ATOM 0 H VAL A 52 14.900 -0.263 2.131 1.00 1.00 H new ATOM 0 HA VAL A 52 15.446 -1.867 -0.262 1.00 1.00 H new ATOM 0 HB VAL A 52 17.910 -1.156 0.756 1.00 1.00 H new ATOM 0 HG11 VAL A 52 18.249 -0.246 -1.599 1.00 1.00 H new ATOM 0 HG12 VAL A 52 17.404 -1.813 -1.599 1.00 1.00 H new ATOM 0 HG13 VAL A 52 16.486 -0.306 -1.834 1.00 1.00 H new ATOM 0 HG21 VAL A 52 18.105 1.268 0.175 1.00 1.00 H new ATOM 0 HG22 VAL A 52 16.334 1.345 0.017 1.00 1.00 H new ATOM 0 HG23 VAL A 52 17.072 0.982 1.595 1.00 1.00 H new ATOM 795 N LEU A 53 16.585 -3.570 1.318 1.00 1.00 N ATOM 796 CA LEU A 53 16.982 -4.644 2.209 1.00 1.00 C ATOM 797 C LEU A 53 18.321 -5.200 1.736 1.00 1.00 C ATOM 798 O LEU A 53 18.469 -5.583 0.583 1.00 1.00 O ATOM 799 CB LEU A 53 15.871 -5.696 2.210 1.00 1.00 C ATOM 800 CG LEU A 53 16.135 -6.953 3.030 1.00 1.00 C ATOM 801 CD1 LEU A 53 16.656 -6.633 4.431 1.00 1.00 C ATOM 802 CD2 LEU A 53 14.875 -7.785 3.230 1.00 1.00 C ATOM 0 H LEU A 53 16.712 -3.802 0.333 1.00 1.00 H new ATOM 0 HA LEU A 53 17.117 -4.298 3.234 1.00 1.00 H new ATOM 0 HB2 LEU A 53 14.958 -5.230 2.582 1.00 1.00 H new ATOM 0 HB3 LEU A 53 15.680 -5.993 1.179 1.00 1.00 H new ATOM 0 HG LEU A 53 16.879 -7.504 2.455 1.00 1.00 H new ATOM 0 HD11 LEU A 53 16.829 -7.561 4.976 1.00 1.00 H new ATOM 0 HD12 LEU A 53 17.591 -6.078 4.354 1.00 1.00 H new ATOM 0 HD13 LEU A 53 15.920 -6.031 4.964 1.00 1.00 H new ATOM 0 HD21 LEU A 53 15.113 -8.670 3.820 1.00 1.00 H new ATOM 0 HD22 LEU A 53 14.126 -7.191 3.753 1.00 1.00 H new ATOM 0 HD23 LEU A 53 14.483 -8.090 2.260 1.00 1.00 H new ATOM 814 N VAL A 54 19.291 -5.281 2.632 1.00 1.00 N ATOM 815 CA VAL A 54 20.591 -5.877 2.339 1.00 1.00 C ATOM 816 C VAL A 54 20.653 -7.262 2.939 1.00 1.00 C ATOM 817 O VAL A 54 20.464 -7.425 4.138 1.00 1.00 O ATOM 818 CB VAL A 54 21.732 -4.968 2.786 1.00 1.00 C ATOM 819 CG1 VAL A 54 23.077 -5.689 2.811 1.00 1.00 C ATOM 820 CG2 VAL A 54 21.817 -3.737 1.885 1.00 1.00 C ATOM 0 H VAL A 54 19.202 -4.935 3.587 1.00 1.00 H new ATOM 0 HA VAL A 54 20.714 -5.983 1.261 1.00 1.00 H new ATOM 0 HB VAL A 54 21.509 -4.659 3.807 1.00 1.00 H new ATOM 0 HG11 VAL A 54 23.855 -4.998 3.136 1.00 1.00 H new ATOM 0 HG12 VAL A 54 23.027 -6.529 3.503 1.00 1.00 H new ATOM 0 HG13 VAL A 54 23.312 -6.056 1.812 1.00 1.00 H new ATOM 0 HG21 VAL A 54 22.636 -3.099 2.217 1.00 1.00 H new ATOM 0 HG22 VAL A 54 21.996 -4.051 0.856 1.00 1.00 H new ATOM 0 HG23 VAL A 54 20.880 -3.182 1.938 1.00 1.00 H new ATOM 830 N VAL A 55 20.936 -8.269 2.124 1.00 1.00 N ATOM 831 CA VAL A 55 21.069 -9.645 2.599 1.00 1.00 C ATOM 832 C VAL A 55 22.439 -10.124 2.154 1.00 1.00 C ATOM 833 O VAL A 55 22.668 -10.323 0.968 1.00 1.00 O ATOM 834 CB VAL A 55 19.905 -10.508 2.093 1.00 1.00 C ATOM 835 CG1 VAL A 55 19.940 -11.843 2.831 1.00 1.00 C ATOM 836 CG2 VAL A 55 18.523 -9.866 2.341 1.00 1.00 C ATOM 0 H VAL A 55 21.080 -8.159 1.120 1.00 1.00 H new ATOM 0 HA VAL A 55 21.008 -9.718 3.685 1.00 1.00 H new ATOM 0 HB VAL A 55 20.031 -10.622 1.016 1.00 1.00 H new ATOM 0 HG11 VAL A 55 19.119 -12.472 2.485 1.00 1.00 H new ATOM 0 HG12 VAL A 55 20.888 -12.343 2.634 1.00 1.00 H new ATOM 0 HG13 VAL A 55 19.837 -11.669 3.902 1.00 1.00 H new ATOM 0 HG21 VAL A 55 17.742 -10.525 1.961 1.00 1.00 H new ATOM 0 HG22 VAL A 55 18.380 -9.713 3.411 1.00 1.00 H new ATOM 0 HG23 VAL A 55 18.470 -8.906 1.827 1.00 1.00 H new ATOM 846 N THR A 56 23.370 -10.282 3.089 1.00 1.00 N ATOM 847 CA THR A 56 24.788 -10.487 2.737 1.00 1.00 C ATOM 848 C THR A 56 25.540 -11.394 3.704 1.00 1.00 C ATOM 849 O THR A 56 25.519 -11.191 4.918 1.00 1.00 O ATOM 850 CB THR A 56 25.479 -9.124 2.515 1.00 1.00 C ATOM 851 OG1 THR A 56 26.812 -9.303 2.103 1.00 1.00 O ATOM 852 CG2 THR A 56 25.444 -8.159 3.706 1.00 1.00 C ATOM 0 H THR A 56 23.180 -10.274 4.091 1.00 1.00 H new ATOM 0 HA THR A 56 24.814 -11.037 1.796 1.00 1.00 H new ATOM 0 HB THR A 56 24.885 -8.650 1.734 1.00 1.00 H new ATOM 0 HG1 THR A 56 27.319 -8.481 2.270 1.00 1.00 H new ATOM 0 HG21 THR A 56 25.957 -7.235 3.441 1.00 1.00 H new ATOM 0 HG22 THR A 56 24.409 -7.938 3.965 1.00 1.00 H new ATOM 0 HG23 THR A 56 25.941 -8.618 4.561 1.00 1.00 H new ATOM 998 N ILE A 68 28.763 -7.854 -3.801 1.00 1.00 N ATOM 999 CA ILE A 68 28.192 -6.700 -3.091 1.00 1.00 C ATOM 1000 C ILE A 68 29.200 -5.577 -2.824 1.00 1.00 C ATOM 1001 O ILE A 68 28.802 -4.451 -2.539 1.00 1.00 O ATOM 1002 CB ILE A 68 27.423 -7.185 -1.857 1.00 1.00 C ATOM 1003 CG1 ILE A 68 26.220 -6.264 -1.635 1.00 1.00 C ATOM 1004 CG2 ILE A 68 28.315 -7.299 -0.616 1.00 1.00 C ATOM 1005 CD1 ILE A 68 25.220 -6.774 -0.610 1.00 1.00 C ATOM 0 HA ILE A 68 27.472 -6.212 -3.748 1.00 1.00 H new ATOM 0 HB ILE A 68 27.065 -8.199 -2.037 1.00 1.00 H new ATOM 0 HG12 ILE A 68 26.581 -5.286 -1.317 1.00 1.00 H new ATOM 0 HG13 ILE A 68 25.707 -6.121 -2.586 1.00 1.00 H new ATOM 0 HG21 ILE A 68 27.720 -7.646 0.229 1.00 1.00 H new ATOM 0 HG22 ILE A 68 29.119 -8.009 -0.810 1.00 1.00 H new ATOM 0 HG23 ILE A 68 28.741 -6.323 -0.383 1.00 1.00 H new ATOM 0 HD11 ILE A 68 24.401 -6.061 -0.515 1.00 1.00 H new ATOM 0 HD12 ILE A 68 24.827 -7.738 -0.933 1.00 1.00 H new ATOM 0 HD13 ILE A 68 25.714 -6.889 0.355 1.00 1.00 H new ATOM 1017 N VAL A 69 30.500 -5.840 -2.977 1.00 1.00 N ATOM 1018 CA VAL A 69 31.561 -4.817 -2.993 1.00 1.00 C ATOM 1019 C VAL A 69 31.203 -3.610 -3.879 1.00 1.00 C ATOM 1020 O VAL A 69 31.258 -2.486 -3.377 1.00 1.00 O ATOM 1021 CB VAL A 69 32.881 -5.467 -3.472 1.00 1.00 C ATOM 1022 CG1 VAL A 69 33.822 -4.523 -4.241 1.00 1.00 C ATOM 1023 CG2 VAL A 69 33.614 -6.076 -2.275 1.00 1.00 C ATOM 0 H VAL A 69 30.857 -6.788 -3.096 1.00 1.00 H new ATOM 0 HA VAL A 69 31.676 -4.434 -1.979 1.00 1.00 H new ATOM 0 HB VAL A 69 32.594 -6.236 -4.189 1.00 1.00 H new ATOM 0 HG11 VAL A 69 34.720 -5.066 -4.536 1.00 1.00 H new ATOM 0 HG12 VAL A 69 33.315 -4.149 -5.130 1.00 1.00 H new ATOM 0 HG13 VAL A 69 34.099 -3.685 -3.602 1.00 1.00 H new ATOM 0 HG21 VAL A 69 34.544 -6.534 -2.612 1.00 1.00 H new ATOM 0 HG22 VAL A 69 33.837 -5.294 -1.549 1.00 1.00 H new ATOM 0 HG23 VAL A 69 32.984 -6.834 -1.810 1.00 1.00 H new ATOM 1033 N PRO A 70 30.832 -3.779 -5.167 1.00 1.00 N ATOM 1034 CA PRO A 70 30.627 -2.641 -6.058 1.00 1.00 C ATOM 1035 C PRO A 70 29.405 -1.817 -5.645 1.00 1.00 C ATOM 1036 O PRO A 70 29.419 -0.594 -5.746 1.00 1.00 O ATOM 1037 CB PRO A 70 30.477 -3.203 -7.476 1.00 1.00 C ATOM 1038 CG PRO A 70 30.100 -4.662 -7.239 1.00 1.00 C ATOM 1039 CD PRO A 70 30.748 -5.020 -5.917 1.00 1.00 C ATOM 0 HA PRO A 70 31.475 -1.959 -6.007 1.00 1.00 H new ATOM 0 HB2 PRO A 70 29.707 -2.675 -8.038 1.00 1.00 H new ATOM 0 HB3 PRO A 70 31.403 -3.114 -8.044 1.00 1.00 H new ATOM 0 HG2 PRO A 70 29.018 -4.789 -7.196 1.00 1.00 H new ATOM 0 HG3 PRO A 70 30.464 -5.300 -8.044 1.00 1.00 H new ATOM 0 HD2 PRO A 70 30.157 -5.762 -5.380 1.00 1.00 H new ATOM 0 HD3 PRO A 70 31.737 -5.451 -6.071 1.00 1.00 H new ATOM 1047 N LEU A 71 28.368 -2.476 -5.111 1.00 1.00 N ATOM 1048 CA LEU A 71 27.223 -1.840 -4.478 1.00 1.00 C ATOM 1049 C LEU A 71 27.649 -1.013 -3.259 1.00 1.00 C ATOM 1050 O LEU A 71 27.363 0.173 -3.206 1.00 1.00 O ATOM 1051 CB LEU A 71 26.258 -2.981 -4.108 1.00 1.00 C ATOM 1052 CG LEU A 71 24.898 -2.517 -3.595 1.00 1.00 C ATOM 1053 CD1 LEU A 71 24.054 -2.064 -4.776 1.00 1.00 C ATOM 1054 CD2 LEU A 71 24.204 -3.678 -2.885 1.00 1.00 C ATOM 0 H LEU A 71 28.308 -3.494 -5.112 1.00 1.00 H new ATOM 0 HA LEU A 71 26.736 -1.129 -5.146 1.00 1.00 H new ATOM 0 HB2 LEU A 71 26.106 -3.610 -4.985 1.00 1.00 H new ATOM 0 HB3 LEU A 71 26.727 -3.604 -3.346 1.00 1.00 H new ATOM 0 HG LEU A 71 25.025 -1.690 -2.896 1.00 1.00 H new ATOM 0 HD11 LEU A 71 23.079 -1.730 -4.420 1.00 1.00 H new ATOM 0 HD12 LEU A 71 24.555 -1.242 -5.287 1.00 1.00 H new ATOM 0 HD13 LEU A 71 23.922 -2.895 -5.469 1.00 1.00 H new ATOM 0 HD21 LEU A 71 23.232 -3.350 -2.517 1.00 1.00 H new ATOM 0 HD22 LEU A 71 24.068 -4.503 -3.584 1.00 1.00 H new ATOM 0 HD23 LEU A 71 24.816 -4.010 -2.047 1.00 1.00 H new ATOM 1066 N PHE A 72 28.384 -1.600 -2.314 1.00 1.00 N ATOM 1067 CA PHE A 72 28.864 -0.922 -1.105 1.00 1.00 C ATOM 1068 C PHE A 72 29.647 0.355 -1.428 1.00 1.00 C ATOM 1069 O PHE A 72 29.310 1.453 -0.978 1.00 1.00 O ATOM 1070 CB PHE A 72 29.743 -1.910 -0.331 1.00 1.00 C ATOM 1071 CG PHE A 72 30.338 -1.352 0.938 1.00 1.00 C ATOM 1072 CD1 PHE A 72 29.525 -1.227 2.074 1.00 1.00 C ATOM 1073 CD2 PHE A 72 31.692 -0.972 0.988 1.00 1.00 C ATOM 1074 CE1 PHE A 72 30.076 -0.744 3.267 1.00 1.00 C ATOM 1075 CE2 PHE A 72 32.239 -0.475 2.184 1.00 1.00 C ATOM 1076 CZ PHE A 72 31.430 -0.364 3.329 1.00 1.00 C ATOM 0 H PHE A 72 28.669 -2.578 -2.366 1.00 1.00 H new ATOM 0 