USER MOD reduce.3.24.130724 H: found=0, std=0, add=1079, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1076 hydrogens (30 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 NoAdj-H: A 90 HIS HE2 : A 90 HIS NE2 : A 148 HEMFE :(H bumps) USER MOD Set 1.1: A 41 MET CE :methyl 138:sc= -5.68! (180deg=-3.5!) USER MOD Set 1.2: A 148 HEM CMB :methyl -30:sc= -8.96! (180deg=-5.25!) USER MOD Set 2.1: A 114 MET CE :methyl 138:sc= -8.09! (180deg=-13.2!) USER MOD Set 2.2: A 134 TYR OH : rot 58:sc= -4.03! USER MOD Set 3.1: A 72 HIS : no HD1:sc= -4.73! C(o=-4.7!,f=-5.4!) USER MOD Set 3.2: A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 3 SER OG : rot -129:sc= -0.566 USER MOD Set 4.2: A 6 GLN : amide:sc= 0.187 X(o=-0.38,f=-0.8) USER MOD Single : A 1 GLY N :NH3+ -131:sc= 0.122 (180deg=0) USER MOD Single : A 8 GLN : amide:sc=-0.00782 K(o=-0.0078,f=-7.7!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 83:sc= 0.859 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc=0.000345 USER MOD Single : A 22 ASN : amide:sc= -0.312 K(o=-0.31,f=-1.6) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 CYS SG : rot -115:sc= -7.02! USER MOD Single : A 32 THR OG1 : rot -93:sc= -1.85! USER MOD Single : A 33 LYS NZ :NH3+ -118:sc=-0.00597 (180deg=-0.0611) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 HIS :FLIP no HD1:sc= -1.05 F(o=-5!,f=-1.1) USER MOD Single : A 39 HIS : no HD1:sc= -0.211 X(o=-0.21,f=-0.038) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= -2.01 X(o=-2,f=-2.1) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 155:sc= -0.987 (180deg=-3.14!) USER MOD Single : A 83 MET CE :methyl 137:sc= -8.47! (180deg=-12.2!) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 180:sc= -0.432 USER MOD Single : A 95 ASN :FLIP amide:sc= -16.8! C(o=-20!,f=-17!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 HIS : no HD1:sc= -0.109 X(o=-0.11,f=-0.23) USER MOD Single : A 99 LYS NZ :NH3+ -151:sc= -0.137 (180deg=-1.35) USER MOD Single : A 102 TYR OH : rot 166:sc= 1.17 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 116 HIS :FLIP no HD1:sc= -0.61 F(o=-1.4,f=-0.61) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 MET CE :methyl 146:sc= -0.0491 (180deg=-0.274) USER MOD Single : A 123 ASN : amide:sc= -4.06! C(o=-4.1!,f=-7!) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 SER OG : rot 180:sc= -0.121 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 146 GLN :FLIP amide:sc= -2.32! C(o=-4.3!,f=-2.3!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 148 HEM CMA :methyl 150:sc= -3.6! (180deg=-3.6!) USER MOD Single : A 148 HEM CMC :methyl -30:sc= -12.2! (180deg=-13.7!) USER MOD Single : A 148 HEM CMD :methyl -30:sc= -0.0246 (180deg=-0.457) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.752 10.036 9.138 1.00 0.00 N ATOM 2 CA GLY A 1 10.952 8.664 9.681 1.00 0.00 C ATOM 3 C GLY A 1 11.931 7.913 8.777 1.00 0.00 C ATOM 4 O GLY A 1 12.622 8.505 7.973 1.00 0.00 O ATOM 0 H1 GLY A 1 10.866 10.732 9.902 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.455 10.221 8.394 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.795 10.115 8.738 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.340 8.714 10.698 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.000 8.135 9.729 1.00 0.00 H new ATOM 8 N LEU A 2 11.997 6.614 8.898 1.00 0.00 N ATOM 9 CA LEU A 2 12.933 5.831 8.040 1.00 0.00 C ATOM 10 C LEU A 2 14.367 6.337 8.226 1.00 0.00 C ATOM 11 O LEU A 2 14.597 7.402 8.763 1.00 0.00 O ATOM 12 CB LEU A 2 12.462 6.071 6.603 1.00 0.00 C ATOM 13 CG LEU A 2 11.455 4.995 6.209 1.00 0.00 C ATOM 14 CD1 LEU A 2 10.920 5.294 4.806 1.00 0.00 C ATOM 15 CD2 LEU A 2 12.147 3.629 6.213 1.00 0.00 C ATOM 0 H LEU A 2 11.444 6.062 9.553 1.00 0.00 H new ATOM 0 HA LEU A 2 12.932 4.771 8.293 1.00 0.00 H new ATOM 0 HB2 LEU A 2 12.007 7.058 6.519 1.00 0.00 H new ATOM 0 HB3 LEU A 2 13.313 6.053 5.923 1.00 0.00 H new ATOM 0 HG LEU A 2 10.628 4.986 6.919 1.00 0.00 H new ATOM 0 HD11 LEU A 2 10.200 4.527 4.520 1.00 0.00 H new ATOM 0 HD12 LEU A 2 10.433 6.269 4.803 1.00 0.00 H new ATOM 0 HD13 LEU A 2 11.746 5.299 4.095 1.00 0.00 H new ATOM 0 HD21 LEU A 2 11.430 2.857 5.932 1.00 0.00 H new ATOM 0 HD22 LEU A 2 12.971 3.636 5.499 1.00 0.00 H new ATOM 0 HD23 LEU A 2 12.533 3.420 7.211 1.00 0.00 H new ATOM 27 N SER A 3 15.332 5.582 7.776 1.00 0.00 N ATOM 28 CA SER A 3 16.752 6.016 7.915 1.00 0.00 C ATOM 29 C SER A 3 17.439 5.939 6.551 1.00 0.00 C ATOM 30 O SER A 3 16.797 5.773 5.533 1.00 0.00 O ATOM 31 CB SER A 3 17.389 5.034 8.899 1.00 0.00 C ATOM 32 OG SER A 3 16.994 3.709 8.566 1.00 0.00 O ATOM 0 H SER A 3 15.198 4.681 7.317 1.00 0.00 H new ATOM 0 HA SER A 3 16.842 7.042 8.271 1.00 0.00 H new ATOM 0 HB2 SER A 3 18.475 5.121 8.865 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.082 5.272 9.917 1.00 0.00 H new ATOM 0 HG SER A 3 16.644 3.262 9.365 1.00 0.00 H new ATOM 38 N ALA A 4 18.736 6.063 6.519 1.00 0.00 N ATOM 39 CA ALA A 4 19.459 6.003 5.215 1.00 0.00 C ATOM 40 C ALA A 4 19.625 4.547 4.769 1.00 0.00 C ATOM 41 O ALA A 4 19.920 4.270 3.622 1.00 0.00 O ATOM 42 CB ALA A 4 20.821 6.641 5.485 1.00 0.00 C ATOM 0 H ALA A 4 19.328 6.203 7.338 1.00 0.00 H new ATOM 0 HA ALA A 4 18.920 6.519 4.420 1.00 0.00 H new ATOM 0 HB1 ALA A 4 21.414 6.634 4.570 1.00 0.00 H new ATOM 0 HB2 ALA A 4 20.681 7.669 5.819 1.00 0.00 H new ATOM 0 HB3 ALA A 4 21.341 6.075 6.258 1.00 0.00 H new ATOM 48 N ALA A 5 19.444 3.612 5.663 1.00 0.00 N ATOM 49 CA ALA A 5 19.599 2.179 5.282 1.00 0.00 C ATOM 50 C ALA A 5 18.222 1.547 5.069 1.00 0.00 C ATOM 51 O ALA A 5 18.039 0.711 4.206 1.00 0.00 O ATOM 52 CB ALA A 5 20.318 1.522 6.461 1.00 0.00 C ATOM 0 H ALA A 5 19.196 3.778 6.638 1.00 0.00 H new ATOM 0 HA ALA A 5 20.157 2.055 4.354 1.00 0.00 H new ATOM 0 HB1 ALA A 5 20.467 0.463 6.252 1.00 0.00 H new ATOM 0 HB2 ALA A 5 21.285 2.002 6.611 1.00 0.00 H new ATOM 0 HB3 ALA A 5 19.715 1.632 7.362 1.00 0.00 H new ATOM 58 N GLN A 6 17.253 1.936 5.850 1.00 0.00 N ATOM 59 CA GLN A 6 15.891 1.354 5.693 1.00 0.00 C ATOM 60 C GLN A 6 15.278 1.823 4.370 1.00 0.00 C ATOM 61 O GLN A 6 14.923 1.026 3.524 1.00 0.00 O ATOM 62 CB GLN A 6 15.090 1.884 6.884 1.00 0.00 C ATOM 63 CG GLN A 6 15.269 0.942 8.077 1.00 0.00 C ATOM 64 CD GLN A 6 14.758 1.609 9.355 1.00 0.00 C ATOM 65 OE1 GLN A 6 15.514 1.842 10.277 1.00 0.00 O ATOM 66 NE2 GLN A 6 13.496 1.929 9.451 1.00 0.00 N ATOM 0 H GLN A 6 17.345 2.632 6.590 1.00 0.00 H new ATOM 0 HA GLN A 6 15.901 0.264 5.672 1.00 0.00 H new ATOM 0 HB2 GLN A 6 15.427 2.887 7.145 1.00 0.00 H new ATOM 0 HB3 GLN A 6 14.035 1.960 6.622 1.00 0.00 H new ATOM 0 HG2 GLN A 6 14.727 0.013 7.901 1.00 0.00 H new ATOM 0 HG3 GLN A 6 16.321 0.681 8.190 1.00 0.00 H new ATOM 0 HE21 GLN A 6 12.860 1.734 8.678 1.00 0.00 H new ATOM 0 HE22 GLN A 6 13.146 2.374 10.299 1.00 0.00 H new ATOM 75 N ARG A 7 15.149 3.108 4.185 1.00 0.00 N ATOM 76 CA ARG A 7 14.554 3.623 2.918 1.00 0.00 C ATOM 77 C ARG A 7 15.245 2.972 1.715 1.00 0.00 C ATOM 78 O ARG A 7 14.683 2.873 0.641 1.00 0.00 O ATOM 79 CB ARG A 7 14.778 5.141 2.954 1.00 0.00 C ATOM 80 CG ARG A 7 16.236 5.493 2.633 1.00 0.00 C ATOM 81 CD ARG A 7 16.293 6.271 1.315 1.00 0.00 C ATOM 82 NE ARG A 7 17.089 5.427 0.382 1.00 0.00 N ATOM 83 CZ ARG A 7 17.923 5.985 -0.452 1.00 0.00 C ATOM 84 NH1 ARG A 7 17.718 7.208 -0.859 1.00 0.00 N ATOM 85 NH2 ARG A 7 18.962 5.321 -0.880 1.00 0.00 N ATOM 0 H ARG A 7 15.429 3.824 4.855 1.00 0.00 H new ATOM 0 HA ARG A 7 13.493 3.390 2.824 1.00 0.00 H new ATOM 0 HB2 ARG A 7 14.117 5.626 2.236 1.00 0.00 H new ATOM 0 HB3 ARG A 7 14.516 5.527 3.939 1.00 0.00 H new ATOM 0 HG2 ARG A 7 16.664 6.089 3.439 1.00 0.00 H new ATOM 0 HG3 ARG A 7 16.833 4.584 2.558 1.00 0.00 H new ATOM 0 HD2 ARG A 7 15.292 6.451 0.923 1.00 0.00 H new ATOM 0 HD3 ARG A 7 16.760 7.246 1.456 1.00 0.00 H new ATOM 0 HE ARG A 7 16.982 4.413 0.395 1.00 0.00 H new ATOM 0 HH11 ARG A 7 16.906 7.727 -0.525 1.00 0.00 H new ATOM 0 HH12 ARG A 7 18.370 7.645 -1.511 1.00 0.00 H new ATOM 0 HH21 ARG A 7 19.123 4.365 -0.563 1.00 0.00 H new ATOM 0 HH22 ARG A 7 19.613 5.758 -1.532 1.00 0.00 H new ATOM 99 N GLN A 8 16.456 2.525 1.887 1.00 0.00 N ATOM 100 CA GLN A 8 17.183 1.877 0.757 1.00 0.00 C ATOM 101 C GLN A 8 16.724 0.424 0.621 1.00 0.00 C ATOM 102 O GLN A 8 16.523 -0.077 -0.468 1.00 0.00 O ATOM 103 CB GLN A 8 18.665 1.943 1.133 1.00 0.00 C ATOM 104 CG GLN A 8 19.481 1.115 0.138 1.00 0.00 C ATOM 105 CD GLN A 8 19.252 1.629 -1.285 1.00 0.00 C ATOM 106 OE1 GLN A 8 19.071 2.812 -1.494 1.00 0.00 O ATOM 107 NE2 GLN A 8 19.253 0.783 -2.279 1.00 0.00 N ATOM 0 H GLN A 8 16.977 2.580 2.762 1.00 0.00 H new ATOM 0 HA GLN A 8 16.994 2.370 -0.197 1.00 0.00 H new ATOM 0 HB2 GLN A 8 19.007 2.978 1.128 1.00 0.00 H new ATOM 0 HB3 GLN A 8 18.812 1.564 2.144 1.00 0.00 H new ATOM 0 HG2 GLN A 8 20.540 1.172 0.388 1.00 0.00 H new ATOM 0 HG3 GLN A 8 19.194 0.066 0.205 1.00 0.00 H new ATOM 0 HE21 GLN A 8 19.405 -0.210 -2.103 1.00 0.00 H new ATOM 0 HE22 GLN A 8 19.102 1.115 -3.231 1.00 0.00 H new ATOM 116 N VAL A 9 16.556 -0.256 1.721 1.00 0.00 N ATOM 117 CA VAL A 9 16.109 -1.676 1.660 1.00 0.00 C ATOM 118 C VAL A 9 14.723 -1.746 1.014 1.00 0.00 C ATOM 119 O VAL A 9 14.336 -2.754 0.458 1.00 0.00 O ATOM 120 CB VAL A 9 16.054 -2.138 3.116 1.00 0.00 C ATOM 121 CG1 VAL A 9 15.592 -3.595 3.176 1.00 0.00 C ATOM 122 CG2 VAL A 9 17.446 -2.019 3.742 1.00 0.00 C ATOM 0 H VAL A 9 16.709 0.111 2.660 1.00 0.00 H new ATOM 0 HA VAL A 9 16.774 -2.304 1.067 1.00 0.00 H new ATOM 0 HB VAL A 9 15.351 -1.513 3.667 1.00 0.00 H new ATOM 0 HG11 VAL A 9 15.554 -3.922 4.215 1.00 0.00 H new ATOM 0 HG12 VAL A 9 14.600 -3.681 2.732 1.00 0.00 H new ATOM 0 HG13 VAL A 9 16.292 -4.222 2.624 1.00 0.00 H new ATOM 0 HG21 VAL A 9 17.407 -2.348 4.780 1.00 0.00 H new ATOM 0 HG22 VAL A 9 18.148 -2.643 3.189 1.00 0.00 H new ATOM 0 HG23 VAL A 9 17.775 -0.981 3.703 1.00 0.00 H new ATOM 132 N VAL A 10 13.975 -0.678 1.084 1.00 0.00 N ATOM 133 CA VAL A 10 12.614 -0.676 0.474 1.00 0.00 C ATOM 134 C VAL A 10 12.732 -0.777 -1.049 1.00 0.00 C ATOM 135 O VAL A 10 12.023 -1.530 -1.687 1.00 0.00 O ATOM 136 CB VAL A 10 11.992 0.662 0.878 1.00 0.00 C ATOM 137 CG1 VAL A 10 10.608 0.798 0.240 1.00 0.00 C ATOM 138 CG2 VAL A 10 11.858 0.727 2.402 1.00 0.00 C ATOM 0 H VAL A 10 14.248 0.194 1.538 1.00 0.00 H new ATOM 0 HA VAL A 10 12.007 -1.517 0.809 1.00 0.00 H new ATOM 0 HB VAL A 10 12.632 1.475 0.534 1.00 0.00 H new ATOM 0 HG11 VAL A 10 10.166 1.752 0.529 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.702 0.755 -0.845 1.00 0.00 H new ATOM 0 HG13 VAL A 10 9.969 -0.016 0.581 1.00 0.00 H new ATOM 0 HG21 VAL A 10 11.415 1.681 2.688 1.00 0.00 H new ATOM 0 HG22 VAL A 10 11.220 -0.087 2.746 1.00 0.00 H new ATOM 0 HG23 VAL A 10 12.844 0.634 2.858 1.00 0.00 H new ATOM 148 N ALA A 11 13.618 -0.020 -1.636 1.00 0.00 N ATOM 149 CA ALA A 11 13.779 -0.067 -3.118 1.00 0.00 C ATOM 150 C ALA A 11 14.462 -1.375 -3.535 1.00 0.00 C ATOM 151 O ALA A 11 14.511 -1.713 -4.701 1.00 0.00 O ATOM 152 CB ALA A 11 14.658 1.135 -3.463 1.00 0.00 C ATOM 0 H ALA A 11 14.238 0.630 -1.153 1.00 0.00 H new ATOM 0 HA ALA A 11 12.822 -0.030 -3.638 1.00 0.00 H new ATOM 0 HB1 ALA A 11 14.822 1.169 -4.540 1.00 0.00 H new ATOM 0 HB2 ALA A 11 14.163 2.052 -3.143 1.00 0.00 H new ATOM 0 HB3 ALA A 11 15.617 1.043 -2.953 1.00 0.00 H new ATOM 158 N SER A 12 14.993 -2.114 -2.597 1.00 0.00 N ATOM 159 CA SER A 12 15.671 -3.394 -2.955 1.00 0.00 C ATOM 160 C SER A 12 14.674 -4.553 -2.862 1.00 0.00 C ATOM 161 O SER A 12 14.852 -5.587 -3.474 1.00 0.00 O ATOM 162 CB SER A 12 16.788 -3.557 -1.925 1.00 0.00 C ATOM 163 OG SER A 12 17.905 -2.769 -2.314 1.00 0.00 O ATOM 0 H SER A 12 14.987 -1.888 -1.602 1.00 0.00 H new ATOM 0 HA SER A 12 16.062 -3.388 -3.973 1.00 0.00 H new ATOM 0 HB2 SER A 12 16.437 -3.250 -0.940 1.00 0.00 H new ATOM 0 HB3 SER A 12 17.077 -4.605 -1.848 1.00 0.00 H new ATOM 0 HG SER A 12 18.622 -2.870 -1.654 1.00 0.00 H new ATOM 169 N THR A 13 13.629 -4.390 -2.098 1.00 0.00 N ATOM 170 CA THR A 13 12.625 -5.484 -1.963 1.00 0.00 C ATOM 171 C THR A 13 11.451 -5.244 -2.920 1.00 0.00 C ATOM 172 O THR A 13 10.613 -6.102 -3.110 1.00 0.00 O ATOM 173 CB THR A 13 12.161 -5.417 -0.506 1.00 0.00 C ATOM 174 OG1 THR A 13 11.846 -4.071 -0.170 1.00 0.00 O ATOM 175 CG2 THR A 13 13.277 -5.922 0.411 1.00 0.00 C ATOM 0 H THR A 13 13.427 -3.547 -1.561 1.00 0.00 H new ATOM 0 HA THR A 13 13.039 -6.461 -2.211 1.00 0.00 H new ATOM 0 HB THR A 13 11.276 -6.041 -0.379 1.00 0.00 H new ATOM 0 HG1 THR A 13 10.935 -3.865 -0.466 1.00 0.00 H new ATOM 0 HG21 THR A 13 12.945 -5.874 1.448 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.519 -6.953 0.155 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.162 -5.299 0.284 1.00 0.00 H new ATOM 183 N TRP A 14 11.379 -4.086 -3.521 1.00 0.00 N ATOM 184 CA TRP A 14 10.253 -3.803 -4.458 1.00 0.00 C ATOM 185 C TRP A 14 10.655 -4.183 -5.885 1.00 0.00 C ATOM 186 O TRP A 14 9.818 -4.396 -6.739 1.00 0.00 O ATOM 187 CB TRP A 14 10.003 -2.298 -4.349 1.00 0.00 C ATOM 188 CG TRP A 14 8.537 -2.046 -4.202 1.00 0.00 C ATOM 189 CD1 TRP A 14 7.898 -1.848 -3.026 1.00 0.00 C ATOM 190 CD2 TRP A 14 7.518 -1.961 -5.241 1.00 0.00 C ATOM 191 NE1 TRP A 14 6.552 -1.649 -3.276 1.00 0.00 N ATOM 192 CE2 TRP A 14 6.268 -1.710 -4.626 1.00 0.00 C ATOM 193 CE3 TRP A 14 7.555 -2.078 -6.642 1.00 0.00 C ATOM 194 CZ2 TRP A 14 5.098 -1.578 -5.375 1.00 0.00 C ATOM 195 CZ3 TRP A 14 6.378 -1.945 -7.399 1.00 0.00 C ATOM 196 CH2 TRP A 14 5.153 -1.697 -6.765 1.00 0.00 C ATOM 0 H TRP A 14 12.049 -3.326 -3.404 1.00 0.00 H new ATOM 0 HA TRP A 14 9.358 -4.375 -4.214 1.00 0.00 H new ATOM 0 HB2 TRP A 14 10.541 -1.890 -3.493 1.00 0.00 H new ATOM 0 HB3 TRP A 14 10.383 -1.790 -5.235 1.00 0.00 H new ATOM 0 HD1 TRP A 14 8.363 -1.846 -2.051 1.00 0.00 H new ATOM 0 HE1 TRP A 14 5.855 -1.478 -2.552 1.00 0.00 H new ATOM 0 HE3 TRP A 14 8.494 -2.271 -7.140 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 4.156 -1.385 -4.883 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 6.418 -2.034 -8.475 1.00 0.00 H new ATOM 0 HH2 TRP A 14 4.252 -1.598 -7.352 1.00 0.00 H new ATOM 207 N LYS A 15 11.929 -4.268 -6.150 1.00 0.00 N ATOM 208 CA LYS A 15 12.380 -4.633 -7.523 1.00 0.00 C ATOM 209 C LYS A 15 12.264 -6.147 -7.726 1.00 0.00 C ATOM 210 O LYS A 15 12.354 -6.641 -8.832 1.00 0.00 O ATOM 211 CB LYS A 15 13.841 -4.185 -7.597 1.00 0.00 C ATOM 212 CG LYS A 15 13.901 -2.669 -7.791 1.00 0.00 C ATOM 213 CD LYS A 15 15.341 -2.185 -7.605 1.00 0.00 C ATOM 214 CE LYS A 15 15.930 -1.804 -8.965 1.00 0.00 C ATOM 215 NZ LYS A 15 16.138 -0.331 -8.886 1.00 0.00 N ATOM 0 H LYS A 15 12.677 -4.101 -5.477 1.00 0.00 H new ATOM 0 HA LYS A 15 11.776 -4.161 -8.298 1.00 0.00 H new ATOM 0 HB2 LYS A 15 14.365 -4.466 -6.684 1.00 0.00 H new ATOM 0 HB3 LYS A 15 14.345 -4.688 -8.422 1.00 0.00 H new ATOM 0 HG2 LYS A 15 13.543 -2.405 -8.786 1.00 0.00 H new ATOM 0 HG3 LYS A 15 13.245 -2.174 -7.075 1.00 0.00 H new ATOM 0 HD2 LYS A 15 15.364 -1.327 -6.933 1.00 0.00 H new ATOM 0 HD3 LYS A 15 15.942 -2.968 -7.143 1.00 0.00 H new ATOM 0 HE2 LYS A 15 16.868 -2.327 -9.151 1.00 0.00 H new ATOM 0 HE3 LYS A 15 15.252 -2.066 -9.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 16.541 0.011 -9.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 15.227 0.140 -8.