USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1052 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 85 MET CE :methyl -170:sc= -8.27! (180deg=-6.83!) USER MOD Set 1.2: A 91 CYS SG : rot 150:sc= -3.66! USER MOD Set 2.1: A 20 LYS NZ :NH3+ -128:sc= 1.23 (180deg=-0.0648) USER MOD Set 2.2: A 84 SER OG : rot -46:sc= 1.26 USER MOD Set 3.1: A 50 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 114 SER OG : rot 60:sc= 0.491 USER MOD Set 4.1: A 41 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 68 HIS : no HE2:sc= 0.869 K(o=0.87,f=-5!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 46:sc= 0.205 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 GLN : amide:sc= -0.634 X(o=-0.63,f=-0.59) USER MOD Single : A 9 LYS NZ :NH3+ -147:sc= 1 (180deg=0.369) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot -170:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 151:sc= 1.28 (180deg=0.373) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= -1.75! C(o=-1.7!,f=-7.5!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ -171:sc= -0.194 (180deg=-0.227) USER MOD Single : A 38 ASN : amide:sc= -2.57! C(o=-2.6!,f=-8.1!) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 TYR OH : rot -121:sc= 1.16 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot -34:sc= 0.619 USER MOD Single : A 53 LYS NZ :NH3+ 152:sc= 1.08 (180deg=0.588) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -0.571 X(o=-0.57,f=-0.55) USER MOD Single : A 66 LYS NZ :NH3+ 168:sc=-0.00478 (180deg=-0.12) USER MOD Single : A 71 GLN : amide:sc= -1.46! C(o=-1.5!,f=-5.9!) USER MOD Single : A 76 LYS NZ :NH3+ -122:sc= 0.347 (180deg=-3.99!) USER MOD Single : A 81 CYS SG : rot 110:sc= -2.05 USER MOD Single : A 83 SER OG : rot 73:sc= 0.496 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 90 LYS NZ :NH3+ -178:sc= 1.78 (180deg=1.78) USER MOD Single : A 97 SER OG : rot 180:sc= 0.00782 USER MOD Single : A 98 MET CE :methyl 159:sc= -0.0679 (180deg=-0.724) USER MOD Single : A 99 TYR OH : rot -70:sc= 0.62 USER MOD Single : A 101 TYR OH : rot 30:sc= 0 USER MOD Single : A 106 CYS SG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 HIS : no HE2:sc= 0.118 K(o=0.12,f=-6.8!) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=-0.00041) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=-0.0075) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.809 1.169 -10.591 1.00 5.93 N ATOM 2 CA MET A 1 4.512 -0.233 -10.977 1.00 5.55 C ATOM 3 C MET A 1 5.715 -1.130 -10.692 1.00 5.18 C ATOM 4 O MET A 1 5.629 -2.052 -9.882 1.00 5.39 O ATOM 5 CB MET A 1 4.136 -0.303 -12.462 1.00 5.94 C ATOM 6 CG MET A 1 3.688 -1.682 -12.928 1.00 6.32 C ATOM 7 SD MET A 1 3.243 -1.713 -14.677 1.00 7.08 S ATOM 8 CE MET A 1 2.675 -3.402 -14.849 1.00 7.48 C ATOM 0 H1 MET A 1 3.982 1.767 -10.791 1.00 5.93 H new ATOM 0 H2 MET A 1 5.029 1.210 -9.575 1.00 5.93 H new ATOM 0 H3 MET A 1 5.625 1.514 -11.136 1.00 5.93 H new ATOM 0 HA MET A 1 3.669 -0.587 -10.384 1.00 5.55 H new ATOM 0 HB2 MET A 1 3.336 0.412 -12.657 1.00 5.94 H new ATOM 0 HB3 MET A 1 4.994 0.009 -13.058 1.00 5.94 H new ATOM 0 HG2 MET A 1 4.488 -2.400 -12.748 1.00 6.32 H new ATOM 0 HG3 MET A 1 2.832 -2.002 -12.333 1.00 6.32 H new ATOM 0 HE1 MET A 1 2.364 -3.578 -15.879 1.00 7.48 H new ATOM 0 HE2 MET A 1 3.484 -4.086 -14.592 1.00 7.48 H new ATOM 0 HE3 MET A 1 1.831 -3.572 -14.181 1.00 7.48 H new ATOM 20 N THR A 2 6.841 -0.848 -11.345 1.00 4.95 N ATOM 21 CA THR A 2 8.061 -1.617 -11.135 1.00 4.71 C ATOM 22 C THR A 2 8.661 -1.294 -9.768 1.00 3.87 C ATOM 23 O THR A 2 9.321 -0.269 -9.591 1.00 3.96 O ATOM 24 CB THR A 2 9.094 -1.342 -12.251 1.00 5.39 C ATOM 25 OG1 THR A 2 9.227 0.070 -12.461 1.00 5.76 O ATOM 26 CG2 THR A 2 8.675 -2.005 -13.551 1.00 5.90 C ATOM 0 H THR A 2 6.931 -0.092 -12.024 1.00 4.95 H new ATOM 0 HA THR A 2 7.802 -2.675 -11.168 1.00 4.71 H new ATOM 0 HB THR A 2 10.051 -1.758 -11.936 1.00 5.39 H new ATOM 0 HG1 THR A 2 9.310 0.523 -11.596 1.00 5.76 H new ATOM 0 HG21 THR A 2 9.418 -1.797 -14.321 1.00 5.90 H new ATOM 0 HG22 THR A 2 8.598 -3.082 -13.402 1.00 5.90 H new ATOM 0 HG23 THR A 2 7.708 -1.612 -13.864 1.00 5.90 H new ATOM 34 N THR A 3 8.404 -2.156 -8.793 1.00 3.53 N ATOM 35 CA THR A 3 8.788 -1.880 -7.420 1.00 3.16 C ATOM 36 C THR A 3 9.887 -2.823 -6.933 1.00 2.69 C ATOM 37 O THR A 3 9.674 -4.031 -6.790 1.00 3.09 O ATOM 38 CB THR A 3 7.571 -1.996 -6.485 1.00 3.92 C ATOM 39 OG1 THR A 3 6.450 -1.319 -7.071 1.00 4.44 O ATOM 40 CG2 THR A 3 7.867 -1.398 -5.117 1.00 4.35 C ATOM 0 H THR A 3 7.932 -3.050 -8.930 1.00 3.53 H new ATOM 0 HA THR A 3 9.176 -0.861 -7.398 1.00 3.16 H new ATOM 0 HB THR A 3 7.342 -3.053 -6.353 1.00 3.92 H new ATOM 0 HG1 THR A 3 5.675 -1.395 -6.476 1.00 4.44 H new ATOM 0 HG21 THR A 3 6.988 -1.495 -4.480 1.00 4.35 H new ATOM 0 HG22 THR A 3 8.705 -1.926 -4.663 1.00 4.35 H new ATOM 0 HG23 THR A 3 8.120 -0.344 -5.228 1.00 4.35 H new ATOM 48 N GLU A 4 11.059 -2.262 -6.684 1.00 2.34 N ATOM 49 CA GLU A 4 12.154 -3.005 -6.087 1.00 2.09 C ATOM 50 C GLU A 4 12.257 -2.658 -4.605 1.00 1.62 C ATOM 51 O GLU A 4 11.899 -1.554 -4.198 1.00 1.79 O ATOM 52 CB GLU A 4 13.461 -2.710 -6.826 1.00 2.45 C ATOM 53 CG GLU A 4 13.487 -3.276 -8.241 1.00 3.05 C ATOM 54 CD GLU A 4 14.687 -2.820 -9.049 1.00 3.65 C ATOM 55 OE1 GLU A 4 15.777 -3.413 -8.903 1.00 4.44 O ATOM 56 OE2 GLU A 4 14.538 -1.885 -9.861 1.00 3.66 O ATOM 0 H GLU A 4 11.276 -1.287 -6.888 1.00 2.34 H new ATOM 0 HA GLU A 4 11.962 -4.074 -6.176 1.00 2.09 H new ATOM 0 HB2 GLU A 4 13.612 -1.631 -6.869 1.00 2.45 H new ATOM 0 HB3 GLU A 4 14.294 -3.126 -6.259 1.00 2.45 H new ATOM 0 HG2 GLU A 4 13.485 -4.365 -8.189 1.00 3.05 H new ATOM 0 HG3 GLU A 4 12.575 -2.980 -8.760 1.00 3.05 H new ATOM 63 N GLN A 5 12.736 -3.604 -3.809 1.00 1.60 N ATOM 64 CA GLN A 5 12.691 -3.487 -2.357 1.00 1.37 C ATOM 65 C GLN A 5 13.746 -2.515 -1.839 1.00 1.11 C ATOM 66 O GLN A 5 14.934 -2.654 -2.134 1.00 1.32 O ATOM 67 CB GLN A 5 12.888 -4.864 -1.706 1.00 1.77 C ATOM 68 CG GLN A 5 11.686 -5.801 -1.799 1.00 2.47 C ATOM 69 CD GLN A 5 11.285 -6.141 -3.227 1.00 3.35 C ATOM 70 OE1 GLN A 5 11.816 -7.074 -3.824 1.00 3.77 O ATOM 71 NE2 GLN A 5 10.322 -5.408 -3.774 1.00 4.15 N ATOM 0 H GLN A 5 13.163 -4.467 -4.147 1.00 1.60 H new ATOM 0 HA GLN A 5 11.710 -3.095 -2.089 1.00 1.37 H new ATOM 0 HB2 GLN A 5 13.745 -5.350 -2.172 1.00 1.77 H new ATOM 0 HB3 GLN A 5 13.136 -4.720 -0.655 1.00 1.77 H new ATOM 0 HG2 GLN A 5 11.914 -6.724 -1.265 1.00 2.47 H new ATOM 0 HG3 GLN A 5 10.838 -5.341 -1.292 1.00 2.47 H new ATOM 0 HE21 GLN A 5 9.904 -4.641 -3.248 1.00 4.15 H new ATOM 0 HE22 GLN A 5 10.000 -5.613 -4.720 1.00 4.15 H new ATOM 80 N GLU A 6 13.301 -1.527 -1.073 1.00 1.06 N ATOM 81 CA GLU A 6 14.213 -0.594 -0.433 1.00 1.21 C ATOM 82 C GLU A 6 14.719 -1.177 0.876 1.00 1.08 C ATOM 83 O GLU A 6 13.987 -1.232 1.865 1.00 1.33 O ATOM 84 CB GLU A 6 13.540 0.757 -0.163 1.00 1.65 C ATOM 85 CG GLU A 6 12.989 1.431 -1.406 1.00 2.45 C ATOM 86 CD GLU A 6 11.510 1.164 -1.620 1.00 3.07 C ATOM 87 OE1 GLU A 6 10.983 0.177 -1.062 1.00 3.61 O ATOM 88 OE2 GLU A 6 10.864 1.957 -2.337 1.00 3.52 O ATOM 0 H GLU A 6 12.314 -1.353 -0.881 1.00 1.06 H new ATOM 0 HA GLU A 6 15.049 -0.429 -1.113 1.00 1.21 H new ATOM 0 HB2 GLU A 6 12.728 0.611 0.549 1.00 1.65 H new ATOM 0 HB3 GLU A 6 14.262 1.423 0.309 1.00 1.65 H new ATOM 0 HG2 GLU A 6 13.151 2.506 -1.332 1.00 2.45 H new ATOM 0 HG3 GLU A 6 13.545 1.084 -2.277 1.00 2.45 H new ATOM 95 N PHE A 7 15.955 -1.638 0.871 1.00 0.87 N ATOM 96 CA PHE A 7 16.568 -2.157 2.078 1.00 0.77 C ATOM 97 C PHE A 7 17.855 -1.416 2.398 1.00 0.72 C ATOM 98 O PHE A 7 18.670 -1.133 1.512 1.00 0.87 O ATOM 99 CB PHE A 7 16.824 -3.659 1.965 1.00 0.77 C ATOM 100 CG PHE A 7 15.576 -4.486 2.114 1.00 1.61 C ATOM 101 CD1 PHE A 7 14.730 -4.301 3.194 1.00 1.82 C ATOM 102 CD2 PHE A 7 15.253 -5.452 1.171 1.00 2.72 C ATOM 103 CE1 PHE A 7 13.584 -5.066 3.331 1.00 2.63 C ATOM 104 CE2 PHE A 7 14.109 -6.217 1.304 1.00 3.60 C ATOM 105 CZ PHE A 7 13.263 -6.003 2.395 1.00 3.44 C ATOM 0 H PHE A 7 16.554 -1.664 0.046 1.00 0.87 H new ATOM 0 HA PHE A 7 15.870 -1.995 2.899 1.00 0.77 H new ATOM 0 HB2 PHE A 7 17.280 -3.872 0.998 1.00 0.77 H new ATOM 0 HB3 PHE A 7 17.543 -3.957 2.728 1.00 0.77 H new ATOM 0 HD1 PHE A 7 14.966 -3.553 3.937 1.00 1.82 H new ATOM 0 HD2 PHE A 7 15.903 -5.608 0.323 1.00 2.72 H new ATOM 0 HE1 PHE A 7 12.940 -4.919 4.186 1.00 2.63 H new ATOM 0 HE2 PHE A 7 13.871 -6.974 0.571 1.00 3.60 H new ATOM 0 HZ PHE A 7 12.355 -6.580 2.497 1.00 3.44 H new ATOM 115 N GLU A 8 18.021 -1.096 3.669 1.00 0.72 N ATOM 116 CA GLU A 8 19.178 -0.354 4.132 1.00 0.76 C ATOM 117 C GLU A 8 20.402 -1.257 4.186 1.00 0.62 C ATOM 118 O GLU A 8 20.310 -2.440 4.527 1.00 0.61 O ATOM 119 CB GLU A 8 18.874 0.246 5.504 1.00 1.01 C ATOM 120 CG GLU A 8 19.994 1.091 6.084 1.00 1.20 C ATOM 121 CD GLU A 8 19.573 1.794 7.355 1.00 1.97 C ATOM 122 OE1 GLU A 8 19.394 1.112 8.384 1.00 2.71 O ATOM 123 OE2 GLU A 8 19.402 3.031 7.328 1.00 2.22 O ATOM 0 H GLU A 8 17.360 -1.342 4.406 1.00 0.72 H new ATOM 0 HA GLU A 8 19.397 0.455 3.435 1.00 0.76 H new ATOM 0 HB2 GLU A 8 17.976 0.859 5.428 1.00 1.01 H new ATOM 0 HB3 GLU A 8 18.649 -0.563 6.199 1.00 1.01 H new ATOM 0 HG2 GLU A 8 20.857 0.458 6.289 1.00 1.20 H new ATOM 0 HG3 GLU A 8 20.309 1.831 5.348 1.00 1.20 H new ATOM 130 N LYS A 9 21.543 -0.689 3.842 1.00 0.60 N ATOM 131 CA LYS A 9 22.777 -1.440 3.732 1.00 0.53 C ATOM 132 C LYS A 9 23.693 -1.102 4.899 1.00 0.50 C ATOM 133 O LYS A 9 23.814 0.061 5.273 1.00 0.56 O ATOM 134 CB LYS A 9 23.463 -1.096 2.409 1.00 0.63 C ATOM 135 CG LYS A 9 22.543 -1.186 1.202 1.00 0.72 C ATOM 136 CD LYS A 9 22.687 0.039 0.316 1.00 0.95 C ATOM 137 CE LYS A 9 21.467 0.945 0.381 1.00 1.49 C ATOM 138 NZ LYS A 9 20.303 0.362 -0.336 1.00 1.88 N ATOM 0 H LYS A 9 21.639 0.304 3.632 1.00 0.60 H new ATOM 0 HA LYS A 9 22.557 -2.507 3.756 1.00 0.53 H new ATOM 0 HB2 LYS A 9 23.868 -0.086 2.472 1.00 0.63 H new ATOM 0 HB3 LYS A 9 24.308 -1.769 2.262 1.00 0.63 H new ATOM 0 HG2 LYS A 9 22.776 -2.083 0.629 1.00 0.72 H new ATOM 0 HG3 LYS A 9 21.509 -1.279 1.534 1.00 0.72 H new ATOM 0 HD2 LYS A 9 23.571 0.601 0.618 1.00 0.95 H new ATOM 0 HD3 LYS A 9 22.847 -0.278 -0.715 1.00 0.95 H new ATOM 0 HE2 LYS A 9 21.200 1.120 1.423 1.00 1.49 H new ATOM 0 HE3 LYS A 9 21.712 1.915 -0.053 1.00 1.49 H new ATOM 0 HZ1 LYS A 9 19.736 1.126 -0.755 1.00 1.88 H new ATOM 0 HZ2 LYS A 9 20.641 -0.272 -1.088 1.00 1.88 H new ATOM 0 HZ3 LYS A 9 19.717 -0.177 0.333 1.00 1.88 H new ATOM 152 N VAL A 10 24.306 -2.114 5.483 1.00 0.46 N ATOM 153 CA VAL A 10 25.244 -1.904 6.576 1.00 0.46 C ATOM 154 C VAL A 10 26.662 -2.156 6.087 1.00 0.48 C ATOM 155 O VAL A 10 27.048 -3.301 5.823 1.00 0.54 O ATOM 156 CB VAL A 10 24.935 -2.820 7.781 1.00 0.51 C ATOM 157 CG1 VAL A 10 25.890 -2.530 8.938 1.00 0.54 C ATOM 158 CG2 VAL A 10 23.482 -2.663 8.218 1.00 0.59 C ATOM 0 H VAL A 10 24.173 -3.091 5.221 1.00 0.46 H new ATOM 0 HA VAL A 10 25.144 -0.871 6.910 1.00 0.46 H new ATOM 0 HB VAL A 10 25.084 -3.855 7.473 1.00 0.51 H new ATOM 0 HG11 VAL A 10 25.655 -3.186 9.777 1.00 0.54 H new ATOM 0 HG12 VAL A 10 26.916 -2.706 8.616 1.00 0.54 H new ATOM 0 HG13 VAL A 10 25.781 -1.491 9.248 1.00 0.54 H new ATOM 0 HG21 VAL A 10 23.285 -3.317 9.068 1.00 0.59 H new ATOM 0 HG22 VAL A 10 23.299 -1.628 8.506 1.00 0.59 H new ATOM 0 HG23 VAL A 10 22.823 -2.932 7.393 1.00 0.59 H new ATOM 168 N GLU A 11 27.426 -1.086 5.938 1.00 0.53 N ATOM 169 CA GLU A 11 28.770 -1.183 5.403 1.00 0.63 C ATOM 170 C GLU A 11 29.818 -1.091 6.507 1.00 0.55 C ATOM 171 O GLU A 11 29.722 -0.254 7.404 1.00 0.59 O ATOM 172 CB GLU A 11 29.027 -0.098 4.341 1.00 0.88 C ATOM 173 CG GLU A 11 28.958 1.337 4.850 1.00 1.37 C ATOM 174 CD GLU A 11 27.540 1.824 5.091 1.00 1.72 C ATOM 175 OE1 GLU A 11 26.997 1.567 6.187 1.00 2.16 O ATOM 176 OE2 GLU A 11 26.970 2.467 4.183 1.00 2.02 O ATOM 0 H GLU A 11 27.135 -0.139 6.181 1.00 0.53 H new ATOM 0 HA GLU A 11 28.856 -2.161 4.929 1.00 0.63 H new ATOM 0 HB2 GLU A 11 30.012 -0.265 3.905 1.00 0.88 H new ATOM 0 HB3 GLU A 11 28.299 -0.218 3.539 1.00 0.88 H new ATOM 0 HG2 GLU A 11 29.523 1.413 5.779 1.00 1.37 H new ATOM 0 HG3 GLU A 11 29.442 1.994 4.128 1.00 1.37 H new ATOM 183 N LEU A 12 30.801 -1.984 6.432 1.00 0.52 N ATOM 184 CA LEU A 12 31.982 -1.943 7.291 1.00 0.51 C ATOM 185 C LEU A 12 31.626 -1.966 8.774 1.00 0.52 C ATOM 186 O LEU A 12 32.096 -1.129 9.549 1.00 0.61 O ATOM 187 CB LEU A 12 32.826 -0.706 6.969 1.00 0.57 C ATOM 188 CG LEU A 12 33.488 -0.715 5.590 1.00 0.88 C ATOM 189 CD1 LEU A 12 34.192 0.605 5.321 1.00 1.35 C ATOM 190 CD2 LEU A 12 34.466 -1.874 5.482 1.00 1.45 C ATOM 0 H LEU A 12 30.801 -2.760 5.771 1.00 0.52 H new ATOM 0 HA LEU A 12 32.560 -2.844 7.086 1.00 0.51 H new ATOM 0 HB2 LEU A 12 32.192 0.177 7.045 1.00 0.57 H new ATOM 0 HB3 LEU A 12 33.603 -0.607 7.727 1.00 0.57 H new ATOM 0 HG LEU A 12 32.711 -0.844 4.836 1.00 0.88 H new ATOM 0 HD11 LEU A 12 34.656 0.576 4.335 1.00 1.35 H new ATOM 0 HD12 LEU A 12 33.467 1.418 5.357 1.00 1.35 H new ATOM 0 HD13 LEU A 12 34.959 0.769 6.078 1.00 1.35 H new ATOM 0 HD21 LEU A 12 34.930 -1.868 4.496 1.00 1.45 H new ATOM 0 HD22 LEU A 12 35.237 -1.772 6.246 1.00 1.45 H new ATOM 0 HD23 LEU A 12 33.934 -2.814 5.627 1.00 1.45 H new ATOM 202 N THR A 13 30.810 -2.935 9.167 1.00 0.50 N ATOM 203 CA THR A 13 30.480 -3.124 10.572 1.00 0.56 C ATOM 204 C THR A 13 31.748 -3.434 11.374 1.00 0.53 C ATOM 205 O THR A 13 32.716 -3.974 10.836 1.00 0.50 O ATOM 206 CB THR A 13 29.434 -4.251 10.760 1.00 0.68 C ATOM 207 OG1 THR A 13 29.095 -4.387 12.144 1.00 0.78 O ATOM 208 CG2 THR A 13 29.946 -5.582 10.226 1.00 0.69 C ATOM 0 H THR A 13 30.366 -3.600 8.534 1.00 0.50 H new ATOM 0 HA THR A 13 30.041 -2.198 10.943 1.00 0.56 H new ATOM 0 HB THR A 13 28.546 -3.974 10.192 1.00 0.68 H new ATOM 0 HG1 THR A 13 28.432 -5.101 12.250 1.00 0.78 H new ATOM 0 HG21 THR A 13 29.187 -6.350 10.374 1.00 0.69 H new ATOM 0 HG22 THR A 13 30.164 -5.488 9.162 1.00 0.69 H new ATOM 0 HG23 THR A 13 30.855 -5.863 10.759 1.00 0.69 H new ATOM 216 N ALA A 14 31.730 -3.107 12.660 1.00 0.61 N ATOM 217 CA ALA A 14 32.920 -3.208 13.500 1.00 0.66 C ATOM 218 C ALA A 14 33.315 -4.657 13.792 1.00 0.69 C ATOM 219 O ALA A 14 34.296 -4.909 14.490 1.00 0.79 O ATOM 220 CB ALA A 14 32.693 -2.454 14.802 1.00 0.81 C ATOM 0 H ALA A 14 30.901 -2.768 13.147 1.00 0.61 H new ATOM 0 HA ALA A 14 33.747 -2.760 12.948 1.00 0.66 H new ATOM 0 HB1 ALA A 14 33.583 -2.531 15.427 1.00 0.81 H new ATOM 0 HB2 ALA A 14 32.492 -1.405 14.585 1.00 0.81 H new ATOM 0 HB3 ALA A 14 31.841 -2.885 15.328 1.00 0.81 H new ATOM 226 N ASP A 15 32.569 -5.611 13.248 1.00 0.71 N ATOM 227 CA ASP A 15 32.823 -7.023 13.524 1.00 0.85 C ATOM 228 C ASP A 15 33.614 -7.679 12.385 1.00 0.74 C ATOM 229 O ASP A 15 33.589 -8.894 12.219 1.00 0.86 O ATOM 230 CB ASP A 15 31.492 -7.753 13.749 1.00 1.08 C ATOM 231 CG ASP A 15 31.654 -9.117 14.407 1.00 1.69 C ATOM 232 OD1 ASP A 15 32.030 -9.169 15.600 1.00 1.87 O ATOM 233 OD2 ASP A 15 31.392 -10.141 13.743 1.00 2.40 O ATOM 0 H ASP A 15 31.787 -5.436 12.617 1.00 0.71 H new ATOM 0 HA ASP A 15 33.428 -7.096 14.428 1.00 0.85 H new ATOM 0 HB2 ASP A 15 30.846 -7.132 14.370 1.00 1.08 H new ATOM 0 HB3 ASP A 15 30.988 -7.878 12.791 1.00 1.08 H new ATOM 238 N GLY A 16 34.365 -6.875 11.637 1.00 0.64 N ATOM 239 CA GLY A 16 35.159 -7.417 10.539 1.00 0.68 C ATOM 240 C GLY A 16 34.861 -6.783 9.187 1.00 0.57 