USER MOD reduce.3.24.130724 H: found=0, std=0, add=1004, rem=0, adj=41 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 112 SER OG : rot 15:sc= 1.99! USER MOD Set 1.2: A 115 THR OG1 : rot -131:sc= 0.917 USER MOD Set 2.1: A 72 THR OG1 : rot 20:sc= -0.244! USER MOD Set 2.2: A 75 THR OG1 : rot -97:sc= 1.86 USER MOD Set 3.1: A 40 SER OG : rot 144:sc= 0.405 USER MOD Set 3.2: A 86 SER OG : rot -77:sc= 0.43 USER MOD Set 3.3: A 134 LYS NZ :NH3+ -150:sc= 0.436 (180deg=-0.249!) USER MOD Set 4.1: A 31 GLN : amide:sc= -0.253 K(o=-5.4,f=-3.3) USER MOD Set 4.2: A 37 ASN : amide:sc= -5.14! C(o=-5.4!,f=-3.3!) USER MOD Set 5.1: A 12 HIS : no HD1:sc= -5.16! C(o=-8.8!,f=-12!) USER MOD Set 5.2: A 136 THR OG1 : rot 59:sc= -3.6! USER MOD Single : A 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 SER OG : rot -69:sc= 0.446 USER MOD Single : A 7 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.107) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot -62:sc= 0.923 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= -0.398 USER MOD Single : A 21 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.171) USER MOD Single : A 22 SER OG : rot -72:sc= 1.24 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot -51:sc= 0.0167 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 142:sc= 0.789 USER MOD Single : A 52 SER OG : rot 3:sc= 0.908 USER MOD Single : A 55 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.0119) USER MOD Single : A 56 SER OG : rot 72:sc= 0.43 USER MOD Single : A 59 ASN : amide:sc= -2.13! K(o=-2.1!,f=-0.057) 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 180:sc= -0.454 USER MOD Single : A 63 TYR OH : rot 180:sc=-0.000962 USER MOD Single : A 69 HIS : no HD1:sc= -2.83 K(o=-2.8,f=-0.25) USER MOD Single : A 73 GLN : amide:sc= -0.939 K(o=-0.94,f=0) USER MOD Single : A 78 ASN : amide:sc= -3.09! K(o=-3.1!,f=-2) USER MOD Single : A 85 SER OG : rot 148:sc= 0.0292 USER MOD Single : A 87 SER OG : rot 174:sc= -4.43! USER MOD Single : A 90 MET CE :methyl -157:sc= -0.272 (180deg=-1.42!) USER MOD Single : A 91 ASN : amide:sc= -0.163 K(o=-0.16,f=-1.1) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0.164 K(o=0.16,f=-1.9) USER MOD Single : A 100 SER OG : rot -12:sc= 0.736 USER MOD Single : A 101 THR OG1 : rot -51:sc= 0.688 USER MOD Single : A 103 SER OG : rot 180:sc= -0.0153 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= -0.408 X(o=-0.41,f=-0.74) USER MOD Single : A 110 SER OG : rot -102:sc= -0.148! USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ -157:sc= -0.0387 (180deg=-0.292) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.858 K(o=-0.86,f=-1.8!) USER MOD Single : A 126 ASN : amide:sc= -0.857 K(o=-0.86,f=-0.17) USER MOD Single : A 131 TYR OH : rot 180:sc= -0.237 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 1 -5.466 21.425 9.288 1.00 0.00 N ATOM 2 CA ARG A 1 -4.804 22.072 8.120 1.00 0.00 C ATOM 3 C ARG A 1 -4.088 21.009 7.285 1.00 0.00 C ATOM 4 O ARG A 1 -3.002 20.573 7.612 1.00 0.00 O ATOM 5 CB ARG A 1 -3.787 23.105 8.616 1.00 0.00 C ATOM 6 CG ARG A 1 -2.964 23.625 7.436 1.00 0.00 C ATOM 7 CD ARG A 1 -2.215 24.893 7.849 