HA PHE A 72 28.008 -0.613 -0.506 1.00 1.00 H new ATOM 0 HB2 PHE A 72 29.149 -2.790 -0.083 1.00 1.00 H new ATOM 0 HB3 PHE A 72 30.552 -2.244 -0.981 1.00 1.00 H new ATOM 0 HD1 PHE A 72 28.481 -1.501 2.029 1.00 1.00 H new ATOM 0 HD2 PHE A 72 32.311 -1.062 0.108 1.00 1.00 H new ATOM 0 HE1 PHE A 72 29.456 -0.662 4.148 1.00 1.00 H new ATOM 0 HE2 PHE A 72 33.277 -0.179 2.223 1.00 1.00 H new ATOM 0 HZ PHE A 72 31.846 0.011 4.252 1.00 1.00 H new ATOM 1086 N GLN A 73 30.655 0.205 -2.286 1.00 1.00 N ATOM 1087 CA GLN A 73 31.498 1.305 -2.750 1.00 1.00 C ATOM 1088 C GLN A 73 30.693 2.329 -3.555 1.00 1.00 C ATOM 1089 O GLN A 73 30.838 3.533 -3.361 1.00 1.00 O ATOM 1090 CB GLN A 73 32.659 0.737 -3.585 1.00 1.00 C ATOM 1091 CG GLN A 73 33.672 -0.050 -2.733 1.00 1.00 C ATOM 1092 CD GLN A 73 34.507 0.821 -1.786 1.00 1.00 C ATOM 1093 OE1 GLN A 73 34.576 2.039 -1.885 1.00 1.00 O ATOM 1094 NE2 GLN A 73 35.180 0.233 -0.821 1.00 1.00 N ATOM 0 H GLN A 73 30.913 -0.698 -2.684 1.00 1.00 H new ATOM 0 HA GLN A 73 31.900 1.828 -1.883 1.00 1.00 H new ATOM 0 HB2 GLN A 73 32.258 0.085 -4.361 1.00 1.00 H new ATOM 0 HB3 GLN A 73 33.173 1.555 -4.090 1.00 1.00 H new ATOM 0 HG2 GLN A 73 33.135 -0.794 -2.145 1.00 1.00 H new ATOM 0 HG3 GLN A 73 34.344 -0.593 -3.397 1.00 1.00 H new ATOM 0 HE21 GLN A 73 35.140 -0.781 -0.716 1.00 1.00 H new ATOM 0 HE22 GLN A 73 35.742 0.791 -0.178 1.00 1.00 H new ATOM 1103 N GLY A 74 29.780 1.856 -4.400 1.00 1.00 N ATOM 1104 CA GLY A 74 28.926 2.703 -5.218 1.00 1.00 C ATOM 1105 C GLY A 74 27.930 3.512 -4.387 1.00 1.00 C ATOM 1106 O GLY A 74 27.702 4.679 -4.682 1.00 1.00 O ATOM 0 H GLY A 74 29.613 0.859 -4.535 1.00 1.00 H new ATOM 0 HA2 GLY A 74 29.547 3.385 -5.799 1.00 1.00 H new ATOM 0 HA3 GLY A 74 28.381 2.083 -5.930 1.00 1.00 H new ATOM 1110 N ILE A 75 27.383 2.981 -3.292 1.00 1.00 N ATOM 1111 CA ILE A 75 26.568 3.782 -2.389 1.00 1.00 C ATOM 1112 C ILE A 75 27.463 4.859 -1.761 1.00 1.00 C ATOM 1113 O ILE A 75 27.113 6.033 -1.773 1.00 1.00 O ATOM 1114 CB ILE A 75 25.849 2.878 -1.366 1.00 1.00 C ATOM 1115 CG1 ILE A 75 24.870 1.866 -2.004 1.00 1.00 C ATOM 1116 CG2 ILE A 75 25.080 3.673 -0.302 1.00 1.00 C ATOM 1117 CD1 ILE A 75 24.437 0.804 -0.989 1.00 1.00 C ATOM 0 H ILE A 75 27.491 2.006 -3.014 1.00 1.00 H new ATOM 0 HA ILE A 75 25.768 4.295 -2.923 1.00 1.00 H new ATOM 0 HB ILE A 75 26.666 2.329 -0.898 1.00 1.00 H new ATOM 0 HG12 ILE A 75 23.993 2.392 -2.381 1.00 1.00 H new ATOM 0 HG13 ILE A 75 25.345 1.385 -2.859 1.00 1.00 H new ATOM 0 HG21 ILE A 75 24.596 2.983 0.389 1.00 1.00 H new ATOM 0 HG22 ILE A 75 25.773 4.310 0.248 1.00 1.00 H new ATOM 0 HG23 ILE A 75 24.324 4.292 -0.786 1.00 1.00 H new ATOM 0 HD11 ILE A 75 23.749 0.105 -1.465 1.00 1.00 H new ATOM 0 HD12 ILE A 75 25.313 0.263 -0.632 1.00 1.00 H new ATOM 0 HD13 ILE A 75 23.940 1.286 -0.147 1.00 1.00 H new ATOM 1129 N LYS A 76 28.644 4.509 -1.252 1.00 1.00 N ATOM 1130 CA LYS A 76 29.428 5.487 -0.474 1.00 1.00 C ATOM 1131 C LYS A 76 30.034 6.604 -1.340 1.00 1.00 C ATOM 1132 O LYS A 76 30.135 7.740 -0.884 1.00 1.00 O ATOM 1133 CB LYS A 76 30.448 4.745 0.405 1.00 1.00 C ATOM 1134 CG LYS A 76 31.884 4.609 -0.110 1.00 1.00 C ATOM 1135 CD LYS A 76 32.644 3.522 0.675 1.00 1.00 C ATOM 1136 CE LYS A 76 32.878 3.758 2.180 1.00 1.00 C ATOM 1137 NZ LYS A 76 33.546 5.055 2.488 1.00 1.00 N1+ ATOM 0 H LYS A 76 29.074 3.590 -1.355 1.00 1.00 H new ATOM 0 HA LYS A 76 28.753 6.025 0.192 1.00 1.00 H new ATOM 0 HB2 LYS A 76 30.487 5.251 1.370 1.00 1.00 H new ATOM 0 HB3 LYS A 76 30.063 3.742 0.587 1.00 1.00 H new ATOM 0 HG2 LYS A 76 31.873 4.358 -1.171 1.00 1.00 H new ATOM 0 HG3 LYS A 76 32.402 5.563 -0.014 1.00 1.00 H new ATOM 0 HD2 LYS A 76 32.099 2.585 0.563 1.00 1.00 H new ATOM 0 HD3 LYS A 76 33.616 3.384 0.202 1.00 1.00 H new ATOM 0 HE2 LYS A 76 31.919 3.722 2.698 1.00 1.00 H new ATOM 0 HE3 LYS A 76 33.485 2.944 2.576 1.00 1.00 H new ATOM 0 HZ1 LYS A 76 34.166 4.938 3.315 1.00 1.00 H new ATOM 0 HZ2 LYS A 76 34.113 5.356 1.670 1.00 1.00 H new ATOM 0 HZ3 LYS A 76 32.826 5.776 2.694 1.00 1.00 H new ATOM 1151 N ASP A 77 30.392 6.285 -2.588 1.00 1.00 N ATOM 1152 CA ASP A 77 31.096 7.165 -3.519 1.00 1.00 C ATOM 1153 C ASP A 77 30.227 7.757 -4.645 1.00 1.00 C ATOM 1154 O ASP A 77 30.401 8.924 -5.006 1.00 1.00 O ATOM 1155 CB ASP A 77 32.306 6.414 -4.090 1.00 1.00 C ATOM 1156 CG ASP A 77 33.220 7.344 -4.908 1.00 1.00 C ATOM 1157 OD1 ASP A 77 33.909 8.201 -4.302 1.00 1.00 O ATOM 1158 OD2 ASP A 77 33.258 7.217 -6.156 1.00 1.00 O1- ATOM 0 H ASP A 77 30.190 5.370 -2.991 1.00 1.00 H new ATOM 0 HA ASP A 77 31.413 8.036 -2.945 1.00 1.00 H new ATOM 0 HB2 ASP A 77 32.876 5.969 -3.274 1.00 1.00 H new ATOM 0 HB3 ASP A 77 31.961 5.595 -4.722 1.00 1.00 H new ATOM 1163 N SER A 78 29.272 6.984 -5.178 1.00 1.00 N ATOM 1164 CA SER A 78 28.419 7.383 -6.315 1.00 1.00 C ATOM 1165 C SER A 78 27.087 8.000 -5.872 1.00 1.00 C ATOM 1166 O SER A 78 26.512 8.799 -6.615 1.00 1.00 O ATOM 1167 CB SER A 78 28.155 6.216 -7.288 1.00 1.00 C ATOM 1168 OG SER A 78 29.342 5.501 -7.602 1.00 1.00 O ATOM 0 H SER A 78 29.064 6.048 -4.829 1.00 1.00 H new ATOM 0 HA SER A 78 28.987 8.150 -6.841 1.00 1.00 H new ATOM 0 HB2 SER A 78 27.428 5.534 -6.846 1.00 1.00 H new ATOM 0 HB3 SER A 78 27.712 6.603 -8.206 1.00 1.00 H new ATOM 0 HG SER A 78 29.130 4.770 -8.219 1.00 1.00 H new ATOM 1174 N LEU A 79 26.605 7.669 -4.662 1.00 1.00 N ATOM 1175 CA LEU A 79 25.467 8.354 -4.030 1.00 1.00 C ATOM 1176 C LEU A 79 26.033 9.511 -3.196 1.00 1.00 C ATOM 1177 O LEU A 79 25.912 10.675 -3.576 1.00 1.00 O ATOM 1178 CB LEU A 79 24.567 7.411 -3.196 1.00 1.00 C ATOM 1179 CG LEU A 79 23.774 6.267 -3.862 1.00 1.00 C ATOM 1180 CD1 LEU A 79 22.323 6.685 -4.056 1.00 1.00 C ATOM 1181 CD2 LEU A 79 24.267 5.861 -5.241 1.00 1.00 C ATOM 0 H LEU A 79 26.995 6.917 -4.094 1.00 1.00 H new ATOM 0 HA LEU A 79 24.801 8.735 -4.805 1.00 1.00 H new ATOM 0 HB2 LEU A 79 25.201 6.957 -2.434 1.00 1.00 H new ATOM 0 HB3 LEU A 79 23.844 8.039 -2.676 1.00 1.00 H new ATOM 0 HG LEU A 79 23.903 5.424 -3.183 1.00 1.00 H new ATOM 0 HD11 LEU A 79 21.770 5.872 -4.527 1.00 1.00 H new ATOM 0 HD12 LEU A 79 21.878 6.914 -3.088 1.00 1.00 H new ATOM 0 HD13 LEU A 79 22.281 7.569 -4.693 1.00 1.00 H new ATOM 0 HD21 LEU A 79 23.647 5.051 -5.625 1.00 1.00 H new ATOM 0 HD22 LEU A 79 24.207 6.715 -5.915 1.00 1.00 H new ATOM 0 HD23 LEU A 79 25.302 5.525 -5.173 1.00 1.00 H new ATOM 1193 N GLY A 80 26.689 9.183 -2.077 1.00 1.00 N ATOM 1194 CA GLY A 80 27.450 10.100 -1.207 1.00 1.00 C ATOM 1195 C GLY A 80 26.597 11.120 -0.425 1.00 1.00 C ATOM 1196 O GLY A 80 27.086 11.789 0.484 1.00 1.00 O ATOM 0 H GLY A 80 26.707 8.223 -1.732 1.00 1.00 H new ATOM 0 HA2 GLY A 80 28.024 9.507 -0.494 1.00 1.00 H new ATOM 0 HA3 GLY A 80 28.168 10.645 -1.820 1.00 1.00 H new ATOM 1200 N PHE A 81 25.309 11.181 -0.745 1.00 1.00 N ATOM 1201 CA PHE A 81 24.228 11.949 -0.133 1.00 1.00 C ATOM 1202 C PHE A 81 22.925 11.192 -0.420 1.00 1.00 C ATOM 1203 O PHE A 81 22.809 10.539 -1.460 1.00 1.00 O ATOM 1204 CB PHE A 81 24.160 13.365 -0.736 1.00 1.00 C ATOM 1205 CG PHE A 81 22.855 14.086 -0.442 1.00 1.00 C ATOM 1206 CD1 PHE A 81 22.618 14.628 0.836 1.00 1.00 C ATOM 1207 CD2 PHE A 81 21.840 14.141 -1.420 1.00 1.00 C ATOM 1208 CE1 PHE A 81 21.378 15.224 1.133 1.00 1.00 C ATOM 1209 CE2 PHE A 81 20.600 14.737 -1.122 1.00 1.00 C ATOM 1210 CZ PHE A 81 20.370 15.277 0.155 1.00 1.00 C ATOM 0 H PHE A 81 24.957 10.631 -1.529 1.00 1.00 H new ATOM 0 HA PHE A 81 24.393 12.057 0.939 1.00 1.00 H new ATOM 0 HB2 PHE A 81 24.989 13.957 -0.348 1.00 1.00 H new ATOM 0 HB3 PHE A 81 24.294 13.299 -1.816 1.00 1.00 H new ATOM 0 HD1 PHE A 81 23.390 14.586 1.590 1.00 1.00 H new ATOM 0 HD2 PHE A 81 22.015 13.724 -2.401 1.00 1.00 H new ATOM 0 HE1 PHE A 81 21.201 15.641 2.113 1.00 1.00 H new ATOM 0 HE2 PHE A 81 19.826 14.779 -1.874 1.00 1.00 H new ATOM 0 HZ PHE A 81 19.418 15.733 0.385 1.00 1.00 H new ATOM 1220 N GLN A 82 21.960 11.234 0.503 1.00 1.00 N ATOM 1221 CA GLN A 82 20.699 10.501 0.378 1.00 1.00 C ATOM 1222 C GLN A 82 19.500 11.382 0.794 1.00 1.00 C ATOM 1223 O GLN A 82 19.491 11.882 1.920 1.00 1.00 O ATOM 1224 CB GLN A 82 20.791 9.262 1.269 1.00 1.00 C ATOM 1225 CG GLN A 82 21.966 8.311 0.941 1.00 1.00 C ATOM 1226 CD GLN A 82 21.718 7.410 -0.259 1.00 1.00 C ATOM 1227 OE1 GLN A 82 20.637 7.317 -0.811 1.00 1.00 O ATOM 1228 NE2 GLN A 82 22.707 6.644 -0.653 1.00 1.00 N ATOM 0 H GLN A 82 22.033 11.780 1.361 1.00 1.00 H new ATOM 0 HA GLN A 82 20.538 10.212 -0.661 1.00 1.00 H new ATOM 0 HB2 GLN A 82 20.882 9.584 2.306 1.00 1.00 H new ATOM 0 HB3 GLN A 82 19.858 8.704 1.189 1.00 1.00 H new