C ATOM 241 O GLY A 16 35.313 -7.285 8.160 1.00 0.63 O ATOM 0 H GLY A 16 34.440 -5.866 11.767 1.00 0.64 H new ATOM 0 HA2 GLY A 16 36.216 -7.281 10.767 1.00 0.68 H new ATOM 0 HA3 GLY A 16 34.983 -8.491 10.472 1.00 0.68 H new ATOM 245 N GLY A 17 34.096 -5.692 9.194 1.00 0.54 N ATOM 246 CA GLY A 17 33.903 -4.871 8.002 1.00 0.52 C ATOM 247 C GLY A 17 33.331 -5.610 6.801 1.00 0.46 C ATOM 248 O GLY A 17 34.002 -5.768 5.784 1.00 0.61 O ATOM 0 H GLY A 17 33.598 -5.356 10.018 1.00 0.54 H new ATOM 0 HA2 GLY A 17 33.238 -4.044 8.252 1.00 0.52 H new ATOM 0 HA3 GLY A 17 34.861 -4.435 7.720 1.00 0.52 H new ATOM 252 N VAL A 18 32.087 -6.046 6.901 1.00 0.36 N ATOM 253 CA VAL A 18 31.407 -6.649 5.757 1.00 0.34 C ATOM 254 C VAL A 18 30.200 -5.811 5.348 1.00 0.32 C ATOM 255 O VAL A 18 29.479 -5.291 6.202 1.00 0.36 O ATOM 256 CB VAL A 18 30.975 -8.104 6.046 1.00 0.40 C ATOM 257 CG1 VAL A 18 29.953 -8.602 5.030 1.00 0.47 C ATOM 258 CG2 VAL A 18 32.181 -9.012 6.033 1.00 0.49 C ATOM 0 H VAL A 18 31.528 -5.997 7.752 1.00 0.36 H new ATOM 0 HA VAL A 18 32.119 -6.673 4.932 1.00 0.34 H new ATOM 0 HB VAL A 18 30.509 -8.120 7.031 1.00 0.40 H new ATOM 0 HG11 VAL A 18 29.674 -9.629 5.267 1.00 0.47 H new ATOM 0 HG12 VAL A 18 29.067 -7.968 5.065 1.00 0.47 H new ATOM 0 HG13 VAL A 18 30.386 -8.565 4.030 1.00 0.47 H new ATOM 0 HG21 VAL A 18 31.868 -10.036 6.238 1.00 0.49 H new ATOM 0 HG22 VAL A 18 32.659 -8.968 5.055 1.00 0.49 H new ATOM 0 HG23 VAL A 18 32.888 -8.689 6.797 1.00 0.49 H new ATOM 268 N ILE A 19 30.011 -5.665 4.038 1.00 0.31 N ATOM 269 CA ILE A 19 28.870 -4.939 3.499 1.00 0.31 C ATOM 270 C ILE A 19 27.698 -5.900 3.330 1.00 0.30 C ATOM 271 O ILE A 19 27.731 -6.779 2.463 1.00 0.30 O ATOM 272 CB ILE A 19 29.180 -4.309 2.117 1.00 0.34 C ATOM 273 CG1 ILE A 19 30.625 -3.790 2.044 1.00 0.41 C ATOM 274 CG2 ILE A 19 28.197 -3.188 1.826 1.00 0.36 C ATOM 275 CD1 ILE A 19 30.960 -2.715 3.056 1.00 0.47 C ATOM 0 H ILE A 19 30.639 -6.043 3.329 1.00 0.31 H new ATOM 0 HA ILE A 19 28.632 -4.139 4.199 1.00 0.31 H new ATOM 0 HB ILE A 19 29.072 -5.086 1.360 1.00 0.34 H new ATOM 0 HG12 ILE A 19 31.306 -4.629 2.186 1.00 0.41 H new ATOM 0 HG13 ILE A 19 30.806 -3.398 1.043 1.00 0.41 H new ATOM 0 HG21 ILE A 19 28.422 -2.751 0.853 1.00 0.36 H new ATOM 0 HG22 ILE A 19 27.182 -3.586 1.819 1.00 0.36 H new ATOM 0 HG23 ILE A 19 28.281 -2.422 2.597 1.00 0.36 H new ATOM 0 HD11 ILE A 19 31.999 -2.409 2.931 1.00 0.47 H new ATOM 0 HD12 ILE A 19 30.308 -1.855 2.903 1.00 0.47 H new ATOM 0 HD13 ILE A 19 30.815 -3.106 4.063 1.00 0.47 H new ATOM 287 N LYS A 20 26.679 -5.750 4.161 1.00 0.33 N ATOM 288 CA LYS A 20 25.513 -6.614 4.076 1.00 0.37 C ATOM 289 C LYS A 20 24.232 -5.800 3.941 1.00 0.33 C ATOM 290 O LYS A 20 24.116 -4.694 4.470 1.00 0.37 O ATOM 291 CB LYS A 20 25.428 -7.556 5.286 1.00 0.53 C ATOM 292 CG LYS A 20 25.352 -6.855 6.632 1.00 0.59 C ATOM 293 CD LYS A 20 24.935 -7.823 7.730 1.00 0.76 C ATOM 294 CE LYS A 20 24.939 -7.151 9.089 1.00 0.83 C ATOM 295 NZ LYS A 20 24.159 -7.919 10.100 1.00 1.34 N ATOM 0 H LYS A 20 26.635 -5.044 4.896 1.00 0.33 H new ATOM 0 HA LYS A 20 25.624 -7.224 3.179 1.00 0.37 H new ATOM 0 HB2 LYS A 20 24.550 -8.192 5.173 1.00 0.53 H new ATOM 0 HB3 LYS A 20 26.299 -8.211 5.281 1.00 0.53 H new ATOM 0 HG2 LYS A 20 26.322 -6.421 6.875 1.00 0.59 H new ATOM 0 HG3 LYS A 20 24.639 -6.032 6.578 1.00 0.59 H new ATOM 0 HD2 LYS A 20 23.939 -8.211 7.517 1.00 0.76 H new ATOM 0 HD3 LYS A 20 25.613 -8.676 7.742 1.00 0.76 H new ATOM 0 HE2 LYS A 20 25.967 -7.039 9.434 1.00 0.83 H new ATOM 0 HE3 LYS A 20 24.523 -6.148 8.997 1.00 0.83 H new ATOM 0 HZ1 LYS A 20 23.472 -7.289 10.560 1.00 1.34 H new ATOM 0 HZ2 LYS A 20 23.654 -8.698 9.631 1.00 1.34 H new ATOM 0 HZ3 LYS A 20 24.806 -8.307 10.816 1.00 1.34 H new ATOM 309 N THR A 21 23.285 -6.351 3.202 1.00 0.34 N ATOM 310 CA THR A 21 21.988 -5.727 3.011 1.00 0.36 C ATOM 311 C THR A 21 20.905 -6.586 3.662 1.00 0.36 C ATOM 312 O THR A 21 20.757 -7.760 3.328 1.00 0.40 O ATOM 313 CB THR A 21 21.692 -5.548 1.508 1.00 0.44 C ATOM 314 OG1 THR A 21 22.840 -4.977 0.867 1.00 0.49 O ATOM 315 CG2 THR A 21 20.487 -4.644 1.291 1.00 0.50 C ATOM 0 H THR A 21 23.393 -7.242 2.718 1.00 0.34 H new ATOM 0 HA THR A 21 21.996 -4.743 3.479 1.00 0.36 H new ATOM 0 HB THR A 21 21.468 -6.525 1.079 1.00 0.44 H new ATOM 0 HG1 THR A 21 22.607 -4.715 -0.048 1.00 0.49 H new ATOM 0 HG21 THR A 21 20.301 -4.535 0.222 1.00 0.50 H new ATOM 0 HG22 THR A 21 19.611 -5.084 1.769 1.00 0.50 H new ATOM 0 HG23 THR A 21 20.684 -3.664 1.726 1.00 0.50 H new ATOM 323 N ILE A 22 20.169 -6.006 4.603 1.00 0.40 N ATOM 324 CA ILE A 22 19.177 -6.755 5.372 1.00 0.43 C ATOM 325 C ILE A 22 17.945 -7.099 4.521 1.00 0.44 C ATOM 326 O ILE A 22 17.346 -6.227 3.898 1.00 0.55 O ATOM 327 CB ILE A 22 18.749 -5.969 6.637 1.00 0.56 C ATOM 328 CG1 ILE A 22 17.680 -6.740 7.424 1.00 0.63 C ATOM 329 CG2 ILE A 22 18.255 -4.576 6.266 1.00 0.67 C ATOM 330 CD1 ILE A 22 18.191 -8.014 8.066 1.00 0.66 C ATOM 0 H ILE A 22 20.239 -5.020 4.853 1.00 0.40 H new ATOM 0 HA ILE A 22 19.646 -7.689 5.682 1.00 0.43 H new ATOM 0 HB ILE A 22 19.623 -5.857 7.279 1.00 0.56 H new ATOM 0 HG12 ILE A 22 17.275 -6.091 8.200 1.00 0.63 H new ATOM 0 HG13 ILE A 22 16.857 -6.987 6.754 1.00 0.63 H new ATOM 0 HG21 ILE A 22 17.960 -4.042 7.169 1.00 0.67 H new ATOM 0 HG22 ILE A 22 19.053 -4.028 5.765 1.00 0.67 H new ATOM 0 HG23 ILE A 22 17.398 -4.660 5.598 1.00 0.67 H new ATOM 0 HD11 ILE A 22 17.378 -8.502 8.604 1.00 0.66 H new ATOM 0 HD12 ILE A 22 18.569 -8.684 7.294 1.00 0.66 H new ATOM 0 HD13 ILE A 22 18.994 -7.774 8.763 1.00 0.66 H new ATOM 342 N LEU A 23 17.600 -8.383 4.475 1.00 0.41 N ATOM 343 CA LEU A 23 16.397 -8.843 3.777 1.00 0.47 C ATOM 344 C LEU A 23 15.321 -9.225 4.790 1.00 0.50 C ATOM 345 O LEU A 23 14.253 -8.616 4.845 1.00 0.67 O ATOM 346 CB LEU A 23 16.709 -10.047 2.868 1.00 0.54 C ATOM 347 CG LEU A 23 17.150 -9.727 1.431 1.00 0.53 C ATOM 348 CD1 LEU A 23 16.050 -8.989 0.689 1.00 0.83 C ATOM 349 CD2 LEU A 23 18.438 -8.919 1.410 1.00 0.64 C ATOM 0 H LEU A 23 18.138 -9.129 4.915 1.00 0.41 H new ATOM 0 HA LEU A 23 16.035 -8.027 3.152 1.00 0.47 H new ATOM 0 HB2 LEU A 23 17.493 -10.638 3.342 1.00 0.54 H new ATOM 0 HB3 LEU A 23 15.821 -10.677 2.820 1.00 0.54 H new ATOM 0 HG LEU A 23 17.342 -10.673 0.925 1.00 0.53 H new ATOM 0 HD11 LEU A 23 16.380 -8.770 -0.327 1.00 0.83 H new ATOM 0 HD12 LEU A 23 15.155 -9.610 0.654 1.00 0.83 H new ATOM 0 HD13 LEU A 23 15.825 -8.056 1.206 1.00 0.83 H new ATOM 0 HD21 LEU A 23 18.720 -8.711 0.378 1.00 0.64 H new ATOM 0 HD22 LEU A 23 18.287 -7.979 1.941 1.00 0.64 H new ATOM 0 HD23 LEU A 23 19.232 -9.487 1.896 1.00 0.64 H new ATOM 361 N LYS A 24 15.622 -10.235 5.593 1.00 0.49 N ATOM 362 CA LYS A 24 14.723 -10.676 6.648 1.00 0.60 C ATOM 363 C LYS A 24 15.408 -10.488 7.992 1.00 0.60 C ATOM 364 O LYS A 24 16.579 -10.822 8.135 1.00 0.76 O ATOM 365 CB LYS A 24 14.344 -12.153 6.468 1.00 0.78 C ATOM 366 CG LYS A 24 13.705 -12.476 5.125 1.00 1.05 C ATOM 367 CD LYS A 24 13.232 -13.926 5.062 1.00 1.11 C ATOM 368 CE LYS A 24 14.378 -14.914 5.273 1.00 1.12 C ATOM 369 NZ LYS A 24 13.935 -16.330 5.128 1.00 1.56 N ATOM 0 H LYS A 24 16.490 -10.768 5.532 1.00 0.49 H new ATOM 0 HA LYS A 24 13.810 -10.082 6.602 1.00 0.60 H new ATOM 0 HB2 LYS A 24 15.239 -12.763 6.587 1.00 0.78 H new ATOM 0 HB3 LYS A 24 13.655 -12.439 7.263 1.00 0.78 H new ATOM 0 HG2 LYS A 24 12.860 -11.809 4.954 1.00 1.05 H new ATOM 0 HG3 LYS A 24 14.423 -12.292 4.326 1.00 1.05 H new ATOM 0 HD2 LYS A 24 12.467 -14.091 5.821 1.00 1.11 H new ATOM 0 HD3 LYS A 24 12.766 -14.113 4.095 1.00 1.11 H new ATOM 0 HE2 LYS A 24 15.170 -14.708 4.554 1.00 1.12 H new ATOM 0 HE3 LYS A 24 14.803 -14.768 6.266 1.00 1.12 H new ATOM 0 HZ1 LYS A 24 14.730 -16.910 4.792 1.00 1.56 H new ATOM 0 HZ2 LYS A 24 13.610 -16.688 6.049 1.00 1.56 H new ATOM 0 HZ3 LYS A 24 13.155 -16.381 4.442 1.00 1.56 H new ATOM 383 N LYS A 25 14.689 -9.945 8.960 1.00 0.61 N ATOM 384 CA LYS A 25 15.253 -9.686 10.279 1.00 0.64 C ATOM 385 C LYS A 25 14.790 -10.733 11.286 1.00 0.72 C ATOM 386 O LYS A 25 13.631 -11.149 11.274 1.00 0.90 O ATOM 387 CB LYS A 25 14.864 -8.280 10.748 1.00 0.76 C ATOM 388 CG LYS A 25 15.313 -7.952 12.163 1.00 1.52 C ATOM 389 CD LYS A 25 15.021 -6.503 12.522 1.00 1.72 C ATOM 390 CE LYS A 25 15.897 -5.542 11.734 1.00 2.60 C ATOM 391 NZ LYS A 25 15.605 -4.123 12.065 1.00 2.95 N ATOM 0 H LYS A 25 13.711 -9.674 8.859 1.00 0.61 H new ATOM 0 HA LYS A 25 16.339 -9.747 10.208 1.00 0.64 H new ATOM 0 HB2 LYS A 25 15.293 -7.548 10.063 1.00 0.76 H new ATOM 0 HB3 LYS A 25 13.781 -8.175 10.688 1.00 0.76 H new ATOM 0 HG2 LYS A 25 14.806 -8.611 12.868 1.00 1.52 H new ATOM 0 HG3 LYS A 25 16.382 -8.143 12.260 1.00 1.52 H new ATOM 0 HD2 LYS A 25 13.972 -6.284 12.325 1.00 1.72 H new ATOM 0 HD3 LYS A 25 15.184 -6.352 13.589 1.00 1.72 H new ATOM 0 HE2 LYS A 25 16.946 -5.754 11.942 1.00 2.60 H new ATOM 0 HE3 LYS A 25 15.744 -5.704 10.667 1.00 2.60 H new ATOM 0 HZ1 LYS A 25 16.224 -3.502 11.506 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 14.611 -3.912 11.843 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 15.775 -3.961 13.078 1.00 2.95 H new ATOM 405 N GLY A 26 15.705 -11.166 12.147 1.00 0.69 N ATOM 406 CA GLY A 26 15.361 -12.129 13.171 1.00 0.85 C ATOM 407 C GLY A 26 14.799 -11.457 14.406 1.00 0.88 C ATOM 408 O GLY A 26 15.345 -10.459 14.878 1.00 1.32 O ATOM 0 H GLY A 26 16.680 -10.865 12.152 1.00 0.69 H new ATOM 0 HA2 GLY A 26 14.630 -12.835 12.776 1.00 0.85 H new ATOM 0 HA3 GLY A 26 16.246 -12.705 13.441 1.00 0.85 H new ATOM 412 N ASP A 27 13.708 -11.999 14.924 1.00 0.84 N ATOM 413 CA ASP A 27 13.052 -11.424 16.098 1.00 1.01 C ATOM 414 C ASP A 27 13.698 -11.960 17.363 1.00 0.93 C ATOM 415 O ASP A 27 14.320 -11.214 18.121 1.00 1.24 O ATOM 416 CB ASP A 27 11.551 -11.733 16.102 1.00 1.33 C ATOM 417 CG ASP A 27 10.814 -11.000 17.210 1.00 2.08 C ATOM 418 OD1 ASP A 27 10.412 -9.835 16.990 1.00 2.38 O ATOM 419 OD2 ASP A 27 10.619 -11.583 18.295 1.00 2.77 O ATOM 0 H ASP A 27 13.255 -12.835 14.554 1.00 0.84 H new ATOM 0 HA ASP A 27 13.172 -10.341 16.060 1.00 1.01 H new ATOM 0 HB2 ASP A 27 11.123 -11.456 15.139 1.00 1.33 H new ATOM 0 HB3 ASP A 27 11.404 -12.807 16.219 1.00 1.33 H new ATOM 424 N GLU A 28 13.556 -13.257 17.582 1.00 0.91 N ATOM 425 CA GLU A 28 14.224 -13.919 18.682 1.00 0.91 C ATOM 426 C GLU A 28 15.523 -14.549 18.186 1.00 0.96 C ATOM 427 O GLU A 28 15.610 -15.007 17.045 1.00 1.22 O ATOM 428 CB GLU A 28 13.317 -14.985 19.327 1.00 1.11 C ATOM 429 CG GLU A 28 13.222 -16.303 18.562 1.00 1.59 C ATOM 430 CD GLU A 28 12.275 -16.278 17.368 1.00 2.09 C ATOM 431 OE1 GLU A 28 12.101 -15.188 16.781 1.00 2.64 O ATOM 432 OE2 GLU A 28 11.658 -17.315 17.046 1.00 2.56 O ATOM 0 H GLU A 28 12.980 -13.872 17.007 1.00 0.91 H new ATOM 0 HA GLU A 28 14.453 -13.177 19.447 1.00 0.91 H new ATOM 0 HB2 GLU A 28 13.684 -15.192 20.332 1.00 1.11 H new ATOM 0 HB3 GLU A 28 12.314 -14.571 19.433 1.00 1.11 H new ATOM 0 HG2 GLU A 28 14.218 -16.578 18.213 1.00 1.59 H new ATOM 0 HG3 GLU A 28 12.898 -17.084 19.250 1.00 1.59 H new ATOM 439 N GLY A 29 16.542 -14.531 19.025 1.00 0.88 N ATOM 440 CA GLY A 29 17.801 -15.140 18.664 1.00 1.04 C ATOM 441 C GLY A 29 18.587 -15.569 19.880 1.00 0.79 C ATOM 442 O GLY A 29 19.769 -15.873 19.782 1.00 0.90 O ATOM 0 H GLY A 29 16.520 -14.105 19.951 1.00 0.88 H new ATOM 0 HA2 GLY A 29 17.617 -16.005 18.027 1.00 1.04 H new ATOM 0 HA3 GLY A 29 18.392 -14.434 18.080 1.00 1.04 H new ATOM 446 N GLU A 30 17.920 -15.612 21.027 1.00 0.73 N ATOM 447 CA GLU A 30 18.577 -15.968 22.277 1.00 0.80 C ATOM 448 C GLU A 30 18.925 -17.455 22.291 1.00 0.78 C ATOM 449 O GLU A 30 19.792 -17.899 23.041 1.00 0.96 O ATOM 450 CB GLU A 30 17.683 -15.608 23.466 1.00 1.08 C ATOM 451 CG GLU A 30 18.420 -15.586 24.792 1.00 1.35 C ATOM 452 CD GLU A 30 17.577 -15.029 25.917 1.00 1.68 C ATOM 453 OE1 GLU A 30 17.426 -13.796 26.001 1.00 2.29 O ATOM 454 OE2 GLU A 30 17.049 -15.830 26.720 1.00 1.89 O ATOM 0 H GLU A 30 16.925 -15.405 21.117 1.00 0.73 H new ATOM 0 HA GLU A 30 19.504 -15.401 22.360 1.00 0.80 H new ATOM 0 HB2 GLU A 30 17.236 -14.629 23.291 1.00 1.08 H new ATOM 0 HB3 GLU A 30 16.865 -16.326 23.526 1.00 1.08 H new ATOM 0 HG2 GLU A 30 18.734 -16.598 25.046 1.00 1.35 H new ATOM 0 HG3 GLU A 30 19.325 -14.987 24.690 1.00 1.35 H new ATOM 461 N GLU A 31 18.233 -18.217 21.455 1.00 0.76 N ATOM 462 CA GLU A 31 18.532 -19.630 21.277 1.00 0.86 C ATOM 463 C GLU A 31 19.014 -19.884 19.852 1.00 0.78 C ATOM 464 O GLU A 31 19.053 -21.025 19.395 1.00 1.11 O ATOM 465 CB GLU A 31 17.293 -20.488 21.538 1.00 1.09 C ATOM 466 CG GLU A 31 16.637 -20.266 22.892 1.00 1.56 C ATOM 467 CD GLU A 31 15.442 -21.173 23.087 1.00 2.17 C ATOM 468 OE1 GLU A 31 14.499 -21.113 22.270 1.00 2.64 O ATOM 469 OE2 GLU A 31 15.427 -21.940 24.073 1.00 2.54 O ATOM 0 H GLU A 31 17.457 -17.877 20.887 1.00 0.76 H new ATOM 0 HA GLU A 31 19.310 -19.901 21.990 1.00 0.86 H new ATOM 0 HB2 GLU A 31 16.559 -20.288 20.757 1.00 1.09 H new ATOM 0 HB3 GLU A 31 17.571 -21.538 21.453 1.00 1.09 H new ATOM 0 HG2 GLU A 31 17.364 -20.446 23.683 1.00 1.56 H new ATOM 0 HG3 GLU A 31 16.323 -19.226 22.979 1.00 1.56 H new ATOM 476 N ASN A 32 19.360 -18.809 19.152 1.00 0.51 N ATOM 477 CA ASN A 32 19.688 -18.881 17.725 1.00 0.55 C ATOM 478 C ASN A 32 20.887 -18.007 17.386 1.00 0.49 C ATOM 479 O ASN A 32 20.720 -16.884 16.902 1.00 0.57 O ATOM 480 CB ASN A 32 18.499 -18.417 16.869 1.00 0.71 C ATOM 481 CG ASN A 32 17.492 -19.511 16.529 1.00 0.95 C ATOM 482 OD1 ASN A 32 16.812 -19.432 15.507 1.00 1.45 O ATOM 483 ND2 ASN A 32 17.383 -20.531 17.363 1.00 1.19 N ATOM 0 H ASN A 32 19.422 -17.871 19.548 1.00 0.51 H new ATOM 0 HA ASN A 32 19.924 -19.923 17.507 1.00 0.55 H new ATOM 0 HB2 ASN A 32 17.980 -17.616 17.396 1.00 0.71 H new ATOM 0 HB3 ASN A 32 18.881 -17.993 15.941 1.00 0.71 H new ATOM 0 HD21 ASN A 32 16.721 -21.282 17.167 1.00 1.19 H new ATOM 0 HD22 ASN A 32 17.961 -20.567 18.202 1.00 1.19 H new ATOM 490 N ILE A 33 22.087 -18.505 17.640 1.00 0.47 N ATOM 491 CA ILE A 33 23.302 -17.740 17.357 1.00 0.51 C ATOM 492 C ILE A 33 24.267 -18.513 16.450 1.00 0.44 C ATOM 493 O ILE A 33 24.829 -19.536 16.841 1.00 0.47 O ATOM 494 CB ILE A 33 24.023 -17.328 18.666 1.00 0.66 C ATOM 495 CG1 ILE A 33 23.126 -16.406 19.506 1.00 0.74 C ATOM 496 CG2 ILE A 33 25.351 -16.643 18.368 1.00 0.76 C ATOM 497 CD1 ILE A 33 22.786 -15.089 18.832 1.00 0.81 C ATOM 0 H ILE A 33 22.251 -19.429 18.039 1.00 0.47 H new ATOM 0 HA ILE A 33 22.989 -16.839 16.829 1.00 0.51 H new ATOM 0 HB ILE A 33 24.228 -18.234 19.236 1.00 0.66 H new ATOM 0 HG12 ILE A 33 22.200 -16.932 19.739 1.00 0.74 H new ATOM 0 HG13 ILE A 33 23.623 -16.199 20.454 1.00 0.74 H new ATOM 0 HG21 ILE A 33 25.835 -16.365 19.304 1.00 0.76 H new ATOM 0 HG22 ILE A 33 25.996 -17.325 17.815 1.00 0.76 H new ATOM 0 HG23 ILE A 33 25.173 -15.748 17.772 1.00 0.76 H new ATOM 0 HD11 ILE A 33 22.150 -14.497 19.490 1.00 0.81 H new ATOM 0 HD12 ILE A 33 23.704 -14.539 18.623 1.00 0.81 H new ATOM 0 HD13 ILE A 33 22.259 -15.284 17.898 1.00 0.81 H new ATOM 509 N PRO A 34 24.472 -18.027 15.214 1.00 0.46 N ATOM 510 CA PRO A 34 25.414 -18.618 14.278 1.00 0.44 C ATOM 511 C PRO A 34 26.808 -17.998 14.385 1.00 0.52 C ATOM 512 O PRO A 34 27.006 -16.831 14.047 1.00 0.75 O ATOM 513 CB PRO A 34 24.792 -18.293 12.925 1.00 0.51 C ATOM 514 CG PRO A 34 23.978 -17.054 13.133 1.00 0.54 