USER MOD reduce.3.24.130724 H: found=0, std=0, add=1504, rem=0, adj=57 USER MOD reduce.3.24.130724 removed 1496 hydrogens (40 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 67 THR OG1 : rot -160:sc= -1.4! USER MOD Set 1.2: B 99 RBF O3' : rot 150:sc= -0.284 USER MOD Set 2.1: B 55 ASN : amide:sc= -0.0308 X(o=-4.4,f=-4.2) USER MOD Set 2.2: B 60 SER OG : rot 180:sc= -4.39! USER MOD Set 3.1: A 72 ASN : amide:sc= -5.91! C(o=-9!,f=-12!) USER MOD Set 3.2: B 45 ASN :FLIP amide:sc= -3.13! F(o=-9.8,f=-9!) USER MOD Set 4.1: A 67 THR OG1 : rot -170:sc= -1.6! USER MOD Set 4.2: A 98 RBF O3' : rot 150:sc= -0.256 USER MOD Set 5.1: A 55 ASN : amide:sc= -0.0345 X(o=-4,f=-3.8) USER MOD Set 5.2: A 60 SER OG : rot 180:sc= -4.01! USER MOD Set 6.1: A 45 ASN : amide:sc= -3.23 X(o=-9.8,f=-9.9!) USER MOD Set 6.2: B 72 ASN : amide:sc= -6.58! C(o=-9.8!,f=-13!) USER MOD Single : A 1 MET CE :methyl -131:sc= -0.165 (180deg=-1.08) USER MOD Single : A 1 MET N :NH3+ -129:sc= -0.0668 (180deg=-0.646) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.0245 USER MOD Single : A 7 GLN : amide:sc= -0.211 X(o=-0.21,f=-0.21) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.008 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN :FLIP amide:sc= -1.16! C(o=-2.5!,f=-1.2!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 HIS : no HE2:sc= -13.2! C(o=-13!,f=-19!) USER MOD Single : A 31 HIS : no HD1:sc= -6.8! C(o=-6.8!,f=-11!) USER MOD Single : A 32 MET CE :methyl -144:sc= -0.177 (180deg=-1.37) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.154 USER MOD Single : A 41 SER OG : rot 48:sc= -0.274 USER MOD Single : A 44 HIS : no HE2:sc= -13.8! C(o=-14!,f=-14!) USER MOD Single : A 47 CYS SG : rot 140:sc= -7.18! USER MOD Single : A 48 CYS SG : rot -91:sc= -1.3 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -44:sc= 0.44 USER MOD Single : A 57 ASN :FLIP amide:sc= -3.05 F(o=-7.6!,f=-3.1) USER MOD Single : A 58 HIS : no HE2:sc= -17.4! C(o=-17!,f=-17!) USER MOD Single : A 64 MET CE :methyl -116:sc= -0.0846 (180deg=-0.52) USER MOD Single : A 65 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.0325) USER MOD Single : A 71 THR OG1 : rot -92:sc= 1.22 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= -7! C(o=-7!,f=-14!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 174:sc= -2.61! USER MOD Single : A 97 HIS : no HD1:sc= 0 X(o=0,f=-0.0019) USER MOD Single : A 98 RBF O2' : rot 180:sc= -2.53! USER MOD Single : A 98 RBF O4' : rot -94:sc= -0.0184 USER MOD Single : A 98 RBF O5' : rot 180:sc= 0.00227 USER MOD Single : B 1 MET CE :methyl -141:sc= -0.048 (180deg=-0.432) USER MOD Single : B 1 MET N :NH3+ -113:sc= 0.0653 (180deg=0) USER MOD Single : B 3 THR OG1 : rot 180:sc=-0.00981 USER MOD Single : B 7 GLN : amide:sc= -0.293 X(o=-0.29,f=-0.29) USER MOD Single : B 9 THR OG1 : rot 180:sc= 0.00428 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 ASN :FLIP amide:sc= -1.05! C(o=-2.8!,f=-1!) USER MOD Single : B 23 THR OG1 : rot 180:sc= 0 USER MOD Single : B 24 HIS : no HE2:sc= -13.5! C(o=-14!,f=-19!) USER MOD Single : B 31 HIS : no HD1:sc= -7.2! C(o=-7.2!,f=-11!) USER MOD Single : B 32 MET CE :methyl -143:sc= -0.186 (180deg=-1.36) USER MOD Single : B 38 THR OG1 : rot 180:sc= -0.118 USER MOD Single : B 41 SER OG : rot 47:sc= -0.607 USER MOD Single : B 44 HIS : no HE2:sc= -13.7! C(o=-14!,f=-14!) USER MOD Single : B 47 CYS SG : rot -74:sc= -7.17! USER MOD Single : B 48 CYS SG : rot -102:sc= -1.65 USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 52 THR OG1 : rot -44:sc= 0.325 USER MOD Single : B 57 ASN :FLIP amide:sc= -3.19 F(o=-7.7!,f=-3.2) USER MOD Single : B 58 HIS :FLIP no HD1:sc= -16.8! C(o=-17!,f=-17!) USER MOD Single : B 64 MET CE :methyl -116:sc= -0.101 (180deg=-0.55) USER MOD Single : B 65 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.0339) USER MOD Single : B 71 THR OG1 : rot -80:sc= 1.2 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 ASN : amide:sc= -6.07! C(o=-6.1!,f=-13!) USER MOD Single : B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 SER OG : rot -160:sc= -0.0123 USER MOD Single : B 97 HIS : no HD1:sc= -0.198 X(o=-0.2,f=-0.0048) USER MOD Single : B 99 RBF O2' : rot 180:sc= -2.49! USER MOD Single : B 99 RBF O4' : rot 180:sc= -0.0334 USER MOD Single : B 99 RBF O5' : rot 39:sc=5.54e-05 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.948 -0.736 -28.647 1.00 0.00 N ATOM 2 CA MET A 1 -14.156 -1.952 -28.296 1.00 0.00 C ATOM 3 C MET A 1 -13.308 -1.687 -27.049 1.00 0.00 C ATOM 4 O MET A 1 -12.566 -0.728 -26.987 1.00 0.00 O ATOM 5 CB MET A 1 -13.261 -2.209 -29.511 1.00 0.00 C ATOM 6 CG MET A 1 -14.117 -2.683 -30.686 1.00 0.00 C ATOM 7 SD MET A 1 -13.056 -2.986 -32.120 1.00 0.00 S ATOM 8 CE MET A 1 -12.634 -1.259 -32.461 1.00 0.00 C ATOM 0 H1 MET A 1 -15.947 -0.996 -28.770 1.00 0.00 H new ATOM 0 H2 MET A 1 -14.864 -0.035 -27.884 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.585 -0.329 -29.532 1.00 0.00 H new ATOM 0 HA MET A 1 -14.792 -2.809 -28.072 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.727 -1.298 -29.781 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.509 -2.960 -29.269 1.00 0.00 H new ATOM 0 HG2 MET A 1 -14.651 -3.594 -30.416 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.869 -1.932 -30.928 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.787 -1.049 -33.520 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.271 -0.604 -31.866 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.590 -1.082 -32.203 1.00 0.00 H new ATOM 20 N PHE A 2 -13.396 -2.543 -26.065 1.00 0.00 N ATOM 21 CA PHE A 2 -12.586 -2.364 -24.836 1.00 0.00 C ATOM 22 C PHE A 2 -12.876 -3.517 -23.878 1.00 0.00 C ATOM 23 O PHE A 2 -13.990 -3.994 -23.785 1.00 0.00 O ATOM 24 CB PHE A 2 -13.036 -1.024 -24.236 1.00 0.00 C ATOM 25 CG PHE A 2 -14.453 -1.123 -23.716 1.00 0.00 C ATOM 26 CD1 PHE A 2 -14.726 -1.870 -22.560 1.00 0.00 C ATOM 27 CD2 PHE A 2 -15.499 -0.460 -24.382 1.00 0.00 C ATOM 28 CE1 PHE A 2 -16.038 -1.960 -22.075 1.00 0.00 C ATOM 29 CE2 PHE A 2 -16.808 -0.551 -23.893 1.00 0.00 C ATOM 30 CZ PHE A 2 -17.078 -1.302 -22.744 1.00 0.00 C ATOM 0 H PHE A 2 -14.001 -3.364 -26.065 1.00 0.00 H new ATOM 0 HA PHE A 2 -11.514 -2.361 -25.033 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -12.365 -0.738 -23.426 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -12.974 -0.242 -24.992 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -13.924 -2.376 -22.043 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -15.293 0.119 -25.270 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -16.247 -2.536 -21.186 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -17.611 -0.040 -24.404 1.00 0.00 H new ATOM 0 HZ PHE A 2 -18.089 -1.375 -22.372 1.00 0.00 H new ATOM 40 N THR A 3 -11.875 -4.023 -23.222 1.00 0.00 N ATOM 41 CA THR A 3 -12.095 -5.196 -22.337 1.00 0.00 C ATOM 42 C THR A 3 -11.464 -4.922 -20.976 1.00 0.00 C ATOM 43 O THR A 3 -11.977 -5.318 -19.949 1.00 0.00 O ATOM 44 CB THR A 3 -11.393 -6.365 -23.038 1.00 0.00 C ATOM 45 OG1 THR A 3 -9.991 -6.260 -22.831 1.00 0.00 O ATOM 46 CG2 THR A 3 -11.690 -6.320 -24.540 1.00 0.00 C ATOM 0 H THR A 3 -10.916 -3.677 -23.259 1.00 0.00 H new ATOM 0 HA THR A 3 -13.151 -5.410 -22.171 1.00 0.00 H new ATOM 0 HB THR A 3 -11.757 -7.307 -22.627 1.00 0.00 H new ATOM 0 HG1 THR A 3 -9.538 -7.006 -23.276 1.00 0.00 H new ATOM 0 HG21 THR A 3 -11.189 -7.152 -25.035 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.765 -6.396 -24.701 1.00 0.00 H new ATOM 0 HG23 THR A 3 -11.327 -5.380 -24.955 1.00 0.00 H new ATOM 54 N GLY A 4 -10.343 -4.258 -20.963 1.00 0.00 N ATOM 55 CA GLY A 4 -9.673 -3.975 -19.670 1.00 0.00 C ATOM 56 C GLY A 4 -9.455 -5.291 -18.935 1.00 0.00 C ATOM 57 O GLY A 4 -9.327 -5.329 -17.727 1.00 0.00 O ATOM 0 H GLY A 4 -9.865 -3.901 -21.790 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.720 -3.475 -19.840 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.283 -3.302 -19.067 1.00 0.00 H new ATOM 61 N ILE A 5 -9.477 -6.380 -19.651 1.00 0.00 N ATOM 62 CA ILE A 5 -9.344 -7.707 -18.983 1.00 0.00 C ATOM 63 C ILE A 5 -7.866 -7.992 -18.697 1.00 0.00 C ATOM 64 O ILE A 5 -7.009 -7.741 -19.519 1.00 0.00 O ATOM 65 CB ILE A 5 -9.934 -8.704 -19.986 1.00 0.00 C ATOM 66 CG1 ILE A 5 -11.309 -8.212 -20.444 1.00 0.00 C ATOM 67 CG2 ILE A 5 -10.103 -10.070 -19.329 1.00 0.00 C ATOM 68 CD1 ILE A 5 -12.263 -8.145 -19.250 1.00 0.00 C ATOM 0 H ILE A 5 -9.581 -6.410 -20.665 1.00 0.00 H new ATOM 0 HA ILE A 5 -9.858 -7.763 -18.023 1.00 0.00 H new ATOM 0 HB ILE A 5 -9.258 -8.787 -20.837 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -11.218 -7.228 -20.903 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -11.710 -8.883 -21.204 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -10.523 -10.771 -20.050 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -9.133 -10.434 -18.992 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -10.774 -9.982 -18.475 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -13.239 -7.794 -19.584 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -12.365 -9.137 -18.810 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -11.865 -7.456 -18.505 1.00 0.00 H new ATOM 80 N VAL A 6 -7.551 -8.269 -17.458 1.00 0.00 N ATOM 81 CA VAL A 6 -6.119 -8.281 -17.036 1.00 0.00 C ATOM 82 C VAL A 6 -5.449 -9.617 -17.370 1.00 0.00 C ATOM 83 O VAL A 6 -6.007 -10.678 -17.170 1.00 0.00 O ATOM 84 CB VAL A 6 -6.156 -8.039 -15.520 1.00 0.00 C ATOM 85 CG1 VAL A 6 -4.905 -8.618 -14.848 1.00 0.00 C ATOM 86 CG2 VAL A 6 -6.203 -6.536 -15.258 1.00 0.00 C ATOM 0 H VAL A 6 -8.222 -8.487 -16.722 1.00 0.00 H new ATOM 0 HA VAL A 6 -5.534 -7.523 -17.557 1.00 0.00 H new ATOM 0 HB VAL A 6 -7.038 -8.529 -15.108 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -4.951 -8.436 -13.774 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -4.857 -9.691 -15.032 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -4.016 -8.139 -15.259 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -6.230 -6.355 -14.184 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -5.317 -6.065 -15.684 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -7.096 -6.114 -15.719 1.00 0.00 H new ATOM 96 N GLN A 7 -4.204 -9.560 -17.752 1.00 0.00 N ATOM 97 CA GLN A 7 -3.420 -10.808 -17.957 1.00 0.00 C ATOM 98 C GLN A 7 -3.137 -11.486 -16.610 1.00 0.00 C ATOM 99 O GLN A 7 -3.117 -12.697 -16.515 1.00 0.00 O ATOM 100 CB GLN A 7 -2.119 -10.347 -18.613 1.00 0.00 C ATOM 101 CG GLN A 7 -2.423 -9.782 -20.002 1.00 0.00 C ATOM 102 CD GLN A 7 -3.071 -10.867 -20.863 1.00 0.00 C ATOM 103 OE1 GLN A 7 -2.442 -11.851 -21.196 1.00 0.00 O ATOM 104 NE2 GLN A 7 -4.313 -10.728 -21.240 1.00 0.00 N ATOM 0 H GLN A 7 -3.693 -8.696 -17.932 1.00 0.00 H new ATOM 0 HA GLN A 7 -3.951 -11.537 -18.569 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -1.637 -9.588 -17.997 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -1.423 -11.182 -18.692 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -3.089 -8.923 -19.919 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -1.505 -9.430 -20.472 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -4.841 -9.902 -20.960 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -4.755 -11.446 -21.814 1.00 0.00 H new ATOM 113 N GLY A 8 -2.856 -10.724 -15.581 1.00 0.00 N ATOM 114 CA GLY A 8 -2.510 -11.356 -14.274 1.00 0.00 C ATOM 115 C GLY A 8 -2.509 -10.297 -13.170 1.00 0.00 C ATOM 116 O GLY A 8 -2.865 -9.159 -13.389 1.00 0.00 O ATOM 0 H GLY A 8 -2.851 -9.704 -15.590 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -3.229 -12.140 -14.037 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -1.530 -11.830 -14.337 1.00 0.00 H new ATOM 120 N THR A 9 -2.157 -10.671 -11.971 1.00 0.00 N ATOM 121 CA THR A 9 -2.196 -9.687 -10.850 1.00 0.00 C ATOM 122 C THR A 9 -0.810 -9.523 -10.220 1.00 0.00 C ATOM 123 O THR A 9 0.127 -10.223 -10.550 1.00 0.00 O ATOM 124 CB THR A 9 -3.183 -10.270 -9.839 1.00 0.00 C ATOM 125 OG1 THR A 9 -3.087 -11.688 -9.848 1.00 0.00 O ATOM 126 CG2 THR A 9 -4.606 -9.847 -10.212 1.00 0.00 C ATOM 0 H THR A 9 -1.846 -11.609 -11.719 1.00 0.00 H new ATOM 0 HA THR A 9 -2.499 -8.697 -11.191 1.00 0.00 H new ATOM 0 HB THR A 9 -2.946 -9.898 -8.842 1.00 0.00 H new ATOM 0 HG1 THR A 9 -3.718 -12.063 -9.199 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.310 -10.263 -9.491 1.00 0.00 H new ATOM 0 HG22 THR A 9 -4.677 -8.759 -10.202 1.00 0.00 H new ATOM 0 HG23 THR A 9 -4.846 -10.217 -11.209 1.00 0.00 H new ATOM 134 N ALA A 10 -0.674 -8.572 -9.339 1.00 0.00 N ATOM 135 CA ALA A 10 0.647 -8.307 -8.698 1.00 0.00 C ATOM 136 C ALA A 10 0.442 -7.986 -7.222 1.00 0.00 C ATOM 137 O ALA A 10 -0.559 -7.433 -6.833 1.00 0.00 O ATOM 138 CB ALA A 10 1.210 -7.091 -9.437 1.00 0.00 C ATOM 0 H ALA A 10 -1.429 -7.960 -9.031 1.00 0.00 H new ATOM 0 HA ALA A 10 1.321 -9.162 -8.756 1.00 0.00 H new ATOM 0 HB1 ALA A 10 2.184 -6.832 -9.022 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.317 -7.326 -10.496 1.00 0.00 H new ATOM 0 HB3 ALA A 10 0.530 -6.247 -9.320 1.00 0.00 H new ATOM 144 N LYS A 11 1.390 -8.304 -6.398 1.00 0.00 N ATOM 145 CA LYS A 11 1.244 -7.980 -4.953 1.00 0.00 C ATOM 146 C LYS A 11 2.133 -6.796 -4.588 1.00 0.00 C ATOM 147 O LYS A 11 3.339 -6.913 -4.540 1.00 0.00 O ATOM 148 CB LYS A 11 1.710 -9.226 -4.213 1.00 0.00 C ATOM 149 CG LYS A 11 1.682 -8.955 -2.709 1.00 0.00 C ATOM 150 CD LYS A 11 1.987 -10.244 -1.949 1.00 0.00 C ATOM 151 CE LYS A 11 2.847 -9.920 -0.726 1.00 0.00 C ATOM 152 NZ LYS A 11 3.207 -11.245 -0.146 1.00 0.00 N ATOM 0 H LYS A 11 2.258 -8.773 -6.656 1.00 0.00 H new ATOM 0 HA LYS A 11 0.219 -7.710 -4.698 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.064 -10.070 -4.455 1.00 0.00 H new ATOM 0 HB3 LYS A 11 2.718 -9.495 -4.528 1.00 0.00 H new ATOM 0 HG2 LYS A 11 2.414 -8.189 -2.454 1.00 0.00 H new ATOM 0 HG3 LYS A 11 0.704 -8.572 -2.417 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.059 -10.724 -1.638 1.00 0.00 H new ATOM 0 HD3 LYS A 11 2.508 -10.948 -2.598 1.00 0.00 H new ATOM 0 HE2 LYS A 11 3.737 -9.357 -1.007 1.00 0.00 H new ATOM 0 HE3 LYS A 11 2.298 -9.311 -0.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 3.798 -11.105 0.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 2.340 -11.755 0.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 3.734 -11.800 -0.850 1.00 0.00 H new ATOM 166 N LEU A 12 1.554 -5.706 -4.190 1.00 0.00 N ATOM 167 CA LEU A 12 2.384 -4.592 -3.669 1.00 0.00 C ATOM 168 C LEU A 12 3.162 -5.088 -2.460 1.00 0.00 C ATOM 169 O LEU A 12 2.611 -5.681 -1.556 1.00 0.00 O ATOM 170 CB LEU A 12 1.388 -3.513 -3.253 1.00 0.00 C ATOM 171 CG LEU A 12 2.086 -2.157 -3.177 1.00 0.00 C ATOM 172 CD1 LEU A 12 2.826 -1.889 -4.488 1.00 0.00 C ATOM 173 CD2 LEU A 12 1.038 -1.063 -2.955 1.00 0.00 C ATOM 0 H LEU A 12 0.548 -5.537 -4.202 1.00 0.00 H new ATOM 0 HA LEU A 12 3.099 -4.214 -4.400 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.567 -3.469 -3.969 1.00 0.00 H new ATOM 0 HB3 LEU A 12 0.953 -3.762 -2.285 1.00 0.00 H new ATOM 0 HG LEU A 12 2.798 -2.159 -2.352 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.324 -0.921 -4.433 1.00 0.00 H new ATOM 0 HD12 LEU A 12 3.568 -2.670 -4.653 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.114 -1.885 -5.313 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.531 -0.093 -2.900 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.330 -1.064 -3.784 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.506 -1.253 -2.023 1.00 0.00 H new ATOM 185 N VAL A 13 4.438 -4.887 -2.455 1.00 0.00 N ATOM 186 CA VAL A 13 5.255 -5.392 -1.324 1.00 0.00 C ATOM 187 C VAL A 13 6.138 -4.284 -0.776 1.00 0.00 C ATOM 188 O VAL A 13 6.464 -4.256 0.395 1.00 0.00 O ATOM 189 CB VAL A 13 6.094 -6.528 -1.908 1.00 0.00 C ATOM 190 CG1 VAL A 13 6.681 -6.133 -3.265 1.00 0.00 C ATOM 191 CG2 VAL A 13 7.231 -6.869 -0.943 1.00 0.00 C ATOM 0 H VAL A 13 4.956 -4.395 -3.183 1.00 0.00 H new ATOM 0 HA VAL A 13 4.640 -5.738 -0.493 1.00 0.00 H new ATOM 0 HB VAL A 13 5.450 -7.396 -2.049 1.00 0.00 H new ATOM 0 HG11 VAL A 13 7.274 -6.958 -3.659 1.00 0.00 H new ATOM 0 HG12 VAL A 13 5.872 -5.904 -3.958 1.00 0.00 H new ATOM 0 HG13 VAL A 13 7.316 -5.255 -3.145 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.830 -7.679 -1.358 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.860 -5.991 -0.797 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.814 -7.180 0.015 1.00 0.00 H new ATOM 201 N SER A 14 6.519 -3.360 -1.604 1.00 0.00 N ATOM 202 CA SER A 14 7.377 -2.245 -1.099 1.00 0.00 C ATOM 203 C SER A 14 7.098 -0.939 -1.846 1.00 0.00 C ATOM 204 O SER A 14 7.010 -0.915 -3.055 1.00 0.00 O ATOM 205 CB SER A 14 8.805 -2.712 -1.363 1.00 0.00 C ATOM 206 OG SER A 14 9.587 -2.518 -0.193 1.00 0.00 O ATOM 0 H SER A 14 6.282 -3.321 -2.595 1.00 0.00 H new ATOM 0 HA SER A 14 7.188 -2.036 -0.046 1.00 0.00 H new ATOM 0 HB2 SER A 14 8.809 -3.765 -1.646 1.00 0.00 H new ATOM 0 HB3 SER A 14 9.233 -2.156 -2.197 1.00 0.00 H new ATOM 0 HG SER A 14 10.505 -2.819 -0.359 1.00 0.00 H new ATOM 212 N ILE A 15 7.125 0.169 -1.149 1.00 0.00 N ATOM 213 CA ILE A 15 7.047 1.487 -1.850 1.00 0.00 C ATOM 214 C ILE A 15 8.401 2.185 -1.809 1.00 0.00 C ATOM 215 O ILE A 15 9.013 2.318 -0.768 1.00 0.00 O ATOM 216 CB ILE A 15 6.025 2.323 -1.086 1.00 0.00 C ATOM 217 CG1 ILE A 15 4.788 1.479 -0.817 1.00 0.00 C ATOM 218 CG2 ILE A 15 5.648 3.544 -1.928 1.00 0.00 C ATOM 219 CD1 ILE A 15 3.693 2.340 -0.179 1.00 0.00 C ATOM 0 H ILE A 15 7.197 0.219 -0.133 1.00 0.00 H new ATOM 0 HA ILE A 15 6.763 1.357 -2.894 1.00 0.00 H new ATOM 0 HB ILE A 15 6.448 2.654 -0.137 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.424 1.045 -1.749 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.041 0.649 -0.157 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.918 4.147 -1.388 1.00 0.00 H new ATOM 0 HG22 ILE A 15 6.539 4.141 -2.122 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.219 3.215 -2.874 1.00 0.00 H new ATOM 0 HD11 ILE A 15 2.812 1.727 0.010 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.057 2.752 0.762 1.00 0.00 H new ATOM 0 HD13 ILE A 15 3.431 3.154 -0.854 1.00 0.00 H new ATOM 231 N ASP A 16 8.813 2.735 -2.907 1.00 0.00 N ATOM 232 CA ASP A 16 10.058 3.549 -2.910 1.00 0.00 C ATOM 233 C ASP A 16 9.724 5.027 -3.112 1.00 0.00 C ATOM 234 O ASP A 16 9.210 5.418 -4.133 1.00 0.00 O ATOM 235 CB ASP A 16 10.881 3.013 -4.079 1.00 0.00 C ATOM 236 CG ASP A 16 11.535 1.690 -3.679 1.00 0.00 C ATOM 237 OD1 ASP A 16 11.650 1.446 -2.489 1.00 0.00 O ATOM 238 OD2 ASP A 16 11.911 0.944 -4.568 1.00 0.00 O ATOM 0 H ASP A 16 8.342 2.658 -3.809 1.00 0.00 H new ATOM 0 HA ASP A 16 10.601 3.477 -1.968 1.00 0.00 H new ATOM 0 HB2 ASP A 16 10.242 2.866 -4.950 1.00 0.00 H new ATOM 0 HB3 ASP A 16 11.645 3.737 -4.362 1.00 0.00 H new ATOM 243 N GLU A 17 9.980 5.844 -2.130 1.00 0.00 N ATOM 244 CA GLU A 17 9.636 7.290 -2.262 1.00 0.00 C ATOM 245 C GLU A 17 10.890 8.111 -2.579 1.00 0.00 C ATOM 246 O GLU A 17 11.717 8.354 -1.723 1.00 0.00 O ATOM 247 CB GLU A 17 9.069 7.684 -0.898 1.00 0.00 C ATOM 248 CG GLU A 17 7.734 6.969 -0.675 1.00 0.00 C ATOM 249 CD GLU A 17 7.165 7.362 0.690 1.00 0.00 C ATOM 250 OE1 GLU A 17 7.772 8.191 1.347 1.00 0.00 O ATOM 251 OE2 GLU A 17 6.131 6.827 1.054 1.00 0.00 O ATOM 0 H GLU A 17 10.411 5.577 -1.245 1.00 0.00 H new ATOM 0 HA GLU A 17 8.928 7.473 -3.070 1.00 0.00 H new ATOM 0 HB2 GLU A 17 9.773 7.418 -0.109 1.00 0.00 H new ATOM 0 HB3 GLU A 17 8.928 8.764 -0.849 1.00 0.00 H new ATOM 0 HG2 GLU A 17 7.031 7.235 -1.464 1.00 0.00 H new ATOM 0 HG3 GLU A 17 7.875 5.889 -0.725 1.00 0.00 H new ATOM 258 N LYS A 18 10.992 8.619 -3.778 1.00 0.00 N ATOM 259 CA LYS A 18 12.136 9.515 -4.117 1.00 0.00 C ATOM 260 C LYS A 18 11.654 10.966 -4.147 1.00 0.00 C ATOM 261 O LYS A 18 10.624 11.262 -4.717 1.00 0.00 O ATOM 262 CB LYS A 18 12.603 9.081 -5.508 1.00 0.00 C ATOM 263 CG LYS A 18 12.596 7.554 -5.610 1.00 0.00 C ATOM 264 CD LYS A 18 13.896 7.084 -6.262 1.00 0.00 C ATOM 265 CE LYS A 18 15.044 7.207 -5.258 1.00 0.00 C ATOM 266 NZ LYS A 18 16.132 6.356 -5.813 1.00 0.00 N ATOM 0 H LYS A 18 10.332 8.452 -4.538 1.00 0.00 H new ATOM 0 HA LYS A 18 12.943 9.448 -3.388 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.950 9.507 -6.269 1.00 0.00 H new ATOM 0 HB3 LYS A 18 13.606 9.462 -5.699 1.00 0.00 H new ATOM 0 HG2 LYS A 18 12.493 7.113 -4.619 1.00 0.00 H new ATOM 0 HG3 LYS A 18 11.740 7.221 -6.198 1.00 0.00 H new ATOM 0 HD2 LYS A 18 13.797 6.050 -6.592 1.00 0.00 H new ATOM 0 HD3 LYS A 18 14.108 7.682 -7.148 1.00 0.00 H new ATOM 0 HE2 LYS A 18 15.367 8.243 -5.153 1.00 0.00 H new ATOM 0 HE3 LYS A 18 14.741 6.865 -4.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 16.956 6.389 -5.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 15.797 5.375 -5.