USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 768 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 75 ASN : amide:sc= -0.786 K(o=0.31,f=-1.9!) USER MOD Set 1.2: A 77 LYS NZ :NH3+ 180:sc= 1.09 (180deg=1.11) USER MOD Set 2.1: A 55 SER OG : rot 180:sc= 0.866 USER MOD Set 2.2: A 85 LYS NZ :NH3+ 149:sc= 0.988 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 170:sc= -0.033 (180deg=-0.142) USER MOD Single : A 2 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 3 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN :FLIP amide:sc= -1.13 F(o=-1.8,f=-1.1) USER MOD Single : A 14 LYS NZ :NH3+ 168:sc= -0.0497 (180deg=-0.0607) USER MOD Single : A 20 GLN : amide:sc= 0.842 K(o=0.84,f=-0.093) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -2.5 K(o=-2.5,f=-6.5!) USER MOD Single : A 28 SER OG : rot -68:sc= 1.2 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -143:sc= 0.0429 (180deg=0) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 37 ASN : amide:sc= -0.0135 X(o=-0.014,f=-0.29) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.0111 USER MOD Single : A 42 THR OG1 : rot 147:sc= 1.77 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 137:sc= 0.00383 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 MET CE :methyl -152:sc= -1.87 (180deg=-5.82!) USER MOD Single : A 59 SER OG : rot 180:sc= 0.00504 USER MOD Single : A 64 THR OG1 : rot 88:sc= 0.854 USER MOD Single : A 70 LYS NZ :NH3+ 168:sc= -0.0177 (180deg=-0.177) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot -87:sc= -1.59! USER MOD Single : A 83 SER OG : rot 122:sc= 1.28 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot 76:sc= 0.938 USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=-0.048) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot 112:sc= 0.687 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0.00507 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.529 -18.772 11.022 1.00 0.00 N ATOM 2 CA MET A 1 6.103 -18.965 9.632 1.00 0.00 C ATOM 3 C MET A 1 5.413 -17.702 9.127 1.00 0.00 C ATOM 4 O MET A 1 4.339 -17.340 9.603 1.00 0.00 O ATOM 5 CB MET A 1 5.273 -20.243 9.454 1.00 0.00 C ATOM 6 CG MET A 1 3.991 -20.371 10.288 1.00 0.00 C ATOM 7 SD MET A 1 2.462 -20.115 9.349 1.00 0.00 S ATOM 8 CE MET A 1 1.257 -20.823 10.499 1.00 0.00 C ATOM 0 H1 MET A 1 6.844 -19.681 11.418 1.00 0.00 H new ATOM 0 H2 MET A 1 7.314 -18.090 11.053 1.00 0.00 H new ATOM 0 H3 MET A 1 5.732 -18.408 11.582 1.00 0.00 H new ATOM 0 HA MET A 1 6.981 -19.123 9.006 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.001 -20.325 8.402 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.912 -21.095 9.685 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.964 -21.362 10.741 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.028 -19.649 11.103 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.257 -20.745 10.072 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.496 -21.872 10.676 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.291 -20.279 11.443 1.00 0.00 H new ATOM 16 N ASN A 2 6.061 -16.983 8.204 1.00 0.00 N ATOM 17 CA ASN A 2 5.533 -15.828 7.468 1.00 0.00 C ATOM 18 C ASN A 2 6.200 -15.768 6.095 1.00 0.00 C ATOM 19 O ASN A 2 7.220 -16.434 5.901 1.00 0.00 O ATOM 20 CB ASN A 2 5.715 -14.523 8.276 1.00 0.00 C ATOM 21 CG ASN A 2 7.110 -14.240 8.830 1.00 0.00 C ATOM 22 OD1 ASN A 2 8.121 -14.745 8.359 1.00 0.00 O ATOM 23 ND2 ASN A 2 7.196 -13.463 9.898 1.00 0.00 N ATOM 0 H ASN A 2 7.020 -17.203 7.935 1.00 0.00 H new ATOM 0 HA ASN A 2 4.459 -15.942 7.321 1.00 0.00 H new ATOM 0 HB2 ASN A 2 5.427 -13.687 7.639 1.00 0.00 H new ATOM 0 HB3 ASN A 2 5.016 -14.542 9.112 1.00 0.00 H new ATOM 0 HD21 ASN A 2 8.104 -13.285 10.328 1.00 0.00 H new ATOM 0 HD22 ASN A 2 6.354 -13.042 10.291 1.00 0.00 H new ATOM 29 N ASN A 3 5.611 -15.045 5.142 1.00 0.00 N ATOM 30 CA ASN A 3 6.140 -14.907 3.776 1.00 0.00 C ATOM 31 C ASN A 3 5.339 -13.797 3.023 1.00 0.00 C ATOM 32 O ASN A 3 4.777 -14.076 1.959 1.00 0.00 O ATOM 33 CB ASN A 3 6.050 -16.230 3.000 1.00 0.00 C ATOM 34 CG ASN A 3 7.037 -16.243 1.852 1.00 0.00 C ATOM 35 OD1 ASN A 3 8.244 -16.314 2.059 1.00 0.00 O ATOM 36 ND2 ASN A 3 6.583 -16.276 0.619 1.00 0.00 N ATOM 0 H ASN A 3 4.743 -14.531 5.294 1.00 0.00 H new ATOM 0 HA ASN A 3 7.192 -14.631 3.842 1.00 0.00 H new ATOM 0 HB2 ASN A 3 6.253 -17.065 3.670 1.00 0.00 H new ATOM 0 HB3 ASN A 3 5.038 -16.366 2.618 1.00 0.00 H new ATOM 0 HD21 ASN A 3 7.234 -16.360 -0.162 1.00 0.00 H new ATOM 0 HD22 ASN A 3 5.580 -16.217 0.443 1.00 0.00 H new ATOM 42 N LEU A 4 5.250 -12.581 3.589 1.00 0.00 N ATOM 43 CA LEU A 4 4.381 -11.480 3.285 1.00 0.00 C ATOM 44 C LEU A 4 2.886 -11.831 3.294 1.00 0.00 C ATOM 45 O LEU A 4 2.502 -12.976 3.061 1.00 0.00 O ATOM 46 CB LEU A 4 4.957 -10.866 2.020 1.00 0.00 C ATOM 47 CG LEU A 4 4.145 -9.789 1.329 1.00 0.00 C ATOM 48 CD1 LEU A 4 2.993 -10.325 0.484 1.00 0.00 C ATOM 49 CD2 LEU A 4 3.916 -8.479 2.063 1.00 0.00 C ATOM 0 H LEU A 4 5.870 -12.340 4.362 1.00 0.00 H new ATOM 0 HA LEU A 4 4.367 -10.724 4.070 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.933 -10.446 2.265 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.127 -11.670 1.304 1.00 0.00 H new ATOM 0 HG LEU A 4 4.852 -9.408 0.592 1.00 0.00 H new ATOM 0 HD11 LEU A 4 2.461 -9.492 0.023 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.386 -10.979 -0.294 1.00 0.00 H new ATOM 0 HD13 LEU A 4 2.307 -10.887 1.118 1.00 0.00 H new ATOM 0 HD21 LEU A 4 3.319 -7.812 1.440 1.00 0.00 H new ATOM 0 HD22 LEU A 4 3.388 -8.673 2.997 1.00 0.00 H new ATOM 0 HD23 LEU A 4 4.876 -8.011 2.280 1.00 0.00 H new ATOM 60 N LYS A 5 2.080 -10.864 3.709 1.00 0.00 N ATOM 61 CA LYS A 5 0.634 -10.950 3.791 1.00 0.00 C ATOM 62 C LYS A 5 0.011 -9.583 3.998 1.00 0.00 C ATOM 63 O LYS A 5 0.693 -8.565 4.143 1.00 0.00 O ATOM 64 CB LYS A 5 0.180 -11.958 4.878 1.00 0.00 C ATOM 65 CG LYS A 5 0.432 -11.525 6.323 1.00 0.00 C ATOM 66 CD LYS A 5 -0.137 -12.479 7.368 1.00 0.00 C ATOM 67 CE LYS A 5 -1.645 -12.276 7.477 1.00 0.00 C ATOM 68 NZ LYS A 5 -2.184 -12.895 8.701 1.00 0.00 N ATOM 0 H LYS A 5 2.436 -9.957 4.011 1.00 0.00 H new ATOM 0 HA LYS A 5 0.275 -11.330 2.835 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -0.887 -12.144 4.754 1.00 0.00 H new ATOM 0 HB3 LYS A 5 0.691 -12.905 4.706 1.00 0.00 H new ATOM 0 HG2 LYS A 5 1.506 -11.430 6.480 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -0.001 -10.536 6.475 1.00 0.00 H new ATOM 0 HD2 LYS A 5 0.083 -13.510 7.092 1.00 0.00 H new ATOM 0 HD3 LYS A 5 0.335 -12.300 8.334 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -1.871 -11.210 7.477 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -2.136 -12.706 6.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -3.211 -12.739 8.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.989 -13.916 8.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -1.733 -12.467 9.534 1.00 0.00 H new ATOM 78 N LEU A 6 -1.319 -9.585 4.034 1.00 0.00 N ATOM 79 CA LEU A 6 -2.189 -8.517 4.441 1.00 0.00 C ATOM 80 C LEU A 6 -3.031 -8.981 5.614 1.00 0.00 C ATOM 81 O LEU A 6 -3.140 -10.177 5.884 1.00 0.00 O ATOM 82 CB LEU A 6 -3.053 -8.171 3.238 1.00 0.00 C ATOM 83 CG LEU A 6 -2.434 -7.081 2.366 1.00 0.00 C ATOM 84 CD1 LEU A 6 -3.125 -6.940 1.029 1.00 0.00 C ATOM 85 CD2 LEU A 6 -2.288 -5.760 3.063 1.00 0.00 C ATOM 0 H LEU A 6 -1.848 -10.411 3.752 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.634 -7.636 4.763 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -3.209 -9.067 2.637 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -4.034 -7.843 3.582 1.00 0.00 H new ATOM 0 HG LEU A 6 -1.419 -7.425 2.166 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -2.643 -6.151 0.452 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -3.058 -7.881 0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -4.173 -6.686 1.186 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -1.842 -5.036 2.381 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -3.269 -5.404 3.378 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.647 -5.878 3.937 1.00 0.00 H new ATOM 96 N ASP A 7 -3.645 -8.011 6.278 1.00 0.00 N ATOM 97 CA ASP A 7 -4.473 -8.209 7.473 1.00 0.00 C ATOM 98 C ASP A 7 -5.911 -7.751 7.272 1.00 0.00 C ATOM 99 O ASP A 7 -6.845 -8.445 7.671 1.00 0.00 O ATOM 100 CB ASP A 7 -3.909 -7.346 8.606 1.00 0.00 C ATOM 101 CG ASP A 7 -3.179 -8.157 9.656 1.00 0.00 C ATOM 102 OD1 ASP A 7 -2.177 -8.807 9.281 1.00 0.00 O ATOM 103 OD2 ASP A 7 -3.489 -8.019 10.856 1.00 0.00 O ATOM 0 H ASP A 7 -3.582 -7.033 5.996 1.00 0.00 H new ATOM 0 HA ASP A 7 -4.460 -9.276 7.694 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -3.228 -6.605 8.187 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -4.724 -6.798 9.079 1.00 0.00 H new ATOM 107 N ILE A 8 -6.026 -6.552 6.685 1.00 0.00 N ATOM 108 CA ILE A 8 -7.214 -5.761 6.369 1.00 0.00 C ATOM 109 C ILE A 8 -8.108 -5.410 7.574 1.00 0.00 C ATOM 110 O ILE A 8 -8.468 -6.246 8.389 1.00 0.00 O ATOM 111 CB ILE A 8 -7.938 -6.439 5.191 1.00 0.00 C ATOM 112 CG1 ILE A 8 -7.088 -6.234 3.918 1.00 0.00 C ATOM 113 CG2 ILE A 8 -9.325 -5.839 4.954 1.00 0.00 C ATOM 114 CD1 ILE A 8 -7.465 -7.181 2.782 1.00 0.00 C ATOM 0 H ILE A 8 -5.185 -6.058 6.386 1.00 0.00 H new ATOM 0 HA ILE A 8 -6.900 -4.764 6.060 1.00 0.00 H new ATOM 0 HB ILE A 8 -8.063 -7.496 5.426 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -7.200 -5.205 3.576 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -6.036 -6.375 4.165 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -9.802 -6.345 4.115 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -9.934 -5.967 5.849 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.228 -4.777 4.730 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.830 -6.984 1.918 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.326 -8.212 3.107 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -8.508 -7.024 2.509 1.00 0.00 H new ATOM 125 N VAL A 9 -8.521 -4.141 7.674 1.00 0.00 N ATOM 126 CA VAL A 9 -9.397 -3.575 8.701 1.00 0.00 C ATOM 127 C VAL A 9 -10.358 -2.581 8.033 1.00 0.00 C ATOM 128 O VAL A 9 -10.072 -1.403 7.871 1.00 0.00 O ATOM 129 CB VAL A 9 -8.556 -3.010 9.876 1.00 0.00 C ATOM 130 CG1 VAL A 9 -9.434 -2.410 10.982 1.00 0.00 C ATOM 131 CG2 VAL A 9 -7.629 -4.064 10.502 1.00 0.00 C ATOM 0 H VAL A 9 -8.232 -3.438 6.994 1.00 0.00 H new ATOM 0 HA VAL A 9 -10.025 -4.337 9.164 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.946 -2.223 9.433 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -8.800 -2.028 11.782 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -10.031 -1.596 10.571 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -10.095 -3.180 11.379 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -7.065 -3.613 11.319 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -8.226 -4.891 10.886 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -6.938 -4.436 9.746 1.00 0.00 H new ATOM 141 N GLU A 10 -11.489 -3.067 7.530 1.00 0.00 N ATOM 142 CA GLU A 10 -12.515 -2.209 6.946 1.00 0.00 C ATOM 143 C GLU A 10 -13.121 -1.360 8.066 1.00 0.00 C ATOM 144 O GLU A 10 -13.630 -1.922 9.040 1.00 0.00 O ATOM 145 CB GLU A 10 -13.553 -3.093 6.247 1.00 0.00 C ATOM 146 CG GLU A 10 -12.952 -3.861 5.063 1.00 0.00 C ATOM 147 CD GLU A 10 -14.014 -4.718 4.391 1.00 0.00 C ATOM 148 OE1 GLU A 10 -14.735 -4.181 3.510 1.00 0.00 O ATOM 149 OE2 GLU A 10 -14.146 -5.909 4.730 1.00 0.00 O ATOM 0 H GLU A 10 -11.719 -4.061 7.515 1.00 0.00 H new ATOM 0 HA GLU A 10 -12.104 -1.532 6.197 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -13.968 -3.801 6.965 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -14.378 -2.474 5.896 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.532 -3.159 4.342 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.133 -4.491 5.409 1.00 0.00 H new ATOM 154 N GLN A 11 -13.016 -0.030 7.942 1.00 0.00 N ATOM 155 CA GLN A 11 -13.482 0.938 8.929 1.00 0.00 C ATOM 156 C GLN A 11 -14.971 1.272 8.672 1.00 0.00 C ATOM 157 O GLN A 11 -15.716 0.418 8.205 1.00 0.00 O ATOM 158 CB GLN A 11 -12.572 2.185 8.940 1.00 0.00 C ATOM 159 CG GLN A 11 -12.185 2.707 10.334 1.00 0.00 C ATOM 160 CD GLN A 11 -13.339 2.702 11.330 1.00 0.00 C ATOM 161 OE1 GLN A 11 -14.125 3.761 11.404 1.00 0.00 O flip ATOM 162 NE2 GLN A 11 -13.564 1.703 12.001 1.00 0.00 N flip ATOM 0 H GLN A 11 -12.591 0.409 7.126 1.00 0.00 H new ATOM 0 HA GLN A 11 -13.418 0.507 9.928 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -11.659 1.953 8.391 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -13.075 2.986 8.398 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -11.373 2.096 10.729 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -11.803 3.723 10.239 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -12.948 0.893 11.933 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -14.368 1.680 12.628 1.00 0.00 H new ATOM 169 N ASP A 12 -15.405 2.513 8.916 1.00 0.00 N ATOM 170 CA ASP A 12 -16.684 3.076 8.467 1.00 0.00 C ATOM 171 C ASP A 12 -16.690 3.218 6.943 1.00 0.00 C ATOM 172 O ASP A 12 -17.534 2.638 6.261 1.00 0.00 O ATOM 173 CB ASP A 12 -16.921 4.485 9.041 1.00 0.00 C ATOM 174 CG ASP A 12 -17.281 4.552 10.516 1.00 0.00 C ATOM 175 OD1 ASP A 12 -18.286 3.898 10.920 1.00 0.00 O ATOM 176 OD2 ASP A 12 -16.576 5.236 11.263 1.00 