USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 960 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 62 ASN : amide:sc= -11.7! C(o=-23!,f=-28!) USER MOD Set 1.2: A 86 THR OG1 : rot 26:sc= -11.9! USER MOD Set 1.3: A 88 TYR OH : rot -107:sc= 0.752 USER MOD Set 2.1: A 51 LYS NZ :NH3+ 172:sc= 0.169 (180deg=0) USER MOD Set 2.2: A 53 GLN : amide:sc= -0.926 K(o=-0.76,f=-0.24) USER MOD Set 3.1: A 1 GLY N :NH3+ 160:sc= 0.473 (180deg=0) USER MOD Set 3.2: A 3 HIS : no HE2:sc= -9.16! C(o=-8.7!,f=-11!) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 61:sc= 0.226 USER MOD Single : A 29 CYS SG : rot 180:sc= 0 USER MOD Single : A 33 HIS : no HD1:sc= -19.3! C(o=-19!,f=-15!) USER MOD Single : A 38 THR OG1 : rot 168:sc= -2.25! USER MOD Single : A 40 SER OG : rot 30:sc= 0.718 USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= -0.0469 K(o=-0.047,f=-1.9!) USER MOD Single : A 68 SER OG : rot 180:sc= -3.89! USER MOD Single : A 69 TYR OH : rot 30:sc= -0.205 USER MOD Single : A 79 ASN : amide:sc= -5.29! C(o=-5.3!,f=-5.2!) USER MOD Single : A 90 SER OG : rot 55:sc= -7.3! USER MOD Single : A 91 LYS NZ :NH3+ -132:sc= -2.33 (180deg=-4.46) USER MOD Single : A 95 THR OG1 : rot -174:sc= 1.25 USER MOD Single : A 97 TYR OH : rot 30:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -6! C(o=-6!,f=-8.9!) USER MOD Single : A 104 THR OG1 : rot 48:sc= -5.16! USER MOD Single : A 105 LYS NZ :NH3+ -179:sc= 1.11 (180deg=1.1) USER MOD Single : A 110 SER OG : rot -105:sc= -0.571 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.530 18.256 13.129 1.00 0.00 N ATOM 2 CA GLY A 1 13.181 19.114 14.297 1.00 0.00 C ATOM 3 C GLY A 1 11.664 19.296 14.362 1.00 0.00 C ATOM 4 O GLY A 1 10.921 18.344 14.500 1.00 0.00 O ATOM 0 H1 GLY A 1 14.529 18.401 12.878 1.00 0.00 H new ATOM 0 H2 GLY A 1 13.376 17.257 13.374 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.929 18.511 12.319 1.00 0.00 H new ATOM 0 HA2 GLY A 1 13.543 18.657 15.218 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.671 20.084 14.208 1.00 0.00 H new ATOM 10 N SER A 2 11.196 20.511 14.265 1.00 0.00 N ATOM 11 CA SER A 2 9.725 20.749 14.323 1.00 0.00 C ATOM 12 C SER A 2 9.133 20.735 12.906 1.00 0.00 C ATOM 13 O SER A 2 8.985 19.689 12.307 1.00 0.00 O ATOM 14 CB SER A 2 9.576 22.127 14.969 1.00 0.00 C ATOM 15 OG SER A 2 10.101 22.088 16.289 1.00 0.00 O ATOM 0 H SER A 2 11.767 21.348 14.148 1.00 0.00 H new ATOM 0 HA SER A 2 9.197 19.981 14.888 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.102 22.877 14.378 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.526 22.419 14.992 1.00 0.00 H new ATOM 0 HG SER A 2 10.008 22.971 16.704 1.00 0.00 H new ATOM 21 N HIS A 3 8.802 21.886 12.365 1.00 0.00 N ATOM 22 CA HIS A 3 8.223 21.948 10.985 1.00 0.00 C ATOM 23 C HIS A 3 7.347 20.724 10.697 1.00 0.00 C ATOM 24 O HIS A 3 6.809 20.108 11.596 1.00 0.00 O ATOM 25 CB HIS A 3 9.429 21.997 10.039 1.00 0.00 C ATOM 26 CG HIS A 3 10.221 20.720 10.131 1.00 0.00 C ATOM 27 ND1 HIS A 3 10.118 19.721 9.177 1.00 0.00 N ATOM 28 CD2 HIS A 3 11.148 20.274 11.041 1.00 0.00 C ATOM 29 CE1 HIS A 3 10.961 18.733 9.531 1.00 0.00 C ATOM 30 NE2 HIS A 3 11.613 19.018 10.660 1.00 0.00 N ATOM 0 H HIS A 3 8.909 22.790 12.825 1.00 0.00 H new ATOM 0 HA HIS A 3 7.577 22.817 10.860 1.00 0.00 H new ATOM 0 HB2 HIS A 3 9.089 22.149 9.014 1.00 0.00 H new ATOM 0 HB3 HIS A 3 10.064 22.845 10.293 1.00 0.00 H new ATOM 0 HD1 HIS A 3 9.513 19.732 8.356 1.00 0.00 H new ATOM 0 HD2 HIS A 3 11.468 20.815 11.919 1.00 0.00 H new ATOM 0 HE1 HIS A 3 11.094 17.820 8.969 1.00 0.00 H new ATOM 38 N MET A 4 7.193 20.372 9.450 1.00 0.00 N ATOM 39 CA MET A 4 6.347 19.193 9.106 1.00 0.00 C ATOM 40 C MET A 4 7.216 17.945 8.942 1.00 0.00 C ATOM 41 O MET A 4 8.420 18.029 8.804 1.00 0.00 O ATOM 42 CB MET A 4 5.683 19.560 7.777 1.00 0.00 C ATOM 43 CG MET A 4 4.549 18.577 7.482 1.00 0.00 C ATOM 44 SD MET A 4 3.031 19.499 7.130 1.00 0.00 S ATOM 45 CE MET A 4 2.885 19.034 5.388 1.00 0.00 C ATOM 0 H MET A 4 7.616 20.849 8.654 1.00 0.00 H new ATOM 0 HA MET A 4 5.616 18.969 9.883 1.00 0.00 H new ATOM 0 HB2 MET A 4 5.294 20.577 7.822 1.00 0.00 H new ATOM 0 HB3 MET A 4 6.418 19.535 6.972 1.00 0.00 H new ATOM 0 HG2 MET A 4 4.811 17.947 6.632 1.00 0.00 H new ATOM 0 HG3 MET A 4 4.396 17.915 8.334 1.00 0.00 H new ATOM 0 HE1 MET A 4 1.998 19.501 4.960 1.00 0.00 H new ATOM 0 HE2 MET A 4 3.769 19.370 4.846 1.00 0.00 H new ATOM 0 HE3 MET A 4 2.800 17.950 5.307 1.00 0.00 H new ATOM 55 N THR A 5 6.618 16.787 8.938 1.00 0.00 N ATOM 56 CA THR A 5 7.413 15.546 8.762 1.00 0.00 C ATOM 57 C THR A 5 7.079 14.934 7.408 1.00 0.00 C ATOM 58 O THR A 5 6.025 15.175 6.856 1.00 0.00 O ATOM 59 CB THR A 5 6.980 14.614 9.893 1.00 0.00 C ATOM 60 OG1 THR A 5 5.623 14.235 9.701 1.00 0.00 O ATOM 61 CG2 THR A 5 7.126 15.332 11.235 1.00 0.00 C ATOM 0 H THR A 5 5.614 16.649 9.049 1.00 0.00 H new ATOM 0 HA THR A 5 8.487 15.728 8.793 1.00 0.00 H new ATOM 0 HB THR A 5 7.610 13.724 9.890 1.00 0.00 H new ATOM 0 HG1 THR A 5 5.345 13.636 10.425 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.817 14.665 12.040 1.00 0.00 H new ATOM 0 HG22 THR A 5 8.167 15.620 11.382 1.00 0.00 H new ATOM 0 HG23 THR A 5 6.499 16.223 11.241 1.00 0.00 H new ATOM 69 N GLU A 6 7.957 14.151 6.861 1.00 0.00 N ATOM 70 CA GLU A 6 7.656 13.544 5.538 1.00 0.00 C ATOM 71 C GLU A 6 8.666 12.444 5.199 1.00 0.00 C ATOM 72 O GLU A 6 8.863 12.111 4.048 1.00 0.00 O ATOM 73 CB GLU A 6 7.768 14.697 4.540 1.00 0.00 C ATOM 74 CG GLU A 6 9.156 15.329 4.646 1.00 0.00 C ATOM 75 CD GLU A 6 10.127 14.578 3.734 1.00 0.00 C ATOM 76 OE1 GLU A 6 10.078 14.803 2.536 1.00 0.00 O ATOM 77 OE2 GLU A 6 10.903 13.790 4.250 1.00 0.00 O ATOM 0 H GLU A 6 8.861 13.905 7.265 1.00 0.00 H new ATOM 0 HA GLU A 6 6.671 13.077 5.521 1.00 0.00 H new ATOM 0 HB2 GLU A 6 7.599 14.333 3.527 1.00 0.00 H new ATOM 0 HB3 GLU A 6 7.000 15.444 4.743 1.00 0.00 H new ATOM 0 HG2 GLU A 6 9.112 16.380 4.361 1.00 0.00 H new ATOM 0 HG3 GLU A 6 9.507 15.293 5.677 1.00 0.00 H new ATOM 84 N ARG A 7 9.306 11.873 6.184 1.00 0.00 N ATOM 85 CA ARG A 7 10.295 10.794 5.893 1.00 0.00 C ATOM 86 C ARG A 7 9.701 9.428 6.252 1.00 0.00 C ATOM 87 O ARG A 7 10.073 8.413 5.697 1.00 0.00 O ATOM 88 CB ARG A 7 11.522 11.121 6.755 1.00 0.00 C ATOM 89 CG ARG A 7 11.301 10.657 8.197 1.00 0.00 C ATOM 90 CD ARG A 7 12.106 9.381 8.447 1.00 0.00 C ATOM 91 NE ARG A 7 13.523 9.830 8.534 1.00 0.00 N ATOM 92 CZ ARG A 7 14.442 9.001 8.946 1.00 0.00 C ATOM 93 NH1 ARG A 7 14.363 7.736 8.639 1.00 0.00 N ATOM 94 NH2 ARG A 7 15.439 9.436 9.667 1.00 0.00 N ATOM 0 H ARG A 7 9.189 12.104 7.170 1.00 0.00 H new ATOM 0 HA ARG A 7 10.562 10.747 4.837 1.00 0.00 H new ATOM 0 HB2 ARG A 7 12.405 10.634 6.341 1.00 0.00 H new ATOM 0 HB3 ARG A 7 11.711 12.194 6.737 1.00 0.00 H new ATOM 0 HG2 ARG A 7 11.609 11.437 8.893 1.00 0.00 H new ATOM 0 HG3 ARG A 7 10.241 10.472 8.373 1.00 0.00 H new ATOM 0 HD2 ARG A 7 11.791 8.889 9.367 1.00 0.00 H new ATOM 0 HD3 ARG A 7 11.968 8.663 7.639 1.00 0.00 H new ATOM 0 HE ARG A 7 13.774 10.783 8.272 1.00 0.00 H new ATOM 0 HH11 ARG A 7 13.583 7.395 8.077 1.00 0.00 H new ATOM 0 HH12 ARG A 7 15.081 7.087 8.961 1.00 0.00 H new ATOM 0 HH21 ARG A 7 15.500 10.425 9.909 1.00 0.00 H new ATOM 0 HH22 ARG A 7 16.157 8.787 9.989 1.00 0.00 H new ATOM 108 N ARG A 8 8.769 9.399 7.165 1.00 0.00 N ATOM 109 CA ARG A 8 8.134 8.107 7.551 1.00 0.00 C ATOM 110 C ARG A 8 6.788 7.954 6.839 1.00 0.00 C ATOM 111 O ARG A 8 6.075 6.989 7.037 1.00 0.00 O ATOM 112 CB ARG A 8 7.925 8.203 9.063 1.00 0.00 C ATOM 113 CG ARG A 8 9.267 8.443 9.754 1.00 0.00 C ATOM 114 CD ARG A 8 9.267 9.829 10.407 1.00 0.00 C ATOM 115 NE ARG A 8 8.253 9.747 11.495 1.00 0.00 N ATOM 116 CZ ARG A 8 8.441 8.943 12.505 1.00 0.00 C ATOM 117 NH1 ARG A 8 9.651 8.584 12.836 1.00 0.00 N ATOM 118 NH2 ARG A 8 7.419 8.502 13.186 1.00 0.00 N ATOM 0 H ARG A 8 8.419 10.218 7.662 1.00 0.00 H new ATOM 0 HA ARG A 8 8.746 7.247 7.277 1.00 0.00 H new ATOM 0 HB2 ARG A 8 7.236 9.015 9.294 1.00 0.00 H new ATOM 0 HB3 ARG A 8 7.472 7.285 9.436 1.00 0.00 H new ATOM 0 HG2 ARG A 8 9.442 7.675 10.507 1.00 0.00 H new ATOM 0 HG3 ARG A 8 10.079 8.371 9.030 1.00 0.00 H new ATOM 0 HD2 ARG A 8 10.251 10.078 10.804 1.00 0.00 H new ATOM 0 HD3 ARG A 8 9.009 10.604 9.686 1.00 0.00 H new ATOM 0 HE ARG A 8 7.411 10.320 11.450 1.00 0.00 H new ATOM 0 HH11 ARG A 8 10.449 8.932 12.305 1.00 0.00 H new ATOM 0 HH12 ARG A 8 9.798 7.955 13.626 1.00 0.00 H new ATOM 0 HH21 ARG A 8 6.474 8.786 12.929 1.00 0.00 H new ATOM 0 HH22 ARG A 8 7.565 7.873 13.976 1.00 0.00 H new ATOM 132 N LEU A 9 6.426 8.909 6.029 1.00 0.00 N ATOM 133 CA LEU A 9 5.122 8.833 5.327 1.00 0.00 C ATOM 134 C LEU A 9 5.281 8.243 3.923 1.00 0.00 C ATOM 135 O LEU A 9 5.624 8.937 2.973 1.00 0.00 O ATOM 136 CB LEU A 9 4.634 10.279 5.249 1.00 0.00 C ATOM 137 CG LEU A 9 3.835 10.619 6.508 1.00 0.00 C ATOM 138 CD1 LEU A 9 2.690 9.618 6.673 1.00 0.00 C ATOM 139 CD2 LEU A 9 4.751 10.546 7.730 1.00 0.00 C ATOM 0 H LEU A 9 6.981 9.740 5.825 1.00 0.00 H new ATOM 0 HA LEU A 9 4.419 8.185 5.851 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.483 10.955 5.151 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.013 10.417 4.364 1.00 0.00 H new ATOM 0 HG LEU A 9 3.429 11.626 6.417 1.00 0.00 H new ATOM 0 HD11 LEU A 9 2.121 9.861 7.570 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.035 9.668 5.803 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.097 8.611 6.763 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.181 10.788 8.627 1.00 0.00 H new ATOM 0 HD22 LEU A 9 5.158 9.539 7.820 1.00 0.00 H new ATOM 0 HD23 LEU A 9 5.568 11.259 7.616 1.00 0.00 H new ATOM 151 N ARG A 10 5.018 6.973 3.770 1.00 0.00 N ATOM 152 CA ARG A 10 5.129 6.379 2.418 1.00 0.00 C ATOM 153 C ARG A 10 4.305 5.109 2.278 1.00 0.00 C ATOM 154 O ARG A 10 3.935 4.470 3.243 1.00 0.00 O ATOM 155 CB ARG A 10 6.600 6.090 2.181 1.00 0.00 C ATOM 156 CG ARG A 10 6.852 6.118 0.670 1.00 0.00 C ATOM 157 CD ARG A 10 6.343 7.444 0.080 1.00 0.00 C ATOM 158 NE ARG A 10 5.238 7.062 -0.866 1.00 0.00 N ATOM 159 CZ ARG A 10 3.967 7.360 -0.633 1.00 0.00 C ATOM 160 NH1 ARG A 10 3.599 8.134 0.359 1.00 0.00 N ATOM 161 NH2 ARG A 10 3.050 6.896 -1.435 1.00 0.00 N ATOM 0 H ARG A 10 4.736 6.334 4.513 1.00 0.00 H new ATOM 0 HA ARG A 10 4.736 7.075 1.677 1.00 0.00 H new ATOM 0 HB2 ARG A 10 7.220 6.832 2.684 1.00 0.00 H new ATOM 0 HB3 ARG A 10 6.868 5.118 2.594 1.00 0.00 H new ATOM 0 HG2 ARG A 10 7.917 6.005 0.468 1.00 0.00 H new ATOM 0 HG3 ARG A 10 6.346 5.279 0.192 1.00 0.00 H new ATOM 0 HD2 ARG A 10 5.978 8.108 0.863 1.00 0.00 H new ATOM 0 HD3 ARG A 10 7.140 7.974 -0.441 1.00 0.00 H new ATOM 0 HE ARG A 10 5.475 6.555 -1.719 1.00 0.00 H new ATOM 0 HH11 ARG A 10 4.301 8.530 0.984 1.00 0.00 H new ATOM 0 HH12 ARG A 10 2.611 8.340 0.506 1.00 0.00 H new ATOM 0 HH21 ARG A 10 3.314 6.312 -2.229 1.00 0.00 H new ATOM 0 HH22 ARG A 10 2.068 7.117 -1.269 1.00 0.00 H new ATOM 175 N VAL A 11 4.025 4.745 1.062 1.00 0.00 N ATOM 176 CA VAL A 11 3.229 3.520 0.807 1.00 0.00 C ATOM 177 C VAL A 11 4.132 2.416 0.263 1.00 0.00 C ATOM 178 O VAL A 11 4.707 2.536 -0.801 1.00 0.00 O ATOM 179 CB VAL A 11 2.194 3.931 -0.242 1.00 0.00 C ATOM 180 CG1 VAL A 11 1.517 5.231 0.194 1.00 0.00 C ATOM 181 CG2 VAL A 11 2.882 4.142 -1.595 1.00 0.00 C ATOM 0 H VAL A 11 4.317 5.250 0.225 1.00 0.00 H new ATOM 0 HA VAL A 11 2.759 3.134 1.712 1.00 0.00 H new ATOM 0 HB VAL A 11 1.446 3.144 -0.338 1.00 0.00 H new ATOM 0 HG11 VAL A 11 0.779 5.525 -0.553 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.022 5.080 1.153 1.00 0.00 H new ATOM 0 HG13 VAL A 11 2.266 6.016 0.292 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.141 4.435 -2.339 1.00 0.00 H new ATOM 0 HG22 VAL A 11 3.633 4.927 -1.503 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.363 3.215 -1.907 1.00 0.00 H new ATOM 191 N LEU A 12 4.249 1.330 0.967 1.00 0.00 N ATOM 192 CA LEU A 12 5.096 0.225 0.457 1.00 0.00 C ATOM 193 C LEU A 12 4.206 -0.719 -0.342 1.00 0.00 C ATOM 194 O LEU A 12 3.405 -1.449 0.204 1.00 0.00 O ATOM 195 CB LEU A 12 5.674 -0.467 1.693 1.00 0.00 C ATOM 196 CG LEU A 12 6.418 0.552 2.573 1.00 0.00 C ATOM 197 CD1 LEU A 12 7.209 1.526 1.698 1.00 0.00 C ATOM 198 CD2 LEU A 12 5.411 1.326 3.417 1.00 0.00 C ATOM 0 H LEU A 12 3.799 1.161 1.866 1.00 0.00 H new ATOM 0 HA LEU A 12 5.902 0.564 -0.194 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.873 -0.936 2.265 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.355 -1.262 1.389 1.00 0.00 H new ATOM 0 HG LEU A 12 7.110 0.020 3.225 1.00 0.00 H new ATOM 0 HD11 LEU A 12 7.731 2.243 2.332 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.934 0.973 1.102 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.526 2.058 1.036 1.00 0.00 H new ATOM 0 HD21 LEU A 12 5.938 2.048 4.041 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.715 1.851 2.763 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.859 0.633 4.052 1.00 0.00 H new ATOM 210 N VAL A 13 4.328 -0.696 -1.632 1.00 0.00 N ATOM 211 CA VAL A 13 3.473 -1.573 -2.475 1.00 0.00 C ATOM 212 C VAL A 13 4.357 -2.604 -3.148 1.00 0.00 C ATOM 213 O VAL A 13 5.218 -2.281 -3.942 1.00 0.00 O ATOM 214 CB VAL A 13 2.825 -0.646 -3.508 1.00 0.00 C ATOM 215 CG1 VAL A 13 1.541 -1.284 -4.038 1.00 0.00 C ATOM 216 CG2 VAL A 13 2.487 0.705 -2.864 1.00 0.00 C ATOM 0 H VAL A 13 4.984 -0.107 -2.144 1.00 0.00 H new ATOM 0 HA VAL A 13 2.712 -2.106 -1.904 1.00 0.00 H new ATOM 0 HB VAL A 13 3.525 -0.490 -4.329 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.082 -0.622 -4.773 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.776 -2.239 -4.507 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.848 -1.446 -3.213 1.00 0.00 H new ATOM 0 HG21 VAL A 13 2.027 1.357 -3.606 1.00 0.00 H new ATOM 0 HG22 VAL A 13 1.794 0.551 -2.037 1.00 0.00 H new ATOM 0 HG23 VAL A 13 3.400 1.169 -2.490 1.00 0.00 H new ATOM 226 N VAL A 14 4.182 -3.840 -2.811 1.00 0.00 N ATOM 227 CA VAL A 14 5.052 -4.878 -3.402 1.00 0.00 C ATOM 228 C VAL A 14 4.227 -5.991 -4.049 1.00 0.00 C ATOM 229 O VAL A 14 3.220 -6.438 -3.527 1.00 0.00 O ATOM 230 CB VAL A 14 5.874 -5.399 -2.218 1.00 0.00 C ATOM 231 CG1 VAL A 14 6.297 -4.231 -1.322 1.00 0.00 C ATOM 232 CG2 VAL A 14 5.039 -6.388 -1.401 1.00 0.00 C ATOM 0 H VAL A 14 3.478 -4.177 -2.155 1.00 0.00 H new ATOM 0 HA VAL A 14 5.683 -4.488 -4.201 1.00 0.00 H new ATOM 0 HB VAL A 14 6.762 -5.902 -2.600 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.881 -4.609 -0.483 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.902 -3.531 -1.898 1.00 0.00 H new ATOM 0 HG13 VAL A 14 5.410 -3.721 -0.946 1.00 0.00 H new ATOM 0 HG21 VAL A 14 5.629 -6.755 -0.561 1.00 0.00 H new ATOM 0 HG22 VAL A 14 4.146 -5.888 -1.027 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.747 -7.227 -2.033 1.00 0.00 H new ATOM 242 N GLU A 15 4.668 -6.432 -5.190 1.00 0.00 N ATOM 243 CA GLU A 15 3.965 -7.519 -5.925 1.00 0.00 C ATOM 244 C GLU A 15 4.985 -8.249 -6.810 1.00 0.00 C ATOM 245 O GLU A 15 6.013 -7.714 -7.153 1.00 0.00 O ATOM 246 CB GLU A 15 2.883 -6.808 -6.737 1.00 0.00 C ATOM 247 CG GLU A 15 2.450 -7.679 -7.911 1.00 0.00 C ATOM 248 CD GLU A 15 2.987 -7.088 -9.214 1.00 0.00 C ATOM 249 OE1 GLU A 15 4.136 -6.679 -9.228 1.00 0.00 O ATOM 250 OE2 GLU A 15 2.240 -7.059 -10.178 1.00 0.00 O ATOM 0 H GLU A 15 5.504 -6.078 -5.655 1.00 0.00 H new ATOM 0 HA GLU A 15 3.515 -8.274 -5.281 1.00 0.00 H new ATOM 0 HB2 GLU A 15 2.025 -6.589 -6.101 1.00 0.00 H new ATOM 0 HB3 GLU A 15 3.261 -5.853 -7.103 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.823 -8.695 -7.780 1.00 0.00 H new ATOM 0 HG3 GLU A 15 1.362 -7.741 -7.949 1.00 0.00 H new ATOM 257 N ASP A 16 4.743 -9.478 -7.138 1.00 0.00 N ATOM 258 CA ASP A 16 5.738 -10.260 -7.941 1.00 0.00 C ATOM 259 C ASP A 16 6.004 -9.719 -9.362 1.00 0.00 C ATOM 260 O ASP A 16 6.475 -10.455 -10.206 1.00 0.00 O ATOM 261 CB ASP A 16 5.120 -11.645 -8.035 1.00 0.00 C ATOM 262 CG ASP A 16 3.730 -11.527 -8.666 1.00 0.00 C ATOM 263 OD1 ASP A 16 3.504 -10.559 -9.376 1.00 0.00 O ATOM 264 OD2 ASP A 16 2.912 -12.397 -8.423 1.00 0.00 O ATOM 0 H ASP A 16 3.896 -9.988 -6.888 1.00 0.00 H new ATOM 0 HA ASP A 16 6.713 -10.217 -7.456 1.00 0.00 H new ATOM 0 HB2 ASP A 16 5.752 -12.300 -8.635 1.00 0.00 H new ATOM 0 HB3 ASP A 16 5.047 -12.093 -7.044 1.00 0.00 H new ATOM 269 N GLU A 17 5.742 -8.475 -9.663 1.00 0.00 N ATOM 270 CA GLU A 17 6.034 -7.996 -11.051 1.00 0.00 C ATOM 271 C GLU A 17 6.568 -6.564 -11.029 1.00 0.00 C ATOM 272 O GLU A 17 6.443 -5.864 -10.050 1.00 0.00 O ATOM 273 CB GLU A 17 4.701 -8.052 -11.803 1.00 0.00 C ATOM 274 CG GLU A 17 4.239 -9.504 -11.953 1.00 0.00 C ATOM 275 CD GLU A 17 2.712 -9.548 -12.025 1.00 0.00 C ATOM 276 OE1 GLU A 17 2.138 -8.627 -12.582 1.00 0.00 O ATOM 277 OE2 GLU A 17 2.142 -10.502 -11.521 1.00 0.00 O ATOM 0 H GLU A 17 5.348 -7.782 -9.027 1.00 0.00 H new ATOM 0 HA GLU A 17 6.795 -8.613 -11.530 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.947 -7.477 -11.265 1.00 0.00 H new ATOM 0 HB3 GLU A 17 4.810 -7.594 -12.786 1.00 0.00 H new ATOM 0 HG2 GLU A 17 4.669 -9.943 -12.853 1.00 0.00 H new ATOM 0 HG3 GLU A 17 4.591 -10.098 -11.110 1.00 0.00 H new ATOM 284 N SER A 18 7.159 -6.125 -12.108 1.00 0.00 N ATOM 285 CA SER A 18 7.695 -4.734 -12.161 1.00 0.00 C ATOM 286 C SER A 18 6.573 -3.763 -12.532 1.00 0.00 C ATOM 287 O SER A 18 6.699 -2.564 -12.384 1.00 0.00 O ATOM 288 CB SER A 18 8.760 -4.766 -13.255 1.00 0.00 C ATOM 289 OG SER A 18 8.810 -3.501 -13.901 1.00 0.00 O ATOM 0 H SER A 18 7.294 -6.672 -12.958 1.00 0.00 H new ATOM 0 HA SER A 18 8.104 -4.404 -11.206 1.00 0.00 H new ATOM 0 HB2 SER A 18 9.732 -5.006 -12.825 1.00 0.00 H new ATOM 0 HB3 SER A 18 8.530 -5.548 -13.979 1.00 0.00 H new ATOM 0 HG SER A 18 9.494 -3.519 -14.603 1.00 0.00 H new ATOM 295 N MET A 19 5.471 -4.277 -13.011 1.00 0.00 N ATOM 296 CA MET A 19 4.337 -3.388 -13.389 1.00 0.00 C ATOM 297 C MET A 19 3.983 -2.467 -12.218 1.00 0.00 C ATOM 298 O MET A 19 3.359 -1.442 -12.390 1.00 0.00 O ATOM 299 CB MET A 19 3.178 -4.335 -13.706 1.00 0.00 C ATOM 300 CG MET A 19 2.353 -3.764 -14.862 1.00 0.00 C ATOM 301 SD MET A 19 1.015 -4.911 -15.277 1.00 0.00 S ATOM 302 CE MET A 19 1.629 -5.395 -16.910 1.00 0.00 C ATOM 0 H MET A 19 5.309 -5.273 -13.156 1.00 0.00 H new ATOM 0 HA MET A 19 4.575 -2.746 -14.237 1.00 0.00 H new ATOM 0 HB2 MET A 19 3.562 -5.320 -13.971 1.00 0.00 H new ATOM 0 HB3 MET A 19 2.549 -4.464 -12.825 1.00 0.00 H new ATOM 0 HG2 MET A 19 1.941 -2.794 -14.584 1.00 0.00 H new ATOM 0 HG3 MET A 19 2.990 -3.602 -15.732 1.00 0.00 H new ATOM 0 HE1 MET A 19 0.943 -6.114 -17.358 1.00 0.00 H new ATOM 0 HE2 MET A 19 1.700 -4.514 -17.548 1.00 0.00 H new ATOM 0 HE3 MET A 19 2.615 -5.849 -16.808 1.00 0.00 H new ATOM 312 N ILE A 20 4.390 -2.822 -11.028 1.00 0.00 N ATOM 313 CA ILE A 20 4.090 -1.964 -9.846 1.00 0.00 C ATOM 314 C ILE A 20 5.254 -1.002 -9.603 1.00 0.00 C ATOM 315 O ILE A 20 5.123 -0.002 -8.926 1.00 0.00 O ATOM 316 CB ILE A 20 3.952 -2.945 -8.683 1.00 0.00 C ATOM 317 CG1 ILE A 20 3.506 -2.209 -7.422 1.00 0.00 C ATOM 318 CG2 ILE A 20 5.297 -3.610 -8.418 1.00 0.00 C ATOM 319 CD1 ILE A 20 2.762 -3.184 -6.507 1.00 0.00 C ATOM 0 H ILE A 20 4.918 -3.671 -10.824 1.00 0.00 H new ATOM 0 HA ILE A 20 3.193 -1.359 -9.977 1.00 0.00 H new ATOM 0 HB ILE A 20 3.207 -3.697 -8.944 1.00 0.00 H new ATOM 0 HG12 ILE A 20 4.370 -1.793 -6.904 1.00 0.00 H new ATOM 0 HG13 ILE A 20 2.859 -1.372 -7.685 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.200 -4.310 -7.588 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.619 -4.147 -9.310 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.036 -2.849 -8.166 1.00 0.00 H new ATOM 0 HD11 ILE A 20 2.441 -2.663 -5.605 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.890 -3.578 -7.028 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.425 -4.006 -6.236 1.00 0.00 H new ATOM 331 N ALA A 21 6.395 -1.308 -10.156 1.00 0.00 N ATOM 332 CA ALA A 21 7.586 -0.430 -9.971 1.00 0.00 C ATOM 333 C ALA A 21 7.310 0.972 -10.517 1.00 0.00 C ATOM 334 O ALA A 21 6.928 1.868 -9.789 1.00 0.00 O ATOM 335 CB ALA A 21 8.691 -1.110 -10.778 1.00 0.00 C ATOM 0 H ALA A 21 6.555 -2.134 -10.732 1.00 0.00 H new ATOM 0 HA ALA A 21 7.852 -0.308 -8.921 1.00 0.00 H new ATOM 0 HB1 ALA A 21 9.610 -0.529 -10.698 1.00 0.00 H new ATOM 0 HB2 ALA A 21 8.861 -2.114 -10.388 1.00 0.00 H new ATOM 0 HB3 ALA A 21 8.391 -1.173 -11.824 1.00 0.00 H new ATOM 341 N MET A 22 7.503 1.179 -11.789 1.00 0.00 N ATOM 342 CA MET A 22 7.249 2.533 -12.352 1.00 0.00 C ATOM 343 C MET A 22 5.794 2.927 -12.108 1.00 0.00 C ATOM 344 O MET A 22 5.444 4.090 -12.120 1.00 0.00 O ATOM 345 CB MET A 22 7.550 2.418 -13.848 1.00 0.00 C ATOM 346 CG MET A 22 7.561 3.812 -14.478 1.00 0.00 C ATOM 347 SD MET A 22 8.850 3.887 -15.746 1.00 0.00 S ATOM 348 CE MET A 22 8.060 5.131 -16.796 1.00 0.00 C ATOM 0 H MET A 22 7.822 0.477 -12.457 1.00 0.00 H new ATOM 0 HA MET A 22 7.868 3.301 -11.888 1.00 0.00 H new ATOM 0 HB2 MET A 22 8.514 1.932 -13.999 1.00 0.00 H new ATOM 0 HB3 MET A 22 6.799 1.794 -14.333 1.00 0.00 H new ATOM 0 HG2 MET A 22 6.589 4.032 -14.919 1.00 0.00 H new ATOM 0 HG3 MET A 22 7.743 4.567 -13.714 1.00 0.00 H new ATOM 0 HE1 MET A 22 8.695 5.336 -17.658 1.00 0.00 H new ATOM 0 HE2 MET A 22 7.094 4.759 -17.137 1.00 0.00 H new ATOM 0 HE3 MET A 22 7.915 6.049 -16.226 1.00 0.00 H new ATOM 358 N LEU A 23 4.951 1.967 -11.855 1.00 0.00 N ATOM 359 CA LEU A 23 3.525 2.287 -11.572 1.00 0.00 C ATOM 360 C LEU A 23 3.440 2.983 -10.205 1.00 0.00 C ATOM 361 O LEU A 23 2.403 3.456 -9.792 1.00 0.00 O ATOM 362 CB LEU A 23 2.816 0.925 -11.562 1.00 0.00 C ATOM 363 CG LEU A 23 1.416 1.035 -10.942 1.00 0.00 C ATOM 364 CD1 LEU A 23 1.524 1.083 -9.416 1.00 0.00 C ATOM 365 CD2 LEU A 23 0.712 2.298 -11.451 1.00 0.00 C ATOM 0 H LEU A 23 5.187 0.975 -11.832 1.00 0.00 H new ATOM 0 HA LEU A 23 3.070 2.957 -12.301 1.00 0.00 H new ATOM 0 HB2 LEU A 23 2.737 0.545 -12.581 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.411 0.206 -10.999 1.00 0.00 H new ATOM 0 HG LEU A 23 0.833 0.161 -11.233 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.527 1.161 -8.983 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.006 0.174 -9.057 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.117 1.949 -9.120 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.280 2.366 -11.005 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.295 3.176 -11.174 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.620 2.251 -12.536 1.00 0.00 H new ATOM 377 N ILE A 24 4.540 3.052 -9.501 1.00 0.00 N ATOM 378 CA ILE A 24 4.540 3.716 -8.170 1.00 0.00 C ATOM 379 C ILE A 24 5.202 5.092 -8.279 1.00 0.00 C ATOM 380 O ILE A 24 4.699 6.078 -7.778 1.00 0.00 O ATOM 381 CB ILE A 24 5.344 2.765 -7.267 1.00 0.00 C ATOM 382 CG1 ILE A 24 4.722 2.752 -5.870 1.00 0.00 C ATOM 383 CG2 ILE A 24 6.808 3.208 -7.159 1.00 0.00 C ATOM 384 CD1 ILE A 24 4.821 1.346 -5.276 1.00 0.00 C ATOM 0 H ILE A 24 5.441 2.674 -9.795 1.00 0.00 H new ATOM 0 HA ILE A 24 3.540 3.890 -7.773 1.00 0.00 H new ATOM 0 HB ILE A 24 5.316 1.768 -7.707 1.00 0.00 H new ATOM 0 HG12 ILE A 24 5.235 3.466 -5.226 1.00 0.00 H new ATOM 0 HG13 ILE A 24 3.679 3.063 -5.923 1.00 0.00 H new ATOM 0 HG21 ILE A 24 7.351 2.517 -6.514 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.261 3.212 -8.150 1.00 0.00 H new ATOM 0 HG23 ILE A 24 6.854 4.211 -6.735 1.00 0.00 H new ATOM 0 HD11 ILE A 24 4.377 1.339 -4.281 1.00 0.00 H new ATOM 0 HD12 ILE A 24 4.288 0.642 -5.916 1.00 0.00 H new ATOM 0 HD13 ILE A 24 5.869 1.053 -5.208 1.00 0.00 H new ATOM 396 N GLU A 25 6.325 5.161 -8.938 1.00 0.00 N ATOM 397 CA GLU A 25 7.015 6.470 -9.088 1.00 0.00 C ATOM 398 C GLU A 25 6.030 7.501 -9.632 1.00 0.00 C ATOM 399 O GLU A 25 6.085 8.669 -9.302 1.00 0.00 O ATOM 400 CB GLU A 25 8.133 6.214 -10.095 1.00 0.00 C ATOM 401 CG GLU A 25 9.196 5.314 -9.461 1.00 0.00 C ATOM 402 CD GLU A 25 10.589 5.870 -9.768 1.00 0.00 C ATOM 403 OE1 GLU A 25 10.900 6.023 -10.937 1.00 0.00 O ATOM 404 OE2 GLU A 25 11.321 6.132 -8.827 1.00 0.00 O ATOM 0 H GLU A 25 6.793 4.369 -9.378 1.00 0.00 H new ATOM 0 HA GLU A 25 7.403 6.854 -8.145 1.00 0.00 H new ATOM 0 HB2 GLU A 25 7.729 5.742 -10.991 1.00 0.00 H new ATOM 0 HB3 GLU A 25 8.580 7.158 -10.406 1.00 0.00 H new ATOM 0 HG2 GLU A 25 9.045 5.259 -8.383 1.00 0.00 H new ATOM 0 HG3 GLU A 25 9.105 4.299 -9.848 1.00 0.00 H new ATOM 411 N ASP A 26 5.121 7.070 -10.460 1.00 0.00 N ATOM 412 CA ASP A 26 4.122 8.014 -11.023 1.00 0.00 C ATOM 413 C ASP A 26 3.146 8.443 -9.924 1.00 0.00 C ATOM 414 O ASP A 26 2.701 9.573 -9.881 1.00 0.00 O ATOM 415 CB ASP A 26 3.410 7.222 -12.125 1.00 0.00 C ATOM 416 CG ASP A 26 2.369 6.284 -11.509 1.00 0.00 C ATOM 417 OD1 ASP A 26 2.685 5.646 -10.519 1.00 0.00 O ATOM 418 OD2 ASP A 26 1.273 6.218 -12.041 1.00 0.00 O ATOM 0 H ASP A 26 5.028 6.103 -10.771 1.00 0.00 H new ATOM 0 HA ASP A 26 4.571 8.926 -11.418 1.00 0.00 H new ATOM 0 HB2 ASP A 26 2.927 7.907 -12.822 1.00 0.00 H new ATOM 0 HB3 ASP A 26 4.137 6.646 -12.697 1.00 0.00 H new ATOM 423 N THR A 27 2.823 7.552 -9.025 1.00 0.00 N ATOM 424 CA THR A 27 1.894 7.910 -7.921 1.00 0.00 C ATOM 425 C THR A 27 2.538 8.972 -7.033 1.00 0.00 C ATOM 426 O THR A 27 2.001 10.044 -6.834 1.00 0.00 O ATOM 427 CB THR A 27 1.686 6.622 -7.141 1.00 0.00 C ATOM 428 OG1 THR A 27 1.033 5.668 -7.966 1.00 0.00 O ATOM 429 CG2 THR A 27 0.835 6.899 -5.900 1.00 0.00 C ATOM 0 H THR A 27 3.164 6.591 -9.010 1.00 0.00 H new ATOM 0 HA THR A 27 0.951 8.317 -8.286 1.00 0.00 H new ATOM 0 HB THR A 27 2.654 6.229 -6.830 1.00 0.00 H new ATOM 0 HG1 THR A 27 1.589 5.480 -8.751 1.00 0.00 H new ATOM 0 HG21 THR A 27 0.689 5.972 -5.345 1.00 0.00 H new ATOM 0 HG22 THR A 27 1.342 7.626 -5.266 1.00 0.00 H new ATOM 0 HG23 THR A 27 -0.133 7.296 -6.204 1.00 0.00 H new ATOM 437 N LEU A 28 3.698 8.685 -6.507 1.00 0.00 N ATOM 438 CA LEU A 28 4.384 9.684 -5.646 1.00 0.00 C ATOM 439 C LEU A 28 4.560 10.986 -6.437 1.00 0.00 C ATOM 440 O LEU A 28 4.688 12.055 -5.877 1.00 0.00 O ATOM 441 CB LEU A 28 5.729 9.034 -5.277 1.00 0.00 C ATOM 442 CG LEU A 28 6.857 9.557 -6.173 1.00 0.00 C ATOM 443 CD1 LEU A 28 7.284 10.945 -5.691 1.00 0.00 C ATOM 444 CD2 LEU A 28 8.050 8.599 -6.098 1.00 0.00 C ATOM 0 H LEU A 28 4.197 7.805 -6.637 1.00 0.00 H new ATOM 0 HA LEU A 28 3.828 9.943 -4.745 1.00 0.00 H new ATOM 0 HB2 LEU A 28 5.963 9.242 -4.233 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.653 7.951 -5.377 1.00 0.00 H new ATOM 0 HG LEU A 28 6.507 9.622 -7.203 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.086 11.320 -6.326 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.434 11.625 -5.741 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.637 10.880 -4.662 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.854 8.969 -6.734 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.402 8.536 -5.068 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.744 7.610 -6.438 1.00 0.00 H new ATOM 456 N CYS A 29 4.549 10.895 -7.742 1.00 0.00 N ATOM 457 CA CYS A 29 4.692 12.119 -8.579 1.00 0.00 C ATOM 458 C CYS A 29 3.415 12.954 -8.465 1.00 0.00 C ATOM 459 O CYS A 29 3.408 14.142 -8.717 1.00 0.00 O ATOM 460 CB CYS A 29 4.875 11.607 -10.009 1.00 0.00 C ATOM 461 SG CYS A 29 5.950 12.739 -10.925 1.00 0.00 S ATOM 0 H CYS A 29 4.447 10.024 -8.263 1.00 0.00 H new ATOM 0 HA CYS A 29 5.527 12.748 -8.272 1.00 0.00 H new ATOM 0 HB2 CYS A 29 5.310 10.607 -9.996 1.00 0.00 H new ATOM 0 HB3 CYS A 29 3.907 11.527 -10.504 1.00 0.00 H new ATOM 0 HG CYS A 29 6.106 12.302 -12.139 1.00 0.00 H new ATOM 467 N GLU A 30 2.336 12.327 -8.083 1.00 0.00 N ATOM 468 CA GLU A 30 1.050 13.055 -7.941 1.00 0.00 C ATOM 469 C GLU A 30 0.930 13.631 -6.525 1.00 0.00 C ATOM 470 O GLU A 30 0.228 14.596 -6.294 1.00 0.00 O ATOM 471 CB GLU A 30 -0.025 11.993 -8.195 1.00 0.00 C ATOM 472 CG GLU A 30 -1.381 12.487 -7.682 1.00 0.00 C ATOM 473 CD GLU A 30 -2.459 11.455 -8.024 1.00 0.00 C ATOM 474 OE1 GLU A 30 -2.401 10.905 -9.112 1.00 0.00 O ATOM 475 OE2 GLU A 30 -3.324 11.231 -7.192 1.00 0.00 O ATOM 0 H GLU A 30 2.293 11.332 -7.862 1.00 0.00 H new ATOM 0 HA GLU A 30 0.960 13.895 -8.630 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -0.088 11.775 -9.261 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.245 11.063 -7.695 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -1.340 12.643 -6.604 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -1.625 13.448 -8.134 1.00 0.00 H new ATOM 482 N LEU A 31 1.610 13.045 -5.575 1.00 0.00 N ATOM 483 CA LEU A 31 1.532 13.561 -4.177 1.00 0.00 C ATOM 484 C LEU A 31 2.877 14.140 -3.725 1.00 0.00 C ATOM 485 O LEU A 31 2.929 15.133 -3.028 1.00 0.00 O ATOM 486 CB LEU A 31 1.178 12.344 -3.326 1.00 0.00 C ATOM 487 CG LEU A 31 -0.150 11.757 -3.800 1.00 0.00 C ATOM 488 CD1 LEU A 31 0.080 10.338 -4.323 1.00 0.00 C ATOM 489 CD2 LEU A 31 -1.135 11.717 -2.629 1.00 0.00 C ATOM 0 H LEU A 31 2.214 12.234 -5.706 1.00 0.00 H new ATOM 0 HA LEU A 31 0.800 14.364 -4.088 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.966 11.594 -3.400 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.107 12.630 -2.276 1.00 0.00 H new ATOM 0 HG LEU A 31 -0.559 12.377 -4.598 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.867 9.917 -4.662 1.00 0.00 H new ATOM 0 HD12 LEU A 31 0.783 10.367 -5.155 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.488 9.718 -3.525 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -2.083 11.298 -2.966 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.727 11.096 -1.831 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.297 12.728 -2.255 1.00 0.00 H new ATOM 501 N GLY A 32 3.964 13.514 -4.090 1.00 0.00 N ATOM 502 CA GLY A 32 5.295 14.021 -3.646 1.00 0.00 C ATOM 503 C GLY A 32 5.632 13.352 -2.315 1.00 0.00 C ATOM 504 O GLY A 32 6.100 13.975 -1.384 1.00 0.00 O ATOM 0 H GLY A 32 3.988 12.678 -4.673 1.00 0.00 H new ATOM 0 HA2 GLY A 32 6.058 13.794 -4.391 1.00 0.00 H new ATOM 0 HA3 GLY A 32 5.272 15.105 -3.533 1.00 0.00 H new ATOM 508 N HIS A 33 5.365 12.080 -2.227 1.00 0.00 N ATOM 509 CA HIS A 33 5.624 11.323 -0.971 1.00 0.00 C ATOM 510 C HIS A 33 7.108 11.011 -0.796 1.00 0.00 C ATOM 511 O HIS A 33 7.951 11.524 -1.505 1.00 0.00 O ATOM 512 CB HIS A 33 4.845 10.041 -1.164 1.00 0.00 C ATOM 513 CG HIS A 33 3.381 10.326 -0.998 1.00 0.00 C ATOM 514 ND1 HIS A 33 2.427 9.835 -1.875 1.00 0.00 N ATOM 515 CD2 HIS A 33 2.693 11.036 -0.050 1.00 0.00 C ATOM 516 CE1 HIS A 33 1.225 10.253 -1.439 1.00 0.00 C ATOM 517 NE2 HIS A 33 1.329 10.990 -0.329 1.00 0.00 N ATOM 0 H HIS A 33 4.971 11.523 -2.986 1.00 0.00 H new ATOM 0 HA HIS A 33 5.331 11.886 -0.085 1.00 0.00 H new ATOM 0 HB2 HIS A 33 5.038 9.629 -2.155 1.00 0.00 H new ATOM 0 HB3 HIS A 33 5.167 9.293 -0.440 1.00 0.00 H new ATOM 0 HD2 HIS A 33 3.140 11.553 0.786 1.00 0.00 H new ATOM 0 HE1 HIS A 33 0.290 10.021 -1.927 1.00 0.00 H new ATOM 0 HE2 HIS A 33 0.573 11.425 0.200 1.00 0.00 H new ATOM 525 N GLU A 34 7.434 10.163 0.147 1.00 0.00 N ATOM 526 CA GLU A 34 8.868 9.821 0.358 1.00 0.00 C ATOM 527 C GLU A 34 9.334 8.831 -0.733 1.00 0.00 C ATOM 528 O GLU A 34 9.577 9.228 -1.856 1.00 0.00 O ATOM 529 CB GLU A 34 8.919 9.236 1.776 1.00 0.00 C ATOM 530 CG GLU A 34 10.251 9.609 2.431 1.00 0.00 C ATOM 531 CD GLU A 34 11.349 8.666 1.940 1.00 0.00 C ATOM 532 OE1 GLU A 34 11.359 7.526 2.373 1.00 0.00 O ATOM 533 OE2 GLU A 34 12.165 9.102 1.144 1.00 0.00 O ATOM 0 H GLU A 34 6.775 9.699 0.772 1.00 0.00 H new ATOM 0 HA GLU A 34 9.543 10.673 0.276 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.089 9.619 2.370 1.00 0.00 H new ATOM 0 HB3 GLU A 34 8.810 8.152 1.738 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.509 10.640 2.190 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.164 9.547 3.516 1.00 0.00 H new ATOM 540 N VAL A 35 9.450 7.560 -0.443 1.00 0.00 N ATOM 541 CA VAL A 35 9.885 6.591 -1.499 1.00 0.00 C ATOM 542 C VAL A 35 9.169 5.249 -1.299 1.00 0.00 C ATOM 543 O VAL A 35 9.596 4.415 -0.526 1.00 0.00 O ATOM 544 CB VAL A 35 11.397 6.438 -1.316 1.00 0.00 C ATOM 545 CG1 VAL A 35 11.721 6.267 0.169 1.00 0.00 C ATOM 546 CG2 VAL A 35 11.886 5.206 -2.085 1.00 0.00 C ATOM 0 H VAL A 35 9.264 7.151 0.473 1.00 0.00 H new ATOM 0 HA VAL A 35 9.642 6.936 -2.504 1.00 0.00 H new ATOM 0 HB VAL A 35 11.896 7.329 -1.698 1.00 0.00 H new ATOM 0 HG11 VAL A 35 12.798 6.158 0.296 1.00 0.00 H new ATOM 0 HG12 VAL A 35 11.377 7.143 0.720 1.00 0.00 H new ATOM 0 HG13 VAL A 35 11.219 5.378 0.551 1.00 0.00 H new ATOM 0 HG21 VAL A 35 12.963 5.099 -1.954 1.00 0.00 H new ATOM 0 HG22 VAL A 35 11.384 4.317 -1.705 1.00 0.00 H new ATOM 0 HG23 VAL A 35 11.660 5.325 -3.145 1.00 0.00 H new ATOM 556 N ALA A 36 8.071 5.050 -1.980 1.00 0.00 N ATOM 557 CA ALA A 36 7.298 3.779 -1.829 1.00 0.00 C ATOM 558 C ALA A 36 8.173 2.552 -2.108 1.00 0.00 C ATOM 559 O ALA A 36 9.370 2.652 -2.291 1.00 0.00 O ATOM 560 CB ALA A 36 6.182 3.880 -2.869 1.00 0.00 C ATOM 0 H ALA A 36 7.673 5.718 -2.640 1.00 0.00 H new ATOM 0 HA ALA A 36 6.921 3.657 -0.814 1.00 0.00 H new ATOM 0 HB1 ALA A 36 5.563 2.984 -2.827 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.567 4.755 -2.659 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.619 3.973 -3.863 1.00 0.00 H new ATOM 566 N ALA A 37 7.569 1.389 -2.148 1.00 0.00 N ATOM 567 CA ALA A 37 8.347 0.142 -2.420 1.00 0.00 C ATOM 568 C ALA A 37 7.785 -0.556 -3.663 1.00 0.00 C ATOM 569 O ALA A 37 6.621 -0.422 -3.986 1.00 0.00 O ATOM 570 CB ALA A 37 8.159 -0.732 -1.179 1.00 0.00 C ATOM 0 H ALA A 37 6.569 1.250 -2.004 1.00 0.00 H new ATOM 0 HA ALA A 37 9.401 0.343 -2.610 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.704 -1.667 -1.307 1.00 0.00 H new ATOM 0 HB2 ALA A 37 8.540 -0.207 -0.303 1.00 0.00 H new ATOM 0 HB3 ALA A 37 7.099 -0.945 -1.041 1.00 0.00 H new ATOM 576 N THR A 38 8.614 -1.272 -4.376 1.00 0.00 N ATOM 577 CA THR A 38 8.148 -1.949 -5.618 1.00 0.00 C ATOM 578 C THR A 38 8.389 -3.461 -5.586 1.00 0.00 C ATOM 579 O THR A 38 9.171 -3.972 -4.811 1.00 0.00 O ATOM 580 CB THR A 38 8.983 -1.302 -6.724 1.00 0.00 C ATOM 581 OG1 THR A 38 8.462 -0.013 -7.011 1.00 0.00 O ATOM 582 CG2 THR A 38 8.954 -2.171 -7.986 1.00 0.00 C ATOM 0 H THR A 38 9.598 -1.417 -4.149 1.00 0.00 H new ATOM 0 HA THR A 38 7.073 -1.833 -5.757 1.00 0.00 H new ATOM 0 HB THR A 38 10.016 -1.211 -6.389 1.00 0.00 H new ATOM 0 HG1 THR A 38 9.097 0.479 -7.572 1.00 0.00 H new ATOM 0 HG21 THR A 38 9.552 -1.700 -8.766 1.00 0.00 H new ATOM 0 HG22 THR A 38 9.364 -3.155 -7.759 1.00 0.00 H new ATOM 0 HG23 THR A 38 7.926 -2.277 -8.331 1.00 0.00 H new ATOM 590 N ALA A 39 7.700 -4.153 -6.455 1.00 0.00 N ATOM 591 CA ALA A 39 7.808 -5.638 -6.558 1.00 0.00 C ATOM 592 C ALA A 39 7.635 -6.279 -5.190 1.00 0.00 C ATOM 593 O ALA A 39 7.784 -5.643 -4.184 1.00 0.00 O ATOM 594 CB ALA A 39 9.194 -5.931 -7.105 1.00 0.00 C ATOM 0 H ALA A 39 7.047 -3.736 -7.118 1.00 0.00 H new ATOM 0 HA ALA A 39 7.032 -6.044 -7.207 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.327 -7.009 -7.201 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.305 -5.463 -8.083 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.946 -5.532 -6.424 1.00 0.00 H new ATOM 600 N SER A 40 7.295 -7.532 -5.152 1.00 0.00 N ATOM 601 CA SER A 40 7.096 -8.207 -3.839 1.00 0.00 C ATOM 602 C SER A 40 8.449 -8.551 -3.213 1.00 0.00 C ATOM 603 O SER A 40 9.268 -9.221 -3.810 1.00 0.00 O ATOM 604 CB SER A 40 6.308 -9.473 -4.156 1.00 0.00 C ATOM 605 OG SER A 40 7.119 -10.357 -4.920 1.00 0.00 O ATOM 0 H SER A 40 7.145 -8.121 -5.971 1.00 0.00 H new ATOM 0 HA SER A 40 6.570 -7.574 -3.124 1.00 0.00 H new ATOM 0 HB2 SER A 40 5.992 -9.958 -3.233 1.00 0.00 H new ATOM 0 HB3 SER A 40 5.403 -9.222 -4.710 1.00 0.00 H new ATOM 0 HG SER A 40 8.060 -10.227 -4.680 1.00 0.00 H new ATOM 611 N ARG A 41 8.693 -8.089 -2.016 1.00 0.00 N ATOM 612 CA ARG A 41 9.991 -8.376 -1.356 1.00 0.00 C ATOM 613 C ARG A 41 9.785 -8.637 0.136 1.00 0.00 C ATOM 614 O ARG A 41 9.175 -7.852 0.837 1.00 0.00 O ATOM 615 CB ARG A 41 10.822 -7.112 -1.564 1.00 0.00 C ATOM 616 CG ARG A 41 12.316 -7.444 -1.460 1.00 0.00 C ATOM 617 CD ARG A 41 12.737 -8.312 -2.647 1.00 0.00 C ATOM 618 NE ARG A 41 13.912 -9.089 -2.160 1.00 0.00 N ATOM 619 CZ ARG A 41 13.871 -10.395 -2.136 1.00 0.00 C ATOM 620 NH1 ARG A 41 13.234 -11.046 -3.071 1.00 0.00 N ATOM 621 NH2 ARG A 41 14.466 -11.048 -1.175 1.00 0.00 N ATOM 0 H ARG A 41 8.044 -7.524 -1.468 1.00 0.00 H new ATOM 0 HA ARG A 41 10.475 -9.262 -1.767 1.00 0.00 H new ATOM 0 HB2 ARG A 41 10.604 -6.680 -2.541 1.00 0.00 H new ATOM 0 HB3 ARG A 41 10.554 -6.364 -0.818 1.00 0.00 H new ATOM 0 HG2 ARG A 41 12.902 -6.525 -1.444 1.00 0.00 H new ATOM 0 HG3 ARG A 41 12.518 -7.967 -0.525 1.00 0.00 H new ATOM 0 HD2 ARG A 41 11.928 -8.973 -2.959 1.00 0.00 H new ATOM 0 HD3 ARG A 41 12.999 -7.700 -3.510 1.00 0.00 H new ATOM 0 HE ARG A 41 14.750 -8.600 -1.845 1.00 0.00 H new ATOM 0 HH11 ARG A 41 12.768 -10.535 -3.821 1.00 0.00 H new ATOM 0 HH12 ARG A 41 13.202 -12.065 -3.052 1.00 0.00 H new ATOM 0 HH21 ARG A 41 14.962 -10.539 -0.444 1.00 0.00 H new ATOM 0 HH22 ARG A 41 14.435 -12.067 -1.155 1.00 0.00 H new ATOM 635 N MET A 42 10.295 -9.728 0.631 1.00 0.00 N ATOM 636 CA MET A 42 10.135 -10.031 2.076 1.00 0.00 C ATOM 637 C MET A 42 10.851 -8.967 2.912 1.00 0.00 C ATOM 638 O MET A 42 10.395 -8.587 3.972 1.00 0.00 O ATOM 639 CB MET A 42 10.778 -11.405 2.264 1.00 0.00 C ATOM 640 CG MET A 42 9.966 -12.444 1.491 1.00 0.00 C ATOM 641 SD MET A 42 10.617 -14.097 1.827 1.00 0.00 S ATOM 642 CE MET A 42 9.166 -15.027 1.277 1.00 0.00 C ATOM 0 H MET A 42 10.816 -10.423 0.096 1.00 0.00 H new ATOM 0 HA MET A 42 9.092 -10.031 2.394 1.00 0.00 H new ATOM 0 HB2 MET A 42 11.808 -11.391 1.907 1.00 0.00 H new ATOM 0 HB3 MET A 42 10.811 -11.664 3.322 1.00 0.00 H new ATOM 0 HG2 MET A 42 8.917 -12.390 1.781 1.00 0.00 H new ATOM 0 HG3 MET A 42 10.012 -12.234 0.422 1.00 0.00 H new ATOM 0 HE1 MET A 42 9.351 -16.094 1.398 1.00 0.00 H new ATOM 0 HE2 MET A 42 8.301 -14.738 1.874 1.00 0.00 H new ATOM 0 HE3 MET A 42 8.971 -14.809 0.227 1.00 0.00 H new ATOM 652 N GLN A 43 11.965 -8.476 2.439 1.00 0.00 N ATOM 653 CA GLN A 43 12.702 -7.430 3.204 1.00 0.00 C ATOM 654 C GLN A 43 11.879 -6.140 3.252 1.00 0.00 C ATOM 655 O GLN A 43 11.489 -5.681 4.307 1.00 0.00 O ATOM 656 CB GLN A 43 13.999 -7.210 2.425 1.00 0.00 C ATOM 657 CG GLN A 43 15.068 -6.644 3.360 1.00 0.00 C ATOM 658 CD GLN A 43 16.421 -6.644 2.646 1.00 0.00 C ATOM 659 OE1 GLN A 43 16.647 -7.431 1.748 1.00 0.00 O ATOM 660 NE2 GLN A 43 17.337 -5.789 3.011 1.00 0.00 N ATOM 0 H GLN A 43 12.396 -8.754 1.557 1.00 0.00 H new ATOM 0 HA GLN A 43 12.893 -7.726 4.235 1.00 0.00 H new ATOM 0 HB2 GLN A 43 14.340 -8.151 1.993 1.00 0.00 H new ATOM 0 HB3 GLN A 43 13.826 -6.523 1.596 1.00 0.00 H new ATOM 0 HG2 GLN A 43 14.803 -5.630 3.661 1.00 0.00 H new ATOM 0 HG3 GLN A 43 15.125 -7.242 4.270 1.00 0.00 H new ATOM 0 HE21 GLN A 43 17.147 -5.129 3.765 1.00 0.00 H new ATOM 0 HE22 GLN A 43 18.243 -5.781 2.542 1.00 0.00 H new ATOM 669 N GLU A 44 11.609 -5.553 2.117 1.00 0.00 N ATOM 670 CA GLU A 44 10.810 -4.296 2.102 1.00 0.00 C ATOM 671 C GLU A 44 9.432 -4.554 2.710 1.00 0.00 C ATOM 672 O GLU A 44 8.991 -3.843 3.593 1.00 0.00 O ATOM 673 CB GLU A 44 10.680 -3.911 0.629 1.00 0.00 C ATOM 674 CG GLU A 44 12.039 -3.452 0.094 1.00 0.00 C ATOM 675 CD GLU A 44 11.855 -2.838 -1.295 1.00 0.00 C ATOM 676 OE1 GLU A 44 11.673 -3.595 -2.234 1.00 0.00 O ATOM 677 OE2 GLU A 44 11.900 -1.624 -1.396 1.00 0.00 O ATOM 0 H GLU A 44 11.907 -5.890 1.201 1.00 0.00 H new ATOM 0 HA GLU A 44 11.280 -3.502 2.682 1.00 0.00 H new ATOM 0 HB2 GLU A 44 10.319 -4.762 0.051 1.00 0.00 H new ATOM 0 HB3 GLU A 44 9.945 -3.114 0.515 1.00 0.00 H new ATOM 0 HG2 GLU A 44 12.481 -2.721 0.771 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.726 -4.296 0.043 1.00 0.00 H new ATOM 684 N ALA A 45 8.753 -5.573 2.250 1.00 0.00 N ATOM 685 CA ALA A 45 7.409 -5.879 2.816 1.00 0.00 C ATOM 686 C ALA A 45 7.472 -5.737 4.337 1.00 0.00 C ATOM 687 O ALA A 45 6.641 -5.104 4.950 1.00 0.00 O ATOM 688 CB ALA A 45 7.126 -7.326 2.412 1.00 0.00 C ATOM 0 H ALA A 45 9.070 -6.202 1.512 1.00 0.00 H new ATOM 0 HA ALA A 45 6.628 -5.211 2.454 1.00 0.00 H new ATOM 0 HB1 ALA A 45 6.150 -7.626 2.794 1.00 0.00 H new ATOM 0 HB2 ALA A 45 7.132 -7.408 1.325 1.00 0.00 H new ATOM 0 HB3 ALA A 45 7.894 -7.977 2.829 1.00 0.00 H new ATOM 694 N LEU A 46 8.474 -6.302 4.945 1.00 0.00 N ATOM 695 CA LEU A 46 8.618 -6.181 6.419 1.00 0.00 C ATOM 696 C LEU A 46 8.745 -4.707 6.798 1.00 0.00 C ATOM 697 O LEU A 46 8.208 -4.257 7.790 1.00 0.00 O ATOM 698 CB LEU A 46 9.911 -6.920 6.753 1.00 0.00 C ATOM 699 CG LEU A 46 10.251 -6.712 8.229 1.00 0.00 C ATOM 700 CD1 LEU A 46 10.744 -8.028 8.833 1.00 0.00 C ATOM 701 CD2 LEU A 46 11.346 -5.649 8.356 1.00 0.00 C ATOM 0 H LEU A 46 9.203 -6.845 4.482 1.00 0.00 H new ATOM 0 HA LEU A 46 7.763 -6.591 6.957 1.00 0.00 H new ATOM 0 HB2 LEU A 46 9.800 -7.983 6.541 1.00 0.00 H new ATOM 0 HB3 LEU A 46 10.724 -6.553 6.126 1.00 0.00 H new ATOM 0 HG LEU A 46 9.360 -6.381 8.762 1.00 0.00 H new ATOM 0 HD11 LEU A 46 10.986 -7.877 9.885 1.00 0.00 H new ATOM 0 HD12 LEU A 46 9.964 -8.784 8.745 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.634 -8.362 8.300 1.00 0.00 H new ATOM 0 HD21 LEU A 46 11.589 -5.500 9.408 1.00 0.00 H new ATOM 0 HD22 LEU A 46 12.237 -5.979 7.821 1.00 0.00 H new ATOM 0 HD23 LEU A 46 10.993 -4.710 7.929 1.00 0.00 H new ATOM 713 N ASP A 47 9.464 -3.955 6.010 1.00 0.00 N ATOM 714 CA ASP A 47 9.643 -2.508 6.313 1.00 0.00 C ATOM 715 C ASP A 47 8.300 -1.776 6.239 1.00 0.00 C ATOM 716 O ASP A 47 8.198 -0.621 6.596 1.00 0.00 O ATOM 717 CB ASP A 47 10.603 -1.985 5.242 1.00 0.00 C ATOM 718 CG ASP A 47 12.044 -2.131 5.733 1.00 0.00 C ATOM 719 OD1 ASP A 47 12.339 -1.623 6.802 1.00 0.00 O ATOM 720 OD2 ASP A 47 12.829 -2.749 5.032 1.00 0.00 O ATOM 0 H ASP A 47 9.936 -4.282 5.167 1.00 0.00 H new ATOM 0 HA ASP A 47 10.034 -2.348 7.318 1.00 0.00 H new ATOM 0 HB2 ASP A 47 10.466 -2.540 4.314 1.00 0.00 H new ATOM 0 HB3 ASP A 47 10.386 -0.939 5.024 1.00 0.00 H new ATOM 725 N ILE A 48 7.271 -2.431 5.773 1.00 0.00 N ATOM 726 CA ILE A 48 5.946 -1.768 5.686 1.00 0.00 C ATOM 727 C ILE A 48 5.107 -2.122 6.915 1.00 0.00 C ATOM 728 O ILE A 48 4.333 -1.323 7.394 1.00 0.00 O ATOM 729 CB ILE A 48 5.297 -2.255 4.374 1.00 0.00 C ATOM 730 CG1 ILE A 48 4.432 -3.508 4.603 1.00 0.00 C ATOM 731 CG2 ILE A 48 6.387 -2.578 3.354 1.00 0.00 C ATOM 732 CD1 ILE A 48 4.277 -4.279 3.276 1.00 0.00 C ATOM 0 H ILE A 48 7.295 -3.398 5.449 1.00 0.00 H new ATOM 0 HA ILE A 48 6.030 -0.681 5.673 1.00 0.00 H new ATOM 0 HB ILE A 48 4.654 -1.458 4.002 1.00 0.00 H new ATOM 0 HG12 ILE A 48 4.893 -4.148 5.355 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.452 -3.221 4.985 1.00 0.00 H new ATOM 0 HG21 ILE A 48 5.928 -2.922 2.427 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.977 -1.683 3.156 1.00 0.00 