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 16.792 -0.114 -8.107 1.00 0.00 H new ATOM 229 N ASP A 16 12.068 -6.890 -6.669 1.00 0.00 N ATOM 230 CA ASP A 16 11.951 -8.369 -6.811 1.00 0.00 C ATOM 231 C ASP A 16 10.479 -8.783 -6.727 1.00 0.00 C ATOM 232 O ASP A 16 9.992 -9.544 -7.539 1.00 0.00 O ATOM 233 CB ASP A 16 12.743 -8.950 -5.639 1.00 0.00 C ATOM 234 CG ASP A 16 14.182 -8.431 -5.669 1.00 0.00 C ATOM 235 OD1 ASP A 16 14.711 -8.274 -6.757 1.00 0.00 O ATOM 236 OD2 ASP A 16 14.730 -8.199 -4.604 1.00 0.00 O ATOM 0 H ASP A 16 11.984 -6.537 -5.716 1.00 0.00 H new ATOM 0 HA ASP A 16 12.332 -8.726 -7.768 1.00 0.00 H new ATOM 0 HB2 ASP A 16 12.268 -8.675 -4.697 1.00 0.00 H new ATOM 0 HB3 ASP A 16 12.740 -10.039 -5.692 1.00 0.00 H new ATOM 241 N ILE A 17 9.768 -8.291 -5.750 1.00 0.00 N ATOM 242 CA ILE A 17 8.330 -8.660 -5.615 1.00 0.00 C ATOM 243 C ILE A 17 7.520 -8.004 -6.737 1.00 0.00 C ATOM 244 O ILE A 17 6.529 -8.539 -7.194 1.00 0.00 O ATOM 245 CB ILE A 17 7.900 -8.122 -4.249 1.00 0.00 C ATOM 246 CG1 ILE A 17 8.730 -8.798 -3.152 1.00 0.00 C ATOM 247 CG2 ILE A 17 6.416 -8.422 -4.028 1.00 0.00 C ATOM 248 CD1 ILE A 17 8.211 -8.372 -1.777 1.00 0.00 C ATOM 0 H ILE A 17 10.120 -7.650 -5.039 1.00 0.00 H new ATOM 0 HA ILE A 17 8.168 -9.735 -5.688 1.00 0.00 H new ATOM 0 HB ILE A 17 8.061 -7.044 -4.213 1.00 0.00 H new ATOM 0 HG12 ILE A 17 8.671 -9.882 -3.254 1.00 0.00 H new ATOM 0 HG13 ILE A 17 9.780 -8.524 -3.256 1.00 0.00 H new ATOM 0 HG21 ILE A 17 6.108 -8.039 -3.055 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.827 -7.942 -4.810 1.00 0.00 H new ATOM 0 HG23 ILE A 17 6.254 -9.499 -4.062 1.00 0.00 H new ATOM 0 HD11 ILE A 17 8.803 -8.854 -0.999 1.00 0.00 H new ATOM 0 HD12 ILE A 17 8.293 -7.290 -1.677 1.00 0.00 H new ATOM 0 HD13 ILE A 17 7.167 -8.668 -1.674 1.00 0.00 H new ATOM 260 N ALA A 18 7.932 -6.850 -7.183 1.00 0.00 N ATOM 261 CA ALA A 18 7.185 -6.162 -8.272 1.00 0.00 C ATOM 262 C ALA A 18 7.980 -6.247 -9.577 1.00 0.00 C ATOM 263 O ALA A 18 7.954 -5.345 -10.391 1.00 0.00 O ATOM 264 CB ALA A 18 7.055 -4.711 -7.810 1.00 0.00 C ATOM 0 H ALA A 18 8.754 -6.354 -6.840 1.00 0.00 H new ATOM 0 HA ALA A 18 6.210 -6.612 -8.460 1.00 0.00 H new ATOM 0 HB1 ALA A 18 6.514 -4.137 -8.562 1.00 0.00 H new ATOM 0 HB2 ALA A 18 6.511 -4.677 -6.866 1.00 0.00 H new ATOM 0 HB3 ALA A 18 8.048 -4.283 -7.672 1.00 0.00 H new ATOM 270 N GLY A 19 8.686 -7.325 -9.783 1.00 0.00 N ATOM 271 CA GLY A 19 9.481 -7.466 -11.036 1.00 0.00 C ATOM 272 C GLY A 19 8.572 -7.217 -12.240 1.00 0.00 C ATOM 273 O GLY A 19 8.668 -6.204 -12.904 1.00 0.00 O ATOM 0 H GLY A 19 8.747 -8.113 -9.139 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.309 -6.757 -11.037 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.916 -8.464 -11.094 1.00 0.00 H new ATOM 277 N SER A 20 7.688 -8.134 -12.528 1.00 0.00 N ATOM 278 CA SER A 20 6.774 -7.948 -13.690 1.00 0.00 C ATOM 279 C SER A 20 5.345 -7.721 -13.190 1.00 0.00 C ATOM 280 O SER A 20 4.546 -7.074 -13.838 1.00 0.00 O ATOM 281 CB SER A 20 6.868 -9.248 -14.488 1.00 0.00 C ATOM 282 OG SER A 20 6.492 -10.338 -13.655 1.00 0.00 O ATOM 0 H SER A 20 7.560 -9.003 -12.009 1.00 0.00 H new ATOM 0 HA SER A 20 7.044 -7.085 -14.299 1.00 0.00 H new ATOM 0 HB2 SER A 20 6.217 -9.201 -15.361 1.00 0.00 H new ATOM 0 HB3 SER A 20 7.884 -9.390 -14.856 1.00 0.00 H new ATOM 0 HG SER A 20 6.549 -11.174 -14.164 1.00 0.00 H new ATOM 288 N ASP A 21 5.018 -8.247 -12.042 1.00 0.00 N ATOM 289 CA ASP A 21 3.641 -8.061 -11.503 1.00 0.00 C ATOM 290 C ASP A 21 3.516 -6.669 -10.879 1.00 0.00 C ATOM 291 O ASP A 21 2.430 -6.151 -10.707 1.00 0.00 O ATOM 292 CB ASP A 21 3.474 -9.149 -10.440 1.00 0.00 C ATOM 293 CG ASP A 21 4.556 -9.004 -9.368 1.00 0.00 C ATOM 294 OD1 ASP A 21 5.716 -9.194 -9.697 1.00 0.00 O ATOM 295 OD2 ASP A 21 4.207 -8.707 -8.238 1.00 0.00 O ATOM 0 H ASP A 21 5.644 -8.797 -11.454 1.00 0.00 H new ATOM 0 HA ASP A 21 2.876 -8.138 -12.276 1.00 0.00 H new ATOM 0 HB2 ASP A 21 2.487 -9.075 -9.984 1.00 0.00 H new ATOM 0 HB3 ASP A 21 3.539 -10.134 -10.903 1.00 0.00 H new ATOM 300 N ASN A 22 4.618 -6.059 -10.539 1.00 0.00 N ATOM 301 CA ASN A 22 4.560 -4.702 -9.926 1.00 0.00 C ATOM 302 C ASN A 22 3.667 -4.738 -8.684 1.00 0.00 C ATOM 303 O ASN A 22 3.118 -3.735 -8.273 1.00 0.00 O ATOM 304 CB ASN A 22 3.954 -3.799 -11.003 1.00 0.00 C ATOM 305 CG ASN A 22 4.469 -2.368 -10.838 1.00 0.00 C ATOM 306 OD1 ASN A 22 5.636 -2.157 -10.572 1.00 0.00 O ATOM 307 ND2 ASN A 22 3.643 -1.369 -10.986 1.00 0.00 N ATOM 0 H ASN A 22 5.556 -6.441 -10.659 1.00 0.00 H new ATOM 0 HA ASN A 22 5.540 -4.344 -9.610 1.00 0.00 H new ATOM 0 HB2 ASN A 22 4.213 -4.175 -11.993 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.866 -3.813 -10.931 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.977 -0.411 -10.878 1.00 0.00 H new ATOM 0 HD22 ASN A 22 2.664 -1.546 -11.209 1.00 0.00 H new ATOM 314 N GLY A 23 3.515 -5.887 -8.084 1.00 0.00 N ATOM 315 CA GLY A 23 2.657 -5.986 -6.870 1.00 0.00 C ATOM 316 C GLY A 23 1.267 -6.477 -7.278 1.00 0.00 C ATOM 317 O GLY A 23 0.287 -6.231 -6.602 1.00 0.00 O ATOM 0 H GLY A 23 3.948 -6.761 -8.382 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.102 -6.673 -6.150 1.00 0.00 H new ATOM 0 HA3 GLY A 23 2.584 -5.015 -6.381 1.00 0.00 H new ATOM 321 N ALA A 24 1.173 -7.169 -8.381 1.00 0.00 N ATOM 322 CA ALA A 24 -0.155 -7.674 -8.833 1.00 0.00 C ATOM 323 C ALA A 24 -0.674 -8.717 -7.840 1.00 0.00 C ATOM 324 O ALA A 24 -1.763 -8.600 -7.316 1.00 0.00 O ATOM 325 CB ALA A 24 0.100 -8.307 -10.202 1.00 0.00 C ATOM 0 H ALA A 24 1.958 -7.406 -8.988 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.904 -6.885 -8.892 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -0.835 -8.702 -10.600 1.00 0.00 H new ATOM 0 HB2 ALA A 24 0.494 -7.553 -10.884 1.00 0.00 H new ATOM 0 HB3 ALA A 24 0.822 -9.117 -10.100 1.00 0.00 H new ATOM 331 N GLY A 25 0.098 -9.737 -7.578 1.00 0.00 N ATOM 332 CA GLY A 25 -0.354 -10.786 -6.619 1.00 0.00 C ATOM 333 C GLY A 25 0.007 -10.367 -5.189 1.00 0.00 C ATOM 334 O GLY A 25 -0.080 -11.151 -4.266 1.00 0.00 O ATOM 0 H GLY A 25 1.021 -9.889 -7.986 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.431 -10.932 -6.705 1.00 0.00 H new ATOM 0 HA3 GLY A 25 0.117 -11.739 -6.859 1.00 0.00 H new ATOM 338 N VAL A 26 0.408 -9.139 -4.996 1.00 0.00 N ATOM 339 CA VAL A 26 0.768 -8.680 -3.624 1.00 0.00 C ATOM 340 C VAL A 26 -0.420 -7.934 -3.011 1.00 0.00 C ATOM 341 O VAL A 26 -0.608 -7.926 -1.810 1.00 0.00 O ATOM 342 CB VAL A 26 1.968 -7.746 -3.820 1.00 0.00 C ATOM 343 CG1 VAL A 26 2.214 -6.934 -2.544 1.00 0.00 C ATOM 344 CG2 VAL A 26 3.212 -8.579 -4.137 1.00 0.00 C ATOM 0 H VAL A 26 0.502 -8.435 -5.728 1.00 0.00 H new ATOM 0 HA VAL A 26 1.012 -9.501 -2.950 1.00 0.00 H new ATOM 0 HB VAL A 26 1.759 -7.064 -4.644 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.068 -6.273 -2.692 1.00 0.00 H new ATOM 0 HG12 VAL A 26 1.330 -6.339 -2.316 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.419 -7.612 -1.715 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.067 -7.917 -4.277 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.413 -9.262 -3.311 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.044 -9.152 -5.049 1.00 0.00 H new ATOM 354 N GLY A 27 -1.221 -7.305 -3.825 1.00 0.00 N ATOM 355 CA GLY A 27 -2.392 -6.559 -3.289 1.00 0.00 C ATOM 356 C GLY A 27 -3.601 -7.494 -3.224 1.00 0.00 C ATOM 357 O GLY A 27 -4.318 -7.528 -2.243 1.00 0.00 O ATOM 0 H GLY A 27 -1.115 -7.276 -4.839 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.166 -6.169 -2.297 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -2.614 -5.702 -3.925 1.00 0.00 H new ATOM 361 N LYS A 28 -3.836 -8.254 -4.259 1.00 0.00 N ATOM 362 CA LYS A 28 -5.001 -9.183 -4.250 1.00 0.00 C ATOM 363 C LYS A 28 -4.908 -10.110 -3.036 1.00 0.00 C ATOM 364 O LYS A 28 -5.907 -10.525 -2.482 1.00 0.00 O ATOM 365 CB LYS A 28 -4.896 -9.975 -5.556 1.00 0.00 C ATOM 366 CG LYS A 28 -3.667 -10.887 -5.510 1.00 0.00 C ATOM 367 CD LYS A 28 -3.666 -11.809 -6.732 1.00 0.00 C ATOM 368 CE LYS A 28 -3.755 -10.971 -8.009 1.00 0.00 C ATOM 369 NZ LYS A 28 -2.973 -11.738 -9.018 1.00 0.00 N ATOM 0 H LYS A 28 -3.272 -8.272 -5.109 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.955 -8.660 -4.181 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.797 -10.570 -5.705 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -4.822 -9.292 -6.402 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -2.757 -10.287 -5.494 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.675 -11.479 -4.595 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.758 -12.412 -6.744 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -4.507 -12.500 -6.679 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -4.790 -10.840 -8.326 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -3.339 -9.975 -7.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -2.984 -11.230 -9.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.991 -11.841 -8.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -3.397 -12.679 -9.143 1.00 0.00 H new ATOM 383 N GLU A 29 -3.716 -10.440 -2.618 1.00 0.00 N ATOM 384 CA GLU A 29 -3.563 -11.341 -1.440 1.00 0.00 C ATOM 385 C GLU A 29 -3.442 -10.505 -0.162 1.00 0.00 C ATOM 386 O GLU A 29 -3.607 -11.004 0.934 1.00 0.00 O ATOM 387 CB GLU A 29 -2.277 -12.129 -1.698 1.00 0.00 C ATOM 388 CG GLU A 29 -1.076 -11.181 -1.662 1.00 0.00 C ATOM 389 CD GLU A 29 0.225 -11.982 -1.738 1.00 0.00 C ATOM 390 OE1 GLU A 29 0.155 -13.162 -2.039 1.00 0.00 O ATOM 391 OE2 GLU A 29 1.270 -11.401 -1.496 1.00 0.00 O ATOM 0 H GLU A 29 -2.843 -10.125 -3.041 1.00 0.00 H new ATOM 0 HA GLU A 29 -4.417 -12.005 -1.310 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.160 -12.909 -0.946 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.332 -12.626 -2.667 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -1.130 -10.480 -2.495 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -1.096 -10.590 -0.746 1.00 0.00 H new ATOM 398 N CYS A 30 -3.154 -9.239 -0.292 1.00 0.00 N ATOM 399 CA CYS A 30 -3.020 -8.377 0.917 1.00 0.00 C ATOM 400 C CYS A 30 -4.397 -7.859 1.340 1.00 0.00 C ATOM 401 O CYS A 30 -4.913 -8.219 2.379 1.00 0.00 O ATOM 402 CB CYS A 30 -2.117 -7.221 0.486 1.00 0.00 C ATOM 403 SG CYS A 30 -2.010 -6.008 1.825 1.00 0.00 S ATOM 0 H CYS A 30 -3.006 -8.764 -1.182 1.00 0.00 H new ATOM 0 HA CYS A 30 -2.604 -8.915 1.769 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -1.123 -7.594 0.239 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -2.514 -6.751 -0.414 1.00 0.00 H new ATOM 0 HG CYS A 30 -2.550 -4.890 1.442 1.00 0.00 H new ATOM 409 N PHE A 31 -4.994 -7.013 0.545 1.00 0.00 N ATOM 410 CA PHE A 31 -6.335 -6.469 0.904 1.00 0.00 C ATOM 411 C PHE A 31 -7.267 -7.610 1.319 1.00 0.00 C ATOM 412 O PHE A 31 -8.168 -7.430 2.114 1.00 0.00 O ATOM 413 CB PHE A 31 -6.843 -5.781 -0.364 1.00 0.00 C ATOM 414 CG PHE A 31 -6.406 -4.337 -0.358 1.00 0.00 C ATOM 415 CD1 PHE A 31 -7.057 -3.412 0.467 1.00 0.00 C ATOM 416 CD2 PHE A 31 -5.347 -3.922 -1.174 1.00 0.00 C ATOM 417 CE1 PHE A 31 -6.650 -2.072 0.475 1.00 0.00 C ATOM 418 CE2 PHE A 31 -4.940 -2.583 -1.167 1.00 0.00 C ATOM 419 CZ PHE A 31 -5.591 -1.658 -0.342 1.00 0.00 C ATOM 0 H PHE A 31 -4.611 -6.675 -0.338 1.00 0.00 H new ATOM 0 HA PHE A 31 -6.291 -5.775 1.743 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -6.453 -6.287 -1.247 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -7.930 -5.844 -0.415 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -7.873 -3.732 1.098 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -4.844 -4.636 -1.809 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.153 -1.358 1.111 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -4.124 -2.263 -1.798 1.00 0.00 H new ATOM 0 HZ PHE A 31 -5.276 -0.625 -0.336 1.00 0.00 H new ATOM 429 N THR A 32 -7.058 -8.783 0.789 1.00 0.00 N ATOM 430 CA THR A 32 -7.934 -9.934 1.157 1.00 0.00 C ATOM 431 C THR A 32 -7.975 -10.078 2.681 1.00 0.00 C ATOM 432 O THR A 32 -9.023 -10.010 3.292 1.00 0.00 O ATOM 433 CB THR A 32 -7.297 -11.175 0.514 1.00 0.00 C ATOM 434 OG1 THR A 32 -6.067 -10.825 -0.110 1.00 0.00 O ATOM 435 CG2 THR A 32 -8.253 -11.753 -0.531 1.00 0.00 C ATOM 0 H THR A 32 -6.320 -8.996 0.118 1.00 0.00 H new ATOM 0 HA THR A 32 -8.958 -9.797 0.810 1.00 0.00 H new ATOM 0 HB THR A 32 -7.104 -11.919 1.287 1.00 0.00 H new ATOM 0 HG1 THR A 32 -6.228 -10.609 -1.052 1.00 0.00 H new ATOM 0 HG21 THR A 32 -7.803 -12.634 -0.988 1.00 0.00 H new ATOM 0 HG22 THR A 32 -9.191 -12.033 -0.051 1.00 0.00 H new ATOM 0 HG23 THR A 32 -8.448 -11.005 -1.299 1.00 0.00 H new ATOM 443 N LYS A 33 -6.842 -10.276 3.299 1.00 0.00 N ATOM 444 CA LYS A 33 -6.817 -10.424 4.783 1.00 0.00 C ATOM 445 C LYS A 33 -7.467 -9.201 5.435 1.00 0.00 C ATOM 446 O LYS A 33 -8.367 -9.320 6.242 1.00 0.00 O ATOM 447 CB LYS A 33 -5.336 -10.512 5.154 1.00 0.00 C ATOM 448 CG LYS A 33 -4.840 -11.945 4.950 1.00 0.00 C ATOM 449 CD LYS A 33 -3.548 -11.927 4.130 1.00 0.00 C ATOM 450 CE LYS A 33 -2.637 -13.068 4.587 1.00 0.00 C ATOM 451 NZ LYS A 33 -3.256 -14.297 4.018 1.00 0.00 N ATOM 0 H LYS A 33 -5.933 -10.342 2.841 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.367 -11.301 5.124 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.755 -9.824 4.539 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.192 -10.211 6.192 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.664 -12.421 5.915 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -5.600 -12.535 4.438 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.776 -12.033 3.069 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -3.040 -10.970 4.253 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.619 -12.932 4.222 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -2.582 -13.119 5.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -3.542 -14.931 4.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.091 -14.037 3.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.567 -14.783 3.409 1.00 0.00 H new ATOM 465 N PHE A 34 -7.017 -8.025 5.092 1.00 0.00 N ATOM 466 CA PHE A 34 -7.607 -6.794 5.693 1.00 0.00 C ATOM 467 C PHE A 34 -9.133 -6.852 5.596 1.00 0.00 C ATOM 468 O PHE A 34 -9.833 -6.695 6.577 1.00 0.00 O ATOM 469 CB PHE A 34 -7.055 -5.635 4.861 1.00 0.00 C ATOM 470 CG PHE A 34 -7.067 -4.370 5.687 1.00 0.00 C ATOM 471 CD1 PHE A 34 -6.203 -4.240 6.781 1.00 0.00 C ATOM 472 CD2 PHE A 34 -7.941 -3.327 5.358 1.00 0.00 C ATOM 473 CE1 PHE A 34 -6.214 -3.068 7.546 1.00 0.00 C ATOM 474 CE2 PHE A 34 -7.952 -2.155 6.123 1.00 0.00 C ATOM 475 CZ PHE A 34 -7.088 -2.025 7.217 1.00 0.00 C ATOM 0 H PHE A 34 -6.266 -7.863 4.421 1.00 0.00 H new ATOM 0 HA PHE A 34 -7.355 -6.684 6.748 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -6.039 -5.859 4.535 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -7.656 -5.500 3.962 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -5.528 -5.044 7.035 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -8.607 -3.427 4.514 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -5.548 -2.968 8.390 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -8.627 -1.351 5.869 1.00 0.00 H new ATOM 0 HZ PHE A 34 -7.096 -1.120 7.807 1.00 0.00 H new ATOM 485 N LEU A 35 -9.655 -7.074 4.421 1.00 0.00 N ATOM 486 CA LEU A 35 -11.136 -7.138 4.265 1.00 0.00 C ATOM 487 C LEU A 35 -11.715 -8.166 5.240 1.00 0.00 C ATOM 488 O LEU A 35 -12.691 -7.912 5.918 1.00 0.00 O ATOM 489 CB LEU A 35 -11.369 -7.572 2.817 1.00 0.00 C ATOM 490 CG LEU A 35 -10.807 -6.511 1.870 1.00 0.00 C ATOM 491 CD1 LEU A 35 -10.535 -7.139 0.502 1.00 0.00 C ATOM 492 CD2 LEU A 35 -11.823 -5.377 1.716 1.00 0.00 C ATOM 0 H LEU A 35 -9.121 -7.214 3.563 1.00 0.00 H new ATOM 0 HA LEU A 35 -11.620 -6.185 4.479 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -10.887 -8.532 2.632 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -12.435 -7.710 2.634 1.00 0.00 H new ATOM 0 HG LEU A 35 -9.877 -6.115 2.279 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -10.134 -6.382 -0.173 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -9.812 -7.948 0.610 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -11.464 -7.535 0.092 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -11.424 -4.620 1.041 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -12.752 -5.774 1.307 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.018 -4.928 2.690 1.00 0.00 H new ATOM 504 N SER A 36 -11.122 -9.326 5.317 1.00 0.00 N ATOM 505 CA SER A 36 -11.642 -10.368 6.249 1.00 0.00 C ATOM 506 C SER A 36 -11.487 -9.891 7.695 1.00 0.00 C ATOM 507 O SER A 36 -12.451 -9.766 8.424 1.00 0.00 O ATOM 508 CB SER A 36 -10.780 -11.604 5.991 1.00 0.00 C ATOM 509 OG SER A 36 -11.583 -12.771 6.115 1.00 0.00 O ATOM 0 H SER A 36 -10.301 -9.598 4.776 1.00 0.00 H new ATOM 0 HA SER A 36 -12.700 -10.579 6.091 1.00 0.00 H new ATOM 0 HB2 SER A 36 -10.342 -11.554 4.994 1.00 0.00 H new ATOM 0 HB3 SER A 36 -9.954 -11.640 6.701 1.00 0.00 H new ATOM 0 HG SER A 36 -11.034 -13.565 5.948 1.00 0.00 H new ATOM 515 N ALA A 37 -10.281 -9.624 8.116 1.00 0.00 N ATOM 516 CA ALA A 37 -10.065 -9.158 9.516 1.00 0.00 C ATOM 517 C ALA A 37 -10.866 -7.877 9.762 1.00 0.00 C ATOM 518 O ALA A 37 -11.196 -7.547 10.884 1.00 0.00 O ATOM 519 CB ALA A 37 -8.564 -8.888 9.623 1.00 0.00 C ATOM 0 H ALA A 37 -9.436 -9.708 7.551 1.00 0.00 H new ATOM 0 HA ALA A 37 -10.392 -9.889 10.255 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.328 -8.540 10.629 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.014 -9.806 9.418 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.279 -8.125 8.899 1.00 0.00 H new ATOM 525 N HIS A 38 -11.181 -7.152 8.724 1.00 0.00 N ATOM 526 CA HIS A 38 -11.960 -5.894 8.904 1.00 0.00 C ATOM 527 C HIS A 38 -13.268 -5.980 8.114 1.00 0.00 C ATOM 528 O HIS A 38 -13.309 -5.703 6.932 1.00 0.00 O ATOM 529 CB HIS A 38 -11.067 -4.782 8.353 1.00 0.00 C ATOM 530 CG HIS A 38 -9.758 -4.774 9.094 1.00 0.00 C ATOM 531 ND1 HIS A 38 -8.743 -5.696 9.175 1.00 0.00 N flip ATOM 532 CD2 HIS A 38 -9.362 -3.706 9.883 1.00 0.00 C flip ATOM 533 CE1 HIS A 38 -7.733 -5.210 10.000 1.00 0.00 C flip ATOM 534 NE2 HIS A 38 -8.157 -4.008 10.400 1.00 0.00 N flip ATOM 0 H HIS A 38 -10.933 -7.376 7.760 1.00 0.00 H new ATOM 0 HA HIS A 38 -12.223 -5.713 9.946 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -10.893 -4.935 7.288 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -11.563 -3.817 8.459 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -9.919 -2.796 10.052 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -6.806 -5.699 10.261 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -7.631 -3.394 11.022 1.00 0.00 H new ATOM 543 N HIS A 39 -14.337 -6.362 8.757 1.00 0.00 N ATOM 544 CA HIS A 39 -15.640 -6.463 8.041 1.00 0.00 C ATOM 545 C HIS A 39 -16.306 -5.084 7.966 1.00 0.00 C ATOM 546 O HIS A 39 -17.428 -4.953 7.518 1.00 0.00 O ATOM 547 CB HIS A 39 -16.484 -7.426 8.878 1.00 0.00 C ATOM 548 CG HIS A 39 -16.371 -8.814 8.312 1.00 0.00 C ATOM 549 ND1 HIS A 39 -17.257 -9.824 8.650 1.00 0.00 N ATOM 550 CD2 HIS A 39 -15.481 -9.376 7.429 1.00 0.00 C ATOM 551 CE1 HIS A 39 -16.885 -10.931 7.981 1.00 0.00 C ATOM 552 NE2 HIS A 39 -15.808 -10.713 7.222 1.00 0.00 N ATOM 0 H HIS A 39 -14.365 -6.608 9.746 1.00 0.00 H new ATOM 0 HA HIS A 39 -15.523 -6.816 7.017 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -16.146 -7.416 9.914 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -17.526 -7.106 8.879 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -14.654 -8.859 6.966 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -17.395 -11.880 8.050 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -15.328 -11.382 6.620 1.00 0.00 H new ATOM 561 N ASP A 40 -15.627 -4.054 8.398 1.00 0.00 N ATOM 562 CA ASP A 40 -16.229 -2.692 8.345 1.00 0.00 C ATOM 563 C ASP A 40 -15.735 -1.963 7.094 1.00 0.00 C ATOM 564 O ASP A 40 -16.340 -1.015 6.636 1.00 0.00 O ATOM 565 CB ASP A 40 -15.744 -1.987 9.612 1.00 0.00 C ATOM 566 CG ASP A 40 -14.229 -1.780 9.549 1.00 0.00 C ATOM 567 OD1 ASP A 40 -13.523 -2.761 9.387 1.00 0.00 O ATOM 568 OD2 ASP A 40 -13.802 -0.643 9.663 1.00 0.00 O ATOM 0 H ASP A 40 -14.684 -4.098 8.784 1.00 0.00 H new ATOM 0 HA ASP A 40 -17.318 -2.717 8.296 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -16.247 -1.026 9.718 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -16.002 -2.580 10.489 1.00 0.00 H new ATOM 573 N MET A 41 -14.638 -2.400 6.537 1.00 0.00 N ATOM 574 CA MET A 41 -14.106 -1.733 5.316 1.00 0.00 C ATOM 575 C MET A 41 -14.389 -2.604 4.091 1.00 0.00 C ATOM 576 O MET A 41 -14.382 -2.138 2.970 1.00 0.00 O ATOM 577 CB MET A 41 -12.601 -1.599 5.552 1.00 0.00 C ATOM 578 CG MET A 41 -12.349 -0.752 6.803 1.00 0.00 C ATOM 579 SD MET A 41 -13.141 0.865 6.614 1.00 0.00 S ATOM 580 CE MET A 41 -11.733 1.726 5.873 1.00 0.00 C ATOM 0 H MET A 41 -14.088 -3.190 6.875 1.00 0.00 H new ATOM 0 HA MET A 41 -14.568 -0.762 5.135 1.00 0.00 H new ATOM 0 HB2 MET A 41 -12.153 -2.585 5.672 1.00 0.00 H new ATOM 0 HB3 MET A 41 -12.127 -1.137 4.686 1.00 0.00 H new ATOM 0 HG2 MET A 41 -12.743 -1.260 7.683 1.00 0.00 H new ATOM 0 HG3 MET A 41 -11.278 -0.627 6.960 1.00 0.00 H new ATOM 0 HE1 MET A 41 -12.082 2.360 5.058 1.00 0.00 H new ATOM 0 HE2 MET A 41 -11.245 2.342 6.628 1.00 0.00 H new ATOM 0 HE3 MET A 41 -11.022 0.996 5.486 1.00 0.00 H new ATOM 590 N ALA A 42 -14.641 -3.868 4.292 1.00 0.00 N ATOM 591 CA ALA A 42 -14.928 -4.760 3.133 1.00 0.00 C ATOM 592 C ALA A 42 -15.983 -4.107 2.237 1.00 0.00 C ATOM 593 O ALA A 42 -15.943 -4.220 1.028 1.00 0.00 O ATOM 594 CB ALA A 42 -15.457 -6.058 3.741 1.00 0.00 C ATOM 0 H ALA A 42 -14.661 -4.321 5.206 1.00 0.00 H new ATOM 0 HA ALA A 42 -14.048 -4.943 2.517 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -15.690 -6.764 2.944 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.700 -6.488 4.397 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -16.359 -5.849 4.316 1.00 0.00 H new ATOM 600 N ALA A 43 -16.922 -3.414 2.823 1.00 0.00 N ATOM 601 CA ALA A 43 -17.973 -2.744 2.007 1.00 0.00 C ATOM 602 C ALA A 43 -17.398 -1.460 1.407 1.00 0.00 C ATOM 603 O ALA A 43 -17.818 -1.006 0.361 1.00 0.00 O ATOM 604 CB ALA A 43 -19.105 -2.428 2.986 1.00 0.00 C ATOM 0 H ALA A 43 -17.006 -3.283 3.831 1.00 0.00 H new ATOM 0 HA ALA A 43 -18.327 -3.362 1.182 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -19.917 -1.932 2.455 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -19.473 -3.354 3.428 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -18.733 -1.773 3.773 1.00 0.00 H new ATOM 610 N VAL A 44 -16.432 -0.875 2.062 1.00 0.00 N ATOM 611 CA VAL A 44 -15.818 0.375 1.534 1.00 0.00 C ATOM 612 C VAL A 44 -15.071 0.059 0.234 1.00 0.00 C ATOM 613 O VAL A 44 -15.382 0.585 -0.816 1.00 0.00 O ATOM 614 CB VAL A 44 -14.851 0.838 2.631 1.00 0.00 C ATOM 615 CG1 VAL A 44 -13.892 1.892 2.074 1.00 0.00 C ATOM 616 CG2 VAL A 44 -15.652 1.441 3.788 1.00 0.00 C ATOM 0 H VAL A 44 -16.041 -1.211 2.942 1.00 0.00 H new ATOM 0 HA VAL A 44 -16.551 1.148 1.304 1.00 0.00 H new ATOM 0 HB VAL A 44 -14.274 -0.017 2.985 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -13.209 2.215 2.860 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -13.321 1.465 1.250 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -14.462 2.749 1.714 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -14.969 1.772 4.570 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -16.229 2.292 3.426 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -16.330 0.689 4.192 1.00 0.00 H new ATOM 626 N PHE A 45 -14.089 -0.798 0.298 1.00 0.00 N ATOM 627 CA PHE A 45 -13.325 -1.149 -0.930 1.00 0.00 C ATOM 628 C PHE A 45 -14.298 -1.548 -2.040 1.00 0.00 C ATOM 629 O PHE A 45 -14.019 -1.388 -3.212 1.00 0.00 O ATOM 630 CB PHE A 45 -12.446 -2.333 -0.526 1.00 0.00 C ATOM 631 CG PHE A 45 -11.428 -1.879 0.492 1.00 0.00 C ATOM 632 CD1 PHE A 45 -10.421 -0.981 0.120 1.00 0.00 C ATOM 633 CD2 PHE A 45 -11.491 -2.357 1.806 1.00 0.00 C ATOM 634 CE1 PHE A 45 -9.476 -0.560 1.062 1.00 0.00 C ATOM 635 CE2 PHE A 45 -10.545 -1.936 2.749 1.00 0.00 C ATOM 636 CZ PHE A 45 -9.537 -1.038 2.377 1.00 0.00 C ATOM 0 H PHE A 45 -13.783 -1.270 1.149 1.00 0.00 H new ATOM 0 HA PHE A 45 -12.728 -0.319 -1.307 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -13.061 -3.131 -0.110 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -11.943 -2.742 -1.402 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -10.373 -0.613 -0.894 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -12.268 -3.050 2.092 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -8.699 0.134 0.775 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -10.593 -2.304 3.763 1.00 0.00 H new ATOM 0 HZ PHE A 45 -8.807 -0.714 3.104 1.00 0.00 H new ATOM 646 N GLY A 46 -15.440 -2.067 -1.680 1.00 0.00 N ATOM 647 CA GLY A 46 -16.431 -2.477 -2.714 1.00 0.00 C ATOM 648 C GLY A 46 -16.566 -3.999 -2.706 1.00 0.00 C ATOM 649 O GLY A 46 -16.934 -4.603 -3.694 1.00 0.00 O ATOM 0 H GLY A 46 -15.729 -2.225 -0.715 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -17.397 -2.013 -2.513 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -16.111 -2.134 -3.698 1.00 0.00 H new ATOM 653 N PHE A 47 -16.269 -4.626 -1.601 1.00 0.00 N ATOM 654 CA PHE A 47 -16.377 -6.112 -1.538 1.00 0.00 C ATOM 655 C PHE A 47 -17.343 -6.521 -0.426 1.00 0.00 C ATOM 656 O PHE A 47 -17.699 -5.733 0.428 1.00 0.00 O ATOM 657 CB PHE A 47 -14.966 -6.615 -1.219 1.00 0.00 C ATOM 658 CG PHE A 47 -13.961 -5.968 -2.141 1.00 0.00 C ATOM 659 CD1 PHE A 47 -14.297 -5.704 -3.474 1.00 0.00 C ATOM 660 CD2 PHE A 47 -12.689 -5.635 -1.661 1.00 0.00 C ATOM 661 CE1 PHE A 47 -13.363 -5.107 -4.326 1.00 0.00 C ATOM 662 CE2 PHE A 47 -11.754 -5.039 -2.514 1.00 0.00 C ATOM 663 CZ PHE A 47 -12.090 -4.775 -3.846 1.00 0.00 C ATOM 0 H PHE A 47 -15.957 -4.175 -0.741 1.00 0.00 H new ATOM 0 HA PHE A 47 -16.755 -6.530 -2.471 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -14.717 -6.389 -0.182 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -14.925 -7.699 -1.328 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -15.278 -5.962 -3.844 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -12.429 -5.838 -0.633 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -13.623 -4.902 -5.354 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -10.772 -4.783 -2.144 1.00 0.00 H new ATOM 0 HZ PHE A 47 -11.368 -4.315 -4.504 1.00 0.00 H new ATOM 673 N SER A 48 -17.754 -7.758 -0.423 1.00 0.00 N ATOM 674 CA SER A 48 -18.678 -8.238 0.639 1.00 0.00 C ATOM 675 C SER A 48 -17.896 -9.122 1.614 1.00 0.00 C ATOM 676 O SER A 48 -18.305 -9.344 2.736 1.00 0.00 O ATOM 677 CB SER A 48 -19.749 -9.048 -0.092 1.00 0.00 C ATOM 678 OG SER A 48 -20.863 -9.239 0.769 1.00 0.00 O ATOM 0 H SER A 48 -17.488 -8.460 -1.114 1.00 0.00 H new ATOM 0 HA SER A 48 -19.124 -7.426 1.213 1.00 0.00 H new ATOM 0 HB2 SER A 48 -20.060 -8.527 -0.998 1.00 0.00 H new ATOM 0 HB3 SER A 48 -19.344 -10.012 -0.401 1.00 0.00 H new ATOM 0 HG SER A 48 -21.552 -9.757 0.303 1.00 0.00 H new ATOM 684 N GLY A 49 -16.767 -9.626 1.189 1.00 0.00 N ATOM 685 CA GLY A 49 -15.947 -10.493 2.079 1.00 0.00 C ATOM 686 C GLY A 49 -14.564 -10.682 1.452 1.00 0.00 C ATOM 687 O GLY A 49 -14.162 -9.939 0.579 1.00 0.00 O ATOM 0 H GLY A 49 -16.378 -9.472 0.259 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -15.854 -10.039 3.066 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.433 -11.459 2.217 1.00 0.00 H new ATOM 691 N ALA A 50 -13.835 -11.670 1.889 1.00 0.00 N ATOM 692 CA ALA A 50 -12.479 -11.907 1.317 1.00 0.00 C ATOM 693 C ALA A 50 -12.551 -13.001 0.248 1.00 0.00 C ATOM 694 O ALA A 50 -11.547 -13.554 -0.156 1.00 0.00 O ATOM 695 CB ALA A 50 -11.618 -12.359 2.498 1.00 0.00 C ATOM 0 H ALA A 50 -14.119 -12.325 2.618 1.00 0.00 H new ATOM 0 HA ALA A 50 -12.068 -11.018 0.839 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -10.602 -12.553 2.154 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -11.601 -11.576 3.257 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -12.037 -13.270 2.926 1.00 0.00 H new ATOM 701 N SER A 51 -13.730 -13.318 -0.217 1.00 0.00 N ATOM 702 CA SER A 51 -13.861 -14.374 -1.260 1.00 0.00 C ATOM 703 C SER A 51 -14.246 -13.730 -2.593 1.00 0.00 C ATOM 704 O SER A 51 -14.835 -14.357 -3.451 1.00 0.00 O ATOM 705 CB SER A 51 -14.971 -15.298 -0.761 1.00 0.00 C ATOM 706 OG SER A 51 -14.664 -15.733 0.557 1.00 0.00 O ATOM 0 H SER A 51 -14.607 -12.891 0.081 1.00 0.00 H new ATOM 0 HA SER A 51 -12.933 -14.922 -1.422 1.00 0.00 H new ATOM 0 HB2 SER A 51 -15.927 -14.774 -0.770 1.00 0.00 H new ATOM 0 HB3 SER A 51 -15.071 -16.156 -1.425 1.00 0.00 H new ATOM 0 HG SER A 51 -15.375 -16.325 0.880 1.00 0.00 H new ATOM 712 N ASP A 52 -13.916 -12.480 -2.772 1.00 0.00 N ATOM 713 CA ASP A 52 -14.261 -11.789 -4.050 1.00 0.00 C ATOM 714 C ASP A 52 -12.977 -11.330 -4.747 1.00 0.00 C ATOM 715 O ASP A 52 -12.047 -10.882 -4.106 1.00 0.00 O ATOM 716 CB ASP A 52 -15.140 -10.585 -3.668 1.00 0.00 C ATOM 717 CG ASP A 52 -14.675 -9.956 -2.350 1.00 0.00 C ATOM 718 OD1 ASP A 52 -13.493 -9.688 -2.229 1.00 0.00 O ATOM 719 OD2 ASP A 52 -15.512 -9.756 -1.485 1.00 0.00 O ATOM 0 H ASP A 52 -13.422 -11.906 -2.089 1.00 0.00 H new ATOM 0 HA ASP A 52 -14.790 -12.447 -4.739 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.105 -9.839 -4.462 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.178 -10.904 -3.576 1.00 0.00 H new ATOM 724 N PRO A 53 -12.969 -11.467 -6.047 1.00 0.00 N ATOM 725 CA PRO A 53 -11.766 -11.062 -6.826 1.00 0.00 C ATOM 726 C PRO A 53 -11.608 -9.538 -6.816 1.00 0.00 C ATOM 727 O PRO A 53 -10.577 -9.012 -7.185 1.00 0.00 O ATOM 728 CB PRO A 53 -12.052 -11.576 -8.235 1.00 0.00 C ATOM 729 CG PRO A 53 -13.530 -11.762 -8.313 1.00 0.00 C ATOM 730 CD PRO A 53 -14.028 -12.002 -6.915 1.00 0.00 C ATOM 0 HA PRO A 53 -10.839 -11.463 -6.417 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -11.708 -10.866 -8.987 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.530 -12.515 -8.421 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -14.005 -10.881 -8.744 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.777 -12.605 -8.958 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -14.977 -11.496 -6.740 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.194 -13.063 -6.730 1.00 0.00 H new ATOM 738 N GLY A 54 -12.619 -8.824 -6.403 1.00 0.00 N ATOM 739 CA GLY A 54 -12.519 -7.336 -6.378 1.00 0.00 C ATOM 740 C GLY A 54 -11.235 -6.926 -5.656 1.00 0.00 C ATOM 741 O GLY A 54 -10.548 -6.010 -6.061 1.00 0.00 O ATOM 0 H GLY A 54 -13.509 -9.205 -6.082 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -12.519 -6.943 -7.395 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.386 -6.911 -5.872 1.00 0.00 H new ATOM 745 N VAL A 55 -10.908 -7.597 -4.589 1.00 0.00 N ATOM 746 CA VAL A 55 -9.668 -7.249 -3.838 1.00 0.00 C ATOM 747 C VAL A 55 -8.490 -7.162 -4.808 1.00 0.00 C ATOM 748 O VAL A 55 -7.706 -6.234 -4.767 1.00 0.00 O ATOM 749 CB VAL A 55 -9.471 -8.390 -2.841 1.00 0.00 C ATOM 750 CG1 VAL A 55 -8.290 -8.074 -1.922 1.00 0.00 C ATOM 751 CG2 VAL A 55 -10.741 -8.549 -2.004 1.00 0.00 C ATOM 0 H VAL A 55 -11.446 -8.373 -4.203 1.00 0.00 H new ATOM 0 HA VAL A 55 -9.739 -6.286 -3.331 1.00 0.00 H new ATOM 0 HB VAL A 55 -9.267 -9.315 -3.381 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -8.153 -8.890 -1.212 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.386 -7.956 -2.519 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.489 -7.150 -1.379 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -10.607 -9.362 -1.290 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -10.940 -7.622 -1.466 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -11.582 -8.776 -2.659 1.00 0.00 H new ATOM 761 N ALA A 56 -8.360 -8.119 -5.685 1.00 0.00 N ATOM 762 CA ALA A 56 -7.236 -8.085 -6.661 1.00 0.00 C ATOM 763 C ALA A 56 -7.360 -6.838 -7.541 1.00 0.00 C ATOM 764 O ALA A 56 -6.420 -6.435 -8.198 1.00 0.00 O ATOM 765 CB ALA A 56 -7.387 -9.357 -7.496 1.00 0.00 C ATOM 0 H ALA A 56 -8.983 -8.922 -5.768 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.261 -8.043 -6.176 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.591 -9.401 -8.239 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.324 -10.229 -6.845 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -8.354 -9.349 -8.000 1.00 0.00 H new ATOM 771 N ASP A 57 -8.512 -6.224 -7.560 1.00 0.00 N ATOM 772 CA ASP A 57 -8.693 -5.005 -8.397 1.00 0.00 C ATOM 773 C ASP A 57 -8.089 -3.795 -7.681 1.00 0.00 C ATOM 774 O ASP A 57 -7.521 -2.916 -8.299 1.00 0.00 O ATOM 775 CB ASP A 57 -10.206 -4.844 -8.555 1.00 0.00 C ATOM 776 CG ASP A 57 -10.536 -4.358 -9.967 1.00 0.00 C ATOM 777 OD1 ASP A 57 -9.812 -3.512 -10.466 1.00 0.00 O ATOM 778 OD2 ASP A 57 -11.507 -4.840 -10.526 1.00 0.00 O ATOM 0 H ASP A 57 -9.335 -6.514 -7.032 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.199 -5.086 -9.365 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.703 -5.795 -8.363 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -10.583 -4.133 -7.820 1.00 0.00 H new ATOM 783 N LEU A 58 -8.206 -3.740 -6.381 1.00 0.00 N ATOM 784 CA LEU A 58 -7.635 -2.583 -5.634 1.00 0.00 C ATOM 785 C LEU A 58 -6.170 -2.861 -5.298 1.00 0.00 C ATOM 786 O LEU A 58 -5.285 -2.134 -5.701 1.00 0.00 O ATOM 787 CB LEU A 58 -8.469 -2.467 -4.354 1.00 0.00 C ATOM 788 CG LEU A 58 -9.677 -1.560 -4.599 1.00 0.00 C ATOM 789 CD1 LEU A 58 -10.450 -1.375 -3.294 1.00 0.00 C ATOM 790 CD2 LEU A 58 -9.205 -0.194 -5.099 1.00 0.00 C ATOM 0 H LEU A 58 -8.670 -4.443 -5.806 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.668 -1.660 -6.214 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -8.803 -3.455 -4.037 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -7.858 -2.063 -3.547 1.00 0.00 H new ATOM 0 HG LEU A 58 -10.322 -2.019 -5.348 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -11.310 -0.729 -3.469 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -10.792 -2.345 -2.933 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.800 -0.919 -2.547 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -10.068 0.448 -5.272 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -8.557 0.263 -4.351 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -8.653 -0.318 -6.031 1.00 0.00 H new ATOM 802 N GLY A 59 -5.906 -3.907 -4.561 1.00 0.00 N ATOM 803 CA GLY A 59 -4.496 -4.232 -4.194 1.00 0.00 C ATOM 804 C GLY A 59 -3.607 -4.145 -5.438 1.00 0.00 C ATOM 805 O GLY A 59 -2.562 -3.525 -5.422 1.00 0.00 O ATOM 0 H GLY A 59 -6.607 -4.552 -4.196 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -4.140 -3.540 -3.431 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -4.443 -5.233 -3.766 1.00 0.00 H new ATOM 809 N ALA A 60 -4.011 -4.761 -6.514 1.00 0.00 N ATOM 810 CA ALA A 60 -3.185 -4.713 -7.754 1.00 0.00 C ATOM 811 C ALA A 60 -2.940 -3.255 -8.155 1.00 0.00 C ATOM 812 O ALA A 60 -1.869 -2.897 -8.603 1.00 0.00 O ATOM 813 CB ALA A 60 -4.012 -5.436 -8.818 1.00 0.00 C ATOM 0 H ALA A 60 -4.877 -5.295 -6.589 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.209 -5.180 -7.623 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.467 -5.441 -9.762 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.196 -6.462 -8.500 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -4.963 -4.921 -8.951 1.00 0.00 H new ATOM 819 N LYS A 61 -3.924 -2.412 -7.999 1.00 0.00 N ATOM 820 CA LYS A 61 -3.744 -0.980 -8.373 1.00 0.00 C ATOM 821 C LYS A 61 -3.079 -0.226 -7.219 1.00 0.00 C ATOM 822 O LYS A 61 -2.364 0.735 -7.423 1.00 0.00 O ATOM 823 CB LYS A 61 -5.157 -0.449 -8.624 1.00 0.00 C ATOM 824 CG LYS A 61 -5.459 -0.493 -10.123 1.00 0.00 C ATOM 825 CD LYS A 61 -6.974 -0.483 -10.339 1.00 0.00 C ATOM 826 CE LYS A 61 -7.284 -0.012 -11.762 1.00 0.00 C ATOM 827 NZ LYS A 61 -8.277 -0.994 -12.277 1.00 0.00 N ATOM 0 H LYS A 61 -4.844 -2.652 -7.629 1.00 0.00 H new ATOM 0 HA LYS A 61 -3.108 -0.854 -9.250 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -5.885 -1.049 -8.078 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -5.244 0.573 -8.254 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -5.004 0.363 -10.622 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -5.024 -1.389 -10.566 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -7.382 -1.481 -10.178 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -7.451 0.177 -9.614 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -7.690 1.000 -11.765 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -6.385 0.003 -12.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -8.542 -0.741 -13.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -7.860 -1.947 -12.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -9.124 -0.981 -11.673 1.00 0.00 H new ATOM 841 N VAL A 62 -3.310 -0.654 -6.009 1.00 0.00 N ATOM 842 CA VAL A 62 -2.692 0.037 -4.843 1.00 0.00 C ATOM 843 C VAL A 62 -1.191 -0.257 -4.807 1.00 0.00 C ATOM 844 O VAL A 62 -0.378 0.635 -4.660 1.00 0.00 O ATOM 845 CB VAL A 62 -3.393 -0.544 -3.614 1.00 0.00 C ATOM 846 CG1 VAL A 62 -2.925 0.196 -2.360 1.00 0.00 C ATOM 847 CG2 VAL A 62 -4.908 -0.381 -3.767 1.00 0.00 C ATOM 0 H VAL A 62 -3.900 -1.453 -5.777 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.805 1.120 -4.889 1.00 0.00 H new ATOM 0 HB VAL A 62 -3.148 -1.602 -3.523 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.425 -0.219 -1.485 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -1.847 0.080 -2.250 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -3.169 1.254 -2.450 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.409 -0.795 -2.892 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.153 0.677 -3.859 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -5.242 -0.909 -4.660 1.00 0.00 H new ATOM 857 N LEU A 63 -0.813 -1.500 -4.944 1.00 0.00 N ATOM 858 CA LEU A 63 0.637 -1.845 -4.920 1.00 0.00 C ATOM 859 C LEU A 63 1.403 -0.917 -5.867 1.00 0.00 C ATOM 860 O LEU A 63 2.398 -0.326 -5.500 1.00 0.00 O ATOM 861 CB LEU A 63 0.714 -3.294 -5.407 1.00 0.00 C ATOM 862 CG LEU A 63 0.957 -4.222 -4.217 1.00 0.00 C ATOM 863 CD1 LEU A 63 2.303 -3.886 -3.573 1.00 0.00 C ATOM 864 CD2 LEU A 63 -0.161 -4.035 -3.189 1.00 0.00 C ATOM 0 H LEU A 63 -1.445 -2.290 -5.071 1.00 0.00 H new ATOM 0 HA LEU A 63 1.076 -1.731 -3.929 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -0.212 -3.568 -5.912 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.518 -3.401 -6.135 1.00 0.00 H new ATOM 0 HG LEU A 63 0.967 -5.257 -4.560 1.00 0.00 H new ATOM 0 HD11 LEU A 63 2.476 -4.548 -2.724 1.00 0.00 H new ATOM 0 HD12 LEU A 63 3.100 -4.019 -4.305 1.00 0.00 H new ATOM 0 HD13 LEU A 63 2.294 -2.851 -3.230 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.011 -4.696 -2.340 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -0.171 -3.000 -2.847 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -1.120 -4.275 -3.647 1.00 0.00 H new ATOM 876 N ALA A 64 0.945 -0.787 -7.083 1.00 0.00 N ATOM 877 CA ALA A 64 1.646 0.099 -8.057 1.00 0.00 C ATOM 878 C ALA A 64 1.965 1.447 -7.404 1.00 0.00 C ATOM 879 O ALA A 64 3.057 1.965 -7.532 1.00 0.00 O ATOM 880 CB ALA A 64 0.665 0.276 -9.217 1.00 0.00 C ATOM 0 H ALA A 64 0.115 -1.257 -7.444 1.00 0.00 H new ATOM 0 HA ALA A 64 2.593 -0.323 -8.394 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.111 0.918 -9.976 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.437 -0.697 -9.653 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -0.254 0.733 -8.850 1.00 0.00 H new ATOM 886 N GLN A 65 1.025 2.019 -6.702 1.00 0.00 N ATOM 887 CA GLN A 65 1.288 3.331 -6.044 1.00 0.00 C ATOM 888 C GLN A 65 2.487 3.195 -5.105 1.00 0.00 C ATOM 889 O GLN A 65 3.436 3.950 -5.182 1.00 0.00 O ATOM 890 CB GLN A 65 0.015 3.654 -5.260 1.00 0.00 C ATOM 891 CG GLN A 65 -0.078 5.165 -5.037 1.00 0.00 C ATOM 892 CD GLN A 65 -0.100 5.892 -6.383 1.00 0.00 C ATOM 893 OE1 GLN A 65 -1.106 5.904 -7.064 1.00 0.00 O ATOM 894 NE2 GLN A 65 0.976 6.503 -6.798 1.00 0.00 N ATOM 0 H GLN A 65 0.091 1.637 -6.556 1.00 0.00 H new ATOM 0 HA GLN A 65 1.522 4.120 -6.758 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.860 3.302 -5.806 1.00 0.00 H new ATOM 0 HB3 GLN A 65 0.024 3.134 -4.302 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.979 5.403 -4.471 1.00 0.00 H new ATOM 0 HG3 GLN A 65 0.770 5.506 -4.444 1.00 0.00 H new ATOM 0 HE21 GLN A 65 1.821 6.493 -6.226 1.00 0.00 H new ATOM 0 HE22 GLN A 65 0.972 6.991 -7.694 1.00 0.00 H new ATOM 903 N ILE A 66 2.456 2.234 -4.224 1.00 0.00 N ATOM 904 CA ILE A 66 3.601 2.050 -3.290 1.00 0.00 C ATOM 905 C ILE A 66 4.895 1.932 -4.098 1.00 0.00 C ATOM 906 O ILE A 66 5.935 2.415 -3.698 1.00 0.00 O ATOM 907 CB ILE A 66 3.304 0.752 -2.538 1.00 0.00 C ATOM 908 CG1 ILE A 66 2.054 0.940 -1.676 1.00 0.00 C ATOM 909 CG2 ILE A 66 4.492 0.398 -1.642 1.00 0.00 C ATOM 910 CD1 ILE A 66 1.646 -0.402 -1.065 1.00 0.00 C ATOM 0 H ILE A 66 1.690 1.570 -4.111 1.00 0.00 H new ATOM 0 HA ILE A 66 3.723 2.885 -2.600 1.00 0.00 H new ATOM 0 HB ILE A 66 3.137 -0.053 -3.253 1.00 0.00 H new ATOM 0 HG12 ILE A 66 2.250 1.666 -0.887 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.239 1.339 -2.281 1.00 0.00 H new ATOM 0 HG21 ILE A 66 4.280 -0.527 -1.106 1.00 0.00 H new ATOM 0 HG22 ILE A 66 5.384 0.266 -2.255 1.00 0.00 H new ATOM 0 HG23 ILE A 66 4.660 1.202 -0.926 1.00 0.00 H new ATOM 0 HD11 ILE A 66 0.755 -0.267 -0.451 1.00 0.00 H new ATOM 0 HD12 ILE A 66 1.433 -1.115 -1.862 1.00 0.00 H new ATOM 0 HD13 ILE A 66 2.459 -0.782 -0.446 1.00 0.00 H new ATOM 922 N GLY A 67 4.835 1.296 -5.237 1.00 0.00 N ATOM 923 CA GLY A 67 6.057 1.151 -6.075 1.00 0.00 C ATOM 924 C GLY A 67 6.538 2.537 -6.499 1.00 0.00 C ATOM 925 O GLY A 67 7.670 2.912 -6.265 1.00 0.00 O ATOM 0 H GLY A 67 3.992 0.871 -5.622 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.838 0.637 -5.515 1.00 0.00 H new ATOM 0 HA3 GLY A 67 5.841 0.543 -6.953 1.00 0.00 H new ATOM 929 N VAL A 68 5.685 3.305 -7.119 1.00 0.00 N ATOM 930 CA VAL A 68 6.096 4.670 -7.553 1.00 0.00 C ATOM 931 C VAL A 68 6.505 5.485 -6.326 1.00 0.00 C ATOM 932 O VAL A 68 7.248 6.441 -6.421 1.00 0.00 O ATOM 933 CB VAL A 68 4.858 5.273 -8.219 1.00 0.00 C ATOM 934 CG1 VAL A 68 5.186 6.677 -8.731 1.00 0.00 C ATOM 935 CG2 VAL A 68 4.432 4.390 -9.395 1.00 0.00 C ATOM 0 H VAL A 68 4.724 3.047 -7.343 1.00 0.00 H new ATOM 0 HA VAL A 68 6.945 4.658 -8.237 1.00 0.00 H new ATOM 0 HB VAL A 68 4.047 5.331 -7.493 1.00 0.00 H new ATOM 0 HG11 VAL A 68 4.304 7.107 -9.206 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.492 7.307 -7.895 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.997 6.619 -9.457 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.550 4.818 -9.871 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.244 4.333 -10.120 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.199 3.389 -9.032 1.00 0.00 H new ATOM 945 N ALA A 69 6.022 5.111 -5.173 1.00 0.00 N ATOM 946 CA ALA A 69 6.379 5.859 -3.936 1.00 0.00 C ATOM 947 C ALA A 69 7.682 5.301 -3.357 1.00 0.00 C ATOM 948 O ALA A 69 8.385 5.972 -2.628 1.00 0.00 O ATOM 949 CB ALA A 69 5.212 5.623 -2.975 1.00 0.00 C ATOM 0 H ALA A 69 5.395 4.319 -5.035 1.00 0.00 H new ATOM 0 HA ALA A 69 6.537 6.922 -4.119 1.00 0.00 H new ATOM 0 HB1 ALA A 69 5.402 6.145 -2.037 1.00 0.00 H new ATOM 0 HB2 ALA A 69 4.292 6.001 -3.420 1.00 0.00 H new ATOM 0 HB3 ALA A 69 5.110 4.555 -2.782 1.00 0.00 H new ATOM 955 N VAL A 70 8.008 4.077 -3.674 1.00 0.00 N ATOM 956 CA VAL A 70 9.264 3.479 -3.138 1.00 0.00 C ATOM 957 C VAL A 70 10.474 4.102 -3.839 1.00 0.00 C ATOM 958 O VAL A 70 11.580 4.068 -3.336 1.00 0.00 O ATOM 959 CB VAL A 70 9.164 1.984 -3.450 1.00 0.00 C ATOM 960 CG1 VAL A 70 10.505 1.307 -3.154 1.00 0.00 C ATOM 961 CG2 VAL A 70 8.076 1.353 -2.579 1.00 0.00 C ATOM 0 H VAL A 70 7.460 3.466 -4.280 1.00 0.00 H new ATOM 0 HA VAL A 70 9.387 3.656 -2.069 1.00 0.00 H new ATOM 0 HB VAL A 70 8.914 1.851 -4.502 1.00 0.00 H new ATOM 0 HG11 VAL A 70 10.432 0.242 -3.377 1.00 0.00 H new ATOM 0 HG12 VAL A 70 11.283 1.755 -3.772 1.00 0.00 H new ATOM 0 HG13 VAL A 70 10.756 1.441 -2.102 1.00 0.00 H new ATOM 0 HG21 VAL A 70 8.004 0.288 -2.801 1.00 0.00 H new ATOM 0 HG22 VAL A 70 8.328 1.488 -1.527 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.119 1.832 -2.788 1.00 0.00 H new ATOM 971 N SER A 71 10.277 4.666 -5.000 1.00 0.00 N ATOM 972 CA SER A 71 11.420 5.282 -5.735 1.00 0.00 C ATOM 973 C SER A 71 11.585 6.746 -5.314 1.00 0.00 C ATOM 974 O SER A 71 11.864 7.604 -6.128 1.00 0.00 O ATOM 975 CB SER A 71 11.047 5.183 -7.214 1.00 0.00 C ATOM 976 OG SER A 71 11.101 3.822 -7.621 1.00 0.00 O ATOM 0 H SER A 71 9.375 4.727 -5.471 1.00 0.00 H new ATOM 0 HA SER A 71 12.365 4.781 -5.525 1.00 0.00 H new ATOM 0 HB2 SER A 71 10.046 5.584 -7.376 1.00 0.00 H new ATOM 0 HB3 SER A 71 11.732 5.782 -7.815 1.00 0.00 H new ATOM 0 HG SER A 71 10.861 3.754 -8.569 1.00 0.00 H new ATOM 982 N HIS A 72 11.414 7.042 -4.054 1.00 0.00 N ATOM 983 CA HIS A 72 11.562 8.454 -3.596 1.00 0.00 C ATOM 984 C HIS A 72 12.028 8.483 -2.137 1.00 0.00 C ATOM 985 O HIS A 72 13.094 8.973 -1.835 1.00 0.00 O ATOM 986 CB HIS A 72 10.167 9.067 -3.727 1.00 0.00 C ATOM 987 CG HIS A 72 9.894 9.394 -5.168 1.00 0.00 C ATOM 988 ND1 HIS A 72 10.874 9.892 -6.013 1.00 0.00 N ATOM 989 CD2 HIS A 72 8.756 9.301 -5.928 1.00 0.00 C ATOM 990 CE1 HIS A 72 10.311 10.078 -7.221 1.00 0.00 C ATOM 991 NE2 HIS A 72 9.020 9.734 -7.224 1.00 0.00 N ATOM 0 H HIS A 72 11.179 6.370 -3.324 1.00 0.00 H new ATOM 0 HA HIS A 72 12.300 9.004 -4.180 1.00 0.00 H new ATOM 0 HB2 HIS A 72 9.416 8.371 -3.353 1.00 0.00 H new ATOM 0 HB3 HIS A 72 10.096 9.969 -3.119 1.00 0.00 H new ATOM 0 HD2 HIS A 72 7.800 8.945 -5.574 1.00 0.00 H new ATOM 0 HE1 HIS A 72 10.838 10.459 -8.083 1.00 0.00 H new ATOM 0 HE2 HIS A 72 8.368 9.779 -8.007 1.00 0.00 H new ATOM 1000 N LEU A 73 11.233 7.951 -1.243 1.00 0.00 N ATOM 1001 CA LEU A 73 11.595 7.924 0.204 1.00 0.00 C ATOM 1002 C LEU A 73 12.205 9.262 0.633 1.00 0.00 C ATOM 1003 O LEU A 73 11.511 10.159 1.069 1.00 0.00 O ATOM 1004 CB LEU A 73 12.602 6.784 0.333 1.00 0.00 C ATOM 1005 CG LEU A 73 11.854 5.453 0.452 1.00 0.00 C ATOM 1006 CD1 LEU A 73 11.091 5.410 1.776 1.00 0.00 C ATOM 1007 CD2 LEU A 73 10.863 5.305 -0.706 1.00 0.00 C ATOM 0 H LEU A 73 10.332 7.527 -1.461 1.00 0.00 H new ATOM 0 HA LEU A 73 10.729 7.770 0.847 1.00 0.00 H new ATOM 0 HB2 LEU A 73 13.261 6.767 -0.535 1.00 0.00 H new ATOM 0 HB3 LEU A 73 13.232 6.939 1.209 1.00 0.00 H new ATOM 0 HG LEU A 73 12.575 4.637 0.417 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.559 4.462 1.859 1.00 0.00 H new ATOM 0 HD12 LEU A 73 11.793 5.506 2.604 1.00 0.00 H new ATOM 0 HD13 LEU A 73 10.375 6.232 1.810 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.335 4.356 -0.614 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.144 6.124 -0.677 1.00 0.00 H new ATOM 0 HD23 LEU A 73 11.403 5.330 -1.652 1.00 0.00 H new ATOM 1019 N GLY A 74 13.492 9.404 0.511 1.00 0.00 N ATOM 1020 CA GLY A 74 14.143 10.684 0.909 1.00 0.00 C ATOM 1021 C GLY A 74 13.496 11.833 0.135 1.00 0.00 C ATOM 1022 O GLY A 74 13.416 12.949 0.610 1.00 0.00 O ATOM 0 H GLY A 74 14.125 8.689 0.152 1.00 0.00 H new ATOM 0 HA2 GLY A 74 14.034 10.844 1.982 1.00 0.00 H new ATOM 0 HA3 GLY A 74 15.212 10.644 0.700 1.00 0.00 H new ATOM 1026 N ASP A 75 13.033 11.568 -1.055 1.00 0.00 N ATOM 1027 CA ASP A 75 12.389 12.641 -1.863 1.00 0.00 C ATOM 1028 C ASP A 75 10.922 12.783 -1.449 1.00 0.00 C ATOM 1029 O ASP A 75 10.024 12.661 -2.258 1.00 0.00 O ATOM 1030 CB ASP A 75 12.499 12.171 -3.315 1.00 0.00 C ATOM 1031 CG ASP A 75 13.822 12.645 -3.920 1.00 0.00 C ATOM 1032 OD1 ASP A 75 14.813 11.957 -3.738 1.00 0.00 O ATOM 1033 OD2 ASP A 75 13.822 13.687 -4.553 1.00 0.00 O ATOM 0 H ASP A 75 13.073 10.653 -1.504 1.00 0.00 H new ATOM 0 HA ASP A 75 12.861 13.613 -1.721 1.00 0.00 H new ATOM 0 HB2 ASP A 75 12.438 11.084 -3.359 1.00 0.00 H new ATOM 0 HB3 ASP A 75 11.663 12.561 -3.896 1.00 0.00 H new ATOM 1038 N GLU A 76 10.673 13.040 -0.194 1.00 0.00 N ATOM 1039 CA GLU A 76 9.265 13.188 0.273 1.00 0.00 C ATOM 1040 C GLU A 76 8.633 14.422 -0.376 1.00 0.00 C ATOM 1041 O GLU A 76 7.428 14.519 -0.503 1.00 0.00 O ATOM 1042 CB GLU A 76 9.362 13.361 1.789 1.00 0.00 C ATOM 1043 CG GLU A 76 10.248 14.567 2.110 1.00 0.00 C ATOM 1044 CD GLU A 76 11.283 14.189 3.172 1.00 0.00 C ATOM 1045 OE1 GLU A 76 12.269 13.566 2.814 1.00 0.00 O ATOM 1046 OE2 GLU A 76 11.071 14.528 4.324 1.00 0.00 O ATOM 0 H GLU A 76 11.384 13.154 0.529 1.00 0.00 H new ATOM 0 HA GLU A 76 8.644 12.332 0.008 1.00 0.00 H new ATOM 0 HB2 GLU A 76 8.368 13.503 2.214 1.00 0.00 H new ATOM 0 HB3 GLU A 76 9.777 12.461 2.243 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.751 14.910 1.206 1.00 0.00 H new ATOM 0 HG3 GLU A 76 9.635 15.394 2.467 1.00 0.00 H new ATOM 1053 N GLY A 77 9.435 15.366 -0.785 1.00 0.00 N ATOM 1054 CA GLY A 77 8.878 16.592 -1.423 1.00 0.00 C ATOM 1055 C GLY A 77 8.096 16.199 -2.677 1.00 0.00 C ATOM 1056 O GLY A 77 7.152 16.860 -3.064 1.00 0.00 O ATOM 0 H GLY A 77 10.452 15.342 -0.705 1.00 0.00 H new ATOM 0 HA2 GLY A 77 8.226 17.116 -0.724 1.00 0.00 H new ATOM 0 HA3 GLY A 77 9.684 17.278 -1.683 1.00 0.00 H new ATOM 1060 N LYS A 78 8.479 15.128 -3.318 1.00 0.00 N ATOM 1061 CA LYS A 78 7.754 14.698 -4.548 1.00 0.00 C ATOM 1062 C LYS A 78 6.857 13.500 -4.228 1.00 0.00 C ATOM 1063 O LYS A 78 5.700 13.465 -4.595 1.00 0.00 O ATOM 1064 CB LYS A 78 8.845 14.306 -5.544 1.00 0.00 C ATOM 1065 CG LYS A 78 8.199 13.726 -6.803 1.00 0.00 C ATOM 1066 CD LYS A 78 8.967 14.202 -8.038 1.00 0.00 C ATOM 1067 CE LYS A 78 9.784 13.042 -8.611 1.00 0.00 C ATOM 1068 NZ LYS A 78 8.827 12.297 -9.474 1.00 0.00 N ATOM 0 H LYS A 78 9.261 14.533 -3.044 1.00 0.00 H new ATOM 0 HA LYS A 78 7.112 15.483 -4.948 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.449 15.177 -5.800 1.00 0.00 H new ATOM 0 HB3 LYS A 78 9.516 13.573 -5.096 1.00 0.00 H new ATOM 0 HG2 LYS A 78 8.202 12.637 -6.757 1.00 0.00 H new ATOM 0 HG3 LYS A 78 7.157 14.039 -6.867 1.00 0.00 H new ATOM 0 HD2 LYS A 78 8.272 14.577 -8.789 1.00 0.00 H new ATOM 0 HD3 LYS A 78 9.626 15.029 -7.773 1.00 0.00 H new ATOM 0 HE2 LYS A 78 10.637 13.404 -9.186 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.180 12.407 -7.