C ATOM 515 CD PRO A 34 23.798 -16.863 14.624 1.00 0.62 C ATOM 0 HA PRO A 34 25.564 -19.682 14.458 1.00 0.44 H new ATOM 0 HB2 PRO A 34 25.562 -18.132 12.170 1.00 0.51 H new ATOM 0 HB3 PRO A 34 24.168 -19.115 12.574 1.00 0.51 H new ATOM 0 HG2 PRO A 34 24.478 -16.190 12.695 1.00 0.54 H new ATOM 0 HG3 PRO A 34 23.010 -17.146 12.640 1.00 0.54 H new ATOM 0 HD2 PRO A 34 24.244 -15.928 14.964 1.00 0.62 H new ATOM 0 HD3 PRO A 34 22.744 -16.831 14.898 1.00 0.62 H new ATOM 523 N LYS A 35 27.766 -18.770 14.874 1.00 0.49 N ATOM 524 CA LYS A 35 29.142 -18.294 14.985 1.00 0.60 C ATOM 525 C LYS A 35 30.126 -19.362 14.528 1.00 0.56 C ATOM 526 O LYS A 35 29.731 -20.404 14.013 1.00 0.58 O ATOM 527 CB LYS A 35 29.469 -17.850 16.418 1.00 0.83 C ATOM 528 CG LYS A 35 28.795 -16.547 16.830 1.00 1.17 C ATOM 529 CD LYS A 35 29.181 -15.404 15.899 1.00 1.46 C ATOM 530 CE LYS A 35 28.390 -14.137 16.193 1.00 1.98 C ATOM 531 NZ LYS A 35 28.885 -13.426 17.400 1.00 2.66 N ATOM 0 H LYS A 35 27.620 -19.725 15.200 1.00 0.49 H new ATOM 0 HA LYS A 35 29.239 -17.427 14.331 1.00 0.60 H new ATOM 0 HB2 LYS A 35 29.169 -18.637 17.109 1.00 0.83 H new ATOM 0 HB3 LYS A 35 30.549 -17.736 16.515 1.00 0.83 H new ATOM 0 HG2 LYS A 35 27.713 -16.676 16.821 1.00 1.17 H new ATOM 0 HG3 LYS A 35 29.077 -16.297 17.853 1.00 1.17 H new ATOM 0 HD2 LYS A 35 30.247 -15.198 16.000 1.00 1.46 H new ATOM 0 HD3 LYS A 35 29.012 -15.705 14.865 1.00 1.46 H new ATOM 0 HE2 LYS A 35 28.446 -13.469 15.333 1.00 1.98 H new ATOM 0 HE3 LYS A 35 27.339 -14.392 16.331 1.00 1.98 H new ATOM 0 HZ1 LYS A 35 28.314 -12.571 17.558 1.00 2.66 H new ATOM 0 HZ2 LYS A 35 28.808 -14.051 18.227 1.00 2.66 H new ATOM 0 HZ3 LYS A 35 29.880 -13.157 17.261 1.00 2.66 H new ATOM 545 N LYS A 36 31.408 -19.090 14.706 1.00 0.67 N ATOM 546 CA LYS A 36 32.450 -19.990 14.242 1.00 0.82 C ATOM 547 C LYS A 36 32.814 -21.000 15.327 1.00 0.84 C ATOM 548 O LYS A 36 32.653 -20.727 16.518 1.00 0.91 O ATOM 549 CB LYS A 36 33.685 -19.198 13.785 1.00 1.09 C ATOM 550 CG LYS A 36 34.489 -18.552 14.908 1.00 1.26 C ATOM 551 CD LYS A 36 35.522 -19.514 15.479 1.00 1.36 C ATOM 552 CE LYS A 36 36.554 -18.796 16.331 1.00 2.14 C ATOM 553 NZ LYS A 36 37.335 -17.808 15.540 1.00 2.51 N ATOM 0 H LYS A 36 31.753 -18.250 15.170 1.00 0.67 H new ATOM 0 HA LYS A 36 32.069 -20.544 13.384 1.00 0.82 H new ATOM 0 HB2 LYS A 36 34.341 -19.867 13.227 1.00 1.09 H new ATOM 0 HB3 LYS A 36 33.363 -18.419 13.094 1.00 1.09 H new ATOM 0 HG2 LYS A 36 34.990 -17.660 14.532 1.00 1.26 H new ATOM 0 HG3 LYS A 36 33.814 -18.228 15.701 1.00 1.26 H new ATOM 0 HD2 LYS A 36 35.019 -20.272 16.080 1.00 1.36 H new ATOM 0 HD3 LYS A 36 36.023 -20.035 14.663 1.00 1.36 H new ATOM 0 HE2 LYS A 36 36.054 -18.287 17.155 1.00 2.14 H new ATOM 0 HE3 LYS A 36 37.233 -19.526 16.772 1.00 2.14 H new ATOM 0 HZ1 LYS A 36 38.125 -17.451 16.114 1.00 2.51 H new ATOM 0 HZ2 LYS A 36 37.708 -18.266 14.684 1.00 2.51 H new ATOM 0 HZ3 LYS A 36 36.719 -17.016 15.268 1.00 2.51 H new ATOM 567 N GLY A 37 33.294 -22.165 14.909 1.00 0.92 N ATOM 568 CA GLY A 37 33.653 -23.203 15.858 1.00 1.04 C ATOM 569 C GLY A 37 32.649 -24.332 15.865 1.00 0.96 C ATOM 570 O GLY A 37 32.836 -25.339 16.545 1.00 1.12 O ATOM 0 H GLY A 37 33.441 -22.410 13.930 1.00 0.92 H new ATOM 0 HA2 GLY A 37 34.639 -23.596 15.610 1.00 1.04 H new ATOM 0 HA3 GLY A 37 33.723 -22.773 16.857 1.00 1.04 H new ATOM 574 N ASN A 38 31.578 -24.157 15.113 1.00 0.79 N ATOM 575 CA ASN A 38 30.521 -25.147 15.048 1.00 0.75 C ATOM 576 C ASN A 38 30.089 -25.373 13.604 1.00 0.72 C ATOM 577 O ASN A 38 30.669 -24.804 12.676 1.00 0.79 O ATOM 578 CB ASN A 38 29.326 -24.693 15.897 1.00 0.75 C ATOM 579 CG ASN A 38 28.743 -23.353 15.456 1.00 0.87 C ATOM 580 OD1 ASN A 38 28.739 -23.014 14.278 1.00 1.38 O ATOM 581 ND2 ASN A 38 28.230 -22.589 16.407 1.00 0.98 N ATOM 0 H ASN A 38 31.418 -23.332 14.535 1.00 0.79 H new ATOM 0 HA ASN A 38 30.899 -26.089 15.444 1.00 0.75 H new ATOM 0 HB2 ASN A 38 28.546 -25.453 15.849 1.00 0.75 H new ATOM 0 HB3 ASN A 38 29.637 -24.620 16.939 1.00 0.75 H new ATOM 0 HD21 ASN A 38 27.815 -21.688 16.169 1.00 0.98 H new ATOM 0 HD22 ASN A 38 28.250 -22.901 17.378 1.00 0.98 H new ATOM 588 N GLU A 39 29.070 -26.191 13.415 1.00 0.71 N ATOM 589 CA GLU A 39 28.549 -26.432 12.088 1.00 0.73 C ATOM 590 C GLU A 39 27.344 -25.552 11.816 1.00 0.63 C ATOM 591 O GLU A 39 26.217 -25.885 12.186 1.00 0.69 O ATOM 592 CB GLU A 39 28.165 -27.897 11.902 1.00 0.86 C ATOM 593 CG GLU A 39 29.333 -28.855 12.015 1.00 1.37 C ATOM 594 CD GLU A 39 28.932 -30.268 11.673 1.00 1.73 C ATOM 595 OE1 GLU A 39 28.308 -30.930 12.523 1.00 2.17 O ATOM 596 OE2 GLU A 39 29.229 -30.714 10.548 1.00 2.20 O ATOM 0 H GLU A 39 28.591 -26.696 14.161 1.00 0.71 H new ATOM 0 HA GLU A 39 29.339 -26.186 11.378 1.00 0.73 H new ATOM 0 HB2 GLU A 39 27.415 -28.164 12.647 1.00 0.86 H new ATOM 0 HB3 GLU A 39 27.700 -28.020 10.924 1.00 0.86 H new ATOM 0 HG2 GLU A 39 30.133 -28.533 11.349 1.00 1.37 H new ATOM 0 HG3 GLU A 39 29.731 -28.825 13.029 1.00 1.37 H new ATOM 603 N VAL A 40 27.589 -24.413 11.202 1.00 0.60 N ATOM 604 CA VAL A 40 26.516 -23.599 10.672 1.00 0.54 C ATOM 605 C VAL A 40 26.373 -23.880 9.186 1.00 0.54 C ATOM 606 O VAL A 40 27.335 -23.766 8.427 1.00 0.67 O ATOM 607 CB VAL A 40 26.735 -22.086 10.905 1.00 0.57 C ATOM 608 CG1 VAL A 40 26.521 -21.740 12.367 1.00 0.61 C ATOM 609 CG2 VAL A 40 28.123 -21.656 10.454 1.00 0.67 C ATOM 0 H VAL A 40 28.523 -24.030 11.058 1.00 0.60 H new ATOM 0 HA VAL A 40 25.604 -23.866 11.206 1.00 0.54 H new ATOM 0 HB VAL A 40 26.004 -21.543 10.306 1.00 0.57 H new ATOM 0 HG11 VAL A 40 26.679 -20.672 12.515 1.00 0.61 H new ATOM 0 HG12 VAL A 40 25.503 -22.000 12.657 1.00 0.61 H new ATOM 0 HG13 VAL A 40 27.227 -22.299 12.980 1.00 0.61 H new ATOM 0 HG21 VAL A 40 28.248 -20.588 10.630 1.00 0.67 H new ATOM 0 HG22 VAL A 40 28.876 -22.207 11.018 1.00 0.67 H new ATOM 0 HG23 VAL A 40 28.241 -21.865 9.391 1.00 0.67 H new ATOM 619 N THR A 41 25.195 -24.302 8.786 1.00 0.46 N ATOM 620 CA THR A 41 24.938 -24.619 7.399 1.00 0.48 C ATOM 621 C THR A 41 24.287 -23.433 6.708 1.00 0.42 C ATOM 622 O THR A 41 23.145 -23.068 7.004 1.00 0.44 O ATOM 623 CB THR A 41 24.051 -25.871 7.269 1.00 0.56 C ATOM 624 OG1 THR A 41 24.618 -26.940 8.040 1.00 0.65 O ATOM 625 CG2 THR A 41 23.937 -26.310 5.817 1.00 0.63 C ATOM 0 H THR A 41 24.395 -24.434 9.405 1.00 0.46 H new ATOM 0 HA THR A 41 25.891 -24.834 6.915 1.00 0.48 H new ATOM 0 HB THR A 41 23.055 -25.626 7.639 1.00 0.56 H new ATOM 0 HG1 THR A 41 24.053 -27.737 7.959 1.00 0.65 H new ATOM 0 HG21 THR A 41 23.305 -27.196 5.753 1.00 0.63 H new ATOM 0 HG22 THR A 41 23.495 -25.506 5.228 1.00 0.63 H new ATOM 0 HG23 THR A 41 24.928 -26.543 5.428 1.00 0.63 H new ATOM 633 N VAL A 42 25.031 -22.824 5.802 1.00 0.40 N ATOM 634 CA VAL A 42 24.575 -21.629 5.126 1.00 0.42 C ATOM 635 C VAL A 42 24.444 -21.884 3.634 1.00 0.43 C ATOM 636 O VAL A 42 25.350 -22.434 3.006 1.00 0.49 O ATOM 637 CB VAL A 42 25.549 -20.453 5.353 1.00 0.46 C ATOM 638 CG1 VAL A 42 25.036 -19.189 4.683 1.00 0.80 C ATOM 639 CG2 VAL A 42 25.780 -20.219 6.841 1.00 0.87 C ATOM 0 H VAL A 42 25.958 -23.142 5.518 1.00 0.40 H new ATOM 0 HA VAL A 42 23.602 -21.366 5.542 1.00 0.42 H new ATOM 0 HB VAL A 42 26.505 -20.714 4.898 1.00 0.46 H new ATOM 0 HG11 VAL A 42 25.739 -18.374 4.857 1.00 0.80 H new ATOM 0 HG12 VAL A 42 24.936 -19.360 3.611 1.00 0.80 H new ATOM 0 HG13 VAL A 42 24.064 -18.925 5.100 1.00 0.80 H new ATOM 0 HG21 VAL A 42 26.470 -19.386 6.976 1.00 0.87 H new ATOM 0 HG22 VAL A 42 24.831 -19.986 7.324 1.00 0.87 H new ATOM 0 HG23 VAL A 42 26.205 -21.117 7.289 1.00 0.87 H new ATOM 649 N HIS A 43 23.306 -21.506 3.083 1.00 0.44 N ATOM 650 CA HIS A 43 23.068 -21.643 1.659 1.00 0.49 C ATOM 651 C HIS A 43 23.248 -20.289 0.989 1.00 0.47 C ATOM 652 O HIS A 43 22.664 -19.297 1.421 1.00 0.53 O ATOM 653 CB HIS A 43 21.659 -22.192 1.417 1.00 0.64 C ATOM 654 CG HIS A 43 21.335 -22.452 -0.020 1.00 1.16 C ATOM 655 ND1 HIS A 43 21.908 -23.471 -0.751 1.00 2.00 N ATOM 656 CD2 HIS A 43 20.483 -21.821 -0.856 1.00 2.04 C ATOM 657 CE1 HIS A 43 21.419 -23.452 -1.976 1.00 2.74 C ATOM 658 NE2 HIS A 43 20.553 -22.460 -2.067 1.00 2.75 N ATOM 0 H HIS A 43 22.528 -21.100 3.603 1.00 0.44 H new ATOM 0 HA HIS A 43 23.783 -22.345 1.229 1.00 0.49 H new ATOM 0 HB2 HIS A 43 21.543 -23.120 1.977 1.00 0.64 H new ATOM 0 HB3 HIS A 43 20.933 -21.485 1.818 1.00 0.64 H new ATOM 0 HD2 HIS A 43 19.862 -20.971 -0.615 1.00 2.04 H new ATOM 0 HE1 HIS A 43 21.683 -24.134 -2.771 1.00 2.74 H new ATOM 0 HE2 HIS A 43 20.023 -22.210 -2.902 1.00 2.75 H new ATOM 667 N TYR A 44 24.066 -20.250 -0.049 1.00 0.44 N ATOM 668 CA TYR A 44 24.382 -18.999 -0.717 1.00 0.42 C ATOM 669 C TYR A 44 24.156 -19.107 -2.218 1.00 0.41 C ATOM 670 O TYR A 44 24.370 -20.165 -2.815 1.00 0.47 O ATOM 671 CB TYR A 44 25.835 -18.588 -0.422 1.00 0.46 C ATOM 672 CG TYR A 44 26.876 -19.598 -0.871 1.00 0.50 C ATOM 673 CD1 TYR A 44 26.993 -20.836 -0.247 1.00 0.52 C ATOM 674 CD2 TYR A 44 27.753 -19.305 -1.906 1.00 0.60 C ATOM 675 CE1 TYR A 44 27.949 -21.750 -0.645 1.00 0.60 C ATOM 676 CE2 TYR A 44 28.709 -20.215 -2.312 1.00 0.68 C ATOM 677 CZ TYR A 44 28.805 -21.436 -1.677 1.00 0.66 C ATOM 678 OH TYR A 44 29.761 -22.343 -2.068 1.00 0.76 O ATOM 0 H TYR A 44 24.523 -21.070 -0.447 1.00 0.44 H new ATOM 0 HA TYR A 44 23.713 -18.230 -0.330 1.00 0.42 H new ATOM 0 HB2 TYR A 44 26.037 -17.635 -0.911 1.00 0.46 H new ATOM 0 HB3 TYR A 44 25.943 -18.425 0.650 1.00 0.46 H new ATOM 0 HD1 TYR A 44 26.324 -21.087 0.563 1.00 0.52 H new ATOM 0 HD2 TYR A 44 27.687 -18.348 -2.403 1.00 0.60 H new ATOM 0 HE1 TYR A 44 28.025 -22.706 -0.149 1.00 0.60 H new ATOM 0 HE2 TYR A 44 29.379 -19.972 -3.123 1.00 0.68 H new ATOM 0 HH TYR A 44 30.650 -21.943 -1.972 1.00 0.76 H new ATOM 688 N VAL A 45 23.697 -18.011 -2.808 1.00 0.35 N ATOM 689 CA VAL A 45 23.497 -17.924 -4.249 1.00 0.36 C ATOM 690 C VAL A 45 23.292 -16.466 -4.657 1.00 0.30 C ATOM 691 O VAL A 45 22.709 -15.686 -3.905 1.00 0.30 O ATOM 692 CB VAL A 45 22.290 -18.782 -4.709 1.00 0.44 C ATOM 693 CG1 VAL A 45 20.977 -18.247 -4.149 1.00 0.47 C ATOM 694 CG2 VAL A 45 22.226 -18.871 -6.224 1.00 0.49 C ATOM 0 H VAL A 45 23.453 -17.159 -2.303 1.00 0.35 H new ATOM 0 HA VAL A 45 24.389 -18.317 -4.738 1.00 0.36 H new ATOM 0 HB VAL A 45 22.439 -19.787 -4.313 1.00 0.44 H new ATOM 0 HG11 VAL A 45 20.153 -18.873 -4.492 1.00 0.47 H new ATOM 0 HG12 VAL A 45 21.014 -18.260 -3.060 1.00 0.47 H new ATOM 0 HG13 VAL A 45 20.824 -17.225 -4.494 1.00 0.47 H new ATOM 0 HG21 VAL A 45 21.370 -19.479 -6.517 1.00 0.49 H new ATOM 0 HG22 VAL A 45 22.121 -17.870 -6.643 1.00 0.49 H new ATOM 0 HG23 VAL A 45 23.141 -19.328 -6.601 1.00 0.49 H new ATOM 704 N GLY A 46 23.794 -16.091 -5.823 1.00 0.31 N ATOM 705 CA GLY A 46 23.660 -14.722 -6.278 1.00 0.30 C ATOM 706 C GLY A 46 24.103 -14.553 -7.711 1.00 0.30 C ATOM 707 O GLY A 46 23.825 -15.409 -8.549 1.00 0.36 O ATOM 0 H GLY A 46 24.292 -16.710 -6.463 1.00 0.31 H new ATOM 0 HA2 GLY A 46 22.621 -14.409 -6.181 1.00 0.30 H new ATOM 0 HA3 GLY A 46 24.251 -14.068 -5.637 1.00 0.30 H new ATOM 711 N LYS A 47 24.790 -13.453 -7.997 1.00 0.27 N ATOM 712 CA LYS A 47 25.269 -13.187 -9.346 1.00 0.29 C ATOM 713 C LYS A 47 26.445 -12.213 -9.324 1.00 0.25 C ATOM 714 O LYS A 47 26.793 -11.662 -8.275 1.00 0.26 O ATOM 715 CB LYS A 47 24.139 -12.646 -10.229 1.00 0.36 C ATOM 716 CG LYS A 47 23.567 -11.313 -9.774 1.00 0.42 C ATOM 717 CD LYS A 47 22.499 -10.813 -10.734 1.00 0.66 C ATOM 718 CE LYS A 47 21.962 -9.454 -10.317 1.00 0.83 C ATOM 719 NZ LYS A 47 20.878 -8.977 -11.215 1.00 1.43 N ATOM 0 H LYS A 47 25.027 -12.733 -7.314 1.00 0.27 H new ATOM 0 HA LYS A 47 25.614 -14.129 -9.771 1.00 0.29 H new ATOM 0 HB2 LYS A 47 24.511 -12.539 -11.248 1.00 0.36 H new ATOM 0 HB3 LYS A 47 23.335 -13.381 -10.259 1.00 0.36 H new ATOM 0 HG2 LYS A 47 23.141 -11.419 -8.776 1.00 0.42 H new ATOM 0 HG3 LYS A 47 24.368 -10.577 -9.702 1.00 0.42 H new ATOM 0 HD2 LYS A 47 22.915 -10.747 -11.739 1.00 0.66 H new ATOM 0 HD3 LYS A 47 21.680 -11.531 -10.774 1.00 0.66 H new ATOM 0 HE2 LYS A 47 21.586 -9.512 -9.296 1.00 0.83 H new ATOM 0 HE3 LYS A 47 22.776 -8.729 -10.316 1.00 0.83 H new ATOM 0 HZ1 LYS A 47 20.543 -8.047 -10.891 1.00 1.43 H new ATOM 0 HZ2 LYS A 47 21.242 -8.895 -12.186 1.00 1.43 H new ATOM 0 HZ3 LYS A 47 20.089 -9.654 -11.197 1.00 1.43 H new ATOM 733 N LEU A 48 27.063 -12.021 -10.480 1.00 0.27 N ATOM 734 CA LEU A 48 28.199 -11.122 -10.604 1.00 0.26 C ATOM 735 C LEU A 48 27.725 -9.688 -10.836 1.00 0.25 C ATOM 736 O LEU A 48 27.343 -9.330 -11.948 1.00 0.27 O ATOM 737 CB LEU A 48 29.098 -11.580 -11.759 1.00 0.29 C ATOM 738 CG LEU A 48 30.333 -10.714 -12.019 1.00 0.32 C ATOM 739 CD1 LEU A 48 31.232 -10.683 -10.793 1.00 0.36 C ATOM 740 CD2 LEU A 48 31.104 -11.225 -13.229 1.00 0.38 C ATOM 0 H LEU A 48 26.794 -12.480 -11.350 1.00 0.27 H new ATOM 0 HA LEU A 48 28.771 -11.146 -9.676 1.00 0.26 H new ATOM 0 HB2 LEU A 48 29.427 -12.599 -11.557 1.00 0.29 H new ATOM 0 HB3 LEU A 48 28.501 -11.612 -12.670 1.00 0.29 H new ATOM 0 HG LEU A 48 29.998 -9.698 -12.228 1.00 0.32 H new ATOM 0 HD11 LEU A 48 32.105 -10.062 -10.997 1.00 0.36 H new ATOM 0 HD12 LEU A 48 30.681 -10.268 -9.949 1.00 0.36 H new ATOM 0 HD13 LEU A 48 31.555 -11.696 -10.553 1.00 0.36 H new ATOM 0 HD21 LEU A 48 31.978 -10.595 -13.396 1.00 0.38 H new ATOM 0 HD22 LEU A 48 31.425 -12.251 -13.049 1.00 0.38 H new ATOM 0 HD23 LEU A 48 30.462 -11.195 -14.109 1.00 0.38 H new ATOM 752 N GLU A 49 27.741 -8.875 -9.781 1.00 0.29 N ATOM 753 CA GLU A 49 27.293 -7.480 -9.873 1.00 0.36 C ATOM 754 C GLU A 49 28.252 -6.655 -10.723 1.00 0.34 C ATOM 755 O GLU A 49 27.855 -5.668 -11.342 1.00 0.41 O ATOM 756 CB GLU A 49 27.159 -6.851 -8.481 1.00 0.50 C ATOM 757 CG GLU A 49 26.852 -5.359 -8.516 1.00 0.63 C ATOM 758 CD GLU A 49 26.535 -4.780 -7.153 1.00 1.20 C ATOM 759 OE1 GLU A 49 27.281 -5.081 -6.194 1.00 1.96 O ATOM 760 OE2 GLU A 49 25.542 -4.030 -7.026 1.00 1.75 O ATOM 0 H GLU A 49 28.058 -9.154 -8.853 1.00 0.29 H new ATOM 0 HA GLU A 49 26.313 -7.481 -10.350 1.00 0.36 H new ATOM 0 HB2 GLU A 49 26.368 -7.364 -7.934 1.00 0.50 H new ATOM 0 HB3 GLU A 49 28.085 -7.011 -7.928 1.00 0.50 H new ATOM 0 HG2 GLU A 49 27.706 -4.829 -8.938 1.00 0.63 H new ATOM 0 HG3 GLU A 49 26.007 -5.185 -9.182 1.00 0.63 H new ATOM 767 N SER A 50 29.502 -7.097 -10.776 1.00 0.33 N ATOM 768 CA SER A 50 30.556 -6.378 -11.483 1.00 0.40 C ATOM 769 C SER A 50 30.168 -6.100 -12.941 1.00 0.45 C ATOM 770 O SER A 50 30.621 -5.124 -13.538 1.00 0.55 O ATOM 771 CB SER A 50 31.855 -7.185 -11.414 1.00 0.46 C ATOM 772 OG SER A 50 32.946 -6.478 -11.970 1.00 0.67 O ATOM 0 H SER A 50 29.814 -7.961 -10.332 1.00 0.33 H new ATOM 0 HA SER A 50 30.702 -5.412 -10.999 1.00 0.40 H new ATOM 0 HB2 SER A 50 32.074 -7.432 -10.375 1.00 0.46 H new ATOM 0 HB3 SER A 50 31.725 -8.128 -11.945 1.00 0.46 H new ATOM 0 HG SER A 50 33.757 -7.025 -11.906 1.00 0.67 H new ATOM 778 N THR A 51 29.312 -6.946 -13.504 1.00 0.44 N ATOM 779 CA THR A 51 28.829 -6.740 -14.860 1.00 0.53 C ATOM 780 C THR A 51 27.337 -7.061 -14.951 1.00 0.54 C ATOM 781 O THR A 51 26.758 -7.094 -16.041 1.00 0.73 O ATOM 782 CB THR A 51 29.629 -7.585 -15.876 1.00 0.59 C ATOM 783 OG1 THR A 51 29.255 -7.248 -17.219 1.00 0.72 O ATOM 784 CG2 THR A 51 29.412 -9.070 -15.652 1.00 0.53 C ATOM 0 H THR A 51 28.941 -7.777 -13.043 1.00 0.44 H new ATOM 0 HA THR A 51 28.976 -5.690 -15.112 1.00 0.53 H new ATOM 0 HB THR A 51 30.685 -7.360 -15.726 1.00 0.59 H new ATOM 0 HG1 THR A 51 28.301 -7.025 -17.247 1.00 0.72 H new ATOM 0 HG21 THR A 51 29.989 -9.636 -16.383 1.00 0.53 H new ATOM 0 HG22 THR A 51 29.738 -9.338 -14.647 1.00 0.53 H new ATOM 0 HG23 THR A 51 28.353 -9.304 -15.765 1.00 0.53 H new ATOM 792 N GLY A 52 26.721 -7.275 -13.788 1.00 0.48 N ATOM 793 CA GLY A 52 25.306 -7.599 -13.725 1.00 0.51 C ATOM 794 C GLY A 52 24.963 -8.873 -14.469 1.00 0.54 C ATOM 795 O GLY A 52 23.950 -8.938 -15.166 1.00 0.78 O ATOM 0 H GLY A 52 27.184 -7.229 -12.880 1.00 0.48 H new ATOM 0 HA2 GLY A 52 25.007 -7.701 -12.682 1.00 0.51 H new ATOM 0 HA3 GLY A 52 24.730 -6.773 -14.142 1.00 0.51 H new ATOM 799 N LYS A 53 25.806 -9.888 -14.329 1.00 0.44 N ATOM 800 CA LYS A 53 25.577 -11.159 -15.000 1.00 0.49 C ATOM 801 C LYS A 53 25.035 -12.186 -14.015 1.00 0.41 C ATOM 802 O LYS A 53 25.692 -12.520 -13.026 1.00 0.38 O ATOM 803 CB LYS A 53 26.870 -11.671 -15.643 1.00 0.60 C ATOM 804 CG LYS A 53 26.703 -12.101 -17.095 1.00 0.84 C ATOM 805 CD LYS A 53 26.056 -13.474 -17.227 1.00 1.47 C ATOM 806 CE LYS A 53 25.715 -13.780 -18.678 1.00 2.09 C ATOM 807 NZ LYS A 53 25.444 -15.223 -18.912 1.00 2.89 N ATOM 0 H LYS A 53 26.651 -9.855 -13.759 1.00 0.44 H new ATOM 0 HA LYS A 53 24.839 -11.004 -15.787 1.00 0.49 H new ATOM 0 HB2 LYS A 53 27.627 -10.888 -15.590 1.00 0.60 H new ATOM 0 HB3 LYS A 53 27.244 -12.515 -15.064 1.00 0.60 H new ATOM 0 HG2 LYS A 53 26.095 -11.365 -17.621 1.00 0.84 H new ATOM 0 HG3 LYS A 53 27.679 -12.115 -17.581 1.00 0.84 H new ATOM 0 HD2 LYS A 53 26.732 -14.237 -16.840 1.00 1.47 H new ATOM 0 HD3 LYS A 53 25.151 -13.513 -16.621 1.00 1.47 H new ATOM 0 HE2 LYS A 53 24.841 -13.198 -18.972 1.00 2.09 H new ATOM 0 HE3 LYS A 53 26.540 -13.461 -19.316 1.00 2.09 H new ATOM 0 HZ1 LYS A 53 24.790 -15.328 -19.714 1.00 2.89 H new ATOM 0 HZ2 LYS A 53 26.336 -15.714 -19.126 1.00 2.89 H new ATOM 0 HZ3 LYS A 53 25.016 -15.638 -18.060 1.00 2.89 H new ATOM 821 N VAL A 54 23.827 -12.668 -14.280 1.00 0.44 N ATOM 822 CA VAL A 54 23.204 -13.685 -13.445 1.00 0.44 C ATOM 823 C VAL A 54 23.867 -15.043 -13.697 1.00 0.46 C ATOM 824 O VAL A 54 24.542 -15.227 -14.712 1.00 0.51 O ATOM 825 CB VAL A 54 21.680 -13.762 -13.716 1.00 0.52 C ATOM 826 CG1 VAL A 54 21.399 -14.301 -15.115 1.00 0.59 C ATOM 827 CG2 VAL A 54 20.969 -14.584 -12.644 1.00 0.57 C ATOM 0 H VAL A 54 23.257 -12.368 -15.071 1.00 0.44 H new ATOM 0 HA VAL A 54 23.345 -13.413 -12.399 1.00 0.44 H new ATOM 0 HB VAL A 54 21.279 -12.750 -13.668 1.00 0.52 H new ATOM 0 HG11 VAL A 54 20.322 -14.345 -15.279 1.00 0.59 H new ATOM 0 HG12 VAL A 54 21.852 -13.643 -15.856 1.00 0.59 H new ATOM 0 HG13 VAL A 54 21.821 -15.301 -15.211 1.00 0.59 H new ATOM 0 HG21 VAL A 54 19.901 -14.620 -12.861 1.00 0.57 H new ATOM 0 HG22 VAL A 54 21.372 -15.597 -12.635 1.00 0.57 H new ATOM 0 HG23 VAL A 54 21.125 -14.123 -11.669 1.00 0.57 H new ATOM 837 N PHE A 55 23.703 -15.974 -12.770 1.00 0.48 N ATOM 838 CA PHE A 55 24.300 -17.293 -12.907 1.00 0.54 C ATOM 839 C PHE A 55 23.499 -18.160 -13.872 1.00 0.61 C ATOM 840 O PHE A 55 22.284 -18.325 -13.724 1.00 0.78 O ATOM 841 CB PHE A 55 24.406 -17.989 -11.546 1.00 0.59 C ATOM 842 CG PHE A 55 25.462 -17.420 -10.630 1.00 0.47 C ATOM 843 CD1 PHE A 55 26.255 -16.347 -11.019 1.00 0.52 C ATOM 844 CD2 PHE A 55 25.667 -17.976 -9.376 1.00 0.58 C ATOM 845 CE1 PHE A 55 27.225 -15.842 -10.174 1.00 0.46 C ATOM 846 CE2 PHE A 55 26.636 -17.473 -8.529 1.00 0.70 C ATOM 847 CZ PHE A 55 27.416 -16.406 -8.929 1.00 0.56 C ATOM 0 H PHE A 55 23.162 -15.841 -11.916 1.00 0.48 H new ATOM 0 HA PHE A 55 25.303 -17.159 -13.312 1.00 0.54 H new ATOM 0 HB2 PHE A 55 23.439 -17.929 -11.046 1.00 0.59 H new ATOM 0 HB3 PHE A 55 24.616 -19.046 -11.709 1.00 0.59 H new ATOM 0 HD1 PHE A 55 26.112 -15.903 -11.993 1.00 0.52 H new ATOM 0 HD2 PHE A 55 25.062 -18.812 -9.058 1.00 0.58 H new ATOM 0 HE1 PHE A 55 27.833 -15.006 -10.488 1.00 0.46 H new ATOM 0 HE2 PHE A 55 26.783 -17.914 -7.554 1.00 0.70 H new ATOM 0 HZ PHE A 55 28.175 -16.013 -8.268 1.00 0.56 H new ATOM 857 N ASP A 56 24.184 -18.667 -14.882 1.00 0.61 N ATOM 858 CA ASP A 56 23.619 -19.649 -15.792 1.00 0.71 C ATOM 859 C ASP A 56 24.660 -20.728 -16.080 1.00 0.70 C ATOM 860 O ASP A 56 25.474 -20.617 -16.996 1.00 0.87 O ATOM 861 CB ASP A 56 23.098 -18.997 -17.092 1.00 0.91 C ATOM 862 CG ASP A 56 24.133 -18.162 -17.826 1.00 1.59 C ATOM 863 OD1 ASP A 56 24.420 -17.029 -17.378 1.00 2.18 O ATOM 864 OD2 ASP A 56 24.677 -18.642 -18.840 1.00 2.14 O ATOM 0 H ASP A 56 25.148 -18.410 -15.095 1.00 0.61 H new ATOM 0 HA ASP A 56 22.754 -20.110 -15.316 1.00 0.71 H new ATOM 0 HB2 ASP A 56 22.739 -19.780 -17.760 1.00 0.91 H new ATOM 0 HB3 ASP A 56 22.242 -18.366 -16.852 1.00 0.91 H new ATOM 869 N SER A 57 24.675 -21.747 -15.237 1.00 0.61 N ATOM 870 CA SER A 57 25.668 -22.798 -15.331 1.00 0.67 C ATOM 871 C SER A 57 25.033 -24.175 -15.151 1.00 0.68 C ATOM 872 O SER A 57 23.847 -24.293 -14.847 1.00 0.75 O ATOM 873 CB SER A 57 26.744 -22.570 -14.267 1.00 0.75 C ATOM 874 OG SER A 57 27.399 -21.329 -14.470 1.00 1.24 O ATOM 0 H SER A 57 24.006 -21.867 -14.477 1.00 0.61 H new ATOM 0 HA SER A 57 26.118 -22.767 -16.323 1.00 0.67 H new ATOM 0 HB2 SER A 57 26.291 -22.589 -13.276 1.00 0.75 H new ATOM 0 HB3 SER A 57 27.472 -23.380 -14.301 1.00 0.75 H new ATOM 0 HG SER A 57 28.082 -21.202 -13.778 1.00 1.24 H new ATOM 880 N SER A 58 25.830 -25.208 -15.363 1.00 0.75 N ATOM 881 CA SER A 58 25.396 -26.579 -15.130 1.00 0.82 C ATOM 882 C SER A 58 25.270 -26.864 -13.630 1.00 0.70 C ATOM 883 O SER A 58 24.529 -27.754 -13.220 1.00 0.70 O ATOM 884 CB SER A 58 26.388 -27.550 -15.787 1.00 1.03 C ATOM 885 OG SER A 58 25.995 -28.904 -15.618 1.00 1.49 O ATOM 0 H SER A 58 26.789 -25.124 -15.699 1.00 0.75 H new ATOM 0 HA SER A 58 24.412 -26.719 -15.577 1.00 0.82 H new ATOM 0 HB2 SER A 58 26.466 -27.325 -16.851 1.00 1.03 H new ATOM 0 HB3 SER A 58 27.379 -27.403 -15.357 1.00 1.03 H new ATOM 0 HG SER A 58 26.650 -29.491 -16.051 1.00 1.49 H new ATOM 891 N PHE A 59 25.992 -26.100 -12.815 1.00 0.69 N ATOM 892 CA PHE A 59 26.033 -26.342 -11.373 1.00 0.70 C ATOM 893 C PHE A 59 25.009 -25.516 -10.596 1.00 0.64 C ATOM 894 O PHE A 59 24.241 -26.070 -9.809 1.00 0.67 O ATOM 895 CB PHE A 59 27.433 -26.067 -10.822 1.00 0.85 C ATOM 896 CG PHE A 59 28.416 -27.154 -11.130 1.00 1.08 C ATOM 897 CD1 PHE A 59 28.455 -28.317 -10.379 1.00 1.28 C ATOM 898 CD2 PHE A 59 29.310 -27.004 -12.176 1.00 1.39 C ATOM 899 CE1 PHE A 59 29.372 -29.310 -10.667 1.00 1.58 C ATOM 900 CE2 PHE A 59 30.226 -27.992 -12.471 1.00 1.77 C ATOM 901 CZ PHE A 59 30.219 -29.190 -11.684 1.00 1.80 C ATOM 0 H PHE A 59 26.556 -25.309 -13.126 1.00 0.69 H new ATOM 0 HA PHE A 59 25.776 -27.392 -11.234 1.00 0.70 H new ATOM 0 HB2 PHE A 59 27.800 -25.127 -11.235 1.00 0.85 H new ATOM 0 HB3 PHE A 59 27.372 -25.938 -9.741 1.00 0.85 H new ATOM 0 HD1 PHE A 59 27.762 -28.449 -9.561 1.00 1.28 H new ATOM 0 HD2 PHE A 59 29.290 -26.102 -12.769 1.00 1.39 H new ATOM 0 HE1 PHE A 59 29.401 -30.199 -10.055 1.00 1.58 H new ATOM 0 HE2 PHE A 59 30.933 -27.866 -13.277 1.00 1.77 H new ATOM 0 HZ PHE A 59 30.901 -29.994 -11.917 1.00 1.80 H new ATOM 911 N ASP A 60 24.993 -24.208 -10.834 1.00 0.66 N ATOM 912 CA ASP A 60 24.247 -23.265 -9.989 1.00 0.72 C ATOM 913 C ASP A 60 22.759 -23.609 -9.923 1.00 0.71 C ATOM 914 O ASP A 60 22.154 -23.582 -8.851 1.00 0.86 O ATOM 915 CB ASP A 60 24.427 -21.830 -10.504 1.00 0.83 C ATOM 916 CG ASP A 60 23.568 -21.529 -11.714 1.00 1.54 C ATOM 917 OD1 ASP A 60 23.833 -22.109 -12.786 1.00 1.89 O ATOM 918 OD2 ASP A 60 22.608 -20.743 -11.587 1.00 2.19 O ATOM 0 H ASP A 60 25.490 -23.769 -11.609 1.00 0.66 H new ATOM 0 HA ASP A 60 24.652 -23.344 -8.980 1.00 0.72 H new ATOM 0 HB2 ASP A 60 24.181 -21.129 -9.706 1.00 0.83 H new ATOM 0 HB3 ASP A 60 25.475 -21.669 -10.759 1.00 0.83 H new ATOM 923 N ARG A 61 22.178 -23.948 -11.067 1.00 0.68 N ATOM 924 CA ARG A 61 20.756 -24.248 -11.137 1.00 0.80 C ATOM 925 C ARG A 61 20.488 -25.731 -10.954 1.00 0.75 C ATOM 926 O ARG A 61 19.372 -26.201 -11.160 1.00 0.92 O ATOM 927 CB ARG A 61 20.161 -23.744 -12.465 1.00 0.97 C ATOM 928 CG ARG A 61 20.946 -24.141 -13.719 1.00 1.23 C ATOM 929 CD ARG A 61 20.744 -25.599 -14.106 1.00 1.65 C ATOM 930 NE ARG A 61 21.527 -25.964 -15.287 1.00 1.75 N ATOM 931 CZ ARG A 61 21.304 -27.054 -16.027 1.00 2.15 C ATOM 932 NH1 ARG A 61 20.321 -27.885 -15.712 1.00 2.58 N ATOM 933 NH2 ARG A 61 22.053 -27.299 -17.094 1.00 2.78 N ATOM 0 H ARG A 61 22.670 -24.022 -11.957 1.00 0.68 H new ATOM 0 HA ARG A 61 20.266 -23.724 -10.317 1.00 0.80 H new ATOM 0 HB2 ARG A 61 19.143 -24.123 -12.557 1.00 0.97 H new ATOM 0 HB3 ARG A 61 20.094 -22.657 -12.426 1.00 0.97 H new ATOM 0 HG2 ARG A 61 20.641 -23.504 -14.549 1.00 1.23 H new ATOM 0 HG3 ARG A 61 22.007 -23.959 -13.550 1.00 1.23 H new ATOM 0 HD2 ARG A 61 21.028 -26.239 -13.270 1.00 1.65 H new ATOM 0 HD3 ARG A 61 19.687 -25.780 -14.301 1.00 1.65 H new ATOM 0 HE ARG A 61 22.291 -25.347 -15.563 1.00 1.75 H new ATOM 0 HH11 ARG A 61 19.731 -27.694 -14.902 1.00 2.58 H new ATOM 0 HH12 ARG A 61 20.154 -28.716 -16.280 1.00 2.58 H new ATOM 0 HH21 ARG A 61 22.801 -26.655 -17.351 1.00 2.78 H new ATOM 0 HH22 ARG A 61 21.881 -28.132 -17.657 1.00 2.78 H new ATOM 947 N ASN A 62 21.515 -26.468 -10.578 1.00 0.64 N ATOM 948 CA ASN A 62 21.379 -27.903 -10.371 1.00 0.68 C ATOM 949 C ASN A 62 21.620 -28.285 -8.916 1.00 0.73 C ATOM 950 O ASN A 62 20.716 -28.771 -8.233 1.00 0.89 O ATOM 951 CB ASN A 62 22.352 -28.667 -11.267 1.00 0.71 C ATOM 952 CG ASN A 62 22.292 -30.167 -11.047 1.00 0.83 C ATOM 953 OD1 ASN A 62 21.244 -30.723 -10.719 1.00 0.93 O ATOM 954 ND2 ASN A 62 23.419 -30.840 -11.226 1.00 1.10 N ATOM 0 H ASN A 62 22.452 -26.101 -10.409 1.00 0.64 H new ATOM 0 HA ASN A 62 20.356 -28.173 -10.632 1.00 0.68 H new ATOM 0 HB2 ASN A 62 22.128 -28.447 -12.311 1.00 0.71 H new ATOM 0 HB3 ASN A 62 23.366 -28.316 -11.078 1.00 0.71 H new ATOM 0 HD21 ASN A 62 23.436 -31.851 -11.092 1.00 1.10 H new ATOM 0 HD22 ASN A 62 24.270 -30.347 -11.498 1.00 1.10 H new ATOM 961 N VAL A 63 22.840 -28.067 -8.446 1.00 0.68 N ATOM 962 CA VAL A 63 23.236 -28.537 -7.128 1.00 0.83 C ATOM 963 C VAL A 63 23.304 -27.403 -6.115 1.00 0.62 C ATOM 964 O VAL A 63 23.951 -26.383 -6.339 1.00 0.64 O ATOM 965 CB VAL A 63 24.591 -29.277 -7.160 1.00 1.16 C ATOM 966 CG1 VAL A 63 24.443 -30.616 -7.857 1.00 1.76 C ATOM 967 CG2 VAL A 63 25.660 -28.449 -7.855 1.00 2.03 C ATOM 0 H VAL A 63 23.570 -27.569 -8.956 1.00 0.68 H new ATOM 0 HA VAL A 63 22.462 -29.239 -6.817 1.00 0.83 H new ATOM 0 HB VAL A 63 24.904 -29.439 -6.129 1.00 1.16 H new ATOM 0 HG11 VAL A 63 25.406 -31.127 -7.872 1.00 1.76 H new ATOM 0 HG12 VAL A 63 23.717 -31.227 -7.321 1.00 1.76 H new ATOM 0 HG13 VAL A 63 24.100 -30.458 -8.879 1.00 1.76 H new ATOM 0 HG21 VAL A 63 26.601 -29.000 -7.860 1.00 2.03 H new ATOM 0 HG22 VAL A 63 25.353 -28.246 -8.881 1.00 2.03 H new ATOM 0 HG23 VAL A 63 25.794 -27.507 -7.323 1.00 2.03 H new ATOM 977 N PRO A 64 22.620 -27.578 -4.979 1.00 0.91 N ATOM 978 CA PRO A 64 22.644 -26.621 -3.887 1.00 1.03 C ATOM 979 C PRO A 64 23.862 -26.828 -2.987 1.00 0.81 C ATOM 980 O PRO A 64 23.954 -27.826 -2.272 1.00 0.86 O ATOM 981 CB PRO A 64 21.348 -26.910 -3.113 1.00 1.53 C ATOM 982 CG PRO A 64 20.757 -28.157 -3.704 1.00 1.76 C ATOM 983 CD PRO A 64 21.764 -28.726 -4.666 1.00 1.40 C ATOM 0 HA PRO A 64 22.710 -25.593 -4.243 1.00 1.03 H new ATOM 0 HB2 PRO A 64 21.554 -27.046 -2.051 1.00 1.53 H new ATOM 0 HB3 PRO A 64 20.653 -26.075 -3.198 1.00 1.53 H new ATOM 0 HG2 PRO A 64 20.525 -28.879 -2.921 1.00 1.76 H new ATOM 0 HG3 PRO A 64 19.822 -27.932 -4.217 1.00 1.76 H new ATOM 0 HD2 PRO A 64 22.332 -29.541 -4.218 1.00 1.40 H new ATOM 0 HD3 PRO A 64 21.285 -29.126 -5.560 1.00 1.40 H new ATOM 991 N PHE A 65 24.791 -25.883 -3.013 1.00 0.68 N ATOM 992 CA PHE A 65 26.018 -25.999 -2.231 1.00 0.53 C ATOM 993 C PHE A 65 25.877 -25.282 -0.883 1.00 0.47 C ATOM 994 O PHE A 65 25.068 -24.361 -0.738 1.00 0.54 O ATOM 995 CB PHE A 65 27.200 -25.432 -3.025 1.00 0.62 C ATOM 996 CG PHE A 65 28.511 -26.098 -2.715 1.00 0.72 C ATOM 997 CD1 PHE A 65 29.321 -25.636 -1.689 1.00 0.71 C ATOM 998 CD2 PHE A 65 28.934 -27.194 -3.451 1.00 1.06 C ATOM 999 CE1 PHE A 65 30.523 -26.253 -1.402 1.00 0.95 C ATOM 1000 CE2 PHE A 65 30.137 -27.816 -3.171 1.00 1.31 C ATOM 1001 CZ PHE A 65 30.932 -27.344 -2.144 1.00 1.24 C ATOM 0 H PHE A 65 24.721 -25.028 -3.565 1.00 0.68 H new ATOM 0 HA PHE A 65 26.204 -27.054 -2.030 1.00 0.53 H new ATOM 0 HB2 PHE A 65 26.993 -25.535 -4.090 1.00 0.62 H new ATOM 0 HB3 PHE A 65 27.287 -24.365 -2.819 1.00 0.62 H new ATOM 0 HD1 PHE A 65 29.008 -24.782 -1.106 1.00 0.71 H new ATOM 0 HD2 PHE A 65 28.316 -27.567 -4.254 1.00 1.06 H new ATOM 0 HE1 PHE A 65 31.142 -25.883 -0.598 1.00 0.95 H new ATOM 0 HE2 PHE A 65 30.454 -28.668 -3.753 1.00 1.31 H new ATOM 0 HZ PHE A 65 31.872 -27.827 -1.922 1.00 1.24 H new ATOM 1011 N LYS A 66 26.659 -25.729 0.100 1.00 0.41 N ATOM 1012 CA LYS A 66 26.605 -25.182 1.454 1.00 0.39 C ATOM 1013 C LYS A 66 28.011 -25.117 2.048 1.00 0.38 C ATOM 1014 O LYS A 66 28.900 -25.860 1.627 1.00 0.48 O ATOM 1015 CB LYS A 66 25.699 -26.056 2.339 1.00 0.45 C ATOM 1016 CG LYS A 66 26.263 -27.447 2.645 1.00 0.60 C ATOM 1017 CD LYS A 66 27.080 -27.452 3.936 1.00 0.67 C ATOM 1018 CE LYS A 66 27.830 -28.763 4.139 1.00 0.93 C ATOM 1019 NZ LYS A 66 28.932 -28.936 3.151 1.00 1.36 N ATOM 0 H LYS A 66 27.343 -26.476 -0.019 1.00 0.41 H new ATOM 0 HA LYS A 66 26.192 -24.174 1.412 1.00 0.39 H new ATOM 0 HB2 LYS A 66 25.519 -25.535 3.280 1.00 0.45 H new ATOM 0 HB3 LYS A 66 24.733 -26.169 1.848 1.00 0.45 H new ATOM 0 HG2 LYS A 66 25.444 -28.162 2.729 1.00 0.60 H new ATOM 0 HG3 LYS A 66 26.890 -27.776 1.816 1.00 0.60 H new ATOM 0 HD2 LYS A 66 27.793 -26.627 3.916 1.00 0.67 H new ATOM 0 HD3 LYS A 66 26.417 -27.280 4.784 1.00 0.67 H new ATOM 0 HE2 LYS A 66 28.240 -28.793 5.148 1.00 0.93 H new ATOM 0 HE3 LYS A 66 27.133 -29.596 4.053 1.00 0.93 H new ATOM 0 HZ1 LYS A 66 29.539 -29.728 3.444 1.00 1.36 H new ATOM 0 HZ2 LYS A 66 28.529 -29.137 2.213 1.00 1.36 H new ATOM 0 HZ3 LYS A 66 29.497 -28.064 3.106 1.00 1.36 H new ATOM 1033 N PHE A 67 28.207 -24.254 3.039 1.00 0.39 N ATOM 1034 CA PHE A 67 29.498 -24.155 3.709 1.00 0.42 C ATOM 1035 C PHE A 67 29.318 -23.966 5.215 1.00 0.42 C ATOM 1036 O PHE A 67 28.197 -23.801 5.701 1.00 0.46 O ATOM 1037 CB PHE A 67 30.329 -23.003 3.123 1.00 0.46 C ATOM 1038 CG PHE A 67 29.800 -21.631 3.439 1.00 0.45 C ATOM 1039 CD1 PHE A 67 28.782 -21.075 2.685 1.00 0.55 C ATOM 1040 CD2 PHE A 67 30.325 -20.896 4.493 1.00 0.43 C ATOM 1041 CE1 PHE A 67 28.296 -19.814 2.973 1.00 0.57 C ATOM 1042 CE2 PHE A 67 29.844 -19.639 4.784 1.00 0.46 C ATOM 1043 CZ PHE A 67 28.828 -19.096 4.024 1.00 0.51 C ATOM 0 H PHE A 67 27.494 -23.617 3.394 1.00 0.39 H new ATOM 0 HA PHE A 67 30.034 -25.089 3.542 1.00 0.42 H new ATOM 0 HB2 PHE A 67 31.350 -23.081 3.498 1.00 0.46 H new ATOM 0 HB3 PHE A 67 30.377 -23.120 2.040 1.00 0.46 H new ATOM 0 HD1 PHE A 67 28.362 -21.633 1.861 1.00 0.55 H new ATOM 0 HD2 PHE A 67 31.120 -21.315 5.092 1.00 0.43 H new ATOM 0 HE1 PHE A 67 27.501 -19.391 2.376 1.00 0.57 H new ATOM 0 HE2 PHE A 67 30.262 -19.078 5.607 1.00 0.46 H new ATOM 0 HZ PHE A 67 28.450 -18.110 4.252 1.00 0.51 H new ATOM 1053 N HIS A 68 30.429 -24.016 5.941 1.00 0.42 N ATOM 1054 CA HIS A 68 30.449 -23.780 7.381 1.00 0.44 C ATOM 1055 C HIS A 68 31.403 -22.627 7.700 1.00 0.42 C ATOM 1056 O HIS A 68 32.369 -22.397 6.973 1.00 0.44 O ATOM 1057 CB HIS A 68 30.885 -25.038 8.143 1.00 0.53 C ATOM 1058 CG HIS A 68 29.969 -26.219 7.980 1.00 0.89 C ATOM 1059 ND1 HIS A 68 28.599 -26.139 8.093 1.00 1.68 N ATOM 1060 CD2 HIS A 68 30.244 -27.523 7.729 1.00 1.56 C ATOM 1061 CE1 HIS A 68 28.070 -27.336 7.918 1.00 1.98 C ATOM 1062 NE2 HIS A 68 29.045 -28.197 7.697 1.00 1.87 N ATOM 0 H HIS A 68 31.346 -24.222 5.546 1.00 0.42 H new ATOM 0 HA HIS A 68 29.439 -23.522 7.699 1.00 0.44 H new ATOM 0 HB2 HIS A 68 31.883 -25.321 7.809 1.00 0.53 H new ATOM 0 HB3 HIS A 68 30.960 -24.797 9.203 1.00 0.53 H new ATOM 0 HD1 HIS A 68 28.073 -25.286 8.283 1.00 1.68 H new ATOM 0 HD2 HIS A 68 31.224 -27.953 7.581 1.00 1.56 H new ATOM 0 HE1 HIS A 68 27.016 -27.571 7.950 1.00 1.98 H new ATOM 1071 N LEU A 69 31.122 -21.895 8.767 1.00 0.44 N ATOM 1072 CA LEU A 69 31.924 -20.730 9.130 1.00 0.47 C ATOM 1073 C LEU A 69 33.302 -21.139 9.659 1.00 0.49 C ATOM 1074 O LEU A 69 33.420 -22.068 10.458 1.00 0.58 O ATOM 1075 CB LEU A 69 31.180 -19.892 10.168 1.00 0.59 C ATOM 1076 CG LEU A 69 31.906 -18.636 10.648 1.00 0.71 C ATOM 1077 CD1 LEU A 69 32.320 -17.762 9.478 1.00 0.74 C ATOM 1078 CD2 LEU A 69 31.021 -17.859 11.600 1.00 0.95 C ATOM 0 H LEU A 69 30.344 -22.085 9.399 1.00 0.44 H new ATOM 0 HA LEU A 69 32.082 -20.133 8.232 1.00 0.47 H new ATOM 0 HB2 LEU A 69 30.219 -19.596 9.748 1.00 0.59 H new ATOM 0 HB3 LEU A 69 30.970 -20.521 11.033 1.00 0.59 H new ATOM 0 HG LEU A 69 32.811 -18.943 11.173 1.00 0.71 H new ATOM 0 HD11 LEU A 69 32.834 -16.876 9.850 1.00 0.74 H new ATOM 0 HD12 LEU A 69 32.989 -18.322 8.824 1.00 0.74 H new ATOM 0 HD13 LEU A 69 31.435 -17.460 8.918 1.00 0.74 H new ATOM 0 HD21 LEU A 69 31.546 -16.965 11.937 1.00 0.95 H new ATOM 0 HD22 LEU A 69 30.103 -17.569 11.089 1.00 0.95 H new ATOM 0 HD23 LEU A 69 30.776 -18.482 12.460 1.00 0.95 H new ATOM 1090 N GLU A 70 34.333 -20.423 9.198 1.00 0.59 N ATOM 1091 CA GLU A 70 35.726 -20.701 9.549 1.00 0.69 C ATOM 1092 C GLU A 70 36.099 -22.163 9.316 1.00 0.69 C ATOM 1093 O GLU A 70 36.864 -22.756 10.077 1.00 0.96 O ATOM 1094 CB GLU A 70 36.047 -20.263 10.983 1.00 0.95 C ATOM 1095 CG GLU A 70 36.328 -18.767 11.096 1.00 1.12 C ATOM 1096 CD GLU A 70 36.933 -18.366 12.428 1.00 1.47 C ATOM 1097 OE1 GLU A 70 37.635 -19.194 13.044 1.00 1.79 O ATOM 1098 OE2 GLU A 70 36.690 -17.231 12.891 1.00 2.08 O ATOM 0 H GLU A 70 34.222 -19.630 8.567 1.00 0.59 H new ATOM 0 HA GLU A 70 36.343 -20.104 8.877 1.00 0.69 H new ATOM 0 HB2 GLU A 70 35.211 -20.521 11.633 1.00 0.95 H new ATOM 0 HB3 GLU A 70 36.913 -20.819 11.343 1.00 0.95 H new ATOM 0 HG2 GLU A 70 37.004 -18.470 10.294 1.00 1.12 H new ATOM 0 HG3 GLU A 70 35.398 -18.218 10.948 1.00 1.12 H new ATOM 1105 N GLN A 71 35.567 -22.735 8.239 1.00 0.68 N ATOM 1106 CA GLN A 71 36.021 -24.038 7.771 1.00 0.86 C ATOM 1107 C GLN A 71 37.348 -23.883 7.033 1.00 0.83 C ATOM 1108 O GLN A 71 37.999 -24.859 6.680 1.00 0.96 O ATOM 1109 CB GLN A 71 34.975 -24.697 6.864 1.00 1.05 C ATOM 1110 CG GLN A 71 34.627 -23.889 5.618 1.00 0.96 C ATOM 1111 CD GLN A 71 33.553 -24.554 4.770 1.00 1.14 C ATOM 1112 OE1 GLN A 71 32.720 -25.300 5.275 1.00 1.98 O ATOM 1113 NE2 GLN A 71 33.546 -24.264 3.478 1.00 0.97 N ATOM 0 H GLN A 71 34.825 -22.318 7.677 1.00 0.68 H new ATOM 0 HA GLN A 71 36.164 -24.687 8.635 1.00 0.86 H new ATOM 0 HB2 GLN A 71 35.342 -25.676 6.557 1.00 1.05 H new ATOM 0 HB3 GLN A 71 34.065 -24.864 7.440 1.00 1.05 H new ATOM 0 HG2 GLN A 71 34.287 -22.897 5.916 1.00 0.96 H new ATOM 0 HG3 GLN A 71 35.526 -23.751 5.017 1.00 0.96 H new ATOM 0 HE21 GLN A 71 34.254 -23.640 3.092 1.00 0.97 H new ATOM 0 HE22 GLN A 71 32.833 -24.665 2.869 1.00 0.97 H new ATOM 1122 N GLY A 72 37.734 -22.632 6.809 1.00 0.72 N ATOM 1123 CA GLY A 72 39.003 -22.340 6.175 1.00 0.72 C ATOM 1124 C GLY A 72 38.856 -21.941 4.721 1.00 0.67 C ATOM 1125 O GLY A 72 39.745 -21.311 4.160 1.00 0.70 O ATOM 0 H GLY A 72 37.184 -21.810 7.058 1.00 0.72 H new ATOM 0 HA2 GLY A 72 39.499 -21.536 6.719 1.00 0.72 H new ATOM 0 HA3 GLY A 72 39.648 -23.216 6.243 1.00 0.72 H new ATOM 1129 N GLU A 73 37.722 -22.277 4.118 1.00 0.63 N ATOM 1130 CA GLU A 73 37.507 -22.002 2.702 1.00 0.62 C ATOM 1131 C GLU A 73 37.011 -20.568 2.497 1.00 0.57 C ATOM 1132 O GLU A 73 37.152 -20.003 1.418 1.00 0.66 O ATOM 1133 CB GLU A 73 36.491 -22.984 2.114 1.00 0.67 C ATOM 1134 CG GLU A 73 36.722 -24.439 2.508 1.00 0.73 C ATOM 1135 CD GLU A 73 38.063 -24.974 2.046 1.00 0.81 C ATOM 1136 OE1 GLU A 73 38.195 -25.301 0.849 1.00 0.97 O ATOM 1137 OE2 GLU A 73 38.989 -25.049 2.874 1.00 0.92 O ATOM 0 H GLU A 73 36.941 -22.738 4.584 1.00 0.63 H new ATOM 0 HA GLU A 73 38.461 -22.123 2.188 1.00 0.62 H new ATOM 0 HB2 GLU A 73 35.491 -22.688 2.432 1.00 0.67 H new ATOM 0 HB3 GLU A 73 36.515 -22.906 1.027 1.00 0.67 H new ATOM 0 HG2 GLU A 73 36.655 -24.531 3.592 1.00 0.73 H new ATOM 0 HG3 GLU A 73 35.927 -25.054 2.086 1.00 0.73 H new ATOM 1144 N VAL A 74 36.438 -19.984 3.543 1.00 0.50 N ATOM 1145 CA VAL A 74 35.914 -18.626 3.470 1.00 0.45 C ATOM 1146 C VAL A 74 36.725 -17.694 4.368 1.00 0.41 C ATOM 1147 O VAL A 74 37.053 -18.042 5.504 1.00 0.46 O ATOM 1148 CB VAL A 74 34.411 -18.578 3.843 1.00 0.50 C ATOM 1149 CG1 VAL A 74 33.581 -19.306 2.793 1.00 0.58 C ATOM 1150 CG2 VAL A 74 34.171 -19.178 5.222 1.00 0.55 C ATOM 0 H VAL A 74 36.325 -20.431 4.453 1.00 0.50 H new ATOM 0 HA VAL A 74 36.007 -18.285 2.439 1.00 0.45 H new ATOM 0 HB VAL A 74 34.101 -17.533 3.871 1.00 0.50 H new ATOM 0 HG11 VAL A 74 32.527 -19.264 3.069 1.00 0.58 H new ATOM 0 HG12 VAL A 74 33.722 -18.829 1.823 1.00 0.58 H new ATOM 0 HG13 VAL A 74 33.899 -20.347 2.735 1.00 0.58 H new ATOM 0 HG21 VAL A 74 33.108 -19.132 5.459 1.00 0.55 H new ATOM 0 HG22 VAL A 74 34.499 -20.217 5.229 1.00 0.55 H new ATOM 0 HG23 VAL A 74 34.734 -18.615 5.967 1.00 0.55 H new ATOM 1160 N ILE A 75 37.072 -16.517 3.853 1.00 0.38 N ATOM 1161 CA ILE A 75 37.980 -15.629 4.567 1.00 0.40 C ATOM 1162 C ILE A 75 37.252 -14.562 5.392 1.00 0.39 C ATOM 1163 O ILE A 75 37.400 -14.529 6.613 1.00 0.47 O ATOM 1164 CB ILE A 75 39.041 -14.957 3.646 1.00 0.45 C ATOM 1165 CG1 ILE A 75 38.428 -14.334 2.375 1.00 0.46 C ATOM 1166 CG2 ILE A 75 40.126 -15.960 3.283 1.00 0.53 C ATOM 1167 CD1 ILE A 75 38.250 -15.297 1.219 1.00 0.62 C ATOM 0 H ILE A 75 36.742 -16.161 2.956 1.00 0.38 H new ATOM 0 HA ILE A 75 38.509 -16.287 5.256 1.00 0.40 H new ATOM 0 HB ILE A 75 39.479 -14.134 4.211 1.00 0.45 H new ATOM 0 HG12 ILE A 75 37.457 -13.908 2.628 1.00 0.46 H new ATOM 0 HG13 ILE A 75 39.062 -13.510 2.049 1.00 0.46 H new ATOM 0 HG21 ILE A 75 40.863 -15.481 2.639 1.00 0.53 H new ATOM 0 HG22 ILE A 75 40.613 -16.314 4.192 1.00 0.53 H new ATOM 0 HG23 ILE A 75 39.680 -16.805 2.758 1.00 0.53 H new ATOM 0 HD11 ILE A 75 37.813 -14.770 0.371 1.00 0.62 H new ATOM 0 HD12 ILE A 75 39.219 -15.705 0.933 1.00 0.62 H new ATOM 0 HD13 ILE A 75 37.589 -16.110 1.521 1.00 0.62 H new ATOM 1179 N LYS A 76 36.472 -13.695 4.749 1.00 0.33 N ATOM 1180 CA LYS A 76 35.900 -12.542 5.447 1.00 0.35 C ATOM 1181 C LYS A 76 34.487 -12.207 4.983 1.00 0.29 C ATOM 1182 O LYS A 76 33.616 -11.958 5.817 1.00 0.31 O ATOM 1183 CB LYS A 76 36.803 -11.311 5.289 1.00 0.48 C ATOM 1184 CG LYS A 76 37.992 -11.254 6.251 1.00 0.62 C ATOM 1185 CD LYS A 76 37.568 -10.839 7.661 1.00 0.98 C ATOM 1186 CE LYS A 76 37.201 -12.037 8.526 1.00 1.18 C ATOM 1187 NZ LYS A 76 36.662 -11.644 9.855 1.00 2.04 N ATOM 0 H LYS A 76 36.224 -13.765 3.762 1.00 0.33 H new ATOM 0 HA LYS A 76 35.838 -12.821 6.499 1.00 0.35 H new ATOM 0 HB2 LYS A 76 37.180 -11.285 4.267 1.00 0.48 H new ATOM 0 HB3 LYS A 76 36.198 -10.415 5.429 1.00 0.48 H new ATOM 0 HG2 LYS A 76 38.474 -12.231 6.290 1.00 0.62 H new ATOM 0 HG3 LYS A 76 38.731 -10.548 5.872 1.00 0.62 H new ATOM 0 HD2 LYS A 76 38.379 -10.286 8.135 1.00 0.98 H new ATOM 0 HD3 LYS A 76 36.715 -10.163 7.598 1.00 0.98 H new ATOM 0 HE2 LYS A 76 36.461 -12.644 8.004 1.00 1.18 H new ATOM 0 HE3 LYS A 76 38.083 -12.662 8.667 1.00 1.18 H new ATOM 0 HZ1 LYS A 76 37.249 -12.062 10.605 1.00 2.04 H new ATOM 0 HZ2 LYS A 76 36.675 -10.608 9.942 1.00 2.04 H new ATOM 0 HZ3 LYS A 76 35.685 -11.987 9.949 1.00 2.04 H new ATOM 1201 N GLY A 77 34.254 -12.206 3.670 1.00 0.29 N ATOM 1202 CA GLY A 77 32.951 -11.810 3.146 1.00 0.30 C ATOM 1203 C GLY A 77 31.807 -12.578 3.781 1.00 0.27 C ATOM 1204 O GLY A 77 30.868 -11.989 4.309 1.00 0.32 O ATOM 0 H GLY A 77 34.939 -12.470 2.962 1.00 0.29 H new ATOM 0 HA2 GLY A 77 32.805 -10.743 3.315 1.00 0.30 H new ATOM 0 HA3 GLY A 77 32.935 -11.967 2.068 1.00 0.30 H new ATOM 1208 N TRP A 78 31.908 -13.894 3.751 1.00 0.24 N ATOM 1209 CA TRP A 78 30.910 -14.753 4.368 1.00 0.26 C ATOM 1210 C TRP A 78 31.076 -14.761 5.885 1.00 0.29 C ATOM 1211 O TRP A 78 30.103 -14.876 6.624 1.00 0.30 O ATOM 1212 CB TRP A 78 31.037 -16.183 3.835 1.00 0.28 C ATOM 1213 CG TRP A 78 31.112 -16.279 2.337 1.00 0.29 C ATOM 1214 CD1 TRP A 78 30.096 -16.597 1.481 1.00 0.32 C ATOM 1215 CD2 TRP A 78 32.274 -16.068 1.519 1.00 0.34 C ATOM 1216 NE1 TRP A 78 30.556 -16.600 0.186 1.00 0.36 N ATOM 1217 CE2 TRP A 78 31.887 -16.275 0.184 1.00 0.37 C ATOM 1218 CE3 TRP A 78 33.604 -15.724 1.790 1.00 0.40 C ATOM 1219 CZ2 TRP A 78 32.779 -16.146 -0.879 1.00 0.43 C ATOM 1220 CZ3 TRP A 78 34.488 -15.596 0.738 1.00 0.48 C ATOM 1221 CH2 TRP A 78 34.072 -15.807 -0.583 1.00 0.49 C ATOM 0 H TRP A 78 32.675 -14.395 3.303 1.00 0.24 H new ATOM 0 HA TRP A 78 29.924 -14.362 4.119 1.00 0.26 H new ATOM 0 HB2 TRP A 78 31.930 -16.640 4.262 1.00 0.28 H new ATOM 0 HB3 TRP A 78 30.184 -16.765 4.183 1.00 0.28 H new ATOM 0 HD1 TRP A 78 29.081 -16.814 1.778 1.00 0.32 H new ATOM 0 HE1 TRP A 78 29.997 -16.810 -0.641 1.00 0.36 H new ATOM 0 HE3 TRP A 78 33.933 -15.561 2.806 1.00 0.40 H new ATOM 0 HZ2 TRP A 78 32.462 -16.308 -1.899 1.00 0.43 H new ATOM 0 HZ3 TRP A 78 35.516 -15.329 0.936 1.00 0.48 H new ATOM 0 HH2 TRP A 78 34.787 -15.700 -1.385 1.00 0.49 H new ATOM 1232 N ASP A 79 32.324 -14.596 6.319 1.00 0.35 N ATOM 1233 CA ASP A 79 32.718 -14.742 7.725 1.00 0.42 C ATOM 1234 C ASP A 79 31.851 -13.899 8.656 1.00 0.43 C ATOM 1235 O ASP A 79 31.257 -14.420 9.597 1.00 0.47 O ATOM 1236 CB ASP A 79 34.192 -14.347 7.876 1.00 0.52 C ATOM 1237 CG ASP A 79 34.738 -14.518 9.284 1.00 0.76 C ATOM 1238 OD1 ASP A 79 35.192 -15.633 9.618 1.00 1.14 O ATOM 1239 OD2 ASP A 79 34.779 -13.524 10.036 1.00 0.90 O ATOM 0 H ASP A 79 33.099 -14.355 5.702 1.00 0.35 H new ATOM 0 HA ASP A 79 32.575 -15.784 8.011 1.00 0.42 H new ATOM 0 HB2 ASP A 79 34.790 -14.947 7.190 1.00 0.52 H new ATOM 0 HB3 ASP A 79 34.311 -13.306 7.575 1.00 0.52 H new ATOM 1244 N ILE A 80 31.763 -12.606 8.384 1.00 0.45 N ATOM 1245 CA ILE A 80 30.970 -11.709 9.221 1.00 0.52 C ATOM 1246 C ILE A 80 29.480 -11.891 8.957 1.00 0.47 C ATOM 1247 O ILE A 80 28.669 -11.922 9.885 1.00 0.56 O ATOM 1248 CB ILE A 80 31.337 -10.218 9.005 1.00 0.63 C ATOM 1249 CG1 ILE A 80 32.742 -9.909 9.530 1.00 0.75 C ATOM 1250 CG2 ILE A 80 30.323 -9.304 9.680 1.00 0.78 C ATOM 1251 CD1 ILE A 80 33.866 -10.482 8.697 1.00 0.70 C ATOM 0 H ILE A 80 32.226 -12.153 7.596 1.00 0.45 H new ATOM 0 HA ILE A 80 31.201 -11.975 10.253 1.00 0.52 H new ATOM 0 HB ILE A 80 31.320 -10.033 7.931 1.00 0.63 H new ATOM 0 HG12 ILE A 80 32.865 -8.827 9.587 1.00 0.75 H new ATOM 0 HG13 ILE A 80 32.828 -10.293 10.546 1.00 0.75 H new ATOM 0 HG21 ILE A 80 30.603 -8.264 9.514 1.00 0.78 H new ATOM 0 HG22 ILE A 80 29.334 -9.485 9.260 1.00 0.78 H new ATOM 0 HG23 ILE A 80 30.305 -9.508 10.751 1.00 0.78 H new ATOM 0 HD11 ILE A 80 34.823 -10.213 9.144 1.00 0.70 H new ATOM 0 HD12 ILE A 80 33.775 -11.568 8.660 1.00 0.70 H new ATOM 0 HD13 ILE A 80 33.811 -10.079 7.686 1.00 0.70 H new ATOM 1263 N CYS A 81 29.128 -12.018 7.688 1.00 0.38 N ATOM 1264 CA CYS A 81 27.732 -12.076 7.283 1.00 0.40 C ATOM 1265 C CYS A 81 27.002 -13.216 7.984 1.00 0.35 C ATOM 1266 O CYS A 81 25.928 -13.004 8.539 1.00 0.42 O ATOM 1267 CB CYS A 81 27.621 -12.231 5.769 1.00 0.44 C ATOM 1268 SG CYS A 81 25.948 -11.988 5.124 1.00 0.55 S ATOM 0 H CYS A 81 29.793 -12.083 6.917 1.00 0.38 H new ATOM 0 HA CYS A 81 27.260 -11.139 7.577 1.00 0.40 H new ATOM 0 HB2 CYS A 81 28.291 -11.516 5.291 1.00 0.44 H new ATOM 0 HB3 CYS A 81 27.966 -13.227 5.490 1.00 0.44 H new ATOM 0 HG CYS A 81 25.899 -10.876 4.452 1.00 0.55 H new ATOM 1274 N VAL A 82 27.601 -14.406 7.993 1.00 0.30 N ATOM 1275 CA VAL A 82 26.963 -15.571 8.599 1.00 0.34 C ATOM 1276 C VAL A 82 26.975 -15.470 10.125 1.00 0.39 C ATOM 1277 O VAL A 82 26.057 -15.948 10.786 1.00 0.48 O ATOM 1278 CB VAL A 82 27.615 -16.899 8.149 1.00 0.36 C ATOM 1279 CG1 VAL A 82 27.548 -17.032 6.638 1.00 0.84 C ATOM 1280 CG2 VAL A 82 29.052 -16.997 8.633 1.00 0.73 C ATOM 0 H VAL A 82 28.521 -14.587 7.590 1.00 0.30 H new ATOM 0 HA VAL A 82 25.930 -15.577 8.251 1.00 0.34 H new ATOM 0 HB VAL A 82 27.057 -17.721 8.597 1.00 0.36 H new ATOM 0 HG11 VAL A 82 28.010 -17.971 6.335 1.00 0.84 H new ATOM 0 HG12 VAL A 82 26.506 -17.020 6.318 1.00 0.84 H new ATOM 0 HG13 VAL A 82 28.079 -16.200 6.176 1.00 0.84 H new ATOM 0 HG21 VAL A 82 29.484 -17.941 8.301 1.00 0.73 H new ATOM 0 HG22 VAL A 82 29.631 -16.169 8.224 1.00 0.73 H new ATOM 0 HG23 VAL A 82 29.073 -16.951 9.722 1.00 0.73 H new ATOM 1290 N SER A 83 28.015 -14.842 10.675 1.00 0.39 N ATOM 1291 CA SER A 83 28.111 -14.624 12.117 1.00 0.49 C ATOM 1292 C SER A 83 27.015 -13.675 12.598 1.00 0.48 C ATOM 1293 O SER A 83 26.633 -13.676 13.768 1.00 0.60 O ATOM 1294 CB SER A 83 29.483 -14.045 12.471 1.00 0.63 C ATOM 1295 OG SER A 83 30.524 -14.935 12.118 1.00 1.43 O ATOM 0 H SER A 83 28.803 -14.475 10.142 1.00 0.39 H new ATOM 0 HA SER A 83 27.983 -15.585 12.615 1.00 0.49 H new ATOM 0 HB2 SER A 83 29.623 -13.095 11.955 1.00 0.63 H new ATOM 0 HB3 SER A 83 29.527 -13.836 13.540 1.00 0.63 H new ATOM 0 HG SER A 83 30.631 -14.944 11.144 1.00 1.43 H new ATOM 1301 N SER A 84 26.513 -12.868 11.683 1.00 0.50 N ATOM 1302 CA SER A 84 25.519 -11.870 12.011 1.00 0.53 C ATOM 1303 C SER A 84 24.176 -12.221 11.367 1.00 0.51 C ATOM 1304 O SER A 84 23.527 -11.367 10.767 1.00 0.64 O ATOM 1305 CB SER A 84 26.011 -10.500 11.531 1.00 0.69 C ATOM 1306 OG SER A 84 25.192 -9.454 12.023 1.00 1.23 O ATOM 0 H SER A 84 26.782 -12.887 10.699 1.00 0.50 H new ATOM 0 HA SER A 84 25.372 -11.841 13.091 1.00 0.53 H new ATOM 0 HB2 SER A 84 27.038 -10.345 11.860 1.00 0.69 H new ATOM 0 HB3 SER A 84 26.019 -10.476 10.441 1.00 0.69 H new ATOM 0 HG SER A 84 24.249 -9.689 11.895 1.00 1.23 H new ATOM 1312 N MET A 85 23.772 -13.483 11.494 1.00 0.46 N ATOM 1313 CA MET A 85 22.503 -13.947 10.935 1.00 0.49 C ATOM 1314 C MET A 85 21.638 -14.608 12.003 1.00 0.49 C ATOM 1315 O MET A 85 21.969 -14.600 13.189 1.00 0.74 O ATOM 1316 CB MET A 85 22.745 -14.953 9.802 1.00 0.54 C ATOM 1317 CG MET A 85 23.315 -14.358 8.520 1.00 0.63 C ATOM 1318 SD MET A 85 22.070 -13.604 7.448 1.00 1.05 S ATOM 1319 CE MET A 85 21.562 -12.190 8.422 1.00 2.27 C ATOM 0 H MET A 85 24.305 -14.204 11.980 1.00 0.46 H new ATOM 0 HA MET A 85 21.983 -13.072 10.545 1.00 0.49 H new ATOM 0 HB2 MET A 85 23.427 -15.724 10.161 1.00 0.54 H new ATOM 0 HB3 MET A 85 21.802 -15.446 9.567 1.00 0.54 H new ATOM 0 HG2 MET A 85 24.060 -13.606 8.780 1.00 0.63 H new ATOM 0 HG3 MET A 85 23.832 -15.141 7.966 1.00 0.63 H new ATOM 0 HE1 MET A 85 20.680 -11.736 7.971 1.00 2.27 H new