USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 913 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 101 GLN : amide:sc= -0.0438 X(o=-0.044,f=0) USER MOD Set 1.2: A 105 LYS NZ :NH3+ -178:sc= 0 (180deg=0) USER MOD Set 2.1: A 73 TYR OH : rot 23:sc= 1.93 USER MOD Set 2.2: A 98 LYS NZ :NH3+ 162:sc= 1.16 (180deg=0) USER MOD Single : A 0 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= -0.028 USER MOD Single : A 12 GLN : amide:sc= -0.0345 K(o=-0.035,f=-1.1) USER MOD Single : A 18 GLN : amide:sc= -0.184 K(o=-0.18,f=-0.69) USER MOD Single : A 20 LYS NZ :NH3+ 165:sc= 0.848 (180deg=0.477) USER MOD Single : A 21 HIS : no HD1:sc= -0.0245 X(o=-0.025,f=-0.013) USER MOD Single : A 29 GLN : amide:sc= -1.49 K(o=-1.5,f=-4.3!) USER MOD Single : A 30 GLN : amide:sc= -0.365 X(o=-0.37,f=-0.7) USER MOD Single : A 33 LYS NZ :NH3+ -168:sc= 1.27 (180deg=1.13) USER MOD Single : A 34 HIS : no HE2:sc= 1.15 K(o=1.1,f=-5!) USER MOD Single : A 39 MET CE :methyl -171:sc=-0.00838 (180deg=-0.141) USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 42 SER OG : rot 75:sc= 1.29 USER MOD Single : A 46 GLN : amide:sc= -0.0343 X(o=-0.034,f=-0.47) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 79:sc= 1.09 USER MOD Single : A 58 ASN : amide:sc=-0.00168 X(o=-0.0017,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.036) USER MOD Single : A 66 LYS NZ :NH3+ -168:sc= 1.96 (180deg=1.78) USER MOD Single : A 67 THR OG1 : rot -100:sc= -2.47! USER MOD Single : A 68 LYS NZ :NH3+ 144:sc= 1.24 (180deg=-0.104) USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=-0.0064) USER MOD Single : A 76 GLN :FLIP amide:sc= 0 F(o=-0.82,f=0) USER MOD Single : A 77 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 GLN :FLIP amide:sc= -0.268 F(o=-0.94,f=-0.27) USER MOD Single : A 84 SER OG : rot -36:sc= 0.123 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 1.27 (180deg=1.27) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 172:sc= 1.26 (180deg=1.06) USER MOD Single : A 100 SER OG : rot -103:sc= 1.09 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 103 THR OG1 : rot 9:sc= 0.742 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.00918 USER MOD Single : A 108 THR OG1 : rot 58:sc= 0.261 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 0 23.849 6.278 26.242 1.00 0.00 N ATOM 2 CA GLY A 0 25.016 7.116 25.992 1.00 0.00 C ATOM 3 C GLY A 0 24.681 8.569 26.187 1.00 0.00 C ATOM 4 O GLY A 0 24.696 9.074 27.304 1.00 0.00 O ATOM 0 H1 GLY A 0 24.102 5.279 26.102 1.00 0.00 H new ATOM 0 H2 GLY A 0 23.524 6.419 27.220 1.00 0.00 H new ATOM 0 H3 GLY A 0 23.088 6.538 25.583 1.00 0.00 H new ATOM 0 HA2 GLY A 0 25.825 6.831 26.665 1.00 0.00 H new ATOM 0 HA3 GLY A 0 25.375 6.954 24.976 1.00 0.00 H new ATOM 10 N SER A 1 24.404 9.254 25.113 1.00 0.00 N ATOM 11 CA SER A 1 23.994 10.632 25.148 1.00 0.00 C ATOM 12 C SER A 1 23.078 10.893 23.965 1.00 0.00 C ATOM 13 O SER A 1 23.525 10.861 22.813 1.00 0.00 O ATOM 14 CB SER A 1 25.218 11.557 25.109 1.00 0.00 C ATOM 15 OG SER A 1 26.090 11.273 26.199 1.00 0.00 O ATOM 0 H SER A 1 24.457 8.865 24.172 1.00 0.00 H new ATOM 0 HA SER A 1 23.458 10.837 26.075 1.00 0.00 H new ATOM 0 HB2 SER A 1 25.750 11.427 24.166 1.00 0.00 H new ATOM 0 HB3 SER A 1 24.897 12.598 25.153 1.00 0.00 H new ATOM 0 HG SER A 1 26.867 11.869 26.160 1.00 0.00 H new ATOM 21 N ALA A 2 21.807 11.144 24.262 1.00 0.00 N ATOM 22 CA ALA A 2 20.747 11.335 23.264 1.00 0.00 C ATOM 23 C ALA A 2 21.102 12.377 22.208 1.00 0.00 C ATOM 24 O ALA A 2 20.854 12.179 21.026 1.00 0.00 O ATOM 25 CB ALA A 2 19.448 11.706 23.949 1.00 0.00 C ATOM 0 H ALA A 2 21.473 11.223 25.222 1.00 0.00 H new ATOM 0 HA ALA A 2 20.632 10.386 22.741 1.00 0.00 H new ATOM 0 HB1 ALA A 2 18.669 11.845 23.200 1.00 0.00 H new ATOM 0 HB2 ALA A 2 19.156 10.908 24.632 1.00 0.00 H new ATOM 0 HB3 ALA A 2 19.583 12.632 24.509 1.00 0.00 H new ATOM 31 N ASP A 3 21.718 13.459 22.637 1.00 0.00 N ATOM 32 CA ASP A 3 22.093 14.551 21.732 1.00 0.00 C ATOM 33 C ASP A 3 23.142 14.104 20.718 1.00 0.00 C ATOM 34 O ASP A 3 23.109 14.490 19.535 1.00 0.00 O ATOM 35 CB ASP A 3 22.621 15.747 22.529 1.00 0.00 C ATOM 36 CG ASP A 3 23.105 16.871 21.640 1.00 0.00 C ATOM 37 OD1 ASP A 3 22.276 17.716 21.215 1.00 0.00 O ATOM 38 OD2 ASP A 3 24.301 16.929 21.342 1.00 0.00 O ATOM 0 H ASP A 3 21.975 13.616 23.611 1.00 0.00 H new ATOM 0 HA ASP A 3 21.197 14.847 21.186 1.00 0.00 H new ATOM 0 HB2 ASP A 3 21.832 16.120 23.183 1.00 0.00 H new ATOM 0 HB3 ASP A 3 23.439 15.419 23.171 1.00 0.00 H new ATOM 43 N GLU A 4 24.034 13.268 21.173 1.00 0.00 N ATOM 44 CA GLU A 4 25.131 12.808 20.366 1.00 0.00 C ATOM 45 C GLU A 4 24.630 11.714 19.418 1.00 0.00 C ATOM 46 O GLU A 4 24.766 11.831 18.197 1.00 0.00 O ATOM 47 CB GLU A 4 26.261 12.307 21.296 1.00 0.00 C ATOM 48 CG GLU A 4 27.662 12.186 20.674 1.00 0.00 C ATOM 49 CD GLU A 4 27.787 11.135 19.600 1.00 0.00 C ATOM 50 OE1 GLU A 4 27.687 9.924 19.924 1.00 0.00 O ATOM 51 OE2 GLU A 4 28.004 11.498 18.424 1.00 0.00 O ATOM 0 H GLU A 4 24.021 12.885 22.118 1.00 0.00 H new ATOM 0 HA GLU A 4 25.535 13.615 19.755 1.00 0.00 H new ATOM 0 HB2 GLU A 4 26.324 12.982 22.149 1.00 0.00 H new ATOM 0 HB3 GLU A 4 25.975 11.329 21.684 1.00 0.00 H new ATOM 0 HG2 GLU A 4 27.942 13.151 20.253 1.00 0.00 H new ATOM 0 HG3 GLU A 4 28.378 11.964 21.465 1.00 0.00 H new ATOM 58 N GLU A 5 23.971 10.705 19.986 1.00 0.00 N ATOM 59 CA GLU A 5 23.500 9.546 19.227 1.00 0.00 C ATOM 60 C GLU A 5 22.469 9.920 18.170 1.00 0.00 C ATOM 61 O GLU A 5 22.382 9.260 17.151 1.00 0.00 O ATOM 62 CB GLU A 5 22.953 8.463 20.152 1.00 0.00 C ATOM 63 CG GLU A 5 21.777 8.902 20.975 1.00 0.00 C ATOM 64 CD GLU A 5 21.321 7.854 21.925 1.00 0.00 C ATOM 65 OE1 GLU A 5 21.911 7.724 23.002 1.00 0.00 O ATOM 66 OE2 GLU A 5 20.329 7.149 21.631 1.00 0.00 O ATOM 0 H GLU A 5 23.749 10.667 20.981 1.00 0.00 H new ATOM 0 HA GLU A 5 24.368 9.147 18.702 1.00 0.00 H new ATOM 0 HB2 GLU A 5 22.663 7.600 19.553 1.00 0.00 H new ATOM 0 HB3 GLU A 5 23.749 8.134 20.820 1.00 0.00 H new ATOM 0 HG2 GLU A 5 22.043 9.801 21.532 1.00 0.00 H new ATOM 0 HG3 GLU A 5 20.954 9.169 20.312 1.00 0.00 H new ATOM 73 N LEU A 6 21.709 10.987 18.415 1.00 0.00 N ATOM 74 CA LEU A 6 20.705 11.465 17.469 1.00 0.00 C ATOM 75 C LEU A 6 21.386 11.778 16.135 1.00 0.00 C ATOM 76 O LEU A 6 20.954 11.313 15.075 1.00 0.00 O ATOM 77 CB LEU A 6 19.983 12.715 18.059 1.00 0.00 C ATOM 78 CG LEU A 6 18.725 13.274 17.335 1.00 0.00 C ATOM 79 CD1 LEU A 6 17.995 14.240 18.256 1.00 0.00 C ATOM 80 CD2 LEU A 6 19.082 14.010 16.046 1.00 0.00 C ATOM 0 H LEU A 6 21.772 11.540 19.270 1.00 0.00 H new ATOM 0 HA LEU A 6 19.949 10.699 17.295 1.00 0.00 H new ATOM 0 HB2 LEU A 6 19.694 12.475 19.082 1.00 0.00 H new ATOM 0 HB3 LEU A 6 20.715 13.521 18.116 1.00 0.00 H new ATOM 0 HG LEU A 6 18.093 12.423 17.081 1.00 0.00 H new ATOM 0 HD11 LEU A 6 17.114 14.631 17.748 1.00 0.00 H new ATOM 0 HD12 LEU A 6 17.689 13.718 19.163 1.00 0.00 H new ATOM 0 HD13 LEU A 6 18.658 15.064 18.518 1.00 0.00 H new ATOM 0 HD21 LEU A 6 18.172 14.382 15.576 1.00 0.00 H new ATOM 0 HD22 LEU A 6 19.741 14.848 16.276 1.00 0.00 H new ATOM 0 HD23 LEU A 6 19.589 13.326 15.365 1.00 0.00 H new ATOM 92 N GLU A 7 22.468 12.522 16.201 1.00 0.00 N ATOM 93 CA GLU A 7 23.186 12.890 15.018 1.00 0.00 C ATOM 94 C GLU A 7 24.048 11.748 14.528 1.00 0.00 C ATOM 95 O GLU A 7 24.112 11.495 13.331 1.00 0.00 O ATOM 96 CB GLU A 7 24.027 14.139 15.248 1.00 0.00 C ATOM 97 CG GLU A 7 23.219 15.394 15.565 1.00 0.00 C ATOM 98 CD GLU A 7 22.370 15.901 14.404 1.00 0.00 C ATOM 99 OE1 GLU A 7 22.157 15.175 13.415 1.00 0.00 O ATOM 100 OE2 GLU A 7 21.911 17.059 14.460 1.00 0.00 O ATOM 0 H GLU A 7 22.865 12.881 17.069 1.00 0.00 H new ATOM 0 HA GLU A 7 22.452 13.117 14.245 1.00 0.00 H new ATOM 0 HB2 GLU A 7 24.719 13.950 16.069 1.00 0.00 H new ATOM 0 HB3 GLU A 7 24.630 14.325 14.359 1.00 0.00 H new ATOM 0 HG2 GLU A 7 22.567 15.188 16.414 1.00 0.00 H new ATOM 0 HG3 GLU A 7 23.903 16.185 15.873 1.00 0.00 H new ATOM 107 N ALA A 8 24.680 11.044 15.458 1.00 0.00 N ATOM 108 CA ALA A 8 25.572 9.936 15.124 1.00 0.00 C ATOM 109 C ALA A 8 24.842 8.836 14.372 1.00 0.00 C ATOM 110 O ALA A 8 25.264 8.445 13.280 1.00 0.00 O ATOM 111 CB ALA A 8 26.244 9.379 16.372 1.00 0.00 C ATOM 0 H ALA A 8 24.591 11.221 16.459 1.00 0.00 H new ATOM 0 HA ALA A 8 26.346 10.331 14.465 1.00 0.00 H new ATOM 0 HB1 ALA A 8 26.902 8.556 16.094 1.00 0.00 H new ATOM 0 HB2 ALA A 8 26.828 10.164 16.852 1.00 0.00 H new ATOM 0 HB3 ALA A 8 25.483 9.018 17.064 1.00 0.00 H new ATOM 117 N LEU A 9 23.725 8.372 14.931 1.00 0.00 N ATOM 118 CA LEU A 9 22.948 7.314 14.322 1.00 0.00 C ATOM 119 C LEU A 9 22.438 7.769 12.987 1.00 0.00 C ATOM 120 O LEU A 9 22.620 7.077 11.993 1.00 0.00 O ATOM 121 CB LEU A 9 21.773 6.865 15.252 1.00 0.00 C ATOM 122 CG LEU A 9 20.863 5.674 14.793 1.00 0.00 C ATOM 123 CD1 LEU A 9 20.009 5.208 15.941 1.00 0.00 C ATOM 124 CD2 LEU A 9 19.930 6.058 13.651 1.00 0.00 C ATOM 0 H LEU A 9 23.343 8.720 15.810 1.00 0.00 H new ATOM 0 HA LEU A 9 23.591 6.446 14.177 1.00 0.00 H new ATOM 0 HB2 LEU A 9 22.200 6.601 16.220 1.00 0.00 H new ATOM 0 HB3 LEU A 9 21.129 7.730 15.413 1.00 0.00 H new ATOM 0 HG LEU A 9 21.535 4.887 14.450 1.00 0.00 H new ATOM 0 HD11 LEU A 9 19.380 4.380 15.614 1.00 0.00 H new ATOM 0 HD12 LEU A 9 20.648 4.876 16.759 1.00 0.00 H new ATOM 0 HD13 LEU A 9 19.379 6.029 16.283 1.00 0.00 H new ATOM 0 HD21 LEU A 9 19.323 5.197 13.372 1.00 0.00 H new ATOM 0 HD22 LEU A 9 19.280 6.873 13.970 1.00 0.00 H new ATOM 0 HD23 LEU A 9 20.519 6.380 12.792 1.00 0.00 H new ATOM 136 N ARG A 10 21.821 8.945 12.951 1.00 0.00 N ATOM 137 CA ARG A 10 21.212 9.411 11.731 1.00 0.00 C ATOM 138 C ARG A 10 22.241 9.632 10.625 1.00 0.00 C ATOM 139 O ARG A 10 22.014 9.239 9.488 1.00 0.00 O ATOM 140 CB ARG A 10 20.363 10.668 11.929 1.00 0.00 C ATOM 141 CG ARG A 10 19.641 11.031 10.653 1.00 0.00 C ATOM 142 CD ARG A 10 18.840 12.299 10.721 1.00 0.00 C ATOM 143 NE ARG A 10 18.207 12.521 9.421 1.00 0.00 N ATOM 144 CZ ARG A 10 18.340 13.602 8.661 1.00 0.00 C ATOM 145 NH1 ARG A 10 18.895 14.711 9.146 1.00 0.00 N ATOM 146 NH2 ARG A 10 17.875 13.593 7.422 1.00 0.00 N ATOM 0 H ARG A 10 21.735 9.579 13.746 1.00 0.00 H new ATOM 0 HA ARG A 10 20.539 8.612 11.418 1.00 0.00 H new ATOM 0 HB2 ARG A 10 19.640 10.502 12.727 1.00 0.00 H new ATOM 0 HB3 ARG A 10 20.998 11.497 12.241 1.00 0.00 H new ATOM 0 HG2 ARG A 10 20.374 11.123 9.851 1.00 0.00 H new ATOM 0 HG3 ARG A 10 18.975 10.211 10.383 1.00 0.00 H new ATOM 0 HD2 ARG A 10 18.084 12.227 11.503 1.00 0.00 H new ATOM 0 HD3 ARG A 10 19.484 13.140 10.977 1.00 0.00 H new ATOM 0 HE ARG A 10 17.608 11.776 9.065 1.00 0.00 H new ATOM 0 HH11 ARG A 10 19.224 14.737 10.111 1.00 0.00 H new ATOM 0 HH12 ARG A 10 18.992 15.535 8.552 1.00 0.00 H new ATOM 0 HH21 ARG A 10 17.417 12.759 7.055 1.00 0.00 H new ATOM 0 HH22 ARG A 10 17.974 14.420 6.834 1.00 0.00 H new ATOM 160 N ARG A 11 23.373 10.223 10.969 1.00 0.00 N ATOM 161 CA ARG A 11 24.417 10.515 9.991 1.00 0.00 C ATOM 162 C ARG A 11 24.920 9.216 9.404 1.00 0.00 C ATOM 163 O ARG A 11 25.006 9.058 8.184 1.00 0.00 O ATOM 164 CB ARG A 11 25.583 11.212 10.649 1.00 0.00 C ATOM 165 CG ARG A 11 26.406 12.101 9.731 1.00 0.00 C ATOM 166 CD ARG A 11 25.919 13.548 9.788 1.00 0.00 C ATOM 167 NE ARG A 11 24.503 13.720 9.426 1.00 0.00 N ATOM 168 CZ ARG A 11 23.564 14.235 10.243 1.00 0.00 C ATOM 169 NH1 ARG A 11 23.845 14.454 11.536 1.00 0.00 N ATOM 170 NH2 ARG A 11 22.346 14.499 9.777 1.00 0.00 N ATOM 0 H ARG A 11 23.596 10.512 11.921 1.00 0.00 H new ATOM 0 HA ARG A 11 23.997 11.159 9.218 1.00 0.00 H new ATOM 0 HB2 ARG A 11 25.206 11.818 11.473 1.00 0.00 H new ATOM 0 HB3 ARG A 11 26.239 10.457 11.082 1.00 0.00 H new ATOM 0 HG2 ARG A 11 27.456 12.055 10.020 1.00 0.00 H new ATOM 0 HG3 ARG A 11 26.341 11.732 8.707 1.00 0.00 H new ATOM 0 HD2 ARG A 11 26.075 13.933 10.796 1.00 0.00 H new ATOM 0 HD3 ARG A 11 26.530 14.152 9.118 1.00 0.00 H new ATOM 0 HE ARG A 11 24.213 13.429 8.492 1.00 0.00 H new ATOM 0 HH11 ARG A 11 24.771 14.231 11.902 1.00 0.00 H new ATOM 0 HH12 ARG A 11 23.133 14.844 12.154 1.00 0.00 H new ATOM 0 HH21 ARG A 11 22.122 14.311 8.800 1.00 0.00 H new ATOM 0 HH22 ARG A 11 21.636 14.889 10.397 1.00 0.00 H new ATOM 184 N GLN A 12 25.202 8.278 10.290 1.00 0.00 N ATOM 185 CA GLN A 12 25.699 6.979 9.918 1.00 0.00 C ATOM 186 C GLN A 12 24.662 6.264 9.053 1.00 0.00 C ATOM 187 O GLN A 12 24.981 5.789 7.984 1.00 0.00 O ATOM 188 CB GLN A 12 26.033 6.190 11.184 1.00 0.00 C ATOM 189 CG GLN A 12 26.791 4.896 10.968 1.00 0.00 C ATOM 190 CD GLN A 12 27.252 4.292 12.285 1.00 0.00 C ATOM 191 OE1 GLN A 12 27.502 5.005 13.263 1.00 0.00 O ATOM 192 NE2 GLN A 12 27.397 3.000 12.321 1.00 0.00 N ATOM 0 H GLN A 12 25.089 8.404 11.296 1.00 0.00 H new ATOM 0 HA GLN A 12 26.611 7.072 9.329 1.00 0.00 H new ATOM 0 HB2 GLN A 12 26.620 6.828 11.844 1.00 0.00 H new ATOM 0 HB3 GLN A 12 25.103 5.963 11.705 1.00 0.00 H new ATOM 0 HG2 GLN A 12 26.154 4.184 10.443 1.00 0.00 H new ATOM 0 HG3 GLN A 12 27.655 5.082 10.330 1.00 0.00 H new ATOM 0 HE21 GLN A 12 27.182 2.440 11.496 1.00 0.00 H new ATOM 0 HE22 GLN A 12 27.726 2.547 13.174 1.00 0.00 H new ATOM 201 N ARG A 13 23.408 6.279 9.504 1.00 0.00 N ATOM 202 CA ARG A 13 22.266 5.680 8.793 1.00 0.00 C ATOM 203 C ARG A 13 22.132 6.251 7.382 1.00 0.00 C ATOM 204 O ARG A 13 21.899 5.506 6.417 1.00 0.00 O ATOM 205 CB ARG A 13 20.980 5.934 9.588 1.00 0.00 C ATOM 206 CG ARG A 13 19.686 5.492 8.917 1.00 0.00 C ATOM 207 CD ARG A 13 18.509 5.847 9.798 1.00 0.00 C ATOM 208 NE ARG A 13 17.210 5.545 9.183 1.00 0.00 N ATOM 209 CZ ARG A 13 16.014 5.780 9.758 1.00 0.00 C ATOM 210 NH1 ARG A 13 15.943 6.284 10.992 1.00 0.00 