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 9.310 11.483 -9.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 8.029 11.960 -8.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 8.472 12.926 -10.222 1.00 0.00 H new ATOM 1082 N MET A 79 7.382 12.518 -3.547 1.00 0.00 N ATOM 1083 CA MET A 79 6.556 11.323 -3.207 1.00 0.00 C ATOM 1084 C MET A 79 5.228 11.774 -2.594 1.00 0.00 C ATOM 1085 O MET A 79 4.222 11.103 -2.705 1.00 0.00 O ATOM 1086 CB MET A 79 7.383 10.536 -2.190 1.00 0.00 C ATOM 1087 CG MET A 79 6.540 9.391 -1.625 1.00 0.00 C ATOM 1088 SD MET A 79 7.573 8.345 -0.569 1.00 0.00 S ATOM 1089 CE MET A 79 8.145 9.648 0.549 1.00 0.00 C ATOM 0 H MET A 79 8.345 12.491 -3.212 1.00 0.00 H new ATOM 0 HA MET A 79 6.319 10.717 -4.081 1.00 0.00 H new ATOM 0 HB2 MET A 79 8.282 10.141 -2.664 1.00 0.00 H new ATOM 0 HB3 MET A 79 7.710 11.193 -1.384 1.00 0.00 H new ATOM 0 HG2 MET A 79 5.703 9.790 -1.052 1.00 0.00 H new ATOM 0 HG3 MET A 79 6.118 8.801 -2.438 1.00 0.00 H new ATOM 0 HE1 MET A 79 8.419 9.210 1.509 1.00 0.00 H new ATOM 0 HE2 MET A 79 9.014 10.144 0.116 1.00 0.00 H new ATOM 0 HE3 MET A 79 7.348 10.376 0.697 1.00 0.00 H new ATOM 1099 N VAL A 80 5.217 12.908 -1.950 1.00 0.00 N ATOM 1100 CA VAL A 80 3.954 13.402 -1.334 1.00 0.00 C ATOM 1101 C VAL A 80 3.114 14.121 -2.392 1.00 0.00 C ATOM 1102 O VAL A 80 1.929 14.330 -2.220 1.00 0.00 O ATOM 1103 CB VAL A 80 4.391 14.373 -0.236 1.00 0.00 C ATOM 1104 CG1 VAL A 80 3.155 14.980 0.429 1.00 0.00 C ATOM 1105 CG2 VAL A 80 5.215 13.621 0.811 1.00 0.00 C ATOM 0 H VAL A 80 6.028 13.514 -1.824 1.00 0.00 H new ATOM 0 HA VAL A 80 3.343 12.595 -0.930 1.00 0.00 H new ATOM 0 HB VAL A 80 4.996 15.167 -0.673 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.466 15.672 1.212 1.00 0.00 H new ATOM 0 HG12 VAL A 80 2.567 15.515 -0.316 1.00 0.00 H new ATOM 0 HG13 VAL A 80 2.550 14.186 0.866 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.527 14.312 1.594 1.00 0.00 H new ATOM 0 HG22 VAL A 80 4.610 12.827 1.248 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.096 13.187 0.338 1.00 0.00 H new ATOM 1115 N ALA A 81 3.716 14.502 -3.486 1.00 0.00 N ATOM 1116 CA ALA A 81 2.948 15.206 -4.551 1.00 0.00 C ATOM 1117 C ALA A 81 2.145 14.187 -5.363 1.00 0.00 C ATOM 1118 O ALA A 81 1.085 14.485 -5.876 1.00 0.00 O ATOM 1119 CB ALA A 81 4.002 15.887 -5.425 1.00 0.00 C ATOM 0 H ALA A 81 4.705 14.356 -3.688 1.00 0.00 H new ATOM 0 HA ALA A 81 2.239 15.929 -4.147 1.00 0.00 H new ATOM 0 HB1 ALA A 81 3.510 16.427 -6.234 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.580 16.586 -4.820 1.00 0.00 H new ATOM 0 HB3 ALA A 81 4.669 15.134 -5.845 1.00 0.00 H new ATOM 1125 N GLU A 82 2.643 12.987 -5.484 1.00 0.00 N ATOM 1126 CA GLU A 82 1.906 11.953 -6.264 1.00 0.00 C ATOM 1127 C GLU A 82 0.890 11.252 -5.359 1.00 0.00 C ATOM 1128 O GLU A 82 -0.236 11.013 -5.748 1.00 0.00 O ATOM 1129 CB GLU A 82 2.975 10.973 -6.758 1.00 0.00 C ATOM 1130 CG GLU A 82 3.562 10.203 -5.573 1.00 0.00 C ATOM 1131 CD GLU A 82 4.727 9.330 -6.042 1.00 0.00 C ATOM 1132 OE1 GLU A 82 5.347 9.684 -7.032 1.00 0.00 O ATOM 1133 OE2 GLU A 82 4.981 8.322 -5.403 1.00 0.00 O ATOM 0 H GLU A 82 3.526 12.678 -5.078 1.00 0.00 H new ATOM 0 HA GLU A 82 1.349 12.378 -7.099 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.540 10.277 -7.475 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.765 11.515 -7.278 1.00 0.00 H new ATOM 0 HG2 GLU A 82 3.904 10.901 -4.809 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.792 9.582 -5.115 1.00 0.00 H new ATOM 1140 N MET A 83 1.268 10.927 -4.152 1.00 0.00 N ATOM 1141 CA MET A 83 0.307 10.253 -3.238 1.00 0.00 C ATOM 1142 C MET A 83 -0.852 11.204 -2.953 1.00 0.00 C ATOM 1143 O MET A 83 -1.989 10.794 -2.830 1.00 0.00 O ATOM 1144 CB MET A 83 1.095 9.948 -1.964 1.00 0.00 C ATOM 1145 CG MET A 83 2.061 8.790 -2.226 1.00 0.00 C ATOM 1146 SD MET A 83 1.127 7.297 -2.652 1.00 0.00 S ATOM 1147 CE MET A 83 0.494 6.936 -0.995 1.00 0.00 C ATOM 0 H MET A 83 2.195 11.098 -3.763 1.00 0.00 H new ATOM 0 HA MET A 83 -0.112 9.340 -3.661 1.00 0.00 H new ATOM 0 HB2 MET A 83 1.648 10.832 -1.645 1.00 0.00 H new ATOM 0 HB3 MET A 83 0.412 9.690 -1.154 1.00 0.00 H new ATOM 0 HG2 MET A 83 2.741 9.048 -3.037 1.00 0.00 H new ATOM 0 HG3 MET A 83 2.673 8.608 -1.343 1.00 0.00 H new ATOM 0 HE1 MET A 83 -0.556 6.650 -1.061 1.00 0.00 H new ATOM 0 HE2 MET A 83 1.066 6.118 -0.557 1.00 0.00 H new ATOM 0 HE3 MET A 83 0.590 7.822 -0.368 1.00 0.00 H new ATOM 1157 N LYS A 84 -0.579 12.479 -2.866 1.00 0.00 N ATOM 1158 CA LYS A 84 -1.675 13.454 -2.611 1.00 0.00 C ATOM 1159 C LYS A 84 -2.776 13.223 -3.644 1.00 0.00 C ATOM 1160 O LYS A 84 -3.951 13.310 -3.349 1.00 0.00 O ATOM 1161 CB LYS A 84 -1.042 14.836 -2.787 1.00 0.00 C ATOM 1162 CG LYS A 84 -1.114 15.603 -1.465 1.00 0.00 C ATOM 1163 CD LYS A 84 -2.317 16.547 -1.489 1.00 0.00 C ATOM 1164 CE LYS A 84 -1.919 17.900 -0.894 1.00 0.00 C ATOM 1165 NZ LYS A 84 -2.402 18.903 -1.883 1.00 0.00 N ATOM 0 H LYS A 84 0.352 12.885 -2.960 1.00 0.00 H new ATOM 0 HA LYS A 84 -2.117 13.354 -1.620 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.004 14.735 -3.105 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -1.562 15.389 -3.569 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -1.202 14.906 -0.632 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.196 16.170 -1.311 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -2.669 16.678 -2.512 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -3.141 16.117 -0.921 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -2.378 18.054 0.083 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -0.840 17.969 -0.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.168 19.860 -1.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.943 18.734 -2.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -3.433 18.816 -1.990 1.00 0.00 H new ATOM 1179 N ALA A 85 -2.398 12.908 -4.855 1.00 0.00 N ATOM 1180 CA ALA A 85 -3.417 12.646 -5.906 1.00 0.00 C ATOM 1181 C ALA A 85 -4.140 11.343 -5.573 1.00 0.00 C ATOM 1182 O ALA A 85 -5.284 11.147 -5.929 1.00 0.00 O ATOM 1183 CB ALA A 85 -2.630 12.517 -7.212 1.00 0.00 C ATOM 0 H ALA A 85 -1.428 12.822 -5.159 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.167 13.433 -5.980 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -3.319 12.322 -8.034 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -2.089 13.443 -7.404 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -1.921 11.693 -7.130 1.00 0.00 H new ATOM 1189 N VAL A 86 -3.481 10.453 -4.879 1.00 0.00 N ATOM 1190 CA VAL A 86 -4.134 9.167 -4.510 1.00 0.00 C ATOM 1191 C VAL A 86 -5.133 9.423 -3.382 1.00 0.00 C ATOM 1192 O VAL A 86 -6.261 8.972 -3.422 1.00 0.00 O ATOM 1193 CB VAL A 86 -3.000 8.256 -4.036 1.00 0.00 C ATOM 1194 CG1 VAL A 86 -3.537 6.838 -3.828 1.00 0.00 C ATOM 1195 CG2 VAL A 86 -1.891 8.229 -5.091 1.00 0.00 C ATOM 0 H VAL A 86 -2.521 10.562 -4.553 1.00 0.00 H new ATOM 0 HA VAL A 86 -4.679 8.715 -5.339 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.600 8.636 -3.096 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.729 6.189 -3.490 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.327 6.855 -3.077 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.938 6.459 -4.768 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -1.083 7.580 -4.753 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.292 7.850 -6.031 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.507 9.238 -5.241 1.00 0.00 H new ATOM 1205 N GLY A 87 -4.729 10.154 -2.378 1.00 0.00 N ATOM 1206 CA GLY A 87 -5.658 10.450 -1.253 1.00 0.00 C ATOM 1207 C GLY A 87 -6.824 11.280 -1.789 1.00 0.00 C ATOM 1208 O GLY A 87 -7.949 11.146 -1.351 1.00 0.00 O ATOM 0 H GLY A 87 -3.797 10.558 -2.290 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.025 9.523 -0.811 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.137 10.994 -0.465 1.00 0.00 H new ATOM 1212 N VAL A 88 -6.563 12.134 -2.742 1.00 0.00 N ATOM 1213 CA VAL A 88 -7.657 12.968 -3.314 1.00 0.00 C ATOM 1214 C VAL A 88 -8.739 12.053 -3.889 1.00 0.00 C ATOM 1215 O VAL A 88 -9.917 12.331 -3.792 1.00 0.00 O ATOM 1216 CB VAL A 88 -6.999 13.798 -4.419 1.00 0.00 C ATOM 1217 CG1 VAL A 88 -8.077 14.516 -5.233 1.00 0.00 C ATOM 1218 CG2 VAL A 88 -6.065 14.834 -3.789 1.00 0.00 C ATOM 0 H VAL A 88 -5.640 12.289 -3.148 1.00 0.00 H new ATOM 0 HA VAL A 88 -8.132 13.609 -2.571 1.00 0.00 H new ATOM 0 HB VAL A 88 -6.428 13.140 -5.074 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -7.606 15.106 -6.019 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -8.744 13.780 -5.682 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -8.649 15.174 -4.579 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -5.596 15.426 -4.575 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -6.638 15.490 -3.134 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -5.295 14.325 -3.209 1.00 0.00 H new ATOM 1228 N ARG A 89 -8.348 10.956 -4.481 1.00 0.00 N ATOM 1229 CA ARG A 89 -9.359 10.022 -5.052 1.00 0.00 C ATOM 1230 C ARG A 89 -10.206 9.449 -3.915 1.00 0.00 C ATOM 1231 O ARG A 89 -11.372 9.151 -4.083 1.00 0.00 O ATOM 1232 CB ARG A 89 -8.551 8.920 -5.741 1.00 0.00 C ATOM 1233 CG ARG A 89 -7.640 9.542 -6.800 1.00 0.00 C ATOM 1234 CD ARG A 89 -8.432 9.769 -8.088 1.00 0.00 C ATOM 1235 NE ARG A 89 -8.427 8.458 -8.795 1.00 0.00 N ATOM 1236 CZ ARG A 89 -9.164 8.288 -9.859 1.00 0.00 C ATOM 1237 NH1 ARG A 89 -10.449 8.100 -9.740 1.00 0.00 N ATOM 1238 NH2 ARG A 89 -8.614 8.302 -11.043 1.00 0.00 N ATOM 0 H ARG A 89 -7.376 10.668 -4.593 1.00 0.00 H new ATOM 0 HA ARG A 89 -10.036 10.508 -5.754 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -7.955 8.378 -5.007 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -9.223 8.197 -6.203 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -7.237 10.488 -6.438 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -6.791 8.887 -6.994 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -9.450 10.094 -7.871 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -7.973 10.546 -8.699 1.00 0.00 H new ATOM 0 HE ARG A 89 -7.848 7.693 -8.448 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -10.879 8.086 -8.815 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -11.024 7.967 -10.572 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -7.609 8.446 -11.137 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -9.190 8.169 -11.874 1.00 0.00 H new ATOM 1252 N HIS A 90 -9.626 9.301 -2.755 1.00 0.00 N ATOM 1253 CA HIS A 90 -10.393 8.755 -1.600 1.00 0.00 C ATOM 1254 C HIS A 90 -11.304 9.842 -1.018 1.00 0.00 C ATOM 1255 O HIS A 90 -12.054 9.605 -0.092 1.00 0.00 O ATOM 1256 CB HIS A 90 -9.332 8.334 -0.583 1.00 0.00 C ATOM 1257 CG HIS A 90 -8.631 7.093 -1.068 1.00 0.00 C ATOM 1258 ND1 HIS A 90 -7.781 7.102 -2.161 1.00 0.00 N ATOM 1259 CD2 HIS A 90 -8.646 5.797 -0.618 1.00 0.00 C ATOM 1260 CE1 HIS A 90 -7.323 5.848 -2.328 1.00 0.00 C ATOM 1261 NE2 HIS A 90 -7.820 5.008 -1.414 1.00 0.00 N ATOM 0 H HIS A 90 -8.653 9.535 -2.557 1.00 0.00 H new ATOM 0 HA HIS A 90 -11.034 7.920 -1.882 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -8.611 9.139 -0.440 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -9.796 8.147 0.385 1.00 0.00 H new ATOM 0 HD1 HIS A 90 -7.545 7.912 -2.735 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -9.215 5.441 0.229 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -6.636 5.555 -3.108 1.00 0.00 H new ATOM 1269 N LYS A 91 -11.243 11.034 -1.548 1.00 0.00 N ATOM 1270 CA LYS A 91 -12.101 12.128 -1.020 1.00 0.00 C ATOM 1271 C LYS A 91 -13.345 12.275 -1.898 1.00 0.00 C ATOM 1272 O LYS A 91 -13.552 13.293 -2.528 1.00 0.00 O ATOM 1273 CB LYS A 91 -11.234 13.386 -1.091 1.00 0.00 C ATOM 1274 CG LYS A 91 -12.040 14.592 -0.606 1.00 0.00 C ATOM 1275 CD LYS A 91 -11.889 15.742 -1.604 1.00 0.00 C ATOM 1276 CE LYS A 91 -10.646 16.563 -1.254 1.00 0.00 C ATOM 1277 NZ LYS A 91 -10.880 17.890 -1.890 1.00 0.00 N ATOM 0 H LYS A 91 -10.635 11.295 -2.324 1.00 0.00 H new ATOM 0 HA LYS A 91 -12.445 11.937 -0.004 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.342 13.261 -0.477 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -10.896 13.550 -2.114 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -13.091 14.322 -0.502 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -11.692 14.903 0.379 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -11.805 15.349 -2.617 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -12.775 16.376 -1.581 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -10.524 16.657 -0.175 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.740 16.094 -1.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -10.071 18.515 -1.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -10.987 17.769 -2.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -11.746 18.314 -1.500 1.00 0.00 H new ATOM 1291 N GLY A 92 -14.184 11.275 -1.938 1.00 0.00 N ATOM 1292 CA GLY A 92 -15.418 11.388 -2.774 1.00 0.00 C ATOM 1293 C GLY A 92 -15.837 10.026 -3.362 1.00 0.00 C ATOM 1294 O GLY A 92 -16.795 9.950 -4.106 1.00 0.00 O ATOM 0 H GLY A 92 -14.073 10.394 -1.435 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -16.231 11.789 -2.169 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -15.245 12.096 -3.584 1.00 0.00 H new ATOM 1298 N TYR A 93 -15.152 8.954 -3.053 1.00 0.00 N ATOM 1299 CA TYR A 93 -15.558 7.633 -3.620 1.00 0.00 C ATOM 1300 C TYR A 93 -17.019 7.338 -3.268 1.00 0.00 C ATOM 1301 O TYR A 93 -17.745 8.195 -2.806 1.00 0.00 O ATOM 1302 CB TYR A 93 -14.638 6.599 -2.966 1.00 0.00 C ATOM 1303 CG TYR A 93 -13.393 6.397 -3.804 1.00 0.00 C ATOM 1304 CD1 TYR A 93 -13.484 6.310 -5.201 1.00 0.00 C ATOM 1305 CD2 TYR A 93 -12.147 6.291 -3.180 1.00 0.00 C ATOM 1306 CE1 TYR A 93 -12.328 6.119 -5.968 1.00 0.00 C ATOM 1307 CE2 TYR A 93 -10.991 6.101 -3.947 1.00 0.00 C ATOM 1308 CZ TYR A 93 -11.081 6.016 -5.340 1.00 0.00 C ATOM 1309 OH TYR A 93 -9.941 5.828 -6.095 1.00 0.00 O ATOM 0 H TYR A 93 -14.338 8.936 -2.439 1.00 0.00 H new ATOM 0 HA TYR A 93 -15.473 7.616 -4.707 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -14.361 6.930 -1.965 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -15.166 5.652 -2.853 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -14.446 6.390 -5.685 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -12.076 6.356 -2.104 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -12.398 6.051 -7.044 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -10.029 6.020 -3.462 1.00 0.00 H new ATOM 0 HH TYR A 93 -9.161 5.779 -5.503 1.00 0.00 H new ATOM 1319 N GLY A 94 -17.451 6.123 -3.475 1.00 0.00 N ATOM 1320 CA GLY A 94 -18.860 5.765 -3.148 1.00 0.00 C ATOM 1321 C GLY A 94 -18.961 5.503 -1.646 1.00 0.00 C ATOM 1322 O GLY A 94 -19.911 5.894 -0.996 1.00 0.00 O ATOM 0 H GLY A 94 -16.888 5.363 -3.857 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -19.532 6.573 -3.437 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -19.165 4.881 -3.708 1.00 0.00 H new ATOM 1326 N ASN A 95 -17.978 4.852 -1.090 1.00 0.00 N ATOM 1327 CA ASN A 95 -17.996 4.569 0.371 1.00 0.00 C ATOM 1328 C ASN A 95 -18.061 5.902 1.123 1.00 0.00 C ATOM 1329 O ASN A 95 -18.858 6.087 2.021 1.00 0.00 O ATOM 1330 CB ASN A 95 -16.681 3.824 0.629 1.00 0.00 C ATOM 1331 CG ASN A 95 -16.290 3.886 2.106 1.00 0.00 C ATOM 1332 OD1 ASN A 95 -15.096 4.305 2.426 1.00 0.00 O flip ATOM 1333 ND2 ASN A 95 -17.074 3.554 2.973 1.00 0.00 N flip ATOM 0 H ASN A 95 -17.159 4.502 -1.588 1.00 0.00 H new ATOM 0 HA ASN A 95 -18.849 3.977 0.703 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -16.783 2.784 0.321 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -15.888 4.260 0.022 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -18.006 3.227 2.720 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -16.800 3.602 3.954 1.00 0.00 H new ATOM 1340 N LYS A 96 -17.234 6.837 0.742 1.00 0.00 N ATOM 1341 CA LYS A 96 -17.241 8.177 1.401 1.00 0.00 C ATOM 1342 C LYS A 96 -16.940 8.052 2.900 1.00 0.00 C ATOM 1343 O LYS A 96 -17.135 8.981 3.658 1.00 0.00 O ATOM 1344 CB LYS A 96 -18.655 8.720 1.183 1.00 0.00 C ATOM 1345 CG LYS A 96 -18.581 10.148 0.641 1.00 0.00 C ATOM 1346 CD LYS A 96 -19.950 10.553 0.091 1.00 0.00 C ATOM 1347 CE LYS A 96 -19.802 11.803 -0.778 1.00 0.00 C ATOM 1348 NZ LYS A 96 -20.961 12.660 -0.404 1.00 0.00 N ATOM 0 H LYS A 96 -16.547 6.730 -0.004 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.478 8.835 0.986 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -19.196 8.083 0.483 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -19.209 8.705 2.121 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -18.277 10.834 1.432 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -17.828 10.212 -0.144 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -20.374 9.738 -0.495 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -20.640 10.748 0.912 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -18.856 12.310 -0.586 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -19.820 11.553 -1.