ATOM 0 HE2 MET A 85 21.326 -12.513 9.436 1.00 2.27 H new ATOM 0 HE3 MET A 85 22.371 -11.460 8.453 1.00 2.27 H new ATOM 1329 N ARG A 86 20.526 -15.182 11.562 1.00 0.45 N ATOM 1330 CA ARG A 86 19.640 -15.958 12.417 1.00 0.46 C ATOM 1331 C ARG A 86 18.869 -16.937 11.535 1.00 0.49 C ATOM 1332 O ARG A 86 18.798 -16.741 10.327 1.00 0.57 O ATOM 1333 CB ARG A 86 18.676 -15.032 13.191 1.00 0.49 C ATOM 1334 CG ARG A 86 17.858 -15.740 14.259 1.00 0.96 C ATOM 1335 CD ARG A 86 16.448 -16.016 13.776 1.00 1.24 C ATOM 1336 NE ARG A 86 15.800 -17.069 14.546 1.00 2.20 N ATOM 1337 CZ ARG A 86 14.535 -17.027 14.958 1.00 3.10 C ATOM 1338 NH1 ARG A 86 13.787 -15.966 14.688 1.00 3.34 N ATOM 1339 NH2 ARG A 86 14.018 -18.050 15.628 1.00 4.19 N ATOM 0 H ARG A 86 20.212 -15.121 10.593 1.00 0.45 H new ATOM 0 HA ARG A 86 20.221 -16.507 13.158 1.00 0.46 H new ATOM 0 HB2 ARG A 86 19.253 -14.235 13.660 1.00 0.49 H new ATOM 0 HB3 ARG A 86 17.996 -14.559 12.482 1.00 0.49 H new ATOM 0 HG2 ARG A 86 18.343 -16.678 14.530 1.00 0.96 H new ATOM 0 HG3 ARG A 86 17.823 -15.127 15.160 1.00 0.96 H new ATOM 0 HD2 ARG A 86 15.857 -15.103 13.843 1.00 1.24 H new ATOM 0 HD3 ARG A 86 16.475 -16.301 12.724 1.00 1.24 H new ATOM 0 HE ARG A 86 16.352 -17.893 14.785 1.00 2.20 H new ATOM 0 HH11 ARG A 86 14.181 -15.184 14.165 1.00 3.34 H new ATOM 0 HH12 ARG A 86 12.817 -15.932 15.003 1.00 3.34 H new ATOM 0 HH21 ARG A 86 14.590 -18.870 15.828 1.00 4.19 H new ATOM 0 HH22 ARG A 86 13.048 -18.016 15.943 1.00 4.19 H new ATOM 1353 N LYS A 87 18.313 -17.986 12.135 1.00 0.51 N ATOM 1354 CA LYS A 87 17.522 -18.993 11.412 1.00 0.59 C ATOM 1355 C LYS A 87 16.490 -18.360 10.465 1.00 0.59 C ATOM 1356 O LYS A 87 16.247 -18.860 9.369 1.00 0.74 O ATOM 1357 CB LYS A 87 16.801 -19.887 12.426 1.00 0.68 C ATOM 1358 CG LYS A 87 15.861 -20.903 11.805 1.00 0.84 C ATOM 1359 CD LYS A 87 14.998 -21.572 12.861 1.00 1.03 C ATOM 1360 CE LYS A 87 15.835 -22.376 13.847 1.00 1.26 C ATOM 1361 NZ LYS A 87 14.999 -23.002 14.908 1.00 1.94 N ATOM 0 H LYS A 87 18.395 -18.167 13.135 1.00 0.51 H new ATOM 0 HA LYS A 87 18.210 -19.577 10.800 1.00 0.59 H new ATOM 0 HB2 LYS A 87 17.546 -20.415 13.021 1.00 0.68 H new ATOM 0 HB3 LYS A 87 16.234 -19.256 13.111 1.00 0.68 H new ATOM 0 HG2 LYS A 87 15.224 -20.411 11.070 1.00 0.84 H new ATOM 0 HG3 LYS A 87 16.439 -21.658 11.272 1.00 0.84 H new ATOM 0 HD2 LYS A 87 14.429 -20.814 13.400 1.00 1.03 H new ATOM 0 HD3 LYS A 87 14.275 -22.229 12.377 1.00 1.03 H new ATOM 0 HE2 LYS A 87 16.381 -23.152 13.311 1.00 1.26 H new ATOM 0 HE3 LYS A 87 16.578 -21.725 14.308 1.00 1.26 H new ATOM 0 HZ1 LYS A 87 15.608 -23.540 15.558 1.00 1.94 H new ATOM 0 HZ2 LYS A 87 14.497 -22.261 15.437 1.00 1.94 H new ATOM 0 HZ3 LYS A 87 14.307 -23.644 14.471 1.00 1.94 H new ATOM 1375 N ASN A 88 15.880 -17.265 10.903 1.00 0.55 N ATOM 1376 CA ASN A 88 14.856 -16.586 10.112 1.00 0.66 C ATOM 1377 C ASN A 88 15.365 -15.252 9.585 1.00 0.60 C ATOM 1378 O ASN A 88 14.616 -14.486 8.977 1.00 0.71 O ATOM 1379 CB ASN A 88 13.597 -16.355 10.953 1.00 0.79 C ATOM 1380 CG ASN A 88 12.890 -17.645 11.321 1.00 0.96 C ATOM 1381 OD1 ASN A 88 13.207 -18.273 12.329 1.00 1.23 O ATOM 1382 ND2 ASN A 88 11.907 -18.034 10.523 1.00 1.20 N ATOM 0 H ASN A 88 16.076 -16.826 11.803 1.00 0.55 H new ATOM 0 HA ASN A 88 14.613 -17.227 9.264 1.00 0.66 H new ATOM 0 HB2 ASN A 88 13.867 -15.822 11.864 1.00 0.79 H new ATOM 0 HB3 ASN A 88 12.910 -15.714 10.401 1.00 0.79 H new ATOM 0 HD21 ASN A 88 11.383 -18.883 10.736 1.00 1.20 H new ATOM 0 HD22 ASN A 88 11.674 -17.485 9.695 1.00 1.20 H new ATOM 1389 N GLU A 89 16.642 -14.983 9.801 1.00 0.50 N ATOM 1390 CA GLU A 89 17.227 -13.726 9.373 1.00 0.46 C ATOM 1391 C GLU A 89 18.088 -13.969 8.150 1.00 0.47 C ATOM 1392 O GLU A 89 18.774 -14.983 8.056 1.00 0.65 O ATOM 1393 CB GLU A 89 18.048 -13.082 10.497 1.00 0.50 C ATOM 1394 CG GLU A 89 18.559 -11.695 10.148 1.00 0.48 C ATOM 1395 CD GLU A 89 19.129 -10.952 11.335 1.00 1.01 C ATOM 1396 OE1 GLU A 89 18.334 -10.389 12.119 1.00 1.38 O ATOM 1397 OE2 GLU A 89 20.368 -10.914 11.480 1.00 1.60 O ATOM 0 H GLU A 89 17.290 -15.617 10.269 1.00 0.50 H new ATOM 0 HA GLU A 89 16.426 -13.032 9.120 1.00 0.46 H new ATOM 0 HB2 GLU A 89 17.435 -13.020 11.396 1.00 0.50 H new ATOM 0 HB3 GLU A 89 18.896 -13.725 10.733 1.00 0.50 H new ATOM 0 HG2 GLU A 89 19.327 -11.781 9.379 1.00 0.48 H new ATOM 0 HG3 GLU A 89 17.743 -11.112 9.720 1.00 0.48 H new ATOM 1404 N LYS A 90 18.040 -13.046 7.210 1.00 0.39 N ATOM 1405 CA LYS A 90 18.725 -13.222 5.945 1.00 0.40 C ATOM 1406 C LYS A 90 19.218 -11.891 5.412 1.00 0.39 C ATOM 1407 O LYS A 90 18.496 -10.894 5.443 1.00 0.47 O ATOM 1408 CB LYS A 90 17.788 -13.874 4.929 1.00 0.50 C ATOM 1409 CG LYS A 90 18.369 -13.953 3.531 1.00 0.56 C ATOM 1410 CD LYS A 90 17.500 -14.794 2.623 1.00 0.93 C ATOM 1411 CE LYS A 90 18.084 -14.874 1.231 1.00 0.85 C ATOM 1412 NZ LYS A 90 17.327 -15.815 0.367 1.00 1.17 N ATOM 0 H LYS A 90 17.533 -12.165 7.299 1.00 0.39 H new ATOM 0 HA LYS A 90 19.586 -13.870 6.108 1.00 0.40 H new ATOM 0 HB2 LYS A 90 17.541 -14.880 5.268 1.00 0.50 H new ATOM 0 HB3 LYS A 90 16.855 -13.311 4.894 1.00 0.50 H new ATOM 0 HG2 LYS A 90 18.466 -12.949 3.118 1.00 0.56 H new ATOM 0 HG3 LYS A 90 19.372 -14.378 3.575 1.00 0.56 H new ATOM 0 HD2 LYS A 90 17.400 -15.797 3.037 1.00 0.93 H new ATOM 0 HD3 LYS A 90 16.498 -14.368 2.576 1.00 0.93 H new ATOM 0 HE2 LYS A 90 18.081 -13.882 0.778 1.00 0.85 H new ATOM 0 HE3 LYS A 90 19.124 -15.193 1.291 1.00 0.85 H new ATOM 0 HZ1 LYS A 90 17.779 -15.867 -0.568 1.00 1.17 H new ATOM 0 HZ2 LYS A 90 17.323 -16.759 0.803 1.00 1.17 H new ATOM 0 HZ3 LYS A 90 16.349 -15.478 0.261 1.00 1.17 H new ATOM 1426 N CYS A 91 20.447 -11.880 4.927 1.00 0.35 N ATOM 1427 CA CYS A 91 21.017 -10.688 4.332 1.00 0.38 C ATOM 1428 C CYS A 91 21.753 -11.025 3.047 1.00 0.32 C ATOM 1429 O CYS A 91 22.134 -12.176 2.810 1.00 0.37 O ATOM 1430 CB CYS A 91 21.972 -9.993 5.306 1.00 0.48 C ATOM 1431 SG CYS A 91 21.160 -9.277 6.754 1.00 1.20 S ATOM 0 H CYS A 91 21.070 -12.687 4.935 1.00 0.35 H new ATOM 0 HA CYS A 91 20.196 -10.010 4.101 1.00 0.38 H new ATOM 0 HB2 CYS A 91 22.719 -10.713 5.641 1.00 0.48 H new ATOM 0 HB3 CYS A 91 22.505 -9.204 4.775 1.00 0.48 H new ATOM 0 HG CYS A 91 21.979 -9.295 7.764 1.00 1.20 H new ATOM 1437 N LEU A 92 21.932 -10.015 2.221 1.00 0.31 N ATOM 1438 CA LEU A 92 22.742 -10.137 1.029 1.00 0.32 C ATOM 1439 C LEU A 92 24.164 -9.739 1.378 1.00 0.28 C ATOM 1440 O LEU A 92 24.375 -8.796 2.139 1.00 0.39 O ATOM 1441 CB LEU A 92 22.233 -9.213 -0.068 1.00 0.40 C ATOM 1442 CG LEU A 92 22.683 -9.564 -1.484 1.00 0.79 C ATOM 1443 CD1 LEU A 92 21.616 -10.384 -2.195 1.00 1.39 C ATOM 1444 CD2 LEU A 92 23.017 -8.299 -2.262 1.00 1.73 C ATOM 0 H LEU A 92 21.522 -9.091 2.357 1.00 0.31 H new ATOM 0 HA LEU A 92 22.696 -11.165 0.670 1.00 0.32 H new ATOM 0 HB2 LEU A 92 21.143 -9.212 -0.042 1.00 0.40 H new ATOM 0 HB3 LEU A 92 22.558 -8.197 0.157 1.00 0.40 H new ATOM 0 HG LEU A 92 23.586 -10.171 -1.425 1.00 0.79 H new ATOM 0 HD11 LEU A 92 21.954 -10.625 -3.203 1.00 1.39 H new ATOM 0 HD12 LEU A 92 21.437 -11.306 -1.642 1.00 1.39 H new ATOM 0 HD13 LEU A 92 20.692 -9.809 -2.250 1.00 1.39 H new ATOM 0 HD21 LEU A 92 23.336 -8.565 -3.270 1.00 1.73 H new ATOM 0 HD22 LEU A 92 22.134 -7.662 -2.317 1.00 1.73 H new ATOM 0 HD23 LEU A 92 23.820 -7.763 -1.757 1.00 1.73 H new ATOM 1456 N VAL A 93 25.118 -10.432 0.808 1.00 0.25 N ATOM 1457 CA VAL A 93 26.517 -10.191 1.116 1.00 0.25 C ATOM 1458 C VAL A 93 27.237 -9.621 -0.100 1.00 0.23 C ATOM 1459 O VAL A 93 27.032 -10.076 -1.231 1.00 0.26 O ATOM 1460 CB VAL A 93 27.226 -11.479 1.608 1.00 0.34 C ATOM 1461 CG1 VAL A 93 27.182 -12.569 0.546 1.00 0.74 C ATOM 1462 CG2 VAL A 93 28.655 -11.174 2.033 1.00 0.60 C ATOM 0 H VAL A 93 24.956 -11.172 0.125 1.00 0.25 H new ATOM 0 HA VAL A 93 26.556 -9.463 1.926 1.00 0.25 H new ATOM 0 HB VAL A 93 26.689 -11.853 2.480 1.00 0.34 H new ATOM 0 HG11 VAL A 93 27.687 -13.460 0.918 1.00 0.74 H new ATOM 0 HG12 VAL A 93 26.144 -12.810 0.314 1.00 0.74 H new ATOM 0 HG13 VAL A 93 27.683 -12.218 -0.356 1.00 0.74 H new ATOM 0 HG21 VAL A 93 29.136 -12.090 2.375 1.00 0.60 H new ATOM 0 HG22 VAL A 93 29.208 -10.768 1.186 1.00 0.60 H new ATOM 0 HG23 VAL A 93 28.646 -10.445 2.843 1.00 0.60 H new ATOM 1472 N ARG A 94 28.046 -8.599 0.127 1.00 0.25 N ATOM 1473 CA ARG A 94 28.800 -7.976 -0.944 1.00 0.30 C ATOM 1474 C ARG A 94 30.270 -8.351 -0.820 1.00 0.33 C ATOM 1475 O ARG A 94 30.939 -7.943 0.128 1.00 0.38 O ATOM 1476 CB ARG A 94 28.646 -6.454 -0.878 1.00 0.40 C ATOM 1477 CG ARG A 94 28.787 -5.768 -2.224 1.00 0.92 C ATOM 1478 CD ARG A 94 27.577 -6.029 -3.103 1.00 0.65 C ATOM 1479 NE ARG A 94 26.334 -5.657 -2.421 1.00 0.89 N ATOM 1480 CZ ARG A 94 25.365 -4.936 -2.982 1.00 1.05 C ATOM 1481 NH1 ARG A 94 25.490 -4.515 -4.229 1.00 1.71 N ATOM 1482 NH2 ARG A 94 24.261 -4.637 -2.293 1.00 1.58 N ATOM 0 H ARG A 94 28.196 -8.184 1.046 1.00 0.25 H new ATOM 0 HA ARG A 94 28.417 -8.329 -1.901 1.00 0.30 H new ATOM 0 HB2 ARG A 94 27.669 -6.214 -0.459 1.00 0.40 H new ATOM 0 HB3 ARG A 94 29.394 -6.051 -0.195 1.00 0.40 H new ATOM 0 HG2 ARG A 94 28.908 -4.695 -2.077 1.00 0.92 H new ATOM 0 HG3 ARG A 94 29.687 -6.125 -2.724 1.00 0.92 H new ATOM 0 HD2 ARG A 94 27.669 -5.463 -4.030 1.00 0.65 H new ATOM 0 HD3 ARG A 94 27.543 -7.084 -3.375 1.00 0.65 H new ATOM 0 HE ARG A 94 26.203 -5.969 -1.459 1.00 0.89 H new ATOM 0 HH11 ARG A 94 26.329 -4.742 -4.762 1.00 1.71 H new ATOM 0 HH12 ARG A 94 24.747 -3.963 -4.658 1.00 1.71 H new ATOM 0 HH21 ARG A 94 24.156 -4.961 -1.332 1.00 1.58 H new ATOM 0 HH22 ARG A 94 23.522 -4.084 -2.728 1.00 1.58 H new ATOM 1496 N ILE A 95 30.767 -9.137 -1.759 1.00 0.35 N ATOM 1497 CA ILE A 95 32.166 -9.528 -1.744 1.00 0.38 C ATOM 1498 C ILE A 95 32.968 -8.613 -2.652 1.00 0.41 C ATOM 1499 O ILE A 95 32.842 -8.667 -3.877 1.00 0.45 O ATOM 1500 CB ILE A 95 32.390 -11.008 -2.164 1.00 0.43 C ATOM 1501 CG1 ILE A 95 31.778 -11.973 -1.136 1.00 0.47 C ATOM 1502 CG2 ILE A 95 33.877 -11.301 -2.322 1.00 0.52 C ATOM 1503 CD1 ILE A 95 30.268 -12.075 -1.185 1.00 0.51 C ATOM 0 H ILE A 95 30.227 -9.515 -2.537 1.00 0.35 H new ATOM 0 HA ILE A 95 32.507 -9.434 -0.713 1.00 0.38 H new ATOM 0 HB ILE A 95 31.893 -11.159 -3.122 1.00 0.43 H new ATOM 0 HG12 ILE A 95 32.201 -12.965 -1.293 1.00 0.47 H new ATOM 0 HG13 ILE A 95 32.075 -11.654 -0.137 1.00 0.47 H new ATOM 0 HG21 ILE A 95 34.014 -12.342 -2.616 1.00 0.52 H new ATOM 0 HG22 ILE A 95 34.297 -10.649 -3.088 1.00 0.52 H new ATOM 0 HG23 ILE A 95 34.386 -11.122 -1.375 1.00 0.52 H new ATOM 0 HD11 ILE A 95 29.926 -12.778 -0.425 1.00 0.51 H new ATOM 0 HD12 ILE A 95 29.831 -11.095 -0.996 1.00 0.51 H new ATOM 0 HD13 ILE A 95 29.959 -12.426 -2.169 1.00 0.51 H new ATOM 1515 N GLU A 96 33.750 -7.740 -2.042 1.00 0.43 N ATOM 1516 CA GLU A 96 34.637 -6.872 -2.786 1.00 0.49 C ATOM 1517 C GLU A 96 35.946 -7.609 -3.057 1.00 0.45 C ATOM 1518 O GLU A 96 36.130 -8.738 -2.600 1.00 0.45 O ATOM 1519 CB GLU A 96 34.896 -5.577 -2.005 1.00 0.55 C ATOM 1520 CG GLU A 96 35.119 -4.361 -2.892 1.00 0.77 C ATOM 1521 CD GLU A 96 35.246 -3.073 -2.104 1.00 0.88 C ATOM 1522 OE1 GLU A 96 34.207 -2.454 -1.803 1.00 1.19 O ATOM 1523 OE2 GLU A 96 36.385 -2.681 -1.773 1.00 1.37 O ATOM 0 H GLU A 96 33.787 -7.615 -1.030 1.00 0.43 H new ATOM 0 HA GLU A 96 34.173 -6.604 -3.735 1.00 0.49 H new ATOM 0 HB2 GLU A 96 34.049 -5.385 -1.347 1.00 0.55 H new ATOM 0 HB3 GLU A 96 35.770 -5.716 -1.368 1.00 0.55 H new ATOM 0 HG2 GLU A 96 36.022 -4.510 -3.484 1.00 0.77 H new ATOM 0 HG3 GLU A 96 34.289 -4.272 -3.593 1.00 0.77 H new ATOM 1530 N SER A 97 36.853 -6.968 -3.779 1.00 0.49 N ATOM 1531 CA SER A 97 38.120 -7.584 -4.144 1.00 0.54 C ATOM 1532 C SER A 97 38.909 -8.038 -2.914 1.00 0.52 C ATOM 1533 O SER A 97 39.545 -9.089 -2.930 1.00 0.59 O ATOM 1534 CB SER A 97 38.944 -6.598 -4.971 1.00 0.64 C ATOM 1535 OG SER A 97 38.915 -5.303 -4.392 1.00 1.00 O ATOM 0 H SER A 97 36.734 -6.016 -4.125 1.00 0.49 H new ATOM 0 HA SER A 97 37.908 -8.474 -4.736 1.00 0.54 H new ATOM 0 HB2 SER A 97 39.974 -6.947 -5.040 1.00 0.64 H new ATOM 0 HB3 SER A 97 38.554 -6.555 -5.988 1.00 0.64 H new ATOM 0 HG SER A 97 39.450 -4.689 -4.937 1.00 1.00 H new ATOM 1541 N MET A 98 38.842 -7.249 -1.849 1.00 0.48 N ATOM 1542 CA MET A 98 39.606 -7.528 -0.638 1.00 0.53 C ATOM 1543 C MET A 98 38.972 -8.639 0.202 1.00 0.49 C ATOM 1544 O MET A 98 39.579 -9.127 1.153 1.00 0.58 O ATOM 1545 CB MET A 98 39.751 -6.253 0.197 1.00 0.59 C ATOM 1546 CG MET A 98 38.435 -5.696 0.713 1.00 0.57 C ATOM 1547 SD MET A 98 38.641 -4.149 1.625 1.00 0.79 S ATOM 1548 CE MET A 98 39.156 -3.049 0.307 1.00 1.79 C ATOM 0 H MET A 98 38.265 -6.409 -1.799 1.00 0.48 H new ATOM 0 HA MET A 98 40.592 -7.876 -0.947 1.00 0.53 H new ATOM 0 HB2 MET A 98 40.403 -6.460 1.045 1.00 0.59 H new ATOM 0 HB3 MET A 98 40.244 -5.491 -0.406 1.00 0.59 H new ATOM 0 HG2 MET A 98 37.761 -5.530 -0.127 1.00 0.57 H new ATOM 0 HG3 MET A 98 37.962 -6.434 1.360 1.00 0.57 H new ATOM 0 HE1 MET A 98 38.967 -2.016 0.600 1.00 1.79 H new ATOM 0 HE2 MET A 98 40.221 -3.183 0.116 1.00 1.79 H new ATOM 0 HE3 MET A 98 38.593 -3.277 -0.598 1.00 1.79 H new ATOM 1558 N TYR A 99 37.756 -9.048 -0.150 1.00 0.41 N ATOM 1559 CA TYR A 99 37.046 -10.059 0.631 1.00 0.43 C ATOM 1560 C TYR A 99 37.081 -11.414 -0.067 1.00 0.49 C ATOM 1561 O TYR A 99 36.448 -12.369 0.387 1.00 0.48 O ATOM 1562 CB TYR A 99 35.590 -9.645 0.871 1.00 0.43 C ATOM 1563 CG TYR A 99 35.432 -8.296 1.538 1.00 0.46 C ATOM 1564 CD1 TYR A 99 36.270 -7.901 2.573 1.00 0.51 C ATOM 1565 CD2 TYR A 99 34.445 -7.414 1.122 1.00 0.53 C ATOM 1566 CE1 TYR A 99 36.122 -6.668 3.175 1.00 0.59 C ATOM 1567 CE2 TYR A 99 34.291 -6.179 1.720 1.00 0.62 C ATOM 1568 CZ TYR A 99 35.136 -5.809 2.743 1.00 0.63 C ATOM 1569 OH TYR A 99 34.986 -4.586 3.348 1.00 0.75 O ATOM 0 H TYR A 99 37.246 -8.700 -0.962 1.00 0.41 H new ATOM 0 HA TYR A 99 37.553 -10.143 1.592 1.00 0.43 H new ATOM 0 HB2 TYR A 99 35.066 -9.629 -0.085 1.00 0.43 H new ATOM 0 HB3 TYR A 99 35.105 -10.402 1.488 1.00 0.43 H new ATOM 0 HD1 TYR A 99 37.049 -8.568 2.912 1.00 0.51 H new ATOM 0 HD2 TYR A 99 33.785 -7.699 0.316 1.00 0.53 H new ATOM 0 HE1 TYR A 99 36.778 -6.378 3.983 1.00 0.59 H new ATOM 0 HE2 TYR A 99 33.513 -5.507 1.388 1.00 0.62 H new ATOM 0 HH TYR A 99 34.638 -4.711 4.256 1.00 0.75 H new ATOM 1579 N GLY A 100 37.831 -11.495 -1.158 1.00 0.60 N ATOM 1580 CA GLY A 100 37.894 -12.720 -1.930 1.00 0.71 C ATOM 1581 C GLY A 100 39.313 -13.246 -2.070 1.00 0.67 C ATOM 1582 O GLY A 100 40.263 -12.593 -1.643 1.00 0.67 O ATOM 0 H GLY A 100 38.399 -10.731 -1.523 1.00 0.60 H new ATOM 0 HA2 GLY A 100 37.274 -13.479 -1.453 1.00 0.71 H new ATOM 0 HA3 GLY A 100 37.476 -12.543 -2.921 1.00 0.71 H new ATOM 1586 N TYR A 101 39.452 -14.423 -2.675 1.00 0.76 N ATOM 1587 CA TYR A 101 40.768 -15.016 -2.924 1.00 0.86 C ATOM 1588 C TYR A 101 41.414 -14.419 -4.165 1.00 0.93 C ATOM 1589 O TYR A 101 42.572 -14.708 -4.479 1.00 1.52 O ATOM 1590 CB TYR A 101 40.659 -16.534 -3.103 1.00 1.01 C ATOM 1591 CG TYR A 101 40.496 -17.301 -1.815 1.00 0.86 C ATOM 1592 CD1 TYR A 101 41.599 -17.594 -1.023 1.00 1.09 C ATOM 1593 CD2 TYR A 101 39.251 -17.735 -1.391 1.00 0.75 C ATOM 1594 CE1 TYR A 101 41.465 -18.300 0.155 1.00 1.14 C ATOM 1595 CE2 TYR A 101 39.109 -18.443 -0.214 1.00 0.74 C ATOM 1596 CZ TYR A 101 40.218 -18.722 0.556 1.00 0.92 C ATOM 1597 OH TYR A 101 40.077 -19.426 1.730 1.00 