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 16.404 6.709 -6.753 1.00 0.00 H new ATOM 280 N PRO A 19 12.421 11.824 -3.536 1.00 0.00 N ATOM 281 CA PRO A 19 12.066 13.264 -3.482 1.00 0.00 C ATOM 282 C PRO A 19 11.785 13.808 -4.886 1.00 0.00 C ATOM 283 O PRO A 19 11.173 14.845 -5.047 1.00 0.00 O ATOM 284 CB PRO A 19 13.301 13.930 -2.865 1.00 0.00 C ATOM 285 CG PRO A 19 14.373 12.883 -2.862 1.00 0.00 C ATOM 286 CD PRO A 19 13.684 11.547 -2.858 1.00 0.00 C ATOM 0 HA PRO A 19 11.162 13.454 -2.904 1.00 0.00 H new ATOM 0 HB2 PRO A 19 13.607 14.800 -3.446 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.093 14.279 -1.854 1.00 0.00 H new ATOM 0 HG2 PRO A 19 15.013 12.984 -3.739 1.00 0.00 H new ATOM 0 HG3 PRO A 19 15.013 12.989 -1.986 1.00 0.00 H new ATOM 0 HD2 PRO A 19 14.267 10.791 -3.384 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.525 11.178 -1.845 1.00 0.00 H new ATOM 294 N ASN A 20 12.228 13.121 -5.903 1.00 0.00 N ATOM 295 CA ASN A 20 11.982 13.610 -7.295 1.00 0.00 C ATOM 296 C ASN A 20 10.792 12.861 -7.885 1.00 0.00 C ATOM 297 O ASN A 20 10.075 13.366 -8.726 1.00 0.00 O ATOM 298 CB ASN A 20 13.248 13.274 -8.107 1.00 0.00 C ATOM 299 CG ASN A 20 14.490 13.288 -7.213 1.00 0.00 C ATOM 300 OD1 ASN A 20 14.528 14.087 -6.187 1.00 0.00 O flip ATOM 301 ND2 ASN A 20 15.434 12.561 -7.453 1.00 0.00 N flip ATOM 0 H ASN A 20 12.748 12.246 -5.834 1.00 0.00 H new ATOM 0 HA ASN A 20 11.770 14.679 -7.312 1.00 0.00 H new ATOM 0 HB2 ASN A 20 13.139 12.293 -8.569 1.00 0.00 H new ATOM 0 HB3 ASN A 20 13.369 13.995 -8.915 1.00 0.00 H new ATOM 0 HD21 ASN A 20 15.404 11.935 -8.258 1.00 0.00 H new ATOM 0 HD22 ASN A 20 16.256 12.577 -6.850 1.00 0.00 H new ATOM 308 N PHE A 21 10.635 11.629 -7.500 1.00 0.00 N ATOM 309 CA PHE A 21 9.556 10.784 -8.093 1.00 0.00 C ATOM 310 C PHE A 21 9.084 9.743 -7.077 1.00 0.00 C ATOM 311 O PHE A 21 9.865 9.214 -6.314 1.00 0.00 O ATOM 312 CB PHE A 21 10.204 10.089 -9.293 1.00 0.00 C ATOM 313 CG PHE A 21 10.805 11.120 -10.217 1.00 0.00 C ATOM 314 CD1 PHE A 21 9.974 12.012 -10.908 1.00 0.00 C ATOM 315 CD2 PHE A 21 12.195 11.182 -10.389 1.00 0.00 C ATOM 316 CE1 PHE A 21 10.531 12.967 -11.769 1.00 0.00 C ATOM 317 CE2 PHE A 21 12.753 12.136 -11.251 1.00 0.00 C ATOM 318 CZ PHE A 21 11.922 13.030 -11.941 1.00 0.00 C ATOM 0 H PHE A 21 11.209 11.164 -6.796 1.00 0.00 H new ATOM 0 HA PHE A 21 8.687 11.375 -8.381 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.976 9.399 -8.952 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.461 9.497 -9.827 1.00 0.00 H new ATOM 0 HD1 PHE A 21 8.903 11.963 -10.777 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.836 10.494 -9.857 1.00 0.00 H new ATOM 0 HE1 PHE A 21 9.890 13.655 -12.300 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.824 12.183 -11.384 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.352 13.766 -12.604 1.00 0.00 H new ATOM 328 N ARG A 22 7.847 9.342 -7.144 1.00 0.00 N ATOM 329 CA ARG A 22 7.403 8.221 -6.271 1.00 0.00 C ATOM 330 C ARG A 22 7.513 6.898 -7.022 1.00 0.00 C ATOM 331 O ARG A 22 7.349 6.833 -8.221 1.00 0.00 O ATOM 332 CB ARG A 22 5.952 8.513 -5.901 1.00 0.00 C ATOM 333 CG ARG A 22 5.446 7.420 -4.957 1.00 0.00 C ATOM 334 CD ARG A 22 4.109 7.841 -4.345 1.00 0.00 C ATOM 335 NE ARG A 22 3.720 6.701 -3.467 1.00 0.00 N ATOM 336 CZ ARG A 22 2.897 6.885 -2.469 1.00 0.00 C ATOM 337 NH1 ARG A 22 2.392 8.067 -2.238 1.00 0.00 N ATOM 338 NH2 ARG A 22 2.574 5.880 -1.700 1.00 0.00 N ATOM 0 H ARG A 22 7.132 9.735 -7.756 1.00 0.00 H new ATOM 0 HA ARG A 22 8.023 8.139 -5.378 1.00 0.00 H new ATOM 0 HB2 ARG A 22 5.875 9.489 -5.422 1.00 0.00 H new ATOM 0 HB3 ARG A 22 5.335 8.550 -6.799 1.00 0.00 H new ATOM 0 HG2 ARG A 22 5.328 6.483 -5.501 1.00 0.00 H new ATOM 0 HG3 ARG A 22 6.177 7.241 -4.168 1.00 0.00 H new ATOM 0 HD2 ARG A 22 4.208 8.765 -3.775 1.00 0.00 H new ATOM 0 HD3 ARG A 22 3.360 8.021 -5.116 1.00 0.00 H new ATOM 0 HE ARG A 22 4.099 5.771 -3.646 1.00 0.00 H new ATOM 0 HH11 ARG A 22 2.639 8.854 -2.838 1.00 0.00 H new ATOM 0 HH12 ARG A 22 1.750 8.204 -1.457 1.00 0.00 H new ATOM 0 HH21 ARG A 22 2.964 4.955 -1.879 1.00 0.00 H new ATOM 0 HH22 ARG A 22 1.932 6.020 -0.920 1.00 0.00 H new ATOM 352 N THR A 23 7.883 5.866 -6.331 1.00 0.00 N ATOM 353 CA THR A 23 8.120 4.554 -6.992 1.00 0.00 C ATOM 354 C THR A 23 7.367 3.455 -6.246 1.00 0.00 C ATOM 355 O THR A 23 7.335 3.434 -5.036 1.00 0.00 O ATOM 356 CB THR A 23 9.629 4.330 -6.877 1.00 0.00 C ATOM 357 OG1 THR A 23 10.311 5.299 -7.662 1.00 0.00 O ATOM 358 CG2 THR A 23 9.980 2.927 -7.372 1.00 0.00 C ATOM 0 H THR A 23 8.035 5.871 -5.322 1.00 0.00 H new ATOM 0 HA THR A 23 7.777 4.538 -8.027 1.00 0.00 H new ATOM 0 HB THR A 23 9.932 4.428 -5.835 1.00 0.00 H new ATOM 0 HG1 THR A 23 11.278 5.158 -7.588 1.00 0.00 H new ATOM 0 HG21 THR A 23 11.055 2.770 -7.289 1.00 0.00 H new ATOM 0 HG22 THR A 23 9.458 2.186 -6.767 1.00 0.00 H new ATOM 0 HG23 THR A 23 9.678 2.823 -8.414 1.00 0.00 H new ATOM 366 N HIS A 24 6.768 2.537 -6.945 1.00 0.00 N ATOM 367 CA HIS A 24 6.039 1.447 -6.242 1.00 0.00 C ATOM 368 C HIS A 24 6.444 0.075 -6.775 1.00 0.00 C ATOM 369 O HIS A 24 6.594 -0.120 -7.957 1.00 0.00 O ATOM 370 CB HIS A 24 4.569 1.721 -6.511 1.00 0.00 C ATOM 371 CG HIS A 24 3.962 2.266 -5.251 1.00 0.00 C ATOM 372 ND1 HIS A 24 3.179 3.409 -5.230 1.00 0.00 N ATOM 373 CD2 HIS A 24 4.055 1.851 -3.947 1.00 0.00 C ATOM 374 CE1 HIS A 24 2.840 3.640 -3.948 1.00 0.00 C ATOM 375 NE2 HIS A 24 3.346 2.719 -3.127 1.00 0.00 N ATOM 0 H HIS A 24 6.750 2.492 -7.964 1.00 0.00 H new ATOM 0 HA HIS A 24 6.266 1.432 -5.176 1.00 0.00 H new ATOM 0 HB2 HIS A 24 4.457 2.434 -7.328 1.00 0.00 H new ATOM 0 HB3 HIS A 24 4.060 0.806 -6.815 1.00 0.00 H new ATOM 0 HD1 HIS A 24 2.909 3.971 -6.037 1.00 0.00 H new ATOM 0 HD2 HIS A 24 4.598 0.981 -3.609 1.00 0.00 H new ATOM 0 HE1 HIS A 24 2.232 4.471 -3.623 1.00 0.00 H new ATOM 383 N VAL A 25 6.677 -0.864 -5.904 1.00 0.00 N ATOM 384 CA VAL A 25 7.144 -2.199 -6.363 1.00 0.00 C ATOM 385 C VAL A 25 6.130 -3.279 -6.002 1.00 0.00 C ATOM 386 O VAL A 25 5.669 -3.375 -4.877 1.00 0.00 O ATOM 387 CB VAL A 25 8.453 -2.446 -5.625 1.00 0.00 C ATOM 388 CG1 VAL A 25 9.204 -3.604 -6.286 1.00 0.00 C ATOM 389 CG2 VAL A 25 9.317 -1.182 -5.665 1.00 0.00 C ATOM 0 H VAL A 25 6.564 -0.765 -4.895 1.00 0.00 H new ATOM 0 HA VAL A 25 7.270 -2.228 -7.445 1.00 0.00 H new ATOM 0 HB VAL A 25 8.238 -2.700 -4.587 1.00 0.00 H new ATOM 0 HG11 VAL A 25 10.141 -3.780 -5.757 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.591 -4.504 -6.247 1.00 0.00 H new ATOM 0 HG13 VAL A 25 9.416 -3.354 -7.326 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.252 -1.364 -5.136 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.531 -0.920 -6.701 1.00 0.00 H new ATOM 0 HG23 VAL A 25 8.783 -0.361 -5.187 1.00 0.00 H new ATOM 399 N VAL A 26 5.804 -4.104 -6.951 1.00 0.00 N ATOM 400 CA VAL A 26 4.838 -5.203 -6.700 1.00 0.00 C ATOM 401 C VAL A 26 5.543 -6.557 -6.810 1.00 0.00 C ATOM 402 O VAL A 26 6.674 -6.639 -7.233 1.00 0.00 O ATOM 403 CB VAL A 26 3.800 -5.065 -7.810 1.00 0.00 C ATOM 404 CG1 VAL A 26 3.298 -3.620 -7.872 1.00 0.00 C ATOM 405 CG2 VAL A 26 4.442 -5.439 -9.150 1.00 0.00 C ATOM 0 H VAL A 26 6.170 -4.063 -7.902 1.00 0.00 H new ATOM 0 HA VAL A 26 4.395 -5.148 -5.706 1.00 0.00 H new ATOM 0 HB VAL A 26 2.960 -5.729 -7.606 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.557 -3.526 -8.666 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.844 -3.351 -6.918 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.135 -2.952 -8.076 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.704 -5.342 -9.947 1.00 0.00 H new ATOM 0 HG22 VAL A 26 5.281 -4.773 -9.350 1.00 0.00 H new ATOM 0 HG23 VAL A 26 4.798 -6.468 -9.108 1.00 0.00 H new ATOM 415 N GLU A 27 4.867 -7.618 -6.466 1.00 0.00 N ATOM 416 CA GLU A 27 5.473 -8.965 -6.576 1.00 0.00 C ATOM 417 C GLU A 27 4.869 -9.683 -7.778 1.00 0.00 C ATOM 418 O GLU A 27 3.667 -9.827 -7.887 1.00 0.00 O ATOM 419 CB GLU A 27 5.072 -9.654 -5.280 1.00 0.00 C ATOM 420 CG GLU A 27 6.159 -10.637 -4.843 1.00 0.00 C ATOM 421 CD GLU A 27 6.005 -10.939 -3.351 1.00 0.00 C ATOM 422 OE1 GLU A 27 5.037 -10.476 -2.770 1.00 0.00 O ATOM 423 OE2 GLU A 27 6.857 -11.627 -2.815 1.00 0.00 O ATOM 0 H GLU A 27 3.911 -7.604 -6.110 1.00 0.00 H new ATOM 0 HA GLU A 27 6.554 -8.951 -6.715 1.00 0.00 H new ATOM 0 HB2 GLU A 27 4.910 -8.910 -4.500 1.00 0.00 H new ATOM 0 HB3 GLU A 27 4.129 -10.182 -5.418 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.085 -11.558 -5.421 1.00 0.00 H new ATOM 0 HG3 GLU A 27 7.145 -10.216 -5.040 1.00 0.00 H new ATOM 430 N LEU A 28 5.681 -9.999 -8.737 1.00 0.00 N ATOM 431 CA LEU A 28 5.159 -10.557 -10.012 1.00 0.00 C ATOM 432 C LEU A 28 4.938 -12.070 -9.870 1.00 0.00 C ATOM 433 O LEU A 28 5.859 -12.804 -9.571 1.00 0.00 O ATOM 434 CB LEU A 28 6.267 -10.248 -11.020 1.00 0.00 C ATOM 435 CG LEU A 28 5.680 -10.042 -12.419 1.00 0.00 C ATOM 436 CD1 LEU A 28 4.526 -9.037 -12.357 1.00 0.00 C ATOM 437 CD2 LEU A 28 6.770 -9.495 -13.343 1.00 0.00 C ATOM 0 H LEU A 28 6.695 -9.895 -8.695 1.00 0.00 H new ATOM 0 HA LEU A 28 4.199 -10.137 -10.312 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.808 -9.353 -10.711 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.988 -11.066 -11.039 1.00 0.00 H new ATOM 0 HG LEU A 28 5.309 -10.994 -12.798 1.00 0.00 H new ATOM 0 HD11 LEU A 28 4.113 -8.895 -13.356 1.00 0.00 H new ATOM 0 HD12 LEU A 28 3.749 -9.416 -11.693 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.894 -8.084 -11.978 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.359 -9.346 -14.342 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.133 -8.544 -12.954 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.595 -10.205 -13.393 1.00 0.00 H new ATOM 449 N PRO A 29 3.714 -12.483 -10.080 1.00 0.00 N ATOM 450 CA PRO A 29 3.362 -13.921 -9.961 1.00 0.00 C ATOM 451 C PRO A 29 4.053 -14.747 -11.049 1.00 0.00 C ATOM 452 O PRO A 29 4.790 -14.231 -11.864 1.00 0.00 O ATOM 453 CB PRO A 29 1.849 -13.947 -10.142 1.00 0.00 C ATOM 454 CG PRO A 29 1.508 -12.665 -10.830 1.00 0.00 C ATOM 455 CD PRO A 29 2.557 -11.661 -10.443 1.00 0.00 C ATOM 0 HA PRO A 29 3.680 -14.351 -9.011 1.00 0.00 H new ATOM 0 HB2 PRO A 29 1.539 -14.806 -10.737 1.00 0.00 H new ATOM 0 HB3 PRO A 29 1.340 -14.024 -9.181 1.00 0.00 H new ATOM 0 HG2 PRO A 29 1.487 -12.802 -11.911 1.00 0.00 H new ATOM 0 HG3 PRO A 29 0.517 -12.321 -10.533 1.00 0.00 H new ATOM 0 HD2 PRO A 29 2.789 -10.987 -11.268 1.00 0.00 H new ATOM 0 HD3 PRO A 29 2.229 -11.042 -9.608 1.00 0.00 H new ATOM 463 N ASP A 30 3.888 -16.040 -11.004 1.00 0.00 N ATOM 464 CA ASP A 30 4.612 -16.926 -11.960 1.00 0.00 C ATOM 465 C ASP A 30 4.244 -16.589 -13.410 1.00 0.00 C ATOM 466 O ASP A 30 5.069 -16.678 -14.297 1.00 0.00 O ATOM 467 CB ASP A 30 4.149 -18.342 -11.607 1.00 0.00 C ATOM 468 CG ASP A 30 4.833 -19.350 -12.533 1.00 0.00 C ATOM 469 OD1 ASP A 30 5.335 -18.933 -13.564 1.00 0.00 O ATOM 470 OD2 ASP A 30 4.841 -20.522 -12.197 1.00 0.00 O ATOM 0 H ASP A 30 3.280 -16.524 -10.343 1.00 0.00 H new ATOM 0 HA ASP A 30 5.693 -16.809 -11.882 1.00 0.00 H new ATOM 0 HB2 ASP A 30 4.390 -18.566 -10.568 1.00 0.00 H new ATOM 0 HB3 ASP A 30 3.066 -18.417 -11.707 1.00 0.00 H new ATOM 475 N HIS A 31 2.998 -16.303 -13.678 1.00 0.00 N ATOM 476 CA HIS A 31 2.588 -16.083 -15.098 1.00 0.00 C ATOM 477 C HIS A 31 2.729 -14.607 -15.482 1.00 0.00 C ATOM 478 O HIS A 31 2.570 -14.240 -16.629 1.00 0.00 O ATOM 479 CB HIS A 31 1.131 -16.550 -15.190 1.00 0.00 C ATOM 480 CG HIS A 31 0.229 -15.670 -14.368 1.00 0.00 C ATOM 481 ND1 HIS A 31 0.705 -14.760 -13.437 1.00 0.00 N ATOM 482 CD2 HIS A 31 -1.139 -15.564 -14.328 1.00 0.00 C ATOM 483 CE1 HIS A 31 -0.362 -14.154 -12.881 1.00 0.00 C ATOM 484 NE2 HIS A 31 -1.510 -14.607 -13.389 1.00 0.00 N ATOM 0 H HIS A 31 2.254 -16.213 -12.986 1.00 0.00 H new ATOM 0 HA HIS A 31 3.221 -16.637 -15.791 1.00 0.00 H new ATOM 0 HB2 HIS A 31 0.807 -16.538 -16.231 1.00 0.00 H new ATOM 0 HB3 HIS A 31 1.053 -17.581 -14.844 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -1.824 -16.137 -14.934 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -0.296 -13.394 -12.117 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -2.455 -14.315 -13.142 1.00 0.00 H new ATOM 492 N MET A 32 3.171 -13.786 -14.570 1.00 0.00 N ATOM 493 CA MET A 32 3.491 -12.375 -14.934 1.00 0.00 C ATOM 494 C MET A 32 4.998 -12.130 -14.812 1.00 0.00 C ATOM 495 O MET A 32 5.515 -11.138 -15.284 1.00 0.00 O ATOM 496 CB MET A 32 2.725 -11.516 -13.929 1.00 0.00 C ATOM 497 CG MET A 32 1.226 -11.610 -14.211 1.00 0.00 C ATOM 498 SD MET A 32 0.890 -11.017 -15.887 1.00 0.00 S ATOM 499 CE MET A 32 1.283 -9.275 -15.594 1.00 0.00 C ATOM 0 H MET A 32 3.324 -14.029 -13.591 1.00 0.00 H new ATOM 0 HA MET A 32 3.210 -12.141 -15.961 1.00 0.00 H new ATOM 0 HB2 MET A 32 2.936 -11.851 -12.914 1.00 0.00 H new ATOM 0 HB3 MET A 32 3.054 -10.479 -13.997 1.00 0.00 H new ATOM 0 HG2 MET A 32 0.889 -12.641 -14.104 1.00 0.00 H new ATOM 0 HG3 MET A 32 0.670 -11.016 -13.485 1.00 0.00 H new ATOM 0 HE1 MET A 32 0.608 -8.647 -16.176 1.00 0.00 H new ATOM 0 HE2 MET A 32 1.166 -9.049 -14.534 1.00 0.00 H new ATOM 0 HE3 MET A 32 2.312 -9.079 -15.895 1.00 0.00 H new ATOM 509 N LEU A 33 5.711 -13.052 -14.224 1.00 0.00 N ATOM 510 CA LEU A 33 7.190 -12.903 -14.118 1.00 0.00 C ATOM 511 C LEU A 33 7.829 -13.058 -15.497 1.00 0.00 C ATOM 512 O LEU A 33 8.876 -12.508 -15.777 1.00 0.00 O ATOM 513 CB LEU A 33 7.637 -14.032 -13.187 1.00 0.00 C ATOM 514 CG LEU A 33 7.459 -13.603 -11.729 1.00 0.00 C ATOM 515 CD1 LEU A 33 7.454 -14.840 -10.829 1.00 0.00 C ATOM 516 CD2 LEU A 33 8.621 -12.694 -11.331 1.00 0.00 C ATOM 0 H LEU A 33 5.332 -13.904 -13.811 1.00 0.00 H new ATOM 0 HA LEU A 33 7.484 -11.925 -13.738 1.00 0.00 H new ATOM 0 HB2 LEU A 33 7.054 -14.931 -13.385 1.00 0.00 H new ATOM 0 HB3 LEU A 33 8.681 -14.281 -13.378 1.00 0.00 H new ATOM 0 HG LEU A 33 6.515 -13.069 -11.617 1.00 0.00 H new ATOM 0 HD11 LEU A 33 7.327 -14.534 -9.791 1.00 0.00 H new ATOM 0 HD12 LEU A 33 6.633 -15.496 -11.117 1.00 0.00 H new ATOM 0 HD13 LEU A 33 8.399 -15.373 -10.937 1.00 0.00 H new ATOM 0 HD21 LEU A 33 8.501 -12.384 -10.293 1.00 0.00 H new ATOM 0 HD22 LEU A 33 9.561 -13.235 -11.442 1.00 0.00 H new ATOM 0 HD23 LEU A 33 8.631 -11.814 -11.974 1.00 0.00 H new ATOM 528 N ASP A 34 7.243 -13.869 -16.329 1.00 0.00 N ATOM 529 CA ASP A 34 7.844 -14.145 -17.662 1.00 0.00 C ATOM 530 C ASP A 34 7.538 -13.012 -18.648 1.00 0.00 C ATOM 531 O ASP A 34 6.409 -12.579 -18.776 1.00 0.00 O ATOM 532 CB ASP A 34 7.174 -15.440 -18.113 1.00 0.00 C ATOM 533 CG ASP A 34 7.695 -16.606 -17.270 1.00 0.00 C ATOM 534 OD1 ASP A 34 8.755 -16.462 -16.685 1.00 0.00 O ATOM 535 OD2 ASP A 34 7.026 -17.625 -17.227 1.00 0.00 O ATOM 0 H ASP A 34 6.367 -14.357 -16.142 1.00 0.00 H new ATOM 0 HA ASP A 34 8.930 -14.224 -17.617 1.00 0.00 H new ATOM 0 HB2 ASP A 34 6.092 -15.357 -18.009 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.380 -15.620 -19.168 1.00 0.00 H new ATOM 540 N GLY A 35 8.496 -12.646 -19.457 1.00 0.00 N ATOM 541 CA GLY A 35 8.214 -11.682 -20.560 1.00 0.00 C ATOM 542 C GLY A 35 8.503 -10.247 -20.110 1.00 0.00 C ATOM 543 O GLY A 35 8.909 -9.415 -20.897 1.00 0.00 O ATOM 0 H GLY A 35 9.461 -12.972 -19.402 1.00 0.00 H new ATOM 0 HA2 GLY A 35 8.825 -11.926 -21.429 1.00 0.00 H new ATOM 0 HA3 GLY A 35 7.172 -11.769 -20.869 1.00 0.00 H new ATOM 547 N LEU A 36 8.189 -9.913 -18.886 1.00 0.00 N ATOM 548 CA LEU A 36 8.329 -8.493 -18.449 1.00 0.00 C ATOM 549 C LEU A 36 9.792 -8.149 -18.152 1.00 0.00 C ATOM 550 O LEU A 36 10.541 -8.954 -17.633 1.00 0.00 O ATOM 551 CB LEU A 36 7.488 -8.377 -17.178 1.00 0.00 C ATOM 552 CG LEU A 36 7.570 -6.943 -16.649 1.00 0.00 C ATOM 553 CD1 LEU A 36 6.974 -5.982 -17.681 1.00 0.00 C ATOM 554 CD2 LEU A 36 6.786 -6.834 -15.341 1.00 0.00 C ATOM 0 H LEU A 36 7.844 -10.557 -18.174 1.00 0.00 H new ATOM 0 HA LEU A 36 7.999 -7.803 -19.226 1.00 0.00 H new ATOM 0 HB2 LEU A 36 6.452 -8.641 -17.388 1.00 0.00 H new ATOM 0 HB3 LEU A 36 7.849 -9.077 -16.424 1.00 0.00 H new ATOM 0 HG LEU A 36 8.613 -6.683 -16.470 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.033 -4.961 -17.304 1.00 0.00 H new ATOM 0 HD12 LEU A 36 7.533 -6.057 -18.614 1.00 0.00 H new ATOM 0 HD13 LEU A 36 5.931 -6.243 -17.861 1.00 0.00 H new ATOM 0 HD21 LEU A 36 6.845 -5.812 -14.965 1.00 0.00 H new ATOM 0 HD22 LEU A 36 5.743 -7.095 -15.519 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.210 -7.516 -14.605 1.00 0.00 H new ATOM 566 N GLU A 37 10.171 -6.923 -18.394 1.00 0.00 N ATOM 567 CA GLU A 37 11.544 -6.467 -18.038 1.00 0.00 C ATOM 568 C GLU A 37 11.509 -4.975 -17.693 1.00 0.00 C ATOM 569 O GLU A 37 10.510 -4.314 -17.882 1.00 0.00 O ATOM 570 CB GLU A 37 12.388 -6.708 -19.292 1.00 0.00 C ATOM 571 CG GLU A 37 11.918 -5.778 -20.412 1.00 0.00 C ATOM 572 CD GLU A 37 12.761 -6.020 -21.665 1.00 0.00 C ATOM 573 OE1 GLU A 37 13.805 -6.638 -21.542 1.00 0.00 O ATOM 574 OE2 GLU A 37 12.350 -5.578 -22.725 1.00 0.00 O ATOM 0 H GLU A 37 9.582 -6.212 -18.827 1.00 0.00 H new ATOM 0 HA GLU A 37 11.951 -6.995 -17.176 1.00 0.00 H new ATOM 0 HB2 GLU A 37 13.441 -6.529 -19.074 1.00 0.00 H new ATOM 0 HB3 GLU A 37 12.300 -7.748 -19.608 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.865 -5.957 -20.629 1.00 0.00 H new ATOM 0 HG3 GLU A 37 12.006 -4.738 -20.097 1.00 0.00 H new ATOM 581 N THR A 38 12.577 -4.441 -17.166 1.00 0.00 N ATOM 582 CA THR A 38 12.566 -2.997 -16.791 1.00 0.00 C ATOM 583 C THR A 38 12.368 -2.130 -18.043 1.00 0.00 C ATOM 584 O THR A 38 12.674 -2.539 -19.146 1.00 0.00 O ATOM 585 CB THR A 38 13.933 -2.733 -16.165 1.00 0.00 C ATOM 586 OG1 THR A 38 14.819 -3.794 -16.489 1.00 0.00 O ATOM 587 CG2 THR A 38 13.792 -2.621 -14.645 1.00 0.00 C ATOM 0 H THR A 38 13.449 -4.936 -16.980 1.00 0.00 H new ATOM 0 HA THR A 38 11.755 -2.756 -16.103 1.00 0.00 H new ATOM 0 HB THR A 38 14.334 -1.798 -16.557 1.00 0.00 H new ATOM 0 HG1 THR A 38 15.696 -3.622 -16.088 1.00 0.00 H new ATOM 0 HG21 THR A 38 14.770 -2.433 -14.202 1.00 0.00 H new ATOM 0 HG22 THR A 38 13.119 -1.799 -14.402 1.00 0.00 H new ATOM 0 HG23 THR A 38 13.387 -3.552 -14.248 1.00 0.00 H new ATOM 595 N GLY A 39 11.790 -0.967 -17.891 1.00 0.00 N ATOM 596 CA GLY A 39 11.492 -0.113 -19.077 1.00 0.00 C ATOM 597 C GLY A 39 10.239 -0.637 -19.785 1.00 0.00 C ATOM 598 O GLY A 39 9.735 -0.026 -20.707 1.00 0.00 O ATOM 0 H GLY A 39 11.511 -0.571 -16.993 1.00 0.00 H new ATOM 0 HA2 GLY A 39 11.340 0.920 -18.765 1.00 0.00 H new ATOM 0 HA3 GLY A 39 12.339 -0.118 -19.763 1.00 0.00 H new ATOM 602 N ALA A 40 9.695 -1.728 -19.318 1.00 0.00 N ATOM 603 CA ALA A 40 8.435 -2.253 -19.914 1.00 0.00 C ATOM 604 C ALA A 40 7.252 -1.425 -19.416 1.00 0.00 C ATOM 605 O ALA A 40 7.331 -0.796 -18.378 1.00 0.00 O ATOM 606 CB ALA A 40 8.336 -3.687 -19.401 1.00 0.00 C ATOM 0 H ALA A 40 10.071 -2.280 -18.547 1.00 0.00 H new ATOM 0 HA ALA A 40 8.428 -2.207 -21.003 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.432 -4.152 -19.793 1.00 0.00 H new ATOM 0 HB2 ALA A 40 9.207 -4.252 -19.731 1.00 0.00 H new ATOM 0 HB3 ALA A 40 8.298 -3.682 -18.312 1.00 0.00 H new ATOM 612 N SER A 41 6.146 -1.433 -20.114 1.00 0.00 N ATOM 613 CA SER A 41 4.978 -0.658 -19.624 1.00 0.00 C ATOM 614 C SER A 41 3.976 -1.592 -18.949 1.00 0.00 C ATOM 615 O SER A 41 3.262 -2.325 -19.598 1.00 0.00 O ATOM 616 CB SER A 41 4.370 -0.023 -20.871 1.00 0.00 C ATOM 617 OG SER A 41 4.703 -0.806 -22.009 1.00 0.00 O ATOM 0 H SER A 41 6.006 -1.937 -20.990 1.00 0.00 H new ATOM 0 HA SER A 41 5.259 0.093 -18.886 1.00 0.00 H new ATOM 0 HB2 SER A 41 3.287 0.045 -20.767 1.00 0.00 H new ATOM 0 HB3 SER A 41 4.743 0.994 -20.994 1.00 0.00 H new ATOM 0 HG SER A 41 4.519 -1.750 -21.822 1.00 0.00 H new ATOM 623 N VAL A 42 3.848 -1.496 -17.657 1.00 0.00 N ATOM 624 CA VAL A 42 2.808 -2.293 -16.951 1.00 0.00 C ATOM 625 C VAL A 42 1.591 -1.408 -16.688 1.00 0.00 C ATOM 626 O VAL A 42 1.689 -0.381 -16.051 1.00 0.00 O ATOM 627 CB VAL A 42 3.472 -2.746 -15.635 1.00 0.00 C ATOM 628 CG1 VAL A 42 2.452 -2.843 -14.506 1.00 0.00 C ATOM 629 CG2 VAL A 42 4.076 -4.126 -15.825 1.00 0.00 C ATOM 0 H VAL A 42 4.419 -0.900 -17.058 1.00 0.00 H new ATOM 0 HA VAL A 42 2.460 -3.151 -17.527 1.00 0.00 H new ATOM 0 HB VAL A 42 4.233 -2.010 -15.377 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.951 -3.165 -13.592 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.993 -1.867 -14.345 1.00 0.00 H new ATOM 0 HG13 VAL A 42 1.682 -3.567 -14.773 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.546 -4.448 -14.896 1.00 0.00 H new ATOM 0 HG22 VAL A 42 3.292 -4.832 -16.099 1.00 0.00 H new ATOM 0 HG23 VAL A 42 4.824 -4.090 -16.617 1.00 0.00 H new ATOM 639 N ALA A 43 0.433 -1.875 -17.037 1.00 0.00 N ATOM 640 CA ALA A 43 -0.790 -1.140 -16.647 1.00 0.00 C ATOM 641 C ALA A 43 -1.347 -1.739 -15.358 1.00 0.00 C ATOM 642 O ALA A 43 -1.715 -2.898 -15.311 1.00 0.00 O ATOM 643 CB ALA A 43 -1.769 -1.337 -17.801 1.00 0.00 C ATOM 0 H ALA A 43 0.281 -2.730 -17.573 1.00 0.00 H new ATOM 0 HA ALA A 43 -0.603 -0.082 -16.465 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -2.701 -0.818 -17.580 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -1.337 -0.934 -18.717 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -1.968 -2.401 -17.931 1.00 0.00 H new ATOM 649 N HIS A 44 -1.442 -0.951 -14.325 1.00 0.00 N ATOM 650 CA HIS A 44 -2.023 -1.461 -13.053 1.00 0.00 C ATOM 651 C HIS A 44 -3.538 -1.257 -13.086 1.00 0.00 C ATOM 652 O HIS A 44 -4.023 -0.149 -13.198 1.00 0.00 O ATOM 653 CB HIS A 44 -1.374 -0.623 -11.952 1.00 0.00 C ATOM 654 CG HIS A 44 -0.065 -1.243 -11.532 1.00 0.00 C ATOM 655 ND1 HIS A 44 0.800 -1.870 -12.431 1.00 0.00 N ATOM 656 CD2 HIS A 44 0.546 -1.333 -10.305 1.00 0.00 C ATOM 657 CE1 HIS A 44 1.868 -2.300 -11.729 1.00 0.00 C ATOM 658 NE2 HIS A 44 1.757 -1.996 -10.437 1.00 0.00 N ATOM 0 H HIS A 44 -1.143 0.024 -14.306 1.00 0.00 H new ATOM 0 HA HIS A 44 -1.841 -2.523 -12.892 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -1.206 0.393 -12.309 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -2.044 -0.553 -11.095 1.00 0.00 H new ATOM 0 HD1 HIS A 44 0.651 -1.982 -13.434 1.00 0.00 H new ATOM 0 HD2 HIS A 44 0.145 -0.947 -9.380 1.00 0.00 H new ATOM 0 HE1 HIS A 44 2.708 -2.825 -12.160 1.00 0.00 H new ATOM 667 N ASN A 45 -4.255 -2.328 -13.250 1.00 0.00 N ATOM 668 CA ASN A 45 -5.703 -2.236 -13.577 1.00 0.00 C ATOM 669 C ASN A 45 -5.927 -1.388 -14.832 1.00 0.00 C ATOM 670 O ASN A 45 -7.049 -1.107 -15.194 1.00 0.00 O ATOM 671 CB ASN A 45 -6.363 -1.586 -12.366 1.00 0.00 C ATOM 672 CG ASN A 45 -7.747 -2.203 -12.179 1.00 0.00 C ATOM 673 OD1 ASN A 45 -8.686 -1.836 -12.857 1.00 0.00 O ATOM 674 ND2 ASN A 45 -7.913 -3.132 -11.281 1.00 0.00 N ATOM 0 H ASN A 45 -3.895 -3.279 -13.170 1.00 0.00 H new ATOM 0 HA ASN A 45 -6.125 -3.219 -13.785 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -5.755 -1.742 -11.475 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -6.445 -0.509 -12.512 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -8.832 -3.553 -11.146 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -7.124 -3.439 -10.713 1.00 0.00 H new ATOM 681 N GLY A 46 -4.892 -1.108 -15.581 1.00 0.00 N ATOM 682 CA GLY A 46 -5.096 -0.426 -16.888 1.00 0.00 C ATOM 683 C GLY A 46 -4.406 0.943 -16.896 1.00 0.00 C ATOM 684 O GLY A 46 -4.384 1.615 -17.903 1.00 0.00 O ATOM 0 H GLY A 46 -3.923 -1.321 -15.345 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -4.698 -1.044 -17.693 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -6.162 -0.303 -17.078 1.00 0.00 H new ATOM 688 N CYS A 47 -3.768 1.335 -15.822 1.00 0.00 N ATOM 689 CA CYS A 47 -3.012 2.622 -15.850 1.00 0.00 C ATOM 690 C CYS A 47 -1.553 2.347 -16.218 1.00 0.00 C ATOM 691 O CYS A 47 -0.836 1.705 -15.479 1.00 0.00 O ATOM 692 CB CYS A 47 -3.117 3.188 -14.432 1.00 0.00 C ATOM 693 SG CYS A 47 -2.444 4.868 -14.407 1.00 0.00 S ATOM 0 H CYS A 47 -3.738 0.827 -14.938 1.00 0.00 H new ATOM 0 HA CYS A 47 -3.407 3.323 -16.585 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -4.158 3.196 -14.107 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -2.570 2.554 -13.734 1.00 0.00 H new ATOM 0 HG CYS A 47 -3.188 5.622 -13.654 1.00 0.00 H new ATOM 699 N CYS A 48 -1.168 2.667 -17.424 1.00 0.00 N ATOM 700 CA CYS A 48 0.175 2.236 -17.906 1.00 0.00 C ATOM 701 C CYS A 48 1.287 3.058 -17.252 1.00 0.00 C ATOM 702 O CYS A 48 1.322 4.268 -17.348 1.00 0.00 O ATOM 703 CB CYS A 48 0.157 2.480 -19.416 1.00 0.00 C ATOM 704 SG CYS A 48 -0.215 4.221 -19.741 1.00 0.00 S ATOM 0 H CYS A 48 -1.721 3.204 -18.092 1.00 0.00 H new ATOM 0 HA CYS A 48 0.372 1.193 -17.656 1.00 0.00 H new ATOM 0 HB2 CYS A 48 1.122 2.216 -19.849 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -0.590 1.843 -19.889 1.00 0.00 H new ATOM 0 HG CYS A 48 -1.500 4.374 -19.869 1.00 0.00 H new ATOM 710 N LEU A 49 2.264 2.388 -16.713 1.00 0.00 N ATOM 711 CA LEU A 49 3.469 3.092 -16.193 1.00 0.00 C ATOM 