USER MOD reduce.3.24.130724 H: found=0, std=0, add=1247, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1248 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 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 155 GLN : amide:sc= -1.05 K(o=-1.1,f=-2.3!) USER MOD Set 2.1: A 143 THR OG1 : rot -41:sc= 0.0913 USER MOD Set 2.2: A 144 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 21 THR OG1 : rot 180:sc= -0.297 USER MOD Set 3.2: A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 101 TYR OH : rot 143:sc= -2.96! USER MOD Set 4.2: A 160 GLN : amide:sc= -0.0446 X(o=-3,f=-3.5) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= -0.311 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.266 K(o=-0.27,f=-2.1!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot -56:sc= 0.597 USER MOD Single : A 45 CYS SG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 170:sc= 0.0227 USER MOD Single : A 49 ASN : amide:sc= -1.01 K(o=-1,f=-3.8!) USER MOD Single : A 50 MET CE :methyl -114:sc= -0.929 (180deg=-1.13) USER MOD Single : A 62 ASN : amide:sc= -1.02 K(o=-1,f=-4.6!) USER MOD Single : A 64 ASN : amide:sc= -0.815 X(o=-0.81,f=-0.83) USER MOD Single : A 67 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.962) USER MOD Single : A 68 MET CE :methyl -172:sc= -3.18! (180deg=-3.41!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.346 K(o=-0.35,f=-2!) USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.612 USER MOD Single : A 87 LYS NZ :NH3+ -110:sc= 1.13 (180deg=-0.195) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 165:sc= -3.84! USER MOD Single : A 103 GLN : amide:sc= -0.0165 K(o=-0.016,f=-2!) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=-0.057) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 80:sc= -3.01! USER MOD Single : A 112 GLN : amide:sc= -1.96 K(o=-2,f=-3.7!) USER MOD Single : A 117 GLN : amide:sc= -0.801 K(o=-0.8,f=-4.9!) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot 180:sc= 0.371 USER MOD Single : A 120 THR OG1 : rot 107:sc= -3.13! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= -0.0684 K(o=-0.068,f=-1.8!) USER MOD Single : A 128 GLN : amide:sc= -0.379 K(o=-0.38,f=-5!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.155) USER MOD Single : A 133 ASN : amide:sc= -0.196 X(o=-0.2,f=-0.015) USER MOD Single : A 138 THR OG1 : rot 66:sc= -0.671! USER MOD Single : A 139 THR OG1 : rot -170:sc= -2.68! USER MOD Single : A 145 ASN : amide:sc= -12.3! C(o=-12!,f=-8.7!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= -0.0766 K(o=-0.077,f=-1.9!) USER MOD Single : A 156 ASN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 162 MET CE :methyl -125:sc= -7.48! (180deg=-14.8!) USER MOD Single : A 163 THR OG1 : rot 76:sc= 0.607 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0.0043 USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 170 SER OG : rot -133:sc= 0.618 USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 SER OG : rot 180:sc= 0.0412 USER MOD Single : A 178 SER OG : rot 180:sc= -0.0347 USER MOD Single : A 184 GLN : amide:sc= -0.0845 X(o=-0.084,f=-0.084) USER MOD Single : A 185 MET CE :methyl -117:sc= -1.55 (180deg=-4.22!) USER MOD ----------------------------------------------------------------- ATOM 20 N THR A 21 20.148 11.099 0.892 1.00 0.58 N ATOM 21 CA THR A 21 20.310 10.035 -0.139 1.00 0.63 C ATOM 22 C THR A 21 18.952 9.722 -0.772 1.00 0.45 C ATOM 23 O THR A 21 17.921 10.172 -0.311 1.00 0.33 O ATOM 24 CB THR A 21 20.872 8.774 0.519 1.00 0.80 C ATOM 25 OG1 THR A 21 20.962 7.736 -0.448 1.00 0.98 O ATOM 26 CG2 THR A 21 19.952 8.336 1.659 1.00 1.00 C ATOM 0 HA THR A 21 20.996 10.379 -0.913 1.00 0.63 H new ATOM 0 HB THR A 21 21.864 8.984 0.919 1.00 0.80 H new ATOM 0 HG1 THR A 21 21.324 6.928 -0.028 1.00 0.98 H new ATOM 0 HG21 THR A 21 20.354 7.437 2.126 1.00 1.00 H new ATOM 0 HG22 THR A 21 19.887 9.132 2.400 1.00 1.00 H new ATOM 0 HG23 THR A 21 18.958 8.126 1.264 1.00 1.00 H new ATOM 34 N SER A 22 18.944 8.955 -1.828 1.00 0.51 N ATOM 35 CA SER A 22 17.655 8.614 -2.492 1.00 0.51 C ATOM 36 C SER A 22 16.698 7.999 -1.470 1.00 0.48 C ATOM 37 O SER A 22 15.494 8.066 -1.616 1.00 0.50 O ATOM 38 CB SER A 22 17.909 7.615 -3.622 1.00 0.75 C ATOM 39 OG SER A 22 17.201 8.029 -4.782 1.00 1.76 O ATOM 0 H SER A 22 19.775 8.550 -2.259 1.00 0.51 H new ATOM 0 HA SER A 22 17.210 9.520 -2.903 1.00 0.51 H new ATOM 0 HB2 SER A 22 18.976 7.554 -3.836 1.00 0.75 H new ATOM 0 HB3 SER A 22 17.586 6.618 -3.321 1.00 0.75 H new ATOM 0 HG SER A 22 17.363 7.392 -5.509 1.00 1.76 H new ATOM 45 N SER A 23 17.222 7.400 -0.434 1.00 0.43 N ATOM 46 CA SER A 23 16.336 6.786 0.594 1.00 0.40 C ATOM 47 C SER A 23 15.756 7.886 1.483 1.00 0.22 C ATOM 48 O SER A 23 14.590 7.877 1.816 1.00 0.28 O ATOM 49 CB SER A 23 17.145 5.813 1.451 1.00 0.50 C ATOM 50 OG SER A 23 16.646 4.494 1.261 1.00 1.24 O ATOM 0 H SER A 23 18.222 7.310 -0.256 1.00 0.43 H new ATOM 0 HA SER A 23 15.526 6.247 0.102 1.00 0.40 H new ATOM 0 HB2 SER A 23 18.199 5.859 1.177 1.00 0.50 H new ATOM 0 HB3 SER A 23 17.076 6.092 2.502 1.00 0.50 H new ATOM 0 HG SER A 23 17.163 3.867 1.808 1.00 1.24 H new ATOM 56 N GLU A 24 16.560 8.839 1.868 1.00 0.17 N ATOM 57 CA GLU A 24 16.046 9.940 2.730 1.00 0.33 C ATOM 58 C GLU A 24 14.949 10.691 1.976 1.00 0.47 C ATOM 59 O GLU A 24 14.054 11.261 2.566 1.00 0.71 O ATOM 60 CB GLU A 24 17.187 10.902 3.067 1.00 0.53 C ATOM 61 CG GLU A 24 16.797 11.755 4.277 1.00 0.52 C ATOM 62 CD GLU A 24 17.793 11.516 5.414 1.00 1.26 C ATOM 63 OE1 GLU A 24 18.961 11.321 5.120 1.00 2.35 O ATOM 64 OE2 GLU A 24 17.370 11.534 6.558 1.00 1.43 O ATOM 0 H GLU A 24 17.548 8.903 1.624 1.00 0.17 H new ATOM 0 HA GLU A 24 15.641 9.527 3.654 1.00 0.33 H new ATOM 0 HB2 GLU A 24 18.097 10.342 3.282 1.00 0.53 H new ATOM 0 HB3 GLU A 24 17.401 11.542 2.211 1.00 0.53 H new ATOM 0 HG2 GLU A 24 16.788 12.810 4.003 1.00 0.52 H new ATOM 0 HG3 GLU A 24 15.788 11.502 4.604 1.00 0.52 H new ATOM 71 N ARG A 25 15.009 10.687 0.671 1.00 0.40 N ATOM 72 CA ARG A 25 13.967 11.391 -0.127 1.00 0.64 C ATOM 73 C ARG A 25 12.779 10.453 -0.330 1.00 0.61 C ATOM 74 O ARG A 25 11.646 10.882 -0.424 1.00 0.77 O ATOM 75 CB ARG A 25 14.543 11.789 -1.487 1.00 0.80 C ATOM 76 CG ARG A 25 14.158 13.235 -1.805 1.00 1.18 C ATOM 77 CD ARG A 25 15.258 14.175 -1.314 1.00 2.32 C ATOM 78 NE ARG A 25 16.211 14.449 -2.427 1.00 2.00 N ATOM 79 CZ ARG A 25 16.190 15.604 -3.036 1.00 2.23 C ATOM 80 NH1 ARG A 25 15.065 16.080 -3.494 1.00 2.10 N ATOM 81 NH2 ARG A 25 17.295 16.283 -3.186 1.00 2.98 N ATOM 0 H ARG A 25 15.736 10.226 0.124 1.00 0.40 H new ATOM 0 HA ARG A 25 13.643 12.288 0.401 1.00 0.64 H new ATOM 0 HB2 ARG A 25 15.628 11.685 -1.478 1.00 0.80 H new ATOM 0 HB3 ARG A 25 14.165 11.123 -2.262 1.00 0.80 H new ATOM 0 HG2 ARG A 25 14.014 13.356 -2.879 1.00 1.18 H new ATOM 0 HG3 ARG A 25 13.211 13.484 -1.326 1.00 1.18 H new ATOM 0 HD2 ARG A 25 14.821 15.108 -0.957 1.00 2.32 H new ATOM 0 HD3 ARG A 25 15.785 13.727 -0.472 1.00 2.32 H new ATOM 0 HE ARG A 25 16.880 13.734 -2.713 1.00 2.00 H new ATOM 0 HH11 ARG A 25 14.201 15.550 -3.376 1.00 2.10 H new ATOM 0 HH12 ARG A 25 15.049 16.982 -3.970 1.00 2.10 H new ATOM 0 HH21 ARG A 25 18.175 15.911 -2.828 1.00 2.98 H new ATOM 0 HH22 ARG A 25 17.279 17.185 -3.662 1.00 2.98 H new ATOM 95 N ILE A 26 13.023 9.170 -0.387 1.00 0.48 N ATOM 96 CA ILE A 26 11.895 8.219 -0.570 1.00 0.61 C ATOM 97 C ILE A 26 11.017 8.275 0.685 1.00 0.47 C ATOM 98 O ILE A 26 9.818 8.123 0.617 1.00 0.48 O ATOM 99 CB ILE A 26 12.447 6.797 -0.835 1.00 0.70 C ATOM 100 CG1 ILE A 26 12.656 6.651 -2.355 1.00 1.08 C ATOM 101 CG2 ILE A 26 11.464 5.720 -0.327 1.00 0.76 C ATOM 102 CD1 ILE A 26 12.970 5.198 -2.731 1.00 0.34 C ATOM 0 H ILE A 26 13.948 8.745 -0.315 1.00 0.48 H new ATOM 0 HA ILE A 26 11.287 8.490 -1.433 1.00 0.61 H new ATOM 0 HB ILE A 26 13.388 6.659 -0.302 1.00 0.70 H new ATOM 0 HG12 ILE A 26 11.761 6.981 -2.882 1.00 1.08 H new ATOM 0 HG13 ILE A 26 13.472 7.298 -2.677 1.00 1.08 H new ATOM 0 HG21 ILE A 26 11.875 4.730 -0.525 1.00 0.76 H new ATOM 0 HG22 ILE A 26 11.313 5.842 0.745 1.00 0.76 H new ATOM 0 HG23 ILE A 26 10.510 5.826 -0.842 1.00 0.76 H new ATOM 0 HD11 ILE A 26 13.113 5.124 -3.809 1.00 0.34 H new ATOM 0 HD12 ILE A 26 13.879 4.879 -2.222 1.00 0.34 H new ATOM 0 HD13 ILE A 26 12.141 4.557 -2.430 1.00 0.34 H new ATOM 114 N ASP A 27 11.600 8.519 1.826 1.00 0.38 N ATOM 115 CA ASP A 27 10.787 8.611 3.069 1.00 0.28 C ATOM 116 C ASP A 27 9.820 9.789 2.914 1.00 0.32 C ATOM 117 O ASP A 27 8.675 9.734 3.323 1.00 0.43 O ATOM 118 CB ASP A 27 11.717 8.851 4.265 1.00 0.20 C ATOM 119 CG ASP A 27 10.890 9.108 5.527 1.00 0.25 C ATOM 120 OD1 ASP A 27 10.428 10.226 5.691 1.00 0.91 O ATOM 121 OD2 ASP A 27 10.733 8.184 6.307 1.00 0.87 O ATOM 0 H ASP A 27 12.603 8.658 1.950 1.00 0.38 H new ATOM 0 HA ASP A 27 10.230 7.689 3.236 1.00 0.28 H new ATOM 0 HB2 ASP A 27 12.363 7.986 4.413 1.00 0.20 H new ATOM 0 HB3 ASP A 27 12.367 9.703 4.066 1.00 0.20 H new ATOM 126 N LYS A 28 10.281 10.852 2.315 1.00 0.28 N ATOM 127 CA LYS A 28 9.414 12.043 2.115 1.00 0.31 C ATOM 128 C LYS A 28 8.367 11.749 1.040 1.00 0.36 C ATOM 129 O LYS A 28 7.285 12.303 1.048 1.00 0.40 O ATOM 130 CB LYS A 28 10.281 13.224 1.665 1.00 0.31 C ATOM 131 CG LYS A 28 10.743 14.023 2.884 1.00 1.59 C ATOM 132 CD LYS A 28 9.523 14.518 3.653 1.00 2.56 C ATOM 133 CE LYS A 28 9.775 15.938 4.166 1.00 3.17 C ATOM 134 NZ LYS A 28 9.396 16.922 3.112 1.00 2.66 N ATOM 0 H LYS A 28 11.230 10.945 1.953 1.00 0.28 H new ATOM 0 HA LYS A 28 8.910 12.285 3.051 1.00 0.31 H new ATOM 0 HB2 LYS A 28 11.145 12.861 1.108 1.00 0.31 H new ATOM 0 HB3 LYS A 28 9.714 13.867 0.991 1.00 0.31 H new ATOM 0 HG2 LYS A 28 11.365 13.400 3.527 1.00 1.59 H new ATOM 0 HG3 LYS A 28 11.356 14.867 2.569 1.00 1.59 H new ATOM 0 HD2 LYS A 28 8.645 14.505 3.007 1.00 2.56 H new ATOM 0 HD3 LYS A 28 9.314 13.851 4.489 1.00 2.56 H new ATOM 0 HE2 LYS A 28 9.195 16.117 5.071 1.00 3.17 H new ATOM 0 HE3 LYS A 28 10.825 16.059 4.431 1.00 3.17 H new ATOM 0 HZ1 LYS A 28 9.567 17.887 3.460 1.00 2.66 H new ATOM 0 HZ2 LYS A 28 9.968 16.755 2.260 1.00 2.66 H new ATOM 0 HZ3 LYS A 28 8.388 16.811 2.880 1.00 2.66 H new ATOM 148 N GLN A 29 8.677 10.892 0.108 1.00 0.38 N ATOM 149 CA GLN A 29 7.696 10.579 -0.968 1.00 0.43 C ATOM 150 C GLN A 29 6.643 9.601 -0.440 1.00 0.25 C ATOM 151 O GLN A 29 5.534 9.542 -0.938 1.00 0.12 O ATOM 152 CB GLN A 29 8.431 9.962 -2.161 1.00 0.61 C ATOM 153 CG GLN A 29 9.037 11.076 -3.016 1.00 1.01 C ATOM 154 CD GLN A 29 7.921 11.823 -3.747 1.00 1.46 C ATOM 155 OE1 GLN A 29 6.823 11.319 -3.881 1.00 1.91 O ATOM 156 NE2 GLN A 29 8.156 13.012 -4.230 1.00 2.02 N ATOM 0 H GLN A 29 9.566 10.395 0.045 1.00 0.38 H new ATOM 0 HA GLN A 29 7.199 11.496 -1.286 1.00 0.43 H new ATOM 0 HB2 GLN A 29 9.215 9.290 -1.811 1.00 0.61 H new ATOM 0 HB3 GLN A 29 7.742 9.365 -2.758 1.00 0.61 H new ATOM 0 HG2 GLN A 29 9.600 11.766 -2.387 1.00 1.01 H new ATOM 0 HG3 GLN A 29 9.739 10.655 -3.736 1.00 1.01 H new ATOM 0 HE21 GLN A 29 9.077 13.435 -4.118 1.00 2.02 H new ATOM 0 HE22 GLN A 29 7.418 13.518 -4.720 1.00 2.02 H new ATOM 165 N ILE A 30 6.963 8.848 0.578 1.00 0.34 N ATOM 166 CA ILE A 30 5.956 7.899 1.130 1.00 0.19 C ATOM 167 C ILE A 30 4.973 8.693 1.980 1.00 0.09 C ATOM 168 O ILE A 30 3.782 8.456 1.956 1.00 0.05 O ATOM 169 CB ILE A 30 6.632 6.832 1.987 1.00 0.27 C ATOM 170 CG1 ILE A 30 7.818 6.212 1.200 1.00 0.61 C ATOM 171 CG2 ILE A 30 5.596 5.776 2.380 1.00 0.37 C ATOM 172 CD1 ILE A 30 7.472 4.827 0.626 1.00 0.63 C ATOM 0 H ILE A 30 7.869 8.849 1.047 1.00 0.34 H new ATOM 0 HA ILE A 30 5.439 7.397 0.312 1.00 0.19 H new ATOM 0 HB ILE A 30 7.033 7.271 2.901 1.00 0.27 H new ATOM 0 HG12 ILE A 30 8.101 6.880 0.387 1.00 0.61 H new ATOM 0 HG13 ILE A 30 8.683 6.125 1.858 1.00 0.61 H new ATOM 0 HG21 ILE A 30 6.072 5.010 2.993 1.00 0.37 H new ATOM 0 HG22 ILE A 30 4.793 6.247 2.947 1.00 0.37 H new ATOM 0 HG23 ILE A 30 5.185 5.318 1.481 1.00 0.37 H new ATOM 0 HD11 ILE A 30 8.332 4.433 0.084 1.00 0.63 H new ATOM 0 HD12 ILE A 30 7.215 4.150 1.440 1.00 0.63 H new ATOM 0 HD13 ILE A 30 6.624 4.916 -0.053 1.00 0.63 H new ATOM 184 N ARG A 31 5.455 9.662 2.716 1.00 0.23 N ATOM 185 CA ARG A 31 4.535 10.490 3.535 1.00 0.36 C ATOM 186 C ARG A 31 3.504 11.117 2.594 1.00 0.31 C ATOM 187 O ARG A 31 2.392 11.424 2.979 1.00 0.32 O ATOM 188 CB ARG A 31 5.329 11.588 4.245 1.00 0.57 C ATOM 189 CG ARG A 31 4.369 12.485 5.020 1.00 0.59 C ATOM 190 CD ARG A 31 5.008 12.896 6.348 1.00 1.27 C ATOM 191 NE ARG A 31 4.824 14.359 6.556 1.00 0.76 N ATOM 192 CZ ARG A 31 5.860 15.124 6.763 1.00 0.95 C ATOM 193 NH1 ARG A 31 6.576 15.540 5.754 1.00 1.46 N ATOM 194 NH2 ARG A 31 6.183 15.474 7.978 1.00 1.92 N ATOM 0 H ARG A 31 6.442 9.911 2.782 1.00 0.23 H new ATOM 0 HA ARG A 31 4.037 9.880 4.288 1.00 0.36 H new ATOM 0 HB2 ARG A 31 6.058 11.145 4.923 1.00 0.57 H new ATOM 0 HB3 ARG A 31 5.888 12.177 3.517 1.00 0.57 H new ATOM 0 HG2 ARG A 31 4.128 13.370 4.432 1.00 0.59 H new ATOM 0 HG3 ARG A 31 3.432 11.959 5.203 1.00 0.59 H new ATOM 0 HD2 ARG A 31 4.554 12.341 7.169 1.00 1.27 H new ATOM 0 HD3 ARG A 31 6.070 12.649 6.345 1.00 1.27 H new ATOM 0 HE ARG A 31 3.888 14.763 6.537 1.00 0.76 H new ATOM 0 HH11 ARG A 31 6.325 15.267 4.804 1.00 1.46 H new ATOM 0 HH12 ARG A 31 7.386 16.138 5.916 1.00 1.46 H new ATOM 0 HH21 ARG A 31 5.625 15.149 8.768 1.00 1.92 H new ATOM 0 HH22 ARG A 31 6.993 16.072 8.138 1.00 1.92 H new ATOM 208 N TYR A 32 3.864 11.277 1.346 1.00 0.28 N ATOM 209 CA TYR A 32 2.917 11.846 0.355 1.00 0.26 C ATOM 210 C TYR A 32 1.940 10.740 -0.031 1.00 0.13 C ATOM 211 O TYR A 32 0.761 10.968 -0.215 1.00 0.10 O ATOM 212 CB TYR A 32 3.693 12.312 -0.880 1.00 0.36 C ATOM 213 CG TYR A 32 2.799 13.149 -1.760 1.00 0.43 C ATOM 214 CD1 TYR A 32 1.719 12.557 -2.425 1.00 1.62 C ATOM 215 CD2 TYR A 32 3.056 14.516 -1.917 1.00 0.67 C ATOM 216 CE1 TYR A 32 0.894 13.332 -3.246 1.00 2.19 C ATOM 217 CE2 TYR A 32 2.231 15.292 -2.741 1.00 0.63 C ATOM 218 CZ TYR A 32 1.150 14.700 -3.404 1.00 1.50 C ATOM 219 OH TYR A 32 0.337 15.464 -4.217 1.00 2.06 O ATOM 0 H TYR A 32 4.782 11.034 0.973 1.00 0.28 H new ATOM 0 HA TYR A 32 2.382 12.700 0.771 1.00 0.26 H new ATOM 0 HB2 TYR A 32 4.565 12.891 -0.576 1.00 0.36 H new ATOM 0 HB3 TYR A 32 4.062 11.450 -1.436 1.00 0.36 H new ATOM 0 HD1 TYR A 32 1.523 11.502 -2.304 1.00 1.62 H new ATOM 0 HD2 TYR A 32 3.890 14.972 -1.403 1.00 0.67 H new ATOM 0 HE1 TYR A 32 0.060 12.876 -3.758 1.00 2.19 H new ATOM 0 HE2 TYR A 32 2.429 16.346 -2.865 1.00 0.63 H new ATOM 0 HH TYR A 32 0.652 16.392 -4.216 1.00 2.06 H new ATOM 229 N ILE A 33 2.429 9.530 -0.135 1.00 0.09 N ATOM 230 CA ILE A 33 1.536 8.390 -0.485 1.00 0.11 C ATOM 231 C ILE A 33 0.368 8.352 0.505 1.00 0.13 C ATOM 232 O ILE A 33 -0.770 8.142 0.136 1.00 0.19 O ATOM 233 CB ILE A 33 2.319 7.076 -0.401 1.00 0.14 C ATOM 234 CG1 ILE A 33 3.449 7.085 -1.431 1.00 0.16 C ATOM 235 CG2 ILE A 33 1.379 5.901 -0.691 1.00 0.17 C ATOM 236 CD1 ILE A 33 4.233 5.774 -1.338 1.00 0.15 C ATOM 0 H ILE A 33 3.409 9.285 0.008 1.00 0.09 H new ATOM 0 HA ILE A 33 1.159 8.517 -1.500 1.00 0.11 H new ATOM 0 HB ILE A 33 2.739 6.970 0.599 1.00 0.14 H new ATOM 0 HG12 ILE A 33 3.040 7.207 -2.434 1.00 0.16 H new ATOM 0 HG13 ILE A 33 4.112 7.931 -1.252 1.00 0.16 H new ATOM 0 HG21 ILE A 33 1.936 4.966 -0.631 1.00 0.17 H new ATOM 0 HG22 ILE A 33 0.573 5.890 0.042 1.00 0.17 H new ATOM 0 HG23 ILE A 33 0.959 6.010 -1.691 1.00 0.17 H new ATOM 0 HD11 ILE A 33 5.039 5.779 -2.072 1.00 0.15 H new ATOM 0 HD12 ILE A 33 4.654 5.672 -0.338 1.00 0.15 H new ATOM 0 HD13 ILE A 33 3.565 4.936 -1.538 1.00 0.15 H new ATOM 248 N LEU A 34 0.649 8.559 1.763 1.00 0.14 N ATOM 249 CA LEU A 34 -0.435 8.541 2.785 1.00 0.21 C ATOM 250 C LEU A 34 -1.287 9.801 2.638 1.00 0.19 C ATOM 251 O LEU A 34 -2.491 9.770 2.806 1.00 0.16 O ATOM 252 CB LEU A 34 0.183 8.510 4.183 1.00 0.27 C ATOM 253 CG LEU A 34 0.075 7.100 4.761 1.00 0.38 C ATOM 254 CD1 LEU A 34 1.341 6.314 4.420 1.00 0.29 C ATOM 255 CD2 LEU A 34 -0.080 7.184 6.281 1.00 0.53 C ATOM 0 H LEU A 34 1.584 8.740 2.127 1.00 0.14 H new ATOM 0 HA LEU A 34 -1.057 7.657 2.642 1.00 0.21 H new ATOM 0 HB2 LEU A 34 1.228 8.815 4.136 1.00 0.27 H new ATOM 0 HB3 LEU A 34 -0.328 9.220 4.833 1.00 0.27 H new ATOM 0 HG LEU A 34 -0.792 6.596 4.335 1.00 0.38 H new ATOM 0 HD11 LEU A 34 1.266 5.307 4.831 1.00 0.29 H new ATOM 0 HD12 LEU A 34 1.453 6.256 3.337 1.00 0.29 H new ATOM 0 HD13 LEU A 34 2.208 6.817 4.848 1.00 0.29 H new ATOM 0 HD21 LEU A 34 -0.157 6.179 6.695 1.00 0.53 H new ATOM 0 HD22 LEU A 34 0.788 7.687 6.708 1.00 0.53 H new ATOM 0 HD23 LEU A 34 -0.981 7.747 6.524 1.00 0.53 H new ATOM 267 N ASP A 35 -0.676 10.911 2.313 1.00 0.21 N ATOM 268 CA ASP A 35 -1.457 12.170 2.144 1.00 0.18 C ATOM 269 C ASP A 35 -2.577 11.913 1.142 1.00 0.18 C ATOM 270 O ASP A 35 -3.667 12.439 1.255 1.00 0.17 O ATOM 271 CB ASP A 35 -0.538 13.276 1.621 1.00 0.20 C ATOM 272 CG ASP A 35 -0.350 14.341 2.703 1.00 0.25 C ATOM 273 OD1 ASP A 35 -1.326 14.673 3.356 1.00 0.63 O ATOM 274 OD2 ASP A 35 0.767 14.805 2.862 1.00 1.05 O ATOM 0 H ASP A 35 0.328 10.999 2.158 1.00 0.21 H new ATOM 0 HA ASP A 35 -1.878 12.483 3.100 1.00 0.18 H new ATOM 0 HB2 ASP A 35 0.427 12.857 1.337 1.00 0.20 H new ATOM 0 HB3 ASP A 35 -0.966 13.725 0.725 1.00 0.20 H new ATOM 279 N GLY A 36 -2.319 11.081 0.176 1.00 0.21 N ATOM 280 CA GLY A 36 -3.366 10.755 -0.823 1.00 0.22 C ATOM 281 C GLY A 36 -4.400 9.855 -0.151 1.00 0.19 C ATOM 282 O GLY A 36 -5.587 10.080 -0.236 1.00 0.17 O ATOM 0 H GLY A 36 -1.424 10.612 0.036 1.00 0.21 H new ATOM 0 HA2 GLY A 36 -3.837 11.666 -1.192 1.00 0.22 H new ATOM 0 HA3 GLY A 36 -2.927 10.252 -1.685 1.00 0.22 H new ATOM 286 N ILE A 37 -3.945 8.834 0.520 1.00 0.21 N ATOM 287 CA ILE A 37 -4.878 7.897 