USER MOD reduce.3.24.130724 H: found=0, std=0, add=1530, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1530 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 ASN : amide:sc= -2.8! X(o=-3.3!,f=-2.9) USER MOD Set 1.2: B 70 SER OG : rot 180:sc= -0.482 USER MOD Set 2.1: A 70 SER OG : rot -52:sc= -2.06! USER MOD Set 2.2: B 51 ASN : amide:sc= -6.65! C(o=-8.7!,f=-11!) USER MOD Set 2.3: B 52 SER OG : rot 84:sc= -0.0271 USER MOD Set 3.1: B 2 THR OG1 : rot 6:sc= 0.369 USER MOD Set 3.2: B 6 ASN : amide:sc= -6.42! C(o=-6!,f=-2.5!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -144:sc= -0.129 (180deg=-1.02) USER MOD Single : A 2 THR OG1 : rot -18:sc= 0.203! USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -8.91! C(o=-8.9!,f=-11!) USER MOD Single : A 12 LYS NZ :NH3+ 157:sc= -4.71! (180deg=-7.47!) USER MOD Single : A 13 THR OG1 : rot -3:sc= 0.644! USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 HIS : no HD1:sc= -1 K(o=-1,f=-2.1!) USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -2.32! K(o=-2.3!,f=-0.71) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -140:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0.0922 USER MOD Single : A 45 LYS NZ :NH3+ -116:sc= -0.31 (180deg=-5.81!) USER MOD Single : A 50 TYR OH : rot -110:sc= -5.05! USER MOD Single : A 52 SER OG : rot -101:sc= -0.103 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= -0.102 X(o=-0.1,f=-0.31) USER MOD Single : A 65 ASN : amide:sc= 0.376 X(o=0.38,f=0) USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 68 THR OG1 : rot -110:sc= -0.538 USER MOD Single : A 79 SER OG : rot -80:sc= -0.537 USER MOD Single : A 80 TYR OH : rot 180:sc= -0.0534 USER MOD Single : A 86 LYS NZ :NH3+ 166:sc=-0.000981 (180deg=-0.222) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -127:sc= -0.0292 (180deg=-0.302) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 LYS NZ :NH3+ 158:sc= -4.61! (180deg=-7.21!) USER MOD Single : B 13 THR OG1 : rot 180:sc= -0.0203 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 ASN : amide:sc= -1.12 K(o=-1.1,f=0.042!) USER MOD Single : B 19 HIS : no HD1:sc= -1.09 K(o=-1.1,f=-2.1!) USER MOD Single : B 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 29 GLN : amide:sc= -3.96! C(o=-4!,f=-1.6!) USER MOD Single : B 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 THR OG1 : rot 140:sc= -0.224 USER MOD Single : B 44 SER OG : rot 76:sc= 1.14 USER MOD Single : B 45 LYS NZ :NH3+ -129:sc= -0.964 (180deg=-4.28!) USER MOD Single : B 50 TYR OH : rot -109:sc= -7.02! USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 GLN : amide:sc= -0.0244 X(o=-0.024,f=-0.22) USER MOD Single : B 65 ASN : amide:sc= 0.333 K(o=0.33,f=-1.3) USER MOD Single : B 67 GLN : amide:sc=-0.000266 K(o=-0.00027,f=-1.7!) USER MOD Single : B 68 THR OG1 : rot 100:sc= -2.26! USER MOD Single : B 79 SER OG : rot -139:sc= -0.792 USER MOD Single : B 80 TYR OH : rot 180:sc= 0 USER MOD Single : B 86 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.099) USER MOD Single : B 89 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 24.933 -2.856 -13.283 1.00 4.01 N ATOM 2 CA MET A 1 23.694 -2.654 -12.480 1.00 3.21 C ATOM 3 C MET A 1 22.976 -1.394 -12.965 1.00 2.18 C ATOM 4 O MET A 1 23.501 -0.302 -12.882 1.00 2.40 O ATOM 5 CB MET A 1 24.062 -2.498 -11.002 1.00 3.87 C ATOM 6 CG MET A 1 24.926 -3.682 -10.564 1.00 4.69 C ATOM 7 SD MET A 1 24.212 -4.435 -9.081 1.00 5.64 S ATOM 8 CE MET A 1 23.478 -5.877 -9.892 1.00 6.33 C ATOM 0 H1 MET A 1 25.087 -3.873 -13.433 1.00 4.01 H new ATOM 0 H2 MET A 1 24.832 -2.382 -14.203 1.00 4.01 H new ATOM 0 H3 MET A 1 25.746 -2.454 -12.774 1.00 4.01 H new ATOM 0 HA MET A 1 23.037 -3.516 -12.599 1.00 3.21 H new ATOM 0 HB2 MET A 1 24.601 -1.564 -10.847 1.00 3.87 H new ATOM 0 HB3 MET A 1 23.158 -2.449 -10.394 1.00 3.87 H new ATOM 0 HG2 MET A 1 24.986 -4.418 -11.366 1.00 4.69 H new ATOM 0 HG3 MET A 1 25.944 -3.348 -10.361 1.00 4.69 H new ATOM 0 HE1 MET A 1 22.974 -6.495 -9.149 1.00 6.33 H new ATOM 0 HE2 MET A 1 22.756 -5.546 -10.639 1.00 6.33 H new ATOM 0 HE3 MET A 1 24.261 -6.459 -10.378 1.00 6.33 H new ATOM 20 N THR A 2 21.781 -1.542 -13.474 1.00 1.58 N ATOM 21 CA THR A 2 21.018 -0.360 -13.973 1.00 1.09 C ATOM 22 C THR A 2 21.164 0.806 -12.992 1.00 0.90 C ATOM 23 O THR A 2 21.071 0.632 -11.796 1.00 1.71 O ATOM 24 CB THR A 2 19.539 -0.729 -14.095 1.00 1.87 C ATOM 25 OG1 THR A 2 18.859 -0.342 -12.909 1.00 2.53 O ATOM 26 CG2 THR A 2 19.401 -2.239 -14.293 1.00 2.32 C ATOM 0 H THR A 2 21.298 -2.436 -13.566 1.00 1.58 H new ATOM 0 HA THR A 2 21.410 -0.065 -14.946 1.00 1.09 H new ATOM 0 HB THR A 2 19.105 -0.212 -14.951 1.00 1.87 H new ATOM 0 HG1 THR A 2 19.510 -0.200 -12.190 1.00 2.53 H new ATOM 0 HG21 THR A 2 18.346 -2.500 -14.380 1.00 2.32 H new ATOM 0 HG22 THR A 2 19.924 -2.536 -15.202 1.00 2.32 H new ATOM 0 HG23 THR A 2 19.834 -2.759 -13.439 1.00 2.32 H new ATOM 34 N GLU A 3 21.409 1.988 -13.490 1.00 0.79 N ATOM 35 CA GLU A 3 21.579 3.165 -12.587 1.00 0.55 C ATOM 36 C GLU A 3 20.220 3.626 -12.078 1.00 0.53 C ATOM 37 O GLU A 3 20.129 4.294 -11.076 1.00 0.58 O ATOM 38 CB GLU A 3 22.223 4.318 -13.354 1.00 0.66 C ATOM 39 CG GLU A 3 23.114 3.767 -14.464 1.00 1.13 C ATOM 40 CD GLU A 3 23.982 4.894 -15.025 1.00 1.17 C ATOM 41 OE1 GLU A 3 23.579 6.040 -14.906 1.00 1.60 O ATOM 42 OE2 GLU A 3 25.032 4.594 -15.566 1.00 1.75 O ATOM 0 H GLU A 3 21.499 2.191 -14.486 1.00 0.79 H new ATOM 0 HA GLU A 3 22.213 2.873 -11.750 1.00 0.55 H new ATOM 0 HB2 GLU A 3 21.451 4.960 -13.779 1.00 0.66 H new ATOM 0 HB3 GLU A 3 22.812 4.935 -12.675 1.00 0.66 H new ATOM 0 HG2 GLU A 3 23.744 2.967 -14.076 1.00 1.13 H new ATOM 0 HG3 GLU A 3 22.502 3.336 -15.256 1.00 1.13 H new ATOM 49 N LYS A 4 19.161 3.278 -12.745 1.00 0.59 N ATOM 50 CA LYS A 4 17.822 3.706 -12.256 1.00 0.59 C ATOM 51 C LYS A 4 16.759 2.755 -12.783 1.00 0.59 C ATOM 52 O LYS A 4 16.901 2.181 -13.843 1.00 0.89 O ATOM 53 CB LYS A 4 17.506 5.127 -12.728 1.00 0.54 C ATOM 54 CG LYS A 4 17.548 5.190 -14.253 1.00 1.07 C ATOM 55 CD LYS A 4 17.914 6.610 -14.702 1.00 1.12 C ATOM 56 CE LYS A 4 19.436 6.764 -14.767 1.00 1.71 C ATOM 57 NZ LYS A 4 19.774 8.117 -15.296 1.00 2.24 N ATOM 0 H LYS A 4 19.161 2.721 -13.600 1.00 0.59 H new ATOM 0 HA LYS A 4 17.829 3.689 -11.166 1.00 0.59 H new ATOM 0 HB2 LYS A 4 16.521 5.428 -12.370 1.00 0.54 H new ATOM 0 HB3 LYS A 4 18.226 5.828 -12.306 1.00 0.54 H new ATOM 0 HG2 LYS A 4 18.279 4.478 -14.636 1.00 1.07 H new ATOM 0 HG3 LYS A 4 16.580 4.906 -14.665 1.00 1.07 H new ATOM 0 HD2 LYS A 4 17.478 6.815 -15.680 1.00 1.12 H new ATOM 0 HD3 LYS A 4 17.496 7.339 -14.007 1.00 1.12 H new ATOM 0 HE2 LYS A 4 19.869 6.630 -13.776 1.00 1.71 H new ATOM 0 HE3 LYS A 4 19.864 5.993 -15.408 1.00 1.71 H new ATOM 0 HZ1 LYS A 4 20.808 8.224 -15.341 1.00 2.24 H new ATOM 0 HZ2 LYS A 4 19.373 8.227 -16.249 1.00 2.24 H new ATOM 0 HZ3 LYS A 4 19.378 8.845 -14.667 1.00 2.24 H new ATOM 71 N LEU A 5 15.707 2.584 -12.025 1.00 0.58 N ATOM 72 CA LEU A 5 14.590 1.673 -12.419 1.00 0.62 C ATOM 73 C LEU A 5 14.900 0.276 -11.891 1.00 0.75 C ATOM 74 O LEU A 5 14.850 -0.707 -12.602 1.00 1.54 O ATOM 75 CB LEU A 5 14.409 1.637 -13.949 1.00 0.73 C ATOM 76 CG LEU A 5 12.940 1.386 -14.314 1.00 1.02 C ATOM 77 CD1 LEU A 5 12.780 1.478 -15.832 1.00 1.39 C ATOM 78 CD2 LEU A 5 12.505 -0.009 -13.852 1.00 1.67 C ATOM 0 H LEU A 5 15.572 3.049 -11.127 1.00 0.58 H new ATOM 0 HA LEU A 5 13.658 2.042 -11.991 1.00 0.62 H new ATOM 0 HB2 LEU A 5 14.741 2.581 -14.382 1.00 0.73 H new ATOM 0 HB3 LEU A 5 15.034 0.853 -14.376 1.00 0.73 H new ATOM 0 HG LEU A 5 12.320 2.134 -13.820 1.00 1.02 H new ATOM 0 HD11 LEU A 5 11.738 1.301 -16.099 1.00 1.39 H new ATOM 0 HD12 LEU A 5 13.077 2.471 -16.170 1.00 1.39 H new ATOM 0 HD13 LEU A 5 13.410 0.728 -16.310 1.00 1.39 H new ATOM 0 HD21 LEU A 5 11.461 -0.171 -14.118 1.00 1.67 H new ATOM 0 HD22 LEU A 5 13.125 -0.763 -14.338 1.00 1.67 H new ATOM 0 HD23 LEU A 5 12.620 -0.086 -12.771 1.00 1.67 H new ATOM 90 N ASN A 6 15.236 0.194 -10.638 1.00 0.26 N ATOM 91 CA ASN A 6 15.568 -1.114 -10.026 1.00 0.26 C ATOM 92 C ASN A 6 14.297 -1.727 -9.441 1.00 0.24 C ATOM 93 O ASN A 6 13.698 -1.186 -8.535 1.00 0.26 O ATOM 94 CB ASN A 6 16.586 -0.870 -8.918 1.00 0.35 C ATOM 95 CG ASN A 6 16.915 -2.185 -8.213 1.00 0.93 C ATOM 96 OD1 ASN A 6 16.388 -3.223 -8.563 1.00 1.72 O ATOM 97 ND2 ASN A 6 17.776 -2.190 -7.232 1.00 1.39 N ATOM 0 H ASN A 6 15.295 0.991 -10.004 1.00 0.26 H new ATOM 0 HA ASN A 6 15.981 -1.797 -10.768 1.00 0.26 H new ATOM 0 HB2 ASN A 6 17.494 -0.435 -9.336 1.00 0.35 H new ATOM 0 HB3 ASN A 6 16.190 -0.152 -8.200 1.00 0.35 H new ATOM 0 HD21 ASN A 6 18.006 -3.064 -6.760 1.00 1.39 H new ATOM 0 HD22 ASN A 6 18.219 -1.320 -6.938 1.00 1.39 H new ATOM 104 N GLU A 7 13.880 -2.853 -9.952 1.00 0.25 N ATOM 105 CA GLU A 7 12.646 -3.494 -9.421 1.00 0.28 C ATOM 106 C GLU A 7 13.016 -4.501 -8.339 1.00 0.28 C ATOM 107 O GLU A 7 13.741 -5.446 -8.581 1.00 0.30 O ATOM 108 CB GLU A 7 11.893 -4.180 -10.561 1.00 0.35 C ATOM 109 CG GLU A 7 12.599 -5.480 -10.951 1.00 0.44 C ATOM 110 CD GLU A 7 12.176 -5.882 -12.365 1.00 0.75 C ATOM 111 OE1 GLU A 7 12.466 -5.135 -13.285 1.00 1.44 O ATOM 112 OE2 GLU A 7 11.566 -6.930 -12.505 1.00 1.12 O ATOM 0 H GLU A 7 14.339 -3.355 -10.712 1.00 0.25 H new ATOM 0 HA GLU A 7 11.998 -2.735 -8.982 1.00 0.28 H new ATOM 0 HB2 GLU A 7 10.868 -4.391 -10.255 1.00 0.35 H new ATOM 0 HB3 GLU A 7 11.838 -3.515 -11.423 1.00 0.35 H new ATOM 0 HG2 GLU A 7 13.680 -5.347 -10.907 1.00 0.44 H new ATOM 0 HG3 GLU A 7 12.346 -6.271 -10.245 1.00 0.44 H new ATOM 119 N ILE A 8 12.556 -4.276 -7.131 1.00 0.28 N ATOM 120 CA ILE A 8 12.926 -5.207 -6.009 1.00 0.31 C ATOM 121 C ILE A 8 11.700 -5.699 -5.230 1.00 0.28 C ATOM 122 O ILE A 8 10.673 -5.061 -5.174 1.00 0.28 O ATOM 123 CB ILE A 8 13.864 -4.482 -5.050 1.00 0.35 C ATOM 124 CG1 ILE A 8 15.039 -3.906 -5.846 1.00 0.42 C ATOM 125 CG2 ILE A 8 14.380 -5.472 -3.998 1.00 0.56 C ATOM 126 CD1 ILE A 8 15.961 -3.114 -4.919 1.00 1.11 C ATOM 0 H ILE A 8 11.948 -3.499 -6.872 1.00 0.28 H new ATOM 0 HA ILE A 8 13.411 -6.078 -6.449 1.00 0.31 H new ATOM 0 HB ILE A 8 13.334 -3.673 -4.547 1.00 0.35 H new ATOM 0 HG12 ILE A 8 15.595 -4.713 -6.323 1.00 0.42 H new ATOM 0 HG13 ILE A 8 14.668 -3.260 -6.642 1.00 0.42 H new ATOM 0 HG21 ILE A 8 15.051 -4.956 -3.311 1.00 0.56 H new ATOM 0 HG22 ILE A 8 13.538 -5.884 -3.442 1.00 0.56 H new ATOM 0 HG23 ILE A 8 14.918 -6.281 -4.492 1.00 0.56 H new ATOM 0 HD11 ILE A 8 16.794 -2.708 -5.494 1.00 1.11 H new ATOM 0 HD12 ILE A 8 15.403 -2.297 -4.462 1.00 1.11 H new ATOM 0 HD13 ILE A 8 16.345 -3.772 -4.139 1.00 1.11 H new ATOM 138 N VAL A 9 11.828 -6.862 -4.641 1.00 0.28 N ATOM 139 CA VAL A 9 10.709 -7.461 -3.853 1.00 0.27 C ATOM 140 C VAL A 9 11.072 -7.503 -2.362 1.00 0.24 C ATOM 141 O VAL A 9 12.141 -7.937 -1.978 1.00 0.25 O ATOM 142 CB VAL A 9 10.453 -8.887 -4.350 1.00 0.30 C ATOM 143 CG1 VAL A 9 11.665 -9.765 -4.031 1.00 1.35 C ATOM 144 CG2 VAL A 9 9.215 -9.457 -3.652 1.00 1.27 C ATOM 0 H VAL A 9 12.675 -7.430 -4.674 1.00 0.28 H new ATOM 0 HA VAL A 9 9.815 -6.852 -3.983 1.00 0.27 H new ATOM 0 HB VAL A 9 10.289 -8.871 -5.427 1.00 0.30 H new ATOM 0 HG11 VAL A 9 11.482 -10.780 -4.385 1.00 1.35 H new ATOM 0 HG12 VAL A 9 12.548 -9.361 -4.527 1.00 1.35 H new ATOM 0 HG13 VAL A 9 11.830 -9.781 -2.954 1.00 1.35 H new ATOM 0 HG21 VAL A 9 9.033 -10.472 -4.006 1.00 1.27 H new ATOM 0 HG22 VAL A 9 9.379 -9.472 -2.575 1.00 1.27 H new ATOM 0 HG23 VAL A 9 8.350 -8.833 -3.878 1.00 1.27 H new ATOM 154 N VAL A 10 10.182 -7.044 -1.527 1.00 0.23 N ATOM 155 CA VAL A 10 10.458 -7.039 -0.058 1.00 0.22 C ATOM 156 C VAL A 10 9.992 -8.375 0.520 1.00 0.20 C ATOM 157 O VAL A 10 9.274 -9.111 -0.128 1.00 0.20 O ATOM 158 CB VAL A 10 9.698 -5.878 0.605 1.00 0.23 C ATOM 159 CG1 VAL A 10 8.209 -5.951 0.249 1.00 0.33 C ATOM 160 CG2 VAL A 10 9.857 -5.955 2.125 1.00 0.39 C ATOM 0 H VAL A 10 9.272 -6.670 -1.797 1.00 0.23 H new ATOM 0 HA VAL A 10 11.523 -6.906 0.130 1.00 0.22 H new ATOM 0 HB VAL A 10 10.110 -4.937 0.241 1.00 0.23 H new ATOM 0 HG11 VAL A 10 7.680 -5.124 0.724 1.00 0.33 H new ATOM 0 HG12 VAL A 10 8.090 -5.885 -0.832 1.00 0.33 H new ATOM 0 HG13 VAL A 10 7.796 -6.896 0.602 1.00 0.33 H new ATOM 0 HG21 VAL A 10 9.317 -5.130 2.590 1.00 0.39 H new ATOM 0 HG22 VAL A 10 9.454 -6.902 2.485 1.00 0.39 H new ATOM 0 HG23 VAL A 10 10.914 -5.888 2.384 1.00 0.39 H new ATOM 170 N ARG A 11 10.399 -8.709 1.719 1.00 0.20 N ATOM 171 CA ARG A 11 9.980 -10.011 2.309 1.00 0.19 C ATOM 172 C ARG A 11 9.622 -9.826 3.781 1.00 0.22 C ATOM 173 O ARG A 11 9.822 -8.775 4.356 1.00 0.22 O ATOM 174 CB ARG A 11 11.125 -11.020 2.200 1.00 0.20 C ATOM 175 CG ARG A 11 12.307 -10.388 1.463 1.00 0.30 C ATOM 176 CD ARG A 11 13.410 -11.433 1.282 1.00 0.34 C ATOM 177 NE ARG A 11 13.168 -12.200 0.027 1.00 1.17 N ATOM 178 CZ ARG A 11 13.508 -11.690 -1.125 1.00 1.42 C ATOM 179 NH1 ARG A 11 14.054 -10.506 -1.178 1.00 1.51 N ATOM 180 NH2 ARG A 11 13.303 -12.363 -2.224 1.00 2.27 N ATOM 0 H ARG A 11 11.001 -8.137 2.311 1.00 0.20 H new ATOM 0 HA ARG A 11 9.110 -10.379 1.765 1.00 0.19 H new ATOM 0 HB2 ARG A 11 11.435 -11.341 3.195 1.00 0.20 H new ATOM 0 HB3 ARG A 11 10.788 -11.910 1.669 1.00 0.20 H new ATOM 0 HG2 ARG A 11 11.985 -10.011 0.492 1.00 0.30 H new ATOM 0 HG3 ARG A 11 12.687 -9.536 2.026 1.00 0.30 H new ATOM 0 HD2 ARG A 11 14.384 -10.946 1.241 1.00 0.34 H new ATOM 0 HD3 ARG A 11 13.428 -12.110 2.136 1.00 0.34 H new ATOM 0 HE ARG A 11 12.737 -13.123 0.069 1.00 1.17 H new ATOM 0 HH11 ARG A 11 14.215 -9.980 -0.319 1.00 1.51 H new ATOM 0 HH12 ARG A 11 14.320 -10.107 -2.078 1.00 1.51 H new ATOM 0 HH21 ARG A 11 12.877 -13.289 -2.183 1.00 2.27 H new ATOM 0 HH22 ARG A 11 13.569 -11.963 -3.124 1.00 2.27 H new ATOM 194 N LYS A 12 9.093 -10.850 4.389 1.00 0.27 N ATOM 195 CA LYS A 12 8.715 -10.762 5.822 1.00 0.32 C ATOM 196 C LYS A 12 9.820 -11.373 6.662 1.00 0.35 C ATOM 197 O LYS A 12 9.781 -11.334 7.877 1.00 0.43 O ATOM 198 CB LYS A 12 7.433 -11.545 6.053 1.00 0.35 C ATOM 199 CG LYS A 12 7.661 -13.016 5.697 1.00 0.38 C ATOM 200 CD LYS A 12 6.380 -13.608 5.105 1.00 1.05 C ATOM 201 CE LYS A 12 6.367 -15.121 5.327 1.00 1.03 C ATOM 202 NZ LYS A 12 6.310 -15.407 6.789 1.00 1.78 N ATOM 0 H LYS A 12 8.906 -11.751 3.949 1.00 0.27 H new ATOM 0 HA LYS A 12 8.566 -9.718 6.099 1.00 0.32 H new ATOM 0 HB2 LYS A 12 7.123 -11.456 7.094 1.00 0.35 H new ATOM 0 HB3 LYS A 12 6.628 -11.133 5.444 1.00 0.35 H new ATOM 0 HG2 LYS A 12 8.478 -13.104 4.981 1.00 0.38 H new ATOM 0 HG3 LYS A 12 7.954 -13.574 6.586 1.00 0.38 H new ATOM 0 HD2 LYS A 12 5.507 -13.154 5.573 1.00 1.05 H new ATOM 0 HD3 LYS A 12 6.323 -13.386 4.039 1.00 1.05 H new ATOM 0 HE2 LYS A 12 5.508 -15.566 4.825 1.00 1.03 H new ATOM 0 HE3 LYS A 12 7.259 -15.571 4.892 1.00 1.03 H new ATOM 0 HZ1 LYS A 12 5.918 -16.358 6.942 1.00 1.78 H new ATOM 0 HZ2 LYS A 12 7.269 -15.359 7.190 1.00 1.78 H new ATOM 0 HZ3 LYS A 12 5.704 -14.703 7.257 1.00 1.78 H new ATOM 216 N THR A 13 10.815 -11.921 6.029 1.00 0.34 N ATOM 217 CA THR A 13 11.934 -12.517 6.797 1.00 0.44 C ATOM 218 C THR A 13 13.015 -11.452 6.929 1.00 0.58 C ATOM 219 O THR A 13 14.046 -11.656 7.537 1.00 1.08 O ATOM 220 CB THR A 13 12.483 -13.739 6.058 1.00 0.48 C ATOM 221 OG1 THR A 13 13.756 -14.080 6.589 1.00 1.24 O ATOM 222 CG2 THR A 13 12.617 -13.426 4.568 1.00 1.01 C ATOM 0 H THR A 13 10.901 -11.981 5.014 1.00 0.34 H new ATOM 0 HA THR A 13 11.597 -12.843 7.781 1.00 0.44 H new ATOM 0 HB THR A 13 11.798 -14.577 6.188 1.00 0.48 H new ATOM 0 HG1 THR A 13 14.014 -13.423 7.269 1.00 1.24 H new ATOM 0 HG21 THR A 13 13.008 -14.299 4.046 1.00 1.01 H new ATOM 0 HG22 THR A 13 11.639 -13.168 4.161 1.00 1.01 H new ATOM 0 HG23 THR A 13 13.299 -12.587 4.432 1.00 1.01 H new ATOM 230 N LYS A 14 12.744 -10.302 6.377 1.00 0.35 N ATOM 231 CA LYS A 14 13.693 -9.157 6.452 1.00 0.43 C ATOM 232 C LYS A 14 12.989 -8.030 7.206 1.00 0.57 C ATOM 233 O LYS A 14 11.858 -7.701 6.915 1.00 1.34 O ATOM 234 CB LYS A 14 14.022 -8.668 5.029 1.00 0.39 C ATOM 235 CG LYS A 14 15.480 -9.006 4.620 1.00 0.60 C ATOM 236 CD LYS A 14 15.582 -10.383 3.932 1.00 0.86 C ATOM 237 CE LYS A 14 16.047 -11.439 4.934 1.00 1.06 C ATOM 238 NZ LYS A 14 17.536 -11.457 4.988 1.00 1.41 N ATOM 0 H LYS A 14 11.884 -10.104 5.865 1.00 0.35 H new ATOM 0 HA LYS A 14 14.614 -9.455 6.953 1.00 0.43 H new ATOM 0 HB2 LYS A 14 13.332 -9.125 4.320 1.00 0.39 H new ATOM 0 HB3 LYS A 14 13.870 -7.590 4.972 1.00 0.39 H new ATOM 0 HG2 LYS A 14 15.856 -8.235 3.947 1.00 0.60 H new ATOM 0 HG3 LYS A 14 16.117 -8.994 5.505 1.00 0.60 H new ATOM 0 HD2 LYS A 14 14.613 -10.664 3.519 1.00 0.86 H new ATOM 0 HD3 LYS A 14 16.281 -10.330 3.097 1.00 0.86 H new ATOM 0 HE2 LYS A 14 15.640 -11.222 5.922 1.00 1.06 H new ATOM 0 HE3 LYS A 14 15.672 -12.420 4.644 1.00 1.06 H new ATOM 0 HZ1 LYS A 14 17.850 -12.176 5.670 1.00 1.41 H new ATOM 0 HZ2 LYS A 14 17.915 -11.684 4.046 1.00 1.41 H new ATOM 0 HZ3 LYS A 14 17.884 -10.523 5.285 1.00 1.41 H new ATOM 252 N ASN A 15 13.623 -7.443 8.178 1.00 0.43 N ATOM 253 CA ASN A 15 12.953 -6.355 8.943 1.00 0.33 C ATOM 254 C ASN A 15 12.752 -5.125 8.057 1.00 0.24 C ATOM 255 O ASN A 15 13.234 -5.057 6.943 1.00 0.24 O ATOM 256 CB ASN A 15 13.825 -5.977 10.139 1.00 0.47 C ATOM 257 CG ASN A 15 13.276 -6.645 11.399 1.00 0.56 C ATOM 258 OD1 ASN A 15 13.406 -7.840 11.572 1.00 1.23 O ATOM 259 ND2 ASN A 15 12.664 -5.918 12.293 1.00 1.25 N ATOM 0 H ASN A 15 14.572 -7.667 8.477 1.00 0.43 H new ATOM 0 HA ASN A 15 11.979 -6.707 9.283 1.00 0.33 H new ATOM 0 HB2 ASN A 15 14.854 -6.292 9.966 1.00 0.47 H new ATOM 0 HB3 ASN A 15 13.839 -4.894 10.265 1.00 0.47 H new ATOM 0 HD21 ASN A 15 12.294 -6.353 13.138 1.00 1.25 H new ATOM 0 HD22 ASN A 15 12.555 -4.914 12.147 1.00 1.25 H new ATOM 266 N VAL A 16 12.052 -4.143 8.559 1.00 0.24 N ATOM 267 CA VAL A 16 11.826 -2.902 7.769 1.00 0.22 C ATOM 268 C VAL A 16 13.177 -2.249 7.504 1.00 0.23 C ATOM 269 O VAL A 16 13.423 -1.680 6.453 1.00 0.25 O ATOM 270 CB VAL A 16 10.954 -1.932 8.571 1.00 0.29 C ATOM 271 CG1 VAL A 16 9.604 -2.581 8.874 1.00 0.31 C ATOM 272 CG2 VAL A 16 11.655 -1.582 9.887 1.00 0.49 C ATOM 0 H VAL A 16 11.626 -4.149 9.486 1.00 0.24 H new ATOM 0 HA VAL A 16 11.327 -3.145 6.831 1.00 0.22 H new ATOM 0 HB VAL A 16 10.797 -1.025 7.987 1.00 0.29 H new ATOM 0 HG11 VAL A 16 8.987 -1.887 9.445 1.00 0.31 H new ATOM 0 HG12 VAL A 16 9.101 -2.829 7.939 1.00 0.31 H new ATOM 0 HG13 VAL A 16 9.760 -3.490 9.455 1.00 0.31 H new ATOM 0 HG21 VAL A 16 11.034 -0.891 10.458 1.00 0.49 H new ATOM 0 HG22 VAL A 16 11.814 -2.491 10.467 1.00 0.49 H new ATOM 0 HG23 VAL A 16 12.616 -1.114 9.674 1.00 0.49 H new ATOM 282 N GLU A 17 14.063 -2.340 8.450 1.00 0.27 N ATOM 283 CA GLU A 17 15.398 -1.739 8.259 1.00 0.33 C ATOM 284 C GLU A 17 16.151 -2.548 7.210 1.00 0.34 C ATOM 285 O GLU A 17 16.852 -2.003 6.384 1.00 0.37 O ATOM 286 CB GLU A 17 16.167 -1.737 9.587 1.00 0.39 C ATOM 287 CG GLU A 17 16.845 -3.091 9.813 1.00 0.86 C ATOM 288 CD GLU A 17 17.267 -3.211 11.279 1.00 1.03 C ATOM 289 OE1 GLU A 17 17.446 -2.182 11.910 1.00 1.56 O ATOM 290 OE2 GLU A 17 17.403 -4.330 11.746 1.00 1.41 O ATOM 0 H GLU A 17 13.917 -2.805 9.346 1.00 0.27 H new ATOM 0 HA GLU A 17 15.298 -0.707 7.922 1.00 0.33 H new ATOM 0 HB2 GLU A 17 16.916 -0.945 9.580 1.00 0.39 H new ATOM 0 HB3 GLU A 17 15.484 -1.523 10.410 1.00 0.39 H new ATOM 0 HG2 GLU A 17 16.162 -3.900 9.553 1.00 0.86 H new ATOM 0 HG3 GLU A 17 17.715 -3.187 9.164 1.00 0.86 H new ATOM 297 N ASP A 18 16.033 -3.850 7.230 1.00 0.35 N ATOM 298 CA ASP A 18 16.763 -4.678 6.244 1.00 0.38 C ATOM 299 C ASP A 18 16.588 -4.160 4.829 1.00 0.35 C ATOM 300 O ASP A 18 17.524 -4.192 4.056 1.00 0.34 O ATOM 301 CB ASP A 18 16.239 -6.108 6.305 1.00 0.46 C ATOM 302 CG ASP A 18 17.378 -7.055 6.687 1.00 0.66 C ATOM 303 OD1 ASP A 18 18.330 -7.138 5.930 1.00 1.27 O ATOM 304 OD2 ASP A 18 17.276 -7.681 7.729 1.00 1.38 O ATOM 0 H ASP A 18 15.458 -4.371 7.892 1.00 0.35 H new ATOM 0 HA ASP A 18 17.823 -4.636 6.496 1.00 0.38 H new ATOM 0 HB2 ASP A 18 15.432 -6.180 7.035 1.00 0.46 H new ATOM 0 HB3 ASP A 18 15.822 -6.395 5.340 1.00 0.46 H new ATOM 309 N HIS A 19 15.430 -3.677 4.447 1.00 0.34 N ATOM 310 CA HIS A 19 15.281 -3.172 3.058 1.00 0.33 C ATOM 311 C HIS A 19 15.543 -1.673 3.054 1.00 0.28 C ATOM 312 O HIS A 19 15.890 -1.100 2.043 1.00 0.27 O ATOM 313 CB HIS A 19 13.860 -3.448 2.564 1.00 0.36 C ATOM 314 CG HIS A 19 13.869 -4.662 1.676 1.00 0.53 C ATOM 315 ND1 HIS A 19 14.106 -5.939 2.170 1.00 1.22 N ATOM 316 CD2 HIS A 19 13.680 -4.813 0.324 1.00 1.43 C ATOM 317 CE1 HIS A 19 14.055 -6.792 1.130 1.00 1.27 C ATOM 318 NE2 HIS A 19 13.798 -6.155 -0.014 1.00 1.40 N ATOM 0 H HIS A 19 14.597 -3.613 5.031 1.00 0.34 H new ATOM 0 HA HIS A 19 15.990 -3.674 2.400 1.00 0.33 H new ATOM 0 HB2 HIS A 19 13.193 -3.608 3.411 1.00 0.36 H new ATOM 0 HB3 HIS A 19 13.479 -2.586 2.017 1.00 0.36 H new ATOM 0 HD2 HIS A 19 13.472 -4.012 -0.369 1.00 1.43 H new ATOM 0 HE1 HIS A 19 14.204 -7.859 1.211 1.00 1.27 H new ATOM 0 HE2 HIS A 19 13.707 -6.567 -0.942 1.00 1.40 H new ATOM 327 N VAL A 20 15.451 -1.033 4.191 1.00 0.26 N ATOM 328 