H new ATOM 0 HG23 ILE A 48 7.035 -3.360 3.750 1.00 0.00 H new ATOM 0 HD11 ILE A 48 3.665 -5.166 3.440 1.00 0.00 H new ATOM 0 HD12 ILE A 48 3.797 -3.638 2.537 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.260 -4.579 2.913 1.00 0.00 H new ATOM 744 N ALA A 49 5.253 -3.313 7.436 1.00 0.00 N ATOM 745 CA ALA A 49 4.457 -3.691 8.634 1.00 0.00 C ATOM 746 C ALA A 49 5.245 -3.396 9.917 1.00 0.00 C ATOM 747 O ALA A 49 4.881 -2.536 10.695 1.00 0.00 O ATOM 748 CB ALA A 49 4.193 -5.191 8.494 1.00 0.00 C ATOM 0 H ALA A 49 5.885 -4.033 7.085 1.00 0.00 H new ATOM 0 HA ALA A 49 3.528 -3.125 8.699 1.00 0.00 H new ATOM 0 HB1 ALA A 49 3.609 -5.539 9.346 1.00 0.00 H new ATOM 0 HB2 ALA A 49 3.640 -5.379 7.574 1.00 0.00 H new ATOM 0 HB3 ALA A 49 5.142 -5.726 8.462 1.00 0.00 H new ATOM 754 N ARG A 50 6.329 -4.097 10.142 1.00 0.00 N ATOM 755 CA ARG A 50 7.142 -3.850 11.373 1.00 0.00 C ATOM 756 C ARG A 50 7.453 -2.356 11.506 1.00 0.00 C ATOM 757 O ARG A 50 7.808 -1.873 12.563 1.00 0.00 O ATOM 758 CB ARG A 50 8.433 -4.644 11.163 1.00 0.00 C ATOM 759 CG ARG A 50 8.435 -5.873 12.075 1.00 0.00 C ATOM 760 CD ARG A 50 7.991 -7.104 11.282 1.00 0.00 C ATOM 761 NE ARG A 50 7.558 -8.088 12.313 1.00 0.00 N ATOM 762 CZ ARG A 50 8.155 -9.246 12.409 1.00 0.00 C ATOM 763 NH1 ARG A 50 9.459 -9.318 12.355 1.00 0.00 N ATOM 764 NH2 ARG A 50 7.449 -10.332 12.561 1.00 0.00 N ATOM 0 H ARG A 50 6.686 -4.829 9.527 1.00 0.00 H new ATOM 0 HA ARG A 50 6.619 -4.153 12.280 1.00 0.00 H new ATOM 0 HB2 ARG A 50 8.517 -4.952 10.121 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.297 -4.016 11.380 1.00 0.00 H new ATOM 0 HG2 ARG A 50 9.433 -6.032 12.484 1.00 0.00 H new ATOM 0 HG3 ARG A 50 7.766 -5.712 12.920 1.00 0.00 H new ATOM 0 HD2 ARG A 50 7.176 -6.862 10.600 1.00 0.00 H new ATOM 0 HD3 ARG A 50 8.807 -7.499 10.676 1.00 0.00 H new ATOM 0 HE ARG A 50 6.793 -7.857 12.946 1.00 0.00 H new ATOM 0 HH11 ARG A 50 10.012 -8.469 12.238 1.00 0.00 H new ATOM 0 HH12 ARG A 50 9.923 -10.223 12.430 1.00 0.00 H new ATOM 0 HH21 ARG A 50 6.431 -10.277 12.605 1.00 0.00 H new ATOM 0 HH22 ARG A 50 7.914 -11.237 12.636 1.00 0.00 H new ATOM 778 N LYS A 51 7.321 -1.628 10.435 1.00 0.00 N ATOM 779 CA LYS A 51 7.605 -0.167 10.467 1.00 0.00 C ATOM 780 C LYS A 51 6.793 0.511 11.576 1.00 0.00 C ATOM 781 O LYS A 51 7.311 1.296 12.347 1.00 0.00 O ATOM 782 CB LYS A 51 7.122 0.309 9.091 1.00 0.00 C ATOM 783 CG LYS A 51 7.889 1.553 8.614 1.00 0.00 C ATOM 784 CD LYS A 51 9.364 1.470 9.023 1.00 0.00 C ATOM 785 CE LYS A 51 10.169 2.528 8.265 1.00 0.00 C ATOM 786 NZ LYS A 51 11.324 2.841 9.154 1.00 0.00 N ATOM 0 H LYS A 51 7.025 -1.987 9.527 1.00 0.00 H new ATOM 0 HA LYS A 51 8.652 0.064 10.664 1.00 0.00 H new ATOM 0 HB2 LYS A 51 7.246 -0.494 8.365 1.00 0.00 H new ATOM 0 HB3 LYS A 51 6.057 0.535 9.138 1.00 0.00 H new ATOM 0 HG2 LYS A 51 7.811 1.641 7.530 1.00 0.00 H new ATOM 0 HG3 LYS A 51 7.438 2.450 9.040 1.00 0.00 H new ATOM 0 HD2 LYS A 51 9.463 1.625 10.097 1.00 0.00 H new ATOM 0 HD3 LYS A 51 9.756 0.476 8.806 1.00 0.00 H new ATOM 0 HE2 LYS A 51 10.505 2.152 7.299 1.00 0.00 H new ATOM 0 HE3 LYS A 51 9.569 3.417 8.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 11.994 3.456 8.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 10.983 3.328 10.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 11.802 1.958 9.426 1.00 0.00 H new ATOM 800 N GLY A 52 5.524 0.216 11.659 1.00 0.00 N ATOM 801 CA GLY A 52 4.675 0.845 12.712 1.00 0.00 C ATOM 802 C GLY A 52 4.630 2.364 12.509 1.00 0.00 C ATOM 803 O GLY A 52 4.120 3.092 13.337 1.00 0.00 O ATOM 0 H GLY A 52 5.037 -0.435 11.042 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.666 0.434 12.671 1.00 0.00 H new ATOM 0 HA3 GLY A 52 5.074 0.613 13.699 1.00 0.00 H new ATOM 807 N GLN A 53 5.158 2.851 11.416 1.00 0.00 N ATOM 808 CA GLN A 53 5.138 4.327 11.173 1.00 0.00 C ATOM 809 C GLN A 53 4.959 4.650 9.679 1.00 0.00 C ATOM 810 O GLN A 53 4.642 5.767 9.325 1.00 0.00 O ATOM 811 CB GLN A 53 6.485 4.860 11.686 1.00 0.00 C ATOM 812 CG GLN A 53 7.594 3.832 11.447 1.00 0.00 C ATOM 813 CD GLN A 53 8.839 4.541 10.908 1.00 0.00 C ATOM 814 OE1 GLN A 53 9.902 4.455 11.491 1.00 0.00 O ATOM 815 NE2 GLN A 53 8.752 5.245 9.813 1.00 0.00 N ATOM 0 H GLN A 53 5.600 2.295 10.684 1.00 0.00 H new ATOM 0 HA GLN A 53 4.298 4.794 11.688 1.00 0.00 H new ATOM 0 HB2 GLN A 53 6.731 5.793 11.179 1.00 0.00 H new ATOM 0 HB3 GLN A 53 6.412 5.085 12.750 1.00 0.00 H new ATOM 0 HG2 GLN A 53 7.831 3.314 12.376 1.00 0.00 H new ATOM 0 HG3 GLN A 53 7.257 3.076 10.738 1.00 0.00 H new ATOM 0 HE21 GLN A 53 7.860 5.318 9.323 1.00 0.00 H new ATOM 0 HE22 GLN A 53 9.576 5.723 9.447 1.00 0.00 H new ATOM 824 N PHE A 54 5.157 3.697 8.799 1.00 0.00 N ATOM 825 CA PHE A 54 4.983 3.984 7.342 1.00 0.00 C ATOM 826 C PHE A 54 3.580 4.547 7.082 1.00 0.00 C ATOM 827 O PHE A 54 2.937 5.062 7.974 1.00 0.00 O ATOM 828 CB PHE A 54 5.209 2.643 6.621 1.00 0.00 C ATOM 829 CG PHE A 54 4.021 1.714 6.784 1.00 0.00 C ATOM 830 CD1 PHE A 54 3.681 1.207 8.046 1.00 0.00 C ATOM 831 CD2 PHE A 54 3.261 1.346 5.664 1.00 0.00 C ATOM 832 CE1 PHE A 54 2.591 0.345 8.185 1.00 0.00 C ATOM 833 CE2 PHE A 54 2.173 0.480 5.810 1.00 0.00 C ATOM 834 CZ PHE A 54 1.838 -0.019 7.068 1.00 0.00 C ATOM 0 H PHE A 54 5.429 2.741 9.025 1.00 0.00 H new ATOM 0 HA PHE A 54 5.685 4.734 6.979 1.00 0.00 H new ATOM 0 HB2 PHE A 54 5.387 2.825 5.561 1.00 0.00 H new ATOM 0 HB3 PHE A 54 6.104 2.163 7.017 1.00 0.00 H new ATOM 0 HD1 PHE A 54 4.263 1.484 8.913 1.00 0.00 H new ATOM 0 HD2 PHE A 54 3.516 1.732 4.688 1.00 0.00 H new ATOM 0 HE1 PHE A 54 2.330 -0.041 9.159 1.00 0.00 H new ATOM 0 HE2 PHE A 54 1.590 0.197 4.946 1.00 0.00 H new ATOM 0 HZ PHE A 54 0.996 -0.687 7.178 1.00 0.00 H new ATOM 844 N ASP A 55 3.098 4.482 5.873 1.00 0.00 N ATOM 845 CA ASP A 55 1.745 5.051 5.601 1.00 0.00 C ATOM 846 C ASP A 55 0.833 4.031 4.924 1.00 0.00 C ATOM 847 O ASP A 55 -0.330 3.944 5.241 1.00 0.00 O ATOM 848 CB ASP A 55 1.987 6.246 4.679 1.00 0.00 C ATOM 849 CG ASP A 55 0.642 6.800 4.204 1.00 0.00 C ATOM 850 OD1 ASP A 55 -0.259 6.896 5.021 1.00 0.00 O ATOM 851 OD2 ASP A 55 0.535 7.118 3.031 1.00 0.00 O ATOM 0 H ASP A 55 3.572 4.067 5.071 1.00 0.00 H new ATOM 0 HA ASP A 55 1.245 5.337 6.526 1.00 0.00 H new ATOM 0 HB2 ASP A 55 2.546 7.019 5.206 1.00 0.00 H new ATOM 0 HB3 ASP A 55 2.591 5.943 3.824 1.00 0.00 H new ATOM 856 N ILE A 56 1.340 3.263 3.995 1.00 0.00 N ATOM 857 CA ILE A 56 0.471 2.254 3.313 1.00 0.00 C ATOM 858 C ILE A 56 1.294 1.027 2.929 1.00 0.00 C ATOM 859 O ILE A 56 2.490 1.113 2.728 1.00 0.00 O ATOM 860 CB ILE A 56 -0.066 2.952 2.065 1.00 0.00 C ATOM 861 CG1 ILE A 56 -0.807 4.231 2.470 1.00 0.00 C ATOM 862 CG2 ILE A 56 -1.023 2.015 1.327 1.00 0.00 C ATOM 863 CD1 ILE A 56 -1.647 4.735 1.294 1.00 0.00 C ATOM 0 H ILE A 56 2.310 3.289 3.680 1.00 0.00 H new ATOM 0 HA ILE A 56 -0.337 1.909 3.958 1.00 0.00 H new ATOM 0 HB ILE A 56 0.765 3.210 1.408 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.448 4.035 3.329 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -0.092 4.996 2.773 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.406 2.514 0.437 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.492 1.109 1.035 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -1.854 1.754 1.982 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.172 5.644 1.586 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.996 4.948 0.446 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.372 3.972 1.011 1.00 0.00 H new ATOM 875 N ALA A 57 0.676 -0.127 2.846 1.00 0.00 N ATOM 876 CA ALA A 57 1.460 -1.346 2.500 1.00 0.00 C ATOM 877 C ALA A 57 0.597 -2.317 1.710 1.00 0.00 C ATOM 878 O ALA A 57 -0.451 -2.733 2.163 1.00 0.00 O ATOM 879 CB ALA A 57 1.850 -1.956 3.845 1.00 0.00 C ATOM 0 H ALA A 57 -0.322 -0.273 3.001 1.00 0.00 H new ATOM 0 HA ALA A 57 2.330 -1.118 1.884 1.00 0.00 H new ATOM 0 HB1 ALA A 57 2.433 -2.862 3.678 1.00 0.00 H new ATOM 0 HB2 ALA A 57 2.447 -1.240 4.410 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.950 -2.202 4.408 1.00 0.00 H new ATOM 885 N ILE A 58 1.007 -2.682 0.529 1.00 0.00 N ATOM 886 CA ILE A 58 0.162 -3.615 -0.248 1.00 0.00 C ATOM 887 C ILE A 58 0.969 -4.752 -0.869 1.00 0.00 C ATOM 888 O ILE A 58 1.546 -4.613 -1.929 1.00 0.00 O ATOM 889 CB ILE A 58 -0.468 -2.758 -1.341 1.00 0.00 C ATOM 890 CG1 ILE A 58 -1.225 -1.595 -0.699 1.00 0.00 C ATOM 891 CG2 ILE A 58 -1.440 -3.610 -2.159 1.00 0.00 C ATOM 892 CD1 ILE A 58 -0.264 -0.430 -0.464 1.00 0.00 C ATOM 0 H ILE A 58 1.872 -2.381 0.079 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.576 -4.096 0.394 1.00 0.00 H new ATOM 0 HB ILE A 58 0.312 -2.369 -1.995 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.045 -1.280 -1.345 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.667 -1.912 0.246 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.891 -2.998 -2.941 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.901 -4.441 -2.614 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.222 -3.998 -1.506 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -0.803 0.400 -0.006 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.540 -0.750 0.199 1.00 0.00 H new ATOM 0 HD13 ILE A 58 0.157 -0.108 -1.416 1.00 0.00 H new ATOM 904 N ILE A 59 0.943 -5.902 -0.259 1.00 0.00 N ATOM 905 CA ILE A 59 1.629 -7.070 -0.867 1.00 0.00 C ATOM 906 C ILE A 59 0.616 -7.606 -1.873 1.00 0.00 C ATOM 907 O ILE A 59 0.060 -8.679 -1.747 1.00 0.00 O ATOM 908 CB ILE A 59 1.882 -8.045 0.293 1.00 0.00 C ATOM 909 CG1 ILE A 59 3.240 -7.750 0.916 1.00 0.00 C ATOM 910 CG2 ILE A 59 1.888 -9.486 -0.216 1.00 0.00 C ATOM 911 CD1 ILE A 59 3.233 -6.365 1.554 1.00 0.00 C ATOM 0 H ILE A 59 0.478 -6.082 0.631 1.00 0.00 H new ATOM 0 HA ILE A 59 2.578 -6.873 -1.365 1.00 0.00 H new ATOM 0 HB ILE A 59 1.089 -7.921 1.030 1.00 0.00 H new ATOM 0 HG12 ILE A 59 3.476 -8.504 1.667 1.00 0.00 H new ATOM 0 HG13 ILE A 59 4.018 -7.804 0.154 1.00 0.00 H new ATOM 0 HG21 ILE A 59 2.068 -10.165 0.617 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.924 -9.716 -0.669 1.00 0.00 H new ATOM 0 HG23 ILE A 59 2.676 -9.606 -0.959 1.00 0.00 H new ATOM 0 HD11 ILE A 59 4.208 -6.163 1.997 1.00 0.00 H new ATOM 0 HD12 ILE A 59 3.018 -5.615 0.793 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.468 -6.325 2.329 1.00 0.00 H new ATOM 923 N ASP A 60 0.321 -6.780 -2.839 1.00 0.00 N ATOM 924 CA ASP A 60 -0.713 -7.110 -3.852 1.00 0.00 C ATOM 925 C ASP A 60 -0.431 -8.441 -4.553 1.00 0.00 C ATOM 926 O ASP A 60 0.546 -9.116 -4.295 1.00 0.00 O ATOM 927 CB ASP A 60 -0.678 -5.913 -4.823 1.00 0.00 C ATOM 928 CG ASP A 60 -0.777 -6.360 -6.290 1.00 0.00 C ATOM 929 OD1 ASP A 60 -1.835 -6.823 -6.684 1.00 0.00 O ATOM 930 OD2 ASP A 60 0.207 -6.220 -6.994 1.00 0.00 O ATOM 0 H ASP A 60 0.765 -5.871 -2.969 1.00 0.00 H new ATOM 0 HA ASP A 60 -1.699 -7.251 -3.409 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -1.501 -5.236 -4.594 1.00 0.00 H new ATOM 0 HB3 ASP A 60 0.246 -5.353 -4.676 1.00 0.00 H new ATOM 935 N VAL A 61 -1.315 -8.809 -5.435 1.00 0.00 N ATOM 936 CA VAL A 61 -1.182 -10.080 -6.184 1.00 0.00 C ATOM 937 C VAL A 61 -1.074 -11.251 -5.201 1.00 0.00 C ATOM 938 O VAL A 61 -0.012 -11.672 -4.790 1.00 0.00 O ATOM 939 CB VAL A 61 0.046 -9.889 -7.096 1.00 0.00 C ATOM 940 CG1 VAL A 61 1.216 -10.785 -6.690 1.00 0.00 C ATOM 941 CG2 VAL A 61 -0.354 -10.220 -8.536 1.00 0.00 C ATOM 0 H VAL A 61 -2.145 -8.265 -5.672 1.00 0.00 H new ATOM 0 HA VAL A 61 -2.047 -10.322 -6.802 1.00 0.00 H new ATOM 0 HB VAL A 61 0.373 -8.853 -7.003 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.056 -10.613 -7.363 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.516 -10.552 -5.668 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.912 -11.830 -6.749 1.00 0.00 H new ATOM 0 HG21 VAL A 61 0.507 -10.089 -9.192 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -0.697 -11.253 -8.590 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.157 -9.554 -8.853 1.00 0.00 H new ATOM 951 N ASN A 62 -2.200 -11.753 -4.794 1.00 0.00 N ATOM 952 CA ASN A 62 -2.215 -12.866 -3.819 1.00 0.00 C ATOM 953 C ASN A 62 -3.241 -13.913 -4.227 1.00 0.00 C ATOM 954 O ASN A 62 -4.285 -13.596 -4.757 1.00 0.00 O ATOM 955 CB ASN A 62 -2.619 -12.248 -2.475 1.00 0.00 C ATOM 956 CG ASN A 62 -1.632 -11.151 -2.056 1.00 0.00 C ATOM 957 OD1 ASN A 62 -1.994 -10.241 -1.336 1.00 0.00 O ATOM 958 ND2 ASN A 62 -0.400 -11.190 -2.478 1.00 0.00 N ATOM 0 H ASN A 62 -3.120 -11.435 -5.100 1.00 0.00 H new ATOM 0 HA ASN A 62 -1.243 -13.356 -3.766 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -3.623 -11.830 -2.550 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -2.653 -13.023 -1.710 1.00 0.00 H new ATOM 0 HD21 ASN A 62 0.256 -10.459 -2.204 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -0.092 -11.952 -3.082 1.00 0.00 H new ATOM 965 N LEU A 63 -2.941 -15.149 -3.967 1.00 0.00 N ATOM 966 CA LEU A 63 -3.868 -16.262 -4.295 1.00 0.00 C ATOM 967 C LEU A 63 -3.148 -17.558 -3.929 1.00 0.00 C ATOM 968 O LEU A 63 -2.107 -17.523 -3.303 1.00 0.00 O ATOM 969 CB LEU A 63 -4.139 -16.129 -5.798 1.00 0.00 C ATOM 970 CG LEU A 63 -5.654 -15.991 -6.085 1.00 0.00 C ATOM 971 CD1 LEU A 63 -6.359 -15.076 -5.064 1.00 0.00 C ATOM 972 CD2 LEU A 63 -5.845 -15.383 -7.479 1.00 0.00 C ATOM 0 H LEU A 63 -2.068 -15.443 -3.529 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.817 -16.249 -3.758 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -3.612 -15.259 -6.189 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.746 -17.002 -6.319 1.00 0.00 H new ATOM 0 HG LEU A 63 -6.092 -16.987 -6.017 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -7.420 -15.010 -5.306 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.241 -15.489 -4.062 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.916 -14.081 -5.100 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -6.910 -15.282 -7.689 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -5.373 -14.401 -7.515 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.388 -16.033 -8.225 1.00 0.00 H new ATOM 984 N ASP A 64 -3.663 -18.696 -4.274 1.00 0.00 N ATOM 985 CA ASP A 64 -2.941 -19.935 -3.879 1.00 0.00 C ATOM 986 C ASP A 64 -2.679 -19.892 -2.373 1.00 0.00 C ATOM 987 O ASP A 64 -1.574 -20.129 -1.928 1.00 0.00 O ATOM 988 CB