0.00 O ATOM 0 H ASP A 12 -14.852 3.181 9.454 1.00 0.00 H new ATOM 0 HA ASP A 12 -17.462 2.395 8.813 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -16.020 5.077 8.880 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -17.720 4.958 8.471 1.00 0.00 H new ATOM 180 N ASP A 13 -15.771 4.040 6.417 1.00 0.00 N ATOM 181 CA ASP A 13 -15.758 4.522 5.026 1.00 0.00 C ATOM 182 C ASP A 13 -14.340 4.472 4.426 1.00 0.00 C ATOM 183 O ASP A 13 -14.151 4.622 3.213 1.00 0.00 O ATOM 184 CB ASP A 13 -16.344 5.950 4.962 1.00 0.00 C ATOM 185 CG ASP A 13 -17.376 6.090 3.848 1.00 0.00 C ATOM 186 OD1 ASP A 13 -18.568 5.795 4.104 1.00 0.00 O ATOM 187 OD2 ASP A 13 -17.019 6.518 2.726 1.00 0.00 O ATOM 0 H ASP A 13 -14.990 4.400 6.965 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.381 3.861 4.424 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -16.806 6.196 5.918 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -15.538 6.667 4.803 1.00 0.00 H new ATOM 191 N LYS A 14 -13.329 4.172 5.256 1.00 0.00 N ATOM 192 CA LYS A 14 -11.940 3.972 4.871 1.00 0.00 C ATOM 193 C LYS A 14 -11.634 2.495 5.052 1.00 0.00 C ATOM 194 O LYS A 14 -12.178 1.863 5.955 1.00 0.00 O ATOM 195 CB LYS A 14 -11.039 4.928 5.670 1.00 0.00 C ATOM 196 CG LYS A 14 -10.904 4.662 7.180 1.00 0.00 C ATOM 197 CD LYS A 14 -9.943 5.617 7.898 1.00 0.00 C ATOM 198 CE LYS A 14 -10.301 7.089 7.664 1.00 0.00 C ATOM 199 NZ LYS A 14 -9.564 8.011 8.549 1.00 0.00 N ATOM 0 H LYS A 14 -13.474 4.059 6.259 1.00 0.00 H new ATOM 0 HA LYS A 14 -11.747 4.218 3.827 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -10.042 4.900 5.231 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -11.418 5.941 5.537 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.889 4.739 7.641 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -10.561 3.638 7.329 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.958 5.408 8.968 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.926 5.433 7.552 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -10.092 7.347 6.626 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -11.371 7.225 7.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.689 8.988 8.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.930 7.928 9.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -8.553 7.768 8.538 1.00 0.00 H new ATOM 209 N ALA A 15 -10.875 1.908 4.135 1.00 0.00 N ATOM 210 CA ALA A 15 -10.496 0.506 4.214 1.00 0.00 C ATOM 211 C ALA A 15 -9.039 0.477 4.663 1.00 0.00 C ATOM 212 O ALA A 15 -8.163 0.861 3.876 1.00 0.00 O ATOM 213 CB ALA A 15 -10.751 -0.198 2.867 1.00 0.00 C ATOM 0 H ALA A 15 -10.506 2.392 3.316 1.00 0.00 H new ATOM 0 HA ALA A 15 -11.098 -0.049 4.934 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -10.462 -1.246 2.944 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -11.810 -0.131 2.616 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -10.162 0.285 2.087 1.00 0.00 H new ATOM 219 N ILE A 16 -8.760 0.123 5.925 1.00 0.00 N ATOM 220 CA ILE A 16 -7.365 0.004 6.332 1.00 0.00 C ATOM 221 C ILE A 16 -6.862 -1.304 5.701 1.00 0.00 C ATOM 222 O ILE A 16 -7.484 -2.357 5.860 1.00 0.00 O ATOM 223 CB ILE A 16 -7.252 0.078 7.872 1.00 0.00 C ATOM 224 CG1 ILE A 16 -7.527 1.476 8.466 1.00 0.00 C ATOM 225 CG2 ILE A 16 -5.887 -0.366 8.376 1.00 0.00 C ATOM 226 CD1 ILE A 16 -8.945 1.693 8.954 1.00 0.00 C ATOM 0 H ILE A 16 -9.451 -0.077 6.648 1.00 0.00 H new ATOM 0 HA ILE A 16 -6.734 0.822 5.985 1.00 0.00 H new ATOM 0 HB ILE A 16 -8.031 -0.605 8.210 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -6.842 1.643 9.298 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -7.299 2.227 7.710 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -5.860 -0.295 9.463 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -5.706 -1.398 8.075 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -5.116 0.276 7.951 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -9.042 2.702 9.354 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -9.639 1.563 8.124 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -9.175 0.970 9.736 1.00 0.00 H new ATOM 237 N VAL A 17 -5.766 -1.268 4.951 1.00 0.00 N ATOM 238 CA VAL A 17 -5.086 -2.455 4.397 1.00 0.00 C ATOM 239 C VAL A 17 -3.704 -2.588 5.042 1.00 0.00 C ATOM 240 O VAL A 17 -2.703 -2.065 4.549 1.00 0.00 O ATOM 241 CB VAL A 17 -5.050 -2.367 2.849 1.00 0.00 C ATOM 242 CG1 VAL A 17 -4.472 -3.639 2.208 1.00 0.00 C ATOM 243 CG2 VAL A 17 -6.464 -2.163 2.286 1.00 0.00 C ATOM 0 H VAL A 17 -5.306 -0.393 4.699 1.00 0.00 H new ATOM 0 HA VAL A 17 -5.634 -3.367 4.634 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.409 -1.519 2.607 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -4.467 -3.530 1.123 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -3.453 -3.794 2.562 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -5.086 -4.497 2.484 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -6.418 -2.104 1.199 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -7.096 -3.002 2.577 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.883 -1.238 2.682 1.00 0.00 H new ATOM 253 N ARG A 18 -3.650 -3.249 6.200 1.00 0.00 N ATOM 254 CA ARG A 18 -2.383 -3.385 6.928 1.00 0.00 C ATOM 255 C ARG A 18 -1.552 -4.476 6.275 1.00 0.00 C ATOM 256 O ARG A 18 -2.060 -5.588 6.113 1.00 0.00 O ATOM 257 CB ARG A 18 -2.557 -3.707 8.415 1.00 0.00 C ATOM 258 CG ARG A 18 -3.327 -2.667 9.217 1.00 0.00 C ATOM 259 CD ARG A 18 -3.298 -3.027 10.704 1.00 0.00 C ATOM 260 NE ARG A 18 -3.382 -1.829 11.552 1.00 0.00 N ATOM 261 CZ ARG A 18 -2.346 -1.098 11.975 1.00 0.00 C ATOM 262 NH1 ARG A 18 -1.097 -1.440 11.662 1.00 0.00 N ATOM 263 NH2 ARG A 18 -2.575 -0.032 12.724 1.00 0.00 N ATOM 0 H ARG A 18 -4.452 -3.692 6.649 1.00 0.00 H new ATOM 0 HA ARG A 18 -1.885 -2.417 6.876 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -3.069 -4.665 8.506 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -1.570 -3.830 8.862 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -2.889 -1.681 9.064 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -4.358 -2.616 8.867 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -4.128 -3.695 10.934 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -2.380 -3.570 10.930 1.00 0.00 H new ATOM 0 HE ARG A 18 -4.313 -1.529 11.843 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -0.922 -2.268 11.093 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -0.315 -0.873 11.991 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -3.532 0.222 12.971 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -1.795 0.536 13.055 1.00 0.00 H new ATOM 274 N VAL A 19 -0.323 -4.162 5.861 1.00 0.00 N ATOM 275 CA VAL A 19 0.630 -5.125 5.315 1.00 0.00 C ATOM 276 C VAL A 19 1.429 -5.771 6.437 1.00 0.00 C ATOM 277 O VAL A 19 1.700 -5.138 7.463 1.00 0.00 O ATOM 278 CB VAL A 19 1.500 -4.325 4.324 1.00 0.00 C ATOM 279 CG1 VAL A 19 2.833 -4.985 3.937 1.00 0.00 C ATOM 280 CG2 VAL A 19 0.721 -4.088 3.023 1.00 0.00 C ATOM 0 H VAL A 19 0.043 -3.211 5.897 1.00 0.00 H new ATOM 0 HA VAL A 19 0.149 -5.955 4.798 1.00 0.00 H new ATOM 0 HB VAL A 19 1.737 -3.403 4.855 1.00 0.00 H new ATOM 0 HG11 VAL A 19 3.368 -4.342 3.237 1.00 0.00 H new ATOM 0 HG12 VAL A 19 3.439 -5.132 4.831 1.00 0.00 H new ATOM 0 HG13 VAL A 19 2.639 -5.950 3.468 1.00 0.00 H new ATOM 0 HG21 VAL A 19 1.340 -3.523 2.326 1.00 0.00 H new ATOM 0 HG22 VAL A 19 0.456 -5.047 2.577 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.187 -3.526 3.240 1.00 0.00 H new ATOM 290 N GLN A 20 1.863 -7.007 6.181 1.00 0.00 N ATOM 291 CA GLN A 20 2.880 -7.681 6.989 1.00 0.00 C ATOM 292 C GLN A 20 4.018 -8.206 6.141 1.00 0.00 C ATOM 293 O GLN A 20 3.756 -8.923 5.178 1.00 0.00 O ATOM 294 CB GLN A 20 2.304 -8.905 7.682 1.00 0.00 C ATOM 295 CG GLN A 20 1.230 -8.530 8.708 1.00 0.00 C ATOM 296 CD GLN A 20 1.161 -9.477 9.907 1.00 0.00 C ATOM 297 OE1 GLN A 20 2.107 -9.631 10.682 1.00 0.00 O ATOM 298 NE2 GLN A 20 0.032 -10.123 10.120 1.00 0.00 N ATOM 0 H GLN A 20 1.517 -7.570 5.404 1.00 0.00 H new ATOM 0 HA GLN A 20 3.229 -6.932 7.700 1.00 0.00 H new ATOM 0 HB2 GLN A 20 1.876 -9.576 6.937 1.00 0.00 H new ATOM 0 HB3 GLN A 20 3.106 -9.451 8.179 1.00 0.00 H new ATOM 0 HG2 GLN A 20 1.421 -7.519 9.067 1.00 0.00 H new ATOM 0 HG3 GLN A 20 0.259 -8.514 8.214 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -0.754 -10.000 9.482 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -0.055 -10.746 10.923 1.00 0.00 H new ATOM 305 N GLY A 21 5.248 -7.983 6.582 1.00 0.00 N ATOM 306 CA GLY A 21 6.444 -8.434 5.910 1.00 0.00 C ATOM 307 C GLY A 21 7.072 -7.257 5.199 1.00 0.00 C ATOM 308 O GLY A 21 6.402 -6.268 4.916 1.00 0.00 O ATOM 0 H GLY A 21 5.440 -7.468 7.442 1.00 0.00 H new ATOM 0 HA2 GLY A 21 7.144 -8.859 6.629 1.00 0.00 H new ATOM 0 HA3 GLY A 21 6.203 -9.222 5.196 1.00 0.00 H new ATOM 312 N ASP A 22 8.357 -7.374 4.896 1.00 0.00 N ATOM 313 CA ASP A 22 8.994 -6.628 3.834 1.00 0.00 C ATOM 314 C ASP A 22 8.319 -6.948 2.497 1.00 0.00 C ATOM 315 O ASP A 22 7.750 -8.021 2.303 1.00 0.00 O ATOM 316 CB ASP A 22 10.537 -6.774 3.808 1.00 0.00 C ATOM 317 CG ASP A 22 11.244 -8.036 4.346 1.00 0.00 C ATOM 318 OD1 ASP A 22 10.713 -8.794 5.179 1.00 0.00 O ATOM 319 OD2 ASP A 22 12.476 -8.138 4.089 1.00 0.00 O ATOM 0 H ASP A 22 8.991 -8.001 5.392 1.00 0.00 H new ATOM 0 HA ASP A 22 8.846 -5.567 4.035 1.00 0.00 H new ATOM 0 HB2 ASP A 22 10.847 -6.657 2.770 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.943 -5.926 4.359 1.00 0.00 H new ATOM 323 N ILE A 23 8.324 -5.949 1.617 1.00 0.00 N ATOM 324 CA ILE A 23 7.673 -5.914 0.313 1.00 0.00 C ATOM 325 C ILE A 23 8.771 -6.108 -0.742 1.00 0.00 C ATOM 326 O ILE A 23 9.857 -5.547 -0.603 1.00 0.00 O ATOM 327 CB ILE A 23 6.918 -4.566 0.185 1.00 0.00 C ATOM 328 CG1 ILE A 23 6.117 -4.504 -1.119 1.00 0.00 C ATOM 329 CG2 ILE A 23 7.867 -3.365 0.204 1.00 0.00 C ATOM 330 CD1 ILE A 23 5.300 -3.224 -1.305 1.00 0.00 C ATOM 0 H ILE A 23 8.820 -5.080 1.813 1.00 0.00 H new ATOM 0 HA ILE A 23 6.933 -6.703 0.176 1.00 0.00 H new ATOM 0 HB ILE A 23 6.253 -4.515 1.047 1.00 0.00 H new ATOM 0 HG12 ILE A 23 6.806 -4.605 -1.958 1.00 0.00 H new ATOM 0 HG13 ILE A 23 5.442 -5.359 -1.156 1.00 0.00 H new ATOM 0 HG21 ILE A 23 7.291 -2.444 0.112 1.00 0.00 H new ATOM 0 HG22 ILE A 23 8.421 -3.354 1.143 1.00 0.00 H new ATOM 0 HG23 ILE A 23 8.566 -3.441 -0.629 1.00 0.00 H new ATOM 0 HD11 ILE A 23 4.766 -3.268 -2.254 1.00 0.00 H new ATOM 0 HD12 ILE A 23 4.583 -3.128 -0.490 1.00 0.00 H new ATOM 0 HD13 ILE A 23 5.968 -2.363 -1.304 1.00 0.00 H new ATOM 341 N ASP A 24 8.529 -6.866 -1.805 1.00 0.00 N ATOM 342 CA ASP A 24 9.573 -7.281 -2.732 1.00 0.00 C ATOM 343 C ASP A 24 9.019 -8.058 -3.924 1.00 0.00 C ATOM 344 O ASP A 24 7.804 -8.152 -4.108 1.00 0.00 O ATOM 345 CB ASP A 24 10.724 -8.042 -2.040 1.00 0.00 C ATOM 346 CG ASP A 24 10.351 -9.195 -1.114 1.00 0.00 C ATOM 347 OD1 ASP A 24 9.324 -9.855 -1.359 1.00 0.00 O ATOM 348 OD2 ASP A 24 11.160 -9.472 -0.195 1.00 0.00 O ATOM 0 H ASP A 24 7.600 -7.211 -2.048 1.00 0.00 H new ATOM 0 HA ASP A 24 10.003 -6.359 -3.123 1.00 0.00 H new ATOM 0 HB2 ASP A 24 11.382 -8.433 -2.816 1.00 0.00 H new ATOM 0 HB3 ASP A 24 11.304 -7.322 -1.463 1.00 0.00 H new ATOM 352 N ALA A 25 9.899 -8.562 -4.798 1.00 0.00 N ATOM 353 CA ALA A 25 9.508 -9.278 -5.996 1.00 0.00 C ATOM 354 C ALA A 25 8.626 -10.485 -5.677 1.00 0.00 C ATOM 355 O ALA A 25 7.844 -10.872 -6.545 1.00 0.00 O ATOM 356 CB ALA A 25 10.745 -9.713 -6.780 1.00 0.00 C ATOM 0 H ALA A 25 10.909 -8.478 -4.683 1.00 0.00 H new ATOM 0 HA ALA A 25 8.918 -8.597 -6.609 1.00 0.00 H new ATOM 0 HB1 ALA A 25 10.437 -10.250 -7.677 1.00 0.00 H new ATOM 0 HB2 ALA A 25 11.324 -8.834 -7.064 1.00 0.00 H new ATOM 0 HB3 ALA A 25 11.358 -10.366 -6.159 1.00 0.00 H new ATOM 362 N TYR A 26 8.708 -11.082 -4.485 1.00 0.00 N ATOM 363 CA TYR A 26 7.862 -12.217 -4.112 1.00 0.00 C ATOM 364 C TYR A 26 6.385 -11.845 -4.072 1.00 0.00 C ATOM 365 O TYR A 26 5.515 -12.683 -4.300 1.00 0.00 O ATOM 366 CB TYR A 26 8.266 -12.743 -2.736 1.00 0.00 C ATOM 367 CG TYR A 26 9.621 -13.403 -2.768 1.00 0.00 C ATOM 368 CD1 TYR A 26 9.672 -14.723 -3.221 1.00 0.00 C ATOM 369 CD2 TYR A 26 10.813 -12.709 -2.478 1.00 0.00 C ATOM 370 CE1 TYR A 26 10.900 -15.356 -3.406 1.00 0.00 C ATOM 371 CE2 TYR A 26 12.059 -13.330 -2.690 1.00 0.00 C ATOM 372 CZ TYR A 26 12.103 -14.655 -3.184 1.00 0.00 C ATOM 373 OH TYR A 26 13.287 -15.260 -3.473 1.00 0.00 O ATOM 0 H TYR A 26 9.359 -10.793 -3.755 1.00 0.00 H new ATOM 0 HA TYR A 26 8.006 -12.983 -4.874 1.00 0.00 H new ATOM 0 HB2 TYR A 26 8.279 -11.920 -2.021 1.00 0.00 H new ATOM 0 HB3 TYR A 26 7.521 -13.458 -2.386 1.00 0.00 H new ATOM 0 HD1 TYR A 26 8.756 -15.256 -3.429 1.00 0.00 H new ATOM 0 HD2 TYR A 26 10.771 -11.701 -2.093 1.00 0.00 H new ATOM 0 HE1 TYR A 26 10.930 -16.389 -3.721 1.00 0.00 H new ATOM 0 HE2 TYR A 26 12.975 -12.798 -2.477 1.00 0.00 H new ATOM 0 HH TYR A 26 14.025 -14.649 -3.267 1.00 0.00 H new ATOM 382 N ASN A 27 6.103 -10.579 -3.794 1.00 0.00 N ATOM 383 CA ASN A 27 4.769 -10.049 -3.595 1.00 0.00 C ATOM 384 C ASN A 27 4.410 -9.001 -4.622 1.00 0.00 C ATOM 385 O ASN A 27 3.267 -8.551 -4.676 1.00 0.00 O ATOM 386 CB ASN A 27 4.612 -9.546 -2.178 1.00 0.00 C ATOM 387 CG ASN A 27 5.724 -8.611 -1.778 1.00 0.00 C ATOM 388 OD1 ASN A 27 5.721 -7.452 -2.162 1.00 0.00 O