ATOM 0 HG2 GLN A 82 22.861 8.906 0.757 1.00 1.00 H new ATOM 0 HG3 GLN A 82 22.171 7.689 1.813 1.00 1.00 H new ATOM 0 HE21 GLN A 82 23.618 6.713 -0.198 1.00 1.00 H new ATOM 0 HE22 GLN A 82 22.566 5.980 -1.414 1.00 1.00 H new ATOM 1237 N PRO A 83 18.473 11.553 -0.061 1.00 1.00 N ATOM 1238 CA PRO A 83 17.400 12.519 0.197 1.00 1.00 C ATOM 1239 C PRO A 83 16.313 12.016 1.167 1.00 1.00 C ATOM 1240 O PRO A 83 15.858 12.769 2.028 1.00 1.00 O ATOM 1241 CB PRO A 83 16.854 12.857 -1.191 1.00 1.00 C ATOM 1242 CG PRO A 83 17.073 11.567 -1.982 1.00 1.00 C ATOM 1243 CD PRO A 83 18.396 11.058 -1.430 1.00 1.00 C ATOM 0 HA PRO A 83 17.780 13.397 0.719 1.00 1.00 H new ATOM 0 HB2 PRO A 83 15.800 13.130 -1.152 1.00 1.00 H new ATOM 0 HB3 PRO A 83 17.385 13.697 -1.638 1.00 1.00 H new ATOM 0 HG2 PRO A 83 16.266 10.852 -1.823 1.00 1.00 H new ATOM 0 HG3 PRO A 83 17.126 11.754 -3.055 1.00 1.00 H new ATOM 0 HD2 PRO A 83 18.437 9.969 -1.455 1.00 1.00 H new ATOM 0 HD3 PRO A 83 19.234 11.422 -2.025 1.00 1.00 H new ATOM 1251 N ASN A 84 15.887 10.749 1.033 1.00 1.00 N ATOM 1252 CA ASN A 84 14.737 10.165 1.753 1.00 1.00 C ATOM 1253 C ASN A 84 14.912 8.654 2.057 1.00 1.00 C ATOM 1254 O ASN A 84 13.929 7.937 2.243 1.00 1.00 O ATOM 1255 CB ASN A 84 13.457 10.404 0.913 1.00 1.00 C ATOM 1256 CG ASN A 84 13.063 11.864 0.771 1.00 1.00 C ATOM 1257 OD1 ASN A 84 12.530 12.479 1.684 1.00 1.00 O ATOM 1258 ND2 ASN A 84 13.292 12.459 -0.380 1.00 1.00 N ATOM 0 H ASN A 84 16.342 10.085 0.407 1.00 1.00 H new ATOM 0 HA ASN A 84 14.661 10.658 2.722 1.00 1.00 H new ATOM 0 HB2 ASN A 84 13.605 9.982 -0.081 1.00 1.00 H new ATOM 0 HB3 ASN A 84 12.630 9.860 1.370 1.00 1.00 H new ATOM 0 HD21 ASN A 84 13.025 13.435 -0.512 1.00 1.00 H new ATOM 0 HD22 ASN A 84 13.737 11.945 -1.140 1.00 1.00 H new ATOM 1265 N LEU A 85 16.150 8.139 2.093 1.00 1.00 N ATOM 1266 CA LEU A 85 16.394 6.692 2.140 1.00 1.00 C ATOM 1267 C LEU A 85 16.311 6.097 3.540 1.00 1.00 C ATOM 1268 O LEU A 85 16.883 6.638 4.482 1.00 1.00 O ATOM 1269 CB LEU A 85 17.757 6.383 1.507 1.00 1.00 C ATOM 1270 CG LEU A 85 18.113 4.885 1.429 1.00 1.00 C ATOM 1271 CD1 LEU A 85 17.073 4.149 0.595 1.00 1.00 C ATOM 1272 CD2 LEU A 85 19.487 4.715 0.788 1.00 1.00 C ATOM 0 H LEU A 85 16.998 8.705 2.090 1.00 1.00 H new ATOM 0 HA LEU A 85 15.593 6.220 1.571 1.00 1.00 H new ATOM 0 HB2 LEU A 85 17.776 6.799 0.500 1.00 1.00 H new ATOM 0 HB3 LEU A 85 18.531 6.896 2.078 1.00 1.00 H new ATOM 0 HG LEU A 85 18.128 4.471 2.437 1.00 1.00 H new ATOM 0 HD11 LEU A 85 17.330 3.091 0.544 1.00 1.00 H new ATOM 0 HD12 LEU A 85 16.091 4.262 1.055 1.00 1.00 H new ATOM 0 HD13 LEU A 85 17.052 4.567 -0.412 1.00 1.00 H new ATOM 0 HD21 LEU A 85 19.735 3.655 0.735 1.00 1.00 H new ATOM 0 HD22 LEU A 85 19.474 5.136 -0.217 1.00 1.00 H new ATOM 0 HD23 LEU A 85 20.235 5.233 1.388 1.00 1.00 H new ATOM 1284 N ARG A 86 15.671 4.934 3.629 1.00 1.00 N ATOM 1285 CA ARG A 86 15.615 4.017 4.786 1.00 1.00 C ATOM 1286 C ARG A 86 15.830 2.586 4.296 1.00 1.00 C ATOM 1287 O ARG A 86 15.504 2.279 3.160 1.00 1.00 O ATOM 1288 CB ARG A 86 14.254 4.119 5.499 1.00 1.00 C ATOM 1289 CG ARG A 86 13.653 5.538 5.600 1.00 1.00 C ATOM 1290 CD ARG A 86 13.195 5.904 7.005 1.00 1.00 C ATOM 1291 NE ARG A 86 12.181 4.962 7.524 1.00 1.00 N ATOM 1292 CZ ARG A 86 11.215 5.239 8.387 1.00 1.00 C ATOM 1293 NH1 ARG A 86 11.105 6.406 8.956 1.00 1.00 N1+ ATOM 1294 NH2 ARG A 86 10.332 4.336 8.701 1.00 1.00 N ATOM 0 H ARG A 86 15.135 4.572 2.840 1.00 1.00 H new ATOM 0 HA ARG A 86 16.395 4.293 5.495 1.00 1.00 H new ATOM 0 HB2 ARG A 86 13.542 3.480 4.976 1.00 1.00 H new ATOM 0 HB3 ARG A 86 14.362 3.718 6.507 1.00 1.00 H new ATOM 0 HG2 ARG A 86 14.396 6.263 5.268 1.00 1.00 H new ATOM 0 HG3 ARG A 86 12.806 5.615 4.919 1.00 1.00 H new ATOM 0 HD2 ARG A 86 14.055 5.915 7.675 1.00 1.00 H new ATOM 0 HD3 ARG A 86 12.782 6.913 7.000 1.00 1.00 H new ATOM 0 HE ARG A 86 12.230 4.002 7.183 1.00 1.00 H new ATOM 0 HH11 ARG A 86 11.776 7.143 8.742 1.00 1.00 H new ATOM 0 HH12 ARG A 86 10.347 6.582 9.616 1.00 1.00 H new ATOM 0 HH21 ARG A 86 10.381 3.407 8.282 1.00 1.00 H new ATOM 0 HH22 ARG A 86 9.591 4.557 9.366 1.00 1.00 H new ATOM 1308 N TYR A 87 16.332 1.688 5.137 1.00 1.00 N ATOM 1309 CA TYR A 87 16.624 0.305 4.733 1.00 1.00 C ATOM 1310 C TYR A 87 16.672 -0.655 5.932 1.00 1.00 C ATOM 1311 O TYR A 87 16.774 -0.211 7.077 1.00 1.00 O ATOM 1312 CB TYR A 87 17.930 0.269 3.915 1.00 1.00 C ATOM 1313 CG TYR A 87 19.172 -0.158 4.647 1.00 1.00 C ATOM 1314 CD1 TYR A 87 19.664 0.635 5.697 1.00 1.00 C ATOM 1315 CD2 TYR A 87 19.838 -1.335 4.258 1.00 1.00 C ATOM 1316 CE1 TYR A 87 20.851 0.248 6.351 1.00 1.00 C ATOM 1317 CE2 TYR A 87 21.007 -1.728 4.925 1.00 1.00 C ATOM 1318 CZ TYR A 87 21.477 -0.960 5.993 1.00 1.00 C ATOM 1319 OH TYR A 87 22.502 -1.448 6.722 1.00 1.00 O ATOM 0 H TYR A 87 16.549 1.890 6.113 1.00 1.00 H new ATOM 0 HA TYR A 87 15.807 -0.047 4.103 1.00 1.00 H new ATOM 0 HB2 TYR A 87 17.784 -0.404 3.070 1.00 1.00 H new ATOM 0 HB3 TYR A 87 18.102 1.264 3.504 1.00 1.00 H new ATOM 0 HD1 TYR A 87 19.140 1.529 5.999 1.00 1.00 H new ATOM 0 HD2 TYR A 87 19.450 -1.934 3.448 1.00 1.00 H new ATOM 0 HE1 TYR A 87 21.277 0.874 7.121 1.00 1.00 H new ATOM 0 HE2 TYR A 87 21.539 -2.616 4.616 1.00 1.00 H new ATOM 0 HH TYR A 87 22.800 -2.299 6.338 1.00 1.00 H new ATOM 1329 N GLY A 88 16.617 -1.960 5.669 1.00 1.00 N ATOM 1330 CA GLY A 88 16.858 -3.039 6.634 1.00 1.00 C ATOM 1331 C GLY A 88 17.939 -3.996 6.159 1.00 1.00 C ATOM 1332 O GLY A 88 18.407 -3.907 5.027 1.00 1.00 O ATOM 0 H GLY A 88 16.394 -2.312 4.738 1.00 1.00 H new ATOM 0 HA2 GLY A 88 17.149 -2.610 7.593 1.00 1.00 H new ATOM 0 HA3 GLY A 88 15.933 -3.591 6.800 1.00 1.00 H new ATOM 1336 N VAL A 89 18.369 -4.931 7.005 1.00 1.00 N ATOM 1337 CA VAL A 89 19.555 -5.741 6.714 1.00 1.00 C ATOM 1338 C VAL A 89 19.627 -7.059 7.488 1.00 1.00 C ATOM 1339 O VAL A 89 19.210 -7.160 8.635 1.00 1.00 O ATOM 1340 CB VAL A 89 20.808 -4.857 6.843 1.00 1.00 C ATOM 1341 CG1 VAL A 89 20.701 -3.733 7.883 1.00 1.00 C ATOM 1342 CG2 VAL A 89 22.144 -5.588 6.949 1.00 1.00 C ATOM 0 H VAL A 89 17.918 -5.147 7.894 1.00 1.00 H new ATOM 0 HA VAL A 89 19.487 -6.089 5.683 1.00 1.00 H new ATOM 0 HB VAL A 89 20.821 -4.382 5.862 1.00 1.00 H new ATOM 0 HG11 VAL A 89 21.631 -3.165 7.902 1.00 1.00 H new ATOM 0 HG12 VAL A 89 19.876 -3.071 7.619 1.00 1.00 H new ATOM 0 HG13 VAL A 89 20.519 -4.164 8.867 1.00 1.00 H new ATOM 0 HG21 VAL A 89 22.951 -4.860 7.035 1.00 1.00 H new ATOM 0 HG22 VAL A 89 22.139 -6.230 7.830 1.00 1.00 H new ATOM 0 HG23 VAL A 89 22.298 -6.196 6.058 1.00 1.00 H new ATOM 1352 N ILE A 90 20.192 -8.080 6.849 1.00 1.00 N ATOM 1353 CA ILE A 90 20.418 -9.435 7.363 1.00 1.00 C ATOM 1354 C ILE A 90 21.860 -9.832 7.017 1.00 1.00 C ATOM 1355 O ILE A 90 22.186 -10.105 5.863 1.00 1.00 O ATOM 1356 CB ILE A 90 19.374 -10.375 6.724 1.00 1.00 C ATOM 1357 CG1 ILE A 90 17.918 -10.049 7.126 1.00 1.00 C ATOM 1358 CG2 ILE A 90 19.601 -11.859 7.036 1.00 1.00 C ATOM 1359 CD1 ILE A 90 17.050 -10.117 5.871 1.00 1.00 C ATOM 0 H ILE A 90 20.529 -7.979 5.891 1.00 1.00 H new ATOM 0 HA ILE A 90 20.299 -9.496 8.445 1.00 1.00 H new ATOM 0 HB ILE A 90 19.517 -10.196 5.658 1.00 1.00 H new ATOM 0 HG12 ILE A 90 17.562 -10.758 7.873 1.00 1.00 H new ATOM 0 HG13 ILE A 90 17.860 -9.057 7.575 1.00 1.00 H new ATOM 0 HG21 ILE A 90 18.827 -12.455 6.552 1.00 1.00 H new ATOM 0 HG22 ILE A 90 20.579 -12.163 6.664 1.00 1.00 H new ATOM 0 HG23 ILE A 90 19.558 -12.015 8.114 1.00 1.00 H new ATOM 0 HD11 ILE A 90 16.016 -9.890 6.131 1.00 1.00 H new ATOM 0 HD12 ILE A 90 17.408 -9.391 5.141 1.00 1.00 H new ATOM 0 HD13 ILE A 90 17.105 -11.118 5.444 1.00 1.00 H new ATOM 1371 N ALA A 91 22.727 -9.830 8.026 1.00 1.00 N ATOM 1372 CA ALA A 91 24.114 -10.268 7.948 1.00 1.00 C ATOM 1373 C ALA A 91 24.233 -11.765 8.264 1.00 1.00 C ATOM 1374 O ALA A 91 23.522 -12.284 9.127 1.00 1.00 O ATOM 1375 CB ALA A 91 24.903 -9.427 8.949 1.00 1.00 C ATOM 0 H ALA A 91 22.469 -9.509 8.959 1.00 1.00 H new ATOM 0 HA ALA A 91 24.508 -10.131 6.941 1.00 1.00 H new ATOM 0 HB1 ALA A 91 25.952 -9.722 8.925 1.00 1.00 H new ATOM 0 HB2 ALA A 91 24.816 -8.373 8.687 1.00 1.00 H new ATOM 0 HB3 ALA A 91 24.505 -9.585 9.951 1.00 1.00 H new ATOM 1381 N LEU A 92 25.146 -12.466 7.593 1.00 1.00 N ATOM 1382 CA LEU A 92 25.387 -13.893 7.825 1.00 1.00 C ATOM 1383 C LEU A 92 26.876 -14.245 7.836 1.00 1.00 C ATOM 1384 O LEU A 92 27.678 -13.592 7.166 1.00 1.00 O ATOM 1385 CB LEU A 92 24.683 -14.761 6.765 1.00 1.00 C ATOM 1386 CG LEU A 92 23.243 -14.384 6.394 1.00 1.00 C ATOM 1387 CD1 LEU A 92 23.123 -13.387 5.246 1.00 1.00 C ATOM 