USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1288 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 33 ASN : amide:sc= -0.673 X(o=-0.076,f=-0.28) USER MOD Set 1.2: A 81 HIS : no HE2:sc= 0.597 K(o=-0.076,f=-5.1!) USER MOD Set 2.1: A 3 LYS NZ :NH3+ -120:sc= 0.73 (180deg=-0.0371) USER MOD Set 2.2: B 50 ASN : amide:sc= 1.47 K(o=2.2,f=-12!) USER MOD Single : A 1 MET CE :methyl -107:sc= -1.55 (180deg=-2.44!) USER MOD Single : A 1 MET N :NH3+ -114:sc= 2.95 (180deg=0.0987) USER MOD Single : A 4 LYS NZ :NH3+ 172:sc=-0.00646 (180deg=-0.0745) USER MOD Single : A 9 ASN : amide:sc= -0.502 X(o=-0.5,f=-0.62) USER MOD Single : A 12 LYS NZ :NH3+ 166:sc= -0.0396 (180deg=-0.231) USER MOD Single : A 15 HIS : no HE2:sc= -1.53! C(o=-1.5!,f=-3.9!) USER MOD Single : A 18 ASN : amide:sc= 0.0397 K(o=0.04,f=-4.5!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ -159:sc= 1.17 (180deg=-0.13) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -5:sc= 0.504 USER MOD Single : A 39 THR OG1 : rot 78:sc= 0.873 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 TYR OH : rot -23:sc= 0.651 USER MOD Single : A 65 ASN : amide:sc= -2.33! C(o=-2.3!,f=-4.4!) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 72 SER OG : rot 180:sc= -0.0219 USER MOD Single : A 77 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 78 HIS : no HE2:sc= 0.722 K(o=0.72,f=-3.4!) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 80 HIS : no HD1:sc= -0.301 X(o=-0.3,f=-0.078) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ -172:sc= 0.669 (180deg=0.624) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 ASN : amide:sc= -0.0515 K(o=-0.052,f=-1.9!) USER MOD Single : B 12 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0164) USER MOD Single : B 15 HIS : no HD1:sc= -0.0557 X(o=-0.056,f=-0.071) USER MOD Single : B 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 24 SER OG : rot -58:sc= 0.00026 USER MOD Single : B 31 LYS NZ :NH3+ 170:sc= 0.739 (180deg=0.553) USER MOD Single : B 33 ASN : amide:sc= -0.0875 X(o=-0.088,f=-0.45) USER MOD Single : B 35 SER OG : rot 180:sc= -0.0241 USER MOD Single : B 38 SER OG : rot -7:sc= -0.0729 USER MOD Single : B 39 THR OG1 : rot 81:sc= 0.14 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0991) USER MOD Single : B 58 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : B 64 TYR OH : rot 82:sc= 0.0374 USER MOD Single : B 65 ASN : amide:sc= -2.73! X(o=-2.7!,f=-2.9) USER MOD Single : B 68 HIS : no HD1:sc= -0.576 X(o=-0.58,f=-0.15) USER MOD Single : B 72 SER OG : rot 180:sc= 0 USER MOD Single : B 77 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 78 HIS : no HD1:sc=-0.00525 X(o=-0.0053,f=-0.0053) USER MOD Single : B 79 HIS : no HD1:sc= -0.211 K(o=-0.21,f=-0.81) USER MOD Single : B 80 HIS : no HE2:sc= -0.113 K(o=-0.11,f=-0.9) USER MOD Single : B 81 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : B 82 HIS : no HD1:sc= 0 X(o=0,f=-0.0079) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.070 15.109 0.050 1.00 12.21 N ATOM 2 CA MET A 1 1.791 15.598 0.634 1.00 63.52 C ATOM 3 C MET A 1 1.216 14.541 1.603 1.00 52.42 C ATOM 4 O MET A 1 0.808 14.872 2.712 1.00 14.41 O ATOM 5 CB MET A 1 0.812 15.954 -0.511 1.00 21.42 C ATOM 6 CG MET A 1 -0.538 16.544 -0.081 1.00 23.13 C ATOM 7 SD MET A 1 -1.458 17.283 -1.459 1.00 52.42 S ATOM 8 CE MET A 1 -1.433 15.981 -2.698 1.00 54.43 C ATOM 0 H1 MET A 1 3.854 15.707 0.381 1.00 12.21 H new ATOM 0 H2 MET A 1 3.234 14.126 0.348 1.00 12.21 H new ATOM 0 H3 MET A 1 3.017 15.152 -0.988 1.00 12.21 H new ATOM 0 HA MET A 1 1.959 16.503 1.218 1.00 63.52 H new ATOM 0 HB2 MET A 1 1.303 16.666 -1.174 1.00 21.42 H new ATOM 0 HB3 MET A 1 0.623 15.053 -1.095 1.00 21.42 H new ATOM 0 HG2 MET A 1 -1.143 15.760 0.374 1.00 23.13 H new ATOM 0 HG3 MET A 1 -0.370 17.301 0.685 1.00 23.13 H new ATOM 0 HE1 MET A 1 -0.748 16.255 -3.500 1.00 54.43 H new ATOM 0 HE2 MET A 1 -1.101 15.049 -2.240 1.00 54.43 H new ATOM 0 HE3 MET A 1 -2.435 15.848 -3.106 1.00 54.43 H new ATOM 20 N ASP A 2 1.169 13.280 1.120 1.00 64.12 N ATOM 21 CA ASP A 2 1.067 12.024 1.925 1.00 74.30 C ATOM 22 C ASP A 2 0.263 12.081 3.266 1.00 32.33 C ATOM 23 O ASP A 2 -0.901 11.717 3.285 1.00 44.31 O ATOM 24 CB ASP A 2 2.484 11.386 2.137 1.00 51.35 C ATOM 25 CG ASP A 2 3.611 12.415 2.342 1.00 74.24 C ATOM 26 OD1 ASP A 2 3.836 12.855 3.481 1.00 34.42 O ATOM 27 OD2 ASP A 2 4.230 12.828 1.340 1.00 52.10 O ATOM 0 H ASP A 2 1.202 13.092 0.118 1.00 64.12 H new ATOM 0 HA ASP A 2 0.441 11.382 1.305 1.00 74.30 H new ATOM 0 HB2 ASP A 2 2.448 10.725 3.003 1.00 51.35 H new ATOM 0 HB3 ASP A 2 2.725 10.766 1.273 1.00 51.35 H new ATOM 32 N LYS A 3 0.898 12.563 4.356 1.00 43.34 N ATOM 33 CA LYS A 3 0.475 12.287 5.769 1.00 61.53 C ATOM 34 C LYS A 3 -1.038 12.497 6.081 1.00 3.21 C ATOM 35 O LYS A 3 -1.676 11.614 6.677 1.00 41.15 O ATOM 36 CB LYS A 3 1.342 13.099 6.763 1.00 41.52 C ATOM 37 CG LYS A 3 2.864 12.875 6.619 1.00 71.22 C ATOM 38 CD LYS A 3 3.266 11.382 6.705 1.00 22.23 C ATOM 39 CE LYS A 3 4.756 11.152 6.403 1.00 52.13 C ATOM 40 NZ LYS A 3 5.637 11.918 7.323 1.00 61.21 N ATOM 0 H LYS A 3 1.724 13.159 4.293 1.00 43.34 H new ATOM 0 HA LYS A 3 0.639 11.217 5.896 1.00 61.53 H new ATOM 0 HB2 LYS A 3 1.130 14.160 6.628 1.00 41.52 H new ATOM 0 HB3 LYS A 3 1.044 12.841 7.779 1.00 41.52 H new ATOM 0 HG2 LYS A 3 3.197 13.281 5.664 1.00 71.22 H new ATOM 0 HG3 LYS A 3 3.383 13.431 7.400 1.00 71.22 H new ATOM 0 HD2 LYS A 3 3.039 11.005 7.702 1.00 22.23 H new ATOM 0 HD3 LYS A 3 2.664 10.806 6.002 1.00 22.23 H new ATOM 0 HE2 LYS A 3 4.983 10.089 6.486 1.00 52.13 H new ATOM 0 HE3 LYS A 3 4.966 11.443 5.374 1.00 52.13 H new ATOM 0 HZ1 LYS A 3 6.230 12.572 6.772 1.00 61.21 H new ATOM 0 HZ2 LYS A 3 5.053 12.460 7.992 1.00 61.21 H new ATOM 0 HZ3 LYS A 3 6.246 11.259 7.850 1.00 61.21 H new ATOM 54 N LYS A 4 -1.607 13.650 5.685 1.00 33.35 N ATOM 55 CA LYS A 4 -3.049 13.945 5.937 1.00 3.02 C ATOM 56 C LYS A 4 -3.971 13.081 5.036 1.00 24.13 C ATOM 57 O LYS A 4 -5.044 12.660 5.477 1.00 71.35 O ATOM 58 CB LYS A 4 -3.374 15.464 5.775 1.00 25.15 C ATOM 59 CG LYS A 4 -2.865 16.385 6.921 1.00 44.51 C ATOM 60 CD LYS A 4 -1.322 16.526 6.975 1.00 4.03 C ATOM 61 CE LYS A 4 -0.845 17.446 8.117 1.00 71.51 C ATOM 62 NZ LYS A 4 -1.256 16.945 9.460 1.00 13.13 N ATOM 0 H LYS A 4 -1.106 14.391 5.194 1.00 33.35 H new ATOM 0 HA LYS A 4 -3.248 13.679 6.975 1.00 3.02 H new ATOM 0 HB2 LYS A 4 -2.944 15.811 4.836 1.00 25.15 H new ATOM 0 HB3 LYS A 4 -4.455 15.579 5.693 1.00 25.15 H new ATOM 0 HG2 LYS A 4 -3.307 17.374 6.802 1.00 44.51 H new ATOM 0 HG3 LYS A 4 -3.218 15.991 7.874 1.00 44.51 H new ATOM 0 HD2 LYS A 4 -0.876 15.539 7.099 1.00 4.03 H new ATOM 0 HD3 LYS A 4 -0.964 16.920 6.024 1.00 4.03 H new ATOM 0 HE2 LYS A 4 0.241 17.532 8.081 1.00 71.51 H new ATOM 0 HE3 LYS A 4 -1.249 18.447 7.966 1.00 71.51 H new ATOM 0 HZ1 LYS A 4 -0.800 17.518 10.199 1.00 13.13 H new ATOM 0 HZ2 LYS A 4 -2.289 17.015 9.555 1.00 13.13 H new ATOM 0 HZ3 LYS A 4 -0.965 15.952 9.564 1.00 13.13 H new ATOM 76 N ILE A 5 -3.528 12.815 3.788 1.00 45.10 N ATOM 77 CA ILE A 5 -4.254 11.927 2.837 1.00 32.33 C ATOM 78 C ILE A 5 -4.377 10.489 3.410 1.00 11.24 C ATOM 79 O ILE A 5 -5.473 9.980 3.623 1.00 20.10 O ATOM 80 CB ILE A 5 -3.510 11.821 1.445 1.00 14.33 C ATOM 81 CG1 ILE A 5 -3.173 13.225 0.853 1.00 22.10 C ATOM 82 CG2 ILE A 5 -4.328 10.970 0.435 1.00 35.13 C ATOM 83 CD1 ILE A 5 -2.311 13.178 -0.406 1.00 2.31 C ATOM 0 H ILE A 5 -2.665 13.203 3.408 1.00 45.10 H new ATOM 0 HA ILE A 5 -5.239 12.372 2.694 1.00 32.33 H new ATOM 0 HB ILE A 5 -2.563 11.313 1.626 1.00 14.33 H new ATOM 0 HG12 ILE A 5 -4.104 13.744 0.624 1.00 22.10 H new ATOM 0 HG13 ILE A 5 -2.658 13.814 1.612 1.00 22.10 H new ATOM 0 HG21 ILE A 5 -3.792 10.915 -0.512 1.00 35.13 H new ATOM 0 HG22 ILE A 5 -4.465 9.965 0.833 1.00 35.13 H new ATOM 0 HG23 ILE A 5 -5.302 11.433 0.274 1.00 35.13 H new ATOM 0 HD11 ILE A 5 -2.121 14.193 -0.755 1.00 2.31 H new ATOM 0 HD12 ILE A 5 -1.363 12.689 -0.180 1.00 2.31 H new ATOM 0 HD13 ILE A 5 -2.832 12.619 -1.183 1.00 2.31 H new ATOM 95 N VAL A 6 -3.207 9.873 3.659 1.00 35.55 N ATOM 96 CA VAL A 6 -3.076 8.467 4.093 1.00 23.43 C ATOM 97 C VAL A 6 -3.714 8.222 5.481 1.00 3.02 C ATOM 98 O VAL A 6 -4.236 7.142 5.732 1.00 13.44 O ATOM 99 CB VAL A 6 -1.560 8.024 4.098 1.00 34.20 C ATOM 100 CG1 VAL A 6 -0.947 8.112 2.682 1.00 22.34 C ATOM 101 CG2 VAL A 6 -0.727 8.863 5.090 1.00 22.14 C ATOM 0 H VAL A 6 -2.308 10.346 3.563 1.00 35.55 H new ATOM 0 HA VAL A 6 -3.621 7.858 3.372 1.00 23.43 H new ATOM 0 HB VAL A 6 -1.532 6.984 4.424 1.00 34.20 H new ATOM 0 HG11 VAL A 6 0.097 7.801 2.718 1.00 22.34 H new ATOM 0 HG12 VAL A 6 -1.498 7.458 2.006 1.00 22.34 H new ATOM 0 HG13 VAL A 6 -1.007 9.139 2.323 1.00 22.34 H new ATOM 0 HG21 VAL A 6 0.311 8.530 5.066 1.00 22.14 H new ATOM 0 HG22 VAL A 6 -0.777 9.915 4.809 1.00 22.14 H new ATOM 0 HG23 VAL A 6 -1.125 8.737 6.097 1.00 22.14 H new ATOM 111 N GLY A 7 -3.672 9.248 6.358 1.00 25.32 N ATOM 112 CA GLY A 7 -4.328 9.190 7.672 1.00 54.42 C ATOM 113 C GLY A 7 -5.862 9.202 7.570 1.00 74.14 C ATOM 114 O GLY A 7 -6.548 8.426 8.250 1.00 55.32 O ATOM 0 H GLY A 7 -3.188 10.127 6.174 1.00 25.32 H new ATOM 0 HA2 GLY A 7 -4.010 8.287 8.193 1.00 54.42 H new ATOM 0 HA3 GLY A 7 -4.001 10.038 8.274 1.00 54.42 H new ATOM 118 N ALA A 8 -6.384 10.084 6.693 1.00 21.52 N ATOM 119 CA ALA A 8 -7.835 10.196 6.405 1.00 12.13 C ATOM 120 C ALA A 8 -8.394 8.897 5.770 1.00 43.21 C ATOM 121 O ALA A 8 -9.465 8.406 6.160 1.00 33.35 O ATOM 122 CB ALA A 8 -8.092 11.394 5.471 1.00 12.33 C ATOM 0 H ALA A 8 -5.813 10.741 6.162 1.00 21.52 H new ATOM 0 HA ALA A 8 -8.354 10.352 7.351 1.00 12.13 H new ATOM 0 HB1 ALA A 8 -9.159 11.471 5.263 1.00 12.33 H new ATOM 0 HB2 ALA A 8 -7.749 12.310 5.952 1.00 12.33 H new ATOM 0 HB3 ALA A 8 -7.550 11.250 4.536 1.00 12.33 H new ATOM 128 N ASN A 9 -7.643 8.350 4.792 1.00 50.50 N ATOM 129 CA ASN A 9 -7.997 7.097 4.091 1.00 23.03 C ATOM 130 C ASN A 9 -7.941 5.887 5.040 1.00 33.33 C ATOM 131 O ASN A 9 -8.824 5.040 5.007 1.00 32.51 O ATOM 132 CB ASN A 9 -7.060 6.853 2.877 1.00 43.22 C ATOM 133 CG ASN A 9 -7.186 7.911 1.783 1.00 10.21 C ATOM 134 OD1 ASN A 9 -8.234 8.526 1.602 1.00 1.03 O ATOM 135 ND2 ASN A 9 -6.123 8.122 1.032 1.00 51.03 N ATOM 0 H ASN A 9 -6.771 8.766 4.465 1.00 50.50 H new ATOM 0 HA ASN A 9 -9.020 7.209 3.732 1.00 23.03 H new ATOM 0 HB2 ASN A 9 -6.028 6.825 3.226 1.00 43.22 H new ATOM 0 HB3 ASN A 9 -7.279 5.874 2.451 1.00 43.22 H new ATOM 0 HD21 ASN A 9 -6.159 8.810 0.279 1.00 51.03 H new ATOM 0 HD22 ASN A 9 -5.265 7.598 1.204 1.00 51.03 H new ATOM 142 N ALA A 10 -6.922 5.848 5.919 1.00 40.11 N ATOM 143 CA ALA A 10 -6.680 4.704 6.832 1.00 14.45 C ATOM 144 C ALA A 10 -7.814 4.545 7.871 1.00 41.25 C ATOM 145 O ALA A 10 -8.166 3.425 8.247 1.00 61.12 O ATOM 146 CB ALA A 10 -5.331 4.885 7.538 1.00 42.20 C ATOM 0 H ALA A 10 -6.243 6.603 6.020 1.00 40.11 H new ATOM 0 HA ALA A 10 -6.661 3.793 6.233 1.00 14.45 H new ATOM 0 HB1 ALA A 10 -5.155 4.044 8.208 1.00 42.20 H new ATOM 0 HB2 ALA A 10 -4.535 4.930 6.795 1.00 42.20 H new ATOM 0 HB3 ALA A 10 -5.343 5.811 8.113 1.00 42.20 H new ATOM 152 N GLY A 11 -8.385 5.684 8.310 1.00 31.34 N ATOM 153 CA GLY A 11 -9.535 5.684 9.228 1.00 44.22 C ATOM 154 C GLY A 11 -10.801 5.067 8.612 1.00 42.03 C ATOM 155 O GLY A 11 -11.548 4.349 9.288 1.00 22.22 O ATOM 0 H GLY A 11 -8.066 6.615 8.042 1.00 31.34 H new ATOM 0 HA2 GLY A 11 -9.272 5.132 10.130 1.00 44.22 H new ATOM 0 HA3 GLY A 11 -9.749 6.709 9.532 1.00 44.22 H new ATOM 159 N LYS A 12 -11.026 5.356 7.314 1.00 74.20 N ATOM 160 CA LYS A 12 -12.170 4.819 6.536 1.00 3.34 C ATOM 161 C LYS A 12 -11.961 3.327 6.151 1.00 2.21 C ATOM 162 O LYS A 12 -12.896 2.516 6.220 1.00 41.35 O ATOM 163 CB LYS A 12 -12.382 5.683 5.260 1.00 21.44 C ATOM 164 CG LYS A 12 -13.607 5.280 4.408 1.00 14.34 C ATOM 165 CD LYS A 12 -13.891 6.264 3.249 1.00 35.44 C ATOM 166 CE LYS A 12 -15.173 5.903 2.477 1.00 21.22 C ATOM 167 NZ LYS A 12 -16.371 5.868 3.358 1.00 60.25 N ATOM 0 H LYS A 12 -10.419 5.970 6.771 1.00 74.20 H new ATOM 0 HA LYS A 12 -13.059 4.868 7.165 1.00 3.34 H new ATOM 0 HB2 LYS A 12 -12.490 6.726 5.557 1.00 21.44 H new ATOM 0 HB3 LYS A 12 -11.488 5.618 4.640 1.00 21.44 H new ATOM 0 HG2 LYS A 12 -13.445 4.283 3.998 1.00 14.34 H new ATOM 0 HG3 LYS A 12 -14.486 5.222 5.051 1.00 14.34 H new ATOM 0 HD2 LYS A 12 -13.982 7.275 3.647 1.00 35.44 H new ATOM 0 HD3 LYS A 12 -13.045 6.267 2.562 1.00 35.44 H new ATOM 0 HE2 LYS A 12 -15.332 6.630 1.680 1.00 21.22 H new ATOM 0 HE3 LYS A 12 -15.046 4.931 2.001 1.00 21.22 H new ATOM 0 HZ1 LYS A 12 -17.231 5.858 2.774 1.00 60.25 H new ATOM 0 HZ2 LYS A 12 -16.343 5.012 3.948 1.00 60.25 H new ATOM 0 HZ3 LYS A 12 -16.377 6.710 3.969 1.00 60.25 H new ATOM 181 N VAL A 13 -10.721 2.983 5.752 1.00 21.23 N ATOM 182 CA VAL A 13 -10.351 1.615 5.321 1.00 70.14 C ATOM 183 C VAL A 13 -10.416 0.619 6.498 1.00 72.42 C ATOM 184 O VAL A 13 -10.993 -0.462 6.364 1.00 0.11 O ATOM 185 CB VAL A 13 -8.932 1.593 4.620 1.00 61.14 C ATOM 186 CG1 VAL A 13 -8.430 0.149 4.365 1.00 63.34 C ATOM 187 CG2 VAL A 13 -8.970 2.388 3.285 1.00 42.44 C ATOM 0 H VAL A 13 -9.945 3.644 5.718 1.00 21.23 H new ATOM 0 HA VAL A 13 -11.084 1.295 4.581 1.00 70.14 H new ATOM 0 HB VAL A 13 -8.230 2.071 5.303 1.00 61.14 H new ATOM 0 HG11 VAL A 13 -7.453 0.183 3.883 1.00 63.34 H new ATOM 0 HG12 VAL A 13 -8.348 -0.381 5.314 1.00 63.34 H new ATOM 0 HG13 VAL A 13 -9.136 -0.373 3.719 1.00 63.34 H new ATOM 0 HG21 VAL A 13 -7.986 2.362 2.818 1.00 42.44 H new ATOM 0 HG22 VAL A 13 -9.702 1.938 2.614 1.00 42.44 H new ATOM 0 HG23 VAL A 13 -9.249 3.422 3.485 1.00 42.44 H new ATOM 197 N TRP A 14 -9.857 1.025 7.654 1.00 42.33 N ATOM 198 CA TRP A 14 -9.892 0.208 8.890 1.00 10.12 C ATOM 199 C TRP A 14 -11.344 0.023 9.397 1.00 22.11 C ATOM 200 O TRP A 14 -11.689 -1.027 9.944 1.00 1.32 O ATOM 201 CB TRP A 14 -9.001 0.821 10.003 1.00 62.14 C ATOM 202 CG TRP A 14 -8.701 -0.138 11.143 1.00 54.42 C ATOM 203 CD1 TRP A 14 -7.661 -1.014 11.231 1.00 61.13 C ATOM 204 CD2 TRP A 14 -9.476 -0.331 12.327 1.00 1.10 C ATOM 205 NE1 TRP A 14 -7.725 -1.707 12.416 1.00 61.33 N ATOM 206 CE2 TRP A 14 -8.837 -1.307 13.104 1.00 43.41 C ATOM 207 CE3 TRP A 14 -10.643 0.252 12.793 1.00 20.25 C ATOM 208 CZ2 TRP A 14 -9.342 -1.724 14.335 1.00 53.13 C ATOM 209 CZ3 TRP A 14 -11.156 -0.155 14.011 1.00 12.14 C ATOM 210 CH2 TRP A 14 -10.500 -1.132 14.776 1.00 62.43 C ATOM 0 H TRP A 14 -9.373 1.917 7.761 1.00 42.33 H new ATOM 0 HA TRP A 14 -9.489 -0.773 8.640 1.00 10.12 H new ATOM 0 HB2 TRP A 14 -8.061 1.153 9.562 1.00 62.14 H new ATOM 0 HB3 TRP A 14 -9.494 1.706 10.405 1.00 62.14 H new ATOM 0 HD1 TRP A 14 -6.897 -1.145 10.479 1.00 61.13 H new ATOM 0 HE1 TRP A 14 -7.052 -2.406 12.731 1.00 61.33 H new ATOM 0 HE3 TRP A 14 -11.145 1.013 12.214 1.00 20.25 H new ATOM 0 HZ2 TRP A 14 -8.842 -2.483 14.919 1.00 53.13 H new ATOM 0 HZ3 TRP A 14 -12.072 0.284 14.378 1.00 12.14 H new ATOM 0 HH2 TRP A 14 -10.914 -1.424 15.730 1.00 62.43 H new ATOM 221 N HIS A 15 -12.178 1.061 9.208 1.00 22.42 N ATOM 222 CA HIS A 15 -13.615 1.026 9.563 1.00 60.31 C ATOM 223 C HIS A 15 -14.359 -0.078 8.771 1.00 31.42 C ATOM 224 O HIS A 15 -15.153 -0.840 9.340 1.00 41.24 O ATOM 225 CB HIS A 15 -14.243 2.414 9.299 1.00 53.33 C ATOM 226 CG HIS A 15 -15.666 2.561 9.761 1.00 35.12 C ATOM 227 ND1 HIS A 15 -16.001 2.902 11.050 1.00 5.14 N ATOM 228 CD2 HIS A 15 -16.839 2.434 9.097 1.00 65.01 C ATOM 229 CE1 HIS A 15 -17.308 2.980 11.159 1.00 21.54 C ATOM 230 NE2 HIS A 15 -17.844 2.706 9.993 1.00 63.34 N ATOM 0 H HIS A 15 -11.879 1.949 8.805 1.00 22.42 H new ATOM 0 HA HIS A 15 -13.712 0.786 10.622 1.00 60.31 H new ATOM 0 HB2 HIS A 15 -13.635 3.172 9.793 1.00 53.33 H new ATOM 0 HB3 HIS A 15 -14.200 2.619 8.229 1.00 53.33 H new ATOM 0 HD1 HIS A 15 -15.337 3.069 11.806 1.00 5.14 H new ATOM 0 HD2 HIS A 15 -16.962 2.169 8.057 1.00 65.01 H new ATOM 0 HE1 HIS A 15 -17.851 3.228 12.059 1.00 21.54 H new ATOM 239 N ALA A 16 -14.077 -0.146 7.459 1.00 74.32 N ATOM 240 CA ALA A 16 -14.632 -1.188 6.572 1.00 5.02 C ATOM 241 C ALA A 16 -14.033 -2.585 6.885 1.00 63.14 C ATOM 242 O ALA A 16 -14.724 -3.599 6.803 1.00 62.22 O ATOM 243 CB ALA A 16 -14.407 -0.810 5.105 1.00 14.02 C ATOM 0 H ALA A 16 -13.462 0.514 6.984 1.00 74.32 H new ATOM 0 HA ALA A 16 -15.705 -1.250 6.756 1.00 5.02 H new ATOM 0 HB1 ALA A 16 -14.821 -1.586 4.462 1.00 14.02 H new ATOM 0 HB2 ALA A 16 -14.902 0.138 4.894 1.00 14.02 H new ATOM 0 HB3 ALA A 16 -13.338 -0.712 4.914 1.00 14.02 H new ATOM 249 N LEU A 17 -12.743 -2.620 7.244 1.00 53.45 N ATOM 250 CA LEU A 17 -12.046 -3.856 7.679 1.00 71.12 C ATOM 251 C LEU A 17 -12.715 -4.473 8.923 1.00 75.41 C ATOM 252 O LEU A 17 -12.938 -5.684 8.983 1.00 2.33 O ATOM 253 CB LEU A 17 -10.560 -3.535 7.985 1.00 2.23 C ATOM 254 CG LEU A 17 -9.630 -3.393 6.748 1.00 1.11 C ATOM 255 CD1 LEU A 17 -8.301 -2.719 7.131 1.00 71.23 C ATOM 256 CD2 LEU A 17 -9.396 -4.774 6.091 1.00 51.22 C ATOM 0 H LEU A 17 -12.144 -1.794 7.244 1.00 53.45 H new ATOM 0 HA LEU A 17 -12.108 -4.584 6.870 1.00 71.12 H new ATOM 0 HB2 LEU A 17 -10.518 -2.607 8.556 1.00 2.23 H new ATOM 0 HB3 LEU A 17 -10.163 -4.322 8.626 1.00 2.23 H new ATOM 0 HG LEU A 17 -10.121 -2.750 6.017 1.00 1.11 H new ATOM 0 HD11 LEU A 17 -7.669 -2.632 6.247 1.00 71.23 H new ATOM 0 HD12 LEU A 17 -8.500 -1.726 7.534 1.00 71.23 H new ATOM 0 HD13 LEU A 17 -7.791 -3.321 7.883 1.00 71.23 H new ATOM 0 HD21 LEU A 17 -8.743 -4.659 5.226 1.00 51.22 H new ATOM 0 HD22 LEU A 17 -8.929 -5.445 6.812 1.00 51.22 H new ATOM 0 HD23 LEU A 17 -10.351 -5.192 5.772 1.00 51.22 H new ATOM 268 N ASN A 18 -13.064 -3.601 9.888 1.00 45.40 N ATOM 269 CA ASN A 18 -13.639 -3.992 11.199 1.00 20.34 C ATOM 270 C ASN A 18 -14.974 -4.783 11.046 1.00 21.41 C ATOM 271 O ASN A 18 -15.342 -5.578 11.924 1.00 22.12 O ATOM 272 CB ASN A 18 -13.847 -2.714 12.051 1.00 25.43 C ATOM 273 CG ASN A 18 -14.273 -3.007 13.490 1.00 2.22 C ATOM 274 OD1 ASN A 18 -15.451 -3.148 13.779 1.00 51.01 O ATOM 275 ND2 ASN A 18 -13.323 -3.079 14.405 1.00 63.53 N ATOM 0 H ASN A 18 -12.955 -2.592 9.783 1.00 45.40 H new ATOM 0 HA ASN A 18 -12.941 -4.664 11.699 1.00 20.34 H new ATOM 0 HB2 ASN A 18 -12.921 -2.140 12.064 1.00 25.43 H new ATOM 0 HB3 ASN A 18 -14.603 -2.089 11.576 1.00 25.43 H new ATOM 0 HD21 ASN A 18 -13.566 -3.256 15.380 1.00 63.53 H new ATOM 0 HD22 ASN A 18 -12.346 -2.958 14.137 1.00 63.53 H new ATOM 282 N GLU A 19 -15.669 -4.567 9.912 1.00 3.42 N ATOM 283 CA GLU A 19 -16.934 -5.263 9.573 1.00 52.20 