CA VAL A 20 15.775 0.414 4.221 1.00 0.24 C ATOM 329 C VAL A 20 17.292 0.468 4.080 1.00 0.23 C ATOM 330 O VAL A 20 17.858 1.340 3.451 1.00 0.22 O ATOM 331 CB VAL A 20 15.281 1.039 5.542 1.00 0.25 C ATOM 332 CG1 VAL A 20 16.440 1.249 6.520 1.00 0.29 C ATOM 333 CG2 VAL A 20 14.621 2.389 5.255 1.00 0.29 C ATOM 0 H VAL A 20 15.171 -1.444 5.081 1.00 0.26 H new ATOM 0 HA VAL A 20 15.289 0.984 3.429 1.00 0.24 H new ATOM 0 HB VAL A 20 14.562 0.355 5.993 1.00 0.25 H new ATOM 0 HG11 VAL A 20 16.062 1.691 7.442 1.00 0.29 H new ATOM 0 HG12 VAL A 20 16.907 0.290 6.742 1.00 0.29 H new ATOM 0 HG13 VAL A 20 17.177 1.916 6.073 1.00 0.29 H new ATOM 0 HG21 VAL A 20 14.272 2.829 6.189 1.00 0.29 H new ATOM 0 HG22 VAL A 20 15.345 3.056 4.787 1.00 0.29 H new ATOM 0 HG23 VAL A 20 13.774 2.245 4.584 1.00 0.29 H new ATOM 343 N LEU A 21 17.935 -0.513 4.652 1.00 0.25 N ATOM 344 CA LEU A 21 19.414 -0.624 4.566 1.00 0.27 C ATOM 345 C LEU A 21 19.793 -0.965 3.126 1.00 0.27 C ATOM 346 O LEU A 21 20.564 -0.276 2.485 1.00 0.28 O ATOM 347 CB LEU A 21 19.881 -1.764 5.474 1.00 0.32 C ATOM 348 CG LEU A 21 19.782 -1.345 6.949 1.00 0.34 C ATOM 349 CD1 LEU A 21 20.078 -2.548 7.847 1.00 0.41 C ATOM 350 CD2 LEU A 21 20.788 -0.224 7.247 1.00 0.34 C ATOM 0 H LEU A 21 17.485 -1.257 5.186 1.00 0.25 H new ATOM 0 HA LEU A 21 19.878 0.314 4.872 1.00 0.27 H new ATOM 0 HB2 LEU A 21 19.271 -2.651 5.299 1.00 0.32 H new ATOM 0 HB3 LEU A 21 20.910 -2.032 5.233 1.00 0.32 H new ATOM 0 HG LEU A 21 18.773 -0.982 7.147 1.00 0.34 H new ATOM 0 HD11 LEU A 21 20.007 -2.248 8.892 1.00 0.41 H new ATOM 0 HD12 LEU A 21 19.355 -3.338 7.647 1.00 0.41 H new ATOM 0 HD13 LEU A 21 21.083 -2.916 7.643 1.00 0.41 H new ATOM 0 HD21 LEU A 21 20.710 0.066 8.295 1.00 0.34 H new ATOM 0 HD22 LEU A 21 21.798 -0.578 7.043 1.00 0.34 H new ATOM 0 HD23 LEU A 21 20.571 0.637 6.615 1.00 0.34 H new ATOM 362 N ASP A 22 19.247 -2.030 2.610 1.00 0.28 N ATOM 363 CA ASP A 22 19.567 -2.427 1.213 1.00 0.31 C ATOM 364 C ASP A 22 19.101 -1.334 0.247 1.00 0.29 C ATOM 365 O ASP A 22 19.678 -1.132 -0.803 1.00 0.31 O ATOM 366 CB ASP A 22 18.852 -3.738 0.880 1.00 0.36 C ATOM 367 CG ASP A 22 19.567 -4.429 -0.282 1.00 0.44 C ATOM 368 OD1 ASP A 22 20.576 -5.069 -0.036 1.00 1.01 O ATOM 369 OD2 ASP A 22 19.094 -4.306 -1.400 1.00 1.22 O ATOM 0 H ASP A 22 18.592 -2.643 3.097 1.00 0.28 H new ATOM 0 HA ASP A 22 20.644 -2.562 1.114 1.00 0.31 H new ATOM 0 HB2 ASP A 22 18.841 -4.390 1.753 1.00 0.36 H new ATOM 0 HB3 ASP A 22 17.813 -3.541 0.616 1.00 0.36 H new ATOM 374 N VAL A 23 18.064 -0.622 0.597 1.00 0.27 N ATOM 375 CA VAL A 23 17.570 0.459 -0.302 1.00 0.27 C ATOM 376 C VAL A 23 18.578 1.607 -0.298 1.00 0.26 C ATOM 377 O VAL A 23 19.061 2.022 -1.332 1.00 0.26 O ATOM 378 CB VAL A 23 16.214 0.970 0.182 1.00 0.28 C ATOM 379 CG1 VAL A 23 15.926 2.308 -0.492 1.00 0.31 C ATOM 380 CG2 VAL A 23 15.121 -0.032 -0.203 1.00 0.32 C ATOM 0 H VAL A 23 17.539 -0.742 1.464 1.00 0.27 H new ATOM 0 HA VAL A 23 17.456 0.064 -1.312 1.00 0.27 H new ATOM 0 HB VAL A 23 16.230 1.090 1.265 1.00 0.28 H new ATOM 0 HG11 VAL A 23 14.960 2.685 -0.155 1.00 0.31 H new ATOM 0 HG12 VAL A 23 16.706 3.023 -0.230 1.00 0.31 H new ATOM 0 HG13 VAL A 23 15.906 2.174 -1.574 1.00 0.31 H new ATOM 0 HG21 VAL A 23 14.154 0.334 0.143 1.00 0.32 H new ATOM 0 HG22 VAL A 23 15.099 -0.148 -1.287 1.00 0.32 H new ATOM 0 HG23 VAL A 23 15.331 -0.996 0.261 1.00 0.32 H new ATOM 390 N ILE A 24 18.908 2.121 0.856 1.00 0.25 N ATOM 391 CA ILE A 24 19.892 3.234 0.910 1.00 0.26 C ATOM 392 C ILE A 24 21.226 2.741 0.350 1.00 0.26 C ATOM 393 O ILE A 24 22.097 3.521 0.020 1.00 0.28 O ATOM 394 CB ILE A 24 20.058 3.714 2.359 1.00 0.30 C ATOM 395 CG1 ILE A 24 20.325 5.220 2.363 1.00 0.57 C ATOM 396 CG2 ILE A 24 21.230 2.994 3.035 1.00 0.45 C ATOM 397 CD1 ILE A 24 20.608 5.684 3.793 1.00 0.58 C ATOM 0 H ILE A 24 18.540 1.819 1.758 1.00 0.25 H new ATOM 0 HA ILE A 24 19.539 4.074 0.311 1.00 0.26 H new ATOM 0 HB ILE A 24 19.144 3.492 2.909 1.00 0.30 H new ATOM 0 HG12 ILE A 24 21.174 5.451 1.720 1.00 0.57 H new ATOM 0 HG13 ILE A 24 19.464 5.754 1.960 1.00 0.57 H new ATOM 0 HG21 ILE A 24 21.331 3.348 4.061 1.00 0.45 H new ATOM 0 HG22 ILE A 24 21.044 1.920 3.038 1.00 0.45 H new ATOM 0 HG23 ILE A 24 22.149 3.201 2.487 1.00 0.45 H new ATOM 0 HD11 ILE A 24 20.798 6.757 3.796 1.00 0.58 H new ATOM 0 HD12 ILE A 24 19.746 5.466 4.423 1.00 0.58 H new ATOM 0 HD13 ILE A 24 21.482 5.159 4.180 1.00 0.58 H new ATOM 409 N VAL A 25 21.388 1.450 0.224 1.00 0.26 N ATOM 410 CA VAL A 25 22.661 0.915 -0.333 1.00 0.29 C ATOM 411 C VAL A 25 22.621 0.992 -1.863 1.00 0.29 C ATOM 412 O VAL A 25 23.562 1.426 -2.494 1.00 0.31 O ATOM 413 CB VAL A 25 22.838 -0.542 0.094 1.00 0.31 C ATOM 414 CG1 VAL A 25 24.002 -1.163 -0.680 1.00 0.41 C ATOM 415 CG2 VAL A 25 23.131 -0.604 1.593 1.00 0.36 C ATOM 0 H VAL A 25 20.696 0.747 0.482 1.00 0.26 H new ATOM 0 HA VAL A 25 23.495 1.508 0.043 1.00 0.29 H new ATOM 0 HB VAL A 25 21.924 -1.096 -0.119 1.00 0.31 H new ATOM 0 HG11 VAL A 25 24.128 -2.202 -0.376 1.00 0.41 H new ATOM 0 HG12 VAL A 25 23.792 -1.121 -1.749 1.00 0.41 H new ATOM 0 HG13 VAL A 25 24.917 -0.609 -0.468 1.00 0.41 H new ATOM 0 HG21 VAL A 25 23.257 -1.643 1.896 1.00 0.36 H new ATOM 0 HG22 VAL A 25 24.045 -0.050 1.808 1.00 0.36 H new ATOM 0 HG23 VAL A 25 22.301 -0.163 2.145 1.00 0.36 H new ATOM 425 N LEU A 26 21.551 0.559 -2.472 1.00 0.29 N ATOM 426 CA LEU A 26 21.470 0.600 -3.960 1.00 0.32 C ATOM 427 C LEU A 26 21.459 2.057 -4.446 1.00 0.32 C ATOM 428 O LEU A 26 22.027 2.385 -5.471 1.00 0.35 O ATOM 429 CB LEU A 26 20.188 -0.106 -4.400 1.00 0.36 C ATOM 430 CG LEU A 26 20.502 -1.557 -4.775 1.00 0.65 C ATOM 431 CD1 LEU A 26 19.224 -2.390 -4.695 1.00 0.49 C ATOM 432 CD2 LEU A 26 21.056 -1.619 -6.202 1.00 1.19 C ATOM 0 H LEU A 26 20.729 0.178 -2.003 1.00 0.29 H new ATOM 0 HA LEU A 26 22.336 0.098 -4.391 1.00 0.32 H new ATOM 0 HB2 LEU A 26 19.452 -0.079 -3.596 1.00 0.36 H new ATOM 0 HB3 LEU A 26 19.749 0.413 -5.252 1.00 0.36 H new ATOM 0 HG LEU A 26 21.245 -1.952 -4.082 1.00 0.65 H new ATOM 0 HD11 LEU A 26 19.446 -3.423 -4.962 1.00 0.49 H new ATOM 0 HD12 LEU A 26 18.829 -2.354 -3.680 1.00 0.49 H new ATOM 0 HD13 LEU A 26 18.484 -1.988 -5.387 1.00 0.49 H new ATOM 0 HD21 LEU A 26 21.277 -2.654 -6.462 1.00 1.19 H new ATOM 0 HD22 LEU A 26 20.317 -1.220 -6.897 1.00 1.19 H new ATOM 0 HD23 LEU A 26 21.969 -1.027 -6.264 1.00 1.19 H new ATOM 444 N PHE A 27 20.844 2.936 -3.707 1.00 0.31 N ATOM 445 CA PHE A 27 20.837 4.368 -4.117 1.00 0.33 C ATOM 446 C PHE A 27 22.288 4.837 -4.116 1.00 0.34 C ATOM 447 O PHE A 27 22.669 5.771 -4.792 1.00 0.37 O ATOM 448 CB PHE A 27 20.028 5.188 -3.112 1.00 0.35 C ATOM 449 CG PHE A 27 20.561 6.599 -3.068 1.00 0.44 C ATOM 450 CD1 PHE A 27 20.289 7.483 -4.120 1.00 1.19 C ATOM 451 CD2 PHE A 27 21.326 7.026 -1.976 1.00 1.38 C ATOM 452 CE1 PHE A 27 20.783 8.792 -4.079 1.00 1.22 C ATOM 453 CE2 PHE A 27 21.819 8.336 -1.936 1.00 1.46 C ATOM 454 CZ PHE A 27 21.548 9.219 -2.987 1.00 0.71 C ATOM 0 H PHE A 27 20.348 2.727 -2.841 1.00 0.31 H new ATOM 0 HA PHE A 27 20.386 4.492 -5.102 1.00 0.33 H new ATOM 0 HB2 PHE A 27 18.975 5.194 -3.395 1.00 0.35 H new ATOM 0 HB3 PHE A 27 20.089 4.734 -2.123 1.00 0.35 H new ATOM 0 HD1 PHE A 27 19.698 7.155 -4.962 1.00 1.19 H new ATOM 0 HD2 PHE A 27 21.536 6.345 -1.164 1.00 1.38 H new ATOM 0 HE1 PHE A 27 20.574 9.473 -4.891 1.00 1.22 H new ATOM 0 HE2 PHE A 27 22.409 8.665 -1.093 1.00 1.46 H new ATOM 0 HZ PHE A 27 21.929 10.229 -2.956 1.00 0.71 H new ATOM 464 N ASN A 28 23.091 4.159 -3.352 1.00 0.33 N ATOM 465 CA ASN A 28 24.535 4.503 -3.272 1.00 0.36 C ATOM 466 C ASN A 28 25.177 4.295 -4.644 1.00 0.38 C ATOM 467 O ASN A 28 26.131 4.962 -4.997 1.00 0.41 O ATOM 468 CB ASN A 28 25.221 3.611 -2.244 1.00 0.35 C ATOM 469 CG ASN A 28 26.340 4.393 -1.551 1.00 0.39 C ATOM 470 OD1 ASN A 28 26.157 4.901 -0.462 1.00 1.15 O ATOM 471 ND2 ASN A 28 27.498 4.512 -2.139 1.00 0.98 N ATOM 0 H ASN A 28 22.806 3.370 -2.771 1.00 0.33 H new ATOM 0 HA ASN A 28 24.646 5.544 -2.970 1.00 0.36 H new ATOM 0 HB2 ASN A 28 24.496 3.264 -1.508 1.00 0.35 H new ATOM 0 HB3 ASN A 28 25.630 2.726 -2.731 1.00 0.35 H new ATOM 0 HD21 ASN A 28 28.250 5.031 -1.685 1.00 0.98 H new ATOM 0 HD22 ASN A 28 27.652 4.086 -3.053 1.00 0.98 H new ATOM 478 N GLN A 29 24.669 3.378 -5.429 1.00 0.38 N ATOM 479 CA GLN A 29 25.262 3.144 -6.775 1.00 0.40 C ATOM 480 C GLN A 29 24.612 4.095 -7.781 1.00 0.43 C ATOM 481 O GLN A 29 25.108 4.293 -8.873 1.00 0.51 O ATOM 482 CB GLN A 29 25.011 1.692 -7.195 1.00 0.40 C ATOM 483 CG GLN A 29 25.463 0.753 -6.075 1.00 0.38 C ATOM 484 CD GLN A 29 25.190 -0.698 -6.477 1.00 0.40 C ATOM 485 OE1 GLN A 29 25.985 -1.576 -6.205 1.00 1.17 O ATOM 486 NE2 GLN A 29 24.091 -0.989 -7.118 1.00 1.10 N ATOM 0 H GLN A 29 23.873 2.785 -5.195 1.00 0.38 H new ATOM 0 HA GLN A 29 26.336 3.328 -6.744 1.00 0.40 H new ATOM 0 HB2 GLN A 29 23.952 1.541 -7.406 1.00 0.40 H new ATOM 0 HB3 GLN A 29 25.554 1.468 -8.113 1.00 0.40 H new ATOM 0 HG2 GLN A 29 26.526 0.892 -5.878 1.00 0.38 H new ATOM 0 HG3 GLN A 29 24.934 0.991 -5.152 1.00 0.38 H new ATOM 0 HE21 GLN A 29 23.424 -0.252 -7.346 1.00 1.10 H new ATOM 0 HE22 GLN A 29 23.900 -1.953 -7.390 1.00 1.10 H new ATOM 495 N GLY A 30 23.517 4.700 -7.398 1.00 0.39 N ATOM 496 CA GLY A 30 22.825 5.670 -8.302 1.00 0.42 C ATOM 497 C GLY A 30 21.374 5.248 -8.524 1.00 0.37 C ATOM 498 O GLY A 30 20.693 5.785 -9.374 1.00 0.39 O ATOM 0 H GLY A 30 23.069 4.563 -6.492 1.00 0.39 H new ATOM 0 HA2 GLY A 30 22.858 6.669 -7.867 1.00 0.42 H new ATOM 0 HA3 GLY A 30 23.346 5.721 -9.258 1.00 0.42 H new ATOM 502 N ILE A 31 20.885 4.304 -7.770 1.00 0.33 N ATOM 503 CA ILE A 31 19.477 3.874 -7.961 1.00 0.31 C ATOM 504 C ILE A 31 18.549 4.929 -7.378 1.00 0.28 C ATOM 505 O ILE A 31 18.299 4.967 -6.190 1.00 0.30 O ATOM 506 CB ILE A 31 19.254 2.532 -7.271 1.00 0.30 C ATOM 507 CG1 ILE A 31 20.073 1.455 -8.004 1.00 0.35 C ATOM 508 CG2 ILE A 31 17.762 2.178 -7.276 1.00 0.31 C ATOM 509 CD1 ILE A 31 19.653 1.328 -9.478 1.00 0.35 C ATOM 0 H ILE A 31 21.397 3.816 -7.035 1.00 0.33 H new ATOM 0 HA ILE A 31 19.265 3.760 -9.024 1.00 0.31 H new ATOM 0 HB ILE A 31 19.582 2.589 -6.233 1.00 0.30 H new ATOM 0 HG12 ILE A 31 21.133 1.702 -7.947 1.00 0.35 H new ATOM 0 HG13 ILE A 31 19.942 0.495 -7.504 1.00 0.35 H new ATOM 0 HG21 ILE A 31 17.614 1.218 -6.781 1.00 0.31 H new ATOM 0 HG22 ILE A 31 17.203 2.949 -6.746 1.00 0.31 H new ATOM 0 HG23 ILE A 31 17.407 2.114 -8.304 1.00 0.31 H new ATOM 0 HD11 ILE A 31 20.253 0.558 -9.962 1.00 0.35 H new ATOM 0 HD12 ILE A 31 18.599 1.055 -9.534 1.00 0.35 H new ATOM 0 HD13 ILE A 31 19.808 2.281 -9.984 1.00 0.35 H new ATOM 521 N ASP A 32 18.018 5.779 -8.215 1.00 0.26 N ATOM 522 CA ASP A 32 17.089 6.815 -7.723 1.00 0.27 C ATOM 523 C ASP A 32 15.688 6.226 -7.677 1.00 0.28 C ATOM 524 O ASP A 32 14.892 6.572 -6.825 1.00 0.45 O ATOM 525 CB ASP A 32 17.115 8.020 -8.666 1.00 0.30 C ATOM 526 CG ASP A 32 18.420 8.792 -8.469 1.00 0.72 C ATOM 527 OD1 ASP A 32 19.210 8.378 -7.636 1.00 1.55 O ATOM 528 OD2 ASP A 32 18.609 9.785 -9.152 1.00 1.22 O ATOM 0 H ASP A 32 18.193 5.794 -9.220 1.00 0.26 H new ATOM 0 HA ASP A 32 17.387 7.142 -6.727 1.00 0.27 H new ATOM 0 HB2 ASP A 32 17.029 7.688 -9.701 1.00 0.30 H new ATOM 0 HB3 ASP A 32 16.262 8.669 -8.468 1.00 0.30 H new ATOM 533 N GLU A 33 15.375 5.352 -8.609 1.00 0.26 N ATOM 534 CA GLU A 33 14.025 4.747 -8.645 1.00 0.27 C ATOM 535 C GLU A 33 14.068 3.327 -8.092 1.00 0.23 C ATOM 536 O GLU A 33 14.998 2.580 -8.328 1.00 0.23 O ATOM 537 CB GLU A 33 13.492 4.702 -10.077 1.00 0.29 C ATOM 538 CG GLU A 33 13.717 6.051 -10.764 1.00 0.48 C ATOM 539 CD GLU A 33 12.380 6.598 -11.268 1.00 0.71 C ATOM 540 OE1 GLU A 33 11.613 5.821 -11.813 1.00 1.15 O ATOM 541 OE2 GLU A 33 12.148 7.785 -11.104 1.00 1.58 O ATOM 0 H GLU A 33 16.008 5.038 -9.345 1.00 0.26 H new ATOM 0 HA GLU A 33 13.366 5.362 -8.033 1.00 0.27 H new ATOM 0 HB2 GLU A 33 13.994 3.912 -10.636 1.00 0.29 H new ATOM 0 HB3 GLU A 33 12.429 4.461 -10.070 1.00 0.29 H new ATOM 0 HG2 GLU A 33 14.170 6.755 -10.066 1.00 0.48 H new ATOM 0 HG3 GLU A 33 14.411 5.936 -11.596 1.00 0.48 H new ATOM 548 N VAL A 34 13.063 2.949 -7.363 1.00 0.21 N ATOM 549 CA VAL A 34 13.045 1.573 -6.803 1.00 0.20 C ATOM 550 C VAL A 34 11.604 1.108 -6.617 1.00 0.19 C ATOM 551 O VAL A 34 10.728 1.891 -6.296 1.00 0.20 O ATOM 552 CB VAL A 34 13.810 1.549 -5.471 1.00 0.21 C ATOM 553 CG1 VAL A 34 12.841 1.559 -4.284 1.00 0.54 C ATOM 554 CG2 VAL A 34 14.666 0.282 -5.406 1.00 0.43 C ATOM 0 H VAL A 34 12.256 3.528 -7.130 1.00 0.21 H new ATOM 0 HA VAL A 34 13.536 0.888 -7.495 1.00 0.20 H new ATOM 0 HB VAL A 34 14.439 2.437 -5.416 1.00 0.21 H new ATOM 0 HG11 VAL A 34 13.407 1.542 -3.352 1.00 0.54 H new ATOM 0 HG12 VAL A 34 12.230 2.461 -4.321 1.00 0.54 H new ATOM 0 HG13 VAL A 34 12.196 0.682 -4.333 1.00 0.54 H new ATOM 0 HG21 VAL A 34 15.211 0.259 -4.463 1.00 0.43 H new ATOM 0 HG22 VAL A 34 14.023 -0.595 -5.474 1.00 0.43 H new ATOM 0 HG23 VAL A 34 15.374 0.278 -6.235 1.00 0.43 H new ATOM 564 N ILE A 35 11.369 -0.161 -6.843 1.00 0.19 N ATOM 565 CA ILE A 35 9.991 -0.725 -6.712 1.00 0.19 C ATOM 566 C ILE A 35 9.985 -1.848 -5.683 1.00 0.19 C ATOM 567 O ILE A 35 10.776 -2.768 -5.746 1.00 0.20 O ATOM 568 CB ILE A 35 9.544 -1.264 -8.066 1.00 0.19 C ATOM 569 CG1 ILE A 35 10.118 -0.351 -9.153 1.00 0.22 C ATOM 570 CG2 ILE A 35 8.013 -1.280 -8.136 1.00 0.19 C ATOM 571 CD1 ILE A 35 9.214 -0.372 -10.391 1.00 0.25 C ATOM 0 H ILE A 35 12.082 -0.837 -7.116 1.00 0.19 H new ATOM 0 HA ILE A 35 9.306 0.057 -6.383 1.00 0.19 H new ATOM 0 HB ILE A 35 9.903 -2.283 -8.210 1.00 0.19 H new ATOM 0 HG12 ILE A 35 10.206 0.667 -8.774 1.00 0.22 H new ATOM 0 HG13 ILE A 35 11.122 -0.679 -9.421 1.00 0.22 H new ATOM 0 HG21 ILE A 35 7.697 -1.666 -9.105 1.00 0.19 H new ATOM 0 HG22 ILE A 35 7.619 -1.919 -7.345 1.00 0.19 H new ATOM 0 HG23 ILE A 35 7.632 -0.267 -8.007 1.00 0.19 H new ATOM 0 HD11 ILE A 35 9.632 0.281 -11.158 1.00 0.25 H new ATOM 0 HD12 ILE A 35 9.149 -1.389 -10.777 1.00 0.25 H new ATOM 0 HD13 ILE A 35 8.218 -0.022 -10.120 1.00 0.25 H new ATOM 583 N LEU A 36 9.084 -1.773 -4.737 1.00 0.21 N ATOM 584 CA LEU A 36 8.998 -2.829 -3.689 1.00 0.23 C ATOM 585 C LEU A 36 7.708 -3.629 -3.850 1.00 0.23 C ATOM 586 O LEU A 36 6.619 -3.089 -3.791 1.00 0.24 O ATOM 587 CB LEU A 36 9.018 -2.195 -2.305 1.00 0.24 C ATOM 588 CG LEU A 36 10.388 -2.425 -1.653 1.00 0.30 C ATOM 589 CD1 LEU A 36 11.501 -1.830 -2.522 1.00 0.40 C ATOM 590 CD2 LEU A 36 10.422 -1.755 -0.280 1.00 0.30 C ATOM 0 H LEU A 36 8.401 -1.021 -4.647 1.00 0.21 H new ATOM 0 HA LEU A 36 9.855 -3.494 -3.800 1.00 0.23 H new ATOM 0 HB2 LEU A 36 8.815 -1.127 -2.380 1.00 0.24 H new ATOM 0 HB3 LEU A 36 8.232 -2.626 -1.685 1.00 0.24 H new ATOM 0 HG LEU A 36 10.546 -3.499 -1.550 1.00 0.30 H new ATOM 0 HD11 LEU A 36 12.466 -2.002 -2.045 1.00 0.40 H new ATOM 0 HD12 LEU A 36 11.491 -2.306 -3.503 1.00 0.40 H new ATOM 0 HD13 LEU A 36 11.339 -0.758 -2.637 1.00 0.40 H new ATOM 0 HD21 LEU A 36 11.396 -1.920 0.181 1.00 0.30 H new ATOM 0 HD22 LEU A 36 10.250 -0.685 -0.393 1.00 0.30 H new ATOM 0 HD23 LEU A 36 9.644 -2.182 0.353 1.00 0.30 H new ATOM 602 N LYS A 37 7.834 -4.917 -3.992 1.00 0.23 N ATOM 603 CA LYS A 37 6.623 -5.783 -4.086 1.00 0.23 C ATOM 604 C LYS A 37 6.447 -6.465 -2.729 1.00 0.18 C ATOM 605 O LYS A 37 7.379 -7.035 -2.201 1.00 0.19 O ATOM 606 CB LYS A 37 6.788 -6.845 -5.171 1.00 0.31 C ATOM 607 CG LYS A 37 7.720 -6.337 -6.277 1.00 1.23 C ATOM 608 CD LYS A 37 7.854 -7.409 -7.362 1.00 1.52 C ATOM 609 CE LYS A 37 6.919 -7.081 -8.526 1.00 2.39 C ATOM 610 NZ LYS A 37 6.709 -8.304 -9.353 1.00 2.74 N ATOM 0 H LYS A 37 8.725 -5.411 -4.047 1.00 0.23 H new ATOM 0 HA LYS A 37 5.754 -5.178 -4.345 1.00 0.23 H new ATOM 0 HB2 LYS A 37 7.193 -7.759 -4.736 1.00 0.31 H new ATOM 0 HB3 LYS A 37 5.815 -7.097 -5.593 1.00 0.31 H new ATOM 0 HG2 LYS A 37 7.325 -5.417 -6.707 1.00 1.23 H new ATOM 0 HG3 LYS A 37 8.700 -6.100 -5.862 1.00 1.23 H new ATOM 0 HD2 LYS A 37 8.885 -7.458 -7.713 1.00 1.52 H new ATOM 0 HD3 LYS A 37 7.610 -8.389 -6.951 1.00 1.52 H new ATOM 0 HE2 LYS A 37 5.964 -6.716 -8.148 1.00 2.39 H new ATOM 0 HE3 LYS A 37 7.346 -6.285 -9.136 1.00 2.39 H new ATOM 0 HZ1 LYS A 37 6.073 -8.082 -10.145 1.00 2.74 H new ATOM 0 HZ2 LYS A 37 7.623 -8.633 -9.724 1.00 2.74 H new ATOM 0 HZ3 LYS A 37 6.284 -9.051 -8.767 1.00 2.74 H new ATOM 624 N GLY A 38 5.278 -6.394 -2.153 1.00 0.18 N ATOM 625 CA GLY A 38 5.076 -7.030 -0.808 1.00 0.21 C ATOM 626 C GLY A 38 3.717 -7.727 -0.729 1.00 0.18 C ATOM 627 O GLY A 38 2.803 -7.402 -1.453 1.00 0.19 O ATOM 0 H GLY A 38 4.459 -5.930 -2.545 1.00 0.18 H new ATOM 0 HA2 GLY A 38 5.870 -7.752 -0.621 1.00 0.21 H new ATOM 0 HA3 GLY A 38 5.145 -6.271 -0.029 1.00 0.21 H new ATOM 631 N THR A 39 3.608 -8.726 0.121 1.00 0.20 N ATOM 632 CA THR A 39 2.329 -9.497 0.218 1.00 0.25 C ATOM 633 C THR A 39 1.909 -9.766 1.669 1.00 0.23 C ATOM 634 O THR A 39 2.716 -10.038 2.525 1.00 0.22 O ATOM 635 CB THR A 39 2.521 -10.842 -0.488 1.00 0.28 C ATOM 636 OG1 THR A 39 3.398 -11.654 0.279 1.00 0.43 O ATOM 637 CG2 THR A 39 3.120 -10.612 -1.878 1.00 0.56 C ATOM 0 H THR A 39 4.349 -9.037 0.749 1.00 0.20 H new ATOM 0 HA THR A 39 1.545 -8.899 -0.248 1.00 0.25 H new ATOM 0 HB THR A 39 1.557 -11.341 -0.590 1.00 0.28 H new ATOM 0 HG1 THR A 39 4.004 -12.138 -0.320 1.00 0.43 H new ATOM 0 HG21 THR A 39 3.256 -11.571 -2.379 1.00 0.56 H new ATOM 0 HG22 THR A 39 2.447 -9.988 -2.466 1.00 0.56 H new ATOM 0 HG23 THR A 39 4.084 -10.114 -1.781 1.00 0.56 H new ATOM 645 N GLY A 40 0.626 -9.681 1.932 1.00 0.27 N ATOM 646 CA GLY A 40 0.087 -9.938 3.305 1.00 0.30 C ATOM 647 C GLY A 40 0.998 -9.361 4.384 1.00 0.29 C ATOM 648 O GLY A 40 0.763 -8.291 4.895 1.00 0.33 O ATOM 0 H GLY A 40 -0.083 -9.440 1.239 1.00 0.27 H new ATOM 0 HA2 GLY A 40 -0.907 -9.499 3.394 1.00 0.30 H new ATOM 0 HA3 GLY A 40 -0.024 -11.012 3.458 1.00 0.30 H new ATOM 652 N ARG A 41 2.009 -10.085 4.771 1.00 0.27 N ATOM 653 CA ARG A 41 2.909 -9.585 5.846 1.00 0.28 C ATOM 654 C ARG A 41 3.984 -8.673 5.250 1.00 0.24 C ATOM 655 O ARG A 41 4.196 -7.574 5.720 1.00 0.25 O ATOM 656 CB ARG A 41 3.556 -10.767 6.575 1.00 0.31 C ATOM 657 CG ARG A 41 2.902 -12.079 6.127 1.00 0.64 C ATOM 658 CD ARG A 41 3.339 -13.211 7.057 1.00 0.92 C ATOM 659 NE ARG A 41 3.542 -14.457 6.263 1.00 1.69 N ATOM 660 CZ ARG A 41 3.628 -15.610 6.870 1.00 2.12 C ATOM 661 NH1 ARG A 41 3.541 -15.670 8.170 1.00 2.03 N ATOM 662 NH2 ARG A 41 3.800 -16.702 6.176 1.00 3.09 N ATOM 0 H ARG A 41 2.251 -11.000 4.390 1.00 0.27 H new ATOM 0 HA ARG A 41 2.323 -9.009 6.562 1.00 0.28 H new ATOM 0 HB2 ARG A 41 4.625 -10.794 6.365 1.00 0.31 H new ATOM 0 HB3 ARG A 41 3.446 -10.645 7.653 1.00 0.31 H new ATOM 0 HG2 ARG A 41 1.817 -11.980 6.142 1.00 0.64 H new ATOM 0 HG3 ARG A 41 3.187 -12.307 5.100 1.00 0.64 H new ATOM 0 HD2 ARG A 41 4.262 -12.939 7.569 1.00 0.92 H new ATOM 0 HD3 ARG A 41 2.584 -13.376 7.826 1.00 0.92 H new ATOM 0 HE ARG A 41 3.614 -14.409 5.247 1.00 1.69 H new ATOM 0 HH11 ARG A 41 3.406 -14.817 8.712 1.00 2.03 H new ATOM 0 HH12 ARG A 41 3.608 -16.570 8.645 1.00 2.03 H new ATOM 0 HH21 ARG A 41 3.867 -16.655 5.159 1.00 3.09 H new ATOM 0 HH22 ARG A 41 3.867 -17.602 6.650 1.00 3.09 H new ATOM 676 N GLU A 42 4.679 -9.107 4.232 1.00 0.21 N ATOM 677 CA GLU A 42 5.739 -8.234 3.652 1.00 0.18 C ATOM 678 C GLU A 42 5.096 -6.936 3.168 1.00 0.17 C ATOM 679 O GLU A 42 5.739 -5.901 3.072 1.00 0.18 O ATOM 680 CB GLU A 42 6.419 -8.930 2.461 1.00 0.16 C ATOM 681 CG GLU A 42 5.916 -10.369 2.310 1.00 0.20 C ATOM 682 CD GLU A 42 6.705 -11.079 1.209 1.00 0.22 C ATOM 683 OE1 GLU A 42 6.919 -10.470 0.174 1.00 1.09 O ATOM 684 OE2 GLU A 42 7.082 -12.219 1.420 1.00 1.06 O ATOM 0 H GLU A 42 4.561 -10.015 3.783 1.00 0.21 H new ATOM 0 HA GLU A 42 6.489 -8.029 4.416 1.00 0.18 H new ATOM 0 HB2 GLU A 42 6.219 -8.372 1.546 1.00 0.16 H new ATOM 0 HB3 GLU A 42 7.500 -8.931 2.604 1.00 0.16 H new ATOM 0 HG2 GLU A 42 6.027 -10.904 3.253 1.00 0.20 H new ATOM 0 HG3 GLU A 42 4.853 -10.369 2.067 1.00 0.20 H new ATOM 691 N ILE A 43 3.830 -6.986 2.858 1.00 0.19 N ATOM 692 CA ILE A 43 3.120 -5.772 2.372 1.00 0.20 C ATOM 693 C ILE A 43 3.330 -4.578 3.328 1.00 0.22 C ATOM 694 O ILE A 43 3.433 -3.447 2.896 1.00 0.24 O ATOM 695 CB ILE A 43 1.624 -6.104 2.275 1.00 0.26 C ATOM 696 CG1 ILE A 43 0.956 -5.192 1.258 1.00 0.40 C ATOM 697 CG2 ILE A 43 0.963 -5.883 3.626 1.00 0.38 C ATOM 698 CD1 ILE A 43 -0.547 -5.473 1.228 1.00 0.87 C ATOM 0 H ILE A 43 3.253 -7.824 2.922 1.00 0.19 H new ATOM 0 HA ILE A 43 3.518 -5.487 1.398 1.00 0.20 H new ATOM 0 HB ILE A 43 1.516 -7.144 1.969 1.00 0.26 H new ATOM 0 HG12 ILE A 43 1.136 -4.148 1.516 1.00 0.40 H new ATOM 0 HG13 ILE A 43 1.387 -5.355 0.270 1.00 0.40 H new ATOM 0 HG21 ILE A 43 -0.099 -6.119 3.555 1.00 0.38 H new ATOM 0 HG22 ILE A 43 1.429 -6.529 4.369 1.00 0.38 H new ATOM 0 HG23 ILE A 43 1.084 -4.842 3.924 1.00 0.38 H new ATOM 0 HD11 ILE A 43 -1.025 -4.819 0.499 1.00 0.87 H new ATOM 0 HD12 ILE A 43 -0.717 -6.513 0.949 1.00 0.87 H new ATOM 0 HD13 ILE A 43 -0.972 -5.288 2.215 1.00 0.87 H new ATOM 710 N SER A 44 