1388 CD2 LEU A 92 22.528 -15.657 5.970 1.00 1.00 C ATOM 0 H LEU A 92 25.742 -12.061 6.871 1.00 1.00 H new ATOM 0 HA LEU A 92 24.974 -14.105 8.811 1.00 1.00 H new ATOM 0 HB2 LEU A 92 25.283 -14.737 5.856 1.00 1.00 H new ATOM 0 HB3 LEU A 92 24.682 -15.792 7.119 1.00 1.00 H new ATOM 0 HG LEU A 92 22.809 -13.906 7.273 1.00 1.00 H new ATOM 0 HD11 LEU A 92 22.071 -13.179 5.053 1.00 1.00 H new ATOM 0 HD12 LEU A 92 23.633 -12.461 5.513 1.00 1.00 H new ATOM 0 HD13 LEU A 92 23.580 -13.807 4.350 1.00 1.00 H new ATOM 0 HD21 LEU A 92 21.498 -15.423 5.699 1.00 1.00 H new ATOM 0 HD22 LEU A 92 23.039 -16.093 5.112 1.00 1.00 H new ATOM 0 HD23 LEU A 92 22.533 -16.369 6.795 1.00 1.00 H new ATOM 1400 N GLY A 93 27.215 -15.338 8.514 1.00 1.00 N ATOM 1401 CA GLY A 93 28.552 -15.920 8.424 1.00 1.00 C ATOM 1402 C GLY A 93 28.870 -16.897 9.549 1.00 1.00 C ATOM 1403 O GLY A 93 27.970 -17.481 10.140 1.00 1.00 O ATOM 0 H GLY A 93 26.580 -15.841 9.134 1.00 1.00 H new ATOM 0 HA2 GLY A 93 28.651 -16.435 7.468 1.00 1.00 H new ATOM 0 HA3 GLY A 93 29.290 -15.117 8.432 1.00 1.00 H new ATOM 1512 N CYS A 101 29.672 -10.631 11.768 1.00 1.00 N ATOM 1513 CA CYS A 101 28.570 -10.157 10.923 1.00 1.00 C ATOM 1514 C CYS A 101 28.815 -8.749 10.347 1.00 1.00 C ATOM 1515 O CYS A 101 27.891 -8.069 9.904 1.00 1.00 O ATOM 1516 CB CYS A 101 27.303 -10.263 11.782 1.00 1.00 C ATOM 1517 SG CYS A 101 27.562 -9.366 13.345 1.00 1.00 S ATOM 0 HA CYS A 101 28.471 -10.770 10.027 1.00 1.00 H new ATOM 0 HB2 CYS A 101 26.450 -9.846 11.246 1.00 1.00 H new ATOM 0 HB3 CYS A 101 27.072 -11.309 11.983 1.00 1.00 H new ATOM 0 HG CYS A 101 28.820 -9.414 13.670 1.00 1.00 H new ATOM 1523 N ASN A 102 30.073 -8.302 10.355 1.00 1.00 N ATOM 1524 CA ASN A 102 30.485 -6.928 10.051 1.00 1.00 C ATOM 1525 C ASN A 102 30.148 -6.468 8.619 1.00 1.00 C ATOM 1526 O ASN A 102 30.027 -5.272 8.410 1.00 1.00 O ATOM 1527 CB ASN A 102 31.971 -6.810 10.428 1.00 1.00 C ATOM 1528 CG ASN A 102 32.429 -5.369 10.562 1.00 1.00 C ATOM 1529 OD1 ASN A 102 32.212 -4.711 11.567 1.00 1.00 O ATOM 1530 ND2 ASN A 102 33.070 -4.839 9.552 1.00 1.00 N ATOM 0 H ASN A 102 30.862 -8.908 10.581 1.00 1.00 H new ATOM 0 HA ASN A 102 29.902 -6.226 10.647 1.00 1.00 H new ATOM 0 HB2 ASN A 102 32.145 -7.331 11.369 1.00 1.00 H new ATOM 0 HB3 ASN A 102 32.575 -7.310 9.670 1.00 1.00 H new ATOM 0 HD21 ASN A 102 33.391 -3.872 9.602 1.00 1.00 H new ATOM 0 HD22 ASN A 102 33.249 -5.393 8.714 1.00 1.00 H new ATOM 1537 N GLY A 103 29.890 -7.367 7.661 1.00 1.00 N ATOM 1538 CA GLY A 103 29.455 -7.006 6.301 1.00 1.00 C ATOM 1539 C GLY A 103 28.144 -6.209 6.263 1.00 1.00 C ATOM 1540 O GLY A 103 28.103 -5.102 5.735 1.00 1.00 O ATOM 0 H GLY A 103 29.977 -8.373 7.806 1.00 1.00 H new ATOM 0 HA2 GLY A 103 30.240 -6.421 5.822 1.00 1.00 H new ATOM 0 HA3 GLY A 103 29.333 -7.917 5.714 1.00 1.00 H new ATOM 1544 N GLY A 104 27.078 -6.703 6.902 1.00 1.00 N ATOM 1545 CA GLY A 104 25.793 -5.975 6.974 1.00 1.00 C ATOM 1546 C GLY A 104 25.857 -4.736 7.871 1.00 1.00 C ATOM 1547 O GLY A 104 25.295 -3.695 7.536 1.00 1.00 O ATOM 0 H GLY A 104 27.073 -7.604 7.379 1.00 1.00 H new ATOM 0 HA2 GLY A 104 25.495 -5.675 5.969 1.00 1.00 H new ATOM 0 HA3 GLY A 104 25.021 -6.648 7.348 1.00 1.00 H new ATOM 1551 N LYS A 105 26.635 -4.801 8.959 1.00 1.00 N ATOM 1552 CA LYS A 105 26.925 -3.661 9.849 1.00 1.00 C ATOM 1553 C LYS A 105 27.690 -2.530 9.150 1.00 1.00 C ATOM 1554 O LYS A 105 27.420 -1.353 9.381 1.00 1.00 O ATOM 1555 CB LYS A 105 27.658 -4.152 11.083 1.00 1.00 C ATOM 1556 CG LYS A 105 26.775 -5.137 11.876 1.00 1.00 C ATOM 1557 CD LYS A 105 27.407 -5.239 13.257 1.00 1.00 C ATOM 1558 CE LYS A 105 26.568 -6.096 14.215 1.00 1.00 C ATOM 1559 NZ LYS A 105 27.198 -6.174 15.568 1.00 1.00 N1+ ATOM 0 H LYS A 105 27.092 -5.664 9.254 1.00 1.00 H new ATOM 0 HA LYS A 105 25.972 -3.225 10.147 1.00 1.00 H new ATOM 0 HB2 LYS A 105 28.588 -4.641 10.791 1.00 1.00 H new ATOM 0 HB3 LYS A 105 27.927 -3.306 11.715 1.00 1.00 H new ATOM 0 HG2 LYS A 105 25.748 -4.777 11.941 1.00 1.00 H new ATOM 0 HG3 LYS A 105 26.741 -6.111 11.389 1.00 1.00 H new ATOM 0 HD2 LYS A 105 28.405 -5.668 13.167 1.00 1.00 H new ATOM 0 HD3 LYS A 105 27.526 -4.240 13.675 1.00 1.00 H new ATOM 0 HE2 LYS A 105 25.567 -5.674 14.302 1.00 1.00 H new ATOM 0 HE3 LYS A 105 26.456 -7.100 13.805 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 26.608 -6.760 16.193 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 28.144 -6.599 15.487 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 27.282 -5.218 15.968 1.00 1.00 H new ATOM 1573 N GLN A 106 28.586 -2.880 8.230 1.00 1.00 N ATOM 1574 CA GLN A 106 29.223 -1.912 7.337 1.00 1.00 C ATOM 1575 C GLN A 106 28.208 -1.250 6.402 1.00 1.00 C ATOM 1576 O GLN A 106 28.276 -0.039 6.209 1.00 1.00 O ATOM 1577 CB GLN A 106 30.376 -2.559 6.553 1.00 1.00 C ATOM 1578 CG GLN A 106 31.643 -2.706 7.405 1.00 1.00 C ATOM 1579 CD GLN A 106 32.369 -1.376 7.620 1.00 1.00 C ATOM 1580 OE1 GLN A 106 32.188 -0.695 8.618 1.00 1.00 O ATOM 1581 NE2 GLN A 106 33.207 -0.952 6.696 1.00 1.00 N ATOM 0 H GLN A 106 28.892 -3.842 8.082 1.00 1.00 H new ATOM 0 HA GLN A 106 29.646 -1.122 7.957 1.00 1.00 H new ATOM 0 HB2 GLN A 106 30.065 -3.540 6.195 1.00 1.00 H new ATOM 0 HB3 GLN A 106 30.599 -1.955 5.673 1.00 1.00 H new ATOM 0 HG2 GLN A 106 31.377 -3.131 8.373 1.00 1.00 H new ATOM 0 HG3 GLN A 106 32.320 -3.411 6.923 1.00 1.00 H new ATOM 0 HE21 GLN A 106 33.367 -1.511 5.858 1.00 1.00 H new ATOM 0 HE22 GLN A 106 33.695 -0.065 6.819 1.00 1.00 H new ATOM 1590 N PHE A 107 27.230 -1.997 5.873 1.00 1.00 N ATOM 1591 CA PHE A 107 26.150 -1.417 5.068 1.00 1.00 C ATOM 1592 C PHE A 107 25.313 -0.401 5.876 1.00 1.00 C ATOM 1593 O PHE A 107 24.914 0.627 5.334 1.00 1.00 O ATOM 1594 CB PHE A 107 25.311 -2.525 4.392 1.00 1.00 C ATOM 1595 CG PHE A 107 25.710 -2.756 2.953 1.00 1.00 C ATOM 1596 CD1 PHE A 107 26.712 -3.698 2.659 1.00 1.00 C ATOM 1597 CD2 PHE A 107 25.098 -2.030 1.910 1.00 1.00 C ATOM 1598 CE1 PHE A 107 27.114 -3.902 1.331 1.00 1.00 C ATOM 1599 CE2 PHE A 107 25.470 -2.276 0.580 1.00 1.00 C ATOM 1600 CZ PHE A 107 26.499 -3.183 0.294 1.00 1.00 C ATOM 0 H PHE A 107 27.166 -3.008 5.990 1.00 1.00 H new ATOM 0 HA PHE A 107 26.594 -0.837 4.259 1.00 1.00 H new ATOM 0 HB2 PHE A 107 25.424 -3.454 4.951 1.00 1.00 H new ATOM 0 HB3 PHE A 107 24.256 -2.254 4.434 1.00 1.00 H new ATOM 0 HD1 PHE A 107 27.172 -4.264 3.456 1.00 1.00 H new ATOM 0 HD2 PHE A 107 24.346 -1.288 2.134 1.00 1.00 H new ATOM 0 HE1 PHE A 107 27.896 -4.612 1.106 1.00 1.00 H new ATOM 0 HE2 PHE A 107 24.962 -1.765 -0.225 1.00 1.00 H new ATOM 0 HZ PHE A 107 26.820 -3.329 -0.727 1.00 1.00 H new ATOM 1610 N ASP A 108 25.137 -0.622 7.188 1.00 1.00 N ATOM 1611 CA ASP A 108 24.436 0.311 8.083 1.00 1.00 C ATOM 1612 C ASP A 108 25.208 1.624 8.235 1.00 1.00 C ATOM 1613 O ASP A 108 24.686 2.701 7.929 1.00 1.00 O ATOM 1614 CB ASP A 108 24.159 -0.407 9.416 1.00 1.00 C ATOM 1615 CG ASP A 108 23.524 0.457 10.516 1.00 1.00 C ATOM 1616 OD1 ASP A 108 24.071 1.523 10.882 1.00 1.00 O ATOM 1617 OD2 ASP A 108 22.493 0.016 11.067 1.00 1.00 O1- ATOM 0 H ASP A 108 25.479 -1.459 7.660 1.00 1.00 H new ATOM 0 HA ASP A 108 23.476 0.602 7.656 1.00 1.00 H new ATOM 0 HB2 ASP A 108 23.503 -1.256 9.222 1.00 1.00 H new ATOM 0 HB3 ASP A 108 25.099 -0.810 9.793 1.00 1.00 H new ATOM 1622 N ALA A 109 26.493 1.510 8.575 1.00 1.00 N ATOM 1623 CA ALA A 109 27.412 2.634 8.639 1.00 1.00 C ATOM 1624 C ALA A 109 27.467 3.433 7.333 1.00 1.00 C ATOM 1625 O ALA A 109 27.570 4.653 7.377 1.00 1.00 O ATOM 1626 CB ALA A 109 28.803 2.105 8.967 1.00 1.00 C ATOM 0 H ALA A 109 26.925 0.618 8.816 1.00 1.00 H new ATOM 0 HA ALA A 109 27.053 3.314 9.412 1.00 1.00 H new ATOM 0 HB1 ALA A 109 29.506 2.937 9.019 1.00 1.00 H new ATOM 0 HB2 ALA A 109 28.779 1.590 9.927 1.00 1.00 H new ATOM 0 HB3 ALA A 109 29.120 1.410 8.190 1.00 1.00 H new ATOM 1632 N LEU A 110 27.348 2.774 6.177 1.00 1.00 N ATOM 1633 CA LEU A 110 27.400 3.392 4.857 1.00 1.00 C ATOM 1634 C LEU A 110 26.321 4.463 4.715 1.00 1.00 C ATOM 1635 O LEU A 110 26.547 5.598 4.300 1.00 1.00 O ATOM 1636 CB LEU A 110 27.190 2.275 3.811 1.00 1.00 C ATOM 1637 CG LEU A 110 27.904 2.567 2.492 1.00 1.00 C ATOM 1638 CD1 LEU A 110 27.530 3.934 1.963 1.00 1.00 C ATOM 1639 CD2 LEU A 110 29.415 2.435 2.678 1.00 1.00 C ATOM 0 H LEU A 110 27.209 1.764 6.137 1.00 1.00 H new ATOM 0 HA LEU A 110 28.363 3.881 4.709 1.00 1.00 H new ATOM 0 HB2 LEU A 110 27.553 1.330 4.215 1.00 1.00 H new ATOM 0 HB3 LEU A 110 26.123 2.153 3.624 1.00 1.00 H new ATOM 0 HG LEU A 110 27.584 1.836 1.750 1.00 1.00 H new ATOM 0 HD11 LEU A 110 