C ATOM 284 C GLU A 19 -16.693 -6.781 9.348 1.00 3.20 C ATOM 285 O GLU A 19 -17.472 -7.629 9.816 1.00 63.35 O ATOM 286 CB GLU A 19 -17.538 -4.635 8.290 1.00 74.33 C ATOM 287 CG GLU A 19 -17.712 -3.097 8.340 1.00 15.24 C ATOM 288 CD GLU A 19 -18.029 -2.452 6.972 1.00 62.22 C ATOM 289 OE1 GLU A 19 -17.599 -2.997 5.922 1.00 12.41 O ATOM 290 OE2 GLU A 19 -18.681 -1.393 6.943 1.00 4.23 O ATOM 0 H GLU A 19 -15.370 -3.902 9.199 1.00 3.42 H new ATOM 0 HA GLU A 19 -17.627 -5.148 10.406 1.00 52.20 H new ATOM 0 HB2 GLU A 19 -16.899 -4.887 7.444 1.00 74.33 H new ATOM 0 HB3 GLU A 19 -18.510 -5.091 8.102 1.00 74.33 H new ATOM 0 HG2 GLU A 19 -18.514 -2.856 9.038 1.00 15.24 H new ATOM 0 HG3 GLU A 19 -16.800 -2.652 8.737 1.00 15.24 H new ATOM 297 N ALA A 20 -15.593 -7.101 8.630 1.00 4.34 N ATOM 298 CA ALA A 20 -15.218 -8.492 8.288 1.00 33.43 C ATOM 299 C ALA A 20 -13.710 -8.602 7.949 1.00 45.41 C ATOM 300 O ALA A 20 -13.260 -8.079 6.920 1.00 2.11 O ATOM 301 CB ALA A 20 -16.077 -9.012 7.114 1.00 72.34 C ATOM 0 H ALA A 20 -14.941 -6.403 8.272 1.00 4.34 H new ATOM 0 HA ALA A 20 -15.410 -9.114 9.162 1.00 33.43 H new ATOM 0 HB1 ALA A 20 -15.787 -10.036 6.877 1.00 72.34 H new ATOM 0 HB2 ALA A 20 -17.130 -8.989 7.395 1.00 72.34 H new ATOM 0 HB3 ALA A 20 -15.921 -8.379 6.241 1.00 72.34 H new ATOM 307 N ASP A 21 -12.940 -9.267 8.837 1.00 51.01 N ATOM 308 CA ASP A 21 -11.504 -9.570 8.615 1.00 73.22 C ATOM 309 C ASP A 21 -11.325 -10.765 7.644 1.00 62.23 C ATOM 310 O ASP A 21 -12.264 -11.542 7.427 1.00 54.52 O ATOM 311 CB ASP A 21 -10.799 -9.856 9.971 1.00 24.10 C ATOM 312 CG ASP A 21 -11.360 -11.076 10.729 1.00 23.21 C ATOM 313 OD1 ASP A 21 -12.519 -11.013 11.192 1.00 2.02 O ATOM 314 OD2 ASP A 21 -10.643 -12.091 10.876 1.00 32.42 O ATOM 0 H ASP A 21 -13.294 -9.610 9.730 1.00 51.01 H new ATOM 0 HA ASP A 21 -11.041 -8.697 8.155 1.00 73.22 H new ATOM 0 HB2 ASP A 21 -9.736 -10.013 9.789 1.00 24.10 H new ATOM 0 HB3 ASP A 21 -10.887 -8.975 10.607 1.00 24.10 H new ATOM 319 N GLY A 22 -10.110 -10.918 7.087 1.00 43.23 N ATOM 320 CA GLY A 22 -9.843 -11.964 6.088 1.00 2.44 C ATOM 321 C GLY A 22 -10.459 -11.631 4.734 1.00 71.43 C ATOM 322 O GLY A 22 -11.339 -12.344 4.236 1.00 42.04 O ATOM 0 H GLY A 22 -9.304 -10.334 7.311 1.00 43.23 H new ATOM 0 HA2 GLY A 22 -8.766 -12.091 5.975 1.00 2.44 H new ATOM 0 HA3 GLY A 22 -10.241 -12.915 6.443 1.00 2.44 H new ATOM 326 N ILE A 23 -9.998 -10.515 4.149 1.00 14.40 N ATOM 327 CA ILE A 23 -10.594 -9.921 2.941 1.00 14.13 C ATOM 328 C ILE A 23 -9.499 -9.368 1.994 1.00 11.11 C ATOM 329 O ILE A 23 -8.544 -8.733 2.440 1.00 44.31 O ATOM 330 CB ILE A 23 -11.624 -8.796 3.360 1.00 12.43 C ATOM 331 CG1 ILE A 23 -12.315 -8.157 2.118 1.00 24.20 C ATOM 332 CG2 ILE A 23 -10.968 -7.713 4.258 1.00 62.44 C ATOM 333 CD1 ILE A 23 -13.411 -7.156 2.447 1.00 4.15 C ATOM 0 H ILE A 23 -9.195 -9.995 4.503 1.00 14.40 H new ATOM 0 HA ILE A 23 -11.129 -10.694 2.389 1.00 14.13 H new ATOM 0 HB ILE A 23 -12.398 -9.283 3.953 1.00 12.43 H new ATOM 0 HG12 ILE A 23 -11.557 -7.660 1.513 1.00 24.20 H new ATOM 0 HG13 ILE A 23 -12.740 -8.953 1.506 1.00 24.20 H new ATOM 0 HG21 ILE A 23 -11.711 -6.960 4.522 1.00 62.44 H new ATOM 0 HG22 ILE A 23 -10.583 -8.177 5.166 1.00 62.44 H new ATOM 0 HG23 ILE A 23 -10.148 -7.240 3.717 1.00 62.44 H new ATOM 0 HD11 ILE A 23 -13.835 -6.763 1.523 1.00 4.15 H new ATOM 0 HD12 ILE A 23 -14.193 -7.649 3.024 1.00 4.15 H new ATOM 0 HD13 ILE A 23 -12.992 -6.336 3.031 1.00 4.15 H new ATOM 345 N SER A 24 -9.641 -9.638 0.683 1.00 24.31 N ATOM 346 CA SER A 24 -8.692 -9.160 -0.353 1.00 55.32 C ATOM 347 C SER A 24 -8.789 -7.628 -0.544 1.00 31.23 C ATOM 348 O SER A 24 -9.852 -7.035 -0.321 1.00 21.34 O ATOM 349 CB SER A 24 -8.966 -9.879 -1.693 1.00 65.25 C ATOM 350 OG SER A 24 -8.827 -11.284 -1.559 1.00 24.33 O ATOM 0 H SER A 24 -10.412 -10.191 0.308 1.00 24.31 H new ATOM 0 HA SER A 24 -7.682 -9.393 -0.017 1.00 55.32 H new ATOM 0 HB2 SER A 24 -9.973 -9.642 -2.037 1.00 65.25 H new ATOM 0 HB3 SER A 24 -8.275 -9.513 -2.453 1.00 65.25 H new ATOM 0 HG SER A 24 -9.007 -11.714 -2.421 1.00 24.33 H new ATOM 356 N ILE A 25 -7.672 -7.010 -0.988 1.00 2.43 N ATOM 357 CA ILE A 25 -7.566 -5.539 -1.186 1.00 20.21 C ATOM 358 C ILE A 25 -8.663 -4.955 -2.162 1.00 25.40 C ATOM 359 O ILE A 25 -9.283 -3.947 -1.813 1.00 10.31 O ATOM 360 CB ILE A 25 -6.128 -5.122 -1.699 1.00 20.43 C ATOM 361 CG1 ILE A 25 -5.014 -5.674 -0.745 1.00 31.44 C ATOM 362 CG2 ILE A 25 -6.012 -3.584 -1.866 1.00 41.14 C ATOM 363 CD1 ILE A 25 -3.582 -5.394 -1.191 1.00 5.32 C ATOM 0 H ILE A 25 -6.816 -7.513 -1.221 1.00 2.43 H new ATOM 0 HA ILE A 25 -7.740 -5.106 -0.201 1.00 20.21 H new ATOM 0 HB ILE A 25 -5.982 -5.569 -2.682 1.00 20.43 H new ATOM 0 HG12 ILE A 25 -5.160 -5.244 0.246 1.00 31.44 H new ATOM 0 HG13 ILE A 25 -5.143 -6.752 -0.647 1.00 31.44 H new ATOM 0 HG21 ILE A 25 -5.012 -3.331 -2.219 1.00 41.14 H new ATOM 0 HG22 ILE A 25 -6.751 -3.240 -2.590 1.00 41.14 H new ATOM 0 HG23 ILE A 25 -6.191 -3.099 -0.906 1.00 41.14 H new ATOM 0 HD11 ILE A 25 -2.886 -5.815 -0.466 1.00 5.32 H new ATOM 0 HD12 ILE A 25 -3.409 -5.849 -2.166 1.00 5.32 H new ATOM 0 HD13 ILE A 25 -3.426 -4.317 -1.260 1.00 5.32 H new ATOM 375 N PRO A 26 -8.939 -5.562 -3.389 1.00 33.33 N ATOM 376 CA PRO A 26 -9.988 -5.040 -4.316 1.00 64.13 C ATOM 377 C PRO A 26 -11.436 -5.157 -3.760 1.00 45.22 C ATOM 378 O PRO A 26 -12.284 -4.320 -4.059 1.00 41.13 O ATOM 379 CB PRO A 26 -9.799 -5.903 -5.599 1.00 64.03 C ATOM 380 CG PRO A 26 -9.184 -7.172 -5.106 1.00 42.45 C ATOM 381 CD PRO A 26 -8.248 -6.744 -3.993 1.00 32.45 C ATOM 0 HA PRO A 26 -9.870 -3.970 -4.485 1.00 64.13 H new ATOM 0 HB2 PRO A 26 -10.751 -6.090 -6.096 1.00 64.03 H new ATOM 0 HB3 PRO A 26 -9.154 -5.404 -6.322 1.00 64.03 H new ATOM 0 HG2 PRO A 26 -9.943 -7.863 -4.740 1.00 42.45 H new ATOM 0 HG3 PRO A 26 -8.644 -7.685 -5.902 1.00 42.45 H new ATOM 0 HD2 PRO A 26 -8.103 -7.540 -3.263 1.00 32.45 H new ATOM 0 HD3 PRO A 26 -7.263 -6.480 -4.377 1.00 32.45 H new ATOM 389 N GLU A 27 -11.693 -6.178 -2.926 1.00 34.33 N ATOM 390 CA GLU A 27 -13.027 -6.415 -2.317 1.00 73.23 C ATOM 391 C GLU A 27 -13.333 -5.313 -1.281 1.00 34.33 C ATOM 392 O GLU A 27 -14.422 -4.721 -1.242 1.00 35.10 O ATOM 393 CB GLU A 27 -13.032 -7.812 -1.647 1.00 15.04 C ATOM 394 CG GLU A 27 -14.391 -8.258 -1.063 1.00 31.11 C ATOM 395 CD GLU A 27 -15.560 -8.168 -2.063 1.00 13.33 C ATOM 396 OE1 GLU A 27 -15.513 -8.844 -3.116 1.00 5.11 O ATOM 397 OE2 GLU A 27 -16.523 -7.402 -1.814 1.00 22.41 O ATOM 0 H GLU A 27 -10.990 -6.864 -2.651 1.00 34.33 H new ATOM 0 HA GLU A 27 -13.799 -6.384 -3.086 1.00 73.23 H new ATOM 0 HB2 GLU A 27 -12.711 -8.550 -2.382 1.00 15.04 H new ATOM 0 HB3 GLU A 27 -12.292 -7.816 -0.847 1.00 15.04 H new ATOM 0 HG2 GLU A 27 -14.305 -9.286 -0.712 1.00 31.11 H new ATOM 0 HG3 GLU A 27 -14.621 -7.642 -0.193 1.00 31.11 H new ATOM 404 N LEU A 28 -12.320 -5.073 -0.461 1.00 31.04 N ATOM 405 CA LEU A 28 -12.241 -3.971 0.505 1.00 22.30 C ATOM 406 C LEU A 28 -12.321 -2.578 -0.185 1.00 70.30 C ATOM 407 O LEU A 28 -12.938 -1.647 0.347 1.00 13.54 O ATOM 408 CB LEU A 28 -10.900 -4.160 1.251 1.00 43.11 C ATOM 409 CG LEU A 28 -10.452 -3.051 2.231 1.00 45.33 C ATOM 410 CD1 LEU A 28 -11.447 -2.865 3.400 1.00 40.53 C ATOM 411 CD2 LEU A 28 -9.016 -3.352 2.719 1.00 61.31 C ATOM 0 H LEU A 28 -11.489 -5.665 -0.445 1.00 31.04 H new ATOM 0 HA LEU A 28 -13.087 -3.995 1.192 1.00 22.30 H new ATOM 0 HB2 LEU A 28 -10.957 -5.095 1.808 1.00 43.11 H new ATOM 0 HB3 LEU A 28 -10.116 -4.282 0.503 1.00 43.11 H new ATOM 0 HG LEU A 28 -10.447 -2.097 1.703 1.00 45.33 H new ATOM 0 HD11 LEU A 28 -11.089 -2.076 4.061 1.00 40.53 H new ATOM 0 HD12 LEU A 28 -12.425 -2.591 3.005 1.00 40.53 H new ATOM 0 HD13 LEU A 28 -11.529 -3.797 3.960 1.00 40.53 H new ATOM 0 HD21 LEU A 28 -8.696 -2.573 3.410 1.00 61.31 H new ATOM 0 HD22 LEU A 28 -8.999 -4.317 3.226 1.00 61.31 H new ATOM 0 HD23 LEU A 28 -8.340 -3.379 1.865 1.00 61.31 H new ATOM 423 N ALA A 29 -11.704 -2.470 -1.382 1.00 13.30 N ATOM 424 CA ALA A 29 -11.666 -1.214 -2.177 1.00 31.41 C ATOM 425 C ALA A 29 -13.078 -0.733 -2.589 1.00 54.23 C ATOM 426 O ALA A 29 -13.340 0.467 -2.631 1.00 12.02 O ATOM 427 CB ALA A 29 -10.773 -1.386 -3.419 1.00 62.35 C ATOM 0 H ALA A 29 -11.217 -3.248 -1.828 1.00 13.30 H new ATOM 0 HA ALA A 29 -11.239 -0.444 -1.535 1.00 31.41 H new ATOM 0 HB1 ALA A 29 -10.758 -0.456 -3.988 1.00 62.35 H new ATOM 0 HB2 ALA A 29 -9.759 -1.637 -3.106 1.00 62.35 H new ATOM 0 HB3 ALA A 29 -11.169 -2.187 -4.043 1.00 62.35 H new ATOM 433 N ARG A 30 -13.981 -1.686 -2.897 1.00 25.24 N ATOM 434 CA ARG A 30 -15.402 -1.379 -3.207 1.00 31.21 C ATOM 435 C ARG A 30 -16.168 -0.900 -1.944 1.00 1.42 C ATOM 436 O ARG A 30 -16.984 0.020 -2.037 1.00 3.24 O ATOM 437 CB ARG A 30 -16.124 -2.602 -3.851 1.00 3.14 C ATOM 438 CG ARG A 30 -15.943 -2.764 -5.386 1.00 14.45 C ATOM 439 CD ARG A 30 -14.479 -2.910 -5.838 1.00 20.52 C ATOM 440 NE ARG A 30 -14.367 -3.328 -7.248 1.00 55.31 N ATOM 441 CZ ARG A 30 -14.306 -2.528 -8.294 1.00 2.21 C ATOM 442 NH1 ARG A 30 -14.328 -1.233 -8.171 1.00 61.23 N ATOM 443 NH2 ARG A 30 -14.203 -3.041 -9.473 1.00 11.40 N ATOM 0 H ARG A 30 -13.755 -2.680 -2.939 1.00 25.24 H new ATOM 0 HA ARG A 30 -15.402 -0.566 -3.933 1.00 31.21 H new ATOM 0 HB2 ARG A 30 -15.765 -3.509 -3.364 1.00 3.14 H new ATOM 0 HB3 ARG A 30 -17.190 -2.525 -3.636 1.00 3.14 H new ATOM 0 HG2 ARG A 30 -16.502 -3.640 -5.716 1.00 14.45 H new ATOM 0 HG3 ARG A 30 -16.381 -1.900 -5.885 1.00 14.45 H new ATOM 0 HD2 ARG A 30 -13.962 -1.960 -5.701 1.00 20.52 H new ATOM 0 HD3 ARG A 30 -13.977 -3.640 -5.204 1.00 20.52 H new ATOM 0 HE ARG A 30 -14.334 -4.331 -7.431 1.00 55.31 H new ATOM 0 HH11 ARG A 30 -14.394 -0.810 -7.245 1.00 61.23 H new ATOM 0 HH12 ARG A 30 -14.279 -0.641 -9.000 1.00 61.23 H new ATOM 0 HH21 ARG A 30 -14.170 -4.054 -9.587 1.00 11.40 H new ATOM 0 HH22 ARG A 30 -14.155 -2.434 -10.291 1.00 11.40 H new ATOM 457 N LYS A 31 -15.885 -1.511 -0.768 1.00 71.24 N ATOM 458 CA LYS A 31 -16.551 -1.134 0.513 1.00 2.22 C ATOM 459 C LYS A 31 -16.212 0.317 0.927 1.00 14.45 C ATOM 460 O LYS A 31 -17.083 1.062 1.386 1.00 33.32 O ATOM 461 CB LYS A 31 -16.175 -2.106 1.665 1.00 51.34 C ATOM 462 CG LYS A 31 -16.545 -3.589 1.409 1.00 63.14 C ATOM 463 CD LYS A 31 -16.667 -4.412 2.713 1.00 54.43 C ATOM 464 CE LYS A 31 -15.405 -4.373 3.584 1.00 61.35 C ATOM 465 NZ LYS A 31 -15.596 -5.126 4.847 1.00 50.02 N ATOM 0 H LYS A 31 -15.204 -2.264 -0.675 1.00 71.24 H new ATOM 0 HA LYS A 31 -17.624 -1.205 0.335 1.00 2.22 H new ATOM 0 HB2 LYS A 31 -15.102 -2.039 1.843 1.00 51.34 H new ATOM 0 HB3 LYS A 31 -16.670 -1.775 2.578 1.00 51.34 H new ATOM 0 HG2 LYS A 31 -17.490 -3.634 0.867 1.00 63.14 H new ATOM 0 HG3 LYS A 31 -15.788 -4.042 0.769 1.00 63.14 H new ATOM 0 HD2 LYS A 31 -17.510 -4.036 3.293 1.00 54.43 H new ATOM 0 HD3 LYS A 31 -16.891 -5.448 2.459 1.00 54.43 H new ATOM 0 HE2 LYS A 31 -14.566 -4.795 3.031 1.00 61.35 H new ATOM 0 HE3 LYS A 31 -15.149 -3.338 3.811 1.00 61.35 H new ATOM 0 HZ1 LYS A 31 -14.903 -4.803 5.552 1.00 50.02 H new ATOM 0 HZ2 LYS A 31 -16.558 -4.962 5.207 1.00 50.02 H new ATOM 0 HZ3 LYS A 31 -15.461 -6.142 4.669 1.00 50.02 H new ATOM 479 N VAL A 32 -14.935 0.699 0.761 1.00 42.13 N ATOM 480 CA VAL A 32 -14.465 2.087 1.006 1.00 62.43 C ATOM 481 C VAL A 32 -14.697 2.994 -0.230 1.00 33.45 C ATOM 482 O VAL A 32 -14.512 4.211 -0.157 1.00 55.54 O ATOM 483 CB VAL A 32 -12.946 2.104 1.421 1.00 53.42 C ATOM 484 CG1 VAL A 32 -12.720 1.232 2.671 1.00 44.02 C ATOM 485 CG2 VAL A 32 -12.012 1.658 0.266 1.00 20.31 C ATOM 0 H VAL A 32 -14.198 0.064 0.455 1.00 42.13 H new ATOM 0 HA VAL A 32 -15.054 2.487 1.831 1.00 62.43 H new ATOM 0 HB VAL A 32 -12.688 3.137 1.656 1.00 53.42 H new ATOM 0 HG11 VAL A 32 -11.665 1.255 2.945 1.00 44.02 H new ATOM 0 HG12 VAL A 32 -13.317 1.618 3.497 1.00 44.02 H new ATOM 0 HG13 VAL A 32 -13.017 0.205 2.457 1.00 44.02 H new ATOM 0 HG21 VAL A 32 -10.976 1.687 0.604 1.00 20.31 H new ATOM 0 HG22 VAL A 32 -12.267 0.642 -0.036 1.00 20.31 H new ATOM 0 HG23 VAL A 32 -12.136 2.331 -0.583 1.00 20.31 H new ATOM 495 N ASN A 33 -15.056 2.356 -1.367 1.00 22.41 N ATOM 496 CA ASN A 33 -15.428 3.014 -2.645 1.00 62.43 C ATOM 497 C ASN A 33 -14.203 3.704 -3.328 1.00 51.52 C ATOM 498 O ASN A 33 -14.358 4.513 -4.248 1.00 61.43 O ATOM 499 CB ASN A 33 -16.640 3.988 -2.435 1.00 25.34 C ATOM 500 CG ASN A 33 -17.384 4.363 -3.724 1.00 41.11 C ATOM 501 OD1 ASN A 33 -17.856 5.479 -3.875 1.00 11.04 O ATOM 502 ND2 ASN A 33 -17.542 3.419 -4.644 1.00 73.44 N ATOM 0 H ASN A 33 -15.097 1.338 -1.425 1.00 22.41 H new ATOM 0 HA ASN A 33 -15.755 2.241 -3.341 1.00 62.43 H new ATOM 0 HB2 ASN A 33 -17.346 3.527 -1.744 1.00 25.34 H new ATOM 0 HB3 ASN A 33 -16.279 4.900 -1.960 1.00 25.34 H new ATOM 0 HD21 ASN A 33 -18.066 3.620 -5.496 1.00 73.44 H new ATOM 0 HD22 ASN A 33 -17.140 2.493 -4.499 1.00 73.44 H new ATOM 509 N LEU A 34 -12.979 3.326 -2.895 1.00 4.12 N ATOM 510 CA LEU A 34 -11.707 3.839 -3.462 1.00 23.13 C ATOM 511 C LEU A 34 -11.106 2.819 -4.467 1.00 22.41 C ATOM 512 O LEU A 34 -11.641 1.723 -4.659 1.00 24.41 O ATOM 513 CB LEU A 34 -10.684 4.138 -2.320 1.00 55.22 C ATOM 514 CG LEU A 34 -11.171 5.100 -1.181 1.00 41.44 C ATOM 515 CD1 LEU A 34 -10.092 5.267 -0.085 1.00 23.10 C ATOM 516 CD2 LEU A 34 -11.614 6.471 -1.749 1.00 61.41 C ATOM 0 H LEU A 34 -12.843 2.654 -2.140 1.00 4.12 H new ATOM 0 HA LEU A 34 -11.918 4.766 -3.995 1.00 23.13 H new ATOM 0 HB2 LEU A 34 -10.393 3.191 -1.866 1.00 55.22 H new ATOM 0 HB3 LEU A 34 -9.787 4.566 -2.768 1.00 55.22 H new ATOM 0 HG LEU A 34 -12.044 4.641 -0.716 1.00 41.44 H new ATOM 0 HD11 LEU A 34 -10.461 5.940 0.689 1.00 23.10 H new ATOM 0 HD12 LEU A 34 -9.867 4.296 0.355 1.00 23.10 H new ATOM 0 HD13 LEU A 34 -9.187 5.684 -0.526 1.00 23.10 H new ATOM 0 HD21 LEU A 34 -11.945 7.113 -0.933 1.00 61.41 H new ATOM 0 HD22 LEU A 34 -10.775 6.941 -2.262 1.00 61.41 H new ATOM 0 HD23 LEU A 34 -12.434 6.326 -2.452 1.00 61.41 H new ATOM 528 N SER A 35 -9.998 3.205 -5.120 1.00 44.12 N ATOM 529 CA SER A 35 -9.240 2.310 -6.036 1.00 62.23 C ATOM 530 C SER A 35 -8.375 1.293 -5.250 1.00 64.33 C ATOM 531 O SER A 35 -8.057 1.522 -4.082 1.00 53.34 O ATOM 532 CB SER A 35 -8.342 3.163 -6.962 1.00 21.21 C ATOM 533 OG SER A 35 -7.565 2.353 -7.834 1.00 15.34 O ATOM 0 H SER A 35 -9.597 4.139 -5.035 1.00 44.12 H new ATOM 0 HA SER A 35 -9.956 1.745 -6.632 1.00 62.23 H new ATOM 0 HB2 SER A 35 -8.963 3.838 -7.550 1.00 21.21 H new ATOM 0 HB3 SER A 35 -7.681 3.784 -6.357 1.00 21.21 H new ATOM 0 HG SER A 35 -7.011 2.925 -8.405 1.00 15.34 H new ATOM 539 N VAL A 36 -7.990 0.179 -5.909 1.00 71.21 N ATOM 540 CA VAL A 36 -7.136 -0.879 -5.292 1.00 22.24 C ATOM 541 C VAL A 36 -5.785 -0.302 -4.797 1.00 20.53 C ATOM 542 O VAL A 36 -5.340 -0.606 -3.689 1.00 34.15 O ATOM 543 CB VAL A 36 -6.857 -2.058 -6.299 1.00 51.31 C ATOM 544 CG1 VAL A 36 -5.971 -3.167 -5.664 1.00 70.32 C ATOM 545 CG2 VAL A 36 -8.178 -2.650 -6.838 1.00 3.34 C ATOM 0 H VAL A 36 -8.255 -0.019 -6.874 1.00 71.21 H new ATOM 0 HA VAL A 36 -7.691 -1.266 -4.438 1.00 22.24 H new ATOM 0 HB VAL A 36 -6.301 -1.640 -7.138 1.00 51.31 H new ATOM 0 HG11 VAL A 36 -5.803 -3.960 -6.392 1.00 70.32 H new ATOM 0 HG12 VAL A 36 -5.013 -2.741 -5.365 1.00 70.32 H new ATOM 0 HG13 VAL A 36 -6.474 -3.578 -4.789 1.00 70.32 H new ATOM 0 HG21 VAL A 36 -7.957 -3.462 -7.531 1.00 3.34 H new ATOM 0 HG22 VAL A 36 -8.771 -3.033 -6.007 1.00 3.34 H new ATOM 0 HG23 VAL A 36 -8.740 -1.873 -7.357 1.00 3.34 H new ATOM 555 N GLU A 37 -5.161 0.535 -5.644 1.00 20.25 N ATOM 556 CA GLU A 37 -3.870 1.205 -5.341 1.00 63.13 C ATOM 557 C GLU A 37 -3.976 2.142 -4.109 1.00 12.22 C ATOM 558 O GLU A 37 -3.130 2.093 -3.212 1.00 30.52 O ATOM 559 CB GLU A 37 -3.387 1.997 -6.587 1.00 52.21 C ATOM 560 CG GLU A 37 -3.173 1.129 -7.841 1.00 41.11 C ATOM 561 CD GLU A 37 -2.715 1.942 -9.067 1.00 73.23 C ATOM 562 OE1 GLU A 37 -3.557 2.623 -9.692 1.00 11.40 O ATOM 563 OE2 GLU A 37 -1.514 1.923 -9.398 1.00 64.24 O ATOM 0 H GLU A 37 -5.534 0.771 -6.564 1.00 20.25 H new ATOM 0 HA GLU A 37 -3.141 0.433 -5.094 1.00 63.13 H new ATOM 0 HB2 GLU A 37 -4.117 2.773 -6.816 1.00 52.21 H new ATOM 0 HB3 GLU A 37 -2.452 2.501 -6.343 1.00 52.21 H new ATOM 0 HG2 GLU A 37 -2.430 0.362 -7.622 1.00 41.11 H new ATOM 0 HG3 GLU A 37 -4.102 0.613 -8.081 1.00 41.11 H new ATOM 570 N SER A 38 -5.041 2.968 -4.068 1.00 31.01 N ATOM 571 CA SER A 38 -5.287 3.928 -2.955 1.00 10.25 C ATOM 572 C SER A 38 -5.654 3.207 -1.636 1.00 64.14 C ATOM 573 O SER A 38 -5.353 3.700 -0.541 1.00 0.55 O ATOM 574 CB SER A 38 -6.397 4.935 -3.346 1.00 51.02 C ATOM 575 OG SER A 38 -7.597 4.277 -3.717 1.00 52.15 O ATOM 0 H SER A 38 -5.754 2.994 -4.796 1.00 31.01 H new ATOM 0 HA SER A 38 -4.357 4.470 -2.782 1.00 10.25 H new ATOM 0 HB2 SER A 38 -6.593 5.604 -2.508 1.00 51.02 H new ATOM 0 HB3 SER A 38 -6.051 5.554 -4.174 1.00 51.02 H new ATOM 0 HG SER A 38 -7.448 3.309 -3.732 1.00 52.15 H new ATOM 581 N THR A 39 -6.308 2.039 -1.760 1.00 23.13 N ATOM 582 CA THR A 39 -6.712 1.204 -0.603 1.00 61.54 C ATOM 583 C THR A 39 -5.494 0.463 0.008 1.00 25.31 C ATOM 584 O THR A 39 -5.287 0.517 1.213 1.00 50.42 O ATOM 585 CB THR A 39 -7.830 0.185 -1.011 1.00 31.10 C ATOM 586 OG1 THR A 39 -8.986 0.905 -1.476 1.00 73.42 O ATOM 587 CG2 THR A 39 -8.255 -0.740 0.146 1.00 1.13 C ATOM 0 H THR A 39 -6.574 1.643 -2.662 1.00 23.13 H new ATOM 0 HA THR A 39 -7.117 1.870 0.159 1.00 61.54 H new ATOM 0 HB THR A 39 -7.412 -0.444 -1.797 1.00 31.10 H new ATOM 0 HG1 THR A 39 -8.829 1.220 -2.390 1.00 73.42 H new ATOM 0 HG21 THR A 39 -9.032 -1.422 -0.200 1.00 1.13 H new ATOM 0 HG22 THR A 39 -7.394 -1.314 0.488 1.00 1.13 H new ATOM 0 HG23 THR A 39 -8.641 -0.139 0.969 1.00 1.13 H new ATOM 595 N ALA A 40 -4.679 -0.193 -0.847 1.00 11.11 N ATOM 596 CA ALA A 40 -3.453 -0.947 -0.425 1.00 5.44 C ATOM 597 C ALA A 40 -2.406 -0.018 0.243 1.00 1.21 C ATOM 598 O ALA A 40 -1.714 -0.407 1.189 1.00 31.05 O ATOM 599 CB ALA A 40 -2.824 -1.656 -1.640 1.00 21.51 C ATOM 0 H ALA A 40 -4.843 -0.221 -1.853 1.00 11.11 H new ATOM 0 HA ALA A 40 -3.760 -1.688 0.313 1.00 5.44 H new ATOM 0 HB1 ALA A 40 -1.935 -2.201 -1.323 1.00 21.51 H new ATOM 0 HB2 ALA A 40 -3.544 -2.354 -2.067 1.00 21.51 H new ATOM 0 HB3 ALA A 40 -2.548 -0.915 -2.391 1.00 21.51 H new ATOM 605 N LEU A 41 -2.315 1.208 -0.290 1.00 34.03 N ATOM 606 CA LEU A 41 -1.493 2.308 0.255 1.00 4.14 C ATOM 607 C LEU A 41 -1.960 2.688 1.695 1.00 44.25 C ATOM 608 O LEU A 41 -1.135 2.874 2.601 1.00 64.02 O ATOM 609 CB LEU A 41 -1.571 3.483 -0.790 1.00 31.15 