USER MOD reduce.3.24.130724 H: found=0, std=0, add=1346, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1340 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: B 8 THR OG1 : rot 180:sc= 0.00465 USER MOD Set 1.2: B 11 GLN : amide:sc= -1.15 K(o=-1.1,f=0.00044) USER MOD Set 2.1: A 35 MET CE :methyl 155:sc= -1.09 (180deg=-1.92) USER MOD Set 2.2: B 4 THR OG1 : rot 54:sc= 1.33 USER MOD Set 3.1: A 53 GLN : amide:sc= 0.203 K(o=1.5,f=-7.6!) USER MOD Set 3.2: A 60 LYS NZ :NH3+ 155:sc= 1.27 (180deg=0) USER MOD Set 4.1: A 29 SER OG : rot 180:sc= 0.0265 USER MOD Set 4.2: B 7 TYR OH : rot 120:sc= 0 USER MOD Set 5.1: A 7 TYR OH : rot -171:sc= 1.53 USER MOD Set 5.2: B 29 SER OG : rot 117:sc= 0.666 USER MOD Single : A 1 MET CE :methyl 161:sc= -0.118 (180deg=-0.583) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot -170:sc= -0.776 USER MOD Single : A 5 SER OG : rot 74:sc= 0.912 USER MOD Single : A 6 LYS NZ :NH3+ 169:sc= -0.0136 (180deg=-0.182) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 14 LYS NZ :NH3+ 174:sc= 1.26 (180deg=1.22) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= -0.0606 K(o=-0.061,f=-4.6!) USER MOD Single : A 33 THR OG1 : rot 70:sc= 0.756 USER MOD Single : A 39 ASN : amide:sc= 0.565 K(o=0.57,f=-0.093) USER MOD Single : A 42 THR OG1 : rot 90:sc= 1.31 USER MOD Single : A 43 ASN : amide:sc= -1.28 K(o=-1.3,f=0) USER MOD Single : A 46 ASN : amide:sc= 0.29 K(o=0.29,f=-6.2!) USER MOD Single : A 47 GLN : amide:sc= -0.963 K(o=-0.96,f=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0.0709 USER MOD Single : A 55 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0333) USER MOD Single : A 63 GLN : amide:sc= -0.739 K(o=-0.74,f=0) USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot -46:sc= 0.118 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= -0.291 USER MOD Single : A 75 HIS : no HD1:sc= 1.09 K(o=1.1,f=-4.9!) USER MOD Single : A 78 HIS : no HD1:sc= 0.511 K(o=0.51,f=-4.9!) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=-0.00091) USER MOD Single : A 80 HIS : no HD1:sc= -0.0171 X(o=-0.017,f=-0.014) USER MOD Single : A 81 HIS : no HD1:sc= -0.302 X(o=-0.3,f=-0.25) USER MOD Single : A 82 HIS : no HD1:sc= -0.706 X(o=-0.71,f=-0.53) USER MOD Single : A 83 HIS : no HD1:sc= -0.0539 X(o=-0.054,f=0) USER MOD Single : B 1 MET CE :methyl 137:sc= -0.268 (180deg=-0.948) USER MOD Single : B 1 MET N :NH3+ -120:sc= 0.077 (180deg=-0.0185) USER MOD Single : B 5 SER OG : rot 180:sc= 0 USER MOD Single : B 6 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.022) USER MOD Single : B 14 LYS NZ :NH3+ -168:sc= 1.26 (180deg=1.02) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 HIS : no HD1:sc= 0.93 K(o=0.93,f=-5.9!) USER MOD Single : B 33 THR OG1 : rot 69:sc= 0.916 USER MOD Single : B 35 MET CE :methyl 173:sc= -0.0112 (180deg=-0.139) USER MOD Single : B 39 ASN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : B 42 THR OG1 : rot 92:sc= 1.27 USER MOD Single : B 43 ASN : amide:sc= -0.0565 K(o=-0.057,f=-1.2!) USER MOD Single : B 46 ASN : amide:sc= 1.14 K(o=1.1,f=-0.042) USER MOD Single : B 47 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD Single : B 53 GLN : amide:sc= -1.16 K(o=-1.2,f=-6.3!) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 LYS NZ :NH3+ -152:sc= 0.0419 (180deg=0.0111) USER MOD Single : B 63 GLN : amide:sc= -0.195 K(o=-0.2,f=-0.88) USER MOD Single : B 66 MET CE :methyl 171:sc= 0 (180deg=-0.263) USER MOD Single : B 67 SER OG : rot -85:sc= 1.16 USER MOD Single : B 68 SER OG : rot 81:sc= 1.03 USER MOD Single : B 71 THR OG1 : rot 180:sc= -0.343 USER MOD Single : B 73 LYS NZ :NH3+ 170:sc= 1 (180deg=0.691) USER MOD Single : B 74 THR OG1 : rot 180:sc= 0.0839 USER MOD Single : B 75 HIS : no HD1:sc= -0.0652 X(o=-0.065,f=0.0047) USER MOD Single : B 78 HIS : no HD1:sc= -0.942 K(o=-0.94,f=0.24) USER MOD Single : B 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 80 HIS : no HD1:sc= -0.575 K(o=-0.57,f=-0.061) USER MOD Single : B 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.174 2.071 22.522 1.00 0.00 N ATOM 2 CA MET A 1 10.036 2.581 21.140 1.00 0.00 C ATOM 3 C MET A 1 8.831 1.945 20.465 1.00 0.00 C ATOM 4 O MET A 1 8.809 0.738 20.219 1.00 0.00 O ATOM 5 CB MET A 1 11.302 2.291 20.330 1.00 0.00 C ATOM 6 CG MET A 1 11.246 2.806 18.899 1.00 0.00 C ATOM 7 SD MET A 1 12.772 2.495 17.981 1.00 0.00 S ATOM 8 CE MET A 1 12.836 0.704 18.021 1.00 0.00 C ATOM 0 H1 MET A 1 11.000 2.512 22.974 1.00 0.00 H new ATOM 0 H2 MET A 1 9.318 2.303 23.065 1.00 0.00 H new ATOM 0 H3 MET A 1 10.301 1.039 22.500 1.00 0.00 H new ATOM 0 HA MET A 1 9.891 3.660 21.184 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.157 2.741 20.835 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.473 1.215 20.313 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.413 2.333 18.380 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.047 3.878 18.911 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.503 0.346 17.237 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.207 0.375 18.992 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.837 0.300 17.859 1.00 0.00 H new ATOM 17 N PRO A 2 7.799 2.747 20.178 1.00 0.00 N ATOM 18 CA PRO A 2 6.586 2.270 19.530 1.00 0.00 C ATOM 19 C PRO A 2 6.701 2.255 18.006 1.00 0.00 C ATOM 20 O PRO A 2 7.644 2.807 17.434 1.00 0.00 O ATOM 21 CB PRO A 2 5.544 3.290 19.984 1.00 0.00 C ATOM 22 CG PRO A 2 6.304 4.566 20.134 1.00 0.00 C ATOM 23 CD PRO A 2 7.728 4.191 20.473 1.00 0.00 C ATOM 0 HA PRO A 2 6.350 1.240 19.796 1.00 0.00 H new ATOM 0 HB2 PRO A 2 4.743 3.390 19.252 1.00 0.00 H new ATOM 0 HB3 PRO A 2 5.081 2.992 20.925 1.00 0.00 H new ATOM 0 HG2 PRO A 2 6.267 5.148 19.213 1.00 0.00 H new ATOM 0 HG3 PRO A 2 5.870 5.184 20.920 1.00 0.00 H new ATOM 0 HD2 PRO A 2 8.442 4.756 19.874 1.00 0.00 H new ATOM 0 HD3 PRO A 2 7.956 4.396 21.519 1.00 0.00 H new ATOM 31 N ILE A 3 5.740 1.614 17.363 1.00 0.00 N ATOM 32 CA ILE A 3 5.663 1.569 15.911 1.00 0.00 C ATOM 33 C ILE A 3 4.331 2.158 15.459 1.00 0.00 C ATOM 34 O ILE A 3 3.774 3.005 16.158 1.00 0.00 O ATOM 35 CB ILE A 3 5.810 0.126 15.376 1.00 0.00 C ATOM 36 CG1 ILE A 3 4.828 -0.817 16.082 1.00 0.00 C ATOM 37 CG2 ILE A 3 7.245 -0.359 15.544 1.00 0.00 C ATOM 38 CD1 ILE A 3 4.871 -2.236 15.560 1.00 0.00 C ATOM 0 H ILE A 3 4.989 1.109 17.833 1.00 0.00 H new ATOM 0 HA ILE A 3 6.488 2.156 15.507 1.00 0.00 H new ATOM 0 HB ILE A 3 5.571 0.126 14.313 1.00 0.00 H new ATOM 0 HG12 ILE A 3 5.048 -0.824 17.150 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.817 -0.427 15.968 1.00 0.00 H new ATOM 0 HG21 ILE A 3 7.332 -1.376 15.163 1.00 0.00 H new ATOM 0 HG22 ILE A 3 7.918 0.295 14.989 1.00 0.00 H new ATOM 0 HG23 ILE A 3 7.513 -0.343 16.600 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.151 -2.846 16.105 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.621 -2.241 14.499 1.00 0.00 H new ATOM 0 HD13 ILE A 3 5.872 -2.645 15.699 1.00 0.00 H new ATOM 50 N THR A 4 3.834 1.705 14.305 1.00 0.00 N ATOM 51 CA THR A 4 2.556 2.163 13.759 1.00 0.00 C ATOM 52 C THR A 4 1.477 2.240 14.839 1.00 0.00 C ATOM 53 O THR A 4 1.044 1.221 15.385 1.00 0.00 O ATOM 54 CB THR A 4 2.086 1.225 12.630 1.00 0.00 C ATOM 55 OG1 THR A 4 3.149 1.038 11.684 1.00 0.00 O ATOM 56 CG2 THR A 4 0.868 1.792 11.918 1.00 0.00 C ATOM 0 H THR A 4 4.306 1.012 13.725 1.00 0.00 H new ATOM 0 HA THR A 4 2.714 3.165 13.360 1.00 0.00 H new ATOM 0 HB THR A 4 1.811 0.268 13.074 1.00 0.00 H new ATOM 0 HG1 THR A 4 2.804 0.575 10.892 1.00 0.00 H new ATOM 0 HG21 THR A 4 0.559 1.109 11.127 1.00 0.00 H new ATOM 0 HG22 THR A 4 0.053 1.913 12.632 1.00 0.00 H new ATOM 0 HG23 THR A 4 1.118 2.760 11.485 1.00 0.00 H new ATOM 64 N SER A 5 1.071 3.459 15.155 1.00 0.00 N ATOM 65 CA SER A 5 0.124 3.703 16.226 1.00 0.00 C ATOM 66 C SER A 5 -1.310 3.459 15.759 1.00 0.00 C ATOM 67 O SER A 5 -1.587 3.424 14.560 1.00 0.00 O ATOM 68 CB SER A 5 0.281 5.140 16.719 1.00 0.00 C ATOM 69 OG SER A 5 1.650 5.464 16.914 1.00 0.00 O ATOM 0 H SER A 5 1.388 4.303 14.677 1.00 0.00 H new ATOM 0 HA SER A 5 0.331 3.010 17.042 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.160 5.827 15.996 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.264 5.269 17.654 1.00 0.00 H new ATOM 0 HG SER A 5 2.085 5.585 16.044 1.00 0.00 H new ATOM 75 N LYS A 6 -2.210 3.282 16.717 1.00 0.00 N ATOM 76 CA LYS A 6 -3.624 3.078 16.425 1.00 0.00 C ATOM 77 C LYS A 6 -4.262 4.362 15.890 1.00 0.00 C ATOM 78 O LYS A 6 -5.034 4.325 14.927 1.00 0.00 O ATOM 79 CB LYS A 6 -4.351 2.612 17.693 1.00 0.00 C ATOM 80 CG LYS A 6 -5.819 2.290 17.483 1.00 0.00 C ATOM 81 CD LYS A 6 -6.471 1.814 18.772 1.00 0.00 C ATOM 82 CE LYS A 6 -7.944 1.492 18.570 1.00 0.00 C ATOM 83 NZ LYS A 6 -8.151 0.378 17.604 1.00 0.00 N ATOM 0 H LYS A 6 -1.984 3.276 17.712 1.00 0.00 H new ATOM 0 HA LYS A 6 -3.714 2.311 15.656 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -3.848 1.727 18.083 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -4.266 3.388 18.454 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -6.339 3.175 17.116 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -5.919 1.521 16.717 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -5.951 0.928 19.137 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -6.368 2.583 19.538 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -8.390 1.227 19.528 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -8.462 2.382 18.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -9.144 0.070 17.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -7.921 0.704 16.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -7.533 -0.419 17.856 1.00 0.00 H new ATOM 97 N TYR A 7 -3.922 5.490 16.521 1.00 0.00 N ATOM 98 CA TYR A 7 -4.477 6.797 16.160 1.00 0.00 C ATOM 99 C TYR A 7 -5.995 6.815 16.304 1.00 0.00 C ATOM 100 O TYR A 7 -6.589 5.920 16.909 1.00 0.00 O ATOM 101 CB TYR A 7 -4.092 7.192 14.728 1.00 0.00 C ATOM 102 CG TYR A 7 -2.655 7.628 14.574 1.00 0.00 C ATOM 103 CD1 TYR A 7 -2.280 8.938 14.838 1.00 0.00 C ATOM 104 CD2 TYR A 7 -1.677 6.736 14.162 1.00 0.00 C ATOM 105 CE1 TYR A 7 -0.970 9.347 14.696 1.00 0.00 C ATOM 106 CE2 TYR A 7 -0.366 7.135 14.018 1.00 0.00 C ATOM 107 CZ TYR A 7 -0.015 8.441 14.286 1.00 0.00 C ATOM 108 OH TYR A 7 1.293 8.841 14.152 1.00 0.00 O ATOM 0 H TYR A 7 -3.257 5.523 17.294 1.00 0.00 H new ATOM 0 HA TYR A 7 -4.050 7.524 16.851 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -4.276 6.345 14.067 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -4.743 8.001 14.398 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -3.026 9.649 15.160 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -1.947 5.712 13.951 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -0.694 10.370 14.905 1.00 0.00 H new ATOM 0 HE2 TYR A 7 0.384 6.427 13.696 1.00 0.00 H new ATOM 0 HH TYR A 7 1.810 8.130 13.719 1.00 0.00 H new ATOM 118 N THR A 8 -6.612 7.854 15.771 1.00 0.00 N ATOM 119 CA THR A 8 -8.055 7.942 15.741 1.00 0.00 C ATOM 120 C THR A 8 -8.550 7.814 14.306 1.00 0.00 C ATOM 121 O THR A 8 -7.940 8.352 13.375 1.00 0.00 O ATOM 122 CB THR A 8 -8.572 9.256 16.376 1.00 0.00 C ATOM 123 OG1 THR A 8 -9.992 9.365 16.203 1.00 0.00 O ATOM 124 CG2 THR A 8 -7.886 10.474 15.773 1.00 0.00 C ATOM 0 H THR A 8 -6.131 8.650 15.352 1.00 0.00 H new ATOM 0 HA THR A 8 -8.451 7.120 16.338 1.00 0.00 H new ATOM 0 HB THR A 8 -8.336 9.225 17.440 1.00 0.00 H new ATOM 0 HG1 THR A 8 -10.308 10.199 16.610 1.00 0.00 H new ATOM 0 HG21 THR A 8 -8.273 11.379 16.242 1.00 0.00 H new ATOM 0 HG22 THR A 8 -6.811 10.408 15.944 1.00 0.00 H new ATOM 0 HG23 THR A 8 -8.082 10.508 14.701 1.00 0.00 H new ATOM 132 N ASP A 9 -9.651 7.093 14.137 1.00 0.00 N ATOM 133 CA ASP A 9 -10.215 6.825 12.820 1.00 0.00 C ATOM 134 C ASP A 9 -10.627 8.123 12.150 1.00 0.00 C ATOM 135 O ASP A 9 -10.559 8.252 10.930 1.00 0.00 O ATOM 136 CB ASP A 9 -11.429 5.900 12.937 1.00 0.00 C ATOM 137 CG ASP A 9 -11.129 4.630 13.709 1.00 0.00 C ATOM 138 OD1 ASP A 9 -10.482 3.721 13.147 1.00 0.00 O ATOM 139 OD2 ASP A 9 -11.527 4.541 14.893 1.00 0.00 O ATOM 0 H ASP A 9 -10.177 6.679 14.906 1.00 0.00 H new ATOM 0 HA ASP A 9 -9.453 6.336 12.214 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -12.241 6.435 13.429 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -11.778 5.638 11.938 1.00 0.00 H new ATOM 144 N GLU A 10 -11.034 9.089 12.969 1.00 0.00 N ATOM 145 CA GLU A 10 -11.472 10.391 12.485 1.00 0.00 C ATOM 146 C GLU A 10 -10.351 11.078 11.709 1.00 0.00 C ATOM 147 O GLU A 10 -10.526 11.475 10.560 1.00 0.00 O ATOM 148 CB GLU A 10 -11.898 11.266 13.667 1.00 0.00 C ATOM 149 CG GLU A 10 -12.625 12.536 13.258 1.00 0.00 C ATOM 150 CD GLU A 10 -13.990 12.254 12.668 1.00 0.00 C ATOM 151 OE1 GLU A 10 -14.078 11.982 11.455 1.00 0.00 O ATOM 152 OE2 GLU A 10 -14.984 12.303 13.420 1.00 0.00 O ATOM 0 H GLU A 10 -11.069 8.990 13.984 1.00 0.00 H new ATOM 0 HA GLU A 10 -12.321 10.248 11.816 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.544 10.684 14.324 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -11.014 11.534 14.246 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.735 13.185 14.127 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.022 13.078 12.530 1.00 0.00 H new ATOM 159 N GLN A 11 -9.192 11.186 12.349 1.00 0.00 N ATOM 160 CA GLN A 11 -8.041 11.861 11.762 1.00 0.00 C ATOM 161 C GLN A 11 -7.591 11.150 10.491 1.00 0.00 C ATOM 162 O GLN A 11 -7.356 11.784 9.463 1.00 0.00 O ATOM 163 CB GLN A 11 -6.888 11.911 12.769 1.00 0.00 C ATOM 164 CG GLN A 11 -5.674 12.691 12.278 1.00 0.00 C ATOM 165 CD GLN A 11 -4.547 12.718 13.293 1.00 0.00 C ATOM 166 OE1 GLN A 11 -4.780 12.646 14.500 1.00 0.00 O ATOM 167 NE2 GLN A 11 -3.319 12.845 12.815 1.00 0.00 N ATOM 0 H GLN A 11 -9.024 10.811 13.283 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.334 12.879 11.505 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -7.246 12.360 13.695 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -6.582 10.892 13.007 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -5.312 12.247 11.351 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -5.973 13.713 12.046 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -3.167 12.901 11.808 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -2.525 12.886 13.454 1.00 0.00 H new ATOM 176 N VAL A 12 -7.486 9.829 10.575 1.00 0.00 N ATOM 177 CA VAL A 12 -7.049 9.020 9.446 1.00 0.00 C ATOM 178 C VAL A 12 -8.017 9.162 8.274 1.00 0.00 C ATOM 179 O VAL A 12 -7.592 9.286 7.123 1.00 0.00 O ATOM 180 CB VAL A 12 -6.913 7.532 9.833 1.00 0.00 C ATOM 181 CG1 VAL A 12 -6.444 6.709 8.641 1.00 0.00 C ATOM 182 CG2 VAL A 12 -5.956 7.370 11.009 1.00 0.00 C ATOM 0 H VAL A 12 -7.699 9.295 11.417 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.067 9.386 9.146 1.00 0.00 H new ATOM 0 HB VAL A 12 -7.893 7.165 10.137 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -6.354 5.663 8.934 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -7.167 6.798 7.830 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.474 7.076 8.304 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -5.873 6.314 11.268 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -4.974 7.755 10.735 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -6.336 7.925 11.867 1.00 0.00 H new ATOM 192 N GLU A 13 -9.312 9.165 8.579 1.00 0.00 N ATOM 193 CA GLU A 13 -10.343 9.337 7.562 1.00 0.00 C ATOM 194 C GLU A 13 -10.129 10.633 6.793 1.00 0.00 C ATOM 195 O GLU A 13 -10.203 10.655 5.565 1.00 0.00 O ATOM 196 CB GLU A 13 -11.735 9.359 8.198 1.00 0.00 C ATOM 197 CG GLU A 13 -12.856 9.525 7.182 1.00 0.00 C ATOM 198 CD GLU A 13 -14.156 9.980 7.809 1.00 0.00 C ATOM 199 OE1 GLU A 13 -14.845 9.147 8.435 1.00 0.00 O ATOM 200 OE2 GLU A 13 -14.498 11.176 7.677 1.00 0.00 O ATOM 0 H GLU A 13 -9.672 9.050 9.526 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.273 8.493 6.876 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -11.889 8.433 8.751 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -11.784 10.174 8.920 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -12.550 10.248 6.426 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -13.018 8.577 6.669 1.00 0.00 H new ATOM 207 N LYS A 14 -9.852 11.705 7.525 1.00 0.00 N ATOM 208 CA LYS A 14 -9.695 13.021 6.917 1.00 0.00 C ATOM 209 C LYS A 14 -8.503 13.034 5.975 1.00 0.00 C ATOM 210 O LYS A 14 -8.574 13.580 4.874 1.00 0.00 O ATOM 211 CB LYS A 14 -9.534 14.105 7.988 1.00 0.00 C ATOM 212 CG LYS A 14 -10.656 14.126 9.008 1.00 0.00 C ATOM 213 CD LYS A 14 -12.020 14.039 8.343 1.00 0.00 C ATOM 214 CE LYS A 14 -13.133 13.989 9.369 1.00 0.00 C ATOM 215 NZ LYS A 14 -14.443 13.677 8.743 1.00 0.00 N ATOM 0 H LYS A 14 -9.732 11.690 8.538 1.00 0.00 H new ATOM 0 HA LYS A 14 -10.597 13.236 6.345 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -8.587 13.954 8.506 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -9.479 15.079 7.501 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -10.535 13.293 9.700 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -10.596 15.041 9.597 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.164 14.900 7.690 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.063 13.150 7.713 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -12.901 13.236 10.122 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.195 14.947 9.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.161 13.551 9.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -14.724 14.459 8.