N ATOM 211 NH2 ARG A 13 14.892 5.514 9.090 1.00 0.00 N ATOM 0 H ARG A 13 23.147 6.714 10.389 1.00 0.00 H new ATOM 0 HA ARG A 13 22.437 4.607 8.705 1.00 0.00 H new ATOM 0 HB2 ARG A 13 21.062 5.424 10.548 1.00 0.00 H new ATOM 0 HB3 ARG A 13 20.911 7.001 9.799 1.00 0.00 H new ATOM 0 HG2 ARG A 13 19.585 5.976 7.946 1.00 0.00 H new ATOM 0 HG3 ARG A 13 19.707 4.417 8.737 1.00 0.00 H new ATOM 0 HD2 ARG A 13 18.592 5.304 10.740 1.00 0.00 H new ATOM 0 HD3 ARG A 13 18.551 6.909 10.038 1.00 0.00 H new ATOM 0 HE ARG A 13 17.213 5.127 8.253 1.00 0.00 H new ATOM 0 HH11 ARG A 13 16.798 6.494 11.507 1.00 0.00 H new ATOM 0 HH12 ARG A 13 15.034 6.459 11.420 1.00 0.00 H new ATOM 0 HH21 ARG A 13 14.939 5.133 8.145 1.00 0.00 H new ATOM 0 HH22 ARG A 13 13.986 5.691 9.524 1.00 0.00 H new ATOM 225 N LEU A 14 22.298 7.564 7.256 1.00 0.00 N ATOM 226 CA LEU A 14 22.226 8.208 5.975 1.00 0.00 C ATOM 227 C LEU A 14 23.343 7.748 5.081 1.00 0.00 C ATOM 228 O LEU A 14 23.121 7.458 3.894 1.00 0.00 O ATOM 229 CB LEU A 14 22.231 9.720 6.122 1.00 0.00 C ATOM 230 CG LEU A 14 20.871 10.435 6.042 1.00 0.00 C ATOM 231 CD1 LEU A 14 20.252 10.231 4.677 1.00 0.00 C ATOM 232 CD2 LEU A 14 19.921 9.947 7.120 1.00 0.00 C ATOM 0 H LEU A 14 22.483 8.194 8.037 1.00 0.00 H new ATOM 0 HA LEU A 14 21.283 7.923 5.508 1.00 0.00 H new ATOM 0 HB2 LEU A 14 22.687 9.965 7.081 1.00 0.00 H new ATOM 0 HB3 LEU A 14 22.877 10.133 5.347 1.00 0.00 H new ATOM 0 HG LEU A 14 21.046 11.499 6.204 1.00 0.00 H new ATOM 0 HD11 LEU A 14 19.290 10.742 4.634 1.00 0.00 H new ATOM 0 HD12 LEU A 14 20.914 10.638 3.913 1.00 0.00 H new ATOM 0 HD13 LEU A 14 20.105 9.166 4.500 1.00 0.00 H new ATOM 0 HD21 LEU A 14 18.971 10.474 7.033 1.00 0.00 H new ATOM 0 HD22 LEU A 14 19.755 8.876 7.001 1.00 0.00 H new ATOM 0 HD23 LEU A 14 20.354 10.140 8.101 1.00 0.00 H new ATOM 244 N ALA A 15 24.521 7.624 5.665 1.00 0.00 N ATOM 245 CA ALA A 15 25.708 7.190 4.957 1.00 0.00 C ATOM 246 C ALA A 15 25.564 5.753 4.495 1.00 0.00 C ATOM 247 O ALA A 15 25.934 5.420 3.366 1.00 0.00 O ATOM 248 CB ALA A 15 26.944 7.364 5.820 1.00 0.00 C ATOM 0 H ALA A 15 24.680 7.824 6.652 1.00 0.00 H new ATOM 0 HA ALA A 15 25.825 7.817 4.073 1.00 0.00 H new ATOM 0 HB1 ALA A 15 27.823 7.032 5.268 1.00 0.00 H new ATOM 0 HB2 ALA A 15 27.058 8.415 6.085 1.00 0.00 H new ATOM 0 HB3 ALA A 15 26.840 6.770 6.728 1.00 0.00 H new ATOM 254 N GLU A 16 25.010 4.921 5.373 1.00 0.00 N ATOM 255 CA GLU A 16 24.732 3.507 5.108 1.00 0.00 C ATOM 256 C GLU A 16 23.887 3.351 3.863 1.00 0.00 C ATOM 257 O GLU A 16 24.187 2.529 2.990 1.00 0.00 O ATOM 258 CB GLU A 16 23.968 2.900 6.280 1.00 0.00 C ATOM 259 CG GLU A 16 24.726 2.861 7.581 1.00 0.00 C ATOM 260 CD GLU A 16 25.879 1.921 7.545 1.00 0.00 C ATOM 261 OE1 GLU A 16 25.659 0.697 7.418 1.00 0.00 O ATOM 262 OE2 GLU A 16 27.034 2.366 7.683 1.00 0.00 O ATOM 0 H GLU A 16 24.735 5.215 6.310 1.00 0.00 H new ATOM 0 HA GLU A 16 25.686 2.998 4.969 1.00 0.00 H new ATOM 0 HB2 GLU A 16 23.049 3.468 6.429 1.00 0.00 H new ATOM 0 HB3 GLU A 16 23.675 1.884 6.016 1.00 0.00 H new ATOM 0 HG2 GLU A 16 25.086 3.862 7.817 1.00 0.00 H new ATOM 0 HG3 GLU A 16 24.048 2.568 8.383 1.00 0.00 H new ATOM 269 N LEU A 17 22.844 4.154 3.785 1.00 0.00 N ATOM 270 CA LEU A 17 21.927 4.108 2.676 1.00 0.00 C ATOM 271 C LEU A 17 22.639 4.566 1.391 1.00 0.00 C ATOM 272 O LEU A 17 22.766 3.793 0.447 1.00 0.00 O ATOM 273 CB LEU A 17 20.681 4.986 3.021 1.00 0.00 C ATOM 274 CG LEU A 17 19.444 4.961 2.081 1.00 0.00 C ATOM 275 CD1 LEU A 17 19.709 5.625 0.744 1.00 0.00 C ATOM 276 CD2 LEU A 17 18.938 3.538 1.883 1.00 0.00 C ATOM 0 H LEU A 17 22.613 4.854 4.490 1.00 0.00 H new ATOM 0 HA LEU A 17 21.582 3.090 2.498 1.00 0.00 H new ATOM 0 HB2 LEU A 17 20.342 4.695 4.015 1.00 0.00 H new ATOM 0 HB3 LEU A 17 21.019 6.020 3.089 1.00 0.00 H new ATOM 0 HG LEU A 17 18.668 5.545 2.576 1.00 0.00 H new ATOM 0 HD11 LEU A 17 18.810 5.577 0.130 1.00 0.00 H new ATOM 0 HD12 LEU A 17 19.985 6.667 0.904 1.00 0.00 H new ATOM 0 HD13 LEU A 17 20.523 5.108 0.236 1.00 0.00 H new ATOM 0 HD21 LEU A 17 18.072 3.549 1.221 1.00 0.00 H new ATOM 0 HD22 LEU A 17 19.726 2.930 1.439 1.00 0.00 H new ATOM 0 HD23 LEU A 17 18.653 3.116 2.847 1.00 0.00 H new ATOM 288 N GLN A 18 23.158 5.785 1.403 1.00 0.00 N ATOM 289 CA GLN A 18 23.837 6.376 0.219 1.00 0.00 C ATOM 290 C GLN A 18 24.797 7.491 0.575 1.00 0.00 C ATOM 291 O GLN A 18 25.745 7.737 -0.171 1.00 0.00 O ATOM 292 CB GLN A 18 22.839 6.915 -0.825 1.00 0.00 C ATOM 293 CG GLN A 18 22.291 5.874 -1.784 1.00 0.00 C ATOM 294 CD GLN A 18 23.374 5.227 -2.622 1.00 0.00 C ATOM 295 OE1 GLN A 18 24.401 5.845 -2.931 1.00 0.00 O ATOM 296 NE2 GLN A 18 23.163 4.002 -3.000 1.00 0.00 N ATOM 0 H GLN A 18 23.130 6.401 2.216 1.00 0.00 H new ATOM 0 HA GLN A 18 24.402 5.547 -0.207 1.00 0.00 H new ATOM 0 HB2 GLN A 18 22.004 7.380 -0.301 1.00 0.00 H new ATOM 0 HB3 GLN A 18 23.329 7.698 -1.403 1.00 0.00 H new ATOM 0 HG2 GLN A 18 21.766 5.104 -1.218 1.00 0.00 H new ATOM 0 HG3 GLN A 18 21.558 6.341 -2.442 1.00 0.00 H new ATOM 0 HE21 GLN A 18 22.304 3.524 -2.726 1.00 0.00 H new ATOM 0 HE22 GLN A 18 23.856 3.518 -3.571 1.00 0.00 H new ATOM 305 N ALA A 19 24.532 8.157 1.703 1.00 0.00 N ATOM 306 CA ALA A 19 25.288 9.305 2.205 1.00 0.00 C ATOM 307 C ALA A 19 24.859 10.595 1.536 1.00 0.00 C ATOM 308 O ALA A 19 25.111 10.817 0.348 1.00 0.00 O ATOM 309 CB ALA A 19 26.804 9.104 2.161 1.00 0.00 C ATOM 0 H ALA A 19 23.756 7.901 2.313 1.00 0.00 H new ATOM 0 HA ALA A 19 25.039 9.389 3.263 1.00 0.00 H new ATOM 0 HB1 ALA A 19 27.300 9.994 2.548 1.00 0.00 H new ATOM 0 HB2 ALA A 19 27.075 8.243 2.772 1.00 0.00 H new ATOM 0 HB3 ALA A 19 27.118 8.932 1.132 1.00 0.00 H new ATOM 315 N LYS A 20 24.174 11.418 2.297 1.00 0.00 N ATOM 316 CA LYS A 20 23.725 12.715 1.857 1.00 0.00 C ATOM 317 C LYS A 20 23.399 13.519 3.094 1.00 0.00 C ATOM 318 O LYS A 20 23.022 12.947 4.128 1.00 0.00 O ATOM 319 CB LYS A 20 22.485 12.625 0.935 1.00 0.00 C ATOM 320 CG LYS A 20 21.218 12.128 1.613 1.00 0.00 C ATOM 321 CD LYS A 20 20.054 12.119 0.652 1.00 0.00 C ATOM 322 CE LYS A 20 18.753 11.777 1.359 1.00 0.00 C ATOM 323 NZ LYS A 20 17.629 11.705 0.410 1.00 0.00 N ATOM 0 H LYS A 20 23.909 11.198 3.257 1.00 0.00 H new ATOM 0 HA LYS A 20 24.511 13.189 1.269 1.00 0.00 H new ATOM 0 HB2 LYS A 20 22.291 13.611 0.514 1.00 0.00 H new ATOM 0 HB3 LYS A 20 22.717 11.962 0.101 1.00 0.00 H new ATOM 0 HG2 LYS A 20 21.380 11.123 2.002 1.00 0.00 H new ATOM 0 HG3 LYS A 20 20.984 12.765 2.466 1.00 0.00 H new ATOM 0 HD2 LYS A 20 19.965 13.096 0.177 1.00 0.00 H new ATOM 0 HD3 LYS A 20 20.240 11.394 -0.141 1.00 0.00 H new ATOM 0 HE2 LYS A 20 18.857 10.822 1.875 1.00 0.00 H new ATOM 0 HE3 LYS A 20 18.542 12.529 2.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 16.822 11.230 0.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 17.351 12.667 0.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 17.919 11.167 -0.432 1.00 0.00 H new ATOM 337 N HIS A 21 23.549 14.804 3.020 1.00 0.00 N ATOM 338 CA HIS A 21 23.299 15.651 4.165 1.00 0.00 C ATOM 339 C HIS A 21 22.577 16.909 3.695 1.00 0.00 C ATOM 340 O HIS A 21 22.520 17.920 4.389 1.00 0.00 O ATOM 341 CB HIS A 21 24.643 15.996 4.840 1.00 0.00 C ATOM 342 CG HIS A 21 24.540 16.556 6.236 1.00 0.00 C ATOM 343 ND1 HIS A 21 25.633 16.971 6.947 1.00 0.00 N ATOM 344 CD2 HIS A 21 23.476 16.731 7.061 1.00 0.00 C ATOM 345 CE1 HIS A 21 25.257 17.371 8.133 1.00 0.00 C ATOM 346 NE2 HIS A 21 23.956 17.237 8.230 1.00 0.00 N ATOM 0 H HIS A 21 23.844 15.300 2.179 1.00 0.00 H new ATOM 0 HA HIS A 21 22.671 15.141 4.895 1.00 0.00 H new ATOM 0 HB2 HIS A 21 25.256 15.095 4.872 1.00 0.00 H new ATOM 0 HB3 HIS A 21 25.169 16.717 4.215 1.00 0.00 H new ATOM 0 HD2 HIS A 21 22.444 16.510 6.833 1.00 0.00 H new ATOM 0 HE1 HIS A 21 25.910 17.749 8.906 1.00 0.00 H new ATOM 0 HE2 HIS A 21 23.395 17.473 9.048 1.00 0.00 H new ATOM 355 N GLY A 22 21.992 16.816 2.528 1.00 0.00 N ATOM 356 CA GLY A 22 21.297 17.933 1.944 1.00 0.00 C ATOM 357 C GLY A 22 19.887 18.055 2.451 1.00 0.00 C ATOM 358 O GLY A 22 18.930 17.978 1.677 1.00 0.00 O ATOM 0 H GLY A 22 21.984 15.969 1.959 1.00 0.00 H new ATOM 0 HA2 GLY A 22 21.841 18.852 2.164 1.00 0.00 H new ATOM 0 HA3 GLY A 22 21.283 17.823 0.860 1.00 0.00 H new ATOM 362 N ASP A 23 19.750 18.196 3.739 1.00 0.00 N ATOM 363 CA ASP A 23 18.468 18.389 4.350 1.00 0.00 C ATOM 364 C ASP A 23 18.641 19.236 5.593 1.00 0.00 C ATOM 365 O ASP A 23 19.480 18.938 6.451 1.00 0.00 O ATOM 366 CB ASP A 23 17.744 17.052 4.708 1.00 0.00 C ATOM 367 CG ASP A 23 18.249 16.354 5.957 1.00 0.00 C ATOM 368 OD1 ASP A 23 19.196 15.562 5.881 1.00 0.00 O ATOM 369 OD2 ASP A 23 17.659 16.556 7.041 1.00 0.00 O ATOM 0 H ASP A 23 20.529 18.180 4.397 1.00 0.00 H new ATOM 0 HA ASP A 23 17.832 18.892 3.622 1.00 0.00 H new ATOM 0 HB2 ASP A 23 16.680 17.256 4.831 1.00 0.00 H new ATOM 0 HB3 ASP A 23 17.842 16.368 3.865 1.00 0.00 H new ATOM 374 N PRO A 24 17.945 20.364 5.676 1.00 0.00 N ATOM 375 CA PRO A 24 17.928 21.172 6.873 1.00 0.00 C ATOM 376 C PRO A 24 16.730 20.801 7.751 1.00 0.00 C ATOM 377 O PRO A 24 16.307 21.571 8.613 1.00 0.00 O ATOM 378 CB PRO A 24 17.776 22.609 6.334 1.00 0.00 C ATOM 379 CG PRO A 24 17.379 22.479 4.885 1.00 0.00 C ATOM 380 CD PRO A 24 17.193 21.012 4.595 1.00 0.00 C ATOM 0 HA PRO A 24 18.816 21.039 7.491 1.00 0.00 H new ATOM 0 HB2 PRO A 24 17.020 23.157 6.896 1.00 0.00 H new ATOM 0 HB3 PRO A 24 18.710 23.162 6.433 1.00 0.00 H new ATOM 0 HG2 PRO A 24 16.458 23.028 4.689 1.00 0.00 H new ATOM 0 HG3 PRO A 24 18.147 22.903 4.238 1.00 0.00 H new ATOM 0 HD2 PRO A 24 16.141 20.728 4.609 1.00 0.00 H new ATOM 0 HD3 PRO A 24 17.583 20.742 3.614 1.00 0.00 H new ATOM 388 N GLY A 25 16.202 19.609 7.540 1.00 0.00 N ATOM 389 CA GLY A 25 15.047 19.169 8.277 1.00 0.00 C ATOM 390 C GLY A 25 13.806 19.113 7.414 1.00 0.00 C ATOM 391 O GLY A 25 13.202 18.049 7.236 1.00 0.00 O ATOM 0 H GLY A 25 16.559 18.934 6.864 1.00 0.00 H new ATOM 0 HA2 GLY A 25 15.240 18.182 8.697 1.00 0.00 H new ATOM 0 HA3 GLY A 25 14.874 19.844 9.115 1.00 0.00 H new ATOM 395 N ASP A 26 13.459 20.247 6.821 1.00 0.00 N ATOM 396 CA ASP A 26 12.252 20.368 5.986 1.00 0.00 C ATOM 397 C ASP A 26 12.306 19.448 4.767 1.00 0.00 C ATOM 398 O ASP A 26 11.276 18.966 4.297 1.00 0.00 O ATOM 399 CB ASP A 26 12.010 21.826 5.541 1.00 0.00 C ATOM 400 CG ASP A 26 13.109 22.378 4.658 1.00 0.00 C ATOM 401 OD1 ASP A 26 14.111 22.892 5.196 1.00 0.00 O ATOM 402 OD2 ASP A 26 12.999 22.294 3.416 1.00 0.00 O ATOM 0 H ASP A 26 13.997 21.110 6.899 1.00 0.00 H new ATOM 0 HA ASP A 26 11.414 20.055 6.609 1.00 0.00 H new ATOM 0 HB2 ASP A 26 11.062 21.882 5.006 1.00 0.00 H new ATOM 0 HB3 ASP A 26 11.914 22.456 6.425 1.00 0.00 H new ATOM 407 N ALA A 27 13.498 19.207 4.256 1.00 0.00 N ATOM 408 CA ALA A 27 13.665 18.319 3.117 1.00 0.00 C ATOM 409 C ALA A 27 13.341 16.874 3.486 1.00 0.00 C ATOM 410 O ALA A 27 12.620 16.186 2.754 1.00 0.00 O ATOM 411 CB ALA A 27 15.070 18.420 2.557 1.00 0.00 C ATOM 0 H ALA A 27 14.365 19.612 4.609 1.00 0.00 H new ATOM 0 HA ALA A 27 12.961 18.635 2.347 1.00 0.00 H new ATOM 0 HB1 ALA A 27 15.172 17.747 1.706 1.00 0.00 H new ATOM 0 HB2 ALA A 27 15.261 19.444 2.235 1.00 0.00 H new ATOM 0 HB3 ALA A 27 15.790 18.142 3.327 1.00 0.00 H new ATOM 417 N ALA A 28 13.829 16.442 4.645 1.00 0.00 N ATOM 418 CA ALA A 28 13.680 15.065 5.091 1.00 0.00 C ATOM 419 C ALA A 28 12.227 14.700 5.339 1.00 0.00 C ATOM 420 O ALA A 28 11.772 13.637 4.921 1.00 0.00 O ATOM 421 CB ALA A 28 14.520 14.811 6.328 1.00 0.00 C ATOM 0 H ALA A 28 14.338 17.037 5.299 1.00 0.00 H new ATOM 0 HA ALA A 28 14.039 14.422 4.288 1.00 0.00 H new ATOM 0 HB1 ALA A 28 14.395 13.776 6.646 1.00 0.00 H new ATOM 0 HB2 ALA A 28 15.570 14.996 6.099 1.00 0.00 H new ATOM 0 HB3 ALA A 28 14.200 15.478 7.129 1.00 0.00 H new ATOM 427 N GLN A 29 11.484 15.594 5.982 1.00 0.00 N ATOM 428 CA GLN A 29 10.079 15.330 6.265 1.00 0.00 C ATOM 429 C GLN A 29 9.255 15.232 4.980 1.00 0.00 C ATOM 430 O GLN A 29 8.390 14.378 4.859 1.00 0.00 O ATOM 431 CB GLN A 29 9.488 16.353 7.238 1.00 0.00 C ATOM 432 CG GLN A 29 9.573 17.792 6.769 1.00 0.00 C ATOM 433 CD GLN A 29 8.981 18.774 7.750 1.00 0.00 C ATOM 434 OE1 GLN A 29 9.432 19.922 7.847 1.00 0.00 O ATOM 435 NE2 GLN A 29 7.977 18.356 8.486 1.00 0.00 N ATOM 0 H GLN A 29 11.826 16.496 6.313 1.00 0.00 H new ATOM 0 HA GLN A 29 10.030 14.359 6.758 1.00 0.00 H new ATOM 0 HB2 GLN A 29 8.442 16.104 7.416 1.00 0.00 H new ATOM 0 HB3 GLN A 29 10.003 16.265 8.194 1.00 0.00 H new ATOM 0 HG2 GLN A 29 10.618 18.049 6.594 1.00 0.00 H new ATOM 0 HG3 GLN A 29 9.057 17.887 5.814 1.00 0.00 H new ATOM 0 HE21 GLN A 29 7.630 17.403 8.381 1.00 0.00 H new ATOM 0 HE22 GLN A 29 7.545 18.985 9.163 1.00 0.00 H new ATOM 444 N GLN A 30 9.568 16.070 4.003 1.00 0.00 N ATOM 445 CA GLN A 30 8.864 16.023 2.726 1.00 0.00 C ATOM 446 C GLN A 30 9.193 14.749 1.976 1.00 0.00 C ATOM 447 O GLN A 30 8.335 14.147 1.341 1.00 0.00 O ATOM 448 CB GLN A 30 9.160 17.254 1.869 1.00 0.00 C ATOM 449 CG GLN A 30 8.536 18.529 2.404 1.00 0.00 C ATOM 450 CD GLN A 30 7.027 18.413 2.513 1.00 0.00 C ATOM 451 OE1 GLN A 30 6.493 18.007 3.547 1.00 0.00 O ATOM 452 NE2 GLN A 30 6.336 18.739 1.452 1.00 0.00 N ATOM 0 H GLN A 30 10.295 16.783 4.066 1.00 0.00 H new ATOM 0 HA GLN A 30 7.796 16.028 2.942 1.00 0.00 H new ATOM 0 HB2 GLN A 30 10.240 17.388 1.801 1.00 0.00 H new ATOM 0 HB3 GLN A 30 8.796 17.078 0.857 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.955 18.756 3.384 1.00 0.00 H new ATOM 0 HG3 GLN A 30 8.790 19.362 1.748 1.00 0.00 H new ATOM 0 HE21 GLN A 30 6.814 19.071 0.614 1.00 0.00 H new ATOM 0 HE22 GLN A 30 5.319 18.661 1.462 1.00 0.00 H new ATOM 461 N GLU A 31 10.419 14.312 2.108 