ATOM 389 ND2 ASN A 27 6.690 -9.141 -1.054 1.00 0.00 N ATOM 0 H ASN A 27 6.829 -9.869 -3.698 1.00 0.00 H new ATOM 0 HA ASN A 27 4.057 -10.861 -3.743 1.00 0.00 H new ATOM 0 HB2 ASN A 27 3.655 -9.032 -2.081 1.00 0.00 H new ATOM 0 HB3 ASN A 27 4.589 -10.394 -1.494 1.00 0.00 H new ATOM 0 HD21 ASN A 27 7.494 -8.575 -0.784 1.00 0.00 H new ATOM 0 HD22 ASN A 27 6.633 -10.117 -0.764 1.00 0.00 H new ATOM 395 N SER A 28 5.351 -8.734 -5.513 1.00 0.00 N ATOM 396 CA SER A 28 5.101 -8.073 -6.788 1.00 0.00 C ATOM 397 C SER A 28 3.969 -8.701 -7.632 1.00 0.00 C ATOM 398 O SER A 28 3.515 -8.071 -8.593 1.00 0.00 O ATOM 399 CB SER A 28 6.385 -7.858 -7.592 1.00 0.00 C ATOM 400 OG SER A 28 6.898 -9.025 -8.214 1.00 0.00 O ATOM 0 H SER A 28 6.332 -8.975 -5.369 1.00 0.00 H new ATOM 0 HA SER A 28 4.720 -7.088 -6.518 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.196 -7.107 -8.359 1.00 0.00 H new ATOM 0 HB3 SER A 28 7.148 -7.451 -6.929 1.00 0.00 H new ATOM 0 HG SER A 28 7.223 -9.645 -7.528 1.00 0.00 H new ATOM 405 N SER A 29 3.452 -9.888 -7.272 1.00 0.00 N ATOM 406 CA SER A 29 2.077 -10.256 -7.587 1.00 0.00 C ATOM 407 C SER A 29 1.228 -10.569 -6.367 1.00 0.00 C ATOM 408 O SER A 29 0.067 -10.193 -6.414 1.00 0.00 O ATOM 409 CB SER A 29 1.976 -11.316 -8.689 1.00 0.00 C ATOM 410 OG SER A 29 2.842 -12.414 -8.488 1.00 0.00 O ATOM 0 H SER A 29 3.972 -10.603 -6.763 1.00 0.00 H new ATOM 0 HA SER A 29 1.632 -9.354 -8.007 1.00 0.00 H new ATOM 0 HB2 SER A 29 0.949 -11.677 -8.743 1.00 0.00 H new ATOM 0 HB3 SER A 29 2.203 -10.854 -9.650 1.00 0.00 H new ATOM 0 HG SER A 29 2.732 -13.056 -9.220 1.00 0.00 H new ATOM 415 N GLU A 30 1.789 -11.132 -5.293 1.00 0.00 N ATOM 416 CA GLU A 30 1.054 -11.457 -4.073 1.00 0.00 C ATOM 417 C GLU A 30 0.234 -10.262 -3.605 1.00 0.00 C ATOM 418 O GLU A 30 -0.982 -10.244 -3.756 1.00 0.00 O ATOM 419 CB GLU A 30 1.964 -12.061 -2.968 1.00 0.00 C ATOM 420 CG GLU A 30 1.186 -12.936 -1.983 1.00 0.00 C ATOM 421 CD GLU A 30 1.587 -14.406 -2.069 1.00 0.00 C ATOM 422 OE1 GLU A 30 1.326 -15.061 -3.095 1.00 0.00 O ATOM 423 OE2 GLU A 30 2.157 -14.940 -1.095 1.00 0.00 O ATOM 0 H GLU A 30 2.778 -11.377 -5.248 1.00 0.00 H new ATOM 0 HA GLU A 30 0.346 -12.252 -4.309 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.751 -12.655 -3.434 1.00 0.00 H new ATOM 0 HB3 GLU A 30 2.454 -11.254 -2.424 1.00 0.00 H new ATOM 0 HG2 GLU A 30 1.355 -12.575 -0.969 1.00 0.00 H new ATOM 0 HG3 GLU A 30 0.118 -12.841 -2.182 1.00 0.00 H new ATOM 428 N LEU A 31 0.889 -9.202 -3.152 1.00 0.00 N ATOM 429 CA LEU A 31 0.277 -7.963 -2.723 1.00 0.00 C ATOM 430 C LEU A 31 -0.567 -7.342 -3.828 1.00 0.00 C ATOM 431 O LEU A 31 -1.650 -6.836 -3.566 1.00 0.00 O ATOM 432 CB LEU A 31 1.387 -6.983 -2.293 1.00 0.00 C ATOM 433 CG LEU A 31 0.844 -5.642 -1.763 1.00 0.00 C ATOM 434 CD1 LEU A 31 -0.006 -5.903 -0.515 1.00 0.00 C ATOM 435 CD2 LEU A 31 1.993 -4.682 -1.424 1.00 0.00 C ATOM 0 H LEU A 31 1.906 -9.187 -3.072 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.387 -8.174 -1.885 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.996 -7.451 -1.520 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.042 -6.791 -3.143 1.00 0.00 H new ATOM 0 HG LEU A 31 0.233 -5.177 -2.537 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.394 -4.958 -0.135 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -0.838 -6.559 -0.772 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.608 -6.378 0.250 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.584 -3.742 -1.052 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.628 -5.130 -0.659 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.584 -4.491 -2.320 1.00 0.00 H new ATOM 446 N LYS A 32 -0.085 -7.386 -5.068 1.00 0.00 N ATOM 447 CA LYS A 32 -0.760 -6.771 -6.210 1.00 0.00 C ATOM 448 C LYS A 32 -2.156 -7.371 -6.372 1.00 0.00 C ATOM 449 O LYS A 32 -3.127 -6.628 -6.517 1.00 0.00 O ATOM 450 CB LYS A 32 0.092 -6.981 -7.476 1.00 0.00 C ATOM 451 CG LYS A 32 -0.172 -5.855 -8.484 1.00 0.00 C ATOM 452 CD LYS A 32 0.904 -5.769 -9.571 1.00 0.00 C ATOM 453 CE LYS A 32 1.195 -7.094 -10.275 1.00 0.00 C ATOM 454 NZ LYS A 32 2.336 -6.976 -11.201 1.00 0.00 N ATOM 0 H LYS A 32 0.789 -7.852 -5.311 1.00 0.00 H new ATOM 0 HA LYS A 32 -0.874 -5.700 -6.044 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.149 -7.003 -7.212 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -0.144 -7.945 -7.926 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.144 -6.013 -8.952 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.224 -4.904 -7.954 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.594 -5.036 -10.316 1.00 0.00 H new ATOM 0 HD3 LYS A 32 1.826 -5.398 -9.124 1.00 0.00 H new ATOM 0 HE2 LYS A 32 1.406 -7.863 -9.532 1.00 0.00 H new ATOM 0 HE3 LYS A 32 0.311 -7.417 -10.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.157 -7.552 -12.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 2.456 -5.981 -11.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 3.201 -7.311 -10.731 1.00 0.00 H new ATOM 464 N GLU A 33 -2.272 -8.699 -6.326 1.00 0.00 N ATOM 465 CA GLU A 33 -3.539 -9.397 -6.469 1.00 0.00 C ATOM 466 C GLU A 33 -4.371 -9.201 -5.216 1.00 0.00 C ATOM 467 O GLU A 33 -5.544 -8.856 -5.335 1.00 0.00 O ATOM 468 CB GLU A 33 -3.307 -10.878 -6.803 1.00 0.00 C ATOM 469 CG GLU A 33 -3.185 -11.006 -8.324 1.00 0.00 C ATOM 470 CD GLU A 33 -2.636 -12.365 -8.756 1.00 0.00 C ATOM 471 OE1 GLU A 33 -1.401 -12.578 -8.609 1.00 0.00 O ATOM 472 OE2 GLU A 33 -3.419 -13.187 -9.248 1.00 0.00 O ATOM 0 H GLU A 33 -1.477 -9.322 -6.187 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.099 -8.978 -7.305 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.402 -11.241 -6.316 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -4.133 -11.486 -6.434 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.164 -10.853 -8.778 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.532 -10.218 -8.700 1.00 0.00 H new ATOM 477 N GLN A 34 -3.760 -9.316 -4.033 1.00 0.00 N ATOM 478 CA GLN A 34 -4.424 -9.118 -2.747 1.00 0.00 C ATOM 479 C GLN A 34 -4.978 -7.694 -2.611 1.00 0.00 C ATOM 480 O GLN A 34 -5.764 -7.456 -1.697 1.00 0.00 O ATOM 481 CB GLN A 34 -3.442 -9.427 -1.597 1.00 0.00 C ATOM 482 CG GLN A 34 -2.916 -10.867 -1.580 1.00 0.00 C ATOM 483 CD GLN A 34 -3.711 -11.855 -0.725 1.00 0.00 C ATOM 484 OE1 GLN A 34 -4.042 -11.605 0.432 1.00 0.00 O ATOM 485 NE2 GLN A 34 -4.032 -13.014 -1.272 1.00 0.00 N ATOM 0 H GLN A 34 -2.772 -9.554 -3.944 1.00 0.00 H new ATOM 0 HA GLN A 34 -5.269 -9.804 -2.693 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -2.595 -8.745 -1.667 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -3.938 -9.224 -0.648 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -2.894 -11.238 -2.605 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -1.886 -10.854 -1.223 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -3.756 -13.219 -2.232 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -4.556 -13.704 -0.734 1.00 0.00 H new ATOM 492 N LEU A 35 -4.611 -6.765 -3.507 1.00 0.00 N ATOM 493 CA LEU A 35 -5.178 -5.437 -3.575 1.00 0.00 C ATOM 494 C LEU A 35 -6.109 -5.323 -4.751 1.00 0.00 C ATOM 495 O LEU A 35 -7.184 -4.823 -4.520 1.00 0.00 O ATOM 496 CB LEU A 35 -4.133 -4.355 -3.752 1.00 0.00 C ATOM 497 CG LEU A 35 -3.258 -4.093 -2.521 1.00 0.00 C ATOM 498 CD1 LEU A 35 -2.015 -3.275 -2.871 1.00 0.00 C ATOM 499 CD2 LEU A 35 -4.068 -3.335 -1.456 1.00 0.00 C ATOM 0 H LEU A 35 -3.895 -6.934 -4.214 1.00 0.00 H new ATOM 0 HA LEU A 35 -5.694 -5.294 -2.626 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.487 -4.627 -4.587 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.635 -3.427 -4.027 1.00 0.00 H new ATOM 0 HG LEU A 35 -2.937 -5.061 -2.137 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -1.422 -3.111 -1.971 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.418 -3.816 -3.605 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -2.317 -2.314 -3.286 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.441 -3.152 -0.584 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.407 -2.383 -1.866 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.932 -3.932 -1.163 1.00 0.00 H new ATOM 510 N ARG A 36 -5.784 -5.683 -5.998 1.00 0.00 N ATOM 511 CA ARG A 36 -6.738 -5.417 -7.082 1.00 0.00 C ATOM 512 C ARG A 36 -8.022 -6.221 -6.908 1.00 0.00 C ATOM 513 O ARG A 36 -9.104 -5.726 -7.222 1.00 0.00 O ATOM 514 CB ARG A 36 -6.133 -5.610 -8.471 1.00 0.00 C ATOM 515 CG ARG A 36 -5.679 -7.021 -8.855 1.00 0.00 C ATOM 516 CD ARG A 36 -5.490 -7.096 -10.383 1.00 0.00 C ATOM 517 NE ARG A 36 -5.774 -8.431 -10.929 1.00 0.00 N ATOM 518 CZ ARG A 36 -5.252 -8.974 -12.036 1.00 0.00 C ATOM 519 NH1 ARG A 36 -4.354 -8.314 -12.768 1.00 0.00 N ATOM 520 NH2 ARG A 36 -5.664 -10.180 -12.398 1.00 0.00 N ATOM 0 H ARG A 36 -4.913 -6.137 -6.275 1.00 0.00 H new ATOM 0 HA ARG A 36 -6.996 -4.360 -7.010 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -6.867 -5.281 -9.206 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -5.274 -4.945 -8.559 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -4.745 -7.266 -8.349 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -6.418 -7.754 -8.532 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -6.144 -6.367 -10.861 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -4.466 -6.817 -10.632 1.00 0.00 H new ATOM 0 HE ARG A 36 -6.439 -9.004 -10.410 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -4.054 -7.380 -12.487 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -3.967 -8.743 -13.608 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -6.361 -10.670 -11.838 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -5.284 -10.618 -13.237 1.00 0.00 H new ATOM 531 N ASN A 37 -7.896 -7.429 -6.366 1.00 0.00 N ATOM 532 CA ASN A 37 -9.014 -8.290 -6.041 1.00 0.00 C ATOM 533 C ASN A 37 -9.800 -7.630 -4.909 1.00 0.00 C ATOM 534 O ASN A 37 -11.022 -7.512 -4.996 1.00 0.00 O ATOM 535 CB ASN A 37 -8.480 -9.677 -5.651 1.00 0.00 C ATOM 536 CG ASN A 37 -9.562 -10.613 -5.137 1.00 0.00 C ATOM 537 OD1 ASN A 37 -9.952 -10.529 -3.977 1.00 0.00 O ATOM 538 ND2 ASN A 37 -10.027 -11.558 -5.928 1.00 0.00 N ATOM 0 H ASN A 37 -6.991 -7.840 -6.138 1.00 0.00 H new ATOM 0 HA ASN A 37 -9.682 -8.427 -6.891 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -7.998 -10.130 -6.517 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -7.714 -9.562 -4.884 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -10.715 -12.224 -5.577 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.699 -11.623 -6.892 1.00 0.00 H new ATOM 544 N PHE A 38 -9.091 -7.152 -3.882 1.00 0.00 N ATOM 545 CA PHE A 38 -9.684 -6.526 -2.721 1.00 0.00 C ATOM 546 C PHE A 38 -10.353 -5.222 -3.098 1.00 0.00 C ATOM 547 O PHE A 38 -11.496 -5.033 -2.736 1.00 0.00 O ATOM 548 CB PHE A 38 -8.655 -6.300 -1.618 1.00 0.00 C ATOM 549 CG PHE A 38 -9.087 -5.348 -0.518 1.00 0.00 C ATOM 550 CD1 PHE A 38 -9.892 -5.814 0.537 1.00 0.00 C ATOM 551 CD2 PHE A 38 -8.663 -4.003 -0.540 1.00 0.00 C ATOM 552 CE1 PHE A 38 -10.243 -4.945 1.584 1.00 0.00 C ATOM 553 CE2 PHE A 38 -9.025 -3.135 0.505 1.00 0.00 C ATOM 554 CZ PHE A 38 -9.794 -3.618 1.575 1.00 0.00 C ATOM 0 H PHE A 38 -8.073 -7.195 -3.844 1.00 0.00 H new ATOM 0 HA PHE A 38 -10.442 -7.207 -2.333 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -8.410 -7.262 -1.169 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -7.740 -5.917 -2.070 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -10.239 -6.837 0.542 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -8.060 -3.640 -1.359 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -10.859 -5.300 2.396 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -8.713 -2.101 0.484 1.00 0.00 H new ATOM 0 HZ PHE A 38 -10.041 -2.962 2.397 1.00 0.00 H new ATOM 563 N ILE A 39 -9.692 -4.321 -3.820 1.00 0.00 N ATOM 564 CA ILE A 39 -10.254 -3.071 -4.323 1.00 0.00 C ATOM 565 C ILE A 39 -11.574 -3.286 -5.071 1.00 0.00 C ATOM 566 O ILE A 39 -12.400 -2.371 -5.092 1.00 0.00 O ATOM 567 CB ILE A 39 -9.169 -2.388 -5.181 1.00 0.00 C ATOM 568 CG1 ILE A 39 -8.232 -1.597 -4.241 1.00 0.00 C ATOM 569 CG2 ILE A 39 -9.692 -1.472 -6.300 1.00 0.00 C ATOM 570 CD1 ILE A 39 -6.860 -1.316 -4.852 1.00 0.00 C ATOM 0 H ILE A 39 -8.714 -4.446 -4.080 1.00 0.00 H new ATOM 0 HA ILE A 39 -10.523 -2.415 -3.495 1.00 0.00 H new ATOM 0 HB ILE A 39 -8.644 -3.186 -5.706 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.706 -0.651 -3.979 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.102 -2.156 -3.314 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -8.850 -1.042 -6.842 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -10.308 -2.052 -6.987 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.290 -0.671 -5.865 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -6.252 -0.758 -4.140 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -6.367 -2.259 -5.089 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -6.981 -0.731 -5.764 1.00 0.00 H new ATOM 581 N SER A 40 -11.788 -4.453 -5.677 1.00 0.00 N ATOM 582 CA SER A 40 -13.054 -4.784 -6.300 1.00 0.00 C ATOM 583 C SER A 40 -14.104 -5.117 -5.227 1.00 0.00 C ATOM 584 O SER A 40 -15.184 -4.525 -5.237 1.00 0.00 O ATOM 585 CB SER A 40 -12.816 -5.884 -7.329 1.00 0.00 C ATOM 586 OG SER A 40 -13.675 -5.689 -8.432 1.00 0.00 O ATOM 0 H SER A 40 -11.086 -5.189 -5.746 1.00 0.00 H new ATOM 0 HA SER A 40 -13.469 -3.934 -6.842 1.00 0.00 H new ATOM 0 HB2 SER A 40 -11.777 -5.871 -7.657 1.00 0.00 H new ATOM 0 HB3 SER A 40 -12.997 -6.861 -6.881 1.00 0.00 H new ATOM 0 HG SER A 40 -13.522 -6.394 -9.095 1.00 0.00 H new ATOM 591 N THR A 41 -13.781 -5.968 -4.246 1.00 0.00 N ATOM 592 CA THR A 41 -14.598 -6.224 -3.073 1.00 0.00 C ATOM 593 C THR A 41 -14.927 -4.925 -2.319 1.00 0.00 C ATOM 594 O THR A 41 -16.069 -4.718 -1.911 1.00 0.00 O ATOM 595 CB THR A 41 -13.832 -7.202 -2.179 1.00 0.00 C ATOM 596 OG1 THR A 41 -13.371 -8.333 -2.896 1.00 0.00 O ATOM 597 CG2 THR A 41 -14.643 -7.675 -0.976 1.00 0.00 C ATOM 0 H THR A 41 -12.917 -6.509 -4.255 1.00 0.00 H new ATOM 0 HA THR A 41 -15.554 -6.654 -3.373 1.00 0.00 H new ATOM 0 HB THR A 41 -12.977 -6.634 -1.813 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.886 -8.930 -2.289 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.044 -8.366 -0.382 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.920 -6.817 -0.364 1.00 0.00 H new ATOM 0 HG23 THR A 41 -15.545 -8.181 -1.321 1.00 0.00 H new ATOM 605 N THR A 42 -13.928 -4.073 -2.089 1.00 0.00 N ATOM 606 CA THR A 42 -13.891 -3.141 -0.980 1.00 0.00 C ATOM 607 C THR A 42 -15.052 -2.140 -1.043 1.00 0.00 C ATOM 608 O THR A 42 -15.191 -1.340 -1.971 1.00 0.00 O ATOM 609 CB THR A 42 -12.471 -2.554 -0.871 1.00 0.00 C ATOM 610 OG1 THR A 42 -12.123 -2.254 0.458 1.00 0.00 O ATOM 611 CG2 THR A 42 -12.191 -1.337 -1.744 1.00 0.00 C ATOM 0 H THR A 42 -13.105 -4.016 -2.688 1.00 0.00 H new ATOM 0 HA THR A 42 -14.071 -3.645 -0.030 1.00 0.00 H new ATOM 0 HB THR A 42 -11.845 -3.359 -1.256 1.00 0.00 H new ATOM 0 HG1 THR A 42 -11.161 -2.392 0.583 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.164 -1.006 -1.589 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.333 -1.601 -2.792 1.00 0.00 H new ATOM 0 HG23 THR A 42 -12.876 -0.532 -1.476 1.00 0.00 H new ATOM 619 N SER A 43 -15.923 -2.222 -0.046 1.00 0.00 N ATOM 620 CA SER A 43 -17.052 -1.345 0.212 1.00 0.00 C ATOM 621 C SER A 43 -16.653 0.065 0.684 1.00 0.00 C ATOM 622 O SER A 43 -17.484 0.968 0.673 1.00 0.00 O ATOM 623 CB SER A 43 -17.905 -2.063 1.264 1.00 0.00 C ATOM 624 OG SER A 43 -18.979 -2.780 0.663 1.00 0.00 O ATOM 0 H SER A 43 -15.851 -2.960 0.655 1.00 0.00 H new ATOM 0 HA SER A 43 -17.598 -1.167 -0.715 1.00 0.00 H new ATOM 0 HB2 SER A 43 -17.280 -2.751 1.833 1.00 0.00 H new ATOM 0 HB3 SER A 43 -18.303 -1.335 1.971 1.00 0.00 H new ATOM 0 HG SER A 43 -19.503 -3.228 1.359 1.00 0.00 H new ATOM 629 N LYS A 44 -15.409 0.290 1.099 1.00 0.00 N ATOM 630 CA LYS A 44 -14.869 1.577 1.553 1.00 0.00 C ATOM 631 C LYS A 44 -14.112 2.241 0.405 1.00 0.00 C ATOM 632 O LYS A 44 -13.875 1.602 -0.619 1.00 0.00 O ATOM 633 CB LYS A 44 -13.972 1.279 2.755 1.00 0.00 C ATOM 634 CG LYS A 44 -14.680 0.971 4.089 1.00 0.00 C ATOM 635 CD LYS A 44 -15.950 0.103 4.104 1.00 0.00 C ATOM 636 CE LYS A 44 -16.185 -0.244 5.569 1.00 0.00 C ATOM 637 NZ LYS A 44 -17.236 -1.238 5.838 1.00 0.00 N ATOM 0 H LYS A 44 -14.713 -0.455 1.131 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.651 2.274 1.854 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -13.337 0.430 2.503 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -13.314 2.134 2.909 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -13.950 0.489 4.739 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -14.935 1.926 4.549 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -16.800 0.643 3.687 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.818 -0.797 3.503 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -15.249 -0.612 5.989 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -16.435 0.673 6.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.309 -1.397 6.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -18.146 -0.888 5.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.997 -2.133 5.365 1.00 0.00 H new ATOM 647 N LYS A 45 -13.724 3.513 0.536 1.00 0.00 N ATOM 648 CA LYS A 45 -12.960 4.214 -0.502 1.00 0.00 C ATOM 649 C LYS A 45 -11.561 4.615 -0.087 1.00 0.00 C ATOM 650 O LYS A 45 -10.699 4.667 -0.962 1.00 0.00 O ATOM 651 CB LYS A 45 -13.711 5.456 -0.999 1.00 0.00 C ATOM 652 CG LYS A 45 -14.769 5.063 -2.034 1.00 0.00 C ATOM 653 CD LYS A 45 -15.174 6.259 -2.909 1.00 0.00 C ATOM 654 CE LYS A 45 -16.114 7.202 -2.150 1.00 0.00 C ATOM 655 NZ LYS A 45 -17.531 6.933 -2.466 1.00 0.00 N ATOM 0 H LYS A 45 -13.928 4.083 1.357 1.00 0.00 H new ATOM 0 HA LYS A 45 -12.855 3.485 -1.306 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -14.186 5.962 -0.158 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -13.007 6.162 -1.440 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -14.382 4.264 -2.666 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -15.649 4.669 -1.525 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -14.283 6.803 -3.223 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -15.665 5.902 -3.814 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -15.953 7.091 -1.078 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -15.875 8.235 -2.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -18.136 7.590 -1.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -17.690 7.064 -3.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -17.766 5.955 -2.202 1.00 0.00 H new ATOM 665 N LYS A 46 -11.297 4.928 1.182 1.00 0.00 N ATOM 666 CA LYS A 46 -9.931 5.327 1.551 1.00 0.00 C ATOM 667 C LYS A 46 -9.074 4.092 1.702 1.00 0.00 C ATOM 668 O LYS A 46 -9.128 3.483 2.762 1.00 0.00 O ATOM 669 CB LYS A 46 -9.892 6.244 2.787 1.00 0.00 C ATOM 670 CG LYS A 46 -9.509 7.693 2.485 1.00 0.00 C ATOM 671 CD LYS A 46 -10.538 8.405 1.603 1.00 0.00 C ATOM 672 CE LYS A 46 -10.385 9.911 1.814 1.00 0.00 C ATOM 673 NZ LYS A 46 -11.278 10.681 0.931 1.00 0.00 N ATOM 0 H LYS A 46 -11.974 4.916 1.945 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.516 5.935 0.747 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.872 6.232 3.265 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -9.182 5.835 3.506 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -9.401 8.239 3.422 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -8.538 7.712 1.991 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.382 8.150 0.555 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -11.547 8.085 1.862 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -10.602 10.156 2.854 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -9.351 10.201 1.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -11.145 11.698 1.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -11.054 10.466 -0.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -12.266 10.423 1.127 1.00 0.00 H new ATOM 683 N ILE A 47 -8.335 3.669 0.674 1.00 0.00 N ATOM 684 CA ILE A 47 -7.543 2.456 0.807 1.00 0.00 C ATOM 685 C ILE A 47 -6.203 2.926 1.347 1.00 0.00 C ATOM 686 O ILE A 47 -5.418 3.561 0.642 1.00 0.00 O ATOM 687 CB ILE A 47 -7.465 1.694 -0.523 1.00 0.00 C ATOM 688 CG1 ILE A 47 -8.820 1.598 -1.272 1.00 0.00 C ATOM 689 CG2 ILE A 47 -6.899 0.290 -0.280 1.00 0.00 C ATOM 690 CD1 ILE A 47 -10.010 1.087 -0.454 1.00 0.00 C ATOM 0 H ILE A 47 -8.271 4.135 -0.231 1.00 0.00 H new ATOM 0 HA ILE A 47 -7.982 1.726 1.487 1.00 0.00 H new ATOM 0 HB ILE A 47 -6.802 2.268 -1.170 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -9.069 2.586 -1.658 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -8.690 0.943 -2.133 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -6.845 -0.249 -1.226 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -5.901 0.370 0.150 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -7.549 -0.250 0.409 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -10.900 1.063 -1.083 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -9.796 0.082 -0.090 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -10.181 1.751 0.393 1.00 0.00 H new ATOM 701 N VAL A 48 -5.995 2.722 2.638 1.00 0.00 N ATOM 702 CA VAL A 48 -4.807 3.192 3.328 1.00 0.00 C ATOM 703 C VAL A 48 -3.962 1.962 3.543 1.00 0.00 C ATOM 704 O VAL A 48 -4.436 0.968 4.078 1.00 0.00 O ATOM 705 CB VAL A 48 -5.144 3.900 4.645 1.00 0.00 C ATOM 706 CG1 VAL A 48 -3.923 4.714 5.089 1.00 0.00 C ATOM 707 CG2 VAL A 48 -6.341 4.835 4.478 1.00 0.00 C ATOM 0 H VAL A 48 -6.650 2.223 3.239 1.00 0.00 H new ATOM 0 HA VAL A 48 -4.277 3.944 2.744 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.401 3.150 5.393 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.147 5.224 6.026 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.074 4.046 5.234 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.679 5.451 4.324 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -6.557 5.323 5.428 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.111 5.590 3.726 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -7.210 4.260 4.160 1.00 0.00 H new ATOM 717 N LEU A 49 -2.728 1.993 3.094 1.00 0.00 N ATOM 718 CA LEU A 49 -1.747 0.963 3.365 1.00 0.00 C ATOM 719 C LEU A 49 -1.007 1.353 4.622 1.00 0.00 C ATOM 720 O LEU A 49 -0.813 2.531 4.803 1.00 0.00 O ATOM 721 CB LEU A 49 -0.835 0.882 2.147 1.00 0.00 C ATOM 722 CG LEU A 49 -1.223 -0.116 1.049 1.00 0.00 C ATOM 723 CD1 LEU A 49 -1.222 -1.559 1.545 1.00 0.00 C ATOM 724 CD2 LEU A 49 -2.568 0.242 0.426 1.00 0.00 C ATOM 0 H LEU A 49 -2.368 2.753 2.516 1.00 0.00 H new ATOM 0 HA LEU A 49 -2.188 -0.020 3.530 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.781 1.874 1.699 1.00 0.00 H new ATOM 0 HB3 LEU A 49 0.168 0.632 2.492 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.456 -0.043 0.278 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.503 -2.224 0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.225 -1.821 1.900 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.937 -1.664 2.361 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.815 -0.484 -0.349 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -3.340 0.229 1.195 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.512 1.237 -0.014 1.00 0.00 H new ATOM 735 N ASP A 50 -0.621 0.426 5.489 1.00 0.00 N ATOM 736 CA ASP A 50 0.236 0.525 6.686 1.00 0.00 C ATOM 737 C ASP A 50 1.501 -0.243 6.413 1.00 0.00 C ATOM 738 O ASP A 50 1.396 -1.423 6.078 1.00 0.00 O ATOM 739 CB ASP A 50 -0.383 -0.177 7.896 1.00 0.00 C ATOM 740 CG ASP A 50 0.377 0.186 9.170 1.00 0.00 C ATOM 741 OD1 ASP A 50 1.406 -0.484 9.424 1.00 0.00 O ATOM 742 OD2 ASP A 50 -0.035 1.137 9.872 1.00 0.00 O ATOM 0 H ASP A 50 -0.935 -0.536 5.362 1.00 0.00 H new ATOM 0 HA ASP A 50 0.384 1.585 6.892 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -1.430 0.111 7.995 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.362 -1.257 7.748 1.00 0.00 H new ATOM 746 N LEU A 51 2.662 0.397 6.513 1.00 0.00 N ATOM 747 CA LEU A 51 3.932 -0.175 6.111 1.00 0.00 C ATOM 748 C LEU A 51 4.882 -0.287 7.311 1.00 0.00 C ATOM 749 O LEU A 51 6.100 -0.356 7.134 1.00 0.00 O ATOM 750 CB LEU A 51 4.501 0.622 4.926 1.00 0.00 C ATOM 751 CG LEU A 51 3.609 0.776 3.668 1.00 0.00 C ATOM 752 CD1 LEU A 51 2.986 -0.519 3.115 1.00 0.00 C ATOM 753 CD2 LEU A 51 2.517 1.840 3.794 1.00 0.00 C ATOM 0 H LEU A 51 2.742 1.344 6.883 1.00 0.00 H new ATOM 0 HA LEU A 51 3.794 -1.198 5.760 1.00 0.00 H new ATOM 0 HB2 LEU A 51 4.753 1.621 5.283 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.434 0.148 4.620 1.00 0.00 H new ATOM 0 HG LEU A 51 4.348 1.109 2.940 1.00 0.00 H new ATOM 0 HD11 LEU A 51 2.384 -0.287 2.236 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.778 -1.215 2.839 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.354 -0.973 3.878 1.00 0.00 H new ATOM 0 HD21 LEU A 51 1.941 1.881 2.870 1.00 0.00 H new ATOM 0 HD22 LEU A 51 1.856 1.587 4.623 1.00 0.00 H new ATOM 0 HD23 LEU A 51 2.975 2.811 3.979 1.00 0.00 H new ATOM 764 N SER A 52 4.351 -0.343 8.538 1.00 0.00 N ATOM 765 CA SER A 52 5.170 -0.506 9.731 1.00 0.00 C ATOM 766 C SER A 52 5.892 -1.863 9.737 1.00 0.00 C ATOM 767 O SER A 52 6.989 -1.978 10.284 1.00 0.00 O ATOM 768 CB SER A 52 4.298 -0.330 10.984 1.00 0.00 C ATOM 769 OG SER A 52 4.940 0.515 11.918 1.00 0.00 O ATOM 0 H SER A 52 3.350 -0.277 8.725 1.00 0.00 H new ATOM 0 HA SER A 52 5.943 0.263 9.731 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.332 0.092 10.706 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.102 -1.302 11.438 1.00 0.00 H new ATOM 0 HG SER A 52 4.372 0.619 12.710 1.00 0.00 H new ATOM 774 N SER A 53 5.324 -2.911 9.141 1.00 0.00 N ATOM 775 CA SER A 53 5.910 -4.231 9.055 1.00 0.00 C ATOM 776 C SER A 53 6.925 -4.324 7.914 1.00 0.00 C ATOM 777 O SER A 53 7.662 -5.304 7.832 1.00 0.00 O ATOM 778 CB SER A 53 4.751 -5.198 8.845 1.00 0.00 C ATOM 779 OG SER A 53 3.795 -5.089 9.889 1.00 0.00 O ATOM 0 H SER A 53 4.410 -2.853 8.691 1.00 0.00 H new ATOM 0 HA SER A 53 6.463 -4.470 9.963 1.00 0.00 H new ATOM 0 HB2 SER A 53 4.272 -4.993 7.887 1.00 0.00 H new ATOM 0 HB3 SER A 53 5.130 -6.219 8.800 1.00 0.00 H new ATOM 0 HG SER A 53 2.892 -5.100 9.508 1.00 0.00 H new ATOM 784 N VAL A 54 6.983 -3.316 7.045 1.00 0.00 N ATOM 785 CA VAL A 54 7.762 -3.356 5.828 1.00 0.00 C ATOM 786 C VAL A 54 9.166 -2.844 6.161 1.00 0.00 C ATOM 787 O VAL A 54 9.479 -1.658 6.041 1.00 0.00 O ATOM 788 CB VAL A 54 7.044 -2.541 