1.209 1.00 0.19 C ATOM 288 C ILE A 37 -5.818 8.666 2.141 1.00 0.16 C ATOM 289 O ILE A 37 -6.878 8.185 2.490 1.00 0.12 O ATOM 290 CB ILE A 37 -4.077 6.891 2.034 1.00 0.22 C ATOM 291 CG1 ILE A 37 -3.119 6.122 1.116 1.00 0.27 C ATOM 292 CG2 ILE A 37 -5.044 5.913 2.711 1.00 0.18 C ATOM 293 CD1 ILE A 37 -3.921 5.277 0.128 1.00 0.25 C ATOM 0 H ILE A 37 -2.956 8.606 0.622 1.00 0.21 H new ATOM 0 HA ILE A 37 -5.468 7.377 0.454 1.00 0.19 H new ATOM 0 HB ILE A 37 -3.498 7.416 2.794 1.00 0.22 H new ATOM 0 HG12 ILE A 37 -2.478 6.820 0.577 1.00 0.27 H new ATOM 0 HG13 ILE A 37 -2.466 5.483 1.710 1.00 0.27 H new ATOM 0 HG21 ILE A 37 -4.478 5.192 3.301 1.00 0.18 H new ATOM 0 HG22 ILE A 37 -5.722 6.464 3.363 1.00 0.18 H new ATOM 0 HG23 ILE A 37 -5.620 5.386 1.951 1.00 0.18 H new ATOM 0 HD11 ILE A 37 -3.238 4.732 -0.523 1.00 0.25 H new ATOM 0 HD12 ILE A 37 -4.543 4.569 0.676 1.00 0.25 H new ATOM 0 HD13 ILE A 37 -4.556 5.927 -0.475 1.00 0.25 H new ATOM 305 N SER A 38 -5.457 9.854 2.542 1.00 0.17 N ATOM 306 CA SER A 38 -6.355 10.625 3.436 1.00 0.13 C ATOM 307 C SER A 38 -7.588 10.980 2.629 1.00 0.12 C ATOM 308 O SER A 38 -8.712 10.814 3.063 1.00 0.12 O ATOM 309 CB SER A 38 -5.655 11.902 3.902 1.00 0.15 C ATOM 310 OG SER A 38 -6.392 12.478 4.972 1.00 0.91 O ATOM 0 H SER A 38 -4.585 10.318 2.290 1.00 0.17 H new ATOM 0 HA SER A 38 -6.620 10.041 4.318 1.00 0.13 H new ATOM 0 HB2 SER A 38 -4.639 11.676 4.225 1.00 0.15 H new ATOM 0 HB3 SER A 38 -5.577 12.610 3.077 1.00 0.15 H new ATOM 0 HG SER A 38 -5.945 13.296 5.274 1.00 0.91 H new ATOM 316 N ALA A 39 -7.373 11.440 1.432 1.00 0.15 N ATOM 317 CA ALA A 39 -8.514 11.785 0.562 1.00 0.17 C ATOM 318 C ALA A 39 -9.089 10.500 -0.041 1.00 0.16 C ATOM 319 O ALA A 39 -10.170 10.496 -0.597 1.00 0.16 O ATOM 320 CB ALA A 39 -8.044 12.713 -0.559 1.00 0.23 C ATOM 0 H ALA A 39 -6.451 11.591 1.022 1.00 0.15 H new ATOM 0 HA ALA A 39 -9.281 12.292 1.147 1.00 0.17 H new ATOM 0 HB1 ALA A 39 -8.889 12.966 -1.200 1.00 0.23 H new ATOM 0 HB2 ALA A 39 -7.630 13.624 -0.127 1.00 0.23 H new ATOM 0 HB3 ALA A 39 -7.278 12.211 -1.150 1.00 0.23 H new ATOM 326 N LEU A 40 -8.379 9.404 0.065 1.00 0.15 N ATOM 327 CA LEU A 40 -8.897 8.132 -0.500 1.00 0.15 C ATOM 328 C LEU A 40 -9.474 7.259 0.615 1.00 0.16 C ATOM 329 O LEU A 40 -9.987 6.189 0.364 1.00 0.20 O ATOM 330 CB LEU A 40 -7.772 7.372 -1.204 1.00 0.24 C ATOM 331 CG LEU A 40 -7.018 8.315 -2.140 1.00 0.27 C ATOM 332 CD1 LEU A 40 -5.621 7.758 -2.410 1.00 0.39 C ATOM 333 CD2 LEU A 40 -7.775 8.435 -3.460 1.00 0.28 C ATOM 0 H LEU A 40 -7.467 9.341 0.518 1.00 0.15 H new ATOM 0 HA LEU A 40 -9.681 8.366 -1.220 1.00 0.15 H new ATOM 0 HB2 LEU A 40 -7.087 6.952 -0.467 1.00 0.24 H new ATOM 0 HB3 LEU A 40 -8.184 6.536 -1.769 1.00 0.24 H new ATOM 0 HG LEU A 40 -6.936 9.297 -1.674 1.00 0.27 H new ATOM 0 HD11 LEU A 40 -5.084 8.431 -3.078 1.00 0.39 H new ATOM 0 HD12 LEU A 40 -5.077 7.669 -1.470 1.00 0.39 H new ATOM 0 HD13 LEU A 40 -5.705 6.776 -2.875 1.00 0.39 H new ATOM 0 HD21 LEU A 40 -7.237 9.108 -4.128 1.00 0.28 H new ATOM 0 HD22 LEU A 40 -7.856 7.452 -3.924 1.00 0.28 H new ATOM 0 HD23 LEU A 40 -8.773 8.831 -3.272 1.00 0.28 H new ATOM 345 N ARG A 41 -9.401 7.699 1.844 1.00 0.17 N ATOM 346 CA ARG A 41 -9.957 6.879 2.953 1.00 0.24 C ATOM 347 C ARG A 41 -10.952 7.706 3.773 1.00 0.31 C ATOM 348 O ARG A 41 -11.603 7.195 4.660 1.00 0.42 O ATOM 349 CB ARG A 41 -8.827 6.402 3.861 1.00 0.23 C ATOM 350 CG ARG A 41 -9.356 5.296 4.777 1.00 0.30 C ATOM 351 CD ARG A 41 -8.238 4.825 5.707 1.00 0.34 C ATOM 352 NE ARG A 41 -8.250 5.646 6.950 1.00 0.84 N ATOM 353 CZ ARG A 41 -8.555 5.096 8.092 1.00 0.20 C ATOM 354 NH1 ARG A 41 -9.444 4.142 8.142 1.00 1.15 N ATOM 355 NH2 ARG A 41 -7.969 5.499 9.186 1.00 0.80 N ATOM 0 H ARG A 41 -8.982 8.586 2.124 1.00 0.17 H new ATOM 0 HA ARG A 41 -10.471 6.017 2.527 1.00 0.24 H new ATOM 0 HB2 ARG A 41 -7.995 6.030 3.263 1.00 0.23 H new ATOM 0 HB3 ARG A 41 -8.446 7.232 4.455 1.00 0.23 H new ATOM 0 HG2 ARG A 41 -10.198 5.666 5.362 1.00 0.30 H new ATOM 0 HG3 ARG A 41 -9.724 4.461 4.181 1.00 0.30 H new ATOM 0 HD2 ARG A 41 -8.374 3.772 5.952 1.00 0.34 H new ATOM 0 HD3 ARG A 41 -7.273 4.914 5.208 1.00 0.34 H new ATOM 0 HE ARG A 41 -8.020 6.639 6.908 1.00 0.84 H new ATOM 0 HH11 ARG A 41 -9.901 3.826 7.287 1.00 1.15 H new ATOM 0 HH12 ARG A 41 -9.682 3.713 9.036 1.00 1.15 H new ATOM 0 HH21 ARG A 41 -7.273 6.244 9.147 1.00 0.80 H new ATOM 0 HH22 ARG A 41 -8.207 5.069 10.080 1.00 0.80 H new ATOM 369 N LYS A 42 -11.084 8.977 3.491 1.00 0.27 N ATOM 370 CA LYS A 42 -12.043 9.808 4.262 1.00 0.37 C ATOM 371 C LYS A 42 -13.442 9.607 3.688 1.00 0.38 C ATOM 372 O LYS A 42 -14.422 9.556 4.408 1.00 0.40 O ATOM 373 CB LYS A 42 -11.648 11.280 4.140 1.00 0.39 C ATOM 374 CG LYS A 42 -12.111 12.039 5.386 1.00 0.59 C ATOM 375 CD LYS A 42 -11.410 13.398 5.446 1.00 0.61 C ATOM 376 CE LYS A 42 -11.850 14.255 4.258 1.00 1.48 C ATOM 377 NZ LYS A 42 -11.141 15.565 4.301 1.00 1.87 N ATOM 0 H LYS A 42 -10.569 9.470 2.762 1.00 0.27 H new ATOM 0 HA LYS A 42 -12.029 9.516 5.312 1.00 0.37 H new ATOM 0 HB2 LYS A 42 -10.567 11.369 4.028 1.00 0.39 H new ATOM 0 HB3 LYS A 42 -12.098 11.715 3.248 1.00 0.39 H new ATOM 0 HG2 LYS A 42 -13.192 12.176 5.360 1.00 0.59 H new ATOM 0 HG3 LYS A 42 -11.884 11.461 6.282 1.00 0.59 H new ATOM 0 HD2 LYS A 42 -11.653 13.903 6.381 1.00 0.61 H new ATOM 0 HD3 LYS A 42 -10.329 13.262 5.429 1.00 0.61 H new ATOM 0 HE2 LYS A 42 -11.629 13.740 3.323 1.00 1.48 H new ATOM 0 HE3 LYS A 42 -12.928 14.412 4.288 1.00 1.48 H new ATOM 0 HZ1 LYS A 42 -11.440 16.148 3.493 1.00 1.87 H new ATOM 0 HZ2 LYS A 42 -11.373 16.056 5.188 1.00 1.87 H new ATOM 0 HZ3 LYS A 42 -10.114 15.406 4.252 1.00 1.87 H new ATOM 391 N GLU A 43 -13.539 9.484 2.395 1.00 0.36 N ATOM 392 CA GLU A 43 -14.867 9.280 1.767 1.00 0.38 C ATOM 393 C GLU A 43 -15.233 7.805 1.866 1.00 0.39 C ATOM 394 O GLU A 43 -16.361 7.452 2.168 1.00 0.42 O ATOM 395 CB GLU A 43 -14.807 9.703 0.298 1.00 0.40 C ATOM 396 CG GLU A 43 -16.206 9.625 -0.316 1.00 1.24 C ATOM 397 CD GLU A 43 -17.100 10.700 0.305 1.00 1.44 C ATOM 398 OE1 GLU A 43 -17.553 10.494 1.419 1.00 2.96 O ATOM 399 OE2 GLU A 43 -17.317 11.710 -0.344 1.00 1.12 O ATOM 0 H GLU A 43 -12.752 9.516 1.747 1.00 0.36 H new ATOM 0 HA GLU A 43 -15.619 9.881 2.278 1.00 0.38 H new ATOM 0 HB2 GLU A 43 -14.419 10.719 0.217 1.00 0.40 H new ATOM 0 HB3 GLU A 43 -14.122 9.056 -0.250 1.00 0.40 H new ATOM 0 HG2 GLU A 43 -16.149 9.765 -1.395 1.00 1.24 H new ATOM 0 HG3 GLU A 43 -16.635 8.638 -0.145 1.00 1.24 H new ATOM 406 N THR A 44 -14.277 6.939 1.632 1.00 0.43 N ATOM 407 CA THR A 44 -14.548 5.476 1.722 1.00 0.47 C ATOM 408 C THR A 44 -14.346 5.003 3.165 1.00 0.43 C ATOM 409 O THR A 44 -13.750 3.978 3.425 1.00 0.62 O ATOM 410 CB THR A 44 -13.608 4.712 0.781 1.00 0.58 C ATOM 411 OG1 THR A 44 -13.925 3.324 0.817 1.00 0.74 O ATOM 412 CG2 THR A 44 -12.157 4.924 1.215 1.00 0.71 C ATOM 0 H THR A 44 -13.319 7.186 1.382 1.00 0.43 H new ATOM 0 HA THR A 44 -15.578 5.282 1.424 1.00 0.47 H new ATOM 0 HB THR A 44 -13.733 5.084 -0.236 1.00 0.58 H new ATOM 0 HG1 THR A 44 -13.873 3.000 1.741 1.00 0.74 H new ATOM 0 HG21 THR A 44 -11.493 4.379 0.544 1.00 0.71 H new ATOM 0 HG22 THR A 44 -11.918 5.987 1.178 1.00 0.71 H new ATOM 0 HG23 THR A 44 -12.024 4.557 2.233 1.00 0.71 H new ATOM 420 N CYS A 45 -14.867 5.740 4.102 1.00 0.29 N ATOM 421 CA CYS A 45 -14.755 5.361 5.531 1.00 0.35 C ATOM 422 C CYS A 45 -15.933 6.011 6.253 1.00 0.52 C ATOM 423 O CYS A 45 -16.644 5.381 7.008 1.00 0.59 O ATOM 424 CB CYS A 45 -13.428 5.867 6.115 1.00 0.57 C ATOM 425 SG CYS A 45 -13.373 5.557 7.904 1.00 1.77 S ATOM 0 H CYS A 45 -15.376 6.607 3.932 1.00 0.29 H new ATOM 0 HA CYS A 45 -14.773 4.278 5.650 1.00 0.35 H new ATOM 0 HB2 CYS A 45 -12.592 5.367 5.626 1.00 0.57 H new ATOM 0 HB3 CYS A 45 -13.319 6.934 5.920 1.00 0.57 H new ATOM 0 HG CYS A 45 -12.245 5.988 8.385 1.00 1.77 H new ATOM 430 N ASN A 46 -16.160 7.272 5.992 1.00 0.63 N ATOM 431 CA ASN A 46 -17.309 7.968 6.625 1.00 0.87 C ATOM 432 C ASN A 46 -18.571 7.637 5.826 1.00 0.88 C ATOM 433 O ASN A 46 -19.577 7.230 6.373 1.00 1.14 O ATOM 434 CB ASN A 46 -17.070 9.480 6.602 1.00 0.92 C ATOM 435 CG ASN A 46 -17.669 10.117 7.857 1.00 1.35 C ATOM 436 OD1 ASN A 46 -18.732 10.705 7.806 1.00 2.25 O ATOM 437 ND2 ASN A 46 -17.028 10.028 8.991 1.00 1.57 N ATOM 0 H ASN A 46 -15.596 7.847 5.366 1.00 0.63 H new ATOM 0 HA ASN A 46 -17.422 7.643 7.659 1.00 0.87 H new ATOM 0 HB2 ASN A 46 -16.001 9.688 6.552 1.00 0.92 H new ATOM 0 HB3 ASN A 46 -17.522 9.916 5.711 1.00 0.92 H new ATOM 0 HD21 ASN A 46 -17.419 10.451 9.833 1.00 1.57 H new ATOM 0 HD22 ASN A 46 -16.136 9.535 9.035 1.00 1.57 H new ATOM 444 N LYS A 47 -18.521 7.800 4.528 1.00 0.67 N ATOM 445 CA LYS A 47 -19.709 7.486 3.689 1.00 0.87 C ATOM 446 C LYS A 47 -19.621 6.038 3.193 1.00 0.90 C ATOM 447 O LYS A 47 -20.149 5.700 2.152 1.00 1.28 O ATOM 448 CB LYS A 47 -19.749 8.434 2.490 1.00 0.84 C ATOM 449 CG LYS A 47 -20.887 9.443 2.669 1.00 0.98 C ATOM 450 CD LYS A 47 -20.659 10.252 3.947 1.00 0.93 C ATOM 451 CE LYS A 47 -21.864 11.157 4.202 1.00 1.44 C ATOM 452 NZ LYS A 47 -21.528 12.141 5.270 1.00 2.84 N ATOM 0 H LYS A 47 -17.706 8.138 4.016 1.00 0.67 H new ATOM 0 HA LYS A 47 -20.615 7.610 4.283 1.00 0.87 H new ATOM 0 HB2 LYS A 47 -18.797 8.957 2.396 1.00 0.84 H new ATOM 0 HB3 LYS A 47 -19.894 7.867 1.570 1.00 0.84 H new ATOM 0 HG2 LYS A 47 -20.934 10.110 1.808 1.00 0.98 H new ATOM 0 HG3 LYS A 47 -21.843 8.922 2.722 1.00 0.98 H new ATOM 0 HD2 LYS A 47 -20.510 9.581 4.793 1.00 0.93 H new ATOM 0 HD3 LYS A 47 -19.754 10.852 3.853 1.00 0.93 H new ATOM 0 HE2 LYS A 47 -22.141 11.679 3.286 1.00 1.44 H new ATOM 0 HE3 LYS A 47 -22.725 10.559 4.501 1.00 1.44 H new ATOM 0 HZ1 LYS A 47 -22.347 12.757 5.444 1.00 2.84 H new ATOM 0 HZ2 LYS A 47 -21.284 11.634 6.145 1.00 2.84 H new ATOM 0 HZ3 LYS A 47 -20.718 12.719 4.967 1.00 2.84 H new ATOM 466 N SER A 48 -18.945 5.182 3.912 1.00 0.69 N ATOM 467 CA SER A 48 -18.818 3.768 3.454 1.00 0.68 C ATOM 468 C SER A 48 -19.568 2.820 4.399 1.00 0.81 C ATOM 469 O SER A 48 -19.590 1.626 4.192 1.00 1.28 O ATOM 470 CB SER A 48 -17.339 3.382 3.419 1.00 0.44 C ATOM 471 OG SER A 48 -16.891 3.113 4.742 1.00 1.55 O ATOM 0 H SER A 48 -18.477 5.399 4.792 1.00 0.69 H new ATOM 0 HA SER A 48 -19.253 3.682 2.458 1.00 0.68 H new ATOM 0 HB2 SER A 48 -17.195 2.504 2.789 1.00 0.44 H new ATOM 0 HB3 SER A 48 -16.751 4.189 2.981 1.00 0.44 H new ATOM 0 HG SER A 48 -15.997 2.713 4.710 1.00 1.55 H new ATOM 477 N ASN A 49 -20.178 3.332 5.440 1.00 0.51 N ATOM 478 CA ASN A 49 -20.927 2.450 6.394 1.00 0.73 C ATOM 479 C ASN A 49 -20.108 1.198 6.752 1.00 0.76 C ATOM 480 O ASN A 49 -20.651 0.193 7.165 1.00 1.17 O ATOM 481 CB ASN A 49 -22.245 2.018 5.748 1.00 0.93 C ATOM 482 CG ASN A 49 -23.134 1.347 6.798 1.00 1.45 C ATOM 483 OD1 ASN A 49 -22.777 1.275 7.957 1.00 1.91 O ATOM 484 ND2 ASN A 49 -24.285 0.848 6.438 1.00 2.25 N ATOM 0 H ASN A 49 -20.190 4.325 5.672 1.00 0.51 H new ATOM 0 HA ASN A 49 -21.116 3.013 7.308 1.00 0.73 H new ATOM 0 HB2 ASN A 49 -22.755 2.883 5.324 1.00 0.93 H new ATOM 0 HB3 ASN A 49 -22.051 1.328 4.927 1.00 0.93 H new ATOM 0 HD21 ASN A 49 -24.884 0.398 7.130 1.00 2.25 H new ATOM 0 HD22 ASN A 49 -24.585 0.908 5.465 1.00 2.25 H new ATOM 491 N MET A 50 -18.812 1.245 6.598 1.00 0.47 N ATOM 492 CA MET A 50 -17.975 0.057 6.933 1.00 0.55 C ATOM 493 C MET A 50 -16.586 0.529 7.357 1.00 0.46 C ATOM 494 O MET A 50 -15.580 0.059 6.865 1.00 0.10 O ATOM 495 CB MET A 50 -17.855 -0.847 5.703 1.00 0.52 C ATOM 496 CG MET A 50 -18.831 -2.018 5.834 1.00 0.88 C ATOM 497 SD MET A 50 -18.119 -3.490 5.059 1.00 0.90 S ATOM 498 CE MET A 50 -18.487 -3.046 3.345 1.00 0.45 C ATOM 0 H MET A 50 -18.296 2.055 6.254 1.00 0.47 H new ATOM 0 HA MET A 50 -18.438 -0.502 7.747 1.00 0.55 H new ATOM 0 HB2 MET A 50 -18.071 -0.279 4.798 1.00 0.52 H new ATOM 0 HB3 MET A 50 -16.835 -1.219 5.610 1.00 0.52 H new ATOM 0 HG2 MET A 50 -19.041 -2.214 6.885 1.00 0.88 H new ATOM 0 HG3 MET A 50 -19.780 -1.768 5.360 1.00 0.88 H new ATOM 0 HE1 MET A 50 -19.214 -3.748 2.935 1.00 0.45 H new ATOM 0 HE2 MET A 50 -18.898 -2.037 3.311 1.00 0.45 H new ATOM 0 HE3 MET A 50 -17.572 -3.085 2.754 1.00 0.45 H new ATOM 660 N ASN A 62 -10.335 -7.944 5.789 1.00 0.98 N ATOM 661 CA ASN A 62 -8.908 -8.092 5.376 1.00 0.80 C ATOM 662 C ASN A 62 -8.820 -8.978 4.138 1.00 0.45 C ATOM 663 O ASN A 62 -9.292 -10.097 4.124 1.00 1.00 O ATOM 664 CB ASN A 62 -8.085 -8.721 6.508 1.00 0.97 C ATOM 665 CG ASN A 62 -8.489 -8.107 7.849 1.00 1.13 C ATOM 666 OD1 ASN A 62 -8.941 -6.981 7.906 1.00 1.82 O ATOM 667 ND2 ASN A 62 -8.338 -8.807 8.941 1.00 0.79 N ATOM 0 HA ASN A 62 -8.507 -7.104 5.152 1.00 0.80 H new ATOM 0 HB2 ASN A 62 -8.244 -9.799 6.529 1.00 0.97 H new ATOM 0 HB3 ASN A 62 -7.022 -8.559 6.330 1.00 0.97 H new ATOM 0 HD21 ASN A 62 -8.600 -8.408 9.843 1.00 0.79 H new ATOM 0 HD22 ASN A 62 -7.958 -9.752 8.892 1.00 0.79 H new ATOM 674 N LEU A 63 -8.207 -8.485 3.101 1.00 0.43 N ATOM 675 CA LEU A 63 -8.075 -9.297 1.862 1.00 0.27 C ATOM 676 C LEU A 63 -6.727 -10.038 1.892 1.00 0.22 C ATOM 677 O LEU A 63 -6.510 -10.879 2.742 1.00 0.41 O ATOM 678 CB LEU A 63 -8.195 -8.384 0.638 1.00 0.97 C ATOM 679 CG LEU A 63 -7.350 -7.148 0.830 1.00 1.22 C ATOM 680 CD1 LEU A 63 -6.643 -6.824 -0.486 1.00 1.86 C ATOM 681 CD2 LEU A 63 -8.245 -5.974 1.234 1.00 2.64 C ATOM 0 H LEU A 63 -7.791 -7.555 3.058 1.00 0.43 H new ATOM 0 HA LEU A 63 -8.871 -10.039 1.802 1.00 0.27 H new ATOM 0 HB2 LEU A 63 -7.875 -8.918 -0.257 1.00 0.97 H new ATOM 0 HB3 LEU A 63 -9.237 -8.102 0.485 1.00 0.97 H new ATOM 0 HG LEU A 63 -6.612 -7.321 1.613 1.00 1.22 H new ATOM 0 HD11 LEU A 63 -6.029 -5.932 -0.359 1.00 1.86 H new ATOM 0 HD12 LEU A 63 -6.009 -7.663 -0.775 1.00 1.86 H new ATOM 0 HD13 LEU A 63 -7.386 -6.646 -1.264 1.00 1.86 H new ATOM 0 HD21 LEU A 63 -7.634 -5.082 1.373 1.00 2.64 H new ATOM 0 HD22 LEU A 63 -8.981 -5.792 0.451 1.00 2.64 H new ATOM 0 HD23 LEU A 63 -8.758 -6.211 2.166 1.00 2.64 H new ATOM 693 N ASN A 64 -5.813 -9.750 0.999 1.00 0.42 N ATOM 694 CA ASN A 64 -4.506 -10.464 1.034 1.00 0.57 C ATOM 695 C ASN A 64 -3.398 -9.503 0.618 1.00 0.70 C ATOM 696 O ASN A 64 -2.386 -9.896 0.075 1.00 0.78 O ATOM 697 CB ASN A 64 -4.539 -11.659 0.076 1.00 0.67 C ATOM 698 CG ASN A 64 -5.861 -12.414 0.242 1.00 0.99 C ATOM 699 OD1 ASN A 64 -5.993 -13.242 1.122 1.00 1.49 O ATOM 700 ND2 ASN A 64 -6.851 -12.160 -0.569 1.00 2.01 N ATOM 0 H ASN A 64 -5.916 -9.059 0.256 1.00 0.42 H new ATOM 0 HA ASN A 64 -4.317 -10.825 2.045 1.00 0.57 H new ATOM 0 HB2 ASN A 64 -4.431 -11.316 -0.953 1.00 0.67 H new ATOM 0 HB3 ASN A 64 -3.700 -12.325 0.280 1.00 0.67 H new ATOM 0 HD21 ASN A 64 -7.736 -12.656 -0.465 1.00 2.01 H new ATOM 0 HD22 ASN A 64 -6.740 -11.465 -1.307 1.00 2.01 H new ATOM 707 N LEU A 65 -3.585 -8.240 0.874 1.00 0.86 N ATOM 708 CA LEU A 65 -2.548 -7.245 0.502 1.00 1.07 C ATOM 709 C LEU A 65 -1.493 -7.013 1.627 1.00 1.16 C ATOM 710 O LEU A 65 -0.436 -6.493 1.328 1.00 1.50 O ATOM 711 CB LEU A 65 -3.227 -5.912 0.137 1.00 1.14 C ATOM 712 CG LEU A 65 -3.683 -5.176 1.397 1.00 1.04 C ATOM 713 CD1 LEU A 65 -2.871 -3.901 1.553 1.00 0.91 C ATOM 714 CD2 LEU A 65 -5.154 -4.801 1.280 1.00 1.32 C ATOM 0 H LEU A 65 -4.414 -7.854 1.326 1.00 0.86 H new ATOM 0 HA LEU A 65 -2.008 -7.647 -0.355 1.00 1.07 H new ATOM 0 HB2 LEU A 65 -2.533 -5.286 -0.425 1.00 1.14 H new ATOM 0 HB3 LEU A 65 -4.083 -6.100 -0.511 1.00 1.14 H new ATOM 0 HG LEU A 65 -3.539 -5.828 2.259 1.00 1.04 H new ATOM 0 HD11 LEU A 65 -3.193 -3.372 2.450 1.00 0.91 H new ATOM 0 HD12 LEU A 65 -1.814 -4.151 1.639 1.00 0.91 H new ATOM 0 HD13 LEU A 65 -3.024 -3.264 0.682 1.00 0.91 H new ATOM 0 HD21 LEU A 65 -5.469 -4.277 2.183 1.00 1.32 H new ATOM 0 HD22 LEU A 65 -5.296 -4.152 0.416 1.00 1.32 H new ATOM 0 HD23 LEU A 65 -5.751 -5.705 1.158 1.00 1.32 H new ATOM 726 N PRO A 66 -1.765 -7.370 2.883 1.00 1.50 N ATOM 727 CA PRO A 66 -0.784 -7.142 3.964 1.00 1.61 C ATOM 728 C PRO A 66 0.296 -8.226 3.940 1.00 0.79 C ATOM 729 O PRO A 66 0.139 -9.256 3.316 1.00 1.13 O ATOM 730 CB PRO A 66 -1.616 -7.235 5.244 1.00 2.67 C ATOM 731 CG PRO A 66 -2.870 -8.064 4.890 1.00 3.07 C ATOM 732 CD PRO A 66 -3.014 -8.016 3.358 1.00 2.27 C ATOM 0 HA PRO A 66 -0.265 -6.188 3.871 1.00 1.61 H new ATOM 0 HB2 PRO A 66 -1.048 -7.712 6.043 1.00 2.67 H new ATOM 0 HB3 PRO A 66 -1.894 -6.243 5.599 1.00 2.67 H new ATOM 0 HG2 PRO A 66 -2.765 -9.092 5.237 1.00 3.07 H new ATOM 0 HG3 PRO A 66 -3.755 -7.653 5.375 1.00 3.07 H new ATOM 0 HD2 PRO A 66 -3.127 -9.016 2.939 1.00 2.27 H new ATOM 0 HD3 PRO A 66 -3.893 -7.445 3.060 1.00 2.27 H new ATOM 740 N LYS A 67 1.394 -8.006 4.614 1.00 0.44 N ATOM 741 CA LYS A 67 2.473 -9.034 4.618 1.00 0.85 C ATOM 742 C LYS A 67 3.677 -8.528 5.419 1.00 0.75 C ATOM 743 O LYS A 67 4.769 -8.398 4.902 1.00 0.76 O ATOM 744 CB LYS A 67 2.901 -9.317 3.182 1.00 1.48 C ATOM 745 CG LYS A 67 3.070 -10.824 2.986 1.00 2.13 C ATOM 746 CD LYS A 67 4.491 -11.118 2.500 1.00 2.98 C ATOM 747 CE LYS A 67 4.902 -12.524 2.942 1.00 3.64 C ATOM 748 NZ LYS A 67 6.390 -12.610 3.021 1.00 4.90 N ATOM 0 H LYS A 67 1.589 -7.165 5.158 1.00 0.44 H new ATOM 0 HA LYS A 67 2.098 -9.948 5.079 1.00 0.85 H new ATOM 0 HB2 LYS A 67 2.156 -8.931 2.487 1.00 1.48 H new ATOM 0 HB3 LYS A 67 3.837 -8.804 2.963 1.00 1.48 H new ATOM 0 HG2 LYS A 67 2.879 -11.347 3.923 1.00 2.13 H new ATOM 0 HG3 LYS A 67 2.343 -11.191 2.262 1.00 2.13 H new ATOM 0 HD2 LYS A 67 4.539 -11.038 1.414 1.00 2.98 H new ATOM 0 HD3 LYS A 67 5.185 -10.381 2.905 1.00 2.98 H new ATOM 0 HE2 LYS A 67 4.462 -12.754 3.913 1.00 3.64 H new ATOM 0 HE3 LYS A 67 4.522 -13.263 2.237 1.00 3.64 H new ATOM 0 HZ1 LYS A 67 6.699 -13.560 2.733 1.00 4.90 H new ATOM 0 HZ2 LYS A 67 6.813 -11.902 2.388 1.00 4.90 H new ATOM 0 HZ3 LYS A 67 