3.378 -4.809 4.616 1.00 0.24 N ATOM 711 CA SER A 44 3.561 -3.684 5.576 1.00 0.27 C ATOM 712 C SER A 44 5.045 -3.383 5.714 1.00 0.26 C ATOM 713 O SER A 44 5.441 -2.287 6.077 1.00 0.27 O ATOM 714 CB SER A 44 2.993 -4.084 6.936 1.00 0.31 C ATOM 715 OG SER A 44 2.449 -5.394 6.851 1.00 1.14 O ATOM 0 H SER A 44 3.298 -5.732 5.043 1.00 0.24 H new ATOM 0 HA SER A 44 3.041 -2.798 5.211 1.00 0.27 H new ATOM 0 HB2 SER A 44 3.776 -4.051 7.694 1.00 0.31 H new ATOM 0 HB3 SER A 44 2.222 -3.377 7.243 1.00 0.31 H new ATOM 0 HG SER A 44 2.085 -5.654 7.723 1.00 1.14 H new ATOM 721 N LYS A 45 5.875 -4.328 5.381 1.00 0.25 N ATOM 722 CA LYS A 45 7.321 -4.044 5.456 1.00 0.25 C ATOM 723 C LYS A 45 7.573 -2.914 4.471 1.00 0.23 C ATOM 724 O LYS A 45 7.842 -1.796 4.861 1.00 0.25 O ATOM 725 CB LYS A 45 8.153 -5.280 5.091 1.00 0.24 C ATOM 726 CG LYS A 45 8.018 -6.343 6.189 1.00 0.42 C ATOM 727 CD LYS A 45 9.045 -6.091 7.298 1.00 0.90 C ATOM 728 CE LYS A 45 8.854 -7.125 8.409 1.00 0.82 C ATOM 729 NZ LYS A 45 10.079 -7.965 8.526 1.00 1.86 N ATOM 0 H LYS A 45 5.618 -5.264 5.067 1.00 0.25 H new ATOM 0 HA LYS A 45 7.615 -3.768 6.469 1.00 0.25 H new ATOM 0 HB2 LYS A 45 7.818 -5.686 4.137 1.00 0.24 H new ATOM 0 HB3 LYS A 45 9.200 -5.002 4.969 1.00 0.24 H new ATOM 0 HG2 LYS A 45 7.011 -6.321 6.604 1.00 0.42 H new ATOM 0 HG3 LYS A 45 8.166 -7.336 5.764 1.00 0.42 H new ATOM 0 HD2 LYS A 45 10.056 -6.156 6.895 1.00 0.90 H new ATOM 0 HD3 LYS A 45 8.925 -5.084 7.698 1.00 0.90 H new ATOM 0 HE2 LYS A 45 8.653 -6.624 9.356 1.00 0.82 H new ATOM 0 HE3 LYS A 45 7.990 -7.753 8.191 1.00 0.82 H new ATOM 0 HZ1 LYS A 45 9.848 -8.950 8.287 1.00 1.86 H new ATOM 0 HZ2 LYS A 45 10.806 -7.611 7.872 1.00 1.86 H new ATOM 0 HZ3 LYS A 45 10.439 -7.920 9.501 1.00 1.86 H new ATOM 743 N ALA A 46 7.501 -3.214 3.200 1.00 0.22 N ATOM 744 CA ALA A 46 7.747 -2.173 2.147 1.00 0.23 C ATOM 745 C ALA A 46 7.276 -0.787 2.616 1.00 0.22 C ATOM 746 O ALA A 46 7.964 0.200 2.455 1.00 0.29 O ATOM 747 CB ALA A 46 6.992 -2.555 0.875 1.00 0.25 C ATOM 0 H ALA A 46 7.281 -4.142 2.840 1.00 0.22 H new ATOM 0 HA ALA A 46 8.819 -2.126 1.954 1.00 0.23 H new ATOM 0 HB1 ALA A 46 7.168 -1.801 0.107 1.00 0.25 H new ATOM 0 HB2 ALA A 46 7.344 -3.524 0.520 1.00 0.25 H new ATOM 0 HB3 ALA A 46 5.925 -2.613 1.089 1.00 0.25 H new ATOM 753 N VAL A 47 6.111 -0.705 3.188 1.00 0.17 N ATOM 754 CA VAL A 47 5.597 0.617 3.667 1.00 0.17 C ATOM 755 C VAL A 47 6.583 1.242 4.658 1.00 0.17 C ATOM 756 O VAL A 47 7.215 2.241 4.375 1.00 0.16 O ATOM 757 CB VAL A 47 4.245 0.421 4.372 1.00 0.18 C ATOM 758 CG1 VAL A 47 3.778 1.744 5.005 1.00 0.22 C ATOM 759 CG2 VAL A 47 3.201 -0.065 3.361 1.00 0.20 C ATOM 0 H VAL A 47 5.486 -1.495 3.348 1.00 0.17 H new ATOM 0 HA VAL A 47 5.479 1.276 2.807 1.00 0.17 H new ATOM 0 HB VAL A 47 4.362 -0.324 5.159 1.00 0.18 H new ATOM 0 HG11 VAL A 47 2.819 1.592 5.501 1.00 0.22 H new ATOM 0 HG12 VAL A 47 4.515 2.078 5.735 1.00 0.22 H new ATOM 0 HG13 VAL A 47 3.668 2.500 4.228 1.00 0.22 H new ATOM 0 HG21 VAL A 47 2.244 -0.203 3.864 1.00 0.20 H new ATOM 0 HG22 VAL A 47 3.091 0.674 2.568 1.00 0.20 H new ATOM 0 HG23 VAL A 47 3.525 -1.013 2.931 1.00 0.20 H new ATOM 769 N ASP A 48 6.692 0.674 5.826 1.00 0.20 N ATOM 770 CA ASP A 48 7.610 1.243 6.858 1.00 0.23 C ATOM 771 C ASP A 48 8.947 1.612 6.220 1.00 0.24 C ATOM 772 O ASP A 48 9.505 2.660 6.476 1.00 0.26 O ATOM 773 CB ASP A 48 7.846 0.203 7.954 1.00 0.26 C ATOM 774 CG ASP A 48 8.403 0.890 9.200 1.00 0.44 C ATOM 775 OD1 ASP A 48 9.513 1.394 9.128 1.00 1.11 O ATOM 776 OD2 ASP A 48 7.714 0.900 10.206 1.00 1.26 O ATOM 0 H ASP A 48 6.184 -0.163 6.114 1.00 0.20 H new ATOM 0 HA ASP A 48 7.157 2.137 7.286 1.00 0.23 H new ATOM 0 HB2 ASP A 48 6.912 -0.306 8.194 1.00 0.26 H new ATOM 0 HB3 ASP A 48 8.543 -0.558 7.603 1.00 0.26 H new ATOM 781 N VAL A 49 9.463 0.749 5.399 1.00 0.26 N ATOM 782 CA VAL A 49 10.768 1.034 4.745 1.00 0.30 C ATOM 783 C VAL A 49 10.762 2.464 4.188 1.00 0.29 C ATOM 784 O VAL A 49 11.615 3.265 4.511 1.00 0.29 O ATOM 785 CB VAL A 49 11.009 0.035 3.605 1.00 0.37 C ATOM 786 CG1 VAL A 49 12.388 0.279 2.990 1.00 1.06 C ATOM 787 CG2 VAL A 49 10.954 -1.396 4.151 1.00 0.95 C ATOM 0 H VAL A 49 9.038 -0.144 5.150 1.00 0.26 H new ATOM 0 HA VAL A 49 11.567 0.935 5.480 1.00 0.30 H new ATOM 0 HB VAL A 49 10.238 0.169 2.847 1.00 0.37 H new ATOM 0 HG11 VAL A 49 12.556 -0.432 2.181 1.00 1.06 H new ATOM 0 HG12 VAL A 49 12.437 1.295 2.597 1.00 1.06 H new ATOM 0 HG13 VAL A 49 13.155 0.148 3.753 1.00 1.06 H new ATOM 0 HG21 VAL A 49 11.126 -2.102 3.339 1.00 0.95 H new ATOM 0 HG22 VAL A 49 11.723 -1.525 4.912 1.00 0.95 H new ATOM 0 HG23 VAL A 49 9.974 -1.580 4.591 1.00 0.95 H new ATOM 797 N TYR A 50 9.831 2.781 3.325 1.00 0.31 N ATOM 798 CA TYR A 50 9.803 4.148 2.717 1.00 0.34 C ATOM 799 C TYR A 50 9.528 5.243 3.744 1.00 0.30 C ATOM 800 O TYR A 50 10.247 6.209 3.805 1.00 0.30 O ATOM 801 CB TYR A 50 8.736 4.213 1.631 1.00 0.40 C ATOM 802 CG TYR A 50 9.123 3.277 0.524 1.00 1.14 C ATOM 803 CD1 TYR A 50 10.274 3.529 -0.228 1.00 2.13 C ATOM 804 CD2 TYR A 50 8.343 2.153 0.259 1.00 1.88 C ATOM 805 CE1 TYR A 50 10.646 2.655 -1.250 1.00 2.97 C ATOM 806 CE2 TYR A 50 8.711 1.280 -0.760 1.00 2.70 C ATOM 807 CZ TYR A 50 9.865 1.529 -1.519 1.00 3.06 C ATOM 808 OH TYR A 50 10.234 0.671 -2.530 1.00 4.02 O ATOM 0 H TYR A 50 9.089 2.154 3.014 1.00 0.31 H new ATOM 0 HA TYR A 50 10.793 4.324 2.296 1.00 0.34 H new ATOM 0 HB2 TYR A 50 7.764 3.936 2.039 1.00 0.40 H new ATOM 0 HB3 TYR A 50 8.644 5.231 1.251 1.00 0.40 H new ATOM 0 HD1 TYR A 50 10.876 4.401 -0.018 1.00 2.13 H new ATOM 0 HD2 TYR A 50 7.455 1.960 0.843 1.00 1.88 H new ATOM 0 HE1 TYR A 50 11.535 2.849 -1.831 1.00 2.97 H new ATOM 0 HE2 TYR A 50 8.107 0.409 -0.967 1.00 2.70 H new ATOM 0 HH TYR A 50 9.598 0.747 -3.272 1.00 4.02 H new ATOM 818 N ASN A 51 8.504 5.128 4.542 1.00 0.30 N ATOM 819 CA ASN A 51 8.249 6.211 5.532 1.00 0.30 C ATOM 820 C ASN A 51 9.545 6.460 6.282 1.00 0.29 C ATOM 821 O ASN A 51 9.989 7.578 6.450 1.00 0.29 O ATOM 822 CB ASN A 51 7.158 5.784 6.511 1.00 0.32 C ATOM 823 CG ASN A 51 7.761 5.581 7.901 1.00 0.61 C ATOM 824 OD1 ASN A 51 7.757 6.484 8.714 1.00 1.34 O ATOM 825 ND2 ASN A 51 8.284 4.426 8.211 1.00 1.28 N ATOM 0 H ASN A 51 7.845 4.349 4.554 1.00 0.30 H new ATOM 0 HA ASN A 51 7.915 7.117 5.026 1.00 0.30 H new ATOM 0 HB2 ASN A 51 6.375 6.542 6.551 1.00 0.32 H new ATOM 0 HB3 ASN A 51 6.690 4.861 6.169 1.00 0.32 H new ATOM 0 HD21 ASN A 51 8.689 4.281 9.136 1.00 1.28 H new ATOM 0 HD22 ASN A 51 8.287 3.668 7.528 1.00 1.28 H new ATOM 832 N SER A 52 10.150 5.406 6.728 1.00 0.30 N ATOM 833 CA SER A 52 11.421 5.547 7.469 1.00 0.30 C ATOM 834 C SER A 52 12.502 6.098 6.532 1.00 0.29 C ATOM 835 O SER A 52 13.368 6.841 6.950 1.00 0.28 O ATOM 836 CB SER A 52 11.868 4.202 8.014 1.00 0.33 C ATOM 837 OG SER A 52 11.763 3.218 6.995 1.00 1.04 O ATOM 0 H SER A 52 9.818 4.449 6.611 1.00 0.30 H new ATOM 0 HA SER A 52 11.267 6.234 8.301 1.00 0.30 H new ATOM 0 HB2 SER A 52 12.897 4.265 8.368 1.00 0.33 H new ATOM 0 HB3 SER A 52 11.253 3.922 8.869 1.00 0.33 H new ATOM 0 HG SER A 52 10.950 2.689 7.134 1.00 1.04 H new ATOM 843 N LEU A 53 12.472 5.749 5.266 1.00 0.28 N ATOM 844 CA LEU A 53 13.504 6.263 4.321 1.00 0.28 C ATOM 845 C LEU A 53 13.077 7.639 3.827 1.00 0.26 C ATOM 846 O LEU A 53 13.880 8.472 3.465 1.00 0.26 O ATOM 847 CB LEU A 53 13.594 5.326 3.116 1.00 0.28 C ATOM 848 CG LEU A 53 14.848 5.645 2.309 1.00 0.29 C ATOM 849 CD1 LEU A 53 16.037 4.841 2.840 1.00 0.44 C ATOM 850 CD2 LEU A 53 14.593 5.265 0.856 1.00 0.40 C ATOM 0 H LEU A 53 11.775 5.130 4.851 1.00 0.28 H new ATOM 0 HA LEU A 53 14.468 6.320 4.826 1.00 0.28 H new ATOM 0 HB2 LEU A 53 13.619 4.289 3.451 1.00 0.28 H new ATOM 0 HB3 LEU A 53 12.709 5.437 2.490 1.00 0.28 H new ATOM 0 HG LEU A 53 15.078 6.707 2.393 1.00 0.29 H new ATOM 0 HD11 LEU A 53 16.926 5.078 2.256 1.00 0.44 H new ATOM 0 HD12 LEU A 53 16.211 5.096 3.885 1.00 0.44 H new ATOM 0 HD13 LEU A 53 15.822 3.776 2.758 1.00 0.44 H new ATOM 0 HD21 LEU A 53 15.479 5.486 0.261 1.00 0.40 H new ATOM 0 HD22 LEU A 53 14.369 4.200 0.792 1.00 0.40 H new ATOM 0 HD23 LEU A 53 13.748 5.837 0.473 1.00 0.40 H new ATOM 862 N LYS A 54 11.817 7.912 3.863 1.00 0.26 N ATOM 863 CA LYS A 54 11.353 9.245 3.448 1.00 0.27 C ATOM 864 C LYS A 54 11.613 10.131 4.641 1.00 0.29 C ATOM 865 O LYS A 54 12.223 11.180 4.564 1.00 0.28 O ATOM 866 CB LYS A 54 9.854 9.180 3.149 1.00 0.30 C ATOM 867 CG LYS A 54 9.392 10.490 2.511 1.00 0.55 C ATOM 868 CD LYS A 54 8.878 11.462 3.576 1.00 0.27 C ATOM 869 CE LYS A 54 8.240 12.673 2.888 1.00 0.36 C ATOM 870 NZ LYS A 54 6.776 12.684 3.162 1.00 1.00 N ATOM 0 H LYS A 54 11.086 7.267 4.163 1.00 0.26 H new ATOM 0 HA LYS A 54 11.855 9.613 2.553 1.00 0.27 H new ATOM 0 HB2 LYS A 54 9.644 8.346 2.480 1.00 0.30 H new ATOM 0 HB3 LYS A 54 9.299 8.998 4.069 1.00 0.30 H new ATOM 0 HG2 LYS A 54 10.219 10.945 1.965 1.00 0.55 H new ATOM 0 HG3 LYS A 54 8.604 10.288 1.786 1.00 0.55 H new ATOM 0 HD2 LYS A 54 8.148 10.966 4.216 1.00 0.27 H new ATOM 0 HD3 LYS A 54 9.698 11.784 4.218 1.00 0.27 H new ATOM 0 HE2 LYS A 54 8.696 13.594 3.252 1.00 0.36 H new ATOM 0 HE3 LYS A 54 8.420 12.631 1.814 1.00 0.36 H new ATOM 0 HZ1 LYS A 54 6.342 13.506 2.695 1.00 1.00 H new ATOM 0 HZ2 LYS A 54 6.347 11.811 2.794 1.00 1.00 H new ATOM 0 HZ3 LYS A 54 6.615 12.743 4.188 1.00 1.00 H new ATOM 884 N ASP A 55 11.183 9.650 5.762 1.00 0.34 N ATOM 885 CA ASP A 55 11.408 10.356 7.040 1.00 0.38 C ATOM 886 C ASP A 55 12.894 10.710 7.123 1.00 0.40 C ATOM 887 O ASP A 55 13.317 11.495 7.948 1.00 0.47 O ATOM 888 CB ASP A 55 11.034 9.407 8.184 1.00 0.43 C ATOM 889 CG ASP A 55 11.387 10.049 9.525 1.00 0.85 C ATOM 890 OD1 ASP A 55 11.587 11.252 9.549 1.00 1.48 O ATOM 891 OD2 ASP A 55 11.447 9.327 10.506 1.00 1.58 O ATOM 0 H ASP A 55 10.671 8.772 5.848 1.00 0.34 H new ATOM 0 HA ASP A 55 10.806 11.262 7.107 1.00 0.38 H new ATOM 0 HB2 ASP A 55 9.968 9.181 8.148 1.00 0.43 H new ATOM 0 HB3 ASP A 55 11.564 8.461 8.072 1.00 0.43 H new ATOM 896 N ARG A 56 13.687 10.130 6.257 1.00 0.36 N ATOM 897 CA ARG A 56 15.143 10.412 6.255 1.00 0.40 C ATOM 898 C ARG A 56 15.387 11.869 5.897 1.00 0.40 C ATOM 899 O ARG A 56 16.164 12.559 6.526 1.00 0.43 O ATOM 900 CB ARG A 56 15.785 9.558 5.179 1.00 0.44 C ATOM 901 CG ARG A 56 17.262 9.362 5.477 1.00 0.81 C ATOM 902 CD ARG A 56 17.440 8.034 6.207 1.00 0.67 C ATOM 903 NE ARG A 56 18.857 7.901 6.650 1.00 1.00 N ATOM 904 CZ ARG A 56 19.233 8.333 7.827 1.00 1.24 C ATOM 905 NH1 ARG A 56 18.368 8.870 8.646 1.00 1.52 N ATOM 906 NH2 ARG A 56 20.482 8.226 8.184 1.00 1.69 N ATOM 0 H ARG A 56 13.378 9.467 5.546 1.00 0.36 H new ATOM 0 HA ARG A 56 15.558 10.198 7.240 1.00 0.40 H new ATOM 0 HB2 ARG A 56 15.286 8.591 5.126 1.00 0.44 H new ATOM 0 HB3 ARG A 56 15.663 10.033 4.206 1.00 0.44 H new ATOM 0 HG2 ARG A 56 17.838 9.365 4.552 1.00 0.81 H new ATOM 0 HG3 ARG A 56 17.637 10.183 6.088 1.00 0.81 H new ATOM 0 HD2 ARG A 56 16.772 7.986 7.067 1.00 0.67 H new ATOM 0 HD3 ARG A 56 17.173 7.206 5.550 1.00 0.67 H new ATOM 0 HE ARG A 56 19.541 7.469 6.029 1.00 1.00 H new ATOM 0 HH11 ARG A 56 17.390 8.956 8.370 1.00 1.52 H new ATOM 0 HH12 ARG A 56 18.671 9.204 9.561 1.00 1.52 H new ATOM 0 HH21 ARG A 56 21.160 7.807 7.547 1.00 1.69 H new ATOM 0 HH22 ARG A 56 20.781 8.561 9.100 1.00 1.69 H new ATOM 920 N LEU A 57 14.739 12.335 4.872 1.00 0.38 N ATOM 921 CA LEU A 57 14.947 13.740 4.455 1.00 0.42 C ATOM 922 C LEU A 57 13.732 14.253 3.695 1.00 0.39 C ATOM 923 O LEU A 57 13.641 15.427 3.407 1.00 0.41 O ATOM 924 CB LEU A 57 16.181 13.819 3.548 1.00 0.51 C ATOM 925 CG LEU A 57 16.699 15.257 3.500 1.00 1.11 C ATOM 926 CD1 LEU A 57 17.873 15.410 4.468 1.00 1.63 C ATOM 927 CD2 LEU A 57 17.166 15.582 2.080 1.00 1.66 C ATOM 0 H LEU A 57 14.076 11.804 4.307 1.00 0.38 H new ATOM 0 HA LEU A 57 15.094 14.355 5.343 1.00 0.42 H new ATOM 0 HB2 LEU A 57 16.960 13.154 3.921 1.00 0.51 H new ATOM 0 HB3 LEU A 57 15.927 13.481 2.543 1.00 0.51 H new ATOM 0 HG LEU A 57 15.900 15.940 3.787 1.00 1.11 H new ATOM 0 HD11 LEU A 57 18.242 16.435 4.433 1.00 1.63 H new ATOM 0 HD12 LEU A 57 17.543 15.177 5.480 1.00 1.63 H new ATOM 0 HD13 LEU A 57 18.672 14.727 4.181 1.00 1.63 H new ATOM 0 HD21 LEU A 57 17.536 16.607 2.044 1.00 1.66 H new ATOM 0 HD22 LEU A 57 17.965 14.898 1.794 1.00 1.66 H new ATOM 0 HD23 LEU A 57 16.331 15.473 1.388 1.00 1.66 H new ATOM 939 N GLY A 58 12.782 13.405 3.385 1.00 0.39 N ATOM 940 CA GLY A 58 11.576 13.886 2.653 1.00 0.38 C ATOM 941 C GLY A 58 11.976 14.388 1.264 1.00 0.33 C ATOM 942 O GLY A 58 11.504 13.913 0.250 1.00 0.31 O ATOM 0 H GLY A 58 12.791 12.409 3.606 1.00 0.39 H new ATOM 0 HA2 GLY A 58 10.849 13.079 2.562 1.00 0.38 H new ATOM 0 HA3 GLY A 58 11.095 14.687 3.214 1.00 0.38 H new ATOM 946 N ASP A 59 12.825 15.367 1.229 1.00 0.37 N ATOM 947 CA ASP A 59 13.258 15.952 -0.068 1.00 0.38 C ATOM 948 C ASP A 59 14.178 14.984 -0.801 1.00 0.30 C ATOM 949 O ASP A 59 14.149 14.891 -2.007 1.00 0.32 O ATOM 950 CB ASP A 59 13.994 17.267 0.183 1.00 0.47 C ATOM 951 CG ASP A 59 13.351 18.378 -0.651 1.00 0.57 C ATOM 952 OD1 ASP A 59 13.670 18.471 -1.824 1.00 1.38 O ATOM 953 OD2 ASP A 59 12.550 19.116 -0.101 1.00 1.06 O ATOM 0 H ASP A 59 13.245 15.795 2.054 1.00 0.37 H new ATOM 0 HA ASP A 59 12.378 16.138 -0.683 1.00 0.38 H new ATOM 0 HB2 ASP A 59 13.954 17.523 1.242 1.00 0.47 H new ATOM 0 HB3 ASP A 59 15.047 17.163 -0.080 1.00 0.47 H new ATOM 958 N GLY A 60 14.998 14.264 -0.096 1.00 0.26 N ATOM 959 CA GLY A 60 15.914 13.318 -0.774 1.00 0.24 C ATOM 960 C GLY A 60 15.175 12.023 -1.066 1.00 0.23 C ATOM 961 O GLY A 60 15.778 10.995 -1.270 1.00 0.24 O ATOM 0 H GLY A 60 15.073 14.291 0.921 1.00 0.26 H new ATOM 0 HA2 GLY A 60 16.285 13.755 -1.701 1.00 0.24 H new ATOM 0 HA3 GLY A 60 16.782 13.121 -0.145 1.00 0.24 H new ATOM 965 N VAL A 61 13.872 12.059 -1.091 1.00 0.22 N ATOM 966 CA VAL A 61 13.089 10.829 -1.373 1.00 0.22 C ATOM 967 C VAL A 61 11.745 11.262 -1.952 1.00 0.22 C ATOM 968 O VAL A 61 11.121 12.181 -1.457 1.00 0.28 O ATOM 969 CB VAL A 61 12.849 10.045 -0.076 1.00 0.25 C ATOM 970 CG1 VAL A 61 11.547 9.239 -0.188 1.00 0.34 C ATOM 971 CG2 VAL A 61 14.016 9.086 0.189 1.00 0.38 C ATOM 0 H VAL A 61 13.313 12.896 -0.926 1.00 0.22 H new ATOM 0 HA VAL A 61 13.631 10.190 -2.070 1.00 0.22 H new ATOM 0 HB VAL A 61 12.772 10.753 0.749 1.00 0.25 H new ATOM 0 HG11 VAL A 61 11.382 8.684 0.736 1.00 0.34 H new ATOM 0 HG12 VAL A 61 10.712 9.919 -0.358 1.00 0.34 H new ATOM 0 HG13 VAL A 61 11.622 8.541 -1.022 1.00 0.34 H new ATOM 0 HG21 VAL A 61 13.833 8.536 1.112 1.00 0.38 H new ATOM 0 HG22 VAL A 61 14.105 8.384 -0.640 1.00 0.38 H new ATOM 0 HG23 VAL A 61 14.941 9.655 0.283 1.00 0.38 H new ATOM 981 N GLN A 62 11.321 10.645 -3.020 1.00 0.20 N ATOM 982 CA GLN A 62 10.045 11.064 -3.658 1.00 0.21 C ATOM 983 C GLN A 62 9.195 9.872 -4.087 1.00 0.22 C ATOM 984 O GLN A 62 9.682 8.818 -4.442 1.00 0.21 O ATOM 985 CB GLN A 62 10.372 11.869 -4.904 1.00 0.23 C ATOM 986 CG GLN A 62 9.999 13.329 -4.691 1.00 0.34 C ATOM 987 CD GLN A 62 8.478 13.467 -4.584 1.00 0.50 C ATOM 988 OE1 GLN A 62 7.751 12.973 -5.422 1.00 1.14 O ATOM 989 NE2 GLN A 62 7.964 14.124 -3.580 1.00 1.31 N ATOM 0 H GLN A 62 11.803 9.871 -3.477 1.00 0.20 H new ATOM 0 HA GLN A 62 9.483 11.644 -2.926 1.00 0.21 H new ATOM 0 HB2 GLN A 62 11.435 11.786 -5.133 1.00 0.23 H new ATOM 0 HB3 GLN A 62 9.829 11.467 -5.760 1.00 0.23 H new ATOM 0 HG2 GLN A 62 10.472 13.706 -3.784 1.00 0.34 H new ATOM 0 HG3 GLN A 62 10.371 13.933 -5.519 1.00 0.34 H new ATOM 0 HE21 GLN A 62 8.574 14.539 -2.876 1.00 1.31 H new ATOM 0 HE22 GLN A 62 6.952 14.222 -3.499 1.00 1.31 H new ATOM 998 N LEU A 63 7.911 10.079 -4.086 1.00 0.25 N ATOM 999 CA LEU A 63 6.952 9.030 -4.521 1.00 0.26 C ATOM 1000 C LEU A 63 6.650 9.267 -6.000 1.00 0.29 C ATOM 1001 O LEU A 63 5.987 10.224 -6.347 1.00 0.34 O ATOM 1002 CB LEU A 63 5.665 9.166 -3.695 1.00 0.29 C ATOM 1003 CG LEU A 63 4.682 8.036 -4.029 1.00 0.29 C ATOM 1004 CD1 LEU A 63 3.984 7.568 -2.747 1.00 0.49 C ATOM 1005 CD2 LEU A 63 3.622 8.544 -5.013 1.00 0.48 C ATOM 0 H LEU A 63 7.475 10.954 -3.794 1.00 0.25 H new ATOM 0 HA LEU A 63 7.363 8.031 -4.377 1.00 0.26 H new ATOM 0 HB2 LEU A 63 5.905 9.143 -2.632 1.00 0.29 H new ATOM 0 HB3 LEU A 63 5.199 10.131 -3.895 1.00 0.29 H new ATOM 0 HG LEU A 63 5.232 7.208 -4.477 1.00 0.29 H new ATOM 0 HD11 LEU A 63 3.286 6.765 -2.985 1.00 0.49 H new ATOM 0 HD12 LEU A 63 4.729 7.203 -2.040 1.00 0.49 H new ATOM 0 HD13 LEU A 63 3.440 8.402 -2.304 1.00 0.49 H new ATOM 0 HD21 LEU A 63 2.927 7.738 -5.247 1.00 0.48 H new ATOM 0 HD22 LEU A 63 3.077 9.374 -4.564 1.00 0.48 H new ATOM 0 HD23 LEU A 63 4.108 8.881 -5.929 1.00 0.48 H new ATOM 1017 N VAL A 64 7.135 8.422 -6.875 1.00 0.29 N ATOM 1018 CA VAL A 64 6.872 8.633 -8.332 1.00 0.33 C ATOM 1019 C VAL A 64 5.781 7.673 -8.822 1.00 0.32 C ATOM 1020 O VAL A 64 5.107 7.958 -9.793 1.00 0.37 O ATOM 1021 CB VAL A 64 8.158 8.434 -9.124 1.00 0.36 C ATOM 1022 CG1 VAL A 64 8.810 7.136 -8.688 1.00 1.12 C ATOM 1023 CG2 VAL A 64 7.839 8.370 -10.617 1.00 1.35 C ATOM 0 H VAL A 64 7.697 7.602 -6.647 1.00 0.29 H new ATOM 0 HA VAL A 64 6.521 9.654 -8.485 1.00 0.33 H new ATOM 0 HB VAL A 64 8.835 9.268 -8.940 1.00 0.36 H new ATOM 0 HG11 VAL A 64 9.732 6.985 -9.250 1.00 1.12 H new ATOM 0 HG12 VAL A 64 9.038 7.183 -7.623 1.00 1.12 H new ATOM 0 HG13 VAL A 64 8.130 6.306 -8.877 1.00 1.12 H new ATOM 0 HG21 VAL A 64 8.761 8.228 -11.180 1.00 1.35 H new ATOM 0 HG22 VAL A 64 7.164 7.536 -10.809 1.00 1.35 H new ATOM 0 HG23 VAL A 64 7.364 9.301 -10.928 1.00 1.35 H new ATOM 1033 N ASN A 65 5.550 6.558 -8.160 1.00 0.28 N ATOM 1034 CA ASN A 65 4.449 5.657 -8.623 1.00 0.29 C ATOM 1035 C ASN A 65 4.077 4.689 -7.495 1.00 0.26 C ATOM 1036 O ASN A 65 4.876 4.396 -6.634 1.00 0.24 O ATOM 1037 CB ASN A 65 4.906 4.863 -9.844 1.00 0.30 C ATOM 1038 CG ASN A 65 3.948 5.115 -11.009 1.00 0.38 C ATOM 1039 OD1 ASN A 65 3.077 4.312 -11.279 1.00 1.20 O ATOM 1040 ND2 ASN A 65 4.072 6.204 -11.715 1.00 0.98 N ATOM 0 H ASN A 65 6.065 6.242 -7.338 1.00 0.28 H new ATOM 0 HA ASN A 65 3.581 6.259 -8.892 1.00 0.29 H new ATOM 0 HB2 ASN A 65 5.918 5.156 -10.123 1.00 0.30 H new ATOM 0 HB3 ASN A 65 4.936 3.799 -9.608 1.00 0.30 H new ATOM 0 HD21 ASN A 65 3.438 6.382 -12.494 1.00 0.98 H new ATOM 0 HD22 ASN A 65 4.803 6.878 -11.488 1.00 0.98 H new ATOM 1047 N VAL A 66 2.857 4.207 -7.488 1.00 0.27 N ATOM 1048 CA VAL A 66 2.420 3.271 -6.408 1.00 0.25 C ATOM 1049 C VAL A 66 1.159 2.531 -6.854 1.00 0.26 C ATOM 1050 O VAL A 66 0.199 3.130 -7.293 1.00 0.29 O ATOM 1051 CB VAL A 66 2.076 4.054 -5.132 1.00 0.28 C ATOM 1052 CG1 VAL A 66 1.356 3.128 -4.152 1.00 0.85 C ATOM 1053 CG2 VAL A 66 3.345 4.592 -4.466 1.00 0.63 C ATOM 0 H VAL A 66 2.145 4.423 -8.186 1.00 0.27 H new ATOM 0 HA VAL A 66 3.232 2.571 -6.211 1.00 0.25 H new ATOM 0 HB VAL A 66 1.436 4.894 -5.402 1.00 0.28 H new ATOM 0 HG11 VAL A 66 1.110 3.679 -3.245 1.00 0.85 H new ATOM 0 HG12 VAL A 66 0.440 2.755 -4.610 1.00 0.85 H new ATOM 0 HG13 VAL A 66 2.004 2.288 -3.902 1.00 0.85 H new ATOM 0 HG21 VAL A 66 3.077 5.143 -3.564 1.00 0.63 H new ATOM 0 HG22 VAL A 66 3.998 3.760 -4.202 1.00 0.63 H new ATOM 0 HG23 VAL A 66 3.865 5.256 -5.156 1.00 0.63 H new ATOM 1063 N GLN A 67 1.163 1.231 -6.740 1.00 0.25 N ATOM 1064 CA GLN A 67 -0.035 0.449 -7.154 1.00 0.27 C ATOM 1065 C GLN A 67 -0.290 -0.698 -6.181 1.00 0.25 C ATOM 1066 O GLN A 67 0.583 -1.139 -5.459 1.00 0.25 O ATOM 1067 CB GLN A 67 0.170 -0.112 -8.563 1.00 0.28 C ATOM 1068 CG GLN A 67 -1.187 -0.487 -9.159 1.00 0.39 C ATOM 1069 CD GLN A 67 -0.992 -1.031 -10.575 1.00 0.60 C ATOM 1070 OE1 GLN A 67 0.066 -0.882 -11.155 1.00 1.07 O ATOM 1071 NE2 GLN A 67 -1.972 -1.664 -11.157 1.00 1.41 N ATOM 0 H GLN A 67 1.941 0.679 -6.379 1.00 0.25 H new ATOM 0 HA GLN A 67 -0.899 1.114 -7.148 1.00 0.27 H new ATOM 0 HB2 GLN A 67 0.665 0.627 -9.193 1.00 0.28 H new ATOM 0 HB3 GLN A 67 0.819 -0.987 -8.528 1.00 0.28 H new ATOM 0 HG2 GLN A 67 -1.675 -1.235 -8.535 1.00 0.39 H new ATOM 0 HG3 GLN A 67 -1.840 0.386 -9.180 1.00 0.39 H new ATOM 0 HE21 GLN A 67 -2.859 -1.789 -10.670 1.00 1.41 H new ATOM 0 HE22 GLN A 67 -1.851 -2.035 -12.100 1.00 1.41 H new ATOM 1080 N THR A 68 -1.505 -1.152 -6.147 1.00 0.26 N ATOM 1081 CA THR A 68 -1.883 -2.249 -5.219 1.00 0.27 C ATOM 1082 C THR A 68 -2.772 -3.231 -5.947 1.00 0.30 C ATOM 1083 O THR A 68 -3.613 -2.850 -6.737 1.00 0.43 O ATOM 1084 CB THR A 68 -2.672 -1.665 -4.046 1.00 0.35 C ATOM 1085 OG1 THR A 68 -3.366 -0.502 -4.476 1.00 0.52 O ATOM 1086 CG2 THR A 68 -1.721 -1.303 -2.919 1.00 0.46 C ATOM 0 H THR A 68 -2.266 -0.805 -6.731 1.00 0.26 H new ATOM 0 HA THR A 68 -0.983 -2.747 -4.859 1.00 0.27 H new ATOM 0 HB THR A 68 -3.388 -2.404 -3.687 1.00 0.35 H new ATOM 0 HG1 THR A 68 -2.961 0.291 -4.066 1.00 0.52 H new ATOM 0 HG21 THR A 68 -2.287 -0.887 -2.085 1.00 0.46 H new ATOM 0 HG22 THR A 68 -1.191 -2.197 -2.589 1.00 0.46 H new ATOM 0 HG23 THR A 68 -1.001 -0.565 -3.273 1.00 0.46 H new ATOM 1094 N GLY A 69 -2.641 -4.490 -5.661 1.00 0.29 N ATOM 1095 CA GLY A 69 -3.527 -5.503 -6.304 1.00 0.38 C ATOM 1096 C GLY A 69 -3.348 -6.821 -5.538 1.00 