28.052 4.116 1.024 1.00 1.00 H new ATOM 0 HD12 LEU A 110 26.454 3.977 1.794 1.00 1.00 H new ATOM 0 HD13 LEU A 110 27.814 4.695 2.689 1.00 1.00 H new ATOM 0 HD21 LEU A 110 29.918 2.645 1.734 1.00 1.00 H new ATOM 0 HD22 LEU A 110 29.752 3.145 3.434 1.00 1.00 H new ATOM 0 HD23 LEU A 110 29.655 1.421 3.000 1.00 1.00 H new ATOM 1651 N LEU A 111 25.101 4.098 5.060 1.00 1.00 N ATOM 1652 CA LEU A 111 23.983 5.030 4.982 1.00 1.00 C ATOM 1653 C LEU A 111 24.111 6.164 5.989 1.00 1.00 C ATOM 1654 O LEU A 111 23.880 7.321 5.623 1.00 1.00 O ATOM 1655 CB LEU A 111 22.679 4.233 5.078 1.00 1.00 C ATOM 1656 CG LEU A 111 22.503 3.230 3.923 1.00 1.00 C ATOM 1657 CD1 LEU A 111 21.029 2.857 3.848 1.00 1.00 C ATOM 1658 CD2 LEU A 111 22.891 3.777 2.542 1.00 1.00 C ATOM 0 H LEU A 111 24.855 3.167 5.396 1.00 1.00 H new ATOM 0 HA LEU A 111 23.984 5.543 4.020 1.00 1.00 H new ATOM 0 HB2 LEU A 111 22.657 3.695 6.026 1.00 1.00 H new ATOM 0 HB3 LEU A 111 21.836 4.924 5.084 1.00 1.00 H new ATOM 0 HG LEU A 111 23.164 2.391 4.142 1.00 1.00 H new ATOM 0 HD11 LEU A 111 20.874 2.146 3.037 1.00 1.00 H new ATOM 0 HD12 LEU A 111 20.720 2.405 4.790 1.00 1.00 H new ATOM 0 HD13 LEU A 111 20.436 3.753 3.663 1.00 1.00 H new ATOM 0 HD21 LEU A 111 22.736 3.005 1.788 1.00 1.00 H new ATOM 0 HD22 LEU A 111 22.273 4.643 2.307 1.00 1.00 H new ATOM 0 HD23 LEU A 111 23.940 4.072 2.549 1.00 1.00 H new ATOM 1670 N GLN A 112 24.611 5.859 7.183 1.00 1.00 N ATOM 1671 CA GLN A 112 24.907 6.865 8.194 1.00 1.00 C ATOM 1672 C GLN A 112 26.096 7.778 7.833 1.00 1.00 C ATOM 1673 O GLN A 112 26.179 8.894 8.347 1.00 1.00 O ATOM 1674 CB GLN A 112 25.158 6.186 9.553 1.00 1.00 C ATOM 1675 CG GLN A 112 23.976 5.350 10.062 1.00 1.00 C ATOM 1676 CD GLN A 112 22.714 6.172 10.330 1.00 1.00 C ATOM 1677 OE1 GLN A 112 22.746 7.289 10.831 1.00 1.00 O ATOM 1678 NE2 GLN A 112 21.547 5.651 10.011 1.00 1.00 N ATOM 0 H GLN A 112 24.822 4.905 7.476 1.00 1.00 H new ATOM 0 HA GLN A 112 24.031 7.512 8.249 1.00 1.00 H new ATOM 0 HB2 GLN A 112 26.035 5.544 9.470 1.00 1.00 H new ATOM 0 HB3 GLN A 112 25.393 6.952 10.292 1.00 1.00 H new ATOM 0 HG2 GLN A 112 23.747 4.577 9.329 1.00 1.00 H new ATOM 0 HG3 GLN A 112 24.270 4.842 10.980 1.00 1.00 H new ATOM 0 HE21 GLN A 112 21.500 4.722 9.593 1.00 1.00 H new ATOM 0 HE22 GLN A 112 20.690 6.177 10.182 1.00 1.00 H new ATOM 1687 N GLU A 113 26.992 7.360 6.924 1.00 1.00 N ATOM 1688 CA GLU A 113 28.147 8.149 6.490 1.00 1.00 C ATOM 1689 C GLU A 113 27.724 9.244 5.494 1.00 1.00 C ATOM 1690 O GLU A 113 28.466 10.198 5.257 1.00 1.00 O ATOM 1691 CB GLU A 113 29.304 7.247 5.985 1.00 1.00 C ATOM 1692 CG GLU A 113 29.497 7.137 4.469 1.00 1.00 C ATOM 1693 CD GLU A 113 30.780 6.359 4.103 1.00 1.00 C ATOM 1694 OE1 GLU A 113 30.996 5.232 4.606 1.00 1.00 O ATOM 1695 OE2 GLU A 113 31.583 6.865 3.281 1.00 1.00 O1- ATOM 0 H GLU A 113 26.930 6.451 6.466 1.00 1.00 H new ATOM 0 HA GLU A 113 28.554 8.672 7.355 1.00 1.00 H new ATOM 0 HB2 GLU A 113 30.234 7.617 6.418 1.00 1.00 H new ATOM 0 HB3 GLU A 113 29.146 6.243 6.379 1.00 1.00 H new ATOM 0 HG2 GLU A 113 28.633 6.639 4.029 1.00 1.00 H new ATOM 0 HG3 GLU A 113 29.543 8.136 4.036 1.00 1.00 H new ATOM 1702 N GLN A 114 26.517 9.109 4.926 1.00 1.00 N ATOM 1703 CA GLN A 114 25.948 10.016 3.949 1.00 1.00 C ATOM 1704 C GLN A 114 24.960 10.957 4.620 1.00 1.00 C ATOM 1705 O GLN A 114 25.251 12.124 4.880 1.00 1.00 O ATOM 1706 CB GLN A 114 25.316 9.207 2.814 1.00 1.00 C ATOM 1707 CG GLN A 114 26.372 8.460 2.000 1.00 1.00 C ATOM 1708 CD GLN A 114 25.656 7.430 1.178 1.00 1.00 C ATOM 1709 OE1 GLN A 114 25.247 7.627 0.050 1.00 1.00 O ATOM 1710 NE2 GLN A 114 25.317 6.337 1.804 1.00 1.00 N ATOM 0 H GLN A 114 25.896 8.332 5.151 1.00 1.00 H new ATOM 0 HA GLN A 114 26.729 10.640 3.514 1.00 1.00 H new ATOM 0 HB2 GLN A 114 24.603 8.494 3.228 1.00 1.00 H new ATOM 0 HB3 GLN A 114 24.756 9.874 2.159 1.00 1.00 H new ATOM 0 HG2 GLN A 114 26.921 9.149 1.359 1.00 1.00 H new ATOM 0 HG3 GLN A 114 27.101 7.987 2.658 1.00 1.00 H new ATOM 0 HE21 GLN A 114 25.656 6.165 2.750 1.00 1.00 H new ATOM 0 HE22 GLN A 114 24.713 5.654 1.347 1.00 1.00 H new ATOM 1719 N SER A 115 23.774 10.405 4.862 1.00 1.00 N ATOM 1720 CA SER A 115 22.573 11.128 5.289 1.00 1.00 C ATOM 1721 C SER A 115 21.381 10.205 5.590 1.00 1.00 C ATOM 1722 O SER A 115 20.360 10.648 6.117 1.00 1.00 O ATOM 1723 CB SER A 115 22.047 12.028 4.142 1.00 1.00 C ATOM 1724 OG SER A 115 22.974 12.343 3.112 1.00 1.00 O ATOM 0 H SER A 115 23.614 9.403 4.763 1.00 1.00 H new ATOM 0 HA SER A 115 22.887 11.674 6.178 1.00 1.00 H new ATOM 0 HB2 SER A 115 21.186 11.536 3.689 1.00 1.00 H new ATOM 0 HB3 SER A 115 21.689 12.961 4.577 1.00 1.00 H new ATOM 0 HG SER A 115 22.655 13.123 2.612 1.00 1.00 H new ATOM 1730 N ALA A 116 21.474 8.936 5.172 1.00 1.00 N ATOM 1731 CA ALA A 116 20.364 7.996 5.148 1.00 1.00 C ATOM 1732 C ALA A 116 20.039 7.343 6.498 1.00 1.00 C ATOM 1733 O ALA A 116 20.824 7.355 7.443 1.00 1.00 O ATOM 1734 CB ALA A 116 20.613 7.006 4.002 1.00 1.00 C ATOM 0 H ALA A 116 22.348 8.532 4.834 1.00 1.00 H new ATOM 0 HA ALA A 116 19.442 8.544 4.955 1.00 1.00 H new ATOM 0 HB1 ALA A 116 19.795 6.287 3.959 1.00 1.00 H new ATOM 0 HB2 ALA A 116 20.670 7.549 3.058 1.00 1.00 H new ATOM 0 HB3 ALA A 116 21.551 6.479 4.174 1.00 1.00 H new ATOM 1740 N GLN A 117 18.831 6.779 6.542 1.00 1.00 N ATOM 1741 CA GLN A 117 18.159 6.276 7.740 1.00 1.00 C ATOM 1742 C GLN A 117 18.199 4.741 7.827 1.00 1.00 C ATOM 1743 O GLN A 117 18.627 4.052 6.900 1.00 1.00 O ATOM 1744 CB GLN A 117 16.708 6.806 7.743 1.00 1.00 C ATOM 1745 CG GLN A 117 16.604 8.341 7.716 1.00 1.00 C ATOM 1746 CD GLN A 117 15.201 8.815 7.347 1.00 1.00 C ATOM 1747 OE1 GLN A 117 14.353 9.078 8.190 1.00 1.00 O ATOM 1748 NE2 GLN A 117 14.895 8.907 6.067 1.00 1.00 N ATOM 0 H GLN A 117 18.267 6.655 5.701 1.00 1.00 H new ATOM 0 HA GLN A 117 18.686 6.637 8.623 1.00 1.00 H new ATOM 0 HB2 GLN A 117 16.182 6.401 6.879 1.00 1.00 H new ATOM 0 HB3 GLN A 117 16.197 6.433 8.631 1.00 1.00 H new ATOM 0 HG2 GLN A 117 16.875 8.740 8.694 1.00 1.00 H new ATOM 0 HG3 GLN A 117 17.321 8.740 6.999 1.00 1.00 H new ATOM 0 HE21 GLN A 117 15.596 8.690 5.358 1.00 1.00 H new ATOM 0 HE22 GLN A 117 13.958 9.195 5.786 1.00 1.00 H new ATOM 1757 N ARG A 118 17.689 4.201 8.939 1.00 1.00 N ATOM 1758 CA ARG A 118 17.642 2.768 9.267 1.00 1.00 C ATOM 1759 C ARG A 118 16.244 2.381 9.770 1.00 1.00 C ATOM 1760 O ARG A 118 15.591 3.144 10.480 1.00 1.00 O ATOM 1761 CB ARG A 118 18.746 2.457 10.303 1.00 1.00 C ATOM 1762 CG ARG A 118 19.766 1.381 9.867 1.00 1.00 C ATOM 1763 CD ARG A 118 19.423 -0.103 10.108 1.00 1.00 C ATOM 1764 NE ARG A 118 18.733 -0.319 11.396 1.00 1.00 N ATOM 1765 CZ ARG A 118 19.201 -0.192 12.625 1.00 1.00 C ATOM 1766 NH1 ARG A 118 20.465 -0.048 12.891 1.00 1.00 N ATOM 1767 NH2 ARG A 118 18.362 -0.202 13.622 1.00 1.00 N1+ ATOM 0 H ARG A 118 17.277 4.778 9.672 1.00 1.00 H new ATOM 0 HA ARG A 118 17.831 2.169 8.376 1.00 1.00 H new ATOM 0 HB2 ARG A 118 19.285 3.378 10.525 1.00 1.00 H new ATOM 0 HB3 ARG A 118 18.273 2.133 11.230 1.00 1.00 H new ATOM 0 HG2 ARG A 118 19.947 1.510 8.800 1.00 1.00 H new ATOM 0 HG3 ARG A 118 20.706 1.590 10.377 1.00 1.00 H new ATOM 0 HD2 ARG A 118 18.792 -0.464 9.296 1.00 1.00 H new ATOM 0 HD3 ARG A 118 20.339 -0.693 10.086 1.00 1.00 H new ATOM 0 HE ARG A 118 17.757 -0.607 11.327 1.00 1.00 H new ATOM 0 HH11 ARG A 118 21.147 -0.029 12.133 1.00 1.00 H new ATOM 0 HH12 ARG A 118 20.775 0.046 13.858 1.00 1.00 H new ATOM 0 HH21 ARG A 118 17.363 -0.307 13.447 1.00 1.00 H new ATOM 0 HH22 ARG A 118 18.705 -0.105 14.578 1.00 1.00 H new ATOM 1781 N VAL A 119 15.803 1.191 9.372 1.00 1.00 N ATOM 1782 CA VAL A 119 14.548 0.542 9.822 1.00 1.00 C ATOM 1783 C VAL A 119 14.918 -0.370 11.018 1.00 1.00 C ATOM 1784 O VAL A 119 15.965 -0.161 11.631 1.00 1.00 O ATOM 1785 CB VAL A 119 13.830 -0.067 8.579 1.00 1.00 C ATOM 1786 CG1 VAL A 119 12.397 -0.533 8.834 1.00 1.00 C ATOM 1787 CG2 VAL A 119 13.656 0.987 7.469 1.00 1.00 C ATOM 0 H VAL A 119 16.320 0.621 8.703 1.00 1.00 H new ATOM 0 HA VAL A 119 13.783 1.206 10.224 1.00 1.00 H new ATOM 0 HB VAL A 119 14.473 -0.906 8.314 1.00 1.00 H new ATOM 0 HG11 VAL A 119 11.978 -0.942 7.914 1.00 1.00 H new ATOM 0 HG12 VAL A 119 12.397 -1.302 9.606 1.00 1.00 H new ATOM 0 HG13 VAL A 119 11.793 0.312 9.164 1.00 1.00 H new ATOM 0 HG21 VAL A 119 13.153 0.535 6.614 1.00 1.00 H new ATOM 0 HG22 VAL A 119 13.058 1.817 7.846 1.00 1.00 H new ATOM 0 HG23 VAL A 119 14.634 1.356 7.161 1.00 1.00 H new ATOM 1797 N GLY A 120 14.105 -1.355 11.410 1.00 1.00 N ATOM 1798 CA GLY A 120 14.431 -2.290 12.516 1.00 