C ATOM 610 CG LEU A 41 -1.018 4.915 -0.449 1.00 55.33 C ATOM 611 CD1 LEU A 41 -2.073 5.770 0.284 1.00 74.23 C ATOM 612 CD2 LEU A 41 0.329 4.862 0.310 1.00 74.10 C ATOM 0 H LEU A 41 -2.822 1.474 -1.134 1.00 34.03 H new ATOM 0 HA LEU A 41 -0.448 2.025 0.382 1.00 4.14 H new ATOM 0 HB2 LEU A 41 -1.051 3.146 -1.687 1.00 31.15 H new ATOM 0 HB3 LEU A 41 -2.621 3.603 -1.057 1.00 31.15 H new ATOM 0 HG LEU A 41 -0.809 5.410 -1.397 1.00 55.33 H new ATOM 0 HD11 LEU A 41 -1.656 6.753 0.504 1.00 74.23 H new ATOM 0 HD12 LEU A 41 -2.953 5.883 -0.349 1.00 74.23 H new ATOM 0 HD13 LEU A 41 -2.356 5.279 1.215 1.00 74.23 H new ATOM 0 HD21 LEU A 41 0.668 5.876 0.522 1.00 74.10 H new ATOM 0 HD22 LEU A 41 0.198 4.320 1.247 1.00 74.10 H new ATOM 0 HD23 LEU A 41 1.072 4.352 -0.303 1.00 74.10 H new ATOM 624 N ALA A 42 -3.289 2.763 1.893 1.00 32.14 N ATOM 625 CA ALA A 42 -3.899 3.076 3.210 1.00 52.14 C ATOM 626 C ALA A 42 -3.742 1.909 4.225 1.00 73.45 C ATOM 627 O ALA A 42 -3.582 2.142 5.427 1.00 45.14 O ATOM 628 CB ALA A 42 -5.378 3.442 3.029 1.00 23.24 C ATOM 0 H ALA A 42 -3.973 2.610 1.152 1.00 32.14 H new ATOM 0 HA ALA A 42 -3.365 3.930 3.626 1.00 52.14 H new ATOM 0 HB1 ALA A 42 -5.818 3.670 4.000 1.00 23.24 H new ATOM 0 HB2 ALA A 42 -5.460 4.314 2.380 1.00 23.24 H new ATOM 0 HB3 ALA A 42 -5.908 2.603 2.579 1.00 23.24 H new ATOM 634 N VAL A 43 -3.793 0.656 3.725 1.00 10.34 N ATOM 635 CA VAL A 43 -3.566 -0.561 4.547 1.00 23.02 C ATOM 636 C VAL A 43 -2.076 -0.664 4.985 1.00 1.45 C ATOM 637 O VAL A 43 -1.776 -1.140 6.088 1.00 24.13 O ATOM 638 CB VAL A 43 -4.004 -1.871 3.777 1.00 2.43 C ATOM 639 CG1 VAL A 43 -3.745 -3.142 4.618 1.00 52.11 C ATOM 640 CG2 VAL A 43 -5.492 -1.814 3.357 1.00 42.33 C ATOM 0 H VAL A 43 -3.992 0.456 2.745 1.00 10.34 H new ATOM 0 HA VAL A 43 -4.186 -0.472 5.439 1.00 23.02 H new ATOM 0 HB VAL A 43 -3.391 -1.922 2.877 1.00 2.43 H new ATOM 0 HG11 VAL A 43 -4.059 -4.021 4.055 1.00 52.11 H new ATOM 0 HG12 VAL A 43 -2.682 -3.217 4.845 1.00 52.11 H new ATOM 0 HG13 VAL A 43 -4.312 -3.085 5.547 1.00 52.11 H new ATOM 0 HG21 VAL A 43 -5.757 -2.731 2.831 1.00 42.33 H new ATOM 0 HG22 VAL A 43 -6.117 -1.712 4.244 1.00 42.33 H new ATOM 0 HG23 VAL A 43 -5.652 -0.959 2.700 1.00 42.33 H new ATOM 650 N GLY A 44 -1.158 -0.198 4.112 1.00 32.22 N ATOM 651 CA GLY A 44 0.271 -0.085 4.458 1.00 25.24 C ATOM 652 C GLY A 44 0.533 0.937 5.580 1.00 55.22 C ATOM 653 O GLY A 44 1.450 0.770 6.394 1.00 13.33 O ATOM 0 H GLY A 44 -1.383 0.105 3.164 1.00 32.22 H new ATOM 0 HA2 GLY A 44 0.644 -1.061 4.768 1.00 25.24 H new ATOM 0 HA3 GLY A 44 0.834 0.204 3.570 1.00 25.24 H new ATOM 657 N TRP A 45 -0.297 1.999 5.611 1.00 74.12 N ATOM 658 CA TRP A 45 -0.288 3.014 6.687 1.00 41.34 C ATOM 659 C TRP A 45 -0.922 2.456 7.999 1.00 1.15 C ATOM 660 O TRP A 45 -0.548 2.859 9.106 1.00 44.54 O ATOM 661 CB TRP A 45 -1.039 4.285 6.216 1.00 42.23 C ATOM 662 CG TRP A 45 -0.953 5.445 7.186 1.00 3.32 C ATOM 663 CD1 TRP A 45 -1.901 5.854 8.082 1.00 41.05 C ATOM 664 CD2 TRP A 45 0.159 6.333 7.357 1.00 4.43 C ATOM 665 NE1 TRP A 45 -1.452 6.941 8.783 1.00 2.54 N ATOM 666 CE2 TRP A 45 -0.188 7.247 8.367 1.00 10.33 C ATOM 667 CE3 TRP A 45 1.425 6.431 6.769 1.00 44.33 C ATOM 668 CZ2 TRP A 45 0.663 8.269 8.772 1.00 31.15 C ATOM 669 CZ3 TRP A 45 2.267 7.446 7.173 1.00 22.11 C ATOM 670 CH2 TRP A 45 1.889 8.343 8.179 1.00 11.31 C ATOM 0 H TRP A 45 -0.995 2.179 4.889 1.00 74.12 H new ATOM 0 HA TRP A 45 0.748 3.272 6.907 1.00 41.34 H new ATOM 0 HB2 TRP A 45 -0.634 4.598 5.254 1.00 42.23 H new ATOM 0 HB3 TRP A 45 -2.088 4.036 6.055 1.00 42.23 H new ATOM 0 HD1 TRP A 45 -2.865 5.387 8.217 1.00 41.05 H new ATOM 0 HE1 TRP A 45 -1.977 7.441 9.500 1.00 2.54 H new ATOM 0 HE3 TRP A 45 1.737 5.725 6.013 1.00 44.33 H new ATOM 0 HZ2 TRP A 45 0.364 8.979 9.529 1.00 31.15 H new ATOM 0 HZ3 TRP A 45 3.235 7.551 6.705 1.00 22.11 H new ATOM 0 HH2 TRP A 45 2.582 9.109 8.492 1.00 11.31 H new ATOM 681 N LEU A 46 -1.895 1.539 7.863 1.00 72.25 N ATOM 682 CA LEU A 46 -2.485 0.818 9.018 1.00 33.13 C ATOM 683 C LEU A 46 -1.469 -0.166 9.639 1.00 63.55 C ATOM 684 O LEU A 46 -1.450 -0.373 10.855 1.00 25.21 O ATOM 685 CB LEU A 46 -3.786 0.087 8.584 1.00 72.42 C ATOM 686 CG LEU A 46 -4.996 1.024 8.280 1.00 4.22 C ATOM 687 CD1 LEU A 46 -6.194 0.242 7.706 1.00 34.33 C ATOM 688 CD2 LEU A 46 -5.401 1.819 9.545 1.00 62.30 C ATOM 0 H LEU A 46 -2.295 1.274 6.963 1.00 72.25 H new ATOM 0 HA LEU A 46 -2.741 1.547 9.787 1.00 33.13 H new ATOM 0 HB2 LEU A 46 -3.573 -0.507 7.695 1.00 72.42 H new ATOM 0 HB3 LEU A 46 -4.074 -0.610 9.371 1.00 72.42 H new ATOM 0 HG LEU A 46 -4.681 1.734 7.515 1.00 4.22 H new ATOM 0 HD11 LEU A 46 -7.016 0.930 7.508 1.00 34.33 H new ATOM 0 HD12 LEU A 46 -5.898 -0.247 6.778 1.00 34.33 H new ATOM 0 HD13 LEU A 46 -6.516 -0.510 8.426 1.00 34.33 H new ATOM 0 HD21 LEU A 46 -6.246 2.467 9.313 1.00 62.30 H new ATOM 0 HD22 LEU A 46 -5.683 1.125 10.336 1.00 62.30 H new ATOM 0 HD23 LEU A 46 -4.559 2.426 9.878 1.00 62.30 H new ATOM 700 N ALA A 47 -0.627 -0.770 8.784 1.00 12.35 N ATOM 701 CA ALA A 47 0.502 -1.623 9.219 1.00 52.12 C ATOM 702 C ALA A 47 1.538 -0.833 10.076 1.00 74.54 C ATOM 703 O ALA A 47 2.206 -1.417 10.942 1.00 74.02 O ATOM 704 CB ALA A 47 1.166 -2.267 7.990 1.00 74.13 C ATOM 0 H ALA A 47 -0.706 -0.683 7.771 1.00 12.35 H new ATOM 0 HA ALA A 47 0.107 -2.409 9.862 1.00 52.12 H new ATOM 0 HB1 ALA A 47 1.997 -2.895 8.312 1.00 74.13 H new ATOM 0 HB2 ALA A 47 0.435 -2.877 7.459 1.00 74.13 H new ATOM 0 HB3 ALA A 47 1.537 -1.486 7.326 1.00 74.13 H new ATOM 710 N ARG A 48 1.651 0.493 9.825 1.00 43.24 N ATOM 711 CA ARG A 48 2.518 1.415 10.614 1.00 12.42 C ATOM 712 C ARG A 48 2.122 1.451 12.105 1.00 3.13 C ATOM 713 O ARG A 48 2.959 1.270 12.997 1.00 60.02 O ATOM 714 CB ARG A 48 2.423 2.862 10.039 1.00 23.12 C ATOM 715 CG ARG A 48 3.223 3.935 10.825 1.00 43.23 C ATOM 716 CD ARG A 48 3.040 5.361 10.277 1.00 43.24 C ATOM 717 NE ARG A 48 3.770 6.367 11.084 1.00 31.24 N ATOM 718 CZ ARG A 48 4.549 7.327 10.610 1.00 53.43 C ATOM 719 NH1 ARG A 48 4.779 7.434 9.336 1.00 60.01 N ATOM 720 NH2 ARG A 48 5.088 8.177 11.421 1.00 44.32 N ATOM 0 H ARG A 48 1.146 0.958 9.071 1.00 43.24 H new ATOM 0 HA ARG A 48 3.538 1.038 10.536 1.00 12.42 H new ATOM 0 HB2 ARG A 48 2.776 2.851 9.008 1.00 23.12 H new ATOM 0 HB3 ARG A 48 1.374 3.159 10.014 1.00 23.12 H new ATOM 0 HG2 ARG A 48 2.914 3.914 11.870 1.00 43.23 H new ATOM 0 HG3 ARG A 48 4.282 3.678 10.800 1.00 43.23 H new ATOM 0 HD2 ARG A 48 3.391 5.400 9.246 1.00 43.24 H new ATOM 0 HD3 ARG A 48 1.979 5.610 10.262 1.00 43.24 H new ATOM 0 HE ARG A 48 3.663 6.315 12.097 1.00 31.24 H new ATOM 0 HH11 ARG A 48 4.357 6.773 8.684 1.00 60.01 H new ATOM 0 HH12 ARG A 48 5.382 8.179 8.987 1.00 60.01 H new ATOM 0 HH21 ARG A 48 4.913 8.107 12.423 1.00 44.32 H new ATOM 0 HH22 ARG A 48 5.689 8.918 11.059 1.00 44.32 H new ATOM 734 N GLU A 49 0.828 1.674 12.349 1.00 23.42 N ATOM 735 CA GLU A 49 0.276 1.887 13.704 1.00 43.54 C ATOM 736 C GLU A 49 -0.184 0.555 14.363 1.00 50.32 C ATOM 737 O GLU A 49 -0.873 0.576 15.397 1.00 51.43 O ATOM 738 CB GLU A 49 -0.900 2.902 13.599 1.00 31.40 C ATOM 739 CG GLU A 49 -0.534 4.265 12.952 1.00 42.12 C ATOM 740 CD GLU A 49 0.455 5.104 13.791 1.00 41.11 C ATOM 741 OE1 GLU A 49 0.006 5.832 14.702 1.00 2.22 O ATOM 742 OE2 GLU A 49 1.682 5.038 13.557 1.00 5.13 O ATOM 0 H GLU A 49 0.124 1.713 11.612 1.00 23.42 H new ATOM 0 HA GLU A 49 1.057 2.289 14.350 1.00 43.54 H new ATOM 0 HB2 GLU A 49 -1.703 2.446 13.020 1.00 31.40 H new ATOM 0 HB3 GLU A 49 -1.292 3.085 14.599 1.00 31.40 H new ATOM 0 HG2 GLU A 49 -0.101 4.086 11.968 1.00 42.12 H new ATOM 0 HG3 GLU A 49 -1.446 4.841 12.798 1.00 42.12 H new ATOM 749 N ASN A 50 0.236 -0.591 13.759 1.00 51.53 N ATOM 750 CA ASN A 50 -0.130 -1.969 14.192 1.00 52.35 C ATOM 751 C ASN A 50 -1.666 -2.141 14.357 1.00 41.11 C ATOM 752 O ASN A 50 -2.166 -2.646 15.367 1.00 41.31 O ATOM 753 CB ASN A 50 0.651 -2.378 15.474 1.00 30.01 C ATOM 754 CG ASN A 50 2.162 -2.433 15.235 1.00 23.30 C ATOM 755 OD1 ASN A 50 2.712 -3.462 14.851 1.00 2.21 O ATOM 756 ND2 ASN A 50 2.843 -1.322 15.437 1.00 15.45 N ATOM 0 H ASN A 50 0.849 -0.583 12.944 1.00 51.53 H new ATOM 0 HA ASN A 50 0.169 -2.653 13.398 1.00 52.35 H new ATOM 0 HB2 ASN A 50 0.436 -1.666 16.271 1.00 30.01 H new ATOM 0 HB3 ASN A 50 0.303 -3.353 15.815 1.00 30.01 H new ATOM 0 HD21 ASN A 50 3.850 -1.304 15.274 1.00 15.45 H new ATOM 0 HD22 ASN A 50 2.363 -0.480 15.756 1.00 15.45 H new ATOM 763 N LYS A 51 -2.392 -1.674 13.342 1.00 42.02 N ATOM 764 CA LYS A 51 -3.865 -1.756 13.266 1.00 42.44 C ATOM 765 C LYS A 51 -4.339 -3.090 12.630 1.00 63.12 C ATOM 766 O LYS A 51 -5.401 -3.621 12.990 1.00 33.04 O ATOM 767 CB LYS A 51 -4.370 -0.564 12.414 1.00 54.31 C ATOM 768 CG LYS A 51 -3.917 0.834 12.907 1.00 0.11 C ATOM 769 CD LYS A 51 -4.652 1.308 14.181 1.00 32.43 C ATOM 770 CE LYS A 51 -6.151 1.562 13.934 1.00 1.24 C ATOM 771 NZ LYS A 51 -6.846 2.052 15.147 1.00 64.33 N ATOM 0 H LYS A 51 -1.973 -1.219 12.531 1.00 42.02 H new ATOM 0 HA LYS A 51 -4.272 -1.717 14.276 1.00 42.44 H new ATOM 0 HB2 LYS A 51 -4.027 -0.699 11.388 1.00 54.31 H new ATOM 0 HB3 LYS A 51 -5.459 -0.589 12.392 1.00 54.31 H new ATOM 0 HG2 LYS A 51 -2.845 0.811 13.103 1.00 0.11 H new ATOM 0 HG3 LYS A 51 -4.080 1.561 12.112 1.00 0.11 H new ATOM 0 HD2 LYS A 51 -4.538 0.558 14.964 1.00 32.43 H new ATOM 0 HD3 LYS A 51 -4.187 2.223 14.546 1.00 32.43 H new ATOM 0 HE2 LYS A 51 -6.266 2.292 13.132 1.00 1.24 H new ATOM 0 HE3 LYS A 51 -6.623 0.639 13.596 1.00 1.24 H new ATOM 0 HZ1 LYS A 51 -7.851 2.208 14.932 1.00 64.33 H new ATOM 0 HZ2 LYS A 51 -6.760 1.346 15.905 1.00 64.33 H new ATOM 0 HZ3 LYS A 51 -6.415 2.946 15.457 1.00 64.33 H new ATOM 785 N VAL A 52 -3.538 -3.619 11.674 1.00 24.22 N ATOM 786 CA VAL A 52 -3.922 -4.780 10.827 1.00 34.14 C ATOM 787 C VAL A 52 -2.794 -5.845 10.751 1.00 40.24 C ATOM 788 O VAL A 52 -1.598 -5.515 10.796 1.00 2.23 O ATOM 789 CB VAL A 52 -4.311 -4.335 9.356 1.00 42.24 C ATOM 790 CG1 VAL A 52 -5.550 -3.411 9.357 1.00 15.40 C ATOM 791 CG2 VAL A 52 -3.117 -3.662 8.619 1.00 51.23 C ATOM 0 H VAL A 52 -2.608 -3.255 11.467 1.00 24.22 H new ATOM 0 HA VAL A 52 -4.794 -5.223 11.308 1.00 34.14 H new ATOM 0 HB VAL A 52 -4.566 -5.241 8.806 1.00 42.24 H new ATOM 0 HG11 VAL A 52 -5.791 -3.124 8.333 1.00 15.40 H new ATOM 0 HG12 VAL A 52 -6.397 -3.939 9.794 1.00 15.40 H new ATOM 0 HG13 VAL A 52 -5.337 -2.518 9.944 1.00 15.40 H new ATOM 0 HG21 VAL A 52 -3.426 -3.372 7.615 1.00 51.23 H new ATOM 0 HG22 VAL A 52 -2.801 -2.777 9.171 1.00 51.23 H new ATOM 0 HG23 VAL A 52 -2.286 -4.365 8.554 1.00 51.23 H new ATOM 801 N VAL A 53 -3.197 -7.122 10.621 1.00 22.31 N ATOM 802 CA VAL A 53 -2.273 -8.251 10.357 1.00 60.54 C ATOM 803 C VAL A 53 -2.565 -8.820 8.952 1.00 44.41 C ATOM 804 O VAL A 53 -3.593 -9.453 8.714 1.00 63.23 O ATOM 805 CB VAL A 53 -2.325 -9.399 11.457 1.00 42.52 C ATOM 806 CG1 VAL A 53 -1.416 -9.061 12.671 1.00 35.00 C ATOM 807 CG2 VAL A 53 -3.778 -9.694 11.919 1.00 14.23 C ATOM 0 H VAL A 53 -4.174 -7.405 10.695 1.00 22.31 H new ATOM 0 HA VAL A 53 -1.258 -7.856 10.406 1.00 60.54 H new ATOM 0 HB VAL A 53 -1.941 -10.305 10.989 1.00 42.52 H new ATOM 0 HG11 VAL A 53 -1.474 -9.865 13.404 1.00 35.00 H new ATOM 0 HG12 VAL A 53 -0.385 -8.951 12.334 1.00 35.00 H new ATOM 0 HG13 VAL A 53 -1.750 -8.129 13.127 1.00 35.00 H new ATOM 0 HG21 VAL A 53 -3.768 -10.484 12.670 1.00 14.23 H new ATOM 0 HG22 VAL A 53 -4.214 -8.791 12.347 1.00 14.23 H new ATOM 0 HG23 VAL A 53 -4.374 -10.014 11.064 1.00 14.23 H new ATOM 817 N ILE A 54 -1.657 -8.549 8.016 1.00 63.41 N ATOM 818 CA ILE A 54 -1.803 -8.955 6.612 1.00 73.13 C ATOM 819 C ILE A 54 -1.201 -10.361 6.427 1.00 11.13 C ATOM 820 O ILE A 54 -0.004 -10.559 6.627 1.00 24.23 O ATOM 821 CB ILE A 54 -1.108 -7.916 5.667 1.00 11.23 C ATOM 822 CG1 ILE A 54 -1.653 -6.475 5.961 1.00 63.01 C ATOM 823 CG2 ILE A 54 -1.297 -8.301 4.177 1.00 60.04 C ATOM 824 CD1 ILE A 54 -0.914 -5.356 5.248 1.00 72.25 C ATOM 0 H ILE A 54 -0.794 -8.040 8.207 1.00 63.41 H new ATOM 0 HA ILE A 54 -2.860 -8.985 6.348 1.00 73.13 H new ATOM 0 HB ILE A 54 -0.037 -7.925 5.867 1.00 11.23 H new ATOM 0 HG12 ILE A 54 -2.705 -6.435 5.678 1.00 63.01 H new ATOM 0 HG13 ILE A 54 -1.605 -6.296 7.035 1.00 63.01 H new ATOM 0 HG21 ILE A 54 -0.804 -7.562 3.545 1.00 60.04 H new ATOM 0 HG22 ILE A 54 -0.859 -9.283 3.997 1.00 60.04 H new ATOM 0 HG23 ILE A 54 -2.361 -8.329 3.941 1.00 60.04 H new ATOM 0 HD11 ILE A 54 -1.362 -4.398 5.513 1.00 72.25 H new ATOM 0 HD12 ILE A 54 0.134 -5.362 5.549 1.00 72.25 H new ATOM 0 HD13 ILE A 54 -0.983 -5.503 4.170 1.00 72.25 H new ATOM 836 N GLU A 55 -2.046 -11.344 6.101 1.00 51.54 N ATOM 837 CA GLU A 55 -1.644 -12.757 6.015 1.00 71.11 C ATOM 838 C GLU A 55 -1.468 -13.196 4.547 1.00 12.21 C ATOM 839 O GLU A 55 -2.422 -13.157 3.759 1.00 75.33 O ATOM 840 CB GLU A 55 -2.693 -13.639 6.741 1.00 3.40 C ATOM 841 CG GLU A 55 -2.915 -13.278 8.232 1.00 42.33 C ATOM 842 CD GLU A 55 -1.622 -13.283 9.073 1.00 21.10 C ATOM 843 OE1 GLU A 55 -1.053 -14.374 9.296 1.00 51.32 O ATOM 844 OE2 GLU A 55 -1.165 -12.205 9.521 1.00 64.24 O ATOM 0 H GLU A 55 -3.031 -11.185 5.888 1.00 51.54 H new ATOM 0 HA GLU A 55 -0.679 -12.880 6.506 1.00 71.11 H new ATOM 0 HB2 GLU A 55 -3.644 -13.557 6.215 1.00 3.40 H new ATOM 0 HB3 GLU A 55 -2.381 -14.681 6.675 1.00 3.40 H new ATOM 0 HG2 GLU A 55 -3.373 -12.291 8.293 1.00 42.33 H new ATOM 0 HG3 GLU A 55 -3.622 -13.985 8.666 1.00 42.33 H new ATOM 851 N ARG A 56 -0.231 -13.588 4.177 1.00 20.34 N ATOM 852 CA ARG A 56 0.062 -14.100 2.826 1.00 21.05 C ATOM 853 C ARG A 56 -0.320 -15.593 2.734 1.00 12.35 C ATOM 854 O ARG A 56 0.337 -16.454 3.329 1.00 14.03 O ATOM 855 CB ARG A 56 1.552 -13.903 2.456 1.00 14.30 C ATOM 856 CG ARG A 56 2.056 -12.455 2.609 1.00 54.41 C ATOM 857 CD ARG A 56 3.486 -12.258 2.061 1.00 72.45 C ATOM 858 NE ARG A 56 3.509 -12.125 0.595 1.00 52.44 N ATOM 859 CZ ARG A 56 3.750 -11.008 -0.065 1.00 53.22 C ATOM 860 NH1 ARG A 56 3.978 -9.882 0.559 1.00 1.33 N ATOM 861 NH2 ARG A 56 3.742 -11.029 -1.356 1.00 21.53 N ATOM 0 H ARG A 56 0.579 -13.559 4.796 1.00 20.34 H new ATOM 0 HA ARG A 56 -0.534 -13.531 2.113 1.00 21.05 H new ATOM 0 HB2 ARG A 56 2.160 -14.555 3.083 1.00 14.30 H new ATOM 0 HB3 ARG A 56 1.704 -14.221 1.425 1.00 14.30 H new ATOM 0 HG2 ARG A 56 1.376 -11.781 2.087 1.00 54.41 H new ATOM 0 HG3 ARG A 56 2.034 -12.177 3.663 1.00 54.41 H new ATOM 0 HD2 ARG A 56 3.926 -11.368 2.511 1.00 72.45 H new ATOM 0 HD3 ARG A 56 4.106 -13.104 2.357 1.00 72.45 H new ATOM 0 HE ARG A 56 3.324 -12.964 0.045 1.00 52.44 H new ATOM 0 HH11 ARG A 56 3.972 -9.854 1.579 1.00 1.33 H new ATOM 0 HH12 ARG A 56 4.162 -9.032 0.026 1.00 1.33 H new ATOM 0 HH21 ARG A 56 3.551 -11.900 -1.851 1.00 21.53 H new ATOM 0 HH22 ARG A 56 3.926 -10.174 -1.881 1.00 21.53 H new ATOM 875 N LYS A 57 -1.404 -15.874 2.003 1.00 43.14 N ATOM 876 CA LYS A 57 -1.966 -17.226 1.865 1.00 64.53 C ATOM 877 C LYS A 57 -1.592 -17.787 0.474 1.00 22.32 C ATOM 878 O LYS A 57 -2.161 -17.371 -0.535 1.00 43.22 O ATOM 879 CB LYS A 57 -3.513 -17.149 2.039 1.00 35.13 C ATOM 880 CG LYS A 57 -3.995 -16.263 3.223 1.00 5.52 C ATOM 881 CD LYS A 57 -3.547 -16.779 4.614 1.00 55.34 C ATOM 882 CE LYS A 57 -4.275 -18.065 5.045 1.00 61.15 C ATOM 883 NZ LYS A 57 -3.711 -18.616 6.302 1.00 22.14 N ATOM 0 H LYS A 57 -1.922 -15.164 1.485 1.00 43.14 H new ATOM 0 HA LYS A 57 -1.561 -17.891 2.628 1.00 64.53 H new ATOM 0 HB2 LYS A 57 -3.949 -16.766 1.116 1.00 35.13 H new ATOM 0 HB3 LYS A 57 -3.899 -18.159 2.179 1.00 35.13 H new ATOM 0 HG2 LYS A 57 -3.618 -15.250 3.083 1.00 5.52 H new ATOM 0 HG3 LYS A 57 -5.083 -16.204 3.201 1.00 5.52 H new ATOM 0 HD2 LYS A 57 -2.473 -16.965 4.597 1.00 55.34 H new ATOM 0 HD3 LYS A 57 -3.724 -16.002 5.357 1.00 55.34 H new ATOM 0 HE2 LYS A 57 -5.336 -17.855 5.183 1.00 61.15 H new ATOM 0 HE3 LYS A 57 -4.198 -18.810 4.253 1.00 61.15 H new ATOM 0 HZ1 LYS A 57 -4.225 -19.482 6.563 1.00 22.14 H new ATOM 0 HZ2 LYS A 57 -2.705 -18.839 6.162 1.00 22.14 H new ATOM 0 HZ3 LYS A 57 -3.807 -17.914 7.063 1.00 22.14 H new ATOM 897 N ASN A 58 -0.635 -18.742 0.445 1.00 44.23 N ATOM 898 CA ASN A 58 0.020 -19.244 -0.805 1.00 45.23 C ATOM 899 C ASN A 58 0.649 -18.090 -1.654 1.00 24.35 C ATOM 900 O ASN A 58 0.750 -18.185 -2.887 1.00 73.43 O ATOM 901 CB ASN A 58 -0.988 -20.074 -1.654 1.00 23.33 C ATOM 902 CG ASN A 58 -1.584 -21.255 -0.883 1.00 12.22 C ATOM 903 OD1 ASN A 58 -1.065 -22.367 -0.916 1.00 40.21 O ATOM 904 ND2 ASN A 58 -2.678 -21.022 -0.179 1.00 35.13 N ATOM 0 H ASN A 58 -0.286 -19.195 1.290 1.00 44.23 H new ATOM 0 HA ASN A 58 0.841 -19.893 -0.500 1.00 45.23 H new ATOM 0 HB2 ASN A 58 -1.794 -19.423 -1.991 1.00 23.33 H new ATOM 0 HB3 ASN A 58 -0.484 -20.446 -2.546 1.00 23.33 H new ATOM 0 HD21 ASN A 58 -3.111 -21.776 0.354 1.00 35.13 H new ATOM 0 HD22 ASN A 58 -3.089 -20.088 -0.169 1.00 35.13 H new ATOM 911 N GLY A 59 1.127 -17.027 -0.971 1.00 50.32 N ATOM 912 CA GLY A 59 1.685 -15.835 -1.641 1.00 13.22 C ATOM 913 C GLY A 59 0.676 -14.686 -1.842 1.00 32.31 C ATOM 914 O GLY A 59 1.079 -13.530 -2.035 1.00 12.11 O ATOM 0 H GLY A 59 1.137 -16.972 0.047 1.00 50.32 H new ATOM 0 HA2 GLY A 59 2.527 -15.465 -1.056 1.00 13.22 H new ATOM 0 HA3 GLY A 59 2.079 -16.131 -2.613 1.00 13.22 H new ATOM 918 N LEU A 60 -0.634 -15.010 -1.793 1.00 40.42 N ATOM 919 CA LEU A 60 -1.736 -14.037 -2.029 1.00 35.12 C ATOM 920 C LEU A 60 -1.901 -13.079 -0.823 1.00 14.24 C ATOM 921 O LEU A 60 -1.900 -13.523 0.325 1.00 1.50 O ATOM 922 CB LEU A 60 -3.090 -14.775 -2.304 1.00 61.42 C ATOM 923 CG LEU A 60 -3.229 -15.550 -3.667 1.00 1.30 C ATOM 924 CD1 LEU A 60 -2.243 -16.735 -3.792 1.00 74.21 C ATOM 925 CD2 LEU A 60 -4.688 -16.024 -3.883 1.00 54.35 C ATOM 0 H LEU A 60 -0.963 -15.953 -1.589 1.00 40.42 H new ATOM 0 HA LEU A 60 -1.469 -13.452 -2.909 1.00 35.12 H new ATOM 0 HB2 LEU A 60 -3.257 -15.485 -1.494 1.00 61.42 H new ATOM 0 HB3 LEU A 60 -3.892 -14.038 -2.252 1.00 61.42 H new ATOM 0 HG LEU A 60 -2.966 -14.843 -4.454 1.00 1.30 H new ATOM 0 HD11 LEU A 60 -2.388 -17.229 -4.753 1.00 74.21 H new ATOM 0 HD12 LEU A 60 -1.220 -16.366 -3.725 1.00 74.21 H new ATOM 0 HD13 LEU A 60 -2.426 -17.447 -2.987 1.00 74.21 H new ATOM 0 HD21 LEU A 60 -4.761 -16.557 -4.831 1.00 54.35 H new ATOM 0 HD22 LEU A 60 -4.979 -16.689 -3.070 1.00 54.35 H new ATOM 0 HD23 LEU A 60 -5.352 -15.160 -3.901 1.00 54.35 H new ATOM 937 N ILE A 61 -2.051 -11.773 -1.099 1.00 31.32 N ATOM 938 CA ILE A 61 -2.144 -10.735 -0.052 1.00 2.44 C ATOM 939 C ILE A 61 -3.612 -10.626 0.457 1.00 74.10 