0.31 C ATOM 1097 O GLY A 69 -2.399 -6.972 -4.808 1.00 0.40 O ATOM 0 H GLY A 69 -1.956 -4.868 -5.007 1.00 0.29 H new ATOM 0 HA2 GLY A 69 -4.567 -5.179 -6.272 1.00 0.38 H new ATOM 0 HA3 GLY A 69 -3.265 -5.631 -7.354 1.00 0.38 H new ATOM 1101 N SER A 70 -4.276 -7.742 -5.633 1.00 0.42 N ATOM 1102 CA SER A 70 -4.144 -9.026 -4.873 1.00 0.34 C ATOM 1103 C SER A 70 -3.594 -10.138 -5.776 1.00 0.32 C ATOM 1104 O SER A 70 -3.686 -10.068 -6.983 1.00 0.33 O ATOM 1105 CB SER A 70 -5.505 -9.435 -4.307 1.00 0.32 C ATOM 1106 OG SER A 70 -6.298 -9.993 -5.346 1.00 0.34 O ATOM 0 H SER A 70 -5.118 -7.661 -6.203 1.00 0.42 H new ATOM 0 HA SER A 70 -3.443 -8.873 -4.052 1.00 0.34 H new ATOM 0 HB2 SER A 70 -5.375 -10.161 -3.504 1.00 0.32 H new ATOM 0 HB3 SER A 70 -6.007 -8.569 -3.876 1.00 0.32 H new ATOM 0 HG SER A 70 -6.318 -9.378 -6.109 1.00 0.34 H new ATOM 1112 N GLU A 71 -3.070 -11.194 -5.195 1.00 0.33 N ATOM 1113 CA GLU A 71 -2.554 -12.319 -6.034 1.00 0.35 C ATOM 1114 C GLU A 71 -2.549 -13.616 -5.243 1.00 0.35 C ATOM 1115 O GLU A 71 -2.868 -13.652 -4.074 1.00 0.33 O ATOM 1116 CB GLU A 71 -1.132 -12.032 -6.524 1.00 0.45 C ATOM 1117 CG GLU A 71 -0.114 -12.123 -5.374 1.00 0.54 C ATOM 1118 CD GLU A 71 0.689 -13.423 -5.479 1.00 0.59 C ATOM 1119 OE1 GLU A 71 1.021 -13.815 -6.586 1.00 1.12 O ATOM 1120 OE2 GLU A 71 0.978 -13.994 -4.447 1.00 1.29 O ATOM 0 H GLU A 71 -2.979 -11.323 -4.187 1.00 0.33 H new ATOM 0 HA GLU A 71 -3.217 -12.416 -6.894 1.00 0.35 H new ATOM 0 HB2 GLU A 71 -0.864 -12.743 -7.306 1.00 0.45 H new ATOM 0 HB3 GLU A 71 -1.092 -11.038 -6.969 1.00 0.45 H new ATOM 0 HG2 GLU A 71 0.560 -11.267 -5.407 1.00 0.54 H new ATOM 0 HG3 GLU A 71 -0.632 -12.084 -4.416 1.00 0.54 H new ATOM 1127 N VAL A 72 -2.204 -14.687 -5.892 1.00 0.43 N ATOM 1128 CA VAL A 72 -2.188 -15.996 -5.203 1.00 0.51 C ATOM 1129 C VAL A 72 -0.808 -16.275 -4.615 1.00 0.58 C ATOM 1130 O VAL A 72 0.207 -16.070 -5.249 1.00 0.93 O ATOM 1131 CB VAL A 72 -2.554 -17.105 -6.192 1.00 0.64 C ATOM 1132 CG1 VAL A 72 -3.676 -17.961 -5.605 1.00 0.49 C ATOM 1133 CG2 VAL A 72 -3.024 -16.487 -7.512 1.00 1.02 C ATOM 0 H VAL A 72 -1.931 -14.710 -6.875 1.00 0.43 H new ATOM 0 HA VAL A 72 -2.917 -15.971 -4.393 1.00 0.51 H new ATOM 0 HB VAL A 72 -1.677 -17.726 -6.376 1.00 0.64 H new ATOM 0 HG11 VAL A 72 -3.937 -18.751 -6.309 1.00 0.49 H new ATOM 0 HG12 VAL A 72 -3.342 -18.406 -4.668 1.00 0.49 H new ATOM 0 HG13 VAL A 72 -4.550 -17.337 -5.419 1.00 0.49 H new ATOM 0 HG21 VAL A 72 -3.283 -17.280 -8.213 1.00 1.02 H new ATOM 0 HG22 VAL A 72 -3.899 -15.863 -7.330 1.00 1.02 H new ATOM 0 HG23 VAL A 72 -2.225 -15.878 -7.933 1.00 1.02 H new ATOM 1143 N ARG A 73 -0.772 -16.781 -3.415 1.00 0.44 N ATOM 1144 CA ARG A 73 0.530 -17.123 -2.781 1.00 0.48 C ATOM 1145 C ARG A 73 0.321 -18.325 -1.856 1.00 0.54 C ATOM 1146 O ARG A 73 -0.210 -18.194 -0.772 1.00 0.55 O ATOM 1147 CB ARG A 73 1.036 -15.926 -1.980 1.00 0.43 C ATOM 1148 CG ARG A 73 2.566 -15.893 -1.976 1.00 0.53 C ATOM 1149 CD ARG A 73 3.035 -14.626 -1.258 1.00 0.62 C ATOM 1150 NE ARG A 73 4.464 -14.366 -1.590 1.00 0.89 N ATOM 1151 CZ ARG A 73 5.409 -15.000 -0.955 1.00 1.42 C ATOM 1152 NH1 ARG A 73 5.106 -15.865 -0.026 1.00 2.23 N ATOM 1153 NH2 ARG A 73 6.661 -14.772 -1.251 1.00 1.70 N ATOM 0 H ARG A 73 -1.594 -16.973 -2.843 1.00 0.44 H new ATOM 0 HA ARG A 73 1.268 -17.371 -3.544 1.00 0.48 H new ATOM 0 HB2 ARG A 73 0.647 -15.003 -2.410 1.00 0.43 H new ATOM 0 HB3 ARG A 73 0.665 -15.982 -0.957 1.00 0.43 H new ATOM 0 HG2 ARG A 73 2.960 -16.777 -1.475 1.00 0.53 H new ATOM 0 HG3 ARG A 73 2.946 -15.909 -2.998 1.00 0.53 H new ATOM 0 HD2 ARG A 73 2.421 -13.777 -1.558 1.00 0.62 H new ATOM 0 HD3 ARG A 73 2.916 -14.741 -0.181 1.00 0.62 H new ATOM 0 HE ARG A 73 4.703 -13.690 -2.316 1.00 0.89 H new ATOM 0 HH11 ARG A 73 4.129 -16.045 0.204 1.00 2.23 H new ATOM 0 HH12 ARG A 73 5.846 -16.361 0.470 1.00 2.23 H new ATOM 0 HH21 ARG A 73 6.898 -14.098 -1.979 1.00 1.70 H new ATOM 0 HH22 ARG A 73 7.401 -15.268 -0.754 1.00 1.70 H new ATOM 1167 N ASP A 74 0.725 -19.491 -2.306 1.00 0.60 N ATOM 1168 CA ASP A 74 0.566 -20.749 -1.509 1.00 0.68 C ATOM 1169 C ASP A 74 -0.805 -21.371 -1.796 1.00 0.68 C ATOM 1170 O ASP A 74 -1.433 -21.940 -0.925 1.00 0.69 O ATOM 1171 CB ASP A 74 0.702 -20.467 -0.012 1.00 0.68 C ATOM 1172 CG ASP A 74 1.231 -21.716 0.695 1.00 0.79 C ATOM 1173 OD1 ASP A 74 0.557 -22.733 0.644 1.00 1.27 O ATOM 1174 OD2 ASP A 74 2.300 -21.635 1.277 1.00 1.38 O ATOM 0 H ASP A 74 1.169 -19.625 -3.215 1.00 0.60 H new ATOM 0 HA ASP A 74 1.353 -21.445 -1.801 1.00 0.68 H new ATOM 0 HB2 ASP A 74 1.380 -19.629 0.151 1.00 0.68 H new ATOM 0 HB3 ASP A 74 -0.264 -20.182 0.405 1.00 0.68 H new ATOM 1179 N ARG A 75 -1.275 -21.256 -3.013 1.00 0.67 N ATOM 1180 CA ARG A 75 -2.608 -21.828 -3.380 1.00 0.69 C ATOM 1181 C ARG A 75 -3.698 -21.117 -2.579 1.00 0.59 C ATOM 1182 O ARG A 75 -4.686 -21.695 -2.169 1.00 0.64 O ATOM 1183 CB ARG A 75 -2.637 -23.341 -3.126 1.00 0.79 C ATOM 1184 CG ARG A 75 -2.532 -24.074 -4.464 1.00 0.87 C ATOM 1185 CD ARG A 75 -1.265 -23.622 -5.191 1.00 0.85 C ATOM 1186 NE ARG A 75 -0.621 -24.795 -5.845 1.00 1.25 N ATOM 1187 CZ ARG A 75 0.319 -24.612 -6.730 1.00 1.89 C ATOM 1188 NH1 ARG A 75 0.700 -23.402 -7.037 1.00 2.62 N ATOM 1189 NH2 ARG A 75 0.879 -25.638 -7.309 1.00 2.29 N ATOM 0 H ARG A 75 -0.788 -20.786 -3.776 1.00 0.67 H new ATOM 0 HA ARG A 75 -2.789 -21.671 -4.443 1.00 0.69 H new ATOM 0 HB2 ARG A 75 -1.813 -23.629 -2.474 1.00 0.79 H new ATOM 0 HB3 ARG A 75 -3.559 -23.619 -2.616 1.00 0.79 H new ATOM 0 HG2 ARG A 75 -2.506 -25.151 -4.300 1.00 0.87 H new ATOM 0 HG3 ARG A 75 -3.410 -23.865 -5.076 1.00 0.87 H new ATOM 0 HD2 ARG A 75 -1.511 -22.866 -5.937 1.00 0.85 H new ATOM 0 HD3 ARG A 75 -0.574 -23.161 -4.486 1.00 0.85 H new ATOM 0 HE ARG A 75 -0.915 -25.741 -5.601 1.00 1.25 H new ATOM 0 HH11 ARG A 75 0.262 -22.599 -6.585 1.00 2.62 H new ATOM 0 HH12 ARG A 75 1.435 -23.259 -7.729 1.00 2.62 H new ATOM 0 HH21 ARG A 75 0.582 -26.584 -7.070 1.00 2.29 H new ATOM 0 HH22 ARG A 75 1.614 -25.494 -8.001 1.00 2.29 H new ATOM 1203 N ARG A 76 -3.531 -19.845 -2.388 1.00 0.46 N ATOM 1204 CA ARG A 76 -4.554 -19.068 -1.650 1.00 0.38 C ATOM 1205 C ARG A 76 -4.428 -17.600 -2.034 1.00 0.34 C ATOM 1206 O ARG A 76 -3.376 -17.147 -2.439 1.00 0.34 O ATOM 1207 CB ARG A 76 -4.357 -19.221 -0.146 1.00 0.37 C ATOM 1208 CG ARG A 76 -5.695 -19.575 0.507 1.00 0.63 C ATOM 1209 CD ARG A 76 -5.625 -19.269 1.995 1.00 1.28 C ATOM 1210 NE ARG A 76 -4.526 -20.057 2.617 1.00 1.50 N ATOM 1211 CZ ARG A 76 -4.152 -19.802 3.842 1.00 2.36 C ATOM 1212 NH1 ARG A 76 -4.745 -18.858 4.520 1.00 3.15 N ATOM 1213 NH2 ARG A 76 -3.187 -20.490 4.386 1.00 2.82 N ATOM 0 H ARG A 76 -2.727 -19.308 -2.712 1.00 0.46 H new ATOM 0 HA ARG A 76 -5.545 -19.441 -1.909 1.00 0.38 H new ATOM 0 HB2 ARG A 76 -3.622 -20.000 0.059 1.00 0.37 H new ATOM 0 HB3 ARG A 76 -3.967 -18.295 0.277 1.00 0.37 H new ATOM 0 HG2 ARG A 76 -6.501 -19.005 0.044 1.00 0.63 H new ATOM 0 HG3 ARG A 76 -5.921 -20.630 0.351 1.00 0.63 H new ATOM 0 HD2 ARG A 76 -5.454 -18.204 2.150 1.00 1.28 H new ATOM 0 HD3 ARG A 76 -6.575 -19.512 2.471 1.00 1.28 H new ATOM 0 HE ARG A 76 -4.065 -20.796 2.086 1.00 1.50 H new ATOM 0 HH11 ARG A 76 -5.499 -18.320 4.093 1.00 3.15 H new ATOM 0 HH12 ARG A 76 -4.454 -18.658 5.477 1.00 3.15 H new ATOM 0 HH21 ARG A 76 -2.724 -21.227 3.855 1.00 2.82 H new ATOM 0 HH22 ARG A 76 -2.895 -20.291 5.343 1.00 2.82 H new ATOM 1227 N ARG A 77 -5.493 -16.858 -1.943 1.00 0.32 N ATOM 1228 CA ARG A 77 -5.408 -15.432 -2.348 1.00 0.31 C ATOM 1229 C ARG A 77 -4.931 -14.578 -1.196 1.00 0.27 C ATOM 1230 O ARG A 77 -5.360 -14.699 -0.066 1.00 0.29 O ATOM 1231 CB ARG A 77 -6.765 -14.914 -2.822 1.00 0.34 C ATOM 1232 CG ARG A 77 -6.605 -13.473 -3.334 1.00 0.58 C ATOM 1233 CD ARG A 77 -7.104 -13.374 -4.774 1.00 0.47 C ATOM 1234 NE ARG A 77 -8.451 -14.000 -4.884 1.00 1.21 N ATOM 1235 CZ ARG A 77 -8.865 -14.463 -6.031 1.00 1.57 C ATOM 1236 NH1 ARG A 77 -8.110 -14.358 -7.091 1.00 1.85 N ATOM 1237 NH2 ARG A 77 -10.038 -15.028 -6.121 1.00 2.44 N ATOM 0 H ARG A 77 -6.405 -17.171 -1.611 1.00 0.32 H new ATOM 0 HA ARG A 77 -4.694 -15.368 -3.169 1.00 0.31 H new ATOM 0 HB2 ARG A 77 -7.155 -15.553 -3.614 1.00 0.34 H new ATOM 0 HB3 ARG A 77 -7.485 -14.944 -2.004 1.00 0.34 H new ATOM 0 HG2 ARG A 77 -7.165 -12.788 -2.698 1.00 0.58 H new ATOM 0 HG3 ARG A 77 -5.558 -13.173 -3.281 1.00 0.58 H new ATOM 0 HD2 ARG A 77 -7.152 -12.329 -5.081 1.00 0.47 H new ATOM 0 HD3 ARG A 77 -6.405 -13.872 -5.446 1.00 0.47 H new ATOM 0 HE ARG A 77 -9.050 -14.067 -4.061 1.00 1.21 H new ATOM 0 HH11 ARG A 77 -7.195 -13.913 -7.023 1.00 1.85 H new ATOM 0 HH12 ARG A 77 -8.436 -14.721 -7.987 1.00 1.85 H new ATOM 0 HH21 ARG A 77 -10.631 -15.107 -5.295 1.00 2.44 H new ATOM 0 HH22 ARG A 77 -10.362 -15.390 -7.018 1.00 2.44 H new ATOM 1251 N ILE A 78 -4.026 -13.712 -1.509 1.00 0.23 N ATOM 1252 CA ILE A 78 -3.452 -12.807 -0.503 1.00 0.20 C ATOM 1253 C ILE A 78 -3.258 -11.446 -1.164 1.00 0.19 C ATOM 1254 O ILE A 78 -3.192 -11.338 -2.372 1.00 0.21 O ATOM 1255 CB ILE A 78 -2.120 -13.378 -0.049 1.00 0.20 C ATOM 1256 CG1 ILE A 78 -1.375 -12.349 0.748 1.00 0.21 C ATOM 1257 CG2 ILE A 78 -1.284 -13.751 -1.260 1.00 0.23 C ATOM 1258 CD1 ILE A 78 -0.212 -13.014 1.488 1.00 0.23 C ATOM 0 H ILE A 78 -3.651 -13.592 -2.450 1.00 0.23 H new ATOM 0 HA ILE A 78 -4.103 -12.702 0.365 1.00 0.20 H new ATOM 0 HB ILE A 78 -2.304 -14.261 0.563 1.00 0.20 H new ATOM 0 HG12 ILE A 78 -1.000 -11.566 0.089 1.00 0.21 H new ATOM 0 HG13 ILE A 78 -2.047 -11.871 1.461 1.00 0.21 H new ATOM 0 HG21 ILE A 78 -0.329 -14.160 -0.931 1.00 0.23 H new ATOM 0 HG22 ILE A 78 -1.814 -14.497 -1.852 1.00 0.23 H new ATOM 0 HG23 ILE A 78 -1.108 -12.864 -1.868 1.00 0.23 H new ATOM 0 HD11 ILE A 78 0.328 -12.264 2.066 1.00 0.23 H new ATOM 0 HD12 ILE A 78 -0.599 -13.781 2.159 1.00 0.23 H new ATOM 0 HD13 ILE A 78 0.465 -13.471 0.766 1.00 0.23 H new ATOM 1270 N SER A 79 -3.242 -10.407 -0.397 1.00 0.20 N ATOM 1271 CA SER A 79 -3.142 -9.056 -0.997 1.00 0.22 C ATOM 1272 C SER A 79 -1.680 -8.653 -1.208 1.00 0.19 C ATOM 1273 O SER A 79 -0.776 -9.182 -0.590 1.00 0.22 O ATOM 1274 CB SER A 79 -3.808 -8.053 -0.057 1.00 0.28 C ATOM 1275 OG SER A 79 -2.826 -7.481 0.798 1.00 0.74 O ATOM 0 H SER A 79 -3.294 -10.431 0.621 1.00 0.20 H new ATOM 0 HA SER A 79 -3.638 -9.065 -1.967 1.00 0.22 H new ATOM 0 HB2 SER A 79 -4.303 -7.272 -0.633 1.00 0.28 H new ATOM 0 HB3 SER A 79 -4.577 -8.549 0.535 1.00 0.28 H new ATOM 0 HG SER A 79 -2.630 -8.101 1.532 1.00 0.74 H new ATOM 1281 N TYR A 80 -1.460 -7.697 -2.075 1.00 0.19 N ATOM 1282 CA TYR A 80 -0.065 -7.231 -2.322 1.00 0.25 C ATOM 1283 C TYR A 80 -0.042 -5.740 -2.598 1.00 0.22 C ATOM 1284 O TYR A 80 -1.000 -5.160 -3.068 1.00 0.21 O ATOM 1285 CB TYR A 80 0.615 -8.025 -3.472 1.00 0.40 C ATOM 1286 CG TYR A 80 0.066 -7.661 -4.847 1.00 0.93 C ATOM 1287 CD1 TYR A 80 0.322 -6.401 -5.421 1.00 1.68 C ATOM 1288 CD2 TYR A 80 -0.694 -8.600 -5.565 1.00 1.82 C ATOM 1289 CE1 TYR A 80 -0.192 -6.093 -6.692 1.00 2.66 C ATOM 1290 CE2 TYR A 80 -1.198 -8.271 -6.833 1.00 2.78 C ATOM 1291 CZ TYR A 80 -0.950 -7.023 -7.387 1.00 3.08 C ATOM 1292 OH TYR A 80 -1.450 -6.711 -8.635 1.00 4.16 O ATOM 0 H TYR A 80 -2.182 -7.223 -2.618 1.00 0.19 H new ATOM 0 HA TYR A 80 0.512 -7.422 -1.417 1.00 0.25 H new ATOM 0 HB2 TYR A 80 1.688 -7.836 -3.453 1.00 0.40 H new ATOM 0 HB3 TYR A 80 0.476 -9.093 -3.302 1.00 0.40 H new ATOM 0 HD1 TYR A 80 0.912 -5.672 -4.885 1.00 1.68 H new ATOM 0 HD2 TYR A 80 -0.890 -9.574 -5.141 1.00 1.82 H new ATOM 0 HE1 TYR A 80 0.005 -5.126 -7.130 1.00 2.66 H new ATOM 0 HE2 TYR A 80 -1.783 -8.994 -7.382 1.00 2.78 H new ATOM 0 HH TYR A 80 -1.957 -7.473 -8.984 1.00 4.16 H new ATOM 1302 N ILE A 81 1.072 -5.120 -2.298 1.00 0.25 N ATOM 1303 CA ILE A 81 1.223 -3.659 -2.519 1.00 0.27 C ATOM 1304 C ILE A 81 2.460 -3.401 -3.362 1.00 0.25 C ATOM 1305 O ILE A 81 3.538 -3.901 -3.090 1.00 0.26 O ATOM 1306 CB ILE A 81 1.412 -2.940 -1.182 1.00 0.34 C ATOM 1307 CG1 ILE A 81 1.261 -1.426 -1.386 1.00 0.76 C ATOM 1308 CG2 ILE A 81 2.815 -3.249 -0.636 1.00 0.92 C ATOM 1309 CD1 ILE A 81 2.091 -0.659 -0.359 1.00 0.69 C ATOM 0 H ILE A 81 1.894 -5.577 -1.903 1.00 0.25 H new ATOM 0 HA ILE A 81 0.328 -3.291 -3.020 1.00 0.27 H new ATOM 0 HB ILE A 81 0.659 -3.283 -0.472 1.00 0.34 H new ATOM 0 HG12 ILE A 81 1.579 -1.156 -2.393 1.00 0.76 H new ATOM 0 HG13 ILE A 81 0.212 -1.145 -1.297 1.00 0.76 H new ATOM 0 HG21 ILE A 81 2.955 -2.739 0.317 1.00 0.92 H new ATOM 0 HG22 ILE A 81 2.920 -4.324 -0.491 1.00 0.92 H new ATOM 0 HG23 ILE A 81 3.566 -2.903 -1.346 1.00 0.92 H new ATOM 0 HD11 ILE A 81 1.970 0.412 -0.521 1.00 0.69 H new ATOM 0 HD12 ILE A 81 1.754 -0.915 0.645 1.00 0.69 H new ATOM 0 HD13 ILE A 81 3.142 -0.926 -0.468 1.00 0.69 H new ATOM 1321 N LEU A 82 2.303 -2.602 -4.366 1.00 0.25 N ATOM 1322 CA LEU A 82 3.442 -2.246 -5.238 1.00 0.25 C ATOM 1323 C LEU A 82 3.770 -0.787 -4.955 1.00 0.25 C ATOM 1324 O LEU A 82 2.905 0.063 -5.052 1.00 0.29 O ATOM 1325 CB LEU A 82 3.016 -2.426 -6.688 1.00 0.29 C ATOM 1326 CG LEU A 82 2.395 -3.803 -6.863 1.00 0.32 C ATOM 1327 CD1 LEU A 82 1.979 -3.989 -8.325 1.00 0.36 C ATOM 1328 CD2 LEU A 82 3.413 -4.887 -6.481 1.00 0.32 C ATOM 0 H LEU A 82 1.415 -2.171 -4.625 1.00 0.25 H new ATOM 0 HA LEU A 82 4.315 -2.872 -5.053 1.00 0.25 H new ATOM 0 HB2 LEU A 82 2.300 -1.653 -6.967 1.00 0.29 H new ATOM 0 HB3 LEU A 82 3.876 -2.316 -7.348 1.00 0.29 H new ATOM 0 HG LEU A 82 1.521 -3.888 -6.217 1.00 0.32 H new ATOM 0 HD11 LEU A 82 1.533 -4.975 -8.454 1.00 0.36 H new ATOM 0 HD12 LEU A 82 1.252 -3.224 -8.596 1.00 0.36 H new ATOM 0 HD13 LEU A 82 2.856 -3.900 -8.967 1.00 0.36 H new ATOM 0 HD21 LEU A 82 2.962 -5.871 -6.609 1.00 0.32 H new ATOM 0 HD22 LEU A 82 4.291 -4.804 -7.122 1.00 0.32 H new ATOM 0 HD23 LEU A 82 3.710 -4.756 -5.441 1.00 0.32 H new ATOM 1340 N LEU A 83 4.981 -0.481 -4.559 1.00 0.22 N ATOM 1341 CA LEU A 83 5.307 0.933 -4.222 1.00 0.23 C ATOM 1342 C LEU A 83 6.614 1.355 -4.876 1.00 0.21 C ATOM 1343 O LEU A 83 7.632 0.702 -4.770 1.00 0.20 O ATOM 1344 CB LEU A 83 5.457 1.053 -2.705 1.00 0.23 C ATOM 1345 CG LEU A 83 4.789 2.319 -2.163 1.00 0.52 C ATOM 1346 CD1 LEU A 83 4.565 2.161 -0.661 1.00 0.52 C ATOM 1347 CD2 LEU A 83 5.708 3.505 -2.404 1.00 0.98 C ATOM 0 H LEU A 83 5.749 -1.144 -4.456 1.00 0.22 H new ATOM 0 HA LEU A 83 4.506 1.576 -4.586 1.00 0.23 H new ATOM 0 HB2 LEU A 83 5.018 0.178 -2.227 1.00 0.23 H new ATOM 0 HB3 LEU A 83 6.515 1.061 -2.445 1.00 0.23 H new ATOM 0 HG LEU A 83 3.835 2.479 -2.665 1.00 0.52 H new ATOM 0 HD11 LEU A 83 4.089 3.059 -0.268 1.00 0.52 H new ATOM 0 HD12 LEU A 83 3.922 1.300 -0.478 1.00 0.52 H new ATOM 0 HD13 LEU A 83 5.523 2.011 -0.164 1.00 0.52 H new ATOM 0 HD21 LEU A 83 5.240 4.412 -2.021 1.00 0.98 H new ATOM 0 HD22 LEU A 83 6.656 3.341 -1.891 1.00 0.98 H new ATOM 0 HD23 LEU A 83 5.889 3.614 -3.473 1.00 0.98 H new ATOM 1359 N ARG A 84 6.561 2.463 -5.548 1.00 0.22 N ATOM 1360 CA ARG A 84 7.769 2.985 -6.230 1.00 0.21 C ATOM 1361 C ARG A 84 8.420 4.073 -5.382 1.00 0.21 C ATOM 1362 O ARG A 84 7.886 4.513 -4.387 1.00 0.23 O ATOM 1363 CB ARG A 84 7.405 3.537 -7.603 1.00 0.23 C ATOM 1364 CG ARG A 84 8.382 2.977 -8.633 1.00 0.25 C ATOM 1365 CD ARG A 84 8.048 3.482 -10.037 1.00 0.31 C ATOM 1366 NE ARG A 84 9.034 2.917 -11.003 1.00 0.40 N ATOM 1367 CZ ARG A 84 8.779 2.923 -12.284 1.00 0.48 C ATOM 1368 NH1 ARG A 84 7.663 3.435 -12.725 1.00 0.49 N ATOM 1369 NH2 ARG A 84 9.642 2.418 -13.123 1.00 0.58 N ATOM 0 H ARG A 84 5.724 3.036 -5.655 1.00 0.22 H new ATOM 0 HA ARG A 84 8.478 2.167 -6.360 1.00 0.21 H new ATOM 0 HB2 ARG A 84 6.383 3.260 -7.862 1.00 0.23 H new ATOM 0 HB3 ARG A 84 7.448 4.626 -7.595 1.00 0.23 H new ATOM 0 HG2 ARG A 84 9.399 3.268 -8.370 1.00 0.25 H new ATOM 0 HG3 ARG A 84 8.348 1.888 -8.617 1.00 0.25 H new ATOM 0 HD2 ARG A 84 7.037 3.184 -10.314 1.00 0.31 H new ATOM 0 HD3 ARG A 84 8.078 4.571 -10.062 1.00 0.31 H new ATOM 0 HE ARG A 84 9.911 2.524 -10.662 1.00 0.40 H new ATOM 0 HH11 ARG A 84 6.989 3.831 -12.069 1.00 0.49 H new ATOM 0 HH12 ARG A 84 7.464 3.440 -13.725 1.00 0.49 H new ATOM 0 HH21 ARG A 84 10.515 2.019 -12.778 1.00 0.58 H new ATOM 0 HH22 ARG A 84 9.443 2.422 -14.123 1.00 0.58 H new ATOM 1383 N LEU A 85 9.572 4.516 -5.776 1.00 0.20 N ATOM 1384 CA LEU A 85 10.254 5.588 -4.981 1.00 0.21 C ATOM 1385 C LEU A 85 11.230 6.314 -5.877 1.00 0.21 C ATOM 1386 O LEU A 85 11.920 5.696 -6.632 1.00 0.22 O ATOM 1387 CB LEU A 85 11.026 4.938 -3.823 1.00 0.23 C ATOM 1388 CG LEU A 85 11.304 5.916 -2.664 1.00 0.53 C ATOM 1389 CD1 LEU A 85 12.208 7.064 -3.126 1.00 1.39 C ATOM 1390 CD2 LEU A 85 9.990 6.475 -2.103 1.00 0.94 C ATOM 0 H LEU A 85 10.075 4.194 -6.603 1.00 0.20 H new ATOM 0 HA LEU A 85 9.516 6.288 -4.588 1.00 0.21 H new ATOM 0 HB2 LEU A 85 10.458 4.088 -3.446 1.00 0.23 H new ATOM 0 HB3 LEU A 85 11.972 4.548 -4.198 1.00 0.23 H new ATOM 0 HG LEU A 85 11.817 5.366 -1.875 1.00 0.53 H new ATOM 0 HD11 LEU A 85 12.391 7.742 -2.292 1.00 1.39 H new ATOM 0 HD12 LEU A 85 13.157 6.660 -3.480 1.00 1.39 H new ATOM 0 HD13 LEU A 85 11.721 7.608 -3.935 1.00 1.39 H new ATOM 0 HD21 LEU A 85 10.207 7.163 -1.286 1.00 0.94 H new ATOM 0 HD22 LEU A 85 9.454 7.004 -2.891 1.00 0.94 H new ATOM 0 HD23 LEU A 85 9.374 5.655 -1.733 1.00 0.94 H new ATOM 1402 N LYS A 86 11.293 7.614 -5.789 1.00 0.22 N ATOM 1403 CA LYS A 86 12.246 8.377 -6.644 1.00 0.24 C ATOM 1404 C LYS A 86 13.125 9.262 -5.762 1.00 0.23 C ATOM 1405 O LYS A 86 12.673 9.840 -4.799 1.00 0.28 O ATOM 1406 CB LYS A 86 11.454 9.222 -7.632 1.00 0.27 C ATOM 1407 CG LYS A 86 12.389 10.050 -8.512 1.00 0.38 C ATOM 1408 CD LYS A 86 12.474 11.490 -7.994 1.00 0.72 C ATOM 1409 CE LYS A 86 13.250 12.352 -8.993 1.00 0.72 C ATOM 1410 NZ LYS A 86 12.392 13.485 -9.442 1.00 1.42 N ATOM 0 H LYS A 86 10.725 8.182 -5.161 1.00 0.22 H new ATOM 0 HA LYS A 86 12.889 7.692 -7.196 1.00 0.24 H new ATOM 0 HB2 LYS A 86 10.837 8.576 -8.257 1.00 0.27 H new ATOM 0 HB3 LYS A 86 10.777 9.883 -7.091 1.00 0.27 H new ATOM 0 HG2 LYS A 86 13.382 9.601 -8.522 1.00 0.38 H new ATOM 0 HG3 LYS A 86 12.028 10.047 -9.540 1.00 0.38 H new ATOM 0 HD2 LYS A 86 11.472 11.895 -7.851 1.00 0.72 H new ATOM 0 HD3 LYS A 86 12.968 11.509 -7.022 1.00 0.72 H new ATOM 0 HE2 LYS A 86 14.161 12.732 -8.531 1.00 0.72 H new ATOM 0 HE3 LYS A 86 13.554 11.750 -9.850 1.00 0.72 H new ATOM 0 HZ1 LYS A 86 12.979 14.195 -9.925 1.00 1.42 H new ATOM 0 HZ2 LYS A 86 11.666 13.132 -10.097 1.00 1.42 H new ATOM 0 HZ3 LYS A 86 11.932 13.920 -8.617 1.00 1.42 H new ATOM 1424 N ARG A 87 14.382 9.364 -6.090 1.00 0.24 N ATOM 1425 CA ARG A 87 15.306 10.212 -5.274 1.00 0.24 C ATOM 1426 C ARG A 87 15.502 11.567 -5.948 1.00 0.26 C ATOM 1427 O ARG A 87 15.710 11.654 -7.142 1.00 0.28 O ATOM 1428 CB ARG A 87 16.665 9.523 -5.142 1.00 0.27 C ATOM 1429 CG ARG A 87 16.507 8.188 -4.406 1.00 0.62 C ATOM 1430 CD ARG A 87 16.124 8.433 -2.943 1.00 0.43 C ATOM 1431 NE ARG A 87 16.528 7.259 -2.119 1.00 0.48 N ATOM 1432 CZ ARG A 87 17.747 7.169 -1.660 1.00 0.80 C ATOM 1433 NH1 ARG A 87 18.622 8.096 -1.939 1.00 1.64 N ATOM 1434 NH2 ARG A 87 18.092 6.147 -0.925 1.00 0.86 N ATOM 0 H ARG A 87 14.814 8.898 -6.888 1.00 0.24 H new ATOM 0 HA ARG A 87 14.868 10.354 -4.286 1.00 0.24 H new ATOM 0 HB2 ARG A 87 17.094 9.354 -6.130 1.00 0.27 H new ATOM 0 HB3 ARG A 87 17.357 10.167 -4.600 1.00 0.27 H new ATOM 0 HG2 ARG A 87 15.742 7.584 -4.894 1.00 0.62 H new ATOM 0 HG3 ARG A 87 17.438 7.624 -4.456 1.00 0.62 H new ATOM 0 HD2 ARG A 87 16.613 9.335 -2.574 1.00 0.43 H new ATOM 0 HD3 ARG A 87 15.050 8.596 -2.860 1.00 0.43 H new ATOM 0 HE ARG A 87 15.851 6.524 -1.913 1.00 0.48 H new ATOM 0 HH11 ARG A 87 18.354 8.893 -2.517 1.00 1.64 H new ATOM 0 HH12 ARG A 87 19.574 8.024 -1.579 1.00 1.64 H new ATOM 0 HH21 ARG A 87 17.410 5.420 -0.710 1.00 0.86 H new ATOM 0 HH22 ARG A 87 19.044 6.075 -0.566 1.00 0.86 H new ATOM 1448 N VAL A 88 15.457 12.621 -5.177 1.00 0.27 N ATOM 1449 CA VAL A 88 15.660 13.989 -5.743 1.00 0.30 C ATOM 1450 C VAL A 88 16.961 14.557 -5.182 1.00 0.31 C ATOM 1451 O VAL A 88 17.377 15.647 -5.521 1.00 0.35 O ATOM 1452 CB VAL A 88 14.493 14.891 -5.341 1.00 0.31 C ATOM 1453 CG1 VAL A 88 14.832 16.346 -5.664 1.00 0.49 C ATOM 1454 CG2 VAL A 88 13.235 14.479 -6.107 1.00 0.63 C ATOM 0 H VAL A 88 15.287 12.594 -4.172 1.00 0.27 H new ATOM 0 HA VAL A 88 15.711 13.939 -6.831 1.00 0.30 H new ATOM 0 HB VAL A 88 14.314 14.789 -4.271 1.00 0.31 H new ATOM 0 HG11 VAL A 88 13.998 16.986 -5.376 1.00 0.49 H new ATOM 0 HG12 VAL A 88 15.724 16.643 -5.113 1.00 0.49 H new ATOM 0 HG13 VAL A 88 15.016 16.448 -6.734 1.00 0.49 H new ATOM 0 HG21 VAL A 88 12.405 15.124 -5.818 1.00 0.63 H new ATOM 0 HG22 VAL A 88 13.413 14.575 -7.178 1.00 0.63 H new ATOM 0 HG23 VAL A 88 12.989 13.444 -5.872 1.00 0.63 H new ATOM 1464 N TYR A 89 17.614 13.801 -4.343 1.00 0.31 N ATOM 1465 CA TYR A 89 18.906 14.260 -3.762 1.00 0.37 C ATOM 1466 C TYR A 89 19.520 13.131 -2.932 1.00 0.49 C ATOM 1467 O TYR A 89 20.578 12.653 -3.309 1.00 1.12 O ATOM 1468 CB TYR A 89 18.677 15.483 -2.867 1.00 0.35 C ATOM 1469 CG TYR A 89 20.005 15.972 -2.338 1.00 0.51 C ATOM 1470 CD1 