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -20.934 13.541 -0.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -21.847 12.153 -0.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -20.913 12.886 0.610 1.00 0.00 H new ATOM 1362 N HIS A 97 -16.461 6.921 3.333 1.00 0.00 N ATOM 1363 CA HIS A 97 -16.142 6.747 4.780 1.00 0.00 C ATOM 1364 C HIS A 97 -14.746 6.149 4.910 1.00 0.00 C ATOM 1365 O HIS A 97 -14.520 5.233 5.674 1.00 0.00 O ATOM 1366 CB HIS A 97 -17.191 5.776 5.321 1.00 0.00 C ATOM 1367 CG HIS A 97 -18.376 6.545 5.830 1.00 0.00 C ATOM 1368 ND1 HIS A 97 -18.257 7.542 6.786 1.00 0.00 N ATOM 1369 CD2 HIS A 97 -19.711 6.469 5.531 1.00 0.00 C ATOM 1370 CE1 HIS A 97 -19.491 8.022 7.026 1.00 0.00 C ATOM 1371 NE2 HIS A 97 -20.415 7.402 6.286 1.00 0.00 N ATOM 0 H HIS A 97 -16.275 6.107 2.748 1.00 0.00 H new ATOM 0 HA HIS A 97 -16.158 7.689 5.329 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -17.502 5.087 4.536 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -16.764 5.174 6.123 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -20.150 5.788 4.817 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -19.708 8.811 7.730 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -21.420 7.575 6.277 1.00 0.00 H new ATOM 1380 N ILE A 98 -13.813 6.647 4.152 1.00 0.00 N ATOM 1381 CA ILE A 98 -12.432 6.100 4.212 1.00 0.00 C ATOM 1382 C ILE A 98 -11.701 6.657 5.435 1.00 0.00 C ATOM 1383 O ILE A 98 -12.020 7.716 5.936 1.00 0.00 O ATOM 1384 CB ILE A 98 -11.767 6.562 2.919 1.00 0.00 C ATOM 1385 CG1 ILE A 98 -12.590 6.071 1.727 1.00 0.00 C ATOM 1386 CG2 ILE A 98 -10.358 5.980 2.838 1.00 0.00 C ATOM 1387 CD1 ILE A 98 -11.992 6.616 0.431 1.00 0.00 C ATOM 0 H ILE A 98 -13.948 7.412 3.491 1.00 0.00 H new ATOM 0 HA ILE A 98 -12.416 5.014 4.305 1.00 0.00 H new ATOM 0 HB ILE A 98 -11.712 7.650 2.903 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -12.601 4.981 1.704 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -13.625 6.398 1.827 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -9.881 6.309 1.915 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -9.773 6.323 3.691 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -10.413 4.891 2.850 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -12.580 6.265 -0.417 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -12.004 7.706 0.455 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -10.964 6.267 0.329 1.00 0.00 H new ATOM 1399 N LYS A 99 -10.722 5.943 5.917 1.00 0.00 N ATOM 1400 CA LYS A 99 -9.964 6.412 7.106 1.00 0.00 C ATOM 1401 C LYS A 99 -8.494 5.999 6.989 1.00 0.00 C ATOM 1402 O LYS A 99 -8.159 4.978 6.423 1.00 0.00 O ATOM 1403 CB LYS A 99 -10.623 5.720 8.300 1.00 0.00 C ATOM 1404 CG LYS A 99 -11.975 6.376 8.589 1.00 0.00 C ATOM 1405 CD LYS A 99 -13.100 5.482 8.057 1.00 0.00 C ATOM 1406 CE LYS A 99 -14.430 6.243 8.100 1.00 0.00 C ATOM 1407 NZ LYS A 99 -14.530 6.750 9.496 1.00 0.00 N ATOM 0 H LYS A 99 -10.414 5.049 5.534 1.00 0.00 H new ATOM 0 HA LYS A 99 -9.984 7.497 7.206 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -10.759 4.659 8.089 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -9.978 5.791 9.176 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -12.095 6.530 9.661 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -12.023 7.358 8.118 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -12.880 5.173 7.035 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -13.170 4.574 8.656 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -14.442 7.061 7.380 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -15.268 5.590 7.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -15.531 6.833 9.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -14.052 6.088 10.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -14.076 7.684 9.560 1.00 0.00 H new ATOM 1421 N ALA A 100 -7.621 6.799 7.542 1.00 0.00 N ATOM 1422 CA ALA A 100 -6.169 6.482 7.495 1.00 0.00 C ATOM 1423 C ALA A 100 -5.833 5.483 8.604 1.00 0.00 C ATOM 1424 O ALA A 100 -4.802 4.843 8.581 1.00 0.00 O ATOM 1425 CB ALA A 100 -5.456 7.813 7.732 1.00 0.00 C ATOM 0 H ALA A 100 -7.857 7.665 8.027 1.00 0.00 H new ATOM 0 HA ALA A 100 -5.867 6.034 6.548 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -4.377 7.657 7.711 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -5.736 8.520 6.951 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -5.746 8.213 8.704 1.00 0.00 H new ATOM 1431 N GLU A 101 -6.693 5.337 9.574 1.00 0.00 N ATOM 1432 CA GLU A 101 -6.409 4.370 10.669 1.00 0.00 C ATOM 1433 C GLU A 101 -6.284 2.964 10.079 1.00 0.00 C ATOM 1434 O GLU A 101 -5.609 2.110 10.620 1.00 0.00 O ATOM 1435 CB GLU A 101 -7.606 4.461 11.619 1.00 0.00 C ATOM 1436 CG GLU A 101 -8.891 4.141 10.855 1.00 0.00 C ATOM 1437 CD GLU A 101 -10.070 4.895 11.471 1.00 0.00 C ATOM 1438 OE1 GLU A 101 -10.000 6.111 11.539 1.00 0.00 O ATOM 1439 OE2 GLU A 101 -11.025 4.244 11.864 1.00 0.00 O ATOM 0 H GLU A 101 -7.575 5.843 9.655 1.00 0.00 H new ATOM 0 HA GLU A 101 -5.478 4.589 11.192 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -7.480 3.764 12.447 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -7.666 5.460 12.050 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -8.779 4.419 9.807 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -9.082 3.068 10.882 1.00 0.00 H new ATOM 1446 N TYR A 102 -6.931 2.714 8.970 1.00 0.00 N ATOM 1447 CA TYR A 102 -6.847 1.359 8.348 1.00 0.00 C ATOM 1448 C TYR A 102 -5.580 1.246 7.491 1.00 0.00 C ATOM 1449 O TYR A 102 -5.123 0.162 7.187 1.00 0.00 O ATOM 1450 CB TYR A 102 -8.094 1.235 7.474 1.00 0.00 C ATOM 1451 CG TYR A 102 -9.323 1.246 8.348 1.00 0.00 C ATOM 1452 CD1 TYR A 102 -9.893 2.463 8.724 1.00 0.00 C ATOM 1453 CD2 TYR A 102 -9.890 0.042 8.779 1.00 0.00 C ATOM 1454 CE1 TYR A 102 -11.035 2.482 9.534 1.00 0.00 C ATOM 1455 CE2 TYR A 102 -11.032 0.058 9.589 1.00 0.00 C ATOM 1456 CZ TYR A 102 -11.605 1.279 9.967 1.00 0.00 C ATOM 1457 OH TYR A 102 -12.730 1.296 10.765 1.00 0.00 O ATOM 0 H TYR A 102 -7.512 3.387 8.470 1.00 0.00 H new ATOM 0 HA TYR A 102 -6.798 0.569 9.098 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -8.135 2.058 6.761 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -8.055 0.313 6.895 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -9.453 3.391 8.390 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -9.447 -0.899 8.487 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -11.476 3.424 9.825 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -11.471 -0.871 9.922 1.00 0.00 H new ATOM 0 HH TYR A 102 -13.126 0.400 10.792 1.00 0.00 H new ATOM 1467 N PHE A 103 -5.014 2.353 7.091 1.00 0.00 N ATOM 1468 CA PHE A 103 -3.785 2.300 6.244 1.00 0.00 C ATOM 1469 C PHE A 103 -2.665 1.558 6.982 1.00 0.00 C ATOM 1470 O PHE A 103 -2.221 0.507 6.564 1.00 0.00 O ATOM 1471 CB PHE A 103 -3.388 3.760 6.010 1.00 0.00 C ATOM 1472 CG PHE A 103 -4.173 4.333 4.853 1.00 0.00 C ATOM 1473 CD1 PHE A 103 -5.569 4.227 4.826 1.00 0.00 C ATOM 1474 CD2 PHE A 103 -3.501 4.977 3.807 1.00 0.00 C ATOM 1475 CE1 PHE A 103 -6.291 4.765 3.753 1.00 0.00 C ATOM 1476 CE2 PHE A 103 -4.223 5.515 2.735 1.00 0.00 C ATOM 1477 CZ PHE A 103 -5.618 5.409 2.708 1.00 0.00 C ATOM 0 H PHE A 103 -5.348 3.291 7.313 1.00 0.00 H new ATOM 0 HA PHE A 103 -3.960 1.772 5.307 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.575 4.344 6.911 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -2.320 3.826 5.803 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -6.089 3.731 5.632 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -2.424 5.059 3.827 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -7.368 4.683 3.732 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -3.703 6.012 1.929 1.00 0.00 H new ATOM 0 HZ PHE A 103 -6.175 5.824 1.881 1.00 0.00 H new ATOM 1487 N GLU A 104 -2.198 2.109 8.070 1.00 0.00 N ATOM 1488 CA GLU A 104 -1.095 1.459 8.839 1.00 0.00 C ATOM 1489 C GLU A 104 -1.345 -0.046 8.986 1.00 0.00 C ATOM 1490 O GLU A 104 -0.545 -0.850 8.550 1.00 0.00 O ATOM 1491 CB GLU A 104 -1.109 2.143 10.208 1.00 0.00 C ATOM 1492 CG GLU A 104 0.148 3.000 10.365 1.00 0.00 C ATOM 1493 CD GLU A 104 -0.073 4.056 11.448 1.00 0.00 C ATOM 1494 OE1 GLU A 104 -1.017 4.818 11.320 1.00 0.00 O ATOM 1495 OE2 GLU A 104 0.705 4.086 12.387 1.00 0.00 O ATOM 0 H GLU A 104 -2.535 2.988 8.463 1.00 0.00 H new ATOM 0 HA GLU A 104 -0.133 1.564 8.337 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -2.000 2.764 10.307 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -1.153 1.395 10.999 1.00 0.00 H new ATOM 0 HG2 GLU A 104 0.998 2.370 10.628 1.00 0.00 H new ATOM 0 HG3 GLU A 104 0.390 3.483 9.418 1.00 0.00 H new ATOM 1502 N PRO A 105 -2.443 -0.378 9.608 1.00 0.00 N ATOM 1503 CA PRO A 105 -2.764 -1.818 9.810 1.00 0.00 C ATOM 1504 C PRO A 105 -2.874 -2.533 8.461 1.00 0.00 C ATOM 1505 O PRO A 105 -2.652 -3.723 8.359 1.00 0.00 O ATOM 1506 CB PRO A 105 -4.104 -1.807 10.547 1.00 0.00 C ATOM 1507 CG PRO A 105 -4.640 -0.421 10.415 1.00 0.00 C ATOM 1508 CD PRO A 105 -3.473 0.494 10.181 1.00 0.00 C ATOM 0 HA PRO A 105 -1.996 -2.350 10.371 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -4.792 -2.533 10.115 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -3.974 -2.076 11.595 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.347 -0.360 9.587 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.180 -0.131 11.317 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -3.733 1.305 9.500 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.135 0.954 11.110 1.00 0.00 H new ATOM 1516 N LEU A 106 -3.212 -1.819 7.423 1.00 0.00 N ATOM 1517 CA LEU A 106 -3.331 -2.465 6.085 1.00 0.00 C ATOM 1518 C LEU A 106 -1.936 -2.643 5.479 1.00 0.00 C ATOM 1519 O LEU A 106 -1.737 -3.435 4.580 1.00 0.00 O ATOM 1520 CB LEU A 106 -4.187 -1.503 5.247 1.00 0.00 C ATOM 1521 CG LEU A 106 -4.298 -1.988 3.789 1.00 0.00 C ATOM 1522 CD1 LEU A 106 -3.016 -1.642 3.029 1.00 0.00 C ATOM 1523 CD2 LEU A 106 -4.525 -3.505 3.744 1.00 0.00 C ATOM 0 H LEU A 106 -3.411 -0.819 7.443 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.786 -3.454 6.131 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -5.182 -1.422 5.684 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.747 -0.506 5.270 1.00 0.00 H new ATOM 0 HG LEU A 106 -5.147 -1.489 3.321 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -3.100 -1.987 1.998 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.867 -0.562 3.039 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.167 -2.130 3.507 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.601 -3.831 2.707 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.688 -4.013 4.223 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.448 -3.751 4.270 1.00 0.00 H new ATOM 1535 N GLY A 107 -0.968 -1.913 5.965 1.00 0.00 N ATOM 1536 CA GLY A 107 0.411 -2.045 5.414 1.00 0.00 C ATOM 1537 C GLY A 107 1.123 -3.205 6.114 1.00 0.00 C ATOM 1538 O GLY A 107 1.858 -3.955 5.502 1.00 0.00 O ATOM 0 H GLY A 107 -1.072 -1.233 6.718 1.00 0.00 H new ATOM 0 HA2 GLY A 107 0.371 -2.223 4.339 1.00 0.00 H new ATOM 0 HA3 GLY A 107 0.966 -1.119 5.564 1.00 0.00 H new ATOM 1542 N ALA A 108 0.911 -3.360 7.393 1.00 0.00 N ATOM 1543 CA ALA A 108 1.577 -4.471 8.130 1.00 0.00 C ATOM 1544 C ALA A 108 1.139 -5.815 7.542 1.00 0.00 C ATOM 1545 O ALA A 108 1.954 -6.632 7.162 1.00 0.00 O ATOM 1546 CB ALA A 108 1.105 -4.333 9.578 1.00 0.00 C ATOM 0 H ALA A 108 0.306 -2.765 7.959 1.00 0.00 H new ATOM 0 HA ALA A 108 2.664 -4.427 8.059 1.00 0.00 H new ATOM 0 HB1 ALA A 108 1.555 -5.119 10.184 1.00 0.00 H new ATOM 0 HB2 ALA A 108 1.404 -3.359 9.967 1.00 0.00 H new ATOM 0 HB3 ALA A 108 0.019 -4.422 9.617 1.00 0.00 H new ATOM 1552 N SER A 109 -0.142 -6.050 7.464 1.00 0.00 N ATOM 1553 CA SER A 109 -0.629 -7.342 6.900 1.00 0.00 C ATOM 1554 C SER A 109 -0.087 -7.519 5.481 1.00 0.00 C ATOM 1555 O SER A 109 0.067 -8.624 4.999 1.00 0.00 O ATOM 1556 CB SER A 109 -2.154 -7.227 6.889 1.00 0.00 C ATOM 1557 OG SER A 109 -2.637 -7.262 8.226 1.00 0.00 O ATOM 0 H SER A 109 -0.872 -5.405 7.766 1.00 0.00 H new ATOM 0 HA SER A 109 -0.299 -8.203 7.481 1.00 0.00 H new ATOM 0 HB2 SER A 109 -2.457 -6.299 6.405 1.00 0.00 H new ATOM 0 HB3 SER A 109 -2.588 -8.044 6.312 1.00 0.00 H new ATOM 0 HG SER A 109 -3.614 -7.187 8.223 1.00 0.00 H new ATOM 1563 N LEU A 110 0.206 -6.440 4.809 1.00 0.00 N ATOM 1564 CA LEU A 110 0.739 -6.550 3.422 1.00 0.00 C ATOM 1565 C LEU A 110 2.154 -7.132 3.462 1.00 0.00 C ATOM 1566 O LEU A 110 2.527 -7.940 2.635 1.00 0.00 O ATOM 1567 CB LEU A 110 0.755 -5.119 2.883 1.00 0.00 C ATOM 1568 CG LEU A 110 1.033 -5.143 1.379 1.00 0.00 C ATOM 1569 CD1 LEU A 110 0.333 -3.958 0.712 1.00 0.00 C ATOM 1570 CD2 LEU A 110 2.541 -5.045 1.138 1.00 0.00 C ATOM 0 H LEU A 110 0.100 -5.488 5.160 1.00 0.00 H new ATOM 0 HA LEU A 110 0.138 -7.206 2.792 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -0.202 -4.635 3.079 1.00 0.00 H new ATOM 0 HB3 LEU A 110 1.519 -4.535 3.396 1.00 0.00 H new ATOM 0 HG LEU A 110 0.656 -6.074 0.955 1.00 0.00 H new ATOM 0 HD11 LEU A 110 0.531 -3.975 -0.360 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -0.741 -4.026 0.884 1.00 0.00 H new ATOM 0 HD13 LEU A 110 0.710 -3.027 1.136 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.740 -5.062 0.066 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.918 -4.114 1.562 1.00 0.00 H new ATOM 0 HD23 LEU A 110 3.041 -5.889 1.613 1.00 0.00 H new ATOM 1582 N LEU A 111 2.945 -6.729 4.419 1.00 0.00 N ATOM 1583 CA LEU A 111 4.334 -7.260 4.512 1.00 0.00 C ATOM 1584 C LEU A 111 4.294 -8.783 4.654 1.00 0.00 C ATOM 1585 O LEU A 111 5.162 -9.485 4.175 1.00 0.00 O ATOM 1586 CB LEU A 111 4.931 -6.615 5.764 1.00 0.00 C ATOM 1587 CG LEU A 111 5.580 -5.281 5.393 1.00 0.00 C ATOM 1588 CD1 LEU A 111 6.176 -4.636 6.645 1.00 0.00 C ATOM 1589 CD2 LEU A 111 6.690 -5.521 4.368 1.00 0.00 C ATOM 0 H LEU A 111 2.689 -6.055 5.140 1.00 0.00 H new ATOM 0 HA LEU A 111 4.927 -7.033 3.626 1.00 0.00 H new ATOM 0 HB2 LEU A 111 4.153 -6.457 6.511 1.00 0.00 H new ATOM 0 HB3 LEU A 111 5.671 -7.279 6.210 1.00 0.00 H new ATOM 0 HG LEU A 111 4.827 -4.619 4.966 1.00 0.00 H new ATOM 0 HD11 LEU A 111 6.638 -3.685 6.380 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.387 -4.464 7.377 1.00 0.00 H new ATOM 0 HD13 LEU A 111 6.929 -5.299 7.073 1.00 0.00 H new ATOM 0 HD21 LEU A 111 7.153 -4.570 4.103 1.00 0.00 H new ATOM 0 HD22 LEU A 111 7.442 -6.184 4.795 1.00 0.00 H new ATOM 0 HD23 LEU A 111 6.267 -5.980 3.474 1.00 0.00 H new ATOM 1601 N SER A 112 3.292 -9.301 5.312 1.00 0.00 N ATOM 1602 CA SER A 112 3.198 -10.778 5.485 1.00 0.00 C ATOM 1603 C SER A 112 2.940 -11.440 4.129 1.00 0.00 C ATOM 1604 O SER A 112 3.306 -12.575 3.902 1.00 0.00 O ATOM 1605 CB SER A 112 2.016 -10.999 6.428 1.00 0.00 C ATOM 1606 OG SER A 112 1.718 -12.388 6.489 1.00 0.00 O ATOM 0 H SER A 112 2.535 -8.765 5.737 1.00 0.00 H new ATOM 0 HA SER A 112 4.115 -11.210 5.886 1.00 0.00 H new ATOM 0 HB2 SER A 112 2.254 -10.622 7.423 1.00 0.00 H new ATOM 0 HB3 SER A 112 1.146 -10.444 6.076 1.00 0.00 H new ATOM 0 HG SER A 112 0.961 -12.534 7.094 1.00 0.00 H new ATOM 1612 N ALA A 113 