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.362 12.802 8.187 1.00 0.00 H new ATOM 229 N ILE A 15 -7.416 12.414 6.407 1.00 0.00 N ATOM 230 CA ILE A 15 -6.227 12.329 5.578 1.00 0.00 C ATOM 231 C ILE A 15 -6.522 11.519 4.321 1.00 0.00 C ATOM 232 O ILE A 15 -6.283 11.982 3.207 1.00 0.00 O ATOM 233 CB ILE A 15 -5.045 11.686 6.332 1.00 0.00 C ATOM 234 CG1 ILE A 15 -4.845 12.361 7.692 1.00 0.00 C ATOM 235 CG2 ILE A 15 -3.774 11.787 5.497 1.00 0.00 C ATOM 236 CD1 ILE A 15 -3.786 11.702 8.550 1.00 0.00 C ATOM 0 H ILE A 15 -7.334 11.966 7.320 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.945 13.347 5.309 1.00 0.00 H new ATOM 0 HB ILE A 15 -5.271 10.633 6.501 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.573 13.405 7.533 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -5.792 12.357 8.232 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -2.946 11.330 6.038 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.919 11.268 4.550 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.547 12.836 5.305 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.701 12.235 9.497 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -4.065 10.666 8.741 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.828 11.730 8.031 1.00 0.00 H new ATOM 248 N LEU A 16 -7.074 10.323 4.512 1.00 0.00 N ATOM 249 CA LEU A 16 -7.412 9.433 3.401 1.00 0.00 C ATOM 250 C LEU A 16 -8.355 10.111 2.416 1.00 0.00 C ATOM 251 O LEU A 16 -8.199 9.979 1.201 1.00 0.00 O ATOM 252 CB LEU A 16 -8.057 8.148 3.926 1.00 0.00 C ATOM 253 CG LEU A 16 -7.118 7.198 4.667 1.00 0.00 C ATOM 254 CD1 LEU A 16 -7.904 6.051 5.279 1.00 0.00 C ATOM 255 CD2 LEU A 16 -6.050 6.662 3.727 1.00 0.00 C ATOM 0 H LEU A 16 -7.298 9.945 5.432 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.486 9.188 2.880 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.874 8.419 4.595 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -8.498 7.613 3.085 1.00 0.00 H new ATOM 0 HG LEU A 16 -6.627 7.753 5.467 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -7.222 5.382 5.804 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -8.637 6.447 5.982 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.417 5.500 4.491 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.391 5.987 4.273 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.524 6.122 2.908 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.468 7.492 3.326 1.00 0.00 H new ATOM 267 N ALA A 17 -9.329 10.839 2.946 1.00 0.00 N ATOM 268 CA ALA A 17 -10.304 11.538 2.121 1.00 0.00 C ATOM 269 C ALA A 17 -9.628 12.538 1.192 1.00 0.00 C ATOM 270 O ALA A 17 -9.952 12.615 0.007 1.00 0.00 O ATOM 271 CB ALA A 17 -11.331 12.241 2.992 1.00 0.00 C ATOM 0 H ALA A 17 -9.465 10.961 3.950 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.812 10.796 1.505 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.052 12.758 2.359 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.850 11.506 3.608 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.829 12.964 3.635 1.00 0.00 H new ATOM 277 N GLU A 18 -8.679 13.297 1.726 1.00 0.00 N ATOM 278 CA GLU A 18 -7.978 14.291 0.930 1.00 0.00 C ATOM 279 C GLU A 18 -6.949 13.641 0.012 1.00 0.00 C ATOM 280 O GLU A 18 -6.702 14.130 -1.087 1.00 0.00 O ATOM 281 CB GLU A 18 -7.327 15.345 1.821 1.00 0.00 C ATOM 282 CG GLU A 18 -8.339 16.211 2.551 1.00 0.00 C ATOM 283 CD GLU A 18 -7.708 17.411 3.216 1.00 0.00 C ATOM 284 OE1 GLU A 18 -7.321 18.355 2.500 1.00 0.00 O ATOM 285 OE2 GLU A 18 -7.608 17.428 4.458 1.00 0.00 O ATOM 0 H GLU A 18 -8.380 13.243 2.700 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.715 14.790 0.300 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -6.686 14.850 2.551 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.684 15.981 1.212 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -9.098 16.549 1.845 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -8.849 15.610 3.304 1.00 0.00 H new ATOM 292 N VAL A 19 -6.361 12.532 0.451 1.00 0.00 N ATOM 293 CA VAL A 19 -5.459 11.767 -0.406 1.00 0.00 C ATOM 294 C VAL A 19 -6.212 11.278 -1.642 1.00 0.00 C ATOM 295 O VAL A 19 -5.745 11.433 -2.770 1.00 0.00 O ATOM 296 CB VAL A 19 -4.834 10.561 0.335 1.00 0.00 C ATOM 297 CG1 VAL A 19 -4.050 9.677 -0.625 1.00 0.00 C ATOM 298 CG2 VAL A 19 -3.933 11.036 1.464 1.00 0.00 C ATOM 0 H VAL A 19 -6.491 12.145 1.386 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.646 12.430 -0.701 1.00 0.00 H new ATOM 0 HB VAL A 19 -5.646 9.971 0.759 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.621 8.837 -0.078 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -4.717 9.302 -1.402 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.250 10.258 -1.083 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.503 10.174 1.973 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.133 11.653 1.056 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.517 11.622 2.173 1.00 0.00 H new ATOM 308 N ALA A 20 -7.399 10.721 -1.416 1.00 0.00 N ATOM 309 CA ALA A 20 -8.253 10.270 -2.506 1.00 0.00 C ATOM 310 C ALA A 20 -8.703 11.451 -3.362 1.00 0.00 C ATOM 311 O ALA A 20 -8.902 11.317 -4.568 1.00 0.00 O ATOM 312 CB ALA A 20 -9.461 9.522 -1.958 1.00 0.00 C ATOM 0 H ALA A 20 -7.790 10.572 -0.486 1.00 0.00 H new ATOM 0 HA ALA A 20 -7.677 9.590 -3.134 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.090 9.191 -2.785 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.125 8.656 -1.388 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.034 10.183 -1.308 1.00 0.00 H new ATOM 318 N LEU A 21 -8.859 12.607 -2.727 1.00 0.00 N ATOM 319 CA LEU A 21 -9.239 13.826 -3.428 1.00 0.00 C ATOM 320 C LEU A 21 -8.134 14.243 -4.400 1.00 0.00 C ATOM 321 O LEU A 21 -8.416 14.682 -5.515 1.00 0.00 O ATOM 322 CB LEU A 21 -9.539 14.941 -2.413 1.00 0.00 C ATOM 323 CG LEU A 21 -10.164 16.223 -2.976 1.00 0.00 C ATOM 324 CD1 LEU A 21 -10.966 16.929 -1.896 1.00 0.00 C ATOM 325 CD2 LEU A 21 -9.095 17.164 -3.512 1.00 0.00 C ATOM 0 H LEU A 21 -8.727 12.725 -1.722 1.00 0.00 H new ATOM 0 HA LEU A 21 -10.143 13.641 -4.008 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -10.208 14.540 -1.652 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.608 15.206 -1.911 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.823 15.943 -3.798 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -11.406 17.838 -2.305 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -11.759 16.270 -1.542 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -10.310 17.186 -1.065 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.567 18.065 -3.905 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.411 17.434 -2.707 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.540 16.668 -4.308 1.00 0.00 H new ATOM 337 N VAL A 22 -6.880 14.090 -3.976 1.00 0.00 N ATOM 338 CA VAL A 22 -5.733 14.399 -4.828 1.00 0.00 C ATOM 339 C VAL A 22 -5.687 13.445 -6.016 1.00 0.00 C ATOM 340 O VAL A 22 -5.415 13.851 -7.151 1.00 0.00 O ATOM 341 CB VAL A 22 -4.400 14.307 -4.048 1.00 0.00 C ATOM 342 CG1 VAL A 22 -3.213 14.595 -4.957 1.00 0.00 C ATOM 343 CG2 VAL A 22 -4.406 15.260 -2.862 1.00 0.00 C ATOM 0 H VAL A 22 -6.633 13.753 -3.046 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.855 15.423 -5.179 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.300 13.288 -3.674 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.289 14.524 -4.383 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.192 13.869 -5.770 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.306 15.599 -5.370 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.460 15.180 -2.326 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.537 16.282 -3.217 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.225 15.001 -2.191 1.00 0.00 H new ATOM 353 N LEU A 23 -5.967 12.177 -5.746 1.00 0.00 N ATOM 354 CA LEU A 23 -6.022 11.162 -6.788 1.00 0.00 C ATOM 355 C LEU A 23 -7.105 11.506 -7.804 1.00 0.00 C ATOM 356 O LEU A 23 -6.856 11.522 -9.009 1.00 0.00 O ATOM 357 CB LEU A 23 -6.294 9.789 -6.169 1.00 0.00 C ATOM 358 CG LEU A 23 -5.321 9.376 -5.062 1.00 0.00 C ATOM 359 CD1 LEU A 23 -5.739 8.052 -4.448 1.00 0.00 C ATOM 360 CD2 LEU A 23 -3.901 9.292 -5.603 1.00 0.00 C ATOM 0 H LEU A 23 -6.161 11.826 -4.808 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.061 11.133 -7.301 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.306 9.784 -5.764 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.263 9.038 -6.959 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.346 10.137 -4.282 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.034 7.776 -3.663 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.738 8.148 -4.022 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.745 7.280 -5.217 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.223 8.997 -4.802 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.860 8.553 -6.404 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.602 10.265 -5.992 1.00 0.00 H new ATOM 372 N GLU A 24 -8.297 11.807 -7.302 1.00 0.00 N ATOM 373 CA GLU A 24 -9.422 12.200 -8.147 1.00 0.00 C ATOM 374 C GLU A 24 -9.080 13.466 -8.938 1.00 0.00 C ATOM 375 O GLU A 24 -9.420 13.591 -10.117 1.00 0.00 O ATOM 376 CB GLU A 24 -10.661 12.439 -7.279 1.00 0.00 C ATOM 377 CG GLU A 24 -11.960 12.526 -8.063 1.00 0.00 C ATOM 378 CD GLU A 24 -12.304 11.227 -8.762 1.00 0.00 C ATOM 379 OE1 GLU A 24 -12.354 10.177 -8.083 1.00 0.00 O ATOM 380 OE2 GLU A 24 -12.529 11.243 -9.990 1.00 0.00 O ATOM 0 H GLU A 24 -8.512 11.786 -6.305 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.630 11.397 -8.854 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.742 11.632 -6.550 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.525 13.363 -6.717 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -12.771 12.797 -7.387 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.882 13.323 -8.802 1.00 0.00 H new ATOM 387 N LYS A 25 -8.383 14.385 -8.275 1.00 0.00 N ATOM 388 CA LYS A 25 -7.978 15.654 -8.875 1.00 0.00 C ATOM 389 C LYS A 25 -7.129 15.428 -10.127 1.00 0.00 C ATOM 390 O LYS A 25 -7.336 16.074 -11.154 1.00 0.00 O ATOM 391 CB LYS A 25 -7.191 16.485 -7.850 1.00 0.00 C ATOM 392 CG LYS A 25 -6.744 17.850 -8.355 1.00 0.00 C ATOM 393 CD LYS A 25 -5.897 18.582 -7.320 1.00 0.00 C ATOM 394 CE LYS A 25 -6.683 18.871 -6.049 1.00 0.00 C ATOM 395 NZ LYS A 25 -5.875 19.616 -5.048 1.00 0.00 N ATOM 0 H LYS A 25 -8.083 14.271 -7.307 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.877 16.195 -9.170 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.809 16.624 -6.963 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.312 15.920 -7.541 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -6.171 17.729 -9.274 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.619 18.452 -8.601 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -5.021 17.981 -7.077 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.534 19.518 -7.744 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.573 19.449 -6.298 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -7.024 17.932 -5.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -6.450 19.791 -4.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -5.038 19.055 -4.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -5.571 20.524 -5.454 1.00 0.00 H new ATOM 409 N HIS A 26 -6.190 14.494 -10.041 1.00 0.00 N ATOM 410 CA HIS A 26 -5.281 14.225 -11.150 1.00 0.00 C ATOM 411 C HIS A 26 -5.784 13.080 -12.023 1.00 0.00 C ATOM 412 O HIS A 26 -5.066 12.624 -12.912 1.00 0.00 O ATOM 413 CB HIS A 26 -3.882 13.889 -10.631 1.00 0.00 C ATOM 414 CG HIS A 26 -3.116 15.075 -10.130 1.00 0.00 C ATOM 415 ND1 HIS A 26 -2.331 15.853 -10.948 1.00 0.00 N ATOM 416 CD2 HIS A 26 -2.998 15.602 -8.889 1.00 0.00 C ATOM 417 CE1 HIS A 26 -1.762 16.805 -10.234 1.00 0.00 C ATOM 418 NE2 HIS A 26 -2.148 16.676 -8.979 1.00 0.00 N ATOM 0 H HIS A 26 -6.038 13.911 -9.218 1.00 0.00 H new ATOM 0 HA HIS A 26 -5.237 15.130 -11.757 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.970 13.160 -9.826 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -3.314 13.414 -11.431 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -3.483 15.244 -7.993 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -1.092 17.563 -10.613 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -1.862 17.275 -8.204 1.00 0.00 H new ATOM 427 N ALA A 27 -7.009 12.620 -11.759 1.00 0.00 N ATOM 428 CA ALA A 27 -7.601 11.504 -12.498 1.00 0.00 C ATOM 429 C ALA A 27 -6.697 10.277 -12.425 1.00 0.00 C ATOM 430 O ALA A 27 -6.492 9.567 -13.417 1.00 0.00 O ATOM 431 CB ALA A 27 -7.867 11.901 -13.946 1.00 0.00 C ATOM 0 H ALA A 27 -7.613 13.007 -11.034 1.00 0.00 H new ATOM 0 HA ALA A 27 -8.556 11.250 -12.037 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -8.307 11.058 -14.479 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -8.555 12.746 -13.971 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -6.929 12.183 -14.424 1.00 0.00 H new ATOM 437 N ALA A 28 -6.166 10.031 -11.234 1.00 0.00 N ATOM 438 CA ALA A 28 -5.231 8.940 -11.016 1.00 0.00 C ATOM 439 C ALA A 28 -5.887 7.592 -11.281 1.00 0.00 C ATOM 440 O ALA A 28 -6.836 7.202 -10.597 1.00 0.00 O ATOM 441 CB ALA A 28 -4.677 8.993 -9.601 1.00 0.00 C ATOM 0 H ALA A 28 -6.371 10.579 -10.399 1.00 0.00 H new ATOM 0 HA ALA A 28 -4.407 9.056 -11.720 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -3.978 8.170 -9.453 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -4.160 9.940 -9.448 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -5.496 8.907 -8.886 1.00 0.00 H new ATOM 447 N SER A 29 -5.384 6.901 -12.293 1.00 0.00 N ATOM 448 CA SER A 29 -5.856 5.569 -12.636 1.00 0.00 C ATOM 449 C SER A 29 -5.584 4.590 -11.493 1.00 0.00 C ATOM 450 O SER A 29 -4.720 4.840 -10.650 1.00 0.00 O ATOM 451 CB SER A 29 -5.167 5.108 -13.923 1.00 0.00 C ATOM 452 OG SER A 29 -3.786 5.438 -13.912 1.00 0.00 O ATOM 0 H SER A 29 -4.639 7.247 -12.898 1.00 0.00 H new ATOM 0 HA SER A 29 -6.934 5.598 -12.797 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.285 4.030 -14.036 1.00 0.00 H new ATOM 0 HB3 SER A 29 -5.648 5.574 -14.783 1.00 0.00 H new ATOM 0 HG SER A 29 -3.370 5.131 -14.744 1.00 0.00 H new ATOM 458 N PRO A 30 -6.330 3.473 -11.436 1.00 0.00 N ATOM 459 CA PRO A 30 -6.158 2.451 -10.395 1.00 0.00 C ATOM 460 C PRO A 30 -4.704 2.017 -10.241 1.00 0.00 C ATOM 461 O PRO A 30 -4.188 1.918 -9.126 1.00 0.00 O ATOM 462 CB PRO A 30 -7.010 1.289 -10.902 1.00 0.00 C ATOM 463 CG PRO A 30 -8.065 1.931 -11.735 1.00 0.00 C ATOM 464 CD PRO A 30 -7.417 3.130 -12.372 1.00 0.00 C ATOM 0 HA PRO A 30 -6.450 2.817 -9.411 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -6.415 0.587 -11.487 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.445 0.727 -10.076 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -8.438 1.241 -12.492 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.918 2.227 -11.124 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -7.033 2.898 -13.365 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -8.122 3.953 -12.487 1.00 0.00 H new ATOM 472 N GLU A 31 -4.046 1.782 -11.369 1.00 0.00 N ATOM 473 CA GLU A 31 -2.651 1.362 -11.373 1.00 0.00 C ATOM 474 C GLU A 31 -1.752 2.452 -10.798 1.00 0.00 C ATOM 475 O GLU A 31 -0.887 2.177 -9.970 1.00 0.00 O ATOM 476 CB GLU A 31 -2.216 1.004 -12.791 1.00 0.00 C ATOM 477 CG GLU A 31 -2.978 -0.178 -13.364 1.00 0.00 C ATOM 478 CD GLU A 31 -2.617 -0.466 -14.803 1.00 0.00 C ATOM 479 OE1 GLU A 31 -1.537 -1.030 -15.049 1.00 0.00 O ATOM 480 OE2 GLU A 31 -3.423 -0.135 -15.697 1.00 0.00 O ATOM 0 H GLU A 31 -4.459 1.876 -12.297 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.555 0.479 -10.741 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -2.358 1.869 -13.438 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.150 0.777 -12.792 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.776 -1.062 -12.760 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -4.048 0.017 -13.295 1.00 0.00 H new ATOM 487 N LEU A 32 -1.975 3.691 -11.232 1.00 0.00 N ATOM 488 CA LEU A 32 -1.228 4.835 -10.715 1.00 0.00 C ATOM 489 C LEU A 32 -1.466 4.987 -9.215 1.00 0.00 C ATOM 490 O LEU A 32 -0.528 5.178 -8.444 1.00 0.00 O ATOM 491 CB LEU A 32 -1.641 6.115 -11.453 1.00 0.00 C ATOM 492 CG LEU A 32 -1.024 7.417 -10.925 1.00 0.00 C ATOM 493 CD1 LEU A 32 0.494 7.366 -10.993 1.00 0.00 C ATOM 494 CD2 LEU A 32 -1.546 8.610 -11.714 1.00 0.00 C ATOM 0 H LEU A 32 -2.668 3.928 -11.942 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.165 4.664 -10.883 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.374 6.008 -12.504 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.726 6.204 -11.407 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.316 7.530 -9.881 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.907 8.301 -10.613 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.858 6.536 -10.387 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.807 7.225 -12.027 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.099 9.526 -11.327 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.283 8.494 -12.765 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.630 8.666 -11.615 1.00 0.00 H new ATOM 506 N THR A 33 -2.724 4.874 -8.821 1.00 0.00 N ATOM 507 CA THR A 33 -3.119 4.971 -7.425 1.00 0.00 C ATOM 508 C THR A 33 -2.363 3.964 -6.558 1.00 0.00 C ATOM 509 O THR A 33 -1.757 4.321 -5.543 1.00 0.00 O ATOM 510 CB THR A 33 -4.633 4.721 -7.281 1.00 0.00 C ATOM 511 OG1 THR A 33 -5.367 5.720 -8.000 1.00 0.00 O ATOM 512 CG2 THR A 33 -5.055 4.720 -5.821 1.00 0.00 C ATOM 0 H THR A 33 -3.501 4.712 -9.461 1.00 0.00 H new ATOM 0 HA THR A 33 -2.874 5.977 -7.085 1.00 0.00 H new ATOM 0 HB THR A 33 -4.853 3.739 -7.699 1.00 0.00 H new ATOM 0 HG1 THR A 33 -5.246 5.585 -8.963 1.00 0.00 H new ATOM 0 HG21 THR A 33 -6.128 4.541 -5.753 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.521 3.933 -5.289 1.00 0.00 H new ATOM 0 HG23 THR A 33 -4.819 5.685 -5.373 1.00 0.00 H new ATOM 520 N LEU A 34 -2.388 2.708 -6.974 1.00 0.00 N ATOM 521 CA LEU A 34 -1.781 1.641 -6.198 1.00 0.00 C ATOM 522 C LEU A 34 -0.255 1.729 -6.263 1.00 0.00 C ATOM 523 O LEU A 34 0.438 1.372 -5.307 1.00 0.00 O ATOM 524 CB LEU A 34 -2.289 0.285 -6.700 1.00 0.00 C ATOM 525 CG LEU A 34 -1.952 -0.909 -5.811 1.00 0.00 C ATOM 526 CD1 LEU A 34 -3.142 -1.851 -5.716 1.00 0.00 C ATOM 527 CD2 LEU A 34 -0.742 -1.650 -6.356 1.00 0.00 C ATOM 0 H LEU A 34 -2.822 2.403 -7.845 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.068 1.748 -5.152 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.372 0.340 -6.811 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -1.876 0.106 -7.693 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.717 -0.540 -4.813 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -2.886 -2.697 -5.079 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -3.993 -1.320 -5.290 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.401 -2.212 -6.711 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.514 -2.499 -5.711 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.957 -2.007 -7.363 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.114 -0.976 -6.385 1.00 0.00 H new ATOM 539 N MET A 35 0.263 2.229 -7.380 1.00 0.00 N ATOM 540 CA MET A 35 1.699 2.442 -7.528 1.00 0.00 C ATOM 541 C MET A 35 2.164 3.550 -6.585 1.00 0.00 C ATOM 542 O MET A 35 3.258 3.487 -6.018 1.00 0.00 O ATOM 543 CB MET A 35 2.045 2.782 -8.986 1.00 0.00 C ATOM 544 CG MET A 35 3.538 2.916 -9.255 1.00 0.00 C ATOM 545 SD MET A 35 4.096 4.631 -9.295 1.00 0.00 S ATOM 546 CE MET A 35 3.279 5.209 -10.780 1.00 0.00 C ATOM 0 H MET A 35 -0.289 2.494 -8.196 1.00 0.00 H new ATOM 0 HA MET A 35 2.221 1.522 -7.264 1.00 0.00 H new ATOM 0 HB2 MET A 35 1.638 2.007 -9.635 1.00 0.00 H new ATOM 0 HB3 MET A 35 1.553 3.716 -9.257 1.00 0.00 H new ATOM 0 HG2 MET A 35 4.090 2.378 -8.484 1.00 0.00 H new ATOM 0 HG3 MET A 35 3.774 2.441 -10.207 1.00 0.00 H new ATOM 0 HE1 MET A 35 3.141 6.289 -10.722 1.00 0.00 H new ATOM 0 HE2 MET A 35 3.891 4.968 -11.649 1.00 0.00 H new ATOM 0 HE3 MET A 35 2.308 4.723 -10.874 1.00 0.00 H new ATOM 556 N ILE A 36 1.316 4.555 -6.406 1.00 0.00 N ATOM 557 CA ILE A 36 1.568 5.617 -5.441 1.00 0.00 C ATOM 558 C ILE A 36 1.661 5.043 -4.028 1.00 0.00 C ATOM 559 O ILE A 36 2.577 5.374 -3.275 1.00 0.00 O ATOM 560 CB ILE A 36 0.467 6.702 -5.508 1.00 0.00 C ATOM 561 CG1 ILE A 36 0.660 7.559 -6.761 1.00 0.00 C ATOM 562 CG2 ILE A 36 0.460 7.564 -4.250 1.00 0.00 C ATOM 563 CD1 ILE A 36 -0.377 8.647 -6.927 1.00 0.00 C ATOM 0 H ILE A 36 0.441 4.657 -6.921 1.00 0.00 H new ATOM 0 HA ILE A 36 2.520 6.083 -5.694 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.503 6.208 -5.566 1.00 0.00 H new ATOM 0 HG12 ILE A 36 1.649 8.016 -6.728 1.00 0.00 H new ATOM 0 HG13 ILE A 36 0.637 6.912 -7.638 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -0.325 8.316 -4.329 1.00 0.00 H new ATOM 0 HG22 ILE A 36 0.274 6.935 -3.379 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.426 8.057 -4.142 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -0.171 9.210 -7.838 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.368 8.198 -6.994 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.340 9.319 -6.069 1.00 0.00 H new ATOM 575 N ALA A 37 0.722 4.166 -3.685 1.00 0.00 N ATOM 576 CA ALA A 37 0.729 3.504 -2.385 1.00 0.00 C ATOM 577 C ALA A 37 2.023 2.723 -2.187 1.00 0.00 C ATOM 578 O ALA A 37 2.603 2.723 -1.099 1.00 0.00 O ATOM 579 CB ALA A 37 -0.477 2.585 -2.255 1.00 0.00 C ATOM 0 H ALA A 37 -0.054 3.897 -4.290 1.00 0.00 H new ATOM 0 HA ALA A 37 0.670 4.266 -1.608 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -0.459 2.097 -1.280 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.392 3.169 -2.352 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -0.445 1.829 -3.040 1.00 0.00 H new ATOM 585 N GLY A 38 2.471 2.069 -3.254 1.00 0.00 N ATOM 586 CA GLY A 38 3.730 1.354 -3.222 1.00 0.00 C ATOM 587 C GLY A 38 4.895 2.276 -2.943 1.00 0.00 C ATOM 588 O GLY A 38 5.766 1.955 -2.132 1.00 0.00 O ATOM 0 H GLY A 38 1.979 2.023 -4.146 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.688 0.580 -2.456 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.886 