TYR A 89 20.799 16.822 -3.117 1.00 1.13 C ATOM 1471 CD2 TYR A 89 20.441 15.577 -1.068 1.00 1.46 C ATOM 1472 CE1 TYR A 89 22.030 17.275 -2.627 1.00 1.28 C ATOM 1473 CE2 TYR A 89 21.671 16.031 -0.577 1.00 1.76 C ATOM 1474 CZ TYR A 89 22.465 16.880 -1.357 1.00 1.27 C ATOM 1475 OH TYR A 89 23.678 17.327 -0.873 1.00 1.67 O ATOM 1476 OXT TYR A 89 18.923 12.764 -1.933 1.00 1.00 O ATOM 0 H TYR A 89 17.306 12.879 -4.033 1.00 0.31 H new ATOM 0 HA TYR A 89 19.583 14.533 -4.572 1.00 0.37 H new ATOM 0 HB2 TYR A 89 18.184 16.274 -3.432 1.00 0.35 H new ATOM 0 HB3 TYR A 89 18.016 15.224 -2.040 1.00 0.35 H new ATOM 0 HD1 TYR A 89 20.462 17.128 -4.096 1.00 1.13 H new ATOM 0 HD2 TYR A 89 19.828 14.922 -0.467 1.00 1.46 H new ATOM 0 HE1 TYR A 89 22.643 17.929 -3.229 1.00 1.28 H new ATOM 0 HE2 TYR A 89 22.007 15.726 0.403 1.00 1.76 H new ATOM 0 HH TYR A 89 23.828 16.960 0.023 1.00 1.67 H new TER 1486 TYR A 89 ATOM 1487 N MET B 1 -25.175 12.348 4.030 1.00 3.96 N ATOM 1488 CA MET B 1 -24.013 11.413 4.024 1.00 3.21 C ATOM 1489 C MET B 1 -23.059 11.785 2.887 1.00 2.20 C ATOM 1490 O MET B 1 -22.762 10.980 2.028 1.00 2.41 O ATOM 1491 CB MET B 1 -24.512 9.981 3.821 1.00 3.93 C ATOM 1492 CG MET B 1 -25.390 9.571 5.005 1.00 4.72 C ATOM 1493 SD MET B 1 -24.718 8.070 5.761 1.00 5.70 S ATOM 1494 CE MET B 1 -23.864 8.874 7.141 1.00 6.35 C ATOM 0 H1 MET B 1 -25.284 12.761 4.978 1.00 3.96 H new ATOM 0 H2 MET B 1 -25.013 13.108 3.339 1.00 3.96 H new ATOM 0 H3 MET B 1 -26.040 11.829 3.777 1.00 3.96 H new ATOM 0 HA MET B 1 -23.487 11.485 4.976 1.00 3.21 H new ATOM 0 HB2 MET B 1 -25.079 9.911 2.893 1.00 3.93 H new ATOM 0 HB3 MET B 1 -23.666 9.300 3.729 1.00 3.93 H new ATOM 0 HG2 MET B 1 -25.428 10.376 5.739 1.00 4.72 H new ATOM 0 HG3 MET B 1 -26.413 9.396 4.670 1.00 4.72 H new ATOM 0 HE1 MET B 1 -23.369 8.119 7.752 1.00 6.35 H new ATOM 0 HE2 MET B 1 -23.121 9.571 6.753 1.00 6.35 H new ATOM 0 HE3 MET B 1 -24.587 9.417 7.750 1.00 6.35 H new ATOM 1506 N THR B 2 -22.579 13.001 2.879 1.00 1.60 N ATOM 1507 CA THR B 2 -21.640 13.439 1.803 1.00 1.14 C ATOM 1508 C THR B 2 -22.132 12.932 0.444 1.00 0.94 C ATOM 1509 O THR B 2 -23.316 12.769 0.228 1.00 1.61 O ATOM 1510 CB THR B 2 -20.242 12.886 2.088 1.00 1.83 C ATOM 1511 OG1 THR B 2 -20.239 11.480 1.884 1.00 2.42 O ATOM 1512 CG2 THR B 2 -19.858 13.197 3.535 1.00 2.32 C ATOM 0 H THR B 2 -22.798 13.714 3.575 1.00 1.60 H new ATOM 0 HA THR B 2 -21.600 14.528 1.782 1.00 1.14 H new ATOM 0 HB THR B 2 -19.521 13.350 1.415 1.00 1.83 H new ATOM 0 HG1 THR B 2 -21.106 11.200 1.523 1.00 2.42 H new ATOM 0 HG21 THR B 2 -18.862 12.804 3.740 1.00 2.32 H new ATOM 0 HG22 THR B 2 -19.860 14.276 3.688 1.00 2.32 H new ATOM 0 HG23 THR B 2 -20.577 12.733 4.210 1.00 2.32 H new ATOM 1520 N GLU B 3 -21.236 12.673 -0.470 1.00 0.88 N ATOM 1521 CA GLU B 3 -21.647 12.170 -1.814 1.00 0.65 C ATOM 1522 C GLU B 3 -20.414 11.590 -2.510 1.00 0.59 C ATOM 1523 O GLU B 3 -20.472 10.565 -3.147 1.00 0.81 O ATOM 1524 CB GLU B 3 -22.201 13.328 -2.643 1.00 0.93 C ATOM 1525 CG GLU B 3 -23.710 13.162 -2.837 1.00 0.89 C ATOM 1526 CD GLU B 3 -24.228 14.249 -3.781 1.00 1.04 C ATOM 1527 OE1 GLU B 3 -23.698 14.358 -4.873 1.00 1.68 O ATOM 1528 OE2 GLU B 3 -25.147 14.953 -3.394 1.00 1.56 O ATOM 0 H GLU B 3 -20.231 12.789 -0.343 1.00 0.88 H new ATOM 0 HA GLU B 3 -22.416 11.404 -1.710 1.00 0.65 H new ATOM 0 HB2 GLU B 3 -21.993 14.275 -2.144 1.00 0.93 H new ATOM 0 HB3 GLU B 3 -21.704 13.362 -3.612 1.00 0.93 H new ATOM 0 HG2 GLU B 3 -23.928 12.176 -3.247 1.00 0.89 H new ATOM 0 HG3 GLU B 3 -24.220 13.227 -1.876 1.00 0.89 H new ATOM 1535 N LYS B 4 -19.302 12.259 -2.392 1.00 0.65 N ATOM 1536 CA LYS B 4 -18.049 11.760 -3.039 1.00 0.57 C ATOM 1537 C LYS B 4 -16.837 12.172 -2.208 1.00 0.51 C ATOM 1538 O LYS B 4 -15.992 12.925 -2.648 1.00 0.47 O ATOM 1539 CB LYS B 4 -17.910 12.325 -4.452 1.00 0.60 C ATOM 1540 CG LYS B 4 -17.966 13.853 -4.419 1.00 1.06 C ATOM 1541 CD LYS B 4 -18.576 14.377 -5.726 1.00 1.25 C ATOM 1542 CE LYS B 4 -20.105 14.389 -5.632 1.00 1.83 C ATOM 1543 NZ LYS B 4 -20.669 15.045 -6.845 1.00 2.31 N ATOM 0 H LYS B 4 -19.203 13.133 -1.875 1.00 0.65 H new ATOM 0 HA LYS B 4 -18.102 10.673 -3.097 1.00 0.57 H new ATOM 0 HB2 LYS B 4 -16.967 11.998 -4.891 1.00 0.60 H new ATOM 0 HB3 LYS B 4 -18.708 11.938 -5.086 1.00 0.60 H new ATOM 0 HG2 LYS B 4 -18.562 14.186 -3.569 1.00 1.06 H new ATOM 0 HG3 LYS B 4 -16.964 14.260 -4.285 1.00 1.06 H new ATOM 0 HD2 LYS B 4 -18.209 15.383 -5.929 1.00 1.25 H new ATOM 0 HD3 LYS B 4 -18.261 13.749 -6.560 1.00 1.25 H new ATOM 0 HE2 LYS B 4 -20.483 13.370 -5.547 1.00 1.83 H new ATOM 0 HE3 LYS B 4 -20.421 14.923 -4.736 1.00 1.83 H new ATOM 0 HZ1 LYS B 4 -21.707 15.054 -6.784 1.00 2.31 H new ATOM 0 HZ2 LYS B 4 -20.317 16.022 -6.907 1.00 2.31 H new ATOM 0 HZ3 LYS B 4 -20.377 14.517 -7.692 1.00 2.31 H new ATOM 1557 N LEU B 5 -16.729 11.643 -1.022 1.00 0.55 N ATOM 1558 CA LEU B 5 -15.549 11.957 -0.160 1.00 0.57 C ATOM 1559 C LEU B 5 -15.680 11.163 1.148 1.00 0.76 C ATOM 1560 O LEU B 5 -15.682 11.711 2.233 1.00 1.59 O ATOM 1561 CB LEU B 5 -15.473 13.474 0.130 1.00 0.62 C ATOM 1562 CG LEU B 5 -14.012 13.938 0.065 1.00 0.90 C ATOM 1563 CD1 LEU B 5 -13.950 15.457 0.231 1.00 1.35 C ATOM 1564 CD2 LEU B 5 -13.213 13.273 1.188 1.00 1.62 C ATOM 0 H LEU B 5 -17.408 11.004 -0.608 1.00 0.55 H new ATOM 0 HA LEU B 5 -14.631 11.675 -0.675 1.00 0.57 H new ATOM 0 HB2 LEU B 5 -16.072 14.024 -0.596 1.00 0.62 H new ATOM 0 HB3 LEU B 5 -15.889 13.688 1.114 1.00 0.62 H new ATOM 0 HG LEU B 5 -13.587 13.659 -0.899 1.00 0.90 H new ATOM 0 HD11 LEU B 5 -12.912 15.786 0.185 1.00 1.35 H new ATOM 0 HD12 LEU B 5 -14.518 15.934 -0.568 1.00 1.35 H new ATOM 0 HD13 LEU B 5 -14.376 15.735 1.195 1.00 1.35 H new ATOM 0 HD21 LEU B 5 -12.175 13.603 1.141 1.00 1.62 H new ATOM 0 HD22 LEU B 5 -13.639 13.551 2.152 1.00 1.62 H new ATOM 0 HD23 LEU B 5 -13.255 12.190 1.072 1.00 1.62 H new ATOM 1576 N ASN B 6 -15.829 9.875 1.049 1.00 0.33 N ATOM 1577 CA ASN B 6 -16.012 9.049 2.273 1.00 0.35 C ATOM 1578 C ASN B 6 -14.687 8.535 2.816 1.00 0.29 C ATOM 1579 O ASN B 6 -14.097 7.622 2.276 1.00 0.32 O ATOM 1580 CB ASN B 6 -16.876 7.851 1.928 1.00 0.52 C ATOM 1581 CG ASN B 6 -18.168 7.896 2.741 1.00 0.62 C ATOM 1582 OD1 ASN B 6 -18.755 8.944 2.917 1.00 1.46 O ATOM 1583 ND2 ASN B 6 -18.637 6.792 3.253 1.00 0.99 N ATOM 0 H ASN B 6 -15.832 9.356 0.171 1.00 0.33 H new ATOM 0 HA ASN B 6 -16.477 9.677 3.033 1.00 0.35 H new ATOM 0 HB2 ASN B 6 -17.105 7.851 0.862 1.00 0.52 H new ATOM 0 HB3 ASN B 6 -16.335 6.928 2.138 1.00 0.52 H new ATOM 0 HD21 ASN B 6 -19.497 6.809 3.801 1.00 0.99 H new ATOM 0 HD22 ASN B 6 -18.144 5.911 3.105 1.00 0.99 H new ATOM 1590 N GLU B 7 -14.239 9.078 3.907 1.00 0.28 N ATOM 1591 CA GLU B 7 -12.983 8.576 4.511 1.00 0.30 C ATOM 1592 C GLU B 7 -13.362 7.521 5.552 1.00 0.32 C ATOM 1593 O GLU B 7 -14.053 7.806 6.510 1.00 0.37 O ATOM 1594 CB GLU B 7 -12.221 9.732 5.153 1.00 0.36 C ATOM 1595 CG GLU B 7 -12.927 10.183 6.434 1.00 0.53 C ATOM 1596 CD GLU B 7 -12.510 11.615 6.769 1.00 0.76 C ATOM 1597 OE1 GLU B 7 -12.841 12.503 6.001 1.00 1.49 O ATOM 1598 OE2 GLU B 7 -11.865 11.800 7.789 1.00 1.08 O ATOM 0 H GLU B 7 -14.688 9.846 4.406 1.00 0.28 H new ATOM 0 HA GLU B 7 -12.334 8.133 3.756 1.00 0.30 H new ATOM 0 HB2 GLU B 7 -11.201 9.423 5.381 1.00 0.36 H new ATOM 0 HB3 GLU B 7 -12.153 10.565 4.454 1.00 0.36 H new ATOM 0 HG2 GLU B 7 -14.008 10.129 6.305 1.00 0.53 H new ATOM 0 HG3 GLU B 7 -12.671 9.516 7.257 1.00 0.53 H new ATOM 1605 N ILE B 8 -12.955 6.294 5.342 1.00 0.33 N ATOM 1606 CA ILE B 8 -13.332 5.203 6.289 1.00 0.38 C ATOM 1607 C ILE B 8 -12.099 4.417 6.730 1.00 0.34 C ATOM 1608 O ILE B 8 -11.113 4.344 6.034 1.00 0.34 O ATOM 1609 CB ILE B 8 -14.294 4.252 5.579 1.00 0.42 C ATOM 1610 CG1 ILE B 8 -15.521 5.031 5.098 1.00 0.47 C ATOM 1611 CG2 ILE B 8 -14.734 3.153 6.545 1.00 0.62 C ATOM 1612 CD1 ILE B 8 -16.362 4.146 4.176 1.00 1.17 C ATOM 0 H ILE B 8 -12.377 6.002 4.554 1.00 0.33 H new ATOM 0 HA ILE B 8 -13.799 5.645 7.169 1.00 0.38 H new ATOM 0 HB ILE B 8 -13.791 3.801 4.723 1.00 0.42 H new ATOM 0 HG12 ILE B 8 -16.117 5.354 5.952 1.00 0.47 H new ATOM 0 HG13 ILE B 8 -15.208 5.931 4.569 1.00 0.47 H new ATOM 0 HG21 ILE B 8 -15.420 2.475 6.037 1.00 0.62 H new ATOM 0 HG22 ILE B 8 -13.861 2.597 6.886 1.00 0.62 H new ATOM 0 HG23 ILE B 8 -15.235 3.602 7.403 1.00 0.62 H new ATOM 0 HD11 ILE B 8 -17.235 4.702 3.835 1.00 1.17 H new ATOM 0 HD12 ILE B 8 -15.764 3.845 3.316 1.00 1.17 H new ATOM 0 HD13 ILE B 8 -16.687 3.259 4.720 1.00 1.17 H new ATOM 1624 N VAL B 9 -12.163 3.837 7.895 1.00 0.32 N ATOM 1625 CA VAL B 9 -11.011 3.045 8.417 1.00 0.30 C ATOM 1626 C VAL B 9 -11.319 1.544 8.332 1.00 0.27 C ATOM 1627 O VAL B 9 -12.337 1.078 8.804 1.00 0.28 O ATOM 1628 CB VAL B 9 -10.759 3.426 9.876 1.00 0.34 C ATOM 1629 CG1 VAL B 9 -11.913 2.922 10.742 1.00 1.37 C ATOM 1630 CG2 VAL B 9 -9.451 2.790 10.351 1.00 1.27 C ATOM 0 H VAL B 9 -12.972 3.877 8.515 1.00 0.32 H new ATOM 0 HA VAL B 9 -10.128 3.262 7.816 1.00 0.30 H new ATOM 0 HB VAL B 9 -10.688 4.510 9.960 1.00 0.34 H new ATOM 0 HG11 VAL B 9 -11.733 3.194 11.782 1.00 1.37 H new ATOM 0 HG12 VAL B 9 -12.846 3.375 10.405 1.00 1.37 H new ATOM 0 HG13 VAL B 9 -11.985 1.838 10.658 1.00 1.37 H new ATOM 0 HG21 VAL B 9 -9.271 3.062 11.391 1.00 1.27 H new ATOM 0 HG22 VAL B 9 -9.522 1.706 10.266 1.00 1.27 H new ATOM 0 HG23 VAL B 9 -8.627 3.149 9.735 1.00 1.27 H new ATOM 1640 N VAL B 10 -10.448 0.793 7.720 1.00 0.24 N ATOM 1641 CA VAL B 10 -10.704 -0.674 7.594 1.00 0.22 C ATOM 1642 C VAL B 10 -10.166 -1.352 8.851 1.00 0.20 C ATOM 1643 O VAL B 10 -9.451 -0.746 9.624 1.00 0.21 O ATOM 1644 CB VAL B 10 -10.008 -1.240 6.345 1.00 0.22 C ATOM 1645 CG1 VAL B 10 -8.526 -0.858 6.344 1.00 0.34 C ATOM 1646 CG2 VAL B 10 -10.132 -2.766 6.346 1.00 0.37 C ATOM 0 H VAL B 10 -9.577 1.124 7.304 1.00 0.24 H new ATOM 0 HA VAL B 10 -11.773 -0.859 7.489 1.00 0.22 H new ATOM 0 HB VAL B 10 -10.484 -0.825 5.456 1.00 0.22 H new ATOM 0 HG11 VAL B 10 -8.046 -1.265 5.454 1.00 0.34 H new ATOM 0 HG12 VAL B 10 -8.430 0.228 6.343 1.00 0.34 H new ATOM 0 HG13 VAL B 10 -8.045 -1.264 7.234 1.00 0.34 H new ATOM 0 HG21 VAL B 10 -9.640 -3.172 5.462 1.00 0.37 H new ATOM 0 HG22 VAL B 10 -9.659 -3.169 7.242 1.00 0.37 H new ATOM 0 HG23 VAL B 10 -11.186 -3.045 6.335 1.00 0.37 H new ATOM 1656 N ARG B 11 -10.527 -2.588 9.084 1.00 0.19 N ATOM 1657 CA ARG B 11 -10.056 -3.273 10.320 1.00 0.20 C ATOM 1658 C ARG B 11 -9.659 -4.715 10.025 1.00 0.21 C ATOM 1659 O ARG B 11 -9.842 -5.220 8.935 1.00 0.22 O ATOM 1660 CB ARG B 11 -11.173 -3.275 11.367 1.00 0.22 C ATOM 1661 CG ARG B 11 -12.254 -2.268 10.979 1.00 0.51 C ATOM 1662 CD ARG B 11 -13.312 -2.212 12.080 1.00 0.49 C ATOM 1663 NE ARG B 11 -13.148 -0.956 12.863 1.00 1.28 N ATOM 1664 CZ ARG B 11 -13.561 0.178 12.369 1.00 1.53 C ATOM 1665 NH1 ARG B 11 -14.129 0.211 11.195 1.00 1.59 N ATOM 1666 NH2 ARG B 11 -13.407 1.281 13.051 1.00 2.37 N ATOM 0 H ARG B 11 -11.124 -3.148 8.475 1.00 0.19 H new ATOM 0 HA ARG B 11 -9.187 -2.734 10.696 1.00 0.20 H new ATOM 0 HB2 ARG B 11 -11.605 -4.272 11.448 1.00 0.22 H new ATOM 0 HB3 ARG B 11 -10.765 -3.024 12.346 1.00 0.22 H new ATOM 0 HG2 ARG B 11 -11.813 -1.282 10.833 1.00 0.51 H new ATOM 0 HG3 ARG B 11 -12.712 -2.556 10.033 1.00 0.51 H new ATOM 0 HD2 ARG B 11 -14.310 -2.253 11.643 1.00 0.49 H new ATOM 0 HD3 ARG B 11 -13.216 -3.077 12.736 1.00 0.49 H new ATOM 0 HE ARG B 11 -12.713 -0.983 13.785 1.00 1.28 H new ATOM 0 HH11 ARG B 11 -14.250 -0.651 10.663 1.00 1.59 H new ATOM 0 HH12 ARG B 11 -14.452 1.098 10.809 1.00 1.59 H new ATOM 0 HH21 ARG B 11 -12.964 1.255 13.969 1.00 2.37 H new ATOM 0 HH22 ARG B 11 -13.730 2.168 12.665 1.00 2.37 H new ATOM 1680 N LYS B 12 -9.124 -5.372 11.012 1.00 0.22 N ATOM 1681 CA LYS B 12 -8.707 -6.786 10.847 1.00 0.25 C ATOM 1682 C LYS B 12 -9.754 -7.667 11.500 1.00 0.25 C ATOM 1683 O LYS B 12 -9.788 -8.866 11.308 1.00 0.31 O ATOM 1684 CB LYS B 12 -7.369 -7.001 11.542 1.00 0.31 C ATOM 1685 CG LYS B 12 -7.547 -6.839 13.053 1.00 0.43 C ATOM 1686 CD LYS B 12 -6.322 -6.132 13.638 1.00 1.00 C ATOM 1687 CE LYS B 12 -6.275 -6.358 15.151 1.00 0.99 C ATOM 1688 NZ LYS B 12 -6.113 -7.813 15.431 1.00 1.75 N ATOM 0 H LYS B 12 -8.956 -4.982 11.939 1.00 0.22 H new ATOM 0 HA LYS B 12 -8.608 -7.031 9.789 1.00 0.25 H new ATOM 0 HB2 LYS B 12 -6.985 -7.995 11.315 1.00 0.31 H new ATOM 0 HB3 LYS B 12 -6.636 -6.284 11.173 1.00 0.31 H new ATOM 0 HG2 LYS B 12 -8.448 -6.263 13.264 1.00 0.43 H new ATOM 0 HG3 LYS B 12 -7.675 -7.815 13.522 1.00 0.43 H new ATOM 0 HD2 LYS B 12 -5.413 -6.514 13.174 1.00 1.00 H new ATOM 0 HD3 LYS B 12 -6.367 -5.065 13.420 1.00 1.00 H new ATOM 0 HE2 LYS B 12 -5.448 -5.798 15.588 1.00 0.99 H new ATOM 0 HE3 LYS B 12 -7.190 -5.987 15.613 1.00 0.99 H new ATOM 0 HZ1 LYS B 12 -5.716 -7.941 16.383 1.00 1.75 H new ATOM 0 HZ2 LYS B 12 -7.040 -8.282 15.376 1.00 1.75 H new ATOM 0 HZ3 LYS B 12 -5.471 -8.232 14.729 1.00 1.75 H new ATOM 1702 N THR B 13 -10.619 -7.073 12.268 1.00 0.25 N ATOM 1703 CA THR B 13 -11.675 -7.872 12.929 1.00 0.36 C ATOM 1704 C THR B 13 -12.829 -8.030 11.946 1.00 0.49 C ATOM 1705 O THR B 13 -13.733 -8.818 12.143 1.00 0.91 O ATOM 1706 CB THR B 13 -12.158 -7.157 14.193 1.00 0.45 C ATOM 1707 OG1 THR B 13 -13.418 -7.685 14.582 1.00 1.19 O ATOM 1708 CG2 THR B 13 -12.293 -5.659 13.919 1.00 1.07 C ATOM 0 H THR B 13 -10.639 -6.072 12.465 1.00 0.25 H new ATOM 0 HA THR B 13 -11.286 -8.849 13.216 1.00 0.36 H new ATOM 0 HB THR B 13 -11.435 -7.311 14.994 1.00 0.45 H new ATOM 0 HG1 THR B 13 -13.728 -7.229 15.392 1.00 1.19 H new ATOM 0 HG21 THR B 13 -12.637 -5.154 14.821 1.00 1.07 H new ATOM 0 HG22 THR B 13 -11.325 -5.255 13.623 1.00 1.07 H new ATOM 0 HG23 THR B 13 -13.013 -5.499 13.117 1.00 1.07 H new ATOM 1716 N LYS B 14 -12.767 -7.315 10.858 1.00 0.31 N ATOM 1717 CA LYS B 14 -13.812 -7.437 9.809 1.00 0.38 C ATOM 1718 C LYS B 14 -13.331 -8.482 8.802 1.00 0.44 C ATOM 1719 O LYS B 14 -12.912 -9.563 9.167 1.00 1.02 O ATOM 1720 CB LYS B 14 -13.997 -6.085 9.108 1.00 0.41 C ATOM 1721 CG LYS B 14 -14.541 -5.047 10.100 1.00 0.68 C ATOM 1722 CD LYS B 14 -16.006 -5.340 10.446 1.00 0.90 C ATOM 1723 CE LYS B 14 -16.118 -5.721 11.925 1.00 1.34 C ATOM 1724 NZ LYS B 14 -17.544 -5.995 12.257 1.00 1.47 N ATOM 0 H LYS B 14 -12.027 -6.644 10.650 1.00 0.31 H new ATOM 0 HA LYS B 14 -14.766 -7.735 10.244 1.00 0.38 H new ATOM 0 HB2 LYS B 14 -13.045 -5.745 8.699 1.00 0.41 H new ATOM 0 HB3 LYS B 14 -14.684 -6.193 8.269 1.00 0.41 H new ATOM 0 HG2 LYS B 14 -13.939 -5.056 11.009 1.00 0.68 H new ATOM 0 HG3 LYS B 14 -14.457 -4.048 9.671 1.00 0.68 H new ATOM 0 HD2 LYS B 14 -16.621 -4.465 10.238 1.00 0.90 H new ATOM 0 HD3 LYS B 14 -16.383 -6.150 9.822 1.00 0.90 H new ATOM 0 HE2 LYS B 14 -15.509 -6.601 12.133 1.00 1.34 H new ATOM 0 HE3 LYS B 14 -15.736 -4.914 12.550 1.00 1.34 H new ATOM 0 HZ1 LYS B 14 -17.623 -6.254 13.261 1.00 1.47 H new ATOM 0 HZ2 LYS B 14 -18.113 -5.144 12.073 1.00 1.47 H new ATOM 0 HZ3 LYS B 14 -17.893 -6.778 11.669 1.00 1.47 H new ATOM 1738 N ASN B 15 -13.359 -8.163 7.540 1.00 0.41 N ATOM 1739 CA ASN B 15 -12.878 -9.133 6.520 1.00 0.31 C ATOM 1740 C ASN B 15 -12.738 -8.425 5.174 1.00 0.26 C ATOM 1741 O ASN B 15 -13.340 -7.398 4.930 1.00 0.30 O ATOM 1742 CB ASN B 15 -13.869 -10.294 6.392 1.00 0.39 C ATOM 1743 CG ASN B 15 -13.230 -11.576 6.931 1.00 0.53 C ATOM 1744 OD1 ASN B 15 -13.176 -11.783 8.128 1.00 1.22 O ATOM 1745 ND2 ASN B 15 -12.741 -12.451 6.095 1.00 1.21 N ATOM 0 H ASN B 15 -13.694 -7.273 7.171 1.00 0.41 H new ATOM 0 HA ASN B 15 -11.910 -9.527 6.828 1.00 0.31 H new ATOM 0 HB2 ASN B 15 -14.781 -10.070 6.945 1.00 0.39 H new ATOM 0 HB3 ASN B 15 -14.154 -10.429 5.349 1.00 0.39 H new ATOM 0 HD21 ASN B 15 -12.314 -13.308 6.446 1.00 1.21 H new ATOM 0 HD22 ASN B 15 -12.786 -12.278 5.091 1.00 1.21 H new ATOM 1752 N VAL B 16 -11.953 -8.978 4.297 1.00 0.24 N ATOM 1753 CA VAL B 16 -11.779 -8.349 2.960 1.00 0.25 C ATOM 1754 C VAL B 16 -13.150 -8.236 2.308 1.00 0.24 C ATOM 1755 O VAL B 16 -13.494 -7.244 1.685 1.00 0.25 O ATOM 1756 CB VAL B 16 -10.882 -9.228 2.084 1.00 0.28 C ATOM 1757 CG1 VAL B 16 -9.577 -9.533 2.817 1.00 0.26 C ATOM 1758 CG2 VAL B 16 -11.608 -10.539 1.773 1.00 0.45 C ATOM 0 H VAL B 16 -11.424 -9.837 4.447 1.00 0.24 H new ATOM 0 HA VAL B 16 -11.319 -7.367 3.068 1.00 0.25 H new ATOM 0 HB VAL B 16 -10.657 -8.701 1.157 1.00 0.28 H new ATOM 0 HG11 VAL B 16 -8.944 -10.159 2.188 1.00 0.26 H new ATOM 0 HG12 VAL B 16 -9.058 -8.601 3.040 1.00 0.26 H new ATOM 0 HG13 VAL B 16 -9.796 -10.058 3.747 1.00 0.26 H new ATOM 0 HG21 VAL B 16 -10.973 -11.168 1.149 1.00 0.45 H new ATOM 0 HG22 VAL B 16 -11.833 -11.060 2.704 1.00 0.45 H new ATOM 0 HG23 VAL B 16 -12.537 -10.324 1.244 1.00 0.45 H new ATOM 1768 N GLU B 17 -13.951 -9.245 2.477 1.00 0.24 N ATOM 1769 CA GLU B 17 -15.306 -9.220 1.890 1.00 0.27 C ATOM 1770 C GLU B 17 -16.185 -8.302 2.720 1.00 0.28 C ATOM 1771 O GLU B 17 -17.069 -7.653 2.207 1.00 0.30 O ATOM 1772 CB GLU B 17 -15.892 -10.638 1.868 1.00 0.37 C ATOM 1773 CG GLU B 17 -16.628 -10.934 3.180 1.00 0.79 C ATOM 1774 CD GLU B 17 -16.884 -12.436 3.292 1.00 1.09 C ATOM 1775 OE1 GLU B 17 -17.032 -13.070 2.261 1.00 1.53 O ATOM 1776 OE2 GLU B 17 -16.929 -12.927 4.408 1.00 1.70 O ATOM 0 H GLU B 17 -13.720 -10.090 3.000 1.00 0.24 H new ATOM 0 HA GLU B 17 -15.258 -8.850 0.866 1.00 0.27 H new ATOM 0 HB2 GLU B 17 -16.578 -10.741 1.028 1.00 0.37 H new ATOM 0 HB3 GLU B 17 -15.094 -11.366 1.719 1.00 0.37 H new ATOM 0 HG2 GLU B 17 -16.035 -10.591 4.028 1.00 0.79 H new ATOM 0 HG3 GLU B 17 -17.572 -10.390 3.211 1.00 0.79 H new ATOM 1783 N ASP B 18 -15.976 -8.248 4.004 1.00 0.29 N ATOM 1784 CA ASP B 18 -16.827 -7.395 4.858 1.00 0.35 C ATOM 1785 C ASP B 18 -16.679 -5.918 4.502 1.00 0.32 C ATOM 1786 O ASP B 18 -17.641 -5.177 4.595 1.00 0.32 O ATOM 1787 CB ASP B 18 -16.418 -7.617 6.311 1.00 0.43 C ATOM 1788 CG ASP B 18 -17.255 -6.729 7.234 1.00 0.66 C ATOM 1789 OD1 ASP B 18 -17.272 -5.529 7.018 1.00 1.46 O ATOM 1790 OD2 ASP B 18 -17.864 -7.267 8.144 1.00 1.19 O ATOM 0 H ASP B 18 -15.246 -8.763 4.496 1.00 0.29 H new ATOM 0 HA ASP B 18 -17.871 -7.666 4.702 1.00 0.35 H new ATOM 0 HB2 ASP B 18 -16.554 -8.665 6.579 1.00 0.43 H new ATOM 0 HB3 ASP B 18 -15.359 -7.391 6.438 1.00 0.43 H new ATOM 1795 N HIS B 19 -15.527 -5.451 4.072 1.00 0.31 N ATOM 1796 CA HIS B 19 -15.424 -4.012 3.714 1.00 0.31 C ATOM 1797 C HIS B 19 -15.726 -3.873 2.225 1.00 0.27 C ATOM 1798 O HIS B 19 -16.067 -2.810 1.747 1.00 0.30 O ATOM 1799 CB HIS B 19 -14.010 -3.505 4.007 1.00 0.35 C ATOM 1800 CG HIS B 19 -14.044 -2.600 5.207 1.00 0.49 C ATOM 1801 ND1 HIS B 19 -14.280 -3.078 6.488 1.00 1.21 N ATOM 1802 CD2 HIS B 19 -13.880 -1.242 5.336 1.00 1.40 C ATOM 1803 CE1 HIS B 19 -14.252 -2.023 7.326 1.00 1.22 C ATOM 1804 NE2 HIS B 19 -14.013 -0.884 6.673 1.00 1.39 N ATOM 0 H HIS B 19 -14.674 -5.998 3.958 1.00 0.31 H new ATOM 0 HA HIS B 19 -16.131 -3.424 4.299 1.00 0.31 H new ATOM 0 HB2 HIS B 19 -13.341 -4.346 4.190 1.00 0.35 H new ATOM 0 HB3 HIS B 19 -13.618 -2.968 3.143 1.00 0.35 H new ATOM 0 HD2 HIS B 19 -13.679 -0.558 4.524 1.00 1.40 H new ATOM 0 HE1 HIS B 19 -14.404 -2.091 8.393 1.00 1.22 H new ATOM 0 HE2 HIS B 19 -13.943 0.052 7.071 1.00 1.39 H new ATOM 1813 N VAL B 20 -15.686 -4.963 1.499 1.00 0.23 N ATOM 1814 CA VAL B 20 -16.064 -4.887 0.065 1.00 0.22 C ATOM 1815 C VAL B 20 -17.584 -4.723 0.078 1.00 0.22 C ATOM 1816 O VAL B 20 -18.174 -4.026 -0.723 1.00 0.23 O ATOM 1817 CB VAL B 20 -15.625 -6.179 -0.660 1.00 0.25 C ATOM 1818 CG1 VAL B 20 -16.829 -7.067 -1.001 1.00 0.34 C ATOM 1819 CG2 VAL B 20 -14.886 -5.825 -1.952 1.00 0.34 C ATOM 0 H VAL B 20 -15.412 -5.886 1.835 1.00 0.23 H new ATOM 0 HA VAL B 20 -15.584 -4.065 -0.467 1.00 0.22 H new ATOM 0 HB VAL B 20 -14.966 -6.729 0.012 1.00 0.25 H new ATOM 0 HG11 VAL B 20 -16.485 -7.967 -1.510 1.00 0.34 H new ATOM 0 HG12 VAL B 20 -17.348 -7.345 -0.083 1.00 0.34 H new ATOM 0 HG13 VAL B 20 -17.511 -6.521 -1.652 1.00 0.34 H new ATOM 0 HG21 VAL B 20 -14.579 -6.740 -2.458 1.00 0.34 H new ATOM 0 HG22 VAL B 20 -15.547 -5.254 -2.604 1.00 0.34 H new ATOM 0 HG23 VAL B 20 -14.005 -5.229 -1.715 1.00 0.34 H new ATOM 1829 N LEU B 21 -18.196 -5.372 1.030 1.00 0.23 N ATOM 1830 CA LEU B 21 -19.671 -5.296 1.194 1.00 0.26 C ATOM 1831 C LEU B 21 -20.059 -3.885 1.632 1.00 0.26 C ATOM 1832 O LEU B 21 -20.926 -3.258 1.052 1.00 0.27 O ATOM 1833 CB LEU B 21 -20.120 -6.279 2.278 1.00 0.29 C ATOM 1834 CG LEU B 21 -20.132 -7.713 1.729 1.00 0.32 C ATOM 1835 CD1 LEU B 21 -20.424 -8.692 2.868 1.00 0.36 C ATOM 1836 CD2 LEU B 21 -21.214 -7.862 0.652 1.00 0.38 C ATOM 0 H LEU B 21 -17.724 -5.963 1.714 1.00 0.23 H new ATOM 0 HA LEU B 21 -20.148 -5.543 0.246 1.00 0.26 H new ATOM 0 HB2 LEU B 21 -19.449 -6.217 3.135 1.00 0.29 H new ATOM 0 HB3 LEU B 21 -21.115 -6.010 2.632 1.00 0.29 H new ATOM 0 HG LEU B 21 -19.158 -7.929 1.291 1.00 0.32 H new ATOM 0 HD11 LEU B 21 -20.433 -9.710 2.479 1.00 0.36 H new ATOM 0 HD12 LEU B 21 -19.652 -8.602 3.632 1.00 0.36 H new ATOM 0 HD13 LEU B 21 -21.396 -8.462 3.305 1.00 0.36 H new ATOM 0 HD21 LEU B 21 -21.211 -8.884 0.272 1.00 0.38 H new ATOM 0 HD22 LEU