1.00 0.00 N ATOM 462 CA GLU A 31 10.875 13.095 1.482 1.00 0.00 C ATOM 463 C GLU A 31 10.216 11.878 2.157 1.00 0.00 C ATOM 464 O GLU A 31 9.917 10.856 1.504 1.00 0.00 O ATOM 465 CB GLU A 31 12.400 13.049 1.538 1.00 0.00 C ATOM 466 CG GLU A 31 13.023 11.876 0.837 1.00 0.00 C ATOM 467 CD GLU A 31 14.508 12.015 0.714 1.00 0.00 C ATOM 468 OE1 GLU A 31 15.242 11.584 1.606 1.00 0.00 O ATOM 469 OE2 GLU A 31 14.981 12.571 -0.304 1.00 0.00 O ATOM 0 H GLU A 31 11.134 14.792 2.655 1.00 0.00 H new ATOM 0 HA GLU A 31 10.581 13.068 0.433 1.00 0.00 H new ATOM 0 HB2 GLU A 31 12.793 13.966 1.100 1.00 0.00 H new ATOM 0 HB3 GLU A 31 12.711 13.036 2.583 1.00 0.00 H new ATOM 0 HG2 GLU A 31 12.789 10.962 1.383 1.00 0.00 H new ATOM 0 HG3 GLU A 31 12.586 11.774 -0.156 1.00 0.00 H new ATOM 476 N ALA A 32 9.966 12.003 3.446 1.00 0.00 N ATOM 477 CA ALA A 32 9.256 10.991 4.196 1.00 0.00 C ATOM 478 C ALA A 32 7.792 10.958 3.761 1.00 0.00 C ATOM 479 O ALA A 32 7.200 9.888 3.610 1.00 0.00 O ATOM 480 CB ALA A 32 9.367 11.255 5.693 1.00 0.00 C ATOM 0 H ALA A 32 10.250 12.810 4.001 1.00 0.00 H new ATOM 0 HA ALA A 32 9.706 10.019 3.992 1.00 0.00 H new ATOM 0 HB1 ALA A 32 8.826 10.483 6.240 1.00 0.00 H new ATOM 0 HB2 ALA A 32 10.416 11.241 5.988 1.00 0.00 H new ATOM 0 HB3 ALA A 32 8.938 12.230 5.923 1.00 0.00 H new ATOM 486 N LYS A 33 7.229 12.141 3.532 1.00 0.00 N ATOM 487 CA LYS A 33 5.848 12.280 3.065 1.00 0.00 C ATOM 488 C LYS A 33 5.701 11.776 1.612 1.00 0.00 C ATOM 489 O LYS A 33 4.609 11.363 1.180 1.00 0.00 O ATOM 490 CB LYS A 33 5.378 13.745 3.194 1.00 0.00 C ATOM 491 CG LYS A 33 3.957 14.002 2.698 1.00 0.00 C ATOM 492 CD LYS A 33 2.911 13.222 3.492 1.00 0.00 C ATOM 493 CE LYS A 33 1.518 13.444 2.923 1.00 0.00 C ATOM 494 NZ LYS A 33 0.484 12.678 3.646 1.00 0.00 N ATOM 0 H LYS A 33 7.713 13.029 3.664 1.00 0.00 H new ATOM 0 HA LYS A 33 5.210 11.661 3.696 1.00 0.00 H new ATOM 0 HB2 LYS A 33 5.443 14.043 4.240 1.00 0.00 H new ATOM 0 HB3 LYS A 33 6.064 14.383 2.638 1.00 0.00 H new ATOM 0 HG2 LYS A 33 3.739 15.068 2.765 1.00 0.00 H new ATOM 0 HG3 LYS A 33 3.888 13.728 1.645 1.00 0.00 H new ATOM 0 HD2 LYS A 33 3.151 12.159 3.471 1.00 0.00 H new ATOM 0 HD3 LYS A 33 2.935 13.533 4.536 1.00 0.00 H new ATOM 0 HE2 LYS A 33 1.276 14.506 2.967 1.00 0.00 H new ATOM 0 HE3 LYS A 33 1.509 13.158 1.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -0.404 12.699 3.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.798 11.693 3.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.329 13.102 4.583 1.00 0.00 H new ATOM 508 N HIS A 34 6.784 11.821 0.864 1.00 0.00 N ATOM 509 CA HIS A 34 6.802 11.299 -0.496 1.00 0.00 C ATOM 510 C HIS A 34 6.600 9.780 -0.422 1.00 0.00 C ATOM 511 O HIS A 34 5.679 9.223 -1.025 1.00 0.00 O ATOM 512 CB HIS A 34 8.150 11.641 -1.170 1.00 0.00 C ATOM 513 CG HIS A 34 8.218 11.391 -2.659 1.00 0.00 C ATOM 514 ND1 HIS A 34 8.510 10.171 -3.231 1.00 0.00 N ATOM 515 CD2 HIS A 34 8.070 12.247 -3.693 1.00 0.00 C ATOM 516 CE1 HIS A 34 8.540 10.296 -4.533 1.00 0.00 C ATOM 517 NE2 HIS A 34 8.274 11.543 -4.842 1.00 0.00 N ATOM 0 H HIS A 34 7.672 12.216 1.174 1.00 0.00 H new ATOM 0 HA HIS A 34 6.007 11.747 -1.092 1.00 0.00 H new ATOM 0 HB2 HIS A 34 8.371 12.692 -0.986 1.00 0.00 H new ATOM 0 HB3 HIS A 34 8.935 11.060 -0.686 1.00 0.00 H new ATOM 0 HD1 HIS A 34 8.677 9.305 -2.718 1.00 0.00 H new ATOM 0 HD2 HIS A 34 7.833 13.298 -3.622 1.00 0.00 H new ATOM 0 HE1 HIS A 34 8.749 9.504 -5.237 1.00 0.00 H new ATOM 526 N ARG A 35 7.415 9.146 0.406 1.00 0.00 N ATOM 527 CA ARG A 35 7.368 7.699 0.614 1.00 0.00 C ATOM 528 C ARG A 35 6.103 7.254 1.336 1.00 0.00 C ATOM 529 O ARG A 35 5.677 6.108 1.198 1.00 0.00 O ATOM 530 CB ARG A 35 8.632 7.208 1.311 1.00 0.00 C ATOM 531 CG ARG A 35 9.825 7.212 0.383 1.00 0.00 C ATOM 532 CD ARG A 35 11.137 6.953 1.101 1.00 0.00 C ATOM 533 NE ARG A 35 12.255 6.856 0.143 1.00 0.00 N ATOM 534 CZ ARG A 35 12.755 7.881 -0.583 1.00 0.00 C ATOM 535 NH1 ARG A 35 12.254 9.102 -0.464 1.00 0.00 N ATOM 536 NH2 ARG A 35 13.743 7.668 -1.436 1.00 0.00 N ATOM 0 H ARG A 35 8.132 9.618 0.957 1.00 0.00 H new ATOM 0 HA ARG A 35 7.330 7.231 -0.370 1.00 0.00 H new ATOM 0 HB2 ARG A 35 8.841 7.841 2.173 1.00 0.00 H new ATOM 0 HB3 ARG A 35 8.469 6.199 1.689 1.00 0.00 H new ATOM 0 HG2 ARG A 35 9.682 6.453 -0.386 1.00 0.00 H new ATOM 0 HG3 ARG A 35 9.879 8.175 -0.125 1.00 0.00 H new ATOM 0 HD2 ARG A 35 11.331 7.756 1.812 1.00 0.00 H new ATOM 0 HD3 ARG A 35 11.065 6.030 1.676 1.00 0.00 H new ATOM 0 HE ARG A 35 12.686 5.940 0.018 1.00 0.00 H new ATOM 0 HH11 ARG A 35 11.483 9.276 0.181 1.00 0.00 H new ATOM 0 HH12 ARG A 35 12.639 9.868 -1.017 1.00 0.00 H new ATOM 0 HH21 ARG A 35 14.128 6.730 -1.546 1.00 0.00 H new ATOM 0 HH22 ARG A 35 14.120 8.442 -1.983 1.00 0.00 H new ATOM 550 N GLU A 36 5.510 8.179 2.083 1.00 0.00 N ATOM 551 CA GLU A 36 4.270 7.968 2.835 1.00 0.00 C ATOM 552 C GLU A 36 3.183 7.440 1.871 1.00 0.00 C ATOM 553 O GLU A 36 2.521 6.429 2.146 1.00 0.00 O ATOM 554 CB GLU A 36 3.895 9.338 3.464 1.00 0.00 C ATOM 555 CG GLU A 36 2.798 9.388 4.522 1.00 0.00 C ATOM 556 CD GLU A 36 1.416 9.112 4.006 1.00 0.00 C ATOM 557 OE1 GLU A 36 0.822 9.995 3.328 1.00 0.00 O ATOM 558 OE2 GLU A 36 0.887 8.038 4.272 1.00 0.00 O ATOM 0 H GLU A 36 5.885 9.122 2.187 1.00 0.00 H new ATOM 0 HA GLU A 36 4.377 7.227 3.627 1.00 0.00 H new ATOM 0 HB2 GLU A 36 4.799 9.756 3.907 1.00 0.00 H new ATOM 0 HB3 GLU A 36 3.601 10.004 2.653 1.00 0.00 H new ATOM 0 HG2 GLU A 36 3.031 8.663 5.302 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.807 10.373 4.989 1.00 0.00 H new ATOM 565 N ALA A 37 3.056 8.105 0.732 1.00 0.00 N ATOM 566 CA ALA A 37 2.123 7.716 -0.303 1.00 0.00 C ATOM 567 C ALA A 37 2.601 6.468 -1.003 1.00 0.00 C ATOM 568 O ALA A 37 1.824 5.537 -1.236 1.00 0.00 O ATOM 569 CB ALA A 37 1.971 8.842 -1.313 1.00 0.00 C ATOM 0 H ALA A 37 3.603 8.935 0.503 1.00 0.00 H new ATOM 0 HA ALA A 37 1.157 7.512 0.160 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.267 8.542 -2.089 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.598 9.734 -0.810 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.939 9.058 -1.765 1.00 0.00 H new ATOM 575 N GLU A 38 3.895 6.440 -1.297 1.00 0.00 N ATOM 576 CA GLU A 38 4.505 5.361 -2.052 1.00 0.00 C ATOM 577 C GLU A 38 4.299 4.009 -1.430 1.00 0.00 C ATOM 578 O GLU A 38 3.861 3.113 -2.098 1.00 0.00 O ATOM 579 CB GLU A 38 5.985 5.585 -2.254 1.00 0.00 C ATOM 580 CG GLU A 38 6.326 6.810 -3.056 1.00 0.00 C ATOM 581 CD GLU A 38 7.794 6.910 -3.290 1.00 0.00 C ATOM 582 OE1 GLU A 38 8.296 6.221 -4.207 1.00 0.00 O ATOM 583 OE2 GLU A 38 8.473 7.658 -2.565 1.00 0.00 O ATOM 0 H GLU A 38 4.550 7.169 -1.016 1.00 0.00 H new ATOM 0 HA GLU A 38 3.996 5.371 -3.016 1.00 0.00 H new ATOM 0 HB2 GLU A 38 6.465 5.660 -1.278 1.00 0.00 H new ATOM 0 HB3 GLU A 38 6.407 4.712 -2.751 1.00 0.00 H new ATOM 0 HG2 GLU A 38 5.804 6.779 -4.012 1.00 0.00 H new ATOM 0 HG3 GLU A 38 5.977 7.700 -2.532 1.00 0.00 H new ATOM 590 N MET A 39 4.575 3.882 -0.149 1.00 0.00 N ATOM 591 CA MET A 39 4.510 2.574 0.530 1.00 0.00 C ATOM 592 C MET A 39 3.106 1.978 0.506 1.00 0.00 C ATOM 593 O MET A 39 2.933 0.776 0.280 1.00 0.00 O ATOM 594 CB MET A 39 5.058 2.639 1.965 1.00 0.00 C ATOM 595 CG MET A 39 6.531 3.044 2.049 1.00 0.00 C ATOM 596 SD MET A 39 7.624 1.993 1.045 1.00 0.00 S ATOM 597 CE MET A 39 7.392 0.384 1.817 1.00 0.00 C ATOM 0 H MET A 39 4.847 4.658 0.455 1.00 0.00 H new ATOM 0 HA MET A 39 5.156 1.905 -0.038 1.00 0.00 H new ATOM 0 HB2 MET A 39 4.463 3.349 2.539 1.00 0.00 H new ATOM 0 HB3 MET A 39 4.932 1.664 2.436 1.00 0.00 H new ATOM 0 HG2 MET A 39 6.635 4.079 1.724 1.00 0.00 H new ATOM 0 HG3 MET A 39 6.853 3.002 3.089 1.00 0.00 H new ATOM 0 HE1 MET A 39 8.117 -0.322 1.412 1.00 0.00 H new ATOM 0 HE2 MET A 39 7.535 0.473 2.894 1.00 0.00 H new ATOM 0 HE3 MET A 39 6.383 0.025 1.614 1.00 0.00 H new ATOM 607 N ARG A 40 2.120 2.823 0.686 1.00 0.00 N ATOM 608 CA ARG A 40 0.729 2.400 0.643 1.00 0.00 C ATOM 609 C ARG A 40 0.346 2.028 -0.783 1.00 0.00 C ATOM 610 O ARG A 40 -0.298 1.006 -1.027 1.00 0.00 O ATOM 611 CB ARG A 40 -0.145 3.520 1.181 1.00 0.00 C ATOM 612 CG ARG A 40 -1.640 3.279 1.126 1.00 0.00 C ATOM 613 CD ARG A 40 -2.378 4.367 1.893 1.00 0.00 C ATOM 614 NE ARG A 40 -2.051 5.733 1.424 1.00 0.00 N ATOM 615 CZ ARG A 40 -1.276 6.611 2.109 1.00 0.00 C ATOM 616 NH1 ARG A 40 -0.711 6.245 3.242 1.00 0.00 N ATOM 617 NH2 ARG A 40 -1.070 7.844 1.651 1.00 0.00 N ATOM 0 H ARG A 40 2.251 3.818 0.866 1.00 0.00 H new ATOM 0 HA ARG A 40 0.583 1.517 1.266 1.00 0.00 H new ATOM 0 HB2 ARG A 40 0.135 3.707 2.218 1.00 0.00 H new ATOM 0 HB3 ARG A 40 0.078 4.429 0.622 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -1.975 3.264 0.089 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -1.874 2.303 1.550 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -3.452 4.205 1.799 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -2.135 4.285 2.952 1.00 0.00 H new ATOM 0 HE ARG A 40 -2.433 6.033 0.527 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -0.857 5.302 3.603 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -0.128 6.904 3.758 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -1.497 8.140 0.774 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -0.485 8.493 2.178 1.00 0.00 H new ATOM 631 N ASN A 41 0.792 2.840 -1.712 1.00 0.00 N ATOM 632 CA ASN A 41 0.551 2.627 -3.132 1.00 0.00 C ATOM 633 C ASN A 41 1.236 1.335 -3.591 1.00 0.00 C ATOM 634 O ASN A 41 0.672 0.556 -4.356 1.00 0.00 O ATOM 635 CB ASN A 41 1.103 3.819 -3.913 1.00 0.00 C ATOM 636 CG ASN A 41 0.824 3.762 -5.408 1.00 0.00 C ATOM 637 OD1 ASN A 41 -0.196 3.245 -5.857 1.00 0.00 O ATOM 638 ND2 ASN A 41 1.742 4.287 -6.183 1.00 0.00 N ATOM 0 H ASN A 41 1.338 3.677 -1.508 1.00 0.00 H new ATOM 0 HA ASN A 41 -0.520 2.535 -3.313 1.00 0.00 H new ATOM 0 HB2 ASN A 41 0.674 4.736 -3.508 1.00 0.00 H new ATOM 0 HB3 ASN A 41 2.180 3.875 -3.757 1.00 0.00 H new ATOM 0 HD21 ASN A 41 1.622 4.275 -7.196 1.00 0.00 H new ATOM 0 HD22 ASN A 41 2.576 4.708 -5.773 1.00 0.00 H new ATOM 645 N SER A 42 2.435 1.095 -3.062 1.00 0.00 N ATOM 646 CA SER A 42 3.225 -0.071 -3.373 1.00 0.00 C ATOM 647 C SER A 42 2.497 -1.362 -3.021 1.00 0.00 C ATOM 648 O SER A 42 2.457 -2.279 -3.835 1.00 0.00 O ATOM 649 CB SER A 42 4.577 -0.010 -2.655 1.00 0.00 C ATOM 650 OG SER A 42 5.356 1.106 -3.087 1.00 0.00 O ATOM 0 H SER A 42 2.883 1.723 -2.395 1.00 0.00 H new ATOM 0 HA SER A 42 3.393 -0.072 -4.450 1.00 0.00 H new ATOM 0 HB2 SER A 42 4.415 0.054 -1.579 1.00 0.00 H new ATOM 0 HB3 SER A 42 5.129 -0.932 -2.840 1.00 0.00 H new ATOM 0 HG SER A 42 4.999 1.928 -2.689 1.00 0.00 H new ATOM 656 N ILE A 43 1.887 -1.435 -1.828 1.00 0.00 N ATOM 657 CA ILE A 43 1.209 -2.668 -1.453 1.00 0.00 C ATOM 658 C ILE A 43 0.005 -2.905 -2.351 1.00 0.00 C ATOM 659 O ILE A 43 -0.229 -4.023 -2.789 1.00 0.00 O ATOM 660 CB ILE A 43 0.822 -2.787 0.062 1.00 0.00 C ATOM 661 CG1 ILE A 43 -0.284 -1.793 0.477 1.00 0.00 C ATOM 662 CG2 ILE A 43 2.062 -2.613 0.936 1.00 0.00 C ATOM 663 CD1 ILE A 43 -0.719 -1.920 1.918 1.00 0.00 C ATOM 0 H ILE A 43 1.852 -0.685 -1.138 1.00 0.00 H new ATOM 0 HA ILE A 43 1.945 -3.458 -1.605 1.00 0.00 H new ATOM 0 HB ILE A 43 0.412 -3.786 0.212 1.00 0.00 H new ATOM 0 HG12 ILE A 43 0.072 -0.777 0.304 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.151 -1.941 -0.167 1.00 0.00 H new ATOM 0 HG21 ILE A 43 1.782 -2.697 1.986 1.00 0.00 H new ATOM 0 HG22 ILE A 43 2.791 -3.386 0.692 1.00 0.00 H new ATOM 0 HG23 ILE A 43 2.500 -1.631 0.755 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.498 -1.187 2.129 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.108 -2.923 2.094 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.134 -1.742 2.573 1.00 0.00 H new ATOM 675 N LEU A 44 -0.699 -1.831 -2.689 1.00 0.00 N ATOM 676 CA LEU A 44 -1.851 -1.909 -3.568 1.00 0.00 C ATOM 677 C LEU A 44 -1.442 -2.351 -4.969 1.00 0.00 C ATOM 678 O LEU A 44 -2.104 -3.178 -5.575 1.00 0.00 O ATOM 679 CB LEU A 44 -2.590 -0.566 -3.625 1.00 0.00 C ATOM 680 CG LEU A 44 -3.234 -0.087 -2.317 1.00 0.00 C ATOM 681 CD1 LEU A 44 -3.871 1.280 -2.509 1.00 0.00 C ATOM 682 CD2 LEU A 44 -4.275 -1.090 -1.830 1.00 0.00 C ATOM 0 H LEU A 44 -0.486 -0.889 -2.362 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.530 -2.657 -3.158 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.887 0.197 -3.960 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -3.369 -0.636 -4.384 1.00 0.00 H new ATOM 0 HG LEU A 44 -2.453 -0.006 -1.561 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -4.323 1.605 -1.572 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -3.108 1.997 -2.812 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -4.639 1.219 -3.280 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.719 -0.731 -0.902 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -5.053 -1.202 -2.585 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -3.797 -2.054 -1.655 1.00 0.00 H new ATOM 694 N ALA A 45 -0.344 -1.809 -5.455 1.00 0.00 N ATOM 695 CA ALA A 45 0.178 -2.141 -6.777 1.00 0.00 C ATOM 696 C ALA A 45 0.712 -3.586 -6.868 1.00 0.00 C ATOM 697 O ALA A 45 0.912 -4.108 -7.970 1.00 0.00 O ATOM 698 CB ALA A 45 1.259 -1.143 -7.180 1.00 0.00 C ATOM 0 H ALA A 45 0.217 -1.124 -4.948 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.657 -2.076 -7.475 1.00 0.00 H new ATOM 0 HB1 ALA A 45 1.642 -1.400 -8.168 1.00 0.00 H new ATOM 0 HB2 ALA A 45 0.836 -0.139 -7.205 1.00 0.00 H new ATOM 0 HB3 ALA A 45 2.073 -1.176 -6.456 1.00 0.00 H new ATOM 704 N GLN A 46 1.000 -4.202 -5.728 1.00 0.00 N ATOM 705 CA GLN A 46 1.477 -5.592 -5.719 1.00 0.00 C ATOM 706 C GLN A 46 0.344 -6.576 -5.446 1.00 0.00 C