ASP A 64 -1.603 -19.863 -4.622 1.00 0.00 C ATOM 989 CG ASP A 64 -1.731 -20.546 -5.984 1.00 0.00 C ATOM 990 OD1 ASP A 64 -2.852 -20.727 -6.431 1.00 0.00 O ATOM 991 OD2 ASP A 64 -0.706 -20.877 -6.559 1.00 0.00 O ATOM 0 H ASP A 64 -4.528 -18.827 -4.798 1.00 0.00 H new ATOM 0 HA ASP A 64 -3.499 -20.842 -4.113 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -1.305 -18.823 -4.753 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -0.823 -20.347 -4.034 1.00 0.00 H new ATOM 996 N GLY A 65 -3.659 -19.550 -1.582 1.00 0.00 N ATOM 997 CA GLY A 65 -3.398 -19.456 -0.120 1.00 0.00 C ATOM 998 C GLY A 65 -2.229 -18.491 0.057 1.00 0.00 C ATOM 999 O GLY A 65 -1.381 -18.664 0.909 1.00 0.00 O ATOM 0 H GLY A 65 -4.611 -19.335 -1.878 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.281 -19.095 0.408 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -3.157 -20.435 0.294 1.00 0.00 H new ATOM 1003 N GLU A 66 -2.189 -17.497 -0.794 1.00 0.00 N ATOM 1004 CA GLU A 66 -1.094 -16.479 -0.794 1.00 0.00 C ATOM 1005 C GLU A 66 -0.241 -16.488 0.470 1.00 0.00 C ATOM 1006 O GLU A 66 -0.751 -16.414 1.570 1.00 0.00 O ATOM 1007 CB GLU A 66 -1.785 -15.124 -0.885 1.00 0.00 C ATOM 1008 CG GLU A 66 -0.711 -14.031 -0.823 1.00 0.00 C ATOM 1009 CD GLU A 66 0.101 -14.032 -2.116 1.00 0.00 C ATOM 1010 OE1 GLU A 66 -0.143 -14.895 -2.944 1.00 0.00 O ATOM 1011 OE2 GLU A 66 0.957 -13.175 -2.257 1.00 0.00 O ATOM 0 H GLU A 66 -2.896 -17.345 -1.514 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.420 -16.697 -1.622 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -2.351 -15.048 -1.813 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -2.496 -15.005 -0.067 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -1.178 -13.057 -0.676 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -0.054 -14.201 0.030 1.00 0.00 H new ATOM 1018 N PRO A 67 1.043 -16.497 0.255 1.00 0.00 N ATOM 1019 CA PRO A 67 2.006 -16.416 1.376 1.00 0.00 C ATOM 1020 C PRO A 67 1.837 -15.075 2.110 1.00 0.00 C ATOM 1021 O PRO A 67 1.421 -15.030 3.250 1.00 0.00 O ATOM 1022 CB PRO A 67 3.367 -16.521 0.674 1.00 0.00 C ATOM 1023 CG PRO A 67 3.103 -16.104 -0.735 1.00 0.00 C ATOM 1024 CD PRO A 67 1.723 -16.591 -1.042 1.00 0.00 C ATOM 0 HA PRO A 67 1.876 -17.187 2.135 1.00 0.00 H new ATOM 0 HB2 PRO A 67 4.106 -15.874 1.146 1.00 0.00 H new ATOM 0 HB3 PRO A 67 3.758 -17.538 0.719 1.00 0.00 H new ATOM 0 HG2 PRO A 67 3.171 -15.022 -0.843 1.00 0.00 H new ATOM 0 HG3 PRO A 67 3.834 -16.539 -1.417 1.00 0.00 H new ATOM 0 HD2 PRO A 67 1.237 -15.975 -1.798 1.00 0.00 H new ATOM 0 HD3 PRO A 67 1.731 -17.613 -1.420 1.00 0.00 H new ATOM 1032 N SER A 68 2.151 -13.985 1.459 1.00 0.00 N ATOM 1033 CA SER A 68 2.009 -12.637 2.100 1.00 0.00 C ATOM 1034 C SER A 68 2.969 -12.474 3.281 1.00 0.00 C ATOM 1035 O SER A 68 2.989 -11.443 3.922 1.00 0.00 O ATOM 1036 CB SER A 68 0.568 -12.563 2.608 1.00 0.00 C ATOM 1037 OG SER A 68 -0.278 -13.342 1.780 1.00 0.00 O ATOM 0 H SER A 68 2.503 -13.968 0.502 1.00 0.00 H new ATOM 0 HA SER A 68 2.242 -11.849 1.384 1.00 0.00 H new ATOM 0 HB2 SER A 68 0.517 -12.923 3.636 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.229 -11.527 2.616 1.00 0.00 H new ATOM 0 HG SER A 68 -1.198 -13.291 2.113 1.00 0.00 H new ATOM 1043 N TYR A 69 3.759 -13.472 3.578 1.00 0.00 N ATOM 1044 CA TYR A 69 4.700 -13.376 4.727 1.00 0.00 C ATOM 1045 C TYR A 69 3.916 -12.958 5.969 1.00 0.00 C ATOM 1046 O TYR A 69 2.779 -12.520 5.884 1.00 0.00 O ATOM 1047 CB TYR A 69 5.789 -12.330 4.384 1.00 0.00 C ATOM 1048 CG TYR A 69 5.603 -11.744 2.998 1.00 0.00 C ATOM 1049 CD1 TYR A 69 5.493 -12.578 1.878 1.00 0.00 C ATOM 1050 CD2 TYR A 69 5.525 -10.359 2.842 1.00 0.00 C ATOM 1051 CE1 TYR A 69 5.307 -12.019 0.610 1.00 0.00 C ATOM 1052 CE2 TYR A 69 5.341 -9.800 1.580 1.00 0.00 C ATOM 1053 CZ TYR A 69 5.229 -10.629 0.458 1.00 0.00 C ATOM 1054 OH TYR A 69 5.048 -10.079 -0.795 1.00 0.00 O ATOM 0 H TYR A 69 3.791 -14.355 3.069 1.00 0.00 H new ATOM 0 HA TYR A 69 5.180 -14.335 4.922 1.00 0.00 H new ATOM 0 HB2 TYR A 69 5.766 -11.528 5.122 1.00 0.00 H new ATOM 0 HB3 TYR A 69 6.772 -12.796 4.451 1.00 0.00 H new ATOM 0 HD1 TYR A 69 5.552 -13.650 1.994 1.00 0.00 H new ATOM 0 HD2 TYR A 69 5.608 -9.717 3.706 1.00 0.00 H new ATOM 0 HE1 TYR A 69 5.223 -12.661 -0.255 1.00 0.00 H new ATOM 0 HE2 TYR A 69 5.285 -8.727 1.467 1.00 0.00 H new ATOM 0 HH TYR A 69 4.539 -10.701 -1.355 1.00 0.00 H new ATOM 1064 N PRO A 70 4.537 -13.124 7.092 1.00 0.00 N ATOM 1065 CA PRO A 70 3.876 -12.774 8.361 1.00 0.00 C ATOM 1066 C PRO A 70 3.725 -11.266 8.502 1.00 0.00 C ATOM 1067 O PRO A 70 3.139 -10.794 9.444 1.00 0.00 O ATOM 1068 CB PRO A 70 4.810 -13.330 9.421 1.00 0.00 C ATOM 1069 CG PRO A 70 6.149 -13.403 8.759 1.00 0.00 C ATOM 1070 CD PRO A 70 5.893 -13.642 7.293 1.00 0.00 C ATOM 0 HA PRO A 70 2.867 -13.179 8.435 1.00 0.00 H new ATOM 0 HB2 PRO A 70 4.839 -12.685 10.299 1.00 0.00 H new ATOM 0 HB3 PRO A 70 4.483 -14.313 9.759 1.00 0.00 H new ATOM 0 HG2 PRO A 70 6.706 -12.478 8.909 1.00 0.00 H new ATOM 0 HG3 PRO A 70 6.748 -14.209 9.184 1.00 0.00 H new ATOM 0 HD2 PRO A 70 6.618 -13.120 6.669 1.00 0.00 H new ATOM 0 HD3 PRO A 70 5.959 -14.701 7.042 1.00 0.00 H new ATOM 1078 N VAL A 71 4.224 -10.494 7.583 1.00 0.00 N ATOM 1079 CA VAL A 71 4.051 -9.028 7.734 1.00 0.00 C ATOM 1080 C VAL A 71 2.796 -8.582 6.979 1.00 0.00 C ATOM 1081 O VAL A 71 1.923 -7.961 7.544 1.00 0.00 O ATOM 1082 CB VAL A 71 5.327 -8.379 7.189 1.00 0.00 C ATOM 1083 CG1 VAL A 71 6.543 -8.991 7.886 1.00 0.00 C ATOM 1084 CG2 VAL A 71 5.439 -8.620 5.691 1.00 0.00 C ATOM 0 H VAL A 71 4.732 -10.804 6.754 1.00 0.00 H new ATOM 0 HA VAL A 71 3.909 -8.730 8.773 1.00 0.00 H new ATOM 0 HB VAL A 71 5.288 -7.306 7.378 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.453 -8.531 7.500 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.474 -8.815 8.959 1.00 0.00 H new ATOM 0 HG13 VAL A 71 6.570 -10.064 7.696 1.00 0.00 H new ATOM 0 HG21 VAL A 71 6.350 -8.154 5.315 1.00 0.00 H new ATOM 0 HG22 VAL A 71 5.473 -9.692 5.496 1.00 0.00 H new ATOM 0 HG23 VAL A 71 4.575 -8.187 5.187 1.00 0.00 H new ATOM 1094 N ALA A 72 2.669 -8.921 5.722 1.00 0.00 N ATOM 1095 CA ALA A 72 1.446 -8.533 4.975 1.00 0.00 C ATOM 1096 C ALA A 72 0.201 -8.938 5.755 1.00 0.00 C ATOM 1097 O ALA A 72 -0.681 -8.137 6.011 1.00 0.00 O ATOM 1098 CB ALA A 72 1.518 -9.344 3.697 1.00 0.00 C ATOM 0 H ALA A 72 3.359 -9.448 5.186 1.00 0.00 H new ATOM 0 HA ALA A 72 1.391 -7.458 4.801 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.650 -9.123 3.076 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.427 -9.087 3.154 1.00 0.00 H new ATOM 0 HB3 ALA A 72 1.529 -10.406 3.940 1.00 0.00 H new ATOM 1104 N ASP A 73 0.115 -10.185 6.136 1.00 0.00 N ATOM 1105 CA ASP A 73 -1.087 -10.629 6.885 1.00 0.00 C ATOM 1106 C ASP A 73 -1.153 -9.937 8.237 1.00 0.00 C ATOM 1107 O ASP A 73 -2.138 -9.315 8.580 1.00 0.00 O ATOM 1108 CB ASP A 73 -0.910 -12.123 7.074 1.00 0.00 C ATOM 1109 CG ASP A 73 -1.589 -12.874 5.928 1.00 0.00 C ATOM 1110 OD1 ASP A 73 -2.757 -12.615 5.687 1.00 0.00 O ATOM 1111 OD2 ASP A 73 -0.932 -13.695 5.312 1.00 0.00 O ATOM 0 H ASP A 73 0.817 -10.904 5.962 1.00 0.00 H new ATOM 0 HA ASP A 73 -2.008 -10.388 6.354 1.00 0.00 H new ATOM 0 HB2 ASP A 73 0.151 -12.372 7.106 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -1.339 -12.432 8.028 1.00 0.00 H new ATOM 1116 N ILE A 74 -0.109 -10.036 9.008 1.00 0.00 N ATOM 1117 CA ILE A 74 -0.123 -9.374 10.337 1.00 0.00 C ATOM 1118 C ILE A 74 -0.429 -7.900 10.150 1.00 0.00 C ATOM 1119 O ILE A 74 -1.154 -7.300 10.917 1.00 0.00 O ATOM 1120 CB ILE A 74 1.278 -9.541 10.896 1.00 0.00 C ATOM 1121 CG1 ILE A 74 1.489 -11.004 11.306 1.00 0.00 C ATOM 1122 CG2 ILE A 74 1.438 -8.639 12.122 1.00 0.00 C ATOM 1123 CD1 ILE A 74 2.852 -11.158 11.977 1.00 0.00 C ATOM 0 H ILE A 74 0.746 -10.542 8.778 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.873 -9.800 11.004 1.00 0.00 H new ATOM 0 HB ILE A 74 2.014 -9.266 10.140 1.00 0.00 H new ATOM 0 HG12 ILE A 74 0.699 -11.318 11.988 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.429 -11.650 10.430 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.442 -8.754 12.529 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.280 -7.600 11.832 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.705 -8.920 12.879 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.999 -12.198 12.267 1.00 0.00 H new ATOM 0 HD12 ILE A 74 3.636 -10.861 11.280 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.895 -10.525 12.863 1.00 0.00 H new ATOM 1135 N LEU A 75 0.112 -7.315 9.121 1.00 0.00 N ATOM 1136 CA LEU A 75 -0.159 -5.882 8.877 1.00 0.00 C ATOM 1137 C LEU A 75 -1.666 -5.655 8.943 1.00 0.00 C ATOM 1138 O LEU A 75 -2.139 -4.643 9.420 1.00 0.00 O ATOM 1139 CB LEU A 75 0.386 -5.621 7.477 1.00 0.00 C ATOM 1140 CG LEU A 75 0.414 -4.125 7.223 1.00 0.00 C ATOM 1141 CD1 LEU A 75 1.259 -3.459 8.306 1.00 0.00 C ATOM 1142 CD2 LEU A 75 1.034 -3.870 5.851 1.00 0.00 C ATOM 0 H LEU A 75 0.726 -7.768 8.444 1.00 0.00 H new ATOM 0 HA LEU A 75 0.301 -5.215 9.606 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.389 -6.037 7.381 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -0.237 -6.117 6.733 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.596 -3.715 7.246 1.00 0.00 H new ATOM 0 HD11 LEU A 75 1.287 -2.383 8.135 1.00 0.00 H new ATOM 0 HD12 LEU A 75 0.821 -3.660 9.284 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.273 -3.858 8.274 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.060 -2.798 5.657 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.049 -4.267 5.831 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.436 -4.363 5.084 1.00 0.00 H new ATOM 1154 N ALA A 76 -2.419 -6.614 8.486 1.00 0.00 N ATOM 1155 CA ALA A 76 -3.892 -6.501 8.533 1.00 0.00 C ATOM 1156 C ALA A 76 -4.389 -6.976 9.896 1.00 0.00 C ATOM 1157 O ALA A 76 -5.249 -6.371 10.494 1.00 0.00 O ATOM 1158 CB ALA A 76 -4.389 -7.421 7.431 1.00 0.00 C ATOM 0 H ALA A 76 -2.067 -7.480 8.078 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.246 -5.479 8.393 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.478 -7.395 7.399 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -3.990 -7.089 6.473 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.056 -8.440 7.630 1.00 0.00 H new ATOM 1164 N GLU A 77 -3.835 -8.046 10.406 1.00 0.00 N ATOM 1165 CA GLU A 77 -4.269 -8.524 11.747 1.00 0.00 C ATOM 1166 C GLU A 77 -4.229 -7.341 12.709 1.00 0.00 C ATOM 1167 O GLU A 77 -4.920 -7.301 13.707 1.00 0.00 O ATOM 1168 CB GLU A 77 -3.240 -9.578 12.156 1.00 0.00 C ATOM 1169 CG GLU A 77 -3.452 -10.858 11.344 1.00 0.00 C ATOM 1170 CD GLU A 77 -3.141 -12.072 12.223 1.00 0.00 C ATOM 1171 OE1 GLU A 77 -2.668 -11.871 13.329 1.00 0.00 O ATOM 1172 OE2 GLU A 77 -3.384 -13.180 11.775 1.00 0.00 O ATOM 0 H GLU A 77 -3.109 -8.602 9.955 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.277 -8.938 11.750 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -2.232 -9.197 11.993 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -3.331 -9.793 13.221 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -4.480 -10.908 10.985 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -2.807 -10.856 10.465 1.00 0.00 H new ATOM 1179 N ARG A 78 -3.423 -6.369 12.388 1.00 0.00 N ATOM 1180 CA ARG A 78 -3.316 -5.157 13.244 1.00 0.00 C ATOM 1181 C ARG A 78 -3.778 -3.933 12.449 1.00 0.00 C ATOM 1182 O ARG A 78 -4.111 -2.902 12.999 1.00 0.00 O ATOM 1183 CB ARG A 78 -1.835 -5.048 13.621 1.00 0.00 C ATOM 1184 CG ARG A 78 -1.019 -4.570 12.418 1.00 0.00 C ATOM 1185 CD ARG A 78 -0.289 -3.273 12.783 1.00 0.00 C ATOM 1186 NE ARG A 78 0.733 -3.675 13.795 1.00 0.00 N ATOM 1187 CZ ARG A 78 1.470 -2.768 14.380 1.00 0.00 C ATOM 1188 NH1 ARG A 78 1.681 -1.621 13.791 1.00 0.00 N ATOM 1189 NH2 ARG A 78 1.994 -3.008 15.555 1.00 0.00 N ATOM 0 H ARG A 78 -2.828 -6.363 11.560 1.00 0.00 H new ATOM 0 HA ARG A 78 -3.939 -5.216 14.136 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -1.714 -4.353 14.452 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -1.466 -6.016 13.959 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -0.300 -5.335 12.125 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.674 -4.404 11.563 1.00 0.00 H new ATOM 0 HD2 ARG A 78 0.179 -2.824 11.907 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -0.978 -2.534 13.191 1.00 0.00 H new ATOM 0 HE ARG A 78 0.856 -4.660 14.030 1.00 0.00 H new ATOM 0 HH11 ARG A 78 1.271 -1.434 12.876 1.00 0.00 H new ATOM 0 HH12 ARG A 78 2.256 -0.912 14.246 1.00 0.00 H new ATOM 0 HH21 ARG A 78 1.827 -3.903 16.015 1.00 0.00 H new ATOM 0 HH22 ARG A 78 2.569 -2.300 16.011 1.00 0.00 H new ATOM 1203 N ASN A 79 -3.820 -4.068 11.151 1.00 0.00 N ATOM 1204 CA ASN A 79 -4.278 -2.965 10.260 1.00 0.00 C ATOM 1205 C ASN A 79 -3.974 -1.572 10.823 1.00 0.00 C ATOM 1206 O ASN A 79 -4.721 -1.024 11.608 1.00 0.00 O ATOM 1207 CB ASN A 79 -5.789 -3.166 10.129 1.00 0.00 C ATOM 1208 CG ASN A 79 -6.387 -3.547 11.484 1.00 0.00 C ATOM 1209 OD1 ASN A 79 -6.996 -2.732 12.148 1.00 0.00 O ATOM 1210 ND2 ASN A 79 -6.239 -4.766 11.919 1.00 0.00 N ATOM 0 H ASN A 79 -3.549 -4.920 10.659 1.00 0.00 H new ATOM 0 HA ASN A 79 -3.755 -3.005 9.305 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -6.255 -2.252 9.761 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -5.998 -3.947 9.398 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -6.635 -5.038 12.819 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -5.727 -5.448 11.360 1.00 0.00 H new ATOM 1217 N VAL A 80 -2.908 -0.982 10.365 1.00 0.00 N ATOM 1218 CA VAL A 80 -2.549 0.402 10.786 1.00 0.00 C ATOM 1219 C VAL A 80 -3.041 1.325 9.660 1.00 0.00 C ATOM 1220 O VAL A 80 -3.560 0.830 8.679 1.00 0.00 O ATOM 1221 CB VAL A 80 -1.007 0.365 10.894 1.00 0.00 C ATOM 1222 CG1 VAL A 80 -0.351 1.095 9.713 1.00 0.00 C ATOM 1223 CG2 VAL A 80 -0.561 1.019 12.203 1.00 0.00 C ATOM 0 H VAL A 80 -2.257 -1.407 9.704 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.982 0.751 11.724 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.693 -0.679 10.875 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.733 1.053 9.816 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -0.646 0.615 8.780 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.674 