2.311 -10.738 3.226 1.00 0.00 N ATOM 1613 CA ALA A 113 2.029 -11.329 1.887 1.00 0.00 C ATOM 1614 C ALA A 113 3.258 -11.178 0.987 1.00 0.00 C ATOM 1615 O ALA A 113 3.566 -12.043 0.192 1.00 0.00 O ATOM 1616 CB ALA A 113 0.851 -10.526 1.333 1.00 0.00 C ATOM 0 H ALA A 113 1.981 -9.782 3.357 1.00 0.00 H new ATOM 0 HA ALA A 113 1.798 -12.393 1.941 1.00 0.00 H new ATOM 0 HB1 ALA A 113 0.585 -10.904 0.346 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -0.004 -10.625 2.002 1.00 0.00 H new ATOM 0 HB3 ALA A 113 1.131 -9.475 1.256 1.00 0.00 H new ATOM 1622 N MET A 114 3.961 -10.086 1.105 1.00 0.00 N ATOM 1623 CA MET A 114 5.169 -9.878 0.256 1.00 0.00 C ATOM 1624 C MET A 114 6.067 -11.116 0.317 1.00 0.00 C ATOM 1625 O MET A 114 6.594 -11.563 -0.682 1.00 0.00 O ATOM 1626 CB MET A 114 5.878 -8.665 0.858 1.00 0.00 C ATOM 1627 CG MET A 114 5.021 -7.414 0.647 1.00 0.00 C ATOM 1628 SD MET A 114 4.992 -6.988 -1.112 1.00 0.00 S ATOM 1629 CE MET A 114 5.106 -5.193 -0.911 1.00 0.00 C ATOM 0 H MET A 114 3.751 -9.327 1.753 1.00 0.00 H new ATOM 0 HA MET A 114 4.918 -9.716 -0.792 1.00 0.00 H new ATOM 0 HB2 MET A 114 6.052 -8.824 1.922 1.00 0.00 H new ATOM 0 HB3 MET A 114 6.854 -8.533 0.391 1.00 0.00 H new ATOM 0 HG2 MET A 114 4.007 -7.591 1.006 1.00 0.00 H new ATOM 0 HG3 MET A 114 5.424 -6.583 1.226 1.00 0.00 H new ATOM 0 HE1 MET A 114 5.796 -4.787 -1.650 1.00 0.00 H new ATOM 0 HE2 MET A 114 4.121 -4.748 -1.052 1.00 0.00 H new ATOM 0 HE3 MET A 114 5.469 -4.961 0.090 1.00 0.00 H new ATOM 1639 N GLU A 115 6.250 -11.670 1.484 1.00 0.00 N ATOM 1640 CA GLU A 115 7.119 -12.875 1.611 1.00 0.00 C ATOM 1641 C GLU A 115 6.679 -13.945 0.607 1.00 0.00 C ATOM 1642 O GLU A 115 7.444 -14.816 0.242 1.00 0.00 O ATOM 1643 CB GLU A 115 6.916 -13.365 3.047 1.00 0.00 C ATOM 1644 CG GLU A 115 8.270 -13.457 3.754 1.00 0.00 C ATOM 1645 CD GLU A 115 8.530 -14.897 4.200 1.00 0.00 C ATOM 1646 OE1 GLU A 115 7.567 -15.600 4.460 1.00 0.00 O ATOM 1647 OE2 GLU A 115 9.688 -15.273 4.274 1.00 0.00 O ATOM 0 H GLU A 115 5.835 -11.340 2.356 1.00 0.00 H new ATOM 0 HA GLU A 115 8.166 -12.655 1.405 1.00 0.00 H new ATOM 0 HB2 GLU A 115 6.259 -12.682 3.586 1.00 0.00 H new ATOM 0 HB3 GLU A 115 6.429 -14.340 3.044 1.00 0.00 H new ATOM 0 HG2 GLU A 115 9.063 -13.126 3.083 1.00 0.00 H new ATOM 0 HG3 GLU A 115 8.285 -12.792 4.617 1.00 0.00 H new ATOM 1654 N HIS A 116 5.454 -13.892 0.162 1.00 0.00 N ATOM 1655 CA HIS A 116 4.972 -14.912 -0.813 1.00 0.00 C ATOM 1656 C HIS A 116 5.676 -14.723 -2.160 1.00 0.00 C ATOM 1657 O HIS A 116 5.761 -15.635 -2.959 1.00 0.00 O ATOM 1658 CB HIS A 116 3.469 -14.661 -0.949 1.00 0.00 C ATOM 1659 CG HIS A 116 2.796 -14.928 0.369 1.00 0.00 C ATOM 1660 ND1 HIS A 116 3.271 -14.929 1.657 1.00 0.00 N flip ATOM 1661 CD2 HIS A 116 1.450 -15.246 0.462 1.00 0.00 C flip ATOM 1662 CE1 HIS A 116 2.238 -15.242 2.537 1.00 0.00 C flip ATOM 1663 NE2 HIS A 116 1.164 -15.423 1.765 1.00 0.00 N flip ATOM 0 H HIS A 116 4.766 -13.188 0.430 1.00 0.00 H new ATOM 0 HA HIS A 116 5.181 -15.930 -0.484 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.288 -13.632 -1.260 1.00 0.00 H new ATOM 0 HB3 HIS A 116 3.050 -15.306 -1.721 1.00 0.00 H new ATOM 0 HD2 HIS A 116 0.757 -15.335 -0.361 1.00 0.00 H new ATOM 0 HE1 HIS A 116 2.294 -15.321 3.613 1.00 0.00 H new ATOM 0 HE2 HIS A 116 0.239 -15.666 2.120 1.00 0.00 H new ATOM 1671 N ARG A 117 6.179 -13.547 -2.421 1.00 0.00 N ATOM 1672 CA ARG A 117 6.872 -13.306 -3.720 1.00 0.00 C ATOM 1673 C ARG A 117 8.374 -13.546 -3.560 1.00 0.00 C ATOM 1674 O ARG A 117 8.983 -14.261 -4.332 1.00 0.00 O ATOM 1675 CB ARG A 117 6.590 -11.843 -4.062 1.00 0.00 C ATOM 1676 CG ARG A 117 6.641 -11.656 -5.579 1.00 0.00 C ATOM 1677 CD ARG A 117 8.015 -12.084 -6.101 1.00 0.00 C ATOM 1678 NE ARG A 117 8.086 -11.571 -7.497 1.00 0.00 N ATOM 1679 CZ ARG A 117 8.109 -12.407 -8.499 1.00 0.00 C ATOM 1680 NH1 ARG A 117 7.023 -13.040 -8.846 1.00 0.00 N ATOM 1681 NH2 ARG A 117 9.220 -12.608 -9.155 1.00 0.00 N ATOM 0 H ARG A 117 6.141 -12.744 -1.793 1.00 0.00 H new ATOM 0 HA ARG A 117 6.523 -13.975 -4.507 1.00 0.00 H new ATOM 0 HB2 ARG A 117 5.611 -11.551 -3.681 1.00 0.00 H new ATOM 0 HB3 ARG A 117 7.324 -11.198 -3.580 1.00 0.00 H new ATOM 0 HG2 ARG A 117 5.859 -12.247 -6.055 1.00 0.00 H new ATOM 0 HG3 ARG A 117 6.452 -10.613 -5.834 1.00 0.00 H new ATOM 0 HD2 ARG A 117 8.815 -11.668 -5.489 1.00 0.00 H new ATOM 0 HD3 ARG A 117 8.125 -13.168 -6.075 1.00 0.00 H new ATOM 0 HE ARG A 117 8.117 -10.566 -7.670 1.00 0.00 H new ATOM 0 HH11 ARG A 117 6.155 -12.882 -8.334 1.00 0.00 H new ATOM 0 HH12 ARG A 117 7.042 -13.693 -9.629 1.00 0.00 H new ATOM 0 HH21 ARG A 117 10.069 -12.112 -8.884 1.00 0.00 H new ATOM 0 HH22 ARG A 117 9.239 -13.261 -9.938 1.00 0.00 H new ATOM 1695 N ILE A 118 8.978 -12.960 -2.564 1.00 0.00 N ATOM 1696 CA ILE A 118 10.442 -13.167 -2.362 1.00 0.00 C ATOM 1697 C ILE A 118 10.664 -14.129 -1.191 1.00 0.00 C ATOM 1698 O ILE A 118 11.555 -14.953 -1.220 1.00 0.00 O ATOM 1699 CB ILE A 118 11.036 -11.780 -2.076 1.00 0.00 C ATOM 1700 CG1 ILE A 118 10.192 -11.040 -1.033 1.00 0.00 C ATOM 1701 CG2 ILE A 118 11.064 -10.965 -3.370 1.00 0.00 C ATOM 1702 CD1 ILE A 118 10.956 -9.807 -0.543 1.00 0.00 C ATOM 0 H ILE A 118 8.525 -12.350 -1.884 1.00 0.00 H new ATOM 0 HA ILE A 118 10.923 -13.610 -3.234 1.00 0.00 H new ATOM 0 HB ILE A 118 12.047 -11.904 -1.689 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.238 -10.742 -1.467 1.00 0.00 H new ATOM 0 HG13 ILE A 118 9.969 -11.700 -0.195 1.00 0.00 H new ATOM 0 HG21 ILE A 118 11.485 -9.980 -3.170 1.00 0.00 H new ATOM 0 HG22 ILE A 118 11.677 -11.479 -4.110 1.00 0.00 H new ATOM 0 HG23 ILE A 118 10.049 -10.855 -3.753 1.00 0.00 H new ATOM 0 HD11 ILE A 118 10.357 -9.279 0.199 1.00 0.00 H new ATOM 0 HD12 ILE A 118 11.899 -10.118 -0.094 1.00 0.00 H new ATOM 0 HD13 ILE A 118 11.156 -9.145 -1.385 1.00 0.00 H new ATOM 1714 N GLY A 119 9.844 -14.041 -0.174 1.00 0.00 N ATOM 1715 CA GLY A 119 9.980 -14.959 1.000 1.00 0.00 C ATOM 1716 C GLY A 119 11.454 -15.118 1.391 1.00 0.00 C ATOM 1717 O GLY A 119 11.995 -14.335 2.145 1.00 0.00 O ATOM 0 H GLY A 119 9.081 -13.368 -0.106 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.414 -14.565 1.844 1.00 0.00 H new ATOM 0 HA3 GLY A 119 9.555 -15.933 0.758 1.00 0.00 H new ATOM 1721 N GLY A 120 12.100 -16.138 0.890 1.00 0.00 N ATOM 1722 CA GLY A 120 13.535 -16.368 1.231 1.00 0.00 C ATOM 1723 C GLY A 120 14.317 -15.056 1.129 1.00 0.00 C ATOM 1724 O GLY A 120 15.148 -14.754 1.963 1.00 0.00 O ATOM 0 H GLY A 120 11.693 -16.825 0.256 1.00 0.00 H new ATOM 0 HA2 GLY A 120 13.617 -16.772 2.240 1.00 0.00 H new ATOM 0 HA3 GLY A 120 13.963 -17.109 0.556 1.00 0.00 H new ATOM 1728 N LYS A 121 14.064 -14.272 0.116 1.00 0.00 N ATOM 1729 CA LYS A 121 14.803 -12.986 -0.027 1.00 0.00 C ATOM 1730 C LYS A 121 14.238 -11.954 0.954 1.00 0.00 C ATOM 1731 O LYS A 121 14.868 -10.959 1.253 1.00 0.00 O ATOM 1732 CB LYS A 121 14.585 -12.551 -1.477 1.00 0.00 C ATOM 1733 CG LYS A 121 15.702 -13.123 -2.353 1.00 0.00 C ATOM 1734 CD LYS A 121 15.148 -13.451 -3.741 1.00 0.00 C ATOM 1735 CE LYS A 121 16.194 -14.234 -4.539 1.00 0.00 C ATOM 1736 NZ LYS A 121 16.012 -13.780 -5.945 1.00 0.00 N ATOM 0 H LYS A 121 13.380 -14.466 -0.616 1.00 0.00 H new ATOM 0 HA LYS A 121 15.865 -13.086 0.196 1.00 0.00 H new ATOM 0 HB2 LYS A 121 13.615 -12.900 -1.831 1.00 0.00 H new ATOM 0 HB3 LYS A 121 14.576 -11.463 -1.544 1.00 0.00 H new ATOM 0 HG2 LYS A 121 16.517 -12.404 -2.436 1.00 0.00 H new ATOM 0 HG3 LYS A 121 16.115 -14.021 -1.893 1.00 0.00 H new ATOM 0 HD2 LYS A 121 14.233 -14.036 -3.650 1.00 0.00 H new ATOM 0 HD3 LYS A 121 14.888 -12.532 -4.266 1.00 0.00 H new ATOM 0 HE2 LYS A 121 17.203 -14.025 -4.182 1.00 0.00 H new ATOM 0 HE3 LYS A 121 16.040 -15.309 -4.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 16.693 -14.270 -6.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 15.044 -13.998 -6.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 16.171 -12.754 -6.002 1.00 0.00 H new ATOM 1750 N MET A 122 13.061 -12.188 1.468 1.00 0.00 N ATOM 1751 CA MET A 122 12.468 -11.227 2.439 1.00 0.00 C ATOM 1752 C MET A 122 13.211 -11.338 3.772 1.00 0.00 C ATOM 1753 O MET A 122 12.877 -12.149 4.614 1.00 0.00 O ATOM 1754 CB MET A 122 11.008 -11.655 2.597 1.00 0.00 C ATOM 1755 CG MET A 122 10.262 -10.626 3.448 1.00 0.00 C ATOM 1756 SD MET A 122 9.425 -9.441 2.367 1.00 0.00 S ATOM 1757 CE MET A 122 9.077 -8.191 3.629 1.00 0.00 C ATOM 0 H MET A 122 12.485 -13.003 1.257 1.00 0.00 H new ATOM 0 HA MET A 122 12.541 -10.192 2.104 1.00 0.00 H new ATOM 0 HB2 MET A 122 10.536 -11.743 1.618 1.00 0.00 H new ATOM 0 HB3 MET A 122 10.955 -12.637 3.066 1.00 0.00 H new ATOM 0 HG2 MET A 122 9.536 -11.126 4.088 1.00 0.00 H new ATOM 0 HG3 MET A 122 10.960 -10.106 4.104 1.00 0.00 H new ATOM 0 HE1 MET A 122 9.134 -7.198 3.183 1.00 0.00 H new ATOM 0 HE2 MET A 122 8.077 -8.351 4.033 1.00 0.00 H new ATOM 0 HE3 MET A 122 9.810 -8.271 4.432 1.00 0.00 H new ATOM 1767 N ASN A 123 14.219 -10.535 3.968 1.00 0.00 N ATOM 1768 CA ASN A 123 14.986 -10.601 5.247 1.00 0.00 C ATOM 1769 C ASN A 123 14.419 -9.589 6.245 1.00 0.00 C ATOM 1770 O ASN A 123 13.515 -8.838 5.938 1.00 0.00 O ATOM 1771 CB ASN A 123 16.432 -10.253 4.881 1.00 0.00 C ATOM 1772 CG ASN A 123 16.482 -8.947 4.085 1.00 0.00 C ATOM 1773 OD1 ASN A 123 16.058 -8.900 2.948 1.00 0.00 O ATOM 1774 ND2 ASN A 123 16.987 -7.879 4.636 1.00 0.00 N ATOM 0 H ASN A 123 14.546 -9.836 3.300 1.00 0.00 H new ATOM 0 HA ASN A 123 14.923 -11.584 5.714 1.00 0.00 H new ATOM 0 HB2 ASN A 123 17.030 -10.157 5.787 1.00 0.00 H new ATOM 0 HB3 ASN A 123 16.870 -11.061 4.294 1.00 0.00 H new ATOM 0 HD21 ASN A 123 17.026 -7.005 4.112 1.00 0.00 H new ATOM 0 HD22 ASN A 123 17.343 -7.918 5.591 1.00 0.00 H new ATOM 1781 N ALA A 124 14.942 -9.565 7.441 1.00 0.00 N ATOM 1782 CA ALA A 124 14.434 -8.604 8.459 1.00 0.00 C ATOM 1783 C ALA A 124 14.495 -7.180 7.902 1.00 0.00 C ATOM 1784 O ALA A 124 13.532 -6.441 7.953 1.00 0.00 O ATOM 1785 CB ALA A 124 15.370 -8.759 9.659 1.00 0.00 C ATOM 0 H ALA A 124 15.700 -10.170 7.756 1.00 0.00 H new ATOM 0 HA ALA A 124 13.397 -8.796 8.734 1.00 0.00 H new ATOM 0 HB1 ALA A 124 15.059 -8.081 10.453 1.00 0.00 H new ATOM 0 HB2 ALA A 124 15.329 -9.786 10.022 1.00 0.00 H new ATOM 0 HB3 ALA A 124 16.390 -8.521 9.358 1.00 0.00 H new ATOM 1791 N ALA A 125 15.621 -6.789 7.370 1.00 0.00 N ATOM 1792 CA ALA A 125 15.743 -5.412 6.811 1.00 0.00 C ATOM 1793 C ALA A 125 14.636 -5.173 5.780 1.00 0.00 C ATOM 1794 O ALA A 125 14.244 -4.051 5.525 1.00 0.00 O ATOM 1795 CB ALA A 125 17.124 -5.366 6.155 1.00 0.00 C ATOM 0 H ALA A 125 16.461 -7.363 7.298 1.00 0.00 H new ATOM 0 HA ALA A 125 15.640 -4.639 7.573 1.00 0.00 H new ATOM 0 HB1 ALA A 125 17.287 -4.380 5.720 1.00 0.00 H new ATOM 0 HB2 ALA A 125 17.890 -5.563 6.905 1.00 0.00 H new ATOM 0 HB3 ALA A 125 17.180 -6.122 5.372 1.00 0.00 H new ATOM 1801 N ALA A 126 14.124 -6.219 5.188 1.00 0.00 N ATOM 1802 CA ALA A 126 13.040 -6.046 4.179 1.00 0.00 C ATOM 1803 C ALA A 126 11.716 -5.762 4.894 1.00 0.00 C ATOM 1804 O ALA A 126 11.024 -4.812 4.584 1.00 0.00 O ATOM 1805 CB ALA A 126 12.976 -7.374 3.422 1.00 0.00 C ATOM 0 H ALA A 126 14.409 -7.183 5.359 1.00 0.00 H new ATOM 0 HA ALA A 126 13.227 -5.213 3.502 1.00 0.00 H new ATOM 0 HB1 ALA A 126 12.198 -7.322 2.660 1.00 0.00 H new ATOM 0 HB2 ALA A 126 13.937 -7.568 2.946 1.00 0.00 H new ATOM 0 HB3 ALA A 126 12.747 -8.180 4.120 1.00 0.00 H new ATOM 1811 N LYS A 127 11.359 -6.577 5.849 1.00 0.00 N ATOM 1812 CA LYS A 127 10.080 -6.349 6.581 1.00 0.00 C ATOM 1813 C LYS A 127 10.221 -5.125 7.489 1.00 0.00 C ATOM 1814 O LYS A 127 9.258 -4.444 7.783 1.00 0.00 O ATOM 1815 CB LYS A 127 9.854 -7.616 7.408 1.00 0.00 C ATOM 1816 CG LYS A 127 10.979 -7.766 8.434 1.00 0.00 C ATOM 1817 CD LYS A 127 10.610 -8.855 9.442 1.00 0.00 C ATOM 1818 CE LYS A 127 10.619 -10.219 8.747 1.00 0.00 C ATOM 1819 NZ LYS A 127 10.218 -11.182 9.809 1.00 0.00 N ATOM 0 H LYS A 127 11.896 -7.389 6.154 1.00 0.00 H new ATOM 0 HA LYS A 127 9.242 -6.160 5.910 1.00 0.00 H new ATOM 0 HB2 LYS A 127 8.890 -7.565 7.915 1.00 0.00 H new ATOM 0 HB3 LYS A 127 9.825 -8.488 6.755 1.00 0.00 H new ATOM 0 HG2 LYS A 127 11.912 -8.022 7.931 1.00 0.00 H new ATOM 0 HG3 LYS A 127 11.144 -6.820 8.949 1.00 0.00 H new ATOM 0 HD2 LYS A 127 11.318 -8.853 10.271 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.625 -8.656 9.864 1.00 0.00 H new ATOM 0 HE2 LYS A 127 9.924 -10.241 7.908 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.606 -10.455 8.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 10.199 -12.145 9.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 10.902 -11.141 10.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 9.272 -10.934 10.163 1.00 0.00 H new ATOM 1833 N ASP A 128 11.413 -4.840 7.937 1.00 0.00 N ATOM 1834 CA ASP A 128 11.610 -3.659 8.824 1.00 0.00 C ATOM 1835 C ASP A 128 11.638 -2.385 7.981 1.00 0.00 C ATOM 1836 O ASP A 128 11.113 -1.359 8.367 1.00 0.00 O ATOM 1837 CB ASP A 128 12.959 -3.887 9.508 1.00 0.00 C ATOM 1838 CG ASP A 128 13.087 -2.974 10.728 1.00 0.00 C ATOM 1839 OD1 ASP A 128 12.061 -2.559 11.242 1.00 0.00 O ATOM 1840 OD2 ASP A 128 14.207 -2.703 11.126 1.00 0.00 O ATOM 0 H ASP A 128 12.257 -5.373 7.728 1.00 0.00 H new ATOM 0 HA ASP A 128 10.809 -3.547 9.554 1.00 0.00 H new ATOM 0 HB2 ASP A 128 13.050 -4.930 9.812 1.00 0.00 H new ATOM 0 HB3 ASP A 128 13.770 -3.687 8.807 1.00 0.00 H new ATOM 1845 N ALA A 129 12.243 -2.447 6.830 1.00 0.00 N ATOM 1846 CA ALA A 129 12.305 -1.244 5.954 1.00 0.00 C ATOM 1847 C ALA A 129 10.912 -0.945 5.401 1.00 0.00 C ATOM 1848 O ALA A 129 10.460 0.182 5.405 1.00 0.00 O ATOM 1849 CB ALA A 129 13.267 -1.618 4.826 1.00 0.00 C ATOM 0 H ALA A 129 12.698 -3.280 6.456 1.00 0.00 H new ATOM 0 HA ALA A 129 12.642 -0.354 6.485 1.00 0.00 H new ATOM 0 HB1 ALA A 129 13.364 -0.779 4.138 1.00 0.00 H new ATOM 0 HB2 ALA A 129 14.244 -1.858 5.246 1.00 0.00 H new ATOM 0 HB3 ALA A 129 12.880 -2.484 4.290 1.00 0.00 H new ATOM 1855 N TRP A 130 10.226 -1.950 4.931 1.00 0.00 N ATOM 1856 CA TRP A 130 8.860 -1.726 4.385 1.00 0.00 C ATOM 1857 C TRP A 130 7.893 -1.457 5.538 1.00 0.00 C ATOM 1858 O TRP A 130 6.848 -0.864 5.360 1.00 0.00 O ATOM 1859 CB TRP A 130 8.503 -3.024 3.652 1.00 0.00 C ATOM 1860 CG TRP A 130 8.916 -2.935 2.210 1.00 0.00 C ATOM 1861 CD1 TRP A 130 9.625 -1.921 1.653 1.00 0.00 C ATOM 1862 CD2 TRP A 130 8.658 -3.887 1.136 1.00 0.00 C ATOM 1863 NE1 TRP A 130 9.809 -2.189 0.309 1.00 0.00 N ATOM 1864 CE2 TRP A 130 9.233 -3.389 -0.057 1.00 0.00 C ATOM 1865 CE3 TRP A 130 7.985 -5.121 1.081 1.00 0.00 C ATOM 1866 CZ2 TRP A 130 9.144 -4.089 -1.260 1.00 0.00 C ATOM 1867 CZ3 TRP A 130 7.895 -5.829 -0.129 1.00 0.00 C ATOM 1868 CH2 TRP A 130 8.473 -5.314 -1.296 1.00 0.00 C ATOM 0 H TRP A 130 10.553 -2.916 4.902 1.00 0.00 H new ATOM 0 HA TRP A 130 8.805 -0.869 3.714 1.00 0.00 H new ATOM 0 HB2 TRP A 130 9.000 -3.868 4.129 1.00 0.00 H new ATOM 0 HB3 TRP A 130 7.430 -3.206 3.720 1.00 0.00 H new ATOM 0 HD1 TRP A 130 9.987 -1.047 2.174 1.00 0.00 H new ATOM 0 HE1 TRP A 130 10.309 -1.575 -0.334 1.00 0.00 H new ATOM 0 HE3 TRP A 130 7.535 -5.527 1.975 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 9.591 -3.687 -2.157 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 7.377 -6.776 -0.159 1.00 0.00 H new ATOM 0 HH2 TRP A 130 8.400 -5.863 -2.223 1.00 0.00 H new ATOM 1879 N ALA A 131 8.237 -1.877 6.724 1.00 0.00 N ATOM 1880 CA ALA A 131 7.340 -1.630 7.887 1.00 0.00 C ATOM 1881 C ALA A 131 7.466 -0.167 8.314 1.00 0.00 C ATOM 1882 O ALA A 131 6.572 0.396 8.916 1.00 0.00 O ATOM 1883 CB ALA A 131 7.839 -2.566 8.990 1.00 0.00 C ATOM 0 H ALA A 131 9.099 -2.379 6.938 1.00 0.00 H new ATOM 0 HA ALA A 131 6.290 -1.816 7.659 1.00 0.00 H new ATOM 0 HB1 ALA A 131 7.224 -2.439 9.881 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.774 -3.599 8.648 1.00 0.00 H new ATOM 0 HB3 ALA A 131 8.876 -2.328 9.228 1.00 0.00 H new ATOM 1889 N ALA A 132 8.571 0.455 8.001 1.00 0.00 N ATOM 1890 CA ALA A 132 8.759 1.884 8.379 1.00 0.00 C ATOM 1891 C ALA A 132 8.450 2.774 7.173 1.00 0.00 C ATOM 1892 O ALA A 132 8.118 3.934 7.314 1.00 0.00 O ATOM 1893 CB ALA A 132 10.231 2.004 8.782 1.00 0.00 C ATOM 0 H ALA A 132 9.352 0.034 7.499 1.00 0.00 H new ATOM 0 HA ALA A 132 8.100 2.195 9.189 1.00 0.00 H new