ATOM 707 O GLN A 46 0.326 -7.663 -6.002 1.00 0.00 O ATOM 708 CB GLN A 46 2.601 -5.809 -4.691 1.00 0.00 C ATOM 709 CG GLN A 46 3.812 -4.891 -4.842 1.00 0.00 C ATOM 710 CD GLN A 46 4.445 -4.921 -6.224 1.00 0.00 C ATOM 711 OE1 GLN A 46 4.408 -5.931 -6.934 1.00 0.00 O ATOM 712 NE2 GLN A 46 5.038 -3.828 -6.610 1.00 0.00 N ATOM 0 H GLN A 46 0.915 -3.774 -4.806 1.00 0.00 H new ATOM 0 HA GLN A 46 1.876 -5.781 -6.715 1.00 0.00 H new ATOM 0 HB2 GLN A 46 2.187 -5.675 -3.692 1.00 0.00 H new ATOM 0 HB3 GLN A 46 2.939 -6.843 -4.760 1.00 0.00 H new ATOM 0 HG2 GLN A 46 3.510 -3.869 -4.615 1.00 0.00 H new ATOM 0 HG3 GLN A 46 4.563 -5.173 -4.104 1.00 0.00 H new ATOM 0 HE21 GLN A 46 5.050 -3.011 -5.999 1.00 0.00 H new ATOM 0 HE22 GLN A 46 5.490 -3.788 -7.523 1.00 0.00 H new ATOM 721 N VAL A 47 -0.579 -6.219 -4.566 1.00 0.00 N ATOM 722 CA VAL A 47 -1.668 -7.134 -4.230 1.00 0.00 C ATOM 723 C VAL A 47 -2.757 -7.099 -5.266 1.00 0.00 C ATOM 724 O VAL A 47 -3.483 -8.063 -5.442 1.00 0.00 O ATOM 725 CB VAL A 47 -2.244 -6.919 -2.804 1.00 0.00 C ATOM 726 CG1 VAL A 47 -1.140 -7.060 -1.775 1.00 0.00 C ATOM 727 CG2 VAL A 47 -2.955 -5.575 -2.660 1.00 0.00 C ATOM 0 H VAL A 47 -0.601 -5.323 -4.079 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.225 -8.130 -4.229 1.00 0.00 H new ATOM 0 HB VAL A 47 -2.996 -7.689 -2.632 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -1.551 -6.908 -0.777 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -0.707 -8.058 -1.841 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.367 -6.316 -1.966 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.339 -5.474 -1.645 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -2.252 -4.768 -2.864 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -3.782 -5.523 -3.368 1.00 0.00 H new ATOM 737 N LEU A 48 -2.864 -6.007 -5.955 1.00 0.00 N ATOM 738 CA LEU A 48 -3.789 -5.908 -7.023 1.00 0.00 C ATOM 739 C LEU A 48 -3.036 -5.953 -8.289 1.00 0.00 C ATOM 740 O LEU A 48 -2.037 -5.246 -8.449 1.00 0.00 O ATOM 741 CB LEU A 48 -4.596 -4.616 -6.978 1.00 0.00 C ATOM 742 CG LEU A 48 -5.518 -4.424 -5.773 1.00 0.00 C ATOM 743 CD1 LEU A 48 -6.217 -3.082 -5.848 1.00 0.00 C ATOM 744 CD2 LEU A 48 -6.537 -5.545 -5.692 1.00 0.00 C ATOM 0 H LEU A 48 -2.312 -5.166 -5.789 1.00 0.00 H new ATOM 0 HA LEU A 48 -4.492 -6.736 -6.939 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -3.899 -3.778 -7.010 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -5.202 -4.562 -7.882 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.908 -4.449 -4.870 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.869 -2.962 -4.983 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -5.474 -2.285 -5.855 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -6.812 -3.032 -6.760 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -7.182 -5.388 -4.828 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -7.141 -5.554 -6.599 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -6.021 -6.500 -5.591 1.00 0.00 H new ATOM 756 N ASP A 49 -3.472 -6.789 -9.173 1.00 0.00 N ATOM 757 CA ASP A 49 -2.908 -6.852 -10.485 1.00 0.00 C ATOM 758 C ASP A 49 -3.223 -5.539 -11.185 1.00 0.00 C ATOM 759 O ASP A 49 -4.179 -4.847 -10.817 1.00 0.00 O ATOM 760 CB ASP A 49 -3.499 -8.040 -11.263 1.00 0.00 C ATOM 761 CG ASP A 49 -2.893 -8.222 -12.640 1.00 0.00 C ATOM 762 OD1 ASP A 49 -3.364 -7.574 -13.597 1.00 0.00 O ATOM 763 OD2 ASP A 49 -1.938 -9.032 -12.785 1.00 0.00 O ATOM 0 H ASP A 49 -4.231 -7.450 -9.007 1.00 0.00 H new ATOM 0 HA ASP A 49 -1.829 -7.000 -10.432 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -3.350 -8.952 -10.686 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -4.575 -7.899 -11.364 1.00 0.00 H new ATOM 768 N GLN A 50 -2.444 -5.204 -12.158 1.00 0.00 N ATOM 769 CA GLN A 50 -2.578 -3.970 -12.914 1.00 0.00 C ATOM 770 C GLN A 50 -3.985 -3.761 -13.471 1.00 0.00 C ATOM 771 O GLN A 50 -4.502 -2.638 -13.474 1.00 0.00 O ATOM 772 CB GLN A 50 -1.567 -3.965 -14.021 1.00 0.00 C ATOM 773 CG GLN A 50 -0.148 -3.843 -13.524 1.00 0.00 C ATOM 774 CD GLN A 50 0.878 -3.971 -14.613 1.00 0.00 C ATOM 775 OE1 GLN A 50 0.661 -4.667 -15.612 1.00 0.00 O ATOM 776 NE2 GLN A 50 2.000 -3.343 -14.427 1.00 0.00 N ATOM 0 H GLN A 50 -1.668 -5.788 -12.471 1.00 0.00 H new ATOM 0 HA GLN A 50 -2.397 -3.140 -12.231 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -1.666 -4.884 -14.600 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -1.781 -3.138 -14.697 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -0.025 -2.879 -13.031 1.00 0.00 H new ATOM 0 HG3 GLN A 50 0.033 -4.611 -12.772 1.00 0.00 H new ATOM 0 HE21 GLN A 50 2.136 -2.780 -13.588 1.00 0.00 H new ATOM 0 HE22 GLN A 50 2.745 -3.413 -15.120 1.00 0.00 H new ATOM 785 N SER A 51 -4.616 -4.827 -13.878 1.00 0.00 N ATOM 786 CA SER A 51 -5.961 -4.738 -14.415 1.00 0.00 C ATOM 787 C SER A 51 -6.971 -4.481 -13.283 1.00 0.00 C ATOM 788 O SER A 51 -7.976 -3.797 -13.467 1.00 0.00 O ATOM 789 CB SER A 51 -6.294 -5.997 -15.200 1.00 0.00 C ATOM 790 OG SER A 51 -5.314 -6.208 -16.214 1.00 0.00 O ATOM 0 H SER A 51 -4.228 -5.770 -13.852 1.00 0.00 H new ATOM 0 HA SER A 51 -6.021 -3.895 -15.103 1.00 0.00 H new ATOM 0 HB2 SER A 51 -6.328 -6.856 -14.530 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.282 -5.905 -15.650 1.00 0.00 H new ATOM 0 HG SER A 51 -5.532 -7.021 -16.716 1.00 0.00 H new ATOM 796 N ALA A 52 -6.651 -4.967 -12.095 1.00 0.00 N ATOM 797 CA ALA A 52 -7.486 -4.763 -10.931 1.00 0.00 C ATOM 798 C ALA A 52 -7.323 -3.330 -10.447 1.00 0.00 C ATOM 799 O ALA A 52 -8.268 -2.716 -9.980 1.00 0.00 O ATOM 800 CB ALA A 52 -7.155 -5.756 -9.833 1.00 0.00 C ATOM 0 H ALA A 52 -5.808 -5.512 -11.914 1.00 0.00 H new ATOM 0 HA ALA A 52 -8.527 -4.932 -11.205 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -7.800 -5.576 -8.973 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -7.314 -6.770 -10.200 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -6.113 -5.637 -9.537 1.00 0.00 H new ATOM 806 N ARG A 53 -6.104 -2.810 -10.576 1.00 0.00 N ATOM 807 CA ARG A 53 -5.800 -1.410 -10.262 1.00 0.00 C ATOM 808 C ARG A 53 -6.637 -0.472 -11.142 1.00 0.00 C ATOM 809 O ARG A 53 -7.156 0.551 -10.672 1.00 0.00 O ATOM 810 CB ARG A 53 -4.300 -1.123 -10.454 1.00 0.00 C ATOM 811 CG ARG A 53 -3.376 -1.769 -9.415 1.00 0.00 C ATOM 812 CD ARG A 53 -3.579 -1.154 -8.037 1.00 0.00 C ATOM 813 NE ARG A 53 -3.281 0.288 -8.047 1.00 0.00 N ATOM 814 CZ ARG A 53 -3.737 1.198 -7.178 1.00 0.00 C ATOM 815 NH1 ARG A 53 -4.527 0.836 -6.168 1.00 0.00 N ATOM 816 NH2 ARG A 53 -3.398 2.468 -7.327 1.00 0.00 N ATOM 0 H ARG A 53 -5.298 -3.344 -10.901 1.00 0.00 H new ATOM 0 HA ARG A 53 -6.054 -1.230 -9.217 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -4.004 -1.468 -11.445 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -4.147 -0.044 -10.433 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -3.569 -2.841 -9.369 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -2.337 -1.645 -9.722 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -4.608 -1.313 -7.713 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -2.936 -1.656 -7.314 1.00 0.00 H new ATOM 0 HE ARG A 53 -2.667 0.626 -8.788 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -4.790 -0.143 -6.051 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -4.869 1.538 -5.511 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -2.794 2.747 -8.100 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -3.741 3.168 -6.669 1.00 0.00 H new ATOM 830 N ALA A 54 -6.790 -0.846 -12.403 1.00 0.00 N ATOM 831 CA ALA A 54 -7.597 -0.080 -13.342 1.00 0.00 C ATOM 832 C ALA A 54 -9.076 -0.197 -12.980 1.00 0.00 C ATOM 833 O ALA A 54 -9.809 0.801 -12.964 1.00 0.00 O ATOM 834 CB ALA A 54 -7.357 -0.565 -14.761 1.00 0.00 C ATOM 0 H ALA A 54 -6.363 -1.682 -12.802 1.00 0.00 H new ATOM 0 HA ALA A 54 -7.306 0.969 -13.282 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.967 0.017 -15.452 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -6.304 -0.442 -15.014 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -7.628 -1.618 -14.836 1.00 0.00 H new ATOM 840 N ARG A 55 -9.492 -1.420 -12.674 1.00 0.00 N ATOM 841 CA ARG A 55 -10.860 -1.737 -12.260 1.00 0.00 C ATOM 842 C ARG A 55 -11.242 -0.899 -11.036 1.00 0.00 C ATOM 843 O ARG A 55 -12.307 -0.274 -10.991 1.00 0.00 O ATOM 844 CB ARG A 55 -10.919 -3.214 -11.885 1.00 0.00 C ATOM 845 CG ARG A 55 -12.309 -3.761 -11.688 1.00 0.00 C ATOM 846 CD ARG A 55 -13.037 -3.845 -13.008 1.00 0.00 C ATOM 847 NE ARG A 55 -14.353 -4.454 -12.888 1.00 0.00 N ATOM 848 CZ ARG A 55 -14.876 -5.295 -13.781 1.00 0.00 C ATOM 849 NH1 ARG A 55 -14.126 -5.775 -14.772 1.00 0.00 N ATOM 850 NH2 ARG A 55 -16.132 -5.705 -13.642 1.00 0.00 N ATOM 0 H ARG A 55 -8.880 -2.236 -12.706 1.00 0.00 H new ATOM 0 HA ARG A 55 -11.551 -1.518 -13.074 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -10.423 -3.792 -12.665 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -10.351 -3.364 -10.967 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -12.256 -4.750 -11.232 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -12.863 -3.122 -11.000 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -13.142 -2.843 -13.424 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -12.438 -4.422 -13.712 1.00 0.00 H new ATOM 0 HE ARG A 55 -14.912 -4.222 -12.067 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -13.147 -5.499 -14.850 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -14.531 -6.418 -15.453 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -16.692 -5.377 -12.855 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -16.537 -6.348 -14.322 1.00 0.00 H new ATOM 864 N LEU A 56 -10.339 -0.887 -10.072 1.00 0.00 N ATOM 865 CA LEU A 56 -10.477 -0.160 -8.825 1.00 0.00 C ATOM 866 C LEU A 56 -10.706 1.328 -9.079 1.00 0.00 C ATOM 867 O LEU A 56 -11.601 1.937 -8.500 1.00 0.00 O ATOM 868 CB LEU A 56 -9.200 -0.339 -8.010 1.00 0.00 C ATOM 869 CG LEU A 56 -9.168 0.323 -6.649 1.00 0.00 C ATOM 870 CD1 LEU A 56 -10.179 -0.317 -5.728 1.00 0.00 C ATOM 871 CD2 LEU A 56 -7.781 0.246 -6.064 1.00 0.00 C ATOM 0 H LEU A 56 -9.460 -1.401 -10.139 1.00 0.00 H new ATOM 0 HA LEU A 56 -11.338 -0.552 -8.283 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -9.029 -1.407 -7.874 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -8.365 0.045 -8.596 1.00 0.00 H new ATOM 0 HG LEU A 56 -9.432 1.374 -6.763 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -10.143 0.170 -4.754 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -11.177 -0.208 -6.152 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -9.947 -1.376 -5.613 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -7.772 0.726 -5.085 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.488 -0.799 -5.959 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -7.079 0.755 -6.724 1.00 0.00 H new ATOM 883 N SER A 57 -9.901 1.885 -9.950 1.00 0.00 N ATOM 884 CA SER A 57 -9.972 3.282 -10.296 1.00 0.00 C ATOM 885 C SER A 57 -11.321 3.641 -10.932 1.00 0.00 C ATOM 886 O SER A 57 -11.923 4.657 -10.591 1.00 0.00 O ATOM 887 CB SER A 57 -8.819 3.605 -11.214 1.00 0.00 C ATOM 888 OG SER A 57 -7.580 3.320 -10.563 1.00 0.00 O ATOM 0 H SER A 57 -9.169 1.374 -10.444 1.00 0.00 H new ATOM 0 HA SER A 57 -9.896 3.885 -9.391 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.900 3.022 -12.131 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.855 4.656 -11.500 1.00 0.00 H new ATOM 0 HG SER A 57 -7.404 2.357 -10.602 1.00 0.00 H new ATOM 894 N ASN A 58 -11.797 2.787 -11.825 1.00 0.00 N ATOM 895 CA ASN A 58 -13.111 2.986 -12.469 1.00 0.00 C ATOM 896 C ASN A 58 -14.225 2.941 -11.420 1.00 0.00 C ATOM 897 O ASN A 58 -15.177 3.721 -11.468 1.00 0.00 O ATOM 898 CB ASN A 58 -13.372 1.923 -13.562 1.00 0.00 C ATOM 899 CG ASN A 58 -14.683 2.152 -14.332 1.00 0.00 C ATOM 900 OD1 ASN A 58 -14.705 2.853 -15.342 1.00 0.00 O ATOM 901 ND2 ASN A 58 -15.763 1.540 -13.899 1.00 0.00 N ATOM 0 H ASN A 58 -11.303 1.947 -12.128 1.00 0.00 H new ATOM 0 HA ASN A 58 -13.103 3.966 -12.946 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -12.540 1.924 -14.266 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -13.397 0.936 -13.100 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -16.644 1.642 -14.404 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -15.720 0.964 -13.059 1.00 0.00 H new ATOM 908 N LEU A 59 -14.070 2.047 -10.451 1.00 0.00 N ATOM 909 CA LEU A 59 -15.039 1.880 -9.370 1.00 0.00 C ATOM 910 C LEU A 59 -15.057 3.158 -8.513 1.00 0.00 C ATOM 911 O LEU A 59 -16.114 3.635 -8.098 1.00 0.00 O ATOM 912 CB LEU A 59 -14.648 0.645 -8.518 1.00 0.00 C ATOM 913 CG LEU A 59 -15.776 -0.115 -7.764 1.00 0.00 C ATOM 914 CD1 LEU A 59 -16.472 0.737 -6.715 1.00 0.00 C ATOM 915 CD2 LEU A 59 -16.788 -0.683 -8.746 1.00 0.00 C ATOM 0 H LEU A 59 -13.270 1.417 -10.391 1.00 0.00 H new ATOM 0 HA LEU A 59 -16.038 1.716 -9.775 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -14.148 -0.067 -9.174 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -13.914 0.969 -7.780 1.00 0.00 H new ATOM 0 HG LEU A 59 -15.293 -0.934 -7.230 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -17.248 0.149 -6.225 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -15.745 1.067 -5.974 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -16.923 1.606 -7.193 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -17.569 -1.211 -8.199 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -17.233 0.129 -9.320 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -16.288 -1.375 -9.424 1.00 0.00 H new ATOM 927 N ALA A 60 -13.874 3.719 -8.300 1.00 0.00 N ATOM 928 CA ALA A 60 -13.695 4.963 -7.532 1.00 0.00 C ATOM 929 C ALA A 60 -14.406 6.134 -8.195 1.00 0.00 C ATOM 930 O ALA A 60 -14.835 7.090 -7.532 1.00 0.00 O ATOM 931 CB ALA A 60 -12.218 5.287 -7.402 1.00 0.00 C ATOM 0 H ALA A 60 -13.001 3.328 -8.654 1.00 0.00 H new ATOM 0 HA ALA A 60 -14.130 4.806 -6.545 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -12.096 6.208 -6.833 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -11.711 4.472 -6.886 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -11.785 5.414 -8.394 1.00 0.00 H new ATOM 937 N LEU A 61 -14.514 6.061 -9.497 1.00 0.00 N ATOM 938 CA LEU A 61 -15.150 7.092 -10.279 1.00 0.00 C ATOM 939 C LEU A 61 -16.669 7.002 -10.183 1.00 0.00 C ATOM 940 O LEU A 61 -17.370 8.010 -10.333 1.00 0.00 O ATOM 941 CB LEU A 61 -14.695 7.005 -11.734 1.00 0.00 C ATOM 942 CG LEU A 61 -13.199 7.211 -11.989 1.00 0.00 C ATOM 943 CD1 LEU A 61 -12.885 7.037 -13.462 1.00 0.00 C ATOM 944 CD2 LEU A 61 -12.754 8.586 -11.511 1.00 0.00 C ATOM 0 H LEU A 61 -14.161 5.279 -10.049 1.00 0.00 H new ATOM 0 HA LEU A 61 -14.851 8.059 -9.875 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.977 6.027 -12.123 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.246 7.748 -12.310 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.650 6.458 -11.424 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -11.818 7.187 -13.627 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -13.163 6.031 -13.777 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -13.448 7.768 -14.043 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -11.688 8.710 -11.702 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -13.311 9.355 -12.046 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -12.944 8.679 -10.442 1.00 0.00 H new ATOM 956 N VAL A 62 -17.182 5.818 -9.920 1.00 0.00 N ATOM 957 CA VAL A 62 -18.619 5.654 -9.809 1.00 0.00 C ATOM 958 C VAL A 62 -19.094 5.775 -8.358 1.00 0.00 C ATOM 959 O VAL A 62 -20.072 6.469 -8.087 1.00 0.00 O ATOM 960 CB VAL A 62 -19.169 4.375 -10.519 1.00 0.00 C ATOM 961 CG1 VAL A 62 -18.847 4.422 -12.006 1.00 0.00 C ATOM 962 CG2 VAL A 62 -18.634 3.088 -9.908 1.00 0.00 C ATOM 0 H VAL A 62 -16.637 4.967 -9.781 1.00 0.00 H new ATOM 0 HA VAL A 62 -19.055 6.486 -10.362 1.00 0.00 H new ATOM 0 HB VAL A 62 -20.250 4.371 -10.376 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -19.235 3.526 -12.491 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -19.309 5.304 -12.451 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -17.767 4.470 -12.143 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -19.049 2.232 -10.441 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -17.547 3.072 -9.987 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -18.922 3.036 -8.858 1.00 0.00 H new ATOM 972 N LYS A 63 -18.400 5.122 -7.436 1.00 0.00 N ATOM 973 CA LYS A 63 -18.667 5.262 -6.010 1.00 0.00 C ATOM 974 C LYS A 63 -17.498 4.800 -5.161 1.00 0.00 C ATOM 975 O LYS A 63 -17.295 3.595 -4.936 1.00 0.00 O ATOM 976 CB LYS A 63 -20.001 4.666 -5.512 1.00 0.00 C ATOM 977 CG LYS A 63 -20.303 3.230 -5.881 1.00 0.00 C ATOM 978 CD LYS A 63 -21.559 2.785 -5.151 1.00 0.00 C ATOM 979 CE LYS A 63 -21.946 1.367 -5.489 1.00 0.00 C ATOM 980 NZ LYS A 63 -22.412 1.231 -6.881 1.00 0.00 N ATOM 0 H LYS A 63 -17.637 4.481 -7.654 1.00 0.00 H new ATOM 0 HA LYS A 63 -18.790 6.337 -5.879 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -20.021 4.746 -4.425 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -20.811 5.289 -5.892 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.442 3.139 -6.958 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -19.464 2.588 -5.613 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -21.401 2.870 -4.076 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -22.381 3.454 -5.406 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -21.090 0.711 -5.329 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -22.733 1.036 -4.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -22.778 0.269 -7.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -23.168 1.921 -7.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -21.619 1.406 -7.531 1.00 0.00 H new ATOM 994 N PRO A 64 -16.733 5.762 -4.644 1.00 0.00 N ATOM 995 CA PRO A 64 -15.529 5.502 -3.865 1.00 0.00 C ATOM 996 C PRO A 64 -15.793 4.831 -2.508 1.00 0.00 C ATOM 997 O PRO A 64 -14.849 4.415 -1.830 1.00 0.00 O ATOM 998 CB PRO A 64 -14.900 6.880 -3.692 1.00 0.00 C ATOM 999 CG PRO A 64 -16.028 7.831 -3.818 1.00 0.00 C ATOM 1000 CD PRO A 64 -16.975 7.218 -4.795 1.00 0.00 C ATOM 0 HA PRO A 64 -14.882 4.789 -4.376 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -14.411 6.973 -2.722 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -14.140 7.066 -4.451 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -16.512 7.993 -2.855 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -15.681 8.803 -4.168 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -18.009 7.479 -4.569 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -16.776 7.555 -5.812 1.00 0.00 H new ATOM 1008 N GLU A 65 -17.075 4.719 -2.108 1.00 0.00 N ATOM 1009 CA GLU A 65 -17.421 4.095 -0.840 1.00 0.00 C ATOM 1010 C GLU A 65 -16.988 2.646 -0.903 1.00 0.00 C ATOM 1011 O GLU A 65 -16.348 2.128 0.008 1.00 0.00 O ATOM 1012 CB GLU A 65 -18.946 4.182 -0.604 1.00 0.00 C ATOM 1013 CG GLU A 65 -19.441 3.946 0.838 1.00 0.00 C ATOM 1014 CD GLU A 65 -19.150 2.569 1.426 1.00 0.00 C ATOM 1015 OE1 GLU A 65 -19.872 1.598 1.117 1.00 0.00 O ATOM 1016 OE2 GLU A 65 -18.195 2.440 2.222 1.00 0.00 O ATOM 0 H GLU A 65 -17.874 5.053 -2.648 1.00 0.00 H new ATOM 0 HA GLU A 65 -16.920 4.606 -0.017 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -19.283 5.169 -0.922 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -19.432 3.454 -1.254 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -18.989 4.698 1.484 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -20.518 4.110 0.863 1.00 0.00 H new ATOM 1023 N LYS A 66 -17.276 2.016 -2.014 1.00 0.00 N ATOM 1024 CA LYS A 66 -16.957 0.619 -2.144 1.00 0.00 C ATOM 1025 C LYS A 66 -15.472 0.453 -2.413 1.00 0.00 C ATOM 1026 O LYS A 66 -14.869 -0.549 -2.029 1.00 0.00 O ATOM 1027 CB LYS A 66 -17.813 -0.076 -3.215 1.00 0.00 C ATOM 1028 CG LYS A 66 -19.323 0.242 -3.159 1.00 0.00 C ATOM 1029 CD LYS A 66 -19.918 0.225 -1.741 1.00 0.00 C ATOM 1030 CE LYS A 66 -19.737 -1.094 -1.015 1.00 0.00 C ATOM 1031 NZ LYS A 66 -20.277 -1.025 0.365 1.00 0.00 N ATOM 0 H LYS A 66 -17.723 2.440 -2.827 1.00 0.00 H new ATOM 0 HA LYS A 66 -17.197 0.127 -1.202 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -17.435 0.205 -4.198 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -17.681 -1.154 -3.119 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -19.493 1.224 -3.601 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -19.858 -0.481 -3.774 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -19.455 1.018 -1.154 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -20.982 0.452 -1.801 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -20.241 -1.888 -1.566 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -18.678 -1.352 -0.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -19.963 -1.858 0.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -19.930 -0.162 0.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -21.316 -1.006 0.331 1.00 0.00 H new ATOM 1045 N THR A 67 -14.896 1.458 -3.054 1.00 0.00 N ATOM 1046 CA THR A 67 -13.484 1.497 -3.360 1.00 0.00 C ATOM 1047 C THR A 67 -12.651 1.471 -2.070 1.00 0.00 C ATOM 1048 O THR A 67 -11.769 0.635 -1.918 1.00 0.00 O ATOM 1049 CB THR A 67 -13.171 2.785 -4.101 1.00 0.00 C ATOM 1050 OG1 THR A 67 -14.173 2.979 -5.107 1.00 0.00 O ATOM 1051 CG2 THR A 67 -11.807 2.713 -4.762 1.00 0.00 C ATOM 0 H THR A 67 -15.408 2.278 -3.379 1.00 0.00 H new ATOM 0 HA THR A 67 -13.237 0.628 -3.969 1.00 0.00 H new ATOM 0 HB THR A 67 -13.164 3.614 -3.393 1.00 0.00 H new ATOM 0 HG1 THR A 67 -13.822 2.696 -5.977 1.00 0.00 H new ATOM 0 HG21 THR A 67 -11.607 3.648 -5.286 1.00 0.00 H new ATOM 0 HG22 THR A 67 -11.042 2.552 -4.002 1.00 0.00 H new ATOM 0 HG23 THR A 67 -11.791 1.887 -5.474 1.00 0.00 H new ATOM 1059 N LYS A 68 -12.974 2.366 -1.125 1.00 0.00 N ATOM 1060 CA LYS A 68 -12.236 2.431 0.127 1.00 0.00 C ATOM 1061 C LYS A 68 -12.367 1.158 0.915 1.00 0.00 C ATOM 1062 O LYS A 68 -11.453 0.768 1.619 1.00 0.00 O ATOM 1063 CB LYS A 68 -12.600 3.646 0.987 1.00 0.00 C ATOM 1064 CG LYS A 68 -14.056 3.779 1.370 1.00 0.00 C ATOM 1065 CD LYS A 68 -14.237 4.965 2.288 1.00 0.00 C ATOM 1066 CE LYS A 68 -15.693 5.291 2.533 1.00 0.00 C ATOM 1067 NZ LYS A 68 -16.442 4.223 3.232 1.00 0.00 N ATOM 0 H LYS A 68 -13.732 3.043 -1.209 1.00 0.00 H new ATOM 0 HA LYS A 68 -11.191 2.555 -0.156 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -12.007 3.609 1.901 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -12.303 4.547 0.451 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -14.667 3.903 0.476 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -14.396 2.869 1.865 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -13.749 4.761 3.241 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -13.741 5.834 1.856 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -15.755 6.207 3.120 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -16.175 5.492 1.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -17.137 4.651 3.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -16.936 3.632 2.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -15.780 3.635 3.777 1.00 0.00 H new ATOM 1081 N ALA A 69 -13.500 0.504 0.772 1.00 0.00 N ATOM 1082 CA ALA A 69 -13.738 -0.736 1.454 1.00 0.00 C ATOM 1083 C ALA A 69 -12.822 -1.825 0.909 1.00 0.00 C ATOM 1084 O ALA A 69 -12.120 -2.481 1.680 1.00 0.00 O ATOM 1085 CB ALA A 69 -15.194 -1.138 1.339 1.00 0.00 C ATOM 0 H ALA A 69 -14.272 0.819 0.184 1.00 0.00 H new ATOM 0 HA ALA A 69 -13.512 -0.601 2.512 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -15.354 -2.081 1.863 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -15.821 -0.365 1.784 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -15.456 -1.258 0.288 1.00 0.00 H new ATOM 1091 N VAL A 70 -12.797 -1.997 -0.420 1.00 0.00 N ATOM 1092 CA VAL A 70 -11.935 -3.009 -1.012 1.00 0.00 C ATOM 1093 C VAL A 70 -10.444 -2.685 -0.806 1.00 0.00 C ATOM 1094 O VAL A 70 -9.655 -3.576 -0.506 1.00 0.00 O ATOM 1095 CB VAL A 70 -12.250 -3.322 -2.517 1.00 0.00 C ATOM 1096 CG1 VAL A 70 -13.674 -3.804 -2.683 1.00 0.00 C ATOM 1097 CG2 VAL A 70 -12.012 -2.131 -3.412 1.00 0.00 C ATOM 0 H VAL A 70 -13.352 -1.459 -1.085 1.00 0.00 H new ATOM 0 HA VAL A 70 -12.163 -3.926 -0.469 1.00 0.00 H new ATOM 0 HB VAL A 70 -11.563 -4.112 -2.819 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -13.867 -4.014 -3.735 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -13.821 -4.712 -2.099 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -14.362 -3.033 -2.335 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -12.244 -2.398 -4.443 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -12.652 -1.306 -3.098 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.968 -1.827 -3.343 1.00 0.00 H new ATOM 1107 N GLU A 71 -10.072 -1.402 -0.916 1.00 0.00 N ATOM 1108 CA GLU A 71 -8.686 -0.995 -0.713 1.00 0.00 C ATOM 1109 C GLU A 71 -8.248 -1.278 0.714 1.00 0.00 C ATOM 1110 O GLU A 71 -7.237 -1.949 0.926 1.00 0.00 O ATOM 1111 CB GLU A 71 -8.459 0.485 -1.051 1.00 0.00 C ATOM 1112 CG GLU A 71 -8.650 0.838 -2.508 1.00 0.00 C ATOM 1113 CD GLU A 71 -8.344 2.290 -2.794 1.00 0.00 C ATOM 1114 OE1 GLU A 71 -9.002 3.179 -2.207 1.00 0.00 O ATOM 1115 OE2 GLU A 71 -7.425 2.585 -3.603 1.00 0.00 O ATOM 0 H GLU A 71 -10.709 -0.639 -1.143 1.00 0.00 H new ATOM 0 HA GLU A 71 -8.078 -1.585 -1.399 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.141 1.089 -0.453 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -7.447 0.760 -0.755 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -8.006 0.206 -3.120 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -9.678 0.622 -2.800 1.00 0.00 H new ATOM 1122 N ASN A 72 -9.040 -0.802 1.684 1.00 0.00 N ATOM 1123 CA ASN A 72 -8.763 -0.992 3.108 1.00 0.00 C ATOM 1124 C ASN A 72 -8.615 -2.470 3.419 1.00 0.00 C ATOM 1125 O ASN A 72 -7.686 -2.883 4.122 1.00 0.00 O ATOM 1126 CB ASN A 72 -9.918 -0.428 3.939 1.00 0.00 C ATOM 1127 CG ASN A 72 -9.617 -0.361 5.413 1.00 0.00 C ATOM 1128 OD1 ASN A 72 -9.834 -1.316 6.166 1.00 0.00 O ATOM 1129 ND2 ASN A 72 -9.200 0.785 5.851 1.00 0.00 N ATOM 0 H ASN A 72 -9.892 -0.273 1.499 1.00 0.00 H new ATOM 0 HA ASN A 72 -7.837 -0.472 3.355 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -10.160 0.572 3.579 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -10.803 -1.045 3.784 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -9.040 0.922 6.849 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -9.032 1.550 5.198 1.00 0.00 H new ATOM 1136 N TYR A 73 -9.517 -3.258 2.851 1.00 0.00 N ATOM 1137 CA TYR A 73 -9.545 -4.689 3.045 1.00 0.00 C ATOM 1138 C TYR A 73 -8.244 -5.320 2.561 1.00 0.00 C ATOM 1139 O TYR A 73 -7.596 -6.024 3.316 1.00 0.00 O ATOM 1140 CB TYR A 73 -10.759 -5.283 2.326 1.00 0.00 C ATOM 1141 CG TYR A 73 -11.036 -6.748 2.593 1.00 0.00 C ATOM 1142 CD1 TYR A 73 -11.064 -7.251 3.887 1.00 0.00 C ATOM 1143 CD2 TYR A 73 -11.299 -7.615 1.553 1.00 0.00 C ATOM 1144 CE1 TYR A 73 -11.349 -8.580 4.126 1.00 0.00 C ATOM 1145 CE2 TYR A 73 -11.599 -8.943 1.782 1.00 0.00 C ATOM 1146 CZ TYR A 73 -11.623 -9.423 3.070 1.00 0.00 C ATOM 1147 OH TYR A 73 -11.944 -10.761 3.307 1.00 0.00 O ATOM 0 H TYR A 73 -10.255 -2.912 2.237 1.00 0.00 H new ATOM 0 HA