USER MOD reduce.3.24.130724 H: found=0, std=0, add=1004, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1001 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 86 SER OG : rot -179:sc= -0.747 USER MOD Set 1.2: A 134 LYS NZ :NH3+ -174:sc= 0.586 (180deg=-0.186) USER MOD Set 2.1: A 72 THR OG1 : rot 29:sc= -3.16! USER MOD Set 2.2: A 75 THR OG1 : rot -101:sc= 1.71 USER MOD Set 3.1: A 14 TYR OH : rot 18:sc= 0.0102 USER MOD Set 3.2: A 40 SER OG : rot 81:sc= -2.02 USER MOD Set 4.1: A 11 SER OG : rot 97:sc= 0.206 USER MOD Set 4.2: A 12 HIS : no HD1:sc= -5.72! C(o=-8.6!,f=-14!) USER MOD Set 4.3: A 136 THR OG1 : rot 74:sc= -3.1! USER MOD Single : A 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -105:sc= -3.26! (180deg=-5.85!) USER MOD Single : A 6 SER OG : rot 96:sc= -2.31! USER MOD Single : A 7 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.141) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot -150:sc= -0.0132 USER MOD Single : A 21 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.147) USER MOD Single : A 22 SER OG : rot -89:sc= 0.182 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -4.4! C(o=-4.4!,f=-8.7!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot -49:sc= 0.0103 USER MOD Single : A 37 ASN :FLIP amide:sc= -3.23! C(o=-4.7!,f=-3.2!) USER MOD Single : A 43 SER OG : rot 180:sc= 0.51 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 138:sc= 0.169 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 145:sc= -1.51! USER MOD Single : A 63 TYR OH : rot 130:sc= 0 USER MOD Single : A 69 HIS :FLIP no HE2:sc= -0.243 F(o=-1.6,f=-0.24) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 ASN : amide:sc= -1.57 K(o=-1.6,f=-2.8!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot -39:sc= -3.52! USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.0369 X(o=-0.037,f=0) USER MOD Single : A 92 TYR OH : rot 180:sc= -0.344 USER MOD Single : A 98 ASN :FLIP amide:sc= -3.76! C(o=-6.5!,f=-3.8!) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot -77:sc= -0.364 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 HIS :FLIP no HD1:sc= -0.955 F(o=-1.8,f=-0.96) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot -47:sc= 0.785 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot -25:sc= 0.608 USER MOD Single : A 121 LYS NZ :NH3+ -147:sc= -0.0298 (180deg=-0.475) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.0293 X(o=-0.029,f=0) USER MOD Single : A 126 ASN :FLIP amide:sc= -0.44 F(o=-3.4!,f=-0.44) USER MOD Single : A 131 TYR OH : rot 180:sc= -0.0724 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 1 -4.398 20.343 10.249 1.00 0.00 N ATOM 2 CA ARG A 1 -3.899 20.903 8.961 1.00 0.00 C ATOM 3 C ARG A 1 -3.628 19.762 7.979 1.00 0.00 C ATOM 4 O ARG A 1 -2.756 18.942 8.192 1.00 0.00 O ATOM 5 CB ARG A 1 -2.605 21.680 9.212 1.00 0.00 C ATOM 6 CG ARG A 1 -2.102 22.276 7.895 1.00 0.00 C ATOM 7 CD ARG A 1 -1.016 23.313 8.184 1.00 0.00 C ATOM 8 NE ARG A 1 -0.183 22.854 9.333 1.00 0.00 N ATOM 9 CZ ARG A 1 -0.363 23.370 10.520 1.00 0.00 C ATOM 10 NH1 ARG A 1 -0.542 24.655 10.652 1.00 0.00 N ATOM 11 NH2 ARG A 1 -0.364 22.600 11.573 1.00 0.00 N ATOM 0 H1 ARG A 1 -4.582 21.119 10.917 1.00 0.00 H new ATOM 0 H2 ARG A 1 -5.278 19.815 10.080 1.00 0.00 H new ATOM 0 H3 ARG A 1 -3.682 19.704 10.650 1.00 0.00 H new ATOM 0 HA ARG A 1 -4.649 21.572 8.540 1.00 0.00 H new ATOM 0 HB2 ARG A 1 -2.780 22.473 9.939 1.00 0.00 H new ATOM 0 HB3 ARG A 1 -1.849 21.020 9.637 1.00 0.00 H new ATOM 0 HG2 ARG A 1 -1.705 21.488 7.255 1.00 0.00 H new ATOM 0 HG3 ARG A 1 -2.928 22.740 7.355 1.00 0.00 H new ATOM 0 HD2 ARG A 1 -0.391 23.456 7.302 1.00 0.00 H new ATOM 0 HD3 ARG A 1 -1.470 24.277 8.413 1.00 0.00 H new ATOM 0 HE ARG A 1 0.528 22.136 9.192 1.00 0.00 H new ATOM 0 HH11 ARG A 1 -0.542 25.257 9.829 1.00 0.00 H new ATOM 0 HH12 ARG A 1 -0.683 25.058 11.578 1.00 0.00 H new ATOM 0 HH21 ARG A 1 -0.224 21.595 11.470 1.00 0.00 H new ATOM 0 HH22 ARG A 1 -0.505 23.003 12.499 1.00 0.00 H new ATOM 27 N CYS A 2 -4.367 19.702 6.904 1.00 0.00 N ATOM 28 CA CYS A 2 -4.153 18.620 5.908 1.00 0.00 C ATOM 29 C CYS A 2 -4.539 19.137 4.511 1.00 0.00 C ATOM 30 O CYS A 2 -5.551 19.793 4.355 1.00 0.00 O ATOM 31 CB CYS A 2 -5.029 17.414 6.282 1.00 0.00 C ATOM 32 SG CYS A 2 -4.148 15.874 5.916 1.00 0.00 S ATOM 0 H CYS A 2 -5.112 20.360 6.674 1.00 0.00 H new ATOM 0 HA CYS A 2 -3.106 18.317 5.902 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -5.285 17.454 7.341 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -5.966 17.448 5.726 1.00 0.00 H new ATOM 37 N PRO A 3 -3.748 18.859 3.495 1.00 0.00 N ATOM 38 CA PRO A 3 -4.069 19.338 2.120 1.00 0.00 C ATOM 39 C PRO A 3 -5.448 18.866 1.639 1.00 0.00 C ATOM 40 O PRO A 3 -6.027 17.944 2.177 1.00 0.00 O ATOM 41 CB PRO A 3 -2.948 18.724 1.271 1.00 0.00 C ATOM 42 CG PRO A 3 -2.022 17.911 2.186 1.00 0.00 C ATOM 43 CD PRO A 3 -2.499 18.061 3.638 1.00 0.00 C ATOM 0 HA PRO A 3 -4.119 20.425 2.061 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -3.369 18.084 0.496 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -2.385 19.508 0.765 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -2.030 16.861 1.893 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -0.994 18.261 2.089 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -2.688 17.094 4.103 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -1.761 18.573 4.255 1.00 0.00 H new ATOM 51 N LYS A 4 -5.973 19.497 0.626 1.00 0.00 N ATOM 52 CA LYS A 4 -7.304 19.101 0.100 1.00 0.00 C ATOM 53 C LYS A 4 -7.208 17.706 -0.507 1.00 0.00 C ATOM 54 O LYS A 4 -6.208 17.340 -1.092 1.00 0.00 O ATOM 55 CB LYS A 4 -7.745 20.092 -0.977 1.00 0.00 C ATOM 56 CG LYS A 4 -7.633 21.521 -0.439 1.00 0.00 C ATOM 57 CD LYS A 4 -8.426 22.471 -1.341 1.00 0.00 C ATOM 58 CE LYS A 4 -7.919 22.360 -2.780 1.00 0.00 C ATOM 59 NZ LYS A 4 -8.502 21.148 -3.421 1.00 0.00 N ATOM 0 H LYS A 4 -5.531 20.276 0.138 1.00 0.00 H new ATOM 0 HA LYS A 4 -8.031 19.101 0.912 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -7.125 19.978 -1.866 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -8.772 19.885 -1.277 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -8.015 21.568 0.581 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -6.587 21.826 -0.402 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.487 22.226 -1.299 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.321 23.496 -0.987 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -8.195 23.251 -3.344 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -6.831 22.302 -2.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -7.776 20.406 -3.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -9.300 20.803 -2.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -8.838 21.388 -4.376 1.00 0.00 H new ATOM 73 N GLY A 5 -8.230 16.918 -0.358 1.00 0.00 N ATOM 74 CA GLY A 5 -8.184 15.542 -0.909 1.00 0.00 C ATOM 75 C GLY A 5 -7.286 14.716 -0.002 1.00 0.00 C ATOM 76 O GLY A 5 -7.201 13.508 -0.114 1.00 0.00 O ATOM 0 H GLY A 5 -9.095 17.167 0.121 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -9.185 15.113 -0.952 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -7.797 15.550 -1.928 1.00 0.00 H new ATOM 80 N SER A 6 -6.619 15.371 0.907 1.00 0.00 N ATOM 81 CA SER A 6 -5.720 14.638 1.846 1.00 0.00 C ATOM 82 C SER A 6 -6.510 14.247 3.097 1.00 0.00 C ATOM 83 O SER A 6 -7.364 14.983 3.553 1.00 0.00 O ATOM 84 CB SER A 6 -4.547 15.536 2.240 1.00 0.00 C ATOM 85 OG SER A 6 -4.907 16.302 3.383 1.00 0.00 O ATOM 0 H SER A 6 -6.656 16.381 1.041 1.00 0.00 H new ATOM 0 HA SER A 6 -5.337 13.741 1.360 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.667 14.931 2.456 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.285 16.196 1.413 1.00 0.00 H new ATOM 0 HG SER A 6 -4.580 15.856 4.192 1.00 0.00 H new ATOM 91 N LYS A 7 -6.238 13.094 3.654 1.00 0.00 N ATOM 92 CA LYS A 7 -6.983 12.656 4.877 1.00 0.00 C ATOM 93 C LYS A 7 -5.983 12.250 5.960 1.00 0.00 C ATOM 94 O LYS A 7 -5.049 11.520 5.709 1.00 0.00 O ATOM 95 CB LYS A 7 -7.872 11.453 4.537 1.00 0.00 C ATOM 96 CG LYS A 7 -8.707 11.746 3.284 1.00 0.00 C ATOM 97 CD LYS A 7 -9.943 12.574 3.660 1.00 0.00 C ATOM 98 CE LYS A 7 -10.442 13.337 2.430 1.00 0.00 C ATOM 99 NZ LYS A 7 -10.864 12.366 1.381 1.00 0.00 N ATOM 0 H LYS A 7 -5.534 12.437 3.317 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.604 13.478 5.235 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.254 10.570 4.372 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -8.530 11.229 5.377 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -8.105 12.287 2.554 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -9.014 10.811 2.815 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -10.729 11.921 4.039 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -9.696 13.273 4.459 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -11.278 13.981 2.703 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -9.654 13.984 2.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.372 12.870 0.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -10.025 11.900 0.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.490 11.650 1.802 1.00 0.00 H new ATOM 113 N ALA A 8 -6.169 12.717 7.166 1.00 0.00 N ATOM 114 CA ALA A 8 -5.219 12.352 8.257 1.00 0.00 C ATOM 115 C ALA A 8 -5.660 11.046 8.918 1.00 0.00 C ATOM 116 O ALA A 8 -6.831 10.726 8.970 1.00 0.00 O ATOM 117 CB ALA A 8 -5.189 13.466 9.306 1.00 0.00 C ATOM 0 H ALA A 8 -6.934 13.333 7.442 1.00 0.00 H new ATOM 0 HA ALA A 8 -4.224 12.222 7.832 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -4.495 13.198 10.102 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -4.864 14.396 8.840 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.187 13.599 9.724 1.00 0.00 H new ATOM 123 N TYR A 9 -4.725 10.291 9.424 1.00 0.00 N ATOM 124 CA TYR A 9 -5.075 9.004 10.087 1.00 0.00 C ATOM 125 C TYR A 9 -3.896 8.551 10.950 1.00 0.00 C ATOM 126 O TYR A 9 -2.760 8.558 10.522 1.00 0.00 O ATOM 127 CB TYR A 9 -5.365 7.944 9.022 1.00 0.00 C ATOM 128 CG TYR A 9 -6.022 6.748 9.669 1.00 0.00 C ATOM 129 CD1 TYR A 9 -5.237 5.704 10.171 1.00 0.00 C ATOM 130 CD2 TYR A 9 -7.417 6.684 9.766 1.00 0.00 C ATOM 131 CE1 TYR A 9 -5.845 4.596 10.770 1.00 0.00 C ATOM 132 CE2 TYR A 9 -8.027 5.575 10.366 1.00 0.00 C ATOM 133 CZ TYR A 9 -7.241 4.532 10.868 1.00 0.00 C ATOM 134 OH TYR A 9 -7.841 3.438 11.459 1.00 0.00 O ATOM 0 H TYR A 9 -3.729 10.511 9.407 1.00 0.00 H new ATOM 0 HA TYR A 9 -5.958 9.139 10.711 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -6.015 8.357 8.250 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -4.439 7.643 8.531 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -4.161 5.754 10.096 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -8.023 7.490 9.378 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -5.239 3.790 11.157 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -9.103 5.525 10.441 1.00 0.00 H new ATOM 0 HH TYR A 9 -8.814 3.552 11.447 1.00 0.00 H new ATOM 144 N GLY A 10 -4.152 8.162 12.168 1.00 0.00 N ATOM 145 CA GLY A 10 -3.036 7.717 13.049 1.00 0.00 C ATOM 146 C GLY A 10 -2.231 8.936 13.503 1.00 0.00 C ATOM 147 O GLY A 10 -2.249 9.306 14.659 1.00 0.00 O ATOM 0 H GLY A 10 -5.080 8.133 12.590 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.431 7.185 13.915 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.391 7.020 12.514 1.00 0.00 H new ATOM 151 N SER A 11 -1.525 9.568 12.599 1.00 0.00 N ATOM 152 CA SER A 11 -0.724 10.764 12.991 1.00 0.00 C ATOM 153 C SER A 11 0.015 11.323 11.770 1.00 0.00 C ATOM 154 O SER A 11 1.054 11.942 11.898 1.00 0.00 O ATOM 155 CB SER A 11 0.294 10.365 14.062 1.00 0.00 C ATOM 156 OG SER A 11 0.834 9.089 13.743 1.00 0.00 O ATOM 0 H SER A 11 -1.470 9.309 11.614 1.00 0.00 H new ATOM 0 HA SER A 11 -1.393 11.529 13.385 1.00 0.00 H new ATOM 0 HB2 SER A 11 1.091 11.107 14.117 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.183 10.336 15.042 1.00 0.00 H new ATOM 0 HG SER A 11 1.687 9.203 13.274 1.00 0.00 H new ATOM 162 N HIS A 12 -0.503 11.118 10.587 1.00 0.00 N ATOM 163 CA HIS A 12 0.176 11.644 9.374 1.00 0.00 C ATOM 164 C HIS A 12 -0.879 12.062 8.347 1.00 0.00 C ATOM 165 O HIS A 12 -1.959 11.508 8.295 1.00 0.00 O ATOM 166 CB HIS A 12 1.058 10.550 8.768 1.00 0.00 C ATOM 167 CG HIS A 12 1.860 9.879 9.849 1.00 0.00 C ATOM 168 ND1 HIS A 12 3.233 10.027 9.945 1.00 0.00 N ATOM 169 CD2 HIS A 12 1.498 9.049 10.879 1.00 0.00 C ATOM 170 CE1 HIS A 12 3.647 9.302 11.001 1.00 0.00 C ATOM 171 NE2 HIS A 12 2.628 8.684 11.606 1.00 0.00 N ATOM 0 H HIS A 12 -1.369 10.608 10.412 1.00 0.00 H new ATOM 0 HA HIS A 12 0.791 12.502 9.645 1.00 0.00 H new ATOM 0 HB2 HIS A 12 0.439 9.815 8.254 1.00 0.00 H new ATOM 0 HB3 HIS A 12 1.726 10.981 8.022 1.00 0.00 H new ATOM 0 HD2 HIS A 12 0.490 8.727 11.094 1.00 0.00 H new ATOM 0 HE1 HIS A 12 4.676 9.229 11.320 1.00 0.00 H new ATOM 0 HE2 HIS A 12 2.669 8.076 12.424 1.00 0.00 H new ATOM 179 N CYS A 13 -0.572 13.023 7.522 1.00 0.00 N ATOM 180 CA CYS A 13 -1.555 13.457 6.492 1.00 0.00 C ATOM 181 C CYS A 13 -1.393 12.555 5.269 1.00 0.00 C ATOM 182 O CYS A 13 -0.307 12.395 4.747 1.00 0.00 O ATOM 183 CB CYS A 13 -1.286 14.917 6.108 1.00 0.00 C ATOM 184 SG CYS A 13 -2.441 15.998 6.989 1.00 0.00 S ATOM 0 H CYS A 13 0.315 13.526 7.516 1.00 0.00 H new ATOM 0 HA CYS A 13 -2.571 13.381 6.879 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -0.259 15.186 6.356 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -1.399 15.047 5.032 1.00 0.00 H new ATOM 189 N TYR A 14 -2.458 11.949 4.816 1.00 0.00 N ATOM 190 CA TYR A 14 -2.354 11.042 3.640 1.00 0.00 C ATOM 191 C TYR A 14 -2.808 11.773 2.378 1.00 0.00 C ATOM 192 O TYR A 14 -3.684 12.612 2.418 1.00 0.00 O ATOM 193 CB TYR A 14 -3.230 9.808 3.863 1.00 0.00 C ATOM 194 CG TYR A 14 -2.688 9.007 5.025 1.00 0.00 C ATOM 195 CD1 TYR A 14 -2.754 9.523 6.325 1.00 0.00 C ATOM 196 CD2 TYR A 14 -2.117 7.746 4.804 1.00 0.00 C ATOM 197 CE1 TYR A 14 -2.253 8.783 7.400 1.00 0.00 C ATOM 198 CE2 TYR A 14 -1.616 7.005 5.882 1.00 0.00 C ATOM 199 CZ TYR A 14 -1.684 7.524 7.179 1.00 0.00 C ATOM 200 OH TYR A 14 -1.189 6.795 8.241 1.00 0.00 O ATOM 0 H TYR A 14 -3.394 12.044 5.210 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.316 10.732 3.519 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -4.258 10.110 4.064 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -3.249 9.195 2.962 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.193 10.495 6.498 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -2.063 7.346 3.802 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.305 9.183 8.402 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -1.177 6.033 5.712 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.553 7.149 9.079 1.00 0.00 H new ATOM 210 N ALA A 15 -2.216 11.458 1.256 1.00 0.00 N ATOM 211 CA ALA A 15 -2.609 12.131 -0.015 1.00 0.00 C ATOM 212 C ALA A 15 -2.593 11.112 -1.156 1.00 0.00 C ATOM 213 O ALA A 15 -1.685 10.314 -1.277 1.00 0.00 O ATOM 214 CB ALA A 15 -1.620 13.257 -0.322 1.00 0.00 C ATOM 0 H ALA A 15 -1.476 10.762 1.166 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.612 12.546 0.087 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.907 13.750 -1.251 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.631 13.982 0.492 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.617 12.842 -0.425 1.00 0.00 H new ATOM 220 N LEU A 16 -3.594 11.132 -1.992 1.00 0.00 N ATOM 221 CA LEU A 16 -3.648 10.166 -3.126 1.00 0.00 