2.136 9.704 1.00 0.00 H new ATOM 0 HG21 VAL A 80 0.526 0.989 12.272 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.898 2.055 12.225 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -0.993 0.479 13.045 1.00 0.00 H new ATOM 1233 N PRO A 81 -2.855 2.614 9.773 1.00 0.00 N ATOM 1234 CA PRO A 81 -3.297 3.482 8.665 1.00 0.00 C ATOM 1235 C PRO A 81 -2.534 3.043 7.421 1.00 0.00 C ATOM 1236 O PRO A 81 -1.320 3.059 7.383 1.00 0.00 O ATOM 1237 CB PRO A 81 -2.948 4.889 9.139 1.00 0.00 C ATOM 1238 CG PRO A 81 -1.884 4.680 10.168 1.00 0.00 C ATOM 1239 CD PRO A 81 -2.236 3.383 10.856 1.00 0.00 C ATOM 0 HA PRO A 81 -4.356 3.435 8.412 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.590 5.508 8.317 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -3.817 5.393 9.562 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.898 4.624 9.707 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -1.858 5.506 10.878 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -1.354 2.883 11.257 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -2.922 3.537 11.689 1.00 0.00 H new ATOM 1247 N PHE A 82 -3.241 2.589 6.428 1.00 0.00 N ATOM 1248 CA PHE A 82 -2.558 2.072 5.209 1.00 0.00 C ATOM 1249 C PHE A 82 -3.566 1.647 4.143 1.00 0.00 C ATOM 1250 O PHE A 82 -4.557 2.306 3.902 1.00 0.00 O ATOM 1251 CB PHE A 82 -1.771 0.855 5.706 1.00 0.00 C ATOM 1252 CG PHE A 82 -2.706 -0.253 6.174 1.00 0.00 C ATOM 1253 CD1 PHE A 82 -4.097 -0.051 6.280 1.00 0.00 C ATOM 1254 CD2 PHE A 82 -2.163 -1.494 6.521 1.00 0.00 C ATOM 1255 CE1 PHE A 82 -4.924 -1.086 6.731 1.00 0.00 C ATOM 1256 CE2 PHE A 82 -2.995 -2.528 6.969 1.00 0.00 C ATOM 1257 CZ PHE A 82 -4.374 -2.323 7.076 1.00 0.00 C ATOM 0 H PHE A 82 -4.260 2.553 6.405 1.00 0.00 H new ATOM 0 HA PHE A 82 -1.927 2.830 4.745 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -1.132 0.481 4.906 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -1.116 1.152 6.525 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -4.525 0.904 6.013 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -1.098 -1.656 6.443 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -5.989 -0.928 6.812 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -2.570 -3.486 7.232 1.00 0.00 H new ATOM 0 HZ PHE A 82 -5.013 -3.120 7.425 1.00 0.00 H new ATOM 1267 N ILE A 83 -3.320 0.534 3.516 1.00 0.00 N ATOM 1268 CA ILE A 83 -4.249 0.039 2.482 1.00 0.00 C ATOM 1269 C ILE A 83 -3.681 -1.245 1.899 1.00 0.00 C ATOM 1270 O ILE A 83 -2.521 -1.580 2.122 1.00 0.00 O ATOM 1271 CB ILE A 83 -4.319 1.169 1.459 1.00 0.00 C ATOM 1272 CG1 ILE A 83 -5.770 1.625 1.294 1.00 0.00 C ATOM 1273 CG2 ILE A 83 -3.770 0.729 0.098 1.00 0.00 C ATOM 1274 CD1 ILE A 83 -5.797 2.922 0.486 1.00 0.00 C ATOM 0 H ILE A 83 -2.505 -0.056 3.682 1.00 0.00 H new ATOM 0 HA ILE A 83 -5.246 -0.202 2.850 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.705 1.992 1.826 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -6.351 0.854 0.788 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.229 1.780 2.270 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -3.835 1.559 -0.606 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -2.729 0.426 0.206 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -4.355 -0.111 -0.276 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -6.828 3.253 0.364 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -5.229 3.690 1.011 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -5.353 2.749 -0.494 1.00 0.00 H new ATOM 1286 N PHE A 84 -4.491 -1.962 1.175 1.00 0.00 N ATOM 1287 CA PHE A 84 -4.030 -3.238 0.589 1.00 0.00 C ATOM 1288 C PHE A 84 -4.866 -3.601 -0.647 1.00 0.00 C ATOM 1289 O PHE A 84 -6.010 -3.186 -0.821 1.00 0.00 O ATOM 1290 CB PHE A 84 -4.258 -4.227 1.719 1.00 0.00 C ATOM 1291 CG PHE A 84 -3.240 -5.346 1.666 1.00 0.00 C ATOM 1292 CD1 PHE A 84 -3.299 -6.309 0.650 1.00 0.00 C ATOM 1293 CD2 PHE A 84 -2.241 -5.425 2.646 1.00 0.00 C ATOM 1294 CE1 PHE A 84 -2.357 -7.347 0.614 1.00 0.00 C ATOM 1295 CE2 PHE A 84 -1.300 -6.462 2.607 1.00 0.00 C ATOM 1296 CZ PHE A 84 -1.360 -7.422 1.590 1.00 0.00 C ATOM 0 H PHE A 84 -5.458 -1.713 0.965 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.996 -3.213 0.244 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -4.191 -3.713 2.678 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -5.264 -4.641 1.649 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.069 -6.252 -0.105 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -2.197 -4.686 3.432 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -2.402 -8.089 -0.169 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -0.529 -6.521 3.361 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.635 -8.222 1.560 1.00 0.00 H new ATOM 1306 N ALA A 85 -4.318 -4.377 -1.520 1.00 0.00 N ATOM 1307 CA ALA A 85 -5.097 -4.742 -2.716 1.00 0.00 C ATOM 1308 C ALA A 85 -4.503 -5.971 -3.392 1.00 0.00 C ATOM 1309 O ALA A 85 -3.375 -5.966 -3.842 1.00 0.00 O ATOM 1310 CB ALA A 85 -5.013 -3.515 -3.630 1.00 0.00 C ATOM 0 H ALA A 85 -3.379 -4.770 -1.461 1.00 0.00 H new ATOM 0 HA ALA A 85 -6.128 -4.998 -2.474 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -5.570 -3.706 -4.547 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -5.439 -2.651 -3.120 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -3.970 -3.314 -3.874 1.00 0.00 H new ATOM 1316 N THR A 86 -5.266 -7.024 -3.472 1.00 0.00 N ATOM 1317 CA THR A 86 -4.760 -8.251 -4.124 1.00 0.00 C ATOM 1318 C THR A 86 -5.914 -9.193 -4.464 1.00 0.00 C ATOM 1319 O THR A 86 -7.064 -8.872 -4.262 1.00 0.00 O ATOM 1320 CB THR A 86 -3.833 -8.874 -3.095 1.00 0.00 C ATOM 1321 OG1 THR A 86 -3.302 -10.059 -3.623 1.00 0.00 O ATOM 1322 CG2 THR A 86 -4.596 -9.166 -1.800 1.00 0.00 C ATOM 0 H THR A 86 -6.219 -7.083 -3.112 1.00 0.00 H new ATOM 0 HA THR A 86 -4.249 -8.044 -5.064 1.00 0.00 H new ATOM 0 HB THR A 86 -3.024 -8.181 -2.864 1.00 0.00 H new ATOM 0 HG1 THR A 86 -3.296 -10.007 -4.602 1.00 0.00 H new ATOM 0 HG21 THR A 86 -3.919 -9.612 -1.072 1.00 0.00 H new ATOM 0 HG22 THR A 86 -5.000 -8.237 -1.398 1.00 0.00 H new ATOM 0 HG23 THR A 86 -5.413 -9.857 -2.007 1.00 0.00 H new ATOM 1330 N GLY A 87 -5.598 -10.341 -5.003 1.00 0.00 N ATOM 1331 CA GLY A 87 -6.637 -11.341 -5.405 1.00 0.00 C ATOM 1332 C GLY A 87 -7.918 -11.217 -4.566 1.00 0.00 C ATOM 1333 O GLY A 87 -9.009 -11.188 -5.099 1.00 0.00 O ATOM 0 H GLY A 87 -4.639 -10.636 -5.187 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.881 -11.206 -6.459 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -6.231 -12.347 -5.298 1.00 0.00 H new ATOM 1337 N TYR A 88 -7.806 -11.162 -3.266 1.00 0.00 N ATOM 1338 CA TYR A 88 -9.040 -11.064 -2.423 1.00 0.00 C ATOM 1339 C TYR A 88 -9.266 -9.628 -1.949 1.00 0.00 C ATOM 1340 O TYR A 88 -10.225 -9.335 -1.264 1.00 0.00 O ATOM 1341 CB TYR A 88 -8.793 -11.986 -1.226 1.00 0.00 C ATOM 1342 CG TYR A 88 -7.407 -11.750 -0.674 1.00 0.00 C ATOM 1343 CD1 TYR A 88 -7.108 -10.550 -0.016 1.00 0.00 C ATOM 1344 CD2 TYR A 88 -6.420 -12.730 -0.824 1.00 0.00 C ATOM 1345 CE1 TYR A 88 -5.823 -10.333 0.493 1.00 0.00 C ATOM 1346 CE2 TYR A 88 -5.135 -12.513 -0.315 1.00 0.00 C ATOM 1347 CZ TYR A 88 -4.837 -11.314 0.343 1.00 0.00 C ATOM 1348 OH TYR A 88 -3.570 -11.100 0.845 1.00 0.00 O ATOM 0 H TYR A 88 -6.925 -11.180 -2.752 1.00 0.00 H new ATOM 0 HA TYR A 88 -9.929 -11.352 -2.984 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -9.539 -11.800 -0.453 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -8.901 -13.027 -1.529 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -7.869 -9.793 0.098 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -6.650 -13.654 -1.333 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -5.592 -9.409 1.002 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.373 -13.270 -0.430 1.00 0.00 H new ATOM 0 HH TYR A 88 -2.951 -10.924 0.106 1.00 0.00 H new ATOM 1358 N GLY A 89 -8.393 -8.733 -2.305 1.00 0.00 N ATOM 1359 CA GLY A 89 -8.559 -7.320 -1.872 1.00 0.00 C ATOM 1360 C GLY A 89 -7.659 -7.057 -0.668 1.00 0.00 C ATOM 1361 O GLY A 89 -6.628 -6.425 -0.778 1.00 0.00 O ATOM 0 H GLY A 89 -7.570 -8.918 -2.878 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -8.302 -6.644 -2.688 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -9.600 -7.126 -1.613 1.00 0.00 H new ATOM 1365 N SER A 90 -8.040 -7.542 0.478 1.00 0.00 N ATOM 1366 CA SER A 90 -7.209 -7.325 1.697 1.00 0.00 C ATOM 1367 C SER A 90 -7.853 -7.996 2.914 1.00 0.00 C ATOM 1368 O SER A 90 -8.085 -7.364 3.923 1.00 0.00 O ATOM 1369 CB SER A 90 -7.179 -5.812 1.887 1.00 0.00 C ATOM 1370 OG SER A 90 -8.484 -5.352 2.210 1.00 0.00 O ATOM 0 H SER A 90 -8.893 -8.081 0.626 1.00 0.00 H new ATOM 0 HA SER A 90 -6.211 -7.750 1.591 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.481 -5.548 2.681 1.00 0.00 H new ATOM 0 HB3 SER A 90 -6.825 -5.327 0.977 1.00 0.00 H new ATOM 0 HG SER A 90 -8.817 -5.837 2.994 1.00 0.00 H new ATOM 1376 N LYS A 91 -8.146 -9.267 2.823 1.00 0.00 N ATOM 1377 CA LYS A 91 -8.782 -9.976 3.974 1.00 0.00 C ATOM 1378 C LYS A 91 -9.879 -9.095 4.586 1.00 0.00 C ATOM 1379 O LYS A 91 -11.014 -9.112 4.158 1.00 0.00 O ATOM 1380 CB LYS A 91 -7.653 -10.221 4.983 1.00 0.00 C ATOM 1381 CG LYS A 91 -6.472 -10.908 4.296 1.00 0.00 C ATOM 1382 CD LYS A 91 -5.270 -10.932 5.248 1.00 0.00 C ATOM 1383 CE LYS A 91 -5.081 -9.549 5.887 1.00 0.00 C ATOM 1384 NZ LYS A 91 -5.086 -8.590 4.743 1.00 0.00 N ATOM 0 H LYS A 91 -7.972 -9.845 2.001 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.252 -10.912 3.673 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -7.331 -9.274 5.416 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -8.016 -10.840 5.803 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -6.744 -11.924 4.011 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -6.213 -10.379 3.379 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -5.424 -11.682 6.023 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -4.370 -11.217 4.704 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -5.883 -9.327 6.591 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -4.145 -9.496 6.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -4.280 -7.938 4.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -5.008 -9.116 3.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -5.973 -8.047 4.749 1.00 0.00 H new ATOM 1398 N GLY A 92 -9.540 -8.316 5.576 1.00 0.00 N ATOM 1399 CA GLY A 92 -10.536 -7.421 6.216 1.00 0.00 C ATOM 1400 C GLY A 92 -9.779 -6.267 6.870 1.00 0.00 C ATOM 1401 O GLY A 92 -10.248 -5.648 7.803 1.00 0.00 O ATOM 0 H GLY A 92 -8.601 -8.263 5.972 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.241 -7.044 5.475 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.117 -7.967 6.960 1.00 0.00 H new ATOM 1405 N LEU A 93 -8.595 -5.989 6.386 1.00 0.00 N ATOM 1406 CA LEU A 93 -7.781 -4.889 6.972 1.00 0.00 C ATOM 1407 C LEU A 93 -8.686 -3.681 7.286 1.00 0.00 C ATOM 1408 O LEU A 93 -9.211 -3.032 6.403 1.00 0.00 O ATOM 1409 CB LEU A 93 -6.711 -4.588 5.897 1.00 0.00 C ATOM 1410 CG LEU A 93 -7.051 -3.328 5.092 1.00 0.00 C ATOM 1411 CD1 LEU A 93 -5.826 -2.893 4.287 1.00 0.00 C ATOM 1412 CD2 LEU A 93 -8.205 -3.632 4.133 1.00 0.00 C ATOM 0 H LEU A 93 -8.158 -6.481 5.607 1.00 0.00 H new ATOM 0 HA LEU A 93 -7.308 -5.145 7.920 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -5.740 -4.462 6.376 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -6.625 -5.439 5.221 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.343 -2.529 5.774 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -6.066 -1.997 3.714 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -5.001 -2.679 4.967 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.536 -3.693 3.605 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -8.448 -2.737 3.560 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -7.911 -4.430 3.452 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.079 -3.946 4.704 1.00 0.00 H new ATOM 1424 N ASP A 94 -8.904 -3.394 8.542 1.00 0.00 N ATOM 1425 CA ASP A 94 -9.794 -2.244 8.900 1.00 0.00 C ATOM 1426 C ASP A 94 -9.002 -1.096 9.538 1.00 0.00 C ATOM 1427 O ASP A 94 -8.468 -1.232 10.620 1.00 0.00 O ATOM 1428 CB ASP A 94 -10.806 -2.817 9.895 1.00 0.00 C ATOM 1429 CG ASP A 94 -10.107 -3.112 11.222 1.00 0.00 C ATOM 1430 OD1 ASP A 94 -9.613 -4.216 11.376 1.00 0.00 O ATOM 1431 OD2 ASP A 94 -10.076 -2.227 12.062 1.00 0.00 O ATOM 0 H ASP A 94 -8.508 -3.901 9.334 1.00 0.00 H new ATOM 0 HA ASP A 94 -10.274 -1.823 8.016 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -11.620 -2.109 10.050 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -11.249 -3.729 9.495 1.00 0.00 H new ATOM 1436 N THR A 95 -8.942 0.041 8.893 1.00 0.00 N ATOM 1437 CA THR A 95 -8.202 1.195 9.488 1.00 0.00 C ATOM 1438 C THR A 95 -8.924 2.511 9.152 1.00 0.00 C ATOM 1439 O THR A 95 -10.132 2.542 9.026 1.00 0.00 O ATOM 1440 CB THR A 95 -6.795 1.131 8.876 1.00 0.00 C ATOM 1441 OG1 THR A 95 -6.881 0.822 7.494 1.00 0.00 O ATOM 1442 CG2 THR A 95 -5.987 0.054 9.601 1.00 0.00 C ATOM 0 H THR A 95 -9.371 0.220 7.985 1.00 0.00 H new ATOM 0 HA THR A 95 -8.150 1.150 10.576 1.00 0.00 H new ATOM 0 HB THR A 95 -6.303 2.097 8.987 1.00 0.00 H new ATOM 0 HG1 THR A 95 -5.980 0.683 7.133 1.00 0.00 H new ATOM 0 HG21 THR A 95 -4.986 0.001 9.173 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.917 0.303 10.660 1.00 0.00 H new ATOM 0 HG23 THR A 95 -6.482 -0.910 9.487 1.00 0.00 H new ATOM 1450 N ARG A 96 -8.211 3.600 9.027 1.00 0.00 N ATOM 1451 CA ARG A 96 -8.879 4.902 8.726 1.00 0.00 C ATOM 1452 C ARG A 96 -9.283 4.997 7.250 1.00 0.00 C ATOM 1453 O ARG A 96 -9.661 6.048 6.772 1.00 0.00 O ATOM 1454 CB ARG A 96 -7.828 5.961 9.064 1.00 0.00 C ATOM 1455 CG ARG A 96 -7.458 5.845 10.543 1.00 0.00 C ATOM 1456 CD ARG A 96 -6.069 6.444 10.777 1.00 0.00 C ATOM 1457 NE ARG A 96 -5.378 5.473 11.670 1.00 0.00 N ATOM 1458 CZ ARG A 96 -5.289 5.710 12.951 1.00 0.00 C ATOM 1459 NH1 ARG A 96 -4.347 6.488 13.408 1.00 0.00 N ATOM 1460 NH2 ARG A 96 -6.146 5.175 13.777 1.00 0.00 N ATOM 0 H ARG A 96 -7.196 3.645 9.120 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.799 5.026 9.297 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -6.943 5.824 8.443 