712 C LEU A 49 4.704 2.214 -16.427 1.00 0.00 C ATOM 713 O LEU A 49 4.586 1.066 -16.799 1.00 0.00 O ATOM 714 CB LEU A 49 3.206 3.304 -14.700 1.00 0.00 C ATOM 715 CG LEU A 49 2.573 2.050 -14.095 1.00 0.00 C ATOM 716 CD1 LEU A 49 3.253 1.746 -12.761 1.00 0.00 C ATOM 717 CD2 LEU A 49 1.076 2.291 -13.865 1.00 0.00 C ATOM 0 H LEU A 49 2.281 1.373 -16.609 1.00 0.00 H new ATOM 0 HA LEU A 49 3.653 4.044 -16.690 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.140 3.533 -14.187 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.546 4.159 -14.557 1.00 0.00 H new ATOM 0 HG LEU A 49 2.700 1.207 -14.775 1.00 0.00 H new ATOM 0 HD11 LEU A 49 2.809 0.853 -12.321 1.00 0.00 H new ATOM 0 HD12 LEU A 49 4.317 1.578 -12.925 1.00 0.00 H new ATOM 0 HD13 LEU A 49 3.119 2.589 -12.084 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.626 1.397 -13.434 1.00 0.00 H new ATOM 0 HD22 LEU A 49 0.943 3.130 -13.182 1.00 0.00 H new ATOM 0 HD23 LEU A 49 0.594 2.518 -14.816 1.00 0.00 H new ATOM 729 N THR A 50 5.876 2.786 -16.404 1.00 0.00 N ATOM 730 CA THR A 50 7.078 2.012 -16.846 1.00 0.00 C ATOM 731 C THR A 50 7.808 1.396 -15.652 1.00 0.00 C ATOM 732 O THR A 50 7.769 1.910 -14.549 1.00 0.00 O ATOM 733 CB THR A 50 7.982 3.026 -17.552 1.00 0.00 C ATOM 734 OG1 THR A 50 7.222 3.752 -18.507 1.00 0.00 O ATOM 735 CG2 THR A 50 9.125 2.287 -18.259 1.00 0.00 C ATOM 0 H THR A 50 6.056 3.744 -16.103 1.00 0.00 H new ATOM 0 HA THR A 50 6.797 1.186 -17.500 1.00 0.00 H new ATOM 0 HB THR A 50 8.397 3.717 -16.818 1.00 0.00 H new ATOM 0 HG1 THR A 50 7.799 4.403 -18.958 1.00 0.00 H new ATOM 0 HG21 THR A 50 9.769 3.009 -18.762 1.00 0.00 H new ATOM 0 HG22 THR A 50 9.708 1.731 -17.525 1.00 0.00 H new ATOM 0 HG23 THR A 50 8.712 1.596 -18.994 1.00 0.00 H new ATOM 743 N VAL A 51 8.494 0.308 -15.880 1.00 0.00 N ATOM 744 CA VAL A 51 9.260 -0.343 -14.780 1.00 0.00 C ATOM 745 C VAL A 51 10.550 0.432 -14.510 1.00 0.00 C ATOM 746 O VAL A 51 11.490 0.367 -15.275 1.00 0.00 O ATOM 747 CB VAL A 51 9.590 -1.745 -15.301 1.00 0.00 C ATOM 748 CG1 VAL A 51 10.195 -2.579 -14.177 1.00 0.00 C ATOM 749 CG2 VAL A 51 8.316 -2.411 -15.814 1.00 0.00 C ATOM 0 H VAL A 51 8.556 -0.159 -16.785 1.00 0.00 H new ATOM 0 HA VAL A 51 8.696 -0.372 -13.848 1.00 0.00 H new ATOM 0 HB VAL A 51 10.309 -1.670 -16.117 1.00 0.00 H new ATOM 0 HG11 VAL A 51 10.429 -3.576 -14.549 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.107 -2.101 -13.820 1.00 0.00 H new ATOM 0 HG13 VAL A 51 9.481 -2.656 -13.357 1.00 0.00 H new ATOM 0 HG21 VAL A 51 8.551 -3.409 -16.185 1.00 0.00 H new ATOM 0 HG22 VAL A 51 7.593 -2.487 -15.002 1.00 0.00 H new ATOM 0 HG23 VAL A 51 7.893 -1.814 -16.622 1.00 0.00 H new ATOM 759 N THR A 52 10.649 1.061 -13.374 1.00 0.00 N ATOM 760 CA THR A 52 11.932 1.714 -12.999 1.00 0.00 C ATOM 761 C THR A 52 12.982 0.648 -12.712 1.00 0.00 C ATOM 762 O THR A 52 14.134 0.779 -13.074 1.00 0.00 O ATOM 763 CB THR A 52 11.622 2.506 -11.731 1.00 0.00 C ATOM 764 OG1 THR A 52 11.369 1.606 -10.661 1.00 0.00 O ATOM 765 CG2 THR A 52 10.394 3.378 -11.968 1.00 0.00 C ATOM 0 H THR A 52 9.898 1.151 -12.690 1.00 0.00 H new ATOM 0 HA THR A 52 12.321 2.354 -13.791 1.00 0.00 H new ATOM 0 HB THR A 52 12.473 3.138 -11.477 1.00 0.00 H new ATOM 0 HG1 THR A 52 10.786 0.883 -10.973 1.00 0.00 H new ATOM 0 HG21 THR A 52 10.170 3.945 -11.064 1.00 0.00 H new ATOM 0 HG22 THR A 52 10.590 4.067 -12.789 1.00 0.00 H new ATOM 0 HG23 THR A 52 9.542 2.746 -12.220 1.00 0.00 H new ATOM 773 N GLU A 53 12.591 -0.412 -12.060 1.00 0.00 N ATOM 774 CA GLU A 53 13.577 -1.486 -11.752 1.00 0.00 C ATOM 775 C GLU A 53 12.868 -2.802 -11.434 1.00 0.00 C ATOM 776 O GLU A 53 11.780 -2.817 -10.911 1.00 0.00 O ATOM 777 CB GLU A 53 14.334 -0.981 -10.523 1.00 0.00 C ATOM 778 CG GLU A 53 15.385 -2.013 -10.110 1.00 0.00 C ATOM 779 CD GLU A 53 16.142 -1.508 -8.881 1.00 0.00 C ATOM 780 OE1 GLU A 53 15.965 -0.351 -8.534 1.00 0.00 O ATOM 781 OE2 GLU A 53 16.887 -2.285 -8.306 1.00 0.00 O ATOM 0 H GLU A 53 11.641 -0.581 -11.730 1.00 0.00 H new ATOM 0 HA GLU A 53 14.238 -1.685 -12.596 1.00 0.00 H new ATOM 0 HB2 GLU A 53 14.813 -0.027 -10.745 1.00 0.00 H new ATOM 0 HB3 GLU A 53 13.639 -0.805 -9.702 1.00 0.00 H new ATOM 0 HG2 GLU A 53 14.906 -2.967 -9.888 1.00 0.00 H new ATOM 0 HG3 GLU A 53 16.080 -2.189 -10.931 1.00 0.00 H new ATOM 788 N ILE A 54 13.545 -3.899 -11.614 1.00 0.00 N ATOM 789 CA ILE A 54 12.986 -5.209 -11.173 1.00 0.00 C ATOM 790 C ILE A 54 13.774 -5.728 -9.978 1.00 0.00 C ATOM 791 O ILE A 54 14.986 -5.805 -10.001 1.00 0.00 O ATOM 792 CB ILE A 54 13.155 -6.140 -12.370 1.00 0.00 C ATOM 793 CG1 ILE A 54 12.260 -5.661 -13.509 1.00 0.00 C ATOM 794 CG2 ILE A 54 12.756 -7.560 -11.968 1.00 0.00 C ATOM 795 CD1 ILE A 54 12.991 -5.819 -14.845 1.00 0.00 C ATOM 0 H ILE A 54 14.466 -3.947 -12.049 1.00 0.00 H new ATOM 0 HA ILE A 54 11.943 -5.134 -10.866 1.00 0.00 H new ATOM 0 HB ILE A 54 14.195 -6.135 -12.697 1.00 0.00 H new ATOM 0 HG12 ILE A 54 11.333 -6.235 -13.521 1.00 0.00 H new ATOM 0 HG13 ILE A 54 11.987 -4.617 -13.355 1.00 0.00 H new ATOM 0 HG21 ILE A 54 12.876 -8.227 -12.822 1.00 0.00 H new ATOM 0 HG22 ILE A 54 13.392 -7.899 -11.150 1.00 0.00 H new ATOM 0 HG23 ILE A 54 11.715 -7.568 -11.645 1.00 0.00 H new ATOM 0 HD11 ILE A 54 12.347 -5.475 -15.655 1.00 0.00 H new ATOM 0 HD12 ILE A 54 13.905 -5.226 -14.832 1.00 0.00 H new ATOM 0 HD13 ILE A 54 13.241 -6.868 -15.001 1.00 0.00 H new ATOM 807 N ASN A 55 13.088 -6.118 -8.950 1.00 0.00 N ATOM 808 CA ASN A 55 13.788 -6.676 -7.762 1.00 0.00 C ATOM 809 C ASN A 55 13.621 -8.192 -7.736 1.00 0.00 C ATOM 810 O ASN A 55 12.899 -8.738 -6.921 1.00 0.00 O ATOM 811 CB ASN A 55 13.111 -6.024 -6.557 1.00 0.00 C ATOM 812 CG ASN A 55 13.671 -4.614 -6.361 1.00 0.00 C ATOM 813 OD1 ASN A 55 14.770 -4.447 -5.871 1.00 0.00 O ATOM 814 ND2 ASN A 55 12.958 -3.586 -6.731 1.00 0.00 N ATOM 0 H ASN A 55 12.071 -6.076 -8.877 1.00 0.00 H new ATOM 0 HA ASN A 55 14.859 -6.475 -7.769 1.00 0.00 H new ATOM 0 HB2 ASN A 55 12.033 -5.981 -6.711 1.00 0.00 H new ATOM 0 HB3 ASN A 55 13.281 -6.623 -5.662 1.00 0.00 H new ATOM 0 HD21 ASN A 55 13.323 -2.641 -6.609 1.00 0.00 H new ATOM 0 HD22 ASN A 55 12.035 -3.727 -7.142 1.00 0.00 H new ATOM 821 N GLY A 56 14.172 -8.865 -8.707 1.00 0.00 N ATOM 822 CA GLY A 56 13.929 -10.328 -8.822 1.00 0.00 C ATOM 823 C GLY A 56 12.523 -10.551 -9.370 1.00 0.00 C ATOM 824 O GLY A 56 12.206 -10.143 -10.469 1.00 0.00 O ATOM 0 H GLY A 56 14.778 -8.466 -9.424 1.00 0.00 H new ATOM 0 HA2 GLY A 56 14.668 -10.783 -9.482 1.00 0.00 H new ATOM 0 HA3 GLY A 56 14.035 -10.806 -7.848 1.00 0.00 H new ATOM 828 N ASN A 57 11.655 -11.134 -8.593 1.00 0.00 N ATOM 829 CA ASN A 57 10.256 -11.300 -9.065 1.00 0.00 C ATOM 830 C ASN A 57 9.499 -9.975 -8.873 1.00 0.00 C ATOM 831 O ASN A 57 8.464 -9.748 -9.465 1.00 0.00 O ATOM 832 CB ASN A 57 9.679 -12.451 -8.216 1.00 0.00 C ATOM 833 CG ASN A 57 8.679 -11.934 -7.181 1.00 0.00 C ATOM 834 OD1 ASN A 57 7.560 -11.443 -7.617 1.00 0.00 O flip ATOM 835 ND2 ASN A 57 8.917 -11.981 -5.991 1.00 0.00 N flip ATOM 0 H ASN A 57 11.852 -11.499 -7.661 1.00 0.00 H new ATOM 0 HA ASN A 57 10.176 -11.542 -10.125 1.00 0.00 H new ATOM 0 HB2 ASN A 57 9.189 -13.175 -8.867 1.00 0.00 H new ATOM 0 HB3 ASN A 57 10.490 -12.974 -7.710 1.00 0.00 H new ATOM 0 HD21 ASN A 57 9.801 -12.370 -5.663 1.00 0.00 H new ATOM 0 HD22 ASN A 57 8.233 -11.632 -5.320 1.00 0.00 H new ATOM 842 N HIS A 58 9.998 -9.114 -8.023 1.00 0.00 N ATOM 843 CA HIS A 58 9.295 -7.822 -7.769 1.00 0.00 C ATOM 844 C HIS A 58 9.536 -6.862 -8.922 1.00 0.00 C ATOM 845 O HIS A 58 10.541 -6.935 -9.596 1.00 0.00 O ATOM 846 CB HIS A 58 9.934 -7.256 -6.509 1.00 0.00 C ATOM 847 CG HIS A 58 9.294 -7.860 -5.287 1.00 0.00 C ATOM 848 ND1 HIS A 58 10.044 -8.395 -4.251 1.00 0.00 N ATOM 849 CD2 HIS A 58 7.978 -8.005 -4.907 1.00 0.00 C ATOM 850 CE1 HIS A 58 9.185 -8.828 -3.309 1.00 0.00 C ATOM 851 NE2 HIS A 58 7.915 -8.616 -3.661 1.00 0.00 N ATOM 0 H HIS A 58 10.860 -9.250 -7.495 1.00 0.00 H new ATOM 0 HA HIS A 58 8.219 -7.964 -7.665 1.00 0.00 H new ATOM 0 HB2 HIS A 58 11.004 -7.465 -6.509 1.00 0.00 H new ATOM 0 HB3 HIS A 58 9.821 -6.172 -6.490 1.00 0.00 H new ATOM 0 HD1 HIS A 58 11.062 -8.450 -4.210 1.00 0.00 H new ATOM 0 HD2 HIS A 58 7.124 -7.691 -5.490 1.00 0.00 H new ATOM 0 HE1 HIS A 58 9.487 -9.291 -2.381 1.00 0.00 H new ATOM 859 N VAL A 59 8.695 -5.884 -9.078 1.00 0.00 N ATOM 860 CA VAL A 59 8.974 -4.847 -10.101 1.00 0.00 C ATOM 861 C VAL A 59 8.575 -3.456 -9.597 1.00 0.00 C ATOM 862 O VAL A 59 7.441 -3.213 -9.245 1.00 0.00 O ATOM 863 CB VAL A 59 8.142 -5.273 -11.300 1.00 0.00 C ATOM 864 CG1 VAL A 59 8.149 -4.160 -12.337 1.00 0.00 C ATOM 865 CG2 VAL A 59 8.764 -6.535 -11.900 1.00 0.00 C ATOM 0 H VAL A 59 7.834 -5.758 -8.546 1.00 0.00 H new ATOM 0 HA VAL A 59 10.033 -4.771 -10.346 1.00 0.00 H new ATOM 0 HB VAL A 59 7.115 -5.473 -10.994 1.00 0.00 H new ATOM 0 HG11 VAL A 59 7.553 -4.462 -13.199 1.00 0.00 H new ATOM 0 HG12 VAL A 59 7.725 -3.255 -11.902 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.173 -3.965 -12.654 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.179 -6.855 -12.762 1.00 0.00 H new ATOM 0 HG22 VAL A 59 9.786 -6.323 -12.214 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.771 -7.328 -11.152 1.00 0.00 H new ATOM 875 N SER A 60 9.510 -2.545 -9.573 1.00 0.00 N ATOM 876 CA SER A 60 9.222 -1.156 -9.108 1.00 0.00 C ATOM 877 C SER A 60 8.829 -0.279 -10.299 1.00 0.00 C ATOM 878 O SER A 60 9.543 -0.205 -11.277 1.00 0.00 O ATOM 879 CB SER A 60 10.544 -0.669 -8.516 1.00 0.00 C ATOM 880 OG SER A 60 11.006 -1.611 -7.557 1.00 0.00 O ATOM 0 H SER A 60 10.475 -2.706 -9.860 1.00 0.00 H new ATOM 0 HA SER A 60 8.403 -1.116 -8.390 1.00 0.00 H new ATOM 0 HB2 SER A 60 11.285 -0.544 -9.306 1.00 0.00 H new ATOM 0 HB3 SER A 60 10.409 0.306 -8.048 1.00 0.00 H new ATOM 0 HG SER A 60 11.855 -1.302 -7.177 1.00 0.00 H new ATOM 886 N PHE A 61 7.715 0.401 -10.229 1.00 0.00 N ATOM 887 CA PHE A 61 7.316 1.278 -11.369 1.00 0.00 C ATOM 888 C PHE A 61 7.395 2.752 -10.957 1.00 0.00 C ATOM 889 O PHE A 61 7.396 3.077 -9.788 1.00 0.00 O ATOM 890 CB PHE A 61 5.867 0.910 -11.682 1.00 0.00 C ATOM 891 CG PHE A 61 5.740 -0.578 -11.895 1.00 0.00 C ATOM 892 CD1 PHE A 61 5.908 -1.122 -13.177 1.00 0.00 C ATOM 893 CD2 PHE A 61 5.438 -1.415 -10.812 1.00 0.00 C ATOM 894 CE1 PHE A 61 5.773 -2.503 -13.375 1.00 0.00 C ATOM 895 CE2 PHE A 61 5.306 -2.795 -11.009 1.00 0.00 C ATOM 896 CZ PHE A 61 5.471 -3.339 -12.291 1.00 0.00 C ATOM 0 H PHE A 61 7.069 0.388 -9.440 1.00 0.00 H new ATOM 0 HA PHE A 61 7.971 1.139 -12.229 1.00 0.00 H new ATOM 0 HB2 PHE A 61 5.220 1.224 -10.863 1.00 0.00 H new ATOM 0 HB3 PHE A 61 5.534 1.442 -12.573 1.00 0.00 H new ATOM 0 HD1 PHE A 61 6.141 -0.477 -14.011 1.00 0.00 H new ATOM 0 HD2 PHE A 61 5.307 -0.995 -9.825 1.00 0.00 H new ATOM 0 HE1 PHE A 61 5.902 -2.923 -14.362 1.00 0.00 H new ATOM 0 HE2 PHE A 61 5.077 -3.440 -10.174 1.00 0.00 H new ATOM 0 HZ PHE A 61 5.365 -4.403 -12.443 1.00 0.00 H new ATOM 906 N ASP A 62 7.456 3.646 -11.909 1.00 0.00 N ATOM 907 CA ASP A 62 7.530 5.099 -11.560 1.00 0.00 C ATOM 908 C ASP A 62 6.145 5.724 -11.498 1.00 0.00 C ATOM 909 O ASP A 62 5.219 5.308 -12.166 1.00 0.00 O ATOM 910 CB ASP A 62 8.350 5.749 -12.675 1.00 0.00 C ATOM 911 CG ASP A 62 7.647 5.533 -14.015 1.00 0.00 C ATOM 912 OD1 ASP A 62 6.789 4.666 -14.079 1.00 0.00 O ATOM 913 OD2 ASP A 62 7.975 6.238 -14.956 1.00 0.00 O ATOM 0 H ASP A 62 7.458 3.437 -12.907 1.00 0.00 H new ATOM 0 HA ASP A 62 7.981 5.243 -10.578 1.00 0.00 H new ATOM 0 HB2 ASP A 62 8.467 6.815 -12.481 1.00 0.00 H new ATOM 0 HB3 ASP A 62 9.351 5.318 -12.703 1.00 0.00 H new ATOM 918 N LEU A 63 5.995 6.698 -10.651 1.00 0.00 N ATOM 919 CA LEU A 63 4.672 7.337 -10.468 1.00 0.00 C ATOM 920 C LEU A 63 4.865 8.755 -9.926 1.00 0.00 C ATOM 921 O LEU A 63 5.386 8.945 -8.846 1.00 0.00 O ATOM 922 CB LEU A 63 3.983 6.450 -9.436 1.00 0.00 C ATOM 923 CG LEU A 63 2.743 5.797 -10.049 1.00 0.00 C ATOM 924 CD1 LEU A 63 2.859 4.279 -9.894 1.00 0.00 C ATOM 925 CD2 LEU A 63 1.479 6.293 -9.327 1.00 0.00 C ATOM 0 H LEU A 63 6.742 7.082 -10.072 1.00 0.00 H new ATOM 0 HA LEU A 63 4.095 7.425 -11.389 1.00 0.00 H new ATOM 0 HB2 LEU A 63 4.673 5.682 -9.086 1.00 0.00 H new ATOM 0 HB3 LEU A 63 3.699 7.043 -8.567 1.00 0.00 H new ATOM 0 HG LEU A 63 2.673 6.060 -11.104 1.00 0.00 H new ATOM 0 HD11 LEU A 63 1.981 3.801 -10.327 1.00 0.00 H new ATOM 0 HD12 LEU A 63 3.754 3.928 -10.408 1.00 0.00 H new ATOM 0 HD13 LEU A 63 2.925 4.025 -8.836 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.600 5.824 -9.769 1.00 0.00 H new ATOM 0 HD22 LEU A 63 1.537 6.032 -8.270 1.00 0.00 H new ATOM 0 HD23 LEU A 63 1.403 7.375 -9.429 1.00 0.00 H new ATOM 937 N MET A 64 4.439 9.752 -10.649 1.00 0.00 N ATOM 938 CA MET A 64 4.595 11.144 -10.137 1.00 0.00 C ATOM 939 C MET A 64 3.598 11.386 -9.004 1.00 0.00 C ATOM 940 O MET A 64 2.502 10.880 -9.022 1.00 0.00 O ATOM 941 CB MET A 64 4.294 12.055 -11.330 1.00 0.00 C ATOM 942 CG MET A 64 5.387 11.903 -12.387 1.00 0.00 C ATOM 943 SD MET A 64 6.843 12.853 -11.888 1.00 0.00 S ATOM 944 CE MET A 64 6.213 14.487 -12.340 1.00 0.00 C ATOM 0 H MET A 64 3.994 9.667 -11.563 1.00 0.00 H new ATOM 0 HA MET A 64 5.592 11.332 -9.738 1.00 0.00 H new ATOM 0 HB2 MET A 64 3.324 11.801 -11.758 1.00 0.00 H new ATOM 0 HB3 MET A 64 4.235 13.093 -11.001 1.00 0.00 H new ATOM 0 HG2 MET A 64 5.649 10.852 -12.507 1.00 0.00 H new ATOM 0 HG3 MET A 64 5.025 12.253 -13.354 1.00 0.00 H new ATOM 0 HE1 MET A 64 6.826 14.905 -13.139 1.00 0.00 H new ATOM 0 HE2 MET A 64 5.182 14.398 -12.682 1.00 0.00 H new ATOM 0 HE3 MET A 64 6.251 15.145 -11.472 1.00 0.00 H new ATOM 954 N LYS A 65 3.984 12.115 -7.996 1.00 0.00 N ATOM 955 CA LYS A 65 3.064 12.339 -6.846 1.00 0.00 C ATOM 956 C LYS A 65 1.785 13.031 -7.323 1.00 0.00 C ATOM 957 O LYS A 65 0.690 12.648 -6.964 1.00 0.00 O ATOM 958 CB LYS A 65 3.838 13.251 -5.894 1.00 0.00 C ATOM 959 CG LYS A 65 2.982 13.552 -4.663 1.00 0.00 C ATOM 960 CD LYS A 65 3.761 14.462 -3.713 1.00 0.00 C ATOM 961 CE LYS A 65 2.980 14.630 -2.407 1.00 0.00 C ATOM 962 NZ LYS A 65 3.356 13.449 -1.582 1.00 0.00 N ATOM 0 H LYS A 65 4.896 12.565 -7.918 1.00 0.00 H new ATOM 0 HA LYS A 65 2.765 11.406 -6.368 1.00 0.00 H new ATOM 0 HB2 LYS A 65 4.770 12.773 -5.593 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.105 14.179 -6.400 1.00 0.00 H new ATOM 0 HG2 LYS A 65 2.051 14.033 -4.963 1.00 0.00 H new ATOM 0 HG3 LYS A 65 2.714 12.624 -4.157 1.00 0.00 H new ATOM 0 HD2 LYS A 65 4.743 14.036 -3.509 1.00 0.00 H new ATOM 0 HD3 LYS A 65 3.926 15.434 -4.178 1.00 0.00 H new ATOM 0 HE2 LYS A 65 3.243 15.562 -1.906 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.906 14.659 -2.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.537 13.144 -1.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 3.656 12.672 -2.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.138 13.705 -0.946 1.00 0.00 H new ATOM 976 N GLU A 66 1.909 14.035 -8.143 1.00 0.00 N ATOM 977 CA GLU A 66 0.690 14.726 -8.649 1.00 0.00 C ATOM 978 C GLU A 66 -0.067 13.816 -9.613 1.00 0.00 C ATOM 979 O GLU A 66 -1.261 13.663 -9.509 1.00 0.00 O ATOM 980 CB GLU A 66 1.203 15.980 -9.360 1.00 0.00 C ATOM 981 CG GLU A 66 0.018 16.775 -9.914 1.00 0.00 C ATOM 982 CD GLU A 66 0.529 18.036 -10.613 1.00 0.00 C ATOM 983 OE1 GLU A 66 1.709 18.323 -10.486 1.00 0.00 O ATOM 984 OE2 GLU A 66 -0.267 18.693 -11.263 1.00 0.00 O ATOM 0 H GLU A 66 2.796 14.406 -8.484 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.005 14.980 -7.849 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.775 16.596 -8.666 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.878 15.701 -10.169 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.548 16.162 -10.615 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -0.662 17.045 -9.106 1.00 0.00 H new ATOM 991 N THR A 67 0.630 13.098 -10.448 1.00 0.00 N ATOM 992 CA THR A 67 -0.057 12.072 -11.285 1.00 0.00 C ATOM 993 C THR A 67 -0.730 11.047 -10.375 1.00 0.00 C ATOM 994 O THR A 67 -1.814 10.585 -10.634 1.00 0.00 O ATOM 995 CB THR A 67 1.044 11.403 -12.106 1.00 0.00 C ATOM 996 OG1 THR A 67 1.693 12.377 -12.909 1.00 0.00 O ATOM 997 CG2 THR A 67 0.428 10.329 -13.005 1.00 0.00 C ATOM 0 H THR A 67 1.637 13.175 -10.588 1.00 0.00 H new ATOM 0 HA THR A 67 -0.823 12.508 -11.926 1.00 0.00 H new ATOM 0 HB THR A 67 1.770 10.943 -11.435 1.00 0.00 H new ATOM 0 HG1 THR A 67 2.287 11.931 -13.548 1.00 0.00 H new ATOM 0 HG21 THR A 67 1.213 9.851 -13.591 1.00 0.00 H new ATOM 0 HG22 THR A 67 -0.071 9.581 -12.389 1.00 0.00 H new ATOM 0 HG23 THR A 67 -0.297 10.789 -13.676 1.00 0.00 H new ATOM 1005 N LEU A 68 -0.081 10.685 -9.308 1.00 0.00 N ATOM 1006 CA LEU A 68 -0.655 9.691 -8.375 1.00 0.00 C ATOM 1007 C LEU A 68 -1.984 10.216 -7.830 1.00 0.00 C ATOM 1008 O LEU A 68 -2.987 9.531 -7.836 1.00 0.00 O ATOM 1009 CB LEU A 68 0.396 9.596 -7.273 1.00 0.00 C ATOM 1010 CG LEU A 68 -0.044 8.596 -6.211 1.00 0.00 C ATOM 1011 CD1 LEU A 68 0.370 7.186 -6.637 1.00 0.00 C ATOM 1012 CD2 LEU A 68 0.636 8.959 -4.895 1.00 0.00 C ATOM 0 H LEU A 68 0.836 11.043 -9.042 1.00 0.00 H new ATOM 0 HA LEU A 68 -0.866 8.723 -8.830 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.352 9.290 -7.698 1.00 0.00 H new ATOM 0 HB3 LEU A 68 0.548 10.576 -6.820 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.127 8.625 -6.090 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.056 6.470 -5.878 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.104 6.939 -7.587 1.00 0.00 H new ATOM 0 HD13 LEU A 68 1.453 7.143 -6.750 1.00 0.00 H new ATOM 0 HD21 LEU A 68 0.333 8.253 -4.122 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.718 8.917 -5.021 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.344 9.967 -4.601 1.00 0.00 H new ATOM 1024 N ARG A 69 -2.011 11.460 -7.443 1.00 0.00 N ATOM 1025 CA ARG A 69 -3.286 12.084 -6.992 1.00 0.00 C ATOM 1026 C ARG A 69 -4.245 12.275 -8.176 1.00 0.00 C ATOM 1027 O ARG A 69 -5.443 12.132 -8.046 1.00 0.00 O ATOM 1028 CB ARG A 69 -2.866 13.432 -6.410 1.00 0.00 C ATOM 1029 CG ARG A 69 -4.076 14.122 -5.784 1.00 0.00 C ATOM 1030 CD ARG A 69 -3.638 15.462 -5.192 1.00 0.00 C ATOM 1031 NE ARG A 69 -4.863 16.018 -4.553 1.00 0.00 N ATOM 1032 CZ ARG A 69 -4.764 16.922 -3.614 1.00 0.00 C ATOM 1033 NH1 ARG A 69 -3.592 17.353 -3.234 1.00 0.00 N ATOM 1034 NH2 ARG A 69 -5.843 17.400 -3.057 1.00 0.00 N ATOM 0 H ARG A 69 -1.198 12.076 -7.420 1.00 0.00 H new ATOM 0 HA ARG A 69 -3.817 11.468 -6.266 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -2.089 13.289 -5.660 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -2.441 14.061 -7.193 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -4.850 14.278 -6.535 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -4.508 13.491 -5.007 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -2.838 15.329 -4.464 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -3.258 16.130 -5.965 1.00 0.00 H new ATOM 0 HE ARG A 69 -5.783 15.692 -4.849 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -2.747 16.984 -3.670 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -3.521 18.059 -2.501 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -6.760 17.068 -3.355 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -5.769 18.105 -2.324 1.00 0.00 H new ATOM 1048 N ILE A 70 -3.730 12.669 -9.311 1.00 0.00 N ATOM 1049 CA ILE A 70 -4.603 12.955 -10.479 1.00 0.00 C ATOM 1050 C ILE A 70 -5.250 11.656 -10.959 1.00 0.00 C ATOM 1051 O ILE A 70 -6.436 11.583 -11.204 1.00 0.00 O ATOM 1052 CB ILE A 70 -3.638 13.557 -11.520 1.00 0.00 C ATOM 1053 CG1 ILE A 70 -4.285 14.786 -12.155 1.00 0.00 C ATOM 1054 CG2 ILE A 70 -3.273 12.547 -12.620 1.00 0.00 C ATOM 1055 CD1 ILE A 70 -3.246 15.544 -12.984 1.00 0.00 C ATOM 0 H ILE A 70 -2.733 12.805 -9.477 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.428 13.635 -10.267 1.00 0.00 H new ATOM 0 HB ILE A 70 -2.718 13.832 -11.003 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.119 14.484 -12.788 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.691 15.436 -11.380 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.592 13.014 -13.331 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.790 11.679 -12.171 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -4.178 12.231 -13.139 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.710 16.420 -13.436 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.426 15.860 -12.339 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.861 14.892 -13.768 1.00 0.00 H new ATOM 1067 N THR A 71 -4.476 10.616 -11.004 1.00 0.00 N ATOM 1068 CA THR A 71 -5.025 9.289 -11.362 1.00 0.00 C ATOM 1069 C THR A 71 -5.601 8.632 -10.115 1.00 0.00 C ATOM 1070 O THR A 71 -5.518 9.165 -9.027 1.00 0.00 O ATOM 1071 CB THR A 71 -3.832 8.480 -11.874 1.00 0.00 C ATOM 1072 OG1 THR A 71 -2.932 8.238 -10.801 1.00 0.00 O ATOM 1073 CG2 THR A 71 -3.113 9.254 -12.975 1.00 0.00 C ATOM 0 H THR A 71 -3.476 10.630 -10.806 1.00 0.00 H new ATOM 0 HA THR A 71 -5.818 9.354 -12.107 1.00 0.00 H new ATOM 0 HB THR A 71 -4.187 7.532 -12.277 1.00 0.00 H new ATOM 0 HG1 THR A 71 -2.254 8.946 -10.777 1.00 0.00 H new ATOM 0 HG21 THR A 71 -2.265 8.672 -13.335 1.00 0.00 H new ATOM 0 HG22 THR A 71 -3.802 9.439 -13.799 1.00 0.00 H new ATOM 0 HG23 THR A 71 -2.758 10.205 -12.579 1.00 0.00 H new ATOM 1081 N ASN A 72 -6.017 7.412 -10.234 1.00 0.00 N ATOM 1082 CA ASN A 72 -6.398 6.648 -9.030 1.00 0.00 C ATOM 1083 C ASN A 72 -5.257 5.689 -8.685 1.00 0.00 C ATOM 1084 O ASN A 72 -5.437 4.709 -7.990 1.00 0.00 O ATOM 1085 CB ASN A 72 -7.677 5.918 -9.449 1.00 0.00 C ATOM 1086 CG ASN A 72 -7.965 4.739 -8.518 1.00 0.00 C ATOM 1087 OD1 ASN A 72 -7.667 4.787 -7.341 1.00 0.00 O ATOM 1088 ND2 ASN A 72 -8.558 3.678 -9.002 1.00 0.00 N ATOM 0 H ASN A 72 -6.110 6.910 -11.117 1.00 0.00 H new ATOM 0 HA ASN A 72 -6.572 7.252 -8.139 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -8.518 6.612 -9.434 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -7.577 5.561 -10.474 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -8.771 2.889 -8.391 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -8.807 3.639 -9.990 1.00 0.00 H new ATOM 1095 N LEU A 73 -4.053 6.008 -9.114 1.00 0.00 N ATOM 1096 CA LEU A 73 -2.888 5.159 -8.745 1.00 0.00 C ATOM 1097 C LEU A 73 -2.585 5.317 -7.250 1.00 0.00 C ATOM 1098 O LEU A 73 -2.256 4.367 -6.569 1.00 0.00 O ATOM 1099 CB LEU A 73 -1.729 5.692 -9.591 1.00 0.00 C ATOM 1100 CG LEU A 73 -1.983 5.395 -11.072 1.00 0.00 C ATOM 1101 CD1 LEU A 73 -0.905 6.073 -11.921 1.00 0.00 C ATOM 1102 CD2 LEU A 73 -1.936 3.882 -11.304 1.00 0.00 C ATOM 0 H LEU A 73 -3.836 6.815 -9.699 1.00 0.00 H new ATOM 0 HA LEU A 73 -3.066 4.099 -8.926 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.621 6.766 -9.440 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -0.794 5.230 -9.274 1.00 0.00 H new ATOM 0 HG LEU A 73 -2.964 5.777 -11.356 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -1.086 5.862 -12.975 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -0.936 7.150 -11.756 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.076 5.691 -11.637 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -2.117 3.670 -12.358 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -0.955 3.501 -11.020 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.703 3.397 -10.700 1.00 0.00 H new ATOM 1114 N GLY A 74 -2.681 6.518 -6.741 1.00 0.00 N ATOM 1115 CA GLY A 74 -2.389 6.751 -5.302 1.00 0.00 C ATOM 1116 C GLY A 74 -3.147 5.741 -4.437 1.00 0.00 C ATOM 1117 O GLY A 74 -2.810 5.520 -3.289 1.00 0.00 O ATOM 0 H GLY A 74 -2.951 7.350 -7.266 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -1.318 6.663 -5.122 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -2.676 7.765 -5.025 1.00 0.00 H new ATOM 1121 N ASP A 75 -4.213 5.186 -4.943 1.00 0.00 N ATOM 1122 CA ASP A 75 -5.039 4.264 -4.107 1.00 0.00 C ATOM 1123 C ASP A 75 -4.227 3.027 -3.718 1.00 0.00 C ATOM 1124 O ASP A 75 -4.587 2.296 -2.816 1.00 0.00 O ATOM 1125 CB ASP A 75 -6.221 3.872 -4.995 1.00 0.00 C ATOM 1126 CG ASP A 75 -5.737 2.963 -6.127 1.00 0.00 C ATOM 1127 OD1 ASP A 75 -4.552 2.983 -6.412 1.00 0.00 O ATOM 1128 OD2 ASP A 75 -6.562 2.267 -6.694 1.00 0.00 O ATOM 0 H ASP A 75 -4.549 5.329 -5.895 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.365 4.733 -3.179 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -6.979 3.359 -4.403 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -6.690 4.765 -5.408 1.00 0.00 H new ATOM 1133 N LEU A 76 -3.170 2.751 -4.428 1.00 0.00 N ATOM 1134 CA LEU A 76 -2.380 1.520 -4.143 1.00 0.00 C ATOM 1135 C LEU A 76 -1.813 1.551 -2.727 1.00 0.00 C ATOM 1136 O LEU A 76 -1.279 2.544 -2.274 1.00 0.00 O ATOM 1137 CB LEU A 76 -1.248 1.517 -5.159 1.00 0.00 C ATOM 1138 CG LEU A 76 -1.834 1.424 -6.566 1.00 0.00 C ATOM 1139 CD1 LEU A 76 -0.712 1.527 -7.598 1.00 0.00 C ATOM 1140 CD2 LEU A 76 -2.552 0.080 -6.717 1.00 0.00 C ATOM 0 H LEU A 76 -2.818 3.325 -5.194 1.00 0.00 H new ATOM 0 HA LEU A 76 -3.000 0.626 -4.216 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -0.652 2.424 -5.060 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.580 0.676 -4.974 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.540 2.239 -6.726 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -1.133 1.460 -8.601 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -0.198 2.481 -7.483 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.003 0.713 -7.447 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -2.974 0.004 -7.719 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.842 -0.732 -6.560 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -3.352 0.010 -5.980 1.00 0.00 H new ATOM 1152 N LYS A 77 -1.830 0.429 -2.078 1.00 0.00 N ATOM 1153 CA LYS A 77 -1.187 0.320 -0.736 1.00 0.00 C ATOM 1154 C LYS A 77 -0.496 -1.039 -0.608 1.00 0.00 C ATOM 1155 O LYS A 77 -0.982 -2.046 -1.086 1.00 0.00 O ATOM 1156 CB LYS A 77 -2.336 0.436 0.267 1.00 0.00 C ATOM 1157 CG LYS A 77 -2.968 1.826 0.161 1.00 0.00 C ATOM 1158 CD LYS A 77 -4.117 1.942 1.165 1.00 0.00 C ATOM 1159 CE LYS A 77 -4.748 3.332 1.059 1.00 0.00 C ATOM 1160 NZ LYS A 77 -4.466 3.983 2.368 1.00 0.00 N ATOM 0 H LYS A 77 -2.264 -0.429 -2.418 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.430 1.086 -0.570 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -3.084 -0.331 0.069 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -1.968 0.269 1.279 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.220 2.593 0.358 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -3.337 1.993 -0.851 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.866 1.175 0.967 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.748 1.774 2.177 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.316 3.900 0.235 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.820 3.266 0.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -4.868 4.942 2.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -4.895 3.424 3.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -3.438 4.038 2.514 1.00 0.00 H new ATOM 1174 N VAL A 78 0.668 -1.069 -0.027 1.00 0.00 N ATOM 1175 CA VAL A 78 1.416 -2.354 0.048 1.00 0.00 C ATOM 1176 C VAL A 78 0.614 -3.389 0.830 1.00 0.00 C ATOM 1177 O VAL A 78 -0.229 -3.058 1.640 1.00 0.00 O ATOM 1178 CB VAL A 78 2.709 -2.022 0.779 1.00 0.00 C ATOM 1179 CG1 VAL A 78 3.603 -3.261 0.825 1.00 0.00 C ATOM 1180 CG2 VAL A 78 3.426 -0.909 0.030 1.00 0.00 C ATOM 0 H VAL A 78 1.132 -0.266 0.397 1.00 0.00 H new ATOM 0 HA VAL A 78 1.603 -2.776 -0.939 1.00 0.00 H new ATOM 0 HB VAL A 78 2.486 -1.701 1.797 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.529 -3.022 1.349 1.00 0.00 H new ATOM 0 HG12 VAL A 78 3.086 -4.064 1.350 1.00 0.00 H new ATOM 0 HG13 VAL A 78 3.833 -3.582 -0.191 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.354 -0.663 0.545 1.00 0.00 H new ATOM 0 HG22 VAL A 78 3.650 -1.239 -0.984 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.788 -0.026 -0.009 1.00 0.00 H new ATOM 1190 N GLY A 79 0.806 -4.638 0.525 1.00 0.00 N ATOM 1191 CA GLY A 79 -0.012 -5.693 1.169 1.00 0.00 C ATOM 1192 C GLY A 79 -1.260 -5.933 0.321 1.00 0.00 C ATOM 1193 O GLY A 79 -1.908 -6.956 0.426 1.00 0.00 O ATOM 0 H GLY A 79 1.497 -4.974 -0.146 1.00 0.00 H new ATOM 0 HA2 GLY A 79 0.564 -6.614 1.262 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -0.293 -5.390 2.178 1.00 0.00 H new ATOM 1197 N ASP A 80 -1.549 -5.035 -0.586 1.00 0.00 N ATOM 1198 CA ASP A 80 -2.690 -5.254 -1.519 1.00 0.00 C ATOM 1199 C ASP A 80 -2.169 -5.796 -2.848 1.00 0.00 C ATOM 1200 O ASP A 80 -0.995 -5.726 -3.133 1.00 0.00 O ATOM 1201 CB ASP A 80 -3.309 -3.872 -1.720 1.00 0.00 C ATOM 1202 CG ASP A 80 -4.736 -4.023 -2.250 1.00 0.00 C ATOM 1203 OD1 ASP A 80 -5.098 -5.129 -2.616 1.00 0.00 O ATOM 1204 OD2 ASP A 80 -5.443 -3.029 -2.281 1.00 0.00 O ATOM 0 H ASP A 80 -1.042 -4.160 -0.719 1.00 0.00 H new ATOM 0 HA ASP A 80 -3.413 -5.972 -1.132 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -3.316 -3.325 -0.777 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.709 -3.292 -2.421 1.00 0.00 H new ATOM 1209 N TRP A 81 -3.036 -6.284 -3.686 1.00 0.00 N ATOM 1210 CA TRP A 81 -2.581 -6.765 -5.023 1.00 0.00 C ATOM 1211 C TRP A 81 -3.192 -5.901 -6.130 1.00 0.00 C ATOM 1212 O TRP A 81 -4.198 -5.247 -5.940 1.00 0.00 O ATOM 1213 CB TRP A 81 -3.076 -8.207 -5.133 1.00 0.00 C ATOM 1214 CG TRP A 81 -2.253 -9.086 -4.245 1.00 0.00 C ATOM 1215 CD1 TRP A 81 -2.040 -8.879 -2.924 1.00 0.00 C ATOM 1216 CD2 TRP A 81 -1.532 -10.307 -4.587 1.00 0.00 C ATOM 1217 NE1 TRP A 81 -1.228 -9.886 -2.439 1.00 0.00 N ATOM 1218 CE2 TRP A 81 -0.892 -10.792 -3.421 1.00 0.00 C ATOM 1219 CE3 TRP A 81 -1.372 -11.031 -5.785 1.00 0.00 C ATOM 1220 CZ2 TRP A 81 -0.120 -11.956 -3.443 1.00 0.00 C ATOM 1221 CZ3 TRP A 81 -0.596 -12.203 -5.811 1.00 0.00 C ATOM 1222 CH2 TRP A 81 0.029 -12.664 -4.642 1.00 0.00 C ATOM 0 H TRP A 81 -4.036 -6.372 -3.507 1.00 0.00 H new ATOM 0 HA TRP A 81 -1.498 -6.705 -5.130 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -4.126 -8.265 -4.848 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -3.007 -8.549 -6.166 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -2.440 -8.060 -2.344 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -0.915 -9.951 -1.470 1.00 0.00 H new ATOM 0 HE3 TRP A 81 -1.849 -10.683 -6.690 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 0.359 -12.308 -2.541 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 -0.480 -12.751 -6.734 1.00 0.00 H new ATOM 0 HH2 TRP A 81 0.625 -13.565 -4.667 1.00 0.00 H new ATOM 1233 N VAL A 82 -2.567 -5.871 -7.269 1.00 0.00 N ATOM 1234 CA VAL A 82 -3.064 -5.026 -8.390 1.00 0.00 C ATOM 1235 C VAL A 82 -3.385 -5.904 -9.601 1.00 0.00 C ATOM 1236 O VAL A 82 -2.713 -6.875 -9.869 1.00 0.00 O ATOM 1237 CB VAL A 82 -1.910 -4.058 -8.716 1.00 0.00 C ATOM 1238 CG1 VAL A 82 -0.574 -4.788 -8.620 1.00 0.00 C ATOM 1239 CG2 VAL A 82 -2.057 -3.524 -10.143 1.00 0.00 C ATOM 0 H VAL A 82 -1.721 -6.402 -7.476 1.00 0.00 H new ATOM 0 HA VAL A 82 -3.976 -4.490 -8.128 1.00 0.00 H new ATOM 0 HB VAL A 82 -1.944 -3.235 -8.002 1.00 0.00 H new ATOM 0 HG11 VAL A 82 0.236 -4.096 -8.852 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.443 -5.175 -7.610 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -0.559 -5.615 -9.330 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -1.236 -2.841 -10.362 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -2.035 -4.356 -10.847 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -3.005 -2.994 -10.237 1.00 0.00 H new ATOM 1249 N ASN A 83 -4.257 -5.438 -10.440 1.00 0.00 N ATOM 1250 CA ASN A 83 -4.444 -6.097 -11.757 1.00 0.00 C ATOM 1251 C ASN A 83 -3.336 -5.640 -12.703 1.00 0.00 C ATOM 1252 O ASN A 83 -3.285 -4.503 -13.105 1.00 0.00 O ATOM 1253 CB ASN A 83 -5.810 -5.598 -12.233 1.00 0.00 C ATOM 1254 CG ASN A 83 -6.845 -6.711 -12.074 1.00 0.00 C ATOM 1255 OD1 ASN A 83 -6.568 -7.732 -11.479 1.00 0.00 O ATOM 1256 ND2 ASN A 83 -8.035 -6.556 -12.587 1.00 0.00 N ATOM 0 H ASN A 83 -4.851 -4.626 -10.272 1.00 0.00 H new ATOM 0 HA ASN A 83 -4.402 -7.185 -11.713 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -6.110 -4.723 -11.656 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -5.752 -5.288 -13.276 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -8.733 -7.293 -12.488 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -8.267 -5.698 -13.087 1.00 0.00 H new ATOM 1263 N VAL A 84 -2.393 -6.484 -12.990 1.00 0.00 N ATOM 1264 CA VAL A 84 -1.244 -6.023 -13.826 1.00 0.00 C ATOM 1265 C VAL A 84 -1.322 -6.606 -15.233 1.00 0.00 C ATOM 1266 O VAL A 84 -1.677 -7.754 -15.436 1.00 0.00 O ATOM 1267 CB VAL A 84 0.048 -6.468 -13.121 1.00 0.00 C ATOM 1268 CG1 VAL A 84 0.499 -5.351 -12.181 1.00 0.00 C ATOM 1269 CG2 VAL A 84 -0.166 -7.756 -12.318 1.00 0.00 C ATOM 0 H VAL A 84 -2.361 -7.459 -12.691 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.266 -4.938 -13.932 1.00 0.00 H new ATOM 0 HB VAL A 84 0.808 -6.668 -13.876 1.00 0.00 H new ATOM 0 HG11 VAL A 84 1.415 -5.651 -11.673 1.00 0.00 H new ATOM 0 HG12 VAL A 84 0.684 -4.444 -12.756 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.280 -5.160 -11.443 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.767 -8.042 -11.833 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.932 -7.590 -11.561 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.485 -8.554 -12.988 1.00 0.00 H new ATOM 1279 N GLU A 85 -1.024 -5.793 -16.207 1.00 0.00 N ATOM 1280 CA GLU A 85 -1.104 -6.252 -17.624 1.00 0.00 C ATOM 1281 C GLU A 85 0.119 -5.756 -18.398 1.00 0.00 C ATOM 1282 O GLU A 85 0.553 -4.635 -18.229 1.00 0.00 O ATOM 1283 CB GLU A 85 -2.383 -5.620 -18.174 1.00 0.00 C ATOM 1284 CG GLU A 85 -2.574 -6.037 -19.634 1.00 0.00 C ATOM 1285 CD GLU A 85 -3.854 -5.403 -20.183 1.00 0.00 C ATOM 1286 OE1 GLU A 85 -4.605 -4.854 -19.394 1.00 0.00 O ATOM 1287 OE2 GLU A 85 -4.060 -5.479 -21.382 1.00 0.00 O ATOM 0 H GLU A 85 -0.727 -4.825 -16.083 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.121 -7.338 -17.712 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -3.241 -5.935 -17.580 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -2.325 -4.534 -18.100 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -1.716 -5.723 -20.228 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -2.633 -7.123 -19.708 1.00 0.00 H new ATOM 1294 N ARG A 86 0.723 -6.599 -19.188 1.00 0.00 N ATOM 1295 CA ARG A 86 1.968 -6.186 -19.897 1.00 0.00 C ATOM 1296 C ARG A 86 1.633 -5.320 -21.115 1.00 0.00 C ATOM 1297 O ARG A 86 0.825 -5.683 -21.947 1.00 0.00 O ATOM 1298 CB ARG A 86 2.631 -7.492 -20.333 1.00 0.00 C ATOM 1299 CG ARG A 86 3.930 -7.181 -21.078 1.00 0.00 C ATOM 1300 CD ARG A 86 4.652 -8.487 -21.416 1.00 0.00 C ATOM 1301 NE ARG A 86 3.736 -9.205 -22.344 1.00 0.00 N ATOM 1302 CZ ARG A 86 4.010 -10.425 -22.726 1.00 0.00 C ATOM 1303 NH1 ARG A 86 5.088 -11.024 -22.294 1.00 0.00 N ATOM 1304 NH2 ARG A 86 3.203 -11.048 -23.540 1.00 0.00 N ATOM 0 H ARG A 86 0.411 -7.552 -19.374 1.00 0.00 H new ATOM 0 HA ARG A 86 2.621 -5.590 -19.260 1.00 0.00 H new ATOM 0 HB2 ARG A 86 2.839 -8.115 -19.463 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.957 -8.057 -20.976 1.00 0.00 H new ATOM 0 HG2 ARG A 86 3.714 -6.626 -21.991 1.00 0.00 H new ATOM 0 HG3 ARG A 86 4.571 -6.548 -20.464 1.00 0.00 H new ATOM 0 HD2 ARG A 86 5.617 -8.294 -21.885 1.00 0.00 H new ATOM 0 HD3 ARG A 86 4.845 -9.075 -20.519 1.00 0.00 H new ATOM 0 HE ARG A 86 2.892 -8.744 -22.683 1.00 0.00 H new ATOM 0 HH11 ARG A 86 5.720 -10.540 -21.656 1.00 0.00 H new ATOM 0 HH12 ARG A 86 5.298 -11.976 -22.595 1.00 0.00 H new ATOM 0 HH21 ARG A 86 2.360 -10.583 -23.877 1.00 0.00 H new ATOM 0 HH22 ARG A 86 3.415 -12.000 -23.839 1.00 0.00 H new ATOM 1318 N ALA A 87 2.275 -4.190 -21.238 1.00 0.00 N ATOM 1319 CA ALA A 87 2.032 -3.310 -22.416 1.00 0.00 C ATOM 1320 C ALA A 87 3.334 -3.086 -23.185 1.00 0.00 C ATOM 1321 O ALA A 87 4.413 -3.032 -22.613 1.00 0.00 O ATOM 1322 CB ALA A 87 1.525 -1.991 -21.840 1.00 0.00 C ATOM 0 H ALA A 87 2.960 -3.837 -20.570 1.00 0.00 H new ATOM 0 HA ALA A 87 1.318 -3.750 -23.112 1.00 0.00 H new ATOM 0 HB1 ALA A 87 1.325 -1.292 -22.652 1.00 0.00 H new ATOM 0 HB2 ALA A 87 0.607 -2.168 -21.279 1.00 0.00 H new ATOM 0 HB3 ALA A 87 2.280 -1.569 -21.177 1.00 0.00 H new ATOM 1328 N ALA A 88 3.237 -2.977 -24.481 1.00 0.00 N ATOM 1329 CA ALA A 88 4.456 -2.787 -25.315 1.00 0.00 C ATOM 1330 C ALA A 88 4.285 -1.581 -26.240 1.00 0.00 C ATOM 1331 O ALA A 88 3.235 -1.370 -26.814 1.00 0.00 O ATOM 1332 CB ALA A 88 4.571 -4.072 -26.135 1.00 0.00 C ATOM 0 H ALA A 88 2.360 -3.012 -25.001 1.00 0.00 H new ATOM 0 HA ALA A 88 5.344 -2.600 -24.711 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.448 -4.015 -26.780 1.00 0.00 H new ATOM 0 HB2 ALA A 88 4.670 -4.925 -25.463 1.00 0.00 H new ATOM 0 HB3 ALA A 88 3.677 -4.194 -26.747 1.00 0.00 H new ATOM 1338 N LYS A 89 5.324 -0.817 -26.429 1.00 0.00 N ATOM 1339 CA LYS A 89 5.236 0.340 -27.363 1.00 0.00 C ATOM 1340 C LYS A 89 5.133 -0.159 -28.807 1.00 0.00 C ATOM 1341 O LYS A 89 4.597 0.511 -29.668 1.00 0.00 O ATOM 1342 CB LYS A 89 6.531 1.121 -27.143 1.00 0.00 C ATOM 1343 CG LYS A 89 7.730 0.215 -27.425 1.00 0.00 C ATOM 1344 CD LYS A 89 8.828 0.496 -26.398 1.00 0.00 C ATOM 1345 CE LYS A 89 9.994 -0.472 -26.615 1.00 0.00 C ATOM 1346 NZ LYS A 89 11.030 -0.059 -25.625 1.00 0.00 N ATOM 0 H LYS A 89 6.230 -0.943 -25.978 1.00 0.00 H new ATOM 0 HA LYS A 89 4.357 0.959 -27.183 1.00 0.00 H new ATOM 0 HB2 LYS A 89 6.558 1.992 -27.798 1.00 0.00 H new ATOM 0 HB3 LYS A 89 6.575 1.491 -26.119 1.00 0.00 H new ATOM 0 HG2 LYS A 89 7.429 -0.832 -27.376 1.00 0.00 H new ATOM 0 HG3 LYS A 89 8.105 0.392 -28.433 1.00 0.00 H new ATOM 0 HD2 LYS A 89 9.174 1.525 -26.493 1.00 0.00 H new ATOM 0 HD3 LYS A 89 8.433 0.385 -25.388 1.00 0.00 H new ATOM 0 HE2 LYS A 89 9.684 -1.505 -26.454 1.00 0.00 H new ATOM 0 HE3 LYS A 89 10.375 -0.408 -27.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 11.861 -0.678 -25.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 11.311 0.926 -25.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 10.642 -0.137 -24.663 1.00 0.00 H new ATOM 1360 N PHE A 90 5.548 -1.372 -29.058 1.00 0.00 N ATOM 1361 CA PHE A 90 5.366 -1.956 -30.419 1.00 0.00 C ATOM 1362 C PHE A 90 4.988 -3.434 -30.311 1.00 0.00 C ATOM 1363 O PHE A 90 5.264 -4.086 -29.325 1.00 0.00 O ATOM 1364 CB PHE A 90 6.719 -1.812 -31.115 1.00 0.00 C ATOM 1365 CG PHE A 90 7.716 -2.754 -30.481 1.00 0.00 C ATOM 1366 CD1 PHE A 90 7.816 -4.076 -30.939 1.00 0.00 C ATOM 1367 CD2 PHE A 90 8.539 -2.311 -29.436 1.00 0.00 C ATOM 1368 CE1 PHE A 90 8.737 -4.954 -30.353 1.00 0.00 C ATOM 1369 CE2 PHE A 90 9.462 -3.189 -28.850 1.00 0.00 C ATOM 1370 CZ PHE A 90 9.561 -4.511 -29.310 1.00 0.00 C ATOM 0 H PHE A 90 6.004 -1.983 -28.381 1.00 0.00 H new ATOM 0 HA PHE A 90 4.571 -1.453 -30.970 1.00 0.00 H new ATOM 0 HB2 PHE A 90 6.618 -2.034 -32.178 1.00 0.00 H new ATOM 0 HB3 PHE A 90 7.073 -0.784 -31.036 1.00 0.00 H new ATOM 0 HD1 PHE A 90 7.182 -4.417 -31.744 1.00 0.00 H new ATOM 0 HD2 PHE A 90 8.462 -1.293 -29.082 1.00 0.00 H new ATOM 0 HE1 PHE A 90 8.812 -5.972 -30.705 1.00 0.00 H new ATOM 0 HE2 PHE A 90 10.096 -2.848 -28.045 1.00 0.00 H new ATOM 0 HZ PHE A 90 10.273 -5.187 -28.860 1.00 0.00 H new ATOM 1380 N SER A 91 4.420 -3.982 -31.348 1.00 0.00 N ATOM 1381 CA SER A 91 4.097 -5.438 -31.335 1.00 0.00 C ATOM 1382 C SER A 91 4.391 -6.059 -32.703 1.00 0.00 C ATOM 1383 O SER A 91 4.269 -5.417 -33.727 1.00 0.00 O ATOM 1384 CB SER A 91 2.602 -5.509 -31.023 1.00 0.00 C ATOM 1385 OG SER A 91 1.881 -4.782 -32.009 1.00 0.00 O ATOM 0 H SER A 91 4.165 -3.487 -32.203 1.00 0.00 H new ATOM 0 HA SER A 91 4.692 -5.986 -30.605 1.00 0.00 H new ATOM 0 HB2 SER A 91 2.271 -6.547 -31.006 1.00 0.00 H new ATOM 0 HB3 SER A 91 2.405 -5.096 -30.034 1.00 0.00 H new ATOM 0 HG SER A 91 0.919 -4.911 -31.872 1.00 0.00 H new ATOM 1391 N ASP A 92 4.746 -7.316 -32.729 1.00 0.00 N ATOM 1392 CA ASP A 92 5.010 -7.990 -34.032 1.00 0.00 C ATOM 1393 C ASP A 92 3.702 -8.176 -34.805 1.00 0.00 C ATOM 1394 O ASP A 92 3.633 -7.939 -35.995 1.00 0.00 O ATOM 1395 CB ASP A 92 5.610 -9.346 -33.659 1.00 0.00 C ATOM 1396 CG ASP A 92 6.152 -10.029 -34.917 1.00 0.00 C ATOM 1397 OD1 ASP A 92 5.736 -9.650 -35.999 1.00 0.00 O ATOM 1398 OD2 ASP A 92 6.975 -10.918 -34.775 1.00 0.00 O ATOM 0 H ASP A 92 4.864 -7.904 -31.904 1.00 0.00 H new ATOM 0 HA ASP A 92 5.676 -7.410 -34.671 1.00 0.00 H new ATOM 0 HB2 ASP A 92 6.410 -9.213 -32.931 1.00 0.00 H new ATOM 0 HB3 ASP A 92 4.853 -9.974 -33.189 1.00 0.00 H new ATOM 1403 N GLU A 93 2.646 -8.524 -34.124 1.00 0.00 N ATOM 1404 CA GLU A 93 1.320 -8.640 -34.825 1.00 0.00 C ATOM 1405 C GLU A 93 1.459 -9.535 -36.059 1.00 0.00 C ATOM 1406 O GLU A 93 1.095 -9.160 -37.157 1.00 0.00 O ATOM 1407 CB GLU A 93 0.987 -7.208 -35.233 1.00 0.00 C ATOM 1408 CG GLU A 93 0.657 -6.387 -33.985 1.00 0.00 C ATOM 1409 CD GLU A 93 0.324 -4.951 -34.389 1.00 0.00 C ATOM 1410 OE1 GLU A 93 0.532 -4.618 -35.545 1.00 0.00 O ATOM 1411 OE2 GLU A 93 -0.134 -4.207 -33.537 1.00 0.00 O ATOM 0 H GLU A 93 2.634 -8.732 -33.126 1.00 0.00 H new ATOM 0 HA GLU A 93 0.545 -9.083 -34.200 1.00 0.00 H new ATOM 0 HB2 GLU A 93 1.830 -6.763 -35.762 1.00 0.00 H new ATOM 0 HB3 GLU A 93 0.141 -7.201 -35.920 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -0.187 -6.832 -33.457 1.00 0.00 H new ATOM 0 HG3 GLU A 93 1.503 -6.395 -33.298 1.00 0.00 H new ATOM 1418 N ILE A 94 1.951 -10.730 -35.878 1.00 0.00 N ATOM 1419 CA ILE A 94 2.079 -11.670 -37.029 1.00 0.00 C ATOM 1420 C ILE A 94 0.702 -11.935 -37.639 1.00 0.00 C ATOM 1421 O ILE A 94 0.539 -11.961 -38.843 1.00 0.00 O ATOM 1422 CB ILE A 94 2.652 -12.954 -36.429 1.00 0.00 C ATOM 1423 CG1 ILE A 94 4.059 -12.688 -35.888 1.00 0.00 C ATOM 1424 CG2 ILE A 94 2.720 -14.035 -37.510 1.00 0.00 C ATOM 1425 CD1 ILE A 94 4.980 -12.273 -37.037 1.00 0.00 C ATOM 0 H ILE A 94 2.271 -11.097 -34.982 1.00 0.00 H new ATOM 0 HA ILE A 94 2.713 -11.273 -37.822 1.00 0.00 H new ATOM 0 HB ILE A 94 2.009 -13.289 -35.615 1.00 0.00 H new ATOM 0 HG12 ILE A 94 4.027 -11.903 -35.133 1.00 0.00 H new ATOM 0 HG13 ILE A 94 4.448 -13.583 -35.402 1.00 0.00 H new ATOM 0 HG21 ILE A 94 3.128 -14.951 -37.083 1.00 0.00 H new ATOM 0 HG22 ILE A 94 1.719 -14.229 -37.894 1.00 0.00 H new ATOM 0 HG23 ILE A 94 3.362 -13.696 -38.324 1.00 0.00 H new ATOM 0 HD11 ILE A 94 5.981 -12.084 -36.650 1.00 0.00 H new ATOM 0 HD12 ILE A 94 5.022 -13.072 -37.777 1.00 0.00 H new ATOM 0 HD13 ILE A 94 4.594 -11.367 -37.503 1.00 0.00 H new ATOM 1437 N GLY A 95 -0.295 -12.102 -36.811 1.00 0.00 N ATOM 1438 CA GLY A 95 -1.676 -12.335 -37.328 1.00 0.00 C ATOM 1439 C GLY A 95 -1.631 -13.293 -38.524 1.00 0.00 C ATOM 1440 O GLY A 95 -2.077 -12.968 -39.605 1.00 0.00 O ATOM 0 H GLY A 95 -0.212 -12.087 -35.794 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -2.303 -12.752 -36.540 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -2.127 -11.388 -37.626 1.00 0.00 H new ATOM 1444 N GLY A 96 -1.100 -14.472 -38.339 1.00 0.00 N ATOM 1445 CA GLY A 96 -1.035 -15.443 -39.467 1.00 0.00 C ATOM 1446 C GLY A 96 -2.334 -16.249 -39.527 1.00 0.00 C ATOM 1447 O GLY A 96 -2.572 -16.991 -40.459 1.00 0.00 O ATOM 0 H GLY A 96 -0.709 -14.803 -37.457 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -0.880 -14.914 -40.407 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -0.185 -16.113 -39.335 1.00 0.00 H new ATOM 1451 N HIS A 97 -3.171 -16.118 -38.535 1.00 0.00 N ATOM 1452 CA HIS A 97 -4.449 -16.888 -38.534 1.00 0.00 C ATOM 1453 C HIS A 97 -5.544 -16.097 -39.254 1.00 0.00 C ATOM 1454 O HIS A 97 -5.483 -14.878 -39.225 1.00 0.00 O ATOM 1455 CB HIS A 97 -4.804 -17.071 -37.057 1.00 0.00 C ATOM 1456 CG HIS A 97 -3.661 -17.736 -36.342 1.00 0.00 C ATOM 1457 ND1 HIS A 97 -2.879 -17.066 -35.414 1.00 0.00 N ATOM 1458 CD2 HIS A 97 -3.155 -19.012 -36.406 1.00 0.00 C ATOM 1459 CE1 HIS A 97 -1.954 -17.932 -34.962 1.00 0.00 C ATOM 1460 NE2 HIS A 97 -2.077 -19.132 -35.534 1.00 0.00 N ATOM 1461 OXT HIS A 97 -6.423 -16.723 -39.823 1.00 0.00 O ATOM 0 H HIS A 97 -3.027 -15.513 -37.727 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.354 -17.843 -39.051 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.018 -16.104 -36.602 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -5.706 -17.675 -36.962 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -3.536 -19.801 -37.037 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -1.203 -17.686 -34.226 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -1.504 -19.959 -35.368 1.00 0.00 H new TER 1469 HIS A 97 ATOM 1470 N MET B 1 -1.010 -0.345 -29.469 1.00 0.00 N ATOM 1471 CA MET B 1 -1.049 0.932 -28.695 1.00 0.00 C ATOM 1472 C MET B 1 -1.770 0.721 -27.361 1.00 0.00 C ATOM 1473 O MET B 1 -2.568 -0.183 -27.214 1.00 0.00 O ATOM 1474 CB MET B 1 -1.829 1.912 -29.575 1.00 0.00 C ATOM 1475 CG MET B 1 -1.856 3.289 -28.908 1.00 0.00 C ATOM 1476 SD MET B 1 -2.780 4.447 -29.948 1.00 0.00 S ATOM 1477 CE MET B 1 -1.487 4.725 -31.184 1.00 0.00 C ATOM 0 H1 MET B 1 -0.027 -0.678 -29.541 1.00 0.00 H new ATOM 0 H2 MET B 1 -1.584 -1.063 -28.983 1.00 0.00 H new ATOM 0 H3 MET B 1 -1.392 -0.184 -30.423 1.00 0.00 H new ATOM 0 HA MET B 1 -0.050 1.301 -28.463 1.00 0.00 H new ATOM 0 HB2 MET B 1 -1.365 1.982 -30.559 1.00 0.00 H new ATOM 0 HB3 MET B 1 -2.846 1.550 -29.727 1.00 0.00 H new ATOM 0 HG2 MET B 1 -2.319 3.219 -27.924 1.00 0.00 H new ATOM 0 HG3 MET B 1 -0.839 3.651 -28.757 1.00 0.00 H new ATOM 0 HE1 MET B 1 -1.483 5.775 -31.477 1.00 0.00 H new ATOM 0 HE2 MET B 1 -0.517 4.463 -30.761 1.00 0.00 H new ATOM 0 HE3 MET B 1 -1.681 4.105 -32.059 1.00 0.00 H new ATOM 1489 N PHE B 2 -1.582 1.615 -26.428 1.00 0.00 N ATOM 