TYR A 73 -9.637 -4.907 4.109 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -11.641 -4.709 2.609 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -10.623 -5.149 1.253 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -10.860 -6.593 4.718 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -11.270 -7.247 0.538 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -11.357 -8.959 5.137 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -11.814 -9.602 0.953 1.00 0.00 H new ATOM 0 HH TYR A 73 -12.286 -10.859 4.220 1.00 0.00 H new ATOM 1157 N LEU A 74 -7.843 -5.017 1.330 1.00 0.00 N ATOM 1158 CA LEU A 74 -6.592 -5.550 0.777 1.00 0.00 C ATOM 1159 C LEU A 74 -5.368 -5.100 1.569 1.00 0.00 C ATOM 1160 O LEU A 74 -4.482 -5.908 1.829 1.00 0.00 O ATOM 1161 CB LEU A 74 -6.412 -5.235 -0.720 1.00 0.00 C ATOM 1162 CG LEU A 74 -7.070 -6.196 -1.747 1.00 0.00 C ATOM 1163 CD1 LEU A 74 -6.465 -7.581 -1.651 1.00 0.00 C ATOM 1164 CD2 LEU A 74 -8.580 -6.273 -1.587 1.00 0.00 C ATOM 0 H LEU A 74 -8.360 -4.409 0.695 1.00 0.00 H new ATOM 0 HA LEU A 74 -6.676 -6.633 0.872 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -6.803 -4.234 -0.901 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -5.343 -5.203 -0.929 1.00 0.00 H new ATOM 0 HG LEU A 74 -6.868 -5.784 -2.735 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -6.941 -8.237 -2.379 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -5.396 -7.526 -1.856 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -6.622 -7.978 -0.648 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -8.990 -6.958 -2.329 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -8.822 -6.634 -0.587 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -9.012 -5.283 -1.730 1.00 0.00 H new ATOM 1176 N ILE A 75 -5.334 -3.818 1.955 1.00 0.00 N ATOM 1177 CA ILE A 75 -4.237 -3.260 2.769 1.00 0.00 C ATOM 1178 C ILE A 75 -4.025 -4.110 4.033 1.00 0.00 C ATOM 1179 O ILE A 75 -2.903 -4.541 4.337 1.00 0.00 O ATOM 1180 CB ILE A 75 -4.545 -1.774 3.185 1.00 0.00 C ATOM 1181 CG1 ILE A 75 -4.533 -0.854 1.949 1.00 0.00 C ATOM 1182 CG2 ILE A 75 -3.571 -1.267 4.257 1.00 0.00 C ATOM 1183 CD1 ILE A 75 -4.882 0.597 2.238 1.00 0.00 C ATOM 0 H ILE A 75 -6.058 -3.140 1.716 1.00 0.00 H new ATOM 0 HA ILE A 75 -3.330 -3.275 2.164 1.00 0.00 H new ATOM 0 HB ILE A 75 -5.543 -1.754 3.623 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -3.544 -0.892 1.493 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -5.238 -1.244 1.215 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -3.818 -0.237 4.516 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -3.650 -1.893 5.146 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.552 -1.309 3.872 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -4.849 1.171 1.312 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -5.884 0.652 2.664 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -4.164 1.010 2.946 1.00 0.00 H new ATOM 1195 N GLN A 76 -5.114 -4.386 4.724 1.00 0.00 N ATOM 1196 CA GLN A 76 -5.062 -5.150 5.956 1.00 0.00 C ATOM 1197 C GLN A 76 -4.809 -6.626 5.681 1.00 0.00 C ATOM 1198 O GLN A 76 -3.867 -7.206 6.210 1.00 0.00 O ATOM 1199 CB GLN A 76 -6.367 -4.996 6.734 1.00 0.00 C ATOM 1200 CG GLN A 76 -6.695 -3.565 7.112 1.00 0.00 C ATOM 1201 CD GLN A 76 -8.005 -3.423 7.867 1.00 0.00 C ATOM 1202 OE1 GLN A 76 -8.949 -4.301 7.622 1.00 0.00 O flip ATOM 1203 NE2 GLN A 76 -8.159 -2.518 8.685 1.00 0.00 N flip ATOM 0 H GLN A 76 -6.051 -4.090 4.451 1.00 0.00 H new ATOM 0 HA GLN A 76 -4.235 -4.760 6.550 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -7.184 -5.399 6.136 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -6.310 -5.597 7.642 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.887 -3.165 7.724 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.739 -2.959 6.207 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -7.407 -1.850 8.854 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -9.039 -2.435 9.194 1.00 0.00 H new ATOM 1212 N MET A 77 -5.607 -7.192 4.793 1.00 0.00 N ATOM 1213 CA MET A 77 -5.594 -8.621 4.498 1.00 0.00 C ATOM 1214 C MET A 77 -4.221 -9.075 4.001 1.00 0.00 C ATOM 1215 O MET A 77 -3.725 -10.143 4.404 1.00 0.00 O ATOM 1216 CB MET A 77 -6.693 -8.945 3.477 1.00 0.00 C ATOM 1217 CG MET A 77 -6.941 -10.420 3.238 1.00 0.00 C ATOM 1218 SD MET A 77 -8.262 -10.722 2.044 1.00 0.00 S ATOM 1219 CE MET A 77 -8.311 -12.514 2.046 1.00 0.00 C ATOM 0 H MET A 77 -6.292 -6.669 4.248 1.00 0.00 H new ATOM 0 HA MET A 77 -5.796 -9.171 5.417 1.00 0.00 H new ATOM 0 HB2 MET A 77 -7.624 -8.487 3.812 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.432 -8.479 2.527 1.00 0.00 H new ATOM 0 HG2 MET A 77 -6.022 -10.885 2.882 1.00 0.00 H new ATOM 0 HG3 MET A 77 -7.195 -10.899 4.183 1.00 0.00 H new ATOM 0 HE1 MET A 77 -9.081 -12.858 1.355 1.00 0.00 H new ATOM 0 HE2 MET A 77 -7.342 -12.905 1.734 1.00 0.00 H new ATOM 0 HE3 MET A 77 -8.540 -12.871 3.050 1.00 0.00 H new ATOM 1229 N ALA A 78 -3.585 -8.256 3.172 1.00 0.00 N ATOM 1230 CA ALA A 78 -2.257 -8.560 2.667 1.00 0.00 C ATOM 1231 C ALA A 78 -1.228 -8.565 3.789 1.00 0.00 C ATOM 1232 O ALA A 78 -0.374 -9.439 3.846 1.00 0.00 O ATOM 1233 CB ALA A 78 -1.852 -7.578 1.598 1.00 0.00 C ATOM 0 H ALA A 78 -3.971 -7.374 2.836 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.293 -9.558 2.230 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.854 -7.826 1.235 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -2.561 -7.627 0.772 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -1.847 -6.570 2.013 1.00 0.00 H new ATOM 1239 N ARG A 79 -1.361 -7.627 4.718 1.00 0.00 N ATOM 1240 CA ARG A 79 -0.432 -7.486 5.832 1.00 0.00 C ATOM 1241 C ARG A 79 -0.513 -8.634 6.833 1.00 0.00 C ATOM 1242 O ARG A 79 0.368 -8.796 7.681 1.00 0.00 O ATOM 1243 CB ARG A 79 -0.583 -6.121 6.506 1.00 0.00 C ATOM 1244 CG ARG A 79 0.075 -5.000 5.712 1.00 0.00 C ATOM 1245 CD ARG A 79 -0.057 -3.647 6.384 1.00 0.00 C ATOM 1246 NE ARG A 79 0.684 -2.611 5.643 1.00 0.00 N ATOM 1247 CZ ARG A 79 0.356 -1.312 5.570 1.00 0.00 C ATOM 1248 NH1 ARG A 79 -0.689 -0.838 6.244 1.00 0.00 N ATOM 1249 NH2 ARG A 79 1.105 -0.490 4.840 1.00 0.00 N ATOM 0 H ARG A 79 -2.117 -6.942 4.720 1.00 0.00 H new ATOM 0 HA ARG A 79 0.571 -7.540 5.409 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -1.642 -5.898 6.633 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -0.144 -6.161 7.503 1.00 0.00 H new ATOM 0 HG2 ARG A 79 1.131 -5.230 5.574 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -0.373 -4.953 4.719 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -1.109 -3.370 6.447 1.00 0.00 H new ATOM 0 HD3 ARG A 79 0.319 -3.707 7.405 1.00 0.00 H new ATOM 0 HE ARG A 79 1.521 -2.908 5.141 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -1.249 -1.464 6.823 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -0.930 0.151 6.182 1.00 0.00 H new ATOM 0 HH21 ARG A 79 1.920 -0.849 4.342 1.00 0.00 H new ATOM 0 HH22 ARG A 79 0.864 0.499 4.778 1.00 0.00 H new ATOM 1263 N TYR A 80 -1.546 -9.436 6.729 1.00 0.00 N ATOM 1264 CA TYR A 80 -1.669 -10.621 7.560 1.00 0.00 C ATOM 1265 C TYR A 80 -1.154 -11.848 6.827 1.00 0.00 C ATOM 1266 O TYR A 80 -1.299 -12.972 7.292 1.00 0.00 O ATOM 1267 CB TYR A 80 -3.107 -10.812 8.067 1.00 0.00 C ATOM 1268 CG TYR A 80 -3.476 -9.830 9.159 1.00 0.00 C ATOM 1269 CD1 TYR A 80 -3.759 -8.509 8.868 1.00 0.00 C ATOM 1270 CD2 TYR A 80 -3.514 -10.227 10.487 1.00 0.00 C ATOM 1271 CE1 TYR A 80 -4.067 -7.605 9.853 1.00 0.00 C ATOM 1272 CE2 TYR A 80 -3.828 -9.329 11.491 1.00 0.00 C ATOM 1273 CZ TYR A 80 -4.103 -8.017 11.167 1.00 0.00 C ATOM 1274 OH TYR A 80 -4.411 -7.118 12.160 1.00 0.00 O ATOM 0 H TYR A 80 -2.318 -9.293 6.077 1.00 0.00 H new ATOM 0 HA TYR A 80 -1.045 -10.480 8.443 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -3.800 -10.699 7.233 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.223 -11.828 8.443 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -3.737 -8.180 7.840 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -3.295 -11.254 10.741 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -4.280 -6.577 9.600 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -3.858 -9.653 12.521 1.00 0.00 H new ATOM 0 HH TYR A 80 -4.394 -7.571 13.029 1.00 0.00 H new ATOM 1284 N GLY A 81 -0.540 -11.613 5.672 1.00 0.00 N ATOM 1285 CA GLY A 81 0.065 -12.676 4.902 1.00 0.00 C ATOM 1286 C GLY A 81 -0.918 -13.405 4.024 1.00 0.00 C ATOM 1287 O GLY A 81 -0.557 -14.368 3.337 1.00 0.00 O ATOM 0 H GLY A 81 -0.452 -10.687 5.253 1.00 0.00 H new ATOM 0 HA2 GLY A 81 0.858 -12.260 4.281 1.00 0.00 H new ATOM 0 HA3 GLY A 81 0.533 -13.388 5.582 1.00 0.00 H new ATOM 1291 N GLN A 82 -2.153 -12.939 4.006 1.00 0.00 N ATOM 1292 CA GLN A 82 -3.193 -13.604 3.243 1.00 0.00 C ATOM 1293 C GLN A 82 -3.010 -13.391 1.749 1.00 0.00 C ATOM 1294 O GLN A 82 -3.459 -14.197 0.944 1.00 0.00 O ATOM 1295 CB GLN A 82 -4.587 -13.195 3.718 1.00 0.00 C ATOM 1296 CG GLN A 82 -4.878 -13.584 5.164 1.00 0.00 C ATOM 1297 CD GLN A 82 -6.278 -13.216 5.604 1.00 0.00 C ATOM 1298 OE1 GLN A 82 -6.434 -12.043 6.148 1.00 0.00 O flip ATOM 1299 NE2 GLN A 82 -7.215 -14.001 5.466 1.00 0.00 N flip ATOM 0 H GLN A 82 -2.460 -12.106 4.509 1.00 0.00 H new ATOM 0 HA GLN A 82 -3.100 -14.675 3.424 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -4.696 -12.116 3.612 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -5.332 -13.656 3.070 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -4.737 -14.658 5.281 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -4.157 -13.095 5.818 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -7.058 -14.912 5.036 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -8.149 -13.741 5.782 1.00 0.00 H new ATOM 1308 N LEU A 83 -2.326 -12.325 1.379 1.00 0.00 N ATOM 1309 CA LEU A 83 -2.021 -12.090 -0.017 1.00 0.00 C ATOM 1310 C LEU A 83 -0.560 -12.213 -0.298 1.00 0.00 C ATOM 1311 O LEU A 83 0.256 -11.433 0.201 1.00 0.00 O ATOM 1312 CB LEU A 83 -2.556 -10.764 -0.591 1.00 0.00 C ATOM 1313 CG LEU A 83 -4.049 -10.694 -0.907 1.00 0.00 C ATOM 1314 CD1 LEU A 83 -4.485 -11.909 -1.715 1.00 0.00 C ATOM 1315 CD2 LEU A 83 -4.878 -10.532 0.343 1.00 0.00 C ATOM 0 H LEU A 83 -1.974 -11.614 2.020 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.562 -12.882 -0.535 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.323 -9.970 0.118 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -2.006 -10.545 -1.506 1.00 0.00 H new ATOM 0 HG LEU A 83 -4.220 -9.806 -1.516 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.551 -11.840 -1.930 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -3.928 -11.942 -2.651 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.288 -12.816 -1.143 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -5.934 -10.486 0.076 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -4.708 -11.381 1.005 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -4.592 -9.612 0.852 1.00 0.00 H new ATOM 1327 N SER A 84 -0.235 -13.211 -1.055 1.00 0.00 N ATOM 1328 CA SER A 84 1.101 -13.417 -1.531 1.00 0.00 C ATOM 1329 C SER A 84 1.016 -13.558 -3.049 1.00 0.00 C ATOM 1330 O SER A 84 2.008 -13.815 -3.752 1.00 0.00 O ATOM 1331 CB SER A 84 1.667 -14.677 -0.876 1.00 0.00 C ATOM 1332 OG SER A 84 3.048 -14.851 -1.158 1.00 0.00 O ATOM 0 H SER A 84 -0.899 -13.919 -1.367 1.00 0.00 H new ATOM 0 HA SER A 84 1.763 -12.588 -1.281 1.00 0.00 H new ATOM 0 HB2 SER A 84 1.522 -14.621 0.203 1.00 0.00 H new ATOM 0 HB3 SER A 84 1.113 -15.548 -1.227 1.00 0.00 H new ATOM 0 HG SER A 84 3.234 -14.558 -2.075 1.00 0.00 H new ATOM 1338 N GLU A 85 -0.189 -13.347 -3.541 1.00 0.00 N ATOM 1339 CA GLU A 85 -0.521 -13.472 -4.931 1.00 0.00 C ATOM 1340 C GLU A 85 -1.154 -12.163 -5.354 1.00 0.00 C ATOM 1341 O GLU A 85 -1.482 -11.335 -4.488 1.00 0.00 O ATOM 1342 CB GLU A 85 -1.560 -14.584 -5.114 1.00 0.00 C ATOM 1343 CG GLU A 85 -1.205 -15.934 -4.492 1.00 0.00 C ATOM 1344 CD GLU A 85 0.062 -16.531 -5.034 1.00 0.00 C ATOM 1345 OE1 GLU A 85 0.253 -16.534 -6.266 1.00 0.00 O ATOM 1346 OE2 GLU A 85 0.866 -17.057 -4.244 1.00 0.00 O ATOM 0 H GLU A 85 -0.982 -13.076 -2.960 1.00 0.00 H new ATOM 0 HA GLU A 85 0.368 -13.705 -5.517 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -2.505 -14.246 -4.688 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -1.725 -14.729 -6.182 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -1.107 -15.813 -3.413 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -2.026 -16.630 -4.662 1.00 0.00 H new ATOM 1353 N LYS A 86 -1.303 -11.951 -6.633 1.00 0.00 N ATOM 1354 CA LYS A 86 -1.985 -10.793 -7.123 1.00 0.00 C ATOM 1355 C LYS A 86 -3.434 -11.102 -7.337 1.00 0.00 C ATOM 1356 O LYS A 86 -3.788 -12.154 -7.900 1.00 0.00 O ATOM 1357 CB LYS A 86 -1.412 -10.304 -8.433 1.00 0.00 C ATOM 1358 CG LYS A 86 -0.065 -9.614 -8.354 1.00 0.00 C ATOM 1359 CD LYS A 86 0.317 -9.061 -9.715 1.00 0.00 C ATOM 1360 CE LYS A 86 0.588 -10.175 -10.695 1.00 0.00 C ATOM 1361 NZ LYS A 86 0.628 -9.704 -12.087 1.00 0.00 N ATOM 0 H LYS A 86 -0.955 -12.576 -7.360 1.00 0.00 H new ATOM 0 HA LYS A 86 -1.859 -10.013 -6.372 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -1.323 -11.155 -9.108 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -2.125 -9.614 -8.883 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -0.103 -8.807 -7.622 1.00 0.00 H new ATOM 0 HG3 LYS A 86 0.694 -10.318 -8.013 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -0.486 -8.427 -10.092 1.00 0.00 H new ATOM 0 HD3 LYS A 86 1.202 -8.432 -9.620 1.00 0.00 H new ATOM 0 HE2 LYS A 86 1.538 -10.649 -10.448 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -0.184 -10.938 -10.