1.00 C ATOM 1799 C GLY A 120 15.836 -2.931 12.424 1.00 1.00 C ATOM 1800 O GLY A 120 16.379 -3.096 11.330 1.00 1.00 O ATOM 0 H GLY A 120 13.200 -1.535 10.976 1.00 1.00 H new ATOM 0 HA2 GLY A 120 14.351 -1.755 13.462 1.00 1.00 H new ATOM 0 HA3 GLY A 120 13.684 -3.084 12.535 1.00 1.00 H new ATOM 1804 N GLU A 121 16.450 -3.245 13.573 1.00 1.00 N ATOM 1805 CA GLU A 121 17.835 -3.716 13.685 1.00 1.00 C ATOM 1806 C GLU A 121 18.062 -5.046 12.959 1.00 1.00 C ATOM 1807 O GLU A 121 17.173 -5.892 12.844 1.00 1.00 O ATOM 1808 CB GLU A 121 18.292 -3.764 15.152 1.00 1.00 C ATOM 1809 CG GLU A 121 17.657 -4.898 15.970 1.00 1.00 C ATOM 1810 CD GLU A 121 18.055 -4.790 17.455 1.00 1.00 C ATOM 1811 OE1 GLU A 121 19.122 -5.323 17.847 1.00 1.00 O1- ATOM 1812 OE2 GLU A 121 17.302 -4.173 18.247 1.00 1.00 O ATOM 0 H GLU A 121 15.982 -3.176 14.476 1.00 1.00 H new ATOM 0 HA GLU A 121 18.464 -2.986 13.175 1.00 1.00 H new ATOM 0 HB2 GLU A 121 19.376 -3.873 15.180 1.00 1.00 H new ATOM 0 HB3 GLU A 121 18.055 -2.812 15.626 1.00 1.00 H new ATOM 0 HG2 GLU A 121 16.572 -4.857 15.876 1.00 1.00 H new ATOM 0 HG3 GLU A 121 17.975 -5.862 15.573 1.00 1.00 H new ATOM 1819 N MET A 122 19.287 -5.226 12.471 1.00 1.00 N ATOM 1820 CA MET A 122 19.642 -6.299 11.566 1.00 1.00 C ATOM 1821 C MET A 122 19.651 -7.681 12.222 1.00 1.00 C ATOM 1822 O MET A 122 19.868 -7.843 13.426 1.00 1.00 O ATOM 1823 CB MET A 122 20.960 -6.002 10.840 1.00 1.00 C ATOM 1824 CG MET A 122 22.192 -5.971 11.718 1.00 1.00 C ATOM 1825 SD MET A 122 22.516 -4.438 12.630 1.00 1.00 S ATOM 1826 CE MET A 122 22.905 -3.302 11.265 1.00 1.00 C ATOM 0 H MET A 122 20.070 -4.615 12.702 1.00 1.00 H new ATOM 0 HA MET A 122 18.847 -6.339 10.822 1.00 1.00 H new ATOM 0 HB2 MET A 122 21.106 -6.754 10.065 1.00 1.00 H new ATOM 0 HB3 MET A 122 20.869 -5.039 10.337 1.00 1.00 H new ATOM 0 HG2 MET A 122 22.114 -6.784 12.440 1.00 1.00 H new ATOM 0 HG3 MET A 122 23.059 -6.182 11.092 1.00 1.00 H new ATOM 0 HE1 MET A 122 23.380 -2.405 11.662 1.00 1.00 H new ATOM 0 HE2 MET A 122 23.583 -3.792 10.566 1.00 1.00 H new ATOM 0 HE3 MET A 122 21.986 -3.027 10.747 1.00 1.00 H new ATOM 1836 N LEU A 123 19.495 -8.689 11.374 1.00 1.00 N ATOM 1837 CA LEU A 123 19.672 -10.091 11.719 1.00 1.00 C ATOM 1838 C LEU A 123 21.128 -10.484 11.543 1.00 1.00 C ATOM 1839 O LEU A 123 21.759 -10.072 10.578 1.00 1.00 O ATOM 1840 CB LEU A 123 18.785 -10.935 10.825 1.00 1.00 C ATOM 1841 CG LEU A 123 18.506 -12.374 11.260 1.00 1.00 C ATOM 1842 CD1 LEU A 123 19.665 -13.301 11.480 1.00 1.00 C ATOM 1843 CD2 LEU A 123 17.720 -12.504 12.567 1.00 1.00 C ATOM 0 H LEU A 123 19.234 -8.548 10.398 1.00 1.00 H new ATOM 0 HA LEU A 123 19.394 -10.255 12.760 1.00 1.00 H new ATOM 0 HB2 LEU A 123 17.828 -10.424 10.722 1.00 1.00 H new ATOM 0 HB3 LEU A 123 19.238 -10.965 9.834 1.00 1.00 H new ATOM 0 HG LEU A 123 17.956 -12.671 10.367 1.00 1.00 H new ATOM 0 HD11 LEU A 123 19.295 -14.280 11.784 1.00 1.00 H new ATOM 0 HD12 LEU A 123 20.233 -13.399 10.555 1.00 1.00 H new ATOM 0 HD13 LEU A 123 20.310 -12.898 12.261 1.00 1.00 H new ATOM 0 HD21 LEU A 123 17.569 -13.559 12.797 1.00 1.00 H new ATOM 0 HD22 LEU A 123 18.278 -12.033 13.376 1.00 1.00 H new ATOM 0 HD23 LEU A 123 16.752 -12.014 12.460 1.00 1.00 H new ATOM 1855 N LEU A 124 21.628 -11.310 12.449 1.00 1.00 N ATOM 1856 CA LEU A 124 22.966 -11.881 12.425 1.00 1.00 C ATOM 1857 C LEU A 124 22.909 -13.434 12.487 1.00 1.00 C ATOM 1858 O LEU A 124 22.651 -14.006 13.549 1.00 1.00 O ATOM 1859 CB LEU A 124 23.736 -11.279 13.612 1.00 1.00 C ATOM 1860 CG LEU A 124 23.443 -9.799 14.011 1.00 1.00 C ATOM 1861 CD1 LEU A 124 24.175 -9.453 15.304 1.00 1.00 C ATOM 1862 CD2 LEU A 124 23.824 -8.792 12.933 1.00 1.00 C ATOM 0 H LEU A 124 21.087 -11.615 13.258 1.00 1.00 H new ATOM 0 HA LEU A 124 23.478 -11.640 11.494 1.00 1.00 H new ATOM 0 HB2 LEU A 124 23.542 -11.903 14.485 1.00 1.00 H new ATOM 0 HB3 LEU A 124 24.801 -11.359 13.393 1.00 1.00 H new ATOM 0 HG LEU A 124 22.364 -9.728 14.147 1.00 1.00 H new ATOM 0 HD11 LEU A 124 23.965 -8.418 15.575 1.00 1.00 H new ATOM 0 HD12 LEU A 124 23.836 -10.113 16.102 1.00 1.00 H new ATOM 0 HD13 LEU A 124 25.248 -9.580 15.160 1.00 1.00 H new ATOM 0 HD21 LEU A 124 23.593 -7.784 13.278 1.00 1.00 H new ATOM 0 HD22 LEU A 124 24.891 -8.868 12.725 1.00 1.00 H new ATOM 0 HD23 LEU A 124 23.261 -9.002 12.024 1.00 1.00 H new ATOM 1874 N ILE A 125 23.121 -14.125 11.359 1.00 1.00 N ATOM 1875 CA ILE A 125 23.105 -15.590 11.242 1.00 1.00 C ATOM 1876 C ILE A 125 24.473 -16.204 11.487 1.00 1.00 C ATOM 1877 O ILE A 125 25.433 -15.837 10.810 1.00 1.00 O ATOM 1878 CB ILE A 125 22.514 -16.037 9.893 1.00 1.00 C ATOM 1879 CG1 ILE A 125 21.002 -15.939 9.938 1.00 1.00 C ATOM 1880 CG2 ILE A 125 22.860 -17.487 9.537 1.00 1.00 C ATOM 1881 CD1 ILE A 125 20.326 -15.283 8.734 1.00 1.00 C ATOM 0 H ILE A 125 23.315 -13.663 10.471 1.00 1.00 H new ATOM 0 HA ILE A 125 22.451 -15.965 12.030 1.00 1.00 H new ATOM 0 HB ILE A 125 22.947 -15.377 9.141 1.00 1.00 H new ATOM 0 HG12 ILE A 125 20.598 -16.945 10.050 1.00 1.00 H new ATOM 0 HG13 ILE A 125 20.722 -15.382 10.832 1.00 1.00 H new ATOM 0 HG21 ILE A 125 22.415 -17.742 8.575 1.00 1.00 H new ATOM 0 HG22 ILE A 125 23.943 -17.598 9.476 1.00 1.00 H new ATOM 0 HG23 ILE A 125 22.469 -18.154 10.306 1.00 1.00 H new ATOM 0 HD11 ILE A 125 19.246 -15.272 8.884 1.00 1.00 H new ATOM 0 HD12 ILE A 125 20.688 -14.260 8.626 1.00 1.00 H new ATOM 0 HD13 ILE A 125 20.561 -15.848 7.832 1.00 1.00 H new ATOM 1893 N ASP A 126 24.526 -17.186 12.388 1.00 1.00 N ATOM 1894 CA ASP A 126 25.734 -17.971 12.673 1.00 1.00 C ATOM 1895 C ASP A 126 25.650 -19.383 12.102 1.00 1.00 C ATOM 1896 O ASP A 126 24.966 -20.260 12.627 1.00 1.00 O ATOM 1897 CB ASP A 126 26.055 -18.024 14.167 1.00 1.00 C ATOM 1898 CG ASP A 126 27.340 -18.826 14.444 1.00 1.00 C ATOM 1899 OD1 ASP A 126 28.161 -19.022 13.512 1.00 1.00 O ATOM 1900 OD2 ASP A 126 27.523 -19.240 15.611 1.00 1.00 O1- ATOM 0 H ASP A 126 23.721 -17.464 12.950 1.00 1.00 H new ATOM 0 HA ASP A 126 26.551 -17.450 12.173 1.00 1.00 H new ATOM 0 HB2 ASP A 126 26.168 -17.010 14.551 1.00 1.00 H new ATOM 0 HB3 ASP A 126 25.221 -18.477 14.703 1.00 1.00 H new ATOM 1905 N ALA A 127 26.428 -19.624 11.056 1.00 1.00 N ATOM 1906 CA ALA A 127 26.473 -20.893 10.353 1.00 1.00 C ATOM 1907 C ALA A 127 27.079 -22.030 11.190 1.00 1.00 C ATOM 1908 O ALA A 127 26.785 -23.202 10.951 1.00 1.00 O ATOM 1909 CB ALA A 127 27.278 -20.664 9.078 1.00 1.00 C ATOM 0 H ALA A 127 27.059 -18.924 10.666 1.00 1.00 H new ATOM 0 HA ALA A 127 25.456 -21.218 10.133 1.00 1.00 H new ATOM 0 HB1 ALA A 127 27.339 -21.595 8.514 1.00 1.00 H new ATOM 0 HB2 ALA A 127 26.788 -19.903 8.470 1.00 1.00 H new ATOM 0 HB3 ALA A 127 28.283 -20.330 9.337 1.00 1.00 H new ATOM 1915 N SER A 128 27.884 -21.680 12.199 1.00 1.00 N ATOM 1916 CA SER A 128 28.446 -22.618 13.171 1.00 1.00 C ATOM 1917 C SER A 128 27.373 -23.281 14.055 1.00 1.00 C ATOM 1918 O SER A 128 27.594 -24.361 14.604 1.00 1.00 O ATOM 1919 CB SER A 128 29.428 -21.867 14.075 1.00 1.00 C ATOM 1920 OG SER A 128 30.325 -22.767 14.712 1.00 1.00 O ATOM 0 H SER A 128 28.168 -20.714 12.364 1.00 1.00 H new ATOM 0 HA SER A 128 28.942 -23.408 12.607 1.00 1.00 H new ATOM 0 HB2 SER A 128 29.991 -21.144 13.485 1.00 1.00 H new ATOM 0 HB3 SER A 128 28.877 -21.304 14.828 1.00 1.00 H new ATOM 0 HG SER A 128 30.943 -22.264 15.282 1.00 1.00 H new ATOM 1926 N GLU A 129 26.196 -22.653 14.175 1.00 1.00 N ATOM 1927 CA GLU A 129 25.084 -23.067 15.025 1.00 1.00 C ATOM 1928 C GLU A 129 23.817 -23.362 14.214 1.00 1.00 C ATOM 1929 O GLU A 129 23.006 -24.204 14.601 1.00 1.00 O ATOM 1930 CB GLU A 129 24.793 -21.972 16.071 1.00 1.00 C ATOM 1931 CG GLU A 129 25.832 -21.896 17.201 1.00 1.00 C ATOM 1932 CD GLU A 129 25.660 -23.056 18.204 1.00 1.00 C ATOM 1933 OE1 GLU A 129 24.817 -22.946 19.129 1.00 1.00 O ATOM 1934 OE2 GLU A 129 26.368 -24.086 18.088 1.00 1.00 O1- ATOM 0 H GLU A 129 25.988 -21.801 13.654 1.00 1.00 H new ATOM 0 HA GLU A 129 25.376 -23.991 15.524 1.00 1.00 H new ATOM 0 HB2 GLU A 129 24.747 -21.006 15.568 1.00 1.00 H new ATOM 0 HB3 GLU A 129 23.810 -22.152 16.506 1.00 1.00 H new ATOM 0 HG2 GLU A 129 26.836 -21.926 16.777 1.00 1.00 H new ATOM 0 HG3 GLU A 129 25.735 -20.944 17.723 1.00 1.00 H new ATOM 1941 N ASN A 130 23.662 -22.674 13.079 1.00 1.00 N ATOM 1942 CA ASN A 130 22.497 -22.726 12.216 1.00 1.00 C ATOM 1943 C ASN A 130 22.879 -22.635 10.717 1.00 1.00 C ATOM 1944 O ASN A 130 22.803 -21.550 10.132 1.00 1.00 O ATOM 1945 CB ASN A 130 21.524 -21.615 12.649 1.00 1.00 C ATOM 1946 CG ASN A 130 20.132 -21.887 12.115 1.00 1.00 