1.00 0.00 C ATOM 8 NE ARG A 1 -1.066 25.118 6.924 1.00 0.00 N ATOM 9 CZ ARG A 1 -1.243 25.042 5.634 1.00 0.00 C ATOM 10 NH1 ARG A 1 -1.721 26.064 4.979 1.00 0.00 N ATOM 11 NH2 ARG A 1 -0.942 23.943 4.996 1.00 0.00 N ATOM 0 H1 ARG A 1 -5.953 22.148 9.856 1.00 0.00 H new ATOM 0 H2 ARG A 1 -6.158 20.725 8.951 1.00 0.00 H new ATOM 0 H3 ARG A 1 -4.750 20.950 9.873 1.00 0.00 H new ATOM 0 HA ARG A 1 -5.555 22.569 7.506 1.00 0.00 H new ATOM 0 HB2 ARG A 1 -4.303 23.932 9.105 1.00 0.00 H new ATOM 0 HB3 ARG A 1 -3.130 22.655 9.360 1.00 0.00 H new ATOM 0 HG2 ARG A 1 -2.256 22.863 7.110 1.00 0.00 H new ATOM 0 HG3 ARG A 1 -3.617 23.836 6.590 1.00 0.00 H new ATOM 0 HD2 ARG A 1 -2.888 25.750 7.824 1.00 0.00 H new ATOM 0 HD3 ARG A 1 -1.857 24.799 8.874 1.00 0.00 H new ATOM 0 HE ARG A 1 -0.142 25.331 7.300 1.00 0.00 H new ATOM 0 HH11 ARG A 1 -1.957 26.923 5.476 1.00 0.00 H new ATOM 0 HH12 ARG A 1 -1.859 26.004 3.970 1.00 0.00 H new ATOM 0 HH21 ARG A 1 -0.568 23.143 5.507 1.00 0.00 H new ATOM 0 HH22 ARG A 1 -1.081 23.885 3.987 1.00 0.00 H new ATOM 27 N CYS A 2 -4.690 20.592 6.205 1.00 0.00 N ATOM 28 CA CYS A 2 -4.051 19.564 5.342 1.00 0.00 C ATOM 29 C CYS A 2 -4.504 19.775 3.888 1.00 0.00 C ATOM 30 O CYS A 2 -5.514 20.402 3.638 1.00 0.00 O ATOM 31 CB CYS A 2 -4.469 18.165 5.822 1.00 0.00 C ATOM 32 SG CYS A 2 -3.039 17.304 6.525 1.00 0.00 S ATOM 0 H CYS A 2 -5.600 20.922 5.884 1.00 0.00 H new ATOM 0 HA CYS A 2 -2.966 19.653 5.400 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -5.258 18.248 6.569 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -4.877 17.592 4.989 1.00 0.00 H new ATOM 37 N PRO A 3 -3.768 19.251 2.939 1.00 0.00 N ATOM 38 CA PRO A 3 -4.136 19.403 1.505 1.00 0.00 C ATOM 39 C PRO A 3 -5.551 18.887 1.211 1.00 0.00 C ATOM 40 O PRO A 3 -6.128 18.149 1.985 1.00 0.00 O ATOM 41 CB PRO A 3 -3.079 18.553 0.788 1.00 0.00 C ATOM 42 CG PRO A 3 -2.141 17.939 1.840 1.00 0.00 C ATOM 43 CD PRO A 3 -2.529 18.480 3.223 1.00 0.00 C ATOM 0 HA PRO A 3 -4.151 20.445 1.185 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -3.559 17.767 0.205 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -2.512 19.167 0.089 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -2.217 16.852 1.825 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -1.105 18.189 1.614 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -2.708 17.676 3.936 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -1.747 19.112 3.644 1.00 0.00 H new ATOM 51 N LYS A 4 -6.110 19.273 0.100 1.00 0.00 N ATOM 52 CA LYS A 4 -7.475 18.816 -0.253 1.00 0.00 C ATOM 53 C LYS A 4 -7.399 17.393 -0.792 1.00 0.00 C ATOM 54 O LYS A 4 -6.412 16.993 -1.378 1.00 0.00 O ATOM 55 CB LYS A 4 -8.062 19.733 -1.325 1.00 0.00 C ATOM 56 CG LYS A 4 -8.138 21.165 -0.789 1.00 0.00 C ATOM 57 CD LYS A 4 -8.334 22.143 -1.954 1.00 0.00 C ATOM 58 CE LYS A 4 -7.041 22.259 -2.773 1.00 0.00 C ATOM 59 NZ LYS A 4 -6.970 23.614 -3.394 1.00 0.00 N ATOM 0 H LYS A 4 -5.673 19.892 -0.583 1.00 0.00 H new ATOM 0 HA LYS A 4 -8.110 18.844 0.632 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -7.444 19.702 -2.223 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -9.056 