4.734 1.00 0.00 C ATOM 789 CG1 VAL A 54 7.779 -2.602 3.396 1.00 0.00 C ATOM 790 CG2 VAL A 54 5.632 -3.073 4.464 1.00 0.00 C ATOM 0 H VAL A 54 6.479 -2.439 7.177 1.00 0.00 H new ATOM 0 HA VAL A 54 7.861 -4.366 5.431 1.00 0.00 H new ATOM 0 HB VAL A 54 7.015 -1.520 5.116 1.00 0.00 H new ATOM 0 HG11 VAL A 54 7.237 -2.014 2.656 1.00 0.00 H new ATOM 0 HG12 VAL A 54 8.785 -2.198 3.515 1.00 0.00 H new ATOM 0 HG13 VAL A 54 7.841 -3.638 3.062 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.159 -2.472 3.687 1.00 0.00 H new ATOM 0 HG22 VAL A 54 5.691 -4.110 4.135 1.00 0.00 H new ATOM 0 HG23 VAL A 54 5.040 -3.015 5.378 1.00 0.00 H new ATOM 800 N SER A 55 10.019 -3.738 6.653 1.00 0.00 N ATOM 801 CA SER A 55 11.373 -3.440 7.063 1.00 0.00 C ATOM 802 C SER A 55 12.312 -3.134 5.889 1.00 0.00 C ATOM 803 O SER A 55 13.323 -2.452 6.086 1.00 0.00 O ATOM 804 CB SER A 55 11.845 -4.630 7.873 1.00 0.00 C ATOM 805 OG SER A 55 11.507 -4.484 9.241 1.00 0.00 O ATOM 0 H SER A 55 9.771 -4.719 6.778 1.00 0.00 H new ATOM 0 HA SER A 55 11.388 -2.526 7.656 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.396 -5.542 7.480 1.00 0.00 H new ATOM 0 HB3 SER A 55 12.925 -4.737 7.772 1.00 0.00 H new ATOM 0 HG SER A 55 11.821 -5.266 9.741 1.00 0.00 H new ATOM 810 N TYR A 56 11.975 -3.598 4.687 1.00 0.00 N ATOM 811 CA TYR A 56 12.731 -3.490 3.452 1.00 0.00 C ATOM 812 C TYR A 56 11.721 -3.400 2.309 1.00 0.00 C ATOM 813 O TYR A 56 10.566 -3.798 2.484 1.00 0.00 O ATOM 814 CB TYR A 56 13.636 -4.718 3.330 1.00 0.00 C ATOM 815 CG TYR A 56 14.149 -4.995 1.935 1.00 0.00 C ATOM 816 CD1 TYR A 56 15.239 -4.265 1.424 1.00 0.00 C ATOM 817 CD2 TYR A 56 13.495 -5.944 1.126 1.00 0.00 C ATOM 818 CE1 TYR A 56 15.667 -4.478 0.102 1.00 0.00 C ATOM 819 CE2 TYR A 56 13.923 -6.166 -0.187 1.00 0.00 C ATOM 820 CZ TYR A 56 15.001 -5.429 -0.706 1.00 0.00 C ATOM 821 OH TYR A 56 15.410 -5.692 -1.968 1.00 0.00 O ATOM 0 H TYR A 56 11.097 -4.097 4.546 1.00 0.00 H new ATOM 0 HA TYR A 56 13.369 -2.606 3.427 1.00 0.00 H new ATOM 0 HB2 TYR A 56 14.489 -4.590 3.996 1.00 0.00 H new ATOM 0 HB3 TYR A 56 13.087 -5.592 3.680 1.00 0.00 H new ATOM 0 HD1 TYR A 56 15.746 -3.542 2.047 1.00 0.00 H new ATOM 0 HD2 TYR A 56 12.659 -6.503 1.521 1.00 0.00 H new ATOM 0 HE1 TYR A 56 16.501 -3.918 -0.295 1.00 0.00 H new ATOM 0 HE2 TYR A 56 13.426 -6.903 -0.801 1.00 0.00 H new ATOM 0 HH TYR A 56 14.829 -6.374 -2.365 1.00 0.00 H new ATOM 830 N MET A 57 12.152 -2.868 1.165 1.00 0.00 N ATOM 831 CA MET A 57 11.364 -2.722 -0.040 1.00 0.00 C ATOM 832 C MET A 57 12.293 -2.945 -1.223 1.00 0.00 C ATOM 833 O MET A 57 13.325 -2.278 -1.317 1.00 0.00 O ATOM 834 CB MET A 57 10.721 -1.333 -0.071 1.00 0.00 C ATOM 835 CG MET A 57 9.843 -1.061 -1.292 1.00 0.00 C ATOM 836 SD MET A 57 9.666 0.679 -1.725 1.00 0.00 S ATOM 837 CE MET A 57 7.900 0.666 -2.055 1.00 0.00 C ATOM 0 H MET A 57 13.103 -2.514 1.057 1.00 0.00 H new ATOM 0 HA MET A 57 10.553 -3.449 -0.078 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.118 -1.207 0.828 1.00 0.00 H new ATOM 0 HB3 MET A 57 11.510 -0.582 -0.034 1.00 0.00 H new ATOM 0 HG2 MET A 57 10.260 -1.593 -2.147 1.00 0.00 H new ATOM 0 HG3 MET A 57 8.853 -1.478 -1.110 1.00 0.00 H new ATOM 0 HE1 MET A 57 7.660 1.442 -2.782 1.00 0.00 H new ATOM 0 HE2 MET A 57 7.612 -0.307 -2.454 1.00 0.00 H new ATOM 0 HE3 MET A 57 7.356 0.855 -1.130 1.00 0.00 H new ATOM 845 N ASP A 58 11.937 -3.872 -2.109 1.00 0.00 N ATOM 846 CA ASP A 58 12.595 -3.986 -3.408 1.00 0.00 C ATOM 847 C ASP A 58 11.961 -2.981 -4.372 1.00 0.00 C ATOM 848 O ASP A 58 10.787 -2.623 -4.244 1.00 0.00 O ATOM 849 CB ASP A 58 12.448 -5.410 -3.959 1.00 0.00 C ATOM 850 CG ASP A 58 13.313 -5.698 -5.183 1.00 0.00 C ATOM 851 OD1 ASP A 58 12.967 -5.210 -6.284 1.00 0.00 O ATOM 852 OD2 ASP A 58 14.290 -6.454 -5.067 1.00 0.00 O ATOM 0 H ASP A 58 11.196 -4.555 -1.951 1.00 0.00 H new ATOM 0 HA ASP A 58 13.658 -3.772 -3.297 1.00 0.00 H new ATOM 0 HB2 ASP A 58 12.703 -6.120 -3.172 1.00 0.00 H new ATOM 0 HB3 ASP A 58 11.403 -5.582 -4.218 1.00 0.00 H new ATOM 856 N SER A 59 12.695 -2.634 -5.421 1.00 0.00 N ATOM 857 CA SER A 59 12.290 -1.865 -6.590 1.00 0.00 C ATOM 858 C SER A 59 11.024 -2.385 -7.298 1.00 0.00 C ATOM 859 O SER A 59 10.528 -1.707 -8.202 1.00 0.00 O ATOM 860 CB SER A 59 13.475 -1.891 -7.565 1.00 0.00 C ATOM 861 OG SER A 59 14.640 -1.368 -6.949 1.00 0.00 O ATOM 0 H SER A 59 13.676 -2.908 -5.480 1.00 0.00 H new ATOM 0 HA SER A 59 12.030 -0.860 -6.257 1.00 0.00 H new ATOM 0 HB2 SER A 59 13.659 -2.914 -7.895 1.00 0.00 H new ATOM 0 HB3 SER A 59 13.234 -1.308 -8.454 1.00 0.00 H new ATOM 0 HG SER A 59 15.386 -1.394 -7.584 1.00 0.00 H new ATOM 866 N ALA A 60 10.494 -3.559 -6.925 1.00 0.00 N ATOM 867 CA ALA A 60 9.291 -4.156 -7.485 1.00 0.00 C ATOM 868 C ALA A 60 8.116 -3.930 -6.540 1.00 0.00 C ATOM 869 O ALA A 60 6.978 -3.860 -6.998 1.00 0.00 O ATOM 870 CB ALA A 60 9.507 -5.658 -7.703 1.00 0.00 C ATOM 0 H ALA A 60 10.915 -4.135 -6.196 1.00 0.00 H new ATOM 0 HA ALA A 60 9.072 -3.687 -8.444 1.00 0.00 H new ATOM 0 HB1 ALA A 60 8.602 -6.099 -8.122 1.00 0.00 H new ATOM 0 HB2 ALA A 60 10.338 -5.810 -8.392 1.00 0.00 H new ATOM 0 HB3 ALA A 60 9.735 -6.135 -6.750 1.00 0.00 H new ATOM 876 N GLY A 61 8.375 -3.766 -5.240 1.00 0.00 N ATOM 877 CA GLY A 61 7.382 -3.429 -4.238 1.00 0.00 C ATOM 878 C GLY A 61 6.729 -2.096 -4.579 1.00 0.00 C ATOM 879 O GLY A 61 5.508 -1.959 -4.638 1.00 0.00 O ATOM 0 H GLY A 61 9.313 -3.869 -4.852 1.00 0.00 H new ATOM 0 HA2 GLY A 61 6.625 -4.212 -4.187 1.00 0.00 H new ATOM 0 HA3 GLY A 61 7.850 -3.373 -3.255 1.00 0.00 H new ATOM 883 N LEU A 62 7.565 -1.098 -4.864 1.00 0.00 N ATOM 884 CA LEU A 62 7.119 0.238 -5.252 1.00 0.00 C ATOM 885 C LEU A 62 6.319 0.162 -6.547 1.00 0.00 C ATOM 886 O LEU A 62 5.248 0.760 -6.673 1.00 0.00 O ATOM 887 CB LEU A 62 8.346 1.168 -5.314 1.00 0.00 C ATOM 888 CG LEU A 62 9.190 1.221 -6.598 1.00 0.00 C ATOM 889 CD1 LEU A 62 8.611 2.218 -7.597 1.00 0.00 C ATOM 890 CD2 LEU A 62 10.616 1.661 -6.258 1.00 0.00 C ATOM 0 H LEU A 62 8.580 -1.196 -4.831 1.00 0.00 H new ATOM 0 HA LEU A 62 6.438 0.664 -4.515 1.00 0.00 H new ATOM 0 HB2 LEU A 62 7.999 2.181 -5.109 1.00 0.00 H new ATOM 0 HB3 LEU A 62 9.011 0.887 -4.497 1.00 0.00 H new ATOM 0 HG LEU A 62 9.187 0.225 -7.040 1.00 0.00 H new ATOM 0 HD11 LEU A 62 9.229 2.234 -8.495 1.00 0.00 H new ATOM 0 HD12 LEU A 62 7.596 1.921 -7.860 1.00 0.00 H new ATOM 0 HD13 LEU A 62 8.594 3.212 -7.151 1.00 0.00 H new ATOM 0 HD21 LEU A 62 11.212 1.698 -7.170 1.00 0.00 H new ATOM 0 HD22 LEU A 62 10.592 2.650 -5.800 1.00 0.00 H new ATOM 0 HD23 LEU A 62 11.060 0.949 -5.562 1.00 0.00 H new ATOM 901 N GLY A 63 6.818 -0.647 -7.479 1.00 0.00 N ATOM 902 CA GLY A 63 6.220 -0.909 -8.769 1.00 0.00 C ATOM 903 C GLY A 63 4.880 -1.650 -8.660 1.00 0.00 C ATOM 904 O GLY A 63 4.153 -1.777 -9.639 1.00 0.00 O ATOM 0 H GLY A 63 7.690 -1.157 -7.341 1.00 0.00 H new ATOM 0 HA2 GLY A 63 6.067 0.035 -9.293 1.00 0.00 H new ATOM 0 HA3 GLY A 63 6.910 -1.500 -9.372 1.00 0.00 H new ATOM 908 N THR A 64 4.534 -2.125 -7.464 1.00 0.00 N ATOM 909 CA THR A 64 3.352 -2.908 -7.144 1.00 0.00 C ATOM 910 C THR A 64 2.351 -2.063 -6.354 1.00 0.00 C ATOM 911 O THR A 64 1.259 -2.526 -6.054 1.00 0.00 O ATOM 912 CB THR A 64 3.836 -4.187 -6.441 1.00 0.00 C ATOM 913 OG1 THR A 64 4.588 -4.888 -7.413 1.00 0.00 O ATOM 914 CG2 THR A 64 2.718 -5.073 -5.899 1.00 0.00 C ATOM 0 H THR A 64 5.114 -1.959 -6.642 1.00 0.00 H new ATOM 0 HA THR A 64 2.795 -3.213 -8.030 1.00 0.00 H new ATOM 0 HB THR A 64 4.413 -3.914 -5.558 1.00 0.00 H new ATOM 0 HG1 THR A 64 5.520 -4.587 -7.385 1.00 0.00 H new ATOM 0 HG21 THR A 64 3.150 -5.952 -5.420 1.00 0.00 H new ATOM 0 HG22 THR A 64 2.131 -4.514 -5.170 1.00 0.00 H new ATOM 0 HG23 THR A 64 2.073 -5.387 -6.719 1.00 0.00 H new ATOM 922 N LEU A 65 2.672 -0.796 -6.083 1.00 0.00 N ATOM 923 CA LEU A 65 1.772 0.156 -5.448 1.00 0.00 C ATOM 924 C LEU A 65 1.512 1.333 -6.382 1.00 0.00 C ATOM 925 O LEU A 65 0.390 1.824 -6.433 1.00 0.00 O ATOM 926 CB LEU A 65 2.373 0.568 -4.100 1.00 0.00 C ATOM 927 CG LEU A 65 2.184 -0.558 -3.060 1.00 0.00 C ATOM 928 CD1 LEU A 65 3.256 -0.472 -1.975 1.00 0.00 C ATOM 929 CD2 LEU A 65 0.797 -0.486 -2.409 1.00 0.00 C ATOM 0 H LEU A 65 3.585 -0.400 -6.305 1.00 0.00 H new ATOM 0 HA LEU A 65 0.798 -0.293 -5.252 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.434 0.787 -4.219 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.896 1.482 -3.746 1.00 0.00 H new ATOM 0 HG LEU A 65 2.275 -1.508 -3.586 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.106 -1.273 -1.251 1.00 0.00 H new ATOM 0 HD12 LEU A 65 4.242 -0.572 -2.429 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.186 0.491 -1.469 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.694 -1.291 -1.682 1.00 0.00 H new ATOM 0 HD22 LEU A 65 0.680 0.474 -1.906 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.029 -0.589 -3.176 1.00 0.00 H new ATOM 940 N VAL A 66 2.488 1.714 -7.212 1.00 0.00 N ATOM 941 CA VAL A 66 2.289 2.721 -8.254 1.00 0.00 C ATOM 942 C VAL A 66 1.179 2.255 -9.201 1.00 0.00 C ATOM 943 O VAL A 66 0.299 3.039 -9.529 1.00 0.00 O ATOM 944 CB VAL A 66 3.643 3.043 -8.930 1.00 0.00 C ATOM 945 CG1 VAL A 66 4.209 1.863 -9.699 1.00 0.00 C ATOM 946 CG2 VAL A 66 3.611 4.239 -9.891 1.00 0.00 C ATOM 0 H VAL A 66 3.434 1.334 -7.179 1.00 0.00 H new ATOM 0 HA VAL A 66 1.943 3.668 -7.840 1.00 0.00 H new ATOM 0 HB VAL A 66 4.280 3.294 -8.082 1.00 0.00 H new ATOM 0 HG11 VAL A 66 5.159 2.146 -10.152 1.00 0.00 H new ATOM 0 HG12 VAL A 66 4.367 1.027 -9.018 1.00 0.00 H new ATOM 0 HG13 VAL A 66 3.508 1.568 -10.480 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.603 4.390 -10.317 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.898 4.043 -10.692 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.310 5.134 -9.348 1.00 0.00 H new ATOM 956 N VAL A 67 1.170 0.965 -9.553 1.00 0.00 N ATOM 957 CA VAL A 67 0.177 0.326 -10.407 1.00 0.00 C ATOM 958 C VAL A 67 -1.226 0.318 -9.773 1.00 0.00 C ATOM 959 O VAL A 67 -2.235 0.334 -10.483 1.00 0.00 O ATOM 960 CB VAL A 67 0.710 -1.078 -10.759 1.00 0.00 C ATOM 961 CG1 VAL A 67 0.599 -2.034 -9.576 1.00 0.00 C ATOM 962 CG2 VAL A 67 0.038 -1.684 -11.991 1.00 0.00 C ATOM 0 H VAL A 67 1.888 0.314 -9.234 1.00 0.00 H new ATOM 0 HA VAL A 67 0.039 0.896 -11.326 1.00 0.00 H new ATOM 0 HB VAL A 67 1.763 -0.939 -11.002 1.00 0.00 H new ATOM 0 HG11 VAL A 67 0.984 -3.013 -9.862 1.00 0.00 H new ATOM 0 HG12 VAL A 67 1.179 -1.646 -8.739 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -0.446 -2.127 -9.280 1.00 0.00 H new ATOM 0 HG21 VAL A 67 0.457 -2.671 -12.185 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.034 -1.773 -11.814 1.00 0.00 H new ATOM 0 HG23 VAL A 67 0.211 -1.040 -12.853 1.00 0.00 H new ATOM 972 N ILE A 68 -1.300 0.295 -8.437 1.00 0.00 N ATOM 973 CA ILE A 68 -2.555 0.206 -7.704 1.00 0.00 C ATOM 974 C ILE A 68 -3.265 1.566 -7.722 1.00 0.00 C ATOM 975 O ILE A 68 -4.481 1.601 -7.535 1.00 0.00 O ATOM 976 CB ILE A 68 -2.307 -0.342 -6.278 1.00 0.00 C ATOM 977 CG1 ILE A 68 -1.739 -1.781 -6.290 1.00 0.00 C ATOM 978 CG2 ILE A 68 -3.567 -0.299 -5.403 1.00 0.00 C ATOM 979 CD1 ILE A 68 -2.694 -2.905 -6.694 1.00 0.00 C ATOM 0 H ILE A 68 -0.478 0.338 -7.834 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.224 -0.504 -8.190 1.00 0.00 H new ATOM 0 HB ILE A 68 -1.562 0.323 -5.842 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.886 -1.802 -6.968 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -1.359 -2.003 -5.293 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.337 -0.695 -4.414 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -3.911 0.731 -5.311 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.350 -0.903 -5.862 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -2.168 -3.859 -6.660 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -3.538 -2.931 -6.005 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -3.058 -2.727 -7.706 1.00 0.00 H new ATOM 990 N LEU A 69 -2.559 2.673 -8.006 1.00 0.00 N ATOM 991 CA LEU A 69 -3.184 3.966 -8.291 1.00 0.00 C ATOM 992 C LEU A 69 -4.282 3.760 -9.334 1.00 0.00 C ATOM 993 O LEU A 69 -5.434 4.120 -9.096 1.00 0.00 O ATOM 994 CB LEU A 69 -2.132 4.960 -8.810 1.00 0.00 C ATOM 995 CG LEU A 69 -2.715 6.332 -9.215 1.00 0.00 C ATOM 996 CD1 LEU A 69 -2.737 7.289 -8.019 1.00 0.00 C ATOM 997 CD2 LEU A 69 -1.904 6.934 -10.371 1.00 0.00 C ATOM 0 H LEU A 69 -1.540 2.692 -8.043 1.00 0.00 H new ATOM 0 HA LEU A 69 -3.618 4.376 -7.379 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.377 5.110 -8.039 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.626 4.523 -9.671 1.00 0.00 H new ATOM 0 HG LEU A 69 -3.742 6.184 -9.549 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -3.151 8.248 -8.328 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -3.354 6.866 -7.226 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -1.722 7.434 -7.651 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.326 7.901 -10.646 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.868 7.066 -10.059 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.942 6.264 -11.230 1.00 0.00 H new ATOM 1008 N LYS A 70 -3.932 3.156 -10.478 1.00 0.00 N ATOM 1009 CA LYS A 70 -4.903 2.800 -11.495 1.00 0.00 C ATOM 1010 C LYS A 70 -5.980 1.910 -10.899 1.00 0.00 C ATOM 1011 O LYS A 70 -7.109 2.361 -10.865 1.00 0.00 O ATOM 1012 CB LYS A 70 -4.218 2.226 -12.736 1.00 0.00 C ATOM 1013 CG LYS A 70 -5.263 1.830 -13.777 1.00 0.00 C ATOM 1014 CD LYS A 70 -4.702 1.823 -15.200 1.00 0.00 C ATOM 1015 CE LYS A 70 -5.798 1.465 -16.205 1.00 0.00 C ATOM 1016 NZ LYS A 70 -6.874 2.475 -16.273 1.00 0.00 N ATOM 0 H LYS A 70 -2.972 2.906 -10.714 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.414 3.696 -11.848 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.535 2.963 -13.158 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -3.620 1.357 -12.461 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.651 0.840 -13.538 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -6.103 2.523 -13.725 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -4.287 2.802 -15.439 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -3.885 1.105 -15.272 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -5.353 1.350 -17.193 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -6.229 0.501 -15.