C ATOM 222 C LEU A 16 -3.074 10.828 -4.384 1.00 0.00 C ATOM 223 O LEU A 16 -3.437 11.934 -4.735 1.00 0.00 O ATOM 224 CB LEU A 16 -5.110 9.764 -3.368 1.00 0.00 C ATOM 225 CG LEU A 16 -5.251 9.035 -4.710 1.00 0.00 C ATOM 226 CD1 LEU A 16 -4.335 7.809 -4.733 1.00 0.00 C ATOM 227 CD2 LEU A 16 -6.702 8.583 -4.890 1.00 0.00 C ATOM 0 H LEU A 16 -4.381 11.779 -1.938 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.061 9.279 -2.890 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.455 9.120 -2.559 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.743 10.651 -3.361 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.971 9.711 -5.518 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.439 7.295 -5.688 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.300 8.125 -4.602 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.612 7.132 -3.925 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.806 8.064 -5.843 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.977 7.909 -4.078 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.358 9.453 -4.877 1.00 0.00 H new ATOM 239 N PHE A 17 -2.191 10.150 -5.073 1.00 0.00 N ATOM 240 CA PHE A 17 -1.600 10.713 -6.313 1.00 0.00 C ATOM 241 C PHE A 17 -1.917 9.746 -7.453 1.00 0.00 C ATOM 242 O PHE A 17 -1.499 8.604 -7.447 1.00 0.00 O ATOM 243 CB PHE A 17 -0.078 10.845 -6.145 1.00 0.00 C ATOM 244 CG PHE A 17 0.281 12.281 -5.824 1.00 0.00 C ATOM 245 CD1 PHE A 17 -0.333 12.934 -4.750 1.00 0.00 C ATOM 246 CD2 PHE A 17 1.227 12.958 -6.604 1.00 0.00 C ATOM 247 CE1 PHE A 17 -0.002 14.262 -4.454 1.00 0.00 C ATOM 248 CE2 PHE A 17 1.558 14.286 -6.308 1.00 0.00 C ATOM 249 CZ PHE A 17 0.943 14.938 -5.233 1.00 0.00 C ATOM 0 H PHE A 17 -1.854 9.221 -4.822 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.010 11.700 -6.525 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.267 10.187 -5.347 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.426 10.530 -7.058 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -1.063 12.413 -4.148 1.00 0.00 H new ATOM 0 HD2 PHE A 17 1.701 12.456 -7.434 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -0.476 14.764 -3.624 1.00 0.00 H new ATOM 0 HE2 PHE A 17 2.288 14.807 -6.909 1.00 0.00 H new ATOM 0 HZ PHE A 17 1.198 15.962 -5.005 1.00 0.00 H new ATOM 259 N LEU A 18 -2.652 10.192 -8.427 1.00 0.00 N ATOM 260 CA LEU A 18 -2.995 9.300 -9.562 1.00 0.00 C ATOM 261 C LEU A 18 -1.746 9.115 -10.401 1.00 0.00 C ATOM 262 O LEU A 18 -1.791 8.630 -11.515 1.00 0.00 O ATOM 263 CB LEU A 18 -4.104 9.939 -10.403 1.00 0.00 C ATOM 264 CG LEU A 18 -5.145 10.576 -9.477 1.00 0.00 C ATOM 265 CD1 LEU A 18 -6.364 11.001 -10.297 1.00 0.00 C ATOM 266 CD2 LEU A 18 -5.578 9.563 -8.414 1.00 0.00 C ATOM 0 H LEU A 18 -3.031 11.137 -8.486 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.351 8.336 -9.199 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.682 10.693 -11.067 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.576 9.186 -11.035 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.708 11.448 -8.990 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.105 11.454 -9.639 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.059 11.724 -11.053 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.797 10.127 -10.784 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.318 10.019 -7.757 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.013 8.689 -8.900 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.711 9.258 -7.827 1.00 0.00 H new ATOM 278 N SER A 19 -0.624 9.503 -9.867 1.00 0.00 N ATOM 279 CA SER A 19 0.646 9.354 -10.635 1.00 0.00 C ATOM 280 C SER A 19 1.279 7.988 -10.324 1.00 0.00 C ATOM 281 O SER A 19 1.546 7.677 -9.179 1.00 0.00 O ATOM 282 CB SER A 19 1.624 10.463 -10.255 1.00 0.00 C ATOM 283 OG SER A 19 0.988 11.368 -9.363 1.00 0.00 O ATOM 0 H SER A 19 -0.529 9.914 -8.939 1.00 0.00 H new ATOM 0 HA SER A 19 0.424 9.423 -11.700 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.511 10.036 -9.786 1.00 0.00 H new ATOM 0 HB3 SER A 19 1.958 10.990 -11.149 1.00 0.00 H new ATOM 0 HG SER A 19 1.367 12.264 -9.481 1.00 0.00 H new ATOM 289 N PRO A 20 1.526 7.180 -11.326 1.00 0.00 N ATOM 290 CA PRO A 20 2.144 5.843 -11.104 1.00 0.00 C ATOM 291 C PRO A 20 3.561 5.950 -10.524 1.00 0.00 C ATOM 292 O PRO A 20 4.275 6.897 -10.786 1.00 0.00 O ATOM 293 CB PRO A 20 2.190 5.255 -12.516 1.00 0.00 C ATOM 294 CG PRO A 20 1.620 6.284 -13.504 1.00 0.00 C ATOM 295 CD PRO A 20 1.203 7.534 -12.733 1.00 0.00 C ATOM 0 HA PRO A 20 1.587 5.240 -10.387 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.215 5.002 -12.785 1.00 0.00 H new ATOM 0 HB3 PRO A 20 1.612 4.332 -12.559 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.367 6.537 -14.257 1.00 0.00 H new ATOM 0 HG3 PRO A 20 0.764 5.865 -14.033 1.00 0.00 H new ATOM 0 HD2 PRO A 20 1.753 8.415 -13.064 1.00 0.00 H new ATOM 0 HD3 PRO A 20 0.143 7.753 -12.861 1.00 0.00 H new ATOM 303 N LYS A 21 3.981 4.978 -9.756 1.00 0.00 N ATOM 304 CA LYS A 21 5.360 5.028 -9.182 1.00 0.00 C ATOM 305 C LYS A 21 5.769 3.625 -8.718 1.00 0.00 C ATOM 306 O LYS A 21 5.073 2.996 -7.954 1.00 0.00 O ATOM 307 CB LYS A 21 5.384 5.989 -7.985 1.00 0.00 C ATOM 308 CG LYS A 21 5.427 7.442 -8.472 1.00 0.00 C ATOM 309 CD LYS A 21 6.010 8.333 -7.372 1.00 0.00 C ATOM 310 CE LYS A 21 5.914 9.799 -7.796 1.00 0.00 C ATOM 311 NZ LYS A 21 6.858 10.055 -8.920 1.00 0.00 N ATOM 0 H LYS A 21 3.433 4.156 -9.502 1.00 0.00 H new ATOM 0 HA LYS A 21 6.057 5.379 -9.942 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.501 5.832 -7.365 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.253 5.781 -7.360 1.00 0.00 H new ATOM 0 HG2 LYS A 21 6.034 7.516 -9.374 1.00 0.00 H new ATOM 0 HG3 LYS A 21 4.424 7.779 -8.734 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.469 8.177 -6.439 1.00 0.00 H new ATOM 0 HD3 LYS A 21 7.050 8.065 -7.186 1.00 0.00 H new ATOM 0 HE2 LYS A 21 4.895 10.034 -8.103 1.00 0.00 H new ATOM 0 HE3 LYS A 21 6.151 10.448 -6.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 6.945 11.080 -9.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 7.791 9.660 -8.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 6.498 9.604 -9.785 1.00 0.00 H new ATOM 325 N SER A 22 6.900 3.136 -9.154 1.00 0.00 N ATOM 326 CA SER A 22 7.336 1.778 -8.711 1.00 0.00 C ATOM 327 C SER A 22 7.217 1.692 -7.190 1.00 0.00 C ATOM 328 O SER A 22 7.407 2.667 -6.491 1.00 0.00 O ATOM 329 CB SER A 22 8.788 1.543 -9.127 1.00 0.00 C ATOM 330 OG SER A 22 8.854 1.379 -10.537 1.00 0.00 O ATOM 0 H SER A 22 7.536 3.613 -9.792 1.00 0.00 H new ATOM 0 HA SER A 22 6.706 1.019 -9.174 1.00 0.00 H new ATOM 0 HB2 SER A 22 9.407 2.385 -8.818 1.00 0.00 H new ATOM 0 HB3 SER A 22 9.182 0.658 -8.628 1.00 0.00 H new ATOM 0 HG SER A 22 8.739 0.432 -10.762 1.00 0.00 H new ATOM 336 N TRP A 23 6.907 0.539 -6.663 1.00 0.00 N ATOM 337 CA TRP A 23 6.787 0.421 -5.182 1.00 0.00 C ATOM 338 C TRP A 23 8.080 0.917 -4.551 1.00 0.00 C ATOM 339 O TRP A 23 8.123 1.300 -3.401 1.00 0.00 O ATOM 340 CB TRP A 23 6.561 -1.042 -4.787 1.00 0.00 C ATOM 341 CG TRP A 23 6.592 -1.159 -3.297 1.00 0.00 C ATOM 342 CD1 TRP A 23 5.501 -1.256 -2.502 1.00 0.00 C ATOM 343 CD2 TRP A 23 7.749 -1.185 -2.410 1.00 0.00 C ATOM 344 NE1 TRP A 23 5.915 -1.340 -1.184 1.00 0.00 N ATOM 345 CE2 TRP A 23 7.291 -1.301 -1.076 1.00 0.00 C ATOM 346 CE3 TRP A 23 9.137 -1.120 -2.632 1.00 0.00 C ATOM 347 CZ2 TRP A 23 8.178 -1.349 -0.001 1.00 0.00 C ATOM 348 CZ3 TRP A 23 10.032 -1.170 -1.550 1.00 0.00 C ATOM 349 CH2 TRP A 23 9.554 -1.283 -0.238 1.00 0.00 C ATOM 0 H TRP A 23 6.733 -0.318 -7.187 1.00 0.00 H new ATOM 0 HA TRP A 23 5.941 1.015 -4.835 1.00 0.00 H new ATOM 0 HB2 TRP A 23 5.603 -1.391 -5.171 1.00 0.00 H new ATOM 0 HB3 TRP A 23 7.331 -1.674 -5.230 1.00 0.00 H new ATOM 0 HD1 TRP A 23 4.475 -1.266 -2.841 1.00 0.00 H new ATOM 0 HE1 TRP A 23 5.281 -1.421 -0.389 1.00 0.00 H new ATOM 0 HE3 TRP A 23 9.516 -1.031 -3.639 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 7.804 -1.437 1.008 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 11.096 -1.121 -1.731 1.00 0.00 H new ATOM 0 HH2 TRP A 23 10.248 -1.319 0.589 1.00 0.00 H new ATOM 360 N THR A 24 9.136 0.915 -5.310 1.00 0.00 N ATOM 361 CA THR A 24 10.448 1.380 -4.781 1.00 0.00 C ATOM 362 C THR A 24 10.595 2.874 -5.067 1.00 0.00 C ATOM 363 O THR A 24 11.394 3.564 -4.465 1.00 0.00 O ATOM 364 CB THR A 24 11.567 0.603 -5.477 1.00 0.00 C ATOM 365 OG1 THR A 24 12.790 0.809 -4.782 1.00 0.00 O ATOM 366 CG2 THR A 24 11.715 1.080 -6.926 1.00 0.00 C ATOM 0 H THR A 24 9.148 0.609 -6.283 1.00 0.00 H new ATOM 0 HA THR A 24 10.506 1.210 -3.706 1.00 0.00 H new ATOM 0 HB THR A 24 11.319 -0.458 -5.475 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.507 0.310 -5.227 1.00 0.00 H new ATOM 0 HG21 THR A 24 12.514 0.521 -7.413 1.00 0.00 H new ATOM 0 HG22 THR A 24 10.779 0.916 -7.460 1.00 0.00 H new ATOM 0 HG23 THR A 24 11.957 2.143 -6.936 1.00 0.00 H new ATOM 374 N ASP A 25 9.823 3.369 -5.989 1.00 0.00 N ATOM 375 CA ASP A 25 9.891 4.815 -6.345 1.00 0.00 C ATOM 376 C ASP A 25 8.960 5.600 -5.429 1.00 0.00 C ATOM 377 O ASP A 25 9.294 6.669 -4.957 1.00 0.00 O ATOM 378 CB ASP A 25 9.464 5.015 -7.802 1.00 0.00 C ATOM 379 CG ASP A 25 10.616 4.638 -8.736 1.00 0.00 C ATOM 380 OD1 ASP A 25 11.755 4.721 -8.306 1.00 0.00 O ATOM 381 OD2 ASP A 25 10.340 4.274 -9.868 1.00 0.00 O ATOM 0 H ASP A 25 9.139 2.829 -6.519 1.00 0.00 H new ATOM 0 HA ASP A 25 10.914 5.170 -6.223 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.590 4.402 -8.022 1.00 0.00 H new ATOM 0 HB3 ASP A 25 9.175 6.053 -7.967 1.00 0.00 H new ATOM 386 N ALA A 26 7.796 5.075 -5.153 1.00 0.00 N ATOM 387 CA ALA A 26 6.871 5.789 -4.254 1.00 0.00 C ATOM 388 C ALA A 26 7.396 5.608 -2.840 1.00 0.00 C ATOM 389 O ALA A 26 7.255 6.462 -1.990 1.00 0.00 O ATOM 390 CB ALA A 26 5.479 5.183 -4.384 1.00 0.00 C ATOM 0 H ALA A 26 7.455 4.184 -5.515 1.00 0.00 H new ATOM 0 HA ALA A 26 6.808 6.848 -4.503 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.791 5.707 -3.721 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.135 5.279 -5.414 1.00 0.00 H new ATOM 0 HB3 ALA A 26 5.514 4.129 -4.110 1.00 0.00 H new ATOM 396 N ASP A 27 8.021 4.492 -2.596 1.00 0.00 N ATOM 397 CA ASP A 27 8.589 4.230 -1.255 1.00 0.00 C ATOM 398 C ASP A 27 9.663 5.274 -0.950 1.00 0.00 C ATOM 399 O ASP A 27 9.735 5.805 0.140 1.00 0.00 O ATOM 400 CB ASP A 27 9.210 2.836 -1.265 1.00 0.00 C ATOM 401 CG ASP A 27 10.007 2.615 0.023 1.00 0.00 C ATOM 402 OD1 ASP A 27 9.767 3.336 0.976 1.00 0.00 O ATOM 403 OD2 ASP A 27 10.842 1.726 0.032 1.00 0.00 O ATOM 0 H ASP A 27 8.162 3.746 -3.277 1.00 0.00 H new ATOM 0 HA ASP A 27 7.813 4.287 -0.492 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.429 2.081 -1.355 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.862 2.725 -2.131 1.00 0.00 H new ATOM 408 N LEU A 28 10.502 5.570 -1.905 1.00 0.00 N ATOM 409 CA LEU A 28 11.577 6.576 -1.675 1.00 0.00 C ATOM 410 C LEU A 28 10.977 7.985 -1.641 1.00 0.00 C ATOM 411 O LEU A 28 11.299 8.787 -0.787 1.00 0.00 O ATOM 412 CB LEU A 28 12.605 6.491 -2.808 1.00 0.00 C ATOM 413 CG LEU A 28 13.856 7.299 -2.438 1.00 0.00 C ATOM 414 CD1 LEU A 28 14.800 6.443 -1.588 1.00 0.00 C ATOM 415 CD2 LEU A 28 14.582 7.730 -3.717 1.00 0.00 C ATOM 0 H LEU A 28 10.489 5.157 -2.838 1.00 0.00 H new ATOM 0 HA LEU A 28 12.061 6.369 -0.721 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.874 5.450 -2.990 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.173 6.875 -3.732 1.00 0.00 H new ATOM 0 HG LEU A 28 13.556 8.178 -1.868 1.00 0.00 H new ATOM 0 HD11 LEU A 28 15.685 7.024 -1.330 1.00 0.00 H new ATOM 0 HD12 LEU A 28 14.289 6.135 -0.676 1.00 0.00 H new ATOM 0 HD13 LEU A 28 15.098 5.560 -2.153 1.00 0.00 H new ATOM 0 HD21 LEU A 28 15.471 8.304 -3.455 1.00 0.00 H new ATOM 0 HD22 LEU A 28 14.875 6.847 -4.284 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.917 8.346 -4.322 1.00 0.00 H new ATOM 427 N ALA A 29 10.115 8.300 -2.570 1.00 0.00 N ATOM 428 CA ALA A 29 9.507 9.661 -2.594 1.00 0.00 C ATOM 429 C ALA A 29 8.655 9.875 -1.343 1.00 0.00 C ATOM 430 O ALA A 29 8.838 10.831 -0.617 1.00 0.00 O ATOM 431 CB ALA A 29 8.629 9.806 -3.833 1.00 0.00 C ATOM 0 H ALA A 29 9.806 7.674 -3.313 1.00 0.00 H new ATOM 0 HA ALA A 29 10.303 10.405 -2.618 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.185 10.801 -3.850 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.236 9.664 -4.727 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.838 9.056 -3.808 1.00 0.00 H new ATOM 437 N CYS A 30 7.727 8.996 -1.074 1.00 0.00 N ATOM 438 CA CYS A 30 6.889 9.175 0.137 1.00 0.00 C ATOM 439 C CYS A 30 7.801 9.145 1.360 1.00 0.00 C ATOM 440 O CYS A 30 7.465 9.644 2.414 1.00 0.00 O ATOM 441 CB CYS A 30 5.854 8.053 0.215 1.00 0.00 C ATOM 442 SG CYS A 30 4.719 8.377 1.587 1.00 0.00 S ATOM 0 H CYS A 30 7.517 8.171 -1.636 1.00 0.00 H new ATOM 0 HA CYS A 30 6.360 10.127 0.098 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.301 7.988 -0.722 1.00 0.00 H new ATOM 0 HB3 CYS A 30 6.351 7.094 0.359 1.00 0.00 H new ATOM 447 N GLN A 31 8.972 8.582 1.218 1.00 0.00 N ATOM 448 CA GLN A 31 9.922 8.546 2.362 1.00 0.00 C ATOM 449 C GLN A 31 10.623 9.899 2.439 1.00 0.00 C ATOM 450 O GLN A 31 10.963 10.379 3.502 1.00 0.00 O ATOM 451 CB GLN A 31 10.956 7.437 2.150 1.00 0.00 C ATOM 452 CG GLN A 31 12.046 7.529 3.225 1.00 0.00 C ATOM 453 CD GLN A 31 13.100 8.559 2.812 1.00 0.00 C ATOM 454 OE1 GLN A 31 13.030 9.121 1.738 1.00 0.00 O ATOM 455 NE2 GLN A 31 14.081 8.834 3.629 1.00 0.00 N ATOM 0 H GLN A 31 9.309 8.147 0.359 1.00 0.00 H new ATOM 0 HA GLN A 31 9.385 8.344 3.289 1.00 0.00 H new ATOM 0 HB2 GLN A 31 10.471 6.462 2.194 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.401 7.527 1.159 1.00 0.00 H new ATOM 0 HG2 GLN A 31 11.604 7.812 4.180 1.00 0.00 H new ATOM 0 HG3 GLN A 31 12.513 6.554 3.366 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.141 8.362 4.531 1.00 0.00 H new ATOM 0 HE22 GLN A 31 14.788 9.520 3.365 1.00 0.00 H new ATOM 464 N LYS A 32 10.828 10.519 1.311 1.00 0.00 N ATOM 465 CA LYS A 32 11.492 11.843 1.299 1.00 0.00 C ATOM 466 C LYS A 32 10.611 12.842 2.052 1.00 0.00 C ATOM 467 O LYS A 32 10.965 13.990 2.234 1.00 0.00 O ATOM 468 CB LYS A 32 11.682 12.299 -0.154 1.00 0.00 C ATOM 469 CG LYS A 32 12.050 13.786 -0.191 1.00 0.00 C ATOM 470 CD LYS A 32 12.700 14.126 -1.537 1.00 0.00 C ATOM 471 CE LYS A 32 14.091 13.484 -1.633 1.00 0.00 C ATOM 472 NZ LYS A 32 14.984 14.362 -2.441 1.00 0.00 N ATOM 0 H LYS A 32 10.561 10.160 0.394 1.00 0.00 H new ATOM 0 HA LYS A 32 12.467 11.782 1.783 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.466 11.710 -0.630 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.767 12.128 -0.720 1.00 0.00 H new ATOM 0 HG2 LYS A 32 11.158 14.395 -0.043 1.00 0.00 H new ATOM 0 HG3 LYS A 32 12.735 14.021 0.624 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.071 13.770 -2.353 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.783 15.207 -1.646 1.00 0.00 H new ATOM 0 HE2 LYS A 32 14.508 13.341 -0.636 1.00 0.00 H new ATOM 0 HE3 LYS A 32 14.018 12.498 -2.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 15.928 13.930 -2.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 14.587 14.477 -3.