6.697 -12.428 3.998 1.00 4.90 H new ATOM 762 N MET A 68 3.488 -8.253 6.676 1.00 0.79 N ATOM 763 CA MET A 68 4.625 -7.769 7.513 1.00 0.71 C ATOM 764 C MET A 68 4.583 -8.464 8.874 1.00 0.91 C ATOM 765 O MET A 68 3.802 -9.367 9.096 1.00 1.52 O ATOM 766 CB MET A 68 4.518 -6.254 7.705 1.00 0.60 C ATOM 767 CG MET A 68 5.917 -5.630 7.648 1.00 0.76 C ATOM 768 SD MET A 68 5.959 -4.344 6.374 1.00 1.17 S ATOM 769 CE MET A 68 7.027 -3.178 7.255 1.00 0.57 C ATOM 0 H MET A 68 2.596 -8.341 7.164 1.00 0.79 H new ATOM 0 HA MET A 68 5.566 -8.000 7.015 1.00 0.71 H new ATOM 0 HB2 MET A 68 3.884 -5.823 6.930 1.00 0.60 H new ATOM 0 HB3 MET A 68 4.048 -6.031 8.663 1.00 0.60 H new ATOM 0 HG2 MET A 68 6.176 -5.204 8.617 1.00 0.76 H new ATOM 0 HG3 MET A 68 6.659 -6.397 7.429 1.00 0.76 H new ATOM 0 HE1 MET A 68 7.072 -2.238 6.704 1.00 0.57 H new ATOM 0 HE2 MET A 68 6.623 -2.996 8.251 1.00 0.57 H new ATOM 0 HE3 MET A 68 8.030 -3.597 7.341 1.00 0.57 H new ATOM 779 N ALA A 69 5.421 -8.052 9.787 1.00 0.44 N ATOM 780 CA ALA A 69 5.431 -8.692 11.132 1.00 0.69 C ATOM 781 C ALA A 69 6.565 -8.097 11.968 1.00 0.54 C ATOM 782 O ALA A 69 7.237 -7.174 11.553 1.00 0.76 O ATOM 783 CB ALA A 69 5.651 -10.199 10.980 1.00 1.21 C ATOM 0 H ALA A 69 6.098 -7.300 9.659 1.00 0.44 H new ATOM 0 HA ALA A 69 4.477 -8.512 11.627 1.00 0.69 H new ATOM 0 HB1 ALA A 69 5.658 -10.667 11.965 1.00 1.21 H new ATOM 0 HB2 ALA A 69 4.846 -10.626 10.381 1.00 1.21 H new ATOM 0 HB3 ALA A 69 6.606 -10.379 10.486 1.00 1.21 H new ATOM 789 N GLU A 70 6.785 -8.617 13.145 1.00 0.63 N ATOM 790 CA GLU A 70 7.876 -8.079 14.006 1.00 0.72 C ATOM 791 C GLU A 70 9.128 -8.939 13.844 1.00 0.92 C ATOM 792 O GLU A 70 10.238 -8.445 13.869 1.00 0.92 O ATOM 793 CB GLU A 70 7.432 -8.098 15.471 1.00 1.09 C ATOM 794 CG GLU A 70 6.292 -7.096 15.675 1.00 1.88 C ATOM 795 CD GLU A 70 6.851 -5.795 16.252 1.00 3.31 C ATOM 796 OE1 GLU A 70 7.035 -5.735 17.457 1.00 3.76 O ATOM 797 OE2 GLU A 70 7.086 -4.880 15.480 1.00 4.22 O ATOM 0 H GLU A 70 6.256 -9.391 13.547 1.00 0.63 H new ATOM 0 HA GLU A 70 8.098 -7.054 13.707 1.00 0.72 H new ATOM 0 HB2 GLU A 70 7.104 -9.099 15.749 1.00 1.09 H new ATOM 0 HB3 GLU A 70 8.271 -7.846 16.119 1.00 1.09 H new ATOM 0 HG2 GLU A 70 5.792 -6.900 14.726 1.00 1.88 H new ATOM 0 HG3 GLU A 70 5.544 -7.513 16.349 1.00 1.88 H new ATOM 804 N LYS A 71 8.962 -10.220 13.687 1.00 1.24 N ATOM 805 CA LYS A 71 10.147 -11.106 13.532 1.00 1.55 C ATOM 806 C LYS A 71 10.508 -11.255 12.051 1.00 1.27 C ATOM 807 O LYS A 71 11.239 -12.148 11.672 1.00 1.49 O ATOM 808 CB LYS A 71 9.826 -12.475 14.125 1.00 2.49 C ATOM 809 CG LYS A 71 8.695 -13.136 13.332 1.00 1.40 C ATOM 810 CD LYS A 71 7.818 -13.958 14.279 1.00 2.53 C ATOM 811 CE LYS A 71 6.350 -13.579 14.075 1.00 2.88 C ATOM 812 NZ LYS A 71 5.538 -14.118 15.201 1.00 4.18 N ATOM 0 H LYS A 71 8.058 -10.692 13.659 1.00 1.24 H new ATOM 0 HA LYS A 71 10.997 -10.667 14.054 1.00 1.55 H new ATOM 0 HB2 LYS A 71 10.714 -13.107 14.104 1.00 2.49 H new ATOM 0 HB3 LYS A 71 9.535 -12.369 15.170 1.00 2.49 H new ATOM 0 HG2 LYS A 71 8.095 -12.376 12.832 1.00 1.40 H new ATOM 0 HG3 LYS A 71 9.109 -13.778 12.554 1.00 1.40 H new ATOM 0 HD2 LYS A 71 7.959 -15.022 14.090 1.00 2.53 H new ATOM 0 HD3 LYS A 71 8.111 -13.776 15.313 1.00 2.53 H new ATOM 0 HE2 LYS A 71 6.247 -12.495 14.024 1.00 2.88 H new ATOM 0 HE3 LYS A 71 5.988 -13.979 13.128 1.00 2.88 H new ATOM 0 HZ1 LYS A 71 4.540 -13.861 15.063 1.00 4.18 H new ATOM 0 HZ2 LYS A 71 5.628 -15.154 15.229 1.00 4.18 H new ATOM 0 HZ3 LYS A 71 5.878 -13.716 16.098 1.00 4.18 H new ATOM 826 N ASP A 72 10.005 -10.395 11.210 1.00 1.21 N ATOM 827 CA ASP A 72 10.331 -10.505 9.760 1.00 1.44 C ATOM 828 C ASP A 72 9.601 -9.414 8.973 1.00 1.68 C ATOM 829 O ASP A 72 9.114 -9.644 7.884 1.00 2.87 O ATOM 830 CB ASP A 72 9.893 -11.876 9.243 1.00 3.36 C ATOM 831 CG ASP A 72 11.078 -12.566 8.563 1.00 4.17 C ATOM 832 OD1 ASP A 72 11.762 -11.907 7.798 1.00 3.33 O ATOM 833 OD2 ASP A 72 11.278 -13.742 8.819 1.00 5.84 O ATOM 0 H ASP A 72 9.386 -9.625 11.461 1.00 1.21 H new ATOM 0 HA ASP A 72 11.406 -10.385 9.628 1.00 1.44 H new ATOM 0 HB2 ASP A 72 9.526 -12.487 10.067 1.00 3.36 H new ATOM 0 HB3 ASP A 72 9.069 -11.765 8.538 1.00 3.36 H new ATOM 838 N GLY A 73 9.523 -8.227 9.508 1.00 1.67 N ATOM 839 CA GLY A 73 8.827 -7.131 8.777 1.00 3.41 C ATOM 840 C GLY A 73 9.012 -5.817 9.533 1.00 2.82 C ATOM 841 O GLY A 73 8.107 -5.326 10.177 1.00 4.23 O ATOM 0 H GLY A 73 9.909 -7.969 10.416 1.00 1.67 H new ATOM 0 HA2 GLY A 73 9.227 -7.041 7.767 1.00 3.41 H new ATOM 0 HA3 GLY A 73 7.766 -7.361 8.680 1.00 3.41 H new ATOM 845 N CYS A 74 10.183 -5.245 9.464 1.00 1.50 N ATOM 846 CA CYS A 74 10.427 -3.964 10.181 1.00 0.76 C ATOM 847 C CYS A 74 10.275 -4.194 11.684 1.00 1.23 C ATOM 848 O CYS A 74 9.201 -4.475 12.176 1.00 2.35 O ATOM 849 CB CYS A 74 9.416 -2.917 9.715 1.00 0.34 C ATOM 850 SG CYS A 74 10.281 -1.595 8.834 1.00 1.59 S ATOM 0 H CYS A 74 10.980 -5.610 8.942 1.00 1.50 H new ATOM 0 HA CYS A 74 11.435 -3.609 9.967 1.00 0.76 H new ATOM 0 HB2 CYS A 74 8.673 -3.378 9.064 1.00 0.34 H new ATOM 0 HB3 CYS A 74 8.879 -2.508 10.571 1.00 0.34 H new ATOM 855 N PHE A 75 11.349 -4.089 12.413 1.00 1.21 N ATOM 856 CA PHE A 75 11.279 -4.316 13.886 1.00 1.68 C ATOM 857 C PHE A 75 12.181 -3.304 14.598 1.00 1.14 C ATOM 858 O PHE A 75 12.660 -2.360 14.002 1.00 1.94 O ATOM 859 CB PHE A 75 11.738 -5.746 14.239 1.00 3.34 C ATOM 860 CG PHE A 75 12.437 -6.396 13.060 1.00 5.38 C ATOM 861 CD1 PHE A 75 11.695 -6.806 11.944 1.00 6.04 C ATOM 862 CD2 PHE A 75 13.823 -6.581 13.083 1.00 6.89 C ATOM 863 CE1 PHE A 75 12.341 -7.402 10.855 1.00 7.87 C ATOM 864 CE2 PHE A 75 14.468 -7.177 11.994 1.00 8.79 C ATOM 865 CZ PHE A 75 13.727 -7.588 10.879 1.00 9.17 C ATOM 0 H PHE A 75 12.275 -3.856 12.054 1.00 1.21 H new ATOM 0 HA PHE A 75 10.246 -4.190 14.211 1.00 1.68 H new ATOM 0 HB2 PHE A 75 12.412 -5.715 15.095 1.00 3.34 H new ATOM 0 HB3 PHE A 75 10.877 -6.347 14.533 1.00 3.34 H new ATOM 0 HD1 PHE A 75 10.625 -6.662 11.924 1.00 6.04 H new ATOM 0 HD2 PHE A 75 14.396 -6.264 13.942 1.00 6.89 H new ATOM 0 HE1 PHE A 75 11.769 -7.719 9.995 1.00 7.87 H new ATOM 0 HE2 PHE A 75 15.538 -7.320 12.013 1.00 8.79 H new ATOM 0 HZ PHE A 75 14.225 -8.048 10.039 1.00 9.17 H new ATOM 875 N GLN A 76 12.412 -3.491 15.870 1.00 1.08 N ATOM 876 CA GLN A 76 13.279 -2.535 16.617 1.00 1.15 C ATOM 877 C GLN A 76 14.270 -3.309 17.491 1.00 1.84 C ATOM 878 O GLN A 76 15.435 -2.974 17.569 1.00 2.50 O ATOM 879 CB GLN A 76 12.407 -1.647 17.508 1.00 1.28 C ATOM 880 CG GLN A 76 11.638 -2.518 18.503 1.00 1.72 C ATOM 881 CD GLN A 76 10.415 -1.754 19.012 1.00 2.79 C ATOM 882 OE1 GLN A 76 10.541 -0.676 19.558 1.00 2.60 O ATOM 883 NE2 GLN A 76 9.226 -2.270 18.854 1.00 4.21 N ATOM 0 H GLN A 76 12.039 -4.263 16.423 1.00 1.08 H new ATOM 0 HA GLN A 76 13.828 -1.918 15.906 1.00 1.15 H new ATOM 0 HB2 GLN A 76 13.028 -0.928 18.042 1.00 1.28 H new ATOM 0 HB3 GLN A 76 11.710 -1.073 16.897 1.00 1.28 H new ATOM 0 HG2 GLN A 76 11.327 -3.447 18.025 1.00 1.72 H new ATOM 0 HG3 GLN A 76 12.283 -2.791 19.338 1.00 1.72 H new ATOM 0 HE21 GLN A 76 9.120 -3.175 18.396 1.00 4.21 H new ATOM 0 HE22 GLN A 76 8.404 -1.768 19.189 1.00 4.21 H new ATOM 892 N SER A 77 13.815 -4.337 18.154 1.00 2.05 N ATOM 893 CA SER A 77 14.730 -5.126 19.026 1.00 2.98 C ATOM 894 C SER A 77 15.921 -5.623 18.203 1.00 3.47 C ATOM 895 O SER A 77 17.063 -5.382 18.539 1.00 5.27 O ATOM 896 CB SER A 77 13.975 -6.322 19.606 1.00 3.32 C ATOM 897 OG SER A 77 13.803 -6.137 21.006 1.00 3.74 O ATOM 0 H SER A 77 12.849 -4.664 18.129 1.00 2.05 H new ATOM 0 HA SER A 77 15.090 -4.495 19.838 1.00 2.98 H new ATOM 0 HB2 SER A 77 13.005 -6.425 19.120 1.00 3.32 H new ATOM 0 HB3 SER A 77 14.527 -7.242 19.414 1.00 3.32 H new ATOM 0 HG SER A 77 13.318 -6.902 21.380 1.00 3.74 H new ATOM 903 N GLY A 78 15.663 -6.314 17.127 1.00 1.89 N ATOM 904 CA GLY A 78 16.782 -6.825 16.285 1.00 2.26 C ATOM 905 C GLY A 78 16.632 -6.289 14.862 1.00 1.92 C ATOM 906 O GLY A 78 16.611 -7.035 13.904 1.00 2.04 O ATOM 0 H GLY A 78 14.727 -6.547 16.794 1.00 1.89 H new ATOM 0 HA2 GLY A 78 17.739 -6.513 16.704 1.00 2.26 H new ATOM 0 HA3 GLY A 78 16.778 -7.915 16.277 1.00 2.26 H new ATOM 910 N PHE A 79 16.525 -4.995 14.716 1.00 1.58 N ATOM 911 CA PHE A 79 16.370 -4.400 13.358 1.00 1.29 C ATOM 912 C PHE A 79 17.486 -4.906 12.440 1.00 1.33 C ATOM 913 O PHE A 79 18.657 -4.799 12.751 1.00 1.53 O ATOM 914 CB PHE A 79 16.447 -2.875 13.469 1.00 1.24 C ATOM 915 CG PHE A 79 16.057 -2.244 12.152 1.00 1.00 C ATOM 916 CD1 PHE A 79 14.930 -2.702 11.460 1.00 1.01 C ATOM 917 CD2 PHE A 79 16.823 -1.196 11.626 1.00 1.13 C ATOM 918 CE1 PHE A 79 14.570 -2.112 10.242 1.00 1.23 C ATOM 919 CE2 PHE A 79 16.463 -0.607 10.410 1.00 1.07 C ATOM 920 CZ PHE A 79 15.336 -1.065 9.716 1.00 1.16 C ATOM 0 H PHE A 79 16.538 -4.322 15.483 1.00 1.58 H new ATOM 0 HA PHE A 79 15.407 -4.691 12.939 1.00 1.29 H new ATOM 0 HB2 PHE A 79 15.784 -2.525 14.260 1.00 1.24 H new ATOM 0 HB3 PHE A 79 17.458 -2.572 13.742 1.00 1.24 H new ATOM 0 HD1 PHE A 79 14.338 -3.510 11.865 1.00 1.01 H new ATOM 0 HD2 PHE A 79 17.693 -0.842 12.160 1.00 1.13 H new ATOM 0 HE1 PHE A 79 13.700 -2.465 9.708 1.00 1.23 H new ATOM 0 HE2 PHE A 79 17.054 0.201 10.006 1.00 1.07 H new ATOM 0 HZ PHE A 79 15.058 -0.611 8.776 1.00 1.16 H new ATOM 930 N ASN A 80 17.132 -5.458 11.310 1.00 1.20 N ATOM 931 CA ASN A 80 18.173 -5.970 10.373 1.00 1.27 C ATOM 932 C ASN A 80 18.307 -5.035 9.172 1.00 1.26 C ATOM 933 O ASN A 80 19.251 -5.128 8.418 1.00 2.52 O ATOM 934 CB ASN A 80 17.792 -7.371 9.895 1.00 1.44 C ATOM 935 CG ASN A 80 18.949 -8.331 10.169 1.00 1.93 C ATOM 936 OD1 ASN A 80 19.718 -8.128 11.088 1.00 2.40 O ATOM 937 ND2 ASN A 80 19.108 -9.377 9.405 1.00 2.16 N ATOM 0 H ASN A 80 16.169 -5.576 10.996 1.00 1.20 H new ATOM 0 HA ASN A 80 19.128 -6.013 10.896 1.00 1.27 H new ATOM 0 HB2 ASN A 80 16.893 -7.711 10.409 1.00 1.44 H new ATOM 0 HB3 ASN A 80 17.563 -7.354 8.829 1.00 1.44 H new ATOM 0 HD21 ASN A 80 19.877 -10.024 9.579 1.00 2.16 H new ATOM 0 HD22 ASN A 80 18.463 -9.548 8.634 1.00 2.16 H new ATOM 944 N GLU A 81 17.380 -4.130 9.004 1.00 0.56 N ATOM 945 CA GLU A 81 17.441 -3.162 7.869 1.00 0.35 C ATOM 946 C GLU A 81 17.020 -3.830 6.553 1.00 0.44 C ATOM 947 O GLU A 81 15.932 -3.613 6.062 1.00 0.70 O ATOM 948 CB GLU A 81 18.857 -2.584 7.721 1.00 0.23 C ATOM 949 CG GLU A 81 19.383 -2.138 9.086 1.00 0.36 C ATOM 950 CD GLU A 81 20.913 -2.149 9.070 1.00 0.68 C ATOM 951 OE1 GLU A 81 21.486 -1.280 8.433 1.00 0.69 O ATOM 952 OE2 GLU A 81 21.486 -3.029 9.691 1.00 1.72 O ATOM 0 H GLU A 81 16.571 -4.019 9.615 1.00 0.56 H new ATOM 0 HA GLU A 81 16.746 -2.352 8.091 1.00 0.35 H new ATOM 0 HB2 GLU A 81 19.522 -3.334 7.293 1.00 0.23 H new ATOM 0 HB3 GLU A 81 18.844 -1.739 7.033 1.00 0.23 H new ATOM 0 HG2 GLU A 81 19.018 -1.138 9.319 1.00 0.36 H new ATOM 0 HG3 GLU A 81 19.012 -2.803 9.866 1.00 0.36 H new ATOM 959 N GLU A 82 17.878 -4.620 5.966 1.00 0.32 N ATOM 960 CA GLU A 82 17.547 -5.274 4.680 1.00 0.44 C ATOM 961 C GLU A 82 16.313 -6.170 4.813 1.00 0.61 C ATOM 962 O GLU A 82 15.733 -6.570 3.827 1.00 0.71 O ATOM 963 CB GLU A 82 18.742 -6.119 4.258 1.00 0.42 C ATOM 964 CG GLU A 82 19.197 -6.992 5.429 1.00 2.87 C ATOM 965 CD GLU A 82 19.761 -8.309 4.895 1.00 2.63 C ATOM 966 OE1 GLU A 82 18.974 -9.134 4.460 1.00 2.04 O ATOM 967 OE2 GLU A 82 20.970 -8.472 4.929 1.00 3.29 O ATOM 0 H GLU A 82 18.804 -4.839 6.332 1.00 0.32 H new ATOM 0 HA GLU A 82 17.326 -4.509 3.936 1.00 0.44 H new ATOM 0 HB2 GLU A 82 18.474 -6.746 3.408 1.00 0.42 H new ATOM 0 HB3 GLU A 82 19.559 -5.474 3.934 1.00 0.42 H new ATOM 0 HG2 GLU A 82 19.955 -6.470 6.013 1.00 2.87 H new ATOM 0 HG3 GLU A 82 18.359 -7.188 6.098 1.00 2.87 H new ATOM 974 N THR A 83 15.894 -6.490 6.008 1.00 0.70 N ATOM 975 CA THR A 83 14.698 -7.359 6.148 1.00 0.84 C ATOM 976 C THR A 83 13.452 -6.524 5.901 1.00 0.60 C ATOM 977 O THR A 83 12.563 -6.915 5.166 1.00 0.47 O ATOM 978 CB THR A 83 14.641 -7.955 7.554 1.00 1.09 C ATOM 979 OG1 THR A 83 15.877 -8.591 7.849 1.00 1.33 O ATOM 980 CG2 THR A 83 13.506 -8.978 7.618 1.00 1.19 C ATOM 0 H THR A 83 16.325 -6.190 6.882 1.00 0.70 H new ATOM 0 HA THR A 83 14.754 -8.172 5.424 1.00 0.84 H new ATOM 0 HB THR A 83 14.462 -7.165 8.283 1.00 1.09 H new ATOM 0 HG1 THR A 83 15.842 -8.972 8.751 1.00 1.33 H new ATOM 0 HG21 THR A 83 13.459 -9.408 8.619 1.00 1.19 H new ATOM 0 HG22 THR A 83 12.560 -8.487 7.389 1.00 1.19 H new ATOM 0 HG23 THR A 83 13.688 -9.770 6.891 1.00 1.19 H new ATOM 988 N CYS A 84 13.380 -5.369 6.496 1.00 0.58 N ATOM 989 CA CYS A 84 12.189 -4.518 6.274 1.00 0.40 C ATOM 990 C CYS A 84 12.196 -4.041 4.825 1.00 0.25 C ATOM 991 O CYS A 84 11.229 -4.191 4.108 1.00 0.31 O ATOM 992 CB CYS A 84 12.206 -3.310 7.216 1.00 0.56 C ATOM 993 SG CYS A 84 10.666 -2.374 7.009 1.00 1.48 S ATOM 0 H CYS A 84 14.088 -4.983 7.120 1.00 0.58 H new ATOM 0 HA CYS A 84 11.288 -5.096 6.477 1.00 0.40 H new ATOM 0 HB2 CYS A 84 12.309 -3.641 8.250 1.00 0.56 H new ATOM 0 HB3 CYS A 84 13.064 -2.675 6.997 1.00 0.56 H new ATOM 998 N LEU A 85 13.292 -3.475 4.385 1.00 0.26 N ATOM 999 CA LEU A 85 13.380 -2.989 2.977 1.00 0.29 C ATOM 1000 C LEU A 85 12.892 -4.083 2.020 1.00 0.43 C ATOM 1001 O LEU A 85 12.215 -3.808 1.053 1.00 0.45 O ATOM 1002 CB LEU A 85 14.833 -2.630 2.651 1.00 0.44 C ATOM 1003 CG LEU A 85 14.876 -1.754 1.396 1.00 0.56 C ATOM 1004 CD1 LEU A 85 14.414 -0.338 1.746 1.00 0.54 C ATOM 1005 CD2 LEU A 85 16.308 -1.701 0.857 1.00 0.84 C ATOM 0 H LEU A 85 14.132 -3.329 4.944 1.00 0.26 H new ATOM 0 HA LEU A 85 12.753 -2.105 2.860 1.00 0.29 H new ATOM 0 HB2 LEU A 85 15.285 -2.102 3.491 1.00 0.44 H new ATOM 0 HB3 LEU A 85 15.416 -3.537 2.494 1.00 0.44 H new ATOM 0 HG LEU A 85 14.217 -2.176 0.638 1.00 0.56 H new ATOM 0 HD11 LEU A 85 14.445 0.286 0.853 1.00 0.54 H new ATOM 0 HD12 LEU A 85 13.394 -0.372 2.130 1.00 0.54 H new ATOM 0 HD13 LEU A 85 15.073 0.083 2.505 1.00 0.54 H new ATOM 0 HD21 LEU A 85 16.338 -1.077 -0.036 1.00 0.84 H new ATOM 0 HD22 LEU A 85 16.967 -1.279 1.616 1.00 0.84 H new ATOM 0 HD23 LEU A 85 16.640 -2.709 0.607 1.00 0.84 H new ATOM 1017 N VAL A 86 13.224 -5.321 2.286 1.00 0.60 N ATOM 1018 CA VAL A 86 12.759 -6.420 1.390 1.00 0.76 C ATOM 1019 C VAL A 86 11.225 -6.425 1.372 1.00 0.60 C ATOM 1020 O VAL A 86 10.598 -6.391 0.321 1.00 0.54 O ATOM 1021 CB VAL A 86 13.288 -7.766 1.914 1.00 1.01 C ATOM 1022 CG1 VAL A 86 12.636 -8.925 1.154 1.00 1.08 C ATOM 1023 CG2 VAL A 86 14.800 -7.830 1.701 1.00 1.21 C ATOM 0 H VAL A 86 13.793 -5.616 3.079 1.00 0.60 H new ATOM 0 HA VAL A 86 13.134 -6.266 0.378 1.00 0.76 H new ATOM 0 HB VAL A 86 13.049 -7.849 2.974 1.00 1.01 H new ATOM 0 HG11 VAL A 86 13.020 -9.871 1.535 1.00 1.08 H new ATOM 0 HG12 VAL A 86 11.555 -8.889 1.293 1.00 1.08 H new ATOM 0 HG13 VAL A 86 12.868 -8.840 0.092 1.00 1.08 H new ATOM 0 HG21 VAL A 86 15.180 -8.782 2.071 1.00 1.21 H new ATOM 0 HG22 VAL A 86 15.022 -7.739 0.638 1.00 1.21 H new ATOM 0 HG23 VAL A 86 15.279 -7.014 2.242 1.00 1.21 H new ATOM 1033 N LYS A 87 10.616 -6.457 2.527 1.00 0.56 N ATOM 1034 CA LYS A 87 9.129 -6.451 2.582 1.00 0.50 C ATOM 1035 C LYS A 87 8.605 -5.170 1.923 1.00 0.29 C ATOM 1036 O LYS A 87 7.455 -5.083 1.546 1.00 0.40 O ATOM 1037 CB LYS A 87 8.666 -6.506 4.041 1.00 0.58 C ATOM 1038 CG LYS A 87 7.300 -7.196 4.123 1.00 1.55 C ATOM 1039 CD LYS A 87 7.432 -8.650 3.659 1.00 1.08 C ATOM 1040 CE LYS A 87 7.237 -9.592 4.849 1.00 1.15 C ATOM 1041 NZ LYS A 87 8.540 -10.226 5.197 1.00 1.40 N ATOM 0 H LYS A 87 11.085 -6.487 3.432 1.00 0.56 H new ATOM 0 HA LYS A 87 8.741 -7.320 2.051 1.00 0.50 H new ATOM 0 HB2 LYS A 87 9.395 -7.048 4.644 1.00 0.58 H new ATOM 0 HB3 LYS A 87 8.600 -5.498 4.450 1.00 0.58 H new ATOM 0 HG2 LYS A 87 6.925 -7.162 5.146 1.00 1.55 H new ATOM 0 HG3 LYS A 87 6.577 -6.669 3.501 1.00 1.55 H new ATOM 0 HD2 LYS A 87 6.692 -8.864 2.888 1.00 1.08 H new ATOM 0 HD3 LYS A 87 8.413 -8.811 3.212 1.00 1.08 H new ATOM 0 HE2 LYS A 87 6.849 -9.039 5.705 1.00 1.15 H new ATOM 0 HE3 LYS A 87 6.501 -10.358 4.604 1.00 1.15 H new ATOM 0 HZ1 LYS A 87 8.512 -11.235 4.948 1.00 1.40 H new ATOM 0 HZ2 LYS A 87 9.305 -9.760 4.668 1.00 1.40 H new ATOM 0 HZ3 LYS A 87 8.713 -10.126 6.218 1.00 1.40 H new ATOM 1055 N ILE A 88 9.444 -4.177 1.773 1.00 0.11 N ATOM 1056 CA ILE A 88 8.995 -2.912 1.129 1.00 0.27 C ATOM 1057 C ILE A 88 9.023 -3.089 -0.393 1.00 0.37 C ATOM 1058 O ILE A 88 8.209 -2.536 -1.104 1.00 0.44 O ATOM 1059 CB ILE A 88 9.934 -1.768 1.527 1.00 0.47 C ATOM 1060 CG1 ILE A 88 9.846 -1.530 3.038 1.00 0.50 C ATOM 1061 CG2 ILE A 88 9.531 -0.488 0.790 1.00 0.53 C ATOM 1062 CD1 ILE A 88 8.410 -1.171 3.421 1.00 0.37 C ATOM 0 H ILE A 88 10.420 -4.190 2.070 1.00 0.11 H new ATOM 0 HA ILE A 88 7.983 -2.675 1.456 1.00 0.27 H new ATOM 0 HB ILE A 88 10.956 -2.036 1.259 1.00 0.47 H new ATOM 0 HG12 ILE A 88 10.163 -2.424 3.576 1.00 0.50 H new ATOM 0 HG13 ILE A 88 10.522 -0.726 3.329 1.00 0.50 H new ATOM 0 HG21 ILE A 88 10.201 0.323 1.076 1.00 0.53 H new ATOM 0 HG22 ILE A 88 9.597 -0.651 -0.286 1.00 0.53 H new ATOM 0 HG23 ILE A 88 8.507 -0.223 1.054 1.00 0.53 H new ATOM 0 HD11 ILE A 88 8.352 -1.003 4.496 1.00 0.37 H new ATOM 0 HD12 ILE A 88 8.109 -0.265 2.895 1.00 0.37 H new ATOM 0 HD13 ILE A 88 7.745 -1.989 3.145 1.00 0.37 H new ATOM 1074 N ILE A 89 9.953 -3.857 -0.898 1.00 0.46 N ATOM 1075 CA ILE A 89 10.022 -4.065 -2.372 1.00 0.61 C ATOM 1076 C ILE A 89 8.783 -4.847 -2.817 1.00 0.40 C ATOM 1077 O ILE A 89 7.979 -4.353 -3.581 1.00 0.32 O ATOM 1078 CB ILE A 89 11.301 -4.841 -2.727 1.00 0.83 C ATOM 1079 CG1 ILE A 89 12.519 -4.108 -2.154 1.00 1.07 C ATOM 1080 CG2 ILE A 89 11.458 -4.945 -4.251 1.00 0.85 C ATOM 1081 CD1 ILE A 89 12.551 -2.669 -2.675 1.00 0.66 C ATOM 0 H ILE A 89 10.664 -4.347 -0.355 1.00 0.46 