C ATOM 1947 OD1 ASN A 130 19.260 -22.369 12.819 1.00 1.00 O ATOM 1948 ND2 ASN A 130 19.919 -21.651 10.843 1.00 1.00 N ATOM 0 H ASN A 130 24.381 -22.041 12.729 1.00 1.00 H new ATOM 0 HA ASN A 130 22.003 -23.692 12.324 1.00 1.00 H new ATOM 0 HB2 ASN A 130 21.496 -21.552 13.737 1.00 1.00 H new ATOM 0 HB3 ASN A 130 21.878 -20.651 12.283 1.00 1.00 H new ATOM 0 HD21 ASN A 130 19.013 -21.871 10.428 1.00 1.00 H new ATOM 0 HD22 ASN A 130 20.659 -21.248 10.268 1.00 1.00 H new ATOM 1955 N PRO A 131 23.232 -23.753 10.050 1.00 1.00 N ATOM 1956 CA PRO A 131 23.564 -23.779 8.620 1.00 1.00 C ATOM 1957 C PRO A 131 22.344 -23.627 7.675 1.00 1.00 C ATOM 1958 O PRO A 131 22.480 -23.758 6.459 1.00 1.00 O ATOM 1959 CB PRO A 131 24.323 -25.097 8.422 1.00 1.00 C ATOM 1960 CG PRO A 131 23.667 -26.018 9.444 1.00 1.00 C ATOM 1961 CD PRO A 131 23.394 -25.083 10.624 1.00 1.00 C ATOM 0 HA PRO A 131 24.167 -22.913 8.346 1.00 1.00 H new ATOM 0 HB2 PRO A 131 24.216 -25.478 7.406 1.00 1.00 H new ATOM 0 HB3 PRO A 131 25.391 -24.981 8.608 1.00 1.00 H new ATOM 0 HG2 PRO A 131 22.748 -26.460 9.058 1.00 1.00 H new ATOM 0 HG3 PRO A 131 24.323 -26.842 9.725 1.00 1.00 H new ATOM 0 HD2 PRO A 131 22.497 -25.387 11.164 1.00 1.00 H new ATOM 0 HD3 PRO A 131 24.218 -25.103 11.337 1.00 1.00 H new ATOM 1969 N GLU A 132 21.154 -23.341 8.221 1.00 1.00 N ATOM 1970 CA GLU A 132 19.877 -23.143 7.529 1.00 1.00 C ATOM 1971 C GLU A 132 19.443 -21.673 7.639 1.00 1.00 C ATOM 1972 O GLU A 132 18.519 -21.352 8.378 1.00 1.00 O ATOM 1973 CB GLU A 132 18.819 -24.120 8.090 1.00 1.00 C ATOM 1974 CG GLU A 132 19.351 -25.533 8.349 1.00 1.00 C ATOM 1975 CD GLU A 132 18.204 -26.523 8.630 1.00 1.00 C ATOM 1976 OE1 GLU A 132 17.648 -27.105 7.665 1.00 1.00 O ATOM 1977 OE2 GLU A 132 17.865 -26.749 9.818 1.00 1.00 O1- ATOM 0 H GLU A 132 21.054 -23.235 9.230 1.00 1.00 H new ATOM 0 HA GLU A 132 19.989 -23.365 6.468 1.00 1.00 H new ATOM 0 HB2 GLU A 132 18.424 -23.715 9.022 1.00 1.00 H new ATOM 0 HB3 GLU A 132 17.986 -24.179 7.389 1.00 1.00 H new ATOM 0 HG2 GLU A 132 19.923 -25.872 7.485 1.00 1.00 H new ATOM 0 HG3 GLU A 132 20.035 -25.516 9.197 1.00 1.00 H new ATOM 1984 N PRO A 133 20.098 -20.722 6.954 1.00 1.00 N ATOM 1985 CA PRO A 133 19.893 -19.292 7.186 1.00 1.00 C ATOM 1986 C PRO A 133 18.473 -18.762 6.999 1.00 1.00 C ATOM 1987 O PRO A 133 18.148 -17.720 7.566 1.00 1.00 O ATOM 1988 CB PRO A 133 20.871 -18.613 6.215 1.00 1.00 C ATOM 1989 CG PRO A 133 21.074 -19.639 5.104 1.00 1.00 C ATOM 1990 CD PRO A 133 21.114 -20.915 5.932 1.00 1.00 C ATOM 0 HA PRO A 133 20.070 -19.075 8.239 1.00 1.00 H new ATOM 0 HB2 PRO A 133 20.462 -17.681 5.825 1.00 1.00 H new ATOM 0 HB3 PRO A 133 21.813 -18.367 6.706 1.00 1.00 H new ATOM 0 HG2 PRO A 133 20.259 -19.637 4.380 1.00 1.00 H new ATOM 0 HG3 PRO A 133 21.996 -19.474 4.547 1.00 1.00 H new ATOM 0 HD2 PRO A 133 20.899 -21.791 5.320 1.00 1.00 H new ATOM 0 HD3 PRO A 133 22.098 -21.069 6.375 1.00 1.00 H new ATOM 1998 N GLU A 134 17.598 -19.462 6.272 1.00 1.00 N ATOM 1999 CA GLU A 134 16.185 -19.073 6.190 1.00 1.00 C ATOM 2000 C GLU A 134 15.482 -19.220 7.536 1.00 1.00 C ATOM 2001 O GLU A 134 14.548 -18.484 7.806 1.00 1.00 O ATOM 2002 CB GLU A 134 15.446 -19.859 5.088 1.00 1.00 C ATOM 2003 CG GLU A 134 15.234 -21.342 5.441 1.00 1.00 C ATOM 2004 CD GLU A 134 14.552 -22.173 4.335 1.00 1.00 C ATOM 2005 OE1 GLU A 134 13.494 -21.760 3.802 1.00 1.00 O ATOM 2006 OE2 GLU A 134 15.048 -23.282 4.020 1.00 1.00 O1- ATOM 0 H GLU A 134 17.839 -20.295 5.735 1.00 1.00 H new ATOM 0 HA GLU A 134 16.158 -18.018 5.919 1.00 1.00 H new ATOM 0 HB2 GLU A 134 14.477 -19.393 4.906 1.00 1.00 H new ATOM 0 HB3 GLU A 134 16.013 -19.790 4.159 1.00 1.00 H new ATOM 0 HG2 GLU A 134 16.201 -21.790 5.670 1.00 1.00 H new ATOM 0 HG3 GLU A 134 14.632 -21.404 6.348 1.00 1.00 H new ATOM 2013 N THR A 135 15.931 -20.113 8.418 1.00 1.00 N ATOM 2014 CA THR A 135 15.216 -20.416 9.659 1.00 1.00 C ATOM 2015 C THR A 135 15.367 -19.299 10.693 1.00 1.00 C ATOM 2016 O THR A 135 14.523 -19.129 11.573 1.00 1.00 O ATOM 2017 CB THR A 135 15.649 -21.765 10.243 1.00 1.00 C ATOM 2018 OG1 THR A 135 16.941 -21.691 10.796 1.00 1.00 O ATOM 2019 CG2 THR A 135 15.657 -22.869 9.191 1.00 1.00 C ATOM 0 H THR A 135 16.794 -20.643 8.295 1.00 1.00 H new ATOM 0 HA THR A 135 14.158 -20.485 9.404 1.00 1.00 H new ATOM 0 HB THR A 135 14.918 -22.003 11.016 1.00 1.00 H new ATOM 0 HG1 THR A 135 17.191 -22.565 11.162 1.00 1.00 H new ATOM 0 HG21 THR A 135 15.970 -23.807 9.650 1.00 1.00 H new ATOM 0 HG22 THR A 135 14.655 -22.984 8.777 1.00 1.00 H new ATOM 0 HG23 THR A 135 16.351 -22.606 8.393 1.00 1.00 H new ATOM 2027 N GLU A 136 16.420 -18.494 10.531 1.00 1.00 N ATOM 2028 CA GLU A 136 16.690 -17.282 11.313 1.00 1.00 C ATOM 2029 C GLU A 136 16.130 -16.029 10.639 1.00 1.00 C ATOM 2030 O GLU A 136 15.418 -15.231 11.246 1.00 1.00 O ATOM 2031 CB GLU A 136 18.199 -17.098 11.509 1.00 1.00 C ATOM 2032 CG GLU A 136 19.006 -18.342 11.889 1.00 1.00 C ATOM 2033 CD GLU A 136 19.949 -18.073 13.080 1.00 1.00 C ATOM 2034 OE1 GLU A 136 19.448 -17.925 14.222 1.00 1.00 O ATOM 2035 OE2 GLU A 136 21.189 -18.020 12.887 1.00 1.00 O1- ATOM 0 H GLU A 136 17.135 -18.674 9.826 1.00 1.00 H new ATOM 0 HA GLU A 136 16.196 -17.411 12.276 1.00 1.00 H new ATOM 0 HB2 GLU A 136 18.614 -16.694 10.586 1.00 1.00 H new ATOM 0 HB3 GLU A 136 18.351 -16.346 12.283 1.00 1.00 H new ATOM 0 HG2 GLU A 136 18.324 -19.154 12.142 1.00 1.00 H new ATOM 0 HG3 GLU A 136 19.590 -18.672 11.030 1.00 1.00 H new ATOM 2042 N SER A 137 16.459 -15.847 9.361 1.00 1.00 N ATOM 2043 CA SER A 137 16.033 -14.663 8.608 1.00 1.00 C ATOM 2044 C SER A 137 14.557 -14.622 8.217 1.00 1.00 C ATOM 2045 O SER A 137 13.995 -13.533 8.204 1.00 1.00 O ATOM 2046 CB SER A 137 16.844 -14.526 7.341 1.00 1.00 C ATOM 2047 OG SER A 137 16.661 -15.700 6.586 1.00 1.00 O ATOM 0 H SER A 137 17.021 -16.506 8.822 1.00 1.00 H new ATOM 0 HA SER A 137 16.199 -13.839 9.302 1.00 1.00 H new ATOM 0 HB2 SER A 137 16.522 -13.653 6.774 1.00 1.00 H new ATOM 0 HB3 SER A 137 17.899 -14.383 7.576 1.00 1.00 H new ATOM 0 HG SER A 137 17.354 -16.352 6.822 1.00 1.00 H new ATOM 2053 N ASN A 138 13.892 -15.742 7.923 1.00 1.00 N ATOM 2054 CA ASN A 138 12.464 -15.729 7.570 1.00 1.00 C ATOM 2055 C ASN A 138 11.609 -15.066 8.666 1.00 1.00 C ATOM 2056 O ASN A 138 11.019 -14.024 8.371 1.00 1.00 O ATOM 2057 CB ASN A 138 12.000 -17.135 7.148 1.00 1.00 C ATOM 2058 CG ASN A 138 10.521 -17.306 6.851 1.00 1.00 C ATOM 2059 OD1 ASN A 138 9.639 -16.845 7.560 1.00 1.00 O ATOM 2060 ND2 ASN A 138 10.213 -18.040 5.810 1.00 1.00 N ATOM 0 H ASN A 138 14.316 -16.670 7.921 1.00 1.00 H new ATOM 0 HA ASN A 138 12.317 -15.095 6.696 1.00 1.00 H new ATOM 0 HB2 ASN A 138 12.561 -17.426 6.260 1.00 1.00 H new ATOM 0 HB3 ASN A 138 12.271 -17.834 7.939 1.00 1.00 H new ATOM 0 HD21 ASN A 138 9.235 -18.228 5.590 1.00 1.00 H new ATOM 0 HD22 ASN A 138 10.951 -18.423 5.220 1.00 1.00 H new ATOM 2067 N PRO A 139 11.603 -15.531 9.936 1.00 1.00 N ATOM 2068 CA PRO A 139 10.867 -14.837 10.995 1.00 1.00 C ATOM 2069 C PRO A 139 11.380 -13.411 11.253 1.00 1.00 C ATOM 2070 O PRO A 139 10.609 -12.563 11.695 1.00 1.00 O ATOM 2071 CB PRO A 139 11.023 -15.711 12.242 1.00 1.00 C ATOM 2072 CG PRO A 139 12.359 -16.403 12.006 1.00 1.00 C ATOM 2073 CD PRO A 139 12.335 -16.661 10.503 1.00 1.00 C ATOM 0 HA PRO A 139 9.824 -14.707 10.707 1.00 1.00 H new ATOM 0 HB2 PRO A 139 11.032 -15.115 13.155 1.00 1.00 H new ATOM 0 HB3 PRO A 139 10.208 -16.428 12.338 1.00 1.00 H new ATOM 0 HG2 PRO A 139 13.200 -15.773 12.296 1.00 1.00 H new ATOM 0 HG3 PRO A 139 12.443 -17.329 12.576 1.00 1.00 H new ATOM 0 HD2 PRO A 139 13.345 -16.721 10.097 1.00 1.00 H new ATOM 0 HD3 PRO A 139 11.842 -17.606 10.273 1.00 1.00 H new ATOM 2081 N TRP A 140 12.643 -13.107 10.927 1.00 1.00 N ATOM 2082 CA TRP A 140 13.175 -11.755 11.034 1.00 1.00 C ATOM 2083 C TRP A 140 12.529 -10.836 10.018 1.00 1.00 C ATOM 2084 O TRP A 140 12.057 -9.770 10.383 1.00 1.00 O ATOM 2085 CB TRP A 140 14.689 -11.699 10.870 1.00 1.00 C ATOM 2086 CG TRP A 140 15.239 -10.303 11.000 1.00 1.00 C ATOM 2087 CD1 TRP A 140 15.621 -9.711 12.151 1.00 1.00 C ATOM 2088 CD2 TRP A 140 15.387 -9.269 9.971 1.00 1.00 C ATOM 2089 NE1 TRP A 140 16.143 -8.462 11.880 1.00 1.00 N ATOM 2090 CE2 TRP A 140 15.933 -8.098 10.571 1.00 1.00 C ATOM 2091 CE3 TRP A 140 15.066 -9.182 8.601 1.00 1.00 C ATOM 2092 CZ2 TRP A 140 16.144 -6.911 9.856 1.00 1.00 C ATOM 2093 CZ3 TRP A 140 15.227 -7.984 7.880 1.00 1.00 C ATOM 2094 CH2 TRP A 140 15.776 -6.853 8.502 1.00 1.00 C ATOM 0 H TRP A 140 13.316 -13.792 10.584 1.00 1.00 H new ATOM 