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 15.061 15.293 -1.984 1.00 0.00 H new ATOM 486 N ARG A 33 9.458 12.406 2.489 1.00 0.00 N ATOM 487 CA ARG A 33 8.538 13.315 3.231 1.00 0.00 C ATOM 488 C ARG A 33 8.807 13.196 4.732 1.00 0.00 C ATOM 489 O ARG A 33 9.387 12.228 5.181 1.00 0.00 O ATOM 490 CB ARG A 33 7.088 12.914 2.922 1.00 0.00 C ATOM 491 CG ARG A 33 6.551 13.754 1.757 1.00 0.00 C ATOM 492 CD ARG A 33 5.060 13.470 1.565 1.00 0.00 C ATOM 493 NE ARG A 33 4.643 13.912 0.203 1.00 0.00 N ATOM 494 CZ ARG A 33 3.382 14.116 -0.059 1.00 0.00 C ATOM 495 NH1 ARG A 33 2.778 15.168 0.421 1.00 0.00 N ATOM 496 NH2 ARG A 33 2.724 13.270 -0.804 1.00 0.00 N ATOM 0 H ARG A 33 9.114 11.454 2.362 1.00 0.00 H new ATOM 0 HA ARG A 33 8.703 14.348 2.923 1.00 0.00 H new ATOM 0 HB2 ARG A 33 7.040 11.855 2.670 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.465 13.060 3.805 1.00 0.00 H new ATOM 0 HG2 ARG A 33 6.707 14.814 1.957 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.097 13.519 0.843 1.00 0.00 H new ATOM 0 HD2 ARG A 33 4.862 12.405 1.690 1.00 0.00 H new ATOM 0 HD3 ARG A 33 4.478 13.994 2.323 1.00 0.00 H new ATOM 0 HE ARG A 33 5.344 14.055 -0.524 1.00 0.00 H new ATOM 0 HH11 ARG A 33 3.292 15.831 1.001 1.00 0.00 H new ATOM 0 HH12 ARG A 33 1.792 15.328 0.216 1.00 0.00 H new ATOM 0 HH21 ARG A 33 3.196 12.449 -1.182 1.00 0.00 H new ATOM 0 HH22 ARG A 33 1.738 13.430 -1.008 1.00 0.00 H new ATOM 510 N PRO A 34 8.386 14.167 5.508 1.00 0.00 N ATOM 511 CA PRO A 34 8.602 14.124 6.977 1.00 0.00 C ATOM 512 C PRO A 34 8.243 12.755 7.555 1.00 0.00 C ATOM 513 O PRO A 34 7.147 12.530 8.032 1.00 0.00 O ATOM 514 CB PRO A 34 7.665 15.232 7.481 1.00 0.00 C ATOM 515 CG PRO A 34 6.976 15.876 6.266 1.00 0.00 C ATOM 516 CD PRO A 34 7.665 15.362 4.998 1.00 0.00 C ATOM 0 HA PRO A 34 9.640 14.276 7.273 1.00 0.00 H new ATOM 0 HB2 PRO A 34 6.922 14.819 8.163 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.228 15.981 8.038 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.916 15.623 6.252 1.00 0.00 H new ATOM 0 HG3 PRO A 34 7.044 16.962 6.322 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.948 15.105 4.218 1.00 0.00 H new ATOM 0 HD3 PRO A 34 8.346 16.100 4.574 1.00 0.00 H new ATOM 524 N SER A 35 9.161 11.834 7.493 1.00 0.00 N ATOM 525 CA SER A 35 8.890 10.470 8.012 1.00 0.00 C ATOM 526 C SER A 35 7.778 9.837 7.183 1.00 0.00 C ATOM 527 O SER A 35 7.173 8.861 7.580 1.00 0.00 O ATOM 528 CB SER A 35 8.468 10.547 9.482 1.00 0.00 C ATOM 529 OG SER A 35 8.742 9.304 10.114 1.00 0.00 O ATOM 0 H SER A 35 10.093 11.970 7.102 1.00 0.00 H new ATOM 0 HA SER A 35 9.792 9.862 7.939 1.00 0.00 H new ATOM 0 HB2 SER A 35 9.006 11.350 9.985 1.00 0.00 H new ATOM 0 HB3 SER A 35 7.406 10.779 9.556 1.00 0.00 H new ATOM 0 HG SER A 35 8.385 8.573 9.567 1.00 0.00 H new ATOM 535 N GLY A 36 7.500 10.385 6.032 1.00 0.00 N ATOM 536 CA GLY A 36 6.423 9.809 5.183 1.00 0.00 C ATOM 537 C GLY A 36 6.855 8.439 4.650 1.00 0.00 C ATOM 538 O GLY A 36 7.923 7.952 4.952 1.00 0.00 O ATOM 0 H GLY A 36 7.971 11.203 5.645 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.505 9.710 5.762 1.00 0.00 H new ATOM 0 HA3 GLY A 36 6.205 10.480 4.352 1.00 0.00 H new ATOM 542 N ASN A 37 6.020 7.823 3.859 1.00 0.00 N ATOM 543 CA ASN A 37 6.341 6.480 3.282 1.00 0.00 C ATOM 544 C ASN A 37 5.034 5.848 2.790 1.00 0.00 C ATOM 545 O ASN A 37 4.000 6.006 3.412 1.00 0.00 O ATOM 546 CB ASN A 37 6.978 5.580 4.357 1.00 0.00 C ATOM 547 CG ASN A 37 8.496 5.522 4.157 1.00 0.00 C ATOM 548 OD1 ASN A 37 8.980 4.883 3.126 1.00 0.00 O flip ATOM 549 ND2 ASN A 37 9.248 6.057 4.947 1.00 0.00 N flip ATOM 0 H ASN A 37 5.113 8.198 3.582 1.00 0.00 H new ATOM 0 HA ASN A 37 7.047 6.587 2.458 1.00 0.00 H new ATOM 0 HB2 ASN A 37 6.748 5.966 5.350 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.556 4.576 4.300 1.00 0.00 H new ATOM 0 HD21 ASN A 37 8.871 6.556 5.752 1.00 0.00 H new ATOM 0 HD22 ASN A 37 10.257 6.007 4.805 1.00 0.00 H new ATOM 556 N LEU A 38 5.061 5.156 1.671 1.00 0.00 N ATOM 557 CA LEU A 38 3.812 4.526 1.138 1.00 0.00 C ATOM 558 C LEU A 38 2.791 4.308 2.267 1.00 0.00 C ATOM 559 O LEU A 38 3.127 3.868 3.349 1.00 0.00 O ATOM 560 CB LEU A 38 4.165 3.186 0.495 1.00 0.00 C ATOM 561 CG LEU A 38 4.861 3.433 -0.843 1.00 0.00 C ATOM 562 CD1 LEU A 38 5.552 2.152 -1.313 1.00 0.00 C ATOM 563 CD2 LEU A 38 3.829 3.876 -1.884 1.00 0.00 C ATOM 0 H LEU A 38 5.896 5.002 1.106 1.00 0.00 H new ATOM 0 HA LEU A 38 3.367 5.189 0.396 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.816 2.613 1.156 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.263 2.593 0.344 1.00 0.00 H new ATOM 0 HG LEU A 38 5.609 4.216 -0.720 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.046 2.334 -2.267 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.292 1.845 -0.574 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.811 1.362 -1.434 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.327 4.052 -2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.077 3.096 -2.005 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.348 4.796 -1.551 1.00 0.00 H new ATOM 575 N VAL A 39 1.551 4.635 2.012 1.00 0.00 N ATOM 576 CA VAL A 39 0.479 4.486 3.046 1.00 0.00 C ATOM 577 C VAL A 39 0.723 3.263 3.939 1.00 0.00 C ATOM 578 O VAL A 39 1.302 2.278 3.527 1.00 0.00 O ATOM 579 CB VAL A 39 -0.873 4.343 2.343 1.00 0.00 C ATOM 580 CG1 VAL A 39 -0.754 3.332 1.201 1.00 0.00 C ATOM 581 CG2 VAL A 39 -1.933 3.860 3.339 1.00 0.00 C ATOM 0 H VAL A 39 1.229 5.005 1.118 1.00 0.00 H new ATOM 0 HA VAL A 39 0.488 5.371 3.682 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.169 5.313 1.944 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.718 3.232 0.702 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.009 3.678 0.485 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.451 2.365 1.602 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.892 3.761 2.830 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.636 2.893 3.746 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -2.026 4.582 4.150 1.00 0.00 H new ATOM 591 N SER A 40 0.275 3.338 5.167 1.00 0.00 N ATOM 592 CA SER A 40 0.456 2.203 6.126 1.00 0.00 C ATOM 593 C SER A 40 -0.886 1.480 6.333 1.00 0.00 C ATOM 594 O SER A 40 -1.902 1.883 5.803 1.00 0.00 O ATOM 595 CB SER A 40 0.951 2.762 7.465 1.00 0.00 C ATOM 596 OG SER A 40 1.218 4.150 7.320 1.00 0.00 O ATOM 0 H SER A 40 -0.214 4.146 5.551 1.00 0.00 H new ATOM 0 HA SER A 40 1.183 1.495 5.728 1.00 0.00 H new ATOM 0 HB2 SER A 40 0.201 2.602 8.239 1.00 0.00 H new ATOM 0 HB3 SER A 40 1.852 2.237 7.781 1.00 0.00 H new ATOM 0 HG SER A 40 0.379 4.653 7.385 1.00 0.00 H new ATOM 602 N VAL A 41 -0.898 0.415 7.103 1.00 0.00 N ATOM 603 CA VAL A 41 -2.180 -0.324 7.333 1.00 0.00 C ATOM 604 C VAL A 41 -2.018 -1.311 8.507 1.00 0.00 C ATOM 605 O VAL A 41 -1.625 -2.446 8.318 1.00 0.00 O ATOM 606 CB VAL A 41 -2.585 -1.107 6.060 1.00 0.00 C ATOM 607 CG1 VAL A 41 -3.933 -0.598 5.544 1.00 0.00 C ATOM 608 CG2 VAL A 41 -1.534 -0.934 4.954 1.00 0.00 C ATOM 0 H VAL A 41 -0.082 0.029 7.578 1.00 0.00 H new ATOM 0 HA VAL A 41 -2.958 0.401 7.572 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.657 -2.163 6.321 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.213 -1.153 4.648 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.694 -0.741 6.311 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -3.854 0.462 5.304 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -1.841 -1.493 4.070 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.442 0.122 4.701 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -0.572 -1.308 5.304 1.00 0.00 H new ATOM 618 N LEU A 42 -2.321 -0.893 9.717 1.00 0.00 N ATOM 619 CA LEU A 42 -2.190 -1.818 10.891 1.00 0.00 C ATOM 620 C LEU A 42 -3.566 -2.115 11.497 1.00 0.00 C ATOM 621 O LEU A 42 -3.660 -2.630 12.594 1.00 0.00 O ATOM 622 CB LEU A 42 -1.321 -1.180 11.977 1.00 0.00 C ATOM 623 CG LEU A 42 0.147 -1.232 11.566 1.00 0.00 C ATOM 624 CD1 LEU A 42 1.002 -0.519 12.627 1.00 0.00 C ATOM 625 CD2 LEU A 42 0.592 -2.698 11.425 1.00 0.00 C ATOM 0 H LEU A 42 -2.652 0.045 9.941 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.731 -2.741 10.536 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.626 -0.146 12.138 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.462 -1.705 12.922 1.00 0.00 H new ATOM 0 HG LEU A 42 0.276 -0.729 10.608 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.051 -0.556 12.334 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.685 0.521 12.711 1.00 0.00 H new ATOM 0 HD13 LEU A 42 0.877 -1.016 13.589 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.641 -2.733 11.131 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.465 -3.210 12.379 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.014 -3.191 10.665 1.00 0.00 H new ATOM 637 N SER A 43 -4.632 -1.798 10.819 1.00 0.00 N ATOM 638 CA SER A 43 -5.977 -2.076 11.405 1.00 0.00 C ATOM 639 C SER A 43 -6.992 -2.350 10.297 1.00 0.00 C ATOM 640 O SER A 43 -6.915 -1.799 9.217 1.00 0.00 O ATOM 641 CB SER A 43 -6.433 -0.868 12.223 1.00 0.00 C ATOM 642 OG SER A 43 -7.834 -0.953 12.444 1.00 0.00 O ATOM 0 H SER A 43 -4.635 -1.364 9.896 1.00 0.00 H new ATOM 0 HA SER A 43 -5.909 -2.954 12.047 1.00 0.00 H new ATOM 0 HB2 SER A 43 -5.904 -0.839 13.176 1.00 0.00 H new ATOM 0 HB3 SER A 43 -6.192 0.055 11.696 1.00 0.00 H new ATOM 0 HG SER A 43 -8.130 -0.181 12.970 1.00 0.00 H new ATOM 648 N GLY A 44 -7.956 -3.190 10.565 1.00 0.00 N ATOM 649 CA GLY A 44 -8.990 -3.492 9.537 1.00 0.00 C ATOM 650 C GLY A 44 -9.780 -2.220 9.239 1.00 0.00 C ATOM 651 O GLY A 44 -10.488 -2.131 8.256 1.00 0.00 O ATOM 0 H GLY A 44 -8.071 -3.680 11.452 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.519 -3.865 8.627 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.658 -4.276 9.894 1.00 0.00 H new ATOM 655 N ALA A 45 -9.655 -1.231 10.082 1.00 0.00 N ATOM 656 CA ALA A 45 -10.387 0.045 9.850 1.00 0.00 C ATOM 657 C ALA A 45 -9.556 0.926 8.918 1.00 0.00 C ATOM 658 O ALA A 45 -10.079 1.591 8.047 1.00 0.00 O ATOM 659 CB ALA A 45 -10.595 0.765 11.183 1.00 0.00 C ATOM 0 H ALA A 45 -9.077 -1.253 10.922 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.358 -0.161 9.399 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -11.131 1.699 11.012 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.176 0.130 11.853 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.627 0.980 11.636 1.00 0.00 H new ATOM 665 N GLU A 46 -8.263 0.928 9.092 1.00 0.00 N ATOM 666 CA GLU A 46 -7.394 1.756 8.212 1.00 0.00 C ATOM 667 C GLU A 46 -7.386 1.146 6.812 1.00 0.00 C ATOM 668 O GLU A 46 -7.506 1.838 5.821 1.00 0.00 O ATOM 669 CB GLU A 46 -5.970 1.776 8.772 1.00 0.00 C ATOM 670 CG GLU A 46 -5.155 2.855 8.055 1.00 0.00 C ATOM 671 CD GLU A 46 -3.716 2.837 8.575 1.00 0.00 C ATOM 672 OE1 GLU A 46 -3.534 2.558 9.748 1.00 0.00 O ATOM 673 OE2 GLU A 46 -2.821 3.104 7.789 1.00 0.00 O ATOM 0 H GLU A 46 -7.771 0.391 9.806 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.775 2.776 8.168 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.992 1.974 9.844 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.501 0.801 8.637 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.166 2.680 6.979 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.602 3.835 8.223 1.00 0.00 H new ATOM 680 N GLY A 47 -7.255 -0.149 6.721 1.00 0.00 N ATOM 681 CA GLY A 47 -7.252 -0.804 5.383 1.00 0.00 C ATOM 682 C GLY A 47 -8.560 -0.470 4.666 1.00 0.00 C ATOM 683 O GLY A 47 -8.615 -0.388 3.455 1.00 0.00 O ATOM 0 H GLY A 47 -7.150 -0.781 7.515 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.401 -0.458 4.796 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.147 -1.883 5.492 1.00 0.00 H new ATOM 687 N SER A 48 -9.612 -0.266 5.411 1.00 0.00 N ATOM 688 CA SER A 48 -10.916 0.080 4.782 1.00 0.00 C ATOM 689 C SER A 48 -10.948 1.585 4.527 1.00 0.00 C ATOM 690 O SER A 48 -11.536 2.054 3.574 1.00 0.00 O ATOM 691 CB SER A 48 -12.058 -0.306 5.724 1.00 0.00 C ATOM 692 OG SER A 48 -13.286 0.164 5.189 1.00 0.00 O ATOM 0 H SER A 48 -9.624 -0.324 6.429 1.00 0.00 H new ATOM 0 HA SER A 48 -11.033 -0.460 3.843 1.00 0.00 H new ATOM 0 HB2 SER A 48 -12.093 -1.388 5.848 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.891 0.123 6.712 1.00 0.00 H new ATOM 0 HG SER A 48 -14.020 -0.083 5.789 1.00 0.00 H new ATOM 698 N PHE A 49 -10.306 2.343 5.373 1.00 0.00 N ATOM 699 CA PHE A 49 -10.281 3.817 5.184 1.00 0.00 C ATOM 700 C PHE A 49 -9.470 4.140 3.928 1.00 0.00 C ATOM 701 O PHE A 49 -9.839 4.989 3.140 1.00 0.00 O ATOM 702 CB PHE A 49 -9.626 4.476 6.401 1.00 0.00 C ATOM 703 CG PHE A 49 -9.811 5.973 6.324 1.00 0.00 C ATOM 704 CD1 PHE A 49 -11.060 6.539 6.603 1.00 0.00 C ATOM 705 CD2 PHE A 49 -8.733 6.795 5.974 1.00 0.00 C ATOM 706 CE1 PHE A 49 -11.232 7.927 6.530 1.00 0.00 C ATOM 707 CE2 PHE A 49 -8.903 8.182 5.901 1.00 0.00 C ATOM 708 CZ PHE A 49 -10.154 8.748 6.181 1.00 0.00 C ATOM 0 H PHE A 49 -9.797 2.002 6.189 1.00 0.00 H new ATOM 0 HA PHE A 49 -11.297 4.195 5.075 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -10.070 4.091 7.319 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.564 4.231 6.433 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -11.891 5.905 6.875 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -7.769 6.358 5.760 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -12.197 8.364 6.743 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -8.071 8.815 5.629 1.00 0.00 H new ATOM 0 HZ PHE A 49 -10.286 9.819 6.127 1.00 0.00 H new ATOM 718 N VAL A 50 -8.374 3.459 3.730 1.00 0.00 N ATOM 719 CA VAL A 50 -7.548 3.717 2.521 1.00 0.00 C ATOM 720 C VAL A 50 -8.350 3.319 1.282 1.00 0.00 C ATOM 721 O VAL A 50 -8.340 4.002 0.278 1.00 0.00 O ATOM 722 CB VAL A 50 -6.261 2.889 2.584 1.00 0.00 C ATOM 723 CG1 VAL A 50 -5.445 3.119 1.311 1.00 0.00 C ATOM 724 CG2 VAL A 50 -5.438 3.322 3.800 1.00 0.00 C ATOM 0 H VAL A 50 -8.017 2.736 4.354 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.288 4.774 2.474 1.00 0.00 H new ATOM 0 HB VAL A 50 -6.512 1.832 2.670 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.529 2.530 1.355 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -6.031 2.815 0.443 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.193 4.176 1.226 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.521 2.734 3.847 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.187 4.379 3.712 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -6.019 3.162 4.708 1.00 0.00 H new ATOM 734 N SER A 51 -9.051 2.219 1.350 1.00 0.00 N ATOM 735 CA SER A 51 -9.861 1.777 0.181 1.00 0.00 C ATOM 736 C SER A 51 -10.824 2.896 -0.219 1.00 0.00 C ATOM 737 O SER A 51 -11.044 3.149 -1.385 1.00 0.00 O ATOM 738 CB SER A 51 -10.659 0.529 0.557 1.00 0.00 C ATOM 739 OG SER A 51 -11.758 0.388 -0.335 1.00 0.00 O ATOM 0 H SER A 51 -9.097 1.608 2.165 1.00 0.00 H new ATOM 0 HA SER A 51 -9.201 1.547 -0.655 1.00 0.00 H new ATOM 0 HB2 SER A 51 -10.021 -0.353 0.508 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.017 0.608 1.584 1.00 0.00 H new ATOM 0 HG SER A 51 -11.852 -0.553 -0.592 1.00 0.00 H new ATOM 745 N SER A 52 -11.398 3.568 0.741 1.00 0.00 N ATOM 746 CA SER A 52 -12.348 4.670 0.419 1.00 0.00 C ATOM 747 C SER A 52 -11.570 5.876 -0.116 1.00 0.00 C ATOM 748 O SER A 52 -12.104 6.708 -0.823 1.00 0.00 O ATOM 749 CB SER A 52 -13.106 5.075 1.684 1.00 0.00 C ATOM 750 OG SER A 52 -14.209 5.900 1.327 1.00 0.00 O ATOM 0 H SER A 52 -11.250 3.401 1.736 1.00 0.00 H new ATOM 0 HA SER A 52 -13.056 4.329 -0.337 1.00 0.00 H new ATOM 0 HB2 SER A 52 -13.456 4.188 2.212 1.00 0.00 H new ATOM 0 HB3 SER A 52 -12.443 5.609 2.364 1.00 0.00 H new ATOM 0 HG SER A 52 -14.698 6.160 2.135 1.00 0.00 H new ATOM 756 N LEU A 53 -10.313 5.976 0.217 1.00 0.00 N ATOM 757 CA LEU A 53 -9.499 7.123 -0.267 1.00 0.00 C ATOM 758 C LEU A 53 -9.077 6.863 -1.715 1.00 0.00 C ATOM 759 O LEU A 53 -8.785 7.778 -2.459 1.00 0.00 O ATOM 760 CB LEU A 53 -8.256 7.264 0.629 1.00 0.00 C ATOM 761 CG LEU A 53 -7.138 8.026 -0.096 1.00 0.00 C ATOM 762 CD1 LEU A 53 -7.572 9.473 -0.346 1.00 0.00 C ATOM 763 CD2 LEU A 53 -5.881 8.026 0.778 1.00 0.00 C ATOM 0 H LEU A 53 -9.814 5.309 0.806 1.00 0.00 H new ATOM 0 HA LEU A 53 -10.080 8.044 -0.225 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.523 7.789 1.547 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.899 6.276 0.919 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.931 7.540 -1.049 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.774 10.008 -0.861 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -8.471 9.482 -0.962 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.780 9.960 0.607 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -5.083 8.566 0.268 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.099 8.513 1.729 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.565 6.999 0.961 1.00 0.00 H new ATOM 775 N VAL A 54 -9.027 5.622 -2.115 1.00 0.00 N ATOM 776 CA VAL A 54 -8.603 5.295 -3.506 1.00 0.00 C ATOM 777 C VAL A 54 -9.723 4.548 -4.237 1.00 0.00 C ATOM 778 O VAL A 54 -9.499 3.923 -5.251 1.00 0.00 O ATOM 779 CB VAL A 54 -7.336 4.436 -3.452 1.00 0.00 C ATOM 780 CG1 VAL A 54 -6.270 5.169 -2.636 1.00 0.00 C ATOM 781 CG2 VAL A 54 -7.642 3.094 -2.782 1.00 0.00 C ATOM 0 H VAL A 54 -9.263 4.817 -1.535 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.394 6.215 -4.051 1.00 0.00 H new ATOM 0 HB VAL A 54 -6.978 4.259 -4.466 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.365 4.564 -2.593 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -6.045 6.126 -3.108 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.640 5.341 -1.625 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.736 2.489 -2.748 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -8.001 3.267 -1.768 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.407 2.568 -3.353 1.00 0.00 H new ATOM 791 N LYS A 55 -10.927 4.612 -3.733 1.00 0.00 N ATOM 792 CA LYS A 55 -12.057 3.910 -4.409 1.00 0.00 C ATOM 793 C LYS A 55 -12.369 4.610 -5.735 1.00 0.00 C ATOM 794 O LYS A 55 -12.842 4.003 -6.675 1.00 0.00 O ATOM 795 CB LYS A 55 -13.298 3.955 -3.508 1.00 0.00 C ATOM 796 CG LYS A 55 -14.391 3.037 -4.075 1.00 0.00 C ATOM 797 CD LYS A 55 -14.223 1.618 -3.514 1.00 0.00 C ATOM 798 CE LYS A 55 -14.581 1.593 -2.021 1.00 0.00 C ATOM 799 NZ LYS A 55 -15.217 0.287 -1.689 1.00 0.00 N ATOM 0 H LYS A 55 -11.177 5.119 -2.884 1.00 0.00 H new ATOM 0 HA LYS A 55 -11.780 2.873 -4.598 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -13.036 3.641 -2.498 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -13.670 4.977 -3.438 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -15.376 3.426 -3.816 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -14.333 3.017 -5.163 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -14.862 0.925 -4.061 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -13.196 1.283 -3.655 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -13.685 1.738 -1.418 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -15.260 2.412 -1.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -15.461 0.267 -0.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -16.081 0.167 -2.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -14.554 -0.486 -1.901 1.00 0.00 H new ATOM 813 N SER A 56 -12.098 5.884 -5.817 1.00 0.00 N ATOM 814 CA SER A 56 -12.365 6.634 -7.078 1.00 0.00 C ATOM 815 C SER A 56 -11.064 6.725 -7.872 1.00 0.00 C ATOM 816 O SER A 56 -10.751 7.735 -8.471 1.00 0.00 O ATOM 817 CB SER A 56 -12.860 8.043 -6.742 1.00 0.00 C ATOM 818 OG SER A 56 -11.828 8.756 -6.073 1.00 0.00 O ATOM 0 H SER A 56 -11.701 6.441 -5.060 1.00 0.00 H new ATOM 0 HA SER A 56 -13.127 6.120 -7.665 1.00 0.00 H new ATOM 0 HB2 SER A 56 -13.148 8.567 -7.654 1.00 0.00 H new ATOM 0 HB3 SER A 56 -13.748 7.988 -6.112 1.00 0.00 H new ATOM 0 HG SER A 56 -12.141 9.659 -5.858 1.00 0.00 H new ATOM 824 N ILE A 57 -10.302 5.670 -7.863 1.00 0.00 N ATOM 825 CA ILE A 57 -9.014 5.659 -8.591 1.00 0.00 C ATOM 826 C ILE A 57 -9.250 5.987 -10.071 1.00 0.00 C ATOM 827 O ILE A 57 -8.758 6.974 -10.579 1.00 0.00 O ATOM 828 CB ILE A 57 -8.396 4.264 -8.421 1.00 0.00 C ATOM 829 CG1 ILE A 57 -7.482 3.922 -9.603 1.00 0.00 C ATOM 830 CG2 ILE A 57 -9.514 3.219 -8.327 1.00 0.00 C ATOM 831 CD1 ILE A 57 -6.495 5.067 -9.862 1.00 0.00 C ATOM 0 H ILE A 57 -10.524 4.803 -7.373 1.00 0.00 H new ATOM 0 HA ILE A 57 -8.333 6.412 -8.195 1.00 0.00 H new ATOM 0 HB ILE A 57 -7.800 4.260 -7.508 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -6.936 3.002 -9.395 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -8.082 3.741 -10.495 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -9.077 2.228 -8.206 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -10.149 3.442 -7.470 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -10.112 3.243 -9.238 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -5.852 4.810 -10.704 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -7.047 5.978 -10.092 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -5.883 5.228 -8.974 1.00 0.00 H new ATOM 843 N GLY A 58 -9.996 5.171 -10.765 1.00 0.00 N ATOM 844 CA GLY A 58 -10.258 5.446 -12.210 1.00 0.00 C ATOM 845 C GLY A 58 -10.288 4.130 -12.992 1.00 0.00 C ATOM 846 O GLY A 58 -9.658 3.159 -12.622 1.00 0.00 O ATOM 0 H GLY A 58 -10.435 4.327 -10.397 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -11.208 5.969 -12.324 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -9.484 6.100 -12.611 1.00 0.00 H new ATOM 850 N ASN A 59 -11.024 4.090 -14.069 1.00 0.00 N ATOM 851 CA ASN A 59 -11.107 2.845 -14.877 1.00 0.00 C ATOM 852 C ASN A 59 -9.712 2.445 -15.368 1.00 0.00 C ATOM 853 O ASN A 59 -9.309 1.303 -15.257 1.00 0.00 O ATOM 854 CB ASN A 59 -12.020 3.081 -16.082 1.00 0.00 C ATOM 855 CG ASN A 59 -13.463 3.246 -15.605 1.00 0.00 C ATOM 856 OD1 ASN A 59 -13.993 4.339 -15.598 1.00 0.00 O ATOM 857 ND2 ASN A 59 -14.128 2.198 -15.200 1.00 0.00 N ATOM 0 H ASN A 59 -11.574 4.872 -14.424 1.00 0.00 H new ATOM 0 HA ASN A 59 -11.512 2.044 -14.258 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -11.701 3.971 -16.624 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -11.949 2.243 -16.775 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -15.091 2.298 -14.878 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -13.685 1.279 -15.205 1.00 0.00 H new ATOM 864 N SER A 60 -8.973 3.373 -15.913 1.00 0.00 N ATOM 865 CA SER A 60 -7.608 3.040 -16.416 1.00 0.00 C ATOM 866 C SER A 60 -6.691 2.697 -15.239 1.00 0.00 C ATOM 867 O SER A 60 -5.483 2.761 -15.341 1.00 0.00 O ATOM 868 CB SER A 60 -7.037 4.243 -17.169 1.00 0.00 C ATOM 869 OG SER A 60 -8.031 4.764 -18.042 1.00 0.00 O ATOM 0 H SER A 60 -9.254 4.346 -16.032 1.00 0.00 H new ATOM 0 HA SER A 60 -7.671 2.182 -17.086 1.00 0.00 H new ATOM 0 HB2 SER A 60 -6.717 5.010 -16.464 1.00 0.00 H new ATOM 0 HB3 SER A 60 -6.156 3.946 -17.738 1.00 0.00 H new ATOM 0 HG SER A 60 -7.670 5.536 -18.525 1.00 0.00 H new ATOM 875 N TYR A 61 -7.257 2.331 -14.122 1.00 0.00 N ATOM 876 CA TYR A 61 -6.426 1.982 -12.938 1.00 0.00 C ATOM 877 C TYR A 61 -7.263 1.145 -11.970 1.00 0.00 C ATOM 878 O TYR A 61 -8.304 1.568 -11.510 1.00 0.00 O ATOM 879 CB TYR A 61 -5.963 3.259 -12.252 1.00 0.00 C ATOM 880 CG TYR A 61 -4.876 3.912 -13.075 1.00 0.00 C ATOM 881 CD1 TYR A 61 -3.649 3.266 -13.257 1.00 0.00 C ATOM 882 CD2 TYR A 61 -5.102 5.166 -13.659 1.00 0.00 C ATOM 883 CE1 TYR A 61 -2.645 3.874 -14.021 1.00 0.00 C ATOM 884 CE2 TYR A 61 -4.097 5.773 -14.421 1.00 0.00 C ATOM 885 CZ TYR A 61 -2.869 5.126 -14.604 1.00 0.00 C ATOM 886 OH TYR A 61 -1.879 5.724 -15.357 1.00 0.00 O ATOM 0 H TYR A 61 -8.264 2.259 -13.979 1.00 0.00 H new ATOM 0 HA TYR A 61 -5.553 1.409 -13.252 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -6.802 3.944 -12.131 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -5.590 3.032 -11.253 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -3.476 2.299 -12.809 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -6.051 5.663 -13.521 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -1.697 3.376 -14.160 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -4.269 6.741 -14.868 1.00 0.00 H new ATOM 0 HH TYR A 61 -2.198 6.589 -15.690 1.00 0.00 H new ATOM 896 N SER A 62 -6.821 -0.048 -11.672 1.00 0.00 N ATOM 897 CA SER A 62 -7.594 -0.931 -10.746 1.00 0.00 C ATOM 898 C SER A 62 -6.769 -1.231 -9.495 1.00 0.00 C ATOM 899 O SER A 62 -7.308 -1.409 -8.423 1.00 0.00 O ATOM 900 CB SER A 62 -7.921 -2.242 -11.470 1.00 0.00 C ATOM 901 OG SER A 62 -9.161 -2.104 -12.149 1.00 0.00 O ATOM 0 H SER A 62 -5.955 -0.451 -12.030 1.00 0.00 H new ATOM 0 HA SER A 62 -8.514 -0.428 -10.448 1.00 0.00 H new ATOM 0 HB2 SER A 62 -7.130 -2.487 -12.179 1.00 0.00 H new ATOM 0 HB3 SER A 62 -7.974 -3.063 -10.755 1.00 0.00 H new ATOM 0 HG SER A 62 -9.132 -2.608 -12.989 1.00 0.00 H new ATOM 907 N TYR A 63 -5.473 -1.305 -9.614 1.00 0.00 N ATOM 908 CA TYR A 63 -4.641 -1.618 -8.416 1.00 0.00 C ATOM 909 C TYR A 63 -3.931 -0.359 -7.913 1.00 0.00 C ATOM 910 O TYR A 63 -3.814 0.628 -8.611 1.00 0.00 O ATOM 911 CB TYR A 63 -3.613 -2.685 -8.778 1.00 0.00 C ATOM 912 CG TYR A 63 -4.296 -4.031 -8.872 1.00 0.00 C ATOM 913 CD1 TYR A 63 -5.255 -4.263 -9.864 1.00 0.00 C ATOM 914 CD2 TYR A 63 -3.969 -5.048 -7.965 1.00 0.00 C ATOM 915 CE1 TYR A 63 -5.886 -5.507 -9.950 1.00 0.00 C ATOM 916 CE2 TYR A 63 -4.601 -6.294 -8.052 1.00 0.00 C ATOM 917 CZ TYR A 63 -5.559 -6.524 -9.046 1.00 0.00 C ATOM 918 OH TYR A 63 -6.182 -7.752 -9.132 1.00 0.00 O ATOM 0 H TYR A 63 -4.956 -1.164 -10.482 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.288 -1.989 -7.622 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -3.137 -2.440 -9.727 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -2.825 -2.717 -8.025 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.508 -3.480 -10.564 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -3.229 -4.870 -7.199 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -6.627 -5.684 -10.715 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.349 -7.077 -7.352 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.507 -8.462 -9.127 1.00 0.00 H new ATOM 928 N VAL A 64 -3.469 -0.394 -6.690 1.00 0.00 N ATOM 929 CA VAL A 64 -2.774 0.790 -6.103 1.00 0.00 C ATOM 930 C VAL A 64 -1.575 0.305 -5.274 1.00 0.00 C ATOM 931 O VAL A 64 -1.639 -0.709 -4.616 1.00 0.00 O ATOM 932 CB VAL A 64 -3.782 1.533 -5.212 1.00 0.00 C ATOM 933 CG1 VAL A 64 -3.135 2.746 -4.548 1.00 0.00 C ATOM 934 CG2 VAL A 64 -4.963 1.996 -6.068 1.00 0.00 C ATOM 0 H VAL A 64 -3.544 -1.199 -6.068 1.00 0.00 H new ATOM 0 HA VAL A 64 -2.409 1.460 -6.881 1.00 0.00 H new ATOM 0 HB VAL A 64 -4.123 0.853 -4.432 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.870 3.254 -3.923 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.298 2.420 -3.931 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.775 3.432 -5.315 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -5.682 2.524 -5.441 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.605 2.664 -6.851 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.445 1.130 -6.522 1.00 0.00 H new ATOM 944 N TRP A 65 -0.475 1.013 -5.310 1.00 0.00 N ATOM 945 CA TRP A 65 0.722 0.569 -4.531 1.00 0.00 C ATOM 946 C TRP A 65 0.572 0.988 -3.063 1.00 0.00 C ATOM 947 O TRP A 65 0.011 2.023 -2.763 1.00 0.00 O ATOM 948 CB TRP A 65 1.988 1.244 -5.088 1.00 0.00 C ATOM 949 CG TRP A 65 2.773 0.339 -5.993 1.00 0.00 C ATOM 950 CD1 TRP A 65 3.409 0.768 -7.105 1.00 0.00 C ATOM 951 CD2 TRP A 65 3.045 -1.096 -5.898 1.00 0.00 C ATOM 952 NE1 TRP A 65 4.048 -0.298 -7.701 1.00 0.00 N ATOM 953 CE2 TRP A 65 3.850 -1.469 -7.003 1.00 0.00 C ATOM 954 CE3 TRP A 65 2.681 -2.105 -4.983 1.00 0.00 C ATOM 955 CZ2 TRP A 65 4.272 -2.780 -7.194 1.00 0.00 C ATOM 956 CZ3 TRP A 65 3.106 -3.429 -5.178 1.00 0.00 C ATOM 957 CH2 TRP A 65 3.898 -3.764 -6.281 1.00 0.00 C ATOM 0 H TRP A 65 -0.353 1.875 -5.842 1.00 0.00 H new ATOM 0 HA TRP A 65 0.803 -0.515 -4.611 1.00 0.00 H new ATOM 0 HB2 TRP A 65 1.705 2.143 -5.635 1.00 0.00 H new ATOM 0 HB3 TRP A 65 2.621 1.561 -4.259 1.00 0.00 H new ATOM 0 HD1 TRP A 65 3.416 1.785 -7.469 1.00 0.00 H new ATOM 0 HE1 TRP A 65 4.601 -0.228 -8.555 1.00 0.00 H new ATOM 0 HE3 TRP A 65 2.071 -1.858 -4.126 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 4.886 -3.034 -8.045 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 2.819 -4.194 -4.471 1.00 0.00 H new ATOM 0 HH2 TRP A 65 4.220 -4.785 -6.425 1.00 0.00 H new ATOM 968 N ILE A 66 1.109 0.217 -2.150 1.00 0.00 N ATOM 969 CA ILE A 66 1.038 0.604 -0.713 1.00 0.00 C ATOM 970 C ILE A 66 2.392 0.299 -0.066 1.00 0.00 C ATOM 971 O ILE A 66 3.288 -0.220 -0.701 1.00 0.00 O ATOM 972 CB ILE A 66 -0.062 -0.177 0.011 1.00 0.00 C ATOM 973 CG1 ILE A 66 0.115 -1.677 -0.224 1.00 0.00 C ATOM 974 CG2 ILE A 66 -1.428 0.255 -0.521 1.00 0.00 C ATOM 975 CD1 ILE A 66 -1.055 -2.428 0.421 1.00 0.00 C ATOM 0 H ILE A 66 1.592 -0.661 -2.340 1.00 0.00 H new ATOM 0 HA ILE A 66 0.804 1.666 -0.637 1.00 0.00 H new ATOM 0 HB ILE A 66 0.003 0.030 1.079 1.00 0.00 H new ATOM 0 HG12 ILE A 66 0.154 -1.888 -1.293 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.059 -2.015 0.202 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.211 -0.301 -0.006 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.566 1.322 -0.347 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.483 0.052 -1.591 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.935 -3.499 0.257 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.072 -2.225 1.492 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -1.992 -2.095 -0.026 1.00 0.00 H new ATOM 987 N GLY A 67 2.560 0.633 1.183 1.00 0.00 N ATOM 988 CA GLY A 67 3.859 0.383 1.854 1.00 0.00 C ATOM 989 C GLY A 67 3.914 -1.034 2.406 1.00 0.00 C ATOM 990 O GLY A 67 4.107 -1.238 3.579 1.00 0.00 O ATOM 0 H GLY A 67 1.848 1.070 1.768 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.675 0.535 1.147 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.000 1.100 2.663 1.00 0.00 H new ATOM 994 N LEU A 68 3.763 -2.014 1.562 1.00 0.00 N ATOM 995 CA LEU A 68 3.842 -3.427 2.037 1.00 0.00 C ATOM 996 C LEU A 68 4.817 -4.189 1.136 1.00 0.00 C ATOM 997 O LEU A 68 4.709 -4.156 -0.074 1.00 0.00 O ATOM 998 CB LEU A 68 2.459 -4.086 1.974 1.00 0.00 C ATOM 999 CG LEU A 68 2.372 -5.287 2.946 1.00 0.00 C ATOM 1000 CD1 LEU A 68 3.693 -6.056 3.006 1.00 0.00 C ATOM 1001 CD2 LEU A 68 2.026 -4.798 4.353 1.00 0.00 C ATOM 0 H LEU A 68 3.588 -1.901 0.563 1.00 0.00 H new ATOM 0 HA LEU A 68 4.189 -3.448 3.070 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.692 -3.354 2.225 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.258 -4.422 0.957 1.00 0.00 H new ATOM 0 HG LEU A 68 1.593 -5.953 2.574 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.596 -6.893 3.698 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.940 -6.433 2.013 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.486 -5.391 3.349 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.967 -5.650 5.030 1.00 0.00 H new ATOM 0 HD22 LEU A 68 2.799 -4.112 4.700 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.066 -4.283 4.333 1.00 0.00 H new ATOM 1013 N HIS A 69 5.768 -4.877 1.714 1.00 0.00 N ATOM 1014 CA HIS A 69 6.741 -5.641 0.887 1.00 