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 0.817 -10.507 -12.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -0.287 -9.276 -12.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 1.382 -8.995 -12.192 1.00 0.00 H new ATOM 1375 N VAL A 87 -4.254 -10.220 -6.890 1.00 0.00 N ATOM 1376 CA VAL A 87 -5.656 -10.307 -7.082 1.00 0.00 C ATOM 1377 C VAL A 87 -5.983 -9.657 -8.420 1.00 0.00 C ATOM 1378 O VAL A 87 -5.697 -8.471 -8.637 1.00 0.00 O ATOM 1379 CB VAL A 87 -6.415 -9.590 -5.933 1.00 0.00 C ATOM 1380 CG1 VAL A 87 -7.910 -9.671 -6.126 1.00 0.00 C ATOM 1381 CG2 VAL A 87 -6.029 -10.184 -4.590 1.00 0.00 C ATOM 0 H VAL A 87 -3.960 -9.396 -6.366 1.00 0.00 H new ATOM 0 HA VAL A 87 -5.970 -11.351 -7.079 1.00 0.00 H new ATOM 0 HB VAL A 87 -6.128 -8.539 -5.952 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -8.411 -9.159 -5.304 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -8.181 -9.196 -7.069 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -8.218 -10.716 -6.144 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -6.570 -9.670 -3.796 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -6.283 -11.244 -4.575 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -4.957 -10.065 -4.434 1.00 0.00 H new ATOM 1391 N SER A 88 -6.511 -10.439 -9.319 1.00 0.00 N ATOM 1392 CA SER A 88 -6.880 -9.968 -10.630 1.00 0.00 C ATOM 1393 C SER A 88 -8.301 -9.386 -10.558 1.00 0.00 C ATOM 1394 O SER A 88 -8.908 -9.408 -9.480 1.00 0.00 O ATOM 1395 CB SER A 88 -6.794 -11.141 -11.609 1.00 0.00 C ATOM 1396 OG SER A 88 -5.520 -11.784 -11.496 1.00 0.00 O ATOM 0 H SER A 88 -6.700 -11.429 -9.164 1.00 0.00 H new ATOM 0 HA SER A 88 -6.208 -9.183 -10.978 1.00 0.00 H new ATOM 0 HB2 SER A 88 -7.590 -11.856 -11.403 1.00 0.00 H new ATOM 0 HB3 SER A 88 -6.941 -10.785 -12.629 1.00 0.00 H new ATOM 0 HG SER A 88 -5.475 -12.534 -12.125 1.00 0.00 H new ATOM 1402 N GLU A 89 -8.843 -8.892 -11.680 1.00 0.00 N ATOM 1403 CA GLU A 89 -10.183 -8.280 -11.682 1.00 0.00 C ATOM 1404 C GLU A 89 -11.226 -9.225 -11.143 1.00 0.00 C ATOM 1405 O GLU A 89 -11.971 -8.864 -10.254 1.00 0.00 O ATOM 1406 CB GLU A 89 -10.591 -7.829 -13.071 1.00 0.00 C ATOM 1407 CG GLU A 89 -9.834 -6.650 -13.592 1.00 0.00 C ATOM 1408 CD GLU A 89 -10.268 -6.293 -14.982 1.00 0.00 C ATOM 1409 OE1 GLU A 89 -11.419 -5.838 -15.163 1.00 0.00 O ATOM 1410 OE2 GLU A 89 -9.483 -6.497 -15.927 1.00 0.00 O ATOM 0 H GLU A 89 -8.382 -8.903 -12.590 1.00 0.00 H new ATOM 0 HA GLU A 89 -10.123 -7.408 -11.030 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -10.460 -8.662 -13.762 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -11.654 -7.586 -13.062 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -9.986 -5.797 -12.931 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -8.766 -6.870 -13.588 1.00 0.00 H new ATOM 1417 N GLN A 90 -11.218 -10.449 -11.642 1.00 0.00 N ATOM 1418 CA GLN A 90 -12.170 -11.474 -11.228 1.00 0.00 C ATOM 1419 C GLN A 90 -12.071 -11.751 -9.721 1.00 0.00 C ATOM 1420 O GLN A 90 -13.077 -11.978 -9.052 1.00 0.00 O ATOM 1421 CB GLN A 90 -11.952 -12.746 -12.048 1.00 0.00 C ATOM 1422 CG GLN A 90 -12.922 -13.874 -11.740 1.00 0.00 C ATOM 1423 CD GLN A 90 -12.713 -15.057 -12.646 1.00 0.00 C ATOM 1424 OE1 GLN A 90 -11.928 -15.953 -12.352 1.00 0.00 O ATOM 1425 NE2 GLN A 90 -13.410 -15.085 -13.740 1.00 0.00 N ATOM 0 H GLN A 90 -10.552 -10.764 -12.347 1.00 0.00 H new ATOM 0 HA GLN A 90 -13.180 -11.110 -11.418 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -12.029 -12.497 -13.106 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -10.936 -13.102 -11.878 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -12.799 -14.185 -10.703 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -13.945 -13.512 -11.845 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -14.054 -14.323 -13.954 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -13.314 -15.869 -14.386 1.00 0.00 H new ATOM 1434 N GLY A 91 -10.862 -11.669 -9.196 1.00 0.00 N ATOM 1435 CA GLY A 91 -10.650 -11.872 -7.786 1.00 0.00 C ATOM 1436 C GLY A 91 -11.121 -10.677 -6.979 1.00 0.00 C ATOM 1437 O GLY A 91 -11.639 -10.826 -5.878 1.00 0.00 O ATOM 0 H GLY A 91 -10.017 -11.463 -9.729 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -11.183 -12.766 -7.461 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -9.591 -12.046 -7.597 1.00 0.00 H new ATOM 1441 N LEU A 92 -10.961 -9.487 -7.537 1.00 0.00 N ATOM 1442 CA LEU A 92 -11.381 -8.276 -6.861 1.00 0.00 C ATOM 1443 C LEU A 92 -12.898 -8.162 -6.895 1.00 0.00 C ATOM 1444 O LEU A 92 -13.498 -7.582 -6.011 1.00 0.00 O ATOM 1445 CB LEU A 92 -10.741 -7.030 -7.479 1.00 0.00 C ATOM 1446 CG LEU A 92 -10.999 -5.717 -6.722 1.00 0.00 C ATOM 1447 CD1 LEU A 92 -10.298 -5.716 -5.368 1.00 0.00 C ATOM 1448 CD2 LEU A 92 -10.599 -4.509 -7.556 1.00 0.00 C ATOM 0 H LEU A 92 -10.543 -9.337 -8.455 1.00 0.00 H new ATOM 0 HA LEU A 92 -11.046 -8.338 -5.826 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -9.664 -7.188 -7.543 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -11.108 -6.921 -8.499 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.071 -5.645 -6.538 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -10.498 -4.775 -4.855 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -10.670 -6.544 -4.765 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -9.224 -5.828 -5.514 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -10.794 -3.597 -6.992 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -9.537 -4.568 -7.795 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -11.179 -4.496 -8.479 1.00 0.00 H new ATOM 1460 N ILE A 93 -13.509 -8.742 -7.909 1.00 0.00 N ATOM 1461 CA ILE A 93 -14.960 -8.781 -8.020 1.00 0.00 C ATOM 1462 C ILE A 93 -15.539 -9.622 -6.867 1.00 0.00 C ATOM 1463 O ILE A 93 -16.616 -9.326 -6.349 1.00 0.00 O ATOM 1464 CB ILE A 93 -15.408 -9.319 -9.422 1.00 0.00 C ATOM 1465 CG1 ILE A 93 -14.933 -8.345 -10.519 1.00 0.00 C ATOM 1466 CG2 ILE A 93 -16.926 -9.503 -9.492 1.00 0.00 C ATOM 1467 CD1 ILE A 93 -15.104 -8.849 -11.938 1.00 0.00 C ATOM 0 H ILE A 93 -13.019 -9.199 -8.678 1.00 0.00 H new ATOM 0 HA ILE A 93 -15.353 -7.768 -7.938 1.00 0.00 H new ATOM 0 HB ILE A 93 -14.953 -10.297 -9.579 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -15.479 -7.408 -10.414 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -13.879 -8.120 -10.353 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -17.202 -9.877 -10.478 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -17.241 -10.217 -8.731 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -17.417 -8.546 -9.317 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -14.742 -8.096 -12.638 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -14.534 -9.769 -12.069 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -16.159 -9.045 -12.130 1.00 0.00 H new ATOM 1479 N GLU A 94 -14.776 -10.626 -6.426 1.00 0.00 N ATOM 1480 CA GLU A 94 -15.149 -11.436 -5.266 1.00 0.00 C ATOM 1481 C GLU A 94 -15.183 -10.528 -4.038 1.00 0.00 C ATOM 1482 O GLU A 94 -16.103 -10.578 -3.222 1.00 0.00 O ATOM 1483 CB GLU A 94 -14.109 -12.544 -5.026 1.00 0.00 C ATOM 1484 CG GLU A 94 -13.855 -13.454 -6.215 1.00 0.00 C ATOM 1485 CD GLU A 94 -15.047 -14.273 -6.594 1.00 0.00 C ATOM 1486 OE1 GLU A 94 -15.961 -13.759 -7.241 1.00 0.00 O ATOM 1487 OE2 GLU A 94 -15.094 -15.469 -6.254 1.00 0.00 O ATOM 0 H GLU A 94 -13.893 -10.897 -6.858 1.00 0.00 H new ATOM 0 HA GLU A 94 -16.122 -11.894 -5.445 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -13.167 -12.080 -4.735 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -14.438 -13.154 -4.184 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -13.551 -12.849 -7.069 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -13.023 -14.120 -5.984 1.00 0.00 H new ATOM 1494 N ILE A 95 -14.181 -9.668 -3.961 1.00 0.00 N ATOM 1495 CA ILE A 95 -14.014 -8.728 -2.863 1.00 0.00 C ATOM 1496 C ILE A 95 -15.112 -7.666 -2.925 1.00 0.00 C ATOM 1497 O ILE A 95 -15.664 -7.257 -1.902 1.00 0.00 O ATOM 1498 CB ILE A 95 -12.634 -8.011 -2.946 1.00 0.00 C ATOM 1499 CG1 ILE A 95 -11.483 -9.011 -3.149 1.00 0.00 C ATOM 1500 CG2 ILE A 95 -12.396 -7.185 -1.696 1.00 0.00 C ATOM 1501 CD1 ILE A 95 -11.314 -10.019 -2.040 1.00 0.00 C ATOM 0 H ILE A 95 -13.450 -9.602 -4.669 1.00 0.00 H new ATOM 0 HA ILE A 95 -14.072 -9.288 -1.930 1.00 0.00 H new ATOM 0 HB ILE A 95 -12.656 -7.352 -3.814 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.647 -9.546 -4.084 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -10.552 -8.454 -3.259 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -11.428 -6.689 -1.767 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -13.182 -6.436 -1.600 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -12.407 -7.836 -0.822 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -10.479 -10.680 -2.273 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.115 -9.499 -1.103 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.226 -10.608 -1.941 1.00 0.00 H new ATOM 1513 N LEU A 96 -15.420 -7.243 -4.129 1.00 0.00 N ATOM 1514 CA LEU A 96 -16.415 -6.237 -4.358 1.00 0.00 C ATOM 1515 C LEU A 96 -17.784 -6.746 -3.934 1.00 0.00 C ATOM 1516 O LEU A 96 -18.546 -6.022 -3.303 1.00 0.00 O ATOM 1517 CB LEU A 96 -16.429 -5.811 -5.824 1.00 0.00 C ATOM 1518 CG LEU A 96 -17.231 -4.552 -6.139 1.00 0.00 C ATOM 1519 CD1 LEU A 96 -16.604 -3.337 -5.454 1.00 0.00 C ATOM 1520 CD2 LEU A 96 -17.316 -4.341 -7.640 1.00 0.00 C ATOM 0 H LEU A 96 -14.980 -7.594 -4.980 1.00 0.00 H new ATOM 0 HA LEU A 96 -16.167 -5.363 -3.756 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -15.400 -5.655 -6.148 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -16.829 -6.633 -6.418 1.00 0.00 H new ATOM 0 HG LEU A 96 -18.243 -4.677 -5.754 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -17.187 -2.446 -5.688 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -16.595 -3.492 -4.375 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -15.582 -3.206 -5.810 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -17.891 -3.439 -7.849 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -16.312 -4.234 -8.050 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -17.806 -5.199 -8.101 1.00 0.00 H new ATOM 1532 N LYS A 97 -18.085 -8.003 -4.262 1.00 0.00 N ATOM 1533 CA LYS A 97 -19.342 -8.625 -3.847 1.00 0.00 C ATOM 1534 C LYS A 97 -19.419 -8.713 -2.323 1.00 0.00 C ATOM 1535 O LYS A 97 -20.486 -8.525 -1.739 1.00 0.00 O ATOM 1536 CB LYS A 97 -19.524 -10.010 -4.471 1.00 0.00 C ATOM 1537 CG LYS A 97 -19.774 -10.013 -5.973 1.00 0.00 C ATOM 1538 CD LYS A 97 -19.871 -11.439 -6.521 1.00 0.00 C ATOM 1539 CE LYS A 97 -18.533 -12.156 -6.438 1.00 0.00 C ATOM 1540 NZ LYS A 97 -18.572 -13.523 -6.998 1.00 0.00 N ATOM 0 H LYS A 97 -17.477 -8.609 -4.813 1.00 0.00 H new ATOM 0 HA LYS A 97 -20.154 -7.993 -4.206 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -18.634 -10.604 -4.265 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -20.360 -10.507 -3.978 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -20.696 -9.475 -6.191 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -18.968 -9.482 -6.479 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -20.620 -11.997 -5.959 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -20.207 -11.410 -7.558 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -17.782 -11.573 -6.970 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -18.218 -12.206 -5.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -17.607 -13.910 -7.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -19.163 -14.129 -6.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -18.973 -13.494 -7.957 1.00 0.00 H new ATOM 1554 N LYS A 98 -18.278 -8.983 -1.695 1.00 0.00 N ATOM 1555 CA LYS A 98 -18.170 -9.019 -0.238 1.00 0.00 C ATOM 1556 C LYS A 98 -18.617 -7.697 0.379 1.00 0.00 C ATOM 1557 O LYS A 98 -19.569 -7.643 1.187 1.00 0.00 O ATOM 1558 CB LYS A 98 -16.717 -9.259 0.197 1.00 0.00 C ATOM 1559 CG LYS A 98 -16.180 -10.669 0.075 1.00 0.00 C ATOM 1560 CD LYS A 98 -14.734 -10.723 0.584 1.00 0.00 C ATOM 1561 CE LYS A 98 -14.185 -12.134 0.574 1.00 0.00 C ATOM 1562 NZ LYS A 98 -12.774 -12.211 1.052 1.00 0.00 N ATOM 0 H LYS A 98 -17.403 -9.183 -2.180 1.00 0.00 H new ATOM 0 HA LYS A 98 -18.811 -9.832 0.104 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -16.076 -8.602 -0.391 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -16.621 -8.950 1.238 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -16.803 -11.355 0.649 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -16.221 -10.994 -0.964 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -14.106 -10.085 -0.038 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -14.690 -10.324 1.597 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -14.811 -12.767 1.203 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -14.243 -12.534 -0.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -12.549 -13.192 1.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -12.133 -11.900 0.