1.09 O ATOM 0 H TYR A 101 38.669 -14.988 -3.003 1.00 0.76 H new ATOM 0 HA TYR A 101 41.389 -14.796 -2.055 1.00 0.86 H new ATOM 0 HB2 TYR A 101 39.810 -16.752 -3.752 1.00 1.01 H new ATOM 0 HB3 TYR A 101 41.552 -16.893 -3.615 1.00 1.01 H new ATOM 0 HD1 TYR A 101 42.579 -17.263 -1.335 1.00 1.09 H new ATOM 0 HD2 TYR A 101 38.379 -17.517 -1.989 1.00 0.75 H new ATOM 0 HE1 TYR A 101 42.333 -18.520 0.758 1.00 1.14 H new ATOM 0 HE2 TYR A 101 38.132 -18.777 0.102 1.00 0.74 H new ATOM 0 HH TYR A 101 40.773 -19.150 2.362 1.00 1.09 H new ATOM 1607 N GLY A 102 40.655 -13.599 -4.878 1.00 1.06 N ATOM 1608 CA GLY A 102 41.140 -13.042 -6.121 1.00 1.21 C ATOM 1609 C GLY A 102 41.325 -14.111 -7.178 1.00 1.78 C ATOM 1610 O GLY A 102 40.617 -15.119 -7.174 1.00 2.30 O ATOM 0 H GLY A 102 39.712 -13.310 -4.617 1.00 1.06 H new ATOM 0 HA2 GLY A 102 40.438 -12.291 -6.482 1.00 1.21 H new ATOM 0 HA3 GLY A 102 42.089 -12.534 -5.947 1.00 1.21 H new ATOM 1614 N ASP A 103 42.282 -13.900 -8.072 1.00 2.37 N ATOM 1615 CA ASP A 103 42.558 -14.846 -9.154 1.00 3.29 C ATOM 1616 C ASP A 103 43.560 -15.909 -8.717 1.00 2.98 C ATOM 1617 O ASP A 103 43.844 -16.851 -9.457 1.00 3.44 O ATOM 1618 CB ASP A 103 43.105 -14.110 -10.381 1.00 4.29 C ATOM 1619 CG ASP A 103 42.156 -13.049 -10.891 1.00 5.21 C ATOM 1620 OD1 ASP A 103 42.234 -11.898 -10.417 1.00 5.54 O ATOM 1621 OD2 ASP A 103 41.329 -13.370 -11.771 1.00 5.86 O ATOM 0 H ASP A 103 42.886 -13.078 -8.072 1.00 2.37 H new ATOM 0 HA ASP A 103 41.618 -15.335 -9.410 1.00 3.29 H new ATOM 0 HB2 ASP A 103 44.059 -13.648 -10.128 1.00 4.29 H new ATOM 0 HB3 ASP A 103 43.300 -14.830 -11.175 1.00 4.29 H new ATOM 1626 N GLU A 104 44.110 -15.742 -7.524 1.00 2.45 N ATOM 1627 CA GLU A 104 45.155 -16.632 -7.041 1.00 2.35 C ATOM 1628 C GLU A 104 44.563 -17.885 -6.403 1.00 1.99 C ATOM 1629 O GLU A 104 45.011 -19.000 -6.678 1.00 2.35 O ATOM 1630 CB GLU A 104 46.056 -15.903 -6.043 1.00 2.63 C ATOM 1631 CG GLU A 104 47.235 -16.737 -5.570 1.00 2.96 C ATOM 1632 CD GLU A 104 48.180 -15.956 -4.686 1.00 3.62 C ATOM 1633 OE1 GLU A 104 49.015 -15.201 -5.220 1.00 3.81 O ATOM 1634 OE2 GLU A 104 48.081 -16.088 -3.452 1.00 4.27 O ATOM 0 H GLU A 104 43.851 -15.000 -6.874 1.00 2.45 H new ATOM 0 HA GLU A 104 45.754 -16.941 -7.897 1.00 2.35 H new ATOM 0 HB2 GLU A 104 46.429 -14.988 -6.503 1.00 2.63 H new ATOM 0 HB3 GLU A 104 45.462 -15.605 -5.179 1.00 2.63 H new ATOM 0 HG2 GLU A 104 46.866 -17.605 -5.024 1.00 2.96 H new ATOM 0 HG3 GLU A 104 47.780 -17.113 -6.436 1.00 2.96 H new ATOM 1641 N GLY A 105 43.563 -17.696 -5.558 1.00 1.73 N ATOM 1642 CA GLY A 105 42.934 -18.819 -4.897 1.00 2.16 C ATOM 1643 C GLY A 105 41.858 -19.460 -5.750 1.00 1.86 C ATOM 1644 O GLY A 105 41.477 -18.920 -6.792 1.00 1.83 O ATOM 0 H GLY A 105 43.175 -16.784 -5.318 1.00 1.73 H new ATOM 0 HA2 GLY A 105 43.691 -19.564 -4.651 1.00 2.16 H new ATOM 0 HA3 GLY A 105 42.497 -18.486 -3.956 1.00 2.16 H new ATOM 1648 N CYS A 106 41.365 -20.609 -5.313 1.00 2.02 N ATOM 1649 CA CYS A 106 40.324 -21.316 -6.043 1.00 1.91 C ATOM 1650 C CYS A 106 38.951 -20.731 -5.717 1.00 1.52 C ATOM 1651 O CYS A 106 38.332 -21.080 -4.706 1.00 1.85 O ATOM 1652 CB CYS A 106 40.363 -22.811 -5.712 1.00 2.62 C ATOM 1653 SG CYS A 106 41.941 -23.604 -6.097 1.00 3.34 S ATOM 0 H CYS A 106 41.669 -21.072 -4.456 1.00 2.02 H new ATOM 0 HA CYS A 106 40.505 -21.193 -7.111 1.00 1.91 H new ATOM 0 HB2 CYS A 106 40.150 -22.944 -4.651 1.00 2.62 H new ATOM 0 HB3 CYS A 106 39.570 -23.316 -6.263 1.00 2.62 H new ATOM 0 HG CYS A 106 41.882 -24.864 -5.782 1.00 3.34 H new ATOM 1659 N GLY A 107 38.501 -19.812 -6.564 1.00 1.20 N ATOM 1660 CA GLY A 107 37.218 -19.172 -6.364 1.00 1.16 C ATOM 1661 C GLY A 107 36.061 -20.128 -6.561 1.00 1.09 C ATOM 1662 O GLY A 107 36.172 -21.103 -7.305 1.00 1.19 O ATOM 0 H GLY A 107 39.008 -19.498 -7.392 1.00 1.20 H new ATOM 0 HA2 GLY A 107 37.175 -18.756 -5.357 1.00 1.16 H new ATOM 0 HA3 GLY A 107 37.119 -18.337 -7.058 1.00 1.16 H new ATOM 1666 N GLU A 108 34.948 -19.850 -5.896 1.00 1.15 N ATOM 1667 CA GLU A 108 33.785 -20.724 -5.956 1.00 1.27 C ATOM 1668 C GLU A 108 33.098 -20.643 -7.316 1.00 1.10 C ATOM 1669 O GLU A 108 32.961 -21.653 -8.003 1.00 1.19 O ATOM 1670 CB GLU A 108 32.802 -20.379 -4.844 1.00 1.53 C ATOM 1671 CG GLU A 108 33.433 -20.386 -3.466 1.00 1.74 C ATOM 1672 CD GLU A 108 32.417 -20.211 -2.362 1.00 2.49 C ATOM 1673 OE1 GLU A 108 31.947 -19.071 -2.167 1.00 3.02 O ATOM 1674 OE2 GLU A 108 32.096 -21.209 -1.691 1.00 3.08 O ATOM 0 H GLU A 108 34.826 -19.025 -5.308 1.00 1.15 H new ATOM 0 HA GLU A 108 34.130 -21.748 -5.816 1.00 1.27 H new ATOM 0 HB2 GLU A 108 32.376 -19.394 -5.037 1.00 1.53 H new ATOM 0 HB3 GLU A 108 31.978 -21.092 -4.863 1.00 1.53 H new ATOM 0 HG2 GLU A 108 33.966 -21.325 -3.319 1.00 1.74 H new ATOM 0 HG3 GLU A 108 34.172 -19.587 -3.405 1.00 1.74 H new ATOM 1681 N SER A 109 32.661 -19.451 -7.704 1.00 0.97 N ATOM 1682 CA SER A 109 32.015 -19.283 -8.997 1.00 0.88 C ATOM 1683 C SER A 109 32.917 -18.528 -9.976 1.00 0.77 C ATOM 1684 O SER A 109 33.524 -19.136 -10.854 1.00 0.85 O ATOM 1685 CB SER A 109 30.681 -18.552 -8.822 1.00 0.92 C ATOM 1686 OG SER A 109 29.901 -19.163 -7.809 1.00 1.52 O ATOM 0 H SER A 109 32.741 -18.598 -7.150 1.00 0.97 H new ATOM 0 HA SER A 109 31.828 -20.271 -9.417 1.00 0.88 H new ATOM 0 HB2 SER A 109 30.864 -17.508 -8.566 1.00 0.92 H new ATOM 0 HB3 SER A 109 30.132 -18.558 -9.763 1.00 0.92 H new ATOM 0 HG SER A 109 29.054 -18.680 -7.712 1.00 1.52 H new ATOM 1692 N ILE A 110 33.039 -17.214 -9.797 1.00 0.68 N ATOM 1693 CA ILE A 110 33.892 -16.398 -10.664 1.00 0.65 C ATOM 1694 C ILE A 110 34.492 -15.217 -9.898 1.00 0.63 C ATOM 1695 O ILE A 110 33.801 -14.249 -9.580 1.00 0.75 O ATOM 1696 CB ILE A 110 33.164 -15.851 -11.934 1.00 0.64 C ATOM 1697 CG1 ILE A 110 31.830 -15.148 -11.590 1.00 0.66 C ATOM 1698 CG2 ILE A 110 32.945 -16.958 -12.960 1.00 0.72 C ATOM 1699 CD1 ILE A 110 30.665 -16.084 -11.339 1.00 0.74 C ATOM 0 H ILE A 110 32.561 -16.692 -9.063 1.00 0.68 H new ATOM 0 HA ILE A 110 34.678 -17.075 -10.999 1.00 0.65 H new ATOM 0 HB ILE A 110 33.819 -15.098 -12.373 1.00 0.64 H new ATOM 0 HG12 ILE A 110 31.979 -14.530 -10.704 1.00 0.66 H new ATOM 0 HG13 ILE A 110 31.568 -14.476 -12.407 1.00 0.66 H new ATOM 0 HG21 ILE A 110 32.437 -16.549 -13.833 1.00 0.72 H new ATOM 0 HG22 ILE A 110 33.908 -17.371 -13.261 1.00 0.72 H new ATOM 0 HG23 ILE A 110 32.334 -17.746 -12.520 1.00 0.72 H new ATOM 0 HD11 ILE A 110 29.774 -15.501 -11.106 1.00 0.74 H new ATOM 0 HD12 ILE A 110 30.483 -16.685 -12.230 1.00 0.74 H new ATOM 0 HD13 ILE A 110 30.899 -16.740 -10.501 1.00 0.74 H new ATOM 1711 N PRO A 111 35.779 -15.305 -9.547 1.00 0.70 N ATOM 1712 CA PRO A 111 36.509 -14.211 -8.927 1.00 0.78 C ATOM 1713 C PRO A 111 37.329 -13.411 -9.943 1.00 0.79 C ATOM 1714 O PRO A 111 37.329 -13.716 -11.139 1.00 1.58 O ATOM 1715 CB PRO A 111 37.430 -14.966 -7.978 1.00 1.10 C ATOM 1716 CG PRO A 111 37.770 -16.225 -8.715 1.00 1.22 C ATOM 1717 CD PRO A 111 36.638 -16.492 -9.686 1.00 0.89 C ATOM 0 HA PRO A 111 35.861 -13.474 -8.453 1.00 0.78 H new ATOM 0 HB2 PRO A 111 38.324 -14.387 -7.747 1.00 1.10 H new ATOM 0 HB3 PRO A 111 36.935 -15.181 -7.031 1.00 1.10 H new ATOM 0 HG2 PRO A 111 38.716 -16.117 -9.246 1.00 1.22 H new ATOM 0 HG3 PRO A 111 37.887 -17.058 -8.021 1.00 1.22 H new ATOM 0 HD2 PRO A 111 37.003 -16.606 -10.707 1.00 0.89 H new ATOM 0 HD3 PRO A 111 36.102 -17.407 -9.435 1.00 0.89 H new ATOM 1725 N GLY A 112 38.029 -12.388 -9.468 1.00 0.95 N ATOM 1726 CA GLY A 112 38.903 -11.629 -10.345 1.00 1.02 C ATOM 1727 C GLY A 112 38.649 -10.136 -10.294 1.00 1.09 C ATOM 1728 O GLY A 112 38.183 -9.551 -11.272 1.00 2.05 O ATOM 0 H GLY A 112 38.009 -12.071 -8.499 1.00 0.95 H new ATOM 0 HA2 GLY A 112 39.940 -11.824 -10.072 1.00 1.02 H new ATOM 0 HA3 GLY A 112 38.772 -11.979 -11.369 1.00 1.02 H new ATOM 1732 N ASN A 113 38.939 -9.526 -9.140 1.00 0.74 N ATOM 1733 CA ASN A 113 38.787 -8.075 -8.949 1.00 0.84 C ATOM 1734 C ASN A 113 37.369 -7.605 -9.270 1.00 0.75 C ATOM 1735 O ASN A 113 37.143 -6.433 -9.567 1.00 1.00 O ATOM 1736 CB ASN A 113 39.806 -7.308 -9.803 1.00 1.00 C ATOM 1737 CG ASN A 113 41.222 -7.451 -9.280 1.00 1.49 C ATOM 1738 OD1 ASN A 113 41.922 -8.406 -9.606 1.00 2.03 O ATOM 1739 ND2 ASN A 113 41.659 -6.498 -8.472 1.00 1.79 N ATOM 0 H ASN A 113 39.284 -10.018 -8.316 1.00 0.74 H new ATOM 0 HA ASN A 113 38.976 -7.865 -7.896 1.00 0.84 H new ATOM 0 HB2 ASN A 113 39.762 -7.671 -10.830 1.00 1.00 H new ATOM 0 HB3 ASN A 113 39.535 -6.252 -9.827 1.00 1.00 H new ATOM 0 HD21 ASN A 113 42.607 -6.542 -8.098 1.00 1.79 H new ATOM 0 HD22 ASN A 113 41.048 -5.720 -8.224 1.00 1.79 H new ATOM 1746 N SER A 114 36.422 -8.521 -9.178 1.00 0.57 N ATOM 1747 CA SER A 114 35.035 -8.221 -9.465 1.00 0.58 C ATOM 1748 C SER A 114 34.221 -8.246 -8.181 1.00 0.50 C ATOM 1749 O SER A 114 34.566 -8.957 -7.238 1.00 0.59 O ATOM 1750 CB SER A 114 34.488 -9.244 -10.458 1.00 0.65 C ATOM 1751 OG SER A 114 35.276 -9.282 -11.635 1.00 1.14 O ATOM 0 H SER A 114 36.593 -9.488 -8.904 1.00 0.57 H new ATOM 0 HA SER A 114 34.963 -7.225 -9.902 1.00 0.58 H new ATOM 0 HB2 SER A 114 34.471 -10.231 -9.996 1.00 0.65 H new ATOM 0 HB3 SER A 114 33.458 -8.993 -10.713 1.00 0.65 H new ATOM 0 HG SER A 114 36.196 -9.530 -11.405 1.00 1.14 H new ATOM 1757 N VAL A 115 33.160 -7.457 -8.142 1.00 0.44 N ATOM 1758 CA VAL A 115 32.269 -7.446 -6.996 1.00 0.38 C ATOM 1759 C VAL A 115 31.085 -8.381 -7.239 1.00 0.31 C ATOM 1760 O VAL A 115 30.453 -8.351 -8.300 1.00 0.31 O ATOM 1761 CB VAL A 115 31.768 -6.016 -6.668 1.00 0.44 C ATOM 1762 CG1 VAL A 115 31.063 -5.386 -7.860 1.00 0.48 C ATOM 1763 CG2 VAL A 115 30.859 -6.034 -5.448 1.00 0.42 C ATOM 0 H VAL A 115 32.896 -6.817 -8.891 1.00 0.44 H new ATOM 0 HA VAL A 115 32.835 -7.800 -6.134 1.00 0.38 H new ATOM 0 HB VAL A 115 32.639 -5.402 -6.440 1.00 0.44 H new ATOM 0 HG11 VAL A 115 30.725 -4.384 -7.595 1.00 0.48 H new ATOM 0 HG12 VAL A 115 31.754 -5.325 -8.701 1.00 0.48 H new ATOM 0 HG13 VAL A 115 30.204 -5.997 -8.139 1.00 0.48 H new ATOM 0 HG21 VAL A 115 30.518 -5.021 -5.234 1.00 0.42 H new ATOM 0 HG22 VAL A 115 29.998 -6.673 -5.645 1.00 0.42 H new ATOM 0 HG23 VAL A 115 31.409 -6.421 -4.590 1.00 0.42 H new ATOM 1773 N LEU A 116 30.815 -9.240 -6.271 1.00 0.28 N ATOM 1774 CA LEU A 116 29.722 -10.193 -6.380 1.00 0.25 C ATOM 1775 C LEU A 116 28.758 -10.031 -5.213 1.00 0.28 C ATOM 1776 O LEU A 116 29.157 -9.610 -4.122 1.00 0.37 O ATOM 1777 CB LEU A 116 30.244 -11.639 -6.413 1.00 0.30 C ATOM 1778 CG LEU A 116 31.127 -12.010 -7.606 1.00 0.33 C ATOM 1779 CD1 LEU A 116 32.570 -11.586 -7.371 1.00 0.51 C ATOM 1780 CD2 LEU A 116 31.038 -13.502 -7.884 1.00 0.50 C ATOM 0 H LEU A 116 31.339 -9.298 -5.398 1.00 0.28 H new ATOM 0 HA LEU A 116 29.200 -9.989 -7.315 1.00 0.25 H new ATOM 0 HB2 LEU A 116 30.809 -11.820 -5.499 1.00 0.30 H new ATOM 0 HB3 LEU A 116 29.388 -12.313 -6.398 1.00 0.30 H new ATOM 0 HG LEU A 116 30.763 -11.473 -8.482 1.00 0.33 H new ATOM 0 HD11 LEU A 116 33.175 -11.862 -8.234 1.00 0.51 H new ATOM 0 HD12 LEU A 116 32.613 -10.506 -7.227 1.00 0.51 H new ATOM 0 HD13 LEU A 116 32.956 -12.086 -6.483 1.00 0.51 H new ATOM 0 HD21 LEU A 116 31.671 -13.752 -8.735 1.00 0.50 H new ATOM 0 HD22 LEU A 116 31.373 -14.056 -7.007 1.00 0.50 H new ATOM 0 HD23 LEU A 116 30.005 -13.769 -8.109 1.00 0.50 H new ATOM 1792 N LEU A 117 27.496 -10.363 -5.448 1.00 0.31 N ATOM 1793 CA LEU A 117 26.486 -10.311 -4.403 1.00 0.38 C ATOM 1794 C LEU A 117 25.728 -11.631 -4.312 1.00 0.31 C ATOM 1795 O LEU A 117 25.195 -12.129 -5.304 1.00 0.38 O ATOM 1796 CB LEU A 117 25.507 -9.140 -4.611 1.00 0.61 C ATOM 1797 CG LEU A 117 25.394 -8.554 -6.029 1.00 0.38 C ATOM 1798 CD1 LEU A 117 24.838 -9.569 -7.017 1.00 0.70 C ATOM 1799 CD2 LEU A 117 24.518 -7.311 -6.006 1.00 0.59 C ATOM 0 H LEU A 117 27.148 -10.672 -6.356 1.00 0.31 H new ATOM 0 HA LEU A 117 27.006 -10.143 -3.460 1.00 0.38 H new ATOM 0 HB2 LEU A 117 24.515 -9.472 -4.304 1.00 0.61 H new ATOM 0 HB3 LEU A 117 25.797 -8.335 -3.936 1.00 0.61 H new ATOM 0 HG LEU A 117 26.397 -8.287 -6.361 1.00 0.38 H new ATOM 0 HD11 LEU A 117 24.774 -9.116 -8.006 1.00 0.70 H new ATOM 0 HD12 LEU A 117 25.497 -10.436 -7.057 1.00 0.70 H new ATOM 0 HD13 LEU A 117 23.844 -9.882 -6.696 1.00 0.70 H new ATOM 0 HD21 LEU A 117 24.442 -6.901 -7.013 1.00 0.59 H new ATOM 0 HD22 LEU A 117 23.524 -7.573 -5.645 1.00 0.59 H new ATOM 0 HD23 LEU A 117 24.960 -6.567 -5.343 1.00 0.59 H new ATOM 1811 N PHE A 118 25.707 -12.201 -3.117 1.00 0.30 N ATOM 1812 CA PHE A 118 25.012 -13.458 -2.877 1.00 0.34 C ATOM 1813 C PHE A 118 24.035 -13.306 -1.723 1.00 0.34 C ATOM 1814 O PHE A 118 24.222 -12.459 -0.850 1.00 0.37 O ATOM 1815 CB PHE A 118 26.007 -14.567 -2.531 1.00 0.43 C ATOM 1816 CG PHE A 118 27.144 -14.708 -3.499 1.00 0.37 C ATOM 1817 CD1 PHE A 118 26.929 -15.176 -4.782 1.00 0.39 C ATOM 1818 CD2 PHE A 118 28.432 -14.381 -3.113 1.00 0.38 C ATOM 1819 CE1 PHE A 118 27.980 -15.315 -5.664 1.00 0.38 C ATOM 1820 CE2 PHE A 118 29.487 -14.515 -3.991 1.00 0.40 C ATOM 1821 CZ PHE A 118 29.263 -14.984 -5.268 1.00 0.38 C ATOM 0 H PHE A 118 26.166 -11.811 -2.294 1.00 0.30 H new ATOM 0 HA PHE A 118 24.474 -13.722 -3.788 1.00 0.34 H new ATOM 0 HB2 PHE A 118 26.414 -14.376 -1.538 1.00 0.43 H new ATOM 0 HB3 PHE A 118 25.471 -15.515 -2.479 1.00 0.43 H new ATOM 0 HD1 PHE A 118 25.929 -15.435 -5.096 1.00 0.39 H new ATOM 0 HD2 PHE A 118 28.613 -14.017 -2.113 1.00 0.38 H new ATOM 0 HE1 PHE A 118 27.801 -15.682 -6.664 1.00 0.38 H new ATOM 0 HE2 PHE A 118 30.487 -14.253 -3.679 1.00 0.40 H new ATOM 0 HZ PHE A 118 30.087 -15.093 -5.957 1.00 0.38 H new ATOM 1831 N GLU A 119 22.989 -14.114 -1.732 1.00 0.33 N ATOM 1832 CA GLU A 119 22.103 -14.211 -0.590 1.00 0.37 C ATOM 1833 C GLU A 119 22.667 -15.220 0.399 1.00 0.34 C ATOM 1834 O GLU A 119 22.988 -16.351 0.026 1.00 0.47 O ATOM 1835 CB GLU A 119 20.700 -14.651 -1.015 1.00 0.56 C ATOM 1836 CG GLU A 119 19.973 -13.675 -1.927 1.00 0.82 C ATOM 1837 CD GLU A 119 18.480 -13.947 -1.978 1.00 1.18 C ATOM 1838 OE1 GLU A 119 18.089 -15.115 -2.183 1.00 1.43 O ATOM 1839 OE2 GLU A 119 17.688 -13.005 -1.767 1.00 1.46 O ATOM 0 H GLU A 119 22.734 -14.712 -2.518 1.00 0.33 H new ATOM 0 HA GLU A 119 22.030 -13.227 -0.127 1.00 0.37 H new ATOM 0 HB2 GLU A 119 20.774 -15.613 -1.522 1.00 0.56 H new ATOM 0 HB3 GLU A 119 20.097 -14.808 -0.120 1.00 0.56 H new ATOM 0 HG2 GLU A 119 20.144 -12.657 -1.578 1.00 0.82 H new ATOM 0 HG3 GLU A 119 20.388 -13.741 -2.933 1.00 0.82 H new ATOM 1846 N ILE A 120 22.815 -14.806 1.648 1.00 0.29 N ATOM 1847 CA ILE A 120 23.266 -15.703 2.699 1.00 0.31 C ATOM 1848 C ILE A 120 22.109 -16.020 3.642 1.00 0.31 C ATOM 1849 O ILE A 120 21.533 -15.123 4.259 1.00 0.33 O ATOM 1850 CB ILE A 120 24.469 -15.112 3.477 1.00 0.34 C ATOM 1851 CG1 ILE A 120 25.753 -15.299 2.658 1.00 0.33 C ATOM 1852 CG2 ILE A 120 24.603 -15.746 4.854 1.00 0.48 C ATOM 1853 CD1 ILE A 120 27.018 -14.865 3.374 1.00 0.39 C ATOM 0 H ILE A 120 22.629 -13.852 1.958 1.00 0.29 H new ATOM 0 HA ILE A 120 23.608 -16.628 2.235 1.00 0.31 H new ATOM 0 HB ILE A 120 24.297 -14.046 3.629 1.00 0.34 H new ATOM 0 HG12 ILE A 120 25.846 -16.350 2.385 1.00 0.33 H new ATOM 0 HG13 ILE A 120 25.663 -14.735 1.729 1.00 0.33 H new ATOM 0 HG21 ILE A 120 25.456 -15.310 5.374 1.00 0.48 H new ATOM 0 HG22 ILE A 120 23.695 -15.563 5.429 1.00 0.48 H new ATOM 0 HG23 ILE A 120 24.754 -16.820 4.747 1.00 0.48 H new