B 21 -22.190 -7.638 1.083 1.00 0.38 H new ATOM 0 HD23 LEU B 21 -21.011 -7.170 -0.166 1.00 0.38 H new ATOM 1848 N ASP B 22 -19.424 -3.370 2.648 1.00 0.27 N ATOM 1849 CA ASP B 22 -19.768 -1.997 3.110 1.00 0.30 C ATOM 1850 C ASP B 22 -19.356 -0.984 2.038 1.00 0.28 C ATOM 1851 O ASP B 22 -19.988 0.036 1.850 1.00 0.31 O ATOM 1852 CB ASP B 22 -19.022 -1.692 4.410 1.00 0.33 C ATOM 1853 CG ASP B 22 -19.751 -0.581 5.168 1.00 0.42 C ATOM 1854 OD1 ASP B 22 -20.734 -0.885 5.824 1.00 1.00 O ATOM 1855 OD2 ASP B 22 -19.315 0.554 5.080 1.00 1.21 O ATOM 0 H ASP B 22 -18.686 -3.837 3.175 1.00 0.27 H new ATOM 0 HA ASP B 22 -20.842 -1.930 3.284 1.00 0.30 H new ATOM 0 HB2 ASP B 22 -18.962 -2.589 5.027 1.00 0.33 H new ATOM 0 HB3 ASP B 22 -17.999 -1.387 4.192 1.00 0.33 H new ATOM 1860 N VAL B 23 -18.289 -1.264 1.343 1.00 0.26 N ATOM 1861 CA VAL B 23 -17.815 -0.321 0.288 1.00 0.27 C ATOM 1862 C VAL B 23 -18.842 -0.268 -0.846 1.00 0.26 C ATOM 1863 O VAL B 23 -19.296 0.791 -1.230 1.00 0.28 O ATOM 1864 CB VAL B 23 -16.466 -0.793 -0.259 1.00 0.26 C ATOM 1865 CG1 VAL B 23 -16.159 -0.058 -1.565 1.00 0.29 C ATOM 1866 CG2 VAL B 23 -15.370 -0.486 0.762 1.00 0.30 C ATOM 0 H VAL B 23 -17.724 -2.105 1.459 1.00 0.26 H new ATOM 0 HA VAL B 23 -17.698 0.674 0.718 1.00 0.27 H new ATOM 0 HB VAL B 23 -16.505 -1.866 -0.445 1.00 0.26 H new ATOM 0 HG11 VAL B 23 -15.198 -0.394 -1.955 1.00 0.29 H new ATOM 0 HG12 VAL B 23 -16.941 -0.270 -2.294 1.00 0.29 H new ATOM 0 HG13 VAL B 23 -16.119 1.015 -1.378 1.00 0.29 H new ATOM 0 HG21 VAL B 23 -14.408 -0.821 0.375 1.00 0.30 H new ATOM 0 HG22 VAL B 23 -15.333 0.588 0.945 1.00 0.30 H new ATOM 0 HG23 VAL B 23 -15.586 -1.006 1.695 1.00 0.30 H new ATOM 1876 N ILE B 24 -19.221 -1.395 -1.382 1.00 0.23 N ATOM 1877 CA ILE B 24 -20.224 -1.385 -2.483 1.00 0.25 C ATOM 1878 C ILE B 24 -21.557 -0.873 -1.938 1.00 0.26 C ATOM 1879 O ILE B 24 -22.413 -0.436 -2.681 1.00 0.28 O ATOM 1880 CB ILE B 24 -20.389 -2.803 -3.047 1.00 0.27 C ATOM 1881 CG1 ILE B 24 -20.762 -2.720 -4.529 1.00 0.46 C ATOM 1882 CG2 ILE B 24 -21.492 -3.551 -2.293 1.00 0.36 C ATOM 1883 CD1 ILE B 24 -20.956 -4.131 -5.085 1.00 0.69 C ATOM 0 H ILE B 24 -18.882 -2.317 -1.107 1.00 0.23 H new ATOM 0 HA ILE B 24 -19.887 -0.729 -3.285 1.00 0.25 H new ATOM 0 HB ILE B 24 -19.448 -3.341 -2.928 1.00 0.27 H new ATOM 0 HG12 ILE B 24 -21.676 -2.140 -4.653 1.00 0.46 H new ATOM 0 HG13 ILE B 24 -19.979 -2.203 -5.084 1.00 0.46 H new ATOM 0 HG21 ILE B 24 -21.597 -4.555 -2.704 1.00 0.36 H new ATOM 0 HG22 ILE B 24 -21.230 -3.617 -1.237 1.00 0.36 H new ATOM 0 HG23 ILE B 24 -22.435 -3.014 -2.400 1.00 0.36 H new ATOM 0 HD11 ILE B 24 -21.222 -4.073 -6.141 1.00 0.69 H new ATOM 0 HD12 ILE B 24 -20.031 -4.696 -4.974 1.00 0.69 H new ATOM 0 HD13 ILE B 24 -21.754 -4.631 -4.537 1.00 0.69 H new ATOM 1895 N VAL B 25 -21.741 -0.917 -0.645 1.00 0.27 N ATOM 1896 CA VAL B 25 -23.021 -0.423 -0.066 1.00 0.30 C ATOM 1897 C VAL B 25 -23.041 1.108 -0.081 1.00 0.30 C ATOM 1898 O VAL B 25 -24.025 1.715 -0.450 1.00 0.32 O ATOM 1899 CB VAL B 25 -23.162 -0.911 1.373 1.00 0.33 C ATOM 1900 CG1 VAL B 25 -24.297 -0.148 2.058 1.00 0.42 C ATOM 1901 CG2 VAL B 25 -23.480 -2.408 1.376 1.00 0.37 C ATOM 0 H VAL B 25 -21.064 -1.272 0.030 1.00 0.27 H new ATOM 0 HA VAL B 25 -23.849 -0.805 -0.663 1.00 0.30 H new ATOM 0 HB VAL B 25 -22.229 -0.737 1.910 1.00 0.33 H new ATOM 0 HG11 VAL B 25 -24.400 -0.495 3.086 1.00 0.42 H new ATOM 0 HG12 VAL B 25 -24.072 0.918 2.056 1.00 0.42 H new ATOM 0 HG13 VAL B 25 -25.229 -0.323 1.521 1.00 0.42 H new ATOM 0 HG21 VAL B 25 -23.581 -2.757 2.404 1.00 0.37 H new ATOM 0 HG22 VAL B 25 -24.413 -2.583 0.841 1.00 0.37 H new ATOM 0 HG23 VAL B 25 -22.673 -2.952 0.886 1.00 0.37 H new ATOM 1911 N LEU B 26 -21.974 1.748 0.323 1.00 0.30 N ATOM 1912 CA LEU B 26 -21.956 3.239 0.330 1.00 0.32 C ATOM 1913 C LEU B 26 -21.981 3.766 -1.109 1.00 0.31 C ATOM 1914 O LEU B 26 -22.624 4.753 -1.417 1.00 0.33 O ATOM 1915 CB LEU B 26 -20.679 3.704 1.030 1.00 0.35 C ATOM 1916 CG LEU B 26 -20.992 4.053 2.486 1.00 0.61 C ATOM 1917 CD1 LEU B 26 -19.697 4.063 3.300 1.00 0.47 C ATOM 1918 CD2 LEU B 26 -21.652 5.433 2.557 1.00 1.15 C ATOM 0 H LEU B 26 -21.116 1.302 0.648 1.00 0.30 H new ATOM 0 HA LEU B 26 -22.831 3.620 0.857 1.00 0.32 H new ATOM 0 HB2 LEU B 26 -19.923 2.920 0.988 1.00 0.35 H new ATOM 0 HB3 LEU B 26 -20.267 4.573 0.517 1.00 0.35 H new ATOM 0 HG LEU B 26 -21.673 3.307 2.896 1.00 0.61 H new ATOM 0 HD11 LEU B 26 -19.921 4.312 4.337 1.00 0.47 H new ATOM 0 HD12 LEU B 26 -19.232 3.078 3.255 1.00 0.47 H new ATOM 0 HD13 LEU B 26 -19.014 4.806 2.888 1.00 0.47 H new ATOM 0 HD21 LEU B 26 -21.873 5.677 3.596 1.00 1.15 H new ATOM 0 HD22 LEU B 26 -20.976 6.181 2.144 1.00 1.15 H new ATOM 0 HD23 LEU B 26 -22.578 5.424 1.981 1.00 1.15 H new ATOM 1930 N PHE B 27 -21.312 3.092 -1.999 1.00 0.29 N ATOM 1931 CA PHE B 27 -21.333 3.531 -3.421 1.00 0.31 C ATOM 1932 C PHE B 27 -22.795 3.533 -3.844 1.00 0.32 C ATOM 1933 O PHE B 27 -23.236 4.305 -4.672 1.00 0.34 O ATOM 1934 CB PHE B 27 -20.541 2.548 -4.284 1.00 0.32 C ATOM 1935 CG PHE B 27 -21.079 2.573 -5.694 1.00 0.42 C ATOM 1936 CD1 PHE B 27 -20.839 3.681 -6.517 1.00 1.18 C ATOM 1937 CD2 PHE B 27 -21.819 1.488 -6.181 1.00 1.37 C ATOM 1938 CE1 PHE B 27 -21.340 3.704 -7.823 1.00 1.22 C ATOM 1939 CE2 PHE B 27 -22.319 1.512 -7.488 1.00 1.46 C ATOM 1940 CZ PHE B 27 -22.079 2.620 -8.310 1.00 0.70 C ATOM 0 H PHE B 27 -20.754 2.260 -1.806 1.00 0.29 H new ATOM 0 HA PHE B 27 -20.882 4.516 -3.540 1.00 0.31 H new ATOM 0 HB2 PHE B 27 -19.484 2.814 -4.281 1.00 0.32 H new ATOM 0 HB3 PHE B 27 -20.617 1.542 -3.872 1.00 0.32 H new ATOM 0 HD1 PHE B 27 -20.267 4.517 -6.143 1.00 1.18 H new ATOM 0 HD2 PHE B 27 -22.004 0.633 -5.548 1.00 1.37 H new ATOM 0 HE1 PHE B 27 -21.156 4.559 -8.456 1.00 1.22 H new ATOM 0 HE2 PHE B 27 -22.890 0.676 -7.863 1.00 1.46 H new ATOM 0 HZ PHE B 27 -22.464 2.638 -9.319 1.00 0.70 H new ATOM 1950 N ASN B 28 -23.540 2.662 -3.234 1.00 0.31 N ATOM 1951 CA ASN B 28 -24.993 2.566 -3.527 1.00 0.34 C ATOM 1952 C ASN B 28 -25.661 3.903 -3.200 1.00 0.35 C ATOM 1953 O ASN B 28 -26.675 4.252 -3.772 1.00 0.36 O ATOM 1954 CB ASN B 28 -25.615 1.466 -2.676 1.00 0.36 C ATOM 1955 CG ASN B 28 -26.717 0.766 -3.473 1.00 0.43 C ATOM 1956 OD1 ASN B 28 -26.510 -0.306 -4.005 1.00 1.17 O ATOM 1957 ND2 ASN B 28 -27.887 1.334 -3.579 1.00 0.97 N ATOM 0 H ASN B 28 -23.200 2.002 -2.534 1.00 0.31 H new ATOM 0 HA ASN B 28 -25.138 2.331 -4.581 1.00 0.34 H new ATOM 0 HB2 ASN B 28 -24.852 0.746 -2.380 1.00 0.36 H new ATOM 0 HB3 ASN B 28 -26.027 1.889 -1.760 1.00 0.36 H new ATOM 0 HD21 ASN B 28 -28.629 0.878 -4.109 1.00 0.97 H new ATOM 0 HD22 ASN B 28 -28.059 2.234 -3.132 1.00 0.97 H new ATOM 1964 N GLN B 29 -25.104 4.660 -2.291 1.00 0.35 N ATOM 1965 CA GLN B 29 -25.713 5.976 -1.944 1.00 0.38 C ATOM 1966 C GLN B 29 -25.083 7.069 -2.808 1.00 0.39 C ATOM 1967 O GLN B 29 -25.446 8.226 -2.722 1.00 0.44 O ATOM 1968 CB GLN B 29 -25.456 6.291 -0.469 1.00 0.39 C ATOM 1969 CG GLN B 29 -25.917 5.117 0.396 1.00 0.39 C ATOM 1970 CD GLN B 29 -25.624 5.427 1.865 1.00 0.42 C ATOM 1971 OE1 GLN B 29 -26.360 5.018 2.742 1.00 1.12 O ATOM 1972 NE2 GLN B 29 -24.576 6.140 2.173 1.00 1.17 N ATOM 0 H GLN B 29 -24.256 4.424 -1.776 1.00 0.35 H new ATOM 0 HA GLN B 29 -26.787 5.935 -2.125 1.00 0.38 H new ATOM 0 HB2 GLN B 29 -24.395 6.480 -0.307 1.00 0.39 H new ATOM 0 HB3 GLN B 29 -25.989 7.198 -0.182 1.00 0.39 H new ATOM 0 HG2 GLN B 29 -26.984 4.943 0.255 1.00 0.39 H new ATOM 0 HG3 GLN B 29 -25.402 4.204 0.095 1.00 0.39 H new ATOM 0 HE21 GLN B 29 -23.958 6.483 1.437 1.00 1.17 H new ATOM 0 HE22 GLN B 29 -24.374 6.354 3.150 1.00 1.17 H new ATOM 1981 N GLY B 30 -24.151 6.702 -3.646 1.00 0.35 N ATOM 1982 CA GLY B 30 -23.492 7.704 -4.536 1.00 0.38 C ATOM 1983 C GLY B 30 -22.054 7.973 -4.080 1.00 0.34 C ATOM 1984 O GLY B 30 -21.428 8.912 -4.529 1.00 0.36 O ATOM 0 H GLY B 30 -23.815 5.745 -3.754 1.00 0.35 H new ATOM 0 HA2 GLY B 30 -23.491 7.340 -5.563 1.00 0.38 H new ATOM 0 HA3 GLY B 30 -24.061 8.634 -4.528 1.00 0.38 H new ATOM 1988 N ILE B 31 -21.504 7.153 -3.219 1.00 0.31 N ATOM 1989 CA ILE B 31 -20.096 7.384 -2.789 1.00 0.29 C ATOM 1990 C ILE B 31 -19.177 6.882 -3.897 1.00 0.26 C ATOM 1991 O ILE B 31 -18.978 5.696 -4.064 1.00 0.25 O ATOM 1992 CB ILE B 31 -19.823 6.629 -1.476 1.00 0.29 C ATOM 1993 CG1 ILE B 31 -20.483 7.368 -0.288 1.00 0.41 C ATOM 1994 CG2 ILE B 31 -18.314 6.502 -1.234 1.00 0.31 C ATOM 1995 CD1 ILE B 31 -19.966 8.811 -0.158 1.00 0.59 C ATOM 0 H ILE B 31 -21.964 6.344 -2.801 1.00 0.31 H new ATOM 0 HA ILE B 31 -19.917 8.445 -2.613 1.00 0.29 H new ATOM 0 HB ILE B 31 -20.252 5.630 -1.558 1.00 0.29 H new ATOM 0 HG12 ILE B 31 -21.565 7.380 -0.422 1.00 0.41 H new ATOM 0 HG13 ILE B 31 -20.282 6.825 0.635 1.00 0.41 H new ATOM 0 HG21 ILE B 31 -18.139 5.966 -0.301 1.00 0.31 H new ATOM 0 HG22 ILE B 31 -17.858 5.954 -2.059 1.00 0.31 H new ATOM 0 HG23 ILE B 31 -17.871 7.496 -1.170 1.00 0.31 H new ATOM 0 HD11 ILE B 31 -20.453 9.297 0.687 1.00 0.59 H new ATOM 0 HD12 ILE B 31 -18.888 8.798 0.002 1.00 0.59 H new ATOM 0 HD13 ILE B 31 -20.190 9.362 -1.072 1.00 0.59 H new ATOM 2007 N ASP B 32 -18.596 7.777 -4.648 1.00 0.27 N ATOM 2008 CA ASP B 32 -17.674 7.352 -5.731 1.00 0.27 C ATOM 2009 C ASP B 32 -16.251 7.294 -5.184 1.00 0.27 C ATOM 2010 O ASP B 32 -15.473 6.429 -5.535 1.00 0.29 O ATOM 2011 CB ASP B 32 -17.740 8.355 -6.885 1.00 0.29 C ATOM 2012 CG ASP B 32 -19.045 8.160 -7.660 1.00 0.66 C ATOM 2013 OD1 ASP B 32 -19.810 7.287 -7.283 1.00 1.46 O ATOM 2014 OD2 ASP B 32 -19.256 8.885 -8.618 1.00 1.25 O ATOM 0 H ASP B 32 -18.722 8.785 -4.556 1.00 0.27 H new ATOM 0 HA ASP B 32 -17.967 6.367 -6.095 1.00 0.27 H new ATOM 0 HB2 ASP B 32 -17.683 9.373 -6.499 1.00 0.29 H new ATOM 0 HB3 ASP B 32 -16.887 8.217 -7.549 1.00 0.29 H new ATOM 2019 N GLU B 33 -15.906 8.239 -4.345 1.00 0.27 N ATOM 2020 CA GLU B 33 -14.537 8.283 -3.774 1.00 0.28 C ATOM 2021 C GLU B 33 -14.544 7.739 -2.350 1.00 0.26 C ATOM 2022 O GLU B 33 -15.408 8.059 -1.556 1.00 0.28 O ATOM 2023 CB GLU B 33 -14.034 9.725 -3.762 1.00 0.30 C ATOM 2024 CG GLU B 33 -13.218 9.988 -5.030 1.00 0.60 C ATOM 2025 CD GLU B 33 -13.205 11.486 -5.334 1.00 0.49 C ATOM 2026 OE1 GLU B 33 -12.946 12.253 -4.421 1.00 1.08 O ATOM 2027 OE2 GLU B 33 -13.451 11.842 -6.474 1.00 1.20 O ATOM 0 H GLU B 33 -16.525 8.987 -4.032 1.00 0.27 H new ATOM 0 HA GLU B 33 -13.878 7.669 -4.388 1.00 0.28 H new ATOM 0 HB2 GLU B 33 -14.876 10.415 -3.708 1.00 0.30 H new ATOM 0 HB3 GLU B 33 -13.421 9.901 -2.878 1.00 0.30 H new ATOM 0 HG2 GLU B 33 -12.199 9.625 -4.900 1.00 0.60 H new ATOM 0 HG3 GLU B 33 -13.646 9.441 -5.870 1.00 0.60 H new ATOM 2034 N VAL B 34 -13.594 6.910 -2.026 1.00 0.25 N ATOM 2035 CA VAL B 34 -13.556 6.335 -0.650 1.00 0.24 C ATOM 2036 C VAL B 34 -12.105 6.147 -0.189 1.00 0.24 C ATOM 2037 O VAL B 34 -11.279 5.598 -0.887 1.00 0.33 O ATOM 2038 CB VAL B 34 -14.314 4.996 -0.646 1.00 0.24 C ATOM 2039 CG1 VAL B 34 -13.360 3.829 -0.916 1.00 0.49 C ATOM 2040 CG2 VAL B 34 -14.990 4.782 0.711 1.00 0.35 C ATOM 0 H VAL B 34 -12.845 6.606 -2.648 1.00 0.25 H new ATOM 0 HA VAL B 34 -14.038 7.020 0.048 1.00 0.24 H new ATOM 0 HB VAL B 34 -15.066 5.031 -1.435 1.00 0.24 H new ATOM 0 HG11 VAL B 34 -13.919 2.893 -0.908 1.00 0.49 H new ATOM 0 HG12 VAL B 34 -12.889 3.962 -1.890 1.00 0.49 H new ATOM 0 HG13 VAL B 34 -12.593 3.800 -0.142 1.00 0.49 H new ATOM 0 HG21 VAL B 34 -15.524 3.832 0.705 1.00 0.35 H new ATOM 0 HG22 VAL B 34 -14.234 4.768 1.496 1.00 0.35 H new ATOM 0 HG23 VAL B 34 -15.694 5.593 0.899 1.00 0.35 H new ATOM 2050 N ILE B 35 -11.803 6.612 1.000 1.00 0.20 N ATOM 2051 CA ILE B 35 -10.407 6.470 1.540 1.00 0.21 C ATOM 2052 C ILE B 35 -10.372 5.394 2.631 1.00 0.21 C ATOM 2053 O ILE B 35 -11.100 5.466 3.603 1.00 0.23 O ATOM 2054 CB ILE B 35 -9.928 7.803 2.116 1.00 0.25 C ATOM 2055 CG1 ILE B 35 -10.614 8.956 1.374 1.00 0.26 C ATOM 2056 CG2 ILE B 35 -8.410 7.906 1.941 1.00 0.31 C ATOM 2057 CD1 ILE B 35 -9.744 10.213 1.450 1.00 0.31 C ATOM 0 H ILE B 35 -12.460 7.084 1.622 1.00 0.20 H new ATOM 0 HA ILE B 35 -9.745 6.175 0.726 1.00 0.21 H new ATOM 0 HB ILE B 35 -10.178 7.860 3.175 1.00 0.25 H new ATOM 0 HG12 ILE B 35 -10.782 8.681 0.333 1.00 0.26 H new ATOM 0 HG13 ILE B 35 -11.592 9.153 1.813 1.00 0.26 H new ATOM 0 HG21 ILE B 35 -8.060 8.854 2.349 1.00 0.31 H new ATOM 0 HG22 ILE B 35 -7.926 7.083 2.468 1.00 0.31 H new ATOM 0 HG23 ILE B 35 -8.162 7.854 0.881 1.00 0.31 H new ATOM 0 HD11 ILE B 35 -10.237 11.029 0.921 1.00 0.31 H new ATOM 0 HD12 ILE B 35 -9.599 10.492 2.494 1.00 0.31 H new ATOM 0 HD13 ILE B 35 -8.776 10.014 0.990 1.00 0.31 H new ATOM 2069 N LEU B 36 -9.525 4.401 2.481 1.00 0.23 N ATOM 2070 CA LEU B 36 -9.435 3.318 3.512 1.00 0.26 C ATOM 2071 C LEU B 36 -8.142 3.435 4.312 1.00 0.24 C ATOM 2072 O LEU B 36 -7.060 3.501 3.753 1.00 0.26 O ATOM 2073 CB LEU B 36 -9.449 1.952 2.838 1.00 0.30 C ATOM 2074 CG LEU B 36 -10.795 1.258 3.094 1.00 0.40 C ATOM 2075 CD1 LEU B 36 -11.949 2.102 2.535 1.00 0.46 C ATOM 2076 CD2 LEU B 36 -10.800 -0.112 2.411 1.00 0.48 C ATOM 0 H LEU B 36 -8.892 4.295 1.688 1.00 0.23 H new ATOM 0 HA LEU B 36 -10.291 3.425 4.178 1.00 0.26 H new ATOM 0 HB2 LEU B 36 -9.285 2.064 1.766 1.00 0.30 H new ATOM 0 HB3 LEU B 36 -8.634 1.338 3.223 1.00 0.30 H new ATOM 0 HG LEU B 36 -10.929 1.141 4.169 1.00 0.40 H new ATOM 0 HD11 LEU B 36 -12.895 1.596 2.725 1.00 0.46 H new ATOM 0 HD12 LEU B 36 -11.955 3.077 3.022 1.00 0.46 H new ATOM 0 HD13 LEU B 36 -11.817 2.233 1.461 1.00 0.46 H new ATOM 0 HD21 LEU B 36 -11.755 -0.605 2.592 1.00 0.48 H new ATOM 0 HD22 LEU B 36 -10.655 0.016 1.338 1.00 0.48 H new ATOM 0 HD23 LEU B 36 -9.993 -0.723 2.816 1.00 0.48 H new ATOM 2088 N LYS B 37 -8.245 3.412 5.616 1.00 0.23 N ATOM 2089 CA LYS B 37 -7.030 3.465 6.477 1.00 0.23 C ATOM 2090 C LYS B 37 -6.799 2.069 7.064 1.00 0.21 C ATOM 2091 O LYS B 37 -7.685 1.493 7.661 1.00 0.20 O ATOM 2092 CB LYS B 37 -7.233 4.456 7.616 1.00 0.29 C ATOM 2093 CG LYS B 37 -8.158 5.589 7.164 1.00 1.26 C ATOM 2094 CD LYS B 37 -8.243 6.648 8.265 1.00 1.50 C ATOM 2095 CE LYS B 37 -7.297 7.804 7.935 1.00 2.39 C ATOM 2096 NZ LYS B 37 -7.040 8.604 9.166 1.00 2.74 N ATOM 0 H LYS B 37 -9.128 3.358 6.124 1.00 0.23 H new ATOM 0 HA LYS B 37 -6.173 3.783 5.883 1.00 0.23 H new ATOM 0 HB2 LYS B 37 -7.662 3.948 8.480 1.00 0.29 H new ATOM 0 HB3 LYS B 37 -6.272 4.863 7.931 1.00 0.29 H new ATOM 0 HG2 LYS B 37 -7.781 6.035 6.244 1.00 1.26 H new ATOM 0 HG3 LYS B 37 -9.151 5.197 6.945 1.00 1.26 H new ATOM 0 HD2 LYS B 37 -9.266 7.015 8.353 1.00 1.50 H new ATOM 0 HD3 LYS B 37 -7.977 6.210 9.227 1.00 1.50 H new ATOM 0 HE2 LYS B 37 -6.359 7.418 7.537 1.00 2.39 H new ATOM 0 HE3 LYS B 37 -7.734 8.436 7.162 1.00 2.39 H new ATOM 0 HZ1 LYS B 37 -6.397 9.390 8.941 1.00 2.74 H new ATOM 0 HZ2 LYS B 37 -7.938 8.984 9.527 1.00 2.74 H new ATOM 0 HZ3 LYS B 37 -6.605 7.997 9.890 1.00 2.74 H new ATOM 2110 N GLY B 38 -5.625 1.528 6.889 1.00 0.21 N ATOM 2111 CA GLY B 38 -5.345 0.153 7.432 1.00 0.22 C ATOM 2112 C GLY B 38 -3.991 0.114 8.138 1.00 0.22 C ATOM 2113 O GLY B 38 -3.126 0.903 7.849 1.00 0.24 O ATOM 0 H GLY B 38 -4.847 1.969 6.398 1.00 0.21 H new ATOM 0 HA2 GLY B 38 -6.132 -0.135 8.129 1.00 0.22 H new ATOM 0 HA3 GLY B 38 -5.358 -0.573 6.619 1.00 0.22 H new ATOM 2117 N THR B 39 -3.825 -0.780 9.094 1.00 0.22 N ATOM 2118 CA THR B 39 -2.535 -0.837 9.859 1.00 0.25 C ATOM 2119 C THR B 39 -2.011 -2.274 10.002 1.00 0.23 C ATOM 2120 O THR B 39 -2.759 -3.203 10.189 1.00 0.20 O ATOM 2121 CB THR B 39 -2.768 -0.272 11.262 1.00 0.28 C ATOM 2122 OG1 THR B 39 -3.905 -0.898 11.838 1.00 0.29 O ATOM 2123 CG2 THR B 39 -3.002 1.239 11.184 1.00 0.49 C ATOM 0 H THR B 39 -4.525 -1.467 9.374 1.00 0.22 H new ATOM 0 HA THR B 39 -1.796 -0.255 9.308 1.00 0.25 H new ATOM 0 HB THR B 39 -1.890 -0.466 11.878 1.00 0.28 H new ATOM 0 HG1 THR B 39 -3.733 -1.080 12.785 1.00 0.29 H new ATOM 0 HG21 THR B 39 -3.167 1.634 12.186 1.00 0.49 H new ATOM 0 HG22 THR B 39 -2.129 1.720 10.744 1.00 0.49 H new ATOM 0 HG23 THR B 39 -3.877 1.440 10.566 1.00 0.49 H new ATOM 2131 N GLY B 40 -0.708 -2.430 9.926 1.00 0.25 N ATOM 2132 CA GLY B 40 -0.049 -3.775 10.075 1.00 0.26 C ATOM 2133 C GLY B 40 -0.915 -4.902 9.507 1.00 0.25 C ATOM 2134 O GLY B 40 -0.674 -5.390 8.425 1.00 0.28 O ATOM 0 H GLY B 40 -0.056 -1.663 9.763 1.00 0.25 H new ATOM 0 HA2 GLY B 40 0.914 -3.766 9.565 1.00 0.26 H new ATOM 0 HA3 GLY B 40 0.150 -3.967 11.129 1.00 0.26 H new ATOM 2138 N ARG B 41 -1.905 -5.338 10.236 1.00 0.23 N ATOM 2139 CA ARG B 41 -2.766 -6.440 9.730 1.00 0.24 C ATOM 2140 C ARG B 41 -3.851 -5.860 8.822 1.00 0.22 C ATOM 2141 O ARG B 41 -4.007 -6.275 7.691 1.00 0.26 O ATOM 2142 CB ARG B 41 -3.416 -7.181 10.903 1.00 0.24 C ATOM 2143 CG ARG B 41 -2.684 -6.841 12.203 1.00 0.61 C ATOM 2144 CD ARG B 41 -3.077 -7.848 13.286 1.00 0.94 C ATOM 2145 NE ARG B 41 -3.309 -7.129 14.570 1.00 1.74 N ATOM 2146 CZ ARG B 41 -3.420 -7.800 15.683 1.00 2.19 C ATOM 2147 NH1 ARG B 41 -3.337 -9.104 15.670 1.00 2.10 N ATOM 2148 NH2 ARG B 41 -3.615 -7.171 16.809 1.00 3.16 N ATOM 0 H ARG B 41 -2.153 -4.979 11.158 1.00 0.23 H new ATOM 0 HA ARG B 41 -2.154 -7.143 9.165 1.00 0.24 H new ATOM 0 HB2 ARG B 41 -4.467 -6.902 10.983 1.00 0.24 H new ATOM 0 HB3 ARG B 41 -3.384 -8.256 10.728 1.00 0.24 H new ATOM 0 HG2 ARG B 41 -1.606 -6.864 12.043 1.00 0.61 H new ATOM 0 HG3 ARG B 41 -2.937 -5.830 12.522 1.00 0.61 H new ATOM 0 HD2 ARG B 41 -3.978 -8.385 12.989 1.00 0.94 H new ATOM 0 HD3 ARG B 41 -2.289 -8.591 13.410 1.00 0.94 H new ATOM 0 HE ARG B 41 -3.381 -6.112 14.579 1.00 1.74 H new ATOM 0 HH11 ARG B 41 -3.185 -9.597 14.790 1.00 2.10 H new ATOM 0 HH12 ARG B 41 -3.424 -9.629 16.540 1.00 2.10 H new ATOM 0 HH21 ARG B 41 -3.681 -6.153 16.820 1.00 3.16 H new ATOM 0 HH22 ARG B 41 -3.702 -7.697 17.679 1.00 3.16 H new ATOM 2162 N GLU B 42 -4.620 -4.923 9.307 1.00 0.18 N ATOM 2163 CA GLU B 42 -5.708 -4.351 8.466 1.00 0.17 C ATOM 2164 C GLU B 42 -5.114 -3.713 7.214 1.00 0.18 C ATOM 2165 O GLU B 42 -5.807 -3.475 6.240 1.00 0.19 O ATOM 2166 CB GLU B 42 -6.478 -3.274 9.246 1.00 0.16 C ATOM 2167 CG GLU B 42 -5.917 -3.113 10.665 1.00 0.16 C ATOM 2168 CD GLU B 42 -6.799 -2.147 11.458 1.00 0.63 C ATOM 2169 OE1 GLU B 42 -7.108 -1.090 10.931 1.00 1.38 O ATOM 2170 OE2 GLU B 42 -7.152 -2.480 12.577 1.00 1.29 O ATOM 0 H GLU B 42 -4.542 -4.531 10.245 1.00 0.18 H new ATOM 0 HA GLU B 42 -6.387 -5.158 8.190 1.00 0.17 H new ATOM 0 HB2 GLU B 42 -6.416 -2.323 8.717 1.00 0.16 H new ATOM 0 HB3 GLU B 42 -7.533 -3.542 9.297 1.00 0.16 H new ATOM 0 HG2 GLU B 42 -5.880 -4.081 11.164 1.00 0.16 H new ATOM 0 HG3 GLU B 42 -4.895 -2.737 10.622 1.00 0.16 H new ATOM 2177 N ILE B 43 -3.841 -3.436 7.218 1.00 0.19 N ATOM 2178 CA ILE B 43 -3.205 -2.820 6.022 1.00 0.23 C ATOM 2179 C ILE B 43 -3.333 -3.762 4.819 1.00 0.26 C ATOM 2180 O ILE B 43 -3.263 -3.342 3.680 1.00 0.30 O ATOM 2181 CB ILE B 43 -1.726 -2.590 6.336 1.00 0.30 C ATOM 2182 CG1 ILE B 43 -1.144 -1.543 5.389 1.00 0.34 C ATOM 2183 CG2 ILE B 43 -0.979 -3.902 6.145 1.00 0.39 C ATOM 2184 CD1 ILE B 43 0.350 -1.383 5.667 1.00 0.85 C ATOM 0 H ILE B 43 -3.211 -3.610 8.001 1.00 0.19 H new ATOM 0 HA ILE B 43 -3.695 -1.877 5.781 1.00 0.23 H new ATOM 0 HB ILE B 43 -1.623 -2.237 7.362 1.00 0.30 H new ATOM 0 HG12 ILE B 43 -1.302 -1.845 4.354 1.00 0.34 H new ATOM 0 HG13 ILE B 43 -1.655 -0.590 5.525 1.00 0.34 H new ATOM 0 HG21 ILE B 43 0.078 -3.754 6.365 1.00 0.39 H new ATOM 0 HG22 ILE B 43 -1.388 -4.655 6.818 1.00 0.39 H new ATOM 0 HG23 ILE B 43 -1.091 -4.238 5.114 1.00 0.39 H new ATOM 0 HD11 ILE B 43 0.768 -0.636 4.992 1.00 0.85 H new ATOM 0 HD12 ILE B 43 0.496 -1.062 6.698 1.00 0.85 H new ATOM 0 HD13 ILE B 43 0.854 -2.337 5.509 1.00 0.85 H new ATOM 2196 N SER B 44 -3.518 -5.031 5.062 1.00 0.27 N ATOM 2197 CA SER B 44 -3.648 -5.996 3.935 1.00 0.31 C ATOM 2198 C SER B 44 -5.119 -6.108 3.568 1.00 0.30 C ATOM 2199 O SER B 44 -5.479 -6.324 2.424 1.00 0.32 O ATOM 2200 CB SER B 44 -3.116 -7.364 4.362 1.00 0.36 C ATOM 2201 OG SER B 44 -2.628 -7.284 5.695 1.00 1.12 O ATOM 0 H SER B 44 -3.585 -5.441 5.994 1.00 0.27 H new ATOM 0 HA SER B 44 -3.073 -5.650 3.076 1.00 0.31 H new ATOM 0 HB2 SER B 44 -3.907 -8.111 4.296 1.00 0.36 H new ATOM 0 HB3 SER B 44 -2.320 -7.683 3.690 1.00 0.36 H new ATOM 0 HG SER B 44 -3.383 -7.262 6.319 1.00 1.12 H new ATOM 2207 N LYS B 45 -5.977 -5.918 4.529 1.00 0.26 N ATOM 2208 CA LYS B 45 -7.419 -5.970 4.216 1.00 0.26 C ATOM 2209 C LYS B 45 -7.674 -4.875 3.189 1.00 0.25 C ATOM 2210 O LYS B 45 -8.017 -5.140 2.053 1.00 0.27 O ATOM 2211 CB LYS B 45 -8.250 -5.710 5.478 1.00 0.26 C ATOM 2212 CG LYS B 45 -8.010 -6.829 6.495 1.00 0.40 C ATOM 2213 CD LYS B 45 -8.973 -7.988 6.228 1.00 0.91 C ATOM 2214 CE LYS B 45 -8.713 -9.108 7.237 1.00 0.81 C ATOM 2215 NZ LYS B 45 -9.902 -9.268 8.120 1.00 1.87 N ATOM 0 H LYS B 45 -5.741 -5.732 5.504 1.00 0.26 H new ATOM 0 HA LYS B 45 -7.703 -6.950 3.833 1.00 0.26 H new ATOM 0 HB2 LYS B 45 -7.979 -4.747 5.912 1.00 0.26 H new ATOM 0 HB3 LYS B 45 -9.309 -5.658 5.223 1.00 0.26 H new ATOM 0 HG2 LYS B 45 -6.979 -7.178 6.429 1.00 0.40 H new ATOM 0 HG3 LYS B 45 -8.154 -6.450 7.507 1.00 