0 HA TRP A 140 12.936 -11.418 12.043 1.00 1.00 H new ATOM 0 HB2 TRP A 140 15.155 -12.339 11.619 1.00 1.00 H new ATOM 0 HB3 TRP A 140 14.959 -12.102 9.894 1.00 1.00 H new ATOM 0 HD1 TRP A 140 15.532 -10.148 13.135 1.00 1.00 H new ATOM 0 HE1 TRP A 140 16.625 -7.881 12.566 1.00 1.00 H new ATOM 0 HE3 TRP A 140 14.687 -10.056 8.092 1.00 1.00 H new ATOM 0 HZ2 TRP A 140 16.584 -6.052 10.340 1.00 1.00 H new ATOM 0 HZ3 TRP A 140 14.927 -7.935 6.844 1.00 1.00 H new ATOM 0 HH2 TRP A 140 15.915 -5.940 7.941 1.00 1.00 H new ATOM 2105 N VAL A 141 12.449 -11.264 8.761 1.00 1.00 N ATOM 2106 CA VAL A 141 11.781 -10.497 7.707 1.00 1.00 C ATOM 2107 C VAL A 141 10.282 -10.390 8.031 1.00 1.00 C ATOM 2108 O VAL A 141 9.653 -9.376 7.765 1.00 1.00 O ATOM 2109 CB VAL A 141 12.010 -11.104 6.314 1.00 1.00 C ATOM 2110 CG1 VAL A 141 11.213 -10.267 5.281 1.00 1.00 C ATOM 2111 CG2 VAL A 141 13.490 -11.224 5.842 1.00 1.00 C ATOM 0 H VAL A 141 12.843 -12.149 8.442 1.00 1.00 H new ATOM 0 HA VAL A 141 12.216 -9.498 7.679 1.00 1.00 H new ATOM 0 HB VAL A 141 11.665 -12.135 6.390 1.00 1.00 H new ATOM 0 HG11 VAL A 141 11.362 -10.682 4.284 1.00 1.00 H new ATOM 0 HG12 VAL A 141 10.152 -10.295 5.531 1.00 1.00 H new ATOM 0 HG13 VAL A 141 11.563 -9.235 5.301 1.00 1.00 H new ATOM 0 HG21 VAL A 141 13.520 -11.666 4.846 1.00 1.00 H new ATOM 0 HG22 VAL A 141 13.944 -10.234 5.813 1.00 1.00 H new ATOM 0 HG23 VAL A 141 14.043 -11.856 6.536 1.00 1.00 H new ATOM 2121 N GLU A 142 9.697 -11.409 8.650 1.00 1.00 N ATOM 2122 CA GLU A 142 8.292 -11.442 9.058 1.00 1.00 C ATOM 2123 C GLU A 142 8.000 -10.461 10.217 1.00 1.00 C ATOM 2124 O GLU A 142 6.915 -9.899 10.328 1.00 1.00 O ATOM 2125 CB GLU A 142 7.969 -12.900 9.433 1.00 1.00 C ATOM 2126 CG GLU A 142 6.760 -13.505 8.740 1.00 1.00 C ATOM 2127 CD GLU A 142 5.420 -12.860 9.124 1.00 1.00 C ATOM 2128 OE1 GLU A 142 5.066 -12.846 10.326 1.00 1.00 O1- ATOM 2129 OE2 GLU A 142 4.700 -12.389 8.211 1.00 1.00 O ATOM 0 H GLU A 142 10.201 -12.263 8.891 1.00 1.00 H new ATOM 0 HA GLU A 142 7.650 -11.111 8.242 1.00 1.00 H new ATOM 0 HB2 GLU A 142 8.840 -13.515 9.208 1.00 1.00 H new ATOM 0 HB3 GLU A 142 7.812 -12.953 10.510 1.00 1.00 H new ATOM 0 HG2 GLU A 142 6.894 -13.420 7.662 1.00 1.00 H new ATOM 0 HG3 GLU A 142 6.717 -14.569 8.973 1.00 1.00 H new ATOM 2136 N HIS A 143 8.995 -10.193 11.058 1.00 1.00 N ATOM 2137 CA HIS A 143 8.995 -9.161 12.091 1.00 1.00 C ATOM 2138 C HIS A 143 9.331 -7.774 11.520 1.00 1.00 C ATOM 2139 O HIS A 143 8.509 -6.862 11.568 1.00 1.00 O ATOM 2140 CB HIS A 143 9.925 -9.554 13.252 1.00 1.00 C ATOM 2141 CG HIS A 143 9.331 -10.549 14.225 1.00 1.00 C ATOM 2142 ND1 HIS A 143 9.381 -10.461 15.601 1.00 1.00 N ATOM 2143 CD2 HIS A 143 8.630 -11.691 13.928 1.00 1.00 C ATOM 2144 CE1 HIS A 143 8.728 -11.518 16.117 1.00 1.00 C ATOM 2145 NE2 HIS A 143 8.249 -12.300 15.132 1.00 1.00 N ATOM 0 H HIS A 143 9.869 -10.718 11.036 1.00 1.00 H new ATOM 0 HA HIS A 143 7.983 -9.087 12.490 1.00 1.00 H new ATOM 0 HB2 HIS A 143 10.843 -9.973 12.839 1.00 1.00 H new ATOM 0 HB3 HIS A 143 10.203 -8.653 13.798 1.00 1.00 H new ATOM 0 HD2 HIS A 143 8.410 -12.058 12.936 1.00 1.00 H new ATOM 0 HE1 HIS A 143 8.606 -11.712 17.172 1.00 1.00 H new ATOM 0 HE2 HIS A 143 7.716 -13.163 15.240 1.00 1.00 H new ATOM 2153 N TRP A 144 10.513 -7.613 10.929 1.00 1.00 N ATOM 2154 CA TRP A 144 11.005 -6.386 10.299 1.00 1.00 C ATOM 2155 C TRP A 144 10.066 -5.865 9.213 1.00 1.00 C ATOM 2156 O TRP A 144 9.858 -4.663 9.123 1.00 1.00 O ATOM 2157 CB TRP A 144 12.395 -6.645 9.708 1.00 1.00 C ATOM 2158 CG TRP A 144 12.939 -5.494 8.924 1.00 1.00 C ATOM 2159 CD1 TRP A 144 13.597 -4.438 9.446 1.00 1.00 C ATOM 2160 CD2 TRP A 144 12.881 -5.265 7.482 1.00 1.00 C ATOM 2161 NE1 TRP A 144 13.920 -3.559 8.434 1.00 1.00 N ATOM 2162 CE2 TRP A 144 13.472 -4.001 7.206 1.00 1.00 C ATOM 2163 CE3 TRP A 144 12.401 -6.001 6.379 1.00 1.00 C ATOM 2164 CZ2 TRP A 144 13.557 -3.479 5.908 1.00 1.00 C ATOM 2165 CZ3 TRP A 144 12.544 -5.518 5.063 1.00 1.00 C ATOM 2166 CH2 TRP A 144 13.116 -4.257 4.824 1.00 1.00 C ATOM 0 H TRP A 144 11.190 -8.374 10.873 1.00 1.00 H new ATOM 0 HA TRP A 144 11.056 -5.617 11.069 1.00 1.00 H new ATOM 0 HB2 TRP A 144 13.086 -6.881 10.517 1.00 1.00 H new ATOM 0 HB3 TRP A 144 12.348 -7.523 9.063 1.00 1.00 H new ATOM 0 HD1 TRP A 144 13.833 -4.303 10.491 1.00 1.00 H new ATOM 0 HE1 TRP A 144 14.429 -2.687 8.576 1.00 1.00 H new ATOM 0 HE3 TRP A 144 11.915 -6.951 6.546 1.00 1.00 H new ATOM 0 HZ2 TRP A 144 13.957 -2.490 5.743 1.00 1.00 H new ATOM 0 HZ3 TRP A 144 12.211 -6.122 4.232 1.00 1.00 H new ATOM 0 HH2 TRP A 144 13.216 -3.888 3.814 1.00 1.00 H new ATOM 2177 N GLY A 145 9.424 -6.748 8.454 1.00 1.00 N ATOM 2178 CA GLY A 145 8.395 -6.412 7.476 1.00 1.00 C ATOM 2179 C GLY A 145 7.284 -5.510 8.032 1.00 1.00 C ATOM 2180 O GLY A 145 6.807 -4.615 7.334 1.00 1.00 O ATOM 0 H GLY A 145 9.612 -7.749 8.505 1.00 1.00 H new ATOM 0 HA2 GLY A 145 8.863 -5.915 6.626 1.00 1.00 H new ATOM 0 HA3 GLY A 145 7.949 -7.333 7.101 1.00 1.00 H new ATOM 2184 N THR A 146 6.950 -5.643 9.320 1.00 1.00 N ATOM 2185 CA THR A 146 5.957 -4.807 9.985 1.00 1.00 C ATOM 2186 C THR A 146 6.391 -3.347 10.186 1.00 1.00 C ATOM 2187 O THR A 146 5.547 -2.493 10.474 1.00 1.00 O ATOM 2188 CB THR A 146 5.538 -5.433 11.327 1.00 1.00 C ATOM 2189 OG1 THR A 146 6.524 -5.270 12.318 1.00 1.00 O ATOM 2190 CG2 THR A 146 5.216 -6.933 11.249 1.00 1.00 C ATOM 0 H THR A 146 7.369 -6.343 9.933 1.00 1.00 H new ATOM 0 HA THR A 146 5.103 -4.770 9.309 1.00 1.00 H new ATOM 0 HB THR A 146 4.628 -4.892 11.588 1.00 1.00 H new ATOM 0 HG1 THR A 146 7.367 -5.664 12.009 1.00 1.00 H new ATOM 0 HG21 THR A 146 4.930 -7.296 12.236 1.00 1.00 H new ATOM 0 HG22 THR A 146 4.394 -7.093 10.551 1.00 1.00 H new ATOM 0 HG23 THR A 146 6.096 -7.476 10.904 1.00 1.00 H new ATOM 2198 N LEU A 147 7.679 -3.041 9.992 1.00 1.00 N ATOM 2199 CA LEU A 147 8.263 -1.712 10.047 1.00 1.00 C ATOM 2200 C LEU A 147 8.057 -0.938 8.726 1.00 1.00 C ATOM 2201 O LEU A 147 8.215 0.286 8.712 1.00 1.00 O ATOM 2202 CB LEU A 147 9.768 -1.814 10.403 1.00 1.00 C ATOM 2203 CG LEU A 147 10.184 -2.388 11.786 1.00 1.00 C ATOM 2204 CD1 LEU A 147 10.283 -1.262 12.819 1.00 1.00 C ATOM 2205 CD2 LEU A 147 9.312 -3.480 12.415 1.00 1.00 C ATOM 0 H LEU A 147 8.373 -3.759 9.782 1.00 1.00 H new ATOM 0 HA LEU A 147 7.751 -1.148 10.827 1.00 1.00 H new ATOM 0 HB2 LEU A 147 10.245 -2.426 9.637 1.00 1.00 H new ATOM 0 HB3 LEU A 147 10.193 -0.813 10.322 1.00 1.00 H new ATOM 0 HG LEU A 147 11.132 -2.870 11.546 1.00 1.00 H new ATOM 0 HD11 LEU A 147 10.575 -1.678 13.783 1.00 1.00 H new ATOM 0 HD12 LEU A 147 11.029 -0.536 12.496 1.00 1.00 H new ATOM 0 HD13 LEU A 147 9.315 -0.770 12.914 1.00 1.00 H new ATOM 0 HD21 LEU A 147 9.734 -3.774 13.376 1.00 1.00 H new ATOM 0 HD22 LEU A 147 8.302 -3.098 12.564 1.00 1.00 H new ATOM 0 HD23 LEU A 147 9.279 -4.345 11.753 1.00 1.00 H new ATOM 2217 N LEU A 148 7.718 -1.621 7.621 1.00 1.00 N ATOM 2218 CA LEU A 148 7.516 -1.019 6.314 1.00 1.00 C ATOM 2219 C LEU A 148 6.102 -0.394 6.198 1.00 1.00 C ATOM 2220 O LEU A 148 5.259 -0.537 7.095 1.00 1.00 O ATOM 2221 CB LEU A 148 7.731 -2.089 5.227 1.00 1.00 C ATOM 2222 CG LEU A 148 9.148 -2.656 5.037 1.00 1.00 C ATOM 2223 CD1 LEU A 148 10.070 -1.698 4.289 1.00 1.00 C ATOM 2224 CD2 LEU A 148 9.885 -3.101 6.290 1.00 1.00 C ATOM 0 H LEU A 148 7.576 -2.631 7.623 1.00 1.00 H new ATOM 0 HA LEU A 148 8.238 -0.214 6.178 1.00 1.00 H new ATOM 0 HB2 LEU A 148 7.065 -2.924 5.445 1.00 1.00 H new ATOM 0 HB3 LEU A 148 7.411 -1.666 4.275 1.00 1.00 H new ATOM 0 HG LEU A 148 8.934 -3.552 4.455 1.00 1.00 H new ATOM 0 HD11 LEU A 148 11.056 -2.150 4.184 1.00 1.00 H new ATOM 0 HD12 LEU A 148 9.658 -1.493 3.301 1.00 1.00 H new ATOM 0 HD13 LEU A 148 10.156 -0.766 4.847 1.00 1.00 H new ATOM 0 HD21 LEU A 148 10.870 -3.480 6.018 1.00 1.00 H new ATOM 0 HD22 LEU A 148 9.996 -2.254 6.967 1.00 1.00 H new ATOM 0 HD23 LEU A 148 9.318 -3.889 6.785 1.00 1.00 H new ATOM 2236 N SER A 149 5.838 0.285 5.076 1.00 1.00 N ATOM 2237 CA SER A 149 4.604 1.042 4.801 1.00 1.00 C ATOM 2238 C SER A 149 3.525 0.275 4.025 1.00 1.00 C ATOM 2239 O SER A 149 3.851 -0.577 3.169 1.00 1.00 O ATOM 2240 CB SER A 149 4.895 2.379 4.117 1.00 1.00 C ATOM 2241 OG SER A 149 5.856 3.108 4.865 1.00 1.00 O ATOM 2242 OXT SER A 149 2.330 0.592 4.210 1.00 1.00 O1- ATOM 0 H SER A 149 6.502 0.326 4.302 1.00 1.00 H new ATOM 0 HA SER A 149 4.185 1.222 5.791 1.00 1.00 H new ATOM 0 HB2 SER A 149 5.264 2.207 3.106 1.00 1.00 H new ATOM 0 HB3 SER A 149 3.976 2.958 4.027 1.00 1.00 H new ATOM 0 HG SER A 149 5.704 4.069 4.745 1.00 1.00 H new