ATOM 0 HB1 ALA A 132 10.446 3.032 9.074 1.00 0.00 H new ATOM 0 HB2 ALA A 132 10.434 1.338 9.621 1.00 0.00 H new ATOM 0 HB3 ALA A 132 10.863 1.727 7.938 1.00 0.00 H new ATOM 1899 N ALA A 133 8.551 2.238 5.987 1.00 0.00 N ATOM 1900 CA ALA A 133 8.257 3.052 4.774 1.00 0.00 C ATOM 1901 C ALA A 133 6.747 3.084 4.538 1.00 0.00 C ATOM 1902 O ALA A 133 6.193 4.087 4.136 1.00 0.00 O ATOM 1903 CB ALA A 133 8.973 2.342 3.622 1.00 0.00 C ATOM 0 H ALA A 133 8.824 1.272 5.806 1.00 0.00 H new ATOM 0 HA ALA A 133 8.594 4.084 4.871 1.00 0.00 H new ATOM 0 HB1 ALA A 133 8.800 2.888 2.694 1.00 0.00 H new ATOM 0 HB2 ALA A 133 10.043 2.305 3.827 1.00 0.00 H new ATOM 0 HB3 ALA A 133 8.587 1.327 3.524 1.00 0.00 H new ATOM 1909 N TYR A 134 6.075 1.993 4.791 1.00 0.00 N ATOM 1910 CA TYR A 134 4.599 1.962 4.587 1.00 0.00 C ATOM 1911 C TYR A 134 3.969 3.180 5.267 1.00 0.00 C ATOM 1912 O TYR A 134 2.937 3.670 4.855 1.00 0.00 O ATOM 1913 CB TYR A 134 4.127 0.659 5.244 1.00 0.00 C ATOM 1914 CG TYR A 134 4.339 -0.513 4.302 1.00 0.00 C ATOM 1915 CD1 TYR A 134 5.297 -0.444 3.278 1.00 0.00 C ATOM 1916 CD2 TYR A 134 3.575 -1.677 4.460 1.00 0.00 C ATOM 1917 CE1 TYR A 134 5.486 -1.532 2.418 1.00 0.00 C ATOM 1918 CE2 TYR A 134 3.767 -2.765 3.599 1.00 0.00 C ATOM 1919 CZ TYR A 134 4.722 -2.692 2.579 1.00 0.00 C ATOM 1920 OH TYR A 134 4.909 -3.765 1.731 1.00 0.00 O ATOM 0 H TYR A 134 6.485 1.123 5.130 1.00 0.00 H new ATOM 0 HA TYR A 134 4.317 1.996 3.535 1.00 0.00 H new ATOM 0 HB2 TYR A 134 4.675 0.492 6.172 1.00 0.00 H new ATOM 0 HB3 TYR A 134 3.072 0.737 5.506 1.00 0.00 H new ATOM 0 HD1 TYR A 134 5.889 0.450 3.154 1.00 0.00 H new ATOM 0 HD2 TYR A 134 2.837 -1.735 5.247 1.00 0.00 H new ATOM 0 HE1 TYR A 134 6.222 -1.476 1.630 1.00 0.00 H new ATOM 0 HE2 TYR A 134 3.177 -3.661 3.723 1.00 0.00 H new ATOM 0 HH TYR A 134 5.843 -4.058 1.775 1.00 0.00 H new ATOM 1930 N ALA A 135 4.592 3.681 6.299 1.00 0.00 N ATOM 1931 CA ALA A 135 4.039 4.875 6.994 1.00 0.00 C ATOM 1932 C ALA A 135 4.355 6.121 6.166 1.00 0.00 C ATOM 1933 O ALA A 135 3.625 7.091 6.176 1.00 0.00 O ATOM 1934 CB ALA A 135 4.750 4.925 8.348 1.00 0.00 C ATOM 0 H ALA A 135 5.460 3.314 6.690 1.00 0.00 H new ATOM 0 HA ALA A 135 2.958 4.828 7.122 1.00 0.00 H new ATOM 0 HB1 ALA A 135 4.391 5.783 8.916 1.00 0.00 H new ATOM 0 HB2 ALA A 135 4.542 4.010 8.902 1.00 0.00 H new ATOM 0 HB3 ALA A 135 5.825 5.018 8.191 1.00 0.00 H new ATOM 1940 N ASP A 136 5.441 6.093 5.440 1.00 0.00 N ATOM 1941 CA ASP A 136 5.810 7.265 4.600 1.00 0.00 C ATOM 1942 C ASP A 136 4.991 7.236 3.308 1.00 0.00 C ATOM 1943 O ASP A 136 4.464 8.241 2.872 1.00 0.00 O ATOM 1944 CB ASP A 136 7.301 7.095 4.305 1.00 0.00 C ATOM 1945 CG ASP A 136 8.008 8.450 4.381 1.00 0.00 C ATOM 1946 OD1 ASP A 136 7.586 9.356 3.683 1.00 0.00 O ATOM 1947 OD2 ASP A 136 8.960 8.557 5.138 1.00 0.00 O ATOM 0 H ASP A 136 6.089 5.306 5.394 1.00 0.00 H new ATOM 0 HA ASP A 136 5.611 8.218 5.091 1.00 0.00 H new ATOM 0 HB2 ASP A 136 7.745 6.403 5.021 1.00 0.00 H new ATOM 0 HB3 ASP A 136 7.437 6.660 3.315 1.00 0.00 H new ATOM 1952 N ILE A 137 4.873 6.089 2.694 1.00 0.00 N ATOM 1953 CA ILE A 137 4.080 5.997 1.436 1.00 0.00 C ATOM 1954 C ILE A 137 2.610 6.294 1.748 1.00 0.00 C ATOM 1955 O ILE A 137 2.002 7.167 1.162 1.00 0.00 O ATOM 1956 CB ILE A 137 4.253 4.552 0.952 1.00 0.00 C ATOM 1957 CG1 ILE A 137 5.663 4.373 0.382 1.00 0.00 C ATOM 1958 CG2 ILE A 137 3.222 4.240 -0.139 1.00 0.00 C ATOM 1959 CD1 ILE A 137 6.284 3.096 0.950 1.00 0.00 C ATOM 0 H ILE A 137 5.291 5.214 3.009 1.00 0.00 H new ATOM 0 HA ILE A 137 4.406 6.708 0.677 1.00 0.00 H new ATOM 0 HB ILE A 137 4.105 3.873 1.791 1.00 0.00 H new ATOM 0 HG12 ILE A 137 5.623 4.318 -0.706 1.00 0.00 H new ATOM 0 HG13 ILE A 137 6.281 5.234 0.635 1.00 0.00 H new ATOM 0 HG21 ILE A 137 3.351 3.212 -0.478 1.00 0.00 H new ATOM 0 HG22 ILE A 137 2.217 4.366 0.263 1.00 0.00 H new ATOM 0 HG23 ILE A 137 3.364 4.920 -0.979 1.00 0.00 H new ATOM 0 HD11 ILE A 137 7.288 2.968 0.545 1.00 0.00 H new ATOM 0 HD12 ILE A 137 6.338 3.170 2.036 1.00 0.00 H new ATOM 0 HD13 ILE A 137 5.669 2.239 0.675 1.00 0.00 H new ATOM 1971 N SER A 138 2.039 5.566 2.668 1.00 0.00 N ATOM 1972 CA SER A 138 0.610 5.792 3.024 1.00 0.00 C ATOM 1973 C SER A 138 0.461 7.133 3.751 1.00 0.00 C ATOM 1974 O SER A 138 -0.464 7.882 3.508 1.00 0.00 O ATOM 1975 CB SER A 138 0.242 4.617 3.939 1.00 0.00 C ATOM 1976 OG SER A 138 0.193 5.055 5.292 1.00 0.00 O ATOM 0 H SER A 138 2.502 4.822 3.190 1.00 0.00 H new ATOM 0 HA SER A 138 -0.042 5.837 2.152 1.00 0.00 H new ATOM 0 HB2 SER A 138 -0.723 4.205 3.646 1.00 0.00 H new ATOM 0 HB3 SER A 138 0.976 3.818 3.832 1.00 0.00 H new ATOM 0 HG SER A 138 -0.044 4.301 5.872 1.00 0.00 H new ATOM 1982 N GLY A 139 1.364 7.440 4.642 1.00 0.00 N ATOM 1983 CA GLY A 139 1.272 8.730 5.383 1.00 0.00 C ATOM 1984 C GLY A 139 1.105 9.877 4.386 1.00 0.00 C ATOM 1985 O GLY A 139 0.204 10.685 4.500 1.00 0.00 O ATOM 0 H GLY A 139 2.161 6.853 4.889 1.00 0.00 H new ATOM 0 HA2 GLY A 139 0.428 8.707 6.072 1.00 0.00 H new ATOM 0 HA3 GLY A 139 2.169 8.882 5.983 1.00 0.00 H new ATOM 1989 N ALA A 140 1.966 9.958 3.409 1.00 0.00 N ATOM 1990 CA ALA A 140 1.858 11.056 2.407 1.00 0.00 C ATOM 1991 C ALA A 140 0.449 11.073 1.806 1.00 0.00 C ATOM 1992 O ALA A 140 -0.047 12.103 1.394 1.00 0.00 O ATOM 1993 CB ALA A 140 2.899 10.728 1.336 1.00 0.00 C ATOM 0 H ALA A 140 2.740 9.311 3.261 1.00 0.00 H new ATOM 0 HA ALA A 140 2.032 12.038 2.846 1.00 0.00 H new ATOM 0 HB1 ALA A 140 2.878 11.495 0.562 1.00 0.00 H new ATOM 0 HB2 ALA A 140 3.890 10.696 1.789 1.00 0.00 H new ATOM 0 HB3 ALA A 140 2.672 9.759 0.893 1.00 0.00 H new ATOM 1999 N LEU A 141 -0.198 9.942 1.750 1.00 0.00 N ATOM 2000 CA LEU A 141 -1.573 9.898 1.173 1.00 0.00 C ATOM 2001 C LEU A 141 -2.564 10.572 2.126 1.00 0.00 C ATOM 2002 O LEU A 141 -3.705 10.807 1.780 1.00 0.00 O ATOM 2003 CB LEU A 141 -1.901 8.412 1.021 1.00 0.00 C ATOM 2004 CG LEU A 141 -3.190 8.255 0.214 1.00 0.00 C ATOM 2005 CD1 LEU A 141 -3.187 6.900 -0.496 1.00 0.00 C ATOM 2006 CD2 LEU A 141 -4.393 8.334 1.156 1.00 0.00 C ATOM 0 H LEU A 141 0.164 9.047 2.078 1.00 0.00 H new ATOM 0 HA LEU A 141 -1.636 10.424 0.220 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -1.081 7.897 0.521 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -2.015 7.952 2.002 1.00 0.00 H new ATOM 0 HG LEU A 141 -3.254 9.052 -0.527 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -4.106 6.789 -1.071 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.330 6.843 -1.167 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.123 6.102 0.244 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -5.313 8.222 0.582 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -4.328 7.537 1.896 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -4.396 9.300 1.662 1.00 0.00 H new ATOM 2018 N ILE A 142 -2.146 10.883 3.323 1.00 0.00 N ATOM 2019 CA ILE A 142 -3.076 11.536 4.286 1.00 0.00 C ATOM 2020 C ILE A 142 -2.972 13.058 4.161 1.00 0.00 C ATOM 2021 O ILE A 142 -3.036 13.777 5.138 1.00 0.00 O ATOM 2022 CB ILE A 142 -2.618 11.072 5.667 1.00 0.00 C ATOM 2023 CG1 ILE A 142 -2.621 9.541 5.715 1.00 0.00 C ATOM 2024 CG2 ILE A 142 -3.574 11.618 6.727 1.00 0.00 C ATOM 2025 CD1 ILE A 142 -4.007 9.020 5.329 1.00 0.00 C ATOM 0 H ILE A 142 -1.204 10.714 3.674 1.00 0.00 H new ATOM 0 HA ILE A 142 -4.117 11.271 4.101 1.00 0.00 H new ATOM 0 HB ILE A 142 -1.611 11.440 5.862 1.00 0.00 H new ATOM 0 HG12 ILE A 142 -1.869 9.144 5.033 1.00 0.00 H new ATOM 0 HG13 ILE A 142 -2.358 9.198 6.715 1.00 0.00 H new ATOM 0 HG21 ILE A 142 -3.250 11.288 7.714 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -3.574 12.707 6.690 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -4.581 11.248 6.534 1.00 0.00 H new ATOM 0 HD11 ILE A 142 -4.009 7.931 5.363 1.00 0.00 H new ATOM 0 HD12 ILE A 142 -4.749 9.406 6.028 1.00 0.00 H new ATOM 0 HD13 ILE A 142 -4.252 9.352 4.320 1.00 0.00 H new ATOM 2037 N SER A 143 -2.819 13.551 2.965 1.00 0.00 N ATOM 2038 CA SER A 143 -2.718 15.025 2.769 1.00 0.00 C ATOM 2039 C SER A 143 -3.918 15.508 1.953 1.00 0.00 C ATOM 2040 O SER A 143 -4.359 16.633 2.081 1.00 0.00 O ATOM 2041 CB SER A 143 -1.415 15.243 2.001 1.00 0.00 C ATOM 2042 OG SER A 143 -0.552 16.073 2.766 1.00 0.00 O ATOM 0 H SER A 143 -2.759 12.996 2.111 1.00 0.00 H new ATOM 0 HA SER A 143 -2.718 15.576 3.709 1.00 0.00 H new ATOM 0 HB2 SER A 143 -0.934 14.286 1.800 1.00 0.00 H new ATOM 0 HB3 SER A 143 -1.621 15.705 1.036 1.00 0.00 H new ATOM 0 HG SER A 143 0.285 16.213 2.277 1.00 0.00 H new ATOM 2048 N GLY A 144 -4.452 14.660 1.116 1.00 0.00 N ATOM 2049 CA GLY A 144 -5.626 15.060 0.292 1.00 0.00 C ATOM 2050 C GLY A 144 -6.711 13.987 0.415 1.00 0.00 C ATOM 2051 O GLY A 144 -7.587 13.877 -0.420 1.00 0.00 O ATOM 0 H GLY A 144 -4.124 13.706 0.968 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -6.010 16.024 0.627 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -5.331 15.179 -0.751 1.00 0.00 H new ATOM 2055 N LEU A 145 -6.657 13.192 1.450 1.00 0.00 N ATOM 2056 CA LEU A 145 -7.682 12.124 1.627 1.00 0.00 C ATOM 2057 C LEU A 145 -8.612 12.485 2.790 1.00 0.00 C ATOM 2058 O LEU A 145 -9.343 11.655 3.293 1.00 0.00 O ATOM 2059 CB LEU A 145 -6.882 10.858 1.942 1.00 0.00 C ATOM 2060 CG LEU A 145 -7.836 9.720 2.309 1.00 0.00 C ATOM 2061 CD1 LEU A 145 -7.417 8.447 1.570 1.00 0.00 C ATOM 2062 CD2 LEU A 145 -7.776 9.470 3.817 1.00 0.00 C ATOM 0 H LEU A 145 -5.947 13.236 2.181 1.00 0.00 H new ATOM 0 HA LEU A 145 -8.310 11.994 0.746 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -6.278 10.575 1.080 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -6.193 11.047 2.765 1.00 0.00 H new ATOM 0 HG LEU A 145 -8.852 9.993 2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -8.096 7.635 1.830 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -7.455 8.621 0.495 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -6.401 8.177 1.858 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -8.456 8.659 4.079 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -6.759 9.197 4.100 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -8.070 10.375 4.348 1.00 0.00 H new ATOM 2074 N GLN A 146 -8.595 13.717 3.223 1.00 0.00 N ATOM 2075 CA GLN A 146 -9.480 14.119 4.352 1.00 0.00 C ATOM 2076 C GLN A 146 -10.539 15.103 3.851 1.00 0.00 C ATOM 2077 O GLN A 146 -10.529 16.269 4.193 1.00 0.00 O ATOM 2078 CB GLN A 146 -8.556 14.788 5.371 1.00 0.00 C ATOM 2079 CG GLN A 146 -7.951 13.721 6.285 1.00 0.00 C ATOM 2080 CD GLN A 146 -6.670 13.164 5.662 1.00 0.00 C ATOM 2081 OE1 GLN A 146 -6.625 11.909 5.310 1.00 0.00 O flip ATOM 2082 NE2 GLN A 146 -5.701 13.877 5.494 1.00 0.00 N flip ATOM 0 H GLN A 146 -8.008 14.460 2.844 1.00 0.00 H new ATOM 0 HA GLN A 146 -10.008 13.272 4.790 1.00 0.00 H new ATOM 0 HB2 GLN A 146 -7.765 15.334 4.857 1.00 0.00 H new ATOM 0 HB3 GLN A 146 -9.113 15.515 5.962 1.00 0.00 H new ATOM 0 HG2 GLN A 146 -7.733 14.149 7.263 1.00 0.00 H new ATOM 0 HG3 GLN A 146 -8.669 12.916 6.442 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -5.736 14.859 5.769 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -4.852 13.494 5.078 1.00 0.00 H new ATOM 2091 N SER A 147 -11.454 14.642 3.043 1.00 0.00 N ATOM 2092 CA SER A 147 -12.514 15.550 2.520 1.00 0.00 C ATOM 2093 C SER A 147 -13.146 16.325 3.679 1.00 0.00 C ATOM 2094 O SER A 147 -12.884 15.969 4.816 1.00 0.00 O ATOM 2095 CB SER A 147 -13.542 14.630 1.860 1.00 0.00 C ATOM 2096 OG SER A 147 -14.494 14.217 2.831 1.00 0.00 O ATOM 2097 OXT SER A 147 -13.880 17.261 3.410 1.00 0.00 O ATOM 0 H SER A 147 -11.513 13.676 2.722 1.00 0.00 H new ATOM 0 HA SER A 147 -12.124 16.284 1.815 1.00 0.00 H new ATOM 0 HB2 SER A 147 -14.041 15.151 1.043 1.00 0.00 H new ATOM 0 HB3 SER A 147 -13.045 13.761 1.428 1.00 0.00 H new ATOM 0 HG SER A 147 -15.155 13.628 2.411 1.00 0.00 H new TER 2103 SER A 147 HETATM 2104 FE HEM A 148 -7.572 2.826 -1.563 1.00 0.00 FE HETATM 2105 CHA HEM A 148 -9.041 2.847 -4.609 1.00 0.00 C HETATM 2106 CHB HEM A 148 -10.600 2.423 -0.107 1.00 0.00 C HETATM 2107 CHC HEM A 148 -6.097 2.749 1.480 1.00 0.00 C HETATM 2108 CHD HEM A 148 -4.549 3.270 -3.016 1.00 0.00 C HETATM 2109 NA HEM A 148 -9.413 2.670 -2.214 1.00 0.00 N HETATM 2110 C1A HEM A 148 -9.855 2.696 -3.516 1.00 0.00 C HETATM 2111 C2A HEM A 148 -11.290 2.559 -3.591 1.00 0.00 C HETATM 2112 C3A HEM A 148 -11.732 2.452 -2.324 1.00 0.00 C HETATM 2113 C4A HEM A 148 -10.564 2.516 -1.476 1.00 0.00 C HETATM 2114 CMA HEM A 148 -13.151 2.316 -1.886 1.00 0.00 C HETATM 2115 CAA HEM A 148 -12.118 2.539 -4.829 1.00 0.00 C HETATM 2116 CBA HEM A 148 -13.014 1.302 -4.912 1.00 0.00 C HETATM 2117 CGA HEM A 148 -13.223 0.930 -6.354 1.00 0.00 C HETATM 2118 O1A HEM A 148 -13.308 1.861 -7.198 1.00 0.00 O HETATM 2119 O2A HEM A 148 -13.304 -0.294 -6.644 1.00 0.00 O HETATM 2120 NB HEM A 148 -8.207 2.628 0.278 1.00 0.00 N HETATM 2121 C1B HEM A 148 -9.502 2.472 0.717 1.00 0.00 C HETATM 2122 C2B HEM A 148 -9.563 2.354 2.154 1.00 0.00 C HETATM 2123 C3B HEM A 148 -8.295 2.436 2.599 1.00 0.00 C HETATM 2124 C4B HEM A 148 -7.461 2.609 1.435 1.00 0.00 C HETATM 2125 CMB HEM A 148 -10.788 2.179 2.984 1.00 0.00 C HETATM 2126 CAB HEM A 148 -7.874 2.355 3.911 1.00 0.00 C HETATM 2127 CBB HEM A 148 -7.124 1.283 4.353 1.00 0.00 C HETATM 2128 NC HEM A 148 -5.732 2.983 -0.912 1.00 0.00 N HETATM 2129 C1C HEM A 148 -5.284 2.925 0.388 1.00 0.00 C HETATM 2130 C2C HEM A 148 -3.850 3.077 0.463 1.00 0.00 C HETATM 2131 C3C HEM A 148 -3.415 3.230 -0.802 1.00 0.00 C HETATM 2132 C4C HEM A 148 -4.583 3.169 -1.648 1.00 0.00 C HETATM 2133 CMC HEM A 148 -3.016 3.066 1.697 1.00 0.00 C HETATM 2134 CAC HEM A 148 -2.107 3.411 -1.210 1.00 0.00 C HETATM 2135 CBC HEM A 148 -1.121 2.511 -0.860 1.00 0.00 C HETATM 2136 ND HEM A 148 -6.936 3.019 -3.404 1.00 0.00 N HETATM 2137 C1D HEM A 148 -5.644 3.199 -3.840 1.00 0.00 C HETATM 2138 C2D HEM A 148 -5.579 3.293 -5.279 1.00 0.00 C HETATM 2139 C3D HEM A 148 -6.842 3.168 -5.728 1.00 0.00 C HETATM 2140 C4D HEM A 148 -7.677 3.000 -4.563 1.00 0.00 C HETATM 2141 CMD HEM A 148 -4.353 3.486 -6.104 1.00 0.00 C HETATM 2142 CAD HEM A 148 -7.288 3.192 -7.149 1.00 0.00 C HETATM 2143 CBD HEM A 148 -7.493 4.615 -7.672 1.00 0.00 C HETATM 2144 CGD HEM A 148 -6.840 4.753 -9.020 1.00 0.00 C HETATM 2145 O1D HEM A 148 -5.658 5.188 -9.062 1.00 0.00 O HETATM 2146 O2D HEM A 148 -7.507 4.427 -10.037 1.00 0.00 O HETATM 0 HMA1 HEM A 148 -13.803 2.806 -2.609 1.00 0.00 H new HETATM 0 HMA2 HEM A 148 -13.277 2.783 -0.909 1.00 0.00 H new HETATM 0 HMA3 HEM A 148 -13.412 1.260 -1.820 1.00 0.00 H new HETATM 0 HMB1 HEM A 148 -11.633 2.659 2.491 1.00 0.00 H new HETATM 0 HMB2 HEM A 148 -10.633 2.634 3.962 1.00 0.00 H new HETATM 0 HMB3 HEM A 148 -10.995 1.116 3.107 1.00 0.00 H new HETATM 0 HMC1 HEM A 148 -3.599 3.450 2.534 1.00 0.00 H new HETATM 0 HMC2 HEM A 148 -2.138 3.694 1.548 1.00 0.00 H new HETATM 0 HMC3 HEM A 148 -2.700 2.046 1.913 1.00 0.00 H new HETATM 0 HMD1 HEM A 148 -3.618 4.056 -5.536 1.00 0.00 H new HETATM 0 HMD2 HEM A 148 -4.609 4.029 -7.014 1.00 0.00 H new HETATM 0 HMD3 HEM A 148 -3.935 2.514 -6.367 1.00 0.00 H new HETATM 0 HBB1 HEM A 148 -6.800 1.236 5.393 1.00 0.00 H new HETATM 0 HBB2 HEM A 148 -6.856 0.484 3.662 1.00 0.00 H new HETATM 0 HBC1 HEM A 148 -0.095 2.671 -1.191 1.00 0.00 H new HETATM 0 HBC2 HEM A 148 -1.368 1.641 -0.252 1.00 0.00 H new HETATM 0 HBA1 HEM A 148 -13.973 1.502 -4.434 1.00 0.00 H new HETATM 0 HBA2 HEM A 148 -12.557 0.472 -4.374 1.00 0.00 H new HETATM 0 HAA1 HEM A 148 -11.464 2.570 -5.701 1.00 0.00 H new HETATM 0 HAA2 HEM A 148 -12.737 3.435 -4.863 1.00 0.00 H new HETATM 0 HBD1 HEM A 148 -7.066 5.335 -6.974 1.00 0.00 H new HETATM 0 HBD2 HEM A 148 -8.558 4.836 -7.747 1.00 0.00 H new HETATM 0 HAD1 HEM A 148 -8.220 2.635 -7.244 1.00 0.00 H new HETATM 0 HAD2 HEM A 148 -6.549 2.683 -7.768 1.00 0.00 H new HETATM 0 HHA HEM A 148 -9.509 2.845 -5.582 1.00 0.00 H new HETATM 0 HHB HEM A 148 -11.567 2.302 0.359 1.00 0.00 H new HETATM 0 HHC HEM A 148 -5.626 2.718 2.451 1.00 0.00 H new HETATM 0 HHD HEM A 148 -3.585 3.417 -3.481 1.00 0.00 H new HETATM 0 HAB HEM A 148 -8.138 3.150 4.609 1.00 0.00 H new HETATM 0 HAC HEM A 148 -1.850 4.278 -1.818 1.00 0.00 H new HETATM 2177 C CMO A 149 -7.365 0.942 -1.693 1.00 0.00 C HETATM 2178 O CMO A 149 -7.242 -0.176 -1.771 1.00 0.00 O