0.40 H new ATOM 0 HD2 LYS B 45 -10.004 -7.644 6.308 1.00 0.91 H new ATOM 0 HD3 LYS B 45 -8.839 -8.360 5.212 1.00 0.91 H new ATOM 0 HE2 LYS B 45 -8.507 -10.042 6.714 1.00 0.81 H new ATOM 0 HE3 LYS B 45 -7.832 -8.876 7.835 1.00 0.81 H new ATOM 0 HZ1 LYS B 45 -9.600 -9.254 9.115 1.00 1.87 H new ATOM 0 HZ2 LYS B 45 -10.569 -8.488 7.950 1.00 1.87 H new ATOM 0 HZ3 LYS B 45 -10.369 -10.174 7.913 1.00 1.87 H new ATOM 2229 N ALA B 46 -7.528 -3.648 3.610 1.00 0.22 N ATOM 2230 CA ALA B 46 -7.771 -2.480 2.706 1.00 0.21 C ATOM 2231 C ALA B 46 -7.407 -2.801 1.247 1.00 0.19 C ATOM 2232 O ALA B 46 -8.158 -2.504 0.341 1.00 0.22 O ATOM 2233 CB ALA B 46 -6.929 -1.295 3.180 1.00 0.26 C ATOM 0 H ALA B 46 -7.246 -3.399 4.558 1.00 0.22 H new ATOM 0 HA ALA B 46 -8.834 -2.240 2.745 1.00 0.21 H new ATOM 0 HB1 ALA B 46 -7.102 -0.441 2.525 1.00 0.26 H new ATOM 0 HB2 ALA B 46 -7.211 -1.033 4.200 1.00 0.26 H new ATOM 0 HB3 ALA B 46 -5.873 -1.565 3.153 1.00 0.26 H new ATOM 2239 N VAL B 47 -6.264 -3.386 1.005 1.00 0.18 N ATOM 2240 CA VAL B 47 -5.866 -3.694 -0.409 1.00 0.18 C ATOM 2241 C VAL B 47 -6.787 -4.750 -1.029 1.00 0.18 C ATOM 2242 O VAL B 47 -7.443 -4.499 -2.019 1.00 0.19 O ATOM 2243 CB VAL B 47 -4.423 -4.209 -0.464 1.00 0.24 C ATOM 2244 CG1 VAL B 47 -4.081 -4.571 -1.915 1.00 0.28 C ATOM 2245 CG2 VAL B 47 -3.463 -3.122 0.031 1.00 0.27 C ATOM 0 H VAL B 47 -5.589 -3.664 1.717 1.00 0.18 H new ATOM 0 HA VAL B 47 -5.951 -2.767 -0.976 1.00 0.18 H new ATOM 0 HB VAL B 47 -4.323 -5.088 0.173 1.00 0.24 H new ATOM 0 HG11 VAL B 47 -3.056 -4.939 -1.966 1.00 0.28 H new ATOM 0 HG12 VAL B 47 -4.763 -5.345 -2.267 1.00 0.28 H new ATOM 0 HG13 VAL B 47 -4.181 -3.686 -2.544 1.00 0.28 H new ATOM 0 HG21 VAL B 47 -2.439 -3.494 -0.011 1.00 0.27 H new ATOM 0 HG22 VAL B 47 -3.554 -2.240 -0.603 1.00 0.27 H new ATOM 0 HG23 VAL B 47 -3.711 -2.858 1.059 1.00 0.27 H new ATOM 2255 N ASP B 48 -6.823 -5.932 -0.475 1.00 0.20 N ATOM 2256 CA ASP B 48 -7.689 -7.004 -1.060 1.00 0.23 C ATOM 2257 C ASP B 48 -9.063 -6.425 -1.380 1.00 0.26 C ATOM 2258 O ASP B 48 -9.577 -6.569 -2.472 1.00 0.30 O ATOM 2259 CB ASP B 48 -7.846 -8.147 -0.054 1.00 0.24 C ATOM 2260 CG ASP B 48 -8.404 -9.382 -0.766 1.00 0.41 C ATOM 2261 OD1 ASP B 48 -9.530 -9.316 -1.230 1.00 1.08 O ATOM 2262 OD2 ASP B 48 -7.694 -10.372 -0.836 1.00 1.25 O ATOM 0 H ASP B 48 -6.294 -6.204 0.354 1.00 0.20 H new ATOM 0 HA ASP B 48 -7.227 -7.383 -1.971 1.00 0.23 H new ATOM 0 HB2 ASP B 48 -6.883 -8.380 0.400 1.00 0.24 H new ATOM 0 HB3 ASP B 48 -8.515 -7.846 0.753 1.00 0.24 H new ATOM 2267 N VAL B 49 -9.649 -5.776 -0.420 1.00 0.26 N ATOM 2268 CA VAL B 49 -10.993 -5.169 -0.624 1.00 0.32 C ATOM 2269 C VAL B 49 -11.059 -4.511 -2.003 1.00 0.31 C ATOM 2270 O VAL B 49 -11.953 -4.775 -2.781 1.00 0.31 O ATOM 2271 CB VAL B 49 -11.240 -4.108 0.455 1.00 0.39 C ATOM 2272 CG1 VAL B 49 -12.619 -3.471 0.256 1.00 1.06 C ATOM 2273 CG2 VAL B 49 -11.180 -4.765 1.835 1.00 0.96 C ATOM 0 H VAL B 49 -9.252 -5.637 0.509 1.00 0.26 H new ATOM 0 HA VAL B 49 -11.754 -5.947 -0.558 1.00 0.32 H new ATOM 0 HB VAL B 49 -10.474 -3.336 0.380 1.00 0.39 H new ATOM 0 HG11 VAL B 49 -12.787 -2.718 1.026 1.00 1.06 H new ATOM 0 HG12 VAL B 49 -12.664 -3.001 -0.726 1.00 1.06 H new ATOM 0 HG13 VAL B 49 -13.388 -4.240 0.326 1.00 1.06 H new ATOM 0 HG21 VAL B 49 -11.355 -4.013 2.604 1.00 0.96 H new ATOM 0 HG22 VAL B 49 -11.945 -5.539 1.903 1.00 0.96 H new ATOM 0 HG23 VAL B 49 -10.197 -5.212 1.983 1.00 0.96 H new ATOM 2283 N TYR B 50 -10.141 -3.633 -2.303 1.00 0.33 N ATOM 2284 CA TYR B 50 -10.188 -2.936 -3.621 1.00 0.36 C ATOM 2285 C TYR B 50 -9.907 -3.889 -4.768 1.00 0.32 C ATOM 2286 O TYR B 50 -10.680 -3.967 -5.699 1.00 0.32 O ATOM 2287 CB TYR B 50 -9.178 -1.799 -3.655 1.00 0.43 C ATOM 2288 CG TYR B 50 -9.601 -0.768 -2.653 1.00 1.19 C ATOM 2289 CD1 TYR B 50 -10.818 -0.094 -2.814 1.00 2.17 C ATOM 2290 CD2 TYR B 50 -8.795 -0.499 -1.553 1.00 1.93 C ATOM 2291 CE1 TYR B 50 -11.222 0.847 -1.873 1.00 3.03 C ATOM 2292 CE2 TYR B 50 -9.195 0.445 -0.613 1.00 2.76 C ATOM 2293 CZ TYR B 50 -10.415 1.121 -0.774 1.00 3.13 C ATOM 2294 OH TYR B 50 -10.824 2.058 0.145 1.00 4.11 O ATOM 0 H TYR B 50 -9.364 -3.369 -1.697 1.00 0.33 H new ATOM 0 HA TYR B 50 -11.196 -2.538 -3.742 1.00 0.36 H new ATOM 0 HB2 TYR B 50 -8.180 -2.170 -3.421 1.00 0.43 H new ATOM 0 HB3 TYR B 50 -9.130 -1.363 -4.653 1.00 0.43 H new ATOM 0 HD1 TYR B 50 -11.443 -0.305 -3.669 1.00 2.17 H new ATOM 0 HD2 TYR B 50 -7.859 -1.023 -1.428 1.00 1.93 H new ATOM 0 HE1 TYR B 50 -12.162 1.365 -1.996 1.00 3.03 H new ATOM 0 HE2 TYR B 50 -8.568 0.658 0.240 1.00 2.76 H new ATOM 0 HH TYR B 50 -10.263 2.858 0.069 1.00 4.11 H new ATOM 2304 N ASN B 51 -8.819 -4.605 -4.729 1.00 0.32 N ATOM 2305 CA ASN B 51 -8.534 -5.536 -5.848 1.00 0.30 C ATOM 2306 C ASN B 51 -9.811 -6.318 -6.143 1.00 0.29 C ATOM 2307 O ASN B 51 -10.309 -6.329 -7.252 1.00 0.30 O ATOM 2308 CB ASN B 51 -7.409 -6.482 -5.446 1.00 0.31 C ATOM 2309 CG ASN B 51 -7.889 -7.928 -5.566 1.00 0.65 C ATOM 2310 OD1 ASN B 51 -7.778 -8.533 -6.614 1.00 1.41 O ATOM 2311 ND2 ASN B 51 -8.423 -8.512 -4.529 1.00 1.19 N ATOM 0 H ASN B 51 -8.125 -4.586 -3.981 1.00 0.32 H new ATOM 0 HA ASN B 51 -8.220 -4.991 -6.738 1.00 0.30 H new ATOM 0 HB2 ASN B 51 -6.540 -6.322 -6.084 1.00 0.31 H new ATOM 0 HB3 ASN B 51 -7.095 -6.276 -4.423 1.00 0.31 H new ATOM 0 HD21 ASN B 51 -8.747 -9.477 -4.598 1.00 1.19 H new ATOM 0 HD22 ASN B 51 -8.516 -8.004 -3.649 1.00 1.19 H new ATOM 2318 N SER B 52 -10.342 -6.969 -5.152 1.00 0.29 N ATOM 2319 CA SER B 52 -11.588 -7.749 -5.369 1.00 0.31 C ATOM 2320 C SER B 52 -12.715 -6.810 -5.814 1.00 0.29 C ATOM 2321 O SER B 52 -13.500 -7.145 -6.678 1.00 0.33 O ATOM 2322 CB SER B 52 -12.004 -8.443 -4.081 1.00 0.34 C ATOM 2323 OG SER B 52 -10.862 -8.645 -3.261 1.00 0.65 O ATOM 0 H SER B 52 -9.969 -6.996 -4.203 1.00 0.29 H new ATOM 0 HA SER B 52 -11.401 -8.497 -6.140 1.00 0.31 H new ATOM 0 HB2 SER B 52 -12.742 -7.840 -3.552 1.00 0.34 H new ATOM 0 HB3 SER B 52 -12.476 -9.399 -4.307 1.00 0.34 H new ATOM 0 HG SER B 52 -10.685 -7.833 -2.741 1.00 0.65 H new ATOM 2329 N LEU B 53 -12.805 -5.633 -5.246 1.00 0.27 N ATOM 2330 CA LEU B 53 -13.878 -4.691 -5.658 1.00 0.27 C ATOM 2331 C LEU B 53 -13.559 -4.171 -7.056 1.00 0.27 C ATOM 2332 O LEU B 53 -14.432 -3.806 -7.821 1.00 0.30 O ATOM 2333 CB LEU B 53 -13.923 -3.498 -4.702 1.00 0.27 C ATOM 2334 CG LEU B 53 -15.190 -2.675 -4.962 1.00 0.32 C ATOM 2335 CD1 LEU B 53 -16.343 -3.190 -4.103 1.00 0.53 C ATOM 2336 CD2 LEU B 53 -14.916 -1.210 -4.617 1.00 0.38 C ATOM 0 H LEU B 53 -12.181 -5.289 -4.517 1.00 0.27 H new ATOM 0 HA LEU B 53 -14.837 -5.209 -5.643 1.00 0.27 H new ATOM 0 HB2 LEU B 53 -13.910 -3.847 -3.669 1.00 0.27 H new ATOM 0 HB3 LEU B 53 -13.039 -2.876 -4.840 1.00 0.27 H new ATOM 0 HG LEU B 53 -15.465 -2.767 -6.013 1.00 0.32 H new ATOM 0 HD11 LEU B 53 -17.236 -2.596 -4.298 1.00 0.53 H new ATOM 0 HD12 LEU B 53 -16.541 -4.234 -4.347 1.00 0.53 H new ATOM 0 HD13 LEU B 53 -16.076 -3.108 -3.049 1.00 0.53 H new ATOM 0 HD21 LEU B 53 -15.814 -0.619 -4.800 1.00 0.38 H new ATOM 0 HD22 LEU B 53 -14.636 -1.130 -3.567 1.00 0.38 H new ATOM 0 HD23 LEU B 53 -14.102 -0.836 -5.239 1.00 0.38 H new ATOM 2348 N LYS B 54 -12.318 -4.195 -7.434 1.00 0.28 N ATOM 2349 CA LYS B 54 -11.960 -3.741 -8.790 1.00 0.32 C ATOM 2350 C LYS B 54 -12.353 -4.853 -9.742 1.00 0.34 C ATOM 2351 O LYS B 54 -13.012 -4.653 -10.743 1.00 0.36 O ATOM 2352 CB LYS B 54 -10.447 -3.516 -8.837 1.00 0.34 C ATOM 2353 CG LYS B 54 -10.059 -2.774 -10.114 1.00 0.96 C ATOM 2354 CD LYS B 54 -9.507 -3.744 -11.166 1.00 0.49 C ATOM 2355 CE LYS B 54 -8.867 -2.946 -12.307 1.00 0.49 C ATOM 2356 NZ LYS B 54 -7.386 -3.101 -12.254 1.00 0.99 N ATOM 0 H LYS B 54 -11.537 -4.511 -6.858 1.00 0.28 H new ATOM 0 HA LYS B 54 -12.464 -2.813 -9.061 1.00 0.32 H new ATOM 0 HB2 LYS B 54 -10.131 -2.943 -7.965 1.00 0.34 H new ATOM 0 HB3 LYS B 54 -9.929 -4.474 -8.794 1.00 0.34 H new ATOM 0 HG2 LYS B 54 -10.929 -2.253 -10.515 1.00 0.96 H new ATOM 0 HG3 LYS B 54 -9.311 -2.015 -9.885 1.00 0.96 H new ATOM 0 HD2 LYS B 54 -8.770 -4.408 -10.714 1.00 0.49 H new ATOM 0 HD3 LYS B 54 -10.309 -4.374 -11.553 1.00 0.49 H new ATOM 0 HE2 LYS B 54 -9.246 -3.297 -13.267 1.00 0.49 H new ATOM 0 HE3 LYS B 54 -9.136 -1.893 -12.224 1.00 0.49 H new ATOM 0 HZ1 LYS B 54 -6.952 -2.559 -13.029 1.00 0.99 H new ATOM 0 HZ2 LYS B 54 -7.032 -2.746 -11.343 1.00 0.99 H new ATOM 0 HZ3 LYS B 54 -7.138 -4.106 -12.354 1.00 0.99 H new ATOM 2370 N ASP B 55 -11.968 -6.036 -9.389 1.00 0.41 N ATOM 2371 CA ASP B 55 -12.312 -7.233 -10.192 1.00 0.47 C ATOM 2372 C ASP B 55 -13.779 -7.164 -10.594 1.00 0.47 C ATOM 2373 O ASP B 55 -14.223 -7.869 -11.477 1.00 0.52 O ATOM 2374 CB ASP B 55 -12.123 -8.472 -9.316 1.00 0.51 C ATOM 2375 CG ASP B 55 -10.811 -9.173 -9.674 1.00 0.66 C ATOM 2376 OD1 ASP B 55 -10.563 -9.355 -10.854 1.00 1.46 O ATOM 2377 OD2 ASP B 55 -10.081 -9.519 -8.761 1.00 1.23 O ATOM 0 H ASP B 55 -11.414 -6.231 -8.555 1.00 0.41 H new ATOM 0 HA ASP B 55 -11.679 -7.278 -11.078 1.00 0.47 H new ATOM 0 HB2 ASP B 55 -12.116 -8.186 -8.264 1.00 0.51 H new ATOM 0 HB3 ASP B 55 -12.960 -9.156 -9.455 1.00 0.51 H new ATOM 2382 N ARG B 56 -14.544 -6.346 -9.932 1.00 0.42 N ATOM 2383 CA ARG B 56 -15.987 -6.272 -10.262 1.00 0.44 C ATOM 2384 C ARG B 56 -16.172 -5.713 -11.666 1.00 0.43 C ATOM 2385 O ARG B 56 -17.016 -6.166 -12.412 1.00 0.51 O ATOM 2386 CB ARG B 56 -16.688 -5.378 -9.243 1.00 0.54 C ATOM 2387 CG ARG B 56 -16.323 -5.835 -7.822 1.00 0.50 C ATOM 2388 CD ARG B 56 -16.999 -7.161 -7.484 1.00 0.64 C ATOM 2389 NE ARG B 56 -18.458 -7.091 -7.801 1.00 1.01 N ATOM 2390 CZ ARG B 56 -19.126 -8.180 -8.079 1.00 1.27 C ATOM 2391 NH1 ARG B 56 -18.520 -9.336 -8.110 1.00 1.51 N ATOM 2392 NH2 ARG B 56 -20.407 -8.113 -8.325 1.00 1.71 N ATOM 0 H ARG B 56 -14.233 -5.729 -9.181 1.00 0.42 H new ATOM 0 HA ARG B 56 -16.422 -7.271 -10.227 1.00 0.44 H new ATOM 0 HB2 ARG B 56 -16.391 -4.339 -9.390 1.00 0.54 H new ATOM 0 HB3 ARG B 56 -17.768 -5.424 -9.385 1.00 0.54 H new ATOM 0 HG2 ARG B 56 -15.242 -5.942 -7.737 1.00 0.50 H new ATOM 0 HG3 ARG B 56 -16.626 -5.074 -7.102 1.00 0.50 H new ATOM 0 HD2 ARG B 56 -16.535 -7.969 -8.049 1.00 0.64 H new ATOM 0 HD3 ARG B 56 -16.859 -7.390 -6.428 1.00 0.64 H new ATOM 0 HE ARG B 56 -18.935 -6.189 -7.800 1.00 1.01 H new ATOM 0 HH11 ARG B 56 -17.520 -9.393 -7.917 1.00 1.51 H new ATOM 0 HH12 ARG B 56 -19.046 -10.182 -8.327 1.00 1.51 H new ATOM 0 HH21 ARG B 56 -20.885 -7.212 -8.300 1.00 1.71 H new ATOM 0 HH22 ARG B 56 -20.930 -8.962 -8.542 1.00 1.71 H new ATOM 2406 N LEU B 57 -15.401 -4.737 -12.044 1.00 0.41 N ATOM 2407 CA LEU B 57 -15.577 -4.186 -13.412 1.00 0.48 C ATOM 2408 C LEU B 57 -14.308 -3.498 -13.906 1.00 0.43 C ATOM 2409 O LEU B 57 -14.193 -3.186 -15.073 1.00 0.44 O ATOM 2410 CB LEU B 57 -16.730 -3.183 -13.408 1.00 0.58 C ATOM 2411 CG LEU B 57 -17.376 -3.147 -14.793 1.00 1.20 C ATOM 2412 CD1 LEU B 57 -18.459 -4.223 -14.880 1.00 1.70 C ATOM 2413 CD2 LEU B 57 -18.003 -1.771 -15.024 1.00 1.77 C ATOM 0 H LEU B 57 -14.671 -4.304 -11.479 1.00 0.41 H new ATOM 0 HA LEU B 57 -15.797 -5.014 -14.086 1.00 0.48 H new ATOM 0 HB2 LEU B 57 -17.469 -3.464 -12.657 1.00 0.58 H new ATOM 0 HB3 LEU B 57 -16.364 -2.192 -13.139 1.00 0.58 H new ATOM 0 HG LEU B 57 -16.618 -3.335 -15.554 1.00 1.20 H new ATOM 0 HD11 LEU B 57 -18.919 -4.197 -15.868 1.00 1.70 H new ATOM 0 HD12 LEU B 57 -18.012 -5.203 -14.714 1.00 1.70 H new ATOM 0 HD13 LEU B 57 -19.219 -4.037 -14.121 1.00 1.70 H new ATOM 0 HD21 LEU B 57 -18.464 -1.743 -16.011 1.00 1.77 H new ATOM 0 HD22 LEU B 57 -18.761 -1.584 -14.263 1.00 1.77 H new ATOM 0 HD23 LEU B 57 -17.231 -1.004 -14.962 1.00 1.77 H new ATOM 2425 N GLY B 58 -13.358 -3.249 -13.052 1.00 0.39 N ATOM 2426 CA GLY B 58 -12.122 -2.568 -13.522 1.00 0.36 C ATOM 2427 C GLY B 58 -12.471 -1.136 -13.928 1.00 0.35 C ATOM 2428 O GLY B 58 -12.025 -0.179 -13.328 1.00 0.35 O ATOM 0 H GLY B 58 -13.382 -3.484 -12.060 1.00 0.39 H new ATOM 0 HA2 GLY B 58 -11.370 -2.564 -12.733 1.00 0.36 H new ATOM 0 HA3 GLY B 58 -11.693 -3.106 -14.368 1.00 0.36 H new ATOM 2432 N ASP B 59 -13.264 -0.992 -14.949 1.00 0.40 N ATOM 2433 CA ASP B 59 -13.651 0.364 -15.418 1.00 0.44 C ATOM 2434 C ASP B 59 -14.571 1.021 -14.391 1.00 0.38 C ATOM 2435 O ASP B 59 -14.452 2.191 -14.104 1.00 0.40 O ATOM 2436 CB ASP B 59 -14.385 0.242 -16.753 1.00 0.53 C ATOM 2437 CG ASP B 59 -13.730 1.160 -17.786 1.00 0.63 C ATOM 2438 OD1 ASP B 59 -14.062 2.334 -17.803 1.00 1.40 O ATOM 2439 OD2 ASP B 59 -12.907 0.673 -18.544 1.00 1.11 O ATOM 0 H ASP B 59 -13.664 -1.763 -15.484 1.00 0.40 H new ATOM 0 HA ASP B 59 -12.757 0.975 -15.543 1.00 0.44 H new ATOM 0 HB2 ASP B 59 -14.358 -0.791 -17.101 1.00 0.53 H new ATOM 0 HB3 ASP B 59 -15.434 0.509 -16.628 1.00 0.53 H new ATOM 2444 N GLY B 60 -15.488 0.282 -13.837 1.00 0.34 N ATOM 2445 CA GLY B 60 -16.414 0.870 -12.837 1.00 0.31 C ATOM 2446 C GLY B 60 -15.675 1.085 -11.523 1.00 0.29 C ATOM 2447 O GLY B 60 -16.281 1.256 -10.487 1.00 0.28 O ATOM 0 H GLY B 60 -15.636 -0.708 -14.035 1.00 0.34 H new ATOM 0 HA2 GLY B 60 -16.808 1.818 -13.204 1.00 0.31 H new ATOM 0 HA3 GLY B 60 -17.267 0.209 -12.683 1.00 0.31 H new ATOM 2451 N VAL B 61 -14.372 1.074 -11.547 1.00 0.29 N ATOM 2452 CA VAL B 61 -13.594 1.274 -10.299 1.00 0.28 C ATOM 2453 C VAL B 61 -12.251 1.890 -10.701 1.00 0.30 C ATOM 2454 O VAL B 61 -11.613 1.436 -11.631 1.00 0.46 O ATOM 2455 CB VAL B 61 -13.356 -0.083 -9.619 1.00 0.30 C ATOM 2456 CG1 VAL B 61 -12.072 -0.033 -8.780 1.00 0.44 C ATOM 2457 CG2 VAL B 61 -14.543 -0.433 -8.715 1.00 0.39 C ATOM 0 H VAL B 61 -13.810 0.934 -12.387 1.00 0.29 H new ATOM 0 HA VAL B 61 -14.128 1.922 -9.604 1.00 0.28 H new ATOM 0 HB VAL B 61 -13.253 -0.847 -10.390 1.00 0.30 H new ATOM 0 HG11 VAL B 61 -11.912 -0.999 -8.302 1.00 0.44 H new ATOM 0 HG12 VAL B 61 -11.224 0.197 -9.425 1.00 0.44 H new ATOM 0 HG13 VAL B 61 -12.166 0.739 -8.016 1.00 0.44 H new ATOM 0 HG21 VAL B 61 -14.365 -1.397 -8.237 1.00 0.39 H new ATOM 0 HG22 VAL B 61 -14.657 0.335 -7.950 1.00 0.39 H new ATOM 0 HG23 VAL B 61 -15.452 -0.487 -9.313 1.00 0.39 H new ATOM 2467 N GLN B 62 -11.848 2.947 -10.047 1.00 0.28 N ATOM 2468 CA GLN B 62 -10.579 3.621 -10.441 1.00 0.30 C ATOM 2469 C GLN B 62 -9.741 4.037 -9.235 1.00 0.29 C ATOM 2470 O GLN B 62 -10.238 4.324 -8.171 1.00 0.27 O ATOM 2471 CB GLN B 62 -10.938 4.879 -11.217 1.00 0.31 C ATOM 2472 CG GLN B 62 -10.740 4.641 -12.708 1.00 0.41 C ATOM 2473 CD GLN B 62 -9.251 4.722 -13.049 1.00 0.56 C ATOM 2474 OE1 GLN B 62 -8.594 5.691 -12.725 1.00 1.26 O ATOM 2475 NE2 GLN B 62 -8.687 3.736 -13.691 1.00 1.42 N ATOM 0 H GLN B 62 -12.341 3.370 -9.261 1.00 0.28 H new ATOM 0 HA GLN B 62 -9.993 2.917 -11.033 1.00 0.30 H new ATOM 0 HB2 GLN B 62 -11.973 5.157 -11.018 1.00 0.31 H new ATOM 0 HB3 GLN B 62 -10.316 5.711 -10.887 1.00 0.31 H new ATOM 0 HG2 GLN B 62 -11.134 3.663 -12.986 1.00 0.41 H new ATOM 0 HG3 GLN B 62 -11.295 5.383 -13.282 1.00 0.41 H new ATOM 0 HE21 GLN B 62 -9.239 2.922 -13.963 1.00 1.42 H new ATOM 0 HE22 GLN B 62 -7.694 3.779 -13.921 1.00 1.42 H new ATOM 2484 N LEU B 63 -8.457 4.093 -9.436 1.00 0.33 N ATOM 2485 CA LEU B 63 -7.514 4.514 -8.364 1.00 0.33 C ATOM 2486 C LEU B 63 -7.258 6.015 -8.525 1.00 0.34 C ATOM 2487 O LEU B 63 -6.767 6.442 -9.552 1.00 0.39 O ATOM 2488 CB LEU B 63 -6.205 3.731 -8.550 1.00 0.36 C ATOM 2489 CG LEU B 63 -5.201 4.064 -7.438 1.00 0.36 C ATOM 2490 CD1 LEU B 63 -4.419 2.801 -7.060 1.00 0.54 C ATOM 2491 CD2 LEU B 63 -4.204 5.124 -7.926 1.00 0.52 C ATOM 0 H LEU B 63 -8.009 3.858 -10.322 1.00 0.33 H new ATOM 0 HA LEU B 63 -7.918 4.317 -7.371 1.00 0.33 H new ATOM 0 HB2 LEU B 63 -6.414 2.661 -8.548 1.00 0.36 H new ATOM 0 HB3 LEU B 63 -5.770 3.969 -9.521 1.00 0.36 H new ATOM 0 HG LEU B 63 -5.749 4.444 -6.576 1.00 0.36 H new ATOM 0 HD11 LEU B 63 -3.706 3.037 -6.270 1.00 0.54 H new ATOM 0 HD12 LEU B 63 -5.111 2.036 -6.707 1.00 0.54 H new ATOM 0 HD13 LEU B 63 -3.883 2.430 -7.934 1.00 0.54 H new ATOM 0 HD21 LEU B 63 -3.497 5.352 -7.129 1.00 0.52 H new ATOM 0 HD22 LEU B 63 -3.664 4.743 -8.793 1.00 0.52 H new ATOM 0 HD23 LEU B 63 -4.743 6.030 -8.203 1.00 0.52 H new ATOM 2503 N VAL B 64 -7.588 6.818 -7.541 1.00 0.33 N ATOM 2504 CA VAL B 64 -7.360 8.293 -7.676 1.00 0.37 C ATOM 2505 C VAL B 64 -6.343 8.785 -6.640 1.00 0.36 C ATOM 2506 O VAL B 64 -5.822 9.876 -6.761 1.00 0.41 O ATOM 2507 CB VAL B 64 -8.679 9.041 -7.512 1.00 0.41 C ATOM 2508 CG1 VAL B 64 -9.317 8.671 -6.179 1.00 1.08 C ATOM 2509 CG2 VAL B 64 -8.426 10.548 -7.549 1.00 1.43 C ATOM 0 H VAL B 64 -8.002 6.520 -6.658 1.00 0.33 H new ATOM 0 HA VAL B 64 -6.958 8.490 -8.670 1.00 0.37 H new ATOM 0 HB VAL B 64 -9.349 8.764 -8.326 1.00 0.41 H new ATOM 0 HG11 VAL B 64 -10.259 9.207 -6.065 1.00 1.08 H new ATOM 0 HG12 VAL B 64 -9.505 7.598 -6.151 1.00 1.08 H new ATOM 0 HG13 VAL B 64 -8.644 8.943 -5.366 1.00 1.08 H new ATOM 0 HG21 VAL B 64 -9.371 11.079 -7.432 1.00 1.43 H new ATOM 0 HG22 VAL B 64 -7.752 10.824 -6.738 1.00 1.43 H new ATOM 0 HG23 VAL B 64 -7.975 10.818 -8.504 1.00 1.43 H new ATOM 2519 N ASN B 65 -6.015 8.000 -5.642 1.00 0.32 N ATOM 2520 CA ASN B 65 -4.994 8.461 -4.659 1.00 0.34 C ATOM 2521 C ASN B 65 -4.624 7.307 -3.730 1.00 0.30 C ATOM 2522 O ASN B 65 -5.455 6.500 -3.370 1.00 0.28 O ATOM 2523 CB ASN B 65 -5.555 9.614 -3.839 1.00 0.36 C ATOM 2524 CG ASN B 65 -4.741 10.880 -4.112 1.00 0.48 C ATOM 2525 OD1 ASN B 65 -3.922 11.274 -3.305 1.00 1.28 O ATOM 2526 ND2 ASN B 65 -4.932 11.537 -5.223 1.00 1.09 N ATOM 0 H ASN B 65 -6.405 7.074 -5.470 1.00 0.32 H new ATOM 0 HA ASN B 65 -4.105 8.798 -5.193 1.00 0.34 H new ATOM 0 HB2 ASN B 65 -6.602 9.780 -4.094 1.00 0.36 H new ATOM 0 HB3 ASN B 65 -5.521 9.369 -2.777 1.00 0.36 H new ATOM 0 HD21 ASN B 65 -4.394 12.382 -5.415 1.00 1.09 H new ATOM 0 HD22 ASN B 65 -5.620 11.206 -5.900 1.00 1.09 H new ATOM 2533 N VAL B 66 -3.378 7.225 -3.346 1.00 0.29 N ATOM 2534 CA VAL B 66 -2.930 6.122 -2.451 1.00 0.26 C ATOM 2535 C VAL B 66 -1.666 6.558 -1.718 1.00 0.27 C ATOM 2536 O VAL B 66 -0.757 7.104 -2.311 1.00 0.31 O ATOM 2537 CB VAL B 66 -2.590 4.882 -3.287 1.00 0.30 C ATOM 2538 CG1 VAL B 66 -2.039 3.785 -2.375 1.00 0.90 C ATOM 2539 CG2 VAL B 66 -3.837 4.362 -4.006 1.00 0.66 C ATOM 0 H VAL B 66 -2.646 7.882 -3.617 1.00 0.29 H new ATOM 0 HA VAL B 66 -3.727 5.890 -1.744 1.00 0.26 H new ATOM 0 HB VAL B 66 -1.842 5.157 -4.030 1.00 0.30 H new ATOM 0 HG11 VAL B 66 -1.798 2.904 -2.970 1.00 0.90 H new ATOM 0 HG12 VAL B 66 -1.138 4.144 -1.877 1.00 0.90 H new ATOM 0 HG13 VAL B 66 -2.788 3.524 -1.627 1.00 0.90 H new ATOM 0 HG21 VAL B 66 -3.577 3.482 -4.594 1.00 0.66 H new ATOM 0 HG22 VAL B 66 -4.596 4.096 -3.271 1.00 0.66 H new ATOM 0 HG23 VAL B 66 -4.227 5.137 -4.666 1.00 0.66 H new ATOM 2549 N GLN B 67 -1.606 6.334 -0.434 1.00 0.25 N ATOM 2550 CA GLN B 67 -0.402 6.751 0.326 1.00 0.28 C ATOM 2551 C GLN B 67 -0.063 5.719 1.394 1.00 0.25 C ATOM 2552 O GLN B 67 -0.880 4.913 1.796 1.00 0.23 O ATOM 2553 CB GLN B 67 -0.664 8.101 0.992 1.00 0.29 C ATOM 2554 CG GLN B 67 0.666 8.734 1.411 1.00 0.37 C ATOM 2555 CD GLN B 67 0.410 10.141 1.956 1.00 0.64 C ATOM 2556 OE1 GLN B 67 -0.696 10.639 1.889 1.00 1.11 O ATOM 2557 NE2 GLN B 67 1.394 10.807 2.495 1.00 1.44 N ATOM 0 H GLN B 67 -2.336 5.882 0.116 1.00 0.25 H new ATOM 0 HA GLN B 67 0.438 6.834 -0.364 1.00 0.28 H new ATOM 0 HB2 GLN B 67 -1.192 8.761 0.304 1.00 0.29 H new ATOM 0 HB3 GLN B 67 -1.306 7.970 1.863 1.00 0.29 H new ATOM 0 HG2 GLN B 67 1.150 8.120 2.171 1.00 0.37 H new ATOM 0 HG3 GLN B 67 1.344 8.780 0.559 1.00 0.37 H new ATOM 0 HE21 GLN B 67 2.323 10.389 2.551 1.00 1.44 H new ATOM 0 HE22 GLN B 67 1.235 11.746 2.860 1.00 1.44 H new ATOM 2566 N THR B 68 1.157 5.751 1.834 1.00 0.26 N ATOM 2567 CA THR B 68 1.619 4.786 2.867 1.00 0.26 C ATOM 2568 C THR B 68 2.456 5.530 3.891 1.00 0.25 C ATOM 2569 O THR B 68 3.038 6.556 3.602 1.00 0.33 O ATOM 2570 CB THR B 68 2.483 3.713 2.203 1.00 0.33 C ATOM 2571 OG1 THR B 68 3.145 4.278 1.082 1.00 0.42 O ATOM 2572 CG2 THR B 68 1.621 2.542 1.744 1.00 0.45 C ATOM 0 H THR B 68 1.866 6.413 1.519 1.00 0.26 H new ATOM 0 HA THR B 68 0.761 4.320 3.351 1.00 0.26 H new ATOM 0 HB THR B 68 3.213 3.348 2.925 1.00 0.33 H new ATOM 0 HG1 THR B 68 4.067 4.503 1.326 1.00 0.42 H new ATOM 0 HG21 THR B 68 2.252 1.788 1.274 1.00 0.45 H new ATOM 0 HG22 THR B 68 1.113 2.105 2.604 1.00 0.45 H new ATOM 0 HG23 THR B 68 0.881 2.895 1.026 1.00 0.45 H new ATOM 2580 N GLY B 69 2.554 5.013 5.082 1.00 0.24 N ATOM 2581 CA GLY B 69 3.386 5.673 6.119 1.00 0.28 C ATOM 2582 C GLY B 69 3.302 4.827 7.393 1.00 0.26 C ATOM 2583 O GLY B 69 2.382 4.062 7.558 1.00 0.29 O ATOM 0 H GLY B 69 2.090 4.156 5.382 1.00 0.24 H new ATOM 0 HA2 GLY B 69 4.420 5.757 5.783 1.00 0.28 H new ATOM 0 HA3 GLY B 69 3.029 6.685 6.308 1.00 0.28 H new ATOM 2587 N SER B 70 4.251 4.938 8.279 1.00 0.24 N ATOM 2588 CA SER B 70 4.201 4.144 9.543 1.00 0.25 C ATOM 2589 C SER B 70 3.601 5.005 10.664 1.00 0.29 C ATOM 2590 O SER B 70 3.674 6.217 10.624 1.00 0.31 O ATOM 2591 CB SER B 70 5.612 3.700 9.924 1.00 0.27 C ATOM 2592 OG SER B 70 6.359 4.828 10.361 1.00 0.39 O ATOM 0 H SER B 70 5.064 5.547 8.184 1.00 0.24 H new ATOM 0 HA SER B 