0.850 -4.176 1.00 0.00 H new ATOM 592 N ASN A 39 4.904 3.425 -3.607 1.00 0.00 N ATOM 593 CA ASN A 39 5.937 4.434 -3.385 1.00 0.00 C ATOM 594 C ASN A 39 5.933 4.893 -1.936 1.00 0.00 C ATOM 595 O ASN A 39 6.983 4.957 -1.301 1.00 0.00 O ATOM 596 CB ASN A 39 5.743 5.639 -4.312 1.00 0.00 C ATOM 597 CG ASN A 39 6.379 5.443 -5.676 1.00 0.00 C ATOM 598 OD1 ASN A 39 7.533 5.810 -5.894 1.00 0.00 O ATOM 599 ND2 ASN A 39 5.635 4.860 -6.601 1.00 0.00 N ATOM 0 H ASN A 39 4.207 3.684 -4.305 1.00 0.00 H new ATOM 0 HA ASN A 39 6.900 3.976 -3.611 1.00 0.00 H new ATOM 0 HB2 ASN A 39 4.677 5.827 -4.437 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.169 6.525 -3.842 1.00 0.00 H new ATOM 0 HD21 ASN A 39 6.014 4.700 -7.534 1.00 0.00 H new ATOM 0 HD22 ASN A 39 4.682 4.570 -6.381 1.00 0.00 H new ATOM 606 N ILE A 40 4.742 5.188 -1.417 1.00 0.00 N ATOM 607 CA ILE A 40 4.585 5.618 -0.031 1.00 0.00 C ATOM 608 C ILE A 40 5.233 4.621 0.926 1.00 0.00 C ATOM 609 O ILE A 40 6.144 4.974 1.675 1.00 0.00 O ATOM 610 CB ILE A 40 3.094 5.786 0.348 1.00 0.00 C ATOM 611 CG1 ILE A 40 2.440 6.884 -0.496 1.00 0.00 C ATOM 612 CG2 ILE A 40 2.955 6.110 1.829 1.00 0.00 C ATOM 613 CD1 ILE A 40 0.951 7.035 -0.249 1.00 0.00 C ATOM 0 H ILE A 40 3.868 5.136 -1.940 1.00 0.00 H new ATOM 0 HA ILE A 40 5.082 6.584 0.058 1.00 0.00 H new ATOM 0 HB ILE A 40 2.584 4.844 0.145 1.00 0.00 H new ATOM 0 HG12 ILE A 40 2.933 7.833 -0.286 1.00 0.00 H new ATOM 0 HG13 ILE A 40 2.604 6.666 -1.551 1.00 0.00 H new ATOM 0 HG21 ILE A 40 1.900 6.225 2.079 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.382 5.300 2.420 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.483 7.038 2.050 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.556 7.831 -0.881 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.446 6.099 -0.486 1.00 0.00 H new ATOM 0 HD13 ILE A 40 0.779 7.285 0.798 1.00 0.00 H new ATOM 625 N ALA A 41 4.776 3.375 0.875 1.00 0.00 N ATOM 626 CA ALA A 41 5.281 2.335 1.761 1.00 0.00 C ATOM 627 C ALA A 41 6.788 2.161 1.608 1.00 0.00 C ATOM 628 O ALA A 41 7.521 2.115 2.597 1.00 0.00 O ATOM 629 CB ALA A 41 4.571 1.018 1.488 1.00 0.00 C ATOM 0 H ALA A 41 4.054 3.061 0.227 1.00 0.00 H new ATOM 0 HA ALA A 41 5.079 2.642 2.787 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.959 0.250 2.157 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.501 1.140 1.656 1.00 0.00 H new ATOM 0 HB3 ALA A 41 4.744 0.719 0.454 1.00 0.00 H new ATOM 635 N THR A 42 7.241 2.088 0.364 1.00 0.00 N ATOM 636 CA THR A 42 8.653 1.888 0.072 1.00 0.00 C ATOM 637 C THR A 42 9.503 3.051 0.597 1.00 0.00 C ATOM 638 O THR A 42 10.566 2.839 1.185 1.00 0.00 O ATOM 639 CB THR A 42 8.879 1.722 -1.443 1.00 0.00 C ATOM 640 OG1 THR A 42 8.082 0.640 -1.936 1.00 0.00 O ATOM 641 CG2 THR A 42 10.342 1.458 -1.758 1.00 0.00 C ATOM 0 H THR A 42 6.648 2.165 -0.462 1.00 0.00 H new ATOM 0 HA THR A 42 8.964 0.976 0.581 1.00 0.00 H new ATOM 0 HB THR A 42 8.586 2.651 -1.931 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.209 0.981 -2.222 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.468 1.346 -2.835 1.00 0.00 H new ATOM 0 HG22 THR A 42 10.946 2.295 -1.407 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.663 0.544 -1.258 1.00 0.00 H new ATOM 649 N ASN A 43 9.023 4.276 0.403 1.00 0.00 N ATOM 650 CA ASN A 43 9.755 5.460 0.844 1.00 0.00 C ATOM 651 C ASN A 43 9.835 5.515 2.364 1.00 0.00 C ATOM 652 O ASN A 43 10.857 5.912 2.921 1.00 0.00 O ATOM 653 CB ASN A 43 9.111 6.745 0.305 1.00 0.00 C ATOM 654 CG ASN A 43 9.458 7.028 -1.151 1.00 0.00 C ATOM 655 OD1 ASN A 43 9.549 8.181 -1.562 1.00 0.00 O ATOM 656 ND2 ASN A 43 9.647 5.982 -1.945 1.00 0.00 N ATOM 0 H ASN A 43 8.134 4.475 -0.055 1.00 0.00 H new ATOM 0 HA ASN A 43 10.766 5.387 0.443 1.00 0.00 H new ATOM 0 HB2 ASN A 43 8.028 6.670 0.405 1.00 0.00 H new ATOM 0 HB3 ASN A 43 9.430 7.588 0.918 1.00 0.00 H new ATOM 0 HD21 ASN A 43 9.875 6.123 -2.929 1.00 0.00 H new ATOM 0 HD22 ASN A 43 9.564 5.037 -1.571 1.00 0.00 H new ATOM 663 N VAL A 44 8.761 5.107 3.032 1.00 0.00 N ATOM 664 CA VAL A 44 8.742 5.061 4.488 1.00 0.00 C ATOM 665 C VAL A 44 9.731 4.021 5.000 1.00 0.00 C ATOM 666 O VAL A 44 10.558 4.316 5.858 1.00 0.00 O ATOM 667 CB VAL A 44 7.334 4.747 5.038 1.00 0.00 C ATOM 668 CG1 VAL A 44 7.367 4.584 6.550 1.00 0.00 C ATOM 669 CG2 VAL A 44 6.355 5.841 4.647 1.00 0.00 C ATOM 0 H VAL A 44 7.894 4.804 2.588 1.00 0.00 H new ATOM 0 HA VAL A 44 9.031 6.050 4.844 1.00 0.00 H new ATOM 0 HB VAL A 44 7.001 3.806 4.600 1.00 0.00 H new ATOM 0 HG11 VAL A 44 6.364 4.363 6.914 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.037 3.765 6.813 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.724 5.506 7.008 1.00 0.00 H new ATOM 0 HG21 VAL A 44 5.367 5.604 5.043 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.691 6.793 5.057 1.00 0.00 H new ATOM 0 HG23 VAL A 44 6.303 5.912 3.561 1.00 0.00 H new ATOM 679 N LEU A 45 9.657 2.816 4.442 1.00 0.00 N ATOM 680 CA LEU A 45 10.521 1.715 4.860 1.00 0.00 C ATOM 681 C LEU A 45 11.999 2.066 4.705 1.00 0.00 C ATOM 682 O LEU A 45 12.804 1.826 5.607 1.00 0.00 O ATOM 683 CB LEU A 45 10.214 0.451 4.052 1.00 0.00 C ATOM 684 CG LEU A 45 8.844 -0.176 4.312 1.00 0.00 C ATOM 685 CD1 LEU A 45 8.596 -1.334 3.357 1.00 0.00 C ATOM 686 CD2 LEU A 45 8.747 -0.647 5.753 1.00 0.00 C ATOM 0 H LEU A 45 9.004 2.576 3.696 1.00 0.00 H new ATOM 0 HA LEU A 45 10.318 1.533 5.915 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.290 0.691 2.991 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.982 -0.292 4.266 1.00 0.00 H new ATOM 0 HG LEU A 45 8.078 0.580 4.139 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.616 -1.767 3.557 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.629 -0.972 2.329 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.365 -2.094 3.499 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.767 -1.091 5.925 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.521 -1.390 5.946 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.883 0.202 6.423 1.00 0.00 H new ATOM 698 N ASN A 46 12.352 2.639 3.567 1.00 0.00 N ATOM 699 CA ASN A 46 13.749 2.911 3.263 1.00 0.00 C ATOM 700 C ASN A 46 14.260 4.146 4.003 1.00 0.00 C ATOM 701 O ASN A 46 15.464 4.287 4.221 1.00 0.00 O ATOM 702 CB ASN A 46 13.952 3.077 1.754 1.00 0.00 C ATOM 703 CG ASN A 46 13.664 1.801 0.981 1.00 0.00 C ATOM 704 OD1 ASN A 46 13.797 0.697 1.506 1.00 0.00 O ATOM 705 ND2 ASN A 46 13.280 1.943 -0.278 1.00 0.00 N ATOM 0 H ASN A 46 11.695 2.924 2.841 1.00 0.00 H new ATOM 0 HA ASN A 46 14.328 2.054 3.606 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.302 3.873 1.389 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.978 3.390 1.562 1.00 0.00 H new ATOM 0 HD21 ASN A 46 13.083 1.120 -0.847 1.00 0.00 H new ATOM 0 HD22 ASN A 46 13.181 2.876 -0.679 1.00 0.00 H new ATOM 712 N GLN A 47 13.356 5.034 4.402 1.00 0.00 N ATOM 713 CA GLN A 47 13.762 6.266 5.075 1.00 0.00 C ATOM 714 C GLN A 47 13.448 6.250 6.573 1.00 0.00 C ATOM 715 O GLN A 47 14.356 6.153 7.399 1.00 0.00 O ATOM 716 CB GLN A 47 13.108 7.486 4.421 1.00 0.00 C ATOM 717 CG GLN A 47 13.757 7.903 3.108 1.00 0.00 C ATOM 718 CD GLN A 47 13.093 9.120 2.490 1.00 0.00 C ATOM 719 OE1 GLN A 47 13.746 9.932 1.834 1.00 0.00 O ATOM 720 NE2 GLN A 47 11.787 9.250 2.679 1.00 0.00 N ATOM 0 H GLN A 47 12.350 4.928 4.274 1.00 0.00 H new ATOM 0 HA GLN A 47 14.845 6.333 4.967 1.00 0.00 H new ATOM 0 HB2 GLN A 47 12.055 7.269 4.242 1.00 0.00 H new ATOM 0 HB3 GLN A 47 13.147 8.324 5.117 1.00 0.00 H new ATOM 0 HG2 GLN A 47 14.812 8.117 3.280 1.00 0.00 H new ATOM 0 HG3 GLN A 47 13.711 7.072 2.404 1.00 0.00 H new ATOM 0 HE21 GLN A 47 11.280 8.557 3.229 1.00 0.00 H new ATOM 0 HE22 GLN A 47 11.290 10.043 2.275 1.00 0.00 H new ATOM 729 N ARG A 48 12.171 6.335 6.927 1.00 0.00 N ATOM 730 CA ARG A 48 11.794 6.570 8.317 1.00 0.00 C ATOM 731 C ARG A 48 11.093 5.363 8.936 1.00 0.00 C ATOM 732 O ARG A 48 9.864 5.330 9.039 1.00 0.00 O ATOM 733 CB ARG A 48 10.897 7.806 8.431 1.00 0.00 C ATOM 734 CG ARG A 48 11.435 9.027 7.705 1.00 0.00 C ATOM 735 CD ARG A 48 10.630 10.271 8.040 1.00 0.00 C ATOM 736 NE ARG A 48 10.918 10.758 9.389 1.00 0.00 N ATOM 737 CZ ARG A 48 10.134 11.592 10.074 1.00 0.00 C ATOM 738 NH1 ARG A 48 8.973 11.996 9.572 1.00 0.00 N ATOM 739 NH2 ARG A 48 10.512 12.013 11.275 1.00 0.00 N ATOM 0 H ARG A 48 11.387 6.246 6.280 1.00 0.00 H new ATOM 0 HA ARG A 48 12.717 6.739 8.872 1.00 0.00 H new ATOM 0 HB2 ARG A 48 9.911 7.565 8.034 1.00 0.00 H new ATOM 0 HB3 ARG A 48 10.765 8.051 9.485 1.00 0.00 H new ATOM 0 HG2 ARG A 48 12.479 9.183 7.977 1.00 0.00 H new ATOM 0 HG3 ARG A 48 11.408 8.853 6.629 1.00 0.00 H new ATOM 0 HD2 ARG A 48 10.853 11.054 7.316 1.00 0.00 H new ATOM 0 HD3 ARG A 48 9.566 10.050 7.953 1.00 0.00 H new ATOM 0 HE ARG A 48 11.777 10.438 9.836 1.00 0.00 H new ATOM 0 HH11 ARG A 48 8.673 11.668 8.654 1.00 0.00 H new ATOM 0 HH12 ARG A 48 8.381 12.634 10.105 1.00 0.00 H new ATOM 0 HH21 ARG A 48 11.398 11.699 11.670 1.00 0.00 H new ATOM 0 HH22 ARG A 48 9.916 12.651 11.803 1.00 0.00 H new ATOM 753 N VAL A 49 11.883 4.374 9.329 1.00 0.00 N ATOM 754 CA VAL A 49 11.387 3.224 10.073 1.00 0.00 C ATOM 755 C VAL A 49 12.574 2.380 10.526 1.00 0.00 C ATOM 756 O VAL A 49 13.667 2.495 9.965 1.00 0.00 O ATOM 757 CB VAL A 49 10.399 2.357 9.246 1.00 0.00 C ATOM 758 CG1 VAL A 49 11.129 1.472 8.248 1.00 0.00 C ATOM 759 CG2 VAL A 49 9.512 1.520 10.156 1.00 0.00 C ATOM 0 H VAL A 49 12.885 4.346 9.141 1.00 0.00 H new ATOM 0 HA VAL A 49 10.831 3.596 10.934 1.00 0.00 H new ATOM 0 HB VAL A 49 9.764 3.040 8.682 1.00 0.00 H new ATOM 0 HG11 VAL A 49 10.405 0.880 7.688 1.00 0.00 H new ATOM 0 HG12 VAL A 49 11.699 2.095 7.559 1.00 0.00 H new ATOM 0 HG13 VAL A 49 11.807 0.806 8.781 1.00 0.00 H new ATOM 0 HG21 VAL A 49 8.830 0.923 9.551 1.00 0.00 H new ATOM 0 HG22 VAL A 49 10.132 0.860 10.762 1.00 0.00 H new ATOM 0 HG23 VAL A 49 8.937 2.177 10.808 1.00 0.00 H new ATOM 769 N ALA A 50 12.369 1.553 11.540 1.00 0.00 N ATOM 770 CA ALA A 50 13.441 0.724 12.068 1.00 0.00 C ATOM 771 C ALA A 50 13.866 -0.319 11.041 1.00 0.00 C ATOM 772 O ALA A 50 13.036 -1.072 10.538 1.00 0.00 O ATOM 773 CB ALA A 50 13.012 0.055 13.368 1.00 0.00 C ATOM 0 H ALA A 50 11.472 1.438 12.013 1.00 0.00 H new ATOM 0 HA ALA A 50 14.297 1.364 12.281 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.828 -0.561 13.747 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.761 0.818 14.105 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.140 -0.572 13.184 1.00 0.00 H new ATOM 779 N ALA A 51 15.157 -0.341 10.722 1.00 0.00 N ATOM 780 CA ALA A 51 15.708 -1.304 9.770 1.00 0.00 C ATOM 781 C ALA A 51 15.386 -2.739 10.181 1.00 0.00 C ATOM 782 O ALA A 51 15.091 -3.581 9.336 1.00 0.00 O ATOM 783 CB ALA A 51 17.212 -1.112 9.648 1.00 0.00 C ATOM 0 H ALA A 51 15.847 0.302 11.112 1.00 0.00 H new ATOM 0 HA ALA A 51 15.245 -1.125 8.800 1.00 0.00 H new ATOM 0 HB1 ALA A 51 17.614 -1.833 8.937 1.00 0.00 H new ATOM 0 HB2 ALA A 51 17.423 -0.101 9.298 1.00 0.00 H new ATOM 0 HB3 ALA A 51 17.678 -1.263 10.622 1.00 0.00 H new ATOM 789 N SER A 52 15.421 -3.000 11.481 1.00 0.00 N ATOM 790 CA SER A 52 15.119 -4.323 12.013 1.00 0.00 C ATOM 791 C SER A 52 13.621 -4.611 11.949 1.00 0.00 C ATOM 792 O SER A 52 13.191 -5.761 12.043 1.00 0.00 O ATOM 793 CB SER A 52 15.615 -4.405 13.456 1.00 0.00 C ATOM 794 OG SER A 52 15.315 -3.202 14.148 1.00 0.00 O ATOM 0 H SER A 52 15.657 -2.307 12.192 1.00 0.00 H new ATOM 0 HA SER A 52 15.626 -5.074 11.407 1.00 0.00 H new ATOM 0 HB2 SER A 52 15.147 -5.250 13.961 1.00 0.00 H new ATOM 0 HB3 SER A 52 16.691 -4.582 13.469 1.00 0.00 H new ATOM 0 HG SER A 52 15.636 -3.267 15.072 1.00 0.00 H new ATOM 800 N GLN A 53 12.834 -3.561 11.777 1.00 0.00 N ATOM 801 CA GLN A 53 11.386 -3.688 11.740 1.00 0.00 C ATOM 802 C GLN A 53 10.890 -3.741 10.301 1.00 0.00 C ATOM 803 O GLN A 53 9.753 -4.112 10.058 1.00 0.00 O ATOM 804 CB GLN A 53 10.740 -2.508 12.475 1.00 0.00 C ATOM 805 CG GLN A 53 9.235 -2.635 12.678 1.00 0.00 C ATOM 806 CD GLN A 53 8.834 -3.841 13.514 1.00 0.00 C ATOM 807 OE1 GLN A 53 7.753 -4.402 13.332 1.00 0.00 O ATOM 808 NE2 GLN A 53 9.691 -4.240 14.444 1.00 0.00 N ATOM 0 H GLN A 53 13.176 -2.607 11.660 1.00 0.00 H new ATOM 0 HA GLN A 53 11.105 -4.617 12.237 1.00 0.00 H new ATOM 0 HB2 GLN A 53 11.217 -2.398 13.449 1.00 0.00 H new ATOM 0 HB3 GLN A 53 10.942 -1.594 11.916 1.00 0.00 H new ATOM 0 HG2 GLN A 53 8.864 -1.730 13.159 1.00 0.00 H new ATOM 0 HG3 GLN A 53 8.749 -2.700 11.704 1.00 0.00 H new ATOM 0 HE21 GLN A 53 10.577 -3.750 14.565 1.00 0.00 H new ATOM 0 HE22 GLN A 53 9.464 -5.037 15.038 1.00 0.00 H new ATOM 817 N ARG A 54 11.759 -3.385 9.358 1.00 0.00 N ATOM 818 CA ARG A 54 11.384 -3.281 7.947 1.00 0.00 C ATOM 819 C ARG A 54 10.694 -4.543 7.438 1.00 0.00 C ATOM 820 O ARG A 54 9.538 -4.495 7.021 1.00 0.00 O ATOM 821 CB ARG A 54 12.611 -2.980 7.082 1.00 0.00 C ATOM 822 CG ARG A 54 13.111 -1.551 7.211 1.00 0.00 C ATOM 823 CD ARG A 54 14.366 -1.322 6.384 1.00 0.00 C ATOM 824 NE ARG A 54 14.730 0.094 6.329 1.00 0.00 N ATOM 825 CZ ARG A 54 15.959 0.545 6.088 1.00 0.00 C ATOM 826 NH1 ARG A 54 16.962 -0.316 5.934 1.00 0.00 N ATOM 827 NH2 ARG A 54 16.180 1.854 6.006 1.00 0.00 N ATOM 0 H ARG A 54 12.736 -3.162 9.546 1.00 0.00 H new ATOM 0 HA ARG A 54 10.674 -2.458 7.870 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.415 -3.663 7.356 1.00 0.00 H new ATOM 0 HB3 ARG A 54 12.367 -3.178 6.038 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.331 -0.861 6.889 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.319 -1.330 8.258 1.00 0.00 H new ATOM 0 HD2 ARG A 54 15.191 -1.893 6.810 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.208 -1.696 5.373 1.00 0.00 H new ATOM 0 HE ARG A 54 13.993 0.781 6.486 1.00 0.00 H new ATOM 0 HH11 ARG A 54 16.788 -1.319 6.001 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.905 0.027 5.749 1.00 0.00 H new ATOM 0 HH21 ARG A 54 15.409 2.510 6.128 1.00 0.00 H new ATOM 0 HH22 ARG A 54 17.121 2.202 5.821 1.00 0.00 H new ATOM 841 N LYS A 55 11.404 -5.665 7.470 1.00 0.00 N ATOM 842 CA LYS A 55 10.856 -6.932 7.000 1.00 0.00 C ATOM 843 C LYS A 55 9.576 -7.294 7.750 1.00 0.00 C ATOM 844 O LYS A 55 8.583 -7.697 7.142 1.00 0.00 O ATOM 845 CB LYS A 55 11.890 -8.049 7.157 1.00 0.00 C ATOM 846 CG LYS A 55 11.353 -9.432 6.824 1.00 0.00 C ATOM 847 CD LYS A 55 10.864 -9.519 5.388 1.00 0.00 C ATOM 848 CE LYS A 55 10.113 -10.816 5.138 1.00 0.00 C ATOM 849 NZ LYS A 55 10.976 -12.011 5.341 1.00 0.00 N ATOM 0 H LYS A 55 12.361 -5.723 7.817 1.00 0.00 H new ATOM 0 HA LYS A 55 10.610 -6.819 5.944 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.743 -7.835 6.513 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.258 -8.049 8.183 1.00 0.00 H new ATOM 0 HG2 LYS A 55 12.135 -10.174 6.987 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.535 -9.677 7.502 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.213 -8.672 5.171 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.713 -9.451 4.708 1.00 0.00 H new ATOM 0 HE2 LYS A 55 9.254 -10.872 5.807 1.00 0.00 H new ATOM 0 HE3 LYS A 55 9.724 -10.819 4.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 10.455 -12.867 5.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 11.833 -11.923 4.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.244 -12.080 6.344 1.00 0.00 H new ATOM 863 N LEU A 56 9.600 -7.133 9.065 1.00 0.00 N ATOM 864 CA LEU A 56 8.458 -7.483 9.902 1.00 0.00 C ATOM 865 C LEU A 56 7.237 -6.643 9.564 1.00 0.00 C ATOM 866 O LEU A 56 6.158 -7.172 9.324 1.00 0.00 O ATOM 867 CB LEU A 56 8.799 -7.308 11.379 1.00 0.00 C ATOM 868 CG LEU A 56 9.744 -8.355 11.957 1.00 0.00 C ATOM 869 CD1 LEU A 56 10.026 -8.061 13.421 1.00 0.00 C ATOM 870 CD2 LEU A 56 9.146 -9.744 11.793 1.00 0.00 C ATOM 0 H LEU A 56 10.399 -6.761 9.578 1.00 0.00 H new ATOM 0 HA LEU A 56 8.224 -8.529 9.704 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.245 -6.323 11.518 1.00 0.00 H new ATOM 0 HB3 LEU A 56 7.873 -7.322 11.953 1.00 0.00 H new ATOM 0 HG LEU A 56 10.688 -8.318 11.414 1.00 0.00 H new ATOM 0 HD11 LEU A 56 10.702 -8.817 13.820 1.00 0.00 H new ATOM 0 HD12 LEU A 56 10.487 -7.077 13.512 1.00 0.00 H new ATOM 0 HD13 LEU A 56 9.092 -8.077 13.982 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.828 -10.485 12.209 1.00 0.00 H new ATOM 0 HD22 LEU A 56 8.192 -9.794 12.318 1.00 0.00 H new ATOM 0 HD23 LEU A 56 8.988 -9.950 10.734 1.00 0.00 H new ATOM 882 N ILE A 57 7.417 -5.334 9.528 1.00 0.00 N ATOM 883 CA ILE A 57 6.307 -4.420 9.335 1.00 0.00 C ATOM 884 C ILE A 57 5.805 -4.471 7.890 1.00 0.00 C ATOM 885 O ILE A 57 4.651 -4.150 7.617 1.00 0.00 O ATOM 886 CB ILE A 57 6.696 -2.981 9.757 1.00 0.00 C ATOM 887 CG1 ILE A 57 5.450 -2.139 10.014 1.00 0.00 C ATOM 888 CG2 ILE A 57 7.581 -2.315 8.710 1.00 0.00 C ATOM 889 CD1 ILE A 57 5.741 -0.865 10.775 1.00 0.00 C ATOM 0 H ILE A 57 8.325 -4.880 9.630 1.00 0.00 H new ATOM 0 HA ILE A 57 5.486 -4.737 9.978 1.00 0.00 H new ATOM 0 HB ILE A 57 7.266 -3.051 10.683 1.00 0.00 H new ATOM 0 HG12 ILE A 57 4.986 -1.887 9.060 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.727 -2.732 10.574 1.00 0.00 H new ATOM 0 HG21 ILE A 57 7.836 -1.307 9.037 1.00 0.00 H new ATOM 0 HG22 ILE A 57 8.494 -2.897 8.582 1.00 0.00 H new ATOM 0 HG23 ILE A 57 7.047 -2.265 7.761 1.00 0.00 H new ATOM 0 HD11 ILE A 57 4.814 -0.311 10.926 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.178 -1.111 11.743 1.00 0.00 H new ATOM 0 HD13 ILE A 57 6.441 -0.253 10.206 1.00 0.00 H new ATOM 901 N ALA A 58 6.666 -4.907 6.974 1.00 0.00 N ATOM 902 CA ALA A 58 6.257 -5.138 5.594 1.00 0.00 C ATOM 903 C ALA A 58 5.453 -6.432 5.499 1.00 0.00 C ATOM 904 O ALA A 58 4.501 -6.534 4.725 1.00 0.00 O ATOM 905 CB ALA A 58 7.467 -5.188 4.673 1.00 0.00 C ATOM 0 H ALA A 58 7.648 -5.107 7.163 1.00 0.00 H new ATOM 0 HA ALA A 58 5.626 -4.309 5.274 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.138 -5.361 3.649 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.004 -4.241 4.726 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.127 -5.998 4.984 1.00 0.00 H new ATOM 911 N GLU A 59 5.848 -7.415 6.302 1.00 0.00 N ATOM 912 CA GLU A 59 5.101 -8.661 6.434 1.00 0.00 C ATOM 913 C GLU A 59 3.718 -8.373 7.014 1.00 0.00 C ATOM 914 O GLU A 59 2.702 -8.828 6.487 1.00 0.00 O ATOM 915 CB GLU A 59 5.879 -9.636 7.329 1.00 0.00 C ATOM 916 CG GLU A 59 5.114 -10.892 7.719 1.00 0.00 C ATOM 917 CD GLU A 59 4.852 -10.971 9.211 1.00 0.00 C ATOM 918 OE1 GLU A 59 5.728 -11.480 9.953 1.00 0.00 O ATOM 919 OE2 GLU A 59 3.779 -10.517 9.656 1.00 0.00 O ATOM 0 H GLU A 59 6.690 -7.371 6.876 1.00 0.00 H new ATOM 0 HA GLU A 59 4.974 -9.119 5.453 1.00 0.00 H new ATOM 0 HB2 GLU A 59 6.793 -9.930 6.814 1.00 0.00 H new ATOM 0 HB3 GLU A 59 6.179 -9.113 8.237 1.00 0.00 H new ATOM 0 HG2 GLU A 59 4.164 -10.916 7.185 1.00 0.00 H new ATOM 0 HG3 GLU A 59 5.679 -11.770 7.405 1.00 0.00 H new ATOM 926 N LYS A 60 3.700 -7.596 8.090 1.00 0.00 N ATOM 927 CA LYS A 60 2.459 -7.167 8.725 1.00 0.00 C ATOM 928 C LYS A 60 1.600 -6.390 7.733 1.00 0.00 C ATOM 929 O LYS A 60 0.384 -6.568 7.678 1.00 0.00 O ATOM 930 CB LYS A 60 2.763 -6.289 9.940 1.00 0.00 C ATOM 931 CG LYS A 60 3.640 -6.972 10.975 1.00 0.00 C ATOM 932 CD LYS A 60 4.090 -6.005 12.056 1.00 0.00 C ATOM 933 CE LYS A 60 5.115 -6.642 12.977 1.00 0.00 C ATOM 934 NZ LYS A 60 5.485 -5.743 14.101 1.00 0.00 N ATOM 0 H LYS A 60 4.542 -7.246 8.546 1.00 0.00 H new ATOM 0 HA LYS A 60 1.914 -8.052 9.052 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.254 -5.375 9.605 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.825 -5.993 10.409 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.091 -7.797 11.430 1.00 0.00 H new ATOM 0 HG3 LYS A 60 4.513 -7.402 10.485 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.517 -5.114 11.595 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.227 -5.680 12.638 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.715 -7.575 13.375 1.00 0.00 H new ATOM 0 HE3 LYS A 60 6.008 -6.896 12.