C ATOM 940 O ILE A 61 -4.485 -10.075 -0.230 1.00 33.31 O ATOM 941 CB ILE A 61 -1.617 -9.320 -0.560 1.00 24.44 C ATOM 942 CG1 ILE A 61 -0.114 -9.371 -1.048 1.00 73.54 C ATOM 943 CG2 ILE A 61 -1.780 -8.251 0.548 1.00 24.43 C ATOM 944 CD1 ILE A 61 0.133 -10.038 -2.399 1.00 71.32 C ATOM 0 H ILE A 61 -2.111 -11.405 -2.049 1.00 31.32 H new ATOM 0 HA ILE A 61 -1.498 -11.036 0.773 1.00 2.44 H new ATOM 0 HB ILE A 61 -2.227 -9.047 -1.421 1.00 24.44 H new ATOM 0 HG12 ILE A 61 0.266 -8.350 -1.095 1.00 73.54 H new ATOM 0 HG13 ILE A 61 0.473 -9.895 -0.294 1.00 73.54 H new ATOM 0 HG21 ILE A 61 -1.415 -7.291 0.184 1.00 24.43 H new ATOM 0 HG22 ILE A 61 -2.833 -8.161 0.815 1.00 24.43 H new ATOM 0 HG23 ILE A 61 -1.207 -8.547 1.427 1.00 24.43 H new ATOM 0 HD11 ILE A 61 1.198 -10.013 -2.628 1.00 71.32 H new ATOM 0 HD12 ILE A 61 -0.206 -11.073 -2.361 1.00 71.32 H new ATOM 0 HD13 ILE A 61 -0.417 -9.504 -3.174 1.00 71.32 H new ATOM 956 N GLU A 62 -3.873 -11.185 1.658 1.00 21.21 N ATOM 957 CA GLU A 62 -5.220 -11.207 2.289 1.00 25.24 C ATOM 958 C GLU A 62 -5.184 -10.441 3.640 1.00 32.04 C ATOM 959 O GLU A 62 -4.420 -10.792 4.538 1.00 42.25 O ATOM 960 CB GLU A 62 -5.669 -12.683 2.475 1.00 35.33 C ATOM 961 CG GLU A 62 -7.071 -12.877 3.083 1.00 43.31 C ATOM 962 CD GLU A 62 -7.514 -14.358 3.093 1.00 25.54 C ATOM 963 OE1 GLU A 62 -7.128 -15.103 4.017 1.00 72.33 O ATOM 964 OE2 GLU A 62 -8.247 -14.782 2.171 1.00 33.41 O ATOM 0 H GLU A 62 -3.155 -11.637 2.224 1.00 21.21 H new ATOM 0 HA GLU A 62 -5.945 -10.706 1.648 1.00 25.24 H new ATOM 0 HB2 GLU A 62 -5.641 -13.178 1.504 1.00 35.33 H new ATOM 0 HB3 GLU A 62 -4.943 -13.188 3.112 1.00 35.33 H new ATOM 0 HG2 GLU A 62 -7.077 -12.493 4.103 1.00 43.31 H new ATOM 0 HG3 GLU A 62 -7.793 -12.289 2.517 1.00 43.31 H new ATOM 971 N ILE A 63 -6.026 -9.396 3.776 1.00 71.02 N ATOM 972 CA ILE A 63 -5.955 -8.435 4.908 1.00 45.12 C ATOM 973 C ILE A 63 -6.870 -8.862 6.091 1.00 2.13 C ATOM 974 O ILE A 63 -8.085 -8.995 5.925 1.00 70.43 O ATOM 975 CB ILE A 63 -6.372 -6.976 4.457 1.00 25.11 C ATOM 976 CG1 ILE A 63 -5.790 -6.603 3.049 1.00 30.22 C ATOM 977 CG2 ILE A 63 -5.955 -5.929 5.524 1.00 31.13 C ATOM 978 CD1 ILE A 63 -4.275 -6.575 2.946 1.00 61.12 C ATOM 0 H ILE A 63 -6.772 -9.191 3.111 1.00 71.02 H new ATOM 0 HA ILE A 63 -4.916 -8.436 5.238 1.00 45.12 H new ATOM 0 HB ILE A 63 -7.458 -6.965 4.367 1.00 25.11 H new ATOM 0 HG12 ILE A 63 -6.172 -7.316 2.319 1.00 30.22 H new ATOM 0 HG13 ILE A 63 -6.173 -5.622 2.767 1.00 30.22 H new ATOM 0 HG21 ILE A 63 -6.252 -4.934 5.193 1.00 31.13 H new ATOM 0 HG22 ILE A 63 -6.446 -6.158 6.470 1.00 31.13 H new ATOM 0 HG23 ILE A 63 -4.874 -5.959 5.660 1.00 31.13 H new ATOM 0 HD11 ILE A 63 -3.984 -6.306 1.930 1.00 61.12 H new ATOM 0 HD12 ILE A 63 -3.876 -5.839 3.644 1.00 61.12 H new ATOM 0 HD13 ILE A 63 -3.876 -7.560 3.189 1.00 61.12 H new ATOM 990 N TYR A 64 -6.276 -9.069 7.279 1.00 12.03 N ATOM 991 CA TYR A 64 -7.027 -9.300 8.544 1.00 43.53 C ATOM 992 C TYR A 64 -6.915 -8.081 9.486 1.00 22.44 C ATOM 993 O TYR A 64 -6.027 -7.232 9.336 1.00 52.11 O ATOM 994 CB TYR A 64 -6.502 -10.559 9.291 1.00 73.21 C ATOM 995 CG TYR A 64 -6.830 -11.901 8.627 1.00 62.45 C ATOM 996 CD1 TYR A 64 -6.256 -12.263 7.407 1.00 32.44 C ATOM 997 CD2 TYR A 64 -7.703 -12.813 9.231 1.00 3.35 C ATOM 998 CE1 TYR A 64 -6.542 -13.479 6.820 1.00 50.30 C ATOM 999 CE2 TYR A 64 -7.989 -14.028 8.644 1.00 25.02 C ATOM 1000 CZ TYR A 64 -7.410 -14.356 7.440 1.00 42.03 C ATOM 1001 OH TYR A 64 -7.703 -15.568 6.849 1.00 45.02 O ATOM 0 H TYR A 64 -5.263 -9.083 7.399 1.00 12.03 H new ATOM 0 HA TYR A 64 -8.071 -9.454 8.269 1.00 43.53 H new ATOM 0 HB2 TYR A 64 -5.420 -10.477 9.390 1.00 73.21 H new ATOM 0 HB3 TYR A 64 -6.915 -10.561 10.300 1.00 73.21 H new ATOM 0 HD1 TYR A 64 -5.578 -11.581 6.915 1.00 32.44 H new ATOM 0 HD2 TYR A 64 -8.162 -12.560 10.175 1.00 3.35 H new ATOM 0 HE1 TYR A 64 -6.087 -13.744 5.877 1.00 50.30 H new ATOM 0 HE2 TYR A 64 -8.664 -14.719 9.127 1.00 25.02 H new ATOM 0 HH TYR A 64 -7.540 -15.510 5.884 1.00 45.02 H new ATOM 1011 N ASN A 65 -7.823 -8.032 10.478 1.00 54.22 N ATOM 1012 CA ASN A 65 -7.772 -7.052 11.582 1.00 1.44 C ATOM 1013 C ASN A 65 -6.978 -7.658 12.750 1.00 42.01 C ATOM 1014 O ASN A 65 -6.916 -8.891 12.894 1.00 74.21 O ATOM 1015 CB ASN A 65 -9.201 -6.699 12.097 1.00 2.54 C ATOM 1016 CG ASN A 65 -10.216 -6.434 10.992 1.00 74.42 C ATOM 1017 OD1 ASN A 65 -9.877 -5.987 9.909 1.00 55.51 O ATOM 1018 ND2 ASN A 65 -11.476 -6.724 11.267 1.00 73.50 N ATOM 0 H ASN A 65 -8.615 -8.672 10.538 1.00 54.22 H new ATOM 0 HA ASN A 65 -7.298 -6.145 11.208 1.00 1.44 H new ATOM 0 HB2 ASN A 65 -9.563 -7.518 12.719 1.00 2.54 H new ATOM 0 HB3 ASN A 65 -9.137 -5.818 12.735 1.00 2.54 H new ATOM 0 HD21 ASN A 65 -12.199 -6.575 10.563 1.00 73.50 H new ATOM 0 HD22 ASN A 65 -11.725 -7.097 12.183 1.00 73.50 H new ATOM 1025 N GLU A 66 -6.395 -6.809 13.597 1.00 74.43 N ATOM 1026 CA GLU A 66 -5.804 -7.270 14.865 1.00 51.42 C ATOM 1027 C GLU A 66 -6.899 -7.363 15.958 1.00 65.31 C ATOM 1028 O GLU A 66 -7.066 -6.467 16.786 1.00 21.33 O ATOM 1029 CB GLU A 66 -4.604 -6.376 15.264 1.00 1.24 C ATOM 1030 CG GLU A 66 -3.418 -6.509 14.284 1.00 74.24 C ATOM 1031 CD GLU A 66 -2.109 -5.808 14.698 1.00 52.20 C ATOM 1032 OE1 GLU A 66 -1.743 -5.840 15.891 1.00 60.33 O ATOM 1033 OE2 GLU A 66 -1.405 -5.275 13.805 1.00 53.32 O ATOM 0 H GLU A 66 -6.317 -5.805 13.435 1.00 74.43 H new ATOM 0 HA GLU A 66 -5.401 -8.275 14.742 1.00 51.42 H new ATOM 0 HB2 GLU A 66 -4.926 -5.335 15.301 1.00 1.24 H new ATOM 0 HB3 GLU A 66 -4.274 -6.643 16.268 1.00 1.24 H new ATOM 0 HG2 GLU A 66 -3.208 -7.569 14.142 1.00 74.24 H new ATOM 0 HG3 GLU A 66 -3.727 -6.113 13.317 1.00 74.24 H new ATOM 1040 N GLY A 67 -7.680 -8.471 15.886 1.00 22.32 N ATOM 1041 CA GLY A 67 -8.811 -8.737 16.799 1.00 60.12 C ATOM 1042 C GLY A 67 -8.387 -9.193 18.199 1.00 33.32 C ATOM 1043 O GLY A 67 -9.181 -9.164 19.139 1.00 34.51 O ATOM 0 H GLY A 67 -7.539 -9.204 15.190 1.00 22.32 H new ATOM 0 HA2 GLY A 67 -9.412 -7.832 16.889 1.00 60.12 H new ATOM 0 HA3 GLY A 67 -9.450 -9.502 16.357 1.00 60.12 H new ATOM 1047 N HIS A 68 -7.130 -9.653 18.320 1.00 43.13 N ATOM 1048 CA HIS A 68 -6.501 -9.958 19.628 1.00 14.43 C ATOM 1049 C HIS A 68 -5.892 -8.677 20.262 1.00 13.24 C ATOM 1050 O HIS A 68 -5.526 -8.666 21.441 1.00 23.00 O ATOM 1051 CB HIS A 68 -5.414 -11.045 19.446 1.00 70.33 C ATOM 1052 CG HIS A 68 -5.958 -12.385 19.008 1.00 23.14 C ATOM 1053 ND1 HIS A 68 -6.180 -13.423 19.883 1.00 25.43 N ATOM 1054 CD2 HIS A 68 -6.321 -12.850 17.789 1.00 14.30 C ATOM 1055 CE1 HIS A 68 -6.661 -14.460 19.228 1.00 0.23 C ATOM 1056 NE2 HIS A 68 -6.754 -14.140 17.952 1.00 22.20 N ATOM 0 H HIS A 68 -6.519 -9.825 17.521 1.00 43.13 H new ATOM 0 HA HIS A 68 -7.268 -10.333 20.305 1.00 14.43 H new ATOM 0 HB2 HIS A 68 -4.688 -10.700 18.710 1.00 70.33 H new ATOM 0 HB3 HIS A 68 -4.878 -11.171 20.387 1.00 70.33 H new ATOM 0 HD2 HIS A 68 -6.277 -12.304 16.858 1.00 14.30 H new ATOM 0 HE1 HIS A 68 -6.933 -15.411 19.662 1.00 0.23 H new ATOM 0 HE2 HIS A 68 -7.092 -14.752 17.209 1.00 22.20 H new ATOM 1065 N PHE A 69 -5.799 -7.604 19.450 1.00 52.30 N ATOM 1066 CA PHE A 69 -5.210 -6.295 19.832 1.00 43.11 C ATOM 1067 C PHE A 69 -6.275 -5.164 19.732 1.00 40.04 C ATOM 1068 O PHE A 69 -5.936 -3.974 19.731 1.00 53.12 O ATOM 1069 CB PHE A 69 -4.025 -5.998 18.869 1.00 43.02 C ATOM 1070 CG PHE A 69 -2.903 -7.043 18.888 1.00 41.44 C ATOM 1071 CD1 PHE A 69 -2.962 -8.184 18.078 1.00 12.31 C ATOM 1072 CD2 PHE A 69 -1.784 -6.883 19.706 1.00 44.24 C ATOM 1073 CE1 PHE A 69 -1.945 -9.119 18.088 1.00 63.31 C ATOM 1074 CE2 PHE A 69 -0.769 -7.823 19.716 1.00 20.05 C ATOM 1075 CZ PHE A 69 -0.849 -8.938 18.906 1.00 62.24 C ATOM 0 H PHE A 69 -6.138 -7.619 18.488 1.00 52.30 H new ATOM 0 HA PHE A 69 -4.860 -6.335 20.864 1.00 43.11 H new ATOM 0 HB2 PHE A 69 -4.412 -5.919 17.853 1.00 43.02 H new ATOM 0 HB3 PHE A 69 -3.602 -5.027 19.125 1.00 43.02 H new ATOM 0 HD1 PHE A 69 -3.816 -8.335 17.435 1.00 12.31 H new ATOM 0 HD2 PHE A 69 -1.709 -6.012 20.341 1.00 44.24 H new ATOM 0 HE1 PHE A 69 -2.008 -9.992 17.455 1.00 63.31 H new ATOM 0 HE2 PHE A 69 0.088 -7.684 20.359 1.00 20.05 H new ATOM 0 HZ PHE A 69 -0.054 -9.669 18.913 1.00 62.24 H new ATOM 1085 N ASP A 70 -7.564 -5.561 19.695 1.00 62.45 N ATOM 1086 CA ASP A 70 -8.699 -4.664 19.357 1.00 13.23 C ATOM 1087 C ASP A 70 -8.951 -3.560 20.419 1.00 55.01 C ATOM 1088 O ASP A 70 -8.542 -3.680 21.576 1.00 23.20 O ATOM 1089 CB ASP A 70 -9.986 -5.512 19.176 1.00 4.33 C ATOM 1090 CG ASP A 70 -10.468 -6.151 20.494 1.00 73.34 C ATOM 1091 OD1 ASP A 70 -9.776 -7.049 21.018 1.00 10.52 O ATOM 1092 OD2 ASP A 70 -11.517 -5.733 21.030 1.00 13.43 O ATOM 0 H ASP A 70 -7.853 -6.518 19.899 1.00 62.45 H new ATOM 0 HA ASP A 70 -8.434 -4.153 18.432 1.00 13.23 H new ATOM 0 HB2 ASP A 70 -10.778 -4.881 18.772 1.00 4.33 H new ATOM 0 HB3 ASP A 70 -9.799 -6.297 18.443 1.00 4.33 H new ATOM 1097 N PHE A 71 -9.642 -2.488 19.995 1.00 45.11 N ATOM 1098 CA PHE A 71 -10.102 -1.398 20.891 1.00 12.24 C ATOM 1099 C PHE A 71 -11.633 -1.199 20.766 1.00 61.14 C ATOM 1100 O PHE A 71 -12.375 -1.341 21.747 1.00 23.01 O ATOM 1101 CB PHE A 71 -9.357 -0.069 20.570 1.00 45.11 C ATOM 1102 CG PHE A 71 -7.847 -0.110 20.813 1.00 25.15 C ATOM 1103 CD1 PHE A 71 -7.320 0.095 22.089 1.00 14.51 C ATOM 1104 CD2 PHE A 71 -6.953 -0.344 19.767 1.00 65.01 C ATOM 1105 CE1 PHE A 71 -5.955 0.066 22.309 1.00 25.24 C ATOM 1106 CE2 PHE A 71 -5.588 -0.376 19.989 1.00 25.43 C ATOM 1107 CZ PHE A 71 -5.089 -0.168 21.260 1.00 33.24 C ATOM 0 H PHE A 71 -9.901 -2.347 19.019 1.00 45.11 H new ATOM 0 HA PHE A 71 -9.872 -1.683 21.917 1.00 12.24 H new ATOM 0 HB2 PHE A 71 -9.537 0.190 19.527 1.00 45.11 H new ATOM 0 HB3 PHE A 71 -9.788 0.729 21.175 1.00 45.11 H new ATOM 0 HD1 PHE A 71 -7.988 0.279 22.917 1.00 14.51 H new ATOM 0 HD2 PHE A 71 -7.333 -0.503 18.769 1.00 65.01 H new ATOM 0 HE1 PHE A 71 -5.566 0.227 23.304 1.00 25.24 H new ATOM 0 HE2 PHE A 71 -4.912 -0.564 19.168 1.00 25.43 H new ATOM 0 HZ PHE A 71 -4.023 -0.188 21.433 1.00 33.24 H new ATOM 1117 N SER A 72 -12.103 -0.881 19.542 1.00 54.41 N ATOM 1118 CA SER A 72 -13.533 -0.573 19.273 1.00 23.32 C ATOM 1119 C SER A 72 -14.037 -1.272 17.992 1.00 74.11 C ATOM 1120 O SER A 72 -13.244 -1.702 17.145 1.00 14.33 O ATOM 1121 CB SER A 72 -13.731 0.958 19.149 1.00 44.51 C ATOM 1122 OG SER A 72 -15.097 1.307 18.936 1.00 24.52 O ATOM 0 H SER A 72 -11.510 -0.829 18.713 1.00 54.41 H new ATOM 0 HA SER A 72 -14.117 -0.951 20.112 1.00 23.32 H new ATOM 0 HB2 SER A 72 -13.370 1.444 20.055 1.00 44.51 H new ATOM 0 HB3 SER A 72 -13.128 1.335 18.323 1.00 44.51 H new ATOM 0 HG SER A 72 -15.179 2.281 18.865 1.00 24.52 H new ATOM 1128 N PHE A 73 -15.374 -1.375 17.867 1.00 1.41 N ATOM 1129 CA PHE A 73 -16.051 -1.964 16.693 1.00 22.12 C ATOM 1130 C PHE A 73 -17.060 -0.959 16.086 1.00 3.41 C ATOM 1131 O PHE A 73 -17.611 -0.107 16.795 1.00 22.12 O ATOM 1132 CB PHE A 73 -16.775 -3.286 17.078 1.00 53.32 C ATOM 1133 CG PHE A 73 -15.847 -4.358 17.655 1.00 74.41 C ATOM 1134 CD1 PHE A 73 -15.067 -5.157 16.816 1.00 4.14 C ATOM 1135 CD2 PHE A 73 -15.743 -4.559 19.035 1.00 53.43 C ATOM 1136 CE1 PHE A 73 -14.212 -6.114 17.339 1.00 22.21 C ATOM 1137 CE2 PHE A 73 -14.893 -5.517 19.553 1.00 42.31 C ATOM 1138 CZ PHE A 73 -14.128 -6.294 18.708 1.00 10.53 C ATOM 0 H PHE A 73 -16.022 -1.049 18.584 1.00 1.41 H new ATOM 0 HA PHE A 73 -15.292 -2.192 15.945 1.00 22.12 H new ATOM 0 HB2 PHE A 73 -17.554 -3.063 17.808 1.00 53.32 H new ATOM 0 HB3 PHE A 73 -17.272 -3.687 16.194 1.00 53.32 H new ATOM 0 HD1 PHE A 73 -15.131 -5.027 15.746 1.00 4.14 H new ATOM 0 HD2 PHE A 73 -16.336 -3.956 19.706 1.00 53.43 H new ATOM 0 HE1 PHE A 73 -13.611 -6.720 16.677 1.00 22.21 H new ATOM 0 HE2 PHE A 73 -14.827 -5.658 20.622 1.00 42.31 H new ATOM 0 HZ PHE A 73 -13.464 -7.042 19.115 1.00 10.53 H new ATOM 1148 N GLY A 74 -17.308 -1.089 14.772 1.00 4.00 N ATOM 1149 CA GLY A 74 -18.198 -0.179 14.037 1.00 1.00 C ATOM 1150 C GLY A 74 -18.565 -0.724 12.657 1.00 0.01 C ATOM 1151 O GLY A 74 -17.938 -0.366 11.651 1.00 71.24 O ATOM 0 H GLY A 74 -16.899 -1.823 14.194 1.00 4.00 H new ATOM 0 HA2 GLY A 74 -19.107 -0.016 14.616 1.00 1.00 H new ATOM 0 HA3 GLY A 74 -17.713 0.791 13.926 1.00 1.00 H new ATOM 1155 N LEU A 75 -19.570 -1.621 12.624 1.00 54.44 N ATOM 1156 CA LEU A 75 -20.079 -2.240 11.377 1.00 62.43 C ATOM 1157 C LEU A 75 -21.032 -1.258 10.662 1.00 12.44 C ATOM 1158 O LEU A 75 -22.110 -0.935 11.180 1.00 74.34 O ATOM 1159 CB LEU A 75 -20.798 -3.597 11.679 1.00 71.23 C ATOM 1160 CG LEU A 75 -19.885 -4.799 12.123 1.00 42.11 C ATOM 1161 CD1 LEU A 75 -19.214 -4.568 13.498 1.00 53.32 C ATOM 1162 CD2 LEU A 75 -20.669 -6.136 12.102 1.00 1.53 C ATOM 0 H LEU A 75 -20.055 -1.940 13.462 1.00 54.44 H new ATOM 0 HA LEU A 75 -19.236 -2.455 10.720 1.00 62.43 H new ATOM 0 HB2 LEU A 75 -21.536 -3.424 12.462 1.00 71.23 H new ATOM 0 HB3 LEU A 75 -21.345 -3.898 10.786 1.00 71.23 H new ATOM 0 HG LEU A 75 -19.080 -4.862 11.391 1.00 42.11 H new ATOM 0 HD11 LEU A 75 -18.597 -5.430 13.751 1.00 53.32 H new ATOM 0 HD12 LEU A 75 -18.590 -3.676 13.453 1.00 53.32 H new ATOM 0 HD13 LEU A 75 -19.982 -4.435 14.260 1.00 53.32 H new ATOM 0 HD21 LEU A 75 -20.012 -6.948 12.413 1.00 1.53 H new ATOM 0 HD22 LEU A 75 -21.516 -6.072 12.785 1.00 1.53 H new ATOM 0 HD23 LEU A 75 -21.031 -6.329 11.092 1.00 1.53 H new ATOM 1174 N GLU A 76 -20.610 -0.782 9.483 1.00 62.11 N ATOM 1175 CA GLU A 76 -21.312 0.279 8.728 1.00 2.15 C ATOM 1176 C GLU A 76 -22.059 -0.302 7.503 1.00 22.41 C ATOM 1177 O GLU A 76 -21.620 -1.286 6.899 1.00 4.34 O ATOM 1178 CB GLU A 76 -20.270 1.338 8.263 1.00 31.24 C ATOM 1179 CG GLU A 76 -20.840 2.562 7.514 1.00 24.42 C ATOM 1180 CD GLU A 76 -19.743 3.534 7.026 1.00 54.15 C ATOM 1181 OE1 GLU A 76 -19.319 4.412 7.815 1.00 50.44 O ATOM 1182 OE2 GLU A 76 -19.288 3.412 5.864 1.00 14.02 O ATOM 0 H GLU A 76 -19.767 -1.121 9.019 1.00 62.11 H new ATOM 0 HA GLU A 76 -22.054 0.742 9.379 1.00 2.15 H new ATOM 0 HB2 GLU A 76 -19.726 1.693 9.138 1.00 31.24 H new ATOM 0 HB3 GLU A 76 -19.545 0.846 7.615 1.00 31.24 H new ATOM 0 HG2 GLU A 76 -21.421 2.219 6.658 1.00 24.42 H new ATOM 0 HG3 GLU A 76 -21.526 3.097 8.171 1.00 24.42 H new ATOM 1189 N HIS A 77 -23.202 0.315 7.148 1.00 2.30 N ATOM 1190 CA HIS A 77 -23.850 0.105 5.837 1.00 3.10 C ATOM 1191 C HIS A 77 -23.142 0.980 4.774 1.00 41.14 C ATOM 1192 O HIS A 77 -23.648 2.023 4.343 1.00 43.13 O ATOM 1193 CB HIS A 77 -25.370 0.397 5.919 1.00 65.44 C ATOM 1194 CG HIS A 77 -26.110 -0.569 6.800 1.00 42.33 C ATOM 1195 ND1 HIS A 77 -26.427 -1.848 6.398 1.00 61.00 N ATOM 1196 CD2 HIS A 77 -26.599 -0.446 8.059 1.00 61.13 C ATOM 1197 CE1 HIS A 77 -27.076 -2.465 7.358 1.00 40.54 C ATOM 1198 NE2 HIS A 77 -27.194 -1.640 8.376 1.00 20.22 N ATOM 0 H HIS A 77 -23.699 0.967 7.754 1.00 2.30 H new ATOM 0 HA HIS A 77 -23.751 -0.939 5.541 1.00 3.10 H new ATOM 0 HB2 HIS A 77 -25.519 1.409 6.294 1.00 65.44 H new ATOM 0 HB3 HIS A 77 -25.795 0.363 4.916 1.00 65.44 H new ATOM 0 HD2 HIS A 77 -26.532 0.427 8.692 1.00 61.13 H new ATOM 0 HE1 HIS A 77 -27.450 -3.478 7.319 1.00 40.54 H new ATOM 0 HE2 HIS A 77 -27.655 -1.854 9.260 1.00 20.22 H new ATOM 1207 N HIS A 78 -21.924 0.540 4.428 1.00 14.33 N ATOM 1208 CA HIS A 78 -21.028 1.189 3.450 1.00 52.34 C ATOM 1209 C HIS A 78 -21.690 1.336 2.046 1.00 51.30 C ATOM 1210 O HIS A 78 -21.861 0.352 1.317 1.00 72.51 O ATOM 1211 CB HIS A 78 -19.686 0.388 3.389 1.00 34.11 C ATOM 1212 CG HIS A 78 -19.862 -1.111 3.297 1.00 63.33 C ATOM 1213 ND1 HIS A 78 -20.063 -1.898 4.410 1.00 31.35 N ATOM 1214 CD2 HIS A 78 -19.911 -1.955 2.239 1.00 62.11 C ATOM 1215 CE1 HIS A 78 -20.226 -3.145 4.046 1.00 13.11 C ATOM 1216 NE2 HIS A 78 -20.141 -3.214 2.737 1.00 4.11 N ATOM 0 H HIS A 78 -21.519 -0.304 4.832 1.00 14.33 H new ATOM 0 HA HIS A 78 -20.822 2.207 3.779 1.00 52.34 H new ATOM 0 HB2 HIS A 78 -19.112 0.729 2.528 1.00 34.11 H new ATOM 0 HB3 HIS A 78 -19.097 0.620 4.277 1.00 34.11 H new ATOM 0 HD1 HIS A 78 -20.082 -1.560 5.372 1.00 31.35 H new ATOM 0 HD2 HIS A 78 -19.792 -1.688 1.199 1.00 62.11 H new ATOM 0 HE1 HIS A 78 -20.401 -3.978 4.711 1.00 13.11 H new ATOM 1225 N HIS A 79 -22.075 2.579 1.699 1.00 41.32 N ATOM 1226 CA HIS A 79 -22.753 2.899 0.422 1.00 50.44 C ATOM 1227 C HIS A 79 -21.745 2.958 -0.752 1.00 73.00 C ATOM 1228 O HIS A 79 -21.229 4.025 -1.113 1.00 13.42 O ATOM 1229 CB HIS A 79 -23.554 4.223 0.548 1.00 31.41 C ATOM 1230 CG HIS A 79 -24.651 4.172 1.577 1.00 74.32 C ATOM 1231 ND1 HIS A 79 -25.887 3.615 1.328 1.00 0.32 N ATOM 1232 CD2 HIS A 79 -24.692 4.597 2.863 1.00 32.34 C ATOM 1233 CE1 HIS A 79 -26.633 3.694 2.408 1.00 30.42 C ATOM 1234 NE2 HIS A 79 -25.934 4.284 3.354 1.00 33.32 N ATOM 0 H HIS A 79 -21.926 3.393 2.295 1.00 41.32 H new ATOM 0 HA HIS A 79 -23.458 2.097 0.202 1.00 50.44 H new ATOM 0 HB2 HIS A 79 -22.867 5.030 0.802 1.00 31.41 H new ATOM 0 HB3 HIS A 79 -23.988 4.468 -0.421 1.00 31.41 H new ATOM 0 HD2 HIS A 79 -23.896 5.090 3.401 1.00 32.34 H new ATOM 0 HE1 HIS A 79 -27.647 3.335 2.503 1.00 30.42 H new ATOM 0 HE2 HIS A 79 -26.263 4.477 4.300 1.00 33.32 H new ATOM 1243 N HIS A 80 -21.435 1.772 -1.293 1.00 44.01 N ATOM 1244 CA HIS A 80 -20.595 1.622 -2.495 1.00 34.51 C ATOM 1245 C HIS A 80 -21.390 2.022 -3.760 1.00 60.23 C ATOM 1246 O HIS A 80 -22.471 1.480 -4.017 1.00 73.40 O ATOM 1247 CB HIS A 80 -20.065 0.157 -2.609 1.00 32.13 C ATOM 1248 CG HIS A 80 -21.129 -0.919 -2.608 1.00 32.24 C ATOM 1249 ND1 HIS A 80 -21.644 -1.468 -3.763 1.00 65.22 N ATOM 1250 CD2 HIS A 80 -21.770 -1.547 -1.586 1.00 4.54 C ATOM 1251 CE1 HIS A 80 -22.557 -2.368 -3.457 1.00 32.43 C ATOM 1252 NE2 HIS A 80 -22.651 -2.439 -2.148 1.00 4.34 N ATOM 0 H HIS A 80 -21.760 0.884 -0.910 1.00 44.01 H new ATOM 0 HA HIS A 80 -19.736 2.288 -2.408 1.00 34.51 H new ATOM 0 HB2 HIS A 80 -19.484 0.069 -3.527 1.00 32.13 H new ATOM 0 HB3 HIS A 80 -19.382 -0.030 -1.780 1.00 32.13 H new ATOM 0 HD2 HIS A 80 -21.615 -1.377 -0.531 1.00 4.54 H new ATOM 0 HE1 HIS A 80 -23.131 -2.949 -4.163 1.00 32.43 H new ATOM 0 HE2 HIS A 80 -23.277 -3.057 -1.632 1.00 4.34 H new ATOM 1261 N HIS A 81 -20.876 3.009 -4.514 1.00 73.12 N ATOM 1262 CA HIS A 81 -21.447 3.376 -5.831 1.00 2.11 C ATOM 1263 C HIS A 81 -21.081 2.291 -6.871 1.00 10.12 C ATOM 1264 O HIS A 81 -21.951 1.749 -7.565 1.00 34.50 O ATOM 1265 CB HIS A 81 -20.949 4.775 -6.280 1.00 63.13 C ATOM 1266 CG HIS A 81 -21.276 5.876 -5.298 1.00 74.43 C ATOM 1267 ND1 HIS A 81 -20.312 6.602 -4.637 1.00 51.34 N ATOM 1268 CD2 HIS A 81 -22.464 6.358 -4.858 1.00 44.33 C ATOM 1269 CE1 HIS A 81 -20.881 7.464 -3.829 1.00 51.42 C ATOM 1270 NE2 HIS A 81 -22.185 7.344 -3.944 1.00 64.20 N ATOM 0 H HIS A 81 -20.069 3.568 -4.239 1.00 73.12 H new ATOM 0 HA HIS A 81 -22.532 3.430 -5.747 1.00 2.11 H new ATOM 0 HB2 HIS A 81 -19.869 4.738 -6.426 1.00 63.13 H new ATOM 0 HB3 HIS A 81 -21.393 5.017 -7.246 1.00 63.13 H new ATOM 0 HD1 HIS A 81 -19.306 6.487 -4.757 1.00 51.34 H new ATOM 0 HD2 HIS A 81 -23.445 6.029 -5.168 1.00 44.33 H new ATOM 0 HE1 HIS A 81 -20.365 8.156 -3.179 1.00 51.42 H new ATOM 1279 N HIS A 82 -19.776 1.971 -6.931 1.00 52.22 N ATOM 1280 CA HIS A 82 -19.225 0.896 -7.779 1.00 3.10 C ATOM 1281 C HIS A 82 -17.815 0.492 -7.280 1.00 34.43 C ATOM 1282 O HIS A 82 -17.390 0.859 -6.174 1.00 1.32 O ATOM 1283 CB HIS A 82 -19.185 1.348 -9.267 1.00 61.23 C ATOM 1284 CG HIS A 82 -18.824 0.258 -10.244 1.00 34.41 C ATOM 1285 ND1 HIS A 82 -19.733 -0.677 -10.689 1.00 2.14 N ATOM 1286 CD2 HIS A 82 -17.655 -0.041 -10.865 1.00 54.11 C ATOM 1287 CE1 HIS A 82 -19.146 -1.498 -11.531 1.00 22.55 C ATOM 1288 NE2 HIS A 82 -17.887 -1.136 -11.659 1.00 71.04 N ATOM 0 H HIS A 82 -19.064 2.457 -6.385 1.00 52.22 H new ATOM 0 HA HIS A 82 -19.873 0.022 -7.710 1.00 3.10 H new ATOM 0 HB2 HIS A 82 -20.161 1.751 -9.537 1.00 61.23 H new ATOM 0 HB3 HIS A 82 -18.465 2.161 -9.367 1.00 61.23 H new ATOM 0 HD2 HIS A 82 -16.718 0.484 -10.755 1.00 54.11 H new ATOM 0 HE1 HIS A 82 -19.617 -2.330 -12.033 1.00 22.55 H new ATOM 0 HE2 HIS A 82 -17.196 -1.595 -12.252 1.00 71.04 H new TER 1297 HIS A 82 ATOM 1298 N MET B 1 4.410 -12.393 10.271 1.00 63.45 N ATOM 1299 CA MET B 1 5.161 -12.882 9.110 1.00 65.11 C ATOM 1300 C MET B 1 5.361 -11.746 8.077 1.00 44.42 C ATOM 1301 O MET B 1 6.490 -11.301 7.831 1.00 65.52 O ATOM 1302 CB MET B 1 4.421 -14.093 8.466 1.00 30.23 C ATOM 1303 CG MET B 1 5.103 -14.708 7.230 1.00 24.34 C ATOM 1304 SD MET B 1 4.097 -16.004 6.462 1.00 2.25 S ATOM 1305 CE MET B 1 5.131 -16.515 5.084 1.00 13.31 C ATOM 0 H1 MET B 1 4.284 -13.167 10.954 1.00 63.45 H new ATOM 0 H2 MET B 1 4.934 -11.615 10.721 1.00 63.45 H new ATOM 0 H3 MET B 1 3.478 -12.049 9.962 1.00 63.45 H new ATOM 0 HA MET B 1 6.145 -13.215 9.441 1.00 65.11 H new ATOM 0 HB2 MET B 1 4.308 -14.871 9.221 1.00 30.23 H new ATOM 0 HB3 MET B 1 3.417 -13.775 8.184 1.00 30.23 H new ATOM 0 HG2 MET B 1 5.301 -13.924 6.499 1.00 24.34 H new ATOM 0 HG3 MET B 1 6.068 -15.124 7.520 1.00 24.34 H new ATOM 0 HE1 MET B 1 4.631 -17.308 4.528 1.00 13.31 H new ATOM 0 HE2 MET B 1 5.306 -15.664 4.425 1.00 13.31 H new ATOM 0 HE3 MET B 1 6.085 -16.883 5.462 1.00 13.31 H new ATOM 1315 N ASP B 2 4.241 -11.257 7.496 1.00 74.23 N ATOM 1316 CA ASP B 2 4.275 -10.244 6.414 1.00 2.43 C ATOM 1317 C ASP B 2 4.657 -8.837 6.938 1.00 51.13 C ATOM 1318 O ASP B 2 5.117 -8.012 6.171 1.00 24.20 O ATOM 1319 CB ASP B 2 2.927 -10.215 5.646 1.00 23.02 C ATOM 1320 CG ASP B 2 2.946 -9.332 4.380 1.00 35.42 C ATOM 1321 OD1 ASP B 2 3.908 -9.432 3.581 1.00 44.33 O ATOM 1322 OD2 ASP B 2 2.011 -8.539 4.178 1.00 63.43 O ATOM 0 H ASP B 2 3.300 -11.548 7.759 1.00 74.23 H new ATOM 0 HA ASP B 2 5.059 -10.540 5.717 1.00 2.43 H new ATOM 0 HB2 ASP B 2 2.660 -11.233 5.363 1.00 23.02 H new ATOM 0 HB3 ASP B 2 2.146 -9.855 6.316 1.00 23.02 H new ATOM 1327 N LYS B 3 4.509 -8.590 8.255 1.00 32.21 N ATOM 1328 CA LYS B 3 4.999 -7.331 8.897 1.00 55.03 C ATOM 1329 C LYS B 3 6.550 -7.184 8.759 1.00 25.51 C ATOM 1330 O LYS B 3 7.089 -6.075 8.841 1.00 40.30 O ATOM 1331 CB LYS B 3 4.565 -7.293 10.390 1.00 32.01 C ATOM 1332 CG LYS B 3 3.025 -7.309 10.611 1.00 75.54 C ATOM 1333 CD LYS B 3 2.299 -5.998 10.156 1.00 1.41 C ATOM 1334 CE LYS B 3 1.886 -5.087 11.337 1.00 21.02 C ATOM 1335 NZ LYS B 3 0.871 -5.738 12.222 1.00 73.05 N ATOM 0 H LYS B 3 4.057 -9.237 8.902 1.00 32.21 H new ATOM 0 HA LYS B 3 4.548 -6.484 8.379 1.00 55.03 H new ATOM 0 HB2 LYS B 3 5.003 -8.148 10.905 1.00 32.01 H new ATOM 0 HB3 LYS B 3 4.977 -6.397 10.853 1.00 32.01 H new ATOM 0 HG2 LYS B 3 2.600 -8.154 10.069 1.00 75.54 H new ATOM 0 HG3 LYS B 3 2.822 -7.475 11.669 1.00 75.54 H new ATOM 0 HD2 LYS B 3 2.955 -5.440 9.488 1.00 1.41 H new ATOM 0 HD3 LYS B 3 1.411 -6.263 9.582 1.00 1.41 H new ATOM 0 HE2 LYS B 3 2.769 -4.833 11.924 1.00 21.02 H new ATOM 0 HE3 LYS B 3 1.482 -4.152 10.949 1.00 21.02 H new ATOM 0 HZ1 LYS B 3 0.523 -5.048 12.918 1.00 73.05 H new ATOM 0 HZ2 LYS B 3 0.076 -6.079 11.645 1.00 73.05 H new ATOM 0 HZ3 LYS B 3 1.308 -6.540 12.719 1.00 73.05 H new ATOM 1349 N LYS B 4 7.244 -8.329 8.557 1.00 42.12 N ATOM 1350 CA LYS B 4 8.687 -8.377 8.206 1.00 32.23 C ATOM 1351 C LYS B 4 8.907 -8.386 6.671 1.00 62.50 C ATOM 1352 O LYS B 4 9.819 -7.715 6.164 1.00 3.33 O ATOM 1353 CB LYS B 4 9.348 -9.634 8.842 1.00 53.14 C ATOM 1354 CG LYS B 4 9.504 -9.570 10.377 1.00 1.40 C ATOM 1355 CD LYS B 4 10.506 -8.474 10.825 1.00 23.11 C ATOM 1356 CE LYS B 4 10.726 -8.449 12.348 1.00 53.04 C ATOM 1357 NZ LYS B 4 11.701 -7.402 12.742 1.00 0.53 N ATOM 0 H LYS B 4 6.817 -9.252 8.633 1.00 42.12 H new ATOM 0 HA LYS B 4 9.154 -7.476 8.604 1.00 32.23 H new ATOM 0 HB2 LYS B 4 8.752 -10.510 8.587 1.00 53.14 H new ATOM 0 HB3 LYS B 4 10.332 -9.776 8.395 1.00 53.14 H new ATOM 0 HG2 LYS B 4 8.532 -9.377 10.830 1.00 1.40 H new ATOM 0 HG3 LYS B 4 9.841 -10.539 10.746 1.00 1.40 H new ATOM 0 HD2 LYS B 4 11.462 -8.638 10.328 1.00 23.11 H new ATOM 0 HD3 LYS B 4 10.140 -7.500 10.500 1.00 23.11 H new ATOM 0 HE2 LYS B 4 9.776 -8.270 12.851 1.00 53.04 H new ATOM 0 HE3 LYS B 4 11.083 -9.424 12.681 1.00 53.04 H new ATOM 0 HZ1 LYS B 4 11.825 -7.414 13.775 1.00 0.53 H new ATOM 0 HZ2 LYS B 4 12.615 -7.588 12.282 1.00 0.53 H new ATOM 0 HZ3 LYS B 4 11.348 -6.470 12.446 1.00 0.53 H new ATOM 1371 N ILE B 5 8.074 -9.167 5.943 1.00 21.41 N ATOM 1372 CA ILE B 5 8.207 -9.342 4.471 1.00 12.03 C ATOM 1373 C ILE B 5 8.013 -8.006 3.711 1.00 64.42 C ATOM 1374 O ILE B 5 8.808 -7.684 2.831 1.00 0.23 O ATOM 1375 CB ILE B 5 7.221 -10.443 3.918 1.00 61.42 C ATOM 1376 CG1 ILE B 5 7.512 -11.824 4.605 1.00 61.23 C ATOM 1377 CG2 ILE B 5 7.288 -10.565 2.366 1.00 62.35 C ATOM 1378 CD1 ILE B 5 6.598 -12.967 4.178 1.00 74.01 C ATOM 0 H ILE B 5 7.298 -9.689 6.351 1.00 21.41 H new ATOM 0 HA ILE B 5 9.226 -9.685 4.291 1.00 12.03 H new ATOM 0 HB ILE B 5 6.206 -10.133 4.165 1.00 61.42 H new ATOM 0 HG12 ILE B 5 8.543 -12.107 4.394 1.00 61.23 H new ATOM 0 HG13 ILE B 5 7.430 -11.699 5.685 1.00 61.23 H new ATOM 0 HG21 ILE B 5 6.593 -11.335 2.031 1.00 62.35 H new ATOM 0 HG22 ILE B 5 7.018 -9.611 1.914 1.00 62.35 H new ATOM 0 HG23 ILE B 5 8.300 -10.835 2.066 1.00 62.35 H new ATOM 0 HD11 ILE B 5 6.880 -13.876 4.709 1.00 74.01 H new ATOM 0 HD12 ILE B 5 5.565 -12.715 4.415 1.00 74.01 H new ATOM 0 HD13 ILE B 5 6.695 -13.129 3.104 1.00 74.01 H new ATOM 1390 N VAL B 6 6.976 -7.221 4.077 1.00 55.11 N ATOM 1391 CA VAL B 6 6.754 -5.867 3.504 1.00 54.13 C ATOM 1392 C VAL B 6 7.948 -4.924 3.779 1.00 32.44 C ATOM 1393 O VAL B 6 8.164 -3.989 3.027 1.00 4.35 O ATOM 1394 CB VAL B 6 5.427 -5.182 4.005 1.00 51.43 C ATOM 1395 CG1 VAL B 6 4.189 -5.994 3.574 1.00 3.23 C ATOM 1396 CG2 VAL B 6 5.440 -4.949 5.540 1.00 71.11 C ATOM 0 H VAL B 6 6.277 -7.498 4.766 1.00 55.11 H new ATOM 0 HA VAL B 6 6.658 -6.030 2.431 1.00 54.13 H new ATOM 0 HB VAL B 6 5.369 -4.201 3.532 1.00 51.43 H new ATOM 0 HG11 VAL B 6 3.286 -5.499 3.933 1.00 3.23 H new ATOM 0 HG12 VAL B 6 4.158 -6.061 2.486 1.00 3.23 H new ATOM 0 HG13 VAL B 6 4.246 -6.997 3.998 1.00 3.23 H new ATOM 0 HG21 VAL B 6 4.507 -4.475 5.844 1.00 71.11 H new ATOM 0 HG22 VAL B 6 5.545 -5.905 6.052 1.00 71.11 H new ATOM 0 HG23 VAL B 6 6.278 -4.303 5.803 1.00 71.11 H new ATOM 1406 N GLY B 7 8.697 -5.179 4.875 1.00 54.45 N ATOM 1407 CA GLY B 7 9.953 -4.465 5.158 1.00 52.42 C ATOM 1408 C GLY B 7 11.032 -4.712 4.095 1.00 22.22 C ATOM 1409 O GLY B 7 11.651 -3.765 3.589 1.00 40.03 O ATOM 0 H GLY B 7 8.449 -5.876 5.577 1.00 54.45 H new ATOM 0 HA2 GLY B 7 9.751 -3.396 5.222 1.00 52.42 H new ATOM 0 HA3 GLY B 7 10.331 -4.777 6.132 1.00 52.42 H new ATOM 1413 N ALA B 8 11.241 -5.999 3.752 1.00 25.04 N ATOM 1414 CA ALA B 8 12.198 -6.424 2.698 1.00 73.11 C ATOM 1415 C ALA B 8 11.767 -5.915 1.295 1.00 71.11 C ATOM 1416 O ALA B 8 12.588 -5.417 0.509 1.00 30.53 O ATOM 1417 CB ALA B 8 12.316 -7.960 2.695 1.00 71.24 C ATOM 0 H ALA B 8 10.753 -6.777 4.195 1.00 25.04 H new ATOM 0 HA ALA B 8 13.169 -5.983 2.923 1.00 73.11 H new ATOM 0 HB1 ALA B 8 13.018 -8.269 1.921 1.00 71.24 H new ATOM 0 HB2 ALA B 8 12.674 -8.299 3.667 1.00 71.24 H new ATOM 0 HB3 ALA B 8 11.339 -8.400 2.495 1.00 71.24 H new ATOM 1423 N ASN B 9 10.457 -6.038 1.018 1.00 1.21 N ATOM 1424 CA ASN B 9 9.834 -5.619 -0.258 1.00 21.44 C ATOM 1425 C ASN B 9 9.858 -4.086 -0.423 1.00 41.25 C ATOM 1426 O ASN B 9 10.088 -3.589 -1.524 1.00 61.21 O ATOM 1427 CB ASN B 9 8.376 -6.153 -0.346 1.00 72.54 C ATOM 1428 CG ASN B 9 8.286 -7.681 -0.439 1.00 63.44 C ATOM 1429 OD1 ASN B 9 9.136 -8.410 0.065 1.00 71.30 O ATOM 1430 ND2 ASN B 9 7.254 -8.181 -1.087 1.00 3.21 N ATOM 0 H ASN B 9 9.790 -6.435 1.679 1.00 1.21 H new ATOM 0 HA ASN B 9 10.418 -6.048 -1.072 1.00 21.44 H new ATOM 0 HB2 ASN B 9 7.822 -5.818 0.530 1.00 72.54 H new ATOM 0 HB3 ASN B 9 7.890 -5.715 -1.218 1.00 72.54 H new ATOM 0 HD21 ASN B 9 7.150 -9.192 -1.178 1.00 3.21 H new ATOM 0 HD22 ASN B 9 6.559 -7.558 -1.498 1.00 3.21 H new ATOM 1437 N ALA B 10 9.675 -3.347 0.689 1.00 50.43 N ATOM 1438 CA ALA B 10 9.637 -1.864 0.679 1.00 71.24 C ATOM 1439 C ALA B 10 11.019 -1.283 0.354 1.00 62.25 C ATOM 1440 O ALA B 10 11.131 -0.313 -0.397 1.00 65.40 O ATOM 1441 CB ALA B 10 9.138 -1.326 2.026 1.00 34.22 C ATOM 0 H ALA B 10 9.550 -3.754 1.616 1.00 50.43 H new ATOM 0 HA ALA B 10 8.941 -1.551 -0.100 1.00 71.24 H new ATOM 0 HB1 ALA B 10 9.118 -0.237 1.998 1.00 34.22 H new ATOM 0 HB2 ALA B 10 8.134 -1.703 2.219 1.00 34.22 H new ATOM 0 HB3 ALA B 10 9.808 -1.656 2.820 1.00 34.22 H new ATOM 1447 N GLY B 11 12.067 -1.918 0.917 1.00 64.12 N ATOM 1448 CA GLY B 11 13.455 -1.548 0.625 1.00 63.40 C ATOM 1449 C GLY B 11 13.780 -1.639 -0.870 1.00 4.32 C ATOM 1450 O GLY B 11 14.339 -0.709 -1.446 1.00 75.41 O ATOM 0 H GLY B 11 11.972 -2.690 1.577 1.00 64.12 H new ATOM 0 HA2 GLY B 11 13.638 -0.531 0.973 1.00 63.40 H new ATOM 0 HA3 GLY B 11 14.127 -2.201 1.181 1.00 63.40 H new ATOM 1454 N LYS B 12 13.357 -2.756 -1.491 1.00 51.40 N ATOM 1455 CA LYS B 12 13.531 -3.028 -2.942 1.00 62.21 C ATOM 1456 C LYS B 12 12.762 -1.996 -3.822 1.00 20.31 C ATOM 1457 O LYS B 12 13.292 -1.507 -4.831 1.00 51.42 O ATOM 1458 CB LYS B 12 13.056 -4.480 -3.234 1.00 1.54 C ATOM 1459 CG LYS B 12 13.295 -4.998 -4.674 1.00 23.13 C ATOM 1460 CD LYS B 12 12.886 -6.488 -4.822 1.00 41.40 C ATOM 1461 CE LYS B 12 13.133 -7.059 -6.228 1.00 43.24 C ATOM 1462 NZ LYS B 12 14.563 -7.035 -6.623 1.00 23.53 N ATOM 0 H LYS B 12 12.877 -3.509 -0.998 1.00 51.40 H new ATOM 0 HA LYS B 12 14.585 -2.926 -3.200 1.00 62.21 H new ATOM 0 HB2 LYS B 12 13.560 -5.152 -2.539 1.00 1.54 H new ATOM 0 HB3 LYS B 12 11.989 -4.542 -3.020 1.00 1.54 H new ATOM 0 HG2 LYS B 12 12.725 -4.392 -5.378 1.00 23.13 H new ATOM 0 HG3 LYS B 12 14.347 -4.882 -4.933 1.00 23.13 H new ATOM 0 HD2 LYS B 12 13.441 -7.082 -4.096 1.00 41.40 H new ATOM 0 HD3 LYS B 12 11.829 -6.592 -4.578 1.00 41.40 H new ATOM 0 HE2 LYS B 12 12.769 -8.086 -6.266 1.00 43.24 H new ATOM 0 HE3 LYS B 12 12.552 -6.488 -6.953 1.00 43.24 H new ATOM 0 HZ1 LYS B 12 14.673 -7.478 -7.557 1.00 23.53 H new ATOM 0 HZ2 LYS B 12 14.895 -6.050 -6.666 1.00 23.53 H new ATOM 0 HZ3 LYS B 12 15.125 -7.560 -5.923 1.00 23.53 H new ATOM 1476 N VAL B 13 11.522 -1.662 -3.404 1.00 45.23 N ATOM 1477 CA VAL B 13 10.671 -0.640 -4.072 1.00 34.25 C ATOM 1478 C VAL B 13 11.294 0.784 -3.966 1.00 30.35 C ATOM 1479 O VAL B 13 11.238 1.579 -4.914 1.00 62.42 O ATOM 1480 CB VAL B 13 9.199 -0.666 -3.482 1.00 21.25 C ATOM 1481 CG1 VAL B 13 8.323 0.492 -4.025 1.00 4.20 C ATOM 1482 CG2 VAL B 13 8.514 -2.031 -3.770 1.00 63.44 C ATOM 0 H VAL B 13 11.077 -2.091 -2.593 1.00 45.23 H new ATOM 0 HA VAL B 13 10.619 -0.891 -5.131 1.00 34.25 H new ATOM 0 HB VAL B 13 9.291 -0.530 -2.405 1.00 21.25 H new ATOM 0 HG11 VAL B 13 7.326 0.428 -3.590 1.00 4.20 H new ATOM 0 HG12 VAL B 13 8.775 1.447 -3.757 1.00 4.20 H new ATOM 0 HG13 VAL B 13 8.251 0.416 -5.110 1.00 4.20 H new ATOM 0 HG21 VAL B 13 7.506 -2.026 -3.356 1.00 63.44 H new ATOM 0 HG22 VAL B 13 8.464 -2.193 -4.847 1.00 63.44 H new ATOM 0 HG23 VAL B 13 9.092 -2.832 -3.309 1.00 63.44 H new ATOM 1492 N TRP B 14 11.916 1.070 -2.814 1.00 52.41 N ATOM 1493 CA TRP B 14 12.576 2.373 -2.548 1.00 55.34 C ATOM 1494 C TRP B 14 13.913 2.505 -3.325 1.00 2.24 C ATOM 1495 O TRP B 14 14.294 3.606 -3.724 1.00 10.12 O ATOM 1496 CB TRP B 14 12.813 2.555 -1.028 1.00 11.31 C ATOM 1497 CG TRP B 14 13.232 3.957 -0.635 1.00 64.52 C ATOM 1498 CD1 TRP B 14 12.418 5.018 -0.354 1.00 33.54 C ATOM 1499 CD2 TRP B 14 14.571 4.437 -0.492 1.00 75.21 C ATOM 1500 NE1 TRP B 14 13.176 6.119 -0.044 1.00 41.44 N ATOM 1501 CE2 TRP B 14 14.500 5.789 -0.129 1.00 32.32 C ATOM 1502 CE3 TRP B 14 15.816 3.839 -0.655 1.00 71.21 C ATOM 1503 CZ2 TRP B 14 15.638 6.556 0.094 1.00 64.41 C ATOM 1504 CZ3 TRP B 14 16.950 4.594 -0.435 1.00 62.24 C ATOM 1505 CH2 TRP B 14 16.855 5.945 -0.070 1.00 23.23 C ATOM 0 H TRP B 14 11.980 0.412 -2.037 1.00 52.41 H new ATOM 0 HA TRP B 14 11.911 3.161 -2.900 1.00 55.34 H new ATOM 0 HB2 TRP B 14 11.898 2.297 -0.494 1.00 11.31 H new ATOM 0 HB3 TRP B 14 13.581 1.853 -0.703 1.00 11.31 H new ATOM 0 HD1 TRP B 14 11.338 4.994 -0.373 1.00 33.54 H new ATOM 0 HE1 TRP B 14 12.810 7.037 0.209 1.00 41.44 H new ATOM 0 HE3 TRP B 14 15.894 2.803 -0.948 1.00 71.21 H new ATOM 0 HZ2 TRP B 14 15.566 7.594 0.385 1.00 64.41 H new ATOM 0 HZ3 TRP B 14 17.923 4.139 -0.545 1.00 62.24 H new ATOM 0 HH2 TRP B 14 17.759 6.516 0.085 1.00 23.23 H new ATOM 1516 N HIS B 15 14.627 1.377 -3.511 1.00 64.00 N ATOM 1517 CA HIS B 15 15.897 1.341 -4.293 1.00 75.11 C ATOM 1518 C HIS B 15 15.668 1.776 -5.759 1.00 33.52 C ATOM 1519 O HIS B 15 16.562 2.347 -6.397 1.00 55.43 O ATOM 1520 CB HIS B 15 16.550 -0.062 -4.235 1.00 25.44 C ATOM 1521 CG HIS B 15 17.007 -0.483 -2.862 1.00 45.25 C ATOM 1522 ND1 HIS B 15 17.080 -1.805 -2.468 1.00 61.22 N ATOM 1523 CD2 HIS B 15 17.424 0.241 -1.792 1.00 50.42 C ATOM 1524 CE1 HIS B 15 17.512 -1.875 -1.228 1.00 64.35 C ATOM 1525 NE2 HIS B 15 17.727 -0.654 -0.794 1.00 71.43 N ATOM 0 H HIS B 15 14.351 0.471 -3.132 1.00 64.00 H new ATOM 0 HA HIS B 15 16.583 2.054 -3.834 1.00 75.11 H new ATOM 0 HB2 HIS B 15 15.836 -0.797 -4.607 1.00 25.44 H new ATOM 0 HB3 HIS B 15 17.406 -0.079 -4.910 1.00 25.44 H new ATOM 0 HD2 HIS B 15 17.503 1.317 -1.736 1.00 50.42 H new ATOM 0 HE1 HIS B 15 17.664 -2.782 -0.662 1.00 64.35 H new ATOM 0 HE2 HIS B 15 18.065 -0.409 0.137 1.00 71.43 H new ATOM 1534 N ALA B 16 14.455 1.496 -6.275 1.00 14.55 N ATOM 1535 CA ALA B 16 14.019 1.952 -7.615 1.00 44.12 C ATOM 1536 C ALA B 16 13.996 3.504 -7.737 1.00 34.40 C ATOM 1537 O ALA B 16 14.208 4.033 -8.829 1.00 42.10 O ATOM 1538 CB ALA B 16 12.642 1.358 -7.947 1.00 12.41 C ATOM 0 H ALA B 16 13.751 0.950 -5.779 1.00 14.55 H new ATOM 0 HA ALA B 16 14.751 1.593 -8.339 1.00 44.12 H new ATOM 0 HB1 ALA B 16 12.328 1.698 -8.934 1.00 12.41 H new ATOM 0 HB2 ALA B 16 12.704 0.270 -7.940 1.00 12.41 H new ATOM 0 HB3 ALA B 16 11.916 1.685 -7.203 1.00 12.41 H new ATOM 1544 N LEU B 17 13.746 4.217 -6.606 1.00 75.11 N ATOM 1545 CA LEU B 17 13.772 5.709 -6.556 1.00 61.40 C ATOM 1546 C LEU B 17 15.175 6.288 -6.862 1.00 11.40 C ATOM 1547 O LEU B 17 15.287 7.375 -7.448 1.00 52.51 O ATOM 1548 CB LEU B 17 13.277 6.240 -5.180 1.00 33.21 C ATOM 1549 CG LEU B 17 11.743 6.163 -4.913 1.00 4.13 C ATOM 1550 CD1 LEU B 17 11.402 6.668 -3.492 1.00 24.13 C ATOM 1551 CD2 LEU B 17 10.960 6.962 -5.982 1.00 44.13 C ATOM 0 H LEU B 17 13.523 3.782 -5.711 1.00 75.11 H new ATOM 0 HA LEU B 17 13.091 6.048 -7.336 1.00 61.40 H new ATOM 0 HB2 LEU B 17 13.788 5.682 -4.396 1.00 33.21 H new ATOM 0 HB3 LEU B 17 13.588 7.280 -5.085 1.00 33.21 H new ATOM 0 HG LEU B 17 11.441 5.118 -4.980 1.00 4.13 H new ATOM 0 HD11 LEU B 17 10.326 6.604 -3.332 1.00 24.13 H new ATOM 0 HD12 LEU B 17 11.916 6.053 -2.754 1.00 24.13 H new ATOM 0 HD13 LEU B 17 11.723 7.704 -3.387 1.00 24.13 H new ATOM 0 HD21 LEU B 17 9.892 6.895 -5.776 1.00 44.13 H new ATOM 0 HD22 LEU B 17 11.270 8.007 -5.955 1.00 44.13 H new ATOM 0 HD23 LEU B 17 11.166 6.548 -6.969 1.00 44.13 H new ATOM 1563 N ASN B 18 16.239 5.569 -6.441 1.00 63.55 N ATOM 1564 CA ASN B 18 17.651 5.963 -6.710 1.00 44.30 C ATOM 1565 C ASN B 18 17.951 6.028 -8.239 1.00 33.05 C ATOM 1566 O ASN B 18 18.839 6.767 -8.681 1.00 54.12 O ATOM 1567 CB ASN B 18 18.621 4.977 -5.996 1.00 32.42 C ATOM 1568 CG ASN B 18 20.102 5.367 -6.113 1.00 62.31 C ATOM 1569 OD1 ASN B 18 20.808 4.924 -7.014 1.00 52.32 O ATOM 1570 ND2 ASN B 18 20.577 6.228 -5.228 1.00 14.23 N ATOM 0 H ASN B 18 16.151 4.704 -5.908 1.00 63.55 H new ATOM 0 HA ASN B 18 17.805 6.965 -6.310 1.00 44.30 H new ATOM 0 HB2 ASN B 18 18.353 4.919 -4.941 1.00 32.42 H new ATOM 0 HB3 ASN B 18 18.484 3.980 -6.415 1.00 32.42 H new ATOM 0 HD21 ASN B 18 21.548 6.536 -5.286 1.00 14.23 H new ATOM 0 HD22 ASN B 18 19.973 6.584 -4.487 1.00 14.23 H new ATOM 1577 N GLU B 19 17.185 5.260 -9.034 1.00 22.21 N ATOM 1578 CA GLU B 19 17.320 5.211 -10.508 1.00 55.04 C ATOM 1579 C GLU B 19 16.274 6.132 -11.196 1.00 14.51 C ATOM 1580 O GLU B 19 16.593 6.838 -12.165 1.00 61.35 O ATOM 1581 CB GLU B 19 17.146 3.741 -10.988 1.00 41.13 C ATOM 1582 CG GLU B 19 17.307 3.538 -12.508 1.00 10.03 C ATOM 1583 CD GLU B 19 17.227 2.064 -12.951 1.00 2.32 C ATOM 1584 OE1 GLU B 19 18.241 1.339 -12.834 1.00 3.10 O ATOM 1585 OE2 GLU B 19 16.161 1.627 -13.421 1.00 30.14 O ATOM 0 H GLU B 19 16.450 4.651 -8.674 1.00 22.21 H new ATOM 0 HA GLU B 19 18.311 5.572 -10.784 1.00 55.04 H new ATOM 0 HB2 GLU B 19 17.875 3.116 -10.472 1.00 41.13 H new ATOM 0 HB3 GLU B 19 16.158 3.390 -10.691 1.00 41.13 H new ATOM 0 HG2 GLU B 19 16.533 4.105 -13.025 1.00 10.03 H new ATOM 0 HG3 GLU B 19 18.267 3.950 -12.820 1.00 10.03 H new ATOM 1592 N ALA B 20 15.031 6.122 -10.669 1.00 13.32 N ATOM 1593 CA ALA B 20 13.871 6.800 -11.299 1.00 50.32 C ATOM 1594 C ALA B 20 12.795 7.194 -10.252 1.00 32.40 C ATOM 1595 O ALA B 20 12.490 6.421 -9.349 1.00 31.51 O ATOM 1596 CB ALA B 20 13.253 5.874 -12.364 1.00 44.40 C ATOM 0 H ALA B 20 14.801 5.646 -9.797 1.00 13.32 H new ATOM 0 HA ALA B 20 14.228 7.718 -11.765 1.00 50.32 H new ATOM 0 HB1 ALA B 20 12.401 6.371 -12.828 1.00 44.40 H new ATOM 0 HB2 ALA B 20 13.999 5.647 -13.126 1.00 44.40 H new ATOM 0 HB3 ALA B 20 12.921 4.948 -11.893 1.00 44.40 H new ATOM 1602 N ASP B 21 12.183 8.379 -10.430 1.00 61.23 N ATOM 1603 CA ASP B 21 11.123 8.903 -9.526 1.00 43.32 C ATOM 1604 C ASP B 21 9.858 9.304 -10.323 1.00 52.42 C ATOM 1605 O ASP B 21 9.884 9.384 -11.557 1.00 11.24 O ATOM 1606 CB ASP B 21 11.651 10.107 -8.701 1.00 62.01 C ATOM 1607 CG ASP B 21 12.034 11.320 -9.567 1.00 65.42 C ATOM 1608 OD1 ASP B 21 13.177 11.372 -10.064 1.00 20.02 O ATOM 1609 OD2 ASP B 21 11.185 12.215 -9.777 1.00 65.33 O ATOM 0 H ASP B 21 12.404 9.007 -11.203 1.00 61.23 H new ATOM 0 HA ASP B 21 10.848 8.105 -8.836 1.00 43.32 H new ATOM 0 HB2 ASP B 21 10.888 10.409 -7.983 1.00 62.01 H new ATOM 0 HB3 ASP B 21 12.522 9.791 -8.127 1.00 62.01 H new ATOM 1614 N GLY B 22 8.760 9.572 -9.592 1.00 51.11 N ATOM 1615 CA GLY B 22 7.469 9.949 -10.194 1.00 11.30 C ATOM 1616 C GLY B 22 6.762 8.818 -10.946 1.00 62.54 C ATOM 1617 O GLY B 22 5.768 9.053 -11.634 1.00 71.11 O ATOM 0 H GLY B 22 8.743 9.533 -8.573 1.00 51.11 H new ATOM 0 HA2 GLY B 22 6.808 10.313 -9.407 1.00 11.30 H new ATOM 0 HA3 GLY B 22 7.632 10.779 -10.882 1.00 11.30 H new ATOM 1621 N ILE B 23 7.271 7.589 -10.797 1.00 74.14 N ATOM 1622 CA ILE B 23 6.768 6.410 -11.518 1.00 42.13 C ATOM 1623 C ILE B 23 5.578 5.764 -10.757 1.00 61.35 C ATOM 1624 O ILE B 23 5.629 5.582 -9.538 1.00 40.23 O ATOM 1625 CB ILE B 23 7.939 5.373 -11.773 1.00 75.33 C ATOM 1626 CG1 ILE B 23 7.426 4.125 -12.559 1.00 31.43 C ATOM 1627 CG2 ILE B 23 8.650 4.964 -10.456 1.00 22.32 C ATOM 1628 CD1 ILE B 23 8.506 3.130 -12.947 1.00 32.01 C ATOM 0 H ILE B 23 8.048 7.382 -10.169 1.00 74.14 H new ATOM 0 HA ILE B 23 6.394 6.729 -12.491 1.00 42.13 H new ATOM 0 HB ILE B 23 8.684 5.873 -12.392 1.00 75.33 H new ATOM 0 HG12 ILE B 23 6.680 3.612 -11.952 1.00 31.43 H new ATOM 0 HG13 ILE B 23 6.922 4.465 -13.464 1.00 31.43 H new ATOM 0 HG21 ILE B 23 9.445 4.252 -10.678 1.00 22.32 H new ATOM 0 HG22 ILE B 23 9.076 5.849 -9.983 1.00 22.32 H new ATOM 0 HG23 ILE B 23 7.929 4.503 -9.781 1.00 22.32 H new ATOM 0 HD11 ILE B 23 8.056 2.298 -13.488 1.00 32.01 H new ATOM 0 HD12 ILE B 23 9.242 3.622 -13.583 1.00 32.01 H new ATOM 0 HD13 ILE B 23 8.996 2.756 -12.048 1.00 32.01 H new ATOM 1640 N SER B 24 4.487 5.471 -11.491 1.00 3.55 N ATOM 1641 CA SER B 24 3.270 4.854 -10.915 1.00 45.34 C ATOM 1642 C SER B 24 3.479 3.372 -10.542 1.00 3.02 C ATOM 1643 O SER B 24 4.341 2.687 -11.105 1.00 44.44 O ATOM 1644 CB SER B 24 2.081 5.005 -11.889 1.00 41.32 C ATOM 1645 OG SER B 24 1.749 6.369 -12.054 1.00 41.12 O ATOM 0 H SER B 24 4.421 5.653 -12.493 1.00 3.55 H new ATOM 0 HA SER B 24 3.047 5.385 -9.990 1.00 45.34 H new ATOM 0 HB2 SER B 24 2.335 4.567 -12.854 1.00 41.32 H new ATOM 0 HB3 SER B 24 1.219 4.458 -11.508 1.00 41.32 H new ATOM 0 HG SER B 24 1.527 6.759 -11.183 1.00 41.12 H new ATOM 1651 N ILE B 25 2.618 2.892 -9.631 1.00 22.44 N ATOM 1652 CA ILE B 25 2.754 1.584 -8.947 1.00 63.01 C ATOM 1653 C ILE B 25 2.857 0.329 -9.904 1.00 63.34 C ATOM 1654 O ILE B 25 3.694 -0.530 -9.636 1.00 73.35 O ATOM 1655 CB ILE B 25 1.583 1.401 -7.902 1.00 25.13 C ATOM 1656 CG1 ILE B 25 1.606 2.576 -6.857 1.00 51.15 C ATOM 1657 CG2 ILE B 25 1.643 0.021 -7.203 1.00 0.03 C ATOM 1658 CD1 ILE B 25 0.451 2.587 -5.860 1.00 13.15 C ATOM 0 H ILE B 25 1.788 3.409 -9.339 1.00 22.44 H new ATOM 0 HA ILE B 25 3.718 1.618 -8.438 1.00 63.01 H new ATOM 0 HB ILE B 25 0.637 1.435 -8.443 1.00 25.13 H new ATOM 0 HG12 ILE B 25 2.543 2.528 -6.302 1.00 51.15 H new ATOM 0 HG13 ILE B 25 1.605 3.522 -7.399 1.00 51.15 H new ATOM 0 HG21 ILE B 25 0.820 -0.063 -6.493 1.00 0.03 H new ATOM 0 HG22 ILE B 25 1.560 -0.769 -7.950 1.00 0.03 H new ATOM 0 HG23 ILE B 25 2.591 -0.078 -6.674 1.00 0.03 H new ATOM 0 HD11 ILE B 25 0.561 3.436 -5.185 1.00 13.15 H new ATOM 0 HD12 ILE B 25 -0.493 2.671 -6.398 1.00 13.15 H new ATOM 0 HD13 ILE B 25 0.459 1.662 -5.284 1.00 13.15 H new ATOM 1670 N PRO B 26 2.043 0.174 -11.023 1.00 75.32 N ATOM 1671 CA PRO B 26 2.152 -1.022 -11.914 1.00 22.42 C ATOM 1672 C PRO B 26 3.486 -1.102 -12.716 1.00 10.23 C ATOM 1673 O PRO B 26 3.989 -2.197 -12.982 1.00 4.41 O ATOM 1674 CB PRO B 26 0.922 -0.880 -12.855 1.00 65.14 C ATOM 1675 CG PRO B 26 0.644 0.589 -12.885 1.00 50.42 C ATOM 1676 CD PRO B 26 0.945 1.073 -11.479 1.00 11.11 C ATOM 0 HA PRO B 26 2.161 -1.947 -11.337 1.00 22.42 H new ATOM 0 HB2 PRO B 26 1.138 -1.264 -13.852 1.00 65.14 H new ATOM 0 HB3 PRO B 26 0.066 -1.439 -12.477 1.00 65.14 H new ATOM 0 HG2 PRO B 26 1.271 1.095 -13.619 1.00 50.42 H new ATOM 0 HG3 PRO B 26 -0.392 0.789 -13.158 1.00 50.42 H new ATOM 0 HD2 PRO B 26 1.255 2.118 -11.473 1.00 11.11 H new ATOM 0 HD3 PRO B 26 0.070 0.996 -10.833 1.00 11.11 H new ATOM 1684 N GLU B 27 4.052 0.063 -13.065 1.00 61.33 N ATOM 1685 CA GLU B 27 5.330 0.164 -13.821 1.00 51.42 C ATOM 1686 C GLU B 27 6.518 -0.087 -12.884 1.00 41.52 C ATOM 1687 O GLU B 27 7.511 -0.733 -13.235 1.00 11.32 O ATOM 1688 CB GLU B 27 5.447 1.570 -14.451 1.00 34.05 C ATOM 1689 CG GLU B 27 4.267 1.966 -15.365 1.00 63.34 C ATOM 1690 CD GLU B 27 3.963 0.918 -16.455 1.00 73.10 C ATOM 1691 OE1 GLU B 27 4.644 0.916 -17.503 1.00 73.12 O ATOM 1692 OE2 GLU B 27 3.057 0.076 -16.249 1.00 2.45 O ATOM 0 H GLU B 27 3.643 0.969 -12.835 1.00 61.33 H new ATOM 0 HA GLU B 27 5.339 -0.588 -14.610 1.00 51.42 H new ATOM 0 HB2 GLU B 27 5.533 2.306 -13.651 1.00 34.05 H new ATOM 0 HB3 GLU B 27 6.370 1.619 -15.029 1.00 34.05 H new ATOM 0 HG2 GLU B 27 3.377 2.114 -14.754 1.00 63.34 H new ATOM 0 HG3 GLU B 27 4.489 2.921 -15.841 1.00 63.34 H new ATOM 1699 N LEU B 28 6.381 0.493 -11.700 1.00 4.45 N ATOM 1700 CA LEU B 28 7.262 0.295 -10.547 1.00 43.42 C ATOM 1701 C LEU B 28 7.296 -1.195 -10.119 1.00 33.30 C ATOM 1702 O LEU B 28 8.352 -1.728 -9.801 1.00 52.25 O ATOM 1703 CB LEU B 28 6.709 1.211 -9.433 1.00 35.30 C ATOM 1704 CG LEU B 28 7.372 1.169 -8.035 1.00 32.42 C ATOM 1705 CD1 LEU B 28 8.860 1.579 -8.079 1.00 35.42 C ATOM 1706 CD2 LEU B 28 6.559 2.055 -7.067 1.00 23.12 C ATOM 0 H LEU B 28 5.621 1.144 -11.503 1.00 4.45 H new ATOM 0 HA LEU B 28 8.296 0.552 -10.778 1.00 43.42 H new ATOM 0 HB2 LEU B 28 6.763 2.238 -9.793 1.00 35.30 H new ATOM 0 HB3 LEU B 28 5.653 0.974 -9.305 1.00 35.30 H new ATOM 0 HG LEU B 28 7.362 0.141 -7.674 1.00 32.42 H new ATOM 0 HD11 LEU B 28 9.280 1.533 -7.074 1.00 35.42 H new ATOM 0 HD12 LEU B 28 9.406 0.898 -8.732 1.00 35.42 H new ATOM 0 HD13 LEU B 28 8.946 2.596 -8.462 1.00 35.42 H new ATOM 0 HD21 LEU B 28 7.019 2.032 -6.079 1.00 23.12 H new ATOM 0 HD22 LEU B 28 6.545 3.080 -7.437 1.00 23.12 H new ATOM 0 HD23 LEU B 28 5.538 1.680 -7.001 1.00 23.12 H new ATOM 1718 N ALA B 29 6.115 -1.850 -10.169 1.00 0.44 N ATOM 1719 CA ALA B 29 5.954 -3.297 -9.869 1.00 30.11 C ATOM 1720 C ALA B 29 6.744 -4.178 -10.866 1.00 63.10 C ATOM 1721 O ALA B 29 7.324 -5.200 -10.484 1.00 3.32 O ATOM 1722 CB ALA B 29 4.465 -3.682 -9.877 1.00 23.14 C ATOM 0 H ALA B 29 5.240 -1.390 -10.420 1.00 0.44 H new ATOM 0 HA ALA B 29 6.362 -3.477 -8.874 1.00 30.11 H new ATOM 0 HB1 ALA B 29 4.363 -4.744 -9.656 1.00 23.14 H new ATOM 0 HB2 ALA B 29 3.935 -3.101 -9.122 1.00 23.14 H new ATOM 0 HB3 ALA B 29 4.041 -3.473 -10.859 1.00 23.14 H new ATOM 1728 N ARG B 30 6.755 -3.757 -12.148 1.00 53.44 N ATOM 1729 CA ARG B 30 7.561 -4.399 -13.216 1.00 32.01 C ATOM 1730 C ARG B 30 9.075 -4.337 -12.899 1.00 2.20 C ATOM 1731 O ARG B 30 9.791 -5.332 -13.062 1.00 50.41 O ATOM 1732 CB ARG B 30 7.269 -3.727 -14.590 1.00 62.11 C ATOM 1733 CG ARG B 30 5.839 -3.978 -15.127 1.00 35.43 C ATOM 1734 CD ARG B 30 5.528 -3.212 -16.436 1.00 33.33 C ATOM 1735 NE ARG B 30 4.258 -3.667 -17.033 1.00 73.53 N ATOM 1736 CZ ARG B 30 3.543 -3.027 -17.936 1.00 51.54 C ATOM 1737 NH1 ARG B 30 3.843 -1.826 -18.322 1.00 64.34 N ATOM 1738 NH2 ARG B 30 2.498 -3.600 -18.427 1.00 51.04 N ATOM 0 H ARG B 30 6.206 -2.962 -12.475 1.00 53.44 H new ATOM 0 HA ARG B 30 7.274 -5.449 -13.265 1.00 32.01 H new ATOM 0 HB2 ARG B 30 7.427 -2.652 -14.497 1.00 62.11 H new ATOM 0 HB3 ARG B 30 7.989 -4.093 -15.321 1.00 62.11 H new ATOM 0 HG2 ARG B 30 5.707 -5.046 -15.300 1.00 35.43 H new ATOM 0 HG3 ARG B 30 5.117 -3.687 -14.364 1.00 35.43 H new ATOM 0 HD2 ARG B 30 5.474 -2.143 -16.230 1.00 33.33 H new ATOM 0 HD3 ARG B 30 6.340 -3.359 -17.148 1.00 33.33 H new ATOM 0 HE ARG B 30 3.897 -4.567 -16.715 1.00 73.53 H new ATOM 0 HH11 ARG B 30 4.653 -1.350 -17.924 1.00 64.34 H new ATOM 0 HH12 ARG B 30 3.269 -1.357 -19.023 1.00 64.34 H new ATOM 0 HH21 ARG B 30 2.235 -4.535 -18.116 1.00 51.04 H new ATOM 0 HH22 ARG B 30 1.934 -3.118 -19.127 1.00 51.04 H new ATOM 1752 N LYS B 31 9.540 -3.164 -12.424 1.00 24.52 N ATOM 1753 CA LYS B 31 10.970 -2.925 -12.100 1.00 2.13 C ATOM 1754 C LYS B 31 11.411 -3.692 -10.831 1.00 2.54 C ATOM 1755 O LYS B 31 12.535 -4.199 -10.764 1.00 15.21 O ATOM 1756 CB LYS B 31 11.239 -1.406 -11.925 1.00 74.44 C ATOM 1757 CG LYS B 31 10.904 -0.560 -13.171 1.00 1.33 C ATOM 1758 CD LYS B 31 11.326 0.922 -13.034 1.00 30.14 C ATOM 1759 CE LYS B 31 12.852 1.106 -12.947 1.00 31.02 C ATOM 1760 NZ LYS B 31 13.556 0.542 -14.130 1.00 74.31 N ATOM 0 H LYS B 31 8.942 -2.356 -12.253 1.00 24.52 H new ATOM 0 HA LYS B 31 11.560 -3.301 -12.936 1.00 2.13 H new ATOM 0 HB2 LYS B 31 10.654 -1.039 -11.082 1.00 74.44 H new ATOM 0 HB3 LYS B 31 12.289 -1.261 -11.672 1.00 74.44 H new ATOM 0 HG2 LYS B 31 11.399 -0.993 -14.040 1.00 1.33 H new ATOM 0 HG3 LYS B 31 9.831 -0.610 -13.358 1.00 1.33 H new ATOM 0 HD2 LYS B 31 10.946 1.483 -13.888 1.00 30.14 H new ATOM 0 HD3 LYS B 31 10.863 1.345 -12.143 1.00 30.14 H new ATOM 0 HE2 LYS B 31 13.084 2.168 -12.861 1.00 31.02 H new ATOM 0 HE3 LYS B 31 13.223 0.624 -12.042 1.00 31.02 H new ATOM 0 HZ1 LYS B 31 14.554 0.835 -14.112 1.00 74.31 H new ATOM 0 HZ2 LYS B 31 13.499 -0.496 -14.105 1.00 74.31 H new ATOM 0 HZ3 LYS B 31 13.108 0.893 -15.000 1.00 74.31 H new ATOM 1774 N VAL B 32 10.517 -3.765 -9.828 1.00 24.22 N ATOM 1775 CA VAL B 32 10.795 -4.458 -8.544 1.00 61.02 C ATOM 1776 C VAL B 32 10.314 -5.931 -8.559 1.00 43.32 C ATOM 1777 O VAL B 32 10.353 -6.604 -7.528 1.00 1.40 O ATOM 1778 CB VAL B 32 10.167 -3.674 -7.331 1.00 52.12 C ATOM 1779 CG1 VAL B 32 10.629 -2.196 -7.351 1.00 35.24 C ATOM 1780 CG2 VAL B 32 8.619 -3.779 -7.303 1.00 43.05 C ATOM 0 H VAL B 32 9.586 -3.350 -9.878 1.00 24.22 H new ATOM 0 HA VAL B 32 11.878 -4.475 -8.418 1.00 61.02 H new ATOM 0 HB VAL B 32 10.527 -4.140 -6.414 1.00 52.12 H new ATOM 0 HG11 VAL B 32 10.188 -1.665 -6.507 1.00 35.24 H new ATOM 0 HG12 VAL B 32 11.716 -2.153 -7.278 1.00 35.24 H new ATOM 0 HG13 VAL B 32 10.309 -1.727 -8.282 1.00 35.24 H new ATOM 0 HG21 VAL B 32 8.232 -3.223 -6.449 1.00 43.05 H new ATOM 0 HG22 VAL B 32 8.209 -3.363 -8.223 1.00 43.05 H new ATOM 0 HG23 VAL B 32 8.327 -4.826 -7.217 1.00 43.05 H new ATOM 1790 N ASN B 33 9.833 -6.402 -9.737 1.00 2.02 N ATOM 1791 CA ASN B 33 9.527 -7.836 -10.014 1.00 22.21 C ATOM 1792 C ASN B 33 8.302 -8.376 -9.202 1.00 24.04 C ATOM 1793 O ASN B 33 8.004 -9.575 -9.234 1.00 22.13 O ATOM 1794 CB ASN B 33 10.818 -8.694 -9.765 1.00 74.21 C ATOM 1795 CG ASN B 33 10.757 -10.139 -10.272 1.00 71.43 C ATOM 1796 OD1 ASN B 33 10.091 -10.445 -11.254 1.00 21.32 O ATOM 1797 ND2 ASN B 33 11.458 -11.044 -9.611 1.00 2.01 N ATOM 0 H ASN B 33 9.643 -5.793 -10.533 1.00 2.02 H new ATOM 0 HA ASN B 33 9.230 -7.920 -11.059 1.00 22.21 H new ATOM 0 HB2 ASN B 33 11.662 -8.195 -10.241 1.00 74.21 H new ATOM 0 HB3 ASN B 33 11.021 -8.711 -8.694 1.00 74.21 H new ATOM 0 HD21 ASN B 33 11.451 -12.017 -9.916 1.00 2.01 H new ATOM 0 HD22 ASN B 33 12.006 -10.769 -8.796 1.00 2.01 H new ATOM 1804 N LEU B 34 7.555 -7.478 -8.521 1.00 33.33 N ATOM 1805 CA LEU B 34 6.411 -7.866 -7.647 1.00 33.42 C ATOM 1806 C LEU B 34 5.053 -7.597 -8.339 1.00 62.11 C ATOM 1807 O LEU B 34 5.002 -7.035 -9.439 1.00 72.44 O ATOM 1808 CB LEU B 34 6.473 -7.095 -6.291 1.00 24.40 C ATOM 1809 CG LEU B 34 7.831 -7.151 -5.513 1.00 1.40 C ATOM 1810 CD1 LEU B 34 7.748 -6.370 -4.181 1.00 55.01 C ATOM 1811 CD2 LEU B 34 8.297 -8.608 -5.289 1.00 61.31 C ATOM 0 H LEU B 34 7.721 -6.472 -8.557 1.00 33.33 H new ATOM 0 HA LEU B 34 6.492 -8.936 -7.457 1.00 33.42 H new ATOM 0 HB2 LEU B 34 6.233 -6.049 -6.483 1.00 24.40 H new ATOM 0 HB3 LEU B 34 5.691 -7.487 -5.640 1.00 24.40 H new ATOM 0 HG LEU B 34 8.584 -6.663 -6.132 1.00 1.40 H new ATOM 0 HD11 LEU B 34 8.706 -6.428 -3.665 1.00 55.01 H new ATOM 0 HD12 LEU B 34 7.509 -5.326 -4.385 1.00 55.01 H new ATOM 0 HD13 LEU B 34 6.970 -6.804 -3.552 1.00 55.01 H new ATOM 0 HD21 LEU B 34 9.242 -8.608 -4.746 1.00 61.31 H new ATOM 0 HD22 LEU B 34 7.546 -9.145 -4.710 1.00 61.31 H new ATOM 0 HD23 LEU B 34 8.432 -9.099 -6.253 1.00 61.31 H new ATOM 1823 N SER B 35 3.950 -8.023 -7.685 1.00 21.02 N ATOM 1824 CA SER B 35 2.569 -7.674 -8.116 1.00 73.21 C ATOM 1825 C SER B 35 2.243 -6.198 -7.808 1.00 3.14 C ATOM 1826 O SER B 35 2.859 -5.594 -6.927 1.00 3.14 O ATOM 1827 CB SER B 35 1.531 -8.586 -7.415 1.00 43.10 C ATOM 1828 OG SER B 35 0.195 -8.220 -7.746 1.00 1.43 O ATOM 0 H SER B 35 3.985 -8.612 -6.853 1.00 21.02 H new ATOM 0 HA SER B 35 2.516 -7.827 -9.194 1.00 73.21 H new ATOM 0 HB2 SER B 35 1.705 -9.623 -7.703 1.00 43.10 H new ATOM 0 HB3 SER B 35 1.667 -8.528 -6.335 1.00 43.10 H new ATOM 0 HG SER B 35 -0.431 -8.818 -7.287 1.00 1.43 H new ATOM 1834 N VAL B 36 1.256 -5.635 -8.528 1.00 25.24 N ATOM 1835 CA VAL B 36 0.779 -4.246 -8.308 1.00 63.25 C ATOM 1836 C VAL B 36 0.280 -4.047 -6.847 1.00 2.21 C ATOM 1837 O VAL B 36 0.570 -3.027 -6.218 1.00 14.12 O ATOM 1838 CB VAL B 36 -0.366 -3.870 -9.324 1.00 53.34 C ATOM 1839 CG1 VAL B 36 -0.878 -2.415 -9.115 1.00 71.23 C ATOM 1840 CG2 VAL B 36 0.101 -4.094 -10.785 1.00 24.14 C ATOM 0 H VAL B 36 0.765 -6.123 -9.277 1.00 25.24 H new ATOM 0 HA VAL B 36 1.626 -3.582 -8.478 1.00 63.25 H new ATOM 0 HB VAL B 36 -1.207 -4.534 -9.127 1.00 53.34 H new ATOM 0 HG11 VAL B 36 -1.666 -2.199 -9.837 1.00 71.23 H new ATOM 0 HG12 VAL B 36 -1.273 -2.310 -8.104 1.00 71.23 H new ATOM 0 HG13 VAL B 36 -0.054 -1.715 -9.257 1.00 71.23 H new ATOM 0 HG21 VAL B 36 -0.705 -3.828 -11.469 1.00 24.14 H new ATOM 0 HG22 VAL B 36 0.971 -3.470 -10.989 1.00 24.14 H new ATOM 0 HG23 VAL B 36 0.366 -5.142 -10.926 1.00 24.14 H new ATOM 1850 N GLU B 37 -0.448 -5.057 -6.327 1.00 50.45 N ATOM 1851 CA GLU B 37 -0.974 -5.059 -4.937 1.00 33.00 C ATOM 1852 C GLU B 37 0.161 -5.070 -3.881 1.00 2.02 C ATOM 1853 O GLU B 37 0.155 -4.264 -2.945 1.00 21.14 O ATOM 1854 CB GLU B 37 -1.901 -6.284 -4.713 1.00 33.10 C ATOM 1855 CG GLU B 37 -3.117 -6.343 -5.652 1.00 73.22 C ATOM 1856 CD GLU B 37 -4.031 -7.550 -5.372 1.00 22.43 C ATOM 1857 OE1 GLU B 37 -4.959 -7.435 -4.541 1.00 24.15 O ATOM 1858 OE2 GLU B 37 -3.832 -8.618 -5.992 1.00 74.11 O ATOM 0 H GLU B 37 -0.690 -5.896 -6.855 1.00 50.45 H new ATOM 0 HA GLU B 37 -1.541 -4.137 -4.810 1.00 33.00 H new ATOM 0 HB2 GLU B 37 -1.316 -7.195 -4.840 1.00 33.10 H new ATOM 0 HB3 GLU B 37 -2.254 -6.273 -3.682 1.00 33.10 H new ATOM 0 HG2 GLU B 37 -3.695 -5.424 -5.549 1.00 73.22 H new ATOM 0 HG3 GLU B 37 -2.771 -6.387 -6.685 1.00 73.22 H new ATOM 1865 N SER B 38 1.138 -5.977 -4.062 1.00 1.45 N ATOM 1866 CA SER B 38 2.261 -6.169 -3.106 1.00 34.24 C ATOM 1867 C SER B 38 3.254 -4.987 -3.136 1.00 2.23 C ATOM 1868 O SER B 38 3.896 -4.681 -2.124 1.00 5.43 O ATOM 1869 CB SER B 38 2.999 -7.493 -3.400 1.00 62.53 C ATOM 1870 OG SER B 38 3.516 -7.519 -4.719 1.00 14.44 O ATOM 0 H SER B 38 1.178 -6.599 -4.870 1.00 1.45 H new ATOM 0 HA SER B 38 1.831 -6.213 -2.105 1.00 34.24 H new ATOM 0 HB2 SER B 38 3.813 -7.623 -2.687 1.00 62.53 H new ATOM 0 HB3 SER B 38 2.315 -8.330 -3.260 1.00 62.53 H new ATOM 0 HG SER B 38 3.198 -6.733 -5.211 1.00 14.44 H new ATOM 1876 N THR B 39 3.378 -4.339 -4.307 1.00 64.35 N ATOM 1877 CA THR B 39 4.197 -3.114 -4.474 1.00 42.01 C ATOM 1878 C THR B 39 3.503 -1.903 -3.805 1.00 63.44 C ATOM 1879 O THR B 39 4.144 -1.172 -3.067 1.00 73.41 O ATOM 1880 CB THR B 39 4.485 -2.816 -5.987 1.00 1.14 C ATOM 1881 OG1 THR B 39 5.234 -3.903 -6.553 1.00 74.43 O ATOM 1882 CG2 THR B 39 5.276 -1.512 -6.207 1.00 54.44 C ATOM 0 H THR B 39 2.917 -4.644 -5.165 1.00 64.35 H new ATOM 0 HA THR B 39 5.155 -3.285 -3.982 1.00 42.01 H new ATOM 0 HB THR B 39 3.516 -2.702 -6.474 1.00 1.14 H new ATOM 0 HG1 THR B 39 4.624 -4.633 -6.789 1.00 74.43 H new ATOM 0 HG21 THR B 39 5.443 -1.363 -7.274 1.00 54.44 H new ATOM 0 HG22 THR B 39 4.709 -0.671 -5.807 1.00 54.44 H new ATOM 0 HG23 THR B 39 6.236 -1.578 -5.696 1.00 54.44 H new ATOM 1890 N ALA B 40 2.184 -1.735 -4.047 1.00 74.02 N ATOM 1891 CA ALA B 40 1.362 -0.643 -3.432 1.00 44.21 C ATOM 1892 C ALA B 40 1.353 -0.727 -1.884 1.00 24.53 C ATOM 1893 O ALA B 40 1.351 0.294 -1.186 1.00 14.52 O ATOM 1894 CB ALA B 40 -0.078 -0.704 -3.968 1.00 2.35 C ATOM 0 H ALA B 40 1.652 -2.343 -4.669 1.00 74.02 H new ATOM 0 HA ALA B 40 1.817 0.308 -3.709 1.00 44.21 H new ATOM 0 HB1 ALA B 40 -0.669 0.093 -3.516 1.00 2.35 H new ATOM 0 HB2 ALA B 40 -0.069 -0.579 -5.051 1.00 2.35 H new ATOM 0 HB3 ALA B 40 -0.519 -1.669 -3.718 1.00 2.35 H new ATOM 1900 N LEU B 41 1.344 -1.968 -1.381 1.00 55.44 N ATOM 1901 CA LEU B 41 1.445 -2.283 0.059 1.00 71.33 C ATOM 1902 C LEU B 41 2.823 -1.810 0.601 1.00 34.12 C ATOM 1903 O LEU B 41 2.909 -1.101 1.611 1.00 71.32 O ATOM 1904 CB LEU B 41 1.281 -3.827 0.244 1.00 32.43 C ATOM 1905 CG LEU B 41 0.704 -4.373 1.599 1.00 24.31 C ATOM 1906 CD1 LEU B 41 0.901 -5.898 1.676 1.00 52.40 C ATOM 1907 CD2 LEU B 41 1.292 -3.675 2.846 1.00 15.32 C ATOM 0 H LEU B 41 1.265 -2.798 -1.968 1.00 55.44 H new ATOM 0 HA LEU B 41 0.663 -1.767 0.616 1.00 71.33 H new ATOM 0 HB2 LEU B 41 0.637 -4.188 -0.558 1.00 32.43 H new ATOM 0 HB3 LEU B 41 2.260 -4.282 0.096 1.00 32.43 H new ATOM 0 HG LEU B 41 -0.361 -4.141 1.606 1.00 24.31 H new ATOM 0 HD11 LEU B 41 0.499 -6.270 2.618 1.00 52.40 H new ATOM 0 HD12 LEU B 41 0.380 -6.375 0.846 1.00 52.40 H new ATOM 0 HD13 LEU B 41 1.964 -6.131 1.619 1.00 52.40 H new ATOM 0 HD21 LEU B 41 0.848 -4.102 3.745 1.00 15.32 H new ATOM 0 HD22 LEU B 41 2.372 -3.821 2.869 1.00 15.32 H new ATOM 0 HD23 LEU B 41 1.071 -2.608 2.804 1.00 15.32 H new ATOM 1919 N ALA B 42 3.886 -2.227 -0.108 1.00 64.23 N ATOM 1920 CA ALA B 42 5.286 -1.888 0.229 1.00 21.50 C ATOM 1921 C ALA B 42 5.533 -0.358 0.180 1.00 34.33 C ATOM 1922 O ALA B 42 6.354 0.173 0.930 1.00 12.12 O ATOM 1923 CB ALA B 42 6.231 -2.628 -0.724 1.00 51.30 C ATOM 0 H ALA B 42 3.801 -2.814 -0.938 1.00 64.23 H new ATOM 0 HA ALA B 42 5.484 -2.207 1.252 1.00 21.50 H new ATOM 0 HB1 ALA B 42 7.263 -2.380 -0.478 1.00 51.30 H new ATOM 0 HB2 ALA B 42 