0.00 C ATOM 1015 C HIS A 69 7.035 -6.977 1.549 1.00 0.00 C ATOM 1016 O HIS A 69 6.477 -7.317 2.570 1.00 0.00 O ATOM 1017 CB HIS A 69 8.041 -4.850 0.740 1.00 0.00 C ATOM 1018 CG HIS A 69 8.680 -4.699 2.087 1.00 0.00 C ATOM 1019 ND1 HIS A 69 8.253 -4.076 3.227 1.00 0.00 N flip ATOM 1020 CD2 HIS A 69 9.919 -5.242 2.391 1.00 0.00 C flip ATOM 1021 CE1 HIS A 69 9.206 -4.224 4.230 1.00 0.00 C flip ATOM 1022 NE2 HIS A 69 10.190 -4.936 3.673 1.00 0.00 N flip ATOM 0 H HIS A 69 5.910 -4.941 2.722 1.00 0.00 H new ATOM 0 HA HIS A 69 6.311 -5.808 -0.100 1.00 0.00 H new ATOM 0 HB2 HIS A 69 8.719 -5.364 0.058 1.00 0.00 H new ATOM 0 HB3 HIS A 69 7.838 -3.870 0.309 1.00 0.00 H new ATOM 0 HD1 HIS A 69 7.369 -3.578 3.327 1.00 0.00 H new ATOM 0 HD2 HIS A 69 10.551 -5.807 1.722 1.00 0.00 H new ATOM 0 HE1 HIS A 69 9.160 -3.845 5.240 1.00 0.00 H new ATOM 1030 N ASP A 70 7.908 -7.729 0.953 1.00 0.00 N ATOM 1031 CA ASP A 70 8.278 -9.064 1.508 1.00 0.00 C ATOM 1032 C ASP A 70 9.724 -9.003 2.022 1.00 0.00 C ATOM 1033 O ASP A 70 10.652 -9.262 1.283 1.00 0.00 O ATOM 1034 CB ASP A 70 8.180 -10.115 0.401 1.00 0.00 C ATOM 1035 CG ASP A 70 6.744 -10.174 -0.123 1.00 0.00 C ATOM 1036 OD1 ASP A 70 6.113 -9.130 -0.180 1.00 0.00 O ATOM 1037 OD2 ASP A 70 6.300 -11.259 -0.458 1.00 0.00 O ATOM 0 H ASP A 70 8.391 -7.476 0.091 1.00 0.00 H new ATOM 0 HA ASP A 70 7.604 -9.329 2.323 1.00 0.00 H new ATOM 0 HB2 ASP A 70 8.864 -9.868 -0.411 1.00 0.00 H new ATOM 0 HB3 ASP A 70 8.479 -11.091 0.784 1.00 0.00 H new ATOM 1042 N PRO A 71 9.921 -8.657 3.273 1.00 0.00 N ATOM 1043 CA PRO A 71 11.295 -8.567 3.834 1.00 0.00 C ATOM 1044 C PRO A 71 12.009 -9.922 3.825 1.00 0.00 C ATOM 1045 O PRO A 71 13.061 -10.086 4.411 1.00 0.00 O ATOM 1046 CB PRO A 71 11.043 -8.076 5.266 1.00 0.00 C ATOM 1047 CG PRO A 71 9.537 -7.899 5.475 1.00 0.00 C ATOM 1048 CD PRO A 71 8.806 -8.337 4.203 1.00 0.00 C ATOM 0 HA PRO A 71 11.947 -7.911 3.257 1.00 0.00 H new ATOM 0 HB2 PRO A 71 11.441 -8.792 5.985 1.00 0.00 H new ATOM 0 HB3 PRO A 71 11.560 -7.132 5.437 1.00 0.00 H new ATOM 0 HG2 PRO A 71 9.202 -8.492 6.326 1.00 0.00 H new ATOM 0 HG3 PRO A 71 9.308 -6.858 5.702 1.00 0.00 H new ATOM 0 HD2 PRO A 71 8.168 -9.202 4.381 1.00 0.00 H new ATOM 0 HD3 PRO A 71 8.167 -7.545 3.811 1.00 0.00 H new ATOM 1056 N THR A 72 11.442 -10.891 3.158 1.00 0.00 N ATOM 1057 CA THR A 72 12.077 -12.237 3.100 1.00 0.00 C ATOM 1058 C THR A 72 12.816 -12.391 1.767 1.00 0.00 C ATOM 1059 O THR A 72 13.742 -13.167 1.647 1.00 0.00 O ATOM 1060 CB THR A 72 10.994 -13.312 3.216 1.00 0.00 C ATOM 1061 OG1 THR A 72 11.540 -14.575 2.869 1.00 0.00 O ATOM 1062 CG2 THR A 72 9.836 -12.976 2.274 1.00 0.00 C ATOM 0 H THR A 72 10.562 -10.807 2.649 1.00 0.00 H new ATOM 0 HA THR A 72 12.785 -12.347 3.921 1.00 0.00 H new ATOM 0 HB THR A 72 10.626 -13.347 4.241 1.00 0.00 H new ATOM 0 HG1 THR A 72 12.495 -14.589 3.087 1.00 0.00 H new ATOM 0 HG21 THR A 72 9.065 -13.742 2.357 1.00 0.00 H new ATOM 0 HG22 THR A 72 9.416 -12.007 2.545 1.00 0.00 H new ATOM 0 HG23 THR A 72 10.201 -12.939 1.248 1.00 0.00 H new ATOM 1070 N GLN A 73 12.414 -11.653 0.765 1.00 0.00 N ATOM 1071 CA GLN A 73 13.097 -11.754 -0.556 1.00 0.00 C ATOM 1072 C GLN A 73 13.284 -13.226 -0.932 1.00 0.00 C ATOM 1073 O GLN A 73 14.255 -13.595 -1.563 1.00 0.00 O ATOM 1074 CB GLN A 73 14.464 -11.071 -0.475 1.00 0.00 C ATOM 1075 CG GLN A 73 14.275 -9.552 -0.450 1.00 0.00 C ATOM 1076 CD GLN A 73 15.643 -8.868 -0.425 1.00 0.00 C ATOM 1077 OE1 GLN A 73 16.305 -8.772 -1.439 1.00 0.00 O ATOM 1078 NE2 GLN A 73 16.098 -8.388 0.698 1.00 0.00 N ATOM 0 H GLN A 73 11.643 -10.986 0.806 1.00 0.00 H new ATOM 0 HA GLN A 73 12.487 -11.264 -1.315 1.00 0.00 H new ATOM 0 HB2 GLN A 73 14.993 -11.397 0.421 1.00 0.00 H new ATOM 0 HB3 GLN A 73 15.077 -11.358 -1.329 1.00 0.00 H new ATOM 0 HG2 GLN A 73 13.712 -9.230 -1.326 1.00 0.00 H new ATOM 0 HG3 GLN A 73 13.695 -9.261 0.426 1.00 0.00 H new ATOM 0 HE21 GLN A 73 15.542 -8.469 1.549 1.00 0.00 H new ATOM 0 HE22 GLN A 73 17.010 -7.932 0.725 1.00 0.00 H new ATOM 1087 N GLY A 74 12.362 -14.069 -0.553 1.00 0.00 N ATOM 1088 CA GLY A 74 12.489 -15.516 -0.893 1.00 0.00 C ATOM 1089 C GLY A 74 13.209 -16.253 0.238 1.00 0.00 C ATOM 1090 O GLY A 74 14.112 -17.033 0.009 1.00 0.00 O ATOM 0 H GLY A 74 11.527 -13.819 -0.023 1.00 0.00 H new ATOM 0 HA2 GLY A 74 11.502 -15.950 -1.051 1.00 0.00 H new ATOM 0 HA3 GLY A 74 13.042 -15.633 -1.825 1.00 0.00 H new ATOM 1094 N THR A 75 12.816 -16.012 1.459 1.00 0.00 N ATOM 1095 CA THR A 75 13.475 -16.700 2.608 1.00 0.00 C ATOM 1096 C THR A 75 12.465 -16.866 3.746 1.00 0.00 C ATOM 1097 O THR A 75 12.693 -16.437 4.860 1.00 0.00 O ATOM 1098 CB THR A 75 14.657 -15.859 3.097 1.00 0.00 C ATOM 1099 OG1 THR A 75 14.193 -14.576 3.493 1.00 0.00 O ATOM 1100 CG2 THR A 75 15.681 -15.708 1.971 1.00 0.00 C ATOM 0 H THR A 75 12.066 -15.368 1.712 1.00 0.00 H new ATOM 0 HA THR A 75 13.833 -17.679 2.290 1.00 0.00 H new ATOM 0 HB THR A 75 15.127 -16.354 3.947 1.00 0.00 H new ATOM 0 HG1 THR A 75 14.381 -13.927 2.783 1.00 0.00 H new ATOM 0 HG21 THR A 75 16.521 -15.109 2.321 1.00 0.00 H new ATOM 0 HG22 THR A 75 16.038 -16.693 1.669 1.00 0.00 H new ATOM 0 HG23 THR A 75 15.214 -15.215 1.118 1.00 0.00 H new ATOM 1108 N GLU A 76 11.348 -17.486 3.475 1.00 0.00 N ATOM 1109 CA GLU A 76 10.322 -17.680 4.540 1.00 0.00 C ATOM 1110 C GLU A 76 9.469 -18.909 4.212 1.00 0.00 C ATOM 1111 O GLU A 76 8.315 -18.789 3.849 1.00 0.00 O ATOM 1112 CB GLU A 76 9.425 -16.441 4.611 1.00 0.00 C ATOM 1113 CG GLU A 76 8.633 -16.455 5.921 1.00 0.00 C ATOM 1114 CD GLU A 76 9.580 -16.192 7.094 1.00 0.00 C ATOM 1115 OE1 GLU A 76 10.666 -15.693 6.852 1.00 0.00 O ATOM 1116 OE2 GLU A 76 9.203 -16.497 8.214 1.00 0.00 O ATOM 0 H GLU A 76 11.102 -17.867 2.561 1.00 0.00 H new ATOM 0 HA GLU A 76 10.817 -17.829 5.500 1.00 0.00 H new ATOM 0 HB2 GLU A 76 10.031 -15.537 4.550 1.00 0.00 H new ATOM 0 HB3 GLU A 76 8.742 -16.425 3.762 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.851 -15.696 5.894 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.138 -17.418 6.049 1.00 0.00 H new ATOM 1123 N PRO A 77 10.032 -20.085 4.334 1.00 0.00 N ATOM 1124 CA PRO A 77 9.284 -21.337 4.036 1.00 0.00 C ATOM 1125 C PRO A 77 8.094 -21.544 4.983 1.00 0.00 C ATOM 1126 O PRO A 77 7.802 -22.648 5.399 1.00 0.00 O ATOM 1127 CB PRO A 77 10.350 -22.425 4.236 1.00 0.00 C ATOM 1128 CG PRO A 77 11.674 -21.753 4.640 1.00 0.00 C ATOM 1129 CD PRO A 77 11.443 -20.243 4.775 1.00 0.00 C ATOM 0 HA PRO A 77 8.841 -21.335 3.040 1.00 0.00 H new ATOM 0 HB2 PRO A 77 10.033 -23.127 5.007 1.00 0.00 H new ATOM 0 HB3 PRO A 77 10.482 -22.998 3.318 1.00 0.00 H new ATOM 0 HG2 PRO A 77 12.034 -22.165 5.583 1.00 0.00 H new ATOM 0 HG3 PRO A 77 12.441 -21.952 3.892 1.00 0.00 H new ATOM 0 HD2 PRO A 77 11.587 -19.902 5.800 1.00 0.00 H new ATOM 0 HD3 PRO A 77 12.129 -19.671 4.150 1.00 0.00 H new ATOM 1137 N ASN A 78 7.405 -20.487 5.321 1.00 0.00 N ATOM 1138 CA ASN A 78 6.234 -20.616 6.237 1.00 0.00 C ATOM 1139 C ASN A 78 5.146 -19.629 5.808 1.00 0.00 C ATOM 1140 O ASN A 78 3.967 -19.912 5.904 1.00 0.00 O ATOM 1141 CB ASN A 78 6.671 -20.304 7.670 1.00 0.00 C ATOM 1142 CG ASN A 78 7.877 -21.171 8.035 1.00 0.00 C ATOM 1143 OD1 ASN A 78 7.847 -22.376 7.872 1.00 0.00 O ATOM 1144 ND2 ASN A 78 8.947 -20.607 8.525 1.00 0.00 N ATOM 0 H ASN A 78 7.603 -19.539 5.002 1.00 0.00 H new ATOM 0 HA ASN A 78 5.843 -21.633 6.191 1.00 0.00 H new ATOM 0 HB2 ASN A 78 6.927 -19.249 7.762 1.00 0.00 H new ATOM 0 HB3 ASN A 78 5.850 -20.494 8.362 1.00 0.00 H new ATOM 0 HD21 ASN A 78 9.757 -21.177 8.771 1.00 0.00 H new ATOM 0 HD22 ASN A 78 8.974 -19.597 8.662 1.00 0.00 H new ATOM 1151 N GLY A 79 5.532 -18.473 5.338 1.00 0.00 N ATOM 1152 CA GLY A 79 4.521 -17.467 4.901 1.00 0.00 C ATOM 1153 C GLY A 79 4.260 -16.482 6.041 1.00 0.00 C ATOM 1154 O GLY A 79 3.137 -16.277 6.453 1.00 0.00 O ATOM 0 H GLY A 79 6.504 -18.182 5.238 1.00 0.00 H new ATOM 0 HA2 GLY A 79 4.879 -16.934 4.020 1.00 0.00 H new ATOM 0 HA3 GLY A 79 3.594 -17.966 4.617 1.00 0.00 H new ATOM 1158 N GLU A 80 5.293 -15.871 6.554 1.00 0.00 N ATOM 1159 CA GLU A 80 5.107 -14.900 7.669 1.00 0.00 C ATOM 1160 C GLU A 80 6.265 -13.900 7.676 1.00 0.00 C ATOM 1161 O GLU A 80 7.073 -13.879 8.584 1.00 0.00 O ATOM 1162 CB GLU A 80 5.079 -15.655 9.000 1.00 0.00 C ATOM 1163 CG GLU A 80 3.783 -16.464 9.108 1.00 0.00 C ATOM 1164 CD GLU A 80 3.593 -16.936 10.552 1.00 0.00 C ATOM 1165 OE1 GLU A 80 4.335 -16.480 11.407 1.00 0.00 O ATOM 1166 OE2 GLU A 80 2.707 -17.744 10.778 1.00 0.00 O ATOM 0 H GLU A 80 6.257 -16.002 6.249 1.00 0.00 H new ATOM 0 HA GLU A 80 4.167 -14.365 7.532 1.00 0.00 H new ATOM 0 HB2 GLU A 80 5.940 -16.319 9.070 1.00 0.00 H new ATOM 0 HB3 GLU A 80 5.150 -14.952 9.830 1.00 0.00 H new ATOM 0 HG2 GLU A 80 2.934 -15.854 8.799 1.00 0.00 H new ATOM 0 HG3 GLU A 80 3.820 -17.321 8.436 1.00 0.00 H new ATOM 1173 N GLY A 81 6.353 -13.069 6.670 1.00 0.00 N ATOM 1174 CA GLY A 81 7.460 -12.067 6.615 1.00 0.00 C ATOM 1175 C GLY A 81 6.904 -10.717 6.153 1.00 0.00 C ATOM 1176 O GLY A 81 7.321 -9.677 6.618 1.00 0.00 O ATOM 0 H GLY A 81 5.705 -13.041 5.883 1.00 0.00 H new ATOM 0 HA2 GLY A 81 7.922 -11.965 7.597 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.238 -12.406 5.930 1.00 0.00 H new ATOM 1180 N TRP A 82 5.968 -10.732 5.241 1.00 0.00 N ATOM 1181 CA TRP A 82 5.372 -9.457 4.729 1.00 0.00 C ATOM 1182 C TRP A 82 5.342 -8.397 5.839 1.00 0.00 C ATOM 1183 O TRP A 82 4.738 -8.595 6.875 1.00 0.00 O ATOM 1184 CB TRP A 82 3.938 -9.730 4.245 1.00 0.00 C ATOM 1185 CG TRP A 82 3.454 -11.032 4.801 1.00 0.00 C ATOM 1186 CD1 TRP A 82 3.776 -12.252 4.316 1.00 0.00 C ATOM 1187 CD2 TRP A 82 2.571 -11.263 5.937 1.00 0.00 C ATOM 1188 NE1 TRP A 82 3.147 -13.218 5.081 1.00 0.00 N ATOM 1189 CE2 TRP A 82 2.392 -12.659 6.093 1.00 0.00 C ATOM 1190 CE3 TRP A 82 1.914 -10.406 6.838 1.00 0.00 C ATOM 1191 CZ2 TRP A 82 1.591 -13.184 7.106 1.00 0.00 C ATOM 1192 CZ3 TRP A 82 1.106 -10.932 7.860 1.00 0.00 C ATOM 1193 CH2 TRP A 82 0.946 -12.318 7.993 1.00 0.00 C ATOM 0 H TRP A 82 5.586 -11.580 4.823 1.00 0.00 H new ATOM 0 HA TRP A 82 5.981 -9.085 3.905 1.00 0.00 H new ATOM 0 HB2 TRP A 82 3.278 -8.922 4.560 1.00 0.00 H new ATOM 0 HB3 TRP A 82 3.911 -9.757 3.156 1.00 0.00 H new ATOM 0 HD1 TRP A 82 4.419 -12.442 3.469 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.231 -14.221 4.917 1.00 0.00 H new ATOM 0 HE3 TRP A 82 2.031 -9.337 6.744 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 1.470 -14.253 7.205 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 0.606 -10.265 8.546 1.00 0.00 H new ATOM 0 HH2 TRP A 82 0.324 -12.717 8.781 1.00 0.00 H new ATOM 1204 N GLU A 83 5.976 -7.268 5.629 1.00 0.00 N ATOM 1205 CA GLU A 83 5.963 -6.199 6.674 1.00 0.00 C ATOM 1206 C GLU A 83 5.692 -4.858 5.997 1.00 0.00 C ATOM 1207 O GLU A 83 6.046 -4.653 4.854 1.00 0.00 O ATOM 1208 CB GLU A 83 7.318 -6.152 7.390 1.00 0.00 C ATOM 1209 CG GLU A 83 7.125 -5.658 8.826 1.00 0.00 C ATOM 1210 CD GLU A 83 8.477 -5.240 9.410 1.00 0.00 C ATOM 1211 OE1 GLU A 83 9.451 -5.927 9.147 1.00 0.00 O ATOM 1212 OE2 GLU A 83 8.514 -4.242 10.110 1.00 0.00 O ATOM 0 H GLU A 83 6.499 -7.042 4.783 1.00 0.00 H new ATOM 0 HA GLU A 83 5.186 -6.410 7.408 1.00 0.00 H new ATOM 0 HB2 GLU A 83 7.773 -7.143 7.394 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.000 -5.490 6.856 1.00 0.00 H new ATOM 0 HG2 GLU A 83 6.434 -4.815 8.842 1.00 0.00 H new ATOM 0 HG3 GLU A 83 6.681 -6.445 9.436 1.00 0.00 H new ATOM 1219 N TRP A 84 5.064 -3.943 6.680 1.00 0.00 N ATOM 1220 CA TRP A 84 4.774 -2.633 6.055 1.00 0.00 C ATOM 1221 C TRP A 84 6.010 -1.745 6.145 1.00 0.00 C ATOM 1222 O TRP A 84 6.688 -1.707 7.152 1.00 0.00 O ATOM 1223 CB TRP A 84 3.606 -1.956 6.779 1.00 0.00 C ATOM 1224 CG TRP A 84 2.913 -2.942 7.662 1.00 0.00 C ATOM 1225 CD1 TRP A 84 3.419 -3.436 8.810 1.00 0.00 C ATOM 1226 CD2 TRP A 84 1.598 -3.548 7.500 1.00 0.00 C ATOM 1227 NE1 TRP A 84 2.506 -4.312 9.360 1.00 0.00 N ATOM 1228 CE2 TRP A 84 1.369 -4.417 8.590 1.00 0.00 C ATOM 1229 CE3 TRP A 84 0.597 -3.434 6.523 1.00 0.00 C ATOM 1230 CZ2 TRP A 84 0.189 -5.147 8.710 1.00 0.00 C ATOM 1231 CZ3 TRP A 84 -0.596 -4.167 6.638 1.00 0.00 C ATOM 1232 CH2 TRP A 84 -0.798 -5.022 7.731 1.00 0.00 C ATOM 0 H TRP A 84 4.741 -4.049 7.642 1.00 0.00 H new ATOM 0 HA TRP A 84 4.506 -2.786 5.009 1.00 0.00 H new ATOM 0 HB2 TRP A 84 3.972 -1.118 7.372 1.00 0.00 H new ATOM 0 HB3 TRP A 84 2.903 -1.549 6.052 1.00 0.00 H new ATOM 0 HD1 TRP A 84 4.382 -3.187 9.230 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.655 -4.820 10.232 1.00 0.00 H new ATOM 0 HE3 TRP A 84 0.745 -2.779 5.677 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 0.039 -5.804 9.554 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -1.361 -4.072 5.881 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.717 -5.583 7.815 1.00 0.00 H new ATOM 1243 N SER A 85 6.305 -1.023 5.104 1.00 0.00 N ATOM 1244 CA SER A 85 7.491 -0.133 5.143 1.00 0.00 C ATOM 1245 C SER A 85 7.084 1.206 5.747 1.00 0.00 C ATOM 1246 O SER A 85 7.886 2.108 5.887 1.00 0.00 O ATOM 1247 CB SER A 85 8.029 0.077 3.726 1.00 0.00 C ATOM 1248 OG SER A 85 7.053 0.759 2.949 1.00 0.00 O ATOM 0 H SER A 85 5.777 -1.011 4.231 1.00 0.00 H new ATOM 0 HA SER A 85 8.273 -0.588 5.751 1.00 0.00 H new ATOM 0 HB2 SER A 85 8.953 0.654 3.757 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.268 -0.883 3.269 1.00 0.00 H new ATOM 0 HG SER A 85 7.395 0.897 2.041 1.00 0.00 H new ATOM 1254 N SER A 86 5.839 1.336 6.106 1.00 0.00 N ATOM 1255 CA SER A 86 5.359 2.608 6.702 1.00 0.00 C ATOM 1256 C SER A 86 4.413 2.304 7.864 1.00 0.00 C ATOM 1257 O SER A 86 3.837 3.203 8.442 1.00 0.00 O ATOM 1258 CB SER A 86 4.605 3.409 5.636 1.00 0.00 C ATOM 1259 OG SER A 86 4.847 4.795 5.831 1.00 0.00 O ATOM 0 H SER A 86 5.130 0.609 6.011 1.00 0.00 H new ATOM 0 HA SER A 86 6.210 3.184 7.066 1.00 0.00 H new ATOM 0 HB2 SER A 86 4.931 3.108 4.640 1.00 0.00 H new ATOM 0 HB3 SER A 86 3.537 3.203 5.698 1.00 0.00 H new ATOM 0 HG SER A 86 4.351 5.311 5.162 1.00 0.00 H new ATOM 1265 N SER A 87 4.227 1.050 8.206 1.00 0.00 N ATOM 1266 CA SER A 87 3.285 0.733 9.328 1.00 0.00 C ATOM 1267 C SER A 87 3.993 -0.045 10.444 1.00 0.00 C ATOM 1268 O SER A 87 3.360 -0.499 11.373 1.00 0.00 O ATOM 1269 CB SER A 87 2.091 -0.063 8.791 1.00 0.00 C ATOM 1270 OG SER A 87 0.891 0.608 9.148 1.00 0.00 O ATOM 0 H SER A 87 4.677 0.247 7.767 1.00 0.00 H new ATOM 0 HA SER A 87 2.928 1.670 9.755 1.00 0.00 H new ATOM 0 HB2 SER A 87 2.160 -0.161 7.708 1.00 0.00 H new ATOM 0 HB3 SER A 87 2.095 -1.072 9.203 1.00 0.00 H new ATOM 0 HG SER A 87 0.976 0.969 10.055 1.00 0.00 H new ATOM 1276 N ASP A 88 5.293 -0.181 10.377 1.00 0.00 N ATOM 1277 CA ASP A 88 6.041 -0.903 11.460 1.00 0.00 C ATOM 1278 C ASP A 88 6.067 -2.412 11.194 1.00 0.00 C ATOM 1279 O ASP A 88 6.385 -2.855 10.109 1.00 0.00 O ATOM 1280 CB ASP A 88 5.378 -0.631 12.822 1.00 0.00 C ATOM 1281 CG ASP A 88 6.421 -0.740 13.938 1.00 0.00 C ATOM 1282 OD1 ASP A 88 7.520 -0.246 13.746 1.00 0.00 O ATOM 1283 OD2 ASP A 88 6.100 -1.313 14.967 1.00 0.00 O ATOM 0 H ASP A 88 5.873 0.177 9.618 1.00 0.00 H new ATOM 0 HA ASP A 88 7.067 -0.535 11.471 1.00 0.00 H new ATOM 0 HB2 ASP A 88 4.930 0.363 12.827 1.00 0.00 H new ATOM 0 HB3 ASP A 88 4.572 -1.345 12.994 1.00 0.00 H new ATOM 1288 N VAL A 89 5.755 -3.202 12.190 1.00 0.00 N ATOM 1289 CA VAL A 89 5.774 -4.681 12.016 1.00 0.00 C ATOM 1290 C VAL A 89 4.374 -5.174 11.640 1.00 0.00 C ATOM 1291 O VAL A 89 3.447 -4.402 11.503 1.00 0.00 O ATOM 1292 CB VAL A 89 6.210 -5.334 13.329 