1490 CA PHE B 2 -2.347 1.541 -25.160 1.00 0.00 C ATOM 1491 C PHE B 2 -2.039 2.779 -24.322 1.00 0.00 C ATOM 1492 O PHE B 2 -0.927 3.269 -24.309 1.00 0.00 O ATOM 1493 CB PHE B 2 -1.867 0.265 -24.460 1.00 0.00 C ATOM 1494 CG PHE B 2 -0.435 0.421 -23.995 1.00 0.00 C ATOM 1495 CD1 PHE B 2 -0.134 1.271 -22.920 1.00 0.00 C ATOM 1496 CD2 PHE B 2 0.593 -0.291 -24.632 1.00 0.00 C ATOM 1497 CE1 PHE B 2 1.192 1.412 -22.487 1.00 0.00 C ATOM 1498 CE2 PHE B 2 1.919 -0.150 -24.197 1.00 0.00 C ATOM 1499 CZ PHE B 2 2.218 0.703 -23.125 1.00 0.00 C ATOM 0 H PHE B 2 -0.928 2.395 -26.494 1.00 0.00 H new ATOM 0 HA PHE B 2 -3.425 1.511 -25.318 1.00 0.00 H new ATOM 0 HB2 PHE B 2 -2.510 0.047 -23.608 1.00 0.00 H new ATOM 0 HB3 PHE B 2 -1.944 -0.582 -25.142 1.00 0.00 H new ATOM 0 HD1 PHE B 2 -0.924 1.817 -22.426 1.00 0.00 H new ATOM 0 HD2 PHE B 2 0.363 -0.948 -25.458 1.00 0.00 H new ATOM 0 HE1 PHE B 2 1.423 2.068 -21.661 1.00 0.00 H new ATOM 0 HE2 PHE B 2 2.710 -0.698 -24.688 1.00 0.00 H new ATOM 0 HZ PHE B 2 3.239 0.813 -22.791 1.00 0.00 H new ATOM 1509 N THR B 3 -3.024 3.336 -23.682 1.00 0.00 N ATOM 1510 CA THR B 3 -2.788 4.586 -22.915 1.00 0.00 C ATOM 1511 C THR B 3 -3.373 4.433 -21.517 1.00 0.00 C ATOM 1512 O THR B 3 -2.832 4.925 -20.546 1.00 0.00 O ATOM 1513 CB THR B 3 -3.523 5.682 -23.698 1.00 0.00 C ATOM 1514 OG1 THR B 3 -4.916 5.587 -23.437 1.00 0.00 O ATOM 1515 CG2 THR B 3 -3.271 5.502 -25.199 1.00 0.00 C ATOM 0 H THR B 3 -3.980 2.981 -23.656 1.00 0.00 H new ATOM 0 HA THR B 3 -1.730 4.822 -22.802 1.00 0.00 H new ATOM 0 HB THR B 3 -3.156 6.660 -23.387 1.00 0.00 H new ATOM 0 HG1 THR B 3 -5.390 6.286 -23.934 1.00 0.00 H new ATOM 0 HG21 THR B 3 -3.794 6.282 -25.752 1.00 0.00 H new ATOM 0 HG22 THR B 3 -2.202 5.571 -25.399 1.00 0.00 H new ATOM 0 HG23 THR B 3 -3.637 4.525 -25.515 1.00 0.00 H new ATOM 1523 N GLY B 4 -4.486 3.765 -21.407 1.00 0.00 N ATOM 1524 CA GLY B 4 -5.114 3.596 -20.073 1.00 0.00 C ATOM 1525 C GLY B 4 -5.321 4.973 -19.454 1.00 0.00 C ATOM 1526 O GLY B 4 -5.411 5.121 -18.251 1.00 0.00 O ATOM 0 H GLY B 4 -4.986 3.330 -22.183 1.00 0.00 H new ATOM 0 HA2 GLY B 4 -6.068 3.077 -20.167 1.00 0.00 H new ATOM 0 HA3 GLY B 4 -4.480 2.984 -19.431 1.00 0.00 H new ATOM 1530 N ILE B 5 -5.330 5.993 -20.267 1.00 0.00 N ATOM 1531 CA ILE B 5 -5.453 7.374 -19.719 1.00 0.00 C ATOM 1532 C ILE B 5 -6.926 7.674 -19.412 1.00 0.00 C ATOM 1533 O ILE B 5 -7.806 7.343 -20.181 1.00 0.00 O ATOM 1534 CB ILE B 5 -4.906 8.280 -20.826 1.00 0.00 C ATOM 1535 CG1 ILE B 5 -3.543 7.759 -21.280 1.00 0.00 C ATOM 1536 CG2 ILE B 5 -4.724 9.701 -20.301 1.00 0.00 C ATOM 1537 CD1 ILE B 5 -2.558 7.800 -20.116 1.00 0.00 C ATOM 0 H ILE B 5 -5.258 5.931 -21.283 1.00 0.00 H new ATOM 0 HA ILE B 5 -4.908 7.520 -18.786 1.00 0.00 H new ATOM 0 HB ILE B 5 -5.612 8.281 -21.657 1.00 0.00 H new ATOM 0 HG12 ILE B 5 -3.639 6.739 -21.651 1.00 0.00 H new ATOM 0 HG13 ILE B 5 -3.169 8.364 -22.106 1.00 0.00 H new ATOM 0 HG21 ILE B 5 -4.335 10.336 -21.097 1.00 0.00 H new ATOM 0 HG22 ILE B 5 -5.685 10.090 -19.964 1.00 0.00 H new ATOM 0 HG23 ILE B 5 -4.022 9.694 -19.467 1.00 0.00 H new ATOM 0 HD11 ILE B 5 -1.588 7.427 -20.446 1.00 0.00 H new ATOM 0 HD12 ILE B 5 -2.452 8.827 -19.765 1.00 0.00 H new ATOM 0 HD13 ILE B 5 -2.929 7.175 -19.303 1.00 0.00 H new ATOM 1549 N VAL B 6 -7.206 8.061 -18.194 1.00 0.00 N ATOM 1550 CA VAL B 6 -8.625 8.102 -17.730 1.00 0.00 C ATOM 1551 C VAL B 6 -9.317 9.398 -18.161 1.00 0.00 C ATOM 1552 O VAL B 6 -8.763 10.475 -18.077 1.00 0.00 O ATOM 1553 CB VAL B 6 -8.537 8.001 -16.200 1.00 0.00 C ATOM 1554 CG1 VAL B 6 -9.772 8.629 -15.544 1.00 0.00 C ATOM 1555 CG2 VAL B 6 -8.468 6.527 -15.803 1.00 0.00 C ATOM 0 H VAL B 6 -6.515 8.350 -17.502 1.00 0.00 H new ATOM 0 HA VAL B 6 -9.219 7.297 -18.162 1.00 0.00 H new ATOM 0 HB VAL B 6 -7.647 8.533 -15.864 1.00 0.00 H new ATOM 0 HG11 VAL B 6 -9.690 8.547 -14.460 1.00 0.00 H new ATOM 0 HG12 VAL B 6 -9.838 9.680 -15.824 1.00 0.00 H new ATOM 0 HG13 VAL B 6 -10.668 8.107 -15.880 1.00 0.00 H new ATOM 0 HG21 VAL B 6 -8.405 6.445 -14.718 1.00 0.00 H new ATOM 0 HG22 VAL B 6 -9.363 6.013 -16.155 1.00 0.00 H new ATOM 0 HG23 VAL B 6 -7.587 6.070 -16.253 1.00 0.00 H new ATOM 1565 N GLN B 7 -10.573 9.298 -18.497 1.00 0.00 N ATOM 1566 CA GLN B 7 -11.374 10.516 -18.790 1.00 0.00 C ATOM 1567 C GLN B 7 -11.623 11.314 -17.503 1.00 0.00 C ATOM 1568 O GLN B 7 -11.652 12.528 -17.516 1.00 0.00 O ATOM 1569 CB GLN B 7 -12.691 9.989 -19.359 1.00 0.00 C ATOM 1570 CG GLN B 7 -12.425 9.302 -20.700 1.00 0.00 C ATOM 1571 CD GLN B 7 -11.815 10.307 -21.677 1.00 0.00 C ATOM 1572 OE1 GLN B 7 -12.463 11.253 -22.078 1.00 0.00 O ATOM 1573 NE2 GLN B 7 -10.583 10.143 -22.079 1.00 0.00 N ATOM 0 H GLN B 7 -11.081 8.418 -18.581 1.00 0.00 H new ATOM 0 HA GLN B 7 -10.867 11.188 -19.483 1.00 0.00 H new ATOM 0 HB2 GLN B 7 -13.146 9.286 -18.661 1.00 0.00 H new ATOM 0 HB3 GLN B 7 -13.397 10.809 -19.491 1.00 0.00 H new ATOM 0 HG2 GLN B 7 -11.749 8.458 -20.560 1.00 0.00 H new ATOM 0 HG3 GLN B 7 -13.354 8.902 -21.106 1.00 0.00 H new ATOM 0 HE21 GLN B 7 -10.038 9.349 -21.743 1.00 0.00 H new ATOM 0 HE22 GLN B 7 -10.166 10.809 -22.729 1.00 0.00 H new ATOM 1582 N GLY B 8 -11.860 10.647 -16.400 1.00 0.00 N ATOM 1583 CA GLY B 8 -12.173 11.392 -15.143 1.00 0.00 C ATOM 1584 C GLY B 8 -12.131 10.437 -13.949 1.00 0.00 C ATOM 1585 O GLY B 8 -11.771 9.285 -14.077 1.00 0.00 O ATOM 0 H GLY B 8 -11.850 9.630 -16.316 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -11.455 12.199 -15.000 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -13.158 11.852 -15.218 1.00 0.00 H new ATOM 1589 N THR B 9 -12.448 10.916 -12.779 1.00 0.00 N ATOM 1590 CA THR B 9 -12.366 10.039 -11.575 1.00 0.00 C ATOM 1591 C THR B 9 -13.729 9.924 -10.889 1.00 0.00 C ATOM 1592 O THR B 9 -14.683 10.585 -11.250 1.00 0.00 O ATOM 1593 CB THR B 9 -11.353 10.720 -10.653 1.00 0.00 C ATOM 1594 OG1 THR B 9 -11.463 12.129 -10.787 1.00 0.00 O ATOM 1595 CG2 THR B 9 -9.939 10.274 -11.031 1.00 0.00 C ATOM 0 H THR B 9 -12.759 11.871 -12.603 1.00 0.00 H new ATOM 0 HA THR B 9 -12.066 9.024 -11.834 1.00 0.00 H new ATOM 0 HB THR B 9 -11.555 10.440 -9.619 1.00 0.00 H new ATOM 0 HG1 THR B 9 -10.815 12.565 -10.195 1.00 0.00 H new ATOM 0 HG21 THR B 9 -9.217 10.759 -10.374 1.00 0.00 H new ATOM 0 HG22 THR B 9 -9.858 9.192 -10.924 1.00 0.00 H new ATOM 0 HG23 THR B 9 -9.734 10.553 -12.065 1.00 0.00 H new ATOM 1603 N ALA B 10 -13.828 9.055 -9.920 1.00 0.00 N ATOM 1604 CA ALA B 10 -15.126 8.841 -9.217 1.00 0.00 C ATOM 1605 C ALA B 10 -14.871 8.658 -7.725 1.00 0.00 C ATOM 1606 O ALA B 10 -13.850 8.147 -7.320 1.00 0.00 O ATOM 1607 CB ALA B 10 -15.701 7.560 -9.825 1.00 0.00 C ATOM 0 H ALA B 10 -13.058 8.478 -9.582 1.00 0.00 H new ATOM 0 HA ALA B 10 -15.810 9.682 -9.331 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -16.660 7.334 -9.358 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -15.843 7.698 -10.897 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -15.011 6.734 -9.654 1.00 0.00 H new ATOM 1613 N LYS B 11 -15.797 9.044 -6.904 1.00 0.00 N ATOM 1614 CA LYS B 11 -15.604 8.854 -5.440 1.00 0.00 C ATOM 1615 C LYS B 11 -16.470 7.703 -4.943 1.00 0.00 C ATOM 1616 O LYS B 11 -17.677 7.817 -4.867 1.00 0.00 O ATOM 1617 CB LYS B 11 -16.058 10.160 -4.803 1.00 0.00 C ATOM 1618 CG LYS B 11 -15.981 10.028 -3.281 1.00 0.00 C ATOM 1619 CD LYS B 11 -16.275 11.379 -2.633 1.00 0.00 C ATOM 1620 CE LYS B 11 -17.093 11.162 -1.358 1.00 0.00 C ATOM 1621 NZ LYS B 11 -17.446 12.531 -0.890 1.00 0.00 N ATOM 0 H LYS B 11 -16.677 9.481 -7.177 1.00 0.00 H new ATOM 0 HA LYS B 11 -14.570 8.615 -5.192 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -15.428 10.982 -5.141 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -17.078 10.393 -5.109 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -16.697 9.283 -2.934 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -14.991 9.680 -2.986 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -15.343 11.893 -2.398 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -16.824 12.016 -3.327 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -17.986 10.570 -1.558 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -16.516 10.624 -0.606 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -18.009 12.465 -0.018 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -16.576 13.068 -0.701 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -18.000 13.017 -1.624 1.00 0.00 H new ATOM 1635 N LEU B 12 -15.866 6.658 -4.464 1.00 0.00 N ATOM 1636 CA LEU B 12 -16.670 5.591 -3.817 1.00 0.00 C ATOM 1637 C LEU B 12 -17.413 6.188 -2.633 1.00 0.00 C ATOM 1638 O LEU B 12 -16.842 6.867 -1.804 1.00 0.00 O ATOM 1639 CB LEU B 12 -15.651 4.561 -3.338 1.00 0.00 C ATOM 1640 CG LEU B 12 -16.334 3.212 -3.116 1.00 0.00 C ATOM 1641 CD1 LEU B 12 -17.113 2.821 -4.373 1.00 0.00 C ATOM 1642 CD2 LEU B 12 -15.270 2.151 -2.829 1.00 0.00 C ATOM 0 H LEU B 12 -14.859 6.496 -4.491 1.00 0.00 H new ATOM 0 HA LEU B 12 -17.405 5.146 -4.487 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -14.854 4.457 -4.074 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -15.188 4.900 -2.411 1.00 0.00 H new ATOM 0 HG LEU B 12 -17.020 3.284 -2.272 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -17.600 1.859 -4.215 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -17.867 3.579 -4.584 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -16.428 2.746 -5.217 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -15.752 1.186 -2.670 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -14.588 2.081 -3.677 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -14.711 2.429 -1.936 1.00 0.00 H new ATOM 1654 N VAL B 13 -18.688 5.982 -2.572 1.00 0.00 N ATOM 1655 CA VAL B 13 -19.475 6.583 -1.466 1.00 0.00 C ATOM 1656 C VAL B 13 -20.329 5.522 -0.789 1.00 0.00 C ATOM 1657 O VAL B 13 -20.618 5.600 0.388 1.00 0.00 O ATOM 1658 CB VAL B 13 -20.343 7.654 -2.123 1.00 0.00 C ATOM 1659 CG1 VAL B 13 -20.967 7.134 -3.420 1.00 0.00 C ATOM 1660 CG2 VAL B 13 -21.452 8.075 -1.156 1.00 0.00 C ATOM 0 H VAL B 13 -19.223 5.424 -3.237 1.00 0.00 H new ATOM 0 HA VAL B 13 -18.838 7.009 -0.691 1.00 0.00 H new ATOM 0 HB VAL B 13 -19.713 8.510 -2.363 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -21.580 7.916 -3.868 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -20.177 6.849 -4.115 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -21.589 6.266 -3.202 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -22.072 8.839 -1.624 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -22.067 7.210 -0.909 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -21.008 8.476 -0.245 1.00 0.00 H new ATOM 1670 N SER B 14 -20.730 4.524 -1.516 1.00 0.00 N ATOM 1671 CA SER B 14 -21.560 3.455 -0.886 1.00 0.00 C ATOM 1672 C SER B 14 -21.291 2.087 -1.522 1.00 0.00 C ATOM 1673 O SER B 14 -21.241 1.954 -2.727 1.00 0.00 O ATOM 1674 CB SER B 14 -22.999 3.886 -1.146 1.00 0.00 C ATOM 1675 OG SER B 14 -23.743 3.795 0.061 1.00 0.00 O ATOM 0 H SER B 14 -20.525 4.397 -2.507 1.00 0.00 H new ATOM 0 HA SER B 14 -21.336 3.343 0.175 1.00 0.00 H new ATOM 0 HB2 SER B 14 -23.022 4.908 -1.524 1.00 0.00 H new ATOM 0 HB3 SER B 14 -23.448 3.253 -1.912 1.00 0.00 H new ATOM 0 HG SER B 14 -24.668 4.073 -0.103 1.00 0.00 H new ATOM 1681 N ILE B 15 -21.285 1.048 -0.726 1.00 0.00 N ATOM 1682 CA ILE B 15 -21.217 -0.327 -1.307 1.00 0.00 C ATOM 1683 C ILE B 15 -22.563 -1.028 -1.160 1.00 0.00 C ATOM 1684 O ILE B 15 -23.141 -1.070 -0.091 1.00 0.00 O ATOM 1685 CB ILE B 15 -20.164 -1.084 -0.502 1.00 0.00 C ATOM 1686 CG1 ILE B 15 -18.928 -0.210 -0.351 1.00 0.00 C ATOM 1687 CG2 ILE B 15 -19.801 -2.375 -1.241 1.00 0.00 C ATOM 1688 CD1 ILE B 15 -17.806 -1.003 0.327 1.00 0.00 C ATOM 0 H ILE B 15 -21.324 1.091 0.292 1.00 0.00 H new ATOM 0 HA ILE B 15 -20.967 -0.290 -2.367 1.00 0.00 H new ATOM 0 HB ILE B 15 -20.554 -1.330 0.486 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -18.598 0.140 -1.329 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -19.168 0.674 0.239 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -19.049 -2.921 -0.671 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -20.692 -2.993 -1.352 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -19.404 -2.131 -2.226 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -16.925 -0.370 0.431 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -18.136 -1.330 1.313 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -17.558 -1.874 -0.280 1.00 0.00 H new ATOM 1700 N ASP B 16 -23.001 -1.680 -2.192 1.00 0.00 N ATOM 1701 CA ASP B 16 -24.239 -2.498 -2.079 1.00 0.00 C ATOM 1702 C ASP B 16 -23.897 -3.986 -2.157 1.00 0.00 C ATOM 1703 O ASP B 16 -23.411 -4.467 -3.156 1.00 0.00 O ATOM 1704 CB ASP B 16 -25.104 -2.076 -3.264 1.00 0.00 C ATOM 1705 CG ASP B 16 -25.758 -0.727 -2.964 1.00 0.00 C ATOM 1706 OD1 ASP B 16 -25.837 -0.376 -1.798 1.00 0.00 O ATOM 1707 OD2 ASP B 16 -26.169 -0.067 -3.905 1.00 0.00 O ATOM 0 H ASP B 16 -22.558 -1.684 -3.111 1.00 0.00 H new ATOM 0 HA ASP B 16 -24.753 -2.343 -1.130 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -24.495 -2.004 -4.165 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -25.869 -2.828 -3.455 1.00 0.00 H new ATOM 1712 N GLU B 17 -24.115 -4.713 -1.097 1.00 0.00 N ATOM 1713 CA GLU B 17 -23.763 -6.161 -1.106 1.00 0.00 C ATOM 1714 C GLU B 17 -25.019 -7.016 -1.307 1.00 0.00 C ATOM 1715 O GLU B 17 -25.816 -7.185 -0.406 1.00 0.00 O ATOM 1716 CB GLU B 17 -23.149 -6.425 0.270 1.00 0.00 C ATOM 1717 CG GLU B 17 -21.815 -5.684 0.385 1.00 0.00 C ATOM 1718 CD GLU B 17 -21.200 -5.947 1.760 1.00 0.00 C ATOM 1719 OE1 GLU B 17 -21.779 -6.717 2.509 1.00 0.00 O ATOM 1720 OE2 GLU B 17 -20.160 -5.375 2.041 1.00 0.00 O ATOM 0 H GLU B 17 -24.521 -4.369 -0.227 1.00 0.00 H new ATOM 0 HA GLU B 17 -23.079 -6.413 -1.916 1.00 0.00 H new ATOM 0 HB2 GLU B 17 -23.830 -6.093 1.054 1.00 0.00 H new ATOM 0 HB3 GLU B 17 -22.996 -7.495 0.413 1.00 0.00 H new ATOM 0 HG2 GLU B 17 -21.134 -6.016 -0.399 1.00 0.00 H new ATOM 0 HG3 GLU B 17 -21.968 -4.614 0.242 1.00 0.00 H new ATOM 1727 N LYS B 18 -25.151 -7.631 -2.452 1.00 0.00 N ATOM 1728 CA LYS B 18 -26.296 -8.563 -2.670 1.00 0.00 C ATOM 1729 C LYS B 18 -25.803 -10.008 -2.584 1.00 0.00 C ATOM 1730 O LYS B 18 -24.784 -10.348 -3.151 1.00 0.00 O ATOM 1731 CB LYS B 18 -26.813 -8.260 -4.081 1.00 0.00 C ATOM 1732 CG LYS B 18 -26.823 -6.749 -4.320 1.00 0.00 C ATOM 1733 CD LYS B 18 -28.148 -6.349 -4.970 1.00 0.00 C ATOM 1734 CE LYS B 18 -29.261 -6.387 -3.922 1.00 0.00 C ATOM 1735 NZ LYS B 18 -30.375 -5.598 -4.518 1.00 0.00 N ATOM 0 H LYS B 18 -24.517 -7.529 -3.244 1.00 0.00 H new ATOM 0 HA LYS B 18 -27.079 -8.435 -1.923 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -26.181 -8.750 -4.822 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -27.818 -8.663 -4.203 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -26.693 -6.219 -3.376 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -25.989 -6.465 -4.962 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -28.069 -5.349 -5.396 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -28.383 -7.028 -5.790 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -29.570 -7.411 -3.711 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -28.930 -5.953 -2.978 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -31.178 -5.577 -3.857 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -30.053 -4.626 -4.702 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -30.673 -6.039 -5.412 1.00 0.00 H new ATOM 1749 N PRO B 19 -26.543 -10.811 -1.874 1.00 0.00 N ATOM 1750 CA PRO B 19 -26.172 -12.237 -1.699 1.00 0.00 C ATOM 1751 C PRO B 19 -25.931 -12.906 -3.057 1.00 0.00 C ATOM 1752 O PRO B 19 -25.314 -13.948 -3.143 1.00 0.00 O ATOM 1753 CB PRO B 19 -27.381 -12.853 -0.985 1.00 0.00 C ATOM 1754 CG PRO B 19 -28.463 -11.817 -1.044 1.00 0.00 C ATOM 1755 CD PRO B 19 -27.787 -10.482 -1.184 1.00 0.00 C ATOM 0 HA PRO B 19 -25.248 -12.366 -1.135 1.00 0.00 H new ATOM 0 HB2 PRO B 19 -27.696 -13.775 -1.474 1.00 0.00 H new ATOM 0 HB3 PRO B 19 -27.138 -13.106 0.047 1.00 0.00 H new ATOM 0 HG2 PRO B 19 -29.129 -12.002 -1.887 1.00 0.00 H new ATOM 0 HG3 PRO B 19 -29.075 -11.847 -0.142 1.00 0.00 H new ATOM 0 HD2 PRO B 19 -28.393 -9.781 -1.758 1.00 0.00 H new ATOM 0 HD3 PRO B 19 -27.600 -10.021 -0.214 1.00 0.00 H new ATOM 1763 N ASN B 20 -26.412 -12.317 -4.117 1.00 0.00 N ATOM 1764 CA ASN B 20 -26.206 -12.928 -5.468 1.00 0.00 C ATOM 1765 C ASN B 20 -25.038 -12.230 -6.157 1.00 0.00 C ATOM 1766 O ASN B 20 -24.342 -12.804 -6.970 1.00 0.00 O ATOM 1767 CB ASN B 20 -27.499 -12.676 -6.266 1.00 0.00 C ATOM 1768 CG ASN B 20 -28.711 -12.617 -5.334 1.00 0.00 C ATOM 1769 OD1 ASN B 20 -28.711 -13.320 -4.239 1.00 0.00 O flip ATOM 1770 ND2 ASN B 20 -29.669 -11.921 -5.608 1.00 0.00 N flip ATOM 0 H ASN B 20 -26.937 -11.443 -4.110 1.00 0.00 H new ATOM 0 HA ASN B 20 -25.987 -13.994 -5.398 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -27.414 -11.740 -6.819 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -27.638 -13.469 -7.001 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -29.670 -11.370 -6.466 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -30.472 -11.888 -4.980 1.00 0.00 H new ATOM 1777 N PHE B 21 -24.887 -10.965 -5.896 1.00 0.00 N ATOM 1778 CA PHE B 21 -23.833 -10.171 -6.596 1.00 0.00 C ATOM 1779 C PHE B 21 -23.338 -9.039 -5.693 1.00 0.00 C ATOM 1780 O PHE B 21 -24.101 -8.449 -4.958 1.00 0.00 O ATOM 1781 CB PHE B 21 -24.524 -9.593 -7.831 1.00 0.00 C ATOM 1782 CG PHE B 21 -25.144 -10.708 -8.639 1.00 0.00 C ATOM 1783 CD1 PHE B 21 -24.325 -11.654 -9.271 1.00 0.00 C ATOM 1784 CD2 PHE B 21 -26.537 -10.794 -8.760 1.00 0.00 C ATOM 1785 CE1 PHE B 21 -24.900 -12.688 -10.023 1.00 0.00 C ATOM 1786 CE2 PHE B 21 -27.113 -11.828 -9.513 1.00 0.00 C ATOM 1787 CZ PHE B 21 -26.295 -12.774 -10.145 1.00 0.00 C ATOM 0 H PHE B 21 -25.449 -10.440 -5.225 1.00 0.00 H new ATOM 0 HA PHE B 21 -22.967 -10.780 -6.856 1.00 0.00 H new ATOM 0 HB2 PHE B 21 -25.291 -8.880 -7.529 1.00 0.00 H new ATOM 0 HB3 PHE B 21 -23.803 -9.047 -8.440 1.00 0.00 H new ATOM 0 HD1 PHE B 21 -23.251 -11.586 -9.179 1.00 0.00 H new ATOM 0 HD2 PHE B 21 -27.167 -10.064 -8.274 1.00 0.00 H new ATOM 0 HE1 PHE B 21 -24.269 -13.418 -10.508 1.00 0.00 H new ATOM 0 HE2 PHE B 21 -28.187 -11.895 -9.606 1.00 0.00 H new ATOM 0 HZ PHE B 21 -26.738 -13.569 -10.726 1.00 0.00 H new ATOM 1797 N ARG B 22 -22.107 -8.638 -5.836 1.00 0.00 N ATOM 1798 CA ARG B 22 -21.647 -7.439 -5.082 1.00 0.00 C ATOM 1799 C ARG B 22 -21.794 -6.190 -5.947 1.00 0.00 C ATOM 1800 O ARG B 22 -21.667 -6.234 -7.153 1.00 0.00 O ATOM 1801 CB ARG B 22 -20.182 -7.687 -4.734 1.00 0.00 C ATOM 1802 CG ARG B 22 -19.657 -6.508 -3.911 1.00 0.00 C ATOM 1803 CD ARG B 22 -18.298 -6.864 -3.306 1.00 0.00 C ATOM 1804 NE ARG B 22 -17.893 -5.645 -2.548 1.00 0.00 N ATOM 1805 CZ ARG B 22 -17.037 -5.732 -1.563 1.00 0.00 C ATOM 1806 NH1 ARG B 22 -16.514 -6.886 -1.242 1.00 0.00 N ATOM 1807 NH2 ARG B 22 -16.700 -4.660 -0.901 1.00 0.00 N ATOM 0 H ARG B 22 -21.408 -9.080 -6.433 1.00 0.00 H new ATOM 0 HA ARG B 22 -22.239 -7.280 -4.181 1.00 0.00 H new ATOM 0 HB2 ARG B 22 -20.081 -8.614 -4.170 1.00 0.00 H new ATOM 0 HB3 ARG B 22 -19.593 -7.802 -5.644 1.00 0.00 H new ATOM 0 HG2 ARG B 22 -19.564 -5.624 -4.542 1.00 0.00 H new ATOM 0 HG3 ARG B 22 -20.365 -6.261 -3.119 1.00 0.00 H new ATOM 0 HD2 ARG B 22 -18.371 -7.732 -2.651 1.00 0.00 H new ATOM 0 HD3 ARG B 22 -17.571 -7.109 -4.080 1.00 0.00 H new ATOM 0 HE ARG B 22 -18.286 -4.738 -2.799 1.00 0.00 H new ATOM 0 HH11 ARG B 22 -16.773 -7.725 -1.761 1.00 0.00 H new ATOM 0 HH12 ARG B 22 -15.847 -6.947 -0.473 1.00 0.00 H new ATOM 0 HH21 ARG B 22 -17.104 -3.758 -1.152 1.00 0.00 H new ATOM 0 HH22 ARG B 22 -16.033 -4.724 -0.132 1.00 0.00 H new ATOM 1821 N THR B 23 -22.152 -5.101 -5.337 1.00 0.00 N ATOM 1822 CA THR B 23 -22.421 -3.858 -6.110 1.00 0.00 C ATOM 1823 C THR B 23 -21.656 -2.690 -5.491 1.00 0.00 C ATOM 1824 O THR B 23 -21.588 -2.558 -4.287 1.00 0.00 O ATOM 1825 CB THR B 23 -23.928 -3.635 -5.969 1.00 0.00 C ATOM 1826 OG1 THR B 23 -24.625 -4.675 -6.640 1.00 0.00 O ATOM 1827 CG2 THR B 23 -24.308 -2.284 -6.577 1.00 0.00 C ATOM 0 H THR B 23 -22.272 -5.015 -4.328 1.00 0.00 H new ATOM 0 HA THR B 23 -22.110 -3.935 -7.152 1.00 0.00 H new ATOM 0 HB THR B 23 -24.198 -3.641 -4.913 1.00 0.00 H new ATOM 0 HG1 THR B 23 -25.590 -4.534 -6.549 1.00 0.00 H new ATOM 0 HG21 THR B 23 -25.382 -2.128 -6.475 1.00 0.00 H new ATOM 0 HG22 THR B 23 -23.775 -1.488 -6.057 1.00 0.00 H new ATOM 0 HG23 THR B 23 -24.038 -2.271 -7.633 1.00 0.00 H new ATOM 1835 N HIS B 24 -21.087 -1.836 -6.292 1.00 0.00 N ATOM 1836 CA HIS B 24 -20.348 -0.681 -5.714 1.00 0.00 C ATOM 1837 C HIS B 24 -20.783 0.632 -6.359 1.00 0.00 C ATOM 1838 O HIS B 24 -20.974 0.716 -7.551 1.00 0.00 O ATOM 1839 CB HIS B 24 -18.884 -0.971 -6.002 1.00 0.00 C ATOM 1840 CG HIS B 24 -18.232 -1.393 -4.718 1.00 0.00 C ATOM 1841 ND1 HIS B 24 -17.438 -2.525 -4.619 1.00 0.00 N ATOM 1842 CD2 HIS B 24 -18.288 -0.861 -3.455 1.00 0.00 C ATOM 1843 CE1 HIS B 24 -17.057 -2.636 -3.332 1.00 0.00 C ATOM 1844 NE2 HIS B 24 -17.546 -1.646 -2.582 1.00 0.00 N ATOM 0 H HIS B 24 -21.100 -1.885 -7.311 1.00 0.00 H new ATOM 0 HA HIS B 24 -20.542 -0.567 -4.647 1.00 0.00 H new ATOM 0 HB2 HIS B 24 -18.792 -1.757 -6.752 1.00 0.00 H new ATOM 0 HB3 HIS B 24 -18.393 -0.086 -6.406 1.00 0.00 H new ATOM 0 HD1 HIS B 24 -17.189 -3.157 -5.380 1.00 0.00 H new ATOM 0 HD2 HIS B 24 -18.828 0.033 -3.181 1.00 0.00 H new ATOM 0 HE1 HIS B 24 -16.431 -3.430 -2.953 1.00 0.00 H new ATOM 1852 N VAL B 25 -20.996 1.646 -5.566 1.00 0.00 N ATOM 1853 CA VAL B 25 -21.490 2.931 -6.129 1.00 0.00 C ATOM 1854 C VAL B 25 -20.475 4.046 -5.903 1.00 0.00 C ATOM 1855 O VAL B 25 -19.977 4.245 -4.810 1.00 0.00 O ATOM 1856 CB VAL B 25 -22.778 3.236 -5.376 1.00 0.00 C ATOM 1857 CG1 VAL B 25 -23.559 4.323 -6.115 1.00 0.00 C ATOM 1858 CG2 VAL B 25 -23.629 1.968 -5.274 1.00 0.00 C ATOM 0 H VAL B 25 -20.850 1.639 -4.557 1.00 0.00 H new ATOM 0 HA VAL B 25 -21.650 2.860 -7.205 1.00 0.00 H new ATOM 0 HB VAL B 25 -22.535 3.586 -4.373 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -24.480 4.540 -5.575 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -22.954 5.227 -6.178 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -23.801 3.978 -7.120 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -24.550 2.190 -4.735 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -23.872 1.611 -6.275 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -23.072 1.198 -4.740 1.00 0.00 H new ATOM 1868 N VAL B 26 -20.189 4.784 -6.932 1.00 0.00 N ATOM 1869 CA VAL B 26 -19.225 5.907 -6.812 1.00 0.00 C ATOM 1870 C VAL B 26 -19.945 7.240 -7.022 1.00 0.00 C ATOM 1871 O VAL B 26 -21.092 7.277 -7.415 1.00 0.00 O ATOM 1872 CB VAL B 26 -18.220 5.675 -7.937 1.00 0.00 C ATOM 1873 CG1 VAL B 26 -17.707 4.234 -7.882 1.00 0.00 C ATOM 1874 CG2 VAL B 26 -18.906 5.922 -9.285 1.00 0.00 C ATOM 0 H VAL B 26 -20.586 4.656 -7.863 1.00 0.00 H new ATOM 0 HA VAL B 26 -18.751 5.945 -5.831 1.00 0.00 H new ATOM 0 HB VAL B 26 -17.380 6.360 -7.821 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -16.990 4.072 -8.687 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -17.222 4.057 -6.922 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -18.544 3.545 -7.998 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -18.192 5.758 -10.092 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -19.745 5.236 -9.397 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -19.269 6.949 -9.326 1.00 0.00 H new ATOM 1884 N GLU B 27 -19.267 8.332 -6.795 1.00 0.00 N ATOM 1885 CA GLU B 27 -19.888 9.660 -7.011 1.00 0.00 C ATOM 1886 C GLU B 27 -19.331 10.269 -8.292 1.00 0.00 C ATOM 1887 O GLU B 27 -18.135 10.413 -8.454 1.00 0.00 O ATOM 1888 CB GLU B 27 -19.455 10.467 -5.796 1.00 0.00 C ATOM 1889 CG GLU B 27 -20.537 11.478 -5.416 1.00 0.00 C ATOM 1890 CD GLU B 27 -20.340 11.916 -3.963 1.00 0.00 C ATOM 1891 OE1 GLU B 27 -19.350 11.515 -3.373 1.00 0.00 O ATOM 1892 OE2 GLU B 27 -21.182 12.645 -3.465 1.00 0.00 O ATOM 0 H GLU B 27 -18.302 8.356 -6.466 1.00 0.00 H new ATOM 0 HA GLU B 27 -20.972 9.626 -7.116 1.00 0.00 H new ATOM 0 HB2 GLU B 27 -19.262 9.798 -4.957 1.00 0.00 H new ATOM 0 HB3 GLU B 27 -18.521 10.987 -6.010 1.00 0.00 H new ATOM 0 HG2 GLU B 27 -20.489 12.343 -6.077 1.00 0.00 H new ATOM 0 HG3 GLU B 27 -21.525 11.034 -5.542 1.00 0.00 H new ATOM 1899 N LEU B 28 -20.176 10.491 -9.248 1.00 0.00 N ATOM 1900 CA LEU B 28 -19.700 10.935 -10.584 1.00 0.00 C ATOM 1901 C LEU B 28 -19.488 12.455 -10.588 1.00 0.00 C ATOM 1902 O LEU B 28 -20.406 13.208 -10.328 1.00 0.00 O ATOM 1903 CB LEU B 28 -20.834 10.527 -11.525 1.00 0.00 C ATOM 1904 CG LEU B 28 -20.290 10.198 -12.918 1.00 0.00 C ATOM 1905 CD1 LEU B 28 -19.124 9.212 -12.801 1.00 0.00 C ATOM 1906 CD2 LEU B 28 -21.403 9.560 -13.751 1.00 0.00 C ATOM 0 H LEU B 28 -21.187 10.384 -9.164 1.00 0.00 H new ATOM 0 HA LEU B 28 -18.745 10.496 -10.874 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -21.356 9.660 -11.119 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -21.563 11.334 -11.595 1.00 0.00 H new ATOM 0 HG LEU B 28 -19.942 11.114 -13.396 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -18.741 8.982 -13.795 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -18.330 9.657 -12.201 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -19.469 8.295 -12.324 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -21.023 9.323 -14.745 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -21.743 8.646 -13.265 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -22.237 10.256 -13.838 1.00 0.00 H new ATOM 1918 N PRO B 29 -18.276 12.855 -10.873 1.00 0.00 N ATOM 1919 CA PRO B 29 -17.933 14.301 -10.898 1.00 0.00 C ATOM 1920 C PRO B 29 -18.666 15.019 -12.033 1.00 0.00 C ATOM 1921 O PRO B 29 -19.423 14.426 -12.774 1.00 0.00 O ATOM 1922 CB PRO B 29 -16.427 14.320 -11.128 1.00 0.00 C ATOM 1923 CG PRO B 29 -16.095 12.982 -11.708 1.00 0.00 C ATOM 1924 CD PRO B 29 -17.123 12.011 -11.197 1.00 0.00 C ATOM 0 HA PRO B 29 -18.224 14.815 -9.982 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -16.144 15.124 -11.808 1.00 0.00 H new ATOM 0 HB3 PRO B 29 -15.889 14.488 -10.195 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -16.109 13.020 -12.797 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -15.092 12.672 -11.413 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -17.374 11.263 -11.949 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -16.763 11.473 -10.320 1.00 0.00 H new ATOM 1932 N ASP B 30 -18.511 16.312 -12.111 1.00 0.00 N ATOM 1933 CA ASP B 30 -19.272 17.103 -13.121 1.00 0.00 C ATOM 1934 C ASP B 30 -18.947 16.637 -14.544 1.00 0.00 C ATOM 1935 O ASP B 30 -19.801 16.639 -15.409 1.00 0.00 O ATOM 1936 CB ASP B 30 -18.814 18.548 -12.913 1.00 0.00 C ATOM 1937 CG ASP B 30 -19.536 19.462 -13.904 1.00 0.00 C ATOM 1938 OD1 ASP B 30 -20.065 18.950 -14.877 1.00 0.00 O ATOM 1939 OD2 ASP B 30 -19.544 20.661 -13.675 1.00 0.00 O ATOM 0 H ASP B 30 -17.887 16.858 -11.516 1.00 0.00 H new ATOM 0 HA ASP B 30 -20.349 16.987 -12.999 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -19.025 18.864 -11.891 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -17.736 18.622 -13.053 1.00 0.00 H new ATOM 1944 N HIS B 31 -17.708 16.336 -14.826 1.00 0.00 N ATOM 1945 CA HIS B 31 -17.340 15.989 -16.231 1.00 0.00 C ATOM 1946 C HIS B 31 -17.479 14.483 -16.475 1.00 0.00 C ATOM 1947 O HIS B 31 -17.352 14.016 -17.590 1.00 0.00 O ATOM 1948 CB HIS B 31 -15.891 16.456 -16.413 1.00 0.00 C ATOM 1949 CG HIS B 31 -14.955 15.661 -15.544 1.00 0.00 C ATOM 1950 ND1 HIS B 31 -15.394 14.837 -14.518 1.00 0.00 N ATOM 1951 CD2 HIS B 31 -13.586 15.568 -15.537 1.00 0.00 C ATOM 1952 CE1 HIS B 31 -14.305 14.291 -13.944 1.00 0.00 C ATOM 1953 NE2 HIS B 31 -13.177 14.703 -14.528 1.00 0.00 N ATOM 0 H HIS B 31 -16.941 16.315 -14.153 1.00 0.00 H new ATOM 0 HA HIS B 31 -18.000 16.473 -16.951 1.00 0.00 H new ATOM 0 HB2 HIS B 31 -15.600 16.351 -17.458 1.00 0.00 H new ATOM 0 HB3 HIS B 31 -15.812 17.514 -16.165 1.00 0.00 H new ATOM 0 HD2 HIS B 31 -12.925 16.089 -16.214 1.00 0.00 H new ATOM 0 HE1 HIS B 31 -14.340 13.603 -13.112 1.00 0.00 H new ATOM 0 HE2 HIS B 31 -12.222 14.440 -14.286 1.00 0.00 H new ATOM 1961 N MET B 32 -17.885 13.747 -15.479 1.00 0.00 N ATOM 1962 CA MET B 32 -18.202 12.307 -15.702 1.00 0.00 C ATOM 1963 C MET B 32 -19.702 12.064 -15.512 1.00 0.00 C ATOM 1964 O MET B 32 -20.223 11.030 -15.875 1.00 0.00 O ATOM 1965 CB MET B 32 -17.398 11.548 -14.648 1.00 0.00 C ATOM 1966 CG MET B 32 -15.908 11.625 -14.986 1.00 0.00 C ATOM 1967 SD MET B 32 -15.621 10.884 -16.612 1.00 0.00 S ATOM 1968 CE MET B 32 -15.987 9.174 -16.148 1.00 0.00 C ATOM 0 H MET B 32 -18.011 14.078 -14.522 1.00 0.00 H new ATOM 0 HA MET B 32 -17.950 11.982 -16.711 1.00 0.00 H new ATOM 0 HB2 MET B 32 -17.580 11.974 -13.661 1.00 0.00 H new ATOM 0 HB3 MET B 32 -17.719 10.507 -14.611 1.00 0.00 H new ATOM 0 HG2 MET B 32 -15.577 12.663 -14.984 1.00 0.00 H new ATOM 0 HG3 MET B 32 -15.324 11.103 -14.228 1.00 0.00 H new ATOM 0 HE1 MET B 32 -15.314 8.501 -16.679 1.00 0.00 H new ATOM 0 HE2 MET B 32 -15.850 9.051 -15.074 1.00 0.00 H new ATOM 0 HE3 MET B 32 -17.018 8.938 -16.411 1.00 0.00 H new ATOM 1978 N LEU B 33 -20.405 13.031 -14.986 1.00 0.00 N ATOM 1979 CA LEU B 33 -21.879 12.883 -14.821 1.00 0.00 C ATOM 1980 C LEU B 33 -22.563 12.908 -16.186 1.00 0.00 C ATOM 1981 O LEU B 33 -23.612 12.327 -16.381 1.00 0.00 O ATOM 1982 CB LEU B 33 -22.307 14.089 -13.982 1.00 0.00 C ATOM 1983 CG LEU B 33 -22.080 13.796 -12.497 1.00 0.00 C ATOM 1984 CD1 LEU B 33 -22.058 15.109 -11.713 1.00 0.00 C ATOM 1985 CD2 LEU B 33 -23.220 12.919 -11.981 1.00 0.00 C ATOM 0 H LEU B 33 -20.021 13.919 -14.663 1.00 0.00 H new ATOM 0 HA LEU B 33 -22.151 11.941 -14.345 1.00 0.00 H new ATOM 0 HB2 LEU B 33 -21.738 14.970 -14.279 1.00 0.00 H new ATOM 0 HB3 LEU B 33 -23.359 14.313 -14.161 1.00 0.00 H new ATOM 0 HG LEU B 33 -21.128 13.281 -12.367 1.00 0.00 H new ATOM 0 HD11 LEU B 33 -21.896 14.899 -10.656 1.00 0.00 H new ATOM 0 HD12 LEU B 33 -21.252 15.741 -12.085 1.00 0.00 H new ATOM 0 HD13 LEU B 33 -23.010 15.624 -11.839 1.00 0.00 H new ATOM 0 HD21 LEU B 33 -23.065 12.706 -10.923 1.00 0.00 H new ATOM 0 HD22 LEU B 33 -24.168 13.441 -12.111 1.00 0.00 H new ATOM 0 HD23 LEU B 33 -23.241 11.984 -12.540 1.00 0.00 H new ATOM 1997 N ASP B 34 -22.010 13.642 -17.107 1.00 0.00 N ATOM 1998 CA ASP B 34 -22.656 13.792 -18.440 1.00 0.00 C ATOM 1999 C ASP B 34 -22.368 12.576 -19.328 1.00 0.00 C ATOM 2000 O ASP B 34 -21.241 12.141 -19.452 1.00 0.00 O ATOM 2001 CB ASP B 34 -22.012 15.046 -19.027 1.00 0.00 C ATOM 2002 CG ASP B 34 -22.518 16.280 -18.279 1.00 0.00 C ATOM 2003 OD1 ASP B 34 -23.557 16.182 -17.648 1.00 0.00 O ATOM 2004 OD2 ASP B 34 -21.856 17.303 -18.350 1.00 0.00 O ATOM 0 H ASP B 34 -21.132 14.149 -16.994 1.00 0.00 H new ATOM 0 HA ASP B 34 -23.741 13.868 -18.369 1.00 0.00 H new ATOM 0 HB2 ASP B 34 -20.927 14.980 -18.949 1.00 0.00 H new ATOM 0 HB3 ASP B 34 -22.251 15.128 -20.087 1.00 0.00 H new ATOM 2009 N GLY B 35 -23.349 12.132 -20.070 1.00 0.00 N ATOM 2010 CA GLY B 35 -23.092 11.073 -21.090 1.00 0.00 C ATOM 2011 C GLY B 35 -23.352 9.682 -20.500 1.00 0.00 C ATOM 2012 O GLY B 35 -23.775 8.780 -21.197 1.00 0.00 O ATOM 0 H GLY B 35 -24.315 12.456 -20.014 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -23.733 11.232 -21.957 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -22.062 11.139 -21.439 1.00 0.00 H new ATOM 2016 N LEU B 36 -22.997 9.464 -19.263 1.00 0.00 N ATOM 2017 CA LEU B 36 -23.111 8.089 -18.694 1.00 0.00 C ATOM 2018 C LEU B 36 -24.561 7.764 -18.320 1.00 0.00 C ATOM 2019 O LEU B 36 -25.301 8.607 -17.853 1.00 0.00 O ATOM 2020 CB LEU B 36 -22.229 8.094 -17.445 1.00 0.00 C ATOM 2021 CG LEU B 36 -22.282 6.714 -16.786 1.00 0.00 C ATOM 2022 CD1 LEU B 36 -21.709 5.668 -17.745 1.00 0.00 C ATOM 2023 CD2 LEU B 36 -21.455 6.730 -15.499 1.00 0.00 C ATOM 0 H LEU B 36 -22.635 10.173 -18.625 1.00 0.00 H new ATOM 0 HA LEU B 36 -22.800 7.333 -19.415 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -21.202 8.344 -17.711 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -22.572 8.857 -16.746 1.00 0.00 H new ATOM 0 HG LEU B 36 -23.317 6.465 -16.551 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -21.747 4.685 -17.276 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -22.297 5.655 -18.663 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -20.675 5.918 -17.981 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -21.493 5.747 -15.030 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -20.420 6.980 -15.734 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -21.861 7.475 -14.815 1.00 0.00 H new ATOM 2035 N GLU B 37 -24.935 6.519 -18.438 1.00 0.00 N ATOM 2036 CA GLU B 37 -26.293 6.088 -17.999 1.00 0.00 C ATOM 2037 C GLU B 37 -26.233 4.634 -17.519 1.00 0.00 C ATOM 2038 O GLU B 37 -25.234 3.965 -17.681 1.00 0.00 O ATOM 2039 CB GLU B 37 -27.177 6.208 -19.240 1.00 0.00 C ATOM 2040 CG GLU B 37 -26.732 5.183 -20.286 1.00 0.00 C ATOM 2041 CD GLU B 37 -27.617 5.303 -21.529 1.00 0.00 C ATOM 2042 OE1 GLU B 37 -28.663 5.923 -21.429 1.00 0.00 O ATOM 2043 OE2 GLU B 37 -27.236 4.770 -22.557 1.00 0.00 O ATOM 0 H GLU B 37 -24.353 5.776 -18.823 1.00 0.00 H new ATOM 0 HA GLU B 37 -26.678 6.691 -17.177 1.00 0.00 H new ATOM 0 HB2 GLU B 37 -28.221 6.041 -18.973 1.00 0.00 H new ATOM 0 HB3 GLU B 37 -27.110 7.215 -19.651 1.00 0.00 H new ATOM 0 HG2 GLU B 37 -25.688 5.350 -20.552 1.00 0.00 H new ATOM 0 HG3 GLU B 37 -26.799 4.176 -19.875 1.00 0.00 H new ATOM 2050 N THR B 38 -27.277 4.143 -16.913 1.00 0.00 N ATOM 2051 CA THR B 38 -27.242 2.739 -16.409 1.00 0.00 C ATOM 2052 C THR B 38 -27.076 1.762 -17.582 1.00 0.00 C ATOM 2053 O THR B 38 -27.419 2.068 -18.706 1.00 0.00 O ATOM 2054 CB THR B 38 -28.585 2.524 -15.718 1.00 0.00 C ATOM 2055 OG1 THR B 38 -29.492 3.545 -16.109 1.00 0.00 O ATOM 2056 CG2 THR B 38 -28.397 2.552 -14.200 1.00 0.00 C ATOM 0 H THR B 38 -28.148 4.647 -16.745 1.00 0.00 H new ATOM 0 HA THR B 38 -26.408 2.567 -15.729 1.00 0.00 H new ATOM 0 HB THR B 38 -28.988 1.554 -16.010 1.00 0.00 H new ATOM 0 HG1 THR B 38 -30.354 3.404 -15.665 1.00 0.00 H new ATOM 0 HG21 THR B 38 -29.359 2.398 -13.711 1.00 0.00 H new ATOM 0 HG22 THR B 38 -27.709 1.760 -13.904 1.00 0.00 H new ATOM 0 HG23 THR B 38 -27.989 3.518 -13.902 1.00 0.00 H new ATOM 2064 N GLY B 39 -26.481 0.622 -17.344 1.00 0.00 N ATOM 2065 CA GLY B 39 -26.212 -0.334 -18.456 1.00 0.00 C ATOM 2066 C GLY B 39 -24.987 0.131 -19.248 1.00 0.00 C ATOM 2067 O GLY B 39 -24.506 -0.557 -20.127 1.00 0.00 O ATOM 0 H GLY B 39 -26.169 0.312 -16.424 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -26.041 -1.334 -18.056 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -27.080 -0.397 -19.113 1.00 0.00 H new ATOM 2071 N ALA B 40 -24.439 1.264 -18.900 1.00 0.00 N ATOM 2072 CA ALA B 40 -23.203 1.739 -19.581 1.00 0.00 C ATOM 2073 C ALA B 40 -21.998 0.968 -19.044 1.00 0.00 C ATOM 2074 O ALA B 40 -22.036 0.437 -17.953 1.00 0.00 O ATOM 2075 CB ALA B 40 -23.102 3.216 -19.204 1.00 0.00 C ATOM 0 H ALA B 40 -24.796 1.882 -18.171 1.00 0.00 H new ATOM 0 HA ALA B 40 -23.228 1.592 -20.661 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -22.215 3.649 -19.665 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -23.988 3.743 -19.557 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -23.031 3.311 -18.120 1.00 0.00 H new ATOM 2081 N SER B 41 -20.920 0.918 -19.776 1.00 0.00 N ATOM 2082 CA SER B 41 -19.724 0.201 -19.259 1.00 0.00 C ATOM 2083 C SER B 41 -18.710 1.201 -18.704 1.00 0.00 C ATOM 2084 O SER B 41 -18.022 1.876 -19.441 1.00 0.00 O ATOM 2085 CB SER B 41 -19.149 -0.539 -20.462 1.00 0.00 C ATOM 2086 OG SER B 41 -19.525 0.135 -21.654 1.00 0.00 O ATOM 0 H SER B 41 -20.816 1.338 -20.700 1.00 0.00 H new ATOM 0 HA SER B 41 -19.972 -0.483 -18.447 1.00 0.00 H new ATOM 0 HB2 SER B 41 -18.063 -0.589 -20.387 1.00 0.00 H new ATOM 0 HB3 SER B 41 -19.515 -1.565 -20.481 1.00 0.00 H new ATOM 0 HG SER B 41 -19.371 1.097 -21.548 1.00 0.00 H new ATOM 2092 N VAL B 42 -18.541 1.223 -17.412 1.00 0.00 N ATOM 2093 CA VAL B 42 -17.487 2.087 -16.815 1.00 0.00 C ATOM 2094 C VAL B 42 -16.255 1.238 -16.512 1.00 0.00 C ATOM 2095 O VAL B 42 -16.323 0.273 -15.779 1.00 0.00 O ATOM 2096 CB VAL B 42 -18.113 2.654 -15.526 1.00 0.00 C ATOM 2097 CG1 VAL B 42 -17.061 2.860 -14.443 1.00 0.00 C ATOM 2098 CG2 VAL B 42 -18.740 4.006 -15.818 1.00 0.00 C ATOM 0 H VAL B 42 -19.088 0.680 -16.744 1.00 0.00 H new ATOM 0 HA VAL B 42 -17.166 2.891 -17.477 1.00 0.00 H new ATOM 0 HB VAL B 42 -18.858 1.938 -15.180 1.00 0.00 H new ATOM 0 HG11 VAL B 42 -17.535 3.261 -13.547 1.00 0.00 H new ATOM 0 HG12 VAL B 42 -16.589 1.906 -14.208 1.00 0.00 H new ATOM 0 HG13 VAL B 42 -16.305 3.561 -14.798 1.00 0.00 H new ATOM 0 HG21 VAL B 42 -19.183 4.406 -14.906 1.00 0.00 H new ATOM 0 HG22 VAL B 42 -17.974 4.691 -16.181 1.00 0.00 H new ATOM 0 HG23 VAL B 42 -19.514 3.892 -16.577 1.00 0.00 H new ATOM 2108 N ALA B 43 -15.112 1.679 -16.940 1.00 0.00 N ATOM 2109 CA ALA B 43 -13.870 0.990 -16.523 1.00 0.00 C ATOM 2110 C ALA B 43 -13.280 1.708 -15.312 1.00 0.00 C ATOM 2111 O ALA B 43 -12.916 2.866 -15.381 1.00 0.00 O ATOM 2112 CB ALA B 43 -12.929 1.089 -17.722 1.00 0.00 C ATOM 0 H ALA B 43 -14.985 2.482 -17.557 1.00 0.00 H new ATOM 0 HA ALA B 43 -14.040 -0.049 -16.239 1.00 0.00 H new ATOM 0 HB1 ALA B 43 -11.985 0.598 -17.485 1.00 0.00 H new ATOM 0 HB2 ALA B 43 -13.385 0.602 -18.584 1.00 0.00 H new ATOM 0 HB3 ALA B 43 -12.744 2.138 -17.954 1.00 0.00 H new ATOM 2118 N HIS B 44 -13.145 1.018 -14.215 1.00 0.00 N ATOM 2119 CA HIS B 44 -12.529 1.646 -13.016 1.00 0.00 C ATOM 2120 C HIS B 44 -11.014 1.450 -13.077 1.00 0.00 C ATOM 2121 O HIS B 44 -10.521 0.340 -13.099 1.00 0.00 O ATOM 2122 CB HIS B 44 -13.135 0.908 -11.822 1.00 0.00 C ATOM 2123 CG HIS B 44 -14.437 1.556 -11.420 1.00 0.00 C ATOM 2124 ND1 HIS B 44 -15.336 2.093 -12.343 1.00 0.00 N ATOM 2125 CD2 HIS B 44 -15.009 1.752 -10.186 1.00 0.00 C ATOM 2126 CE1 HIS B 44 -16.385 2.577 -11.648 1.00 0.00 C ATOM 2127 NE2 HIS B 44 -16.231 2.393 -10.339 1.00 0.00 N ATOM 0 H HIS B 44 -13.435 0.047 -14.097 1.00 0.00 H new ATOM 0 HA HIS B 44 -12.716 2.718 -12.948 1.00 0.00 H new ATOM 0 HB2 HIS B 44 -13.304 -0.138 -12.078 1.00 0.00 H new ATOM 0 HB3 HIS B 44 -12.438 0.922 -10.984 1.00 0.00 H new ATOM 0 HD1 HIS B 44 -15.221 2.115 -13.356 1.00 0.00 H new ATOM 0 HD2 HIS B 44 -14.575 1.454 -9.243 1.00 0.00 H new ATOM 0 HE1 HIS B 44 -17.243 3.054 -12.097 1.00 0.00 H new ATOM 2136 N ASN B 45 -10.314 2.506 -13.365 1.00 0.00 N ATOM 2137 CA ASN B 45 -8.876 2.395 -13.727 1.00 0.00 C ATOM 2138 C ASN B 45 -8.682 1.436 -14.904 1.00 0.00 C ATOM 2139 O ASN B 45 -7.569 1.132 -15.274 1.00 0.00 O ATOM 2140 CB ASN B 45 -8.172 1.864 -12.480 1.00 0.00 C ATOM 2141 CG ASN B 45 -6.788 2.503 -12.395 1.00 0.00 C ATOM 2142 OD1 ASN B 45 -6.600 3.510 -11.591 1.00 0.00 O flip ATOM 2143 ND2 ASN B 45 -5.867 2.080 -13.066 1.00 0.00 N flip ATOM 0 H ASN B 45 -10.682 3.457 -13.365 1.00 0.00 H new ATOM 0 HA ASN B 45 -8.470 3.358 -14.038 1.00 0.00 H new ATOM 0 HB2 ASN B 45 -8.753 2.099 -11.588 1.00 0.00 H new ATOM 0 HB3 ASN B 45 -8.086 0.778 -12.527 1.00 0.00 H new ATOM 0 HD21 ASN B 45 -6.015 1.291 -13.696 1.00 0.00 H new ATOM 0 HD22 ASN B 45 -4.946 2.514 -12.999 1.00 0.00 H new ATOM 2150 N GLY B 46 -9.737 1.083 -15.591 1.00 0.00 N ATOM 2151 CA GLY B 46 -9.568 0.287 -16.836 1.00 0.00 C ATOM 2152 C GLY B 46 -10.244 -1.083 -16.697 1.00 0.00 C ATOM 2153 O GLY B 46 -10.290 -1.844 -17.637 1.00 0.00 O ATOM 0 H GLY B 46 -10.700 1.311 -15.344 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -9.998 0.827 -17.680 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -8.507 0.155 -17.049 1.00 0.00 H new ATOM 2157 N CYS B 47 -10.846 -1.378 -15.572 1.00 0.00 N ATOM 2158 CA CYS B 47 -11.590 -2.667 -15.459 1.00 0.00 C ATOM 2159 C CYS B 47 -13.061 -2.437 -15.803 1.00 0.00 C ATOM 2160 O CYS B 47 -13.762 -1.736 -15.103 1.00 0.00 O ATOM 2161 CB CYS B 47 -11.435 -3.102 -14.000 1.00 0.00 C ATOM 2162 SG CYS B 47 -12.091 -4.776 -13.799 1.00 0.00 S ATOM 0 H CYS B 47 -10.855 -0.790 -14.738 1.00 0.00 H new ATOM 0 HA CYS B 47 -11.211 -3.429 -16.140 1.00 0.00 H new ATOM 0 HB2 CYS B 47 -10.385 -3.074 -13.710 1.00 0.00 H new ATOM 0 HB3 CYS B 47 -11.965 -2.411 -13.345 1.00 0.00 H new ATOM 0 HG CYS B 47 -13.390 -4.740 -13.831 1.00 0.00 H new ATOM 2168 N CYS B 48 -13.482 -2.868 -16.963 1.00 0.00 N ATOM 2169 CA CYS B 48 -14.843 -2.492 -17.440 1.00 0.00 C ATOM 2170 C CYS B 48 -15.925 -3.258 -16.676 1.00 0.00 C ATOM 2171 O CYS B 48 -15.953 -4.473 -16.662 1.00 0.00 O ATOM 2172 CB CYS B 48 -14.868 -2.873 -18.920 1.00 0.00 C ATOM 2173 SG CYS B 48 -14.493 -4.634 -19.097 1.00 0.00 S ATOM 0 H CYS B 48 -12.945 -3.460 -17.597 1.00 0.00 H new ATOM 0 HA CYS B 48 -15.044 -1.432 -17.283 1.00 0.00 H new ATOM 0 HB2 CYS B 48 -15.847 -2.654 -19.346 1.00 0.00 H new ATOM 0 HB3 CYS B 48 -14.140 -2.278 -19.472 1.00 0.00 H new ATOM 0 HG CYS B 48 -13.261 -4.778 -19.487 1.00 0.00 H new ATOM 2179 N LEU B 49 -16.892 -2.548 -16.172 1.00 0.00 N ATOM 2180 CA LEU B 49 -18.074 -3.210 -15.552 1.00 0.00 C ATOM 2181 C LEU B 49 -19.324 -2.364 -15.824 1.00 0.00 C ATOM 2182 O LEU B 49 -19.226 -1.253 -16.304 1.00 0.00 O ATOM 2183 CB LEU B 49 -17.762 -3.284 -14.055 1.00 0.00 C ATOM 2184 CG LEU B 49 -17.123 -1.975 -13.586 1.00 0.00 C ATOM 2185 CD1 LEU B 49 -17.762 -1.554 -12.265 1.00 0.00 C ATOM 2186 CD2 LEU B 49 -15.616 -2.184 -13.383 1.00 0.00 C ATOM 0 H LEU B 49 -16.916 -1.528 -16.162 1.00 0.00 H new ATOM 0 HA LEU B 49 -18.265 -4.204 -15.955 1.00 0.00 H new ATOM 0 HB2 LEU B 49 -18.677 -3.473 -13.494 1.00 0.00 H new ATOM 0 HB3 LEU B 49 -17.089 -4.118 -13.857 1.00 0.00 H new ATOM 0 HG LEU B 49 -17.281 -1.199 -14.335 1.00 0.00 H new ATOM 0 HD11 LEU B 49 -17.312 -0.622 -11.924 1.00 0.00 H new ATOM 0 HD12 LEU B 49 -18.833 -1.409 -12.409 1.00 0.00 H new ATOM 0 HD13 LEU B 49 -17.598 -2.331 -11.518 1.00 0.00 H new ATOM 0 HD21 LEU B 49 -15.161 -1.251 -13.049 1.00 0.00 H new ATOM 0 HD22 LEU B 49 -15.454 -2.957 -12.631 1.00 0.00 H new ATOM 0 HD23 LEU B 49 -15.161 -2.493 -14.324 1.00 0.00 H new ATOM 2198 N THR B 50 -20.489 -2.941 -15.712 1.00 0.00 N ATOM 2199 CA THR B 50 -21.711 -2.219 -16.184 1.00 0.00 C ATOM 2200 C THR B 50 -22.408 -1.499 -15.029 1.00 0.00 C ATOM 2201 O THR B 50 -22.331 -1.909 -13.886 1.00 0.00 O ATOM 2202 CB THR B 50 -22.627 -3.298 -16.765 1.00 0.00 C ATOM 2203 OG1 THR B 50 -21.890 -4.103 -17.674 1.00 0.00 O ATOM 2204 CG2 THR B 50 -23.799 -2.634 -17.500 1.00 0.00 C ATOM 0 H THR B 50 -20.650 -3.869 -15.320 1.00 0.00 H new ATOM 0 HA THR B 50 -21.458 -1.456 -16.920 1.00 0.00 H new ATOM 0 HB THR B 50 -23.013 -3.921 -15.958 1.00 0.00 H new ATOM 0 HG1 THR B 50 -22.475 -4.796 -18.046 1.00 0.00 H new ATOM 0 HG21 THR B 50 -24.451 -3.403 -17.914 1.00 0.00 H new ATOM 0 HG22 THR B 50 -24.364 -2.016 -16.801 1.00 0.00 H new ATOM 0 HG23 THR B 50 -23.416 -2.010 -18.308 1.00 0.00 H new ATOM 2212 N VAL B 51 -23.113 -0.442 -15.332 1.00 0.00 N ATOM 2213 CA VAL B 51 -23.850 0.301 -14.273 1.00 0.00 C ATOM 2214 C VAL B 51 -25.124 -0.453 -13.891 1.00 0.00 C ATOM 2215 O VAL B 51 -26.089 -0.466 -14.628 1.00 0.00 O ATOM 2216 CB VAL B 51 -24.209 1.647 -14.908 1.00 0.00 C ATOM 2217 CG1 VAL B 51 -24.787 2.577 -13.845 1.00 0.00 C ATOM 2218 CG2 VAL B 51 -22.958 2.273 -15.517 1.00 0.00 C ATOM 0 H VAL B 51 -23.210 -0.061 -16.273 1.00 0.00 H new ATOM 0 HA VAL B 51 -23.257 0.418 -13.366 1.00 0.00 H new ATOM 0 HB VAL B 51 -24.952 1.493 -15.691 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -25.042 3.535 -14.299 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -25.683 2.128 -13.417 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -24.049 2.733 -13.058 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -23.214 3.231 -15.969 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -22.212 2.427 -14.737 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -22.553 1.608 -16.280 1.00 0.00 H new ATOM 2228 N THR B 52 -25.179 -0.976 -12.698 1.00 0.00 N ATOM 2229 CA THR B 52 -26.444 -1.603 -12.227 1.00 0.00 C ATOM 2230 C THR B 52 -27.495 -0.521 -12.004 1.00 0.00 C ATOM 2231 O THR B 52 -28.656 -0.694 -12.316 1.00 0.00 O ATOM 2232 CB THR B 52 -26.088 -2.274 -10.903 1.00 0.00 C ATOM 2233 OG1 THR B 52 -25.810 -1.278 -9.928 1.00 0.00 O ATOM 2234 CG2 THR B 52 -24.860 -3.155 -11.097 1.00 0.00 C ATOM 0 H THR B 52 -24.407 -0.996 -12.032 1.00 0.00 H new ATOM 0 HA THR B 52 -26.850 -2.315 -12.945 1.00 0.00 H new ATOM 0 HB THR B 52 -26.925 -2.886 -10.567 1.00 0.00 H new ATOM 0 HG1 THR B 52 -25.244 -0.582 -10.323 1.00 0.00 H new ATOM 0 HG21 THR B 52 -24.604 -3.635 -10.153 1.00 0.00 H new ATOM 0 HG22 THR B 52 -25.074 -3.918 -11.846 1.00 0.00 H new ATOM 0 HG23 THR B 52 -24.022 -2.543 -11.432 1.00 0.00 H new ATOM 2242 N GLU B 53 -27.095 0.595 -11.465 1.00 0.00 N ATOM 2243 CA GLU B 53 -28.081 1.687 -11.223 1.00 0.00 C ATOM 2244 C GLU B 53 -27.373 3.031 -11.048 1.00 0.00 C ATOM 2245 O GLU B 53 -26.265 3.101 -10.561 1.00 0.00 O ATOM 2246 CB GLU B 53 -28.794 1.291 -9.930 1.00 0.00 C ATOM 2247 CG GLU B 53 -29.842 2.350 -9.579 1.00 0.00 C ATOM 2248 CD GLU B 53 -30.555 1.953 -8.285 1.00 0.00 C ATOM 2249 OE1 GLU B 53 -30.356 0.835 -7.841 1.00 0.00 O ATOM 2250 OE2 GLU B 53 -31.288 2.775 -7.761 1.00 0.00 O ATOM 0 H GLU B 53 -26.136 0.799 -11.183 1.00 0.00 H new ATOM 0 HA GLU B 53 -28.770 1.805 -12.059 1.00 0.00 H new ATOM 0 HB2 GLU B 53 -29.271 0.318 -10.049 1.00 0.00 H new ATOM 0 HB3 GLU B 53 -28.072 1.196 -9.119 1.00 0.00 H new ATOM 0 HG2 GLU B 53 -29.366 3.323 -9.460 1.00 0.00 H new ATOM 0 HG3 GLU B 53 -30.564 2.445 -10.390 1.00 