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.823 -6.312 14.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 6.238 -5.095 13.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.653 -5.192 14.394 1.00 0.00 H new ATOM 948 N PHE A 61 2.253 -5.532 6.958 1.00 0.00 N ATOM 949 CA PHE A 61 1.592 -4.754 5.917 1.00 0.00 C ATOM 950 C PHE A 61 0.917 -5.674 4.902 1.00 0.00 C ATOM 951 O PHE A 61 -0.286 -5.578 4.667 1.00 0.00 O ATOM 952 CB PHE A 61 2.621 -3.858 5.218 1.00 0.00 C ATOM 953 CG PHE A 61 2.066 -3.022 4.101 1.00 0.00 C ATOM 954 CD1 PHE A 61 1.461 -1.808 4.365 1.00 0.00 C ATOM 955 CD2 PHE A 61 2.160 -3.445 2.784 1.00 0.00 C ATOM 956 CE1 PHE A 61 0.957 -1.031 3.340 1.00 0.00 C ATOM 957 CE2 PHE A 61 1.660 -2.673 1.756 1.00 0.00 C ATOM 958 CZ PHE A 61 1.057 -1.465 2.034 1.00 0.00 C ATOM 0 H PHE A 61 3.255 -5.356 7.033 1.00 0.00 H new ATOM 0 HA PHE A 61 0.823 -4.132 6.375 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.071 -3.198 5.959 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.420 -4.485 4.822 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.381 -1.462 5.385 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.631 -4.391 2.560 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.485 -0.085 3.561 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.741 -3.015 0.735 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.664 -0.859 1.231 1.00 0.00 H new ATOM 968 N ALA A 62 1.701 -6.573 4.319 1.00 0.00 N ATOM 969 CA ALA A 62 1.195 -7.516 3.329 1.00 0.00 C ATOM 970 C ALA A 62 0.063 -8.356 3.908 1.00 0.00 C ATOM 971 O ALA A 62 -0.962 -8.572 3.259 1.00 0.00 O ATOM 972 CB ALA A 62 2.322 -8.412 2.834 1.00 0.00 C ATOM 0 H ALA A 62 2.697 -6.669 4.517 1.00 0.00 H new ATOM 0 HA ALA A 62 0.799 -6.950 2.486 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.932 -9.112 2.095 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.100 -7.800 2.379 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.741 -8.967 3.673 1.00 0.00 H new ATOM 978 N GLN A 63 0.249 -8.812 5.139 1.00 0.00 N ATOM 979 CA GLN A 63 -0.751 -9.623 5.814 1.00 0.00 C ATOM 980 C GLN A 63 -2.027 -8.820 6.057 1.00 0.00 C ATOM 981 O GLN A 63 -3.126 -9.357 5.962 1.00 0.00 O ATOM 982 CB GLN A 63 -0.197 -10.165 7.133 1.00 0.00 C ATOM 983 CG GLN A 63 -1.149 -11.105 7.857 1.00 0.00 C ATOM 984 CD GLN A 63 -0.508 -11.785 9.050 1.00 0.00 C ATOM 985 OE1 GLN A 63 -0.873 -12.904 9.412 1.00 0.00 O ATOM 986 NE2 GLN A 63 0.463 -11.126 9.658 1.00 0.00 N ATOM 0 H GLN A 63 1.087 -8.632 5.691 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.999 -10.467 5.170 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.738 -10.690 6.936 1.00 0.00 H new ATOM 0 HB3 GLN A 63 0.040 -9.327 7.789 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -2.023 -10.545 8.190 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.504 -11.864 7.159 1.00 0.00 H new ATOM 0 HE21 GLN A 63 0.736 -10.201 9.327 1.00 0.00 H new ATOM 0 HE22 GLN A 63 0.939 -11.543 10.458 1.00 0.00 H new ATOM 995 N ALA A 64 -1.876 -7.531 6.357 1.00 0.00 N ATOM 996 CA ALA A 64 -3.023 -6.649 6.555 1.00 0.00 C ATOM 997 C ALA A 64 -3.841 -6.539 5.276 1.00 0.00 C ATOM 998 O ALA A 64 -5.069 -6.632 5.305 1.00 0.00 O ATOM 999 CB ALA A 64 -2.571 -5.268 7.014 1.00 0.00 C ATOM 0 H ALA A 64 -0.970 -7.075 6.468 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.652 -7.081 7.334 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.442 -4.628 7.155 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -2.030 -5.357 7.956 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.917 -4.830 6.260 1.00 0.00 H new ATOM 1005 N LEU A 65 -3.148 -6.363 4.155 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.794 -6.297 2.845 1.00 0.00 C ATOM 1007 C LEU A 65 -4.600 -7.560 2.570 1.00 0.00 C ATOM 1008 O LEU A 65 -5.713 -7.499 2.059 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.757 -6.112 1.729 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.444 -4.664 1.345 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -1.750 -3.943 2.484 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.592 -4.624 0.084 1.00 0.00 C ATOM 0 H LEU A 65 -2.133 -6.263 4.126 1.00 0.00 H new ATOM 0 HA LEU A 65 -4.465 -5.438 2.858 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.830 -6.595 2.037 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -3.110 -6.636 0.840 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.384 -4.150 1.144 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -1.537 -2.916 2.188 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -2.397 -3.942 3.361 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -0.816 -4.453 2.722 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.377 -3.588 -0.177 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.657 -5.155 0.260 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -2.131 -5.100 -0.735 1.00 0.00 H new ATOM 1024 N MET A 66 -4.025 -8.703 2.923 1.00 0.00 N ATOM 1025 CA MET A 66 -4.634 -9.998 2.640 1.00 0.00 C ATOM 1026 C MET A 66 -5.632 -10.391 3.724 1.00 0.00 C ATOM 1027 O MET A 66 -6.433 -11.310 3.549 1.00 0.00 O ATOM 1028 CB MET A 66 -3.534 -11.049 2.484 1.00 0.00 C ATOM 1029 CG MET A 66 -2.560 -10.684 1.380 1.00 0.00 C ATOM 1030 SD MET A 66 -1.098 -11.731 1.327 1.00 0.00 S ATOM 1031 CE MET A 66 -0.118 -10.809 0.145 1.00 0.00 C ATOM 0 H MET A 66 -3.130 -8.760 3.410 1.00 0.00 H new ATOM 0 HA MET A 66 -5.194 -9.932 1.707 1.00 0.00 H new ATOM 0 HB2 MET A 66 -2.994 -11.153 3.425 1.00 0.00 H new ATOM 0 HB3 MET A 66 -3.984 -12.017 2.266 1.00 0.00 H new ATOM 0 HG2 MET A 66 -3.074 -10.744 0.420 1.00 0.00 H new ATOM 0 HG3 MET A 66 -2.249 -9.648 1.511 1.00 0.00 H new ATOM 0 HE1 MET A 66 0.834 -11.316 -0.013 1.00 0.00 H new ATOM 0 HE2 MET A 66 -0.656 -10.744 -0.801 1.00 0.00 H new ATOM 0 HE3 MET A 66 0.065 -9.805 0.528 1.00 0.00 H new ATOM 1041 N SER A 67 -5.586 -9.684 4.840 1.00 0.00 N ATOM 1042 CA SER A 67 -6.550 -9.878 5.910 1.00 0.00 C ATOM 1043 C SER A 67 -7.817 -9.092 5.601 1.00 0.00 C ATOM 1044 O SER A 67 -8.931 -9.555 5.843 1.00 0.00 O ATOM 1045 CB SER A 67 -5.953 -9.437 7.253 1.00 0.00 C ATOM 1046 OG SER A 67 -6.854 -9.664 8.322 1.00 0.00 O ATOM 0 H SER A 67 -4.887 -8.966 5.029 1.00 0.00 H new ATOM 0 HA SER A 67 -6.799 -10.937 5.982 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.026 -9.980 7.436 1.00 0.00 H new ATOM 0 HB3 SER A 67 -5.699 -8.378 7.209 1.00 0.00 H new ATOM 0 HG SER A 67 -6.443 -9.374 9.163 1.00 0.00 H new ATOM 1052 N SER A 68 -7.635 -7.904 5.039 1.00 0.00 N ATOM 1053 CA SER A 68 -8.752 -7.063 4.650 1.00 0.00 C ATOM 1054 C SER A 68 -9.034 -7.242 3.156 1.00 0.00 C ATOM 1055 O SER A 68 -9.755 -6.454 2.538 1.00 0.00 O ATOM 1056 CB SER A 68 -8.441 -5.597 4.979 1.00 0.00 C ATOM 1057 OG SER A 68 -9.616 -4.800 4.967 1.00 0.00 O ATOM 0 H SER A 68 -6.718 -7.502 4.843 1.00 0.00 H new ATOM 0 HA SER A 68 -9.642 -7.356 5.207 1.00 0.00 H new ATOM 0 HB2 SER A 68 -7.968 -5.535 5.959 1.00 0.00 H new ATOM 0 HB3 SER A 68 -7.726 -5.204 4.256 1.00 0.00 H new ATOM 0 HG SER A 68 -10.145 -5.010 4.169 1.00 0.00 H new ATOM 1063 N LEU A 69 -8.463 -8.300 2.584 1.00 0.00 N ATOM 1064 CA LEU A 69 -8.682 -8.633 1.182 1.00 0.00 C ATOM 1065 C LEU A 69 -10.051 -9.279 1.019 1.00 0.00 C ATOM 1066 O LEU A 69 -10.170 -10.471 0.722 1.00 0.00 O ATOM 1067 CB LEU A 69 -7.589 -9.577 0.678 1.00 0.00 C ATOM 1068 CG LEU A 69 -7.582 -9.847 -0.829 1.00 0.00 C ATOM 1069 CD1 LEU A 69 -7.113 -8.621 -1.594 1.00 0.00 C ATOM 1070 CD2 LEU A 69 -6.702 -11.047 -1.146 1.00 0.00 C ATOM 0 H LEU A 69 -7.842 -8.943 3.075 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.643 -7.718 0.591 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.620 -9.163 0.958 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.690 -10.530 1.198 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.601 -10.072 -1.144 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.116 -8.836 -2.663 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.783 -7.786 -1.390 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.103 -8.360 -1.279 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.706 -11.228 -2.221 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.683 -10.848 -0.816 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.086 -11.926 -0.629 1.00 0.00 H new ATOM 1082 N GLU A 70 -11.082 -8.488 1.246 1.00 0.00 N ATOM 1083 CA GLU A 70 -12.441 -8.976 1.200 1.00 0.00 C ATOM 1084 C GLU A 70 -12.950 -9.028 -0.230 1.00 0.00 C ATOM 1085 O GLU A 70 -13.293 -8.004 -0.822 1.00 0.00 O ATOM 1086 CB GLU A 70 -13.348 -8.099 2.064 1.00 0.00 C ATOM 1087 CG GLU A 70 -14.807 -8.518 2.043 1.00 0.00 C ATOM 1088 CD GLU A 70 -15.666 -7.677 2.960 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -15.734 -6.446 2.762 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -16.280 -8.245 3.888 1.00 0.00 O ATOM 0 H GLU A 70 -10.999 -7.495 1.466 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.455 -9.990 1.599 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.988 -8.123 3.092 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.271 -7.067 1.723 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -15.188 -8.443 1.025 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.885 -9.565 2.337 1.00 0.00 H new ATOM 1097 N THR A 71 -12.954 -10.223 -0.795 1.00 0.00 N ATOM 1098 CA THR A 71 -13.583 -10.443 -2.078 1.00 0.00 C ATOM 1099 C THR A 71 -15.095 -10.382 -1.889 1.00 0.00 C ATOM 1100 O THR A 71 -15.620 -11.024 -0.983 1.00 0.00 O ATOM 1101 CB THR A 71 -13.175 -11.808 -2.666 1.00 0.00 C ATOM 1102 OG1 THR A 71 -11.749 -11.950 -2.603 1.00 0.00 O ATOM 1103 CG2 THR A 71 -13.634 -11.947 -4.110 1.00 0.00 C ATOM 0 H THR A 71 -12.528 -11.053 -0.383 1.00 0.00 H new ATOM 0 HA THR A 71 -13.259 -9.673 -2.778 1.00 0.00 H new ATOM 0 HB THR A 71 -13.656 -12.589 -2.078 1.00 0.00 H new ATOM 0 HG1 THR A 71 -11.490 -12.819 -2.975 1.00 0.00 H new ATOM 0 HG21 THR A 71 -13.331 -12.920 -4.496 1.00 0.00 H new ATOM 0 HG22 THR A 71 -14.720 -11.860 -4.157 1.00 0.00 H new ATOM 0 HG23 THR A 71 -13.181 -11.160 -4.713 1.00 0.00 H new ATOM 1111 N PRO A 72 -15.799 -9.573 -2.705 1.00 0.00 N ATOM 1112 CA PRO A 72 -17.249 -9.371 -2.593 1.00 0.00 C ATOM 1113 C PRO A 72 -18.032 -10.658 -2.338 1.00 0.00 C ATOM 1114 O PRO A 72 -18.224 -11.479 -3.238 1.00 0.00 O ATOM 1115 CB PRO A 72 -17.619 -8.778 -3.950 1.00 0.00 C ATOM 1116 CG PRO A 72 -16.408 -8.017 -4.358 1.00 0.00 C ATOM 1117 CD PRO A 72 -15.227 -8.769 -3.799 1.00 0.00 C ATOM 0 HA PRO A 72 -17.498 -8.739 -1.740 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -17.862 -9.557 -4.672 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -18.491 -8.129 -3.876 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -16.343 -7.943 -5.444 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -16.440 -6.999 -3.970 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -14.761 -9.400 -4.556 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -14.458 -8.089 -3.434 1.00 0.00 H new ATOM 1125 N LYS A 73 -18.450 -10.833 -1.091 1.00 0.00 N ATOM 1126 CA LYS A 73 -19.264 -11.972 -0.688 1.00 0.00 C ATOM 1127 C LYS A 73 -20.604 -11.471 -0.171 1.00 0.00 C ATOM 1128 O LYS A 73 -20.864 -10.266 -0.178 1.00 0.00 O ATOM 1129 CB LYS A 73 -18.556 -12.779 0.410 1.00 0.00 C ATOM 1130 CG LYS A 73 -17.233 -13.387 -0.025 1.00 0.00 C ATOM 1131 CD LYS A 73 -16.473 -13.968 1.158 1.00 0.00 C ATOM 1132 CE LYS A 73 -15.099 -14.472 0.746 1.00 0.00 C ATOM 1133 NZ LYS A 73 -14.327 -14.990 1.906 1.00 0.00 N ATOM 0 H LYS A 73 -18.234 -10.189 -0.330 1.00 0.00 H new ATOM 0 HA LYS A 73 -19.418 -12.621 -1.550 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -18.381 -12.130 1.268 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -19.219 -13.577 0.744 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -17.415 -14.169 -0.762 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -16.624 -12.626 -0.512 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -16.366 -13.208 1.931 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -17.046 -14.787 1.593 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -15.210 -15.261 0.002 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -14.543 -13.663 0.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -13.397 -15.324 1.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -14.199 -14.230 2.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -14.845 -15.779 2.343 1.00 0.00 H new ATOM 1147 N THR A 74 -21.446 -12.385 0.276 1.00 0.00 N ATOM 1148 CA THR A 74 -22.727 -12.013 0.844 1.00 0.00 C ATOM 1149 C THR A 74 -22.592 -11.809 2.357 1.00 0.00 C ATOM 1150 O THR A 74 -22.095 -12.681 3.075 1.00 0.00 O ATOM 1151 CB THR A 74 -23.817 -13.067 0.521 1.00 0.00 C ATOM 1152 OG1 THR A 74 -25.084 -12.657 1.044 1.00 0.00 O ATOM 1153 CG2 THR A 74 -23.458 -14.441 1.075 1.00 0.00 C ATOM 0 H THR A 74 -21.265 -13.389 0.256 1.00 0.00 H new ATOM 0 HA THR A 74 -23.041 -11.073 0.391 1.00 0.00 H new ATOM 0 HB THR A 74 -23.878 -13.142 -0.565 1.00 0.00 H new ATOM 0 HG1 THR A 74 -25.761 -13.333 0.830 1.00 0.00 H new ATOM 0 HG21 THR A 74 -24.247 -15.151 0.827 1.00 0.00 H new ATOM 0 HG22 THR A 74 -22.518 -14.776 0.636 1.00 0.00 H new ATOM 0 HG23 THR A 74 -23.352 -14.380 2.158 1.00 0.00 H new ATOM 1161 N HIS A 75 -22.978 -10.629 2.827 1.00 0.00 N ATOM 1162 CA HIS A 75 -22.947 -10.330 4.254 1.00 0.00 C ATOM 1163 C HIS A 75 -24.361 -10.398 4.816 1.00 0.00 C ATOM 1164 O HIS A 75 -24.746 -11.392 5.431 1.00 0.00 O ATOM 1165 CB HIS A 75 -22.344 -8.942 4.514 1.00 0.00 C ATOM 1166 CG HIS A 75 -20.958 -8.765 3.977 1.00 0.00 C ATOM 1167 ND1 HIS A 75 -20.681 -8.029 2.847 1.00 0.00 N ATOM 1168 CD2 HIS A 75 -19.765 -9.220 4.425 1.00 0.00 C ATOM 1169 CE1 HIS A 75 -19.383 -8.039 2.624 1.00 0.00 C ATOM 1170 NE2 HIS A 75 -18.801 -8.754 3.566 1.00 0.00 N ATOM 0 H HIS A 75 -23.316 -9.865 2.242 1.00 0.00 H new ATOM 0 HA HIS A 75 -22.318 -11.069 4.751 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -22.993 -8.187 4.070 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -22.331 -8.759 5.588 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -19.602 -9.836 5.297 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -18.880 -7.544 1.806 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -17.800 -8.932 3.644 1.00 0.00 H new ATOM 1179 N LEU A 76 -25.134 -9.346 4.582 1.00 0.00 N ATOM 1180 CA LEU A 76 -26.539 -9.324 4.957 1.00 0.00 C ATOM 1181 C LEU A 76 -27.378 -9.016 3.726 1.00 0.00 C ATOM 1182 O LEU A 76 -27.771 -7.872 3.483 1.00 0.00 O ATOM 1183 CB LEU A 76 -26.793 -8.293 6.061 1.00 0.00 C ATOM 1184 CG LEU A 76 -26.064 -8.565 7.382 1.00 0.00 C ATOM 1185 CD1 LEU A 76 -26.288 -7.426 8.364 1.00 0.00 C ATOM 1186 CD2 LEU A 76 -26.521 -9.886 7.989 1.00 0.00 C ATOM 0 H LEU A 76 -24.807 -8.491 4.131 1.00 0.00 H new ATOM 0 HA LEU A 76 -26.821 -10.301 5.350 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -26.496 -7.310 5.695 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -27.864 -8.249 6.257 1.00 0.00 H new ATOM 0 HG LEU A 76 -24.997 -8.634 7.171 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -25.762 -7.639 9.295 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -25.908 -6.498 7.937 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -27.354 -7.323 8.565 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -25.991 -10.059 8.926 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -27.593 -9.847 8.181 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -26.306 -10.699 7.295 1.00 0.00 H new ATOM 1198 N GLU A 77 -27.620 -10.042 2.932 1.00 0.00 N ATOM 1199 CA GLU A 77 -28.279 -9.882 1.650 1.00 0.00 C ATOM 1200 C GLU A 77 -29.486 -10.808 1.542 1.00 0.00 C ATOM 1201 O GLU A 77 -29.365 -11.962 1.127 1.00 0.00 O ATOM 1202 CB GLU A 77 -27.279 -10.167 0.526 1.00 0.00 C ATOM 1203 CG GLU A 77 -27.831 -9.966 -0.875 1.00 0.00 C ATOM 1204 CD GLU A 77 -26.848 -10.410 -1.936 1.00 0.00 C ATOM 1205 OE1 GLU A 77 -26.679 -11.635 -2.111 1.00 0.00 O ATOM 1206 OE2 GLU A 77 -26.234 -9.541 -2.587 1.00 0.00 O ATOM 0 H GLU A 77 -27.367 -11.004 3.156 1.00 0.00 H new ATOM 0 HA GLU A 77 -28.638 -8.857 1.560 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -26.411 -9.521 0.657 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -26.929 -11.195 0.621 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -28.760 -10.526 -0.983 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -28.074 -8.914 -1.022 1.00 0.00 H new ATOM 1213 N HIS A 78 -30.641 -10.304 1.962 1.00 0.00 N ATOM 1214 CA HIS A 78 -31.901 -11.031 1.842 1.00 0.00 C ATOM 1215 C HIS A 78 -33.062 -10.058 2.038 1.00 0.00 C ATOM 1216 O HIS A 78 -34.039 -10.349 2.724 1.00 0.00 O ATOM 1217 CB HIS A 78 -31.970 -12.177 2.869 1.00 0.00 C ATOM 1218 CG HIS A 78 -33.087 -13.156 2.621 1.00 0.00 C ATOM 1219 ND1 HIS A 78 -32.968 -14.239 1.774 1.00 0.00 N ATOM 1220 CD2 HIS A 78 -34.352 -13.206 3.108 1.00 0.00 C ATOM 1221 CE1 HIS A 78 -34.108 -14.905 1.751 1.00 0.00 C ATOM 1222 NE2 HIS A 78 -34.962 -14.299 2.552 1.00 0.00 N ATOM 0 H HIS A 78 -30.731 -9.384 2.394 1.00 0.00 H new ATOM 0 HA HIS A 78 -31.967 -11.474 0.848 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -31.022 -12.714 2.863 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -32.088 -11.751 3.865 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -34.796 -12.512 3.806 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -34.307 -15.796 1.174 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -35.922 -14.596 2.729 1.00 0.00 H new ATOM 1231 N HIS A 79 -32.954 -8.887 1.429 1.00 0.00 N ATOM 1232 CA HIS A 79 -33.998 -7.881 1.556 1.00 0.00 C ATOM 1233 C HIS A 79 -34.299 -7.206 0.227 1.00 0.00 C ATOM 1234 O HIS A 79 -34.969 -6.175 0.186 1.00 0.00 O ATOM 1235 CB HIS A 79 -33.641 -6.841 2.618 1.00 0.00 C ATOM 1236 CG HIS A 79 -34.340 -7.077 3.923 1.00 0.00 C ATOM 1237 ND1 HIS A 79 -35.507 -6.438 4.269 1.00 0.00 N ATOM 1238 CD2 HIS A 79 -34.049 -7.904 4.957 1.00 0.00 C ATOM 1239 CE1 HIS A 79 -35.904 -6.855 5.453 1.00 0.00 C ATOM 1240 NE2 HIS A 79 -35.041 -7.749 5.898 1.00 0.00 N ATOM 0 H HIS A 79 -32.163 -8.611 0.848 1.00 0.00 H new ATOM 0 HA HIS A 79 -34.901 -8.400 1.876 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -32.563 -6.851 2.782 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -33.898 -5.848 2.248 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -33.196 -8.563 5.029 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -36.789 -6.521 5.974 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -35.100 -8.242 6.789 1.00 0.00 H new ATOM 1249 N HIS A 80 -33.817 -7.788 -0.864 1.00 0.00 N ATOM 1250 CA HIS A 80 -34.244 -7.350 -2.185 1.00 0.00 C ATOM 1251 C HIS A 80 -35.703 -7.749 -2.348 1.00 0.00 C ATOM 1252 O HIS A 80 -36.532 -6.972 -2.817 1.00 0.00 O ATOM 1253 CB HIS A 80 -33.379 -7.971 -3.286 1.00 0.00 C ATOM 1254 CG HIS A 80 -33.547 -7.312 -4.620 1.00 0.00 C ATOM 1255 ND1 HIS A 80 -32.573 -6.532 -5.199 1.00 0.00 N ATOM 1256 CD2 HIS A 80 -34.588 -7.314 -5.487 1.00 0.00 C ATOM 1257 CE1 HIS A 80 -33.006 -6.082 -6.361 1.00 0.00 C ATOM 1258 NE2 HIS A 80 -34.229 -6.541 -6.562 1.00 0.00 N ATOM 0 H HIS A 80 -33.141 -8.552 -0.861 1.00 0.00 H new ATOM 0 HA HIS A 80 -34.131 -6.270 -2.276 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -32.331 -7.913 -2.990 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -33.626 -9.029 -3.378 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -35.528 -7.829 -5.356 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -32.453 -5.445 -7.036 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -34.809 -6.352 -7.380 1.00 0.00 H new ATOM 1267 N HIS A 81 -35.995 -8.979 -1.948 1.00 0.00 N ATOM 1268 