19.387 -1.610 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -8.963 21.256 -0.082 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -7.225 21.409 -0.246 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.148 21.800 -2.593 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.620 23.123 -1.571 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -6.175 22.094 -2.132 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -7.016 21.491 -3.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -6.095 23.696 -3.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -7.790 23.753 -4.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -6.975 24.339 -2.648 1.00 0.00 H new ATOM 73 N GLY A 5 -8.418 16.617 -0.582 1.00 0.00 N ATOM 74 CA GLY A 5 -8.388 15.215 -1.067 1.00 0.00 C ATOM 75 C GLY A 5 -7.490 14.428 -0.126 1.00 0.00 C ATOM 76 O GLY A 5 -7.420 13.215 -0.175 1.00 0.00 O ATOM 0 H GLY A 5 -9.271 16.892 -0.095 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -9.393 14.792 -1.082 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -8.008 15.170 -2.088 1.00 0.00 H new ATOM 80 N SER A 6 -6.803 15.122 0.741 1.00 0.00 N ATOM 81 CA SER A 6 -5.903 14.426 1.705 1.00 0.00 C ATOM 82 C SER A 6 -6.683 14.106 2.984 1.00 0.00 C ATOM 83 O SER A 6 -7.532 14.865 3.405 1.00 0.00 O ATOM 84 CB SER A 6 -4.716 15.330 2.046 1.00 0.00 C ATOM 85 OG SER A 6 -5.123 16.297 3.006 1.00 0.00 O ATOM 0 H SER A 6 -6.826 16.138 0.823 1.00 0.00 H new ATOM 0 HA SER A 6 -5.536 13.502 1.257 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.892 14.735 2.439 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.351 15.825 1.146 1.00 0.00 H new ATOM 0 HG SER A 6 -5.753 16.924 2.592 1.00 0.00 H new ATOM 91 N LYS A 7 -6.409 12.983 3.602 1.00 0.00 N ATOM 92 CA LYS A 7 -7.145 12.614 4.852 1.00 0.00 C ATOM 93 C LYS A 7 -6.141 12.223 5.938 1.00 0.00 C ATOM 94 O LYS A 7 -5.200 11.501 5.690 1.00 0.00 O ATOM 95 CB LYS A 7 -8.072 11.423 4.572 1.00 0.00 C ATOM 96 CG LYS A 7 -9.001 11.741 3.392 1.00 0.00 C ATOM 97 CD LYS A 7 -10.196 12.577 3.874 1.00 0.00 C ATOM 98 CE LYS A 7 -10.632 13.540 2.766 1.00 0.00 C ATOM 99 NZ LYS A 7 -11.091 12.761 1.581 1.00 0.00 N ATOM 0 H LYS A 7 -5.709 12.307 3.296 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.736 13.467 5.186 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.479 10.536 4.349 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -8.663 11.196 5.459 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -8.453 12.285 2.623 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -9.354 10.816 2.937 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -11.024 11.922 4.147 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -9.924 13.136 4.769 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -11.435 14.184 3.125 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -9.803 14.190 2.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.543 13.402 0.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -10.275 12.297 1.