ATOM 0 HD11 ILE A 120 27.878 -15.031 2.726 1.00 0.39 H new ATOM 0 HD12 ILE A 120 26.950 -13.806 3.623 1.00 0.39 H new ATOM 0 HD13 ILE A 120 27.136 -15.446 4.289 1.00 0.39 H new ATOM 1865 N GLU A 121 21.748 -17.296 3.715 1.00 0.36 N ATOM 1866 CA GLU A 121 20.632 -17.724 4.542 1.00 0.40 C ATOM 1867 C GLU A 121 21.029 -18.947 5.377 1.00 0.35 C ATOM 1868 O GLU A 121 21.614 -19.904 4.859 1.00 0.40 O ATOM 1869 CB GLU A 121 19.426 -18.031 3.648 1.00 0.60 C ATOM 1870 CG GLU A 121 18.093 -18.010 4.378 1.00 1.06 C ATOM 1871 CD GLU A 121 16.908 -17.997 3.430 1.00 1.43 C ATOM 1872 OE1 GLU A 121 17.116 -18.078 2.197 1.00 1.67 O ATOM 1873 OE2 GLU A 121 15.760 -17.877 3.913 1.00 1.88 O ATOM 0 H GLU A 121 22.214 -18.050 3.210 1.00 0.36 H new ATOM 0 HA GLU A 121 20.360 -16.925 5.232 1.00 0.40 H new ATOM 0 HB2 GLU A 121 19.395 -17.305 2.836 1.00 0.60 H new ATOM 0 HB3 GLU A 121 19.564 -19.012 3.194 1.00 0.60 H new ATOM 0 HG2 GLU A 121 18.025 -18.883 5.027 1.00 1.06 H new ATOM 0 HG3 GLU A 121 18.049 -17.131 5.021 1.00 1.06 H new ATOM 1880 N LEU A 122 20.722 -18.895 6.668 1.00 0.33 N ATOM 1881 CA LEU A 122 21.108 -19.943 7.611 1.00 0.33 C ATOM 1882 C LEU A 122 19.994 -20.975 7.755 1.00 0.38 C ATOM 1883 O LEU A 122 18.907 -20.655 8.228 1.00 0.54 O ATOM 1884 CB LEU A 122 21.413 -19.312 8.975 1.00 0.38 C ATOM 1885 CG LEU A 122 21.984 -20.256 10.040 1.00 0.43 C ATOM 1886 CD1 LEU A 122 23.412 -20.654 9.699 1.00 0.80 C ATOM 1887 CD2 LEU A 122 21.917 -19.607 11.411 1.00 1.12 C ATOM 0 H LEU A 122 20.200 -18.128 7.092 1.00 0.33 H new ATOM 0 HA LEU A 122 21.997 -20.448 7.233 1.00 0.33 H new ATOM 0 HB2 LEU A 122 22.119 -18.495 8.825 1.00 0.38 H new ATOM 0 HB3 LEU A 122 20.494 -18.872 9.363 1.00 0.38 H new ATOM 0 HG LEU A 122 21.378 -21.162 10.058 1.00 0.43 H new ATOM 0 HD11 LEU A 122 23.797 -21.324 10.468 1.00 0.80 H new ATOM 0 HD12 LEU A 122 23.428 -21.162 8.735 1.00 0.80 H new ATOM 0 HD13 LEU A 122 24.036 -19.762 9.649 1.00 0.80 H new ATOM 0 HD21 LEU A 122 22.326 -20.289 12.157 1.00 1.12 H new ATOM 0 HD22 LEU A 122 22.498 -18.685 11.406 1.00 1.12 H new ATOM 0 HD23 LEU A 122 20.879 -19.381 11.656 1.00 1.12 H new ATOM 1899 N LEU A 123 20.260 -22.211 7.347 1.00 0.39 N ATOM 1900 CA LEU A 123 19.243 -23.258 7.422 1.00 0.47 C ATOM 1901 C LEU A 123 19.485 -24.209 8.594 1.00 0.47 C ATOM 1902 O LEU A 123 18.565 -24.882 9.051 1.00 0.59 O ATOM 1903 CB LEU A 123 19.163 -24.059 6.114 1.00 0.55 C ATOM 1904 CG LEU A 123 20.451 -24.770 5.680 1.00 0.58 C ATOM 1905 CD1 LEU A 123 20.134 -26.151 5.126 1.00 1.00 C ATOM 1906 CD2 LEU A 123 21.185 -23.946 4.631 1.00 0.77 C ATOM 0 H LEU A 123 21.157 -22.512 6.966 1.00 0.39 H new ATOM 0 HA LEU A 123 18.292 -22.751 7.584 1.00 0.47 H new ATOM 0 HB2 LEU A 123 18.376 -24.806 6.217 1.00 0.55 H new ATOM 0 HB3 LEU A 123 18.858 -23.383 5.315 1.00 0.55 H new ATOM 0 HG LEU A 123 21.093 -24.880 6.554 1.00 0.58 H new ATOM 0 HD11 LEU A 123 21.058 -26.642 4.823 1.00 1.00 H new ATOM 0 HD12 LEU A 123 19.642 -26.747 5.894 1.00 1.00 H new ATOM 0 HD13 LEU A 123 19.474 -26.054 4.264 1.00 1.00 H new ATOM 0 HD21 LEU A 123 22.097 -24.464 4.334 1.00 0.77 H new ATOM 0 HD22 LEU A 123 20.544 -23.811 3.760 1.00 0.77 H new ATOM 0 HD23 LEU A 123 21.441 -22.972 5.047 1.00 0.77 H new ATOM 1918 N SER A 124 20.717 -24.265 9.085 1.00 0.44 N ATOM 1919 CA SER A 124 21.052 -25.179 10.169 1.00 0.47 C ATOM 1920 C SER A 124 22.266 -24.669 10.938 1.00 0.43 C ATOM 1921 O SER A 124 23.122 -23.991 10.374 1.00 0.48 O ATOM 1922 CB SER A 124 21.319 -26.580 9.605 1.00 0.63 C ATOM 1923 OG SER A 124 21.536 -27.528 10.636 1.00 1.19 O ATOM 0 H SER A 124 21.494 -23.694 8.753 1.00 0.44 H new ATOM 0 HA SER A 124 20.210 -25.234 10.860 1.00 0.47 H new ATOM 0 HB2 SER A 124 20.472 -26.894 8.994 1.00 0.63 H new ATOM 0 HB3 SER A 124 22.190 -26.549 8.950 1.00 0.63 H new ATOM 0 HG SER A 124 21.701 -28.409 10.241 1.00 1.19 H new ATOM 1929 N PHE A 125 22.317 -24.982 12.226 1.00 0.39 N ATOM 1930 CA PHE A 125 23.398 -24.543 13.099 1.00 0.43 C ATOM 1931 C PHE A 125 23.335 -25.289 14.421 1.00 0.46 C ATOM 1932 O PHE A 125 22.380 -26.024 14.680 1.00 0.46 O ATOM 1933 CB PHE A 125 23.308 -23.035 13.362 1.00 0.46 C ATOM 1934 CG PHE A 125 22.085 -22.633 14.141 1.00 0.46 C ATOM 1935 CD1 PHE A 125 20.820 -22.824 13.613 1.00 0.44 C ATOM 1936 CD2 PHE A 125 22.201 -22.066 15.401 1.00 0.62 C ATOM 1937 CE1 PHE A 125 19.692 -22.457 14.322 1.00 0.54 C ATOM 1938 CE2 PHE A 125 21.078 -21.697 16.114 1.00 0.72 C ATOM 1939 CZ PHE A 125 19.821 -21.895 15.574 1.00 0.67 C ATOM 0 H PHE A 125 21.610 -25.548 12.695 1.00 0.39 H new ATOM 0 HA PHE A 125 24.344 -24.758 12.602 1.00 0.43 H new ATOM 0 HB2 PHE A 125 24.197 -22.716 13.906 1.00 0.46 H new ATOM 0 HB3 PHE A 125 23.311 -22.507 12.408 1.00 0.46 H new ATOM 0 HD1 PHE A 125 20.713 -23.266 12.633 1.00 0.44 H new ATOM 0 HD2 PHE A 125 23.180 -21.911 15.829 1.00 0.62 H new ATOM 0 HE1 PHE A 125 18.711 -22.610 13.896 1.00 0.54 H new ATOM 0 HE2 PHE A 125 21.181 -21.254 17.093 1.00 0.72 H new ATOM 0 HZ PHE A 125 18.941 -21.610 16.132 1.00 0.67 H new ATOM 1949 N ARG A 126 24.351 -25.094 15.250 1.00 0.60 N ATOM 1950 CA ARG A 126 24.373 -25.643 16.597 1.00 0.71 C ATOM 1951 C ARG A 126 25.388 -24.899 17.450 1.00 0.76 C ATOM 1952 O ARG A 126 26.551 -24.785 17.082 1.00 0.90 O ATOM 1953 CB ARG A 126 24.685 -27.140 16.589 1.00 0.83 C ATOM 1954 CG ARG A 126 25.708 -27.566 15.548 1.00 0.85 C ATOM 1955 CD ARG A 126 26.195 -28.982 15.828 1.00 1.12 C ATOM 1956 NE ARG A 126 26.395 -29.760 14.610 1.00 1.57 N ATOM 1957 CZ ARG A 126 25.514 -30.650 14.155 1.00 2.14 C ATOM 1958 NH1 ARG A 126 24.346 -30.795 14.767 1.00 2.47 N ATOM 1959 NH2 ARG A 126 25.801 -31.386 13.091 1.00 2.98 N ATOM 0 H ARG A 126 25.181 -24.552 15.008 1.00 0.60 H new ATOM 0 HA ARG A 126 23.380 -25.513 17.026 1.00 0.71 H new ATOM 0 HB2 ARG A 126 25.048 -27.428 17.576 1.00 0.83 H new ATOM 0 HB3 ARG A 126 23.760 -27.690 16.417 1.00 0.83 H new ATOM 0 HG2 ARG A 126 25.265 -27.517 14.553 1.00 0.85 H new ATOM 0 HG3 ARG A 126 26.552 -26.876 15.555 1.00 0.85 H new ATOM 0 HD2 ARG A 126 27.132 -28.936 16.383 1.00 1.12 H new ATOM 0 HD3 ARG A 126 25.472 -29.491 16.465 1.00 1.12 H new ATOM 0 HE ARG A 126 27.254 -29.615 14.079 1.00 1.57 H new ATOM 0 HH11 ARG A 126 24.124 -30.226 15.584 1.00 2.47 H new ATOM 0 HH12 ARG A 126 23.670 -31.476 14.421 1.00 2.47 H new ATOM 0 HH21 ARG A 126 26.698 -31.272 12.619 1.00 2.98 H new ATOM 0 HH22 ARG A 126 25.125 -32.067 12.744 1.00 2.98 H new ATOM 1973 N GLU A 127 24.943 -24.403 18.588 1.00 0.82 N ATOM 1974 CA GLU A 127 25.773 -23.562 19.434 1.00 0.88 C ATOM 1975 C GLU A 127 26.573 -24.391 20.436 1.00 1.01 C ATOM 1976 O GLU A 127 26.069 -25.358 21.010 1.00 1.11 O ATOM 1977 CB GLU A 127 24.900 -22.533 20.145 1.00 1.10 C ATOM 1978 CG GLU A 127 24.337 -21.489 19.195 1.00 1.68 C ATOM 1979 CD GLU A 127 23.194 -20.698 19.793 1.00 2.69 C ATOM 1980 OE1 GLU A 127 23.447 -19.934 20.748 1.00 3.18 O ATOM 1981 OE2 GLU A 127 22.053 -20.845 19.320 1.00 3.38 O ATOM 0 H GLU A 127 24.004 -24.568 18.952 1.00 0.82 H new ATOM 0 HA GLU A 127 26.495 -23.041 18.805 1.00 0.88 H new ATOM 0 HB2 GLU A 127 24.078 -23.044 20.646 1.00 1.10 H new ATOM 0 HB3 GLU A 127 25.486 -22.037 20.918 1.00 1.10 H new ATOM 0 HG2 GLU A 127 25.133 -20.803 18.905 1.00 1.68 H new ATOM 0 HG3 GLU A 127 23.993 -21.982 18.285 1.00 1.68 H new ATOM 1988 N LEU A 128 27.830 -24.002 20.626 1.00 1.18 N ATOM 1989 CA LEU A 128 28.744 -24.721 21.508 1.00 1.39 C ATOM 1990 C LEU A 128 28.850 -24.023 22.866 1.00 1.83 C ATOM 1991 O LEU A 128 29.480 -24.538 23.791 1.00 2.41 O ATOM 1992 CB LEU A 128 30.122 -24.802 20.842 1.00 1.95 C ATOM 1993 CG LEU A 128 31.166 -25.643 21.580 1.00 2.44 C ATOM 1994 CD1 LEU A 128 30.768 -27.113 21.581 1.00 2.79 C ATOM 1995 CD2 LEU A 128 32.540 -25.453 20.955 1.00 3.35 C ATOM 0 H LEU A 128 28.242 -23.185 20.176 1.00 1.18 H new ATOM 0 HA LEU A 128 28.360 -25.727 21.678 1.00 1.39 H new ATOM 0 HB2 LEU A 128 29.997 -25.209 19.839 1.00 1.95 H new ATOM 0 HB3 LEU A 128 30.511 -23.790 20.729 1.00 1.95 H new ATOM 0 HG LEU A 128 31.213 -25.306 22.615 1.00 2.44 H new ATOM 0 HD11 LEU A 128 31.523 -27.694 22.110 1.00 2.79 H new ATOM 0 HD12 LEU A 128 29.806 -27.229 22.079 1.00 2.79 H new ATOM 0 HD13 LEU A 128 30.690 -27.470 20.554 1.00 2.79 H new ATOM 0 HD21 LEU A 128 33.271 -26.058 21.492 1.00 3.35 H new ATOM 0 HD22 LEU A 128 32.510 -25.762 19.910 1.00 3.35 H new ATOM 0 HD23 LEU A 128 32.825 -24.403 21.015 1.00 3.35 H new ATOM 2007 N GLU A 129 28.221 -22.848 22.960 1.00 2.29 N ATOM 2008 CA GLU A 129 28.220 -22.032 24.178 1.00 3.05 C ATOM 2009 C GLU A 129 29.567 -21.352 24.411 1.00 3.49 C ATOM 2010 O GLU A 129 30.599 -21.770 23.875 1.00 3.72 O ATOM 2011 CB GLU A 129 27.810 -22.861 25.402 1.00 3.72 C ATOM 2012 CG GLU A 129 26.502 -22.405 26.033 1.00 4.36 C ATOM 2013 CD GLU A 129 26.613 -21.047 26.702 1.00 4.88 C ATOM 2014 OE1 GLU A 129 27.002 -20.066 26.029 1.00 5.39 O ATOM 2015 OE2 GLU A 129 26.347 -20.959 27.915 1.00 5.04 O ATOM 0 H GLU A 129 27.696 -22.434 22.190 1.00 2.29 H new ATOM 0 HA GLU A 129 27.478 -21.247 24.034 1.00 3.05 H new ATOM 0 HB2 GLU A 129 27.718 -23.907 25.108 1.00 3.72 H new ATOM 0 HB3 GLU A 129 28.602 -22.808 26.149 1.00 3.72 H new ATOM 0 HG2 GLU A 129 25.729 -22.365 25.266 1.00 4.36 H new ATOM 0 HG3 GLU A 129 26.183 -23.143 26.769 1.00 4.36 H new ATOM 2022 N HIS A 130 29.536 -20.284 25.204 1.00 4.02 N ATOM 2023 CA HIS A 130 30.730 -19.497 25.502 1.00 4.65 C ATOM 2024 C HIS A 130 31.770 -20.339 26.236 1.00 4.79 C ATOM 2025 O HIS A 130 31.490 -20.952 27.266 1.00 5.17 O ATOM 2026 CB HIS A 130 30.376 -18.223 26.296 1.00 5.23 C ATOM 2027 CG HIS A 130 29.780 -18.445 27.660 1.00 5.76 C ATOM 2028 ND1 HIS A 130 28.502 -18.911 27.860 1.00 6.35 N ATOM 2029 CD2 HIS A 130 30.291 -18.223 28.897 1.00 6.21 C ATOM 2030 CE1 HIS A 130 28.251 -18.966 29.151 1.00 7.04 C ATOM 2031 NE2 HIS A 130 29.316 -18.553 29.808 1.00 6.98 N ATOM 0 H HIS A 130 28.688 -19.941 25.656 1.00 4.02 H new ATOM 0 HA HIS A 130 31.167 -19.181 24.555 1.00 4.65 H new ATOM 0 HB2 HIS A 130 31.280 -17.625 26.408 1.00 5.23 H new ATOM 0 HB3 HIS A 130 29.675 -17.633 25.706 1.00 5.23 H new ATOM 0 HD1 HIS A 130 27.849 -19.174 27.122 1.00 6.35 H new ATOM 0 HD2 HIS A 130 31.281 -17.855 29.124 1.00 6.21 H new ATOM 0 HE1 HIS A 130 27.325 -19.295 29.598 1.00 7.04 H new ATOM 2040 N HIS A 131 32.975 -20.357 25.689 1.00 4.87 N ATOM 2041 CA HIS A 131 34.015 -21.255 26.159 1.00 5.24 C ATOM 2042 C HIS A 131 35.018 -20.525 27.047 1.00 5.58 C ATOM 2043 O HIS A 131 35.722 -21.144 27.842 1.00 5.71 O ATOM 2044 CB HIS A 131 34.731 -21.877 24.957 1.00 5.62 C ATOM 2045 CG HIS A 131 35.399 -23.184 25.258 1.00 6.06 C ATOM 2046 ND1 HIS A 131 34.730 -24.385 25.223 1.00 6.53 N ATOM 2047 CD2 HIS A 131 36.680 -23.477 25.582 1.00 6.53 C ATOM 2048 CE1 HIS A 131 35.566 -25.361 25.517 1.00 7.20 C ATOM 2049 NE2 HIS A 131 36.759 -24.838 25.741 1.00 7.21 N ATOM 0 H HIS A 131 33.257 -19.756 24.915 1.00 4.87 H new ATOM 0 HA HIS A 131 33.551 -22.039 26.757 1.00 5.24 H new ATOM 0 HB2 HIS A 131 34.009 -22.025 24.154 1.00 5.62 H new ATOM 0 HB3 HIS A 131 35.478 -21.175 24.588 1.00 5.62 H new ATOM 0 HD2 HIS A 131 37.490 -22.771 25.695 1.00 6.53 H new ATOM 0 HE1 HIS A 131 35.318 -26.411 25.566 1.00 7.20 H new ATOM 0 HE2 HIS A 131 37.599 -25.360 25.991 1.00 7.21 H new ATOM 2058 N HIS A 132 35.083 -19.208 26.907 1.00 6.07 N ATOM 2059 CA HIS A 132 36.012 -18.412 27.693 1.00 6.73 C ATOM 2060 C HIS A 132 35.396 -18.085 29.045 1.00 7.16 C ATOM 2061 O HIS A 132 34.223 -17.715 29.129 1.00 7.46 O ATOM 2062 CB HIS A 132 36.378 -17.123 26.953 1.00 7.36 C ATOM 2063 CG HIS A 132 37.719 -16.563 27.344 1.00 7.90 C ATOM 2064 ND1 HIS A 132 37.887 -15.371 28.023 1.00 8.29 N ATOM 2065 CD2 HIS A 132 38.968 -17.043 27.129 1.00 8.39 C ATOM 2066 CE1 HIS A 132 39.178 -15.148 28.205 1.00 8.95 C ATOM 2067 NE2 HIS A 132 39.851 -16.144 27.671 1.00 9.02 N ATOM 0 H HIS A 132 34.506 -18.671 26.259 1.00 6.07 H new ATOM 0 HA HIS A 132 36.924 -18.989 27.846 1.00 6.73 H new ATOM 0 HB2 HIS A 132 36.373 -17.316 25.880 1.00 7.36 H new ATOM 0 HB3 HIS A 132 35.611 -16.373 27.145 1.00 7.36 H new ATOM 0 HD2 HIS A 132 39.221 -17.963 26.624 1.00 8.39 H new ATOM 0 HE1 HIS A 132 39.607 -14.293 28.707 1.00 8.95 H new ATOM 0 HE2 HIS A 132 40.867 -16.234 27.661 1.00 9.02 H new ATOM 2076 N HIS A 133 36.176 -18.233 30.100 1.00 7.47 N ATOM 2077 CA HIS A 133 35.692 -17.970 31.443 1.00 8.09 C ATOM 2078 C HIS A 133 36.150 -16.610 31.935 1.00 8.82 C ATOM 2079 O HIS A 133 37.333 -16.276 31.864 1.00 9.23 O ATOM 2080 CB HIS A 133 36.166 -19.053 32.409 1.00 8.42 C ATOM 2081 CG HIS A 133 35.366 -20.312 32.350 1.00 8.83 C ATOM 2082 ND1 HIS A 133 35.791 -21.455 31.707 1.00 9.20 N ATOM 2083 CD2 HIS A 133 34.152 -20.605 32.867 1.00 9.20 C ATOM 2084 CE1 HIS A 133 34.872 -22.392 31.833 1.00 9.73 C ATOM 2085 NE2 HIS A 133 33.867 -21.901 32.533 1.00 9.75 N ATOM 0 H HIS A 133 37.149 -18.535 30.053 1.00 7.47 H new ATOM 0 HA HIS A 133 34.603 -17.977 31.406 1.00 8.09 H new ATOM 0 HB2 HIS A 133 37.209 -19.287 32.193 1.00 8.42 H new ATOM 0 HB3 HIS A 133 36.131 -18.660 33.425 1.00 8.42 H new ATOM 0 HD2 HIS A 133 33.523 -19.939 33.439 1.00 9.20 H new ATOM 0 HE1 HIS A 133 34.932 -23.393 31.431 1.00 9.73 H new ATOM 0 HE2 HIS A 133 33.017 -22.405 32.784 1.00 9.75 H new ATOM 2094 N HIS A 134 35.200 -15.829 32.424 1.00 9.17 N ATOM 2095 CA HIS A 134 35.503 -14.556 33.061 1.00 10.02 C ATOM 2096 C HIS A 134 35.633 -14.781 34.561 1.00 10.42 C ATOM 2097 O HIS A 134 36.348 -14.069 35.259 1.00 10.82 O ATOM 2098 CB HIS A 134 34.397 -13.532 32.771 1.00 10.46 C ATOM 2099 CG HIS A 134 34.739 -12.132 33.194 1.00 11.09 C ATOM 2100 ND1 HIS A 134 34.598 -11.674 34.488 1.00 11.60 N ATOM 2101 CD2 HIS A 134 35.219 -11.088 32.480 1.00 11.51 C ATOM 2102 CE1 HIS A 134 34.971 -10.412 34.549 1.00 12.26 C ATOM 2103 NE2 HIS A 134 35.355 -10.033 33.346 1.00 12.22 N ATOM 0 H HIS A 134 34.206 -16.056 32.392 1.00 9.17 H new ATOM 0 HA HIS A 134 36.438 -14.162 32.663 1.00 10.02 H new ATOM 0 HB2 HIS A 134 34.182 -13.536 31.702 1.00 10.46 H new ATOM 0 HB3 HIS A 134 33.485 -13.843 33.280 1.00 10.46 H new ATOM 0 HD2 HIS A 134 35.452 -11.086 31.425 1.00 11.51 H new ATOM 0 HE1 HIS A 134 34.964 -9.793 35.434 1.00 12.26 H new ATOM 0 HE2 HIS A 134 35.698 -9.105 33.099 1.00 12.22 H new ATOM 2112 N HIS A 135 34.924 -15.790 35.033 1.00 10.51 N ATOM 2113 CA HIS A 135 34.957 -16.188 36.426 1.00 11.06 C ATOM 2114 C HIS A 135 34.953 -17.708 36.507 1.00 11.14 C ATOM 2115 O HIS A 135 35.989 -18.288 36.872 1.00 11.30 O ATOM 2116 CB HIS A 135 33.750 -15.610 37.175 1.00 11.78 C ATOM 2117 CG HIS A 135 33.558 -16.176 38.553 1.00 12.27 C ATOM 2118 ND1 HIS A 135 32.390 -16.789 38.962 1.00 12.92 N ATOM 2119 CD2 HIS A 135 34.398 -16.232 39.613 1.00 12.37 C ATOM 2120 CE1 HIS A 135 32.523 -17.198 40.209 1.00 13.35 C ATOM 2121 NE2 HIS A 135 33.731 -16.872 40.629 1.00 13.03 N ATOM 2122 OXT HIS A 135 33.906 -18.306 36.178 1.00 11.24 O ATOM 0 H HIS A 135 34.305 -16.359 34.456 1.00 10.51 H new ATOM 0 HA HIS A 135 35.862 -15.801 36.894 1.00 11.06 H new ATOM 0 HB2 HIS A 135 33.866 -14.529 37.250 1.00 11.78 H new ATOM 0 HB3 HIS A 135 32.850 -15.794 36.589 1.00 11.78 H new ATOM 0 HD2 HIS A 135 35.406 -15.845 39.653 1.00 12.37 H new ATOM 0 HE1 HIS A 135 31.771 -17.713 40.788 1.00 13.35 H new ATOM 0 HE2 HIS A 135 34.108 -17.064 41.557 1.00 13.03 H new TER 2131 HIS A 135