CA HIS A 81 -37.363 -9.400 -1.704 1.00 0.00 C ATOM 1269 C HIS A 81 -37.443 -9.870 -0.254 1.00 0.00 C ATOM 1270 O HIS A 81 -36.844 -10.878 0.120 1.00 0.00 O ATOM 1271 CB HIS A 81 -37.827 -10.490 -2.700 1.00 0.00 C ATOM 1272 CG HIS A 81 -37.193 -11.846 -2.535 1.00 0.00 C ATOM 1273 ND1 HIS A 81 -35.961 -12.179 -3.055 1.00 0.00 N ATOM 1274 CD2 HIS A 81 -37.647 -12.963 -1.915 1.00 0.00 C ATOM 1275 CE1 HIS A 81 -35.686 -13.437 -2.763 1.00 0.00 C ATOM 1276 NE2 HIS A 81 -36.693 -13.935 -2.070 1.00 0.00 N ATOM 0 H HIS A 81 -35.297 -9.705 -1.786 1.00 0.00 H new ATOM 0 HA HIS A 81 -38.045 -8.565 -1.864 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -38.907 -10.602 -2.608 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -37.628 -10.138 -3.712 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -38.588 -13.068 -1.395 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -34.789 -13.969 -3.044 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -36.752 -14.887 -1.709 1.00 0.00 H new ATOM 1285 N HIS A 82 -38.138 -9.110 0.579 1.00 0.00 N ATOM 1286 CA HIS A 82 -38.095 -9.347 2.020 1.00 0.00 C ATOM 1287 C HIS A 82 -39.028 -10.488 2.436 1.00 0.00 C ATOM 1288 O HIS A 82 -40.066 -10.284 3.066 1.00 0.00 O ATOM 1289 CB HIS A 82 -38.382 -8.055 2.812 1.00 0.00 C ATOM 1290 CG HIS A 82 -39.767 -7.495 2.650 1.00 0.00 C ATOM 1291 ND1 HIS A 82 -40.677 -7.454 3.683 1.00 0.00 N ATOM 1292 CD2 HIS A 82 -40.392 -6.952 1.581 1.00 0.00 C ATOM 1293 CE1 HIS A 82 -41.801 -6.915 3.257 1.00 0.00 C ATOM 1294 NE2 HIS A 82 -41.654 -6.603 1.985 1.00 0.00 N ATOM 0 H HIS A 82 -38.732 -8.333 0.290 1.00 0.00 H new ATOM 0 HA HIS A 82 -37.081 -9.660 2.267 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -38.209 -8.251 3.870 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -37.663 -7.295 2.507 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -39.975 -6.818 0.594 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -42.690 -6.756 3.849 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -42.366 -6.171 1.396 1.00 0.00 H new ATOM 1303 N HIS A 83 -38.645 -11.699 2.056 1.00 0.00 N ATOM 1304 CA HIS A 83 -39.379 -12.898 2.428 1.00 0.00 C ATOM 1305 C HIS A 83 -38.564 -14.126 2.043 1.00 0.00 C ATOM 1306 O HIS A 83 -37.602 -14.446 2.766 1.00 0.00 O ATOM 1307 CB HIS A 83 -40.757 -12.928 1.747 1.00 0.00 C ATOM 1308 CG HIS A 83 -41.698 -13.945 2.325 1.00 0.00 C ATOM 1309 ND1 HIS A 83 -42.683 -14.568 1.589 1.00 0.00 N ATOM 1310 CD2 HIS A 83 -41.815 -14.427 3.587 1.00 0.00 C ATOM 1311 CE1 HIS A 83 -43.361 -15.387 2.370 1.00 0.00 C ATOM 1312 NE2 HIS A 83 -42.856 -15.321 3.586 1.00 0.00 N ATOM 1313 OXT HIS A 83 -38.869 -14.748 1.009 1.00 0.00 O ATOM 0 H HIS A 83 -37.820 -11.877 1.483 1.00 0.00 H new ATOM 0 HA HIS A 83 -39.541 -12.897 3.506 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -41.212 -11.941 1.825 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -40.622 -13.134 0.685 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -41.203 -14.157 4.435 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -44.191 -16.007 2.064 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -43.185 -15.849 4.394 1.00 0.00 H new TER 1322 HIS A 83 ATOM 1323 N MET B 1 -0.796 -6.400 -20.833 1.00 0.00 N ATOM 1324 CA MET B 1 -1.350 -6.671 -19.486 1.00 0.00 C ATOM 1325 C MET B 1 -1.145 -5.465 -18.577 1.00 0.00 C ATOM 1326 O MET B 1 -0.311 -4.605 -18.864 1.00 0.00 O ATOM 1327 CB MET B 1 -0.687 -7.913 -18.874 1.00 0.00 C ATOM 1328 CG MET B 1 -1.012 -9.203 -19.606 1.00 0.00 C ATOM 1329 SD MET B 1 -0.360 -10.661 -18.772 1.00 0.00 S ATOM 1330 CE MET B 1 -1.218 -10.575 -17.201 1.00 0.00 C ATOM 0 H1 MET B 1 -1.555 -6.471 -21.541 1.00 0.00 H new ATOM 0 H2 MET B 1 -0.390 -5.443 -20.855 1.00 0.00 H new ATOM 0 H3 MET B 1 -0.054 -7.096 -21.050 1.00 0.00 H new ATOM 0 HA MET B 1 -2.419 -6.859 -19.584 1.00 0.00 H new ATOM 0 HB2 MET B 1 0.394 -7.771 -18.869 1.00 0.00 H new ATOM 0 HB3 MET B 1 -1.001 -8.007 -17.835 1.00 0.00 H new ATOM 0 HG2 MET B 1 -2.094 -9.298 -19.703 1.00 0.00 H new ATOM 0 HG3 MET B 1 -0.605 -9.155 -20.616 1.00 0.00 H new ATOM 0 HE1 MET B 1 -1.567 -11.569 -16.922 1.00 0.00 H new ATOM 0 HE2 MET B 1 -0.539 -10.200 -16.435 1.00 0.00 H new ATOM 0 HE3 MET B 1 -2.072 -9.903 -17.289 1.00 0.00 H new ATOM 1339 N PRO B 2 -1.926 -5.375 -17.484 1.00 0.00 N ATOM 1340 CA PRO B 2 -1.846 -4.258 -16.532 1.00 0.00 C ATOM 1341 C PRO B 2 -0.445 -4.051 -15.957 1.00 0.00 C ATOM 1342 O PRO B 2 0.063 -4.867 -15.177 1.00 0.00 O ATOM 1343 CB PRO B 2 -2.822 -4.657 -15.423 1.00 0.00 C ATOM 1344 CG PRO B 2 -3.776 -5.594 -16.079 1.00 0.00 C ATOM 1345 CD PRO B 2 -2.969 -6.342 -17.100 1.00 0.00 C ATOM 0 HA PRO B 2 -2.086 -3.312 -17.017 1.00 0.00 H new ATOM 0 HB2 PRO B 2 -2.304 -5.136 -14.593 1.00 0.00 H new ATOM 0 HB3 PRO B 2 -3.338 -3.787 -15.017 1.00 0.00 H new ATOM 0 HG2 PRO B 2 -4.218 -6.276 -15.352 1.00 0.00 H new ATOM 0 HG3 PRO B 2 -4.597 -5.052 -16.548 1.00 0.00 H new ATOM 0 HD2 PRO B 2 -2.539 -7.253 -16.684 1.00 0.00 H new ATOM 0 HD3 PRO B 2 -3.577 -6.638 -17.955 1.00 0.00 H new ATOM 1353 N ILE B 3 0.174 -2.956 -16.366 1.00 0.00 N ATOM 1354 CA ILE B 3 1.455 -2.536 -15.835 1.00 0.00 C ATOM 1355 C ILE B 3 1.549 -1.011 -15.889 1.00 0.00 C ATOM 1356 O ILE B 3 1.574 -0.408 -16.962 1.00 0.00 O ATOM 1357 CB ILE B 3 2.650 -3.195 -16.579 1.00 0.00 C ATOM 1358 CG1 ILE B 3 3.984 -2.671 -16.040 1.00 0.00 C ATOM 1359 CG2 ILE B 3 2.562 -2.979 -18.081 1.00 0.00 C ATOM 1360 CD1 ILE B 3 4.229 -3.010 -14.582 1.00 0.00 C ATOM 0 H ILE B 3 -0.202 -2.332 -17.080 1.00 0.00 H new ATOM 0 HA ILE B 3 1.518 -2.870 -14.799 1.00 0.00 H new ATOM 0 HB ILE B 3 2.597 -4.268 -16.393 1.00 0.00 H new ATOM 0 HG12 ILE B 3 4.795 -3.083 -16.641 1.00 0.00 H new ATOM 0 HG13 ILE B 3 4.015 -1.588 -16.162 1.00 0.00 H new ATOM 0 HG21 ILE B 3 3.414 -3.454 -18.567 1.00 0.00 H new ATOM 0 HG22 ILE B 3 1.638 -3.418 -18.458 1.00 0.00 H new ATOM 0 HG23 ILE B 3 2.570 -1.910 -18.296 1.00 0.00 H new ATOM 0 HD11 ILE B 3 5.193 -2.606 -14.272 1.00 0.00 H new ATOM 0 HD12 ILE B 3 3.439 -2.575 -13.970 1.00 0.00 H new ATOM 0 HD13 ILE B 3 4.232 -4.093 -14.456 1.00 0.00 H new ATOM 1372 N THR B 4 1.552 -0.396 -14.715 1.00 0.00 N ATOM 1373 CA THR B 4 1.560 1.055 -14.602 1.00 0.00 C ATOM 1374 C THR B 4 2.828 1.661 -15.203 1.00 0.00 C ATOM 1375 O THR B 4 2.807 2.803 -15.669 1.00 0.00 O ATOM 1376 CB THR B 4 1.419 1.496 -13.126 1.00 0.00 C ATOM 1377 OG1 THR B 4 1.523 2.920 -13.017 1.00 0.00 O ATOM 1378 CG2 THR B 4 2.479 0.837 -12.250 1.00 0.00 C ATOM 0 H THR B 4 1.549 -0.885 -13.820 1.00 0.00 H new ATOM 0 HA THR B 4 0.704 1.424 -15.167 1.00 0.00 H new ATOM 0 HB THR B 4 0.436 1.179 -12.779 1.00 0.00 H new ATOM 0 HG1 THR B 4 0.881 3.342 -13.625 1.00 0.00 H new ATOM 0 HG21 THR B 4 2.354 1.166 -11.218 1.00 0.00 H new ATOM 0 HG22 THR B 4 2.371 -0.246 -12.301 1.00 0.00 H new ATOM 0 HG23 THR B 4 3.470 1.120 -12.604 1.00 0.00 H new ATOM 1386 N SER B 5 3.911 0.881 -15.204 1.00 0.00 N ATOM 1387 CA SER B 5 5.220 1.338 -15.668 1.00 0.00 C ATOM 1388 C SER B 5 5.747 2.466 -14.777 1.00 0.00 C ATOM 1389 O SER B 5 6.582 2.231 -13.904 1.00 0.00 O ATOM 1390 CB SER B 5 5.158 1.780 -17.138 1.00 0.00 C ATOM 1391 OG SER B 5 4.702 0.723 -17.969 1.00 0.00 O ATOM 0 H SER B 5 3.904 -0.087 -14.882 1.00 0.00 H new ATOM 0 HA SER B 5 5.915 0.501 -15.600 1.00 0.00 H new ATOM 0 HB2 SER B 5 4.492 2.637 -17.236 1.00 0.00 H new ATOM 0 HB3 SER B 5 6.146 2.105 -17.466 1.00 0.00 H new ATOM 0 HG SER B 5 4.669 1.029 -18.899 1.00 0.00 H new ATOM 1397 N LYS B 6 5.224 3.669 -14.982 1.00 0.00 N ATOM 1398 CA LYS B 6 5.599 4.834 -14.191 1.00 0.00 C ATOM 1399 C LYS B 6 4.825 6.061 -14.660 1.00 0.00 C ATOM 1400 O LYS B 6 4.614 6.994 -13.891 1.00 0.00 O ATOM 1401 CB LYS B 6 7.109 5.105 -14.279 1.00 0.00 C ATOM 1402 CG LYS B 6 7.594 6.163 -13.299 1.00 0.00 C ATOM 1403 CD LYS B 6 7.224 5.796 -11.869 1.00 0.00 C ATOM 1404 CE LYS B 6 7.622 6.885 -10.887 1.00 0.00 C ATOM 1405 NZ LYS B 6 9.095 7.029 -10.777 1.00 0.00 N ATOM 0 H LYS B 6 4.528 3.864 -15.702 1.00 0.00 H new ATOM 0 HA LYS B 6 5.350 4.626 -13.151 1.00 0.00 H new ATOM 0 HB2 LYS B 6 7.648 4.176 -14.094 1.00 0.00 H new ATOM 0 HB3 LYS B 6 7.355 5.420 -15.293 1.00 0.00 H new ATOM 0 HG2 LYS B 6 8.675 6.271 -13.382 1.00 0.00 H new ATOM 0 HG3 LYS B 6 7.157 7.128 -13.555 1.00 0.00 H new ATOM 0 HD2 LYS B 6 6.150 5.623 -11.804 1.00 0.00 H new ATOM 0 HD3 LYS B 6 7.714 4.862 -11.595 1.00 0.00 H new ATOM 0 HE2 LYS B 6 7.188 7.834 -11.204 1.00 0.00 H new ATOM 0 HE3 LYS B 6 7.207 6.656 -9.906 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 9.322 7.722 -10.036 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 9.516 6.110 -10.532 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 9.481 7.355 -11.686 1.00 0.00 H new ATOM 1419 N TYR B 7 4.396 6.042 -15.926 1.00 0.00 N ATOM 1420 CA TYR B 7 3.696 7.177 -16.532 1.00 0.00 C ATOM 1421 C TYR B 7 4.604 8.406 -16.559 1.00 0.00 C ATOM 1422 O TYR B 7 5.830 8.279 -16.588 1.00 0.00 O ATOM 1423 CB TYR B 7 2.402 7.505 -15.773 1.00 0.00 C ATOM 1424 CG TYR B 7 1.384 6.385 -15.754 1.00 0.00 C ATOM 1425 CD1 TYR B 7 1.006 5.734 -16.921 1.00 0.00 C ATOM 1426 CD2 TYR B 7 0.783 5.995 -14.566 1.00 0.00 C ATOM 1427 CE1 TYR B 7 0.063 4.724 -16.902 1.00 0.00 C ATOM 1428 CE2 TYR B 7 -0.158 4.985 -14.537 1.00 0.00 C ATOM 1429 CZ TYR B 7 -0.517 4.355 -15.708 1.00 0.00 C ATOM 1430 OH TYR B 7 -1.462 3.356 -15.683 1.00 0.00 O ATOM 0 H TYR B 7 4.523 5.248 -16.553 1.00 0.00 H new ATOM 0 HA TYR B 7 3.433 6.899 -17.553 1.00 0.00 H new ATOM 0 HB2 TYR B 7 2.655 7.767 -14.745 1.00 0.00 H new ATOM 0 HB3 TYR B 7 1.945 8.386 -16.223 1.00 0.00 H new ATOM 0 HD1 TYR B 7 1.457 6.022 -17.859 1.00 0.00 H new ATOM 0 HD2 TYR B 7 1.056 6.491 -13.646 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -0.218 4.226 -17.818 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -0.610 4.691 -13.601 1.00 0.00 H new ATOM 0 HH TYR B 7 -1.151 2.626 -15.108 1.00 0.00 H new ATOM 1440 N THR B 8 4.000 9.588 -16.577 1.00 0.00 N ATOM 1441 CA THR B 8 4.752 10.831 -16.497 1.00 0.00 C ATOM 1442 C THR B 8 5.504 10.894 -15.167 1.00 0.00 C ATOM 1443 O THR B 8 4.892 11.023 -14.104 1.00 0.00 O ATOM 1444 CB THR B 8 3.816 12.045 -16.620 1.00 0.00 C ATOM 1445 OG1 THR B 8 2.851 11.821 -17.658 1.00 0.00 O ATOM 1446 CG2 THR B 8 4.601 13.314 -16.929 1.00 0.00 C ATOM 0 H THR B 8 2.990 9.710 -16.646 1.00 0.00 H new ATOM 0 HA THR B 8 5.464 10.858 -17.322 1.00 0.00 H new ATOM 0 HB THR B 8 3.307 12.172 -15.665 1.00 0.00 H new ATOM 0 HG1 THR B 8 2.259 12.599 -17.727 1.00 0.00 H new ATOM 0 HG21 THR B 8 3.914 14.156 -17.010 1.00 0.00 H new ATOM 0 HG22 THR B 8 5.315 13.504 -16.128 1.00 0.00 H new ATOM 0 HG23 THR B 8 5.137 13.190 -17.870 1.00 0.00 H new ATOM 1454 N ASP B 9 6.826 10.808 -15.232 1.00 0.00 N ATOM 1455 CA ASP B 9 7.648 10.654 -14.036 1.00 0.00 C ATOM 1456 C ASP B 9 7.557 11.864 -13.110 1.00 0.00 C ATOM 1457 O ASP B 9 7.478 11.703 -11.892 1.00 0.00 O ATOM 1458 CB ASP B 9 9.108 10.345 -14.404 1.00 0.00 C ATOM 1459 CG ASP B 9 9.745 11.384 -15.309 1.00 0.00 C ATOM 1460 OD1 ASP B 9 9.217 11.620 -16.416 1.00 0.00 O ATOM 1461 OD2 ASP B 9 10.797 11.943 -14.933 1.00 0.00 O ATOM 0 H ASP B 9 7.355 10.842 -16.103 1.00 0.00 H new ATOM 0 HA ASP B 9 7.249 9.803 -13.484 1.00 0.00 H new ATOM 0 HB2 ASP B 9 9.695 10.265 -13.489 1.00 0.00 H new ATOM 0 HB3 ASP B 9 9.151 9.373 -14.896 1.00 0.00 H new ATOM 1466 N GLU B 10 7.542 13.069 -13.673 1.00 0.00 N ATOM 1467 CA GLU B 10 7.415 14.269 -12.854 1.00 0.00 C ATOM 1468 C GLU B 10 6.011 14.362 -12.261 1.00 0.00 C ATOM 1469 O GLU B 10 5.834 14.790 -11.121 1.00 0.00 O ATOM 1470 CB GLU B 10 7.703 15.535 -13.658 1.00 0.00 C ATOM 1471 CG GLU B 10 7.812 16.774 -12.782 1.00 0.00 C ATOM 1472 CD GLU B 10 7.631 18.068 -13.542 1.00 0.00 C ATOM 1473 OE1 GLU B 10 8.501 18.412 -14.365 1.00 0.00 O ATOM 1474 OE2 GLU B 10 6.618 18.761 -13.305 1.00 0.00 O ATOM 0 H GLU B 10 7.615 13.239 -14.676 1.00 0.00 H new ATOM 0 HA GLU B 10 8.151 14.192 -12.054 1.00 0.00 H new ATOM 0 HB2 GLU B 10 8.632 15.405 -14.213 1.00 0.00 H new ATOM 0 HB3 GLU B 10 6.911 15.682 -14.392 1.00 0.00 H new ATOM 0 HG2 GLU B 10 7.063 16.718 -11.992 1.00 0.00 H new ATOM 0 HG3 GLU B 10 8.788 16.781 -12.296 1.00 0.00 H new ATOM 1481 N GLN B 11 5.016 13.946 -13.039 1.00 0.00 N ATOM 1482 CA GLN B 11 3.626 14.023 -12.606 1.00 0.00 C ATOM 1483 C GLN B 11 3.411 13.171 -11.362 1.00 0.00 C ATOM 1484 O GLN B 11 2.798 13.620 -10.396 1.00 0.00 O ATOM 1485 CB GLN B 11 2.686 13.570 -13.723 1.00 0.00 C ATOM 1486 CG GLN B 11 1.213 13.710 -13.371 1.00 0.00 C ATOM 1487 CD GLN B 11 0.295 13.278 -14.497 1.00 0.00 C ATOM 1488 OE1 GLN B 11 -0.820 12.811 -14.263 1.00 0.00 O ATOM 1489 NE2 GLN B 11 0.755 13.435 -15.727 1.00 0.00 N ATOM 0 H GLN B 11 5.147 13.553 -13.971 1.00 0.00 H new ATOM 0 HA GLN B 11 3.400 15.062 -12.365 1.00 0.00 H new ATOM 0 HB2 GLN B 11 2.894 14.153 -14.620 1.00 0.00 H new ATOM 0 HB3 GLN B 11 2.896 12.528 -13.964 1.00 0.00 H new ATOM 0 HG2 GLN B 11 0.998 13.114 -12.484 1.00 0.00 H new ATOM 0 HG3 GLN B 11 1.003 14.748 -13.115 1.00 0.00 H new ATOM 0 HE21 GLN B 11 1.685 13.826 -15.878 1.00 0.00 H new ATOM 0 HE22 GLN B 11 0.180 13.165 -16.525 1.00 0.00 H new ATOM 1498 N VAL B 12 3.931 11.946 -11.387 1.00 0.00 N ATOM 1499 CA VAL B 12 3.836 11.057 -10.235 1.00 0.00 C ATOM 1500 C VAL B 12 4.534 11.676 -9.030 1.00 0.00 C ATOM 1501 O VAL B 12 3.997 11.673 -7.922 1.00 0.00 O ATOM 1502 CB VAL B 12 4.447 9.671 -10.526 1.00 0.00 C ATOM 1503 CG1 VAL B 12 4.365 8.775 -9.297 1.00 0.00 C ATOM 1504 CG2 VAL B 12 3.743 9.021 -11.705 1.00 0.00 C ATOM 0 H VAL B 12 4.420 11.549 -12.189 1.00 0.00 H new ATOM 0 HA VAL B 12 2.776 10.922 -10.018 1.00 0.00 H new ATOM 0 HB VAL B 12 5.499 9.806 -10.779 1.00 0.00 H new ATOM 0 HG11 VAL B 12 4.802 7.803 -9.526 1.00 0.00 H new ATOM 0 HG12 VAL B 12 4.913 9.235 -8.474 1.00 0.00 H new ATOM 0 HG13 VAL B 12 3.321 8.645 -9.010 1.00 0.00 H new ATOM 0 HG21 VAL B 12 4.185 8.044 -11.899 1.00 0.00 H new ATOM 0 HG22 VAL B 12 2.684 8.902 -11.476 1.00 0.00 H new ATOM 0 HG23 VAL B 12 3.854 9.651 -12.588 1.00 0.00 H new ATOM 1514 N GLU B 13 5.722 12.228 -9.266 1.00 0.00 N ATOM 1515 CA GLU B 13 6.485 12.903 -8.221 1.00 0.00 C ATOM 1516 C GLU B 13 5.645 13.998 -7.569 1.00 0.00 C ATOM 1517 O GLU B 13 5.580 14.105 -6.343 1.00 0.00 O ATOM 1518 CB GLU B 13 7.754 13.516 -8.816 1.00 0.00 C ATOM 1519 CG GLU B 13 8.635 14.209 -7.793 1.00 0.00 C ATOM 1520 CD GLU B 13 9.689 15.082 -8.438 1.00 0.00 C ATOM 1521 OE1 GLU B 13 10.735 14.551 -8.866 1.00 0.00 O ATOM 1522 OE2 GLU B 13 9.481 16.309 -8.509 1.00 0.00 O ATOM 0 H GLU B 13 6.179 12.220 -10.178 1.00 0.00 H new ATOM 0 HA GLU B 13 6.758 12.169 -7.462 1.00 0.00 H new ATOM 0 HB2 GLU B 13 8.330 12.731 -9.306 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.473 14.234 -9.586 1.00 0.00 H new ATOM 0 HG2 GLU B 13 8.014 14.818 -7.136 1.00 0.00 H new ATOM 0 HG3 GLU B 13 9.120 13.459 -7.168 1.00 0.00 H new ATOM 1529 N LYS B 14 4.988 14.795 -8.403 1.00 0.00 N ATOM 1530 CA LYS B 14 4.161 15.895 -7.927 1.00 0.00 C ATOM 1531 C LYS B 14 2.960 15.391 -7.136 1.00 0.00 C ATOM 1532 O LYS B 14 2.634 15.941 -6.085 1.00 0.00 O ATOM 1533 CB LYS B 14 3.701 16.768 -9.097 1.00 0.00 C ATOM 1534 CG LYS B 14 4.585 17.984 -9.335 1.00 0.00 C ATOM 1535 CD LYS B 14 6.030 17.603 -9.611 1.00 0.00 C ATOM 1536 CE LYS B 14 6.919 18.832 -9.707 1.00 0.00 C ATOM 1537 NZ LYS B 14 6.489 19.751 -10.794 1.00 0.00 N ATOM 0 H LYS B 14 5.013 14.698 -9.418 1.00 0.00 H new ATOM 0 HA LYS B 14 4.771 16.500 -7.256 1.00 0.00 H new ATOM 0 HB2 LYS B 14 3.678 16.163 -10.003 1.00 0.00 H new ATOM 0 HB3 LYS B 14 2.680 17.102 -8.911 1.00 0.00 H new ATOM 0 HG2 LYS B 14 4.195 18.554 -10.178 1.00 0.00 H new ATOM 0 HG3 LYS B 14 4.544 18.636 -8.463 1.00 0.00 H new ATOM 0 HD2 LYS B 14 6.394 16.950 -8.817 1.00 0.00 H new ATOM 0 HD3 LYS B 14 6.087 17.037 -10.541 1.00 0.00 H new ATOM 0 HE2 LYS B 14 6.904 19.364 -8.756 1.00 0.00 H new ATOM 0 HE3 LYS B 14 7.949 18.521 -9.882 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 7.228 20.463 -10.959 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 6.331 19.207 -11.666 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 5.606 20.226 -10.518 1.00 0.00 H new ATOM 1551 N ILE B 15 2.312 14.341 -7.631 1.00 0.00 N ATOM 1552 CA ILE B 15 1.169 13.765 -6.930 1.00 0.00 C ATOM 1553 C ILE B 15 1.611 13.205 -5.580 1.00 0.00 C ATOM 1554 O ILE B 15 0.940 13.399 -4.567 1.00 0.00 O ATOM 1555 CB ILE B 15 0.481 12.651 -7.750 1.00 0.00 C ATOM 1556 CG1 ILE B 15 0.064 13.179 -9.125 1.00 0.00 C ATOM 1557 CG2 ILE B 15 -0.734 12.116 -6.999 1.00 0.00 C ATOM 1558 CD1 ILE B 15 -0.521 12.115 -10.030 1.00 0.00 C ATOM 0 H ILE B 15 2.555 13.876 -8.505 1.00 0.00 H new ATOM 0 HA ILE B 15 0.444 14.566 -6.783 1.00 0.00 H new ATOM 0 HB ILE B 15 1.191 11.836 -7.892 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -0.669 13.975 -8.993 1.00 0.00 H new ATOM 0 HG13 ILE B 15 0.932 13.623 -9.613 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -1.209 11.332 -7.588 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -0.418 11.708 -6.039 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -1.444 12.926 -6.832 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -0.794 12.561 -10.987 1.00 0.00 H new ATOM 0 HD12 ILE B 15 0.217 11.330 -10.193 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -1.408 11.687 -9.563 1.00 0.00 H new ATOM 1570 N LEU B 16 2.759 12.531 -5.576 1.00 0.00 N ATOM 1571 CA LEU B 16 3.337 12.008 -4.344 1.00 0.00 C ATOM 1572 C LEU B 16 3.602 13.141 -3.360 1.00 0.00 C ATOM 1573 O LEU B 16 3.318 13.019 -2.170 1.00 0.00 O ATOM 1574 CB LEU B 16 4.642 11.260 -4.633 1.00 0.00 C ATOM 1575 CG LEU B 16 4.490 9.946 -5.398 1.00 0.00 C ATOM 1576 CD1 LEU B 16 5.855 9.378 -5.752 1.00 0.00 C ATOM 1577 CD2 LEU B 16 3.697 8.946 -4.576 1.00 0.00 C ATOM 0 H LEU B 16 3.306 12.335 -6.414 1.00 0.00 H new ATOM 0 HA LEU B 16 2.623 11.312 -3.904 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.299 11.918 -5.202 1.00 0.00 H new ATOM 0 HB3 LEU B 16 5.140 11.053 -3.686 1.00 0.00 H new ATOM 0 HG LEU B 16 3.947 10.143 -6.323 1.00 0.00 H new ATOM 0 HD11 LEU B 16 5.730 8.442 -6.297 1.00 0.00 H new ATOM 0 HD12 LEU B 16 6.395 10.091 -6.375 1.00 0.00 H new ATOM 0 HD13 LEU B 16 6.420 9.193 -4.839 1.00 0.00 H new ATOM 0 HD21 LEU B 16 3.597 8.015 -5.134 1.00 0.00 H new ATOM 0 HD22 LEU B 16 4.217 8.753 -3.638 1.00 0.00 H new ATOM 0 HD23 LEU B 16 2.707 9.351 -4.366 1.00 0.00 H new ATOM 1589 N ALA B 17 4.134 14.244 -3.874 1.00 0.00 N ATOM 1590 CA ALA B 17 4.407 15.422 -3.058 1.00 0.00 C ATOM 1591 C ALA B 17 3.118 15.991 -2.474 1.00 0.00 C ATOM 1592 O ALA B 17 3.073 16.363 -1.302 1.00 0.00 O ATOM 1593 CB ALA B 17 5.134 16.478 -3.878 1.00 0.00 C ATOM 0 H ALA B 17 4.386 14.347 -4.857 1.00 0.00 H new ATOM 0 HA ALA B 17 5.049 15.122 -2.230 1.00 0.00 H new ATOM 0 HB1 ALA B 17 5.331 17.351 -3.255 1.00 0.00 H new ATOM 0 HB2 ALA B 17 6.078 16.071 -4.241 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.515 16.770 -4.726 1.00 0.00 H new ATOM 1599 N GLU B 18 2.073 16.046 -3.293 1.00 0.00 N ATOM 1600 CA GLU B 18 0.771 16.526 -2.843 1.00 0.00 C ATOM 1601 C GLU B 18 0.206 15.624 -1.753 1.00 0.00 C ATOM 1602 O GLU B 18 -0.261 16.109 -0.723 1.00 0.00 O ATOM 1603 CB GLU B 18 -0.205 16.610 -4.015 1.00 0.00 C ATOM 1604 CG GLU B 18 0.121 17.728 -4.991 1.00 0.00 C ATOM 1605 CD GLU B 18 -0.806 17.745 -6.186 1.00 0.00 C ATOM 1606 OE1 GLU B 18 -2.009 18.021 -6.008 1.00 0.00 O ATOM 1607 OE2 GLU B 18 -0.338 17.478 -7.310 1.00 0.00 O ATOM 0 H GLU B 18 2.102 15.764 -4.273 1.00 0.00 H new ATOM 0 HA GLU B 18 0.906 17.525 -2.428 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.203 15.660 -4.549 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -1.214 16.757 -3.629 1.00 0.00 H new ATOM 0 HG2 GLU B 18 0.059 18.686 -4.474 1.00 0.00 H new ATOM 0 HG3 GLU B 18 1.149 17.617 -5.335 1.00 0.00 H new ATOM 