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -8.216 6.957 8.850 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -8.196 6.365 11.154 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -7.470 4.799 10.850 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -5.530 6.570 9.838 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -6.136 7.428 11.240 1.00 0.00 H new ATOM 0 HE ARG A 96 -4.974 4.621 11.280 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -3.679 6.912 12.764 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -4.279 6.672 14.409 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -6.887 4.570 13.422 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -6.075 5.361 14.777 1.00 0.00 H new ATOM 1474 N TYR A 97 -9.207 3.917 6.521 1.00 0.00 N ATOM 1475 CA TYR A 97 -9.586 3.967 5.081 1.00 0.00 C ATOM 1476 C TYR A 97 -11.041 3.536 4.880 1.00 0.00 C ATOM 1477 O TYR A 97 -11.552 3.562 3.780 1.00 0.00 O ATOM 1478 CB TYR A 97 -8.634 2.989 4.396 1.00 0.00 C ATOM 1479 CG TYR A 97 -7.285 3.648 4.248 1.00 0.00 C ATOM 1480 CD1 TYR A 97 -6.445 3.787 5.361 1.00 0.00 C ATOM 1481 CD2 TYR A 97 -6.879 4.130 2.999 1.00 0.00 C ATOM 1482 CE1 TYR A 97 -5.199 4.410 5.222 1.00 0.00 C ATOM 1483 CE2 TYR A 97 -5.633 4.751 2.859 1.00 0.00 C ATOM 1484 CZ TYR A 97 -4.793 4.891 3.971 1.00 0.00 C ATOM 1485 OH TYR A 97 -3.563 5.503 3.832 1.00 0.00 O ATOM 0 H TYR A 97 -8.900 3.005 6.859 1.00 0.00 H new ATOM 0 HA TYR A 97 -9.509 4.975 4.673 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -8.545 2.075 4.983 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -9.024 2.704 3.419 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -6.758 3.414 6.325 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -7.528 4.023 2.142 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -4.551 4.520 6.079 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -5.319 5.122 1.894 1.00 0.00 H new ATOM 0 HH TYR A 97 -2.935 5.127 4.484 1.00 0.00 H new ATOM 1495 N SER A 98 -11.713 3.139 5.927 1.00 0.00 N ATOM 1496 CA SER A 98 -13.131 2.708 5.786 1.00 0.00 C ATOM 1497 C SER A 98 -13.203 1.374 5.039 1.00 0.00 C ATOM 1498 O SER A 98 -14.257 0.947 4.612 1.00 0.00 O ATOM 1499 CB SER A 98 -13.829 3.824 5.004 1.00 0.00 C ATOM 1500 OG SER A 98 -14.812 4.430 5.835 1.00 0.00 O ATOM 0 H SER A 98 -11.339 3.095 6.875 1.00 0.00 H new ATOM 0 HA SER A 98 -13.611 2.551 6.752 1.00 0.00 H new ATOM 0 HB2 SER A 98 -13.101 4.567 4.679 1.00 0.00 H new ATOM 0 HB3 SER A 98 -14.294 3.419 4.105 1.00 0.00 H new ATOM 0 HG SER A 98 -15.262 5.147 5.341 1.00 0.00 H new ATOM 1506 N ASN A 99 -12.091 0.695 4.906 1.00 0.00 N ATOM 1507 CA ASN A 99 -12.105 -0.628 4.220 1.00 0.00 C ATOM 1508 C ASN A 99 -12.731 -0.506 2.832 1.00 0.00 C ATOM 1509 O ASN A 99 -13.158 -1.477 2.241 1.00 0.00 O ATOM 1510 CB ASN A 99 -12.966 -1.492 5.132 1.00 0.00 C ATOM 1511 CG ASN A 99 -12.264 -1.641 6.476 1.00 0.00 C ATOM 1512 OD1 ASN A 99 -11.806 -2.711 6.826 1.00 0.00 O ATOM 1513 ND2 ASN A 99 -12.157 -0.596 7.250 1.00 0.00 N ATOM 0 H ASN A 99 -11.178 1.001 5.243 1.00 0.00 H new ATOM 0 HA ASN A 99 -11.108 -1.041 4.065 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -13.947 -1.036 5.267 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -13.129 -2.471 4.681 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -11.688 -0.675 8.152 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -12.543 0.300 6.953 1.00 0.00 H new ATOM 1520 N ILE A 100 -12.790 0.684 2.314 1.00 0.00 N ATOM 1521 CA ILE A 100 -13.400 0.868 0.952 1.00 0.00 C ATOM 1522 C ILE A 100 -12.348 0.998 -0.178 1.00 0.00 C ATOM 1523 O ILE A 100 -12.641 0.650 -1.305 1.00 0.00 O ATOM 1524 CB ILE A 100 -14.309 2.118 1.005 1.00 0.00 C ATOM 1525 CG1 ILE A 100 -13.709 3.244 1.857 1.00 0.00 C ATOM 1526 CG2 ILE A 100 -15.663 1.725 1.592 1.00 0.00 C ATOM 1527 CD1 ILE A 100 -12.833 4.140 0.981 1.00 0.00 C ATOM 0 H ILE A 100 -12.449 1.535 2.761 1.00 0.00 H new ATOM 0 HA ILE A 100 -13.976 -0.025 0.708 1.00 0.00 H new ATOM 0 HB ILE A 100 -14.413 2.491 -0.014 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -14.505 3.832 2.314 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -13.117 2.823 2.670 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -16.310 2.601 1.633 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -16.124 0.962 0.964 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -15.523 1.331 2.598 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.408 4.939 1.588 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -12.028 3.548 0.545 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -13.438 4.573 0.184 1.00 0.00 H new ATOM 1539 N PRO A 101 -11.166 1.490 0.124 1.00 0.00 N ATOM 1540 CA PRO A 101 -10.128 1.640 -0.928 1.00 0.00 C ATOM 1541 C PRO A 101 -9.284 0.363 -1.062 1.00 0.00 C ATOM 1542 O PRO A 101 -8.121 0.351 -0.715 1.00 0.00 O ATOM 1543 CB PRO A 101 -9.259 2.767 -0.394 1.00 0.00 C ATOM 1544 CG PRO A 101 -9.426 2.738 1.097 1.00 0.00 C ATOM 1545 CD PRO A 101 -10.678 1.955 1.422 1.00 0.00 C ATOM 0 HA PRO A 101 -10.555 1.833 -1.912 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -8.215 2.623 -0.674 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -9.569 3.728 -0.804 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -8.557 2.277 1.567 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -9.500 3.752 1.490 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -10.462 1.119 2.087 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -11.417 2.579 1.924 1.00 0.00 H new ATOM 1553 N LEU A 102 -9.844 -0.710 -1.556 1.00 0.00 N ATOM 1554 CA LEU A 102 -9.037 -1.967 -1.694 1.00 0.00 C ATOM 1555 C LEU A 102 -9.372 -2.682 -3.009 1.00 0.00 C ATOM 1556 O LEU A 102 -10.385 -2.415 -3.619 1.00 0.00 O ATOM 1557 CB LEU A 102 -9.447 -2.844 -0.507 1.00 0.00 C ATOM 1558 CG LEU A 102 -9.474 -2.017 0.781 1.00 0.00 C ATOM 1559 CD1 LEU A 102 -10.239 -2.785 1.861 1.00 0.00 C ATOM 1560 CD2 LEU A 102 -8.040 -1.761 1.253 1.00 0.00 C ATOM 0 H LEU A 102 -10.813 -0.775 -1.868 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.967 -1.757 -1.704 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -10.430 -3.278 -0.689 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.748 -3.673 -0.400 1.00 0.00 H new ATOM 0 HG LEU A 102 -9.969 -1.064 0.593 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -10.260 -2.198 2.779 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -11.259 -2.967 1.524 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -9.744 -3.737 2.050 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -8.058 -1.172 2.170 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -7.544 -2.713 1.443 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.495 -1.215 0.482 1.00 0.00 H new ATOM 1572 N LEU A 103 -8.536 -3.599 -3.449 1.00 0.00 N ATOM 1573 CA LEU A 103 -8.851 -4.325 -4.740 1.00 0.00 C ATOM 1574 C LEU A 103 -7.690 -5.243 -5.168 1.00 0.00 C ATOM 1575 O LEU A 103 -6.724 -5.369 -4.472 1.00 0.00 O ATOM 1576 CB LEU A 103 -9.046 -3.215 -5.774 1.00 0.00 C ATOM 1577 CG LEU A 103 -10.499 -3.202 -6.258 1.00 0.00 C ATOM 1578 CD1 LEU A 103 -10.689 -2.063 -7.263 1.00 0.00 C ATOM 1579 CD2 LEU A 103 -10.826 -4.540 -6.928 1.00 0.00 C ATOM 0 H LEU A 103 -7.669 -3.875 -2.988 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.727 -4.965 -4.634 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -8.791 -2.250 -5.337 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -8.374 -3.370 -6.618 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.166 -3.051 -5.409 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -11.723 -2.052 -7.609 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -10.456 -1.112 -6.784 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.023 -2.213 -8.113 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.860 -4.531 -7.273 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -10.161 -4.693 -7.778 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -10.690 -5.349 -6.211 1.00 0.00 H new ATOM 1591 N THR A 104 -7.773 -5.878 -6.321 1.00 0.00 N ATOM 1592 CA THR A 104 -6.652 -6.764 -6.772 1.00 0.00 C ATOM 1593 C THR A 104 -5.757 -5.992 -7.758 1.00 0.00 C ATOM 1594 O THR A 104 -4.923 -6.556 -8.439 1.00 0.00 O ATOM 1595 CB THR A 104 -7.323 -7.997 -7.441 1.00 0.00 C ATOM 1596 OG1 THR A 104 -7.391 -9.068 -6.516 1.00 0.00 O ATOM 1597 CG2 THR A 104 -6.526 -8.458 -8.667 1.00 0.00 C ATOM 0 H THR A 104 -8.564 -5.819 -6.962 1.00 0.00 H new ATOM 0 HA THR A 104 -6.013 -7.085 -5.949 1.00 0.00 H new ATOM 0 HB THR A 104 -8.325 -7.705 -7.755 1.00 0.00 H new ATOM 0 HG1 THR A 104 -7.751 -8.743 -5.665 1.00 0.00 H new ATOM 0 HG21 THR A 104 -7.017 -9.321 -9.116 1.00 0.00 H new ATOM 0 HG22 THR A 104 -6.478 -7.648 -9.395 1.00 0.00 H new ATOM 0 HG23 THR A 104 -5.516 -8.732 -8.362 1.00 0.00 H new ATOM 1605 N LYS A 105 -5.929 -4.698 -7.831 1.00 0.00 N ATOM 1606 CA LYS A 105 -5.101 -3.869 -8.759 1.00 0.00 C ATOM 1607 C LYS A 105 -5.464 -4.147 -10.244 1.00 0.00 C ATOM 1608 O LYS A 105 -4.636 -4.029 -11.119 1.00 0.00 O ATOM 1609 CB LYS A 105 -3.634 -4.222 -8.379 1.00 0.00 C ATOM 1610 CG LYS A 105 -2.717 -4.372 -9.602 1.00 0.00 C ATOM 1611 CD LYS A 105 -2.934 -5.746 -10.247 1.00 0.00 C ATOM 1612 CE LYS A 105 -2.198 -5.811 -11.591 1.00 0.00 C ATOM 1613 NZ LYS A 105 -1.347 -7.035 -11.512 1.00 0.00 N ATOM 0 H LYS A 105 -6.613 -4.175 -7.284 1.00 0.00 H new ATOM 0 HA LYS A 105 -5.274 -2.798 -8.658 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -3.236 -3.445 -7.727 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -3.626 -5.151 -7.809 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -2.927 -3.583 -10.325 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -1.675 -4.261 -9.303 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -2.570 -6.531 -9.584 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -3.999 -5.924 -10.396 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -2.900 -5.873 -12.422 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -1.592 -4.919 -11.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -0.801 -7.135 -12.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -0.695 -6.953 -10.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -1.952 -7.871 -11.383 1.00 0.00 H new ATOM 1627 N PRO A 106 -6.716 -4.461 -10.515 1.00 0.00 N ATOM 1628 CA PRO A 106 -7.115 -4.685 -11.921 1.00 0.00 C ATOM 1629 C PRO A 106 -7.286 -3.330 -12.613 1.00 0.00 C ATOM 1630 O PRO A 106 -7.639 -3.255 -13.770 1.00 0.00 O ATOM 1631 CB PRO A 106 -8.455 -5.402 -11.815 1.00 0.00 C ATOM 1632 CG PRO A 106 -9.013 -4.992 -10.489 1.00 0.00 C ATOM 1633 CD PRO A 106 -7.851 -4.634 -9.593 1.00 0.00 C ATOM 0 HA PRO A 106 -6.386 -5.257 -12.495 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -9.121 -5.115 -12.629 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -8.329 -6.483 -11.872 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -9.684 -4.141 -10.603 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -9.597 -5.802 -10.053 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -8.049 -3.721 -9.031 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -7.654 -5.420 -8.864 1.00 0.00 H new ATOM 1641 N PHE A 107 -7.047 -2.262 -11.895 1.00 0.00 N ATOM 1642 CA PHE A 107 -7.199 -0.898 -12.475 1.00 0.00 C ATOM 1643 C PHE A 107 -8.646 -0.666 -12.916 1.00 0.00 C ATOM 1644 O PHE A 107 -9.546 -1.361 -12.491 1.00 0.00 O ATOM 1645 CB PHE A 107 -6.221 -0.836 -13.648 1.00 0.00 C ATOM 1646 CG PHE A 107 -4.817 -0.736 -13.096 1.00 0.00 C ATOM 1647 CD1 PHE A 107 -4.541 0.156 -12.050 1.00 0.00 C ATOM 1648 CD2 PHE A 107 -3.797 -1.543 -13.612 1.00 0.00 C ATOM 1649 CE1 PHE A 107 -3.246 0.243 -11.525 1.00 0.00 C ATOM 1650 CE2 PHE A 107 -2.502 -1.457 -13.086 1.00 0.00 C ATOM 1651 CZ PHE A 107 -2.226 -0.564 -12.041 1.00 0.00 C ATOM 0 H PHE A 107 -6.749 -2.280 -10.920 1.00 0.00 H new ATOM 0 HA PHE A 107 -6.978 -0.113 -11.752 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -6.321 -1.724 -14.272 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -6.442 0.024 -14.280 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -5.328 0.777 -11.649 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -4.008 -2.232 -14.416 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -3.034 0.933 -10.722 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -1.715 -2.079 -13.486 1.00 0.00 H new ATOM 0 HZ PHE A 107 -1.227 -0.499 -11.635 1.00 0.00 H new ATOM 1661 N LEU A 108 -8.882 0.333 -13.727 1.00 0.00 N ATOM 1662 CA LEU A 108 -10.280 0.643 -14.159 1.00 0.00 C ATOM 1663 C LEU A 108 -11.133 0.991 -12.929 1.00 0.00 C ATOM 1664 O LEU A 108 -12.338 1.110 -13.017 1.00 0.00 O ATOM 1665 CB LEU A 108 -10.810 -0.628 -14.843 1.00 0.00 C ATOM 1666 CG LEU A 108 -10.065 -0.880 -16.159 1.00 0.00 C ATOM 1667 CD1 LEU A 108 -9.841 0.439 -16.901 1.00 0.00 C ATOM 1668 CD2 LEU A 108 -8.716 -1.530 -15.859 1.00 0.00 C ATOM 0 H LEU A 108 -8.166 0.950 -14.110 1.00 0.00 H new ATOM 0 HA LEU A 108 -10.317 1.494 -14.839 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -10.687 -1.484 -14.179 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -11.878 -0.526 -15.037 1.00 0.00 H new ATOM 0 HG LEU A 108 -10.663 -1.541 -16.786 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -9.311 0.246 -17.834 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -10.803 0.902 -17.119 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.249 1.110 -16.279 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.183 -1.711 -16.793 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.125 -0.867 -15.227 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -8.875 -2.477 -15.343 1.00 0.00 H new ATOM 1680 N ASP A 109 -10.499 1.167 -11.788 1.00 0.00 N ATOM 1681 CA ASP A 109 -11.233 1.520 -10.525 1.00 0.00 C ATOM 1682 C ASP A 109 -10.385 1.174 -9.283 1.00 0.00 C ATOM 1683 O ASP A 109 -10.733 1.531 -8.179 1.00 0.00 O ATOM 1684 CB ASP A 109 -12.518 0.678 -10.530 1.00 0.00 C ATOM 1685 CG ASP A 109 -13.075 0.565 -9.106 1.00 0.00 C ATOM 1686 OD1 ASP A 109 -12.661 -0.339 -8.398 1.00 0.00 O ATOM 1687 OD2 ASP A 109 -13.902 1.386 -8.748 1.00 0.00 O ATOM 0 H ASP A 109 -9.489 1.079 -11.678 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.447 2.588 -10.484 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -13.260 