6.082 -3.703 -0.622 1.00 51.30 H new ATOM 0 HB3 ALA B 42 6.021 -2.328 -1.751 1.00 51.30 H new ATOM 1929 N VAL B 43 4.791 0.332 -0.702 1.00 14.34 N ATOM 1930 CA VAL B 43 4.808 1.814 -0.815 1.00 32.51 C ATOM 1931 C VAL B 43 4.171 2.468 0.445 1.00 44.23 C ATOM 1932 O VAL B 43 4.649 3.504 0.932 1.00 34.53 O ATOM 1933 CB VAL B 43 4.068 2.286 -2.134 1.00 23.45 C ATOM 1934 CG1 VAL B 43 3.808 3.812 -2.157 1.00 35.25 C ATOM 1935 CG2 VAL B 43 4.861 1.865 -3.400 1.00 64.01 C ATOM 0 H VAL B 43 4.157 -0.117 -1.363 1.00 14.34 H new ATOM 0 HA VAL B 43 5.846 2.140 -0.877 1.00 32.51 H new ATOM 0 HB VAL B 43 3.099 1.788 -2.136 1.00 23.45 H new ATOM 0 HG11 VAL B 43 3.299 4.080 -3.083 1.00 35.25 H new ATOM 0 HG12 VAL B 43 3.184 4.088 -1.307 1.00 35.25 H new ATOM 0 HG13 VAL B 43 4.758 4.344 -2.098 1.00 35.25 H new ATOM 0 HG21 VAL B 43 4.330 2.202 -4.290 1.00 64.01 H new ATOM 0 HG22 VAL B 43 5.852 2.317 -3.376 1.00 64.01 H new ATOM 0 HG23 VAL B 43 4.958 0.780 -3.424 1.00 64.01 H new ATOM 1945 N GLY B 44 3.107 1.831 0.973 1.00 31.31 N ATOM 1946 CA GLY B 44 2.499 2.239 2.252 1.00 53.42 C ATOM 1947 C GLY B 44 3.439 2.039 3.458 1.00 15.53 C ATOM 1948 O GLY B 44 3.406 2.815 4.419 1.00 1.21 O ATOM 0 H GLY B 44 2.652 1.032 0.532 1.00 31.31 H new ATOM 0 HA2 GLY B 44 2.212 3.289 2.193 1.00 53.42 H new ATOM 0 HA3 GLY B 44 1.585 1.667 2.412 1.00 53.42 H new ATOM 1952 N TRP B 45 4.284 0.985 3.393 1.00 50.41 N ATOM 1953 CA TRP B 45 5.321 0.705 4.417 1.00 5.34 C ATOM 1954 C TRP B 45 6.523 1.693 4.293 1.00 10.42 C ATOM 1955 O TRP B 45 7.238 1.955 5.271 1.00 63.53 O ATOM 1956 CB TRP B 45 5.794 -0.768 4.304 1.00 63.40 C ATOM 1957 CG TRP B 45 6.631 -1.248 5.475 1.00 60.05 C ATOM 1958 CD1 TRP B 45 7.988 -1.403 5.520 1.00 32.44 C ATOM 1959 CD2 TRP B 45 6.151 -1.628 6.778 1.00 73.04 C ATOM 1960 NE1 TRP B 45 8.373 -1.878 6.745 1.00 52.41 N ATOM 1961 CE2 TRP B 45 7.269 -2.025 7.534 1.00 35.42 C ATOM 1962 CE3 TRP B 45 4.885 -1.684 7.374 1.00 72.12 C ATOM 1963 CZ2 TRP B 45 7.163 -2.464 8.852 1.00 12.35 C ATOM 1964 CZ3 TRP B 45 4.782 -2.122 8.682 1.00 20.15 C ATOM 1965 CH2 TRP B 45 5.914 -2.507 9.409 1.00 52.54 C ATOM 0 H TRP B 45 4.268 0.306 2.632 1.00 50.41 H new ATOM 0 HA TRP B 45 4.881 0.855 5.403 1.00 5.34 H new ATOM 0 HB2 TRP B 45 4.919 -1.412 4.210 1.00 63.40 H new ATOM 0 HB3 TRP B 45 6.373 -0.882 3.388 1.00 63.40 H new ATOM 0 HD1 TRP B 45 8.661 -1.182 4.705 1.00 32.44 H new ATOM 0 HE1 TRP B 45 9.331 -2.088 7.023 1.00 52.41 H new ATOM 0 HE3 TRP B 45 4.004 -1.390 6.822 1.00 72.12 H new ATOM 0 HZ2 TRP B 45 8.036 -2.760 9.414 1.00 12.35 H new ATOM 0 HZ3 TRP B 45 3.810 -2.168 9.151 1.00 20.15 H new ATOM 0 HH2 TRP B 45 5.800 -2.844 10.429 1.00 52.54 H new ATOM 1976 N LEU B 46 6.740 2.237 3.084 1.00 12.54 N ATOM 1977 CA LEU B 46 7.693 3.349 2.862 1.00 53.32 C ATOM 1978 C LEU B 46 7.151 4.677 3.441 1.00 73.10 C ATOM 1979 O LEU B 46 7.915 5.499 3.962 1.00 32.10 O ATOM 1980 CB LEU B 46 8.020 3.488 1.351 1.00 24.24 C ATOM 1981 CG LEU B 46 8.855 2.325 0.734 1.00 13.52 C ATOM 1982 CD1 LEU B 46 9.118 2.541 -0.773 1.00 41.32 C ATOM 1983 CD2 LEU B 46 10.173 2.143 1.511 1.00 61.03 C ATOM 0 H LEU B 46 6.266 1.925 2.236 1.00 12.54 H new ATOM 0 HA LEU B 46 8.617 3.116 3.392 1.00 53.32 H new ATOM 0 HB2 LEU B 46 7.083 3.571 0.801 1.00 24.24 H new ATOM 0 HB3 LEU B 46 8.562 4.421 1.199 1.00 24.24 H new ATOM 0 HG LEU B 46 8.271 1.409 0.824 1.00 13.52 H new ATOM 0 HD11 LEU B 46 9.703 1.708 -1.163 1.00 41.32 H new ATOM 0 HD12 LEU B 46 8.168 2.597 -1.304 1.00 41.32 H new ATOM 0 HD13 LEU B 46 9.669 3.470 -0.917 1.00 41.32 H new ATOM 0 HD21 LEU B 46 10.746 1.328 1.069 1.00 61.03 H new ATOM 0 HD22 LEU B 46 10.755 3.064 1.462 1.00 61.03 H new ATOM 0 HD23 LEU B 46 9.952 1.909 2.552 1.00 61.03 H new ATOM 1995 N ALA B 47 5.823 4.881 3.330 1.00 61.20 N ATOM 1996 CA ALA B 47 5.121 6.007 3.994 1.00 51.55 C ATOM 1997 C ALA B 47 5.185 5.859 5.538 1.00 64.03 C ATOM 1998 O ALA B 47 5.268 6.855 6.268 1.00 41.11 O ATOM 1999 CB ALA B 47 3.663 6.091 3.500 1.00 52.52 C ATOM 0 H ALA B 47 5.208 4.278 2.784 1.00 61.20 H new ATOM 0 HA ALA B 47 5.623 6.938 3.730 1.00 51.55 H new ATOM 0 HB1 ALA B 47 3.159 6.921 3.995 1.00 52.52 H new ATOM 0 HB2 ALA B 47 3.653 6.251 2.422 1.00 52.52 H new ATOM 0 HB3 ALA B 47 3.145 5.161 3.734 1.00 52.52 H new ATOM 2005 N ARG B 48 5.176 4.595 6.010 1.00 22.13 N ATOM 2006 CA ARG B 48 5.372 4.235 7.435 1.00 42.25 C ATOM 2007 C ARG B 48 6.744 4.730 7.963 1.00 50.24 C ATOM 2008 O ARG B 48 6.835 5.301 9.054 1.00 4.30 O ATOM 2009 CB ARG B 48 5.206 2.680 7.579 1.00 1.31 C ATOM 2010 CG ARG B 48 5.666 2.025 8.918 1.00 44.00 C ATOM 2011 CD ARG B 48 7.105 1.489 8.902 1.00 65.53 C ATOM 2012 NE ARG B 48 7.496 0.955 10.209 1.00 33.52 N ATOM 2013 CZ ARG B 48 8.611 0.313 10.480 1.00 32.21 C ATOM 2014 NH1 ARG B 48 9.480 0.028 9.549 1.00 43.41 N ATOM 2015 NH2 ARG B 48 8.827 -0.058 11.692 1.00 13.24 N ATOM 0 H ARG B 48 5.031 3.785 5.408 1.00 22.13 H new ATOM 0 HA ARG B 48 4.621 4.732 8.049 1.00 42.25 H new ATOM 0 HB2 ARG B 48 4.153 2.440 7.432 1.00 1.31 H new ATOM 0 HB3 ARG B 48 5.758 2.207 6.767 1.00 1.31 H new ATOM 0 HG2 ARG B 48 5.574 2.760 9.718 1.00 44.00 H new ATOM 0 HG3 ARG B 48 4.989 1.205 9.159 1.00 44.00 H new ATOM 0 HD2 ARG B 48 7.194 0.707 8.147 1.00 65.53 H new ATOM 0 HD3 ARG B 48 7.788 2.288 8.616 1.00 65.53 H new ATOM 0 HE ARG B 48 6.843 1.094 10.980 1.00 33.52 H new ATOM 0 HH11 ARG B 48 9.302 0.304 8.583 1.00 43.41 H new ATOM 0 HH12 ARG B 48 10.337 -0.471 9.787 1.00 43.41 H new ATOM 0 HH21 ARG B 48 8.141 0.147 12.418 1.00 13.24 H new ATOM 0 HH22 ARG B 48 9.685 -0.558 11.927 1.00 13.24 H new ATOM 2029 N GLU B 49 7.802 4.506 7.166 1.00 1.14 N ATOM 2030 CA GLU B 49 9.182 4.959 7.488 1.00 34.12 C ATOM 2031 C GLU B 49 9.443 6.428 7.052 1.00 2.31 C ATOM 2032 O GLU B 49 10.559 6.936 7.219 1.00 20.34 O ATOM 2033 CB GLU B 49 10.195 4.004 6.821 1.00 25.40 C ATOM 2034 CG GLU B 49 10.072 2.537 7.271 1.00 13.43 C ATOM 2035 CD GLU B 49 10.967 1.577 6.477 1.00 13.55 C ATOM 2036 OE1 GLU B 49 12.157 1.436 6.828 1.00 52.55 O ATOM 2037 OE2 GLU B 49 10.482 0.954 5.511 1.00 60.30 O ATOM 0 H GLU B 49 7.734 4.007 6.279 1.00 1.14 H new ATOM 0 HA GLU B 49 9.303 4.933 8.571 1.00 34.12 H new ATOM 0 HB2 GLU B 49 10.065 4.052 5.740 1.00 25.40 H new ATOM 0 HB3 GLU B 49 11.204 4.355 7.037 1.00 25.40 H new ATOM 0 HG2 GLU B 49 10.326 2.467 8.329 1.00 13.43 H new ATOM 0 HG3 GLU B 49 9.034 2.220 7.171 1.00 13.43 H new ATOM 2044 N ASN B 50 8.391 7.088 6.502 1.00 2.23 N ATOM 2045 CA ASN B 50 8.386 8.533 6.121 1.00 14.44 C ATOM 2046 C ASN B 50 9.420 8.867 4.995 1.00 13.54 C ATOM 2047 O ASN B 50 9.815 10.026 4.823 1.00 40.40 O ATOM 2048 CB ASN B 50 8.625 9.433 7.378 1.00 41.40 C ATOM 2049 CG ASN B 50 7.697 9.100 8.556 1.00 62.40 C ATOM 2050 OD1 ASN B 50 6.599 9.620 8.665 1.00 24.23 O ATOM 2051 ND2 ASN B 50 8.136 8.229 9.450 1.00 42.40 N ATOM 0 H ASN B 50 7.503 6.626 6.305 1.00 2.23 H new ATOM 0 HA ASN B 50 7.399 8.748 5.712 1.00 14.44 H new ATOM 0 HB2 ASN B 50 9.661 9.326 7.700 1.00 41.40 H new ATOM 0 HB3 ASN B 50 8.485 10.477 7.099 1.00 41.40 H new ATOM 0 HD21 ASN B 50 7.553 7.981 10.249 1.00 42.40 H new ATOM 0 HD22 ASN B 50 9.057 7.806 9.340 1.00 42.40 H new ATOM 2058 N LYS B 51 9.813 7.840 4.212 1.00 21.21 N ATOM 2059 CA LYS B 51 10.903 7.943 3.202 1.00 41.51 C ATOM 2060 C LYS B 51 10.394 8.072 1.734 1.00 4.30 C ATOM 2061 O LYS B 51 11.200 8.042 0.796 1.00 42.54 O ATOM 2062 CB LYS B 51 11.859 6.726 3.377 1.00 40.32 C ATOM 2063 CG LYS B 51 11.175 5.342 3.267 1.00 13.23 C ATOM 2064 CD LYS B 51 12.038 4.180 3.824 1.00 45.20 C ATOM 2065 CE LYS B 51 13.321 3.916 3.029 1.00 14.30 C ATOM 2066 NZ LYS B 51 14.054 2.731 3.536 1.00 21.21 N ATOM 0 H LYS B 51 9.388 6.914 4.257 1.00 21.21 H new ATOM 0 HA LYS B 51 11.441 8.873 3.385 1.00 41.51 H new ATOM 0 HB2 LYS B 51 12.645 6.788 2.624 1.00 40.32 H new ATOM 0 HB3 LYS B 51 12.344 6.800 4.351 1.00 40.32 H new ATOM 0 HG2 LYS B 51 10.227 5.370 3.804 1.00 13.23 H new ATOM 0 HG3 LYS B 51 10.943 5.142 2.221 1.00 13.23 H new ATOM 0 HD2 LYS B 51 12.303 4.402 4.858 1.00 45.20 H new ATOM 0 HD3 LYS B 51 11.438 3.270 3.837 1.00 45.20 H new ATOM 0 HE2 LYS B 51 13.072 3.766 1.978 1.00 14.30 H new ATOM 0 HE3 LYS B 51 13.967 4.792 3.082 1.00 14.30 H new ATOM 0 HZ1 LYS B 51 14.915 2.588 2.971 1.00 21.21 H new ATOM 0 HZ2 LYS B 51 14.314 2.883 4.531 1.00 21.21 H new ATOM 0 HZ3 LYS B 51 13.447 1.890 3.462 1.00 21.21 H new ATOM 2080 N VAL B 52 9.069 8.243 1.531 1.00 53.12 N ATOM 2081 CA VAL B 52 8.483 8.568 0.194 1.00 60.11 C ATOM 2082 C VAL B 52 7.490 9.743 0.294 1.00 71.43 C ATOM 2083 O VAL B 52 6.857 9.955 1.337 1.00 70.14 O ATOM 2084 CB VAL B 52 7.751 7.349 -0.500 1.00 41.10 C ATOM 2085 CG1 VAL B 52 8.750 6.240 -0.897 1.00 14.45 C ATOM 2086 CG2 VAL B 52 6.606 6.786 0.387 1.00 2.31 C ATOM 0 H VAL B 52 8.375 8.163 2.274 1.00 53.12 H new ATOM 0 HA VAL B 52 9.337 8.837 -0.427 1.00 60.11 H new ATOM 0 HB VAL B 52 7.297 7.726 -1.416 1.00 41.10 H new ATOM 0 HG11 VAL B 52 8.212 5.419 -1.371 1.00 14.45 H new ATOM 0 HG12 VAL B 52 9.484 6.644 -1.595 1.00 14.45 H new ATOM 0 HG13 VAL B 52 9.260 5.874 -0.006 1.00 14.45 H new ATOM 0 HG21 VAL B 52 6.127 5.950 -0.124 1.00 2.31 H new ATOM 0 HG22 VAL B 52 7.016 6.444 1.337 1.00 2.31 H new ATOM 0 HG23 VAL B 52 5.870 7.569 0.571 1.00 2.31 H new ATOM 2096 N VAL B 53 7.366 10.502 -0.809 1.00 74.35 N ATOM 2097 CA VAL B 53 6.404 11.615 -0.928 1.00 52.33 C ATOM 2098 C VAL B 53 5.220 11.182 -1.836 1.00 40.14 C ATOM 2099 O VAL B 53 5.370 11.100 -3.068 1.00 33.51 O ATOM 2100 CB VAL B 53 7.096 12.917 -1.502 1.00 51.12 C ATOM 2101 CG1 VAL B 53 6.127 14.130 -1.496 1.00 13.21 C ATOM 2102 CG2 VAL B 53 8.400 13.243 -0.727 1.00 54.31 C ATOM 0 H VAL B 53 7.931 10.361 -1.646 1.00 74.35 H new ATOM 0 HA VAL B 53 6.029 11.856 0.067 1.00 52.33 H new ATOM 0 HB VAL B 53 7.361 12.715 -2.540 1.00 51.12 H new ATOM 0 HG11 VAL B 53 6.638 15.006 -1.897 1.00 13.21 H new ATOM 0 HG12 VAL B 53 5.257 13.904 -2.112 1.00 13.21 H new ATOM 0 HG13 VAL B 53 5.805 14.334 -0.475 1.00 13.21 H new ATOM 0 HG21 VAL B 53 8.855 14.142 -1.142 1.00 54.31 H new ATOM 0 HG22 VAL B 53 8.167 13.407 0.325 1.00 54.31 H new ATOM 0 HG23 VAL B 53 9.096 12.409 -0.819 1.00 54.31 H new ATOM 2112 N ILE B 54 4.062 10.844 -1.217 1.00 32.14 N ATOM 2113 CA ILE B 54 2.847 10.407 -1.955 1.00 43.12 C ATOM 2114 C ILE B 54 2.122 11.633 -2.571 1.00 12.40 C ATOM 2115 O ILE B 54 1.620 12.506 -1.841 1.00 23.45 O ATOM 2116 CB ILE B 54 1.832 9.618 -1.028 1.00 41.42 C ATOM 2117 CG1 ILE B 54 2.545 8.469 -0.234 1.00 14.34 C ATOM 2118 CG2 ILE B 54 0.625 9.066 -1.837 1.00 33.53 C ATOM 2119 CD1 ILE B 54 3.116 7.347 -1.080 1.00 41.04 C ATOM 0 H ILE B 54 3.942 10.865 -0.204 1.00 32.14 H new ATOM 0 HA ILE B 54 3.182 9.732 -2.743 1.00 43.12 H new ATOM 0 HB ILE B 54 1.446 10.333 -0.302 1.00 41.42 H new ATOM 0 HG12 ILE B 54 3.353 8.905 0.354 1.00 14.34 H new ATOM 0 HG13 ILE B 54 1.832 8.042 0.471 1.00 14.34 H new ATOM 0 HG21 ILE B 54 -0.048 8.531 -1.167 1.00 33.53 H new ATOM 0 HG22 ILE B 54 0.091 9.894 -2.304 1.00 33.53 H new ATOM 0 HG23 ILE B 54 0.985 8.385 -2.609 1.00 33.53 H new ATOM 0 HD11 ILE B 54 3.586 6.606 -0.433 1.00 41.04 H new ATOM 0 HD12 ILE B 54 2.314 6.876 -1.648 1.00 41.04 H new ATOM 0 HD13 ILE B 54 3.859 7.752 -1.768 1.00 41.04 H new ATOM 2131 N GLU B 55 2.084 11.694 -3.915 1.00 60.53 N ATOM 2132 CA GLU B 55 1.462 12.805 -4.675 1.00 43.51 C ATOM 2133 C GLU B 55 0.400 12.293 -5.678 1.00 15.42 C ATOM 2134 O GLU B 55 0.426 11.132 -6.091 1.00 64.43 O ATOM 2135 CB GLU B 55 2.562 13.592 -5.435 1.00 2.52 C ATOM 2136 CG GLU B 55 3.537 14.390 -4.538 1.00 41.14 C ATOM 2137 CD GLU B 55 2.890 15.562 -3.776 1.00 52.32 C ATOM 2138 OE1 GLU B 55 1.976 16.226 -4.326 1.00 1.45 O ATOM 2139 OE2 GLU B 55 3.300 15.838 -2.636 1.00 54.30 O ATOM 0 H GLU B 55 2.485 10.971 -4.512 1.00 60.53 H new ATOM 0 HA GLU B 55 0.958 13.458 -3.962 1.00 43.51 H new ATOM 0 HB2 GLU B 55 3.139 12.890 -6.037 1.00 2.52 H new ATOM 0 HB3 GLU B 55 2.080 14.284 -6.126 1.00 2.52 H new ATOM 0 HG2 GLU B 55 3.987 13.708 -3.816 1.00 41.14 H new ATOM 0 HG3 GLU B 55 4.346 14.778 -5.157 1.00 41.14 H new ATOM 2146 N ARG B 56 -0.544 13.178 -6.049 1.00 52.40 N ATOM 2147 CA ARG B 56 -1.568 12.910 -7.086 1.00 41.31 C ATOM 2148 C ARG B 56 -1.424 13.894 -8.269 1.00 53.25 C ATOM 2149 O ARG B 56 -1.730 15.081 -8.126 1.00 65.23 O ATOM 2150 CB ARG B 56 -2.996 13.027 -6.479 1.00 61.11 C ATOM 2151 CG ARG B 56 -3.347 11.961 -5.415 1.00 31.14 C ATOM 2152 CD ARG B 56 -4.771 12.160 -4.849 1.00 41.13 C ATOM 2153 NE ARG B 56 -5.203 11.046 -3.984 1.00 43.04 N ATOM 2154 CZ ARG B 56 -5.930 10.012 -4.369 1.00 1.45 C ATOM 2155 NH1 ARG B 56 -6.272 9.856 -5.614 1.00 73.01 N ATOM 2156 NH2 ARG B 56 -6.309 9.140 -3.500 1.00 20.53 N ATOM 0 H ARG B 56 -0.621 14.108 -5.636 1.00 52.40 H new ATOM 0 HA ARG B 56 -1.416 11.896 -7.455 1.00 41.31 H new ATOM 0 HB2 ARG B 56 -3.103 14.015 -6.030 1.00 61.11 H new ATOM 0 HB3 ARG B 56 -3.724 12.964 -7.288 1.00 61.11 H new ATOM 0 HG2 ARG B 56 -3.267 10.967 -5.856 1.00 31.14 H new ATOM 0 HG3 ARG B 56 -2.623 12.008 -4.602 1.00 31.14 H new ATOM 0 HD2 ARG B 56 -4.805 13.089 -4.281 1.00 41.13 H new ATOM 0 HD3 ARG B 56 -5.474 12.266 -5.675 1.00 41.13 H new ATOM 0 HE ARG B 56 -4.916 11.076 -3.006 1.00 43.04 H new ATOM 0 HH11 ARG B 56 -5.979 10.539 -6.313 1.00 73.01 H new ATOM 0 HH12 ARG B 56 -6.834 9.051 -5.892 1.00 73.01 H new ATOM 0 HH21 ARG B 56 -6.048 9.250 -2.520 1.00 20.53 H new ATOM 0 HH22 ARG B 56 -6.870 8.340 -3.792 1.00 20.53 H new ATOM 2170 N LYS B 57 -0.934 13.414 -9.428 1.00 0.12 N ATOM 2171 CA LYS B 57 -0.915 14.204 -10.690 1.00 53.42 C ATOM 2172 C LYS B 57 -1.755 13.494 -11.774 1.00 23.21 C ATOM 2173 O LYS B 57 -1.578 12.295 -12.004 1.00 33.34 O ATOM 2174 CB LYS B 57 0.534 14.451 -11.217 1.00 14.04 C ATOM 2175 CG LYS B 57 1.374 15.465 -10.397 1.00 33.34 C ATOM 2176 CD LYS B 57 1.999 14.869 -9.112 1.00 12.31 C ATOM 2177 CE LYS B 57 2.750 15.925 -8.283 1.00 71.31 C ATOM 2178 NZ LYS B 57 1.836 16.968 -7.750 1.00 34.10 N ATOM 0 H LYS B 57 -0.542 12.477 -9.524 1.00 0.12 H new ATOM 0 HA LYS B 57 -1.350 15.178 -10.465 1.00 53.42 H new ATOM 0 HB2 LYS B 57 1.063 13.498 -11.237 1.00 14.04 H new ATOM 0 HB3 LYS B 57 0.473 14.803 -12.247 1.00 14.04 H new ATOM 0 HG2 LYS B 57 2.171 15.856 -11.029 1.00 33.34 H new ATOM 0 HG3 LYS B 57 0.741 16.309 -10.123 1.00 33.34 H new ATOM 0 HD2 LYS B 57 1.214 14.423 -8.502 1.00 12.31 H new ATOM 0 HD3 LYS B 57 2.686 14.067 -9.383 1.00 12.31 H new ATOM 0 HE2 LYS B 57 3.265 15.437 -7.455 1.00 71.31 H new ATOM 0 HE3 LYS B 57 3.515 16.395 -8.902 1.00 71.31 H new ATOM 0 HZ1 LYS B 57 2.342 17.549 -7.051 1.00 34.10 H new ATOM 0 HZ2 LYS B 57 1.507 17.573 -8.530 1.00 34.10 H new ATOM 0 HZ3 LYS B 57 1.018 16.514 -7.295 1.00 34.10 H new ATOM 2192 N ASN B 58 -2.672 14.257 -12.416 1.00 52.42 N ATOM 2193 CA ASN B 58 -3.575 13.764 -13.497 1.00 63.45 C ATOM 2194 C ASN B 58 -4.543 12.648 -12.991 1.00 45.22 C ATOM 2195 O ASN B 58 -4.979 11.781 -13.762 1.00 2.44 O ATOM 2196 CB ASN B 58 -2.740 13.271 -14.720 1.00 73.53 C ATOM 2197 CG ASN B 58 -1.812 14.342 -15.303 1.00 63.55 C ATOM 2198 OD1 ASN B 58 -2.110 15.534 -15.276 1.00 14.12 O ATOM 2199 ND2 ASN B 58 -0.675 13.931 -15.832 1.00 53.20 N ATOM 0 H ASN B 58 -2.811 15.244 -12.199 1.00 52.42 H new ATOM 0 HA ASN B 58 -4.197 14.601 -13.814 1.00 63.45 H new ATOM 0 HB2 ASN B 58 -2.143 12.410 -14.418 1.00 73.53 H new ATOM 0 HB3 ASN B 58 -3.421 12.929 -15.500 1.00 73.53 H new ATOM 0 HD21 ASN B 58 -0.023 14.608 -16.229 1.00 53.20 H new ATOM 0 HD22 ASN B 58 -0.448 12.937 -15.844 1.00 53.20 H new ATOM 2206 N GLY B 59 -4.905 12.723 -11.691 1.00 73.24 N ATOM 2207 CA GLY B 59 -5.753 11.710 -11.029 1.00 31.25 C ATOM 2208 C GLY B 59 -5.016 10.389 -10.737 1.00 23.25 C ATOM 2209 O GLY B 59 -5.635 9.379 -10.388 1.00 15.35 O ATOM 0 H GLY B 59 -4.619 13.484 -11.075 1.00 73.24 H new ATOM 0 HA2 GLY B 59 -6.132 12.120 -10.093 1.00 31.25 H new ATOM 0 HA3 GLY B 59 -6.618 11.503 -11.660 1.00 31.25 H new ATOM 2213 N LEU B 60 -3.681 10.418 -10.860 1.00 62.24 N ATOM 2214 CA LEU B 60 -2.815 9.226 -10.779 1.00 11.25 C ATOM 2215 C LEU B 60 -1.765 9.399 -9.659 1.00 61.12 C ATOM 2216 O LEU B 60 -1.176 10.476 -9.517 1.00 71.10 O ATOM 2217 CB LEU B 60 -2.136 9.029 -12.162 1.00 33.43 C ATOM 2218 CG LEU B 60 -1.260 7.758 -12.349 1.00 64.20 C ATOM 2219 CD1 LEU B 60 -2.080 6.466 -12.115 1.00 50.13 C ATOM 2220 CD2 LEU B 60 -0.590 7.759 -13.749 1.00 11.01 C ATOM 0 H LEU B 60 -3.162 11.281 -11.021 1.00 62.24 H new ATOM 0 HA LEU B 60 -3.405 8.343 -10.534 1.00 11.25 H new ATOM 0 HB2 LEU B 60 -2.917 9.016 -12.923 1.00 33.43 H new ATOM 0 HB3 LEU B 60 -1.513 9.901 -12.360 1.00 33.43 H new ATOM 0 HG LEU B 60 -0.471 7.778 -11.597 1.00 64.20 H new ATOM 0 HD11 LEU B 60 -1.437 5.597 -12.254 1.00 50.13 H new ATOM 0 HD12 LEU B 60 -2.477 6.466 -11.100 1.00 50.13 H new ATOM 0 HD13 LEU B 60 -2.905 6.425 -12.827 1.00 50.13 H new ATOM 0 HD21 LEU B 60 0.019 6.862 -13.862 1.00 11.01 H new ATOM 0 HD22 LEU B 60 -1.360 7.774 -14.521 1.00 11.01 H new ATOM 0 HD23 LEU B 60 0.042 8.641 -13.849 1.00 11.01 H new ATOM 2232 N ILE B 61 -1.549 8.334 -8.864 1.00 21.40 N ATOM 2233 CA ILE B 61 -0.615 8.360 -7.720 1.00 41.34 C ATOM 2234 C ILE B 61 0.845 8.172 -8.214 1.00 75.03 C ATOM 2235 O ILE B 61 1.166 7.179 -8.879 1.00 41.10 O ATOM 2236 CB ILE B 61 -0.964 7.263 -6.617 1.00 73.32 C ATOM 2237 CG1 ILE B 61 -2.411 7.460 -6.012 1.00 11.13 C ATOM 2238 CG2 ILE B 61 0.101 7.262 -5.481 1.00 13.14 C ATOM 2239 CD1 ILE B 61 -3.572 7.029 -6.903 1.00 64.25 C ATOM 0 H ILE B 61 -2.014 7.435 -8.995 1.00 21.40 H new ATOM 0 HA ILE B 61 -0.720 9.336 -7.247 1.00 41.34 H new ATOM 0 HB ILE B 61 -0.949 6.295 -7.118 1.00 73.32 H new ATOM 0 HG12 ILE B 61 -2.471 6.904 -5.076 1.00 11.13 H new ATOM 0 HG13 ILE B 61 -2.540 8.514 -5.765 1.00 11.13 H new ATOM 0 HG21 ILE B 61 -0.158 6.506 -4.740 1.00 13.14 H new ATOM 0 HG22 ILE B 61 1.081 7.037 -5.901 1.00 13.14 H new ATOM 0 HG23 ILE B 61 0.126 8.242 -5.005 1.00 13.14 H new ATOM 0 HD11 ILE B 61 -4.514 7.210 -6.386 1.00 64.25 H new ATOM 0 HD12 ILE B 61 -3.551 7.602 -7.830 1.00 64.25 H new ATOM 0 HD13 ILE B 61 -3.481 5.967 -7.131 1.00 64.25 H new ATOM 2251 N GLU B 62 1.716 9.152 -7.896 1.00 1.01 N ATOM 2252 CA GLU B 62 3.155 9.138 -8.252 1.00 31.22 C ATOM 2253 C GLU B 62 4.019 9.317 -6.977 1.00 61.14 C ATOM 2254 O GLU B 62 3.748 10.201 -6.154 1.00 41.20 O ATOM 2255 CB GLU B 62 3.471 10.262 -9.283 1.00 65.24 C ATOM 2256 CG GLU B 62 2.641 10.206 -10.591 1.00 12.43 C ATOM 2257 CD GLU B 62 3.107 11.224 -11.658 1.00 12.45 