H new ATOM 0 HA ILE A 89 10.048 -3.104 -2.885 1.00 0.61 H new ATOM 0 HB ILE A 89 11.230 -5.843 -2.303 1.00 0.83 H new ATOM 0 HG12 ILE A 89 12.476 -4.109 -1.065 1.00 1.07 H new ATOM 0 HG13 ILE A 89 13.434 -4.628 -2.438 1.00 1.07 H new ATOM 0 HG21 ILE A 89 12.368 -5.497 -4.486 1.00 0.85 H new ATOM 0 HG22 ILE A 89 10.598 -5.467 -4.671 1.00 0.85 H new ATOM 0 HG23 ILE A 89 11.519 -3.945 -4.680 1.00 0.85 H new ATOM 0 HD11 ILE A 89 13.419 -2.153 -2.265 1.00 0.66 H new ATOM 0 HD12 ILE A 89 12.615 -2.677 -3.763 1.00 0.66 H new ATOM 0 HD13 ILE A 89 11.642 -2.151 -2.369 1.00 0.66 H new ATOM 1093 N THR A 90 8.601 -6.052 -2.335 1.00 0.43 N ATOM 1094 CA THR A 90 7.384 -6.824 -2.748 1.00 0.39 C ATOM 1095 C THR A 90 6.142 -6.163 -2.154 1.00 0.26 C ATOM 1096 O THR A 90 5.093 -6.125 -2.764 1.00 0.54 O ATOM 1097 CB THR A 90 7.461 -8.269 -2.249 1.00 0.70 C ATOM 1098 OG1 THR A 90 6.240 -8.931 -2.548 1.00 2.01 O ATOM 1099 CG2 THR A 90 7.687 -8.284 -0.736 1.00 1.31 C ATOM 0 H THR A 90 9.228 -6.528 -1.686 1.00 0.43 H new ATOM 0 HA THR A 90 7.330 -6.828 -3.837 1.00 0.39 H new ATOM 0 HB THR A 90 8.290 -8.778 -2.741 1.00 0.70 H new ATOM 0 HG1 THR A 90 6.284 -9.858 -2.232 1.00 2.01 H new ATOM 0 HG21 THR A 90 7.741 -9.315 -0.386 1.00 1.31 H new ATOM 0 HG22 THR A 90 8.621 -7.772 -0.502 1.00 1.31 H new ATOM 0 HG23 THR A 90 6.861 -7.775 -0.240 1.00 1.31 H new ATOM 1107 N GLY A 91 6.254 -5.641 -0.964 1.00 0.37 N ATOM 1108 CA GLY A 91 5.083 -4.978 -0.327 1.00 0.33 C ATOM 1109 C GLY A 91 4.565 -3.882 -1.256 1.00 0.25 C ATOM 1110 O GLY A 91 3.379 -3.629 -1.340 1.00 0.25 O ATOM 0 H GLY A 91 7.107 -5.645 -0.405 1.00 0.37 H new ATOM 0 HA2 GLY A 91 4.298 -5.708 -0.132 1.00 0.33 H new ATOM 0 HA3 GLY A 91 5.369 -4.552 0.635 1.00 0.33 H new ATOM 1114 N LEU A 92 5.451 -3.237 -1.961 1.00 0.26 N ATOM 1115 CA LEU A 92 5.025 -2.160 -2.892 1.00 0.30 C ATOM 1116 C LEU A 92 4.518 -2.790 -4.195 1.00 0.35 C ATOM 1117 O LEU A 92 3.694 -2.225 -4.882 1.00 0.36 O ATOM 1118 CB LEU A 92 6.214 -1.245 -3.191 1.00 0.42 C ATOM 1119 CG LEU A 92 6.266 -0.119 -2.158 1.00 0.32 C ATOM 1120 CD1 LEU A 92 7.646 0.542 -2.190 1.00 0.42 C ATOM 1121 CD2 LEU A 92 5.195 0.923 -2.487 1.00 0.50 C ATOM 0 H LEU A 92 6.456 -3.411 -1.931 1.00 0.26 H new ATOM 0 HA LEU A 92 4.226 -1.575 -2.436 1.00 0.30 H new ATOM 0 HB2 LEU A 92 7.141 -1.817 -3.167 1.00 0.42 H new ATOM 0 HB3 LEU A 92 6.122 -0.828 -4.194 1.00 0.42 H new ATOM 0 HG LEU A 92 6.083 -0.529 -1.165 1.00 0.32 H new ATOM 0 HD11 LEU A 92 7.682 1.345 -1.453 1.00 0.42 H new ATOM 0 HD12 LEU A 92 8.410 -0.199 -1.957 1.00 0.42 H new ATOM 0 HD13 LEU A 92 7.830 0.952 -3.183 1.00 0.42 H new ATOM 0 HD21 LEU A 92 5.231 1.726 -1.751 1.00 0.50 H new ATOM 0 HD22 LEU A 92 5.379 1.332 -3.480 1.00 0.50 H new ATOM 0 HD23 LEU A 92 4.211 0.454 -2.464 1.00 0.50 H new ATOM 1133 N LEU A 93 5.000 -3.961 -4.539 1.00 0.44 N ATOM 1134 CA LEU A 93 4.530 -4.627 -5.795 1.00 0.55 C ATOM 1135 C LEU A 93 3.033 -4.933 -5.665 1.00 0.36 C ATOM 1136 O LEU A 93 2.202 -4.437 -6.414 1.00 0.29 O ATOM 1137 CB LEU A 93 5.297 -5.941 -6.000 1.00 0.80 C ATOM 1138 CG LEU A 93 6.780 -5.645 -6.230 1.00 0.99 C ATOM 1139 CD1 LEU A 93 7.567 -6.958 -6.283 1.00 1.17 C ATOM 1140 CD2 LEU A 93 6.950 -4.896 -7.552 1.00 0.75 C ATOM 0 H LEU A 93 5.696 -4.482 -4.006 1.00 0.44 H new ATOM 0 HA LEU A 93 4.705 -3.969 -6.646 1.00 0.55 H new ATOM 0 HB2 LEU A 93 5.176 -6.583 -5.128 1.00 0.80 H new ATOM 0 HB3 LEU A 93 4.888 -6.482 -6.853 1.00 0.80 H new ATOM 0 HG LEU A 93 7.157 -5.032 -5.411 1.00 0.99 H new ATOM 0 HD11 LEU A 93 8.623 -6.743 -6.447 1.00 1.17 H new ATOM 0 HD12 LEU A 93 7.448 -7.492 -5.340 1.00 1.17 H new ATOM 0 HD13 LEU A 93 7.191 -7.575 -7.099 1.00 1.17 H new ATOM 0 HD21 LEU A 93 8.006 -4.684 -7.717 1.00 0.75 H new ATOM 0 HD22 LEU A 93 6.571 -5.510 -8.369 1.00 0.75 H new ATOM 0 HD23 LEU A 93 6.394 -3.959 -7.514 1.00 0.75 H new ATOM 1152 N GLU A 94 2.678 -5.738 -4.705 1.00 0.35 N ATOM 1153 CA GLU A 94 1.243 -6.062 -4.510 1.00 0.28 C ATOM 1154 C GLU A 94 0.492 -4.754 -4.257 1.00 0.19 C ATOM 1155 O GLU A 94 -0.600 -4.548 -4.741 1.00 0.24 O ATOM 1156 CB GLU A 94 1.093 -7.000 -3.311 1.00 0.41 C ATOM 1157 CG GLU A 94 1.665 -6.333 -2.059 1.00 2.58 C ATOM 1158 CD GLU A 94 1.964 -7.404 -1.007 1.00 3.01 C ATOM 1159 OE1 GLU A 94 3.035 -7.985 -1.069 1.00 3.26 O ATOM 1160 OE2 GLU A 94 1.115 -7.626 -0.159 1.00 3.81 O ATOM 0 H GLU A 94 3.319 -6.184 -4.049 1.00 0.35 H new ATOM 0 HA GLU A 94 0.836 -6.558 -5.391 1.00 0.28 H new ATOM 0 HB2 GLU A 94 0.042 -7.243 -3.157 1.00 0.41 H new ATOM 0 HB3 GLU A 94 1.612 -7.939 -3.504 1.00 0.41 H new ATOM 0 HG2 GLU A 94 2.575 -5.787 -2.307 1.00 2.58 H new ATOM 0 HG3 GLU A 94 0.955 -5.606 -1.663 1.00 2.58 H new ATOM 1167 N PHE A 95 1.088 -3.860 -3.519 1.00 0.15 N ATOM 1168 CA PHE A 95 0.431 -2.551 -3.242 1.00 0.25 C ATOM 1169 C PHE A 95 0.067 -1.873 -4.565 1.00 0.24 C ATOM 1170 O PHE A 95 -0.928 -1.183 -4.669 1.00 0.29 O ATOM 1171 CB PHE A 95 1.415 -1.658 -2.487 1.00 0.32 C ATOM 1172 CG PHE A 95 1.109 -1.649 -1.007 1.00 0.42 C ATOM 1173 CD1 PHE A 95 0.540 -2.772 -0.390 1.00 0.38 C ATOM 1174 CD2 PHE A 95 1.408 -0.513 -0.247 1.00 0.85 C ATOM 1175 CE1 PHE A 95 0.269 -2.755 0.980 1.00 0.45 C ATOM 1176 CE2 PHE A 95 1.137 -0.496 1.123 1.00 1.08 C ATOM 1177 CZ PHE A 95 0.568 -1.617 1.739 1.00 0.81 C ATOM 0 H PHE A 95 2.007 -3.980 -3.093 1.00 0.15 H new ATOM 0 HA PHE A 95 -0.470 -2.710 -2.650 1.00 0.25 H new ATOM 0 HB2 PHE A 95 2.433 -2.013 -2.650 1.00 0.32 H new ATOM 0 HB3 PHE A 95 1.365 -0.642 -2.879 1.00 0.32 H new ATOM 0 HD1 PHE A 95 0.311 -3.651 -0.975 1.00 0.38 H new ATOM 0 HD2 PHE A 95 1.849 0.352 -0.720 1.00 0.85 H new ATOM 0 HE1 PHE A 95 -0.171 -3.620 1.454 1.00 0.45 H new ATOM 0 HE2 PHE A 95 1.367 0.383 1.708 1.00 1.08 H new ATOM 0 HZ PHE A 95 0.360 -1.604 2.799 1.00 0.81 H new ATOM 1187 N GLU A 96 0.882 -2.053 -5.571 1.00 0.18 N ATOM 1188 CA GLU A 96 0.604 -1.408 -6.884 1.00 0.18 C ATOM 1189 C GLU A 96 -0.663 -2.010 -7.497 1.00 0.17 C ATOM 1190 O GLU A 96 -1.497 -1.296 -8.018 1.00 0.17 O ATOM 1191 CB GLU A 96 1.832 -1.567 -7.817 1.00 0.27 C ATOM 1192 CG GLU A 96 1.695 -2.775 -8.762 1.00 1.86 C ATOM 1193 CD GLU A 96 3.059 -3.102 -9.372 1.00 2.77 C ATOM 1194 OE1 GLU A 96 3.954 -3.452 -8.622 1.00 3.74 O ATOM 1195 OE2 GLU A 96 3.187 -2.995 -10.581 1.00 3.32 O ATOM 0 H GLU A 96 1.729 -2.620 -5.538 1.00 0.18 H new ATOM 0 HA GLU A 96 0.430 -0.341 -6.746 1.00 0.18 H new ATOM 0 HB2 GLU A 96 1.957 -0.659 -8.407 1.00 0.27 H new ATOM 0 HB3 GLU A 96 2.732 -1.681 -7.213 1.00 0.27 H new ATOM 0 HG2 GLU A 96 1.313 -3.637 -8.215 1.00 1.86 H new ATOM 0 HG3 GLU A 96 0.976 -2.554 -9.550 1.00 1.86 H new ATOM 1202 N VAL A 97 -0.830 -3.309 -7.443 1.00 0.17 N ATOM 1203 CA VAL A 97 -2.072 -3.895 -8.036 1.00 0.17 C ATOM 1204 C VAL A 97 -3.287 -3.369 -7.258 1.00 0.14 C ATOM 1205 O VAL A 97 -4.355 -3.161 -7.810 1.00 0.11 O ATOM 1206 CB VAL A 97 -2.020 -5.434 -7.999 1.00 0.17 C ATOM 1207 CG1 VAL A 97 -2.123 -5.956 -6.563 1.00 0.23 C ATOM 1208 CG2 VAL A 97 -3.184 -5.999 -8.820 1.00 0.13 C ATOM 0 H VAL A 97 -0.179 -3.974 -7.026 1.00 0.17 H new ATOM 0 HA VAL A 97 -2.154 -3.596 -9.081 1.00 0.17 H new ATOM 0 HB VAL A 97 -1.066 -5.755 -8.418 1.00 0.17 H new ATOM 0 HG11 VAL A 97 -2.084 -7.045 -6.568 1.00 0.23 H new ATOM 0 HG12 VAL A 97 -1.293 -5.566 -5.974 1.00 0.23 H new ATOM 0 HG13 VAL A 97 -3.066 -5.629 -6.124 1.00 0.23 H new ATOM 0 HG21 VAL A 97 -3.151 -7.088 -8.796 1.00 0.13 H new ATOM 0 HG22 VAL A 97 -4.128 -5.655 -8.397 1.00 0.13 H new ATOM 0 HG23 VAL A 97 -3.102 -5.656 -9.851 1.00 0.13 H new ATOM 1218 N TYR A 98 -3.128 -3.118 -5.985 1.00 0.21 N ATOM 1219 CA TYR A 98 -4.263 -2.579 -5.192 1.00 0.19 C ATOM 1220 C TYR A 98 -4.443 -1.112 -5.568 1.00 0.18 C ATOM 1221 O TYR A 98 -5.526 -0.566 -5.488 1.00 0.18 O ATOM 1222 CB TYR A 98 -3.961 -2.716 -3.701 1.00 0.18 C ATOM 1223 CG TYR A 98 -3.869 -4.182 -3.354 1.00 0.21 C ATOM 1224 CD1 TYR A 98 -5.017 -4.985 -3.396 1.00 0.21 C ATOM 1225 CD2 TYR A 98 -2.638 -4.743 -3.001 1.00 0.31 C ATOM 1226 CE1 TYR A 98 -4.930 -6.347 -3.086 1.00 0.27 C ATOM 1227 CE2 TYR A 98 -2.551 -6.104 -2.689 1.00 0.35 C ATOM 1228 CZ TYR A 98 -3.697 -6.907 -2.733 1.00 0.31 C ATOM 1229 OH TYR A 98 -3.611 -8.249 -2.424 1.00 0.37 O ATOM 0 H TYR A 98 -2.263 -3.264 -5.465 1.00 0.21 H new ATOM 0 HA TYR A 98 -5.178 -3.132 -5.404 1.00 0.19 H new ATOM 0 HB2 TYR A 98 -3.026 -2.212 -3.458 1.00 0.18 H new ATOM 0 HB3 TYR A 98 -4.744 -2.238 -3.112 1.00 0.18 H new ATOM 0 HD1 TYR A 98 -5.969 -4.553 -3.668 1.00 0.21 H new ATOM 0 HD2 TYR A 98 -1.753 -4.125 -2.969 1.00 0.31 H new ATOM 0 HE1 TYR A 98 -5.814 -6.966 -3.119 1.00 0.27 H new ATOM 0 HE2 TYR A 98 -1.600 -6.535 -2.414 1.00 0.35 H new ATOM 0 HH TYR A 98 -2.671 -8.527 -2.434 1.00 0.37 H new ATOM 1239 N LEU A 99 -3.393 -0.482 -6.028 1.00 0.19 N ATOM 1240 CA LEU A 99 -3.510 0.930 -6.465 1.00 0.18 C ATOM 1241 C LEU A 99 -4.298 0.917 -7.764 1.00 0.16 C ATOM 1242 O LEU A 99 -5.044 1.824 -8.068 1.00 0.17 O ATOM 1243 CB LEU A 99 -2.123 1.523 -6.697 1.00 0.19 C ATOM 1244 CG LEU A 99 -1.524 1.932 -5.356 1.00 0.36 C ATOM 1245 CD1 LEU A 99 -0.083 2.392 -5.563 1.00 0.58 C ATOM 1246 CD2 LEU A 99 -2.347 3.077 -4.760 1.00 0.39 C ATOM 0 H LEU A 99 -2.462 -0.889 -6.118 1.00 0.19 H new ATOM 0 HA LEU A 99 -4.008 1.537 -5.709 1.00 0.18 H new ATOM 0 HB2 LEU A 99 -1.480 0.794 -7.189 1.00 0.19 H new ATOM 0 HB3 LEU A 99 -2.189 2.387 -7.358 1.00 0.19 H new ATOM 0 HG LEU A 99 -1.539 1.081 -4.674 1.00 0.36 H new ATOM 0 HD11 LEU A 99 0.347 2.685 -4.605 1.00 0.58 H new ATOM 0 HD12 LEU A 99 0.502 1.577 -5.989 1.00 0.58 H new ATOM 0 HD13 LEU A 99 -0.067 3.244 -6.243 1.00 0.58 H new ATOM 0 HD21 LEU A 99 -1.920 3.371 -3.801 1.00 0.39 H new ATOM 0 HD22 LEU A 99 -2.332 3.929 -5.440 1.00 0.39 H new ATOM 0 HD23 LEU A 99 -3.376 2.748 -4.614 1.00 0.39 H new ATOM 1258 N GLU A 100 -4.180 -0.158 -8.505 1.00 0.16 N ATOM 1259 CA GLU A 100 -4.961 -0.297 -9.750 1.00 0.15 C ATOM 1260 C GLU A 100 -6.420 -0.294 -9.317 1.00 0.15 C ATOM 1261 O GLU A 100 -7.287 0.260 -9.964 1.00 0.15 O ATOM 1262 CB GLU A 100 -4.612 -1.634 -10.408 1.00 0.17 C ATOM 1263 CG GLU A 100 -4.625 -1.484 -11.928 1.00 0.25 C ATOM 1264 CD GLU A 100 -6.053 -1.664 -12.448 1.00 0.78 C ATOM 1265 OE1 GLU A 100 -6.463 -2.801 -12.611 1.00 1.64 O ATOM 1266 OE2 GLU A 100 -6.711 -0.662 -12.675 1.00 0.98 O ATOM 0 H GLU A 100 -3.568 -0.945 -8.290 1.00 0.16 H new ATOM 0 HA GLU A 100 -4.754 0.499 -10.465 1.00 0.15 H new ATOM 0 HB2 GLU A 100 -3.629 -1.968 -10.075 1.00 0.17 H new ATOM 0 HB3 GLU A 100 -5.328 -2.397 -10.103 1.00 0.17 H new ATOM 0 HG2 GLU A 100 -4.245 -0.502 -12.210 1.00 0.25 H new ATOM 0 HG3 GLU A 100 -3.966 -2.223 -12.382 1.00 0.25 H new ATOM 1273 N TYR A 101 -6.668 -0.892 -8.182 1.00 0.14 N ATOM 1274 CA TYR A 101 -8.036 -0.922 -7.621 1.00 0.14 C ATOM 1275 C TYR A 101 -8.519 0.513 -7.430 1.00 0.13 C ATOM 1276 O TYR A 101 -9.631 0.865 -7.768 1.00 0.08 O ATOM 1277 CB TYR A 101 -7.988 -1.617 -6.256 1.00 0.15 C ATOM 1278 CG TYR A 101 -9.126 -2.595 -6.135 1.00 0.16 C ATOM 1279 CD1 TYR A 101 -9.370 -3.512 -7.162 1.00 0.14 C ATOM 1280 CD2 TYR A 101 -9.936 -2.584 -4.995 1.00 0.22 C ATOM 1281 CE1 TYR A 101 -10.428 -4.421 -7.050 1.00 0.15 C ATOM 1282 CE2 TYR A 101 -10.992 -3.493 -4.881 1.00 0.24 C ATOM 1283 CZ TYR A 101 -11.240 -4.410 -5.908 1.00 0.20 C ATOM 1284 OH TYR A 101 -12.285 -5.299 -5.794 1.00 0.22 O ATOM 0 H TYR A 101 -5.964 -1.366 -7.616 1.00 0.14 H new ATOM 0 HA TYR A 101 -8.710 -1.456 -8.291 1.00 0.14 H new ATOM 0 HB2 TYR A 101 -7.037 -2.136 -6.137 1.00 0.15 H new ATOM 0 HB3 TYR A 101 -8.049 -0.876 -5.459 1.00 0.15 H new ATOM 0 HD1 TYR A 101 -8.742 -3.519 -8.041 1.00 0.14 H new ATOM 0 HD2 TYR A 101 -9.746 -1.874 -4.204 1.00 0.22 H new ATOM 0 HE1 TYR A 101 -10.618 -5.130 -7.842 1.00 0.15 H new ATOM 0 HE2 TYR A 101 -11.616 -3.487 -4.000 1.00 0.24 H new ATOM 0 HH TYR A 101 -12.364 -5.593 -4.863 1.00 0.22 H new ATOM 1294 N LEU A 102 -7.684 1.328 -6.858 1.00 0.20 N ATOM 1295 CA LEU A 102 -8.061 2.743 -6.593 1.00 0.20 C ATOM 1296 C LEU A 102 -7.631 3.650 -7.752 1.00 0.19 C ATOM 1297 O LEU A 102 -7.748 4.858 -7.674 1.00 0.22 O ATOM 1298 CB LEU A 102 -7.376 3.192 -5.300 1.00 0.28 C ATOM 1299 CG LEU A 102 -7.542 2.105 -4.228 1.00 0.27 C ATOM 1300 CD1 LEU A 102 -6.231 1.922 -3.468 1.00 0.28 C ATOM 1301 CD2 LEU A 102 -8.648 2.517 -3.264 1.00 0.27 C ATOM 0 H LEU A 102 -6.743 1.072 -6.558 1.00 0.20 H new ATOM 0 HA LEU A 102 -9.144 2.816 -6.495 1.00 0.20 H new ATOM 0 HB2 LEU A 102 -6.318 3.379 -5.483 1.00 0.28 H new ATOM 0 HB3 LEU A 102 -7.810 4.130 -4.953 1.00 0.28 H new ATOM 0 HG LEU A 102 -7.807 1.161 -4.704 1.00 0.27 H new ATOM 0 HD11 LEU A 102 -6.355 1.150 -2.709 1.00 0.28 H new ATOM 0 HD12 LEU A 102 -5.446 1.625 -4.163 1.00 0.28 H new ATOM 0 HD13 LEU A 102 -5.954 2.861 -2.988 1.00 0.28 H new ATOM 0 HD21 LEU A 102 -8.770 1.749 -2.501 1.00 0.27 H new ATOM 0 HD22 LEU A 102 -8.383 3.462 -2.789 1.00 0.27 H new ATOM 0 HD23 LEU A 102 -9.583 2.636 -3.812 1.00 0.27 H new ATOM 1313 N GLN A 103 -7.131 3.092 -8.821 1.00 0.19 N ATOM 1314 CA GLN A 103 -6.698 3.945 -9.963 1.00 0.20 C ATOM 1315 C GLN A 103 -7.823 4.028 -10.997 1.00 0.37 C ATOM 1316 O GLN A 103 -7.584 4.049 -12.189 1.00 1.27 O ATOM 1317 CB GLN A 103 -5.452 3.335 -10.609 1.00 0.27 C ATOM 1318 CG GLN A 103 -4.806 4.359 -11.545 1.00 0.32 C ATOM 1319 CD GLN A 103 -3.898 3.634 -12.539 1.00 0.72 C ATOM 1320 OE1 GLN A 103 -3.644 2.455 -12.398 1.00 1.12 O ATOM 1321 NE2 GLN A 103 -3.395 4.292 -13.547 1.00 1.36 N ATOM 0 H GLN A 103 -7.004 2.088 -8.952 1.00 0.19 H new ATOM 0 HA GLN A 103 -6.467 4.947 -9.601 1.00 0.20 H new ATOM 0 HB2 GLN A 103 -4.742 3.032 -9.839 1.00 0.27 H new ATOM 0 HB3 GLN A 103 -5.721 2.437 -11.166 1.00 0.27 H new ATOM 0 HG2 GLN A 103 -5.575 4.917 -12.078 1.00 0.32 H new ATOM 0 HG3 GLN A 103 -4.229 5.082 -10.969 1.00 0.32 H new ATOM 0 HE21 GLN A 103 -3.608 5.282 -13.667 1.00 1.36 H new ATOM 0 HE22 GLN A 103 -2.789 3.816 -14.215 1.00 1.36 H new ATOM 1330 N ASN A 104 -9.051 4.073 -10.554 1.00 0.48 N ATOM 1331 CA ASN A 104 -10.186 4.154 -11.516 1.00 0.27 C ATOM 1332 C ASN A 104 -11.512 4.095 -10.755 1.00 0.25 C ATOM 1333 O ASN A 104 -12.485 4.717 -11.134 1.00 0.23 O ATOM 1334 CB ASN A 104 -10.109 2.982 -12.497 1.00 0.20 C ATOM 1335 CG ASN A 104 -10.089 3.516 -13.930 1.00 0.37 C ATOM 1336 OD1 ASN A 104 -10.937 4.296 -14.313 1.00 0.57 O ATOM 1337 ND2 ASN A 104 -9.148 3.126 -14.747 1.00 1.47 N ATOM 0 H ASN A 104 -9.316 4.057 -9.569 1.00 0.48 H new ATOM 0 HA ASN A 104 -10.126 5.094 -12.065 1.00 0.27 H new ATOM 0 HB2 ASN A 104 -9.213 2.392 -12.305 1.00 0.20 H new ATOM 0 HB3 ASN A 104 -10.963 2.320 -12.356 1.00 0.20 H new ATOM 0 HD21 ASN A 104 -9.126 3.477 -15.705 1.00 1.47 H new ATOM 0 HD22 ASN A 104 -8.434 2.471 -14.428 1.00 1.47 H new ATOM 1344 N ARG A 105 -11.563 3.349 -9.684 1.00 0.26 N ATOM 1345 CA ARG A 105 -12.829 3.249 -8.904 1.00 0.24 C ATOM 1346 C ARG A 105 -13.169 4.614 -8.299 1.00 0.23 C ATOM 1347 O ARG A 105 -14.321 4.942 -8.097 1.00 0.24 O ATOM 1348 CB ARG A 105 -12.662 2.217 -7.788 1.00 0.23 C ATOM 1349 CG ARG A 105 -13.196 0.864 -8.264 1.00 0.77 C ATOM 1350 CD ARG A 105 -13.042 -0.168 -7.146 1.00 1.48 C ATOM 1351 NE ARG A 105 -14.307 -0.942 -7.008 1.00 1.71 N ATOM 1352 CZ ARG A 105 -14.809 -1.161 -5.824 1.00 2.34 C ATOM 1353 NH1 ARG A 105 -14.019 -1.438 -4.822 1.00 3.53 N ATOM 1354 NH2 ARG A 105 -16.100 -1.102 -5.643 1.00 2.21 N ATOM 0 H ARG A 105 -10.783 2.805 -9.316 1.00 0.26 H new ATOM 0 HA ARG A 105 -13.638 2.937 -9.565 1.00 0.24 H new ATOM 0 HB2 ARG A 105 -11.611 2.129 -7.513 1.00 0.23 H new ATOM 0 HB3 ARG A 105 -13.199 2.539 -6.896 1.00 0.23 H new ATOM 0 HG2 ARG A 105 -14.245 0.954 -8.548 1.00 0.77 H new ATOM 0 HG3 ARG A 105 -12.653 0.538 -9.151 1.00 0.77 H new ATOM 0 HD2 ARG A 105 -12.214 -0.841 -7.369 1.00 1.48 H new ATOM 0 HD3 ARG A 105 -12.804 0.331 -6.206 1.00 1.48 H new ATOM 0 HE ARG A 105 -14.780 -1.300 -7.838 1.00 1.71 H new ATOM 0 HH11 ARG A 105 -13.010 -1.483 -4.965 1.00 3.53 H new ATOM 0 HH12 ARG A 105 -14.411 -1.609 -3.896 1.00 3.53 H new ATOM 0 HH21 ARG A 105 -16.715 -0.885 -6.427 1.00 2.21 H new ATOM 0 HH22 ARG A 105 -16.494 -1.273 -4.718 1.00 2.21 H new ATOM 1368 N PHE A 106 -12.178 5.414 -8.012 1.00 0.27 N ATOM 1369 CA PHE A 106 -12.451 6.758 -7.425 1.00 0.34 C ATOM 1370 C PHE A 106 -12.937 7.700 -8.531 1.00 0.44 C ATOM 1371 O PHE A 106 -12.171 8.446 -9.108 1.00 0.48 O ATOM 1372 CB PHE A 106 -11.169 7.315 -6.802 1.00 0.29 C ATOM 1373 CG PHE A 106 -11.269 7.247 -5.295 1.00 0.41 C ATOM 1374 CD1 PHE A 106 -11.931 8.261 -4.591 1.00 1.15 C ATOM 1375 CD2 PHE A 106 -10.697 6.173 -4.601 1.00 0.49 C ATOM 1376 CE1 PHE A 106 -12.022 8.201 -3.196 1.00 1.32 C ATOM 1377 CE2 PHE A 106 -10.788 6.114 -3.205 1.00 0.41 C ATOM 1378 CZ PHE A 106 -11.450 7.127 -2.503 1.00 0.72 C ATOM 0 H PHE A 106 -11.192 5.196 -8.158 1.00 0.27 H new ATOM 0 HA PHE A 106 -13.217 6.673 -6.654 1.00 0.34 H new ATOM 0 HB2 PHE A 106 -10.307 6.743 -7.146 1.00 0.29 H new ATOM 0 HB3 PHE A 106 -11.016 8.346 -7.121 1.00 0.29 H new ATOM 0 HD1 PHE A 106 -12.372 9.090 -5.125 1.00 1.15 H new ATOM 0 HD2 PHE A 106 -10.186 5.391 -5.143 1.00 0.49 H new ATOM 0 HE1 PHE A 106 -12.533 8.983 -2.654 1.00 1.32 H new ATOM 0 HE2 PHE A 106 -10.347 5.286 -2.670 1.00 0.41 H new ATOM 0 HZ PHE A 106 -11.520 7.081 -1.426 1.00 0.72 H new ATOM 1388 N GLU A 107 -14.208 7.667 -8.833 1.00 0.48 N ATOM 1389 CA GLU A 107 -14.748 8.553 -9.905 1.00 0.58 C ATOM 1390 C GLU A 107 -15.026 9.951 -9.340 1.00 0.62 C ATOM 1391 O GLU A 107 -15.199 10.903 -10.075 1.00 0.70 O ATOM 1392 CB GLU A 107 -16.049 7.959 -10.444 1.00 0.69 C ATOM 1393 CG GLU A 107 -17.073 7.862 -9.311 1.00 1.49 C ATOM 1394 CD GLU A 107 -17.667 6.453 -9.278 1.00 2.41 C ATOM 1395 OE1 GLU A 107 -16.904 5.508 -9.381 1.00 3.16 O ATOM 1396 OE2 