1614 N VAL B 19 0.264 14.316 -1.981 1.00 0.00 N ATOM 1615 CA VAL B 19 -0.182 13.343 -0.989 1.00 0.00 C ATOM 1616 C VAL B 19 0.624 13.491 0.301 1.00 0.00 C ATOM 1617 O VAL B 19 0.063 13.510 1.397 1.00 0.00 O ATOM 1618 CB VAL B 19 -0.060 11.895 -1.517 1.00 0.00 C ATOM 1619 CG1 VAL B 19 -0.402 10.884 -0.431 1.00 0.00 C ATOM 1620 CG2 VAL B 19 -0.959 11.690 -2.728 1.00 0.00 C ATOM 0 H VAL B 19 0.616 13.904 -2.845 1.00 0.00 H new ATOM 0 HA VAL B 19 -1.234 13.543 -0.785 1.00 0.00 H new ATOM 0 HB VAL B 19 0.976 11.735 -1.817 1.00 0.00 H new ATOM 0 HG11 VAL B 19 -0.308 9.874 -0.831 1.00 0.00 H new ATOM 0 HG12 VAL B 19 0.282 11.007 0.409 1.00 0.00 H new ATOM 0 HG13 VAL B 19 -1.425 11.046 -0.092 1.00 0.00 H new ATOM 0 HG21 VAL B 19 -0.860 10.665 -3.086 1.00 0.00 H new ATOM 0 HG22 VAL B 19 -1.995 11.878 -2.448 1.00 0.00 H new ATOM 0 HG23 VAL B 19 -0.667 12.380 -3.519 1.00 0.00 H new ATOM 1630 N ALA B 20 1.940 13.622 0.156 1.00 0.00 N ATOM 1631 CA ALA B 20 2.826 13.817 1.300 1.00 0.00 C ATOM 1632 C ALA B 20 2.477 15.099 2.053 1.00 0.00 C ATOM 1633 O ALA B 20 2.564 15.153 3.279 1.00 0.00 O ATOM 1634 CB ALA B 20 4.279 13.848 0.851 1.00 0.00 C ATOM 0 H ALA B 20 2.417 13.597 -0.745 1.00 0.00 H new ATOM 0 HA ALA B 20 2.687 12.975 1.979 1.00 0.00 H new ATOM 0 HB1 ALA B 20 4.924 13.994 1.717 1.00 0.00 H new ATOM 0 HB2 ALA B 20 4.530 12.905 0.366 1.00 0.00 H new ATOM 0 HB3 ALA B 20 4.425 14.668 0.147 1.00 0.00 H new ATOM 1640 N LEU B 21 2.075 16.128 1.316 1.00 0.00 N ATOM 1641 CA LEU B 21 1.665 17.383 1.929 1.00 0.00 C ATOM 1642 C LEU B 21 0.351 17.220 2.677 1.00 0.00 C ATOM 1643 O LEU B 21 0.132 17.875 3.685 1.00 0.00 O ATOM 1644 CB LEU B 21 1.549 18.494 0.887 1.00 0.00 C ATOM 1645 CG LEU B 21 2.882 19.019 0.356 1.00 0.00 C ATOM 1646 CD1 LEU B 21 2.646 20.097 -0.682 1.00 0.00 C ATOM 1647 CD2 LEU B 21 3.734 19.553 1.500 1.00 0.00 C ATOM 0 H LEU B 21 2.025 16.117 0.297 1.00 0.00 H new ATOM 0 HA LEU B 21 2.436 17.667 2.645 1.00 0.00 H new ATOM 0 HB2 LEU B 21 0.960 18.125 0.047 1.00 0.00 H new ATOM 0 HB3 LEU B 21 0.995 19.325 1.324 1.00 0.00 H new ATOM 0 HG LEU B 21 3.419 18.197 -0.117 1.00 0.00 H new ATOM 0 HD11 LEU B 21 3.604 20.462 -1.052 1.00 0.00 H new ATOM 0 HD12 LEU B 21 2.071 19.684 -1.511 1.00 0.00 H new ATOM 0 HD13 LEU B 21 2.093 20.921 -0.231 1.00 0.00 H new ATOM 0 HD21 LEU B 21 4.681 19.924 1.106 1.00 0.00 H new ATOM 0 HD22 LEU B 21 3.205 20.365 1.999 1.00 0.00 H new ATOM 0 HD23 LEU B 21 3.927 18.753 2.215 1.00 0.00 H new ATOM 1659 N VAL B 22 -0.519 16.345 2.186 1.00 0.00 N ATOM 1660 CA VAL B 22 -1.757 16.029 2.894 1.00 0.00 C ATOM 1661 C VAL B 22 -1.426 15.381 4.233 1.00 0.00 C ATOM 1662 O VAL B 22 -2.049 15.675 5.258 1.00 0.00 O ATOM 1663 CB VAL B 22 -2.669 15.088 2.072 1.00 0.00 C ATOM 1664 CG1 VAL B 22 -3.913 14.710 2.864 1.00 0.00 C ATOM 1665 CG2 VAL B 22 -3.056 15.738 0.754 1.00 0.00 C ATOM 0 H VAL B 22 -0.393 15.844 1.307 1.00 0.00 H new ATOM 0 HA VAL B 22 -2.299 16.961 3.051 1.00 0.00 H new ATOM 0 HB VAL B 22 -2.111 14.176 1.859 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -4.538 14.048 2.265 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -3.619 14.200 3.781 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -4.473 15.611 3.113 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.697 15.062 0.189 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -3.591 16.667 0.950 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -2.157 15.952 0.176 1.00 0.00 H new ATOM 1675 N LEU B 23 -0.421 14.514 4.212 1.00 0.00 N ATOM 1676 CA LEU B 23 0.077 13.872 5.419 1.00 0.00 C ATOM 1677 C LEU B 23 0.639 14.919 6.373 1.00 0.00 C ATOM 1678 O LEU B 23 0.239 14.997 7.535 1.00 0.00 O ATOM 1679 CB LEU B 23 1.169 12.861 5.060 1.00 0.00 C ATOM 1680 CG LEU B 23 0.801 11.854 3.970 1.00 0.00 C ATOM 1681 CD1 LEU B 23 2.012 11.024 3.585 1.00 0.00 C ATOM 1682 CD2 LEU B 23 -0.334 10.955 4.432 1.00 0.00 C ATOM 0 H LEU B 23 0.069 14.238 3.361 1.00 0.00 H new ATOM 0 HA LEU B 23 -0.747 13.351 5.907 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.056 13.408 4.740 1.00 0.00 H new ATOM 0 HB3 LEU B 23 1.441 12.311 5.961 1.00 0.00 H new ATOM 0 HG LEU B 23 0.465 12.406 3.092 1.00 0.00 H new ATOM 0 HD11 LEU B 23 1.733 10.312 2.808 1.00 0.00 H new ATOM 0 HD12 LEU B 23 2.798 11.680 3.211 1.00 0.00 H new ATOM 0 HD13 LEU B 23 2.375 10.483 4.459 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -0.581 10.246 3.642 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.027 10.411 5.325 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -1.210 11.563 4.661 1.00 0.00 H new ATOM 1694 N GLU B 24 1.551 15.735 5.857 1.00 0.00 N ATOM 1695 CA GLU B 24 2.208 16.774 6.642 1.00 0.00 C ATOM 1696 C GLU B 24 1.188 17.782 7.176 1.00 0.00 C ATOM 1697 O GLU B 24 1.314 18.278 8.296 1.00 0.00 O ATOM 1698 CB GLU B 24 3.255 17.485 5.774 1.00 0.00 C ATOM 1699 CG GLU B 24 4.219 18.360 6.562 1.00 0.00 C ATOM 1700 CD GLU B 24 5.275 19.003 5.684 1.00 0.00 C ATOM 1701 OE1 GLU B 24 6.167 18.281 5.187 1.00 0.00 O ATOM 1702 OE2 GLU B 24 5.221 20.232 5.489 1.00 0.00 O ATOM 0 H GLU B 24 1.856 15.695 4.884 1.00 0.00 H new ATOM 0 HA GLU B 24 2.700 16.310 7.497 1.00 0.00 H new ATOM 0 HB2 GLU B 24 3.826 16.736 5.224 1.00 0.00 H new ATOM 0 HB3 GLU B 24 2.742 18.101 5.035 1.00 0.00 H new ATOM 0 HG2 GLU B 24 3.658 19.139 7.078 1.00 0.00 H new ATOM 0 HG3 GLU B 24 4.707 17.758 7.328 1.00 0.00 H new ATOM 1709 N LYS B 25 0.167 18.057 6.371 1.00 0.00 N ATOM 1710 CA LYS B 25 -0.871 19.025 6.718 1.00 0.00 C ATOM 1711 C LYS B 25 -1.727 18.512 7.876 1.00 0.00 C ATOM 1712 O LYS B 25 -2.325 19.292 8.608 1.00 0.00 O ATOM 1713 CB LYS B 25 -1.738 19.303 5.479 1.00 0.00 C ATOM 1714 CG LYS B 25 -2.500 20.622 5.501 1.00 0.00 C ATOM 1715 CD LYS B 25 -3.857 20.502 6.179 1.00 0.00 C ATOM 1716 CE LYS B 25 -4.660 21.784 6.027 1.00 0.00 C ATOM 1717 NZ LYS B 25 -5.976 21.708 6.716 1.00 0.00 N ATOM 0 H LYS B 25 0.035 17.617 5.461 1.00 0.00 H new ATOM 0 HA LYS B 25 -0.401 19.953 7.043 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -1.098 19.287 4.597 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -2.455 18.490 5.368 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -1.904 21.373 6.019 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -2.638 20.975 4.479 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -4.411 19.669 5.746 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -3.720 20.278 7.237 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -4.088 22.619 6.431 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -4.818 21.989 4.968 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -6.488 22.604 6.586 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -6.534 20.928 6.314 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -5.827 21.539 7.731 1.00 0.00 H new ATOM 1731 N HIS B 26 -1.779 17.197 8.046 1.00 0.00 N ATOM 1732 CA HIS B 26 -2.565 16.604 9.126 1.00 0.00 C ATOM 1733 C HIS B 26 -1.668 15.989 10.193 1.00 0.00 C ATOM 1734 O HIS B 26 -2.148 15.263 11.065 1.00 0.00 O ATOM 1735 CB HIS B 26 -3.528 15.541 8.589 1.00 0.00 C ATOM 1736 CG HIS B 26 -4.748 16.102 7.928 1.00 0.00 C ATOM 1737 ND1 HIS B 26 -5.975 16.180 8.552 1.00 0.00 N ATOM 1738 CD2 HIS B 26 -4.933 16.602 6.685 1.00 0.00 C ATOM 1739 CE1 HIS B 26 -6.856 16.701 7.722 1.00 0.00 C ATOM 1740 NE2 HIS B 26 -6.251 16.965 6.583 1.00 0.00 N ATOM 0 H HIS B 26 -1.291 16.523 7.456 1.00 0.00 H new ATOM 0 HA HIS B 26 -3.144 17.409 9.579 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.997 14.912 7.874 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -3.837 14.897 9.412 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -4.181 16.698 5.915 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -7.898 16.881 7.939 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -6.691 17.373 5.759 1.00 0.00 H new ATOM 1749 N ALA B 27 -0.371 16.293 10.116 1.00 0.00 N ATOM 1750 CA ALA B 27 0.613 15.790 11.078 1.00 0.00 C ATOM 1751 C ALA B 27 0.629 14.261 11.108 1.00 0.00 C ATOM 1752 O ALA B 27 0.597 13.645 12.174 1.00 0.00 O ATOM 1753 CB ALA B 27 0.342 16.354 12.468 1.00 0.00 C ATOM 0 H ALA B 27 0.025 16.891 9.391 1.00 0.00 H new ATOM 0 HA ALA B 27 1.598 16.126 10.755 1.00 0.00 H new ATOM 0 HB1 ALA B 27 1.083 15.969 13.168 1.00 0.00 H new ATOM 0 HB2 ALA B 27 0.403 17.442 12.437 1.00 0.00 H new ATOM 0 HB3 ALA B 27 -0.654 16.055 12.794 1.00 0.00 H new ATOM 1759 N ALA B 28 0.678 13.656 9.929 1.00 0.00 N ATOM 1760 CA ALA B 28 0.738 12.208 9.818 1.00 0.00 C ATOM 1761 C ALA B 28 2.175 11.715 9.909 1.00 0.00 C ATOM 1762 O ALA B 28 3.004 12.023 9.050 1.00 0.00 O ATOM 1763 CB ALA B 28 0.100 11.752 8.514 1.00 0.00 C ATOM 0 H ALA B 28 0.677 14.148 9.035 1.00 0.00 H new ATOM 0 HA ALA B 28 0.180 11.778 10.650 1.00 0.00 H new ATOM 0 HB1 ALA B 28 0.152 10.665 8.444 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -0.943 12.068 8.489 1.00 0.00 H new ATOM 0 HB3 ALA B 28 0.633 12.196 7.673 1.00 0.00 H new ATOM 1769 N SER B 29 2.465 10.958 10.959 1.00 0.00 N ATOM 1770 CA SER B 29 3.788 10.387 11.161 1.00 0.00 C ATOM 1771 C SER B 29 4.063 9.296 10.118 1.00 0.00 C ATOM 1772 O SER B 29 3.129 8.792 9.486 1.00 0.00 O ATOM 1773 CB SER B 29 3.881 9.819 12.580 1.00 0.00 C ATOM 1774 OG SER B 29 3.339 10.722 13.529 1.00 0.00 O ATOM 0 H SER B 29 1.793 10.724 11.690 1.00 0.00 H new ATOM 0 HA SER B 29 4.542 11.164 11.039 1.00 0.00 H new ATOM 0 HB2 SER B 29 3.347 8.870 12.631 1.00 0.00 H new ATOM 0 HB3 SER B 29 4.923 9.612 12.824 1.00 0.00 H new ATOM 0 HG SER B 29 2.559 10.314 13.960 1.00 0.00 H new ATOM 1780 N PRO B 30 5.345 8.924 9.909 1.00 0.00 N ATOM 1781 CA PRO B 30 5.739 7.919 8.907 1.00 0.00 C ATOM 1782 C PRO B 30 4.984 6.593 9.037 1.00 0.00 C ATOM 1783 O PRO B 30 4.581 6.004 8.034 1.00 0.00 O ATOM 1784 CB PRO B 30 7.237 7.702 9.170 1.00 0.00 C ATOM 1785 CG PRO B 30 7.518 8.359 10.481 1.00 0.00 C ATOM 1786 CD PRO B 30 6.519 9.468 10.610 1.00 0.00 C ATOM 0 HA PRO B 30 5.508 8.268 7.900 1.00 0.00 H new ATOM 0 HB2 PRO B 30 7.478 6.640 9.205 1.00 0.00 H new ATOM 0 HB3 PRO B 30 7.841 8.140 8.375 1.00 0.00 H new ATOM 0 HG2 PRO B 30 7.421 7.649 11.302 1.00 0.00 H new ATOM 0 HG3 PRO B 30 8.537 8.746 10.513 1.00 0.00 H new ATOM 0 HD2 PRO B 30 6.299 9.696 11.653 1.00 0.00 H new ATOM 0 HD3 PRO B 30 6.875 10.390 10.150 1.00 0.00 H new ATOM 1794 N GLU B 31 4.782 6.128 10.263 1.00 0.00 N ATOM 1795 CA GLU B 31 4.109 4.855 10.481 1.00 0.00 C ATOM 1796 C GLU B 31 2.627 4.939 10.106 1.00 0.00 C ATOM 1797 O GLU B 31 2.078 4.014 9.501 1.00 0.00 O ATOM 1798 CB GLU B 31 4.318 4.362 11.921 1.00 0.00 C ATOM 1799 CG GLU B 31 4.426 5.460 12.975 1.00 0.00 C ATOM 1800 CD GLU B 31 3.096 6.090 13.322 1.00 0.00 C ATOM 1801 OE1 GLU B 31 2.391 5.550 14.196 1.00 0.00 O ATOM 1802 OE2 GLU B 31 2.756 7.128 12.721 1.00 0.00 O ATOM 0 H GLU B 31 5.072 6.609 11.115 1.00 0.00 H new ATOM 0 HA GLU B 31 4.559 4.114 9.820 1.00 0.00 H new ATOM 0 HB2 GLU B 31 3.489 3.706 12.187 1.00 0.00 H new ATOM 0 HB3 GLU B 31 5.225 3.759 11.953 1.00 0.00 H new ATOM 0 HG2 GLU B 31 4.870 5.043 13.879 1.00 0.00 H new ATOM 0 HG3 GLU B 31 5.104 6.234 12.615 1.00 0.00 H new ATOM 1809 N LEU B 32 1.992 6.051 10.449 1.00 0.00 N ATOM 1810 CA LEU B 32 0.630 6.332 10.015 1.00 0.00 C ATOM 1811 C LEU B 32 0.585 6.441 8.498 1.00 0.00 C ATOM 1812 O LEU B 32 -0.324 5.925 7.853 1.00 0.00 O ATOM 1813 CB LEU B 32 0.131 7.634 10.652 1.00 0.00 C ATOM 1814 CG LEU B 32 -1.253 8.108 10.196 1.00 0.00 C ATOM 1815 CD1 LEU B 32 -2.312 7.062 10.509 1.00 0.00 C ATOM 1816 CD2 LEU B 32 -1.606 9.434 10.854 1.00 0.00 C ATOM 0 H LEU B 32 2.403 6.780 11.032 1.00 0.00 H new ATOM 0 HA LEU B 32 -0.020 5.516 10.333 1.00 0.00 H new ATOM 0 HB2 LEU B 32 0.112 7.504 11.734 1.00 0.00 H new ATOM 0 HB3 LEU B 32 0.853 8.422 10.438 1.00 0.00 H new ATOM 0 HG LEU B 32 -1.224 8.253 9.116 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -3.286 7.420 10.177 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -2.071 6.134 9.991 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -2.339 6.882 11.584 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -2.592 9.755 10.519 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -1.613 9.312 11.937 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -0.866 10.185 10.578 1.00 0.00 H new ATOM 1828 N THR B 33 1.587 7.113 7.947 1.00 0.00 N ATOM 1829 CA THR B 33 1.735 7.264 6.506 1.00 0.00 C ATOM 1830 C THR B 33 1.704 5.906 5.802 1.00 0.00 C ATOM 1831 O THR B 33 0.983 5.712 4.821 1.00 0.00 O ATOM 1832 CB THR B 33 3.065 7.977 6.183 1.00 0.00 C ATOM 1833 OG1 THR B 33 3.049 9.316 6.704 1.00 0.00 O ATOM 1834 CG2 THR B 33 3.331 8.004 4.685 1.00 0.00 C ATOM 0 H THR B 33 2.321 7.570 8.488 1.00 0.00 H new ATOM 0 HA THR B 33 0.899 7.862 6.144 1.00 0.00 H new ATOM 0 HB THR B 33 3.869 7.415 6.658 1.00 0.00 H new ATOM 0 HG1 THR B 33 3.072 9.286 7.683 1.00 0.00 H new ATOM 0 HG21 THR B 33 4.275 8.513 4.492 1.00 0.00 H new ATOM 0 HG22 THR B 33 3.385 6.983 4.307 1.00 0.00 H new ATOM 0 HG23 THR B 33 2.523 8.535 4.182 1.00 0.00 H new ATOM 1842 N LEU B 34 2.474 4.961 6.324 1.00 0.00 N ATOM 1843 CA LEU B 34 2.568 3.641 5.724 1.00 0.00 C ATOM 1844 C LEU B 34 1.252 2.880 5.893 1.00 0.00 C ATOM 1845 O LEU B 34 0.820 2.162 4.989 1.00 0.00 O ATOM 1846 CB LEU B 34 3.746 2.874 6.336 1.00 0.00 C ATOM 1847 CG LEU B 34 4.148 1.597 5.598 1.00 0.00 C ATOM 1848 CD1 LEU B 34 5.642 1.355 5.731 1.00 0.00 C ATOM 1849 CD2 LEU B 34 3.386 0.397 6.138 1.00 0.00 C ATOM 0 H LEU B 34 3.042 5.086 7.162 1.00 0.00 H new ATOM 0 HA LEU B 34 2.750 3.745 4.654 1.00 0.00 H new ATOM 0 HB2 LEU B 34 4.609 3.538 6.376 1.00 0.00 H new ATOM 0 HB3 LEU B 34 3.495 2.616 7.365 1.00 0.00 H new ATOM 0 HG LEU B 34 3.898 1.726 4.545 1.00 0.00 H new ATOM 0 HD11 LEU B 34 5.911 0.442 5.200 1.00 0.00 H new ATOM 0 HD12 LEU B 34 6.186 2.197 5.304 1.00 0.00 H new ATOM 0 HD13 LEU B 34 5.902 1.252 6.785 1.00 0.00 H new ATOM 0 HD21 LEU B 34 3.689 -0.500 5.597 1.00 0.00 H new ATOM 0 HD22 LEU B 34 3.606 0.273 7.198 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.316 0.556 6.006 1.00 0.00 H new ATOM 1861 N MET B 35 0.604 3.058 7.039 1.00 0.00 N ATOM 1862 CA MET B 35 -0.699 2.442 7.282 1.00 0.00 C ATOM 1863 C MET B 35 -1.741 3.030 6.329 1.00 0.00 C ATOM 1864 O MET B 35 -2.675 2.345 5.904 1.00 0.00 O ATOM 1865 CB MET B 35 -1.127 2.628 8.745 1.00 0.00 C ATOM 1866 CG MET B 35 -2.453 1.961 9.081 1.00 0.00 C ATOM 1867 SD MET B 35 -2.780 1.879 10.856 1.00 0.00 S ATOM 1868 CE MET B 35 -2.800 3.613 11.299 1.00 0.00 C ATOM 0 H MET B 35 0.957 3.621 7.813 1.00 0.00 H new ATOM 0 HA MET B 35 -0.620 1.371 7.093 1.00 0.00 H new ATOM 0 HB2 MET B 35 -0.351 2.224 9.396 1.00 0.00 H new ATOM 0 HB3 MET B 35 -1.201 3.694 8.961 1.00 0.00 H new ATOM 0 HG2 MET B 35 -3.261 2.508 8.594 1.00 0.00 H new ATOM 0 HG3 MET B 35 -2.459 0.951 8.670 1.00 0.00 H new ATOM 0 HE1 MET B 35 -3.113 3.720 12.338 1.00 0.00 H new ATOM 0 HE2 MET B 35 -1.801 4.031 11.177 1.00 0.00 H new ATOM 0 HE3 MET B 35 -3.498 4.146 10.653 1.00 0.00 H new ATOM 1878 N ILE B 36 -1.566 4.302 5.993 1.00 0.00 N ATOM 1879 CA ILE B 36 -2.405 4.971 5.010 1.00 0.00 C ATOM 1880 C ILE B 36 -2.230 4.340 3.629 1.00 0.00 C ATOM 1881 O ILE B 36 -3.210 4.094 2.924 1.00 0.00 O ATOM 1882 CB ILE B 36 -2.087 6.486 4.960 1.00 0.00 C ATOM 1883 CG1 ILE B 36 -2.702 7.176 6.181 1.00 0.00 C ATOM 1884 CG2 ILE B 36 -2.577 7.126 3.663 1.00 0.00 C ATOM 1885 CD1 ILE B 36 -2.406 8.655 6.264 1.00 0.00 C ATOM 0 H ILE B 36 -0.840 4.896 6.394 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.445 4.848 5.312 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.005 6.613 4.983 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -3.782 7.033 6.161 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -2.333 6.691 7.084 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.335 8.189 3.667 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -2.090 6.646 2.814 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -3.657 7.000 3.581 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -2.876 9.071 7.155 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -1.328 8.808 6.317 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -2.800 9.155 5.379 1.00 0.00 H new ATOM 1897 N ALA B 37 -0.985 4.053 3.265 1.00 0.00 N ATOM 1898 CA ALA B 37 -0.686 3.390 1.998 1.00 0.00 C ATOM 1899 C ALA B 37 -1.386 2.039 1.923 1.00 0.00 C ATOM 1900 O ALA B 37 -1.885 1.642 0.868 1.00 0.00 O ATOM 1901 CB ALA B 37 0.816 3.217 1.832 1.00 0.00 C ATOM 0 H ALA B 37 -0.164 4.269 3.830 1.00 0.00 H new ATOM 0 HA ALA B 37 -1.056 4.016 1.186 1.00 0.00 H new ATOM 0 HB1 ALA B 37 1.023 2.722 0.883 1.00 0.00 H new ATOM 0 HB2 ALA B 37 1.298 4.194 1.843 1.00 0.00 H new ATOM 0 HB3 ALA B 37 1.205 2.611 2.650 1.00 0.00 H new ATOM 1907 N GLY B 38 -1.422 1.343 3.054 1.00 0.00 N ATOM 1908 CA GLY B 38 -2.123 0.076 3.130 1.00 0.00 C ATOM 1909 C GLY B 38 -3.604 0.238 2.877 1.00 0.00 C ATOM 1910 O GLY B 38 -4.211 -0.561 2.163 1.00 0.00 O ATOM 0 H GLY B 38 -0.976 1.636 3.923 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -1.703 -0.616 2.400 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -1.969 -0.366 4.114 1.00 0.00 H new ATOM 1914 N ASN B 39 -4.182 1.284 3.454 1.00 0.00 N ATOM 1915 CA ASN B 39 -5.589 1.602 3.239 1.00 0.00 C ATOM 1916 C ASN B 39 -5.859 1.865 1.766 1.00 0.00 C ATOM 1917 O ASN B 39 -6.846 1.378 1.214 1.00 0.00 O ATOM 1918 CB ASN B 39 -6.003 2.819 4.070 1.00 0.00 C ATOM 1919 CG ASN B 39 -6.395 2.462 5.492 1.00 0.00 C ATOM 1920 OD1 ASN B 39 -7.564 2.210 5.777 1.00 0.00 O ATOM 1921 ND2 ASN B 39 -5.424 2.436 6.397 1.00 0.00 N ATOM 0 H ASN B 39 -3.696 1.929 4.077 1.00 0.00 H new ATOM 0 HA ASN B 39 -6.180 0.744 3.558 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -5.179 3.532 4.095 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -6.841 3.317 3.582 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -5.637 2.201 7.367 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -4.465 2.651 6.123 1.00 0.00 H new ATOM 1928 N ILE B 40 -4.971 2.630 1.133 1.00 0.00 N ATOM 1929 CA ILE B 40 -5.085 2.929 -0.291 1.00 0.00 C ATOM 1930 C ILE B 40 -5.125 1.640 -1.107 1.00 0.00 C ATOM 1931 O ILE B 40 -6.102 1.369 -1.805 1.00 0.00 O ATOM 1932 CB ILE B 40 -3.908 3.806 -0.789 1.00 0.00 C ATOM 1933 CG1 ILE B 40 -3.874 5.146 -0.044 1.00 0.00 C ATOM 1934 CG2 ILE B 40 -4.012 4.038 -2.292 1.00 0.00 C ATOM 1935 CD1 ILE B 40 -2.694 6.023 -0.418 1.00 0.00 C ATOM 0 H ILE B 40 -4.162 3.055 1.587 1.00 0.00 H new ATOM 0 HA ILE B 40 -6.014 3.483 -0.428 1.00 0.00 H new ATOM 0 HB ILE B 40 -2.979 3.275 -0.583 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -4.797 5.688 -0.248 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -3.847 4.954 1.029 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -3.177 4.656 -2.623 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -3.983 3.080 -2.811 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -4.950 4.545 -2.518 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -2.738 6.953 0.149 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -1.765 5.501 -0.188 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -2.730 6.246 -1.484 1.00 0.00 H new ATOM 1947 N ALA B 41 -4.068 0.841 -0.990 1.00 0.00 N ATOM 1948 CA ALA B 41 -3.947 -0.403 -1.738 1.00 0.00 C ATOM 1949 C ALA B 41 -5.146 -1.316 -1.509 1.00 0.00 C ATOM 1950 O ALA B 41 -5.745 -1.816 -2.460 1.00 0.00 O ATOM 1951 CB ALA B 41 -2.659 -1.118 -1.360 1.00 0.00 C ATOM 0 H ALA B 41 -3.277 1.037 -0.377 1.00 0.00 H new ATOM 0 HA ALA B 41 -3.921 -0.153 -2.799 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -2.579 -2.047 -1.925 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -1.807 -0.479 -1.590 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -2.667 -1.342 -0.293 1.00 0.00 H new ATOM 1957 N THR B 42 -5.506 -1.511 -0.247 1.00 0.00 N ATOM 1958 CA THR B 42 -6.605 -2.397 0.106 1.00 0.00 C