C ATOM 2258 OE1 GLU B 62 3.347 12.401 -11.309 1.00 74.52 O ATOM 2259 OE2 GLU B 62 3.263 10.845 -12.848 1.00 10.43 O ATOM 0 H GLU B 62 1.439 9.986 -7.379 1.00 1.01 H new ATOM 0 HA GLU B 62 3.394 8.177 -8.707 1.00 31.22 H new ATOM 0 HB2 GLU B 62 3.305 11.228 -8.806 1.00 65.24 H new ATOM 0 HB3 GLU B 62 4.529 10.211 -9.540 1.00 65.24 H new ATOM 0 HG2 GLU B 62 2.701 9.201 -11.008 1.00 12.43 H new ATOM 0 HG3 GLU B 62 1.593 10.391 -10.356 1.00 12.43 H new ATOM 2266 N ILE B 63 5.052 8.464 -6.812 1.00 12.51 N ATOM 2267 CA ILE B 63 5.967 8.502 -5.640 1.00 70.30 C ATOM 2268 C ILE B 63 7.300 9.217 -5.970 1.00 24.02 C ATOM 2269 O ILE B 63 7.966 8.886 -6.945 1.00 74.43 O ATOM 2270 CB ILE B 63 6.224 7.050 -5.022 1.00 0.04 C ATOM 2271 CG1 ILE B 63 6.287 5.898 -6.103 1.00 54.13 C ATOM 2272 CG2 ILE B 63 5.156 6.725 -3.957 1.00 35.33 C ATOM 2273 CD1 ILE B 63 7.557 5.822 -6.937 1.00 73.14 C ATOM 0 H ILE B 63 5.279 7.730 -7.483 1.00 12.51 H new ATOM 0 HA ILE B 63 5.461 9.090 -4.874 1.00 70.30 H new ATOM 0 HB ILE B 63 7.211 7.088 -4.561 1.00 0.04 H new ATOM 0 HG12 ILE B 63 6.155 4.944 -5.593 1.00 54.13 H new ATOM 0 HG13 ILE B 63 5.441 6.018 -6.779 1.00 54.13 H new ATOM 0 HG21 ILE B 63 5.343 5.734 -3.545 1.00 35.33 H new ATOM 0 HG22 ILE B 63 5.202 7.465 -3.158 1.00 35.33 H new ATOM 0 HG23 ILE B 63 4.167 6.747 -4.415 1.00 35.33 H new ATOM 0 HD11 ILE B 63 7.481 4.994 -7.641 1.00 73.14 H new ATOM 0 HD12 ILE B 63 7.688 6.754 -7.486 1.00 73.14 H new ATOM 0 HD13 ILE B 63 8.414 5.664 -6.282 1.00 73.14 H new ATOM 2285 N TYR B 64 7.663 10.225 -5.158 1.00 45.43 N ATOM 2286 CA TYR B 64 8.950 10.953 -5.291 1.00 40.34 C ATOM 2287 C TYR B 64 9.916 10.597 -4.140 1.00 11.50 C ATOM 2288 O TYR B 64 9.518 9.993 -3.134 1.00 33.43 O ATOM 2289 CB TYR B 64 8.698 12.487 -5.324 1.00 42.33 C ATOM 2290 CG TYR B 64 7.823 12.954 -6.497 1.00 53.11 C ATOM 2291 CD1 TYR B 64 8.215 12.739 -7.822 1.00 61.53 C ATOM 2292 CD2 TYR B 64 6.609 13.608 -6.286 1.00 12.10 C ATOM 2293 CE1 TYR B 64 7.429 13.161 -8.881 1.00 11.24 C ATOM 2294 CE2 TYR B 64 5.824 14.028 -7.343 1.00 3.50 C ATOM 2295 CZ TYR B 64 6.234 13.801 -8.637 1.00 1.51 C ATOM 2296 OH TYR B 64 5.444 14.224 -9.688 1.00 2.22 O ATOM 0 H TYR B 64 7.080 10.562 -4.392 1.00 45.43 H new ATOM 0 HA TYR B 64 9.415 10.647 -6.228 1.00 40.34 H new ATOM 0 HB2 TYR B 64 8.224 12.787 -4.389 1.00 42.33 H new ATOM 0 HB3 TYR B 64 9.658 13.001 -5.374 1.00 42.33 H new ATOM 0 HD1 TYR B 64 9.148 12.234 -8.023 1.00 61.53 H new ATOM 0 HD2 TYR B 64 6.275 13.790 -5.275 1.00 12.10 H new ATOM 0 HE1 TYR B 64 7.753 12.989 -9.897 1.00 11.24 H new ATOM 0 HE2 TYR B 64 4.889 14.534 -7.154 1.00 3.50 H new ATOM 0 HH TYR B 64 4.907 13.473 -10.017 1.00 2.22 H new ATOM 2306 N ASN B 65 11.198 10.975 -4.314 1.00 72.52 N ATOM 2307 CA ASN B 65 12.252 10.791 -3.293 1.00 15.44 C ATOM 2308 C ASN B 65 12.002 11.686 -2.052 1.00 72.34 C ATOM 2309 O ASN B 65 11.564 12.842 -2.183 1.00 62.33 O ATOM 2310 CB ASN B 65 13.634 11.123 -3.906 1.00 3.14 C ATOM 2311 CG ASN B 65 13.996 10.220 -5.082 1.00 52.05 C ATOM 2312 OD1 ASN B 65 13.634 10.488 -6.218 1.00 2.43 O ATOM 2313 ND2 ASN B 65 14.738 9.160 -4.827 1.00 65.32 N ATOM 0 H ASN B 65 11.534 11.418 -5.169 1.00 72.52 H new ATOM 0 HA ASN B 65 12.231 9.751 -2.968 1.00 15.44 H new ATOM 0 HB2 ASN B 65 13.639 12.161 -4.237 1.00 3.14 H new ATOM 0 HB3 ASN B 65 14.399 11.031 -3.135 1.00 3.14 H new ATOM 0 HD21 ASN B 65 15.023 8.542 -5.587 1.00 65.32 H new ATOM 0 HD22 ASN B 65 15.027 8.958 -3.870 1.00 65.32 H new ATOM 2320 N GLU B 66 12.288 11.133 -0.858 1.00 72.44 N ATOM 2321 CA GLU B 66 12.148 11.827 0.447 1.00 4.22 C ATOM 2322 C GLU B 66 12.775 13.248 0.492 1.00 23.45 C ATOM 2323 O GLU B 66 12.160 14.160 1.020 1.00 32.42 O ATOM 2324 CB GLU B 66 12.783 10.948 1.561 1.00 42.22 C ATOM 2325 CG GLU B 66 14.249 10.534 1.295 1.00 11.04 C ATOM 2326 CD GLU B 66 14.904 9.812 2.478 1.00 64.13 C ATOM 2327 OE1 GLU B 66 14.667 8.604 2.647 1.00 12.24 O ATOM 2328 OE2 GLU B 66 15.667 10.454 3.233 1.00 52.54 O ATOM 0 H GLU B 66 12.629 10.176 -0.766 1.00 72.44 H new ATOM 0 HA GLU B 66 11.079 11.967 0.604 1.00 4.22 H new ATOM 0 HB2 GLU B 66 12.738 11.492 2.505 1.00 42.22 H new ATOM 0 HB3 GLU B 66 12.181 10.048 1.683 1.00 42.22 H new ATOM 0 HG2 GLU B 66 14.282 9.885 0.420 1.00 11.04 H new ATOM 0 HG3 GLU B 66 14.832 11.423 1.054 1.00 11.04 H new ATOM 2335 N GLY B 67 13.956 13.418 -0.137 1.00 3.14 N ATOM 2336 CA GLY B 67 14.822 14.608 0.048 1.00 43.04 C ATOM 2337 C GLY B 67 14.188 15.994 -0.198 1.00 12.32 C ATOM 2338 O GLY B 67 14.763 17.003 0.212 1.00 53.05 O ATOM 0 H GLY B 67 14.340 12.734 -0.790 1.00 3.14 H new ATOM 0 HA2 GLY B 67 15.206 14.590 1.068 1.00 43.04 H new ATOM 0 HA3 GLY B 67 15.679 14.507 -0.617 1.00 43.04 H new ATOM 2342 N HIS B 68 13.024 16.053 -0.874 1.00 31.21 N ATOM 2343 CA HIS B 68 12.291 17.324 -1.099 1.00 50.04 C ATOM 2344 C HIS B 68 11.119 17.511 -0.081 1.00 60.23 C ATOM 2345 O HIS B 68 10.864 18.631 0.360 1.00 21.42 O ATOM 2346 CB HIS B 68 11.770 17.394 -2.557 1.00 15.44 C ATOM 2347 CG HIS B 68 11.169 18.730 -2.927 1.00 63.43 C ATOM 2348 ND1 HIS B 68 11.911 19.886 -3.019 1.00 40.12 N ATOM 2349 CD2 HIS B 68 9.899 19.089 -3.210 1.00 74.34 C ATOM 2350 CE1 HIS B 68 11.125 20.892 -3.336 1.00 4.21 C ATOM 2351 NE2 HIS B 68 9.899 20.437 -3.459 1.00 14.23 N ATOM 0 H HIS B 68 12.566 15.235 -1.277 1.00 31.21 H new ATOM 0 HA HIS B 68 12.992 18.143 -0.936 1.00 50.04 H new ATOM 0 HB2 HIS B 68 12.593 17.175 -3.238 1.00 15.44 H new ATOM 0 HB3 HIS B 68 11.020 16.616 -2.703 1.00 15.44 H new ATOM 0 HD2 HIS B 68 9.040 18.434 -3.236 1.00 74.34 H new ATOM 0 HE1 HIS B 68 11.435 21.918 -3.472 1.00 4.21 H new ATOM 0 HE2 HIS B 68 9.080 20.996 -3.700 1.00 14.23 H new ATOM 2360 N PHE B 69 10.416 16.402 0.274 1.00 62.24 N ATOM 2361 CA PHE B 69 9.235 16.418 1.200 1.00 14.51 C ATOM 2362 C PHE B 69 8.150 17.456 0.776 1.00 41.45 C ATOM 2363 O PHE B 69 7.564 18.131 1.630 1.00 72.02 O ATOM 2364 CB PHE B 69 9.685 16.654 2.677 1.00 54.24 C ATOM 2365 CG PHE B 69 10.494 15.508 3.281 1.00 44.44 C ATOM 2366 CD1 PHE B 69 9.926 14.241 3.433 1.00 4.42 C ATOM 2367 CD2 PHE B 69 11.816 15.688 3.701 1.00 41.31 C ATOM 2368 CE1 PHE B 69 10.650 13.195 3.981 1.00 73.20 C ATOM 2369 CE2 PHE B 69 12.540 14.639 4.250 1.00 35.34 C ATOM 2370 CZ PHE B 69 11.956 13.394 4.388 1.00 73.23 C ATOM 0 H PHE B 69 10.646 15.470 -0.070 1.00 62.24 H new ATOM 0 HA PHE B 69 8.771 15.434 1.131 1.00 14.51 H new ATOM 0 HB2 PHE B 69 10.281 17.566 2.721 1.00 54.24 H new ATOM 0 HB3 PHE B 69 8.800 16.821 3.291 1.00 54.24 H new ATOM 0 HD1 PHE B 69 8.906 14.074 3.118 1.00 4.42 H new ATOM 0 HD2 PHE B 69 12.280 16.658 3.597 1.00 41.31 H new ATOM 0 HE1 PHE B 69 10.193 12.222 4.090 1.00 73.20 H new ATOM 0 HE2 PHE B 69 13.560 14.796 4.569 1.00 35.34 H new ATOM 0 HZ PHE B 69 12.520 12.577 4.814 1.00 73.23 H new ATOM 2380 N ASP B 70 7.891 17.544 -0.557 1.00 0.52 N ATOM 2381 CA ASP B 70 6.977 18.544 -1.214 1.00 13.34 C ATOM 2382 C ASP B 70 7.124 20.017 -0.690 1.00 22.11 C ATOM 2383 O ASP B 70 6.231 20.853 -0.887 1.00 21.23 O ATOM 2384 CB ASP B 70 5.488 18.060 -1.206 1.00 51.11 C ATOM 2385 CG ASP B 70 4.812 18.017 0.179 1.00 72.14 C ATOM 2386 OD1 ASP B 70 4.933 16.996 0.885 1.00 44.35 O ATOM 2387 OD2 ASP B 70 4.145 19.002 0.567 1.00 23.05 O ATOM 0 H ASP B 70 8.319 16.908 -1.230 1.00 0.52 H new ATOM 0 HA ASP B 70 7.312 18.591 -2.250 1.00 13.34 H new ATOM 0 HB2 ASP B 70 4.907 18.716 -1.854 1.00 51.11 H new ATOM 0 HB3 ASP B 70 5.446 17.062 -1.643 1.00 51.11 H new ATOM 2392 N PHE B 71 8.299 20.334 -0.100 1.00 74.14 N ATOM 2393 CA PHE B 71 8.596 21.655 0.507 1.00 74.23 C ATOM 2394 C PHE B 71 10.107 21.971 0.387 1.00 23.23 C ATOM 2395 O PHE B 71 10.938 21.290 0.991 1.00 53.41 O ATOM 2396 CB PHE B 71 8.149 21.673 2.001 1.00 55.43 C ATOM 2397 CG PHE B 71 8.426 22.992 2.731 1.00 45.23 C ATOM 2398 CD1 PHE B 71 7.620 24.115 2.516 1.00 31.00 C ATOM 2399 CD2 PHE B 71 9.497 23.119 3.624 1.00 64.13 C ATOM 2400 CE1 PHE B 71 7.875 25.310 3.166 1.00 23.43 C ATOM 2401 CE2 PHE B 71 9.749 24.316 4.271 1.00 54.31 C ATOM 2402 CZ PHE B 71 8.939 25.410 4.042 1.00 32.13 C ATOM 0 H PHE B 71 9.075 19.676 -0.030 1.00 74.14 H new ATOM 0 HA PHE B 71 8.039 22.423 -0.030 1.00 74.23 H new ATOM 0 HB2 PHE B 71 7.081 21.463 2.050 1.00 55.43 H new ATOM 0 HB3 PHE B 71 8.657 20.866 2.529 1.00 55.43 H new ATOM 0 HD1 PHE B 71 6.786 24.048 1.833 1.00 31.00 H new ATOM 0 HD2 PHE B 71 10.137 22.269 3.811 1.00 64.13 H new ATOM 0 HE1 PHE B 71 7.241 26.166 2.988 1.00 23.43 H new ATOM 0 HE2 PHE B 71 10.580 24.394 4.956 1.00 54.31 H new ATOM 0 HZ PHE B 71 9.137 26.344 4.547 1.00 32.13 H new ATOM 2412 N SER B 72 10.452 23.015 -0.382 1.00 34.40 N ATOM 2413 CA SER B 72 11.855 23.450 -0.556 1.00 2.31 C ATOM 2414 C SER B 72 12.329 24.280 0.662 1.00 61.05 C ATOM 2415 O SER B 72 11.627 25.198 1.108 1.00 23.25 O ATOM 2416 CB SER B 72 12.016 24.265 -1.863 1.00 70.44 C ATOM 2417 OG SER B 72 13.382 24.521 -2.144 1.00 44.31 O ATOM 0 H SER B 72 9.777 23.580 -0.898 1.00 34.40 H new ATOM 0 HA SER B 72 12.479 22.559 -0.626 1.00 2.31 H new ATOM 0 HB2 SER B 72 11.568 23.718 -2.693 1.00 70.44 H new ATOM 0 HB3 SER B 72 11.477 25.208 -1.775 1.00 70.44 H new ATOM 0 HG SER B 72 13.454 25.035 -2.975 1.00 44.31 H new ATOM 2423 N PHE B 73 13.523 23.951 1.192 1.00 2.20 N ATOM 2424 CA PHE B 73 14.103 24.645 2.369 1.00 73.12 C ATOM 2425 C PHE B 73 15.641 24.801 2.219 1.00 11.31 C ATOM 2426 O PHE B 73 16.307 23.950 1.622 1.00 22.23 O ATOM 2427 CB PHE B 73 13.746 23.867 3.670 1.00 63.13 C ATOM 2428 CG PHE B 73 14.201 24.548 4.966 1.00 14.11 C ATOM 2429 CD1 PHE B 73 13.481 25.613 5.506 1.00 51.21 C ATOM 2430 CD2 PHE B 73 15.352 24.126 5.641 1.00 63.04 C ATOM 2431 CE1 PHE B 73 13.894 26.230 6.673 1.00 65.13 C ATOM 2432 CE2 PHE B 73 15.762 24.746 6.805 1.00 3.44 C ATOM 2433 CZ PHE B 73 15.033 25.798 7.321 1.00 3.44 C ATOM 0 H PHE B 73 14.112 23.204 0.824 1.00 2.20 H new ATOM 0 HA PHE B 73 13.675 25.646 2.431 1.00 73.12 H new ATOM 0 HB2 PHE B 73 12.666 23.726 3.709 1.00 63.13 H new ATOM 0 HB3 PHE B 73 14.195 22.875 3.619 1.00 63.13 H new ATOM 0 HD1 PHE B 73 12.589 25.961 5.006 1.00 51.21 H new ATOM 0 HD2 PHE B 73 15.929 23.303 5.246 1.00 63.04 H new ATOM 0 HE1 PHE B 73 13.323 27.052 7.078 1.00 65.13 H new ATOM 0 HE2 PHE B 73 16.654 24.407 7.312 1.00 3.44 H new ATOM 0 HZ PHE B 73 15.354 26.283 8.231 1.00 3.44 H new ATOM 2443 N GLY B 74 16.187 25.904 2.770 1.00 11.53 N ATOM 2444 CA GLY B 74 17.632 26.163 2.741 1.00 52.25 C ATOM 2445 C GLY B 74 18.020 27.472 3.440 1.00 71.15 C ATOM 2446 O GLY B 74 18.394 28.452 2.785 1.00 40.53 O ATOM 0 H GLY B 74 15.644 26.628 3.240 1.00 11.53 H new ATOM 0 HA2 GLY B 74 18.154 25.334 3.219 1.00 52.25 H new ATOM 0 HA3 GLY B 74 17.969 26.197 1.705 1.00 52.25 H new ATOM 2450 N LEU B 75 17.924 27.485 4.788 1.00 23.11 N ATOM 2451 CA LEU B 75 18.191 28.693 5.617 1.00 42.22 C ATOM 2452 C LEU B 75 19.272 28.423 6.703 1.00 64.24 C ATOM 2453 O LEU B 75 20.365 29.006 6.670 1.00 43.11 O ATOM 2454 CB LEU B 75 16.875 29.179 6.301 1.00 20.22 C ATOM 2455 CG LEU B 75 15.666 29.494 5.356 1.00 10.33 C ATOM 2456 CD1 LEU B 75 14.410 29.892 6.162 1.00 5.10 C ATOM 2457 CD2 LEU B 75 16.025 30.580 4.312 1.00 30.14 C ATOM 0 H LEU B 75 17.661 26.665 5.335 1.00 23.11 H new ATOM 0 HA LEU B 75 18.568 29.468 4.950 1.00 42.22 H new ATOM 0 HB2 LEU B 75 16.560 28.417 7.014 1.00 20.22 H new ATOM 0 HB3 LEU B 75 17.102 30.078 6.875 1.00 20.22 H new ATOM 0 HG LEU B 75 15.436 28.578 4.811 1.00 10.33 H new ATOM 0 HD11 LEU B 75 13.590 30.104 5.476 1.00 5.10 H new ATOM 0 HD12 LEU B 75 14.128 29.073 6.823 1.00 5.10 H new ATOM 0 HD13 LEU B 75 14.625 30.780 6.756 1.00 5.10 H new ATOM 0 HD21 LEU B 75 15.162 30.772 3.675 1.00 30.14 H new ATOM 0 HD22 LEU B 75 16.308 31.499 4.825 1.00 30.14 H new ATOM 0 HD23 LEU B 75 16.858 30.235 3.700 1.00 30.14 H new ATOM 2469 N GLU B 76 18.951 27.524 7.659 1.00 34.51 N ATOM 2470 CA GLU B 76 19.730 27.349 8.917 1.00 11.42 C ATOM 2471 C GLU B 76 20.801 26.228 8.837 1.00 33.14 C ATOM 2472 O GLU B 76 20.779 25.373 7.947 1.00 30.22 O ATOM 2473 CB GLU B 76 18.764 27.055 10.103 1.00 22.34 C ATOM 2474 CG GLU B 76 17.914 25.773 9.947 1.00 74.35 C ATOM 2475 CD GLU B 76 17.157 25.387 11.232 1.00 24.02 C ATOM 2476 OE1 GLU B 76 16.202 26.106 11.609 1.00 63.25 O ATOM 2477 OE2 GLU B 76 17.515 24.365 11.871 1.00 33.10 O ATOM 0 H GLU B 76 18.149 26.899 7.586 1.00 34.51 H new ATOM 0 HA GLU B 76 20.265 28.285 9.076 1.00 11.42 H new ATOM 0 HB2 GLU B 76 19.350 26.976 11.019 1.00 22.34 H new ATOM 0 HB3 GLU B 76 18.093 27.905 10.226 1.00 22.34 H new ATOM 0 HG2 GLU B 76 17.196 25.917 9.139 1.00 74.35 H new ATOM 0 HG3 GLU B 76 18.563 24.948 9.654 1.00 74.35 H new ATOM 2484 N HIS B 77 21.748 26.267 9.802 1.00 15.24 N ATOM 2485 CA HIS B 77 22.771 25.215 10.017 1.00 73.32 C ATOM 2486 C HIS B 77 22.974 24.965 11.537 1.00 33.51 C ATOM 2487 O HIS B 77 23.459 25.838 12.264 1.00 20.31 O ATOM 2488 CB HIS B 77 24.120 25.603 9.355 1.00 40.23 C ATOM 2489 CG HIS B 77 24.067 25.710 7.854 1.00 54.33 C ATOM 2490 ND1 HIS B 77 24.036 26.913 7.183 1.00 33.30 N ATOM 2491 CD2 HIS B 77 24.036 24.751 6.895 1.00 44.10 C ATOM 2492 CE1 HIS B 77 23.980 26.693 5.887 1.00 33.32 C ATOM 2493 NE2 HIS B 77 23.984 25.392 5.685 1.00 61.32 N ATOM 0 H HIS B 77 21.825 27.040 10.463 1.00 15.24 H new ATOM 0 HA HIS B 77 22.415 24.297 9.549 1.00 73.32 H new ATOM 0 HB2 HIS B 77 24.450 26.558 9.764 1.00 40.23 H new ATOM 0 HB3 HIS B 77 24.871 24.862 9.628 1.00 40.23 H new ATOM 0 HD2 HIS B 77 24.050 23.683 7.055 1.00 44.10 H new ATOM 0 HE1 HIS B 77 23.938 27.451 5.119 1.00 33.32 H new ATOM 0 HE2 HIS B 77 23.953 24.935 4.774 1.00 61.32 H new ATOM 2502 N HIS B 78 22.617 23.749 11.993 1.00 43.23 N ATOM 2503 CA HIS B 78 22.696 23.336 13.417 1.00 43.11 C ATOM 2504 C HIS B 78 24.167 23.072 13.885 1.00 51.41 C ATOM 2505 O HIS B 78 24.431 22.960 15.088 1.00 44.04 O ATOM 2506 CB HIS B 78 21.794 22.081 13.611 1.00 31.45 C ATOM 2507 CG HIS B 78 21.695 21.563 15.025 1.00 32.54 C ATOM 2508 ND1 HIS B 78 20.870 22.124 15.977 1.00 15.22 N ATOM 2509 CD2 HIS B 78 22.342 20.545 15.654 1.00 21.41 C ATOM 2510 CE1 HIS B 78 21.009 21.480 17.118 1.00 32.41 C ATOM 2511 NE2 HIS B 78 21.894 20.522 16.949 1.00 15.20 N ATOM 0 H HIS B 78 22.261 23.015 11.381 1.00 43.23 H new ATOM 0 HA HIS B 78 22.336 24.151 14.045 1.00 43.11 H new ATOM 0 HB2 HIS B 78 20.790 22.319 13.259 1.00 31.45 H new ATOM 0 HB3 HIS B 78 22.173 21.281 12.975 1.00 31.45 H new ATOM 0 HD2 HIS B 78 23.071 19.880 15.215 1.00 21.41 H new ATOM 0 HE1 HIS B 78 20.485 21.701 18.036 1.00 32.41 H new ATOM 0 HE2 HIS B 78 22.199 19.866 17.668 1.00 15.20 H new ATOM 2520 N HIS B 79 25.119 23.050 12.928 1.00 41.04 N ATOM 2521 CA HIS B 79 26.551 22.698 13.168 1.00 43.34 C ATOM 2522 C HIS B 79 27.325 23.765 14.027 1.00 52.10 C ATOM 2523 O HIS B 79 28.541 23.644 14.217 1.00 25.45 O ATOM 2524 CB HIS B 79 27.227 22.477 11.781 1.00 51.15 C ATOM 2525 CG HIS B 79 28.607 21.859 11.797 1.00 43.14 C ATOM 2526 ND1 HIS B 79 29.763 22.605 11.881 1.00 75.10 N ATOM 2527 CD2 HIS B 79 29.014 20.566 11.716 1.00 53.51 C ATOM 2528 CE1 HIS B 79 30.809 21.812 11.849 1.00 3.24 C ATOM 2529 NE2 HIS B 79 30.387 20.568 11.750 1.00 64.10 N ATOM 0 H HIS B 79 24.921 23.277 11.953 1.00 41.04 H new ATOM 0 HA HIS B 79 26.590 21.786 13.764 1.00 43.34 H new ATOM 0 HB2 HIS B 79 26.575 21.842 11.180 1.00 51.15 H new ATOM 0 HB3 HIS B 79 27.290 23.440 11.274 1.00 51.15 H new ATOM 0 HD2 HIS B 79 28.377 19.698 11.639 1.00 53.51 H new ATOM 0 HE1 HIS B 79 31.841 22.127 11.896 1.00 3.24 H new ATOM 0 HE2 HIS B 79 30.983 19.741 11.706 1.00 64.10 H new ATOM 2538 N HIS B 80 26.624 24.804 14.547 1.00 50.43 N ATOM 2539 CA HIS B 80 27.212 25.776 15.510 1.00 23.03 C ATOM 2540 C HIS B 80 27.614 25.091 16.859 1.00 74.01 C ATOM 2541 O HIS B 80 26.842 25.060 17.819 1.00 53.22 O ATOM 2542 CB HIS B 80 26.253 26.998 15.725 1.00 64.01 C ATOM 2543 CG HIS B 80 24.798 26.662 16.017 1.00 43.12 C ATOM 2544 ND1 HIS B 80 23.810 26.684 15.049 1.00 11.11 N ATOM 2545 CD2 HIS B 80 24.163 26.325 17.171 1.00 65.33 C ATOM 2546 CE1 HIS B 80 22.647 26.384 15.592 1.00 20.13 C ATOM 2547 NE2 HIS B 80 22.833 26.158 16.870 1.00 14.32 N ATOM 0 H HIS B 80 25.648 24.992 14.316 1.00 50.43 H new ATOM 0 HA HIS B 80 28.136 26.159 15.076 1.00 23.03 H new ATOM 0 HB2 HIS B 80 26.639 27.597 16.550 1.00 64.01 H new ATOM 0 HB3 HIS B 80 26.289 27.624 14.833 1.00 64.01 H new ATOM 0 HD1 HIS B 80 23.959 26.900 14.063 1.00 11.11 H new ATOM 0 HD2 HIS B 80 24.619 26.210 18.143 1.00 65.33 H new ATOM 0 HE1 HIS B 80 21.702 26.333 15.072 1.00 20.13 H new ATOM 2556 N HIS B 81 28.833 24.507 16.881 1.00 60.03 N ATOM 2557 CA HIS B 81 29.405 23.804 18.058 1.00 24.10 C ATOM 2558 C HIS B 81 30.887 23.434 17.788 1.00 23.11 C ATOM 2559 O HIS B 81 31.223 22.980 16.689 1.00 33.21 O ATOM 2560 CB HIS B 81 28.589 22.514 18.388 1.00 31.40 C ATOM 2561 CG HIS B 81 29.070 21.750 19.600 1.00 15.32 C ATOM 2562 ND1 HIS B 81 30.013 20.743 19.526 1.00 52.33 N ATOM 2563 CD2 HIS B 81 28.744 21.850 20.914 1.00 64.21 C ATOM 2564 CE1 HIS B 81 30.242 20.261 20.728 1.00 31.03 C ATOM 2565 NE2 HIS B 81 29.491 20.913 21.586 1.00 62.23 N ATOM 0 H HIS B 81 29.457 24.509 16.074 1.00 60.03 H new ATOM 0 HA HIS B 81 29.351 24.475 18.915 1.00 24.10 H new ATOM 0 HB2 HIS B 81 27.546 22.791 18.541 1.00 31.40 H new ATOM 0 HB3 HIS B 81 28.619 21.851 17.523 1.00 31.40 H new ATOM 0 HD2 HIS B 81 28.032 22.536 21.349 1.00 64.21 H new ATOM 0 HE1 HIS B 81 30.931 19.464 20.969 1.00 31.03 H new ATOM 0 HE2 HIS B 81 29.466 20.749 22.592 1.00 62.23 H new ATOM 2574 N HIS B 82 31.760 23.627 18.796 1.00 34.22 N ATOM 2575 CA HIS B 82 33.196 23.239 18.725 1.00 1.41 C ATOM 2576 C HIS B 82 33.365 21.710 18.526 1.00 31.24 C ATOM 2577 O HIS B 82 32.998 20.908 19.386 1.00 24.44 O ATOM 2578 CB HIS B 82 33.929 23.718 20.010 1.00 64.43 C ATOM 2579 CG HIS B 82 35.362 23.251 20.142 1.00 61.21 C ATOM 2580 ND1 HIS B 82 35.734 22.205 20.964 1.00 5.10 N ATOM 2581 CD2 HIS B 82 36.509 23.685 19.560 1.00 24.02 C ATOM 2582 CE1 HIS B 82 37.033 22.020 20.887 1.00 61.13 C ATOM 2583 NE2 HIS B 82 37.528 22.898 20.044 1.00 54.43 N ATOM 0 H HIS B 82 31.497 24.055 19.684 1.00 34.22 H new ATOM 0 HA HIS B 82 33.643 23.724 17.857 1.00 1.41 H new ATOM 0 HB2 HIS B 82 33.914 24.808 20.033 1.00 64.43 H new ATOM 0 HB3 HIS B 82 33.369 23.373 20.879 1.00 64.43 H new ATOM 0 HD2 HIS B 82 36.604 24.495 18.851 1.00 24.02 H new ATOM 0 HE1 HIS B 82 37.598 21.273 21.425 1.00 61.13 H new ATOM 0 HE2 HIS B 82 38.512 22.983 19.789 1.00 54.43 H new TER 2592 HIS B 82