GLU A 107 -18.875 6.343 -9.151 1.00 2.76 O ATOM 0 H GLU A 107 -14.896 7.064 -8.383 1.00 0.48 H new ATOM 0 HA GLU A 107 -14.015 8.630 -10.708 1.00 0.58 H new ATOM 0 HB2 GLU A 107 -16.439 8.581 -11.249 1.00 0.69 H new ATOM 0 HB3 GLU A 107 -15.863 6.971 -10.866 1.00 0.69 H new ATOM 0 HG2 GLU A 107 -16.598 8.090 -8.357 1.00 1.49 H new ATOM 0 HG3 GLU A 107 -17.864 8.598 -9.457 1.00 1.49 H new ATOM 1403 N SER A 108 -15.066 10.087 -8.042 1.00 0.60 N ATOM 1404 CA SER A 108 -15.324 11.426 -7.442 1.00 0.66 C ATOM 1405 C SER A 108 -13.987 12.121 -7.221 1.00 0.50 C ATOM 1406 O SER A 108 -13.816 13.288 -7.518 1.00 0.48 O ATOM 1407 CB SER A 108 -16.043 11.262 -6.101 1.00 0.80 C ATOM 1408 OG SER A 108 -17.438 11.120 -6.330 1.00 0.74 O ATOM 0 H SER A 108 -14.931 9.329 -7.372 1.00 0.60 H new ATOM 0 HA SER A 108 -15.951 12.018 -8.109 1.00 0.66 H new ATOM 0 HB2 SER A 108 -15.659 10.389 -5.574 1.00 0.80 H new ATOM 0 HB3 SER A 108 -15.853 12.127 -5.466 1.00 0.80 H new ATOM 0 HG SER A 108 -17.901 11.013 -5.473 1.00 0.74 H new ATOM 1414 N SER A 109 -13.032 11.399 -6.713 1.00 0.40 N ATOM 1415 CA SER A 109 -11.689 11.985 -6.478 1.00 0.30 C ATOM 1416 C SER A 109 -10.685 11.249 -7.357 1.00 0.18 C ATOM 1417 O SER A 109 -9.589 10.933 -6.940 1.00 0.19 O ATOM 1418 CB SER A 109 -11.306 11.812 -5.008 1.00 0.46 C ATOM 1419 OG SER A 109 -10.238 12.696 -4.694 1.00 0.68 O ATOM 0 H SER A 109 -13.126 10.418 -6.448 1.00 0.40 H new ATOM 0 HA SER A 109 -11.694 13.048 -6.721 1.00 0.30 H new ATOM 0 HB2 SER A 109 -12.165 12.020 -4.370 1.00 0.46 H new ATOM 0 HB3 SER A 109 -11.008 10.781 -4.817 1.00 0.46 H new ATOM 0 HG SER A 109 -10.593 13.597 -4.542 1.00 0.68 H new ATOM 1425 N GLU A 110 -11.065 10.958 -8.572 1.00 0.15 N ATOM 1426 CA GLU A 110 -10.161 10.224 -9.497 1.00 0.12 C ATOM 1427 C GLU A 110 -8.754 10.836 -9.471 1.00 0.12 C ATOM 1428 O GLU A 110 -7.771 10.163 -9.709 1.00 0.49 O ATOM 1429 CB GLU A 110 -10.726 10.307 -10.914 1.00 0.23 C ATOM 1430 CG GLU A 110 -9.831 9.514 -11.863 1.00 0.30 C ATOM 1431 CD GLU A 110 -10.555 9.312 -13.195 1.00 0.41 C ATOM 1432 OE1 GLU A 110 -11.365 10.155 -13.541 1.00 0.84 O ATOM 1433 OE2 GLU A 110 -10.286 8.316 -13.847 1.00 0.39 O ATOM 0 H GLU A 110 -11.974 11.201 -8.965 1.00 0.15 H new ATOM 0 HA GLU A 110 -10.094 9.183 -9.180 1.00 0.12 H new ATOM 0 HB2 GLU A 110 -11.741 9.910 -10.937 1.00 0.23 H new ATOM 0 HB3 GLU A 110 -10.783 11.347 -11.234 1.00 0.23 H new ATOM 0 HG2 GLU A 110 -8.892 10.044 -12.024 1.00 0.30 H new ATOM 0 HG3 GLU A 110 -9.580 8.549 -11.423 1.00 0.30 H new ATOM 1440 N GLU A 111 -8.653 12.108 -9.192 1.00 0.27 N ATOM 1441 CA GLU A 111 -7.315 12.762 -9.161 1.00 0.18 C ATOM 1442 C GLU A 111 -6.545 12.321 -7.912 1.00 0.15 C ATOM 1443 O GLU A 111 -5.408 11.900 -7.993 1.00 0.18 O ATOM 1444 CB GLU A 111 -7.499 14.280 -9.134 1.00 0.20 C ATOM 1445 CG GLU A 111 -6.270 14.950 -9.747 1.00 0.95 C ATOM 1446 CD GLU A 111 -6.684 16.258 -10.424 1.00 0.91 C ATOM 1447 OE1 GLU A 111 -7.287 17.083 -9.757 1.00 1.09 O ATOM 1448 OE2 GLU A 111 -6.392 16.414 -11.598 1.00 1.42 O ATOM 0 H GLU A 111 -9.441 12.722 -8.984 1.00 0.27 H new ATOM 0 HA GLU A 111 -6.752 12.472 -10.048 1.00 0.18 H new ATOM 0 HB2 GLU A 111 -8.394 14.559 -9.690 1.00 0.20 H new ATOM 0 HB3 GLU A 111 -7.640 14.622 -8.109 1.00 0.20 H new ATOM 0 HG2 GLU A 111 -5.527 15.148 -8.974 1.00 0.95 H new ATOM 0 HG3 GLU A 111 -5.804 14.284 -10.473 1.00 0.95 H new ATOM 1455 N GLN A 112 -7.151 12.416 -6.758 1.00 0.29 N ATOM 1456 CA GLN A 112 -6.442 12.004 -5.513 1.00 0.30 C ATOM 1457 C GLN A 112 -5.987 10.550 -5.651 1.00 0.23 C ATOM 1458 O GLN A 112 -4.929 10.174 -5.189 1.00 0.22 O ATOM 1459 CB GLN A 112 -7.384 12.141 -4.314 1.00 0.40 C ATOM 1460 CG GLN A 112 -7.687 13.622 -4.072 1.00 0.56 C ATOM 1461 CD GLN A 112 -6.618 14.222 -3.158 1.00 1.00 C ATOM 1462 OE1 GLN A 112 -5.438 14.058 -3.393 1.00 2.03 O ATOM 1463 NE2 GLN A 112 -6.985 14.916 -2.115 1.00 0.96 N ATOM 0 H GLN A 112 -8.102 12.760 -6.625 1.00 0.29 H new ATOM 0 HA GLN A 112 -5.573 12.644 -5.357 1.00 0.30 H new ATOM 0 HB2 GLN A 112 -8.309 11.595 -4.500 1.00 0.40 H new ATOM 0 HB3 GLN A 112 -6.927 11.702 -3.427 1.00 0.40 H new ATOM 0 HG2 GLN A 112 -7.711 14.158 -5.021 1.00 0.56 H new ATOM 0 HG3 GLN A 112 -8.672 13.733 -3.618 1.00 0.56 H new ATOM 0 HE21 GLN A 112 -7.976 15.054 -1.917 1.00 0.96 H new ATOM 0 HE22 GLN A 112 -6.281 15.320 -1.498 1.00 0.96 H new ATOM 1472 N ALA A 113 -6.774 9.735 -6.294 1.00 0.21 N ATOM 1473 CA ALA A 113 -6.380 8.310 -6.473 1.00 0.16 C ATOM 1474 C ALA A 113 -5.160 8.248 -7.393 1.00 0.14 C ATOM 1475 O ALA A 113 -4.239 7.483 -7.177 1.00 0.17 O ATOM 1476 CB ALA A 113 -7.538 7.534 -7.102 1.00 0.19 C ATOM 0 H ALA A 113 -7.672 9.993 -6.703 1.00 0.21 H new ATOM 0 HA ALA A 113 -6.138 7.867 -5.507 1.00 0.16 H new ATOM 0 HB1 ALA A 113 -7.249 6.491 -7.233 1.00 0.19 H new ATOM 0 HB2 ALA A 113 -8.410 7.590 -6.450 1.00 0.19 H new ATOM 0 HB3 ALA A 113 -7.782 7.967 -8.072 1.00 0.19 H new ATOM 1482 N ARG A 114 -5.144 9.060 -8.412 1.00 0.17 N ATOM 1483 CA ARG A 114 -3.984 9.067 -9.342 1.00 0.26 C ATOM 1484 C ARG A 114 -2.757 9.643 -8.622 1.00 0.27 C ATOM 1485 O ARG A 114 -1.641 9.518 -9.085 1.00 0.54 O ATOM 1486 CB ARG A 114 -4.317 9.937 -10.557 1.00 0.31 C ATOM 1487 CG ARG A 114 -3.582 9.400 -11.786 1.00 0.33 C ATOM 1488 CD ARG A 114 -4.172 10.030 -13.050 1.00 0.46 C ATOM 1489 NE ARG A 114 -4.067 9.065 -14.180 1.00 0.87 N ATOM 1490 CZ ARG A 114 -5.073 8.902 -14.996 1.00 1.66 C ATOM 1491 NH1 ARG A 114 -5.578 9.927 -15.626 1.00 1.61 N ATOM 1492 NH2 ARG A 114 -5.575 7.711 -15.181 1.00 2.84 N ATOM 0 H ARG A 114 -5.887 9.721 -8.641 1.00 0.17 H new ATOM 0 HA ARG A 114 -3.769 8.049 -9.668 1.00 0.26 H new ATOM 0 HB2 ARG A 114 -5.392 9.936 -10.734 1.00 0.31 H new ATOM 0 HB3 ARG A 114 -4.026 10.970 -10.369 1.00 0.31 H new ATOM 0 HG2 ARG A 114 -2.519 9.628 -11.715 1.00 0.33 H new ATOM 0 HG3 ARG A 114 -3.673 8.315 -11.832 1.00 0.33 H new ATOM 0 HD2 ARG A 114 -5.215 10.299 -12.883 1.00 0.46 H new ATOM 0 HD3 ARG A 114 -3.641 10.950 -13.293 1.00 0.46 H new ATOM 0 HE ARG A 114 -3.209 8.531 -14.316 1.00 0.87 H new ATOM 0 HH11 ARG A 114 -5.187 10.858 -15.481 1.00 1.61 H new ATOM 0 HH12 ARG A 114 -6.364 9.797 -16.263 1.00 1.61 H new ATOM 0 HH21 ARG A 114 -5.181 6.909 -14.688 1.00 2.84 H new ATOM 0 HH22 ARG A 114 -6.361 7.582 -15.818 1.00 2.84 H new ATOM 1506 N ALA A 115 -2.954 10.279 -7.495 1.00 0.11 N ATOM 1507 CA ALA A 115 -1.800 10.863 -6.757 1.00 0.18 C ATOM 1508 C ALA A 115 -1.205 9.822 -5.806 1.00 0.19 C ATOM 1509 O ALA A 115 -0.009 9.772 -5.600 1.00 0.30 O ATOM 1510 CB ALA A 115 -2.274 12.073 -5.951 1.00 0.20 C ATOM 0 H ALA A 115 -3.864 10.418 -7.057 1.00 0.11 H new ATOM 0 HA ALA A 115 -1.037 11.171 -7.472 1.00 0.18 H new ATOM 0 HB1 ALA A 115 -1.431 12.502 -5.410 1.00 0.20 H new ATOM 0 HB2 ALA A 115 -2.690 12.820 -6.627 1.00 0.20 H new ATOM 0 HB3 ALA A 115 -3.040 11.760 -5.241 1.00 0.20 H new ATOM 1516 N VAL A 116 -2.024 8.990 -5.216 1.00 0.10 N ATOM 1517 CA VAL A 116 -1.483 7.965 -4.278 1.00 0.11 C ATOM 1518 C VAL A 116 -0.755 6.876 -5.079 1.00 0.10 C ATOM 1519 O VAL A 116 0.231 6.329 -4.639 1.00 0.13 O ATOM 1520 CB VAL A 116 -2.628 7.347 -3.460 1.00 0.14 C ATOM 1521 CG1 VAL A 116 -3.530 6.497 -4.356 1.00 0.55 C ATOM 1522 CG2 VAL A 116 -2.042 6.467 -2.353 1.00 0.68 C ATOM 0 H VAL A 116 -3.036 8.976 -5.342 1.00 0.10 H new ATOM 0 HA VAL A 116 -0.779 8.436 -3.591 1.00 0.11 H new ATOM 0 HB VAL A 116 -3.222 8.151 -3.024 1.00 0.14 H new ATOM 0 HG11 VAL A 116 -4.335 6.068 -3.759 1.00 0.55 H new ATOM 0 HG12 VAL A 116 -3.954 7.121 -5.142 1.00 0.55 H new ATOM 0 HG13 VAL A 116 -2.944 5.695 -4.806 1.00 0.55 H new ATOM 0 HG21 VAL A 116 -2.852 6.027 -1.771 1.00 0.68 H new ATOM 0 HG22 VAL A 116 -1.442 5.673 -2.798 1.00 0.68 H new ATOM 0 HG23 VAL A 116 -1.414 7.073 -1.700 1.00 0.68 H new ATOM 1532 N GLN A 117 -1.246 6.558 -6.248 1.00 0.09 N ATOM 1533 CA GLN A 117 -0.607 5.513 -7.089 1.00 0.11 C ATOM 1534 C GLN A 117 0.607 6.098 -7.814 1.00 0.16 C ATOM 1535 O GLN A 117 1.647 5.479 -7.893 1.00 0.31 O ATOM 1536 CB GLN A 117 -1.621 5.025 -8.122 1.00 0.10 C ATOM 1537 CG GLN A 117 -1.030 3.850 -8.892 1.00 0.41 C ATOM 1538 CD GLN A 117 -0.486 4.335 -10.236 1.00 0.86 C ATOM 1539 OE1 GLN A 117 -0.467 5.520 -10.506 1.00 1.54 O ATOM 1540 NE2 GLN A 117 -0.041 3.462 -11.096 1.00 1.08 N ATOM 0 H GLN A 117 -2.075 6.987 -6.658 1.00 0.09 H new ATOM 0 HA GLN A 117 -0.282 4.685 -6.458 1.00 0.11 H new ATOM 0 HB2 GLN A 117 -2.544 4.723 -7.628 1.00 0.10 H new ATOM 0 HB3 GLN A 117 -1.876 5.833 -8.808 1.00 0.10 H new ATOM 0 HG2 GLN A 117 -0.232 3.387 -8.312 1.00 0.41 H new ATOM 0 HG3 GLN A 117 -1.792 3.087 -9.051 1.00 0.41 H new ATOM 0 HE21 GLN A 117 -0.057 2.468 -10.868 1.00 1.08 H new ATOM 0 HE22 GLN A 117 0.324 3.773 -11.996 1.00 1.08 H new ATOM 1549 N MET A 118 0.484 7.283 -8.353 1.00 0.19 N ATOM 1550 CA MET A 118 1.637 7.897 -9.075 1.00 0.32 C ATOM 1551 C MET A 118 2.802 8.075 -8.102 1.00 0.40 C ATOM 1552 O MET A 118 3.912 7.659 -8.366 1.00 0.36 O ATOM 1553 CB MET A 118 1.223 9.261 -9.634 1.00 0.40 C ATOM 1554 CG MET A 118 0.391 9.065 -10.902 1.00 0.31 C ATOM 1555 SD MET A 118 1.493 8.958 -12.335 1.00 0.59 S ATOM 1556 CE MET A 118 1.382 10.695 -12.835 1.00 1.23 C ATOM 0 H MET A 118 -0.363 7.851 -8.325 1.00 0.19 H new ATOM 0 HA MET A 118 1.942 7.249 -9.896 1.00 0.32 H new ATOM 0 HB2 MET A 118 0.646 9.810 -8.890 1.00 0.40 H new ATOM 0 HB3 MET A 118 2.108 9.858 -9.856 1.00 0.40 H new ATOM 0 HG2 MET A 118 -0.207 8.157 -10.821 1.00 0.31 H new ATOM 0 HG3 MET A 118 -0.305 9.895 -11.026 1.00 0.31 H new ATOM 0 HE1 MET A 118 1.998 10.859 -13.719 1.00 1.23 H new ATOM 0 HE2 MET A 118 0.345 10.942 -13.064 1.00 1.23 H new ATOM 0 HE3 MET A 118 1.736 11.331 -12.023 1.00 1.23 H new ATOM 1566 N SER A 119 2.562 8.679 -6.972 1.00 0.51 N ATOM 1567 CA SER A 119 3.661 8.860 -5.984 1.00 0.59 C ATOM 1568 C SER A 119 4.101 7.478 -5.504 1.00 0.57 C ATOM 1569 O SER A 119 5.273 7.165 -5.460 1.00 0.54 O ATOM 1570 CB SER A 119 3.157 9.682 -4.798 1.00 0.69 C ATOM 1571 OG SER A 119 2.805 10.984 -5.246 1.00 1.62 O ATOM 0 H SER A 119 1.656 9.054 -6.691 1.00 0.51 H new ATOM 0 HA SER A 119 4.499 9.385 -6.442 1.00 0.59 H new ATOM 0 HB2 SER A 119 2.294 9.195 -4.344 1.00 0.69 H new ATOM 0 HB3 SER A 119 3.928 9.745 -4.030 1.00 0.69 H new ATOM 0 HG SER A 119 2.476 11.512 -4.489 1.00 1.62 H new ATOM 1577 N THR A 120 3.157 6.640 -5.173 1.00 0.61 N ATOM 1578 CA THR A 120 3.494 5.262 -4.720 1.00 0.61 C ATOM 1579 C THR A 120 4.276 4.548 -5.836 1.00 0.57 C ATOM 1580 O THR A 120 4.960 3.572 -5.601 1.00 0.55 O ATOM 1581 CB THR A 120 2.187 4.511 -4.408 1.00 0.68 C ATOM 1582 OG1 THR A 120 1.646 4.999 -3.190 1.00 1.96 O ATOM 1583 CG2 THR A 120 2.442 3.011 -4.276 1.00 1.09 C ATOM 0 H THR A 120 2.160 6.853 -5.197 1.00 0.61 H new ATOM 0 HA THR A 120 4.110 5.291 -3.821 1.00 0.61 H new ATOM 0 HB THR A 120 1.487 4.677 -5.227 1.00 0.68 H new ATOM 0 HG1 THR A 120 0.862 5.555 -3.380 1.00 1.96 H new ATOM 0 HG21 THR A 120 1.504 2.501 -4.055 1.00 1.09 H new ATOM 0 HG22 THR A 120 2.853 2.628 -5.210 1.00 1.09 H new ATOM 0 HG23 THR A 120 3.151 2.832 -3.468 1.00 1.09 H new ATOM 1591 N LYS A 121 4.192 5.041 -7.043 1.00 0.56 N ATOM 1592 CA LYS A 121 4.937 4.415 -8.168 1.00 0.53 C ATOM 1593 C LYS A 121 6.356 4.975 -8.150 1.00 0.45 C ATOM 1594 O LYS A 121 7.316 4.303 -8.470 1.00 0.40 O ATOM 1595 CB LYS A 121 4.232 4.769 -9.484 1.00 0.58 C ATOM 1596 CG LYS A 121 5.094 4.354 -10.678 1.00 1.57 C ATOM 1597 CD LYS A 121 5.346 2.845 -10.630 1.00 1.32 C ATOM 1598 CE LYS A 121 4.991 2.222 -11.982 1.00 1.00 C ATOM 1599 NZ LYS A 121 6.188 1.531 -12.542 1.00 2.41 N ATOM 0 H LYS A 121 3.634 5.857 -7.297 1.00 0.56 H new ATOM 0 HA LYS A 121 4.969 3.330 -8.073 1.00 0.53 H new ATOM 0 HB2 LYS A 121 3.266 4.267 -9.533 1.00 0.58 H new ATOM 0 HB3 LYS A 121 4.037 5.841 -9.523 1.00 0.58 H new ATOM 0 HG2 LYS A 121 4.595 4.620 -11.610 1.00 1.57 H new ATOM 0 HG3 LYS A 121 6.042 4.892 -10.659 1.00 1.57 H new ATOM 0 HD2 LYS A 121 6.391 2.648 -10.391 1.00 1.32 H new ATOM 0 HD3 LYS A 121 4.747 2.391 -9.841 1.00 1.32 H new ATOM 0 HE2 LYS A 121 4.171 1.513 -11.864 1.00 1.00 H new ATOM 0 HE3 LYS A 121 4.648 2.994 -12.671 1.00 1.00 H new ATOM 0 HZ1 LYS A 121 5.946 1.108 -13.461 1.00 2.41 H new ATOM 0 HZ2 LYS A 121 6.958 2.219 -12.669 1.00 2.41 H new ATOM 0 HZ3 LYS A 121 6.496 0.784 -11.887 1.00 2.41 H new ATOM 1613 N VAL A 122 6.483 6.211 -7.761 1.00 0.46 N ATOM 1614 CA VAL A 122 7.821 6.851 -7.690 1.00 0.40 C ATOM 1615 C VAL A 122 8.666 6.145 -6.625 1.00 0.35 C ATOM 1616 O VAL A 122 9.875 6.109 -6.714 1.00 0.28 O ATOM 1617 CB VAL A 122 7.649 8.325 -7.327 1.00 0.41 C ATOM 1618 CG1 VAL A 122 9.016 8.979 -7.140 1.00 0.34 C ATOM 1619 CG2 VAL A 122 6.899 9.035 -8.454 1.00 0.47 C ATOM 0 H VAL A 122 5.706 6.811 -7.486 1.00 0.46 H new ATOM 0 HA VAL A 122 8.324 6.772 -8.654 1.00 0.40 H new ATOM 0 HB VAL A 122 7.085 8.404 -6.398 1.00 0.41 H new ATOM 0 HG11 VAL A 122 8.884 10.030 -6.881 1.00 0.34 H new ATOM 0 HG12 VAL A 122 9.555 8.473 -6.339 1.00 0.34 H new ATOM 0 HG13 VAL A 122 9.586 8.902 -8.066 1.00 0.34 H new ATOM 0 HG21 VAL A 122 6.773 10.088 -8.201 1.00 0.47 H new ATOM 0 HG22 VAL A 122 7.468 8.950 -9.380 1.00 0.47 H new ATOM 0 HG23 VAL A 122 5.920 8.574 -8.586 1.00 0.47 H new ATOM 1629 N LEU A 123 8.048 5.582 -5.621 1.00 0.39 N ATOM 1630 CA LEU A 123 8.843 4.875 -4.572 1.00 0.34 C ATOM 1631 C LEU A 123 9.186 3.470 -5.074 1.00 0.36 C ATOM 1632 O LEU A 123 10.186 2.889 -4.701 1.00 0.32 O ATOM 1633 CB LEU A 123 8.033 4.759 -3.270 1.00 0.37 C ATOM 1634 CG LEU A 123 7.885 6.129 -2.587 1.00 0.54 C ATOM 1635 CD1 LEU A 123 9.235 6.850 -2.521 1.00 0.89 C ATOM 1636 CD2 LEU A 123 6.891 6.980 -3.371 1.00 0.92 C ATOM 0 H LEU A 123 7.038 5.580 -5.481 1.00 0.39 H new ATOM 0 HA LEU A 123 9.753 5.442 -4.372 1.00 0.34 H new ATOM 0 HB2 LEU A 123 7.047 4.349 -3.487 1.00 0.37 H new ATOM 0 HB3 LEU A 123 8.526 4.062 -2.592 1.00 0.37 H new ATOM 0 HG LEU A 123 7.523 5.976 -1.570 1.00 0.54 H new ATOM 0 HD11 LEU A 123 9.108 7.817 -2.034 1.00 0.89 H new ATOM 0 HD12 LEU A 123 9.942 6.247 -1.951 1.00 0.89 H new ATOM 0 HD13 LEU A 123 9.617 7.000 -3.531 1.00 0.89 H new ATOM 0 HD21 LEU A 123 6.784 7.952 -2.889 1.00 0.92 H new ATOM 0 HD22 LEU A 123 7.254 7.118 -4.389 1.00 0.92 H new ATOM 0 HD23 LEU A 123 5.923 6.479 -3.396 1.00 0.92 H new ATOM 1648 N ILE A 124 8.358 2.924 -5.920 1.00 0.43 N ATOM 1649 CA ILE A 124 8.617 1.555 -6.458 1.00 0.46 C ATOM 1650 C ILE A 124 9.862 1.586 -7.345 1.00 0.36 C ATOM 1651 O ILE A 124 10.708 0.716 -7.274 1.00 0.36 O ATOM 1652 CB ILE A 124 7.411 1.093 -7.287 1.00 0.55 C ATOM 1653 CG1 ILE A 124 6.185 0.971 -6.381 1.00 0.92 C ATOM 1654 CG2 ILE A 124 7.704 -0.271 -7.913 1.00 0.25 C ATOM 1655 CD1 ILE A 124 4.913 1.077 -7.224 1.00 1.31 C ATOM 0 H ILE A 124 7.507 3.368 -6.265 1.00 0.43 H new ATOM 0 HA ILE A 124 8.775 0.863 -5.631 1.00 0.46 H new ATOM 0 HB ILE A 124 7.220 1.823 -8.074 1.00 0.55 H new ATOM 0 HG12 ILE A 124 6.205 0.018 -5.852 1.00 0.92 H new ATOM 0 HG13 ILE A 124 6.199 1.756 -5.625 1.00 0.92 H new ATOM 0 HG21 ILE A 124 6.844 -0.594 -8.500 1.00 0.25 H new ATOM 0 HG22 ILE A 124 8.578 -0.194 -8.560 1.00 0.25 H new ATOM 0 HG23 ILE A 124 7.899 -0.999 -7.125 1.00 0.25 H new ATOM 0 HD11 ILE A 124 4.040 0.990 -6.578 1.00 1.31 H new ATOM 0 HD12 ILE A 124 4.893 2.041 -7.733 1.00 1.31 H new ATOM 0 HD13 ILE A 124 4.899 0.276 -7.963 1.00 1.31 H new ATOM 1667 N GLN A 125 9.979 2.575 -8.184 1.00 0.29 N ATOM 1668 CA GLN A 125 11.161 2.654 -9.075 1.00 0.18 C ATOM 1669 C GLN A 125 12.343 3.241 -8.302 1.00 0.16 C ATOM 1670 O GLN A 125 13.466 2.793 -8.428 1.00 0.15 O ATOM 1671 CB GLN A 125 10.817 3.553 -10.259 1.00 0.16 C ATOM 1672 CG GLN A 125 10.394 2.686 -11.445 1.00 0.15 C ATOM 1673 CD GLN A 125 10.666 3.436 -12.752 1.00 0.20 C ATOM 1674 OE1 GLN A 125 10.948 4.617 -12.740 1.00 0.66 O ATOM 1675 NE2 GLN A 125 10.590 2.794 -13.886 1.00 0.60 N ATOM 0 H GLN A 125 9.304 3.332 -8.289 1.00 0.29 H new ATOM 0 HA GLN A 125 11.431 1.660 -9.432 1.00 0.18 H new ATOM 0 HB2 GLN A 125 10.013 4.238 -9.989 1.00 0.16 H new ATOM 0 HB3 GLN A 125 11.678 4.164 -10.529 1.00 0.16 H new ATOM 0 HG2 GLN A 125 10.942 1.744 -11.434 1.00 0.15 H new ATOM 0 HG3 GLN A 125 9.335 2.440 -11.369 1.00 0.15 H new ATOM 0 HE21 GLN A 125 10.353 1.802 -13.896 1.00 0.60 H new ATOM 0 HE22 GLN A 125 10.768 3.284 -14.763 1.00 0.60 H new ATOM 1684 N PHE A 126 12.097 4.240 -7.500 1.00 0.21 N ATOM 1685 CA PHE A 126 13.201 4.860 -6.713 1.00 0.20 C ATOM 1686 C PHE A 126 13.849 3.805 -5.817 1.00 0.21 C ATOM 1687 O PHE A 126 15.012 3.893 -5.483 1.00 0.28 O ATOM 1688 CB PHE A 126 12.636 5.983 -5.838 1.00 0.21 C ATOM 1689 CG PHE A 126 12.557 7.263 -6.638 1.00 0.22 C ATOM 1690 CD1 PHE A 126 12.057 7.243 -7.945 1.00 0.17 C ATOM 1691 CD2 PHE A 126 12.986 8.469 -6.070 1.00 0.28 C ATOM 1692 CE1 PHE A 126 11.986 8.429 -8.684 1.00 0.19 C ATOM 1693 CE2 PHE A 126 12.915 9.654 -6.811 1.00 0.29 C ATOM 1694 CZ PHE A 126 12.415 9.634 -8.117 1.00 0.24 C ATOM 0 H PHE A 126 11.177 4.655 -7.355 1.00 0.21 H new ATOM 0 HA PHE A 126 13.946 5.265 -7.397 1.00 0.20 H new ATOM 0 HB2 PHE A 126 11.646 5.709 -5.473 1.00 0.21 H new ATOM 0 HB3 PHE A 126 13.269 6.129 -4.963 1.00 0.21 H new ATOM 0 HD1 PHE A 126 11.726 6.313 -8.383 1.00 0.17 H new ATOM 0 HD2 PHE A 126 13.371 8.485 -5.061 1.00 0.28 H new ATOM 0 HE1 PHE A 126 11.600 8.414 -9.693 1.00 0.19 H new ATOM 0 HE2 PHE A 126 13.246 10.584 -6.374 1.00 0.29 H new ATOM 0 HZ PHE A 126 12.360 10.549 -8.688 1.00 0.24 H new ATOM 1704 N LEU A 127 13.104 2.810 -5.420 1.00 0.22 N ATOM 1705 CA LEU A 127 13.676 1.750 -4.539 1.00 0.24 C ATOM 1706 C LEU A 127 14.339 0.668 -5.394 1.00 0.28 C ATOM 1707 O LEU A 127 15.368 0.127 -5.042 1.00 0.30 O ATOM 1708 CB LEU A 127 12.552 1.115 -3.716 1.00 0.28 