70 3.578 3.262 9.397 1.00 0.25 H new ATOM 0 HB2 SER B 70 5.569 2.950 10.714 1.00 0.27 H new ATOM 0 HB3 SER B 70 6.102 3.234 9.069 1.00 0.27 H new ATOM 0 HG SER B 70 7.264 4.545 10.607 1.00 0.39 H new ATOM 2598 N GLU B 71 3.011 4.399 11.669 1.00 0.32 N ATOM 2599 CA GLU B 71 2.425 5.213 12.777 1.00 0.39 C ATOM 2600 C GLU B 71 2.403 4.412 14.071 1.00 0.40 C ATOM 2601 O GLU B 71 2.699 3.234 14.098 1.00 0.37 O ATOM 2602 CB GLU B 71 0.998 5.631 12.433 1.00 0.40 C ATOM 2603 CG GLU B 71 0.062 4.421 12.475 1.00 0.49 C ATOM 2604 CD GLU B 71 -0.692 4.400 13.805 1.00 0.68 C ATOM 2605 OE1 GLU B 71 -1.233 5.430 14.174 1.00 1.26 O ATOM 2606 OE2 GLU B 71 -0.717 3.356 14.431 1.00 1.49 O ATOM 0 H GLU B 71 2.912 3.389 11.768 1.00 0.32 H new ATOM 0 HA GLU B 71 3.045 6.100 12.907 1.00 0.39 H new ATOM 0 HB2 GLU B 71 0.655 6.389 13.137 1.00 0.40 H new ATOM 0 HB3 GLU B 71 0.974 6.083 11.441 1.00 0.40 H new ATOM 0 HG2 GLU B 71 -0.644 4.466 11.646 1.00 0.49 H new ATOM 0 HG3 GLU B 71 0.635 3.501 12.356 1.00 0.49 H new ATOM 2613 N VAL B 72 2.091 5.063 15.157 1.00 0.45 N ATOM 2614 CA VAL B 72 2.093 4.363 16.463 1.00 0.49 C ATOM 2615 C VAL B 72 0.734 3.733 16.756 1.00 0.52 C ATOM 2616 O VAL B 72 -0.307 4.328 16.551 1.00 0.71 O ATOM 2617 CB VAL B 72 2.447 5.347 17.581 1.00 0.59 C ATOM 2618 CG1 VAL B 72 3.585 4.767 18.424 1.00 0.56 C ATOM 2619 CG2 VAL B 72 2.894 6.680 16.976 1.00 0.87 C ATOM 0 H VAL B 72 1.835 6.050 15.192 1.00 0.45 H new ATOM 0 HA VAL B 72 2.839 3.570 16.417 1.00 0.49 H new ATOM 0 HB VAL B 72 1.570 5.511 18.207 1.00 0.59 H new ATOM 0 HG11 VAL B 72 3.840 5.465 19.221 1.00 0.56 H new ATOM 0 HG12 VAL B 72 3.269 3.819 18.859 1.00 0.56 H new ATOM 0 HG13 VAL B 72 4.458 4.603 17.793 1.00 0.56 H new ATOM 0 HG21 VAL B 72 3.145 7.377 17.776 1.00 0.87 H new ATOM 0 HG22 VAL B 72 3.770 6.519 16.347 1.00 0.87 H new ATOM 0 HG23 VAL B 72 2.086 7.095 16.373 1.00 0.87 H new ATOM 2629 N ARG B 73 0.749 2.525 17.254 1.00 0.47 N ATOM 2630 CA ARG B 73 -0.520 1.824 17.589 1.00 0.50 C ATOM 2631 C ARG B 73 -0.271 0.871 18.762 1.00 0.54 C ATOM 2632 O ARG B 73 0.230 -0.221 18.589 1.00 0.55 O ATOM 2633 CB ARG B 73 -0.999 1.031 16.375 1.00 0.49 C ATOM 2634 CG ARG B 73 -2.474 1.337 16.112 1.00 0.62 C ATOM 2635 CD ARG B 73 -2.934 0.572 14.873 1.00 0.72 C ATOM 2636 NE ARG B 73 -4.387 0.819 14.645 1.00 0.90 N ATOM 2637 CZ ARG B 73 -5.278 0.141 15.316 1.00 1.40 C ATOM 2638 NH1 ARG B 73 -4.901 -0.758 16.182 1.00 2.18 N ATOM 2639 NH2 ARG B 73 -6.549 0.364 15.121 1.00 1.68 N ATOM 0 H ARG B 73 1.597 1.990 17.444 1.00 0.47 H new ATOM 0 HA ARG B 73 -1.282 2.552 17.865 1.00 0.50 H new ATOM 0 HB2 ARG B 73 -0.402 1.290 15.500 1.00 0.49 H new ATOM 0 HB3 ARG B 73 -0.864 -0.037 16.549 1.00 0.49 H new ATOM 0 HG2 ARG B 73 -3.076 1.051 16.974 1.00 0.62 H new ATOM 0 HG3 ARG B 73 -2.615 2.408 15.966 1.00 0.62 H new ATOM 0 HD2 ARG B 73 -2.360 0.890 14.003 1.00 0.72 H new ATOM 0 HD3 ARG B 73 -2.752 -0.495 15.003 1.00 0.72 H new ATOM 0 HE ARG B 73 -4.685 1.518 13.964 1.00 0.90 H new ATOM 0 HH11 ARG B 73 -3.908 -0.933 16.336 1.00 2.18 H new ATOM 0 HH12 ARG B 73 -5.599 -1.287 16.705 1.00 2.18 H new ATOM 0 HH21 ARG B 73 -6.845 1.068 14.445 1.00 1.68 H new ATOM 0 HH22 ARG B 73 -7.246 -0.165 15.645 1.00 1.68 H new ATOM 2653 N ASP B 74 -0.601 1.308 19.955 1.00 0.59 N ATOM 2654 CA ASP B 74 -0.395 0.484 21.188 1.00 0.65 C ATOM 2655 C ASP B 74 1.008 0.738 21.741 1.00 0.65 C ATOM 2656 O ASP B 74 1.664 -0.158 22.235 1.00 0.67 O ATOM 2657 CB ASP B 74 -0.569 -1.008 20.886 1.00 0.66 C ATOM 2658 CG ASP B 74 -1.039 -1.734 22.148 1.00 0.76 C ATOM 2659 OD1 ASP B 74 -0.329 -1.678 23.139 1.00 1.25 O ATOM 2660 OD2 ASP B 74 -2.099 -2.334 22.102 1.00 1.35 O ATOM 0 H ASP B 74 -1.015 2.224 20.128 1.00 0.59 H new ATOM 0 HA ASP B 74 -1.142 0.773 21.927 1.00 0.65 H new ATOM 0 HB2 ASP B 74 -1.294 -1.145 20.084 1.00 0.66 H new ATOM 0 HB3 ASP B 74 0.374 -1.432 20.540 1.00 0.66 H new ATOM 2665 N ARG B 75 1.474 1.959 21.641 1.00 0.64 N ATOM 2666 CA ARG B 75 2.838 2.318 22.140 1.00 0.66 C ATOM 2667 C ARG B 75 3.893 1.576 21.318 1.00 0.60 C ATOM 2668 O ARG B 75 4.950 1.214 21.796 1.00 0.65 O ATOM 2669 CB ARG B 75 2.979 1.997 23.634 1.00 0.75 C ATOM 2670 CG ARG B 75 2.798 3.285 24.440 1.00 0.85 C ATOM 2671 CD ARG B 75 1.473 3.945 24.053 1.00 0.86 C ATOM 2672 NE ARG B 75 0.818 4.501 25.271 1.00 1.19 N ATOM 2673 CZ ARG B 75 -0.155 5.364 25.151 1.00 1.81 C ATOM 2674 NH1 ARG B 75 -0.559 5.732 23.967 1.00 2.57 N ATOM 2675 NH2 ARG B 75 -0.725 5.858 26.218 1.00 2.18 N ATOM 0 H ARG B 75 0.957 2.735 21.227 1.00 0.64 H new ATOM 0 HA ARG B 75 2.987 3.391 22.022 1.00 0.66 H new ATOM 0 HB2 ARG B 75 2.235 1.259 23.932 1.00 0.75 H new ATOM 0 HB3 ARG B 75 3.958 1.562 23.835 1.00 0.75 H new ATOM 0 HG2 ARG B 75 2.809 3.064 25.507 1.00 0.85 H new ATOM 0 HG3 ARG B 75 3.626 3.967 24.248 1.00 0.85 H new ATOM 0 HD2 ARG B 75 1.649 4.739 23.327 1.00 0.86 H new ATOM 0 HD3 ARG B 75 0.818 3.216 23.576 1.00 0.86 H new ATOM 0 HE ARG B 75 1.129 4.208 26.197 1.00 1.19 H new ATOM 0 HH11 ARG B 75 -0.115 5.346 23.134 1.00 2.57 H new ATOM 0 HH12 ARG B 75 -1.319 6.406 23.874 1.00 2.57 H new ATOM 0 HH21 ARG B 75 -0.410 5.570 27.144 1.00 2.18 H new ATOM 0 HH22 ARG B 75 -1.485 6.532 26.125 1.00 2.18 H new ATOM 2689 N ARG B 76 3.616 1.393 20.063 1.00 0.50 N ATOM 2690 CA ARG B 76 4.599 0.725 19.171 1.00 0.44 C ATOM 2691 C ARG B 76 4.322 1.143 17.738 1.00 0.40 C ATOM 2692 O ARG B 76 3.222 1.527 17.399 1.00 0.39 O ATOM 2693 CB ARG B 76 4.492 -0.789 19.253 1.00 0.45 C ATOM 2694 CG ARG B 76 5.771 -1.378 19.868 1.00 0.62 C ATOM 2695 CD ARG B 76 5.827 -2.871 19.579 1.00 1.29 C ATOM 2696 NE ARG B 76 4.698 -3.559 20.267 1.00 1.55 N ATOM 2697 CZ ARG B 76 4.347 -4.761 19.900 1.00 2.38 C ATOM 2698 NH1 ARG B 76 4.980 -5.356 18.925 1.00 3.14 N ATOM 2699 NH2 ARG B 76 3.365 -5.369 20.507 1.00 2.85 N ATOM 0 H ARG B 76 2.747 1.678 19.612 1.00 0.50 H new ATOM 0 HA ARG B 76 5.599 1.022 19.488 1.00 0.44 H new ATOM 0 HB2 ARG B 76 3.628 -1.068 19.856 1.00 0.45 H new ATOM 0 HB3 ARG B 76 4.334 -1.204 18.258 1.00 0.45 H new ATOM 0 HG2 ARG B 76 6.649 -0.883 19.454 1.00 0.62 H new ATOM 0 HG3 ARG B 76 5.785 -1.203 20.944 1.00 0.62 H new ATOM 0 HD2 ARG B 76 5.771 -3.045 18.505 1.00 1.29 H new ATOM 0 HD3 ARG B 76 6.777 -3.282 19.920 1.00 1.29 H new ATOM 0 HE ARG B 76 4.200 -3.091 21.024 1.00 1.55 H new ATOM 0 HH11 ARG B 76 5.748 -4.881 18.451 1.00 3.14 H new ATOM 0 HH12 ARG B 76 4.706 -6.296 18.638 1.00 3.14 H new ATOM 0 HH21 ARG B 76 2.871 -4.905 21.269 1.00 2.85 H new ATOM 0 HH22 ARG B 76 3.091 -6.309 20.219 1.00 2.85 H new ATOM 2713 N ARG B 77 5.316 1.099 16.904 1.00 0.38 N ATOM 2714 CA ARG B 77 5.101 1.541 15.500 1.00 0.34 C ATOM 2715 C ARG B 77 4.617 0.407 14.620 1.00 0.30 C ATOM 2716 O ARG B 77 4.962 -0.745 14.789 1.00 0.32 O ATOM 2717 CB ARG B 77 6.372 2.140 14.904 1.00 0.36 C ATOM 2718 CG ARG B 77 6.000 3.424 14.155 1.00 0.47 C ATOM 2719 CD ARG B 77 7.158 3.855 13.258 1.00 0.48 C ATOM 2720 NE ARG B 77 8.394 4.012 14.077 1.00 1.12 N ATOM 2721 CZ ARG B 77 8.615 5.125 14.726 1.00 1.45 C ATOM 2722 NH1 ARG B 77 7.741 6.094 14.679 1.00 1.69 N ATOM 2723 NH2 ARG B 77 9.707 5.266 15.425 1.00 2.39 N ATOM 0 H ARG B 77 6.259 0.780 17.127 1.00 0.38 H new ATOM 0 HA ARG B 77 4.328 2.309 15.532 1.00 0.34 H new ATOM 0 HB2 ARG B 77 7.094 2.357 15.691 1.00 0.36 H new ATOM 0 HB3 ARG B 77 6.844 1.429 14.226 1.00 0.36 H new ATOM 0 HG2 ARG B 77 5.105 3.259 13.555 1.00 0.47 H new ATOM 0 HG3 ARG B 77 5.765 4.216 14.867 1.00 0.47 H new ATOM 0 HD2 ARG B 77 7.320 3.114 12.475 1.00 0.48 H new ATOM 0 HD3 ARG B 77 6.917 4.795 12.762 1.00 0.48 H new ATOM 0 HE ARG B 77 9.069 3.249 14.131 1.00 1.12 H new ATOM 0 HH11 ARG B 77 6.885 5.983 14.136 1.00 1.69 H new ATOM 0 HH12 ARG B 77 7.914 6.962 15.186 1.00 1.69 H new ATOM 0 HH21 ARG B 77 10.388 4.508 15.465 1.00 2.39 H new ATOM 0 HH22 ARG B 77 9.880 6.134 15.932 1.00 2.39 H new ATOM 2737 N ILE B 78 3.787 0.758 13.683 1.00 0.26 N ATOM 2738 CA ILE B 78 3.210 -0.236 12.756 1.00 0.23 C ATOM 2739 C ILE B 78 3.071 0.417 11.383 1.00 0.21 C ATOM 2740 O ILE B 78 3.077 1.625 11.254 1.00 0.22 O ATOM 2741 CB ILE B 78 1.820 -0.622 13.284 1.00 0.24 C ATOM 2742 CG1 ILE B 78 1.367 -1.994 12.757 1.00 0.26 C ATOM 2743 CG2 ILE B 78 0.805 0.425 12.842 1.00 0.32 C ATOM 2744 CD1 ILE B 78 0.514 -2.682 13.825 1.00 0.58 C ATOM 0 H ILE B 78 3.480 1.717 13.521 1.00 0.26 H new ATOM 0 HA ILE B 78 3.841 -1.122 12.681 1.00 0.23 H new ATOM 0 HB ILE B 78 1.882 -0.674 14.371 1.00 0.24 H new ATOM 0 HG12 ILE B 78 0.794 -1.873 11.838 1.00 0.26 H new ATOM 0 HG13 ILE B 78 2.234 -2.609 12.514 1.00 0.26 H new ATOM 0 HG21 ILE B 78 -0.183 0.154 13.215 1.00 0.32 H new ATOM 0 HG22 ILE B 78 1.089 1.399 13.241 1.00 0.32 H new ATOM 0 HG23 ILE B 78 0.781 0.472 11.753 1.00 0.32 H new ATOM 0 HD11 ILE B 78 0.189 -3.656 13.459 1.00 0.58 H new ATOM 0 HD12 ILE B 78 1.104 -2.814 14.732 1.00 0.58 H new ATOM 0 HD13 ILE B 78 -0.359 -2.067 14.045 1.00 0.58 H new ATOM 2756 N SER B 79 2.977 -0.369 10.360 1.00 0.20 N ATOM 2757 CA SER B 79 2.873 0.198 8.994 1.00 0.19 C ATOM 2758 C SER B 79 1.403 0.452 8.671 1.00 0.20 C ATOM 2759 O SER B 79 0.527 -0.220 9.173 1.00 0.22 O ATOM 2760 CB SER B 79 3.459 -0.804 7.994 1.00 0.22 C ATOM 2761 OG SER B 79 3.888 -1.962 8.695 1.00 0.61 O ATOM 0 H SER B 79 2.967 -1.388 10.408 1.00 0.20 H new ATOM 0 HA SER B 79 3.424 1.137 8.932 1.00 0.19 H new ATOM 0 HB2 SER B 79 2.711 -1.072 7.248 1.00 0.22 H new ATOM 0 HB3 SER B 79 4.297 -0.356 7.460 1.00 0.22 H new ATOM 0 HG SER B 79 4.744 -2.268 8.328 1.00 0.61 H new ATOM 2767 N TYR B 80 1.132 1.425 7.838 1.00 0.23 N ATOM 2768 CA TYR B 80 -0.288 1.723 7.489 1.00 0.29 C ATOM 2769 C TYR B 80 -0.398 2.143 6.031 1.00 0.29 C ATOM 2770 O TYR B 80 0.533 2.657 5.442 1.00 0.27 O ATOM 2771 CB TYR B 80 -0.879 2.803 8.433 1.00 0.41 C ATOM 2772 CG TYR B 80 -0.370 4.196 8.110 1.00 0.94 C ATOM 2773 CD1 TYR B 80 -0.801 4.864 6.951 1.00 1.63 C ATOM 2774 CD2 TYR B 80 0.528 4.829 8.982 1.00 1.88 C ATOM 2775 CE1 TYR B 80 -0.329 6.151 6.668 1.00 2.58 C ATOM 2776 CE2 TYR B 80 0.999 6.119 8.692 1.00 2.80 C ATOM 2777 CZ TYR B 80 0.572 6.775 7.535 1.00 3.04 C ATOM 2778 OH TYR B 80 1.037 8.043 7.251 1.00 4.08 O ATOM 0 H TYR B 80 1.827 2.021 7.388 1.00 0.23 H new ATOM 0 HA TYR B 80 -0.874 0.814 7.626 1.00 0.29 H new ATOM 0 HB2 TYR B 80 -1.966 2.790 8.359 1.00 0.41 H new ATOM 0 HB3 TYR B 80 -0.627 2.557 9.465 1.00 0.41 H new ATOM 0 HD1 TYR B 80 -1.497 4.384 6.279 1.00 1.63 H new ATOM 0 HD2 TYR B 80 0.857 4.323 9.878 1.00 1.88 H new ATOM 0 HE1 TYR B 80 -0.662 6.663 5.777 1.00 2.58 H new ATOM 0 HE2 TYR B 80 1.692 6.605 9.363 1.00 2.80 H new ATOM 0 HH TYR B 80 1.654 8.330 7.956 1.00 4.08 H new ATOM 2788 N ILE B 81 -1.541 1.888 5.441 1.00 0.31 N ATOM 2789 CA ILE B 81 -1.754 2.223 4.005 1.00 0.32 C ATOM 2790 C ILE B 81 -3.033 3.029 3.809 1.00 0.31 C ATOM 2791 O ILE B 81 -4.082 2.705 4.342 1.00 0.31 O ATOM 2792 CB ILE B 81 -1.887 0.925 3.203 1.00 0.35 C ATOM 2793 CG1 ILE B 81 -1.874 1.242 1.705 1.00 0.70 C ATOM 2794 CG2 ILE B 81 -3.216 0.251 3.557 1.00 0.90 C ATOM 2795 CD1 ILE B 81 -1.752 -0.058 0.907 1.00 0.69 C ATOM 0 H ILE B 81 -2.342 1.457 5.902 1.00 0.31 H new ATOM 0 HA ILE B 81 -0.903 2.814 3.666 1.00 0.32 H new ATOM 0 HB ILE B 81 -1.055 0.263 3.444 1.00 0.35 H new ATOM 0 HG12 ILE B 81 -2.787 1.768 1.426 1.00 0.70 H new ATOM 0 HG13 ILE B 81 -1.041 1.904 1.470 1.00 0.70 H new ATOM 0 HG21 ILE B 81 -3.317 -0.674 2.989 1.00 0.90 H new ATOM 0 HG22 ILE B 81 -3.237 0.027 4.623 1.00 0.90 H new ATOM 0 HG23 ILE B 81 -4.040 0.920 3.310 1.00 0.90 H new ATOM 0 HD11 ILE B 81 -1.743 0.169 -0.159 1.00 0.69 H new ATOM 0 HD12 ILE B 81 -0.826 -0.566 1.178 1.00 0.69 H new ATOM 0 HD13 ILE B 81 -2.600 -0.705 1.133 1.00 0.69 H new ATOM 2807 N LEU B 82 -2.945 4.066 3.019 1.00 0.30 N ATOM 2808 CA LEU B 82 -4.131 4.909 2.718 1.00 0.29 C ATOM 2809 C LEU B 82 -4.482 4.665 1.250 1.00 0.27 C ATOM 2810 O LEU B 82 -3.633 4.806 0.393 1.00 0.30 O ATOM 2811 CB LEU B 82 -3.775 6.387 2.912 1.00 0.31 C ATOM 2812 CG LEU B 82 -2.843 6.559 4.115 1.00 0.33 C ATOM 2813 CD1 LEU B 82 -2.492 8.039 4.278 1.00 0.34 C ATOM 2814 CD2 LEU B 82 -3.548 6.070 5.385 1.00 0.37 C ATOM 0 H LEU B 82 -2.084 4.367 2.563 1.00 0.30 H new ATOM 0 HA LEU B 82 -4.965 4.662 3.375 1.00 0.29 H new ATOM 0 HB2 LEU B 82 -3.294 6.773 2.013 1.00 0.31 H new ATOM 0 HB3 LEU B 82 -4.684 6.970 3.062 1.00 0.31 H new ATOM 0 HG LEU B 82 -1.935 5.979 3.953 1.00 0.33 H new ATOM 0 HD11 LEU B 82 -1.829 8.163 5.134 1.00 0.34 H new ATOM 0 HD12 LEU B 82 -1.993 8.396 3.377 1.00 0.34 H new ATOM 0 HD13 LEU B 82 -3.404 8.614 4.439 1.00 0.34 H new ATOM 0 HD21 LEU B 82 -2.884 6.193 6.240 1.00 0.37 H new ATOM 0 HD22 LEU B 82 -4.456 6.652 5.544 1.00 0.37 H new ATOM 0 HD23 LEU B 82 -3.807 5.017 5.275 1.00 0.37 H new ATOM 2826 N LEU B 83 -5.695 4.265 0.945 1.00 0.23 N ATOM 2827 CA LEU B 83 -6.037 3.979 -0.488 1.00 0.23 C ATOM 2828 C LEU B 83 -7.319 4.695 -0.905 1.00 0.22 C ATOM 2829 O LEU B 83 -8.346 4.595 -0.265 1.00 0.21 O ATOM 2830 CB LEU B 83 -6.211 2.467 -0.663 1.00 0.25 C ATOM 2831 CG LEU B 83 -5.428 1.951 -1.884 1.00 0.48 C ATOM 2832 CD1 LEU B 83 -5.183 0.445 -1.746 1.00 0.46 C ATOM 2833 CD2 LEU B 83 -6.250 2.208 -3.146 1.00 0.98 C ATOM 0 H LEU B 83 -6.453 4.126 1.614 1.00 0.23 H new ATOM 0 HA LEU B 83 -5.228 4.344 -1.121 1.00 0.23 H new ATOM 0 HB2 LEU B 83 -5.868 1.953 0.235 1.00 0.25 H new ATOM 0 HB3 LEU B 83 -7.269 2.232 -0.781 1.00 0.25 H new ATOM 0 HG LEU B 83 -4.471 2.469 -1.946 1.00 0.48 H new ATOM 0 HD11 LEU B 83 -4.629 0.086 -2.613 1.00 0.46 H new ATOM 0 HD12 LEU B 83 -4.607 0.252 -0.841 1.00 0.46 H new ATOM 0 HD13 LEU B 83 -6.139 -0.075 -1.686 1.00 0.46 H new ATOM 0 HD21 LEU B 83 -5.703 1.846 -4.016 1.00 0.98 H new ATOM 0 HD22 LEU B 83 -7.203 1.684 -3.072 1.00 0.98 H new ATOM 0 HD23 LEU B 83 -6.431 3.278 -3.251 1.00 0.98 H new ATOM 2845 N ARG B 84 -7.236 5.434 -1.985 1.00 0.23 N ATOM 2846 CA ARG B 84 -8.413 6.201 -2.486 1.00 0.24 C ATOM 2847 C ARG B 84 -8.974 5.578 -3.767 1.00 0.30 C ATOM 2848 O ARG B 84 -8.367 5.631 -4.819 1.00 0.71 O ATOM 2849 CB ARG B 84 -7.981 7.640 -2.777 1.00 0.29 C ATOM 2850 CG ARG B 84 -9.184 8.585 -2.625 1.00 0.30 C ATOM 2851 CD ARG B 84 -8.736 10.052 -2.615 1.00 0.34 C ATOM 2852 NE ARG B 84 -9.707 10.859 -1.825 1.00 0.41 N ATOM 2853 CZ ARG B 84 -9.550 12.150 -1.726 1.00 0.50 C ATOM 2854 NH1 ARG B 84 -8.537 12.729 -2.311 1.00 0.55 N ATOM 2855 NH2 ARG B 84 -10.404 12.861 -1.044 1.00 0.60 N ATOM 0 H ARG B 84 -6.390 5.538 -2.546 1.00 0.23 H new ATOM 0 HA ARG B 84 -9.191 6.180 -1.723 1.00 0.24 H new ATOM 0 HB2 ARG B 84 -7.186 7.936 -2.093 1.00 0.29 H new ATOM 0 HB3 ARG B 84 -7.576 7.711 -3.787 1.00 0.29 H new ATOM 0 HG2 ARG B 84 -9.885 8.421 -3.444 1.00 0.30 H new ATOM 0 HG3 ARG B 84 -9.715 8.357 -1.701 1.00 0.30 H new ATOM 0 HD2 ARG B 84 -7.739 10.137 -2.183 1.00 0.34 H new ATOM 0 HD3 ARG B 84 -8.675 10.432 -3.635 1.00 0.34 H new ATOM 0 HE ARG B 84 -10.493 10.403 -1.362 1.00 0.41 H new ATOM 0 HH11 ARG B 84 -7.870 12.172 -2.845 1.00 0.55 H new ATOM 0 HH12 ARG B 84 -8.413 13.739 -2.235 1.00 0.55 H new ATOM 0 HH21 ARG B 84 -11.195 12.408 -0.587 1.00 0.60 H new ATOM 0 HH22 ARG B 84 -10.281 13.871 -0.967 1.00 0.60 H new ATOM 2869 N LEU B 85 -10.134 4.995 -3.677 1.00 0.31 N ATOM 2870 CA LEU B 85 -10.773 4.364 -4.872 1.00 0.28 C ATOM 2871 C LEU B 85 -11.757 5.350 -5.486 1.00 0.27 C ATOM 2872 O LEU B 85 -12.461 6.033 -4.787 1.00 0.29 O ATOM 2873 CB LEU B 85 -11.529 3.115 -4.404 1.00 0.29 C ATOM 2874 CG LEU B 85 -11.828 2.122 -5.543 1.00 0.56 C ATOM 2875 CD1 LEU B 85 -12.767 2.744 -6.582 1.00 1.44 C ATOM 2876 CD2 LEU B 85 -10.522 1.668 -6.209 1.00 0.93 C ATOM 0 H LEU B 85 -10.677 4.926 -2.816 1.00 0.31 H new ATOM 0 HA LEU B 85 -10.021 4.094 -5.613 1.00 0.28 H new ATOM 0 HB2 LEU B 85 -10.943 2.610 -3.636 1.00 0.29 H new ATOM 0 HB3 LEU B 85 -12.468 3.419 -3.941 1.00 0.29 H new ATOM 0 HG LEU B 85 -12.326 1.253 -5.114 1.00 0.56 H new ATOM 0 HD11 LEU B 85 -12.962 2.022 -7.375 1.00 1.44 H new ATOM 0 HD12 LEU B 85 -13.707 3.020 -6.104 1.00 1.44 H new ATOM 0 HD13 LEU B 85 -12.301 3.633 -7.007 1.00 1.44 H new ATOM 0 HD21 LEU B 85 -10.748 0.967 -7.012 1.00 0.93 H new ATOM 0 HD22 LEU B 85 -10.002 2.534 -6.619 1.00 0.93 H new ATOM 0 HD23 LEU B 85 -9.887 1.181 -5.469 1.00 0.93 H new ATOM 2888 N LYS B 86 -11.811 5.407 -6.787 1.00 0.31 N ATOM 2889 CA LYS B 86 -12.754 6.330 -7.479 1.00 0.33 C ATOM 2890 C LYS B 86 -13.670 5.523 -8.402 1.00 0.30 C ATOM 2891 O LYS B 86 -13.233 4.644 -9.111 1.00 0.34 O ATOM 2892 CB LYS B 86 -11.940 7.319 -8.300 1.00 0.39 C ATOM 2893 CG LYS B 86 -12.858 8.320 -9.009 1.00 0.41 C ATOM 2894 CD LYS B 86 -13.031 7.920 -10.481 1.00 0.41 C ATOM 2895 CE LYS B 86 -13.825 8.998 -11.221 1.00 0.51 C ATOM 2896 NZ LYS B 86 -13.034 9.486 -12.387 1.00 1.31 N ATOM 0 H LYS B 86 -11.232 4.844 -7.410 1.00 0.31 H new ATOM 0 HA LYS B 86 -13.365 6.863 -6.751 1.00 0.33 H new ATOM 0 HB2 LYS B 86 -11.245 7.852 -7.651 1.00 0.39 H new ATOM 0 HB3 LYS B 86 -11.342 6.782 -9.036 1.00 0.39 H new ATOM 0 HG2 LYS B 86 -13.829 8.349 -8.515 1.00 0.41 H new ATOM 0 HG3 LYS B 86 -12.436 9.323 -8.943 1.00 0.41 H new ATOM 0 HD2 LYS B 86 -12.055 7.789 -10.949 1.00 0.41 H new ATOM 0 HD3 LYS B 86 -13.549 6.963 -10.549 1.00 0.41 H new ATOM 0 HE2 LYS B 86 -14.779 8.594 -11.559 1.00 0.51 H new ATOM 0 HE3 LYS B 86 -14.049 9.826 -10.548 1.00 0.51 H new ATOM 0 HZ1 LYS B 86 -13.634 10.090 -12.985 1.00 1.31 H new ATOM 0 HZ2 LYS B 86 -12.218 10.035 -12.048 1.00 1.31 H new ATOM 0 HZ3 LYS B 86 -12.698 8.674 -12.943 1.00 1.31 H new ATOM 2910 N ARG B 87 -14.939 5.821 -8.396 1.00 0.28 N ATOM 2911 CA ARG B 87 -15.885 5.070 -9.281 1.00 0.27 C ATOM 2912 C ARG B 87 -16.117 5.836 -10.577 1.00 0.28 C ATOM 2913 O ARG B 87 -16.248 7.045 -10.585 1.00 0.32 O ATOM 2914 CB ARG B 87 -17.224 4.872 -8.575 1.00 0.29 C ATOM 2915 CG ARG B 87 -17.027 4.032 -7.311 1.00 0.61 C ATOM 2916 CD ARG B 87 -16.619 2.601 -7.686 1.00 0.42 C ATOM 2917 NE ARG B 87 -16.983 1.677 -6.574 1.00 0.48 N ATOM 2918 CZ ARG B 87 -18.206 1.237 -6.464 1.00 0.81 C ATOM 2919 NH1 ARG B 87 -19.112 1.601 -7.331 1.00 1.64 N ATOM 2920 NH2 ARG B 87 -18.524 0.432 -5.488 1.00 0.87 N ATOM 0 H ARG B 87 -15.365 6.548 -7.821 1.00 0.28 H new ATOM 0 HA ARG B 87 -15.444 4.099 -9.506 1.00 0.27 H new ATOM 0 HB2 ARG B 87 -17.655 5.839 -8.316 1.00 0.29 H new ATOM 0 HB3 ARG B 87 -17.928 4.378 -9.244 1.00 0.29 H new ATOM 0 HG2 ARG B 87 -16.261 4.483 -6.681 1.00 0.61 H new ATOM 0 HG3 ARG B 87 -17.949 4.015 -6.729 1.00 0.61 H new ATOM 0 HD2 ARG B 87 -17.120 2.297 -8.605 1.00 0.42 H new ATOM 0 HD3 ARG B 87 -15.547 2.554 -7.877 1.00 0.42 H new ATOM 0 HE ARG B 87 -16.275 1.389 -5.899 1.00 0.48 H new ATOM 0 HH11 ARG B 87 -18.864 2.230 -8.095 1.00 1.64 H new ATOM 0 HH12 ARG B 87 -20.068 1.257 -7.244 1.00 1.64 H new ATOM 0 HH21 ARG B 87 -17.816 0.147 -4.811 1.00 0.87 H new ATOM 0 HH22 ARG B 87 -19.480 0.088 -5.402 1.00 0.87 H new ATOM 2934 N VAL B 88 -16.184 5.125 -11.672 1.00 0.28 N ATOM 2935 CA VAL B 88 -16.426 5.778 -12.993 1.00 0.32 C ATOM 2936 C VAL B 88 -17.738 5.250 -13.567 1.00 0.34 C ATOM 2937 O VAL B 88 -18.228 5.725 -14.571 1.00 0.39 O ATOM 2938 CB VAL B 88 -15.277 5.448 -13.947 1.00 0.34 C ATOM 2939 CG1 VAL B 88 -15.683 5.797 -15.380 1.00 0.49 C ATOM 2940 CG2 VAL B 88 -14.036 6.255 -13.559 1.00 0.68 C ATOM 0 H VAL B 88 -16.081 4.111 -11.708 1.00 0.28 H new ATOM 0 HA VAL B 88 -16.484 6.859 -12.868 1.00 0.32 H new ATOM 0 HB VAL B 88 -15.052 4.384 -13.882 1.00 0.34 H new ATOM 0 HG11 VAL B 88 -14.863 5.561 -16.058 1.00 0.49 H new ATOM 0 HG12 VAL B 88 -16.563 5.218 -15.660 1.00 0.49 H new ATOM 0 HG13 VAL B 88 -15.913 6.861 -15.444 1.00 0.49 H new ATOM 0 HG21 VAL B 88 -13.220 6.017 -14.241 1.00 0.68 H new ATOM 0 HG22 VAL B 88 -14.261 7.320 -13.619 1.00 0.68 H new ATOM 0 HG23 VAL B 88 -13.742 6.004 -12.540 1.00 0.68 H new ATOM 2950 N TYR B 89 -18.317 4.277 -12.922 1.00 0.33 N ATOM 2951 CA TYR B 89 -19.606 3.724 -13.414 1.00 0.39 C ATOM 2952 C TYR B 89 -20.193 2.785 -12.358 1.00 0.50 C ATOM 2953 O TYR B 89 -21.257 3.093 -11.846 1.00 1.12 O ATOM 2954 CB TYR B 89 -19.378 2.950 -14.714 1.00 0.41 C ATOM 2955 CG TYR B 89 -20.689 2.372 -15.190 1.00 0.54 C ATOM 2956 CD1 TYR B 89 -21.539 3.136 -15.997 1.00 1.13 C ATOM 2957 CD2 TYR B 89 -21.056 1.072 -14.820 1.00 1.47 C ATOM 2958 CE1 TYR B 89 -22.757 2.600 -16.437 1.00 1.27 C ATOM 2959 CE2 TYR B 89 -22.273 0.536 -15.259 1.00 1.77 C ATOM 2960 CZ TYR B 89 -23.123 1.301 -16.067 1.00 1.26 C ATOM 2961 OH TYR B 89 -24.323 0.772 -16.498 1.00 1.66 O ATOM 2962 OXT TYR B 89 -19.570 1.775 -12.078 1.00 1.01 O ATOM 0 H TYR B 89 -17.952 3.841 -12.075 1.00 0.33 H new ATOM 0 HA TYR B 89 -20.300 4.544 -13.602 1.00 0.39 H new ATOM 0 HB2 TYR B 89 -18.961 3.610 -15.475 1.00 0.41 H new ATOM 0 HB3 TYR B 89 -18.653 2.152 -14.553 1.00 0.41 H new ATOM 0 HD1 TYR B 89 -21.257 4.139 -16.281 1.00 1.13 H new ATOM 0 HD2 TYR B 89 -20.400 0.483 -14.196 1.00 1.47 H new ATOM 0 HE1 TYR B 89 -23.413 3.189 -17.061 1.00 1.27 H new ATOM 0 HE2 TYR B 89 -22.556 -0.467 -14.975 1.00 1.77 H new ATOM 0 HH TYR B 89 -24.422 -0.140 -16.152 1.00 1.66 H new TER 2972 TYR B 89