1.135 -11.185 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -12.311 -0.315 -10.928 1.00 0.00 H new ATOM 1692 N SER A 110 -9.297 0.463 -9.441 1.00 0.00 N ATOM 1693 CA SER A 110 -8.472 0.089 -8.251 1.00 0.00 C ATOM 1694 C SER A 110 -7.646 1.276 -7.729 1.00 0.00 C ATOM 1695 O SER A 110 -8.138 2.105 -6.990 1.00 0.00 O ATOM 1696 CB SER A 110 -7.553 -1.025 -8.747 1.00 0.00 C ATOM 1697 OG SER A 110 -6.705 -1.446 -7.685 1.00 0.00 O ATOM 0 H SER A 110 -8.945 0.127 -10.337 1.00 0.00 H new ATOM 0 HA SER A 110 -9.100 -0.224 -7.417 1.00 0.00 H new ATOM 0 HB2 SER A 110 -8.145 -1.865 -9.109 1.00 0.00 H new ATOM 0 HB3 SER A 110 -6.955 -0.671 -9.586 1.00 0.00 H new ATOM 0 HG SER A 110 -5.802 -1.094 -7.829 1.00 0.00 H new ATOM 1703 N GLU A 111 -6.386 1.343 -8.085 1.00 0.00 N ATOM 1704 CA GLU A 111 -5.512 2.448 -7.590 1.00 0.00 C ATOM 1705 C GLU A 111 -6.270 3.773 -7.521 1.00 0.00 C ATOM 1706 O GLU A 111 -6.239 4.462 -6.521 1.00 0.00 O ATOM 1707 CB GLU A 111 -4.374 2.540 -8.605 1.00 0.00 C ATOM 1708 CG GLU A 111 -3.176 1.742 -8.092 1.00 0.00 C ATOM 1709 CD GLU A 111 -3.630 0.335 -7.696 1.00 0.00 C ATOM 1710 OE1 GLU A 111 -4.177 -0.349 -8.544 1.00 0.00 O ATOM 1711 OE2 GLU A 111 -3.422 -0.033 -6.552 1.00 0.00 O ATOM 0 H GLU A 111 -5.924 0.674 -8.701 1.00 0.00 H new ATOM 0 HA GLU A 111 -5.155 2.249 -6.580 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -4.699 2.151 -9.570 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -4.093 3.582 -8.760 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -2.408 1.684 -8.863 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -2.730 2.246 -7.235 1.00 0.00 H new ATOM 1718 N LEU A 112 -6.939 4.146 -8.571 1.00 0.00 N ATOM 1719 CA LEU A 112 -7.679 5.440 -8.544 1.00 0.00 C ATOM 1720 C LEU A 112 -8.575 5.514 -7.305 1.00 0.00 C ATOM 1721 O LEU A 112 -8.763 6.566 -6.732 1.00 0.00 O ATOM 1722 CB LEU A 112 -8.509 5.461 -9.827 1.00 0.00 C ATOM 1723 CG LEU A 112 -9.393 4.216 -9.899 1.00 0.00 C ATOM 1724 CD1 LEU A 112 -10.831 4.588 -9.529 1.00 0.00 C ATOM 1725 CD2 LEU A 112 -9.356 3.662 -11.325 1.00 0.00 C ATOM 0 H LEU A 112 -7.008 3.619 -9.441 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.007 6.297 -8.493 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.127 6.358 -9.855 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.851 5.500 -10.695 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.028 3.462 -9.202 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -11.461 3.700 -9.580 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.854 4.991 -8.516 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -11.204 5.338 -10.226 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.984 2.773 -11.386 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.727 4.417 -12.018 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.331 3.401 -11.587 1.00 0.00 H new ATOM 1737 N GLU A 113 -9.122 4.408 -6.882 1.00 0.00 N ATOM 1738 CA GLU A 113 -9.997 4.427 -5.673 1.00 0.00 C ATOM 1739 C GLU A 113 -9.157 4.679 -4.424 1.00 0.00 C ATOM 1740 O GLU A 113 -9.404 5.599 -3.670 1.00 0.00 O ATOM 1741 CB GLU A 113 -10.626 3.035 -5.610 1.00 0.00 C ATOM 1742 CG GLU A 113 -11.737 3.025 -4.561 1.00 0.00 C ATOM 1743 CD GLU A 113 -12.607 1.781 -4.754 1.00 0.00 C ATOM 1744 OE1 GLU A 113 -12.058 0.746 -5.092 1.00 0.00 O ATOM 1745 OE2 GLU A 113 -13.807 1.885 -4.561 1.00 0.00 O ATOM 0 H GLU A 113 -9.002 3.494 -7.319 1.00 0.00 H new ATOM 0 HA GLU A 113 -10.750 5.214 -5.724 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.029 2.762 -6.585 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -9.868 2.293 -5.360 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -11.307 3.030 -3.560 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -12.345 3.925 -4.651 1.00 0.00 H new ATOM 1752 N ALA A 114 -8.169 3.861 -4.203 1.00 0.00 N ATOM 1753 CA ALA A 114 -7.307 4.031 -3.002 1.00 0.00 C ATOM 1754 C ALA A 114 -6.973 5.509 -2.775 1.00 0.00 C ATOM 1755 O ALA A 114 -6.742 5.933 -1.660 1.00 0.00 O ATOM 1756 CB ALA A 114 -6.040 3.236 -3.315 1.00 0.00 C ATOM 0 H ALA A 114 -7.920 3.077 -4.806 1.00 0.00 H new ATOM 0 HA ALA A 114 -7.799 3.684 -2.093 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.348 3.309 -2.476 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.298 2.190 -3.482 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.569 3.640 -4.211 1.00 0.00 H new ATOM 1762 N VAL A 115 -6.937 6.296 -3.815 1.00 0.00 N ATOM 1763 CA VAL A 115 -6.607 7.739 -3.631 1.00 0.00 C ATOM 1764 C VAL A 115 -7.876 8.596 -3.682 1.00 0.00 C ATOM 1765 O VAL A 115 -7.957 9.634 -3.054 1.00 0.00 O ATOM 1766 CB VAL A 115 -5.673 8.081 -4.792 1.00 0.00 C ATOM 1767 CG1 VAL A 115 -4.981 9.417 -4.513 1.00 0.00 C ATOM 1768 CG2 VAL A 115 -4.617 6.982 -4.933 1.00 0.00 C ATOM 0 H VAL A 115 -7.120 6.007 -4.776 1.00 0.00 H new ATOM 0 HA VAL A 115 -6.144 7.934 -2.664 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.249 8.155 -5.714 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -4.315 9.661 -5.340 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -5.731 10.200 -4.408 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -4.403 9.342 -3.592 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -3.949 7.223 -5.760 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -4.041 6.911 -4.011 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -5.108 6.029 -5.129 1.00 0.00 H new ATOM 1778 N LEU A 116 -8.866 8.173 -4.419 1.00 0.00 N ATOM 1779 CA LEU A 116 -10.128 8.968 -4.503 1.00 0.00 C ATOM 1780 C LEU A 116 -10.897 8.876 -3.184 1.00 0.00 C ATOM 1781 O LEU A 116 -11.459 9.841 -2.705 1.00 0.00 O ATOM 1782 CB LEU A 116 -10.931 8.310 -5.624 1.00 0.00 C ATOM 1783 CG LEU A 116 -10.935 9.211 -6.857 1.00 0.00 C ATOM 1784 CD1 LEU A 116 -11.369 10.623 -6.460 1.00 0.00 C ATOM 1785 CD2 LEU A 116 -9.530 9.260 -7.462 1.00 0.00 C ATOM 0 H LEU A 116 -8.858 7.313 -4.967 1.00 0.00 H new ATOM 0 HA LEU A 116 -9.938 10.024 -4.694 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -10.499 7.341 -5.872 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -11.953 8.128 -5.292 1.00 0.00 H new ATOM 0 HG LEU A 116 -11.633 8.811 -7.593 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -11.371 11.264 -7.341 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -12.372 10.589 -6.033 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -10.674 11.023 -5.722 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -9.535 9.903 -8.342 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -8.831 9.657 -6.726 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -9.222 8.255 -7.750 1.00 0.00 H new ATOM 1797 N VAL A 117 -10.926 7.712 -2.607 1.00 0.00 N ATOM 1798 CA VAL A 117 -11.657 7.515 -1.321 1.00 0.00 C ATOM 1799 C VAL A 117 -11.225 8.545 -0.272 1.00 0.00 C ATOM 1800 O VAL A 117 -11.948 8.829 0.664 1.00 0.00 O ATOM 1801 CB VAL A 117 -11.248 6.117 -0.868 1.00 0.00 C ATOM 1802 CG1 VAL A 117 -11.790 5.076 -1.849 1.00 0.00 C ATOM 1803 CG2 VAL A 117 -9.721 6.029 -0.824 1.00 0.00 C ATOM 0 H VAL A 117 -10.470 6.876 -2.973 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.734 7.631 -1.445 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.657 5.923 0.123 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -11.495 4.079 -1.521 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -12.878 5.140 -1.883 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -11.384 5.266 -2.842 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.423 5.032 -0.501 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.317 6.224 -1.817 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.334 6.768 -0.123 1.00 0.00 H new ATOM 1813 N GLN A 118 -10.048 9.088 -0.401 1.00 0.00 N ATOM 1814 CA GLN A 118 -9.568 10.074 0.611 1.00 0.00 C ATOM 1815 C GLN A 118 -9.973 11.501 0.233 1.00 0.00 C ATOM 1816 O GLN A 118 -10.112 12.357 1.083 1.00 0.00 O ATOM 1817 CB GLN A 118 -8.049 9.929 0.600 1.00 0.00 C ATOM 1818 CG GLN A 118 -7.678 8.480 0.913 1.00 0.00 C ATOM 1819 CD GLN A 118 -7.577 8.292 2.428 1.00 0.00 C ATOM 1820 OE1 GLN A 118 -6.507 8.388 2.994 1.00 0.00 O ATOM 1821 NE2 GLN A 118 -8.655 8.023 3.114 1.00 0.00 N ATOM 0 H GLN A 118 -9.397 8.894 -1.162 1.00 0.00 H new ATOM 0 HA GLN A 118 -10.000 9.888 1.594 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -7.652 10.216 -0.374 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -7.603 10.598 1.336 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -8.429 7.805 0.502 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -6.729 8.227 0.441 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -9.554 7.942 2.640 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -8.598 7.894 4.124 1.00 0.00 H new ATOM 1830 N ILE A 119 -10.154 11.774 -1.029 1.00 0.00 N ATOM 1831 CA ILE A 119 -10.538 13.158 -1.430 1.00 0.00 C ATOM 1832 C ILE A 119 -12.054 13.362 -1.290 1.00 0.00 C ATOM 1833 O ILE A 119 -12.561 14.450 -1.473 1.00 0.00 O ATOM 1834 CB ILE A 119 -10.076 13.293 -2.890 1.00 0.00 C ATOM 1835 CG1 ILE A 119 -9.575 14.720 -3.128 1.00 0.00 C ATOM 1836 CG2 ILE A 119 -11.228 12.988 -3.854 1.00 0.00 C ATOM 1837 CD1 ILE A 119 -10.587 15.720 -2.566 1.00 0.00 C ATOM 0 H ILE A 119 -10.054 11.107 -1.794 1.00 0.00 H new ATOM 0 HA ILE A 119 -10.078 13.917 -0.797 1.00 0.00 H new ATOM 0 HB ILE A 119 -9.273 12.579 -3.073 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -8.606 14.860 -2.649 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -9.432 14.893 -4.195 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -10.879 13.089 -4.882 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -11.580 11.970 -3.689 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -12.045 13.688 -3.678 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -10.228 16.735 -2.736 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -11.547 15.586 -3.065 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -10.708 15.553 -1.496 1.00 0.00 H new ATOM 1849 N SER A 120 -12.779 12.326 -0.968 1.00 0.00 N ATOM 1850 CA SER A 120 -14.256 12.472 -0.819 1.00 0.00 C ATOM 1851 C SER A 120 -14.622 12.674 0.654 1.00 0.00 C ATOM 1852 O SER A 120 -14.877 13.776 1.096 1.00 0.00 O ATOM 1853 CB SER A 120 -14.839 11.159 -1.340 1.00 0.00 C ATOM 1854 OG SER A 120 -15.342 11.355 -2.656 1.00 0.00 O ATOM 0 H SER A 120 -12.415 11.388 -0.802 1.00 0.00 H new ATOM 0 HA SER A 120 -14.642 13.334 -1.363 1.00 0.00 H new ATOM 0 HB2 SER A 120 -14.073 10.384 -1.343 1.00 0.00 H new ATOM 0 HB3 SER A 120 -15.637 10.816 -0.681 1.00 0.00 H new ATOM 0 HG SER A 120 -15.715 10.513 -2.992 1.00 0.00 H new ATOM 1860 N LYS A 121 -14.648 11.615 1.418 1.00 0.00 N ATOM 1861 CA LYS A 121 -14.997 11.743 2.862 1.00 0.00 C ATOM 1862 C LYS A 121 -16.369 12.400 3.023 1.00 0.00 C ATOM 1863 O LYS A 121 -16.976 12.831 2.064 1.00 0.00 O ATOM 1864 CB LYS A 121 -13.902 12.628 3.458 1.00 0.00 C ATOM 1865 CG LYS A 121 -12.829 11.746 4.098 1.00 0.00 C ATOM 1866 CD LYS A 121 -13.442 10.948 5.250 1.00 0.00 C ATOM 1867 CE LYS A 121 -12.737 11.315 6.559 1.00 0.00 C ATOM 1868 NZ LYS A 121 -11.675 10.282 6.734 1.00 0.00 N ATOM 0 H LYS A 121 -14.443 10.666 1.104 1.00 0.00 H new ATOM 0 HA LYS A 121 -15.053 10.774 3.359 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -13.460 13.252 2.681 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -14.328 13.300 4.203 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -12.410 11.068 3.355 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -12.008 12.362 4.465 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -14.508 11.161 5.327 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -13.343 9.879 5.059 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -12.308 12.316 6.508 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -13.434 11.309 7.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -11.150 10.469 7.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -12.112 9.340 6.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -11.021 10.316 5.926 1.00 0.00 H new ATOM 1882 N GLU A 122 -16.867 12.459 4.236 1.00 0.00 N ATOM 1883 CA GLU A 122 -18.211 13.064 4.489 1.00 0.00 C ATOM 1884 C GLU A 122 -19.159 12.672 3.363 1.00 0.00 C ATOM 1885 O GLU A 122 -20.081 13.389 3.026 1.00 0.00 O ATOM 1886 CB GLU A 122 -18.007 14.589 4.560 1.00 0.00 C ATOM 1887 CG GLU A 122 -17.056 15.068 3.460 1.00 0.00 C ATOM 1888 CD GLU A 122 -16.917 16.591 3.534 1.00 0.00 C ATOM 1889 OE1 GLU A 122 -16.794 17.103 4.635 1.00 0.00 O ATOM 1890 OE2 GLU A 122 -16.935 17.219 2.488 1.00 0.00 O ATOM 0 H GLU A 122 -16.393 12.110 5.069 1.00 0.00 H new ATOM 0 HA GLU A 122 -18.653 12.709 5.420 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -18.968 15.093 4.459 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -17.605 14.861 5.536 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -16.080 14.597 3.577 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -17.436 14.774 2.482 1.00 0.00 H new ATOM 1897 N VAL A 123 -18.923 11.519 2.794 1.00 0.00 N ATOM 1898 CA VAL A 123 -19.776 11.012 1.685 1.00 0.00 C ATOM 1899 C VAL A 123 -20.312 12.165 0.829 1.00 0.00 C ATOM 1900 O VAL A 123 -21.502 12.170 0.558 1.00 0.00 O ATOM 1901 CB VAL A 123 -20.923 10.270 2.372 1.00 0.00 C ATOM 1902 CG1 VAL A 123 -21.738 11.256 3.211 1.00 0.00 C ATOM 1903 CG2 VAL A 123 -21.825 9.637 1.310 1.00 0.00 C ATOM 0 H VAL A 123 -18.159 10.897 3.059 1.00 0.00 H new ATOM 0 HA VAL A 123 -19.216 10.366 1.009 1.00 0.00 H new ATOM 0 HB VAL A 123 -20.519 9.491 3.019 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -22.556 10.728 3.701 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -21.095 11.710 3.966 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -22.144 12.034 2.565 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -22.644 9.107 1.797 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -22.230 10.417 0.665 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -21.245 8.936 0.711 1.00 0.00 H new TER 1913 VAL A 123 HETATM 1914 CA CA A 201 1.953 -9.163 -9.487 1.00 0.00 CA HETATM 1915 BE BEF A 202 -0.603 -6.693 -8.732 1.00 0.00 BE HETATM 1916 F1 BEF A 202 0.847 -6.318 -8.906 1.00 0.00 F HETATM 1917 F2 BEF A 202 0.364 -7.874 -9.779 1.00 0.00 F HETATM 1918 F3 BEF A 202 -0.674 -7.960 -8.185 1.00 0.00 F