C ATOM 1709 CG LEU A 127 12.270 1.971 -2.479 1.00 0.70 C ATOM 1710 CD1 LEU A 127 11.102 1.367 -1.697 1.00 1.24 C ATOM 1711 CD2 LEU A 127 13.514 2.005 -1.588 1.00 0.34 C ATOM 0 H LEU A 127 12.122 2.684 -5.667 1.00 0.22 H new ATOM 0 HA LEU A 127 14.417 2.196 -3.876 1.00 0.24 H new ATOM 0 HB2 LEU A 127 11.650 1.026 -4.322 1.00 0.28 H new ATOM 0 HB3 LEU A 127 12.834 0.106 -3.415 1.00 0.28 H new ATOM 0 HG LEU A 127 12.016 2.985 -2.789 1.00 0.70 H new ATOM 0 HD11 LEU A 127 10.900 1.976 -0.816 1.00 1.24 H new ATOM 0 HD12 LEU A 127 10.215 1.340 -2.330 1.00 1.24 H new ATOM 0 HD13 LEU A 127 11.357 0.354 -1.387 1.00 1.24 H new ATOM 0 HD21 LEU A 127 13.314 2.615 -0.707 1.00 0.34 H new ATOM 0 HD22 LEU A 127 13.767 0.991 -1.278 1.00 0.34 H new ATOM 0 HD23 LEU A 127 14.348 2.434 -2.144 1.00 0.34 H new ATOM 1723 N GLN A 128 13.750 0.343 -6.511 1.00 0.33 N ATOM 1724 CA GLN A 128 14.330 -0.712 -7.388 1.00 0.37 C ATOM 1725 C GLN A 128 15.791 -0.382 -7.722 1.00 0.22 C ATOM 1726 O GLN A 128 16.660 -1.229 -7.646 1.00 0.39 O ATOM 1727 CB GLN A 128 13.525 -0.787 -8.687 1.00 0.47 C ATOM 1728 CG GLN A 128 12.508 -1.928 -8.596 1.00 0.57 C ATOM 1729 CD GLN A 128 11.440 -1.746 -9.677 1.00 1.26 C ATOM 1730 OE1 GLN A 128 11.122 -0.635 -10.052 1.00 2.23 O ATOM 1731 NE2 GLN A 128 10.870 -2.798 -10.198 1.00 1.15 N ATOM 0 H GLN A 128 12.888 0.765 -6.856 1.00 0.33 H new ATOM 0 HA GLN A 128 14.290 -1.668 -6.866 1.00 0.37 H new ATOM 0 HB2 GLN A 128 13.011 0.158 -8.863 1.00 0.47 H new ATOM 0 HB3 GLN A 128 14.194 -0.949 -9.532 1.00 0.47 H new ATOM 0 HG2 GLN A 128 13.009 -2.887 -8.723 1.00 0.57 H new ATOM 0 HG3 GLN A 128 12.044 -1.939 -7.610 1.00 0.57 H new ATOM 0 HE21 GLN A 128 11.137 -3.731 -9.883 1.00 1.15 H new ATOM 0 HE22 GLN A 128 10.158 -2.687 -10.920 1.00 1.15 H new ATOM 1740 N LYS A 129 16.069 0.835 -8.113 1.00 0.11 N ATOM 1741 CA LYS A 129 17.472 1.201 -8.477 1.00 0.35 C ATOM 1742 C LYS A 129 18.287 1.552 -7.225 1.00 0.40 C ATOM 1743 O LYS A 129 19.464 1.263 -7.148 1.00 0.46 O ATOM 1744 CB LYS A 129 17.454 2.399 -9.431 1.00 0.51 C ATOM 1745 CG LYS A 129 16.804 3.598 -8.739 1.00 1.93 C ATOM 1746 CD LYS A 129 15.978 4.391 -9.754 1.00 1.43 C ATOM 1747 CE LYS A 129 16.904 5.267 -10.597 1.00 2.05 C ATOM 1748 NZ LYS A 129 16.798 6.682 -10.143 1.00 3.29 N ATOM 0 H LYS A 129 15.388 1.590 -8.196 1.00 0.11 H new ATOM 0 HA LYS A 129 17.940 0.346 -8.964 1.00 0.35 H new ATOM 0 HB2 LYS A 129 18.470 2.649 -9.735 1.00 0.51 H new ATOM 0 HB3 LYS A 129 16.903 2.147 -10.337 1.00 0.51 H new ATOM 0 HG2 LYS A 129 16.167 3.258 -7.923 1.00 1.93 H new ATOM 0 HG3 LYS A 129 17.570 4.237 -8.300 1.00 1.93 H new ATOM 0 HD2 LYS A 129 15.421 3.709 -10.397 1.00 1.43 H new ATOM 0 HD3 LYS A 129 15.246 5.011 -9.237 1.00 1.43 H new ATOM 0 HE2 LYS A 129 17.933 4.920 -10.505 1.00 2.05 H new ATOM 0 HE3 LYS A 129 16.635 5.191 -11.651 1.00 2.05 H new ATOM 0 HZ1 LYS A 129 17.428 7.279 -10.716 1.00 3.29 H new ATOM 0 HZ2 LYS A 129 15.817 7.009 -10.253 1.00 3.29 H new ATOM 0 HZ3 LYS A 129 17.075 6.747 -9.143 1.00 3.29 H new ATOM 1762 N LYS A 130 17.683 2.171 -6.247 1.00 0.42 N ATOM 1763 CA LYS A 130 18.448 2.529 -5.014 1.00 0.53 C ATOM 1764 C LYS A 130 18.530 1.316 -4.081 1.00 0.59 C ATOM 1765 O LYS A 130 19.051 1.401 -2.987 1.00 0.72 O ATOM 1766 CB LYS A 130 17.750 3.705 -4.309 1.00 0.64 C ATOM 1767 CG LYS A 130 18.364 3.968 -2.923 1.00 1.20 C ATOM 1768 CD LYS A 130 19.891 4.061 -3.022 1.00 2.17 C ATOM 1769 CE LYS A 130 20.496 4.031 -1.619 1.00 2.67 C ATOM 1770 NZ LYS A 130 21.857 4.635 -1.653 1.00 3.96 N ATOM 0 H LYS A 130 16.700 2.444 -6.246 1.00 0.42 H new ATOM 0 HA LYS A 130 19.462 2.825 -5.283 1.00 0.53 H new ATOM 0 HB2 LYS A 130 17.834 4.602 -4.923 1.00 0.64 H new ATOM 0 HB3 LYS A 130 16.687 3.490 -4.203 1.00 0.64 H new ATOM 0 HG2 LYS A 130 17.963 4.894 -2.511 1.00 1.20 H new ATOM 0 HG3 LYS A 130 18.086 3.167 -2.238 1.00 1.20 H new ATOM 0 HD2 LYS A 130 20.279 3.232 -3.614 1.00 2.17 H new ATOM 0 HD3 LYS A 130 20.178 4.980 -3.533 1.00 2.17 H new ATOM 0 HE2 LYS A 130 19.860 4.580 -0.925 1.00 2.67 H new ATOM 0 HE3 LYS A 130 20.551 3.004 -1.257 1.00 2.67 H new ATOM 0 HZ1 LYS A 130 22.270 4.615 -0.699 1.00 3.96 H new ATOM 0 HZ2 LYS A 130 22.461 4.093 -2.303 1.00 3.96 H new ATOM 0 HZ3 LYS A 130 21.792 5.620 -1.981 1.00 3.96 H new ATOM 1784 N ALA A 131 18.042 0.182 -4.501 1.00 0.58 N ATOM 1785 CA ALA A 131 18.119 -1.013 -3.625 1.00 0.68 C ATOM 1786 C ALA A 131 19.444 -1.739 -3.872 1.00 0.94 C ATOM 1787 O ALA A 131 19.477 -2.941 -4.046 1.00 1.20 O ATOM 1788 CB ALA A 131 16.952 -1.949 -3.934 1.00 0.72 C ATOM 0 H ALA A 131 17.597 0.034 -5.407 1.00 0.58 H new ATOM 0 HA ALA A 131 18.065 -0.705 -2.581 1.00 0.68 H new ATOM 0 HB1 ALA A 131 17.009 -2.827 -3.290 1.00 0.72 H new ATOM 0 HB2 ALA A 131 16.011 -1.429 -3.755 1.00 0.72 H new ATOM 0 HB3 ALA A 131 17.002 -2.261 -4.977 1.00 0.72 H new ATOM 1794 N LYS A 132 20.543 -1.017 -3.885 1.00 0.94 N ATOM 1795 CA LYS A 132 21.874 -1.669 -4.114 1.00 1.21 C ATOM 1796 C LYS A 132 21.994 -2.906 -3.219 1.00 1.47 C ATOM 1797 O LYS A 132 21.598 -2.890 -2.071 1.00 1.44 O ATOM 1798 CB LYS A 132 22.992 -0.683 -3.769 1.00 1.33 C ATOM 1799 CG LYS A 132 22.708 -0.041 -2.409 1.00 1.32 C ATOM 1800 CD LYS A 132 24.026 0.187 -1.667 1.00 1.74 C ATOM 1801 CE LYS A 132 24.398 -1.075 -0.886 1.00 3.23 C ATOM 1802 NZ LYS A 132 25.583 -1.719 -1.520 1.00 4.91 N ATOM 0 H LYS A 132 20.575 -0.007 -3.747 1.00 0.94 H new ATOM 0 HA LYS A 132 21.959 -1.964 -5.160 1.00 1.21 H new ATOM 0 HB2 LYS A 132 23.952 -1.199 -3.746 1.00 1.33 H new ATOM 0 HB3 LYS A 132 23.063 0.086 -4.538 1.00 1.33 H new ATOM 0 HG2 LYS A 132 22.186 0.906 -2.544 1.00 1.32 H new ATOM 0 HG3 LYS A 132 22.054 -0.684 -1.821 1.00 1.32 H new ATOM 0 HD2 LYS A 132 24.816 0.435 -2.376 1.00 1.74 H new ATOM 0 HD3 LYS A 132 23.931 1.033 -0.987 1.00 1.74 H new ATOM 0 HE2 LYS A 132 24.619 -0.822 0.151 1.00 3.23 H new ATOM 0 HE3 LYS A 132 23.557 -1.769 -0.873 1.00 3.23 H new ATOM 0 HZ1 LYS A 132 26.012 -2.391 -0.852 1.00 4.91 H new ATOM 0 HZ2 LYS A 132 25.285 -2.226 -2.378 1.00 4.91 H new ATOM 0 HZ3 LYS A 132 26.280 -0.990 -1.773 1.00 4.91 H new ATOM 1816 N ASN A 133 22.509 -3.988 -3.738 1.00 1.75 N ATOM 1817 CA ASN A 133 22.613 -5.224 -2.912 1.00 2.02 C ATOM 1818 C ASN A 133 21.215 -5.574 -2.406 1.00 1.80 C ATOM 1819 O ASN A 133 21.018 -5.965 -1.273 1.00 1.82 O ATOM 1820 CB ASN A 133 23.551 -4.983 -1.726 1.00 2.21 C ATOM 1821 CG ASN A 133 24.668 -6.028 -1.736 1.00 2.77 C ATOM 1822 OD1 ASN A 133 25.829 -5.693 -1.611 1.00 2.13 O ATOM 1823 ND2 ASN A 133 24.364 -7.289 -1.882 1.00 4.17 N ATOM 0 H ASN A 133 22.860 -4.069 -4.692 1.00 1.75 H new ATOM 0 HA ASN A 133 23.016 -6.043 -3.508 1.00 2.02 H new ATOM 0 HB2 ASN A 133 23.976 -3.981 -1.783 1.00 2.21 H new ATOM 0 HB3 ASN A 133 22.994 -5.040 -0.791 1.00 2.21 H new ATOM 0 HD21 ASN A 133 25.101 -7.994 -1.891 1.00 4.17 H new ATOM 0 HD22 ASN A 133 23.389 -7.570 -1.987 1.00 4.17 H new ATOM 1830 N LEU A 134 20.245 -5.407 -3.257 1.00 1.62 N ATOM 1831 CA LEU A 134 18.834 -5.692 -2.878 1.00 1.48 C ATOM 1832 C LEU A 134 17.961 -5.578 -4.126 1.00 1.71 C ATOM 1833 O LEU A 134 18.442 -5.672 -5.238 1.00 2.04 O ATOM 1834 CB LEU A 134 18.374 -4.668 -1.835 1.00 0.99 C ATOM 1835 CG LEU A 134 17.858 -5.393 -0.589 1.00 1.20 C ATOM 1836 CD1 LEU A 134 18.530 -4.809 0.655 1.00 0.95 C ATOM 1837 CD2 LEU A 134 16.342 -5.206 -0.481 1.00 1.50 C ATOM 0 H LEU A 134 20.371 -5.080 -4.215 1.00 1.62 H new ATOM 0 HA LEU A 134 18.752 -6.695 -2.458 1.00 1.48 H new ATOM 0 HB2 LEU A 134 19.201 -4.011 -1.568 1.00 0.99 H new ATOM 0 HB3 LEU A 134 17.588 -4.038 -2.252 1.00 0.99 H new ATOM 0 HG LEU A 134 18.090 -6.455 -0.665 1.00 1.20 H new ATOM 0 HD11 LEU A 134 18.163 -5.325 1.543 1.00 0.95 H new ATOM 0 HD12 LEU A 134 19.610 -4.939 0.580 1.00 0.95 H new ATOM 0 HD13 LEU A 134 18.297 -3.747 0.730 1.00 0.95 H new ATOM 0 HD21 LEU A 134 15.974 -5.722 0.406 1.00 1.50 H new ATOM 0 HD22 LEU A 134 16.111 -4.143 -0.405 1.00 1.50 H new ATOM 0 HD23 LEU A 134 15.860 -5.619 -1.367 1.00 1.50 H new ATOM 1849 N ASP A 135 16.684 -5.379 -3.944 1.00 1.77 N ATOM 1850 CA ASP A 135 15.749 -5.255 -5.107 1.00 2.40 C ATOM 1851 C ASP A 135 15.458 -6.640 -5.674 1.00 1.53 C ATOM 1852 O ASP A 135 16.202 -7.579 -5.464 1.00 1.17 O ATOM 1853 CB ASP A 135 16.361 -4.377 -6.207 1.00 3.36 C ATOM 1854 CG ASP A 135 15.253 -3.880 -7.137 1.00 5.37 C ATOM 1855 OD1 ASP A 135 14.113 -3.846 -6.703 1.00 6.04 O ATOM 1856 OD2 ASP A 135 15.563 -3.543 -8.268 1.00 6.49 O ATOM 0 H ASP A 135 16.240 -5.296 -3.029 1.00 1.77 H new ATOM 0 HA ASP A 135 14.826 -4.790 -4.761 1.00 2.40 H new ATOM 0 HB2 ASP A 135 16.885 -3.531 -5.763 1.00 3.36 H new ATOM 0 HB3 ASP A 135 17.098 -4.946 -6.773 1.00 3.36 H new ATOM 1861 N ALA A 136 14.371 -6.781 -6.381 1.00 1.85 N ATOM 1862 CA ALA A 136 14.016 -8.109 -6.950 1.00 1.95 C ATOM 1863 C ALA A 136 13.612 -9.011 -5.807 1.00 1.87 C ATOM 1864 O ALA A 136 14.097 -10.114 -5.646 1.00 3.04 O ATOM 1865 CB ALA A 136 15.207 -8.705 -7.691 1.00 1.80 C ATOM 0 H ALA A 136 13.712 -6.031 -6.589 1.00 1.85 H new ATOM 0 HA ALA A 136 13.196 -8.005 -7.661 1.00 1.95 H new ATOM 0 HB1 ALA A 136 14.931 -9.676 -8.101 1.00 1.80 H new ATOM 0 HB2 ALA A 136 15.501 -8.039 -8.502 1.00 1.80 H new ATOM 0 HB3 ALA A 136 16.041 -8.827 -7.000 1.00 1.80 H new ATOM 1871 N ILE A 137 12.728 -8.516 -5.008 1.00 1.50 N ATOM 1872 CA ILE A 137 12.238 -9.267 -3.839 1.00 1.68 C ATOM 1873 C ILE A 137 11.059 -10.151 -4.288 1.00 2.19 C ATOM 1874 O ILE A 137 9.984 -10.131 -3.722 1.00 2.58 O ATOM 1875 CB ILE A 137 11.819 -8.215 -2.803 1.00 1.91 C ATOM 1876 CG1 ILE A 137 13.068 -7.652 -2.118 1.00 1.50 C ATOM 1877 CG2 ILE A 137 10.902 -8.808 -1.748 1.00 2.55 C ATOM 1878 CD1 ILE A 137 13.953 -6.934 -3.139 1.00 0.91 C ATOM 0 H ILE A 137 12.311 -7.592 -5.121 1.00 1.50 H new ATOM 0 HA ILE A 137 12.988 -9.927 -3.403 1.00 1.68 H new ATOM 0 HB ILE A 137 11.279 -7.425 -3.324 1.00 1.91 H new ATOM 0 HG12 ILE A 137 12.777 -6.960 -1.328 1.00 1.50 H new ATOM 0 HG13 ILE A 137 13.627 -8.459 -1.645 1.00 1.50 H new ATOM 0 HG21 ILE A 137 10.625 -8.035 -1.031 1.00 2.55 H new ATOM 0 HG22 ILE A 137 10.003 -9.199 -2.225 1.00 2.55 H new ATOM 0 HG23 ILE A 137 11.418 -9.616 -1.230 1.00 2.55 H new ATOM 0 HD11 ILE A 137 14.837 -6.538 -2.640 1.00 0.91 H new ATOM 0 HD12 ILE A 137 14.258 -7.637 -3.914 1.00 0.91 H new ATOM 0 HD13 ILE A 137 13.395 -6.114 -3.592 1.00 0.91 H new ATOM 1890 N THR A 138 11.255 -10.927 -5.321 1.00 2.36 N ATOM 1891 CA THR A 138 10.158 -11.800 -5.827 1.00 2.78 C ATOM 1892 C THR A 138 8.925 -10.938 -6.111 1.00 2.41 C ATOM 1893 O THR A 138 8.864 -9.782 -5.745 1.00 2.20 O ATOM 1894 CB THR A 138 9.814 -12.885 -4.795 1.00 3.13 C ATOM 1895 OG1 THR A 138 10.464 -12.608 -3.562 1.00 3.22 O ATOM 1896 CG2 THR A 138 10.281 -14.242 -5.320 1.00 3.74 C ATOM 0 H THR A 138 12.132 -10.993 -5.838 1.00 2.36 H new ATOM 0 HA THR A 138 10.484 -12.291 -6.744 1.00 2.78 H new ATOM 0 HB THR A 138 8.736 -12.899 -4.634 1.00 3.13 H new ATOM 0 HG1 THR A 138 10.100 -11.783 -3.178 1.00 3.22 H new ATOM 0 HG21 THR A 138 10.040 -15.016 -4.592 1.00 3.74 H new ATOM 0 HG22 THR A 138 9.778 -14.460 -6.262 1.00 3.74 H new ATOM 0 HG23 THR A 138 11.359 -14.219 -5.481 1.00 3.74 H new ATOM 1904 N THR A 139 7.948 -11.477 -6.776 1.00 2.32 N ATOM 1905 CA THR A 139 6.742 -10.671 -7.087 1.00 1.95 C ATOM 1906 C THR A 139 5.706 -11.556 -7.797 1.00 1.68 C ATOM 1907 O THR A 139 6.074 -12.478 -8.496 1.00 1.73 O ATOM 1908 CB THR A 139 7.163 -9.503 -7.984 1.00 1.72 C ATOM 1909 OG1 THR A 139 6.085 -8.588 -8.119 1.00 1.44 O ATOM 1910 CG2 THR A 139 7.577 -10.016 -9.366 1.00 1.63 C ATOM 0 H THR A 139 7.932 -12.438 -7.117 1.00 2.32 H new ATOM 0 HA THR A 139 6.291 -10.282 -6.174 1.00 1.95 H new ATOM 0 HB THR A 139 8.013 -8.998 -7.525 1.00 1.72 H new ATOM 0 HG1 THR A 139 6.299 -7.930 -8.813 1.00 1.44 H new ATOM 0 HG21 THR A 139 7.874 -9.175 -9.993 1.00 1.63 H new ATOM 0 HG22 THR A 139 8.416 -10.705 -9.262 1.00 1.63 H new ATOM 0 HG23 THR A 139 6.737 -10.534 -9.828 1.00 1.63 H new ATOM 1958 N THR A 143 0.434 -11.108 -13.886 1.00 0.61 N ATOM 1959 CA THR A 143 -0.335 -12.317 -14.282 1.00 0.31 C ATOM 1960 C THR A 143 -0.917 -12.958 -13.024 1.00 0.32 C ATOM 1961 O THR A 143 -2.067 -13.348 -12.990 1.00 0.30 O ATOM 1962 CB THR A 143 0.593 -13.313 -14.981 1.00 0.59 C ATOM 1963 OG1 THR A 143 1.687 -13.616 -14.125 1.00 1.19 O ATOM 1964 CG2 THR A 143 1.113 -12.704 -16.283 1.00 0.86 C ATOM 0 HA THR A 143 -1.137 -12.039 -14.966 1.00 0.31 H new ATOM 0 HB THR A 143 0.043 -14.227 -15.207 1.00 0.59 H new ATOM 0 HG1 THR A 143 1.994 -12.796 -13.684 1.00 1.19 H new ATOM 0 HG21 THR A 143 1.774 -13.415 -16.779 1.00 0.86 H new ATOM 0 HG22 THR A 143 0.273 -12.472 -16.937 1.00 0.86 H new ATOM 0 HG23 THR A 143 1.664 -11.790 -16.062 1.00 0.86 H new ATOM 1972 N THR A 144 -0.136 -13.055 -11.979 1.00 0.48 N ATOM 1973 CA THR A 144 -0.663 -13.652 -10.724 1.00 0.52 C ATOM 1974 C THR A 144 -1.534 -12.605 -10.037 1.00 0.39 C ATOM 1975 O THR A 144 -2.560 -12.907 -9.455 1.00 0.38 O ATOM 1976 CB THR A 144 0.503 -14.043 -9.816 1.00 0.69 C ATOM 1977 OG1 THR A 144 1.589 -14.494 -10.613 1.00 1.07 O ATOM 1978 CG2 THR A 144 0.066 -15.163 -8.874 1.00 0.80 C ATOM 0 H THR A 144 0.836 -12.748 -11.944 1.00 0.48 H new ATOM 0 HA THR A 144 -1.249 -14.545 -10.939 1.00 0.52 H new ATOM 0 HB THR A 144 0.813 -13.178 -9.230 1.00 0.69 H new ATOM 0 HG1 THR A 144 2.339 -14.744 -10.033 1.00 1.07 H new ATOM 0 HG21 THR A 144 0.899 -15.440 -8.228 1.00 0.80 H new ATOM 0 HG22 THR A 144 -0.769 -14.820 -8.263 1.00 0.80 H new ATOM 0 HG23 THR A 144 -0.244 -16.029 -9.458 1.00 0.80 H new ATOM 1986 N ASN A 145 -1.142 -11.364 -10.129 1.00 0.34 N ATOM 1987 CA ASN A 145 -1.952 -10.285 -9.514 1.00 0.27 C ATOM 1988 C ASN A 145 -3.215 -10.078 -10.350 1.00 0.20 C ATOM 1989 O ASN A 145 -4.122 -9.381 -9.949 1.00 0.18 O ATOM 1990 CB ASN A 145 -1.144 -8.987 -9.462 1.00 0.44 C ATOM 1991 CG ASN A 145 -1.036 -8.527 -8.009 1.00 0.57 C ATOM 1992 OD1 ASN A 145 -0.003 -8.054 -7.581 1.00 0.80 O ATOM 1993 ND2 ASN A 145 -2.074 -8.649 -7.229 1.00 0.51 N ATOM 0 H ASN A 145 -0.295 -11.054 -10.605 1.00 0.34 H new ATOM 0 HA ASN A 145 -2.224 -10.566 -8.497 1.00 0.27 H new ATOM 0 HB2 ASN A 145 -0.151 -9.145 -9.882 1.00 0.44 H new ATOM 0 HB3 ASN A 145 -1.627 -8.218 -10.065 1.00 0.44 H new ATOM 0 HD21 ASN A 145 -2.019 -8.347 -6.256 1.00 0.51 H new ATOM 0 HD22 ASN A 145 -2.940 -9.047 -7.592 1.00 0.51 H new ATOM 2000 N ALA A 146 -3.295 -10.697 -11.501 1.00 0.22 N ATOM 2001 CA ALA A 146 -4.517 -10.560 -12.335 1.00 0.19 C ATOM 2002 C ALA A 146 -5.573 -11.489 -11.752 1.00 0.22 C ATOM 2003 O ALA A 146 -6.758 -11.232 -11.827 1.00 0.25 O ATOM 2004 CB ALA A 146 -4.208 -10.958 -13.780 1.00 0.20 C ATOM 0 H ALA A 146 -2.565 -11.290 -11.895 1.00 0.22 H new ATOM 0 HA ALA A 146 -4.871 -9.529 -12.335 1.00 0.19 H new ATOM 0 HB1 ALA A 146 -5.108 -10.855 -14.386 1.00 0.20 H new ATOM 0 HB2 ALA A 146 -3.427 -10.309 -14.177 1.00 0.20 H new ATOM 0 HB3 ALA A 146 -3.868 -11.993 -13.808 1.00 0.20 H new ATOM 2010 N SER A 147 -5.142 -12.558 -11.140 1.00 0.26 N ATOM 2011 CA SER A 147 -6.103 -13.495 -10.513 1.00 0.33 C ATOM 2012 C SER A 147 -6.560 -12.879 -9.193 1.00 0.28 C ATOM 2013 O SER A 147 -7.721 -12.904 -8.846 1.00 0.25 O ATOM 2014 CB SER A 147 -5.415 -14.836 -10.253 1.00 0.41 C ATOM 2015 OG SER A 147 -6.268 -15.892 -10.678 1.00 0.49 O ATOM 0 H SER A 147 -4.160 -12.820 -11.050 1.00 0.26 H new ATOM 0 HA SER A 147 -6.958 -13.665 -11.167 1.00 0.33 H new ATOM 0 HB2 SER A 147 -4.467 -14.881 -10.789 1.00 0.41 H new ATOM 0 HB3 SER A 147 -5.187 -14.941 -9.192 1.00 0.41 H new ATOM 0 HG SER A 147 -5.829 -16.753 -10.514 1.00 0.49 H new ATOM 2021 N LEU A 148 -5.651 -12.300 -8.458 1.00 0.29 N ATOM 2022 CA LEU A 148 -6.045 -11.660 -7.174 1.00 0.27 C ATOM 2023 C LEU A 148 -7.023 -10.525 -7.484 1.00 0.27 C ATOM 2024 O LEU A 148 -8.001 -10.340 -6.799 1.00 0.26 O ATOM 2025 CB LEU A 148 -4.796 -11.102 -6.469 1.00 0.25 C ATOM 2026 CG LEU A 148 -5.184 -10.005 -5.462 1.00 0.15 C ATOM 2027 CD1 LEU A 148 -6.160 -10.566 -4.425 1.00 0.23 C ATOM 2028 CD2 LEU A 148 -3.936 -9.499 -4.754 1.00 0.13 C ATOM 0 H LEU A 148 -4.659 -12.243 -8.690 1.00 0.29 H new ATOM 0 HA LEU A 148 -6.518 -12.390 -6.517 1.00 0.27 H new ATOM 0 HB2 LEU A 148 -4.273 -11.907 -5.953 1.00 0.25 H new ATOM 0 HB3 LEU A 148 -4.106 -10.696 -7.209 1.00 0.25 H new ATOM 0 HG LEU A 148 -5.661 -9.185 -5.998 1.00 0.15 H new ATOM 0 HD11 LEU A 148 -6.429 -9.782 -3.717 1.00 0.23 H new ATOM 0 HD12 LEU A 148 -7.058 -10.925 -4.927 1.00 0.23 H new ATOM 0 HD13 LEU A 148 -5.689 -11.391 -3.891 1.00 0.23 H new ATOM 0 HD21 LEU A 148 -4.212 -8.722 -4.041 1.00 0.13 H new ATOM 0 HD22 LEU A 148 -3.458 -10.324 -4.225 1.00 0.13 H new ATOM 0 HD23 LEU A 148 -3.243 -9.088 -5.488 1.00 0.13 H new ATOM 2040 N LEU A 149 -6.749 -9.762 -8.504 1.00 0.29 N ATOM 2041 CA LEU A 149 -7.648 -8.632 -8.854 1.00 0.31 C ATOM 2042 C LEU A 149 -8.962 -9.188 -9.387 1.00 0.34 C ATOM 2043 O LEU A 149 -10.009 -8.604 -9.206 1.00 0.33 O ATOM 2044 CB LEU A 149 -6.984 -7.758 -9.919 1.00 0.27 C ATOM 2045 CG LEU A 149 -7.712 -6.415 -10.010 1.00 0.31 C ATOM 2046 CD1 LEU A 149 -7.690 -5.723 -8.644 1.00 0.53 C ATOM 2047 CD2 LEU A 149 -7.014 -5.525 -11.042 1.00 0.29 C ATOM 0 H LEU A 149 -5.938 -9.874 -9.112 1.00 0.29 H new ATOM 0 HA LEU A 149 -7.841 -8.027 -7.968 1.00 0.31 H new ATOM 0 HB2 LEU A 149 -5.935 -7.598 -9.670 1.00 0.27 H new ATOM 0 HB3 LEU A 149 -7.009 -8.263 -10.885 1.00 0.27 H new ATOM 0 HG LEU A 149 -8.745 -6.585 -10.313 1.00 0.31 H new ATOM 0 HD11 LEU A 149 -8.209 -4.767 -8.712 1.00 0.53 H new ATOM 0 HD12 LEU A 149 -8.188 -6.355 -7.908 1.00 0.53 H new ATOM 0 HD13 LEU A 149 -6.657 -5.554 -8.338 1.00 0.53 H new ATOM 0 HD21 LEU A 149 -7.532 -4.568 -11.107 1.00 0.29 H new ATOM 0 HD22 LEU