1.00 0.00 C ATOM 1293 CG1 VAL A 89 7.736 -5.321 13.429 1.00 0.00 C ATOM 1294 CG2 VAL A 89 5.619 -4.551 14.506 1.00 0.00 C ATOM 0 H VAL A 89 5.487 -2.881 13.120 1.00 0.00 H new ATOM 0 HA VAL A 89 6.472 -4.947 11.222 1.00 0.00 H new ATOM 0 HB VAL A 89 5.854 -6.364 13.356 1.00 0.00 H new ATOM 0 HG11 VAL A 89 8.043 -5.787 14.365 1.00 0.00 H new ATOM 0 HG12 VAL A 89 8.160 -5.875 12.592 1.00 0.00 H new ATOM 0 HG13 VAL A 89 8.094 -4.292 13.401 1.00 0.00 H new ATOM 0 HG21 VAL A 89 5.928 -5.014 15.443 1.00 0.00 H new ATOM 0 HG22 VAL A 89 5.977 -3.522 14.475 1.00 0.00 H new ATOM 0 HG23 VAL A 89 4.531 -4.559 14.439 1.00 0.00 H new ATOM 1304 N MET A 90 4.222 -6.459 11.466 1.00 0.00 N ATOM 1305 CA MET A 90 2.891 -7.019 11.090 1.00 0.00 C ATOM 1306 C MET A 90 1.935 -6.972 12.284 1.00 0.00 C ATOM 1307 O MET A 90 1.848 -7.912 13.049 1.00 0.00 O ATOM 1308 CB MET A 90 3.065 -8.474 10.650 1.00 0.00 C ATOM 1309 CG MET A 90 3.790 -8.520 9.305 1.00 0.00 C ATOM 1310 SD MET A 90 4.393 -10.200 9.004 1.00 0.00 S ATOM 1311 CE MET A 90 5.977 -10.032 9.865 1.00 0.00 C ATOM 0 H MET A 90 4.966 -7.149 11.569 1.00 0.00 H new ATOM 0 HA MET A 90 2.475 -6.424 10.277 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.632 -9.026 11.399 1.00 0.00 H new ATOM 0 HB3 MET A 90 2.092 -8.958 10.567 1.00 0.00 H new ATOM 0 HG2 MET A 90 3.115 -8.215 8.505 1.00 0.00 H new ATOM 0 HG3 MET A 90 4.623 -7.817 9.304 1.00 0.00 H new ATOM 0 HE1 MET A 90 6.526 -10.972 9.804 1.00 0.00 H new ATOM 0 HE2 MET A 90 6.562 -9.239 9.399 1.00 0.00 H new ATOM 0 HE3 MET A 90 5.798 -9.784 10.911 1.00 0.00 H new ATOM 1321 N ASN A 91 1.193 -5.902 12.441 1.00 0.00 N ATOM 1322 CA ASN A 91 0.227 -5.831 13.575 1.00 0.00 C ATOM 1323 C ASN A 91 -1.181 -6.039 13.012 1.00 0.00 C ATOM 1324 O ASN A 91 -2.167 -5.914 13.711 1.00 0.00 O ATOM 1325 CB ASN A 91 0.331 -4.459 14.263 1.00 0.00 C ATOM 1326 CG ASN A 91 0.573 -4.649 15.764 1.00 0.00 C ATOM 1327 OD1 ASN A 91 1.545 -4.158 16.301 1.00 0.00 O ATOM 1328 ND2 ASN A 91 -0.277 -5.347 16.466 1.00 0.00 N ATOM 0 H ASN A 91 1.216 -5.081 11.836 1.00 0.00 H new ATOM 0 HA ASN A 91 0.449 -6.600 14.315 1.00 0.00 H new ATOM 0 HB2 ASN A 91 1.145 -3.882 13.824 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -0.585 -3.891 14.102 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -0.125 -5.480 17.466 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -1.094 -5.760 16.015 1.00 0.00 H new ATOM 1335 N TYR A 92 -1.274 -6.366 11.748 1.00 0.00 N ATOM 1336 CA TYR A 92 -2.610 -6.592 11.129 1.00 0.00 C ATOM 1337 C TYR A 92 -2.455 -7.468 9.879 1.00 0.00 C ATOM 1338 O TYR A 92 -1.391 -7.552 9.299 1.00 0.00 O ATOM 1339 CB TYR A 92 -3.230 -5.250 10.744 1.00 0.00 C ATOM 1340 CG TYR A 92 -4.538 -5.474 10.015 1.00 0.00 C ATOM 1341 CD1 TYR A 92 -5.554 -6.239 10.603 1.00 0.00 C ATOM 1342 CD2 TYR A 92 -4.732 -4.912 8.747 1.00 0.00 C ATOM 1343 CE1 TYR A 92 -6.759 -6.444 9.924 1.00 0.00 C ATOM 1344 CE2 TYR A 92 -5.939 -5.117 8.068 1.00 0.00 C ATOM 1345 CZ TYR A 92 -6.952 -5.884 8.657 1.00 0.00 C ATOM 1346 OH TYR A 92 -8.141 -6.086 7.986 1.00 0.00 O ATOM 0 H TYR A 92 -0.480 -6.486 11.119 1.00 0.00 H new ATOM 0 HA TYR A 92 -3.260 -7.096 11.844 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -3.400 -4.649 11.637 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.542 -4.691 10.110 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -5.406 -6.671 11.582 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -3.951 -4.321 8.293 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -7.541 -7.035 10.378 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.089 -4.684 7.090 1.00 0.00 H new ATOM 0 HH TYR A 92 -8.110 -5.627 7.120 1.00 0.00 H new ATOM 1356 N PHE A 93 -3.506 -8.126 9.459 1.00 0.00 N ATOM 1357 CA PHE A 93 -3.411 -8.999 8.247 1.00 0.00 C ATOM 1358 C PHE A 93 -4.628 -8.775 7.341 1.00 0.00 C ATOM 1359 O PHE A 93 -5.722 -8.520 7.807 1.00 0.00 O ATOM 1360 CB PHE A 93 -3.367 -10.465 8.682 1.00 0.00 C ATOM 1361 CG PHE A 93 -4.453 -10.720 9.700 1.00 0.00 C ATOM 1362 CD1 PHE A 93 -4.234 -10.409 11.047 1.00 0.00 C ATOM 1363 CD2 PHE A 93 -5.677 -11.267 9.298 1.00 0.00 C ATOM 1364 CE1 PHE A 93 -5.240 -10.646 11.992 1.00 0.00 C ATOM 1365 CE2 PHE A 93 -6.683 -11.503 10.243 1.00 0.00 C ATOM 1366 CZ PHE A 93 -6.465 -11.193 11.590 1.00 0.00 C ATOM 0 H PHE A 93 -4.425 -8.097 9.901 1.00 0.00 H new ATOM 0 HA PHE A 93 -2.504 -8.748 7.696 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.503 -11.116 7.818 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -2.392 -10.700 9.108 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -3.290 -9.987 11.357 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -5.846 -11.507 8.259 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -5.071 -10.407 13.032 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -7.628 -11.924 9.932 1.00 0.00 H new ATOM 0 HZ PHE A 93 -7.241 -11.375 12.319 1.00 0.00 H new ATOM 1376 N ALA A 94 -4.446 -8.875 6.050 1.00 0.00 N ATOM 1377 CA ALA A 94 -5.594 -8.677 5.113 1.00 0.00 C ATOM 1378 C ALA A 94 -5.158 -9.010 3.680 1.00 0.00 C ATOM 1379 O ALA A 94 -5.732 -8.531 2.720 1.00 0.00 O ATOM 1380 CB ALA A 94 -6.069 -7.220 5.183 1.00 0.00 C ATOM 0 H ALA A 94 -3.553 -9.085 5.603 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.411 -9.338 5.401 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -6.906 -7.077 4.499 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -6.387 -6.990 6.200 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.252 -6.557 4.900 1.00 0.00 H new ATOM 1386 N TRP A 95 -4.153 -9.828 3.525 1.00 0.00 N ATOM 1387 CA TRP A 95 -3.688 -10.190 2.155 1.00 0.00 C ATOM 1388 C TRP A 95 -4.712 -11.126 1.504 1.00 0.00 C ATOM 1389 O TRP A 95 -5.464 -11.803 2.176 1.00 0.00 O ATOM 1390 CB TRP A 95 -2.322 -10.889 2.241 1.00 0.00 C ATOM 1391 CG TRP A 95 -2.112 -11.420 3.623 1.00 0.00 C ATOM 1392 CD1 TRP A 95 -1.301 -10.863 4.552 1.00 0.00 C ATOM 1393 CD2 TRP A 95 -2.704 -12.596 4.249 1.00 0.00 C ATOM 1394 NE1 TRP A 95 -1.357 -11.621 5.708 1.00 0.00 N ATOM 1395 CE2 TRP A 95 -2.209 -12.700 5.571 1.00 0.00 C ATOM 1396 CE3 TRP A 95 -3.613 -13.571 3.803 1.00 0.00 C ATOM 1397 CZ2 TRP A 95 -2.601 -13.736 6.420 1.00 0.00 C ATOM 1398 CZ3 TRP A 95 -4.011 -14.615 4.655 1.00 0.00 C ATOM 1399 CH2 TRP A 95 -3.506 -14.697 5.961 1.00 0.00 C ATOM 0 H TRP A 95 -3.633 -10.262 4.288 1.00 0.00 H new ATOM 0 HA TRP A 95 -3.588 -9.287 1.552 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.273 -11.703 1.517 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -1.527 -10.188 1.986 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -0.707 -9.972 4.414 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -0.833 -11.409 6.557 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -4.008 -13.517 2.799 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -2.208 -13.795 7.424 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -4.710 -15.359 4.302 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -3.816 -15.502 6.611 1.00 0.00 H new ATOM 1410 N GLU A 96 -4.746 -11.165 0.200 1.00 0.00 N ATOM 1411 CA GLU A 96 -5.722 -12.054 -0.493 1.00 0.00 C ATOM 1412 C GLU A 96 -5.324 -13.515 -0.276 1.00 0.00 C ATOM 1413 O GLU A 96 -6.161 -14.370 -0.054 1.00 0.00 O ATOM 1414 CB GLU A 96 -5.718 -11.743 -1.993 1.00 0.00 C ATOM 1415 CG GLU A 96 -6.950 -12.371 -2.649 1.00 0.00 C ATOM 1416 CD GLU A 96 -8.206 -11.621 -2.204 1.00 0.00 C ATOM 1417 OE1 GLU A 96 -8.573 -10.669 -2.873 1.00 0.00 O ATOM 1418 OE2 GLU A 96 -8.782 -12.013 -1.202 1.00 0.00 O ATOM 0 H GLU A 96 -4.141 -10.621 -0.415 1.00 0.00 H new ATOM 0 HA GLU A 96 -6.720 -11.885 -0.088 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.719 -10.665 -2.151 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -4.810 -12.132 -2.453 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -6.856 -12.332 -3.734 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -7.025 -13.423 -2.373 1.00 0.00 H new ATOM 1425 N ARG A 97 -4.055 -13.811 -0.340 1.00 0.00 N ATOM 1426 CA ARG A 97 -3.604 -15.218 -0.141 1.00 0.00 C ATOM 1427 C ARG A 97 -2.190 -15.219 0.446 1.00 0.00 C ATOM 1428 O ARG A 97 -1.465 -14.249 0.343 1.00 0.00 O ATOM 1429 CB ARG A 97 -3.603 -15.945 -1.490 1.00 0.00 C ATOM 1430 CG ARG A 97 -3.690 -17.456 -1.264 1.00 0.00 C ATOM 1431 CD ARG A 97 -3.796 -18.167 -2.616 1.00 0.00 C ATOM 1432 NE ARG A 97 -4.888 -17.545 -3.417 1.00 0.00 N ATOM 1433 CZ ARG A 97 -4.908 -17.686 -4.715 1.00 0.00 C ATOM 1434 NH1 ARG A 97 -5.490 -18.724 -5.249 1.00 0.00 N ATOM 1435 NH2 ARG A 97 -4.345 -16.788 -5.477 1.00 0.00 N ATOM 0 H ARG A 97 -3.310 -13.139 -0.522 1.00 0.00 H new ATOM 0 HA ARG A 97 -4.280 -15.728 0.545 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -4.445 -15.609 -2.095 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -2.696 -15.702 -2.044 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -2.809 -17.806 -0.725 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -4.557 -17.693 -0.647 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -2.850 -18.095 -3.153 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -3.998 -19.228 -2.467 1.00 0.00 H new ATOM 0 HE ARG A 97 -5.620 -17.009 -2.951 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -5.929 -19.425 -4.653 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -5.506 -18.834 -6.263 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -3.890 -15.977 -5.058 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -4.360 -16.898 -6.491 1.00 0.00 H new ATOM 1449 N ASN A 98 -1.791 -16.298 1.064 1.00 0.00 N ATOM 1450 CA ASN A 98 -0.424 -16.353 1.657 1.00 0.00 C ATOM 1451 C ASN A 98 0.600 -16.651 0.551 1.00 0.00 C ATOM 1452 O ASN A 98 0.326 -17.416 -0.352 1.00 0.00 O ATOM 1453 CB ASN A 98 -0.371 -17.461 2.713 1.00 0.00 C ATOM 1454 CG ASN A 98 -1.662 -17.452 3.533 1.00 0.00 C ATOM 1455 OD1 ASN A 98 -2.480 -16.441 3.431 1.00 0.00 O flip ATOM 1456 ND2 ASN A 98 -1.930 -18.377 4.275 1.00 0.00 N flip ATOM 0 H ASN A 98 -2.351 -17.142 1.184 1.00 0.00 H new ATOM 0 HA ASN A 98 -0.189 -15.396 2.122 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -0.241 -18.430 2.231 1.00 0.00 H new ATOM 0 HB3 ASN A 98 0.488 -17.313 3.367 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -1.291 -19.168 4.355 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -2.794 -18.362 4.817 1.00 0.00 H new ATOM 1463 N PRO A 99 1.774 -16.063 0.615 1.00 0.00 N ATOM 1464 CA PRO A 99 2.813 -16.313 -0.421 1.00 0.00 C ATOM 1465 C PRO A 99 3.162 -17.802 -0.546 1.00 0.00 C ATOM 1466 O PRO A 99 3.638 -18.256 -1.567 1.00 0.00 O ATOM 1467 CB PRO A 99 4.014 -15.513 0.100 1.00 0.00 C ATOM 1468 CG PRO A 99 3.623 -14.833 1.422 1.00 0.00 C ATOM 1469 CD PRO A 99 2.144 -15.122 1.708 1.00 0.00 C ATOM 0 HA PRO A 99 2.487 -16.019 -1.419 1.00 0.00 H new ATOM 0 HB2 PRO A 99 4.868 -16.172 0.253 1.00 0.00 H new ATOM 0 HB3 PRO A 99 4.316 -14.766 -0.634 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.245 -15.205 2.236 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.792 -13.758 1.358 1.00 0.00 H new ATOM 0 HD2 PRO A 99 2.002 -15.569 2.692 1.00 0.00 H new ATOM 0 HD3 PRO A 99 1.542 -14.214 1.681 1.00 0.00 H new ATOM 1477 N SER A 100 2.931 -18.562 0.491 1.00 0.00 N ATOM 1478 CA SER A 100 3.252 -20.016 0.436 1.00 0.00 C ATOM 1479 C SER A 100 2.334 -20.710 -0.573 1.00 0.00 C ATOM 1480 O SER A 100 2.579 -21.829 -0.980 1.00 0.00 O ATOM 1481 CB SER A 100 3.049 -20.635 1.821 1.00 0.00 C ATOM 1482 OG SER A 100 1.709 -20.415 2.240 1.00 0.00 O ATOM 0 H SER A 100 2.534 -18.238 1.373 1.00 0.00 H new ATOM 0 HA SER A 100 4.289 -20.145 0.127 1.00 0.00 H new ATOM 0 HB2 SER A 100 3.262 -21.704 1.790 1.00 0.00 H new ATOM 0 HB3 SER A 100 3.743 -20.193 2.535 1.00 0.00 H new ATOM 0 HG SER A 100 1.574 -20.811 3.126 1.00 0.00 H new ATOM 1488 N THR A 101 1.280 -20.058 -0.982 1.00 0.00 N ATOM 1489 CA THR A 101 0.351 -20.683 -1.964 1.00 0.00 C ATOM 1490 C THR A 101 0.840 -20.395 -3.384 1.00 0.00 C ATOM 1491 O THR A 101 0.276 -20.863 -4.353 1.00 0.00 O ATOM 1492 CB THR A 101 -1.051 -20.099 -1.782 1.00 0.00 C ATOM 1493 OG1 THR A 101 -0.987 -18.685 -1.894 1.00 0.00 O ATOM 1494 CG2 THR A 101 -1.592 -20.481 -0.403 1.00 0.00 C ATOM 0 H THR A 101 1.022 -19.119 -0.678 1.00 0.00 H new ATOM 0 HA THR A 101 0.322 -21.760 -1.800 1.00 0.00 H new ATOM 0 HB THR A 101 -1.715 -20.497 -2.550 1.00 0.00 H new ATOM 0 HG1 THR A 101 -0.634 -18.307 -1.062 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.591 -20.064 -0.276 1.00 0.00 H new ATOM 0 HG22 THR A 101 -1.639 -21.567 -0.318 1.00 0.00 H new ATOM 0 HG23 THR A 101 -0.932 -20.085 0.369 1.00 0.00 H new ATOM 1502 N ILE A 102 1.886 -19.621 -3.514 1.00 0.00 N ATOM 1503 CA ILE A 102 2.419 -19.293 -4.869 1.00 0.00 C ATOM 1504 C ILE A 102 3.934 -19.510 -4.880 1.00 0.00 C ATOM 1505 O ILE A 102 4.586 -19.458 -3.857 1.00 0.00 O ATOM 1506 CB ILE A 102 2.112 -17.831 -5.193 1.00 0.00 C ATOM 1507 CG1 ILE A 102 0.596 -17.625 -5.225 1.00 0.00 C ATOM 1508 CG2 ILE A 102 2.702 -17.475 -6.559 1.00 0.00 C ATOM 1509 CD1 ILE A 102 0.285 -16.128 -5.288 1.00 0.00 C ATOM 0 H ILE A 102 2.396 -19.201 -2.737 1.00 0.00 H new ATOM 0 HA ILE A 102 1.952 -19.937 -5.614 1.00 0.00 H new ATOM 0 HB ILE A 102 2.552 -17.190 -4.429 1.00 0.00 H new ATOM 0 HG12 ILE A 102 0.168 -18.133 -6.089 1.00 0.00 H new ATOM 0 HG13 ILE A 102 0.140 -18.065 -4.338 1.00 0.00 H new ATOM 0 HG21 ILE A 102 2.483 -16.432 -6.790 1.00 0.00 H new ATOM 0 HG22 ILE A 102 3.782 -17.623 -6.539 1.00 0.00 H new ATOM 0 HG23 ILE A 102 2.262 -18.116 -7.323 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -0.795 -15.981 -5.311 1.00 0.00 H new ATOM 0 HD12 ILE A 102 0.700 -15.633 -4.410 1.00 0.00 H new ATOM 0 HD13 ILE A 102 0.728 -15.702 -6.188 1.00 0.00 H new ATOM 1521 N SER A 103 4.500 -19.756 -6.029 1.00 0.00 N ATOM 1522 CA SER A 103 5.971 -19.980 -6.103 1.00 0.00 C ATOM 1523 C SER A 103 6.707 -18.685 -5.750 1.00 0.00 C ATOM 1524 O SER A 103 7.413 -18.121 -6.562 1.00 0.00 O ATOM 1525 CB SER A 103 6.351 -20.412 -7.520 1.00 0.00 C ATOM 1526 OG SER A 103 5.550 -21.523 -7.902 1.00 0.00 O ATOM 0 H SER A 103 4.007 -19.812 -6.920 1.00 0.00 H new ATOM 0 HA SER A 103 6.253 -20.760 -5.396 1.00 0.00 H new ATOM 0 HB2 SER A 103 6.204 -19.586 -8.216 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.407 -20.679 -7.561 1.00 0.00 H new ATOM 0 HG SER A 103 5.789 -21.802 -8.810 1.00 0.00 H new ATOM 1532 N SER A 104 6.551 -18.210 -4.543 1.00 0.00 N ATOM 1533 CA SER A 104 7.247 -16.956 -4.139 1.00 0.00 C ATOM 1534 C SER A 104 6.873 -15.824 -5.106 1.00 0.00 C ATOM 1535 O SER A 104 7.553 -15.600 -6.089 1.00 0.00 O ATOM 1536 CB SER A 104 8.759 -17.181 -4.186 1.00 0.00 C ATOM 1537 OG SER A 104 9.411 -16.141 -3.469 1.00 0.00 O ATOM 0 H SER A 104 5.972 -18.637 -3.820 1.00 0.00 H new ATOM 0 HA SER A 104 6.945 -16.683 -3.128 1.00 0.00 H new ATOM 0 HB2 SER A 104 9.008 -18.149 -3.752 1.00 0.00 H new ATOM 0 HB3 SER A 104 9.104 -17.197 -5.220 1.00 0.00 H new ATOM 0 HG SER A 104 10.380 -16.283 -3.496 1.00 0.00 H new ATOM 1543 N PRO A 105 5.802 -15.112 -4.840 1.00 0.00 N ATOM 1544 CA PRO A 105 5.379 -13.999 -5.733 1.00 0.00 C ATOM 1545 C PRO A 105 6.403 -12.858 -5.760 1.00 0.00 C ATOM 1546 O PRO A 105 7.551 -13.035 -5.403 1.00 0.00 O ATOM 1547 CB PRO A 105 4.059 -13.537 -5.099 1.00 0.00 C ATOM 1548 CG PRO A 105 3.775 -14.401 -3.861 1.00 0.00 C ATOM 1549 CD PRO A 105 4.949 -15.363 -3.647 1.00 0.00 C ATOM 0 HA PRO A 105 5.282 -14.310 -6.773 1.00 0.00 H new ATOM 0 HB2 PRO A 105 4.123 -12.486 -4.819 1.00 0.00 H new ATOM 0 HB3 PRO A 105 3.244 -13.627 -5.817 1.00 0.00 H new ATOM 0 HG2 PRO A 105 3.641 -13.769 -2.983 1.00 0.00 H new ATOM 0 HG3 PRO A 105 2.849 -14.960 -3.996 1.00 0.00 H new ATOM 0 HD2 PRO A 105 5.480 -15.153 -2.719 1.00 0.00 H new ATOM 0 HD3 PRO A 105 4.618 -16.400 -3.597 1.00 0.00 H new ATOM 1557 N GLY A 106 5.995 -11.688 -6.174 1.00 0.00 N ATOM 1558 CA GLY A 106 6.947 -10.542 -6.215 1.00 0.00 C ATOM 1559 C GLY A 106 7.418 -10.230 -4.795 1.00 0.00 C ATOM 1560 O GLY A 106 7.651 -11.120 -4.000 1.00 0.00 O ATOM 0 H GLY A 106 5.047 -11.477 -6.485 1.00 0.00 H new ATOM 0 HA2 GLY A 106 7.800 -10.785 -6.849 1.00 0.00 H new ATOM 0 HA3 GLY A 106 6.464 -9.668 -6.651 1.00 0.00 H new ATOM 1564 N HIS A 107 7.557 -8.975 -4.465 1.00 0.00 N ATOM 1565 CA HIS A 107 8.008 -8.610 -3.090 1.00 0.00 C ATOM 1566 C HIS A 107 7.321 -7.309 -2.663 1.00 0.00 C ATOM 1567 O HIS A 107 7.772 -6.617 -1.773 1.00 0.00 O ATOM 1568 CB HIS A 107 9.530 -8.430 -3.077 1.00 0.00 C ATOM 1569 CG HIS A 107 10.158 -9.393 -4.048 1.00 0.00 C ATOM 1570 ND1 HIS A 107 10.319 -9.350 -5.409 1.00 0.00 N flip ATOM 1571 CD2 HIS A 107 10.716 -10.591 -3.642 1.00 0.00 C flip ATOM 1572 CE1 HIS A 107 10.966 -10.496 -5.844 1.00 0.00 C flip ATOM 1573 NE2 HIS A 107 11.181 -11.210 -4.743 1.00 0.00 N flip ATOM 0 H HIS A 107 7.378 -8.186 -5.087 1.00 0.00 H new ATOM 0 HA HIS A 107 7.741 -9.404 -2.393 1.00 0.00 H new ATOM 0 HB2 HIS A 107 9.788 -7.406 -3.346 1.00 0.00 H new ATOM 0 HB3 HIS A 107 9.919 -8.603 -2.074 1.00 0.00 H new ATOM 0 HD2 HIS A 107 10.769 -10.962 -2.629 1.00 0.00 H new ATOM 0 HE1 HIS A 107 11.237 -10.753 -6.857 1.00 0.00 H new ATOM 0 HE2 HIS A 107 11.644 -12.119 -4.734 1.00 0.00 H new ATOM 1581 N CYS A 108 6.225 -6.978 -3.295 1.00 0.00 N ATOM 1582 CA CYS A 108 5.490 -5.732 -2.933 1.00 0.00 C ATOM 1583 C CYS A 108 3.988 -5.988 -3.053 1.00 0.00 C ATOM 1584 O CYS A 108 3.546 -6.721 -3.915 1.00 0.00 O ATOM 1585 CB CYS A 108 5.899 -4.602 -3.878 1.00 0.00 C ATOM 1586 SG CYS A 108 7.583 -4.075 -3.483 1.00 0.00 S ATOM 0 H CYS A 108 5.806 -7.521 -4.050 1.00 0.00 H new ATOM 0 HA CYS A 108 5.732 -5.445 -1.910 1.00 0.00 H new ATOM 0 HB2 CYS A 108 5.844 -4.940 -4.913 1.00 0.00 H new ATOM 0 HB3 CYS A 108 5.210 -3.763 -3.780 1.00 0.00 H new ATOM 1591 N ALA A 109 3.197 -5.402 -2.189 1.00 0.00 N ATOM 1592 CA ALA A 109 1.722 -5.632 -2.251 1.00 0.00 C ATOM 1593 C ALA A 109 0.998 -4.360 -2.712 1.00 0.00 C ATOM 1594 O ALA A 109 1.447 -3.246 -2.495 1.00 0.00 O ATOM 1595 CB ALA A 109 1.209 -6.045 -0.865 1.00 0.00 C ATOM 0 H ALA A 109 3.508 -4.776 -1.446 1.00 0.00 H new ATOM 0 HA ALA A 109 1.520 -6.427 -2.969 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.133 -6.213 -0.910 1.00 0.00 H new ATOM 0 HB2 ALA A 109 1.706 -6.963 -0.552 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.423 -5.253 -0.147 1.00 0.00 H new ATOM 1601 N SER A 110 -0.127 -4.538 -3.346 1.00 0.00 N ATOM 1602 CA SER A 110 -0.927 -3.386 -3.846 1.00 0.00 C ATOM 1603 C SER A 110 -2.408 -3.691 -3.611 1.00 0.00 C ATOM 1604 O SER A 110 -2.781 -4.819 -3.356 1.00 0.00 O ATOM 1605 CB SER A 110 -0.681 -3.200 -5.347 1.00 0.00 C ATOM 1606 OG SER A 110 -0.428 -4.468 -5.940 1.00 0.00 O ATOM 0 H SER A 110 -0.534 -5.453 -3.542 1.00 0.00 H new ATOM 0 HA SER A 110 -0.638 -2.475 -3.322 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.548 -2.733 -5.815 1.00 0.00 H new ATOM 0 HB3 SER A 110 0.166 -2.534 -5.509 1.00 0.00 H new ATOM 0 HG SER A 110 -0.271 -4.354 -6.901 1.00 0.00 H new ATOM 1612 N LEU A 111 -3.256 -2.708 -3.698 1.00 0.00 N ATOM 1613 CA LEU A 111 -4.706 -2.965 -3.485 1.00 0.00 C ATOM 1614 C LEU A 111 -5.309 -3.426 -4.811 1.00 0.00 C ATOM 1615 O LEU A 111 -4.862 -3.036 -5.868 1.00 0.00 O ATOM 1616 CB LEU A 111 -5.398 -1.674 -3.031 1.00 0.00 C ATOM 1617 CG LEU A 111 -4.846 -1.221 -1.666 1.00 0.00 C ATOM 1618 CD1 LEU A 111 -4.488 0.266 -1.716 1.00 0.00 C ATOM 1619 CD2 LEU A 111 -5.907 -1.434 -0.584 1.00 0.00 C ATOM 0 H LEU A 111 -3.010 -1.740 -3.907 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.844 -3.728 -2.719 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.242 -0.890 -3.772 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.474 -1.836 -2.960 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.956 -1.807 -1.436 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.098 0.579 -0.747 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.731 0.432 -2.483 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.379 0.847 -1.954 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.513 -1.113 0.380 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.795 -0.851 -0.826 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -6.169 -2.491 -0.535 1.00 0.00 H new ATOM 1631 N SER A 112 -6.305 -4.266 -4.765 1.00 0.00 N ATOM 1632 CA SER A 112 -6.933 -4.770 -6.025 1.00 0.00 C ATOM 1633 C SER A 112 -8.367 -4.249 -6.132 1.00 0.00 C ATOM 1634 O SER A 112 -9.215 -4.575 -5.327 1.00 0.00 O ATOM 1635 CB SER A 112 -6.954 -6.300 -5.997 1.00 0.00 C ATOM 1636 OG SER A 112 -5.712 -6.777 -5.493 1.00 0.00 O ATOM 0 H SER A 112 -6.716 -4.629 -3.905 1.00 0.00 H new ATOM 0 HA SER A 112 -6.357 -4.421 -6.882 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.773 -6.653 -5.371 1.00 0.00 H new ATOM 0 HB3 SER A 112 -7.128 -6.691 -6.999 1.00 0.00 H new ATOM 0 HG SER A 112 -4.976 -6.308 -5.939 1.00 0.00 H new ATOM 1642 N ARG A 113 -8.648 -3.441 -7.120 1.00 0.00 N ATOM 1643 CA ARG A 113 -10.037 -2.908 -7.263 1.00 0.00 C ATOM 1644 C ARG A 113 -11.033 -4.070 -7.268 1.00 0.00 C ATOM 1645 O ARG A 113 -12.100 -3.988 -6.693 1.00 0.00 O ATOM 1646 CB ARG A 113 -10.158 -2.133 -8.579 1.00 0.00 C ATOM 1647 CG ARG A 113 -11.623 -1.755 -8.822 1.00 0.00 C ATOM 1648 CD ARG A 113 -11.711 -0.788 -10.004 1.00 0.00 C ATOM 1649 NE ARG A 113 -11.334 -1.504 -11.257 1.00 0.00 N ATOM 1650 CZ ARG A 113 -11.802 -1.103 -12.406 1.00 0.00 C ATOM 1651 NH1 ARG A 113 -13.089 -0.955 -12.570 1.00 0.00 N ATOM 1652 NH2 ARG A 113 -10.986 -0.852 -13.393 1.00 0.00 N ATOM 0 H ARG A 113 -7.984 -3.129 -7.828 1.00 0.00 H new ATOM 0 HA ARG A 113 -10.255 -2.243 -6.427 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -9.542 -1.235 -8.541 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -9.787 -2.740 -9.405 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -12.212 -2.650 -9.026 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -12.044 -1.293 -7.929 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -12.723 -0.391 -10.089 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -11.047 0.062 -9.844 1.00 0.00 H new ATOM 0 HE ARG A 113 -10.709 -2.309 -11.215 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -13.727 -1.153 -11.800 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -13.456 -0.641 -13.469 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -9.981 -0.969 -13.266 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -11.353 -0.538 -14.291 1.00 0.00 H new ATOM 1666 N SER A 114 -10.698 -5.150 -7.919 1.00 0.00 N ATOM 1667 CA SER A 114 -11.630 -6.312 -7.968 1.00 0.00 C ATOM 1668 C SER A 114 -11.944 -6.787 -6.548 1.00 0.00 C ATOM 1669 O SER A 114 -12.952 -7.423 -6.307 1.00 0.00 O ATOM 1670 CB SER A 114 -10.979 -7.452 -8.752 1.00 0.00 C ATOM 1671 OG SER A 114 -11.811 -8.602 -8.689 1.00 0.00 O ATOM 0 H SER A 114 -9.819 -5.278 -8.419 1.00 0.00 H new ATOM 0 HA SER A 114 -12.555 -6.010 -8.458 1.00 0.00 H new ATOM 0 HB2 SER A 114 -10.828 -7.155 -9.790 1.00 0.00 H new ATOM 0 HB3 SER A 114 -9.996 -7.678 -8.339 1.00 0.00 H new ATOM 0 HG SER A 114 -11.396 -9.334 -9.192 1.00 0.00 H new ATOM 1677 N THR A 115 -11.089 -6.490 -5.607 1.00 0.00 N ATOM 1678 CA THR A 115 -11.335 -6.929 -4.200 1.00 0.00 C ATOM 1679 C THR A 115 -11.809 -5.737 -3.365 1.00 0.00 C ATOM 1680 O THR A 115 -11.594 -5.680 -2.171 1.00 0.00 O ATOM 1681 CB THR A 115 -10.037 -7.485 -3.608 1.00 0.00 C ATOM 1682 OG1 THR A 115 -9.098 -6.429 -3.459 1.00 0.00 O ATOM 1683 CG2 THR A 115 -9.463 -8.557 -4.538 1.00 0.00 C ATOM 0 H THR A 115 -10.229 -5.961 -5.751 1.00 0.00 H new ATOM 0 HA THR A 115 -12.102 -7.703 -4.190 1.00 0.00 H new ATOM 0 HB THR A 115 -10.243 -7.930 -2.634 1.00 0.00 H new ATOM 0 HG1 THR A 115 -9.300 -5.719 -4.103 1.00 0.00 H new ATOM 0 HG21 THR A 115 -8.539 -8.950 -4.113 1.00 0.00 H new ATOM 0 HG22 THR A 115 -10.185 -9.366 -4.649 1.00 0.00 H new ATOM 0 HG23 THR A 115 -9.256 -8.119 -5.514 1.00 0.00 H new ATOM 1691 N ALA A 116 -12.449 -4.783 -3.986 1.00 0.00 N ATOM 1692 CA ALA A 116 -12.935 -3.594 -3.230 1.00 0.00 C ATOM 1693 C ALA A 116 -11.748 -2.905 -2.552 1.00 0.00 C ATOM 1694 O ALA A 116 -11.894 -2.240 -1.546 1.00 0.00 O ATOM 1695 CB ALA A 116 -13.944 -4.039 -2.169 1.00 0.00 C ATOM 0 H ALA A 116 -12.656 -4.776 -4.985 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.417 -2.898 -3.916 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -14.299 -3.169 -1.617 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -14.788 -4.530 -2.653 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -13.465 -4.735 -1.481 1.00 0.00 H new ATOM 1701 N PHE A 117 -10.575 -3.059 -3.101 1.00 0.00 N ATOM 1702 CA PHE A 117 -9.373 -2.416 -2.502 1.00 0.00 C ATOM 1703 C PHE A 117 -9.238 -2.839 -1.038 1.00 0.00 C ATOM 1704 O PHE A 117 -8.680 -2.124 -0.228 1.00 0.00 O ATOM 1705 CB PHE A 117 -9.507 -0.893 -2.573 1.00 0.00 C ATOM 1706 CG PHE A 117 -9.807 -0.467 -3.990 1.00 0.00 C ATOM 1707 CD1 PHE A 117 -11.133 -0.380 -4.429 1.00 0.00 C ATOM 1708 CD2 PHE A 117 -8.759 -0.150 -4.863 1.00 0.00 C ATOM 1709 CE1 PHE A 117 -11.411 0.023 -5.741 1.00 0.00 C ATOM 1710 CE2 PHE A 117 -9.037 0.253 -6.173 1.00 0.00 C ATOM 1711 CZ PHE A 117 -10.363 0.340 -6.613 1.00 0.00 C ATOM 0 H PHE A 117 -10.397 -3.606 -3.943 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.490 -2.730 -3.058 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -10.303 -0.558 -1.908 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -8.586 -0.422 -2.230 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -11.942 -0.624 -3.756 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -7.736 -0.217 -4.524 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -12.434 0.089 -6.080 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -8.228 0.497 -6.846 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.577 0.652 -7.625 1.00 0.00 H new ATOM 1721 N LEU A 118 -9.746 -3.990 -0.691 1.00 0.00 N ATOM 1722 CA LEU A 118 -9.650 -4.456 0.723 1.00 0.00 C ATOM 1723 C LEU A 118 -8.625 -5.588 0.826 1.00 0.00 C ATOM 1724 O LEU A 118 -8.108 -5.870 1.889 1.00 0.00 O ATOM 1725 CB LEU A 118 -11.021 -4.966 1.178 1.00 0.00 C ATOM 1726 CG LEU A 118 -11.955 -3.783 1.454 1.00 0.00 C ATOM 1727 CD1 LEU A 118 -13.351 -4.312 1.797 1.00 0.00 C ATOM 1728 CD2 LEU A 118 -11.421 -2.948 2.629 1.00 0.00 C ATOM 0 H LEU A 118 -10.224 -4.629 -1.326 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.335 -3.628 1.358 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.452 -5.609 0.411 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -10.913 -5.572 2.078 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.005 -3.152 0.566 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -14.019 -3.474 1.994 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -13.736 -4.894 0.959 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -13.293 -4.946 2.682 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -12.093 -2.110 2.815 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -11.362 -3.571 3.521 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -10.429 -2.569 2.385 1.00 0.00 H new ATOM 1740 N ARG A 119 -8.324 -6.239 -0.267 1.00 0.00 N ATOM 1741 CA ARG A 119 -7.330 -7.353 -0.232 1.00 0.00 C ATOM 1742 C ARG A 119 -6.031 -6.898 -0.901 1.00 0.00 C ATOM 1743 O ARG A 119 -6.046 -6.176 -1.879 1.00 0.00 O ATOM 1744 CB ARG A 119 -7.895 -8.562 -0.982 1.00 0.00 C ATOM 1745 CG ARG A 119 -9.256 -8.943 -0.392 1.00 0.00 C ATOM 1746 CD ARG A 119 -9.072 -9.512 1.019 1.00 0.00 C ATOM 1747 NE ARG A 119 -10.270 -10.318 1.388 1.00 0.00 N ATOM 1748 CZ ARG A 119 -10.195 -11.194 2.352 1.00 0.00 C ATOM 1749 NH1 ARG A 119 -9.883 -10.811 3.559 1.00 0.00 N ATOM 1750 NH2 ARG A 119 -10.432 -12.455 2.109 1.00 0.00 N ATOM 0 H ARG A 119 -8.725 -6.047 -1.185 1.00 0.00 H new ATOM 0 HA ARG A 119 -7.128 -7.629 0.803 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -7.999 -8.329 -2.042 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -7.206 -9.404 -0.907 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -9.906 -8.068 -0.359 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -9.745 -9.679 -1.030 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -8.176 -10.132 1.059 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -8.931 -8.702 1.734 1.00 0.00 H new ATOM 0 HE ARG A 119 -11.148 -10.185 0.887 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -9.698 -9.826 3.750 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -9.825 -11.496 4.312 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -10.676 -12.755 1.165 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -10.373 -13.139 2.863 1.00 0.00 H new ATOM 1764 N TRP A 120 -4.907 -7.312 -0.379 1.00 0.00 N ATOM 1765 CA TRP A 120 -3.604 -6.898 -0.982 1.00 0.00 C ATOM 1766 C TRP A 120 -3.102 -7.986 -1.936 1.00 0.00 C ATOM 1767 O TRP A 120 -3.153 -9.161 -1.635 1.00 0.00 O ATOM 1768 CB TRP A 120 -2.573 -6.693 0.132 1.00 0.00 C ATOM 1769 CG TRP A 120 -3.137 -5.784 1.174 1.00 0.00 C ATOM 1770 CD1 TRP A 120 -3.752 -4.604 0.930 1.00 0.00 C ATOM 1771 CD2 TRP A 120 -3.147 -5.958 2.619 1.00 0.00 C ATOM 1772 NE1 TRP A 120 -4.139 -4.044 2.134 1.00 0.00 N ATOM 1773 CE2 TRP A 120 -3.789 -4.843 3.203 1.00 0.00 C ATOM 1774 CE3 TRP A 120 -2.666 -6.970 3.470 1.00 0.00 C ATOM 1775 CZ2 TRP A 120 -3.948 -4.733 4.585 1.00 0.00 C ATOM 1776 CZ3 TRP A 120 -2.825 -6.863 4.860 1.00 0.00 C ATOM 1777 CH2 TRP A 120 -3.464 -5.746 5.417 1.00 0.00 C ATOM 0 H TRP A 120 -4.834 -7.918 0.438 1.00 0.00 H new ATOM 0 HA TRP A 120 -3.744 -5.969 -1.535 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -2.307 -7.652 0.577 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -1.658 -6.268 -0.279 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -3.914 -4.170 -0.046 1.00 0.00 H new ATOM 0 HE1 TRP A 120 -4.623 -3.151 2.221 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -2.172 -7.834 3.051 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 -4.442 -3.871 5.009 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -2.453 -7.646 5.505 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -3.582 -5.669 6.488 1.00 0.00 H new ATOM 1788 N LYS A 121 -2.607 -7.596 -3.084 1.00 0.00 N ATOM 1789 CA LYS A 121 -2.087 -8.596 -4.065 1.00 0.00 C ATOM 1790 C LYS A 121 -0.610 -8.331 -4.322 1.00 0.00 C ATOM 1791 O LYS A 121 -0.166 -7.201 -4.357 1.00 0.00 O ATOM 1792 CB LYS A 121 -2.866 -8.482 -5.379 1.00 0.00 C ATOM 1793 CG LYS A 121 -2.575 -9.705 -6.251 1.00 0.00 C ATOM 1794 CD LYS A 121 -3.408 -9.630 -7.532 1.00 0.00 C ATOM 1795 CE LYS A 121 -3.327 -10.965 -8.274 1.00 0.00 C ATOM 1796 NZ LYS A 121 -1.899 -11.326 -8.493 1.00 0.00 N ATOM 0 H LYS A 121 -2.541 -6.624 -3.385 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.211 -9.600 -3.660 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -3.935 -8.413 -5.176 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -2.582 -7.571 -5.905 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -1.514 -9.745 -6.497 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -2.810 -10.618 -5.705 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -4.445 -9.399 -7.290 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -3.042 -8.825 -8.169 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -3.826 -11.744 -7.698 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -3.846 -10.894 -9.