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -7.474 2.288 -17.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.451 2.426 -15.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.455 3.423 -16.356 1.00 0.00 H new ATOM 1026 N ASP A 71 -5.690 0.683 -10.465 1.00 0.00 N ATOM 1027 CA ASP A 71 -6.656 -0.286 -9.933 1.00 0.00 C ATOM 1028 C ASP A 71 -7.696 0.364 -9.011 1.00 0.00 C ATOM 1029 O ASP A 71 -8.891 0.098 -9.138 1.00 0.00 O ATOM 1030 CB ASP A 71 -5.934 -1.426 -9.186 1.00 0.00 C ATOM 1031 CG ASP A 71 -5.453 -2.559 -10.094 1.00 0.00 C ATOM 1032 OD1 ASP A 71 -6.280 -3.139 -10.817 1.00 0.00 O ATOM 1033 OD2 ASP A 71 -4.242 -2.881 -10.094 1.00 0.00 O ATOM 0 H ASP A 71 -4.737 0.320 -10.474 1.00 0.00 H new ATOM 0 HA ASP A 71 -7.188 -0.695 -10.792 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -5.077 -1.012 -8.654 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -6.608 -1.838 -8.434 1.00 0.00 H new ATOM 1037 N ALA A 72 -7.267 1.245 -8.107 1.00 0.00 N ATOM 1038 CA ALA A 72 -8.128 2.014 -7.234 1.00 0.00 C ATOM 1039 C ALA A 72 -9.013 2.940 -8.051 1.00 0.00 C ATOM 1040 O ALA A 72 -10.233 2.816 -7.991 1.00 0.00 O ATOM 1041 CB ALA A 72 -7.247 2.816 -6.267 1.00 0.00 C ATOM 0 H ALA A 72 -6.277 1.443 -7.964 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.779 1.348 -6.668 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.879 3.403 -5.600 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -6.636 2.131 -5.679 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -6.599 3.484 -6.834 1.00 0.00 H new ATOM 1047 N LYS A 73 -8.418 3.838 -8.834 1.00 0.00 N ATOM 1048 CA LYS A 73 -9.093 4.782 -9.714 1.00 0.00 C ATOM 1049 C LYS A 73 -10.043 4.076 -10.692 1.00 0.00 C ATOM 1050 O LYS A 73 -11.083 4.650 -11.008 1.00 0.00 O ATOM 1051 CB LYS A 73 -7.991 5.607 -10.404 1.00 0.00 C ATOM 1052 CG LYS A 73 -8.468 6.687 -11.391 1.00 0.00 C ATOM 1053 CD LYS A 73 -7.946 6.496 -12.828 1.00 0.00 C ATOM 1054 CE LYS A 73 -9.053 6.278 -13.864 1.00 0.00 C ATOM 1055 NZ LYS A 73 -9.852 7.494 -14.110 1.00 0.00 N ATOM 0 H LYS A 73 -7.403 3.929 -8.872 1.00 0.00 H new ATOM 0 HA LYS A 73 -9.747 5.450 -9.153 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -7.390 6.089 -9.633 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -7.333 4.921 -10.938 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -9.558 6.693 -11.409 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -8.150 7.664 -11.027 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -7.363 7.372 -13.112 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -7.269 5.642 -12.848 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -8.607 5.946 -14.801 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -9.711 5.479 -13.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -10.586 7.290 -14.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -10.302 7.799 -13.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -9.232 8.251 -14.462 1.00 0.00 H new ATOM 1065 N ILE A 74 -9.771 2.844 -11.144 1.00 0.00 N ATOM 1066 CA ILE A 74 -10.681 2.030 -11.952 1.00 0.00 C ATOM 1067 C ILE A 74 -11.989 1.845 -11.177 1.00 0.00 C ATOM 1068 O ILE A 74 -13.061 2.058 -11.745 1.00 0.00 O ATOM 1069 CB ILE A 74 -10.056 0.662 -12.350 1.00 0.00 C ATOM 1070 CG1 ILE A 74 -8.804 0.834 -13.242 1.00 0.00 C ATOM 1071 CG2 ILE A 74 -11.103 -0.222 -13.053 1.00 0.00 C ATOM 1072 CD1 ILE A 74 -8.198 -0.470 -13.745 1.00 0.00 C ATOM 0 H ILE A 74 -8.886 2.376 -10.950 1.00 0.00 H new ATOM 0 HA ILE A 74 -10.879 2.549 -12.890 1.00 0.00 H new ATOM 0 HB ILE A 74 -9.735 0.170 -11.432 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.068 1.451 -14.101 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -8.046 1.378 -12.679 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -10.650 -1.175 -13.325 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -11.942 -0.398 -12.380 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -11.459 0.281 -13.952 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.326 -0.252 -14.361 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -7.898 -1.083 -12.895 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -8.936 -1.009 -14.339 1.00 0.00 H new ATOM 1083 N ASN A 75 -11.918 1.470 -9.897 1.00 0.00 N ATOM 1084 CA ASN A 75 -13.094 1.249 -9.059 1.00 0.00 C ATOM 1085 C ASN A 75 -13.463 2.496 -8.245 1.00 0.00 C ATOM 1086 O ASN A 75 -14.252 2.431 -7.300 1.00 0.00 O ATOM 1087 CB ASN A 75 -12.915 0.000 -8.177 1.00 0.00 C ATOM 1088 CG ASN A 75 -14.279 -0.608 -7.827 1.00 0.00 C ATOM 1089 OD1 ASN A 75 -15.317 -0.224 -8.349 1.00 0.00 O ATOM 1090 ND2 ASN A 75 -14.364 -1.540 -6.899 1.00 0.00 N ATOM 0 H ASN A 75 -11.035 1.311 -9.412 1.00 0.00 H new ATOM 0 HA ASN A 75 -13.941 1.059 -9.718 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -12.304 -0.737 -8.699 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -12.383 0.265 -7.263 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -15.275 -1.917 -6.637 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -13.519 -1.884 -6.443 1.00 0.00 H new ATOM 1096 N GLY A 76 -12.850 3.636 -8.573 1.00 0.00 N ATOM 1097 CA GLY A 76 -13.135 4.937 -7.990 1.00 0.00 C ATOM 1098 C GLY A 76 -12.691 5.066 -6.532 1.00 0.00 C ATOM 1099 O GLY A 76 -13.233 5.898 -5.805 1.00 0.00 O ATOM 0 H GLY A 76 -12.115 3.673 -9.279 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.640 5.707 -8.581 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.206 5.127 -8.053 1.00 0.00 H new ATOM 1103 N LYS A 77 -11.757 4.228 -6.072 1.00 0.00 N ATOM 1104 CA LYS A 77 -11.272 4.230 -4.698 1.00 0.00 C ATOM 1105 C LYS A 77 -10.044 5.133 -4.641 1.00 0.00 C ATOM 1106 O LYS A 77 -9.378 5.327 -5.658 1.00 0.00 O ATOM 1107 CB LYS A 77 -10.909 2.802 -4.261 1.00 0.00 C ATOM 1108 CG LYS A 77 -11.895 1.721 -4.726 1.00 0.00 C ATOM 1109 CD LYS A 77 -13.315 1.800 -4.157 1.00 0.00 C ATOM 1110 CE LYS A 77 -14.131 0.582 -4.627 1.00 0.00 C ATOM 1111 NZ LYS A 77 -15.429 0.936 -5.254 1.00 0.00 N ATOM 0 H LYS A 77 -11.313 3.520 -6.657 1.00 0.00 H new ATOM 0 HA LYS A 77 -12.043 4.599 -4.022 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -9.918 2.560 -4.644 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -10.846 2.774 -3.173 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -11.960 1.764 -5.813 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -11.479 0.747 -4.470 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -13.280 1.828 -3.068 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -13.797 2.721 -4.484 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -13.537 0.012 -5.341 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -14.316 -0.071 -3.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -15.922 0.068 -5.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -16.015 1.454 -4.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -15.260 1.534 -6.088 1.00 0.00 H new ATOM 1121 N GLU A 78 -9.694 5.630 -3.458 1.00 0.00 N ATOM 1122 CA GLU A 78 -8.461 6.378 -3.240 1.00 0.00 C ATOM 1123 C GLU A 78 -7.324 5.433 -2.823 1.00 0.00 C ATOM 1124 O GLU A 78 -7.513 4.215 -2.756 1.00 0.00 O ATOM 1125 CB GLU A 78 -8.723 7.464 -2.180 1.00 0.00 C ATOM 1126 CG GLU A 78 -7.945 8.755 -2.472 1.00 0.00 C ATOM 1127 CD GLU A 78 -8.351 9.385 -3.812 1.00 0.00 C ATOM 1128 OE1 GLU A 78 -9.545 9.728 -3.968 1.00 0.00 O ATOM 1129 OE2 GLU A 78 -7.505 9.478 -4.733 1.00 0.00 O ATOM 0 H GLU A 78 -10.263 5.524 -2.618 1.00 0.00 H new ATOM 0 HA GLU A 78 -8.147 6.861 -4.165 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -9.790 7.684 -2.143 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -8.442 7.086 -1.197 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.118 9.471 -1.668 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -6.877 8.539 -2.483 1.00 0.00 H new ATOM 1134 N PHE A 79 -6.139 5.981 -2.536 1.00 0.00 N ATOM 1135 CA PHE A 79 -4.960 5.230 -2.140 1.00 0.00 C ATOM 1136 C PHE A 79 -3.981 6.140 -1.380 1.00 0.00 C ATOM 1137 O PHE A 79 -3.693 7.254 -1.837 1.00 0.00 O ATOM 1138 CB PHE A 79 -4.339 4.636 -3.405 1.00 0.00 C ATOM 1139 CG PHE A 79 -2.861 4.357 -3.278 1.00 0.00 C ATOM 1140 CD1 PHE A 79 -2.417 3.420 -2.328 1.00 0.00 C ATOM 1141 CD2 PHE A 79 -1.936 5.124 -4.009 1.00 0.00 C ATOM 1142 CE1 PHE A 79 -1.047 3.292 -2.062 1.00 0.00 C ATOM 1143 CE2 PHE A 79 -0.563 4.979 -3.756 1.00 0.00 C ATOM 1144 CZ PHE A 79 -0.127 4.087 -2.762 1.00 0.00 C ATOM 0 H PHE A 79 -5.977 6.987 -2.576 1.00 0.00 H new ATOM 0 HA PHE A 79 -5.220 4.420 -1.459 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.856 3.709 -3.652 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -4.501 5.322 -4.236 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -3.130 2.800 -1.805 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.280 5.820 -4.760 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.701 2.585 -1.322 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.156 5.551 -4.324 1.00 0.00 H new ATOM 0 HZ PHE A 79 0.926 4.013 -2.535 1.00 0.00 H new ATOM 1153 N ILE A 80 -3.497 5.687 -0.215 1.00 0.00 N ATOM 1154 CA ILE A 80 -2.584 6.381 0.701 1.00 0.00 C ATOM 1155 C ILE A 80 -1.646 5.320 1.311 1.00 0.00 C ATOM 1156 O ILE A 80 -2.029 4.151 1.385 1.00 0.00 O ATOM 1157 CB ILE A 80 -3.421 7.116 1.793 1.00 0.00 C ATOM 1158 CG1 ILE A 80 -4.381 8.169 1.184 1.00 0.00 C ATOM 1159 CG2 ILE A 80 -2.528 7.792 2.854 1.00 0.00 C ATOM 1160 CD1 ILE A 80 -5.490 8.647 2.118 1.00 0.00 C ATOM 0 H ILE A 80 -3.751 4.763 0.135 1.00 0.00 H new ATOM 0 HA ILE A 80 -1.984 7.132 0.187 1.00 0.00 H new ATOM 0 HB ILE A 80 -4.015 6.342 2.278 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -3.796 9.032 0.868 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -4.837 7.748 0.288 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -3.155 8.291 3.593 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.915 7.038 3.348 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -1.882 8.526 2.372 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -6.109 9.381 1.602 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -6.106 7.798 2.416 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -5.048 9.103 3.004 1.00 0.00 H new ATOM 1171 N LEU A 81 -0.458 5.704 1.790 1.00 0.00 N ATOM 1172 CA LEU A 81 0.472 4.855 2.553 1.00 0.00 C ATOM 1173 C LEU A 81 0.643 5.455 3.958 1.00 0.00 C ATOM 1174 O LEU A 81 0.791 6.666 4.073 1.00 0.00 O ATOM 1175 CB LEU A 81 1.863 4.879 1.886 1.00 0.00 C ATOM 1176 CG LEU A 81 1.992 4.397 0.430 1.00 0.00 C ATOM 1177 CD1 LEU A 81 3.432 4.638 -0.014 1.00 0.00 C ATOM 1178 CD2 LEU A 81 1.720 2.907 0.218 1.00 0.00 C ATOM 0 H LEU A 81 -0.102 6.650 1.653 1.00 0.00 H new ATOM 0 HA LEU A 81 0.078 3.839 2.591 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.233 5.903 1.929 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.533 4.272 2.496 1.00 0.00 H new ATOM 0 HG LEU A 81 1.243 4.950 -0.137 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.555 4.306 -1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.661 5.702 0.054 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.110 4.079 0.631 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.835 2.663 -0.838 1.00 0.00 H new ATOM 0 HD22 LEU A 81 2.427 2.321 0.805 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.704 2.674 0.536 1.00 0.00 H new ATOM 1189 N SER A 82 0.727 4.634 5.005 1.00 0.00 N ATOM 1190 CA SER A 82 0.837 5.013 6.396 1.00 0.00 C ATOM 1191 C SER A 82 2.011 4.293 7.076 1.00 0.00 C ATOM 1192 O SER A 82 2.497 3.282 6.559 1.00 0.00 O ATOM 1193 CB SER A 82 -0.512 4.664 7.037 1.00 0.00 C ATOM 1194 OG SER A 82 -0.751 3.324 7.195 1.00 0.00 O ATOM 0 H SER A 82 0.719 3.621 4.886 1.00 0.00 H new ATOM 0 HA SER A 82 1.049 6.076 6.508 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.568 5.145 8.014 1.00 0.00 H new ATOM 0 HB3 SER A 82 -1.308 5.090 6.426 1.00 0.00 H new ATOM 0 HG SER A 82 -1.155 2.965 6.378 1.00 0.00 H new ATOM 1199 N SER A 83 2.408 4.748 8.266 1.00 0.00 N ATOM 1200 CA SER A 83 3.405 4.131 9.134 1.00 0.00 C ATOM 1201 C SER A 83 4.736 3.793 8.429 1.00 0.00 C ATOM 1202 O SER A 83 5.404 2.809 8.761 1.00 0.00 O ATOM 1203 CB SER A 83 2.788 2.878 9.760 1.00 0.00 C ATOM 1204 OG SER A 83 1.568 3.129 10.397 1.00 0.00 O ATOM 0 H SER A 83 2.021 5.601 8.668 1.00 0.00 H new ATOM 0 HA SER