A 149 -5.980 -5.358 -10.739 1.00 0.29 H new ATOM 0 HD23 LEU A 149 -7.032 -6.014 -12.016 1.00 0.29 H new ATOM 2059 N THR A 150 -8.924 -10.325 -10.026 1.00 0.41 N ATOM 2060 CA THR A 150 -10.188 -10.913 -10.537 1.00 0.42 C ATOM 2061 C THR A 150 -11.027 -11.354 -9.325 1.00 0.32 C ATOM 2062 O THR A 150 -12.229 -11.510 -9.408 1.00 0.31 O ATOM 2063 CB THR A 150 -9.866 -12.093 -11.489 1.00 0.52 C ATOM 2064 OG1 THR A 150 -10.913 -12.220 -12.441 1.00 0.81 O ATOM 2065 CG2 THR A 150 -9.715 -13.423 -10.736 1.00 0.84 C ATOM 0 H THR A 150 -8.080 -10.866 -10.214 1.00 0.41 H new ATOM 0 HA THR A 150 -10.760 -10.187 -11.114 1.00 0.42 H new ATOM 0 HB THR A 150 -8.916 -11.875 -11.977 1.00 0.52 H new ATOM 0 HG1 THR A 150 -10.715 -12.964 -13.048 1.00 0.81 H new ATOM 0 HG21 THR A 150 -9.490 -14.219 -11.445 1.00 0.84 H new ATOM 0 HG22 THR A 150 -8.904 -13.341 -10.013 1.00 0.84 H new ATOM 0 HG23 THR A 150 -10.644 -13.653 -10.215 1.00 0.84 H new ATOM 2073 N LYS A 151 -10.384 -11.552 -8.197 1.00 0.28 N ATOM 2074 CA LYS A 151 -11.117 -11.978 -6.972 1.00 0.23 C ATOM 2075 C LYS A 151 -11.599 -10.747 -6.191 1.00 0.12 C ATOM 2076 O LYS A 151 -12.665 -10.759 -5.609 1.00 0.11 O ATOM 2077 CB LYS A 151 -10.185 -12.809 -6.087 1.00 0.33 C ATOM 2078 CG LYS A 151 -10.944 -13.292 -4.850 1.00 0.40 C ATOM 2079 CD LYS A 151 -9.977 -13.394 -3.669 1.00 0.37 C ATOM 2080 CE LYS A 151 -10.153 -12.177 -2.760 1.00 0.80 C ATOM 2081 NZ LYS A 151 -10.713 -12.611 -1.451 1.00 1.14 N ATOM 0 H LYS A 151 -9.378 -11.435 -8.077 1.00 0.28 H new ATOM 0 HA LYS A 151 -11.981 -12.576 -7.262 1.00 0.23 H new ATOM 0 HB2 LYS A 151 -9.802 -13.662 -6.646 1.00 0.33 H new ATOM 0 HB3 LYS A 151 -9.324 -12.212 -5.787 1.00 0.33 H new ATOM 0 HG2 LYS A 151 -11.753 -12.601 -4.613 1.00 0.40 H new ATOM 0 HG3 LYS A 151 -11.400 -14.262 -5.046 1.00 0.40 H new ATOM 0 HD2 LYS A 151 -10.165 -14.310 -3.109 1.00 0.37 H new ATOM 0 HD3 LYS A 151 -8.950 -13.446 -4.030 1.00 0.37 H new ATOM 0 HE2 LYS A 151 -9.195 -11.680 -2.611 1.00 0.80 H new ATOM 0 HE3 LYS A 151 -10.818 -11.452 -3.230 1.00 0.80 H new ATOM 0 HZ1 LYS A 151 -10.833 -11.783 -0.833 1.00 1.14 H new ATOM 0 HZ2 LYS A 151 -11.636 -13.067 -1.602 1.00 1.14 H new ATOM 0 HZ3 LYS A 151 -10.063 -13.287 -1.002 1.00 1.14 H new ATOM 2095 N LEU A 152 -10.838 -9.678 -6.172 1.00 0.09 N ATOM 2096 CA LEU A 152 -11.289 -8.472 -5.429 1.00 0.08 C ATOM 2097 C LEU A 152 -12.510 -7.911 -6.140 1.00 0.09 C ATOM 2098 O LEU A 152 -13.465 -7.479 -5.526 1.00 0.11 O ATOM 2099 CB LEU A 152 -10.189 -7.400 -5.427 1.00 0.20 C ATOM 2100 CG LEU A 152 -8.871 -7.984 -4.912 1.00 0.34 C ATOM 2101 CD1 LEU A 152 -7.704 -7.131 -5.423 1.00 0.48 C ATOM 2102 CD2 LEU A 152 -8.864 -7.968 -3.384 1.00 0.70 C ATOM 0 H LEU A 152 -9.934 -9.594 -6.636 1.00 0.09 H new ATOM 0 HA LEU A 152 -11.520 -8.745 -4.399 1.00 0.08 H new ATOM 0 HB2 LEU A 152 -10.051 -7.010 -6.436 1.00 0.20 H new ATOM 0 HB3 LEU A 152 -10.492 -6.561 -4.800 1.00 0.20 H new ATOM 0 HG LEU A 152 -8.768 -9.009 -5.269 1.00 0.34 H new ATOM 0 HD11 LEU A 152 -6.764 -7.544 -5.058 1.00 0.48 H new ATOM 0 HD12 LEU A 152 -7.702 -7.133 -6.513 1.00 0.48 H new ATOM 0 HD13 LEU A 152 -7.815 -6.109 -5.062 1.00 0.48 H new ATOM 0 HD21 LEU A 152 -7.925 -8.384 -3.020 1.00 0.70 H new ATOM 0 HD22 LEU A 152 -8.967 -6.942 -3.030 1.00 0.70 H new ATOM 0 HD23 LEU A 152 -9.695 -8.566 -3.010 1.00 0.70 H new ATOM 2114 N GLN A 153 -12.473 -7.903 -7.442 1.00 0.10 N ATOM 2115 CA GLN A 153 -13.613 -7.358 -8.215 1.00 0.11 C ATOM 2116 C GLN A 153 -14.758 -8.374 -8.257 1.00 0.07 C ATOM 2117 O GLN A 153 -15.902 -8.022 -8.465 1.00 0.14 O ATOM 2118 CB GLN A 153 -13.157 -7.043 -9.642 1.00 0.17 C ATOM 2119 CG GLN A 153 -12.530 -5.648 -9.685 1.00 0.25 C ATOM 2120 CD GLN A 153 -12.778 -5.018 -11.057 1.00 0.69 C ATOM 2121 OE1 GLN A 153 -13.194 -5.689 -11.981 1.00 1.62 O ATOM 2122 NE2 GLN A 153 -12.537 -3.747 -11.229 1.00 0.67 N ATOM 0 H GLN A 153 -11.697 -8.253 -8.003 1.00 0.10 H new ATOM 0 HA GLN A 153 -13.966 -6.447 -7.732 1.00 0.11 H new ATOM 0 HB2 GLN A 153 -12.435 -7.788 -9.976 1.00 0.17 H new ATOM 0 HB3 GLN A 153 -14.005 -7.093 -10.325 1.00 0.17 H new ATOM 0 HG2 GLN A 153 -12.958 -5.021 -8.903 1.00 0.25 H new ATOM 0 HG3 GLN A 153 -11.459 -5.713 -9.491 1.00 0.25 H new ATOM 0 HE21 GLN A 153 -12.188 -3.185 -10.453 1.00 0.67 H new ATOM 0 HE22 GLN A 153 -12.698 -3.316 -12.139 1.00 0.67 H new ATOM 2131 N ALA A 154 -14.460 -9.630 -8.069 1.00 0.08 N ATOM 2132 CA ALA A 154 -15.536 -10.661 -8.107 1.00 0.18 C ATOM 2133 C ALA A 154 -16.292 -10.674 -6.777 1.00 0.29 C ATOM 2134 O ALA A 154 -17.416 -11.129 -6.697 1.00 0.92 O ATOM 2135 CB ALA A 154 -14.914 -12.037 -8.356 1.00 0.26 C ATOM 0 H ALA A 154 -13.521 -9.987 -7.891 1.00 0.08 H new ATOM 0 HA ALA A 154 -16.232 -10.424 -8.911 1.00 0.18 H new ATOM 0 HB1 ALA A 154 -15.700 -12.792 -8.384 1.00 0.26 H new ATOM 0 HB2 ALA A 154 -14.384 -12.030 -9.308 1.00 0.26 H new ATOM 0 HB3 ALA A 154 -14.215 -12.271 -7.553 1.00 0.26 H new ATOM 2141 N GLN A 155 -15.688 -10.181 -5.733 1.00 0.48 N ATOM 2142 CA GLN A 155 -16.376 -10.168 -4.412 1.00 0.49 C ATOM 2143 C GLN A 155 -17.729 -9.460 -4.543 1.00 0.46 C ATOM 2144 O GLN A 155 -17.917 -8.614 -5.395 1.00 0.56 O ATOM 2145 CB GLN A 155 -15.505 -9.424 -3.400 1.00 0.50 C ATOM 2146 CG GLN A 155 -14.129 -10.091 -3.326 1.00 0.53 C ATOM 2147 CD GLN A 155 -13.861 -10.553 -1.893 1.00 0.91 C ATOM 2148 OE1 GLN A 155 -14.527 -11.437 -1.393 1.00 1.11 O ATOM 2149 NE2 GLN A 155 -12.903 -9.992 -1.207 1.00 1.29 N ATOM 0 H GLN A 155 -14.747 -9.786 -5.737 1.00 0.48 H new ATOM 0 HA GLN A 155 -16.538 -11.192 -4.074 1.00 0.49 H new ATOM 0 HB2 GLN A 155 -15.400 -8.379 -3.693 1.00 0.50 H new ATOM 0 HB3 GLN A 155 -15.979 -9.434 -2.419 1.00 0.50 H new ATOM 0 HG2 GLN A 155 -14.088 -10.941 -4.007 1.00 0.53 H new ATOM 0 HG3 GLN A 155 -13.356 -9.391 -3.644 1.00 0.53 H new ATOM 0 HE21 GLN A 155 -12.343 -9.250 -1.626 1.00 1.29 H new ATOM 0 HE22 GLN A 155 -12.714 -10.296 -0.252 1.00 1.29 H new ATOM 2158 N ASN A 156 -18.672 -9.799 -3.706 1.00 0.36 N ATOM 2159 CA ASN A 156 -20.010 -9.144 -3.784 1.00 0.32 C ATOM 2160 C ASN A 156 -19.841 -7.630 -3.661 1.00 0.31 C ATOM 2161 O ASN A 156 -18.760 -7.137 -3.414 1.00 0.58 O ATOM 2162 CB ASN A 156 -20.893 -9.654 -2.643 1.00 0.32 C ATOM 2163 CG ASN A 156 -21.953 -10.604 -3.204 1.00 0.46 C ATOM 2164 OD1 ASN A 156 -22.788 -10.204 -3.991 1.00 1.07 O ATOM 2165 ND2 ASN A 156 -21.956 -11.855 -2.832 1.00 0.60 N ATOM 0 H ASN A 156 -18.574 -10.501 -2.972 1.00 0.36 H new ATOM 0 HA ASN A 156 -20.478 -9.381 -4.739 1.00 0.32 H new ATOM 0 HB2 ASN A 156 -20.284 -10.169 -1.900 1.00 0.32 H new ATOM 0 HB3 ASN A 156 -21.372 -8.816 -2.137 1.00 0.32 H new ATOM 0 HD21 ASN A 156 -22.659 -12.495 -3.202 1.00 0.60 H new ATOM 0 HD22 ASN A 156 -21.256 -12.192 -2.171 1.00 0.60 H new ATOM 2172 N GLN A 157 -20.901 -6.888 -3.827 1.00 0.08 N ATOM 2173 CA GLN A 157 -20.794 -5.409 -3.712 1.00 0.11 C ATOM 2174 C GLN A 157 -20.350 -5.061 -2.291 1.00 0.09 C ATOM 2175 O GLN A 157 -19.640 -4.102 -2.062 1.00 0.13 O ATOM 2176 CB GLN A 157 -22.159 -4.777 -3.990 1.00 0.16 C ATOM 2177 CG GLN A 157 -22.066 -3.257 -3.837 1.00 0.29 C ATOM 2178 CD GLN A 157 -23.469 -2.673 -3.667 1.00 1.42 C ATOM 2179 OE1 GLN A 157 -24.414 -3.146 -4.266 1.00 1.75 O ATOM 2180 NE2 GLN A 157 -23.645 -1.654 -2.870 1.00 2.57 N ATOM 0 H GLN A 157 -21.834 -7.242 -4.037 1.00 0.08 H new ATOM 0 HA GLN A 157 -20.070 -5.029 -4.432 1.00 0.11 H new ATOM 0 HB2 GLN A 157 -22.489 -5.031 -4.997 1.00 0.16 H new ATOM 0 HB3 GLN A 157 -22.902 -5.177 -3.300 1.00 0.16 H new ATOM 0 HG2 GLN A 157 -21.449 -3.005 -2.974 1.00 0.29 H new ATOM 0 HG3 GLN A 157 -21.583 -2.822 -4.712 1.00 0.29 H new ATOM 0 HE21 GLN A 157 -22.851 -1.257 -2.367 1.00 2.57 H new ATOM 0 HE22 GLN A 157 -24.576 -1.255 -2.750 1.00 2.57 H new ATOM 2189 N TRP A 158 -20.767 -5.844 -1.338 1.00 0.07 N ATOM 2190 CA TRP A 158 -20.384 -5.587 0.075 1.00 0.14 C ATOM 2191 C TRP A 158 -18.881 -5.822 0.247 1.00 0.09 C ATOM 2192 O TRP A 158 -18.133 -4.923 0.585 1.00 0.09 O ATOM 2193 CB TRP A 158 -21.156 -6.548 0.979 1.00 0.21 C ATOM 2194 CG TRP A 158 -20.938 -6.174 2.408 1.00 0.41 C ATOM 2195 CD1 TRP A 158 -20.014 -6.733 3.222 1.00 0.34 C ATOM 2196 CD2 TRP A 158 -21.635 -5.172 3.206 1.00 0.92 C ATOM 2197 NE1 TRP A 158 -20.097 -6.139 4.468 1.00 0.52 N ATOM 2198 CE2 TRP A 158 -21.081 -5.170 4.508 1.00 0.92 C ATOM 2199 CE3 TRP A 158 -22.680 -4.272 2.929 1.00 1.42 C ATOM 2200 CZ2 TRP A 158 -21.550 -4.309 5.501 1.00 1.37 C ATOM 2201 CZ3 TRP A 158 -23.154 -3.404 3.926 1.00 1.88 C ATOM 2202 CH2 TRP A 158 -22.589 -3.421 5.208 1.00 1.85 C ATOM 0 H TRP A 158 -21.363 -6.659 -1.480 1.00 0.07 H new ATOM 0 HA TRP A 158 -20.620 -4.557 0.341 1.00 0.14 H new ATOM 0 HB2 TRP A 158 -22.219 -6.512 0.741 1.00 0.21 H new ATOM 0 HB3 TRP A 158 -20.825 -7.572 0.806 1.00 0.21 H new ATOM 0 HD1 TRP A 158 -19.324 -7.516 2.944 1.00 0.34 H new ATOM 0 HE1 TRP A 158 -19.504 -6.386 5.261 1.00 0.52 H new ATOM 0 HE3 TRP A 158 -23.121 -4.248 1.943 1.00 1.42 H new ATOM 0 HZ2 TRP A 158 -21.113 -4.329 6.489 1.00 1.37 H new ATOM 0 HZ3 TRP A 158 -23.959 -2.719 3.703 1.00 1.88 H new ATOM 0 HH2 TRP A 158 -22.956 -2.749 5.969 1.00 1.85 H new ATOM 2213 N LEU A 159 -18.434 -7.025 0.012 1.00 0.10 N ATOM 2214 CA LEU A 159 -16.982 -7.324 0.156 1.00 0.12 C ATOM 2215 C LEU A 159 -16.171 -6.415 -0.776 1.00 0.11 C ATOM 2216 O LEU A 159 -14.982 -6.240 -0.603 1.00 0.13 O ATOM 2217 CB LEU A 159 -16.728 -8.788 -0.206 1.00 0.14 C ATOM 2218 CG LEU A 159 -17.154 -9.682 0.959 1.00 0.30 C ATOM 2219 CD1 LEU A 159 -17.009 -11.151 0.556 1.00 0.54 C ATOM 2220 CD2 LEU A 159 -16.261 -9.395 2.169 1.00 0.73 C ATOM 0 H LEU A 159 -19.013 -7.815 -0.274 1.00 0.10 H new ATOM 0 HA LEU A 159 -16.675 -7.145 1.186 1.00 0.12 H new ATOM 0 HB2 LEU A 159 -17.285 -9.053 -1.105 1.00 0.14 H new ATOM 0 HB3 LEU A 159 -15.672 -8.941 -0.429 1.00 0.14 H new ATOM 0 HG LEU A 159 -18.194 -9.478 1.214 1.00 0.30 H new ATOM 0 HD11 LEU A 159 -17.313 -11.788 1.387 1.00 0.54 H new ATOM 0 HD12 LEU A 159 -17.641 -11.355 -0.308 1.00 0.54 H new ATOM 0 HD13 LEU A 159 -15.969 -11.358 0.302 1.00 0.54 H new ATOM 0 HD21 LEU A 159 -16.562 -10.031 3.002 1.00 0.73 H new ATOM 0 HD22 LEU A 159 -15.222 -9.601 1.912 1.00 0.73 H new ATOM 0 HD23 LEU A 159 -16.363 -8.348 2.456 1.00 0.73 H new ATOM 2232 N GLN A 160 -16.803 -5.829 -1.759 1.00 0.16 N ATOM 2233 CA GLN A 160 -16.064 -4.929 -2.689 1.00 0.16 C ATOM 2234 C GLN A 160 -15.712 -3.636 -1.953 1.00 0.22 C ATOM 2235 O GLN A 160 -14.612 -3.132 -2.051 1.00 0.27 O ATOM 2236 CB GLN A 160 -16.946 -4.604 -3.898 1.00 0.25 C ATOM 2237 CG GLN A 160 -16.340 -5.229 -5.156 1.00 0.46 C ATOM 2238 CD GLN A 160 -16.572 -4.302 -6.352 1.00 0.46 C ATOM 2239 OE1 GLN A 160 -15.632 -3.851 -6.976 1.00 1.54 O ATOM 2240 NE2 GLN A 160 -17.792 -3.997 -6.701 1.00 0.76 N ATOM 0 H GLN A 160 -17.798 -5.935 -1.957 1.00 0.16 H new ATOM 0 HA GLN A 160 -15.153 -5.420 -3.031 1.00 0.16 H new ATOM 0 HB2 GLN A 160 -17.954 -4.986 -3.739 1.00 0.25 H new ATOM 0 HB3 GLN A 160 -17.030 -3.524 -4.020 1.00 0.25 H new ATOM 0 HG2 GLN A 160 -15.272 -5.395 -5.014 1.00 0.46 H new ATOM 0 HG3 GLN A 160 -16.792 -6.203 -5.345 1.00 0.46 H new ATOM 0 HE21 GLN A 160 -18.582 -4.375 -6.178 1.00 0.76 H new ATOM 0 HE22 GLN A 160 -17.956 -3.381 -7.497 1.00 0.76 H new ATOM 2249 N ASP A 161 -16.643 -3.098 -1.210 1.00 0.24 N ATOM 2250 CA ASP A 161 -16.367 -1.842 -0.460 1.00 0.31 C ATOM 2251 C ASP A 161 -15.329 -2.124 0.629 1.00 0.30 C ATOM 2252 O ASP A 161 -14.513 -1.286 0.954 1.00 0.36 O ATOM 2253 CB ASP A 161 -17.663 -1.339 0.181 1.00 0.38 C ATOM 2254 CG ASP A 161 -17.450 0.075 0.730 1.00 0.49 C ATOM 2255 OD1 ASP A 161 -16.508 0.720 0.300 1.00 0.63 O ATOM 2256 OD2 ASP A 161 -18.233 0.487 1.569 1.00 0.79 O ATOM 0 H ASP A 161 -17.583 -3.476 -1.091 1.00 0.24 H new ATOM 0 HA ASP A 161 -15.983 -1.082 -1.140 1.00 0.31 H new ATOM 0 HB2 ASP A 161 -18.467 -1.337 -0.555 1.00 0.38 H new ATOM 0 HB3 ASP A 161 -17.967 -2.010 0.984 1.00 0.38 H new ATOM 2261 N MET A 162 -15.356 -3.301 1.194 1.00 0.25 N ATOM 2262 CA MET A 162 -14.371 -3.642 2.262 1.00 0.28 C ATOM 2263 C MET A 162 -12.956 -3.671 1.655 1.00 0.26 C ATOM 2264 O MET A 162 -12.024 -3.128 2.210 1.00 0.19 O ATOM 2265 CB MET A 162 -14.764 -5.012 2.875 1.00 0.26 C ATOM 2266 CG MET A 162 -13.537 -5.896 3.181 1.00 0.41 C ATOM 2267 SD MET A 162 -12.446 -5.056 4.359 1.00 1.18 S ATOM 2268 CE MET A 162 -10.898 -5.288 3.445 1.00 0.64 C ATOM 0 H MET A 162 -16.018 -4.042 0.962 1.00 0.25 H new ATOM 0 HA MET A 162 -14.377 -2.895 3.055 1.00 0.28 H new ATOM 0 HB2 MET A 162 -15.327 -4.847 3.794 1.00 0.26 H new ATOM 0 HB3 MET A 162 -15.425 -5.539 2.186 1.00 0.26 H new ATOM 0 HG2 MET A 162 -13.861 -6.853 3.591 1.00 0.41 H new ATOM 0 HG3 MET A 162 -12.995 -6.111 2.260 1.00 0.41 H new ATOM 0 HE1 MET A 162 -10.166 -5.778 4.087 1.00 0.64 H new ATOM 0 HE2 MET A 162 -11.083 -5.907 2.567 1.00 0.64 H new ATOM 0 HE3 MET A 162 -10.512 -4.318 3.130 1.00 0.64 H new ATOM 2278 N THR A 163 -12.794 -4.316 0.529 1.00 0.36 N ATOM 2279 CA THR A 163 -11.443 -4.402 -0.111 1.00 0.35 C ATOM 2280 C THR A 163 -10.770 -3.025 -0.137 1.00 0.30 C ATOM 2281 O THR A 163 -9.633 -2.875 0.259 1.00 0.28 O ATOM 2282 CB THR A 163 -11.597 -4.917 -1.544 1.00 0.39 C ATOM 2283 OG1 THR A 163 -12.218 -6.194 -1.523 1.00 0.48 O ATOM 2284 CG2 THR A 163 -10.219 -5.029 -2.198 1.00 0.35 C ATOM 0 H THR A 163 -13.541 -4.790 0.021 1.00 0.36 H new ATOM 0 HA THR A 163 -10.822 -5.085 0.469 1.00 0.35 H new ATOM 0 HB THR A 163 -12.213 -4.223 -2.115 1.00 0.39 H new ATOM 0 HG1 THR A 163 -13.178 -6.088 -1.355 1.00 0.48 H new ATOM 0 HG21 THR A 163 -10.329 -5.396 -3.218 1.00 0.35 H new ATOM 0 HG22 THR A 163 -9.743 -4.048 -2.214 1.00 0.35 H new ATOM 0 HG23 THR A 163 -9.601 -5.723 -1.628 1.00 0.35 H new ATOM 2292 N THR A 164 -11.460 -2.022 -0.603 1.00 0.28 N ATOM 2293 CA THR A 164 -10.856 -0.660 -0.658 1.00 0.23 C ATOM 2294 C THR A 164 -10.560 -0.157 0.759 1.00 0.10 C ATOM 2295 O THR A 164 -9.602 0.555 0.990 1.00 0.03 O ATOM 2296 CB THR A 164 -11.841 0.296 -1.335 1.00 0.29 C ATOM 2297 OG1 THR A 164 -12.382 -0.326 -2.492 1.00 1.25 O ATOM 2298 CG2 THR A 164 -11.116 1.580 -1.734 1.00 1.00 C ATOM 0 H THR A 164 -12.417 -2.086 -0.949 1.00 0.28 H new ATOM 0 HA THR A 164 -9.925 -0.703 -1.223 1.00 0.23 H new ATOM 0 HB THR A 164 -12.647 0.539 -0.643 1.00 0.29 H new ATOM 0 HG1 THR A 164 -13.014 0.284 -2.926 1.00 1.25 H new ATOM 0 HG21 THR A 164 -11.819 2.260 -2.216 1.00 1.00 H new ATOM 0 HG22 THR A 164 -10.703 2.056 -0.845 1.00 1.00 H new ATOM 0 HG23 THR A 164 -10.309 1.342 -2.426 1.00 1.00 H new ATOM 2306 N HIS A 165 -11.388 -0.510 1.701 1.00 0.10 N ATOM 2307 CA HIS A 165 -11.181 -0.045 3.103 1.00 0.08 C ATOM 2308 C HIS A 165 -9.822 -0.520 3.640 1.00 0.21 C ATOM 2309 O HIS A 165 -9.031 0.267 4.121 1.00 0.42 O ATOM 2310 CB HIS A 165 -12.315 -0.604 3.981 1.00 0.07 C ATOM 2311 CG HIS A 165 -12.032 -0.336 5.439 1.00 0.21 C ATOM 2312 ND1 HIS A 165 -11.498 -1.304 6.275 1.00 0.52 N ATOM 2313 CD2 HIS A 165 -12.198 0.782 6.218 1.00 0.45 C ATOM 2314 CE1 HIS A 165 -11.363 -0.756 7.495 1.00 0.62 C ATOM 2315 NE2 HIS A 165 -11.774 0.514 7.517 1.00 0.53 N ATOM 0 H HIS A 165 -12.205 -1.104 1.561 1.00 0.10 H new ATOM 0 HA HIS A 165 -11.191 1.045 3.125 1.00 0.08 H new ATOM 0 HB2 HIS A 165 -13.263 -0.146 3.698 1.00 0.07 H new ATOM 0 HB3 HIS A 165 -12.417 -1.676 3.815 1.00 0.07 H new ATOM 0 HD2 HIS A 165 -12.597 1.726 5.876 1.00 0.45 H new ATOM 0 HE1 HIS A 165 -10.970 -1.280 8.354 1.00 0.62 H new ATOM 0 HE2 HIS A 165 -11.777 1.151 8.314 1.00 0.53 H new ATOM 2323 N LEU A 166 -9.559 -1.796 3.602 1.00 0.23 N ATOM 2324 CA LEU A 166 -8.267 -2.300 4.156 1.00 0.40 C ATOM 2325 C LEU A 166 -7.080 -1.863 3.298 1.00 0.32 C ATOM 2326 O LEU A 166 -6.002 -1.654 3.815 1.00 0.36 O ATOM 2327 CB LEU A 166 -8.290 -3.824 4.251 1.00 0.58 C ATOM 2328 CG LEU A 166 -7.107 -4.290 5.103 1.00 1.03 C ATOM 2329 CD1 LEU A 166 -7.563 -4.488 6.550 1.00 1.29 C ATOM 2330 CD2 LEU A 166 -6.568 -5.613 4.552 1.00 1.88 C ATOM 0 H LEU A 166 -10.177 -2.509 3.215 1.00 0.23 H new ATOM 0 HA LEU A 166 -8.149 -1.872 5.151 1.00 0.40 H new ATOM 0 HB2 LEU A 166 -9.228 -4.159 4.694 1.00 0.58 H new ATOM 0 HB3 LEU A 166 -8.233 -4.264 3.255 1.00 0.58 H new ATOM 0 HG LEU A 166 -6.320 -3.536 5.071 1.00 1.03 H new ATOM 0 HD11 LEU A 166 -6.719 -4.820 7.155 1.00 1.29 H new ATOM 0 HD12 LEU A 166 -7.944 -3.546 6.944 1.00 1.29 H new ATOM 0 HD13 LEU A 166 -8.351 -5.240 6.583 1.00 1.29 H new ATOM 0 HD21 LEU A 166 -5.726 -5.944 5.159 1.00 1.88 H new ATOM 0 HD22 LEU A 166 -7.355 -6.367 4.581 1.00 1.88 H new ATOM 0 HD23 LEU A 166 -6.239 -5.471 3.522 1.00 1.88 H new ATOM 2342 N ILE A 167 -7.235 -1.720 2.005 1.00 0.23 N ATOM 2343 CA ILE A 167 -6.063 -1.293 1.188 1.00 0.19 C ATOM 2344 C ILE A 167 -5.593 0.070 1.692 1.00 0.23 C ATOM 2345 O ILE A 167 -4.415 0.323 1.819 1.00 0.40 O ATOM 2346 CB ILE A 167 -6.432 -1.186 -0.293 1.00 0.19 C ATOM 2347 CG1 ILE A 167 -6.847 -2.563 -0.815 1.00 0.23 C ATOM 2348 CG2 ILE A 167 -5.214 -0.686 -1.083 1.00 0.25 C ATOM 2349 CD1 ILE A 167 -7.574 -2.403 -2.152 1.00 0.25 C ATOM 0 H ILE A 167 -8.102 -1.877 1.491 1.00 0.23 H new ATOM 0 HA ILE A 167 -5.272 -2.036 1.287 1.00 0.19 H new ATOM 0 HB ILE A 167 -7.260 -0.487 -0.415 1.00 0.19 H new ATOM 0 HG12 ILE A 167 -5.969 -3.196 -0.940 1.00 0.23 H new ATOM 0 HG13 ILE A 167 -7.496 -3.057 -0.092 1.00 0.23 H new ATOM 0 HG21 ILE A 167 -5.472 -0.608 -2.139 1.00 0.25 H new ATOM 0 HG22 ILE A 167 -4.915 0.293 -0.709 1.00 0.25 H new ATOM 0 HG23 ILE A 167 -4.389 -1.388 -0.962 1.00 0.25 H new ATOM 0 HD11 ILE A 167 -7.870 -3.384 -2.525 1.00 0.25 H new ATOM 0 HD12 ILE A 167 -8.461 -1.785 -2.012 1.00 0.25 H new ATOM 0 HD13 ILE A 167 -6.910 -1.926 -2.873 1.00 0.25 H new ATOM 2361 N LEU A 168 -6.512 0.947 1.986 1.00 