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -12.654 -11.595 1.881 1.00 0.00 H new ATOM 1576 N VAL A 99 -17.951 -6.636 -0.032 1.00 0.00 N ATOM 1577 CA VAL A 99 -18.137 -5.329 0.557 1.00 0.00 C ATOM 1578 C VAL A 99 -19.470 -4.685 0.180 1.00 0.00 C ATOM 1579 O VAL A 99 -19.938 -3.792 0.880 1.00 0.00 O ATOM 1580 CB VAL A 99 -16.965 -4.357 0.221 1.00 0.00 C ATOM 1581 CG1 VAL A 99 -15.621 -4.961 0.615 1.00 0.00 C ATOM 1582 CG2 VAL A 99 -16.970 -3.958 -1.246 1.00 0.00 C ATOM 0 H VAL A 99 -17.264 -6.658 -0.786 1.00 0.00 H new ATOM 0 HA VAL A 99 -18.147 -5.503 1.633 1.00 0.00 H new ATOM 0 HB VAL A 99 -17.116 -3.451 0.809 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -14.822 -4.262 0.369 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -15.612 -5.161 1.687 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -15.467 -5.893 0.071 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -16.139 -3.280 -1.442 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -16.866 -4.849 -1.866 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -17.909 -3.458 -1.484 1.00 0.00 H new ATOM 1592 N SER A 100 -20.078 -5.127 -0.906 1.00 0.00 N ATOM 1593 CA SER A 100 -21.313 -4.539 -1.357 1.00 0.00 C ATOM 1594 C SER A 100 -22.539 -5.111 -0.649 1.00 0.00 C ATOM 1595 O SER A 100 -23.612 -4.501 -0.659 1.00 0.00 O ATOM 1596 CB SER A 100 -21.427 -4.630 -2.874 1.00 0.00 C ATOM 1597 OG SER A 100 -21.153 -5.939 -3.329 1.00 0.00 O ATOM 0 H SER A 100 -19.732 -5.891 -1.487 1.00 0.00 H new ATOM 0 HA SER A 100 -21.288 -3.484 -1.083 1.00 0.00 H new ATOM 0 HB2 SER A 100 -22.430 -4.337 -3.184 1.00 0.00 H new ATOM 0 HB3 SER A 100 -20.732 -3.929 -3.336 1.00 0.00 H new ATOM 0 HG SER A 100 -20.249 -5.972 -3.705 1.00 0.00 H new ATOM 1603 N GLN A 101 -22.408 -6.272 -0.054 1.00 0.00 N ATOM 1604 CA GLN A 101 -23.522 -6.807 0.696 1.00 0.00 C ATOM 1605 C GLN A 101 -23.303 -6.688 2.193 1.00 0.00 C ATOM 1606 O GLN A 101 -24.227 -6.369 2.937 1.00 0.00 O ATOM 1607 CB GLN A 101 -23.893 -8.225 0.265 1.00 0.00 C ATOM 1608 CG GLN A 101 -22.797 -9.261 0.377 1.00 0.00 C ATOM 1609 CD GLN A 101 -23.225 -10.584 -0.209 1.00 0.00 C ATOM 1610 OE1 GLN A 101 -23.026 -10.848 -1.388 1.00 0.00 O ATOM 1611 NE2 GLN A 101 -23.831 -11.407 0.585 1.00 0.00 N ATOM 0 H GLN A 101 -21.569 -6.851 -0.071 1.00 0.00 H new ATOM 0 HA GLN A 101 -24.388 -6.189 0.457 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -24.741 -8.556 0.865 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -24.230 -8.192 -0.771 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -21.905 -8.905 -0.138 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -22.528 -9.396 1.425 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -23.981 -11.156 1.562 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -24.159 -12.307 0.234 1.00 0.00 H new ATOM 1620 N GLN A 102 -22.078 -6.913 2.631 1.00 0.00 N ATOM 1621 CA GLN A 102 -21.755 -6.825 4.038 1.00 0.00 C ATOM 1622 C GLN A 102 -20.483 -6.001 4.243 1.00 0.00 C ATOM 1623 O GLN A 102 -20.526 -4.776 4.349 1.00 0.00 O ATOM 1624 CB GLN A 102 -21.628 -8.232 4.677 1.00 0.00 C ATOM 1625 CG GLN A 102 -22.937 -9.015 4.742 1.00 0.00 C ATOM 1626 CD GLN A 102 -22.764 -10.438 5.243 1.00 0.00 C ATOM 1627 OE1 GLN A 102 -21.860 -10.750 6.026 1.00 0.00 O ATOM 1628 NE2 GLN A 102 -23.621 -11.314 4.805 1.00 0.00 N ATOM 0 H GLN A 102 -21.291 -7.158 2.030 1.00 0.00 H new ATOM 0 HA GLN A 102 -22.574 -6.315 4.545 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -20.900 -8.811 4.109 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -21.232 -8.125 5.687 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -23.634 -8.490 5.395 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -23.387 -9.039 3.750 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -24.357 -11.029 4.159 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -23.557 -12.286 5.107 1.00 0.00 H new ATOM 1637 N THR A 103 -19.372 -6.678 4.256 1.00 0.00 N ATOM 1638 CA THR A 103 -18.045 -6.108 4.354 1.00 0.00 C ATOM 1639 C THR A 103 -17.098 -7.169 3.863 1.00 0.00 C ATOM 1640 O THR A 103 -16.345 -6.971 2.927 1.00 0.00 O ATOM 1641 CB THR A 103 -17.676 -5.666 5.804 1.00 0.00 C ATOM 1642 OG1 THR A 103 -18.531 -4.575 6.222 1.00 0.00 O ATOM 1643 CG2 THR A 103 -16.211 -5.228 5.888 1.00 0.00 C ATOM 0 H THR A 103 -19.358 -7.696 4.196 1.00 0.00 H new ATOM 0 HA THR A 103 -17.988 -5.198 3.757 1.00 0.00 H new ATOM 0 HB THR A 103 -17.822 -6.520 6.465 1.00 0.00 H new ATOM 0 HG1 THR A 103 -19.247 -4.450 5.564 1.00 0.00 H new ATOM 0 HG21 THR A 103 -15.980 -4.925 6.909 1.00 0.00 H new ATOM 0 HG22 THR A 103 -15.566 -6.058 5.601 1.00 0.00 H new ATOM 0 HG23 THR A 103 -16.043 -4.388 5.214 1.00 0.00 H new ATOM 1651 N GLU A 104 -17.173 -8.304 4.477 1.00 0.00 N ATOM 1652 CA GLU A 104 -16.473 -9.444 4.017 1.00 0.00 C ATOM 1653 C GLU A 104 -17.233 -10.655 4.418 1.00 0.00 C ATOM 1654 O GLU A 104 -18.150 -10.567 5.238 1.00 0.00 O ATOM 1655 CB GLU A 104 -15.031 -9.510 4.508 1.00 0.00 C ATOM 1656 CG GLU A 104 -14.858 -9.650 5.996 1.00 0.00 C ATOM 1657 CD GLU A 104 -13.445 -9.994 6.331 1.00 0.00 C ATOM 1658 OE1 GLU A 104 -12.988 -11.088 5.930 1.00 0.00 O ATOM 1659 OE2 GLU A 104 -12.763 -9.210 6.986 1.00 0.00 O ATOM 0 H GLU A 104 -17.728 -8.461 5.318 1.00 0.00 H new ATOM 0 HA GLU A 104 -16.401 -9.381 2.931 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -14.538 -10.352 4.022 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -14.514 -8.607 4.183 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -15.138 -8.719 6.489 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -15.526 -10.424 6.374 1.00 0.00 H new ATOM 1666 N LYS A 105 -16.914 -11.758 3.821 1.00 0.00 N ATOM 1667 CA LYS A 105 -17.546 -12.995 4.127 1.00 0.00 C ATOM 1668 C LYS A 105 -16.499 -14.047 4.039 1.00 0.00 C ATOM 1669 O LYS A 105 -15.594 -13.942 3.200 1.00 0.00 O ATOM 1670 CB LYS A 105 -18.659 -13.349 3.123 1.00 0.00 C ATOM 1671 CG LYS A 105 -19.722 -12.281 2.899 1.00 0.00 C ATOM 1672 CD LYS A 105 -20.868 -12.807 2.045 1.00 0.00 C ATOM 1673 CE LYS A 105 -20.382 -13.414 0.739 1.00 0.00 C ATOM 1674 NZ LYS A 105 -21.506 -13.853 -0.112 1.00 0.00 N ATOM 0 H LYS A 105 -16.197 -11.823 3.098 1.00 0.00 H new ATOM 0 HA LYS A 105 -18.000 -12.923 5.115 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -18.196 -13.579 2.164 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -19.153 -14.259 3.464 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -20.108 -11.943 3.861 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -19.273 -11.415 2.414 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -21.423 -13.558 2.608 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -21.561 -11.994 1.830 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -19.781 -12.682 0.199 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -19.734 -14.264 0.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -21.135 -14.292 -0.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -22.084 -14.545 0.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -22.092 -13.032 -0.364 1.00 0.00 H new ATOM 1688 N THR A 106 -16.576 -15.006 4.891 1.00 0.00 N ATOM 1689 CA THR A 106 -15.706 -16.120 4.816 1.00 0.00 C ATOM 1690 C THR A 106 -16.366 -17.162 3.906 1.00 0.00 C ATOM 1691 O THR A 106 -17.345 -17.835 4.291 1.00 0.00 O ATOM 1692 CB THR A 106 -15.334 -16.667 6.245 1.00 0.00 C ATOM 1693 OG1 THR A 106 -14.551 -17.879 6.184 1.00 0.00 O ATOM 1694 CG2 THR A 106 -16.561 -16.866 7.134 1.00 0.00 C ATOM 0 H THR A 106 -17.245 -15.039 5.660 1.00 0.00 H new ATOM 0 HA THR A 106 -14.748 -15.836 4.382 1.00 0.00 H new ATOM 0 HB THR A 106 -14.716 -15.894 6.702 1.00 0.00 H new ATOM 0 HG1 THR A 106 -14.343 -18.180 7.093 1.00 0.00 H new ATOM 0 HG21 THR A 106 -16.248 -17.244 8.107 1.00 0.00 H new ATOM 0 HG22 THR A 106 -17.075 -15.914 7.263 1.00 0.00 H new ATOM 0 HG23 THR A 106 -17.237 -17.582 6.667 1.00 0.00 H new ATOM 1702 N THR A 107 -15.908 -17.184 2.667 1.00 0.00 N ATOM 1703 CA THR A 107 -16.422 -18.055 1.636 1.00 0.00 C ATOM 1704 C THR A 107 -16.394 -19.517 2.089 1.00 0.00 C ATOM 1705 O THR A 107 -15.341 -20.061 2.427 1.00 0.00 O ATOM 1706 CB THR A 107 -15.588 -17.885 0.348 1.00 0.00 C ATOM 1707 OG1 THR A 107 -15.493 -16.481 0.036 1.00 0.00 O ATOM 1708 CG2 THR A 107 -16.244 -18.610 -0.828 1.00 0.00 C ATOM 0 H THR A 107 -15.150 -16.581 2.347 1.00 0.00 H new ATOM 0 HA THR A 107 -17.458 -17.781 1.437 1.00 0.00 H new ATOM 0 HB THR A 107 -14.599 -18.312 0.513 1.00 0.00 H new ATOM 0 HG1 THR A 107 -14.963 -16.362 -0.780 1.00 0.00 H new ATOM 0 HG21 THR A 107 -15.637 -18.475 -1.723 1.00 0.00 H new ATOM 0 HG22 THR A 107 -16.324 -19.673 -0.601 1.00 0.00 H new ATOM 0 HG23 THR A 107 -17.239 -18.200 -0.999 1.00 0.00 H new ATOM 1716 N THR A 108 -17.552 -20.117 2.148 1.00 0.00 N ATOM 1717 CA THR A 108 -17.677 -21.478 2.548 1.00 0.00 C ATOM 1718 C THR A 108 -18.409 -22.252 1.458 1.00 0.00 C ATOM 1719 O THR A 108 -19.634 -22.396 1.480 1.00 0.00 O ATOM 1720 CB THR A 108 -18.433 -21.582 3.882 1.00 0.00 C ATOM 1721 OG1 THR A 108 -17.879 -20.613 4.794 1.00 0.00 O ATOM 1722 CG2 THR A 108 -18.286 -22.977 4.481 1.00 0.00 C ATOM 0 H THR A 108 -18.437 -19.665 1.917 1.00 0.00 H new ATOM 0 HA THR A 108 -16.684 -21.905 2.692 1.00 0.00 H new ATOM 0 HB THR A 108 -19.492 -21.392 3.711 1.00 0.00 H new ATOM 0 HG1 THR A 108 -17.956 -19.717 4.405 1.00 0.00 H new ATOM 0 HG21 THR A 108 -18.829 -23.027 5.425 1.00 0.00 H new ATOM 0 HG22 THR A 108 -18.692 -23.715 3.789 1.00 0.00 H new ATOM 0 HG23 THR A 108 -17.231 -23.188 4.658 1.00 0.00 H new ATOM 1730 N VAL A 109 -17.672 -22.646 0.462 1.00 0.00 N ATOM 1731 CA VAL A 109 -18.227 -23.399 -0.640 1.00 0.00 C ATOM 1732 C VAL A 109 -17.605 -24.797 -0.668 1.00 0.00 C ATOM 1733 O VAL A 109 -18.193 -25.748 -1.206 1.00 0.00 O ATOM 1734 CB VAL A 109 -18.013 -22.648 -2.003 1.00 0.00 C ATOM 1735 CG1 VAL A 109 -16.535 -22.445 -2.325 1.00 0.00 C ATOM 1736 CG2 VAL A 109 -18.736 -23.339 -3.155 1.00 0.00 C ATOM 0 H VAL A 109 -16.672 -22.459 0.384 1.00 0.00 H new ATOM 0 HA VAL A 109 -19.303 -23.498 -0.496 1.00 0.00 H new ATOM 0 HB VAL A 109 -18.457 -21.660 -1.881 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -16.438 -21.922 -3.276 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -16.069 -21.854 -1.537 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -16.041 -23.414 -2.392 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -18.561 -22.786 -4.078 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -18.359 -24.356 -3.264 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -19.806 -23.369 -2.947 1.00 0.00 H new ATOM 1746 N LYS A 110 -16.437 -24.911 -0.017 1.00 0.00 N ATOM 1747 CA LYS A 110 -15.652 -26.137 0.033 1.00 0.00 C ATOM 1748 C LYS A 110 -15.236 -26.531 -1.384 1.00 0.00 C ATOM 1749 O LYS A 110 -15.777 -27.459 -1.993 1.00 0.00 O ATOM 1750 CB LYS A 110 -16.396 -27.272 0.784 1.00 0.00 C ATOM 1751 CG LYS A 110 -15.614 -28.570 0.947 1.00 0.00 C ATOM 1752 CD LYS A 110 -16.431 -29.596 1.712 1.00 0.00 C ATOM 1753 CE LYS A 110 -15.690 -30.912 1.850 1.00 0.00 C ATOM 1754 NZ LYS A 110 -16.462 -31.891 2.638 1.00 0.00 N ATOM 0 H LYS A 110 -16.012 -24.138 0.495 1.00 0.00 H new ATOM 0 HA LYS A 110 -14.746 -25.958 0.612 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -16.674 -26.909 1.773 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -17.322 -27.490 0.252 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -15.349 -28.966 -0.033 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -14.681 -28.374 1.475 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -16.669 -29.207 2.702 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -17.378 -29.763 1.199 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -15.486 -31.321 0.860 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -14.726 -30.739 2.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -15.925 -32.778 2.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -16.635 -31.511 3.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -17.371 -32.075 2.168 1.00 0.00 H new ATOM 1768 N PHE A 111 -14.340 -25.752 -1.919 1.00 0.00 N ATOM 1769 CA PHE A 111 -13.856 -25.911 -3.257 1.00 0.00 C ATOM 1770 C PHE A 111 -12.426 -25.427 -3.247 1.00 0.00 C ATOM 1771 O PHE A 111 -12.096 -24.499 -2.496 1.00 0.00 O ATOM 1772 CB PHE A 111 -14.724 -25.063 -4.210 1.00 0.00 C ATOM 1773 CG PHE A 111 -14.435 -25.239 -5.675 1.00 0.00 C ATOM 1774 CD1 PHE A 111 -14.974 -26.305 -6.375 1.00 0.00 C ATOM 1775 CD2 PHE A 111 -13.647 -24.327 -6.357 1.00 0.00 C ATOM 1776 CE1 PHE A 111 -14.728 -26.461 -7.723 1.00 0.00 C ATOM 1777 CE2 PHE A 111 -13.398 -24.480 -7.704 1.00 0.00 C ATOM 1778 CZ PHE A 111 -13.938 -25.546 -8.387 1.00 0.00 C ATOM 0 H PHE A 111 -13.916 -24.969 -1.422 1.00 0.00 H new ATOM 0 HA PHE A 111 -13.905 -26.945 -3.598 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -15.772 -25.305 -4.032 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -14.592 -24.011 -3.955 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -15.594 -27.023 -5.859 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -13.223 -23.487 -5.828 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -15.153 -27.298 -8.257 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -12.779 -23.763 -8.224 1.00 0.00 H new ATOM 0 HZ PHE A 111 -13.743 -25.666 -9.442 1.00 0.00 H new ATOM 1788 N ASN A 112 -11.584 -26.037 -4.027 1.00 0.00 N ATOM 1789 CA ASN A 112 -10.182 -25.698 -4.015 1.00 0.00 C ATOM 1790 C ASN A 112 -9.782 -25.002 -5.283 1.00 0.00 C ATOM 1791 O ASN A 112 -9.517 -25.673 -6.283 1.00 0.00 O ATOM 1792 CB ASN A 112 -9.312 -26.934 -3.758 1.00 0.00 C ATOM 1793 CG ASN A 112 -9.488 -27.483 -2.360 1.00 0.00 C ATOM 1794 OD1 ASN A 112 -10.354 -28.328 -2.104 1.00 0.00 O ATOM 1795 ND2 ASN A 112 -8.685 -27.020 -1.443 1.00 0.00 N ATOM 1796 OXT ASN A 112 -9.723 -23.743 -5.298 1.00 0.00 O ATOM 0 H ASN A 112 -11.839 -26.775 -4.683 1.00 0.00 H new ATOM 0 HA ASN A 112 -10.016 -25.004 -3.191 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -9.562 -27.708 -4.483 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -8.265 -26.677 -3.915 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -8.761 -27.355 -0.482 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -7.981 -26.323 -1.686 1.00 0.00 H new TER 1803 ASN A 112