ATOM 1959 C THR B 42 -7.926 -1.922 -0.504 1.00 0.00 C ATOM 1960 O THR B 42 -8.677 -2.718 -1.070 1.00 0.00 O ATOM 1961 CB THR B 42 -6.749 -2.518 1.635 1.00 0.00 C ATOM 1962 OG1 THR B 42 -5.493 -2.904 2.207 1.00 0.00 O ATOM 1963 CG2 THR B 42 -7.811 -3.540 2.004 1.00 0.00 C ATOM 0 H THR B 42 -5.051 -1.066 0.550 1.00 0.00 H new ATOM 0 HA THR B 42 -6.370 -3.379 -0.304 1.00 0.00 H new ATOM 0 HB THR B 42 -7.053 -1.548 2.029 1.00 0.00 H new ATOM 0 HG1 THR B 42 -4.989 -2.103 2.460 1.00 0.00 H new ATOM 0 HG21 THR B 42 -7.892 -3.605 3.089 1.00 0.00 H new ATOM 0 HG22 THR B 42 -8.770 -3.235 1.586 1.00 0.00 H new ATOM 0 HG23 THR B 42 -7.534 -4.514 1.602 1.00 0.00 H new ATOM 1971 N ASN B 43 -8.199 -0.624 -0.412 1.00 0.00 N ATOM 1972 CA ASN B 43 -9.433 -0.069 -0.960 1.00 0.00 C ATOM 1973 C ASN B 43 -9.460 -0.205 -2.477 1.00 0.00 C ATOM 1974 O ASN B 43 -10.513 -0.455 -3.064 1.00 0.00 O ATOM 1975 CB ASN B 43 -9.609 1.396 -0.551 1.00 0.00 C ATOM 1976 CG ASN B 43 -10.071 1.545 0.888 1.00 0.00 C ATOM 1977 OD1 ASN B 43 -10.815 0.709 1.404 1.00 0.00 O ATOM 1978 ND2 ASN B 43 -9.632 2.607 1.546 1.00 0.00 N ATOM 0 H ASN B 43 -7.587 0.060 0.034 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.266 -0.638 -0.547 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -8.664 1.923 -0.682 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -10.333 1.871 -1.213 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -9.909 2.756 2.516 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -9.017 3.276 1.082 1.00 0.00 H new ATOM 1985 N VAL B 44 -8.300 -0.056 -3.110 1.00 0.00 N ATOM 1986 CA VAL B 44 -8.189 -0.249 -4.552 1.00 0.00 C ATOM 1987 C VAL B 44 -8.509 -1.695 -4.917 1.00 0.00 C ATOM 1988 O VAL B 44 -9.254 -1.954 -5.859 1.00 0.00 O ATOM 1989 CB VAL B 44 -6.780 0.124 -5.072 1.00 0.00 C ATOM 1990 CG1 VAL B 44 -6.627 -0.219 -6.548 1.00 0.00 C ATOM 1991 CG2 VAL B 44 -6.509 1.603 -4.848 1.00 0.00 C ATOM 0 H VAL B 44 -7.426 0.197 -2.649 1.00 0.00 H new ATOM 0 HA VAL B 44 -8.910 0.415 -5.029 1.00 0.00 H new ATOM 0 HB VAL B 44 -6.051 -0.461 -4.511 1.00 0.00 H new ATOM 0 HG11 VAL B 44 -5.627 0.055 -6.883 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -6.777 -1.289 -6.690 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -7.368 0.331 -7.128 1.00 0.00 H new ATOM 0 HG21 VAL B 44 -5.514 1.851 -5.219 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -7.253 2.194 -5.382 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -6.565 1.826 -3.783 1.00 0.00 H new ATOM 2001 N LEU B 45 -7.971 -2.629 -4.138 1.00 0.00 N ATOM 2002 CA LEU B 45 -8.206 -4.053 -4.363 1.00 0.00 C ATOM 2003 C LEU B 45 -9.680 -4.403 -4.193 1.00 0.00 C ATOM 2004 O LEU B 45 -10.181 -5.346 -4.806 1.00 0.00 O ATOM 2005 CB LEU B 45 -7.363 -4.891 -3.398 1.00 0.00 C ATOM 2006 CG LEU B 45 -5.847 -4.721 -3.533 1.00 0.00 C ATOM 2007 CD1 LEU B 45 -5.126 -5.520 -2.458 1.00 0.00 C ATOM 2008 CD2 LEU B 45 -5.383 -5.143 -4.917 1.00 0.00 C ATOM 0 H LEU B 45 -7.367 -2.425 -3.342 1.00 0.00 H new ATOM 0 HA LEU B 45 -7.914 -4.280 -5.388 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -7.651 -4.638 -2.377 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -7.608 -5.943 -3.547 1.00 0.00 H new ATOM 0 HG LEU B 45 -5.604 -3.667 -3.399 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -4.049 -5.389 -2.568 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -5.436 -5.169 -1.474 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -5.375 -6.576 -2.561 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -4.303 -5.015 -4.994 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -5.637 -6.190 -5.082 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -5.876 -4.527 -5.669 1.00 0.00 H new ATOM 2020 N ASN B 46 -10.369 -3.642 -3.359 1.00 0.00 N ATOM 2021 CA ASN B 46 -11.791 -3.858 -3.131 1.00 0.00 C ATOM 2022 C ASN B 46 -12.624 -3.404 -4.327 1.00 0.00 C ATOM 2023 O ASN B 46 -13.486 -4.141 -4.805 1.00 0.00 O ATOM 2024 CB ASN B 46 -12.250 -3.122 -1.868 1.00 0.00 C ATOM 2025 CG ASN B 46 -12.086 -3.947 -0.602 1.00 0.00 C ATOM 2026 OD1 ASN B 46 -13.009 -4.637 -0.171 1.00 0.00 O ATOM 2027 ND2 ASN B 46 -10.908 -3.891 0.000 1.00 0.00 N ATOM 0 H ASN B 46 -9.968 -2.869 -2.828 1.00 0.00 H new ATOM 0 HA ASN B 46 -11.943 -4.929 -2.997 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -11.682 -2.197 -1.767 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.298 -2.842 -1.979 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -10.743 -4.431 0.850 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -10.165 -3.308 -0.386 1.00 0.00 H new ATOM 2034 N GLN B 47 -12.353 -2.204 -4.827 1.00 0.00 N ATOM 2035 CA GLN B 47 -13.198 -1.618 -5.862 1.00 0.00 C ATOM 2036 C GLN B 47 -12.466 -1.413 -7.194 1.00 0.00 C ATOM 2037 O GLN B 47 -12.825 -2.026 -8.202 1.00 0.00 O ATOM 2038 CB GLN B 47 -13.807 -0.295 -5.368 1.00 0.00 C ATOM 2039 CG GLN B 47 -12.797 0.684 -4.789 1.00 0.00 C ATOM 2040 CD GLN B 47 -13.428 1.987 -4.344 1.00 0.00 C ATOM 2041 OE1 GLN B 47 -13.551 2.928 -5.127 1.00 0.00 O ATOM 2042 NE2 GLN B 47 -13.822 2.056 -3.082 1.00 0.00 N ATOM 0 H GLN B 47 -11.566 -1.624 -4.538 1.00 0.00 H new ATOM 0 HA GLN B 47 -13.996 -2.334 -6.058 1.00 0.00 H new ATOM 0 HB2 GLN B 47 -14.325 0.185 -6.198 1.00 0.00 H new ATOM 0 HB3 GLN B 47 -14.557 -0.516 -4.609 1.00 0.00 H new ATOM 0 HG2 GLN B 47 -12.295 0.221 -3.940 1.00 0.00 H new ATOM 0 HG3 GLN B 47 -12.032 0.893 -5.536 1.00 0.00 H new ATOM 0 HE21 GLN B 47 -13.702 1.252 -2.466 1.00 0.00 H new ATOM 0 HE22 GLN B 47 -14.246 2.913 -2.726 1.00 0.00 H new ATOM 2051 N ARG B 48 -11.431 -0.578 -7.198 1.00 0.00 N ATOM 2052 CA ARG B 48 -10.802 -0.136 -8.442 1.00 0.00 C ATOM 2053 C ARG B 48 -9.729 -1.106 -8.940 1.00 0.00 C ATOM 2054 O ARG B 48 -8.570 -0.730 -9.095 1.00 0.00 O ATOM 2055 CB ARG B 48 -10.197 1.262 -8.273 1.00 0.00 C ATOM 2056 CG ARG B 48 -11.229 2.379 -8.230 1.00 0.00 C ATOM 2057 CD ARG B 48 -10.570 3.747 -8.118 1.00 0.00 C ATOM 2058 NE ARG B 48 -11.535 4.839 -8.259 1.00 0.00 N ATOM 2059 CZ ARG B 48 -11.334 6.082 -7.818 1.00 0.00 C ATOM 2060 NH1 ARG B 48 -10.206 6.404 -7.197 1.00 0.00 N ATOM 2061 NH2 ARG B 48 -12.261 7.010 -8.012 1.00 0.00 N ATOM 0 H ARG B 48 -11.009 -0.193 -6.353 1.00 0.00 H new ATOM 0 HA ARG B 48 -11.590 -0.107 -9.194 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -9.612 1.285 -7.354 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -9.506 1.450 -9.095 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -11.843 2.343 -9.130 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.897 2.226 -7.382 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -10.069 3.829 -7.153 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -9.802 3.842 -8.885 1.00 0.00 H new ATOM 0 HE ARG B 48 -12.419 4.636 -8.725 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -9.484 5.698 -7.053 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -10.062 7.357 -6.863 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -13.126 6.773 -8.498 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -12.109 7.961 -7.676 1.00 0.00 H new ATOM 2075 N VAL B 49 -10.121 -2.345 -9.190 1.00 0.00 N ATOM 2076 CA VAL B 49 -9.240 -3.317 -9.821 1.00 0.00 C ATOM 2077 C VAL B 49 -10.053 -4.526 -10.279 1.00 0.00 C ATOM 2078 O VAL B 49 -11.108 -4.819 -9.709 1.00 0.00 O ATOM 2079 CB VAL B 49 -8.101 -3.769 -8.872 1.00 0.00 C ATOM 2080 CG1 VAL B 49 -8.637 -4.628 -7.742 1.00 0.00 C ATOM 2081 CG2 VAL B 49 -7.013 -4.505 -9.641 1.00 0.00 C ATOM 0 H VAL B 49 -11.049 -2.704 -8.964 1.00 0.00 H new ATOM 0 HA VAL B 49 -8.775 -2.837 -10.682 1.00 0.00 H new ATOM 0 HB VAL B 49 -7.660 -2.874 -8.432 1.00 0.00 H new ATOM 0 HG11 VAL B 49 -7.815 -4.930 -7.093 1.00 0.00 H new ATOM 0 HG12 VAL B 49 -9.364 -4.057 -7.165 1.00 0.00 H new ATOM 0 HG13 VAL B 49 -9.117 -5.515 -8.155 1.00 0.00 H new ATOM 0 HG21 VAL B 49 -6.225 -4.812 -8.953 1.00 0.00 H new ATOM 0 HG22 VAL B 49 -7.439 -5.386 -10.121 1.00 0.00 H new ATOM 0 HG23 VAL B 49 -6.594 -3.845 -10.401 1.00 0.00 H new ATOM 2091 N ALA B 50 -9.582 -5.200 -11.320 1.00 0.00 N ATOM 2092 CA ALA B 50 -10.261 -6.377 -11.842 1.00 0.00 C ATOM 2093 C ALA B 50 -10.341 -7.478 -10.790 1.00 0.00 C ATOM 2094 O ALA B 50 -9.344 -7.803 -10.146 1.00 0.00 O ATOM 2095 CB ALA B 50 -9.553 -6.883 -13.085 1.00 0.00 C ATOM 0 H ALA B 50 -8.729 -4.950 -11.821 1.00 0.00 H new ATOM 0 HA ALA B 50 -11.279 -6.092 -12.107 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -10.071 -7.764 -13.466 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -9.554 -6.104 -13.847 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -8.525 -7.146 -12.836 1.00 0.00 H new ATOM 2101 N ALA B 51 -11.535 -8.038 -10.628 1.00 0.00 N ATOM 2102 CA ALA B 51 -11.793 -9.088 -9.645 1.00 0.00 C ATOM 2103 C ALA B 51 -10.782 -10.230 -9.734 1.00 0.00 C ATOM 2104 O ALA B 51 -10.250 -10.674 -8.715 1.00 0.00 O ATOM 2105 CB ALA B 51 -13.205 -9.627 -9.820 1.00 0.00 C ATOM 0 H ALA B 51 -12.355 -7.777 -11.176 1.00 0.00 H new ATOM 0 HA ALA B 51 -11.688 -8.640 -8.657 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -13.390 -10.409 -9.084 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -13.923 -8.819 -9.679 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -13.315 -10.039 -10.823 1.00 0.00 H new ATOM 2111 N SER B 52 -10.511 -10.694 -10.946 1.00 0.00 N ATOM 2112 CA SER B 52 -9.593 -11.807 -11.153 1.00 0.00 C ATOM 2113 C SER B 52 -8.135 -11.372 -10.995 1.00 0.00 C ATOM 2114 O SER B 52 -7.238 -12.205 -10.878 1.00 0.00 O ATOM 2115 CB SER B 52 -9.809 -12.402 -12.541 1.00 0.00 C ATOM 2116 OG SER B 52 -11.173 -12.738 -12.737 1.00 0.00 O ATOM 0 H SER B 52 -10.915 -10.316 -11.803 1.00 0.00 H new ATOM 0 HA SER B 52 -9.801 -12.560 -10.393 1.00 0.00 H new ATOM 0 HB2 SER B 52 -9.493 -11.688 -13.301 1.00 0.00 H new ATOM 0 HB3 SER B 52 -9.190 -13.291 -12.661 1.00 0.00 H new ATOM 0 HG SER B 52 -11.291 -13.116 -13.633 1.00 0.00 H new ATOM 2122 N GLN B 53 -7.905 -10.070 -10.977 1.00 0.00 N ATOM 2123 CA GLN B 53 -6.554 -9.537 -10.884 1.00 0.00 C ATOM 2124 C GLN B 53 -6.214 -9.199 -9.437 1.00 0.00 C ATOM 2125 O GLN B 53 -5.049 -9.052 -9.091 1.00 0.00 O ATOM 2126 CB GLN B 53 -6.426 -8.280 -11.755 1.00 0.00 C ATOM 2127 CG GLN B 53 -4.996 -7.877 -12.063 1.00 0.00 C ATOM 2128 CD GLN B 53 -4.250 -8.950 -12.830 1.00 0.00 C ATOM 2129 OE1 GLN B 53 -3.586 -9.801 -12.246 1.00 0.00 O ATOM 2130 NE2 GLN B 53 -4.378 -8.931 -14.147 1.00 0.00 N ATOM 0 H GLN B 53 -8.636 -9.361 -11.026 1.00 0.00 H new ATOM 0 HA GLN B 53 -5.856 -10.294 -11.241 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -6.954 -8.447 -12.694 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -6.924 -7.451 -11.252 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -4.998 -6.954 -12.642 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -4.471 -7.668 -11.131 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -4.939 -8.206 -14.594 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.916 -9.641 -14.715 1.00 0.00 H new ATOM 2139 N ARG B 54 -7.249 -9.109 -8.604 1.00 0.00 N ATOM 2140 CA ARG B 54 -7.121 -8.637 -7.222 1.00 0.00 C ATOM 2141 C ARG B 54 -5.978 -9.307 -6.453 1.00 0.00 C ATOM 2142 O ARG B 54 -5.093 -8.626 -5.939 1.00 0.00 O ATOM 2143 CB ARG B 54 -8.442 -8.838 -6.475 1.00 0.00 C ATOM 2144 CG ARG B 54 -9.528 -7.857 -6.892 1.00 0.00 C ATOM 2145 CD ARG B 54 -10.863 -8.170 -6.236 1.00 0.00 C ATOM 2146 NE ARG B 54 -11.841 -7.106 -6.476 1.00 0.00 N ATOM 2147 CZ ARG B 54 -13.145 -7.312 -6.660 1.00 0.00 C ATOM 2148 NH1 ARG B 54 -13.630 -8.545 -6.689 1.00 0.00 N ATOM 2149 NH2 ARG B 54 -13.966 -6.283 -6.811 1.00 0.00 N ATOM 0 H ARG B 54 -8.202 -9.361 -8.866 1.00 0.00 H new ATOM 0 HA ARG B 54 -6.878 -7.576 -7.278 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -8.796 -9.855 -6.646 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -8.264 -8.738 -5.404 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.223 -6.845 -6.627 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -9.642 -7.882 -7.976 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -11.248 -9.113 -6.623 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.721 -8.300 -5.163 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.502 -6.144 -6.504 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -13.005 -9.342 -6.570 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -14.629 -8.697 -6.830 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -13.600 -5.331 -6.787 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.964 -6.443 -6.952 1.00 0.00 H new ATOM 2163 N LYS B 55 -5.982 -10.630 -6.378 1.00 0.00 N ATOM 2164 CA LYS B 55 -4.980 -11.329 -5.580 1.00 0.00 C ATOM 2165 C LYS B 55 -3.629 -11.356 -6.286 1.00 0.00 C ATOM 2166 O LYS B 55 -2.583 -11.259 -5.646 1.00 0.00 O ATOM 2167 CB LYS B 55 -5.438 -12.749 -5.253 1.00 0.00 C ATOM 2168 CG LYS B 55 -6.678 -12.797 -4.376 1.00 0.00 C ATOM 2169 CD LYS B 55 -6.943 -14.200 -3.857 1.00 0.00 C ATOM 2170 CE LYS B 55 -5.785 -14.710 -3.013 1.00 0.00 C ATOM 2171 NZ LYS B 55 -6.050 -16.065 -2.463 1.00 0.00 N ATOM 0 H LYS B 55 -6.654 -11.234 -6.850 1.00 0.00 H new ATOM 0 HA LYS B 55 -4.862 -10.779 -4.646 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -5.639 -13.281 -6.183 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -4.627 -13.278 -4.752 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -6.556 -12.115 -3.535 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -7.540 -12.450 -4.945 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -7.857 -14.203 -3.263 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -7.107 -14.875 -4.697 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -4.879 -14.736 -3.619 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -5.601 -14.016 -2.193 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -5.236 -16.374 -1.895 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -6.900 -16.036 -1.864 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -6.200 -16.734 -3.245 1.00 0.00 H new ATOM 2185 N LEU B 56 -3.662 -11.460 -7.607 1.00 0.00 N ATOM 2186 CA LEU B 56 -2.441 -11.510 -8.400 1.00 0.00 C ATOM 2187 C LEU B 56 -1.692 -10.183 -8.289 1.00 0.00 C ATOM 2188 O LEU B 56 -0.485 -10.157 -8.043 1.00 0.00 O ATOM 2189 CB LEU B 56 -2.779 -11.818 -9.866 1.00 0.00 C ATOM 2190 CG LEU B 56 -1.636 -12.386 -10.726 1.00 0.00 C ATOM 2191 CD1 LEU B 56 -2.180 -12.893 -12.050 1.00 0.00 C ATOM 2192 CD2 LEU B 56 -0.550 -11.348 -10.984 1.00 0.00 C ATOM 0 H LEU B 56 -4.522 -11.511 -8.153 1.00 0.00 H new ATOM 0 HA LEU B 56 -1.799 -12.304 -8.018 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -3.606 -12.528 -9.884 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -3.136 -10.901 -10.334 1.00 0.00 H new ATOM 0 HG LEU B 56 -1.189 -13.210 -10.171 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -1.363 -13.293 -12.650 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -2.912 -13.679 -11.865 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -2.656 -12.072 -12.586 1.00 0.00 H new ATOM 0 HD21 LEU B 56 0.238 -11.790 -11.594 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -0.980 -10.494 -11.508 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -0.130 -11.017 -10.034 1.00 0.00 H new ATOM 2204 N ILE B 57 -2.422 -9.085 -8.453 1.00 0.00 N ATOM 2205 CA ILE B 57 -1.822 -7.758 -8.436 1.00 0.00 C ATOM 2206 C ILE B 57 -1.374 -7.380 -7.024 1.00 0.00 C ATOM 2207 O ILE B 57 -0.436 -6.607 -6.853 1.00 0.00 O ATOM 2208 CB ILE B 57 -2.789 -6.691 -9.008 1.00 0.00 C ATOM 2209 CG1 ILE B 57 -2.027 -5.414 -9.374 1.00 0.00 C ATOM 2210 CG2 ILE B 57 -3.905 -6.374 -8.020 1.00 0.00 C ATOM 2211 CD1 ILE B 57 -2.874 -4.392 -10.105 1.00 0.00 C ATOM 0 H ILE B 57 -3.431 -9.089 -8.599 1.00 0.00 H new ATOM 0 HA ILE B 57 -0.942 -7.787 -9.079 1.00 0.00 H new ATOM 0 HB ILE B 57 -3.241 -7.101 -9.911 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -1.632 -4.963 -8.464 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -1.172 -5.677 -9.996 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -4.568 -5.622 -8.449 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -4.473 -7.280 -7.809 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -3.474 -5.992 -7.094 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -2.269 -3.514 -10.332 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -3.247 -4.826 -11.033 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -3.715 -4.100 -9.476 1.00 0.00 H new ATOM 2223 N ALA B 58 -2.035 -7.946 -6.015 1.00 0.00 N ATOM 2224 CA ALA B 58 -1.642 -7.727 -4.628 1.00 0.00 C ATOM 2225 C ALA B 58 -0.331 -8.447 -4.330 1.00 0.00 C ATOM 2226 O ALA B 58 0.533 -7.928 -3.622 1.00 0.00 O ATOM 2227 CB ALA B 58 -2.742 -8.190 -3.682 1.00 0.00 C ATOM 0 H ALA B 58 -2.843 -8.558 -6.134 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.490 -6.659 -4.473 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.431 -8.019 -2.651 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -3.655 -7.630 -3.884 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -2.928 -9.253 -3.833 1.00 0.00 H new ATOM 2233 N GLU B 59 -0.193 -9.643 -4.887 1.00 0.00 N ATOM 2234 CA GLU B 59 1.041 -10.410 -4.783 1.00 0.00 C ATOM 2235 C GLU B 59 2.155 -9.662 -5.515 1.00 0.00 C ATOM 2236 O GLU B 59 3.255 -9.475 -4.992 1.00 0.00 O ATOM 2237 CB GLU B 59 0.820 -11.802 -5.395 1.00 0.00 C ATOM 2238 CG GLU B 59 1.800 -12.874 -4.935 1.00 0.00 C ATOM 2239 CD GLU B 59 3.231 -12.619 -5.361 1.00 0.00 C ATOM 2240 OE1 GLU B 59 3.475 -12.448 -6.577 1.00 0.00 O ATOM 2241 OE2 GLU B 59 4.117 -12.598 -4.480 1.00 0.00 O ATOM 0 H GLU B 59 -0.929 -10.106 -5.421 1.00 0.00 H new ATOM 0 HA GLU B 59 1.330 -10.531 -3.739 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -0.192 -12.130 -5.156 1.00 0.00 H new ATOM 0 HB3 GLU B 59 0.880 -11.718 -6.480 1.00 0.00 H new ATOM 0 HG2 GLU B 59 1.762 -12.945 -3.848 1.00 0.00 H new ATOM 0 HG3 GLU B 59 1.480 -13.839 -5.329 1.00 0.00 H new ATOM 2248 N LYS B 60 1.829 -9.214 -6.724 1.00 0.00 N ATOM 2249 CA LYS B 60 2.736 -8.427 -7.554 1.00 0.00 C ATOM 2250 C LYS B 60 3.181 -7.163 -6.815 1.00 0.00 C ATOM 2251 O LYS B 60 4.338 -6.750 -6.899 1.00 0.00 O ATOM 2252 CB LYS B 60 2.016 -8.073 -8.862 1.00 0.00 C ATOM 2253 CG LYS B 60 2.858 -7.325 -9.881 1.00 0.00 C ATOM 2254 CD LYS B 60 2.094 -7.159 -11.190 1.00 0.00 C ATOM 2255 CE LYS B 60 2.873 -6.339 -12.209 1.00 0.00 C ATOM 2256 NZ LYS B 60 2.160 -6.251 -13.514 1.00 0.00 N ATOM 0 H LYS B 60 0.923 -9.388 -7.158 1.00 0.00 H new ATOM 0 HA LYS B 60 3.632 -9.007 -7.777 1.00 0.00 H new ATOM 0 HB2 LYS B 60 1.654 -8.994 -9.319 1.00 0.00 H new ATOM 0 HB3 LYS B 60 1.140 -7.469 -8.624 1.00 0.00 H new ATOM 0 HG2 LYS B 60 3.132 -6.346 -9.487 1.00 0.00 H new ATOM 0 HG3 LYS B 60 3.786 -7.867 -10.062 1.00 0.00 H new ATOM 0 HD2 LYS B 60 1.874 -8.141 -11.608 1.00 0.00 H new ATOM 0 HD3 LYS B 60 1.137 -6.676 -10.992 1.00 0.00 H new ATOM 0 HE2 LYS B 60 3.038 -5.335 -11.817 1.00 0.00 H new ATOM 0 HE3 LYS B 60 3.855 -6.787 -12.361 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 2.852 -6.130 -14.280 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 1.617 -7.124 -13.673 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 1.512 -5.438 -13.501 1.00 0.00 H new ATOM 2270 N PHE B 61 2.247 -6.570 -6.083 1.00 0.00 N ATOM 2271 CA PHE B 61 2.515 -5.383 -5.280 1.00 0.00 C ATOM 2272 C PHE B 61 3.456 -5.707 -4.121 1.00 0.00 C ATOM 2273 O PHE B 61 4.443 -5.007 -3.895 1.00 0.00 O ATOM 2274 CB PHE B 61 1.190 -4.818 -4.753 1.00 0.00 C ATOM 2275 CG PHE B 61 1.335 -3.655 -3.809 1.00 0.00 C ATOM 2276 CD1 PHE B 61 1.757 -2.419 -4.265 1.00 0.00 C ATOM 2277 CD2 PHE B 61 1.038 -3.802 -2.463 1.00 0.00 C ATOM 2278 CE1 PHE B 61 1.880 -1.351 -3.398 1.00 0.00 C ATOM 2279 CE2 PHE B 61 1.160 -2.735 -1.593 1.00 0.00 C ATOM 2280 CZ PHE B 61 1.581 -1.509 -2.061 1.00 0.00 C ATOM 0 H PHE B 61 1.283 -6.898 -6.029 1.00 0.00 H new ATOM 0 HA PHE B 61 3.005 -4.637 -5.906 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.580 -4.506 -5.601 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.647 -5.615 -4.246 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.993 -2.288 -5.311 1.00 0.00 H new ATOM 0 HD2 PHE B 61 0.708 -4.760 -2.090 1.00 0.00 H new ATOM 0 HE1 PHE B 61 2.211 -0.391 -3.767 1.00 0.00 H new ATOM 0 HE2 PHE B 61 0.925 -2.862 -0.546 1.00 0.00 H new ATOM 0 HZ PHE B 61 1.677 -0.674 -1.383 1.00 0.00 H new ATOM 2290 N ALA B 62 3.146 -6.775 -3.398 1.00 0.00 N ATOM 2291 CA ALA B 62 3.941 -7.186 -2.248 1.00 0.00 C ATOM 2292 C ALA B 62 5.380 -7.488 -2.649 1.00 0.00 C ATOM 2293 O ALA B 62 6.323 -7.076 -1.971 1.00 0.00 O ATOM 2294 CB ALA B 62 3.309 -8.395 -1.576 1.00 0.00 C ATOM 0 H ALA B 62 2.344 -7.376 -3.589 1.00 0.00 H new ATOM 0 HA ALA B 62 3.961 -6.359 -1.538 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.913 -8.692 -0.718 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.303 -8.141 -1.241 1.00 0.00 H new ATOM 0 HB3 ALA B 62 3.257 -9.220 -2.286 1.00 0.00 H new ATOM 2300 N GLN B 63 5.550 -8.195 -3.760 1.00 0.00 N ATOM 2301 CA GLN B 63 6.883 -8.531 -4.239 1.00 0.00 C ATOM 2302 C GLN B 63 7.613 -7.275 -4.703 1.00 0.00 C ATOM 2303 O GLN B 63 8.832 -7.172 -4.560 1.00 0.00 O ATOM 2304 CB GLN B 63 6.820 -9.557 -5.373 1.00 0.00 C ATOM 2305 CG GLN B 63 8.182 -10.121 -5.756 1.00 0.00 C ATOM 2306 CD GLN B 63 8.895 -10.777 -4.586 1.00 0.00 C ATOM 2307 OE1 GLN B 63 8.264 -11.318 -3.677 1.00 0.00 O ATOM 2308 NE2 GLN B 63 10.218 -10.734 -4.597 1.00 0.00 N ATOM 0 H GLN B 63 4.788 -8.544 -4.341 1.00 0.00 H new ATOM 0 HA GLN B 63 7.436 -8.975 -3.411 1.00 0.00 H new ATOM 0 HB2 GLN B 63 6.166 -10.377 -5.075 1.00 0.00 H new ATOM 0 HB3 GLN B 63 6.368 -9.092 -6.249 1.00 0.00 H new ATOM 0 HG2 GLN B 63 8.057 -10.851 -6.555 1.00 0.00 H new ATOM 0 HG3 GLN B 63 8.805 -9.319 -6.152 1.00 0.00 H new ATOM 0 HE21 GLN B 63 10.707 -10.277 -5.367 1.00 0.00 H new ATOM 0 HE22 GLN B 63 10.748 -11.158 -3.836 1.00 0.00 H new ATOM 2317 N ALA B 64 6.867 -6.319 -5.250 1.00 0.00 N ATOM 2318 CA ALA B 64 7.443 -5.042 -5.660 1.00 0.00 C ATOM 2319 C ALA B 64 8.039 -4.318 -4.459 1.00 0.00 C ATOM 2320 O ALA B 64 9.120 -3.743 -4.546 1.00 0.00 O ATOM 2321 CB ALA B 64 6.397 -4.174 -6.344 1.00 0.00 C ATOM 0 H ALA B 64 5.865 -6.404 -5.419 1.00 0.00 H new ATOM 0 HA ALA B 64 8.241 -5.239 -6.376 1.00 0.00 H new ATOM 0 HB1 ALA B 64 6.848 -3.227 -6.641 1.00 0.00 H new ATOM 0 HB2 ALA B 64 6.018 -4.689 -7.227 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.575 -3.984 -5.654 1.00 0.00 H new ATOM 2327 N LEU B 65 7.337 -4.377 -3.335 1.00 0.00 N ATOM 2328 CA LEU B 65 7.820 -3.779 -2.093 1.00 0.00 C ATOM 2329 C LEU B 65 9.115 -4.438 -1.631 1.00 0.00 C ATOM 2330 O LEU B 65 10.065 -3.760 -1.257 1.00 0.00 O ATOM 2331 CB LEU B 65 6.761 -3.895 -0.995 1.00 0.00 C ATOM 2332 CG LEU B 65 5.898 -2.649 -0.789 1.00 0.00 C ATOM 2333 CD1 LEU B 65 5.117 -2.322 -2.049 1.00 0.00 C ATOM 2334 CD2 LEU B 65 4.957 -2.849 0.386 1.00 0.00 C ATOM 0 H LEU B 65 6.428 -4.834 -3.256 1.00 0.00 H new ATOM 0 HA LEU B 65 8.019 -2.725 -2.289 1.00 0.00 H new ATOM 0 HB2 LEU B 65 6.108 -4.735 -1.230 1.00 0.00 H new ATOM 0 HB3 LEU B 65 7.259 -4.132 -0.055 1.00 0.00 H new ATOM 0 HG LEU B 65 6.554 -1.807 -0.569 1.00 0.00 H new ATOM 0 HD11 LEU B 65 4.510 -1.432 -1.880 1.00 0.00 H new ATOM 0 HD12 LEU B 65 5.811 -2.138 -2.869 1.00 0.00 H new ATOM 0 HD13 LEU B 65 4.469 -3.161 -2.303 1.00 0.00 H new ATOM 0 HD21 LEU B 65 4.349 -1.955 0.521 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.308 -3.703 0.191 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.538 -3.033 1.290 1.00 0.00 H new ATOM 2346 N MET B 66 9.153 -5.764 -1.681 1.00 0.00 N ATOM 2347 CA MET B 66 10.309 -6.516 -1.195 1.00 0.00 C ATOM 2348 C MET B 66 11.510 -6.349 -2.118 1.00 0.00 C ATOM 2349 O MET B 66 12.656 -6.408 -1.672 1.00 0.00 O ATOM 2350 CB MET B 66 9.963 -7.999 -1.061 1.00 0.00 C ATOM 2351 CG MET B 66 8.751 -8.264 -0.185 1.00 0.00 C ATOM 2352 SD MET B 66 8.971 -7.682 1.505 1.00 0.00 S ATOM 2353 CE MET B 66 7.292 -7.816 2.114 1.00 0.00 C ATOM 0 H MET B 66 8.399 -6.342 -2.052 1.00 0.00 H new ATOM 0 HA MET B 66 10.573 -6.117 -0.215 1.00 0.00 H new ATOM 0 HB2 MET B 66 9.781 -8.412 -2.053 1.00 0.00 H new ATOM 0 HB3 MET B 66 10.822 -8.528 -0.648 1.00 0.00 H new ATOM 0 HG2 MET B 66 7.879 -7.777 -0.622 1.00 0.00 H new ATOM 0 HG3 MET B 66 8.545 -9.334 -0.172 1.00 0.00 H new ATOM 0 HE1 MET B 66 7.281 -7.646 3.191 1.00 0.00 H new ATOM 0 HE2 MET B 66 6.666 -7.071 1.623 1.00 0.00 H new ATOM 0 HE3 MET B 66 6.906 -8.812 1.900 1.00 0.00 H new ATOM 2363 N SER B 67 11.248 -6.142 -3.401 1.00 0.00 N ATOM 2364 CA SER B 67 12.317 -5.984 -4.375 1.00 0.00 C ATOM 2365 C SER B 67 12.811 -4.538 -4.419 1.00 0.00 C ATOM 2366 O SER B 67 13.955 -4.276 -4.788 1.00 0.00 O ATOM 2367 CB SER B 67 11.846 -6.446 -5.759 1.00 0.00 C ATOM 2368 OG SER B 67 10.597 -5.869 -6.103 1.00 0.00 O ATOM 0 H SER B 67 10.307 -6.080 -3.790 1.00 0.00 H new ATOM 0 HA SER B 67 13.156 -6.609 -4.069 1.00 0.00 H new ATOM 0 HB2 SER B 67 12.591 -6.175 -6.507 1.00 0.00 H new ATOM 0 HB3 SER B 67 11.762 -7.533 -5.772 1.00 0.00 H new ATOM 0 HG SER B 67 9.872 -6.413 -5.730 1.00 0.00 H new ATOM 2374 N SER B 68 11.949 -3.603 -4.029 1.00 0.00 N ATOM 2375 CA SER B 68 12.322 -2.194 -3.965 1.00 0.00 C ATOM 2376 C SER B 68 12.782 -1.833 -2.555 1.00 0.00 C ATOM 2377 O SER B 68 13.110 -0.681 -2.262 1.00 0.00 O ATOM 2378 CB SER B 68 11.138 -1.319 -4.380 1.00 0.00 C ATOM 2379 OG SER B 68 10.629 -1.721 -5.642 1.00 0.00 O ATOM 0 H SER B 68 10.986 -3.796 -3.752 1.00 0.00 H new ATOM 0 HA SER B 68 13.147 -2.016 -4.654 1.00 0.00 H new ATOM 0 HB2 SER B 68 10.351 -1.385 -3.628 1.00 0.00 H new ATOM 0 HB3 SER B 68 11.450 -0.276 -4.425 1.00 0.00 H new ATOM 0 HG SER B 68 10.035 -2.491 -5.525 1.00 0.00 H new ATOM 2385 N LEU B 69 12.800 -2.837 -1.687 1.00 0.00 N ATOM 2386 CA LEU B 69 13.244 -2.670 -0.316 1.00 0.00 C ATOM 2387 C LEU B 69 14.756 -2.506 -0.285 1.00 0.00 C ATOM 2388 O LEU B 69 15.495 -3.414 -0.676 1.00 0.00 O ATOM 2389 CB LEU B 69 12.820 -3.885 0.517 1.00 0.00 C ATOM 2390 CG LEU B 69 13.135 -3.804 2.008 1.00 0.00 C ATOM 2391 CD1 LEU B 69 12.326 -2.700 2.668 1.00 0.00 C ATOM 2392 CD2 LEU B 69 12.867 -5.142 2.684 1.00 0.00 C ATOM 0 H LEU B 69 12.507 -3.787 -1.917 1.00 0.00 H new ATOM 0 HA LEU B 69 12.785 -1.778 0.109 1.00 0.00 H new ATOM 0 HB2 LEU B 69 11.746 -4.028 0.398 1.00 0.00 H new ATOM 0 HB3 LEU B 69 13.307 -4.771 0.109 1.00 0.00 H new ATOM 0 HG LEU B 69 14.193 -3.567 2.122 1.00 0.00 H new ATOM 0 HD11 LEU B 69 12.565 -2.659 3.731 1.00 0.00 H new ATOM 0 HD12 LEU B 69 12.569 -1.744 2.204 1.00 0.00 H new ATOM 0 HD13 LEU B 69 11.263 -2.904 2.543 1.00 0.00 H new ATOM 0 HD21 LEU B 69 13.097 -5.065 3.747 1.00 0.00 H new ATOM 0 HD22 LEU B 69 11.818 -5.409 2.558 1.00 0.00 H new ATOM 0 HD23 LEU B 69 13.494 -5.910 2.231 1.00 0.00 H new ATOM 2404 N GLU B 70 15.211 -1.347 0.160 1.00 0.00 N ATOM 2405 CA GLU B 70 16.630 -1.040 0.165 1.00 0.00 C ATOM 2406 C GLU B 70 17.358 -1.748 1.295 1.00 0.00 C ATOM 2407 O GLU B 70 17.349 -1.299 2.444 1.00 0.00 O ATOM 2408 CB GLU B 70 16.864 0.468 0.253 1.00 0.00 C ATOM 2409 CG GLU B 70 16.731 1.177 -1.081 1.00 0.00 C ATOM 2410 CD GLU B 70 17.723 0.657 -2.100 1.00 0.00 C ATOM 2411 OE1 GLU B 70 18.940 0.888 -1.928 1.00 0.00 O ATOM 2412 OE2 GLU B 70 17.299 -0.009 -3.062 1.00 0.00 O ATOM 0 H GLU B 70 14.616 -0.602 0.523 1.00 0.00 H new ATOM 0 HA GLU B 70 17.038 -1.405 -0.778 1.00 0.00 H new ATOM 0 HB2 GLU B 70 16.152 0.898 0.957 1.00 0.00 H new ATOM 0 HB3 GLU B 70 17.860 0.651 0.655 1.00 0.00 H new ATOM 0 HG2 GLU B 70 15.718 1.047 -1.462 1.00 0.00 H new ATOM 0 HG3 GLU B 70 16.883 2.247 -0.940 1.00 0.00 H new ATOM 2419 N THR B 71 17.963 -2.875 0.964 1.00 0.00 N ATOM 2420 CA THR B 71 18.854 -3.556 1.881 1.00 0.00 C ATOM 2421 C THR B 71 20.126 -2.721 2.056 1.00 0.00 C ATOM 2422 O THR B 71 20.582 -2.084 1.101 1.00 0.00 O ATOM 2423 CB THR B 71 19.202 -4.980 1.370 1.00 0.00 C ATOM 2424 OG1 THR B 71 20.068 -5.652 2.297 1.00 0.00 O ATOM 2425 CG2 THR B 71 19.861 -4.929 -0.002 1.00 0.00 C ATOM 0 H THR B 71 17.851 -3.338 0.062 1.00 0.00 H new ATOM 0 HA THR B 71 18.355 -3.667 2.844 1.00 0.00 H new ATOM 0 HB THR B 71 18.268 -5.535 1.285 1.00 0.00 H new ATOM 0 HG1 THR B 71 20.276 -6.548 1.960 1.00 0.00 H new ATOM 0 HG21 THR B 71 20.093 -5.942 -0.332 1.00 0.00 H new ATOM 0 HG22 THR B 71 19.182 -4.461 -0.715 1.00 0.00 H new ATOM 0 HG23 THR B 71 20.781 -4.348 0.058 1.00 0.00 H new ATOM 2433 N PRO B 72 20.680 -2.671 3.282 1.00 0.00 N ATOM 2434 CA PRO B 72 21.898 -1.908 3.574 1.00 0.00 C ATOM 2435 C PRO B 72 23.065 -2.322 2.681 1.00 0.00 C ATOM 2436 O PRO B 72 23.635 -3.403 2.842 1.00 0.00 O ATOM 2437 CB PRO B 72 22.197 -2.227 5.046 1.00 0.00 C ATOM 2438 CG PRO B 72 21.365 -3.424 5.370 1.00 0.00 C ATOM 2439 CD PRO B 72 20.159 -3.343 4.481 1.00 0.00 C ATOM 0 HA PRO B 72 21.761 -0.843 3.388 1.00 0.00 H new ATOM 0 HB2 PRO B 72 23.257 -2.433 5.196 1.00 0.00 H new ATOM 0 HB3 PRO B 72 21.942 -1.385 5.690 1.00 0.00 H new ATOM 0 HG2 PRO B 72 21.920 -4.345 5.191 1.00 0.00 H new ATOM 0 HG3 PRO B 72 21.076 -3.425 6.421 1.00 0.00 H new ATOM 0 HD2 PRO B 72 19.761 -4.331 4.250 1.00 0.00 H new ATOM 0 HD3 PRO B 72 19.353 -2.775 4.945 1.00 0.00 H new ATOM 2447 N LYS B 73 23.394 -1.464 1.728 1.00 0.00 N ATOM 2448 CA LYS B 73 24.451 -1.745 0.773 1.00 0.00 C ATOM 2449 C LYS B 73 25.760 -1.134 1.226 1.00 0.00 C ATOM 2450 O LYS B 73 25.792 -0.054 1.820 1.00 0.00 O ATOM 2451 CB LYS B 73 24.067 -1.218 -0.612 1.00 0.00 C ATOM 2452 CG LYS B 73 22.786 -1.831 -1.156 1.00 0.00 C ATOM 2453 CD LYS B 73 22.352 -1.178 -2.456 1.00 0.00 C ATOM 2454 CE LYS B 73 21.045 -1.770 -2.955 1.00 0.00 C ATOM 2455 NZ LYS B 73 19.935 -1.567 -1.984 1.00 0.00 N ATOM 0 H LYS B 73 22.939 -0.561 1.596 1.00 0.00 H new ATOM 0 HA LYS B 73 24.582 -2.825 0.713 1.00 0.00 H new ATOM 0 HB2 LYS B 73 23.950 -0.135 -0.561 1.00 0.00 H new ATOM 0 HB3 LYS B 73 24.882 -1.419 -1.308 1.00 0.00 H new ATOM 0 HG2 LYS B 73 22.935 -2.898 -1.318 1.00 0.00 H new ATOM 0 HG3 LYS B 73 21.992 -1.729 -0.416 1.00 0.00 H new ATOM 0 HD2 LYS B 73 22.235 -0.105 -2.306 1.00 0.00 H new ATOM 0 HD3 LYS B 73 23.127 -1.312 -3.211 1.00 0.00 H new ATOM 0 HE2 LYS B 73 20.781 -1.313 -3.909 1.00 0.00 H new ATOM 0 HE3 LYS B 73 21.176 -2.836 -3.138 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 19.032 -1.831 -2.428 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 20.094 -2.161 -1.145 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 19.902 -0.567 -1.699 1.00 0.00 H new ATOM 2469 N THR B 74 26.830 -1.846 0.943 1.00 0.00 N ATOM 2470 CA THR B 74 28.153 -1.459 1.369 1.00 0.00 C ATOM 2471 C THR B 74 28.637 -0.214 0.634 1.00 0.00 C ATOM 2472 O THR B 74 28.704 -0.191 -0.595 1.00 0.00 O ATOM 2473 CB THR B 74 29.129 -2.615 1.126 1.00 0.00 C ATOM 2474 OG1 THR B 74 28.398 -3.847 1.050 1.00 0.00 O ATOM 2475 CG2 THR B 74 30.127 -2.700 2.257 1.00 0.00 C ATOM 0 H THR B 74 26.804 -2.714 0.408 1.00 0.00 H new ATOM 0 HA THR B 74 28.110 -1.225 2.433 1.00 0.00 H new ATOM 0 HB THR B 74 29.661 -2.439 0.191 1.00 0.00 H new ATOM 0 HG1 THR B 74 29.020 -4.588 0.893 1.00 0.00 H new ATOM 0 HG21 THR B 74 30.815 -3.525 2.074 1.00 0.00 H new ATOM 0 HG22 THR B 74 30.687 -1.767 2.319 1.00 0.00 H new ATOM 0 HG23 THR B 74 29.600 -2.870 3.196 1.00 0.00 H new ATOM 2483 N HIS B 75 28.951 0.827 1.392 1.00 0.00 N ATOM 2484 CA HIS B 75 29.494 2.049 0.818 1.00 0.00 C ATOM 2485 C HIS B 75 31.006 1.945 0.710 1.00 0.00 C ATOM 2486 O HIS B 75 31.680 1.586 1.675 1.00 0.00 O ATOM 2487 CB HIS B 75 29.116 3.268 1.667 1.00 0.00 C ATOM 2488 CG HIS B 75 27.717 3.763 1.445 1.00 0.00 C ATOM 2489 ND1 HIS B 75 27.438 5.021 0.957 1.00 0.00 N ATOM 2490 CD2 HIS B 75 26.519 3.172 1.658 1.00 0.00 C ATOM 2491 CE1 HIS B 75 26.131 5.181 0.880 1.00 0.00 C ATOM 2492 NE2 HIS B 75 25.549 4.075 1.300 1.00 0.00 N ATOM 0 H HIS B 75 28.839 0.850 2.406 1.00 0.00 H new ATOM 0 HA HIS B 75 29.068 2.177 -0.177 1.00 0.00 H new ATOM 0 HB2 HIS B 75 29.237 3.015 2.720 1.00 0.00 H new ATOM 0 HB3 HIS B 75 29.814 4.077 1.452 1.00 0.00 H new ATOM 0 HD2 HIS B 75 26.356 2.175 2.039 1.00 0.00 H new ATOM 0 HE1 HIS B 75 25.623 6.068 0.532 1.00 0.00 H new ATOM 0 HE2 HIS B 75 24.543 3.916 1.351 1.00 0.00 H new ATOM 2501 N LEU B 76 31.535 2.264 -0.463 1.00 0.00 N ATOM 2502 CA LEU B 76 32.973 2.217 -0.702 1.00 0.00 C ATOM 2503 C LEU B 76 33.676 3.250 0.167 1.00 0.00 C ATOM 2504 O LEU B 76 34.808 3.053 0.607 1.00 0.00 O ATOM 2505 CB LEU B 76 33.300 2.478 -2.182 1.00 0.00 C ATOM 2506 CG LEU B 76 32.813 1.417 -3.182 1.00 0.00 C ATOM 2507 CD1 LEU B 76 31.307 1.506 -3.399 1.00 0.00 C ATOM 2508 CD2 LEU B 76 33.546 1.563 -4.508 1.00 0.00 C ATOM 0 H LEU B 76 30.986 2.560 -1.270 1.00 0.00 H new ATOM 0 HA LEU B 76 33.326 1.219 -0.444 1.00 0.00 H new ATOM 0 HB2 LEU B 76 32.868 3.438 -2.464 1.00 0.00 H new ATOM 0 HB3 LEU B 76 34.381 2.573 -2.282 1.00 0.00 H new ATOM 0 HG LEU B 76 33.033 0.436 -2.760 1.00 0.00 H new ATOM 0 HD11 LEU B 76 30.996 0.742 -4.111 1.00 0.00 H new ATOM 0 HD12 LEU B 76 30.793 1.349 -2.451 1.00 0.00 H new ATOM 0 HD13 LEU B 76 31.053 2.491 -3.790 1.00 0.00 H new ATOM 0 HD21 LEU B 76 33.190 0.805 -5.206 1.00 0.00 H new ATOM 0 HD22 LEU B 76 33.357 2.554 -4.921 1.00 0.00 H new ATOM 0 HD23 LEU B 76 34.617 1.435 -4.348 1.00 0.00 H new ATOM 2520 N GLU B 77 32.976 4.342 0.434 1.00 0.00 N ATOM 2521 CA GLU B 77 33.514 5.424 1.246 1.00 0.00 C ATOM 2522 C GLU B 77 33.292 5.161 2.735 1.00 0.00 C ATOM 2523 O GLU B 77 33.177 6.099 3.525 1.00 0.00 O ATOM 2524 CB GLU B 77 32.857 6.744 0.850 1.00 0.00 C ATOM 2525 CG GLU B 77 33.005 7.080 -0.623 1.00 0.00 C ATOM 2526 CD GLU B 77 32.336 8.387 -0.987 1.00 0.00 C ATOM 2527 OE1 GLU B 77 31.087 8.444 -0.967 1.00 0.00 O ATOM 2528 OE2 GLU B 77 33.055 9.363 -1.294 1.00 0.00 O ATOM 0 H GLU B 77 32.027 4.503 0.097 1.00 0.00 H new ATOM 0 HA GLU B 77 34.588 5.482 1.067 1.00 0.00 H new ATOM 0 HB2 GLU B 77 31.797 6.701 1.099 1.00 0.00 H new ATOM 0 HB3 GLU B 77 33.292 7.549 1.443 1.00 0.00 H new ATOM 0 HG2 GLU B 77 34.064 7.134 -0.876 1.00 0.00 H new ATOM 0 HG3 GLU B 77 32.575 6.276 -1.221 1.00 0.00 H new ATOM 2535 N HIS B 78 33.240 3.886 3.115 1.00 0.00 N ATOM 2536 CA HIS B 78 33.089 3.511 4.522 1.00 0.00 C ATOM 2537 C HIS B 78 34.266 4.018 5.348 1.00 0.00 C ATOM 2538 O HIS B 78 34.119 4.326 6.530 1.00 0.00 O ATOM 2539 CB HIS B 78 32.930 1.990 4.694 1.00 0.00 C ATOM 2540 CG HIS B 78 34.045 1.159 4.119 1.00 0.00 C ATOM 2541 ND1 HIS B 78 35.192 0.839 4.813 1.00 0.00 N ATOM 2542 CD2 HIS B 78 34.167 0.561 2.910 1.00 0.00 C ATOM 2543 CE1 HIS B 78 35.968 0.083 4.057 1.00 0.00 C ATOM 2544 NE2 HIS B 78 35.367 -0.100 2.898 1.00 0.00 N ATOM 0 H HIS B 78 33.300 3.097 2.472 1.00 0.00 H new ATOM 0 HA HIS B 78 32.177 3.984 4.886 1.00 0.00 H new ATOM 0 HB2 HIS B 78 32.845 1.768 5.758 1.00 0.00 H new ATOM 0 HB3 HIS B 78 31.993 1.684 4.228 1.00 0.00 H new ATOM 0 HD2 HIS B 78 33.450 0.598 2.103 1.00 0.00 H new ATOM 0 HE1 HIS B 78 36.930 -0.317 4.340 1.00 0.00 H new ATOM 0 HE2 HIS B 78 35.736 -0.645 2.119 1.00 0.00 H new ATOM 2553 N HIS B 79 35.427 4.112 4.718 1.00 0.00 N ATOM 2554 CA HIS B 79 36.596 4.676 5.369 1.00 0.00 C ATOM 2555 C HIS B 79 36.626 6.179 5.132 1.00 0.00 C ATOM 2556 O HIS B 79 36.998 6.645 4.054 1.00 0.00 O ATOM 2557 CB HIS B 79 37.876 4.016 4.849 1.00 0.00 C ATOM 2558 CG HIS B 79 39.121 4.489 5.536 1.00 0.00 C ATOM 2559 ND1 HIS B 79 40.099 5.214 4.898 1.00 0.00 N ATOM 2560 CD2 HIS B 79 39.541 4.335 6.814 1.00 0.00 C ATOM 2561 CE1 HIS B 79 41.069 5.488 5.751 1.00 0.00 C ATOM 2562 NE2 HIS B 79 40.755 4.967 6.922 1.00 0.00 N ATOM 0 H HIS B 79 35.583 3.805 3.758 1.00 0.00 H new ATOM 0 HA HIS B 79 36.539 4.485 6.441 1.00 0.00 H new ATOM 0 HB2 HIS B 79 37.793 2.936 4.971 1.00 0.00 H new ATOM 0 HB3 HIS B 79 37.966 4.210 3.780 1.00 0.00 H new ATOM 0 HD2 HIS B 79 39.018 3.812 7.602 1.00 0.00 H new ATOM 0 HE1 HIS B 79 41.967 6.044 5.528 1.00 0.00 H new ATOM 0 HE2 HIS B 79 41.321 5.024 7.768 1.00 0.00 H new ATOM 2571 N HIS B 80 36.211 6.927 6.138 1.00 0.00 N ATOM 2572 CA HIS B 80 36.086 8.371 6.020 1.00 0.00 C ATOM 2573 C HIS B 80 36.902 9.072 7.099 1.00 0.00 C ATOM 2574 O HIS B 80 37.526 8.418 7.934 1.00 0.00 O ATOM 2575 CB HIS B 80 34.609 8.795 6.114 1.00 0.00 C ATOM 2576 CG HIS B 80 33.909 8.369 7.379 1.00 0.00 C ATOM 2577 ND1 HIS B 80 32.747 7.627 7.380 1.00 0.00 N ATOM 2578 CD2 HIS B 80 34.204 8.595 8.684 1.00 0.00 C ATOM 2579 CE1 HIS B 80 32.361 7.416 8.624 1.00 0.00 C ATOM 2580 NE2 HIS B 80 33.228 7.992 9.434 1.00 0.00 N ATOM 0 H HIS B 80 35.953 6.557 7.053 1.00 0.00 H new ATOM 0 HA HIS B 80 36.473 8.666 5.045 1.00 0.00 H new ATOM 0 HB2 HIS B 80 34.551 9.880 6.031 1.00 0.00 H new ATOM 0 HB3 HIS B 80 34.072 8.381 5.261 1.00 0.00 H new ATOM 0 HD2 HIS B 80 35.051 9.148 9.062 1.00 0.00 H new ATOM 0 HE1 HIS B 80 31.483 6.865 8.928 1.00 0.00 H new ATOM 0 HE2 HIS B 80 33.180 7.989 10.453 1.00 0.00 H new ATOM 2589 N HIS B 81 36.877 10.396 7.089 1.00 0.00 N ATOM 2590 CA HIS B 81 37.554 11.177 8.114 1.00 0.00 C ATOM 2591 C HIS B 81 36.558 11.624 9.165 1.00 0.00 C ATOM 2592 O HIS B 81 35.352 11.654 8.916 1.00 0.00 O ATOM 2593 CB HIS B 81 38.251 12.402 7.515 1.00 0.00 C ATOM 2594 CG HIS B 81 39.454 12.073 6.691 1.00 0.00 C ATOM 2595 ND1 HIS B 81 40.724 11.986 7.215 1.00 0.00 N ATOM 2596 CD2 HIS B 81 39.577 11.818 5.369 1.00 0.00 C ATOM 2597 CE1 HIS B 81 41.574 11.696 6.250 1.00 0.00 C ATOM 2598 NE2 HIS B 81 40.905 11.586 5.118 1.00 0.00 N ATOM 0 H HIS B 81 36.395 10.952 6.383 1.00 0.00 H new ATOM 0 HA HIS B 81 38.313 10.542 8.571 1.00 0.00 H new ATOM 0 HB2 HIS B 81 37.538 12.947 6.897 1.00 0.00 H new ATOM 0 HB3 HIS B 81 38.548 13.070 8.323 1.00 0.00 H new ATOM 0 HD2 HIS B 81 38.777 11.800 4.644 1.00 0.00 H new ATOM 0 HE1 HIS B 81 42.640 11.570 6.367 1.00 0.00 H new ATOM 0 HE2 HIS B 81 41.309 11.365 4.208 1.00 0.00 H new ATOM 2607 N HIS B 82 37.056 11.959 10.341 1.00 0.00 N ATOM 2608 CA HIS B 82 36.206 12.432 11.419 1.00 0.00 C ATOM 2609 C HIS B 82 37.037 13.189 12.442 1.00 0.00 C ATOM 2610 O HIS B 82 38.113 12.738 12.820 1.00 0.00 O ATOM 2611 CB HIS B 82 35.486 11.252 12.081 1.00 0.00 C ATOM 2612 CG HIS B 82 34.501 11.656 13.131 1.00 0.00 C ATOM 2613 ND1 HIS B 82 34.532 11.170 14.417 1.00 0.00 N ATOM 2614 CD2 HIS B 82 33.439 12.494 13.073 1.00 0.00 C ATOM 2615 CE1 HIS B 82 33.535 11.691 15.106 1.00 0.00 C ATOM 2616 NE2 HIS B 82 32.856 12.499 14.313 1.00 0.00 N ATOM 0 H HIS B 82 38.048 11.912 10.575 1.00 0.00 H new ATOM 0 HA HIS B 82 35.456 13.108 11.009 1.00 0.00 H new ATOM 0 HB2 HIS B 82 34.968 10.677 11.313 1.00 0.00 H new ATOM 0 HB3 HIS B 82 36.228 10.591 12.528 1.00 0.00 H new ATOM 0 HD2 HIS B 82 33.112 13.054 12.210 1.00 0.00 H new ATOM 0 HE1 HIS B 82 33.312 11.490 16.144 1.00 0.00 H new ATOM 0 HE2 HIS B 82 32.032 13.039 14.580 1.00 0.00 H new ATOM 2625 N HIS B 83 36.546 14.344 12.865 1.00 0.00 N ATOM 2626 CA HIS B 83 37.238 15.138 13.869 1.00 0.00 C ATOM 2627 C HIS B 83 36.851 14.671 15.260 1.00 0.00 C ATOM 2628 O HIS B 83 35.811 15.130 15.771 1.00 0.00 O ATOM 2629 CB HIS B 83 36.917 16.629 13.711 1.00 0.00 C ATOM 2630 CG HIS B 83 37.428 17.227 12.440 1.00 0.00 C ATOM 2631 ND1 HIS B 83 36.641 17.407 11.324 1.00 0.00 N ATOM 2632 CD2 HIS B 83 38.651 17.702 12.112 1.00 0.00 C ATOM 2633 CE1 HIS B 83 37.357 17.967 10.368 1.00 0.00 C ATOM 2634 NE2 HIS B 83 38.582 18.157 10.819 1.00 0.00 N ATOM 2635 OXT HIS B 83 37.585 13.844 15.835 1.00 0.00 O ATOM 0 H HIS B 83 35.673 14.752 12.530 1.00 0.00 H new ATOM 0 HA HIS B 83 38.310 15.002 13.728 1.00 0.00 H new ATOM 0 HB2 HIS B 83 35.836 16.765 13.756 1.00 0.00 H new ATOM 0 HB3 HIS B 83 37.342 17.174 14.554 1.00 0.00 H new ATOM 0 HD2 HIS B 83 39.522 17.720 12.750 1.00 0.00 H new ATOM 0 HE1 HIS B 83 37.000 18.226 9.382 1.00 0.00 H new ATOM 0 HE2 HIS B 83 39.351 18.573 10.294 1.00 0.00 H new TER 2644 HIS B 83