A 83 3.672 4.861 9.898 1.00 0.00 H new ATOM 0 HB2 SER A 83 2.639 2.127 8.984 1.00 0.00 H new ATOM 0 HB3 SER A 83 3.488 2.457 10.481 1.00 0.00 H new ATOM 0 HG SER A 83 0.869 2.570 9.997 1.00 0.00 H new ATOM 1209 N LEU A 84 5.123 4.561 7.408 1.00 0.00 N ATOM 1210 CA LEU A 84 6.246 4.250 6.528 1.00 0.00 C ATOM 1211 C LEU A 84 7.553 4.324 7.298 1.00 0.00 C ATOM 1212 O LEU A 84 7.841 5.316 7.979 1.00 0.00 O ATOM 1213 CB LEU A 84 6.293 5.208 5.321 1.00 0.00 C ATOM 1214 CG LEU A 84 5.424 4.692 4.164 1.00 0.00 C ATOM 1215 CD1 LEU A 84 4.988 5.866 3.294 1.00 0.00 C ATOM 1216 CD2 LEU A 84 6.181 3.649 3.325 1.00 0.00 C ATOM 0 H LEU A 84 4.653 5.434 7.167 1.00 0.00 H new ATOM 0 HA LEU A 84 6.106 3.236 6.153 1.00 0.00 H new ATOM 0 HB2 LEU A 84 5.948 6.196 5.625 1.00 0.00 H new ATOM 0 HB3 LEU A 84 7.323 5.320 4.983 1.00 0.00 H new ATOM 0 HG LEU A 84 4.542 4.204 4.579 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.371 5.501 2.473 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.412 6.570 3.895 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.868 6.367 2.892 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.542 3.301 2.513 1.00 0.00 H new ATOM 0 HD22 LEU A 84 7.082 4.101 2.909 1.00 0.00 H new ATOM 0 HD23 LEU A 84 6.457 2.805 3.957 1.00 0.00 H new ATOM 1227 N LYS A 85 8.367 3.275 7.169 1.00 0.00 N ATOM 1228 CA LYS A 85 9.731 3.315 7.664 1.00 0.00 C ATOM 1229 C LYS A 85 10.519 4.319 6.880 1.00 0.00 C ATOM 1230 O LYS A 85 10.352 4.429 5.665 1.00 0.00 O ATOM 1231 CB LYS A 85 10.427 1.971 7.577 1.00 0.00 C ATOM 1232 CG LYS A 85 9.656 0.927 8.360 1.00 0.00 C ATOM 1233 CD LYS A 85 10.599 -0.210 8.721 1.00 0.00 C ATOM 1234 CE LYS A 85 9.790 -1.196 9.552 1.00 0.00 C ATOM 1235 NZ LYS A 85 10.621 -2.020 10.456 1.00 0.00 N ATOM 0 H LYS A 85 8.101 2.395 6.727 1.00 0.00 H new ATOM 0 HA LYS A 85 9.679 3.593 8.717 1.00 0.00 H new ATOM 0 HB2 LYS A 85 10.511 1.664 6.534 1.00 0.00 H new ATOM 0 HB3 LYS A 85 11.441 2.053 7.968 1.00 0.00 H new ATOM 0 HG2 LYS A 85 9.234 1.368 9.263 1.00 0.00 H new ATOM 0 HG3 LYS A 85 8.821 0.552 7.768 1.00 0.00 H new ATOM 0 HD2 LYS A 85 10.991 -0.689 7.824 1.00 0.00 H new ATOM 0 HD3 LYS A 85 11.456 0.161 9.284 1.00 0.00 H new ATOM 0 HE2 LYS A 85 9.057 -0.647 10.143 1.00 0.00 H new ATOM 0 HE3 LYS A 85 9.233 -1.852 8.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 10.076 -2.257 11.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 10.900 -2.896 9.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 11.473 -1.488 10.726 1.00 0.00 H new ATOM 1245 N GLU A 86 11.468 4.934 7.563 1.00 0.00 N ATOM 1246 CA GLU A 86 12.300 5.973 6.963 1.00 0.00 C ATOM 1247 C GLU A 86 13.034 5.385 5.758 1.00 0.00 C ATOM 1248 O GLU A 86 13.121 5.995 4.691 1.00 0.00 O ATOM 1249 CB GLU A 86 13.294 6.520 7.998 1.00 0.00 C ATOM 1250 CG GLU A 86 14.151 7.648 7.401 1.00 0.00 C ATOM 1251 CD GLU A 86 15.335 8.000 8.292 1.00 0.00 C ATOM 1252 OE1 GLU A 86 16.408 7.347 8.126 1.00 0.00 O ATOM 1253 OE2 GLU A 86 15.229 8.935 9.100 1.00 0.00 O ATOM 0 H GLU A 86 11.686 4.734 8.539 1.00 0.00 H new ATOM 0 HA GLU A 86 11.675 6.802 6.631 1.00 0.00 H new ATOM 0 HB2 GLU A 86 12.751 6.893 8.867 1.00 0.00 H new ATOM 0 HB3 GLU A 86 13.940 5.715 8.347 1.00 0.00 H new ATOM 0 HG2 GLU A 86 14.514 7.346 6.419 1.00 0.00 H new ATOM 0 HG3 GLU A 86 13.533 8.533 7.254 1.00 0.00 H new ATOM 1258 N SER A 87 13.495 4.143 5.907 1.00 0.00 N ATOM 1259 CA SER A 87 14.344 3.476 4.925 1.00 0.00 C ATOM 1260 C SER A 87 13.611 3.194 3.605 1.00 0.00 C ATOM 1261 O SER A 87 14.259 2.890 2.607 1.00 0.00 O ATOM 1262 CB SER A 87 14.905 2.187 5.532 1.00 0.00 C ATOM 1263 OG SER A 87 15.529 2.480 6.769 1.00 0.00 O ATOM 0 H SER A 87 13.286 3.567 6.723 1.00 0.00 H new ATOM 0 HA SER A 87 15.164 4.149 4.676 1.00 0.00 H new ATOM 0 HB2 SER A 87 14.104 1.463 5.679 1.00 0.00 H new ATOM 0 HB3 SER A 87 15.623 1.733 4.849 1.00 0.00 H new ATOM 0 HG SER A 87 15.887 1.655 7.159 1.00 0.00 H new ATOM 1268 N ILE A 88 12.283 3.340 3.595 1.00 0.00 N ATOM 1269 CA ILE A 88 11.351 3.034 2.518 1.00 0.00 C ATOM 1270 C ILE A 88 10.755 4.351 2.030 1.00 0.00 C ATOM 1271 O ILE A 88 10.629 4.600 0.835 1.00 0.00 O ATOM 1272 CB ILE A 88 10.235 2.122 3.068 1.00 0.00 C ATOM 1273 CG1 ILE A 88 10.743 0.929 3.914 1.00 0.00 C ATOM 1274 CG2 ILE A 88 9.314 1.679 1.925 1.00 0.00 C ATOM 1275 CD1 ILE A 88 11.557 -0.130 3.183 1.00 0.00 C ATOM 0 H ILE A 88 11.796 3.707 4.413 1.00 0.00 H new ATOM 0 HA ILE A 88 11.853 2.524 1.696 1.00 0.00 H new ATOM 0 HB ILE A 88 9.660 2.719 3.776 1.00 0.00 H new ATOM 0 HG12 ILE A 88 11.351 1.324 4.728 1.00 0.00 H new ATOM 0 HG13 ILE A 88 9.880 0.442 4.368 1.00 0.00 H new ATOM 0 HG21 ILE A 88 8.528 1.035 2.320 1.00 0.00 H new ATOM 0 HG22 ILE A 88 8.865 2.556 1.459 1.00 0.00 H new ATOM 0 HG23 ILE A 88 9.894 1.130 1.183 1.00 0.00 H new ATOM 0 HD11 ILE A 88 11.853 -0.910 3.885 1.00 0.00 H new ATOM 0 HD12 ILE A 88 10.954 -0.567 2.387 1.00 0.00 H new ATOM 0 HD13 ILE A 88 12.448 0.328 2.753 1.00 0.00 H new ATOM 1286 N SER A 89 10.422 5.222 2.974 1.00 0.00 N ATOM 1287 CA SER A 89 9.827 6.512 2.707 1.00 0.00 C ATOM 1288 C SER A 89 10.809 7.359 1.881 1.00 0.00 C ATOM 1289 O SER A 89 10.426 8.008 0.903 1.00 0.00 O ATOM 1290 CB SER A 89 9.410 7.208 4.010 1.00 0.00 C ATOM 1291 OG SER A 89 8.172 7.856 3.815 1.00 0.00 O ATOM 0 H SER A 89 10.564 5.041 3.968 1.00 0.00 H new ATOM 0 HA SER A 89 8.915 6.381 2.125 1.00 0.00 H new ATOM 0 HB2 SER A 89 9.329 6.479 4.816 1.00 0.00 H new ATOM 0 HB3 SER A 89 10.169 7.931 4.309 1.00 0.00 H new ATOM 0 HG SER A 89 7.901 8.300 4.645 1.00 0.00 H new ATOM 1296 N ARG A 90 12.111 7.273 2.200 1.00 0.00 N ATOM 1297 CA ARG A 90 13.169 7.763 1.322 1.00 0.00 C ATOM 1298 C ARG A 90 13.061 7.116 -0.044 1.00 0.00 C ATOM 1299 O ARG A 90 13.017 7.843 -1.019 1.00 0.00 O ATOM 1300 CB ARG A 90 14.563 7.606 1.961 1.00 0.00 C ATOM 1301 CG ARG A 90 15.146 6.182 1.901 1.00 0.00 C ATOM 1302 CD ARG A 90 16.411 6.102 2.742 1.00 0.00 C ATOM 1303 NE ARG A 90 17.060 4.783 2.704 1.00 0.00 N ATOM 1304 CZ ARG A 90 18.345 4.584 3.029 1.00 0.00 C ATOM 1305 NH1 ARG A 90 19.080 5.564 3.553 1.00 0.00 N ATOM 1306 NH2 ARG A 90 18.904 3.403 2.822 1.00 0.00 N ATOM 0 H ARG A 90 12.451 6.863 3.070 1.00 0.00 H new ATOM 0 HA ARG A 90 13.035 8.835 1.180 1.00 0.00 H new ATOM 0 HB2 ARG A 90 15.254 8.287 1.464 1.00 0.00 H new ATOM 0 HB3 ARG A 90 14.506 7.916 3.004 1.00 0.00 H new ATOM 0 HG2 ARG A 90 14.411 5.464 2.265 1.00 0.00 H new ATOM 0 HG3 ARG A 90 15.369 5.914 0.868 1.00 0.00 H new ATOM 0 HD2 ARG A 90 17.117 6.855 2.394 1.00 0.00 H new ATOM 0 HD3 ARG A 90 16.167 6.348 3.775 1.00 0.00 H new ATOM 0 HE ARG A 90 16.504 3.978 2.415 1.00 0.00 H new ATOM 0 HH11 ARG A 90 18.666 6.483 3.712 1.00 0.00 H new ATOM 0 HH12 ARG A 90 20.057 5.396 3.795 1.00 0.00 H new ATOM 0 HH21 ARG A 90 18.357 2.644 2.415 1.00 0.00 H new ATOM 0 HH22 ARG A 90 19.882 3.251 3.069 1.00 0.00 H new ATOM 1317 N ILE A 91 13.041 5.792 -0.156 1.00 0.00 N ATOM 1318 CA ILE A 91 13.267 5.049 -1.384 1.00 0.00 C ATOM 1319 C ILE A 91 12.228 5.478 -2.424 1.00 0.00 C ATOM 1320 O ILE A 91 12.554 5.689 -3.594 1.00 0.00 O ATOM 1321 CB ILE A 91 13.124 3.541 -1.005 1.00 0.00 C ATOM 1322 CG1 ILE A 91 14.465 2.877 -0.685 1.00 0.00 C ATOM 1323 CG2 ILE A 91 12.364 2.728 -2.060 1.00 0.00 C ATOM 1324 CD1 ILE A 91 14.311 1.444 -0.144 1.00 0.00 C ATOM 0 H ILE A 91 12.859 5.184 0.643 1.00 0.00 H new ATOM 0 HA ILE A 91 14.250 5.234 -1.818 1.00 0.00 H new ATOM 0 HB ILE A 91 12.527 3.539 -0.093 1.00 0.00 H new ATOM 0 HG12 ILE A 91 15.078 2.856 -1.586 1.00 0.00 H new ATOM 0 HG13 ILE A 91 14.998 3.482 0.049 1.00 0.00 H new ATOM 0 HG21 ILE A 91 12.297 1.688 -1.740 1.00 0.00 H new ATOM 0 HG22 ILE A 91 11.360 3.136 -2.180 1.00 0.00 H new ATOM 0 HG23 ILE A 91 12.893 2.781 -3.011 1.00 0.00 H new ATOM 0 HD11 ILE A 91 15.296 1.026 0.064 1.00 0.00 H new ATOM 0 HD12 ILE A 91 13.723 1.463 0.774 1.00 0.00 H new ATOM 0 HD13 ILE A 91 13.805 0.827 -0.887 1.00 0.00 H new ATOM 1335 N LEU A 92 10.977 5.658 -1.986 1.00 0.00 N ATOM 1336 CA LEU A 92 9.909 6.209 -2.779 1.00 0.00 C ATOM 1337 C LEU A 92 10.396 7.520 -3.377 1.00 0.00 C ATOM 1338 O LEU A 92 10.423 7.672 -4.591 1.00 0.00 O ATOM 1339 CB LEU A 92 8.664 6.373 -1.889 1.00 0.00 C ATOM 1340 CG LEU A 92 8.085 5.021 -1.419 1.00 0.00 C ATOM 1341 CD1 LEU A 92 7.115 5.187 -0.249 1.00 0.00 C ATOM 1342 CD2 LEU A 92 7.388 4.290 -2.564 1.00 0.00 C ATOM 0 H LEU A 92 10.687 5.412 -1.040 1.00 0.00 H new ATOM 0 HA LEU A 92 9.626 5.553 -3.602 1.00 0.00 H new ATOM 0 HB2 LEU A 92 8.922 6.976 -1.018 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.898 6.920 -2.439 1.00 0.00 H new ATOM 0 HG LEU A 92 8.931 4.424 -1.078 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.733 4.210 0.048 1.00 0.00 H new ATOM 0 HD12 LEU A 92 7.635 5.644 0.593 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.285 5.825 -0.552 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.991 3.342 -2.202 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.572 4.904 -2.944 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.103 4.102 -3.364 1.00 0.00 H new ATOM 1353 N LYS A 93 10.895 8.450 -2.571 1.00 0.00 N ATOM 1354 CA LYS A 93 11.404 9.739 -3.007 1.00 0.00 C ATOM 1355 C LYS A 93 12.642 9.590 -3.892 1.00 0.00 C ATOM 1356 O LYS A 93 12.746 10.303 -4.895 1.00 0.00 O ATOM 1357 CB LYS A 93 11.544 10.627 -1.753 1.00 0.00 C ATOM 1358 CG LYS A 93 12.713 11.614 -1.655 1.00 0.00 C ATOM 1359 CD LYS A 93 12.299 12.849 -0.828 1.00 0.00 C ATOM 1360 CE LYS A 93 13.465 13.444 -0.040 1.00 0.00 C ATOM 1361 NZ LYS A 93 13.050 14.567 0.827 1.00 0.00 N ATOM 0 H LYS A 93 10.957 8.320 -1.561 1.00 0.00 H new ATOM 0 HA LYS A 93 10.714 10.252 -3.677 1.00 0.00 H new ATOM 0 HB2 LYS A 93 10.623 11.201 -1.654 1.00 0.00 H new ATOM 0 HB3 LYS A 93 11.602 9.965 -0.889 1.00 0.00 H new ATOM 0 HG2 LYS A 93 13.571 11.128 -1.191 1.00 0.00 H new ATOM 0 HG3 LYS A 93 13.023 11.923 -2.653 1.00 0.00 H new ATOM 0 HD2 LYS A 93 11.890 13.608 -1.495 1.00 0.00 H new ATOM 0 HD3 LYS A 93 11.503 12.570 -0.138 1.00 0.00 H new ATOM 0 HE2 LYS A 93 13.920 12.665 0.573 1.00 0.00 H new ATOM 0 HE3 LYS A 93 14.230 13.790 -0.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 13.877 14.934 1.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 12.640 15.324 0.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 12.340 14.234 1.510 1.00 0.00 H new ATOM 1371 N LEU A 94 13.516 8.618 -3.634 1.00 0.00 N ATOM 1372 CA LEU A 94 14.624 8.250 -4.516 1.00 0.00 C ATOM 1373 C LEU A 94 14.140 7.770 -5.891 1.00 0.00 C ATOM 1374 O LEU A 94 14.896 7.853 -6.860 1.00 0.00 O ATOM 1375 CB LEU A 94 15.528 7.186 -3.856 1.00 0.00 C ATOM 1376 CG LEU A 94 16.431 7.753 -2.744 1.00 0.00 C ATOM 1377 CD1 LEU A 94 15.901 7.928 -1.334 1.00 0.00 C ATOM 1378 CD2 LEU A 94 17.750 7.002 -2.607 1.00 0.00 C ATOM 0 H LEU A 94 13.473 8.051 -2.787 1.00 0.00 H new ATOM 0 HA LEU A 94 15.211 9.154 -4.678 1.00 0.00 H new ATOM 0 HB2 LEU A 94 14.902 6.397 -3.438 1.00 0.00 H new ATOM 0 HB3 LEU A 94 16.153 6.726 -4.621 1.00 0.00 H new ATOM 0 HG LEU A 94 16.526 8.761 -3.147 1.00 0.00 H new ATOM 0 HD11 LEU A 94 16.686 8.339 -0.699 1.00 0.00 H new ATOM 0 HD12 LEU A 94 15.050 8.609 -1.347 1.00 0.00 H new ATOM 0 HD13 LEU A 94 15.586 6.961 -0.941 1.00 0.00 H new ATOM 0 HD21 LEU A 94 18.342 7.449 -1.808 1.00 0.00 H new ATOM 0 HD22 LEU A 94 17.551 5.957 -2.370 1.00 0.00 H new ATOM 0 HD23 LEU A 94 18.302 7.063 -3.545 1.00 0.00 H new ATOM 1389 N THR A 95 12.873 7.385 -6.021 1.00 0.00 N ATOM 1390 CA THR A 95 12.249 6.928 -7.263 1.00 0.00 C ATOM 1391 C THR A 95 11.132 7.889 -7.713 1.00 0.00 C ATOM 1392 O THR A 95 10.282 7.558 -8.538 1.00 0.00 O ATOM 1393 CB THR A 95 11.823 5.452 -7.090 1.00 0.00 C ATOM 1394 OG1 THR A 95 12.730 4.743 -6.255 1.00 0.00 O ATOM 1395 CG2 THR A 95 11.796 4.709 -8.429 1.00 0.00 C ATOM 0 H THR A 95 12.226 7.382 -5.233 1.00 0.00 H new ATOM 0 HA THR A 95 12.959 6.951 -8.090 1.00 0.00 H new ATOM 0 HB THR A 95 10.828 5.484 -6.647 1.00 0.00 H new ATOM 0 HG1 THR A 95 12.573 4.988 -5.319 1.00 0.00 H new ATOM 0 HG21 THR A 95 11.492 3.675 -8.265 1.00 0.00 H new ATOM 0 HG22 THR A 95 11.087 5.194 -9.100 1.00 0.00 H new ATOM 0 HG23 THR A 95 12.790 4.729 -8.876 1.00 0.00 H new ATOM 1403 N HIS A 96 11.155 9.117 -7.181 1.00 0.00 N ATOM 1404 CA HIS A 96 10.162 10.178 -7.329 1.00 0.00 C ATOM 1405 C HIS A 96 8.726 9.742 -7.030 1.00 0.00 C ATOM 1406 O HIS A 96 7.791 10.286 -7.606 1.00 0.00 O ATOM 1407 CB HIS A 96 10.177 10.851 -8.711 1.00 0.00 C ATOM 1408 CG HIS A 96 11.518 11.220 -9.288 1.00 0.00 C ATOM 1409 ND1 HIS A 96 12.681 11.509 -8.594 1.00 0.00 N ATOM 1410 CD2 HIS A 96 11.769 11.381 -10.622 1.00 0.00 C ATOM 1411 CE1 HIS A 96 13.623 11.815 -9.500 1.00 0.00 C ATOM 1412 NE2 HIS A 96 13.086 11.770 -10.734 1.00 0.00 N ATOM 0 H HIS A 96 11.931 9.414 -6.590 1.00 0.00 H new ATOM 0 HA HIS A 96 10.474 10.898 -6.573 1.00 0.00 H new ATOM 0 HB2 HIS A 96 9.679 10.185 -9.415 1.00 0.00 H new ATOM 0 HB3 HIS A 96 9.575 11.758 -8.650 1.00 0.00 H new ATOM 0 HD2 HIS A 96 11.070 11.232 -11.432 1.00 0.00 H new ATOM 0 HE1 HIS A 96 14.651 12.059 -9.275 1.00 0.00 H new ATOM 0 HE2 HIS A 96 13.572 11.987 -11.604 1.00 0.00 H new ATOM 1420 N LEU A 97 8.531 8.746 -6.184 1.00 0.00 N ATOM 1421 CA LEU A 97 7.234 8.197 -5.858 1.00 0.00 C ATOM 1422 C LEU A 97 6.552 8.957 -4.734 1.00 0.00 