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -1.805 -11.842 -9.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -1.324 -10.460 -8.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -1.569 -11.928 -7.712 1.00 0.00 H new ATOM 1810 N ASP A 122 0.162 -9.368 -4.492 1.00 0.00 N ATOM 1811 CA ASP A 122 1.615 -9.178 -4.730 1.00 0.00 C ATOM 1812 C ASP A 122 1.850 -8.692 -6.163 1.00 0.00 C ATOM 1813 O ASP A 122 1.102 -9.008 -7.066 1.00 0.00 O ATOM 1814 CB ASP A 122 2.347 -10.505 -4.512 1.00 0.00 C ATOM 1815 CG ASP A 122 1.775 -11.205 -3.278 1.00 0.00 C ATOM 1816 OD1 ASP A 122 0.704 -11.777 -3.390 1.00 0.00 O ATOM 1817 OD2 ASP A 122 2.419 -11.158 -2.243 1.00 0.00 O ATOM 0 H ASP A 122 -0.153 -10.338 -4.476 1.00 0.00 H new ATOM 0 HA ASP A 122 1.997 -8.432 -4.033 1.00 0.00 H new ATOM 0 HB2 ASP A 122 2.236 -11.142 -5.389 1.00 0.00 H new ATOM 0 HB3 ASP A 122 3.414 -10.327 -4.380 1.00 0.00 H new ATOM 1822 N TYR A 123 2.886 -7.924 -6.379 1.00 0.00 N ATOM 1823 CA TYR A 123 3.165 -7.421 -7.758 1.00 0.00 C ATOM 1824 C TYR A 123 4.651 -7.049 -7.880 1.00 0.00 C ATOM 1825 O TYR A 123 5.321 -6.795 -6.899 1.00 0.00 O ATOM 1826 CB TYR A 123 2.287 -6.189 -8.033 1.00 0.00 C ATOM 1827 CG TYR A 123 1.415 -6.439 -9.243 1.00 0.00 C ATOM 1828 CD1 TYR A 123 0.148 -7.012 -9.086 1.00 0.00 C ATOM 1829 CD2 TYR A 123 1.875 -6.096 -10.519 1.00 0.00 C ATOM 1830 CE1 TYR A 123 -0.658 -7.244 -10.206 1.00 0.00 C ATOM 1831 CE2 TYR A 123 1.068 -6.327 -11.640 1.00 0.00 C ATOM 1832 CZ TYR A 123 -0.199 -6.902 -11.483 1.00 0.00 C ATOM 1833 OH TYR A 123 -0.995 -7.131 -12.587 1.00 0.00 O ATOM 0 H TYR A 123 3.549 -7.624 -5.664 1.00 0.00 H new ATOM 0 HA TYR A 123 2.935 -8.197 -8.488 1.00 0.00 H new ATOM 0 HB2 TYR A 123 1.665 -5.973 -7.164 1.00 0.00 H new ATOM 0 HB3 TYR A 123 2.915 -5.314 -8.201 1.00 0.00 H new ATOM 0 HD1 TYR A 123 -0.208 -7.275 -8.101 1.00 0.00 H new ATOM 0 HD2 TYR A 123 2.853 -5.653 -10.640 1.00 0.00 H new ATOM 0 HE1 TYR A 123 -1.635 -7.687 -10.085 1.00 0.00 H new ATOM 0 HE2 TYR A 123 1.423 -6.062 -12.625 1.00 0.00 H new ATOM 0 HH TYR A 123 -0.526 -6.835 -13.395 1.00 0.00 H new ATOM 1843 N ASN A 124 5.167 -7.020 -9.081 1.00 0.00 N ATOM 1844 CA ASN A 124 6.606 -6.670 -9.276 1.00 0.00 C ATOM 1845 C ASN A 124 6.903 -5.317 -8.623 1.00 0.00 C ATOM 1846 O ASN A 124 6.380 -4.297 -9.021 1.00 0.00 O ATOM 1847 CB ASN A 124 6.912 -6.591 -10.774 1.00 0.00 C ATOM 1848 CG ASN A 124 7.023 -8.005 -11.350 1.00 0.00 C ATOM 1849 OD1 ASN A 124 6.257 -8.383 -12.215 1.00 0.00 O ATOM 1850 ND2 ASN A 124 7.948 -8.809 -10.902 1.00 0.00 N ATOM 0 H ASN A 124 4.653 -7.224 -9.938 1.00 0.00 H new ATOM 0 HA ASN A 124 7.229 -7.436 -8.815 1.00 0.00 H new ATOM 0 HB2 ASN A 124 6.125 -6.039 -11.288 1.00 0.00 H new ATOM 0 HB3 ASN A 124 7.842 -6.047 -10.937 1.00 0.00 H new ATOM 0 HD21 ASN A 124 8.028 -9.754 -11.278 1.00 0.00 H new ATOM 0 HD22 ASN A 124 8.591 -8.492 -10.176 1.00 0.00 H new ATOM 1857 N CYS A 125 7.738 -5.307 -7.621 1.00 0.00 N ATOM 1858 CA CYS A 125 8.073 -4.030 -6.923 1.00 0.00 C ATOM 1859 C CYS A 125 8.461 -2.941 -7.928 1.00 0.00 C ATOM 1860 O CYS A 125 8.686 -1.808 -7.555 1.00 0.00 O ATOM 1861 CB CYS A 125 9.257 -4.266 -5.983 1.00 0.00 C ATOM 1862 SG CYS A 125 8.740 -5.298 -4.593 1.00 0.00 S ATOM 0 H CYS A 125 8.207 -6.134 -7.252 1.00 0.00 H new ATOM 0 HA CYS A 125 7.195 -3.704 -6.366 1.00 0.00 H new ATOM 0 HB2 CYS A 125 10.071 -4.749 -6.523 1.00 0.00 H new ATOM 0 HB3 CYS A 125 9.639 -3.313 -5.618 1.00 0.00 H new ATOM 1867 N ASN A 126 8.566 -3.266 -9.189 1.00 0.00 N ATOM 1868 CA ASN A 126 8.971 -2.225 -10.184 1.00 0.00 C ATOM 1869 C ASN A 126 7.750 -1.689 -10.939 1.00 0.00 C ATOM 1870 O ASN A 126 7.714 -0.537 -11.323 1.00 0.00 O ATOM 1871 CB ASN A 126 9.958 -2.831 -11.182 1.00 0.00 C ATOM 1872 CG ASN A 126 11.274 -3.149 -10.469 1.00 0.00 C ATOM 1873 OD1 ASN A 126 11.245 -3.725 -9.299 1.00 0.00 O flip ATOM 1874 ND2 ASN A 126 12.340 -2.869 -10.982 1.00 0.00 N flip ATOM 0 H ASN A 126 8.392 -4.195 -9.572 1.00 0.00 H new ATOM 0 HA ASN A 126 9.440 -1.399 -9.650 1.00 0.00 H new ATOM 0 HB2 ASN A 126 9.540 -3.738 -11.618 1.00 0.00 H new ATOM 0 HB3 ASN A 126 10.135 -2.136 -12.002 1.00 0.00 H new ATOM 0 HD21 ASN A 126 12.363 -2.419 -11.897 1.00 0.00 H new ATOM 0 HD22 ASN A 126 13.211 -3.085 -10.498 1.00 0.00 H new ATOM 1881 N VAL A 127 6.744 -2.494 -11.152 1.00 0.00 N ATOM 1882 CA VAL A 127 5.543 -1.980 -11.876 1.00 0.00 C ATOM 1883 C VAL A 127 5.059 -0.744 -11.125 1.00 0.00 C ATOM 1884 O VAL A 127 4.889 -0.778 -9.921 1.00 0.00 O ATOM 1885 CB VAL A 127 4.446 -3.051 -11.890 1.00 0.00 C ATOM 1886 CG1 VAL A 127 3.102 -2.415 -12.262 1.00 0.00 C ATOM 1887 CG2 VAL A 127 4.800 -4.128 -12.917 1.00 0.00 C ATOM 0 H VAL A 127 6.700 -3.471 -10.862 1.00 0.00 H new ATOM 0 HA VAL A 127 5.787 -1.732 -12.909 1.00 0.00 H new ATOM 0 HB VAL A 127 4.369 -3.499 -10.899 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.327 -3.181 -12.270 1.00 0.00 H new ATOM 0 HG12 VAL A 127 2.847 -1.649 -11.530 1.00 0.00 H new ATOM 0 HG13 VAL A 127 3.175 -1.962 -13.251 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.021 -4.890 -12.928 1.00 0.00 H new ATOM 0 HG22 VAL A 127 4.879 -3.676 -13.906 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.752 -4.586 -12.650 1.00 0.00 H new ATOM 1897 N ARG A 128 4.875 0.365 -11.792 1.00 0.00 N ATOM 1898 CA ARG A 128 4.455 1.570 -11.050 1.00 0.00 C ATOM 1899 C ARG A 128 2.955 1.602 -10.902 1.00 0.00 C ATOM 1900 O ARG A 128 2.249 1.112 -11.761 1.00 0.00 O ATOM 1901 CB ARG A 128 4.914 2.793 -11.844 1.00 0.00 C ATOM 1902 CG ARG A 128 6.318 2.544 -12.398 1.00 0.00 C ATOM 1903 CD ARG A 128 6.865 3.837 -13.006 1.00 0.00 C ATOM 1904 NE ARG A 128 5.940 4.314 -14.072 1.00 0.00 N ATOM 1905 CZ ARG A 128 6.359 5.171 -14.964 1.00 0.00 C ATOM 1906 NH1 ARG A 128 7.535 5.022 -15.507 1.00 0.00 N ATOM 1907 NH2 ARG A 128 5.601 6.175 -15.311 1.00 0.00 N ATOM 0 H ARG A 128 4.996 0.480 -12.798 1.00 0.00 H new ATOM 0 HA ARG A 128 4.897 1.565 -10.054 1.00 0.00 H new ATOM 0 HB2 ARG A 128 4.219 2.992 -12.660 1.00 0.00 H new ATOM 0 HB3 ARG A 128 4.915 3.676 -11.204 1.00 0.00 H new ATOM 0 HG2 ARG A 128 6.978 2.196 -11.603 1.00 0.00 H new ATOM 0 HG3 ARG A 128 6.288 1.759 -13.153 1.00 0.00 H new ATOM 0 HD2 ARG A 128 6.970 4.599 -12.233 1.00 0.00 H new ATOM 0 HD3 ARG A 128 7.858 3.665 -13.421 1.00 0.00 H new ATOM 0 HE ARG A 128 4.980 3.971 -14.105 1.00 0.00 H new ATOM 0 HH11 ARG A 128 8.127 4.237 -15.235 1.00 0.00 H new ATOM 0 HH12 ARG A 128 7.863 5.691 -16.204 1.00 0.00 H new ATOM 0 HH21 ARG A 128 4.681 6.290 -14.886 1.00 0.00 H new ATOM 0 HH22 ARG A 128 5.928 6.844 -16.008 1.00 0.00 H new ATOM 1921 N LEU A 129 2.427 2.159 -9.834 1.00 0.00 N ATOM 1922 CA LEU A 129 0.923 2.139 -9.756 1.00 0.00 C ATOM 1923 C LEU A 129 0.427 3.393 -9.091 1.00 0.00 C ATOM 1924 O LEU A 129 1.151 3.987 -8.317 1.00 0.00 O ATOM 1925 CB LEU A 129 0.482 0.941 -8.903 1.00 0.00 C ATOM 1926 CG LEU A 129 0.432 -0.346 -9.743 1.00 0.00 C ATOM 1927 CD1 LEU A 129 1.392 -1.385 -9.160 1.00 0.00 C ATOM 1928 CD2 LEU A 129 -0.988 -0.904 -9.711 1.00 0.00 C ATOM 0 H LEU A 129 2.927 2.598 -9.061 1.00 0.00 H new ATOM 0 HA LEU A 129 0.516 2.068 -10.765 1.00 0.00 H new ATOM 0 HB2 LEU A 129 1.173 0.809 -8.070 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.501 1.138 -8.474 1.00 0.00 H new ATOM 0 HG LEU A 129 0.725 -0.121 -10.769 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.352 -2.294 -9.760 1.00 0.00 H new ATOM 0 HD12 LEU A 129 2.407 -0.988 -9.170 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.102 -1.614 -8.134 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.034 -1.817 -10.304 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.269 -1.126 -8.681 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.678 -0.168 -10.125 1.00 0.00 H new ATOM 1940 N PRO A 130 -0.797 3.789 -9.291 1.00 0.00 N ATOM 1941 CA PRO A 130 -1.287 4.965 -8.552 1.00 0.00 C ATOM 1942 C PRO A 130 -1.115 4.649 -7.063 1.00 0.00 C ATOM 1943 O PRO A 130 -1.310 3.519 -6.666 1.00 0.00 O ATOM 1944 CB PRO A 130 -2.761 5.039 -8.971 1.00 0.00 C ATOM 1945 CG PRO A 130 -3.048 3.887 -9.954 1.00 0.00 C ATOM 1946 CD PRO A 130 -1.741 3.128 -10.223 1.00 0.00 C ATOM 0 HA PRO A 130 -0.778 5.909 -8.747 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.408 4.961 -8.097 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.974 5.999 -9.440 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -3.797 3.213 -9.537 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -3.455 4.279 -10.886 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -1.839 2.062 -10.015 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -1.422 3.222 -11.261 1.00 0.00 H new ATOM 1954 N TYR A 131 -0.691 5.568 -6.238 1.00 0.00 N ATOM 1955 CA TYR A 131 -0.467 5.175 -4.812 1.00 0.00 C ATOM 1956 C TYR A 131 -0.866 6.266 -3.826 1.00 0.00 C ATOM 1957 O TYR A 131 -1.226 7.366 -4.194 1.00 0.00 O ATOM 1958 CB TYR A 131 1.023 4.887 -4.628 1.00 0.00 C ATOM 1959 CG TYR A 131 1.804 6.172 -4.789 1.00 0.00 C ATOM 1960 CD1 TYR A 131 1.944 6.750 -6.056 1.00 0.00 C ATOM 1961 CD2 TYR A 131 2.383 6.786 -3.673 1.00 0.00 C ATOM 1962 CE1 TYR A 131 2.663 7.941 -6.209 1.00 0.00 C ATOM 1963 CE2 TYR A 131 3.104 7.977 -3.824 1.00 0.00 C ATOM 1964 CZ TYR A 131 3.243 8.554 -5.092 1.00 0.00 C ATOM 1965 OH TYR A 131 3.954 9.727 -5.242 1.00 0.00 O ATOM 0 H TYR A 131 -0.495 6.541 -6.474 1.00 0.00 H new ATOM 0 HA TYR A 131 -1.088 4.303 -4.607 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.203 4.459 -3.642 1.00 0.00 H new ATOM 0 HB3 TYR A 131 1.356 4.151 -5.360 1.00 0.00 H new ATOM 0 HD1 TYR A 131 1.496 6.276 -6.917 1.00 0.00 H new ATOM 0 HD2 TYR A 131 2.274 6.341 -2.695 1.00 0.00 H new ATOM 0 HE1 TYR A 131 2.770 8.386 -7.187 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.552 8.450 -2.963 1.00 0.00 H new ATOM 0 HH TYR A 131 4.289 10.020 -4.369 1.00 0.00 H new ATOM 1975 N VAL A 132 -0.769 5.952 -2.554 1.00 0.00 N ATOM 1976 CA VAL A 132 -1.100 6.948 -1.497 1.00 0.00 C ATOM 1977 C VAL A 132 0.167 7.190 -0.676 1.00 0.00 C ATOM 1978 O VAL A 132 1.080 6.389 -0.696 1.00 0.00 O ATOM 1979 CB VAL A 132 -2.209 6.394 -0.596 1.00 0.00 C ATOM 1980 CG1 VAL A 132 -2.480 7.374 0.549 1.00 0.00 C ATOM 1981 CG2 VAL A 132 -3.487 6.209 -1.417 1.00 0.00 C ATOM 0 H VAL A 132 -0.472 5.040 -2.206 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.450 7.880 -1.941 1.00 0.00 H new ATOM 0 HB VAL A 132 -1.895 5.434 -0.185 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.269 6.978 1.188 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -1.571 7.509 1.136 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -2.793 8.334 0.139 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -4.277 5.815 -0.777 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -3.798 7.170 -1.827 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -3.298 5.510 -2.232 1.00 0.00 H new ATOM 1991 N CYS A 133 0.250 8.281 0.032 1.00 0.00 N ATOM 1992 CA CYS A 133 1.488 8.545 0.824 1.00 0.00 C ATOM 1993 C CYS A 133 1.137 9.202 2.162 1.00 0.00 C ATOM 1994 O CYS A 133 0.375 10.144 2.216 1.00 0.00 O ATOM 1995 CB CYS A 133 2.392 9.480 0.018 1.00 0.00 C ATOM 1996 SG CYS A 133 3.751 10.066 1.056 1.00 0.00 S ATOM 0 H CYS A 133 -0.475 8.995 0.098 1.00 0.00 H new ATOM 0 HA CYS A 133 1.998 7.603 1.024 1.00 0.00 H new ATOM 0 HB2 CYS A 133 2.787 8.957 -0.853 1.00 0.00 H new ATOM 0 HB3 CYS A 133 1.815 10.327 -0.354 1.00 0.00 H new ATOM 2001 N LYS A 134 1.704 8.719 3.244 1.00 0.00 N ATOM 2002 CA LYS A 134 1.411 9.323 4.580 1.00 0.00 C ATOM 2003 C LYS A 134 2.577 10.235 4.978 1.00 0.00 C ATOM 2004 O LYS A 134 3.685 10.067 4.512 1.00 0.00 O ATOM 2005 CB LYS A 134 1.241 8.204 5.619 1.00 0.00 C ATOM 2006 CG LYS A 134 2.586 7.883 6.283 1.00 0.00 C ATOM 2007 CD LYS A 134 2.492 6.545 7.020 1.00 0.00 C ATOM 2008 CE LYS A 134 3.592 6.466 8.081 1.00 0.00 C ATOM 2009 NZ LYS A 134 4.924 6.608 7.427 1.00 0.00 N ATOM 0 H LYS A 134 2.355 7.934 3.257 1.00 0.00 H new ATOM 0 HA LYS A 134 0.492 9.907 4.534 1.00 0.00 H new ATOM 0 HB2 LYS A 134 0.518 8.508 6.376 1.00 0.00 H new ATOM 0 HB3 LYS A 134 0.843 7.310 5.139 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.373 7.840 5.530 1.00 0.00 H new ATOM 0 HG3 LYS A 134 2.856 8.675 6.981 1.00 0.00 H new ATOM 0 HD2 LYS A 134 1.513 6.444 7.488 1.00 0.00 H new ATOM 0 HD3 LYS A 134 2.594 5.721 6.314 1.00 0.00 H new ATOM 0 HE2 LYS A 134 3.454 7.252 8.823 1.00 0.00 H new ATOM 0 HE3 LYS A 134 3.534 5.515 8.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 5.674 6.453 8.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 5.013 5.906 6.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 5.015 7.564 7.029 1.00 0.00 H new ATOM 2023 N PHE A 135 2.338 11.203 5.826 1.00 0.00 N ATOM 2024 CA PHE A 135 3.450 12.120 6.235 1.00 0.00 C ATOM 2025 C PHE A 135 2.938 13.142 7.255 1.00 0.00 C ATOM 2026 O PHE A 135 1.994 13.862 7.002 1.00 0.00 O ATOM 2027 CB PHE A 135 3.981 12.868 5.008 1.00 0.00 C ATOM 2028 CG PHE A 135 2.830 13.499 4.259 1.00 0.00 C ATOM 2029 CD1 PHE A 135 2.388 14.782 4.605 1.00 0.00 C ATOM 2030 CD2 PHE A 135 2.205 12.802 3.217 1.00 0.00 C ATOM 2031 CE1 PHE A 135 1.322 15.368 3.909 1.00 0.00 C ATOM 2032 CE2 PHE A 135 1.138 13.387 2.523 1.00 0.00 C ATOM 2033 CZ PHE A 135 0.697 14.669 2.870 1.00 0.00 C ATOM 0 H PHE A 135 1.431 11.399 6.250 1.00 0.00 H new ATOM 0 HA PHE A 135 4.248 11.526 6.681 1.00 0.00 H new ATOM 0 HB2 PHE A 135 4.691 13.635 5.317 1.00 0.00 H new ATOM 0 HB3 PHE A 135 4.519 12.180 4.355 1.00 0.00 H new ATOM 0 HD1 PHE A 135 2.869 15.320 5.409 1.00 0.00 H new ATOM 0 HD2 PHE A 135 2.546 11.813 2.949 1.00 0.00 H new ATOM 0 HE1 PHE A 135 0.983 16.358 4.174 1.00 0.00 H new ATOM 0 HE2 PHE A 135 0.656 12.849 1.720 1.00 0.00 H new ATOM 0 HZ PHE A 135 -0.126 15.119 2.336 1.00 0.00 H new ATOM 2043 N THR A 136 3.558 13.220 8.401 1.00 0.00 N ATOM 2044 CA THR A 136 3.107 14.205 9.427 1.00 0.00 C ATOM 2045 C THR A 136 3.869 15.519 9.235 1.00 0.00 C ATOM 2046 O THR A 136 4.737 15.625 8.392 1.00 0.00 O ATOM 2047 CB THR A 136 3.388 13.647 10.830 1.00 0.00 C ATOM 2048 OG1 THR A 136 3.196 12.241 10.823 1.00 0.00 O ATOM 2049 CG2 THR A 136 2.439 14.284 11.849 1.00 0.00 C ATOM 0 H THR A 136 4.356 12.645 8.672 1.00 0.00 H new ATOM 0 HA THR A 136 2.038 14.385 9.318 1.00 0.00 H new ATOM 0 HB THR A 136 4.416 13.879 11.107 1.00 0.00 H new ATOM 0 HG1 THR A 136 3.946 11.811 10.361 1.00 0.00 H new ATOM 0 HG21 THR A 136 2.646 13.882 12.841 1.00 0.00 H new ATOM 0 HG22 THR A 136 2.586 15.364 11.858 1.00 0.00 H new ATOM 0 HG23 THR A 136 1.408 14.060 11.575 1.00 0.00 H new ATOM 2057 N ASP A 137 3.549 16.521 10.007 1.00 0.00 N ATOM 2058 CA ASP A 137 4.256 17.825 9.865 1.00 0.00 C ATOM 2059 C ASP A 137 4.256 18.248 8.396 1.00 0.00 C ATOM 2060 O ASP A 137 4.947 19.200 8.072 1.00 0.00 O ATOM 2061 CB ASP A 137 5.698 17.679 10.354 1.00 0.00 C ATOM 2062 CG ASP A 137 5.710 17.552 11.880 1.00 0.00 C ATOM 2063 OD1 ASP A 137 5.781 18.576 12.539 1.00 0.00 O ATOM 2064 OD2 ASP A 137 5.648 16.433 12.361 1.00 0.00 O ATOM 2065 OXT ASP A 137 3.564 17.613 7.616 1.00 0.00 O ATOM 0 H ASP A 137 2.829 16.493 10.729 1.00 0.00 H new ATOM 0 HA ASP A 137 3.745 18.582 10.460 1.00 0.00 H new ATOM 0 HB2 ASP A 137 6.159 16.801 9.902 1.00 0.00 H new ATOM 0 HB3 ASP A 137 6.287 18.543 10.046 1.00 0.00 H new TER 2070 ASP A 137