0.00 H new ATOM 2257 N ILE B 54 -28.066 4.101 -11.305 1.00 0.00 N ATOM 2258 CA ILE B 54 -27.506 5.451 -11.004 1.00 0.00 C ATOM 2259 C ILE B 54 -28.261 6.072 -9.837 1.00 0.00 C ATOM 2260 O ILE B 54 -29.474 6.139 -9.829 1.00 0.00 O ATOM 2261 CB ILE B 54 -27.723 6.267 -12.275 1.00 0.00 C ATOM 2262 CG1 ILE B 54 -26.858 5.693 -13.395 1.00 0.00 C ATOM 2263 CG2 ILE B 54 -27.322 7.721 -12.015 1.00 0.00 C ATOM 2264 CD1 ILE B 54 -27.633 5.724 -14.714 1.00 0.00 C ATOM 0 H ILE B 54 -29.001 4.102 -11.713 1.00 0.00 H new ATOM 0 HA ILE B 54 -26.453 5.412 -10.725 1.00 0.00 H new ATOM 0 HB ILE B 54 -28.772 6.224 -12.566 1.00 0.00 H new ATOM 0 HG12 ILE B 54 -25.938 6.270 -13.489 1.00 0.00 H new ATOM 0 HG13 ILE B 54 -26.569 4.670 -13.156 1.00 0.00 H new ATOM 0 HG21 ILE B 54 -27.475 8.308 -12.920 1.00 0.00 H new ATOM 0 HG22 ILE B 54 -27.934 8.129 -11.210 1.00 0.00 H new ATOM 0 HG23 ILE B 54 -26.271 7.763 -11.729 1.00 0.00 H new ATOM 0 HD11 ILE B 54 -27.012 5.314 -15.510 1.00 0.00 H new ATOM 0 HD12 ILE B 54 -28.540 5.128 -14.617 1.00 0.00 H new ATOM 0 HD13 ILE B 54 -27.899 6.753 -14.955 1.00 0.00 H new ATOM 2276 N ASN B 55 -27.546 6.559 -8.871 1.00 0.00 N ATOM 2277 CA ASN B 55 -28.216 7.218 -7.718 1.00 0.00 C ATOM 2278 C ASN B 55 -28.062 8.731 -7.834 1.00 0.00 C ATOM 2279 O ASN B 55 -27.326 9.353 -7.093 1.00 0.00 O ATOM 2280 CB ASN B 55 -27.496 6.683 -6.479 1.00 0.00 C ATOM 2281 CG ASN B 55 -28.036 5.293 -6.140 1.00 0.00 C ATOM 2282 OD1 ASN B 55 -29.117 5.163 -5.601 1.00 0.00 O ATOM 2283 ND2 ASN B 55 -27.325 4.240 -6.437 1.00 0.00 N ATOM 0 H ASN B 55 -26.527 6.531 -8.826 1.00 0.00 H new ATOM 0 HA ASN B 55 -29.285 7.010 -7.675 1.00 0.00 H new ATOM 0 HB2 ASN B 55 -26.422 6.634 -6.661 1.00 0.00 H new ATOM 0 HB3 ASN B 55 -27.646 7.359 -5.637 1.00 0.00 H new ATOM 0 HD21 ASN B 55 -27.677 3.308 -6.217 1.00 0.00 H new ATOM 0 HD22 ASN B 55 -26.417 4.349 -6.890 1.00 0.00 H new ATOM 2290 N GLY B 56 -28.648 9.309 -8.846 1.00 0.00 N ATOM 2291 CA GLY B 56 -28.424 10.757 -9.100 1.00 0.00 C ATOM 2292 C GLY B 56 -27.039 10.938 -9.710 1.00 0.00 C ATOM 2293 O GLY B 56 -26.753 10.434 -10.778 1.00 0.00 O ATOM 0 H GLY B 56 -29.270 8.842 -9.505 1.00 0.00 H new ATOM 0 HA2 GLY B 56 -29.187 11.145 -9.774 1.00 0.00 H new ATOM 0 HA3 GLY B 56 -28.504 11.320 -8.170 1.00 0.00 H new ATOM 2297 N ASN B 57 -26.152 11.595 -9.018 1.00 0.00 N ATOM 2298 CA ASN B 57 -24.770 11.726 -9.548 1.00 0.00 C ATOM 2299 C ASN B 57 -23.993 10.429 -9.261 1.00 0.00 C ATOM 2300 O ASN B 57 -22.976 10.156 -9.864 1.00 0.00 O ATOM 2301 CB ASN B 57 -24.178 12.954 -8.825 1.00 0.00 C ATOM 2302 CG ASN B 57 -23.142 12.540 -7.780 1.00 0.00 C ATOM 2303 OD1 ASN B 57 -22.032 12.019 -8.205 1.00 0.00 O flip ATOM 2304 ND2 ASN B 57 -23.342 12.694 -6.592 1.00 0.00 N flip ATOM 0 H ASN B 57 -26.322 12.042 -8.117 1.00 0.00 H new ATOM 0 HA ASN B 57 -24.726 11.870 -10.628 1.00 0.00 H new ATOM 0 HB2 ASN B 57 -23.716 13.620 -9.554 1.00 0.00 H new ATOM 0 HB3 ASN B 57 -24.979 13.516 -8.343 1.00 0.00 H new ATOM 0 HD21 ASN B 57 -24.219 13.105 -6.271 1.00 0.00 H new ATOM 0 HD22 ASN B 57 -22.633 12.413 -5.915 1.00 0.00 H new ATOM 2311 N HIS B 58 -24.458 9.647 -8.322 1.00 0.00 N ATOM 2312 CA HIS B 58 -23.738 8.388 -7.972 1.00 0.00 C ATOM 2313 C HIS B 58 -24.005 7.324 -9.024 1.00 0.00 C ATOM 2314 O HIS B 58 -25.032 7.330 -9.670 1.00 0.00 O ATOM 2315 CB HIS B 58 -24.331 7.935 -6.645 1.00 0.00 C ATOM 2316 CG HIS B 58 -23.658 8.653 -5.504 1.00 0.00 C ATOM 2317 ND1 HIS B 58 -22.334 8.839 -5.182 1.00 0.00 N flip ATOM 2318 CD2 HIS B 58 -24.380 9.274 -4.499 1.00 0.00 C flip ATOM 2319 CE1 HIS B 58 -22.237 9.563 -3.999 1.00 0.00 C flip ATOM 2320 NE2 HIS B 58 -23.497 9.797 -3.629 1.00 0.00 N flip ATOM 0 H HIS B 58 -25.305 9.826 -7.783 1.00 0.00 H new ATOM 0 HA HIS B 58 -22.661 8.546 -7.915 1.00 0.00 H new ATOM 0 HB2 HIS B 58 -25.402 8.135 -6.629 1.00 0.00 H new ATOM 0 HB3 HIS B 58 -24.206 6.858 -6.531 1.00 0.00 H new ATOM 0 HD2 HIS B 58 -25.456 9.329 -4.427 1.00 0.00 H new ATOM 0 HE1 HIS B 58 -21.336 9.870 -3.489 1.00 0.00 H new ATOM 0 HE2 HIS B 58 -23.759 10.311 -2.788 1.00 0.00 H new ATOM 2328 N VAL B 59 -23.158 6.342 -9.117 1.00 0.00 N ATOM 2329 CA VAL B 59 -23.460 5.216 -10.033 1.00 0.00 C ATOM 2330 C VAL B 59 -23.035 3.879 -9.417 1.00 0.00 C ATOM 2331 O VAL B 59 -21.886 3.675 -9.081 1.00 0.00 O ATOM 2332 CB VAL B 59 -22.670 5.536 -11.292 1.00 0.00 C ATOM 2333 CG1 VAL B 59 -22.698 4.332 -12.223 1.00 0.00 C ATOM 2334 CG2 VAL B 59 -23.323 6.733 -11.984 1.00 0.00 C ATOM 0 H VAL B 59 -22.279 6.271 -8.604 1.00 0.00 H new ATOM 0 HA VAL B 59 -24.526 5.112 -10.237 1.00 0.00 H new ATOM 0 HB VAL B 59 -21.636 5.770 -11.039 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -22.132 4.558 -13.127 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -22.252 3.473 -11.721 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -23.730 4.101 -12.489 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -22.768 6.976 -12.890 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -24.352 6.486 -12.244 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -23.314 7.591 -11.312 1.00 0.00 H new ATOM 2344 N SER B 60 -23.963 2.968 -9.284 1.00 0.00 N ATOM 2345 CA SER B 60 -23.645 1.628 -8.703 1.00 0.00 C ATOM 2346 C SER B 60 -23.279 0.648 -9.820 1.00 0.00 C ATOM 2347 O SER B 60 -24.021 0.481 -10.766 1.00 0.00 O ATOM 2348 CB SER B 60 -24.941 1.188 -8.026 1.00 0.00 C ATOM 2349 OG SER B 60 -25.382 2.210 -7.142 1.00 0.00 O ATOM 0 H SER B 60 -24.938 3.096 -9.556 1.00 0.00 H new ATOM 0 HA SER B 60 -22.803 1.661 -8.012 1.00 0.00 H new ATOM 0 HB2 SER B 60 -25.706 0.986 -8.776 1.00 0.00 H new ATOM 0 HB3 SER B 60 -24.780 0.261 -7.476 1.00 0.00 H new ATOM 0 HG SER B 60 -26.215 1.930 -6.708 1.00 0.00 H new ATOM 2355 N PHE B 61 -22.156 -0.013 -9.719 1.00 0.00 N ATOM 2356 CA PHE B 61 -21.784 -0.988 -10.788 1.00 0.00 C ATOM 2357 C PHE B 61 -21.837 -2.420 -10.244 1.00 0.00 C ATOM 2358 O PHE B 61 -21.800 -2.638 -9.049 1.00 0.00 O ATOM 2359 CB PHE B 61 -20.350 -0.641 -11.182 1.00 0.00 C ATOM 2360 CG PHE B 61 -20.244 0.822 -11.535 1.00 0.00 C ATOM 2361 CD1 PHE B 61 -20.456 1.244 -12.854 1.00 0.00 C ATOM 2362 CD2 PHE B 61 -19.916 1.756 -10.542 1.00 0.00 C ATOM 2363 CE1 PHE B 61 -20.341 2.603 -13.180 1.00 0.00 C ATOM 2364 CE2 PHE B 61 -19.803 3.113 -10.868 1.00 0.00 C ATOM 2365 CZ PHE B 61 -20.014 3.537 -12.187 1.00 0.00 C ATOM 0 H PHE B 61 -21.488 0.077 -8.954 1.00 0.00 H new ATOM 0 HA PHE B 61 -22.467 -0.931 -11.635 1.00 0.00 H new ATOM 0 HB2 PHE B 61 -19.673 -0.874 -10.360 1.00 0.00 H new ATOM 0 HB3 PHE B 61 -20.041 -1.250 -12.031 1.00 0.00 H new ATOM 0 HD1 PHE B 61 -20.708 0.524 -13.618 1.00 0.00 H new ATOM 0 HD2 PHE B 61 -19.751 1.429 -9.526 1.00 0.00 H new ATOM 0 HE1 PHE B 61 -20.504 2.930 -14.196 1.00 0.00 H new ATOM 0 HE2 PHE B 61 -19.553 3.833 -10.103 1.00 0.00 H new ATOM 0 HZ PHE B 61 -19.925 4.583 -12.439 1.00 0.00 H new ATOM 2375 N ASP B 62 -21.919 -3.399 -11.108 1.00 0.00 N ATOM 2376 CA ASP B 62 -21.969 -4.814 -10.626 1.00 0.00 C ATOM 2377 C ASP B 62 -20.576 -5.421 -10.551 1.00 0.00 C ATOM 2378 O ASP B 62 -19.676 -5.062 -11.284 1.00 0.00 O ATOM 2379 CB ASP B 62 -22.817 -5.568 -11.651 1.00 0.00 C ATOM 2380 CG ASP B 62 -22.157 -5.469 -13.028 1.00 0.00 C ATOM 2381 OD1 ASP B 62 -21.311 -4.607 -13.198 1.00 0.00 O ATOM 2382 OD2 ASP B 62 -22.509 -6.259 -13.889 1.00 0.00 O ATOM 0 H ASP B 62 -21.953 -3.282 -12.121 1.00 0.00 H new ATOM 0 HA ASP B 62 -22.389 -4.871 -9.622 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -22.918 -6.613 -11.358 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -23.823 -5.149 -11.686 1.00 0.00 H new ATOM 2387 N LEU B 63 -20.391 -6.312 -9.625 1.00 0.00 N ATOM 2388 CA LEU B 63 -19.057 -6.923 -9.427 1.00 0.00 C ATOM 2389 C LEU B 63 -19.218 -8.287 -8.753 1.00 0.00 C ATOM 2390 O LEU B 63 -19.704 -8.382 -7.644 1.00 0.00 O ATOM 2391 CB LEU B 63 -18.344 -5.941 -8.503 1.00 0.00 C ATOM 2392 CG LEU B 63 -17.130 -5.339 -9.213 1.00 0.00 C ATOM 2393 CD1 LEU B 63 -17.256 -3.815 -9.192 1.00 0.00 C ATOM 2394 CD2 LEU B 63 -15.841 -5.759 -8.490 1.00 0.00 C ATOM 0 H LEU B 63 -21.116 -6.646 -8.990 1.00 0.00 H new ATOM 0 HA LEU B 63 -18.509 -7.091 -10.354 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -19.030 -5.149 -8.203 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -18.027 -6.450 -7.593 1.00 0.00 H new ATOM 0 HG LEU B 63 -17.090 -5.697 -10.242 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -16.397 -3.372 -9.695 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -18.170 -3.518 -9.706 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -17.291 -3.467 -8.160 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -14.980 -5.327 -9.001 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -15.869 -5.402 -7.460 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -15.758 -6.846 -8.496 1.00 0.00 H new ATOM 2406 N MET B 64 -18.806 -9.343 -9.396 1.00 0.00 N ATOM 2407 CA MET B 64 -18.933 -10.683 -8.755 1.00 0.00 C ATOM 2408 C MET B 64 -17.897 -10.814 -7.637 1.00 0.00 C ATOM 2409 O MET B 64 -16.803 -10.304 -7.737 1.00 0.00 O ATOM 2410 CB MET B 64 -18.661 -11.698 -9.868 1.00 0.00 C ATOM 2411 CG MET B 64 -19.788 -11.650 -10.900 1.00 0.00 C ATOM 2412 SD MET B 64 -21.220 -12.559 -10.271 1.00 0.00 S ATOM 2413 CE MET B 64 -20.588 -14.224 -10.592 1.00 0.00 C ATOM 0 H MET B 64 -18.391 -9.339 -10.328 1.00 0.00 H new ATOM 0 HA MET B 64 -19.915 -10.840 -8.310 1.00 0.00 H new ATOM 0 HB2 MET B 64 -17.707 -11.479 -10.347 1.00 0.00 H new ATOM 0 HB3 MET B 64 -18.583 -12.701 -9.447 1.00 0.00 H new ATOM 0 HG2 MET B 64 -20.062 -10.616 -11.107 1.00 0.00 H new ATOM 0 HG3 MET B 64 -19.452 -12.085 -11.841 1.00 0.00 H new ATOM 0 HE1 MET B 64 -21.221 -14.717 -11.330 1.00 0.00 H new ATOM 0 HE2 MET B 64 -19.569 -14.159 -10.973 1.00 0.00 H new ATOM 0 HE3 MET B 64 -20.593 -14.800 -9.667 1.00 0.00 H new ATOM 2423 N LYS B 65 -18.246 -11.452 -6.555 1.00 0.00 N ATOM 2424 CA LYS B 65 -17.289 -11.564 -5.419 1.00 0.00 C ATOM 2425 C LYS B 65 -16.018 -12.287 -5.872 1.00 0.00 C ATOM 2426 O LYS B 65 -14.917 -11.866 -5.583 1.00 0.00 O ATOM 2427 CB LYS B 65 -18.025 -12.389 -4.364 1.00 0.00 C ATOM 2428 CG LYS B 65 -17.128 -12.571 -3.138 1.00 0.00 C ATOM 2429 CD LYS B 65 -17.868 -13.398 -2.085 1.00 0.00 C ATOM 2430 CE LYS B 65 -17.045 -13.440 -0.797 1.00 0.00 C ATOM 2431 NZ LYS B 65 -17.407 -12.192 -0.071 1.00 0.00 N ATOM 0 H LYS B 65 -19.151 -11.900 -6.408 1.00 0.00 H new ATOM 0 HA LYS B 65 -16.984 -10.590 -5.036 1.00 0.00 H new ATOM 0 HB2 LYS B 65 -18.951 -11.890 -4.079 1.00 0.00 H new ATOM 0 HB3 LYS B 65 -18.299 -13.361 -4.774 1.00 0.00 H new ATOM 0 HG2 LYS B 65 -16.201 -13.069 -3.423 1.00 0.00 H new ATOM 0 HG3 LYS B 65 -16.854 -11.599 -2.727 1.00 0.00 H new ATOM 0 HD2 LYS B 65 -18.848 -12.963 -1.889 1.00 0.00 H new ATOM 0 HD3 LYS B 65 -18.036 -14.410 -2.454 1.00 0.00 H new ATOM 0 HE2 LYS B 65 -17.282 -14.324 -0.205 1.00 0.00 H new ATOM 0 HE3 LYS B 65 -15.977 -13.477 -1.011 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 -16.583 -11.849 0.463 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 -17.703 -11.466 -0.754 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 -18.188 -12.387 0.587 1.00 0.00 H new ATOM 2445 N GLU B 66 -16.158 -13.363 -6.594 1.00 0.00 N ATOM 2446 CA GLU B 66 -14.950 -14.090 -7.073 1.00 0.00 C ATOM 2447 C GLU B 66 -14.230 -13.265 -8.139 1.00 0.00 C ATOM 2448 O GLU B 66 -13.031 -13.094 -8.087 1.00 0.00 O ATOM 2449 CB GLU B 66 -15.473 -15.406 -7.650 1.00 0.00 C ATOM 2450 CG GLU B 66 -14.298 -16.240 -8.167 1.00 0.00 C ATOM 2451 CD GLU B 66 -14.819 -17.562 -8.732 1.00 0.00 C ATOM 2452 OE1 GLU B 66 -15.991 -17.845 -8.542 1.00 0.00 O ATOM 2453 OE2 GLU B 66 -14.038 -18.271 -9.345 1.00 0.00 O ATOM 0 H GLU B 66 -17.052 -13.769 -6.872 1.00 0.00 H new ATOM 0 HA GLU B 66 -14.228 -14.267 -6.276 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -16.017 -15.960 -6.885 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -16.175 -15.207 -8.459 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -13.760 -15.690 -8.939 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -13.591 -16.431 -7.360 1.00 0.00 H new ATOM 2460 N THR B 67 -14.960 -12.631 -9.014 1.00 0.00 N ATOM 2461 CA THR B 67 -14.311 -11.681 -9.964 1.00 0.00 C ATOM 2462 C THR B 67 -13.619 -10.574 -9.171 1.00 0.00 C ATOM 2463 O THR B 67 -12.543 -10.130 -9.506 1.00 0.00 O ATOM 2464 CB THR B 67 -15.443 -11.097 -10.804 1.00 0.00 C ATOM 2465 OG1 THR B 67 -16.108 -12.146 -11.495 1.00 0.00 O ATOM 2466 CG2 THR B 67 -14.867 -10.107 -11.817 1.00 0.00 C ATOM 0 H THR B 67 -15.971 -12.727 -9.113 1.00 0.00 H new ATOM 0 HA THR B 67 -13.563 -12.168 -10.590 1.00 0.00 H new ATOM 0 HB THR B 67 -16.150 -10.582 -10.154 1.00 0.00 H new ATOM 0 HG1 THR B 67 -16.604 -11.775 -12.254 1.00 0.00 H new ATOM 0 HG21 THR B 67 -15.675 -9.689 -12.418 1.00 0.00 H new ATOM 0 HG22 THR B 67 -14.354 -9.303 -11.289 1.00 0.00 H new ATOM 0 HG23 THR B 67 -14.160 -10.622 -12.468 1.00 0.00 H new ATOM 2474 N LEU B 68 -14.242 -10.123 -8.122 1.00 0.00 N ATOM 2475 CA LEU B 68 -13.646 -9.042 -7.303 1.00 0.00 C ATOM 2476 C LEU B 68 -12.296 -9.506 -6.752 1.00 0.00 C ATOM 2477 O LEU B 68 -11.300 -8.818 -6.852 1.00 0.00 O ATOM 2478 CB LEU B 68 -14.663 -8.853 -6.178 1.00 0.00 C ATOM 2479 CG LEU B 68 -14.200 -7.758 -5.226 1.00 0.00 C ATOM 2480 CD1 LEU B 68 -14.639 -6.396 -5.765 1.00 0.00 C ATOM 2481 CD2 LEU B 68 -14.832 -8.000 -3.858 1.00 0.00 C ATOM 0 H LEU B 68 -15.147 -10.462 -7.796 1.00 0.00 H new ATOM 0 HA LEU B 68 -13.458 -8.120 -7.854 1.00 0.00 H new ATOM 0 HB2 LEU B 68 -15.635 -8.593 -6.597 1.00 0.00 H new ATOM 0 HB3 LEU B 68 -14.791 -9.788 -5.633 1.00 0.00 H new ATOM 0 HG LEU B 68 -13.114 -7.772 -5.138 1.00 0.00 H new ATOM 0 HD11 LEU B 68 -14.308 -5.612 -5.084 1.00 0.00 H new ATOM 0 HD12 LEU B 68 -14.197 -6.234 -6.748 1.00 0.00 H new ATOM 0 HD13 LEU B 68 -15.726 -6.370 -5.847 1.00 0.00 H new ATOM 0 HD21 LEU B 68 -14.509 -7.223 -3.165 1.00 0.00 H new ATOM 0 HD22 LEU B 68 -15.918 -7.976 -3.950 1.00 0.00 H new ATOM 0 HD23 LEU B 68 -14.521 -8.974 -3.481 1.00 0.00 H new ATOM 2493 N ARG B 69 -12.245 -10.710 -6.255 1.00 0.00 N ATOM 2494 CA ARG B 69 -10.950 -11.281 -5.791 1.00 0.00 C ATOM 2495 C ARG B 69 -10.029 -11.574 -6.983 1.00 0.00 C ATOM 2496 O ARG B 69 -8.827 -11.409 -6.905 1.00 0.00 O ATOM 2497 CB ARG B 69 -11.339 -12.573 -5.075 1.00 0.00 C ATOM 2498 CG ARG B 69 -10.103 -13.195 -4.428 1.00 0.00 C ATOM 2499 CD ARG B 69 -10.510 -14.478 -3.703 1.00 0.00 C ATOM 2500 NE ARG B 69 -9.259 -14.965 -3.055 1.00 0.00 N ATOM 2501 CZ ARG B 69 -9.321 -15.782 -2.036 1.00 0.00 C ATOM 2502 NH1 ARG B 69 -10.477 -16.183 -1.580 1.00 0.00 N ATOM 2503 NH2 ARG B 69 -8.220 -16.199 -1.472 1.00 0.00 N ATOM 0 H ARG B 69 -13.050 -11.327 -6.150 1.00 0.00 H new ATOM 0 HA ARG B 69 -10.402 -10.597 -5.143 1.00 0.00 H new ATOM 0 HB2 ARG B 69 -12.094 -12.367 -4.316 1.00 0.00 H new ATOM 0 HB3 ARG B 69 -11.782 -13.273 -5.783 1.00 0.00 H new ATOM 0 HG2 ARG B 69 -9.351 -13.414 -5.186 1.00 0.00 H new ATOM 0 HG3 ARG B 69 -9.652 -12.493 -3.726 1.00 0.00 H new ATOM 0 HD2 ARG B 69 -11.288 -14.285 -2.965 1.00 0.00 H new ATOM 0 HD3 ARG B 69 -10.908 -15.216 -4.399 1.00 0.00 H new ATOM 0 HE ARG B 69 -8.352 -14.660 -3.408 1.00 0.00 H new ATOM 0 HH11 ARG B 69 -11.339 -15.859 -2.019 1.00 0.00 H new ATOM 0 HH12 ARG B 69 -10.518 -16.820 -0.785 1.00 0.00 H new ATOM 0 HH21 ARG B 69 -7.316 -15.887 -1.826 1.00 0.00 H new ATOM 0 HH22 ARG B 69 -8.264 -16.836 -0.677 1.00 0.00 H new ATOM 2517 N ILE B 70 -10.577 -12.075 -8.060 1.00 0.00 N ATOM 2518 CA ILE B 70 -9.736 -12.459 -9.224 1.00 0.00 C ATOM 2519 C ILE B 70 -9.117 -11.204 -9.840 1.00 0.00 C ATOM 2520 O ILE B 70 -7.938 -11.146 -10.129 1.00 0.00 O ATOM 2521 CB ILE B 70 -10.726 -13.158 -10.175 1.00 0.00 C ATOM 2522 CG1 ILE B 70 -10.087 -14.435 -10.717 1.00 0.00 C ATOM 2523 CG2 ILE B 70 -11.134 -12.255 -11.349 1.00 0.00 C ATOM 2524 CD1 ILE B 70 -11.144 -15.275 -11.439 1.00 0.00 C ATOM 0 H ILE B 70 -11.577 -12.234 -8.180 1.00 0.00 H new ATOM 0 HA ILE B 70 -8.898 -13.111 -8.977 1.00 0.00 H new ATOM 0 HB ILE B 70 -11.627 -13.391 -9.607 1.00 0.00 H new ATOM 0 HG12 ILE B 70 -9.277 -14.185 -11.402 1.00 0.00 H new ATOM 0 HG13 ILE B 70 -9.648 -15.009 -9.900 1.00 0.00 H new ATOM 0 HG21 ILE B 70 -11.832 -12.789 -11.993 1.00 0.00 H new ATOM 0 HG22 ILE B 70 -11.611 -11.353 -10.966 1.00 0.00 H new ATOM 0 HG23 ILE B 70 -10.248 -11.981 -11.922 1.00 0.00 H new ATOM 0 HD11 ILE B 70 -10.684 -16.185 -11.824 1.00 0.00 H new ATOM 0 HD12 ILE B 70 -11.939 -15.537 -10.741 1.00 0.00 H new ATOM 0 HD13 ILE B 70 -11.562 -14.701 -12.266 1.00 0.00 H new ATOM 2536 N THR B 71 -9.904 -10.176 -9.954 1.00 0.00 N ATOM 2537 CA THR B 71 -9.376 -8.885 -10.449 1.00 0.00 C ATOM 2538 C THR B 71 -8.766 -8.114 -9.287 1.00 0.00 C ATOM 2539 O THR B 71 -8.809 -8.546 -8.153 1.00 0.00 O ATOM 2540 CB THR B 71 -10.591 -8.132 -10.994 1.00 0.00 C ATOM 2541 OG1 THR B 71 -11.458 -7.800 -9.920 1.00 0.00 O ATOM 2542 CG2 THR B 71 -11.336 -9.008 -11.997 1.00 0.00 C ATOM 0 H THR B 71 -10.898 -10.177 -9.723 1.00 0.00 H new ATOM 0 HA THR B 71 -8.606 -9.015 -11.210 1.00 0.00 H new ATOM 0 HB THR B 71 -10.258 -7.222 -11.492 1.00 0.00 H new ATOM 0 HG1 THR B 71 -12.000 -8.581 -9.684 1.00 0.00 H new ATOM 0 HG21 THR B 71 -12.200 -8.466 -12.382 1.00 0.00 H new ATOM 0 HG22 THR B 71 -10.671 -9.263 -12.822 1.00 0.00 H new ATOM 0 HG23 THR B 71 -11.670 -9.921 -11.505 1.00 0.00 H new ATOM 2550 N ASN B 72 -8.367 -6.906 -9.529 1.00 0.00 N ATOM 2551 CA ASN B 72 -7.955 -6.033 -8.412 1.00 0.00 C ATOM 2552 C ASN B 72 -9.093 -5.054 -8.120 1.00 0.00 C ATOM 2553 O ASN B 72 -8.900 -4.015 -7.524 1.00 0.00 O ATOM 2554 CB ASN B 72 -6.695 -5.336 -8.937 1.00 0.00 C ATOM 2555 CG ASN B 72 -6.389 -4.075 -8.127 1.00 0.00 C ATOM 2556 OD1 ASN B 72 -6.649 -4.018 -6.942 1.00 0.00 O ATOM 2557 ND2 ASN B 72 -5.832 -3.054 -8.727 1.00 0.00 N ATOM 0 H ASN B 72 -8.309 -6.485 -10.456 1.00 0.00 H new ATOM 0 HA ASN B 72 -7.748 -6.552 -7.476 1.00 0.00 H new ATOM 0 HB2 ASN B 72 -5.848 -6.020 -8.885 1.00 0.00 H new ATOM 0 HB3 ASN B 72 -6.830 -5.075 -9.987 1.00 0.00 H new ATOM 0 HD21 ASN B 72 -5.615 -2.208 -8.199 1.00 0.00 H new ATOM 0 HD22 ASN B 72 -5.614 -3.104 -9.722 1.00 0.00 H new ATOM 2564 N LEU B 73 -10.306 -5.419 -8.479 1.00 0.00 N ATOM 2565 CA LEU B 73 -11.468 -4.549 -8.152 1.00 0.00 C ATOM 2566 C LEU B 73 -11.723 -4.572 -6.641 1.00 0.00 C ATOM 2567 O LEU B 73 -12.039 -3.565 -6.038 1.00 0.00 O ATOM 2568 CB LEU B 73 -12.648 -5.164 -8.908 1.00 0.00 C ATOM 2569 CG LEU B 73 -12.443 -5.000 -10.418 1.00 0.00 C ATOM 2570 CD1 LEU B 73 -13.539 -5.759 -11.168 1.00 0.00 C ATOM 2571 CD2 LEU B 73 -12.510 -3.515 -10.785 1.00 0.00 C ATOM 0 H LEU B 73 -10.532 -6.278 -8.981 1.00 0.00 H new ATOM 0 HA LEU B 73 -11.305 -3.509 -8.435 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -12.741 -6.221 -8.657 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -13.577 -4.682 -8.604 1.00 0.00 H new ATOM 0 HG LEU B 73 -11.468 -5.400 -10.696 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -13.393 -5.642 -12.242 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -13.492 -6.817 -10.908 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -14.514 -5.360 -10.889 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -12.364 -3.399 -11.859 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -13.485 -3.115 -10.506 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -11.729 -2.973 -10.252 1.00 0.00 H new ATOM 2583 N GLY B 74 -11.600 -5.720 -6.027 1.00 0.00 N ATOM 2584 CA GLY B 74 -11.845 -5.822 -4.564 1.00 0.00 C ATOM 2585 C GLY B 74 -11.069 -4.732 -3.819 1.00 0.00 C ATOM 2586 O GLY B 74 -11.372 -4.410 -2.687 1.00 0.00 O ATOM 0 H GLY B 74 -11.339 -6.595 -6.482 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -12.911 -5.724 -4.359 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -11.540 -6.805 -4.205 1.00 0.00 H new ATOM 2590 N ASP B 75 -10.024 -4.219 -4.407 1.00 0.00 N ATOM 2591 CA ASP B 75 -9.182 -3.220 -3.686 1.00 0.00 C ATOM 2592 C ASP B 75 -9.993 -1.958 -3.385 1.00 0.00 C ATOM 2593 O ASP B 75 -9.611 -1.145 -2.565 1.00 0.00 O ATOM 2594 CB ASP B 75 -8.031 -2.902 -4.642 1.00 0.00 C ATOM 2595 CG ASP B 75 -8.559 -2.103 -5.837 1.00 0.00 C ATOM 2596 OD1 ASP B 75 -9.753 -2.157 -6.081 1.00 0.00 O ATOM 2597 OD2 ASP B 75 -7.758 -1.456 -6.490 1.00 0.00 O ATOM 0 H ASP B 75 -9.716 -4.447 -5.352 1.00 0.00 H new ATOM 0 HA ASP B 75 -8.823 -3.601 -2.730 1.00 0.00 H new ATOM 0 HB2 ASP B 75 -7.261 -2.332 -4.123 1.00 0.00 H new ATOM 0 HB3 ASP B 75 -7.566 -3.826 -4.987 1.00 0.00 H new ATOM 2602 N LEU B 76 -11.074 -1.755 -4.084 1.00 0.00 N ATOM 2603 CA LEU B 76 -11.867 -0.507 -3.886 1.00 0.00 C ATOM 2604 C LEU B 76 -12.388 -0.414 -2.455 1.00 0.00 C ATOM 2605 O LEU B 76 -12.898 -1.364 -1.897 1.00 0.00 O ATOM 2606 CB LEU B 76 -13.030 -0.604 -4.862 1.00 0.00 C ATOM 2607 CG LEU B 76 -12.488 -0.636 -6.289 1.00 0.00 C ATOM 2608 CD1 LEU B 76 -13.641 -0.839 -7.272 1.00 0.00 C ATOM 2609 CD2 LEU B 76 -11.789 0.692 -6.584 1.00 0.00 C ATOM 0 H LEU B 76 -11.444 -2.398 -4.784 1.00 0.00 H new ATOM 0 HA LEU B 76 -11.259 0.381 -4.059 1.00 0.00 H new ATOM 0 HB2 LEU B 76 -13.614 -1.502 -4.662 1.00 0.00 H new ATOM 0 HB3 LEU B 76 -13.700 0.246 -4.734 1.00 0.00 H new ATOM 0 HG LEU B 76 -11.780 -1.458 -6.396 1.00 0.00 H new ATOM 0 HD11 LEU B 76 -13.252 -0.861 -8.290 1.00 0.00 H new ATOM 0 HD12 LEU B 76 -14.143 -1.782 -7.055 1.00 0.00 H new ATOM 0 HD13 LEU B 76 -14.352 -0.019 -7.173 1.00 0.00 H new ATOM 0 HD21 LEU B 76 -11.398 0.679 -7.601 1.00 0.00 H new ATOM 0 HD22 LEU B 76 -12.502 1.510 -6.479 1.00 0.00 H new ATOM 0 HD23 LEU B 76 -10.968 0.835 -5.882 1.00 0.00 H new ATOM 2621 N LYS B 77 -12.361 0.764 -1.912 1.00 0.00 N ATOM 2622 CA LYS B 77 -12.962 0.990 -0.566 1.00 0.00 C ATOM 2623 C LYS B 77 -13.663 2.349 -0.540 1.00 0.00 C ATOM 2624 O LYS B 77 -13.201 3.310 -1.124 1.00 0.00 O ATOM 2625 CB LYS B 77 -11.782 0.973 0.406 1.00 0.00 C ATOM 2626 CG LYS B 77 -11.141 -0.416 0.408 1.00 0.00 C ATOM 2627 CD LYS B 77 -9.961 -0.434 1.380 1.00 0.00 C ATOM 2628 CE LYS B 77 -9.320 -1.823 1.381 1.00 0.00 C ATOM 2629 NZ LYS B 77 -9.555 -2.353 2.752 1.00 0.00 N ATOM 0 H LYS B 77 -11.946 1.590 -2.343 1.00 0.00 H new ATOM 0 HA LYS B 77 -13.706 0.236 -0.307 1.00 0.00 H new ATOM 0 HB2 LYS B 77 -11.047 1.724 0.115 1.00 0.00 H new ATOM 0 HB3 LYS B 77 -12.120 1.230 1.410 1.00 0.00 H new ATOM 0 HG2 LYS B 77 -11.876 -1.167 0.698 1.00 0.00 H new ATOM 0 HG3 LYS B 77 -10.803 -0.673 -0.596 1.00 0.00 H new ATOM 0 HD2 LYS B 77 -9.226 0.317 1.090 1.00 0.00 H new ATOM 0 HD3 LYS B 77 -10.299 -0.178 2.384 1.00 0.00 H new ATOM 0 HE2 LYS B 77 -9.771 -2.467 0.626 1.00 0.00 H new ATOM 0 HE3 LYS B 77 -8.255 -1.767 1.157 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 -9.143 -3.305 2.832 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 -9.108 -1.723 3.449 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 -10.578 -2.402 2.935 1.00 0.00 H new ATOM 2643 N VAL B 78 -14.808 2.426 0.073 1.00 0.00 N ATOM 2644 CA VAL B 78 -15.567 3.707 0.055 1.00 0.00 C ATOM 2645 C VAL B 78 -14.752 4.814 0.712 1.00 0.00 C ATOM 2646 O VAL B 78 -13.881 4.564 1.523 1.00 0.00 O ATOM 2647 CB VAL B 78 -16.833 3.435 0.853 1.00 0.00 C ATOM 2648 CG1 VAL B 78 -17.737 4.667 0.815 1.00 0.00 C ATOM 2649 CG2 VAL B 78 -17.562 2.253 0.232 1.00 0.00 C ATOM 0 H VAL B 78 -15.251 1.662 0.584 1.00 0.00 H new ATOM 0 HA VAL B 78 -15.790 4.035 -0.960 1.00 0.00 H new ATOM 0 HB VAL B 78 -16.575 3.210 1.888 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -18.644 4.471 1.387 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -17.211 5.518 1.249 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -18.002 4.892 -0.218 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -18.472 2.049 0.797 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -17.821 2.487 -0.801 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -16.917 1.375 0.254 1.00 0.00 H new ATOM 2659 N GLY B 79 -14.964 6.028 0.300 1.00 0.00 N ATOM 2660 CA GLY B 79 -14.138 7.144 0.819 1.00 0.00 C ATOM 2661 C GLY B 79 -12.916 7.314 -0.085 1.00 0.00 C ATOM 2662 O GLY B 79 -12.275 8.346 -0.094 1.00 0.00 O ATOM 0 H GLY B 79 -15.678 6.296 -0.378 1.00 0.00 H new ATOM 0 HA2 GLY B 79 -14.720 8.065 0.844 1.00 0.00 H new ATOM 0 HA3 GLY B 79 -13.825 6.938 1.842 1.00 0.00 H new ATOM 2666 N ASP B 80 -12.649 6.340 -0.915 1.00 0.00 N ATOM 2667 CA ASP B 80 -11.540 6.479 -1.900 1.00 0.00 C ATOM 2668 C ASP B 80 -12.108 6.895 -3.256 1.00 0.00 C ATOM 2669 O ASP B 80 -13.293 6.791 -3.496 1.00 0.00 O ATOM 2670 CB ASP B 80 -10.913 5.089 -1.994 1.00 0.00 C ATOM 2671 CG ASP B 80 -9.505 5.200 -2.581 1.00 0.00 C ATOM 2672 OD1 ASP B 80 -9.165 6.271 -3.057 1.00 0.00 O ATOM 2673 OD2 ASP B 80 -8.790 4.212 -2.544 1.00 0.00 O ATOM 0 H ASP B 80 -13.153 5.454 -0.952 1.00 0.00 H new ATOM 0 HA ASP B 80 -10.812 7.233 -1.603 1.00 0.00 H new ATOM 0 HB2 ASP B 80 -10.871 4.630 -1.006 1.00 0.00 H new ATOM 0 HB3 ASP B 80 -11.529 4.443 -2.619 1.00 0.00 H new ATOM 2678 N TRP B 81 -11.271 7.310 -4.162 1.00 0.00 N ATOM 2679 CA TRP B 81 -11.772 7.664 -5.521 1.00 0.00 C ATOM 2680 C TRP B 81 -11.188 6.708 -6.563 1.00 0.00 C ATOM 2681 O TRP B 81 -10.171 6.079 -6.349 1.00 0.00 O ATOM 2682 CB TRP B 81 -11.295 9.094 -5.778 1.00 0.00 C ATOM 2683 CG TRP B 81 -12.097 10.045 -4.947 1.00 0.00 C ATOM 2684 CD1 TRP B 81 -12.267 9.956 -3.607 1.00 0.00 C ATOM 2685 CD2 TRP B 81 -12.839 11.223 -5.376 1.00 0.00 C ATOM 2686 NE1 TRP B 81 -13.072 10.998 -3.189 1.00 0.00 N ATOM 2687 CE2 TRP B 81 -13.447 11.809 -4.240 1.00 0.00 C ATOM 2688 CE3 TRP B 81 -13.044 11.834 -6.629 1.00 0.00 C ATOM 2689 CZ2 TRP B 81 -14.231 12.961 -4.343 1.00 0.00 C ATOM 2690 CZ3 TRP B 81 -13.831 12.995 -6.737 1.00 0.00 C ATOM 2691 CH2 TRP B 81 -14.423 13.555 -5.595 1.00 0.00 C ATOM 0 H TRP B 81 -10.266 7.420 -4.024 1.00 0.00 H new ATOM 0 HA TRP B 81 -12.857 7.587 -5.587 1.00 0.00 H new ATOM 0 HB2 TRP B 81 -10.237 9.185 -5.534 1.00 0.00 H new ATOM 0 HB3 TRP B 81 -11.401 9.340 -6.835 1.00 0.00 H new ATOM 0 HD1 TRP B 81 -11.843 9.195 -2.969 1.00 0.00 H new ATOM 0 HE1 TRP B 81 -13.355 11.149 -2.221 1.00 0.00 H new ATOM 0 HE3 TRP B 81 -12.594 11.408 -7.513 1.00 0.00 H new ATOM 0 HZ2 TRP B 81 -14.686 13.390 -3.462 1.00 0.00 H new ATOM 0 HZ3 TRP B 81 -13.980 13.457 -7.702 1.00 0.00 H new ATOM 0 HH2 TRP B 81 -15.028 14.446 -5.682 1.00 0.00 H new ATOM 2702 N VAL B 82 -11.851 6.572 -7.674 1.00 0.00 N ATOM 2703 CA VAL B 82 -11.378 5.631 -8.731 1.00 0.00 C ATOM 2704 C VAL B 82 -11.104 6.396 -10.026 1.00 0.00 C ATOM 2705 O VAL B 82 -11.795 7.336 -10.360 1.00 0.00 O ATOM 2706 CB VAL B 82 -12.530 4.627 -8.932 1.00 0.00 C ATOM 2707 CG1 VAL B 82 -13.870 5.352 -8.858 1.00 0.00 C ATOM 2708 CG2 VAL B 82 -12.422 3.967 -10.306 1.00 0.00 C ATOM 0 H VAL B 82 -12.709 7.076 -7.900 1.00 0.00 H new ATOM 0 HA VAL B 82 -10.452 5.129 -8.450 1.00 0.00 H new ATOM 0 HB VAL B 82 -12.464 3.872 -8.149 1.00 0.00 H new ATOM 0 HG11 VAL B 82 -14.679 4.636 -9.001 1.00 0.00 H new ATOM 0 HG12 VAL B 82 -13.973 5.827 -7.882 1.00 0.00 H new ATOM 0 HG13 VAL B 82 -13.916 6.112 -9.638 1.00 0.00 H new ATOM 0 HG21 VAL B 82 -13.241 3.260 -10.435 1.00 0.00 H new ATOM 0 HG22 VAL B 82 -12.476 4.731 -11.082 1.00 0.00 H new ATOM 0 HG23 VAL B 82 -11.472 3.439 -10.382 1.00 0.00 H new ATOM 2718 N ASN B 83 -10.255 5.861 -10.846 1.00 0.00 N ATOM 2719 CA ASN B 83 -10.113 6.397 -12.223 1.00 0.00 C ATOM 2720 C ASN B 83 -11.245 5.849 -13.090 1.00 0.00 C ATOM 2721 O ASN B 83 -11.298 4.680 -13.384 1.00 0.00 O ATOM 2722 CB ASN B 83 -8.758 5.863 -12.687 1.00 0.00 C ATOM 2723 CG ASN B 83 -7.729 6.994 -12.671 1.00 0.00 C ATOM 2724 OD1 ASN B 83 -7.996 8.065 -12.163 1.00 0.00 O ATOM 2725 ND2 ASN B 83 -6.555 6.802 -13.207 1.00 0.00 N ATOM 0 H ASN B 83 -9.649 5.071 -10.623 1.00 0.00 H new ATOM 0 HA ASN B 83 -10.164 7.484 -12.280 1.00 0.00 H new ATOM 0 HB2 ASN B 83 -8.433 5.052 -12.035 1.00 0.00 H new ATOM 0 HB3 ASN B 83 -8.843 5.449 -13.692 1.00 0.00 H new ATOM 0 HD21 ASN B 83 -5.862 7.551 -13.199 1.00 0.00 H new ATOM 0 HD22 ASN B 83 -6.330 5.903 -13.634 1.00 0.00 H new ATOM 2732 N VAL B 84 -12.206 6.657 -13.419 1.00 0.00 N ATOM 2733 CA VAL B 84 -13.376 6.114 -14.173 1.00 0.00 C ATOM 2734 C VAL B 84 -13.346 6.564 -15.629 1.00 0.00 C ATOM 2735 O VAL B 84 -13.011 7.690 -15.947 1.00 0.00 O ATOM 2736 CB VAL B 84 -14.650 6.613 -13.471 1.00 0.00 C ATOM 2737 CG1 VAL B 84 -15.060 5.582 -12.420 1.00 0.00 C ATOM 2738 CG2 VAL B 84 -14.422 7.970 -12.795 1.00 0.00 C ATOM 0 H VAL B 84 -12.239 7.654 -13.206 1.00 0.00 H new ATOM 0 HA VAL B 84 -13.348 5.024 -14.180 1.00 0.00 H new ATOM 0 HB VAL B 84 -15.436 6.739 -14.216 1.00 0.00 H new ATOM 0 HG11 VAL B 84 -15.963 5.920 -11.912 1.00 0.00 H new ATOM 0 HG12 VAL B 84 -15.253 4.625 -12.905 1.00 0.00 H new ATOM 0 HG13 VAL B 84 -14.257 5.464 -11.693 1.00 0.00 H new ATOM 0 HG21 VAL B 84 -15.342 8.293 -12.309 1.00 0.00 H new ATOM 0 HG22 VAL B 84 -13.631 7.877 -12.051 1.00 0.00 H new ATOM 0 HG23 VAL B 84 -14.130 8.705 -13.545 1.00 0.00 H new ATOM 2748 N GLU B 85 -13.668 5.667 -16.516 1.00 0.00 N ATOM 2749 CA GLU B 85 -13.637 5.996 -17.970 1.00 0.00 C ATOM 2750 C GLU B 85 -14.878 5.422 -18.657 1.00 0.00 C ATOM 2751 O GLU B 85 -15.297 4.318 -18.373 1.00 0.00 O ATOM 2752 CB GLU B 85 -12.368 5.324 -18.501 1.00 0.00 C ATOM 2753 CG GLU B 85 -12.227 5.607 -19.998 1.00 0.00 C ATOM 2754 CD GLU B 85 -10.960 4.935 -20.528 1.00 0.00 C ATOM 2755 OE1 GLU B 85 -10.179 4.464 -19.717 1.00 0.00 O ATOM 2756 OE2 GLU B 85 -10.791 4.902 -21.736 1.00 0.00 O ATOM 0 H GLU B 85 -13.954 4.713 -16.296 1.00 0.00 H new ATOM 0 HA GLU B 85 -13.634 7.070 -18.156 1.00 0.00 H new ATOM 0 HB2 GLU B 85 -11.495 5.698 -17.966 1.00 0.00 H new ATOM 0 HB3 GLU B 85 -12.413 4.249 -18.326 1.00 0.00 H new ATOM 0 HG2 GLU B 85 -13.100 5.234 -20.533 1.00 0.00 H new ATOM 0 HG3 GLU B 85 -12.181 6.682 -20.173 1.00 0.00 H new ATOM 2763 N ARG B 86 -15.514 6.185 -19.500 1.00 0.00 N ATOM 2764 CA ARG B 86 -16.777 5.701 -20.129 1.00 0.00 C ATOM 2765 C ARG B 86 -16.470 4.729 -21.272 1.00 0.00 C ATOM 2766 O ARG B 86 -15.694 5.022 -22.159 1.00 0.00 O ATOM 2767 CB ARG B 86 -17.465 6.958 -20.661 1.00 0.00 C ATOM 2768 CG ARG B 86 -18.784 6.571 -21.332 1.00 0.00 C ATOM 2769 CD ARG B 86 -19.529 7.836 -21.764 1.00 0.00 C ATOM 2770 NE ARG B 86 -18.649 8.473 -22.783 1.00 0.00 N ATOM 2771 CZ ARG B 86 -18.945 9.651 -23.264 1.00 0.00 C ATOM 2772 NH1 ARG B 86 -20.016 10.280 -22.854 1.00 0.00 N ATOM 2773 NH2 ARG B 86 -18.170 10.203 -24.158 1.00 0.00 N ATOM 0 H ARG B 86 -15.217 7.119 -19.781 1.00 0.00 H new ATOM 0 HA ARG B 86 -17.406 5.162 -19.421 1.00 0.00 H new ATOM 0 HB2 ARG B 86 -17.651 7.657 -19.845 1.00 0.00 H new ATOM 0 HB3 ARG B 86 -16.817 7.466 -21.375 1.00 0.00 H new ATOM 0 HG2 ARG B 86 -18.591 5.937 -22.197 1.00 0.00 H new ATOM 0 HG3 ARG B 86 -19.399 5.992 -20.643 1.00 0.00 H new ATOM 0 HD2 ARG B 86 -20.506 7.595 -22.182 1.00 0.00 H new ATOM 0 HD3 ARG B 86 -19.699 8.502 -20.918 1.00 0.00 H new ATOM 0 HE ARG B 86 -17.812 7.988 -23.106 1.00 0.00 H new ATOM 0 HH11 ARG B 86 -20.624 9.851 -22.156 1.00 0.00 H new ATOM 0 HH12 ARG B 86 -20.243 11.200 -23.232 1.00 0.00 H new ATOM 0 HH21 ARG B 86 -17.335 9.715 -24.480 1.00 0.00 H new ATOM 0 HH22 ARG B 86 -18.400 11.123 -24.534 1.00 0.00 H new ATOM 2787 N ALA B 87 -17.107 3.589 -21.271 1.00 0.00 N ATOM 2788 CA ALA B 87 -16.891 2.605 -22.373 1.00 0.00 C ATOM 2789 C ALA B 87 -18.213 2.306 -23.078 1.00 0.00 C ATOM 2790 O ALA B 87 -19.271 2.301 -22.474 1.00 0.00 O ATOM 2791 CB ALA B 87 -16.355 1.349 -21.695 1.00 0.00 C ATOM 0 H ALA B 87 -17.769 3.295 -20.553 1.00 0.00 H new ATOM 0 HA ALA B 87 -16.202 2.982 -23.128 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -16.172 0.580 -22.446 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -15.423 1.583 -21.181 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -17.086 0.985 -20.973 1.00 0.00 H new ATOM 2797 N ALA B 88 -18.157 2.079 -24.359 1.00 0.00 N ATOM 2798 CA ALA B 88 -19.401 1.807 -25.133 1.00 0.00 C ATOM 2799 C ALA B 88 -19.248 0.522 -25.951 1.00 0.00 C ATOM 2800 O ALA B 88 -18.214 0.267 -26.536 1.00 0.00 O ATOM 2801 CB ALA B 88 -19.549 3.008 -26.062 1.00 0.00 C ATOM 0 H ALA B 88 -17.297 2.070 -24.908 1.00 0.00 H new ATOM 0 HA ALA B 88 -20.268 1.672 -24.487 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -20.445 2.888 -26.671 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -19.632 3.919 -25.469 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -18.676 3.076 -26.711 1.00 0.00 H new ATOM 2807 N LYS B 89 -20.284 -0.262 -26.036 1.00 0.00 N ATOM 2808 CA LYS B 89 -20.214 -1.499 -26.863 1.00 0.00 C ATOM 2809 C LYS B 89 -20.161 -1.134 -28.349 1.00 0.00 C ATOM 2810 O LYS B 89 -19.645 -1.876 -29.162 1.00 0.00 O ATOM 2811 CB LYS B 89 -21.494 -2.266 -26.531 1.00 0.00 C ATOM 2812 CG LYS B 89 -22.710 -1.397 -26.856 1.00 0.00 C ATOM 2813 CD LYS B 89 -23.773 -1.590 -25.773 1.00 0.00 C ATOM 2814 CE LYS B 89 -24.955 -0.655 -26.041 1.00 0.00 C ATOM 2815 NZ LYS B 89 -25.953 -0.982 -24.984 1.00 0.00 N ATOM 0 H LYS B 89 -21.177 -0.101 -25.569 1.00 0.00 H new ATOM 0 HA LYS B 89 -19.324 -2.093 -26.655 1.00 0.00 H new ATOM 0 HB2 LYS B 89 -21.533 -3.193 -27.103 1.00 0.00 H new ATOM 0 HB3 LYS B 89 -21.502 -2.541 -25.476 1.00 0.00 H new ATOM 0 HG2 LYS B 89 -22.418 -0.348 -26.912 1.00 0.00 H new ATOM 0 HG3 LYS B 89 -23.115 -1.668 -27.831 1.00 0.00 H new ATOM 0 HD2 LYS B 89 -24.111 -2.626 -25.762 1.00 0.00 H new ATOM 0 HD3 LYS B 89 -23.348 -1.383 -24.791 1.00 0.00 H new ATOM 0 HE2 LYS B 89 -24.651 0.390 -25.987 1.00 0.00 H new ATOM 0 HE3 LYS B 89 -25.368 -0.816 -27.037 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 -26.793 -0.381 -25.102 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 -26.229 -1.982 -25.064 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 -25.535 -0.812 -24.047 1.00 0.00 H new ATOM 2829 N PHE B 90 -20.595 0.050 -28.695 1.00 0.00 N ATOM 2830 CA PHE B 90 -20.461 0.507 -30.108 1.00 0.00 C ATOM 2831 C PHE B 90 -20.094 1.991 -30.148 1.00 0.00 C ATOM 2832 O PHE B 90 -20.345 2.729 -29.216 1.00 0.00 O ATOM 2833 CB PHE B 90 -21.833 0.292 -30.745 1.00 0.00 C ATOM 2834 CG PHE B 90 -22.819 1.280 -30.168 1.00 0.00 C ATOM 2835 CD1 PHE B 90 -22.945 2.555 -30.741 1.00 0.00 C ATOM 2836 CD2 PHE B 90 -23.605 0.930 -29.061 1.00 0.00 C ATOM 2837 CE1 PHE B 90 -23.856 3.476 -30.209 1.00 0.00 C ATOM 2838 CE2 PHE B 90 -24.517 1.852 -28.529 1.00 0.00 C ATOM 2839 CZ PHE B 90 -24.643 3.125 -29.102 1.00 0.00 C ATOM 0 H PHE B 90 -21.035 0.718 -28.062 1.00 0.00 H new ATOM 0 HA PHE B 90 -19.679 -0.040 -30.635 1.00 0.00 H new ATOM 0 HB2 PHE B 90 -21.767 0.417 -31.826 1.00 0.00 H new ATOM 0 HB3 PHE B 90 -22.174 -0.727 -30.562 1.00 0.00 H new ATOM 0 HD1 PHE B 90 -22.339 2.826 -31.593 1.00 0.00 H new ATOM 0 HD2 PHE B 90 -23.508 -0.050 -28.618 1.00 0.00 H new ATOM 0 HE1 PHE B 90 -23.953 4.457 -30.651 1.00 0.00 H new ATOM 0 HE2 PHE B 90 -25.123 1.581 -27.677 1.00 0.00 H new ATOM 0 HZ PHE B 90 -25.346 3.835 -28.692 1.00 0.00 H new ATOM 2849 N SER B 91 -19.563 2.446 -31.248 1.00 0.00 N ATOM 2850 CA SER B 91 -19.254 3.900 -31.378 1.00 0.00 C ATOM 2851 C SER B 91 -19.597 4.392 -32.786 1.00 0.00 C ATOM 2852 O SER B 91 -19.501 3.660 -33.751 1.00 0.00 O ATOM 2853 CB SER B 91 -17.752 4.010 -31.121 1.00 0.00 C ATOM 2854 OG SER B 91 -17.054 3.201 -32.060 1.00 0.00 O ATOM 0 H SER B 91 -19.329 1.877 -32.062 1.00 0.00 H new ATOM 0 HA SER B 91 -19.832 4.508 -30.682 1.00 0.00 H new ATOM 0 HB2 SER B 91 -17.431 5.048 -31.209 1.00 0.00 H new ATOM 0 HB3 SER B 91 -17.521 3.690 -30.105 1.00 0.00 H new ATOM 0 HG SER B 91 -16.154 3.011 -31.722 1.00 0.00 H new ATOM 2860 N ASP B 92 -19.964 5.638 -32.915 1.00 0.00 N ATOM 2861 CA ASP B 92 -20.275 6.190 -34.266 1.00 0.00 C ATOM 2862 C ASP B 92 -18.993 6.315 -35.093 1.00 0.00 C ATOM 2863 O ASP B 92 -18.956 5.966 -36.257 1.00 0.00 O ATOM 2864 CB ASP B 92 -20.876 7.569 -33.998 1.00 0.00 C ATOM 2865 CG ASP B 92 -21.464 8.131 -35.294 1.00 0.00 C ATOM 2866 OD1 ASP B 92 -21.077 7.659 -36.350 1.00 0.00 O ATOM 2867 OD2 ASP B 92 -22.290 9.024 -35.208 1.00 0.00 O ATOM 0 H ASP B 92 -20.062 6.298 -32.144 1.00 0.00 H new ATOM 0 HA ASP B 92 -20.955 5.550 -34.829 1.00 0.00 H new ATOM 0 HB2 ASP B 92 -21.652 7.497 -33.236 1.00 0.00 H new ATOM 0 HB3 ASP B 92 -20.111 8.242 -33.612 1.00 0.00 H new ATOM 2872 N GLU B 93 -17.962 6.870 -34.516 1.00 0.00 N ATOM 2873 CA GLU B 93 -16.705 7.090 -35.275 1.00 0.00 C ATOM 2874 C GLU B 93 -15.570 7.494 -34.327 1.00 0.00 C ATOM 2875 O GLU B 93 -15.133 8.627 -34.314 1.00 0.00 O ATOM 2876 CB GLU B 93 -17.042 8.226 -36.232 1.00 0.00 C ATOM 2877 CG GLU B 93 -17.586 9.425 -35.448 1.00 0.00 C ATOM 2878 CD GLU B 93 -17.715 10.628 -36.384 1.00 0.00 C ATOM 2879 OE1 GLU B 93 -16.738 11.344 -36.534 1.00 0.00 O ATOM 2880 OE2 GLU B 93 -18.788 10.814 -36.934 1.00 0.00 O ATOM 0 H GLU B 93 -17.940 7.181 -33.545 1.00 0.00 H new ATOM 0 HA GLU B 93 -16.365 6.195 -35.796 1.00 0.00 H new ATOM 0 HB2 GLU B 93 -16.153 8.519 -36.790 1.00 0.00 H new ATOM 0 HB3 GLU B 93 -17.780 7.892 -36.961 1.00 0.00 H new ATOM 0 HG2 GLU B 93 -18.556 9.181 -35.016 1.00 0.00 H new ATOM 0 HG3 GLU B 93 -16.919 9.665 -34.620 1.00 0.00 H new ATOM 2887 N ILE B 94 -15.039 6.561 -33.585 1.00 0.00 N ATOM 2888 CA ILE B 94 -13.883 6.884 -32.701 1.00 0.00 C ATOM 2889 C ILE B 94 -12.711 7.392 -33.543 1.00 0.00 C ATOM 2890 O ILE B 94 -12.092 8.388 -33.226 1.00 0.00 O ATOM 2891 CB ILE B 94 -13.522 5.565 -32.018 1.00 0.00 C ATOM 2892 CG1 ILE B 94 -14.621 5.188 -31.022 1.00 0.00 C ATOM 2893 CG2 ILE B 94 -12.194 5.721 -31.274 1.00 0.00 C ATOM 2894 CD1 ILE B 94 -14.634 6.195 -29.869 1.00 0.00 C ATOM 0 H ILE B 94 -15.354 5.592 -33.552 1.00 0.00 H new ATOM 0 HA ILE B 94 -14.119 7.663 -31.976 1.00 0.00 H new ATOM 0 HB ILE B 94 -13.428 4.782 -32.770 1.00 0.00 H new ATOM 0 HG12 ILE B 94 -15.590 5.178 -31.521 1.00 0.00 H new ATOM 0 HG13 ILE B 94 -14.449 4.182 -30.638 1.00 0.00 H new ATOM 0 HG21 ILE B 94 -11.937 4.780 -30.787 1.00 0.00 H new ATOM 0 HG22 ILE B 94 -11.410 5.989 -31.982 1.00 0.00 H new ATOM 0 HG23 ILE B 94 -12.288 6.505 -30.522 1.00 0.00 H new ATOM 0 HD11 ILE B 94 -15.417 5.926 -29.160 1.00 0.00 H new ATOM 0 HD12 ILE B 94 -13.668 6.183 -29.365 1.00 0.00 H new ATOM 0 HD13 ILE B 94 -14.827 7.194 -30.260 1.00 0.00 H new ATOM 2906 N GLY B 95 -12.434 6.732 -34.633 1.00 0.00 N ATOM 2907 CA GLY B 95 -11.331 7.188 -35.531 1.00 0.00 C ATOM 2908 C GLY B 95 -10.127 7.634 -34.695 1.00 0.00 C ATOM 2909 O GLY B 95 -9.672 8.757 -34.799 1.00 0.00 O ATOM 0 H GLY B 95 -12.925 5.893 -34.943 1.00 0.00 H new ATOM 0 HA2 GLY B 95 -11.039 6.380 -36.202 1.00 0.00 H new ATOM 0 HA3 GLY B 95 -11.676 8.012 -36.155 1.00 0.00 H new ATOM 2913 N GLY B 96 -9.600 6.765 -33.876 1.00 0.00 N ATOM 2914 CA GLY B 96 -8.419 7.145 -33.049 1.00 0.00 C ATOM 2915 C GLY B 96 -7.214 7.390 -33.959 1.00 0.00 C ATOM 2916 O GLY B 96 -6.475 8.339 -33.786 1.00 0.00 O ATOM 0 H GLY B 96 -9.935 5.811 -33.744 1.00 0.00 H new ATOM 0 HA2 GLY B 96 -8.640 8.043 -32.472 1.00 0.00 H new ATOM 0 HA3 GLY B 96 -8.193 6.354 -32.334 1.00 0.00 H new ATOM 2920 N HIS B 97 -7.013 6.543 -34.931 1.00 0.00 N ATOM 2921 CA HIS B 97 -5.858 6.729 -35.856 1.00 0.00 C ATOM 2922 C HIS B 97 -6.325 7.386 -37.157 1.00 0.00 C ATOM 2923 O HIS B 97 -6.036 8.557 -37.344 1.00 0.00 O ATOM 2924 CB HIS B 97 -5.335 5.318 -36.127 1.00 0.00 C ATOM 2925 CG HIS B 97 -4.045 5.400 -36.895 1.00 0.00 C ATOM 2926 ND1 HIS B 97 -2.814 5.178 -36.299 1.00 0.00 N ATOM 2927 CD2 HIS B 97 -3.778 5.679 -38.213 1.00 0.00 C ATOM 2928 CE1 HIS B 97 -1.871 5.326 -37.248 1.00 0.00 C ATOM 2929 NE2 HIS B 97 -2.405 5.633 -38.433 1.00 0.00 N ATOM 2930 OXT HIS B 97 -6.965 6.709 -37.945 1.00 0.00 O ATOM 0 H HIS B 97 -7.598 5.730 -35.125 1.00 0.00 H new ATOM 0 HA HIS B 97 -5.089 7.374 -35.431 1.00 0.00 H new ATOM 0 HB2 HIS B 97 -5.178 4.790 -35.186 1.00 0.00 H new ATOM 0 HB3 HIS B 97 -6.072 4.748 -36.693 1.00 0.00 H new ATOM 0 HD2 HIS B 97 -4.521 5.901 -38.965 1.00 0.00 H new ATOM 0 HE1 HIS B 97 -0.812 5.211 -37.073 1.00 0.00 H new ATOM 0 HE2 HIS B 97 -1.912 5.798 -39.311 1.00 0.00 H new TER 2938 HIS B 97 HETATM 2939 N1 RBF A 98 1.937 8.301 -15.170 1.00 0.00 N HETATM 2940 C2 RBF A 98 2.688 7.954 -14.108 1.00 0.00 C HETATM 2941 O2 RBF A 98 2.505 8.574 -12.932 1.00 0.00 O HETATM 2942 N3 RBF A 98 3.650 6.962 -14.226 1.00 0.00 N HETATM 2943 C4 RBF A 98 3.840 6.327 -15.445 1.00 0.00 C HETATM 2944 O4 RBF A 98 4.770 5.369 -15.564 1.00 0.00 O HETATM 2945 C4A RBF A 98 3.057 6.698 -16.546 1.00 0.00 C HETATM 2946 N5 RBF A 98 3.207 6.109 -17.746 1.00 0.00 N HETATM 2947 C5A RBF A 98 2.458 6.451 -18.813 1.00 0.00 C HETATM 2948 C6 RBF A 98 2.656 5.806 -20.040 1.00 0.00 C HETATM 2949 C7 RBF A 98 1.877 6.160 -21.151 1.00 0.00 C HETATM 2950 C7M RBF A 98 2.091 5.467 -22.474 1.00 0.00 C HETATM 2951 C8 RBF A 98 0.901 7.157 -21.033 1.00 0.00 C HETATM 2952 C8M RBF A 98 0.068 7.539 -22.233 1.00 0.00 C HETATM 2953 C9 RBF A 98 0.701 7.804 -19.807 1.00 0.00 C HETATM 2954 C9A RBF A 98 1.478 7.454 -18.692 1.00 0.00 C HETATM 2955 N10 RBF A 98 1.301 8.084 -17.458 1.00 0.00 N HETATM 2956 C10 RBF A 98 2.093 7.708 -16.371 1.00 0.00 C HETATM 2957 C1' RBF A 98 0.279 9.136 -17.296 1.00 0.00 C HETATM 2958 C2' RBF A 98 0.540 10.275 -18.284 1.00 0.00 C HETATM 2959 O2' RBF A 98 1.783 10.049 -18.956 1.00 0.00 O HETATM 2960 C3' RBF A 98 0.604 11.602 -17.529 1.00 0.00 C HETATM 2961 O3' RBF A 98 1.458 11.463 -16.390 1.00 0.00 O HETATM 2962 C4' RBF A 98 -0.798 11.995 -17.068 1.00 0.00 C HETATM 2963 O4' RBF A 98 -1.622 12.245 -18.210 1.00 0.00 O HETATM 2964 C5' RBF A 98 -0.719 13.257 -16.212 1.00 0.00 C HETATM 2965 O5' RBF A 98 -0.089 14.301 -16.959 1.00 0.00 O HETATM 0 HO5' RBF A 98 -0.039 15.112 -16.411 1.00 0.00 H new HETATM 0 HO4' RBF A 98 -1.611 13.203 -18.418 1.00 0.00 H new HETATM 0 HO3' RBF A 98 1.883 12.324 -16.193 1.00 0.00 H new HETATM 0 HO2' RBF A 98 1.949 10.778 -19.590 1.00 0.00 H new HETATM 0 HC83 RBF A 98 0.720 7.900 -23.028 1.00 0.00 H new HETATM 0 HC82 RBF A 98 -0.485 6.668 -22.584 1.00 0.00 H new HETATM 0 HC81 RBF A 98 -0.633 8.325 -21.954 1.00 0.00 H new HETATM 0 HC73 RBF A 98 3.116 5.630 -22.808 1.00 0.00 H new HETATM 0 HC72 RBF A 98 1.913 4.398 -22.358 1.00 0.00 H new HETATM 0 HC71 RBF A 98 1.399 5.872 -23.213 1.00 0.00 H new HETATM 0 HC52 RBF A 98 -1.719 13.566 -15.907 1.00 0.00 H new HETATM 0 HC51 RBF A 98 -0.156 13.056 -15.301 1.00 0.00 H new HETATM 0 HC4' RBF A 98 -1.227 11.184 -16.480 1.00 0.00 H new HETATM 0 HC3' RBF A 98 1.000 12.375 -18.188 1.00 0.00 H new HETATM 0 HC2' RBF A 98 -0.267 10.312 -19.015 1.00 0.00 H new HETATM 0 HC12 RBF A 98 -0.714 8.719 -17.463 1.00 0.00 H new HETATM 0 HC11 RBF A 98 0.297 9.518 -16.275 1.00 0.00 H new HETATM 0 HN3 RBF A 98 4.216 6.700 -13.419 1.00 0.00 H new HETATM 0 HC9 RBF A 98 -0.059 8.580 -19.719 1.00 0.00 H new HETATM 0 HC6 RBF A 98 3.415 5.029 -20.132 1.00 0.00 H new HETATM 2986 N1 RBF B 99 -16.461 -8.294 -14.108 1.00 0.00 N HETATM 2987 C2 RBF B 99 -17.182 -7.858 -13.058 1.00 0.00 C HETATM 2988 O2 RBF B 99 -16.956 -8.366 -11.837 1.00 0.00 O HETATM 2989 N3 RBF B 99 -18.156 -6.886 -13.235 1.00 0.00 N HETATM 2990 C4 RBF B 99 -18.391 -6.366 -14.500 1.00 0.00 C HETATM 2991 O4 RBF B 99 -19.331 -5.429 -14.676 1.00 0.00 O HETATM 2992 C4A RBF B 99 -17.638 -6.830 -15.588 1.00 0.00 C HETATM 2993 N5 RBF B 99 -17.830 -6.354 -16.831 1.00 0.00 N HETATM 2994 C5A RBF B 99 -17.112 -6.788 -17.885 1.00 0.00 C HETATM 2995 C6 RBF B 99 -17.355 -6.259 -19.159 1.00 0.00 C HETATM 2996 C7 RBF B 99 -16.608 -6.707 -20.258 1.00 0.00 C HETATM 2997 C7M RBF B 99 -16.869 -6.138 -21.631 1.00 0.00 C HETATM 2998 C8 RBF B 99 -15.619 -7.682 -20.081 1.00 0.00 C HETATM 2999 C8M RBF B 99 -14.820 -8.166 -21.267 1.00 0.00 C HETATM 3000 C9 RBF B 99 -15.374 -8.214 -18.808 1.00 0.00 C HETATM 3001 C9A RBF B 99 -16.120 -7.770 -17.705 1.00 0.00 C HETATM 3002 N10 RBF B 99 -15.899 -8.282 -16.425 1.00 0.00 N HETATM 3003 C10 RBF B 99 -16.659 -7.814 -15.353 1.00 0.00 C HETATM 3004 C1' RBF B 99 -14.863 -9.308 -16.201 1.00 0.00 C HETATM 3005 C2' RBF B 99 -15.146 -10.534 -17.072 1.00 0.00 C HETATM 3006 O2' RBF B 99 -16.410 -10.378 -17.721 1.00 0.00 O HETATM 3007 C3' RBF B 99 -15.171 -11.788 -16.198 1.00 0.00 C HETATM 3008 O3' RBF B 99 -15.990 -11.551 -15.050 1.00 0.00 O HETATM 3009 C4' RBF B 99 -13.751 -12.127 -15.748 1.00 0.00 C HETATM 3010 O4' RBF B 99 -12.961 -12.475 -16.889 1.00 0.00 O HETATM 3011 C5' RBF B 99 -13.792 -13.307 -14.779 1.00 0.00 C HETATM 3012 O5' RBF B 99 -14.435 -14.419 -15.408 1.00 0.00 O HETATM 0 HO5' RBF B 99 -14.165 -14.464 -16.349 1.00 0.00 H new HETATM 0 HO4' RBF B 99 -12.049 -12.691 -16.602 1.00 0.00 H new HETATM 0 HO3' RBF B 99 -16.400 -12.393 -14.761 1.00 0.00 H new HETATM 0 HO2' RBF B 99 -16.590 -11.163 -18.280 1.00 0.00 H new HETATM 0 HC83 RBF B 99 -15.493 -8.603 -22.005 1.00 0.00 H new HETATM 0 HC82 RBF B 99 -14.287 -7.327 -21.714 1.00 0.00 H new HETATM 0 HC81 RBF B 99 -14.103 -8.919 -20.940 1.00 0.00 H new HETATM 0 HC73 RBF B 99 -17.902 -6.337 -21.917 1.00 0.00 H new HETATM 0 HC72 RBF B 99 -16.697 -5.062 -21.618 1.00 0.00 H new HETATM 0 HC71 RBF B 99 -16.197 -6.604 -22.352 1.00 0.00 H new HETATM 0 HC52 RBF B 99 -12.780 -13.580 -14.479 1.00 0.00 H new HETATM 0 HC51 RBF B 99 -14.329 -13.028 -13.872 1.00 0.00 H new HETATM 0 HC4' RBF B 99 -13.311 -11.263 -15.250 1.00 0.00 H new HETATM 0 HC3' RBF B 99 -15.578 -12.621 -16.771 1.00 0.00 H new HETATM 0 HC2' RBF B 99 -14.363 -10.632 -17.824 1.00 0.00 H new HETATM 0 HC12 RBF B 99 -13.880 -8.902 -16.438 1.00 0.00 H new HETATM 0 HC11 RBF B 99 -14.844 -9.595 -15.150 1.00 0.00 H new HETATM 0 HN3 RBF B 99 -18.698 -6.554 -12.437 1.00 0.00 H new HETATM 0 HC9 RBF B 99 -14.603 -8.973 -18.674 1.00 0.00 H new HETATM 0 HC6 RBF B 99 -18.125 -5.499 -19.296 1.00 0.00 H new