C ATOM 1423 O LEU A 97 5.324 9.011 -4.718 1.00 0.00 O ATOM 1424 CB LEU A 97 7.377 6.717 -5.486 1.00 0.00 C ATOM 1425 CG LEU A 97 6.654 5.866 -6.538 1.00 0.00 C ATOM 1426 CD1 LEU A 97 7.461 5.755 -7.836 1.00 0.00 C ATOM 1427 CD2 LEU A 97 6.432 4.497 -5.932 1.00 0.00 C ATOM 0 H LEU A 97 9.297 8.285 -5.692 1.00 0.00 H new ATOM 0 HA LEU A 97 6.603 8.297 -6.741 1.00 0.00 H new ATOM 0 HB2 LEU A 97 8.430 6.441 -5.438 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.954 6.534 -4.498 1.00 0.00 H new ATOM 0 HG LEU A 97 5.707 6.336 -6.804 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.913 5.144 -8.554 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.619 6.750 -8.252 1.00 0.00 H new ATOM 0 HD13 LEU A 97 8.425 5.292 -7.627 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.918 3.859 -6.652 1.00 0.00 H new ATOM 0 HD22 LEU A 97 7.394 4.053 -5.675 1.00 0.00 H new ATOM 0 HD23 LEU A 97 5.824 4.592 -5.032 1.00 0.00 H new ATOM 1438 N ASP A 98 7.296 9.537 -3.787 1.00 0.00 N ATOM 1439 CA ASP A 98 6.667 10.251 -2.667 1.00 0.00 C ATOM 1440 C ASP A 98 5.888 11.458 -3.192 1.00 0.00 C ATOM 1441 O ASP A 98 4.788 11.728 -2.714 1.00 0.00 O ATOM 1442 CB ASP A 98 7.670 10.599 -1.550 1.00 0.00 C ATOM 1443 CG ASP A 98 7.850 12.105 -1.328 1.00 0.00 C ATOM 1444 OD1 ASP A 98 8.601 12.730 -2.113 1.00 0.00 O ATOM 1445 OD2 ASP A 98 7.304 12.672 -0.361 1.00 0.00 O ATOM 0 H ASP A 98 8.316 9.529 -3.770 1.00 0.00 H new ATOM 0 HA ASP A 98 5.950 9.585 -2.188 1.00 0.00 H new ATOM 0 HB2 ASP A 98 7.336 10.141 -0.619 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.637 10.159 -1.793 1.00 0.00 H new ATOM 1449 N LYS A 99 6.381 12.106 -4.255 1.00 0.00 N ATOM 1450 CA LYS A 99 5.682 13.198 -4.908 1.00 0.00 C ATOM 1451 C LYS A 99 4.341 12.784 -5.538 1.00 0.00 C ATOM 1452 O LYS A 99 3.518 13.678 -5.720 1.00 0.00 O ATOM 1453 CB LYS A 99 6.609 13.968 -5.876 1.00 0.00 C ATOM 1454 CG LYS A 99 7.273 13.080 -6.912 1.00 0.00 C ATOM 1455 CD LYS A 99 7.749 13.790 -8.196 1.00 0.00 C ATOM 1456 CE LYS A 99 6.988 13.226 -9.407 1.00 0.00 C ATOM 1457 NZ LYS A 99 7.618 13.492 -10.717 1.00 0.00 N ATOM 0 H LYS A 99 7.280 11.880 -4.681 1.00 0.00 H new ATOM 0 HA LYS A 99 5.401 13.899 -4.122 1.00 0.00 H new ATOM 0 HB2 LYS A 99 6.030 14.738 -6.386 1.00 0.00 H new ATOM 0 HB3 LYS A 99 7.380 14.479 -5.299 1.00 0.00 H new ATOM 0 HG2 LYS A 99 8.131 12.592 -6.449 1.00 0.00 H new ATOM 0 HG3 LYS A 99 6.572 12.294 -7.192 1.00 0.00 H new ATOM 0 HD2 LYS A 99 7.579 14.864 -8.115 1.00 0.00 H new ATOM 0 HD3 LYS A 99 8.821 13.646 -8.328 1.00 0.00 H new ATOM 0 HE2 LYS A 99 6.884 12.148 -9.282 1.00 0.00 H new ATOM 0 HE3 LYS A 99 5.982 13.645 -9.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 7.037 13.076 -11.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 7.693 14.519 -10.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 8.568 13.069 -10.738 1.00 0.00 H new ATOM 1467 N ILE A 100 4.069 11.506 -5.848 1.00 0.00 N ATOM 1468 CA ILE A 100 2.946 11.095 -6.717 1.00 0.00 C ATOM 1469 C ILE A 100 1.959 10.153 -6.011 1.00 0.00 C ATOM 1470 O ILE A 100 1.085 9.561 -6.644 1.00 0.00 O ATOM 1471 CB ILE A 100 3.497 10.507 -8.037 1.00 0.00 C ATOM 1472 CG1 ILE A 100 4.586 9.452 -7.814 1.00 0.00 C ATOM 1473 CG2 ILE A 100 4.013 11.646 -8.933 1.00 0.00 C ATOM 1474 CD1 ILE A 100 5.055 8.755 -9.092 1.00 0.00 C ATOM 0 H ILE A 100 4.623 10.722 -5.503 1.00 0.00 H new ATOM 0 HA ILE A 100 2.359 11.982 -6.957 1.00 0.00 H new ATOM 0 HB ILE A 100 2.675 9.992 -8.534 1.00 0.00 H new ATOM 0 HG12 ILE A 100 5.443 9.926 -7.337 1.00 0.00 H new ATOM 0 HG13 ILE A 100 4.211 8.700 -7.120 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.401 11.230 -9.863 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.196 12.332 -9.156 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.808 12.184 -8.416 1.00 0.00 H new ATOM 0 HD11 ILE A 100 5.825 8.024 -8.846 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.211 8.249 -9.561 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.463 9.495 -9.781 1.00 0.00 H new ATOM 1485 N PHE A 101 2.138 9.988 -4.704 1.00 0.00 N ATOM 1486 CA PHE A 101 1.425 9.133 -3.766 1.00 0.00 C ATOM 1487 C PHE A 101 0.975 10.004 -2.580 1.00 0.00 C ATOM 1488 O PHE A 101 1.161 11.229 -2.600 1.00 0.00 O ATOM 1489 CB PHE A 101 2.430 8.080 -3.283 1.00 0.00 C ATOM 1490 CG PHE A 101 2.637 6.802 -4.077 1.00 0.00 C ATOM 1491 CD1 PHE A 101 2.774 6.762 -5.475 1.00 0.00 C ATOM 1492 CD2 PHE A 101 2.813 5.612 -3.358 1.00 0.00 C ATOM 1493 CE1 PHE A 101 3.078 5.561 -6.126 1.00 0.00 C ATOM 1494 CE2 PHE A 101 3.125 4.409 -3.984 1.00 0.00 C ATOM 1495 CZ PHE A 101 3.244 4.402 -5.368 1.00 0.00 C ATOM 0 H PHE A 101 2.871 10.511 -4.224 1.00 0.00 H new ATOM 0 HA PHE A 101 0.554 8.656 -4.217 1.00 0.00 H new ATOM 0 HB2 PHE A 101 3.400 8.571 -3.203 1.00 0.00 H new ATOM 0 HB3 PHE A 101 2.135 7.790 -2.275 1.00 0.00 H new ATOM 0 HD1 PHE A 101 2.644 7.666 -6.052 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.703 5.629 -2.284 1.00 0.00 H new ATOM 0 HE1 PHE A 101 3.183 5.532 -7.201 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.271 3.506 -3.410 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.471 3.474 -5.871 1.00 0.00 H new ATOM 1504 N LYS A 102 0.455 9.396 -1.507 1.00 0.00 N ATOM 1505 CA LYS A 102 0.318 10.066 -0.214 1.00 0.00 C ATOM 1506 C LYS A 102 0.985 9.238 0.857 1.00 0.00 C ATOM 1507 O LYS A 102 0.973 8.011 0.772 1.00 0.00 O ATOM 1508 CB LYS A 102 -1.162 10.338 0.099 1.00 0.00 C ATOM 1509 CG LYS A 102 -1.329 11.233 1.346 1.00 0.00 C ATOM 1510 CD LYS A 102 -2.354 12.359 1.218 1.00 0.00 C ATOM 1511 CE LYS A 102 -3.800 11.886 1.354 1.00 0.00 C ATOM 1512 NZ LYS A 102 -4.702 13.042 1.484 1.00 0.00 N ATOM 0 H LYS A 102 0.120 8.432 -1.513 1.00 0.00 H new ATOM 0 HA LYS A 102 0.817 11.035 -0.248 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.633 10.818 -0.759 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.680 9.392 0.258 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.612 10.602 2.189 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.361 11.673 1.588 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.153 13.111 1.981 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.229 12.845 0.251 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -4.080 11.293 0.483 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -3.898 11.239 2.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -5.683 12.708 1.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -4.443 13.591 2.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -4.619 13.644 0.640 1.00 0.00 H new ATOM 1522 N ILE A 103 1.532 9.947 1.839 1.00 0.00 N ATOM 1523 CA ILE A 103 2.151 9.429 3.029 1.00 0.00 C ATOM 1524 C ILE A 103 1.415 10.072 4.209 1.00 0.00 C ATOM 1525 O ILE A 103 1.293 11.304 4.221 1.00 0.00 O ATOM 1526 CB ILE A 103 3.673 9.732 3.026 1.00 0.00 C ATOM 1527 CG1 ILE A 103 4.414 9.000 1.880 1.00 0.00 C ATOM 1528 CG2 ILE A 103 4.291 9.355 4.388 1.00 0.00 C ATOM 1529 CD1 ILE A 103 4.533 9.810 0.583 1.00 0.00 C ATOM 0 H ILE A 103 1.550 10.966 1.811 1.00 0.00 H new ATOM 0 HA ILE A 103 2.073 8.344 3.095 1.00 0.00 H new ATOM 0 HB ILE A 103 3.792 10.802 2.856 1.00 0.00 H new ATOM 0 HG12 ILE A 103 5.415 8.735 2.222 1.00 0.00 H new ATOM 0 HG13 ILE A 103 3.893 8.067 1.665 1.00 0.00 H new ATOM 0 HG21 ILE A 103 5.359 9.572 4.375 1.00 0.00 H new ATOM 0 HG22 ILE A 103 3.813 9.935 5.178 1.00 0.00 H new ATOM 0 HG23 ILE A 103 4.138 8.292 4.575 1.00 0.00 H new ATOM 0 HD11 ILE A 103 5.065 9.223 -0.165 1.00 0.00 H new ATOM 0 HD12 ILE A 103 3.537 10.053 0.213 1.00 0.00 H new ATOM 0 HD13 ILE A 103 5.082 10.731 0.778 1.00 0.00 H new ATOM 1540 N THR A 104 0.971 9.264 5.172 1.00 0.00 N ATOM 1541 CA THR A 104 0.425 9.678 6.455 1.00 0.00 C ATOM 1542 C THR A 104 1.117 8.921 7.585 1.00 0.00 C ATOM 1543 O THR A 104 1.906 7.997 7.372 1.00 0.00 O ATOM 1544 CB THR A 104 -1.109 9.500 6.487 1.00 0.00 C ATOM 1545 OG1 THR A 104 -1.515 8.159 6.257 1.00 0.00 O ATOM 1546 CG2 THR A 104 -1.820 10.410 5.482 1.00 0.00 C ATOM 0 H THR A 104 0.985 8.249 5.068 1.00 0.00 H new ATOM 0 HA THR A 104 0.620 10.741 6.598 1.00 0.00 H new ATOM 0 HB THR A 104 -1.402 9.783 7.498 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.904 7.790 7.077 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.896 10.248 5.542 1.00 0.00 H new ATOM 0 HG22 THR A 104 -1.596 11.452 5.713 1.00 0.00 H new ATOM 0 HG23 THR A 104 -1.474 10.179 4.474 1.00 0.00 H new ATOM 1554 N ASP A 105 0.833 9.316 8.818 1.00 0.00 N ATOM 1555 CA ASP A 105 1.401 8.687 9.998 1.00 0.00 C ATOM 1556 C ASP A 105 0.678 7.406 10.302 1.00 0.00 C ATOM 1557 O ASP A 105 1.301 6.371 10.520 1.00 0.00 O ATOM 1558 CB ASP A 105 1.232 9.596 11.224 1.00 0.00 C ATOM 1559 CG ASP A 105 2.529 9.582 12.005 1.00 0.00 C ATOM 1560 OD1 ASP A 105 3.528 10.147 11.521 1.00 0.00 O ATOM 1561 OD2 ASP A 105 2.552 8.910 13.069 1.00 0.00 O ATOM 0 H ASP A 105 0.198 10.086 9.027 1.00 0.00 H new ATOM 0 HA ASP A 105 2.456 8.502 9.795 1.00 0.00 H new ATOM 0 HB2 ASP A 105 0.986 10.611 10.913 1.00 0.00 H new ATOM 0 HB3 ASP A 105 0.409 9.245 11.847 1.00 0.00 H new ATOM 1565 N THR A 106 -0.639 7.518 10.352 1.00 0.00 N ATOM 1566 CA THR A 106 -1.542 6.488 10.769 1.00 0.00 C ATOM 1567 C THR A 106 -2.444 6.230 9.576 1.00 0.00 C ATOM 1568 O THR A 106 -2.673 7.093 8.716 1.00 0.00 O ATOM 1569 CB THR A 106 -2.275 6.953 12.045 1.00 0.00 C ATOM 1570 OG1 THR A 106 -2.838 8.245 11.897 1.00 0.00 O ATOM 1571 CG2 THR A 106 -1.325 6.991 13.245 1.00 0.00 C ATOM 0 H THR A 106 -1.119 8.378 10.087 1.00 0.00 H new ATOM 0 HA THR A 106 -1.059 5.551 11.045 1.00 0.00 H new ATOM 0 HB THR A 106 -3.072 6.228 12.213 1.00 0.00 H new ATOM 0 HG1 THR A 106 -3.294 8.500 12.726 1.00 0.00 H new ATOM 0 HG21 THR A 106 -1.869 7.322 14.130 1.00 0.00 H new ATOM 0 HG22 THR A 106 -0.920 5.994 13.420 1.00 0.00 H new ATOM 0 HG23 THR A 106 -0.509 7.684 13.041 1.00 0.00 H new ATOM 1579 N VAL A 107 -3.008 5.036 9.547 1.00 0.00 N ATOM 1580 CA VAL A 107 -4.091 4.671 8.659 1.00 0.00 C ATOM 1581 C VAL A 107 -5.312 5.570 8.899 1.00 0.00 C ATOM 1582 O VAL A 107 -6.176 5.711 8.038 1.00 0.00 O ATOM 1583 CB VAL A 107 -4.407 3.182 8.852 1.00 0.00 C ATOM 1584 CG1 VAL A 107 -3.204 2.303 8.514 1.00 0.00 C ATOM 1585 CG2 VAL A 107 -4.805 2.886 10.295 1.00 0.00 C ATOM 0 H VAL A 107 -2.715 4.274 10.159 1.00 0.00 H new ATOM 0 HA VAL A 107 -3.798 4.825 7.621 1.00 0.00 H new ATOM 0 HB VAL A 107 -5.233 2.955 8.177 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -3.466 1.255 8.663 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.918 2.462 7.474 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.369 2.564 9.164 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -5.023 1.823 10.402 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.986 3.157 10.961 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -5.691 3.466 10.554 1.00 0.00 H new ATOM 1595 N GLU A 108 -5.369 6.185 10.080 1.00 0.00 N ATOM 1596 CA GLU A 108 -6.450 7.014 10.569 1.00 0.00 C ATOM 1597 C GLU A 108 -6.315 8.467 10.121 1.00 0.00 C ATOM 1598 O GLU A 108 -7.340 9.135 9.969 1.00 0.00 O ATOM 1599 CB GLU A 108 -6.444 6.933 12.099 1.00 0.00 C ATOM 1600 CG GLU A 108 -6.781 5.507 12.560 1.00 0.00 C ATOM 1601 CD GLU A 108 -7.810 5.504 13.684 1.00 0.00 C ATOM 1602 OE1 GLU A 108 -9.009 5.688 13.350 1.00 0.00 O ATOM 1603 OE2 GLU A 108 -7.411 5.267 14.845 1.00 0.00 O ATOM 0 H GLU A 108 -4.610 6.107 10.757 1.00 0.00 H new ATOM 0 HA GLU A 108 -7.391 6.648 10.157 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -5.466 7.224 12.481 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -7.169 7.636 12.510 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.163 4.933 11.716 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -5.872 5.010 12.898 1.00 0.00 H new ATOM 1608 N GLU A 109 -5.096 8.970 9.874 1.00 0.00 N ATOM 1609 CA GLU A 109 -4.903 10.333 9.396 1.00 0.00 C ATOM 1610 C GLU A 109 -5.444 10.515 7.965 1.00 0.00 C ATOM 1611 O GLU A 109 -5.771 11.645 7.577 1.00 0.00 O ATOM 1612 CB GLU A 109 -3.403 10.600 9.514 1.00 0.00 C ATOM 1613 CG GLU A 109 -2.944 11.925 8.919 1.00 0.00 C ATOM 1614 CD GLU A 109 -1.540 12.218 9.415 1.00 0.00 C ATOM 1615 OE1 GLU A 109 -1.442 12.808 10.497 1.00 0.00 O ATOM 1616 OE2 GLU A 109 -0.562 11.855 8.692 1.00 0.00 O ATOM 0 H GLU A 109 -4.231 8.445 10.000 1.00 0.00 H new ATOM 0 HA GLU A 109 -5.464 11.057 9.986 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -3.125 10.575 10.568 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -2.864 9.790 9.022 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -2.958 11.876 7.830 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -3.623 12.726 9.211 1.00 0.00 H new ATOM 1621 N ALA A 110 -5.587 9.405 7.223 1.00 0.00 N ATOM 1622 CA ALA A 110 -6.134 9.387 5.874 1.00 0.00 C ATOM 1623 C ALA A 110 -7.531 10.010 5.835 1.00 0.00 C ATOM 1624 O ALA A 110 -7.743 10.928 5.006 1.00 0.00 O ATOM 1625 CB ALA A 110 -6.188 7.938 5.382 1.00 0.00 C ATOM 0 H ALA A 110 -5.317 8.481 7.559 1.00 0.00 H new ATOM 0 HA ALA A 110 -5.491 9.979 5.223 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -6.596 7.912 4.372 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -5.182 7.517 5.378 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -6.824 7.352 6.046 1.00 0.00 H new TER 1631 ALA A 110