0.13 N ATOM 2362 CA LEU A 168 -6.119 2.290 2.491 1.00 0.19 C ATOM 2363 C LEU A 168 -5.595 2.153 3.924 1.00 0.30 C ATOM 2364 O LEU A 168 -4.869 2.997 4.413 1.00 0.38 O ATOM 2365 CB LEU A 168 -7.335 3.218 2.474 1.00 0.17 C ATOM 2366 CG LEU A 168 -7.950 3.224 1.072 1.00 0.23 C ATOM 2367 CD1 LEU A 168 -9.476 3.255 1.181 1.00 0.52 C ATOM 2368 CD2 LEU A 168 -7.471 4.462 0.311 1.00 0.33 C ATOM 0 H LEU A 168 -7.516 0.791 1.898 1.00 0.13 H new ATOM 0 HA LEU A 168 -5.339 2.709 1.855 1.00 0.19 H new ATOM 0 HB2 LEU A 168 -8.072 2.884 3.205 1.00 0.17 H new ATOM 0 HB3 LEU A 168 -7.040 4.228 2.758 1.00 0.17 H new ATOM 0 HG LEU A 168 -7.642 2.325 0.539 1.00 0.23 H new ATOM 0 HD11 LEU A 168 -9.912 3.259 0.182 1.00 0.52 H new ATOM 0 HD12 LEU A 168 -9.820 2.374 1.723 1.00 0.52 H new ATOM 0 HD13 LEU A 168 -9.784 4.154 1.715 1.00 0.52 H new ATOM 0 HD21 LEU A 168 -7.908 4.467 -0.687 1.00 0.33 H new ATOM 0 HD22 LEU A 168 -7.779 5.360 0.847 1.00 0.33 H new ATOM 0 HD23 LEU A 168 -6.384 4.442 0.231 1.00 0.33 H new ATOM 2380 N ARG A 169 -5.958 1.094 4.602 1.00 0.32 N ATOM 2381 CA ARG A 169 -5.480 0.904 5.999 1.00 0.43 C ATOM 2382 C ARG A 169 -4.064 0.321 5.981 1.00 0.30 C ATOM 2383 O ARG A 169 -3.306 0.484 6.918 1.00 0.21 O ATOM 2384 CB ARG A 169 -6.419 -0.053 6.737 1.00 0.56 C ATOM 2385 CG ARG A 169 -6.878 0.589 8.051 1.00 1.01 C ATOM 2386 CD ARG A 169 -6.611 -0.374 9.209 1.00 0.87 C ATOM 2387 NE ARG A 169 -7.782 -1.279 9.383 1.00 1.10 N ATOM 2388 CZ ARG A 169 -8.033 -1.807 10.549 1.00 1.22 C ATOM 2389 NH1 ARG A 169 -7.076 -2.384 11.224 1.00 0.75 N ATOM 2390 NH2 ARG A 169 -9.240 -1.758 11.042 1.00 2.39 N ATOM 0 H ARG A 169 -6.564 0.355 4.246 1.00 0.32 H new ATOM 0 HA ARG A 169 -5.469 1.866 6.511 1.00 0.43 H new ATOM 0 HB2 ARG A 169 -7.282 -0.285 6.113 1.00 0.56 H new ATOM 0 HB3 ARG A 169 -5.909 -0.995 6.939 1.00 0.56 H new ATOM 0 HG2 ARG A 169 -6.348 1.527 8.214 1.00 1.01 H new ATOM 0 HG3 ARG A 169 -7.940 0.828 8.000 1.00 1.01 H new ATOM 0 HD2 ARG A 169 -5.713 -0.958 9.010 1.00 0.87 H new ATOM 0 HD3 ARG A 169 -6.431 0.185 10.127 1.00 0.87 H new ATOM 0 HE ARG A 169 -8.388 -1.486 8.589 1.00 1.10 H new ATOM 0 HH11 ARG A 169 -6.132 -2.422 10.840 1.00 0.75 H new ATOM 0 HH12 ARG A 169 -7.272 -2.797 12.136 1.00 0.75 H new ATOM 0 HH21 ARG A 169 -9.988 -1.307 10.516 1.00 2.39 H new ATOM 0 HH22 ARG A 169 -9.436 -2.171 11.954 1.00 2.39 H new ATOM 2404 N SER A 170 -3.685 -0.331 4.913 1.00 0.34 N ATOM 2405 CA SER A 170 -2.315 -0.885 4.841 1.00 0.25 C ATOM 2406 C SER A 170 -1.406 0.250 4.417 1.00 0.25 C ATOM 2407 O SER A 170 -0.406 0.526 5.031 1.00 0.24 O ATOM 2408 CB SER A 170 -2.259 -2.013 3.810 1.00 0.24 C ATOM 2409 OG SER A 170 -1.059 -2.754 3.992 1.00 0.98 O ATOM 0 H SER A 170 -4.268 -0.500 4.093 1.00 0.34 H new ATOM 0 HA SER A 170 -2.008 -1.295 5.803 1.00 0.25 H new ATOM 0 HB2 SER A 170 -3.124 -2.666 3.921 1.00 0.24 H new ATOM 0 HB3 SER A 170 -2.297 -1.602 2.801 1.00 0.24 H new ATOM 0 HG SER A 170 -0.628 -2.897 3.124 1.00 0.98 H new ATOM 2415 N PHE A 171 -1.770 0.949 3.385 1.00 0.26 N ATOM 2416 CA PHE A 171 -0.942 2.096 2.945 1.00 0.28 C ATOM 2417 C PHE A 171 -0.704 3.015 4.140 1.00 0.30 C ATOM 2418 O PHE A 171 0.383 3.490 4.362 1.00 0.32 O ATOM 2419 CB PHE A 171 -1.674 2.851 1.841 1.00 0.30 C ATOM 2420 CG PHE A 171 -1.314 2.227 0.522 1.00 0.31 C ATOM 2421 CD1 PHE A 171 -1.647 0.892 0.269 1.00 0.23 C ATOM 2422 CD2 PHE A 171 -0.632 2.975 -0.440 1.00 0.70 C ATOM 2423 CE1 PHE A 171 -1.299 0.303 -0.950 1.00 0.21 C ATOM 2424 CE2 PHE A 171 -0.279 2.388 -1.658 1.00 0.71 C ATOM 2425 CZ PHE A 171 -0.611 1.052 -1.915 1.00 0.34 C ATOM 0 H PHE A 171 -2.606 0.775 2.827 1.00 0.26 H new ATOM 0 HA PHE A 171 0.015 1.746 2.559 1.00 0.28 H new ATOM 0 HB2 PHE A 171 -2.751 2.806 2.001 1.00 0.30 H new ATOM 0 HB3 PHE A 171 -1.394 3.904 1.852 1.00 0.30 H new ATOM 0 HD1 PHE A 171 -2.173 0.316 1.016 1.00 0.23 H new ATOM 0 HD2 PHE A 171 -0.378 4.006 -0.243 1.00 0.70 H new ATOM 0 HE1 PHE A 171 -1.559 -0.726 -1.148 1.00 0.21 H new ATOM 0 HE2 PHE A 171 0.250 2.965 -2.402 1.00 0.71 H new ATOM 0 HZ PHE A 171 -0.337 0.599 -2.856 1.00 0.34 H new ATOM 2435 N LYS A 172 -1.712 3.245 4.930 1.00 0.28 N ATOM 2436 CA LYS A 172 -1.529 4.113 6.120 1.00 0.29 C ATOM 2437 C LYS A 172 -0.434 3.518 7.016 1.00 0.33 C ATOM 2438 O LYS A 172 0.638 4.078 7.164 1.00 0.37 O ATOM 2439 CB LYS A 172 -2.844 4.196 6.900 1.00 0.27 C ATOM 2440 CG LYS A 172 -3.900 4.903 6.047 1.00 1.28 C ATOM 2441 CD LYS A 172 -4.070 6.343 6.533 1.00 0.29 C ATOM 2442 CE LYS A 172 -4.899 6.353 7.818 1.00 1.21 C ATOM 2443 NZ LYS A 172 -4.777 7.684 8.479 1.00 1.18 N ATOM 0 H LYS A 172 -2.652 2.870 4.803 1.00 0.28 H new ATOM 0 HA LYS A 172 -1.236 5.114 5.802 1.00 0.29 H new ATOM 0 HB2 LYS A 172 -3.186 3.195 7.165 1.00 0.27 H new ATOM 0 HB3 LYS A 172 -2.692 4.739 7.833 1.00 0.27 H new ATOM 0 HG2 LYS A 172 -3.601 4.895 4.999 1.00 1.28 H new ATOM 0 HG3 LYS A 172 -4.850 4.372 6.111 1.00 1.28 H new ATOM 0 HD2 LYS A 172 -3.095 6.795 6.713 1.00 0.29 H new ATOM 0 HD3 LYS A 172 -4.561 6.941 5.766 1.00 0.29 H new ATOM 0 HE2 LYS A 172 -5.944 6.143 7.591 1.00 1.21 H new ATOM 0 HE3 LYS A 172 -4.555 5.568 8.491 1.00 1.21 H new ATOM 0 HZ1 LYS A 172 -5.341 7.691 9.353 1.00 1.18 H new ATOM 0 HZ2 LYS A 172 -3.779 7.867 8.709 1.00 1.18 H new ATOM 0 HZ3 LYS A 172 -5.126 8.424 7.837 1.00 1.18 H new ATOM 2457 N GLU A 173 -0.693 2.382 7.613 1.00 0.32 N ATOM 2458 CA GLU A 173 0.331 1.751 8.501 1.00 0.36 C ATOM 2459 C GLU A 173 1.496 1.212 7.663 1.00 0.34 C ATOM 2460 O GLU A 173 2.598 1.701 7.751 1.00 0.38 O ATOM 2461 CB GLU A 173 -0.309 0.600 9.281 1.00 0.36 C ATOM 2462 CG GLU A 173 0.139 0.662 10.742 1.00 0.77 C ATOM 2463 CD GLU A 173 -0.678 1.724 11.482 1.00 1.64 C ATOM 2464 OE1 GLU A 173 -1.878 1.541 11.601 1.00 2.19 O ATOM 2465 OE2 GLU A 173 -0.091 2.700 11.916 1.00 2.69 O ATOM 0 H GLU A 173 -1.568 1.865 7.524 1.00 0.32 H new ATOM 0 HA GLU A 173 0.709 2.501 9.196 1.00 0.36 H new ATOM 0 HB2 GLU A 173 -1.395 0.665 9.220 1.00 0.36 H new ATOM 0 HB3 GLU A 173 -0.021 -0.355 8.842 1.00 0.36 H new ATOM 0 HG2 GLU A 173 0.005 -0.310 11.216 1.00 0.77 H new ATOM 0 HG3 GLU A 173 1.201 0.901 10.798 1.00 0.77 H new ATOM 2472 N PHE A 174 1.248 0.198 6.870 1.00 0.29 N ATOM 2473 CA PHE A 174 2.315 -0.424 6.008 1.00 0.28 C ATOM 2474 C PHE A 174 3.334 0.618 5.508 1.00 0.32 C ATOM 2475 O PHE A 174 4.517 0.507 5.771 1.00 0.38 O ATOM 2476 CB PHE A 174 1.646 -1.088 4.803 1.00 0.24 C ATOM 2477 CG PHE A 174 2.446 -2.287 4.362 1.00 0.17 C ATOM 2478 CD1 PHE A 174 3.736 -2.113 3.855 1.00 0.67 C ATOM 2479 CD2 PHE A 174 1.894 -3.570 4.459 1.00 0.82 C ATOM 2480 CE1 PHE A 174 4.481 -3.223 3.442 1.00 0.52 C ATOM 2481 CE2 PHE A 174 2.640 -4.681 4.045 1.00 0.98 C ATOM 2482 CZ PHE A 174 3.934 -4.507 3.538 1.00 0.37 C ATOM 0 H PHE A 174 0.330 -0.238 6.779 1.00 0.29 H new ATOM 0 HA PHE A 174 2.855 -1.155 6.610 1.00 0.28 H new ATOM 0 HB2 PHE A 174 0.632 -1.393 5.062 1.00 0.24 H new ATOM 0 HB3 PHE A 174 1.564 -0.374 3.983 1.00 0.24 H new ATOM 0 HD1 PHE A 174 4.158 -1.122 3.782 1.00 0.67 H new ATOM 0 HD2 PHE A 174 0.897 -3.703 4.852 1.00 0.82 H new ATOM 0 HE1 PHE A 174 5.478 -3.089 3.049 1.00 0.52 H new ATOM 0 HE2 PHE A 174 2.217 -5.672 4.117 1.00 0.98 H new ATOM 0 HZ PHE A 174 4.510 -5.364 3.221 1.00 0.37 H new ATOM 2492 N LEU A 175 2.902 1.627 4.787 1.00 0.30 N ATOM 2493 CA LEU A 175 3.883 2.639 4.293 1.00 0.33 C ATOM 2494 C LEU A 175 4.557 3.319 5.489 1.00 0.38 C ATOM 2495 O LEU A 175 5.751 3.540 5.494 1.00 0.42 O ATOM 2496 CB LEU A 175 3.179 3.695 3.432 1.00 0.34 C ATOM 2497 CG LEU A 175 2.821 3.105 2.062 1.00 0.42 C ATOM 2498 CD1 LEU A 175 1.634 3.864 1.467 1.00 0.40 C ATOM 2499 CD2 LEU A 175 4.018 3.238 1.117 1.00 0.44 C ATOM 0 H LEU A 175 1.930 1.790 4.524 1.00 0.30 H new ATOM 0 HA LEU A 175 4.633 2.135 3.683 1.00 0.33 H new ATOM 0 HB2 LEU A 175 2.276 4.042 3.934 1.00 0.34 H new ATOM 0 HB3 LEU A 175 3.827 4.563 3.305 1.00 0.34 H new ATOM 0 HG LEU A 175 2.561 2.054 2.185 1.00 0.42 H new ATOM 0 HD11 LEU A 175 1.383 3.442 0.494 1.00 0.40 H new ATOM 0 HD12 LEU A 175 0.775 3.777 2.133 1.00 0.40 H new ATOM 0 HD13 LEU A 175 1.896 4.915 1.349 1.00 0.40 H new ATOM 0 HD21 LEU A 175 3.762 2.818 0.144 1.00 0.44 H new ATOM 0 HD22 LEU A 175 4.275 4.291 1.002 1.00 0.44 H new ATOM 0 HD23 LEU A 175 4.870 2.700 1.531 1.00 0.44 H new ATOM 2511 N GLN A 176 3.804 3.653 6.510 1.00 0.40 N ATOM 2512 CA GLN A 176 4.416 4.316 7.701 1.00 0.45 C ATOM 2513 C GLN A 176 5.624 3.503 8.189 1.00 0.45 C ATOM 2514 O GLN A 176 6.637 4.053 8.575 1.00 0.42 O ATOM 2515 CB GLN A 176 3.378 4.413 8.824 1.00 0.46 C ATOM 2516 CG GLN A 176 2.724 5.796 8.796 1.00 0.50 C ATOM 2517 CD GLN A 176 1.988 6.042 10.114 1.00 0.45 C ATOM 2518 OE1 GLN A 176 0.906 5.530 10.325 1.00 1.28 O ATOM 2519 NE2 GLN A 176 2.534 6.808 11.019 1.00 0.86 N ATOM 0 H GLN A 176 2.798 3.496 6.569 1.00 0.40 H new ATOM 0 HA GLN A 176 4.746 5.317 7.422 1.00 0.45 H new ATOM 0 HB2 GLN A 176 2.621 3.638 8.702 1.00 0.46 H new ATOM 0 HB3 GLN A 176 3.854 4.244 9.790 1.00 0.46 H new ATOM 0 HG2 GLN A 176 3.481 6.565 8.642 1.00 0.50 H new ATOM 0 HG3 GLN A 176 2.027 5.863 7.961 1.00 0.50 H new ATOM 0 HE21 GLN A 176 3.442 7.238 10.843 1.00 0.86 H new ATOM 0 HE22 GLN A 176 2.053 6.976 11.902 1.00 0.86 H new ATOM 2528 N SER A 177 5.528 2.201 8.169 1.00 0.52 N ATOM 2529 CA SER A 177 6.671 1.364 8.626 1.00 0.54 C ATOM 2530 C SER A 177 7.818 1.507 7.630 1.00 0.54 C ATOM 2531 O SER A 177 8.973 1.533 8.000 1.00 0.53 O ATOM 2532 CB SER A 177 6.240 -0.101 8.702 1.00 0.56 C ATOM 2533 OG SER A 177 4.853 -0.168 9.008 1.00 1.09 O ATOM 0 H SER A 177 4.707 1.682 7.856 1.00 0.52 H new ATOM 0 HA SER A 177 6.994 1.692 9.614 1.00 0.54 H new ATOM 0 HB2 SER A 177 6.439 -0.600 7.754 1.00 0.56 H new ATOM 0 HB3 SER A 177 6.818 -0.623 9.465 1.00 0.56 H new ATOM 0 HG SER A 177 4.573 -1.106 9.056 1.00 1.09 H new ATOM 2539 N SER A 178 7.510 1.606 6.366 1.00 0.55 N ATOM 2540 CA SER A 178 8.588 1.757 5.351 1.00 0.55 C ATOM 2541 C SER A 178 9.403 3.012 5.670 1.00 0.53 C ATOM 2542 O SER A 178 10.591 3.076 5.421 1.00 0.58 O ATOM 2543 CB SER A 178 7.966 1.890 3.960 1.00 0.54 C ATOM 2544 OG SER A 178 8.999 2.003 2.991 1.00 1.43 O ATOM 0 H SER A 178 6.561 1.589 5.994 1.00 0.55 H new ATOM 0 HA SER A 178 9.238 0.882 5.372 1.00 0.55 H new ATOM 0 HB2 SER A 178 7.342 1.023 3.744 1.00 0.54 H new ATOM 0 HB3 SER A 178 7.318 2.766 3.921 1.00 0.54 H new ATOM 0 HG SER A 178 8.603 2.087 2.099 1.00 1.43 H new ATOM 2550 N LEU A 179 8.772 4.011 6.228 1.00 0.47 N ATOM 2551 CA LEU A 179 9.504 5.262 6.574 1.00 0.48 C ATOM 2552 C LEU A 179 10.322 5.033 7.845 1.00 0.48 C ATOM 2553 O LEU A 179 11.391 5.582 8.016 1.00 0.32 O ATOM 2554 CB LEU A 179 8.499 6.388 6.826 1.00 0.48 C ATOM 2555 CG LEU A 179 7.894 6.850 5.501 1.00 0.62 C ATOM 2556 CD1 LEU A 179 6.601 6.081 5.236 1.00 0.99 C ATOM 2557 CD2 LEU A 179 7.586 8.347 5.581 1.00 0.40 C ATOM 0 H LEU A 179 7.779 4.013 6.459 1.00 0.47 H new ATOM 0 HA LEU A 179 10.164 5.535 5.751 1.00 0.48 H new ATOM 0 HB2 LEU A 179 7.711 6.041 7.495 1.00 0.48 H new ATOM 0 HB3 LEU A 179 8.993 7.224 7.322 1.00 0.48 H new ATOM 0 HG LEU A 179 8.601 6.663 4.692 1.00 0.62 H new ATOM 0 HD11 LEU A 179 6.169 6.410 4.291 1.00 0.99 H new ATOM 0 HD12 LEU A 179 6.816 5.014 5.184 1.00 0.99 H new ATOM 0 HD13 LEU A 179 5.894 6.270 6.043 1.00 0.99 H new ATOM 0 HD21 LEU A 179 7.154 8.681 4.637 1.00 0.40 H new ATOM 0 HD22 LEU A 179 6.878 8.530 6.389 1.00 0.40 H new ATOM 0 HD23 LEU A 179 8.507 8.898 5.774 1.00 0.40 H new ATOM 2569 N ARG A 180 9.816 4.232 8.744 1.00 0.73 N ATOM 2570 CA ARG A 180 10.552 3.972 10.015 1.00 0.78 C ATOM 2571 C ARG A 180 11.737 3.039 9.755 1.00 0.78 C ATOM 2572 O ARG A 180 12.671 2.981 10.530 1.00 0.79 O ATOM 2573 CB ARG A 180 9.606 3.323 11.027 1.00 0.92 C ATOM 2574 CG ARG A 180 8.559 4.346 11.472 1.00 1.17 C ATOM 2575 CD ARG A 180 9.099 5.146 12.658 1.00 0.89 C ATOM 2576 NE ARG A 180 8.336 6.420 12.784 1.00 1.77 N ATOM 2577 CZ ARG A 180 7.292 6.486 13.566 1.00 1.79 C ATOM 2578 NH1 ARG A 180 6.606 5.408 13.835 1.00 1.41 N ATOM 2579 NH2 ARG A 180 6.931 7.631 14.078 1.00 2.76 N ATOM 0 H ARG A 180 8.924 3.746 8.653 1.00 0.73 H new ATOM 0 HA ARG A 180 10.923 4.917 10.411 1.00 0.78 H new ATOM 0 HB2 ARG A 180 9.117 2.457 10.581 1.00 0.92 H new ATOM 0 HB3 ARG A 180 10.168 2.963 11.889 1.00 0.92 H new ATOM 0 HG2 ARG A 180 8.317 5.017 10.647 1.00 1.17 H new ATOM 0 HG3 ARG A 180 7.636 3.839 11.752 1.00 1.17 H new ATOM 0 HD2 ARG A 180 9.009 4.563 13.575 1.00 0.89 H new ATOM 0 HD3 ARG A 180 10.159 5.357 12.516 1.00 0.89 H new ATOM 0 HE ARG A 180 8.630 7.243 12.258 1.00 1.77 H new ATOM 0 HH11 ARG A 180 6.885 4.513 13.434 1.00 1.41 H new ATOM 0 HH12 ARG A 180 5.791 5.461 14.446 1.00 1.41 H new ATOM 0 HH21 ARG A 180 7.464 8.475 13.867 1.00 2.76 H new ATOM 0 HH22 ARG A 180 6.116 7.682 14.689 1.00 2.76 H new ATOM 2593 N ALA A 181 11.718 2.312 8.672 1.00 0.79 N ATOM 2594 CA ALA A 181 12.852 1.398 8.379 1.00 0.82 C ATOM 2595 C ALA A 181 13.931 2.180 7.639 1.00 0.71 C ATOM 2596 O ALA A 181 15.103 2.073 7.934 1.00 0.60 O ATOM 2597 CB ALA A 181 12.367 0.239 7.505 1.00 0.92 C ATOM 0 H ALA A 181 10.968 2.313 7.981 1.00 0.79 H new ATOM 0 HA ALA A 181 13.255 0.997 9.309 1.00 0.82 H new ATOM 0 HB1 ALA A 181 13.201 -0.430 7.292 1.00 0.92 H new ATOM 0 HB2 ALA A 181 11.586 -0.311 8.030 1.00 0.92 H new ATOM 0 HB3 ALA A 181 11.968 0.631 6.569 1.00 0.92 H new ATOM 2603 N LEU A 182 13.542 2.976 6.684 1.00 0.77 N ATOM 2604 CA LEU A 182 14.544 3.776 5.933 1.00 0.67 C ATOM 2605 C LEU A 182 15.128 4.838 6.862 1.00 0.48 C ATOM 2606 O LEU A 182 16.258 5.260 6.712 1.00 0.40 O ATOM 2607 CB LEU A 182 13.869 4.452 4.740 1.00 0.73 C ATOM 2608 CG LEU A 182 14.430 3.873 3.442 1.00 1.08 C ATOM 2609 CD1 LEU A 182 14.076 2.387 3.350 1.00 1.69 C ATOM 2610 CD2 LEU A 182 13.825 4.616 2.249 1.00 0.75 C ATOM 0 H LEU A 182 12.573 3.106 6.392 1.00 0.77 H new ATOM 0 HA LEU A 182 15.340 3.125 5.571 1.00 0.67 H new ATOM 0 HB2 LEU A 182 12.791 4.298 4.783 1.00 0.73 H new ATOM 0 HB3 LEU A 182 14.039 5.528 4.774 1.00 0.73 H new ATOM 0 HG LEU A 182 15.514 3.989 3.431 1.00 1.08 H new ATOM 0 HD11 LEU A 182 14.476 1.974 2.424 1.00 1.69 H new ATOM 0 HD12 LEU A 182 14.507 1.857 4.200 1.00 1.69 H new ATOM 0 HD13 LEU A 182 12.992 2.270 3.361 1.00 1.69 H new ATOM 0 HD21 LEU A 182 14.225 4.203 1.323 1.00 0.75 H new ATOM 0 HD22 LEU A 182 12.741 4.500 2.260 1.00 0.75 H new ATOM 0 HD23 LEU A 182 14.077 5.674 2.313 1.00 0.75 H new ATOM 2622 N ARG A 183 14.364 5.266 7.828 1.00 0.50 N ATOM 2623 CA ARG A 183 14.862 6.296 8.780 1.00 0.39 C ATOM 2624 C ARG A 183 15.599 5.604 9.930 1.00 0.29 C ATOM 2625 O ARG A 183 16.446 6.187 10.577 1.00 0.27 O ATOM 2626 CB ARG A 183 13.677 7.089 9.333 1.00 0.57 C ATOM 2627 CG ARG A 183 14.176 8.116 10.354 1.00 0.73 C ATOM 2628 CD ARG A 183 13.745 9.520 9.925 1.00 0.31 C ATOM 2629 NE ARG A 183 14.953 10.349 9.658 1.00 1.51 N ATOM 2630 CZ ARG A 183 15.294 11.293 10.493 1.00 1.75 C ATOM 2631 NH1 ARG A 183 14.633 12.418 10.512 1.00 1.65 N ATOM 2632 NH2 ARG A 183 16.293 11.111 11.313 1.00 2.71 N ATOM 0 H ARG A 183 13.411 4.945 7.999 1.00 0.50 H new ATOM 0 HA ARG A 183 15.543 6.975 8.267 1.00 0.39 H new ATOM 0 HB2 ARG A 183 13.154 7.594 8.521 1.00 0.57 H new ATOM 0 HB3 ARG A 183 12.962 6.413 9.802 1.00 0.57 H new ATOM 0 HG2 ARG A 183 13.774 7.887 11.341 1.00 0.73 H new ATOM 0 HG3 ARG A 183 15.262 8.067 10.433 1.00 0.73 H new ATOM 0 HD2 ARG A 183 13.124 9.464 9.031 1.00 0.31 H new ATOM 0 HD3 ARG A 183 13.140 9.981 10.706 1.00 0.31 H new ATOM 0 HE ARG A 183 15.514 10.179 8.823 1.00 1.51 H new ATOM 0 HH11 ARG A 183 13.850 12.560 9.874 1.00 1.65 H new ATOM 0 HH12 ARG A 183 14.900 13.155 11.164 1.00 1.65 H new ATOM 0 HH21 ARG A 183 16.808 10.231 11.302 1.00 2.71 H new ATOM 0 HH22 ARG A 183 16.559 11.849 11.965 1.00 2.71 H new ATOM 2646 N GLN A 184 15.284 4.363 10.185 1.00 0.39 N ATOM 2647 CA GLN A 184 15.961 3.630 11.285 1.00 0.31 C ATOM 2648 C GLN A 184 17.326 3.141 10.798 1.00 0.10 C ATOM 2649 O GLN A 184 18.229 2.908 11.578 1.00 0.15 O ATOM 2650 CB GLN A 184 15.092 2.435 11.687 1.00 0.52 C ATOM 2651 CG GLN A 184 15.830 1.567 12.706 1.00 1.89 C ATOM 2652 CD GLN A 184 15.990 2.337 14.019 1.00 1.34 C ATOM 2653 OE1 GLN A 184 17.095 2.597 14.453 1.00 2.04 O ATOM 2654 NE2 GLN A 184 14.927 2.714 14.675 1.00 0.58 N ATOM 0 H GLN A 184 14.583 3.826 9.675 1.00 0.39 H new ATOM 0 HA GLN A 184 16.102 4.285 12.145 1.00 0.31 H new ATOM 0 HB2 GLN A 184 14.151 2.786 12.111 1.00 0.52 H new ATOM 0 HB3 GLN A 184 14.844 1.843 10.806 1.00 0.52 H new ATOM 0 HG2 GLN A 184 15.277 0.644 12.880 1.00 1.89 H new ATOM 0 HG3 GLN A 184 16.808 1.285 12.317 1.00 1.89 H new ATOM 0 HE21 GLN A 184 13.999 2.496 14.311 1.00 0.58 H new ATOM 0 HE22 GLN A 184 15.024 3.227 15.552 1.00 0.58 H new ATOM 2663 N MET A 185 17.481 2.983 9.516 1.00 0.29 N ATOM 2664 CA MET A 185 18.781 2.509 8.978 1.00 0.50 C ATOM 2665 C MET A 185 19.851 3.581 9.199 1.00 0.82 C ATOM 2666 O MET A 185 19.484 4.695 9.535 1.00 1.39 O ATOM 2667 CB MET A 185 18.629 2.233 7.484 1.00 0.76 C ATOM 2668 CG MET A 185 17.777 0.978 7.287 1.00 0.71 C ATOM 2669 SD MET A 185 17.081 0.973 5.615 1.00 0.87 S ATOM 2670 CE MET A 185 15.677 -0.119 5.956 1.00 0.72 C ATOM 2671 OXT MET A 185 21.018 3.270 9.029 1.00 1.23 O ATOM 0 H MET A 185 16.761 3.162 8.816 1.00 0.29 H new ATOM 0 HA MET A 185 19.082 1.596 9.492 1.00 0.50 H new ATOM 0 HB2 MET A 185 18.162 3.085 6.991 1.00 0.76 H new ATOM 0 HB3 MET A 185 19.609 2.097 7.026 1.00 0.76 H new ATOM 0 HG2 MET A 185 18.384 0.086 7.442 1.00 0.71 H new ATOM 0 HG3 MET A 185 16.976 0.950 8.025 1.00 0.71 H new ATOM 0 HE1 MET A 185 15.774 -1.031 5.367 1.00 0.72 H new ATOM 0 HE2 MET A 185 15.661 -0.371 7.016 1.00 0.72 H new ATOM 0 HE3 MET A 185 14.749 0.387 5.690 1.00 0.72 H new