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.776 12.040 1.884 1.00 0.00 H new ATOM 113 N ALA A 8 -6.332 12.695 7.141 1.00 0.00 N ATOM 114 CA ALA A 8 -5.380 12.348 8.235 1.00 0.00 C ATOM 115 C ALA A 8 -5.798 11.035 8.897 1.00 0.00 C ATOM 116 O ALA A 8 -6.961 10.682 8.928 1.00 0.00 O ATOM 117 CB ALA A 8 -5.374 13.463 9.281 1.00 0.00 C ATOM 0 H ALA A 8 -7.104 13.304 7.413 1.00 0.00 H new ATOM 0 HA ALA A 8 -4.381 12.235 7.813 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -4.678 13.208 10.080 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -5.064 14.398 8.814 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.376 13.579 9.695 1.00 0.00 H new ATOM 123 N TYR A 9 -4.851 10.312 9.431 1.00 0.00 N ATOM 124 CA TYR A 9 -5.176 9.022 10.099 1.00 0.00 C ATOM 125 C TYR A 9 -3.997 8.608 10.982 1.00 0.00 C ATOM 126 O TYR A 9 -2.850 8.788 10.626 1.00 0.00 O ATOM 127 CB TYR A 9 -5.426 7.946 9.040 1.00 0.00 C ATOM 128 CG TYR A 9 -6.073 6.744 9.688 1.00 0.00 C ATOM 129 CD1 TYR A 9 -7.468 6.663 9.777 1.00 0.00 C ATOM 130 CD2 TYR A 9 -5.277 5.713 10.201 1.00 0.00 C ATOM 131 CE1 TYR A 9 -8.066 5.549 10.377 1.00 0.00 C ATOM 132 CE2 TYR A 9 -5.876 4.599 10.801 1.00 0.00 C ATOM 133 CZ TYR A 9 -7.272 4.518 10.890 1.00 0.00 C ATOM 134 OH TYR A 9 -7.863 3.420 11.480 1.00 0.00 O ATOM 0 H TYR A 9 -3.862 10.562 9.433 1.00 0.00 H new ATOM 0 HA TYR A 9 -6.071 9.138 10.710 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -6.069 8.338 8.252 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -4.486 7.657 8.570 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -8.082 7.459 9.383 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -4.201 5.777 10.134 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -9.142 5.485 10.444 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -5.262 3.802 11.195 1.00 0.00 H new ATOM 0 HH TYR A 9 -7.169 2.798 11.782 1.00 0.00 H new ATOM 144 N GLY A 10 -4.265 8.060 12.133 1.00 0.00 N ATOM 145 CA GLY A 10 -3.150 7.645 13.029 1.00 0.00 C ATOM 146 C GLY A 10 -2.366 8.882 13.471 1.00 0.00 C ATOM 147 O GLY A 10 -2.444 9.305 14.606 1.00 0.00 O ATOM 0 H GLY A 10 -5.203 7.882 12.492 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.544 7.121 13.899 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.491 6.950 12.509 1.00 0.00 H new ATOM 151 N SER A 11 -1.607 9.470 12.580 1.00 0.00 N ATOM 152 CA SER A 11 -0.822 10.679 12.956 1.00 0.00 C ATOM 153 C SER A 11 -0.062 11.211 11.735 1.00 0.00 C ATOM 154 O SER A 11 1.027 11.733 11.855 1.00 0.00 O ATOM 155 CB SER A 11 0.178 10.316 14.056 1.00 0.00 C ATOM 156 OG SER A 11 1.153 11.344 14.164 1.00 0.00 O ATOM 0 H SER A 11 -1.499 9.164 11.613 1.00 0.00 H new ATOM 0 HA SER A 11 -1.504 11.448 13.318 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.340 10.189 15.007 1.00 0.00 H new ATOM 0 HB3 SER A 11 0.659 9.365 13.826 1.00 0.00 H new ATOM 0 HG SER A 11 1.644 11.419 13.319 1.00 0.00 H new ATOM 162 N HIS A 12 -0.625 11.087 10.562 1.00 0.00 N ATOM 163 CA HIS A 12 0.067 11.586 9.346 1.00 0.00 C ATOM 164 C HIS A 12 -0.985 11.985 8.310 1.00 0.00 C ATOM 165 O HIS A 12 -2.067 11.437 8.272 1.00 0.00 O ATOM 166 CB HIS A 12 0.951 10.478 8.774 1.00 0.00 C ATOM 167 CG HIS A 12 1.913 10.002 9.828 1.00 0.00 C ATOM 168 ND1 HIS A 12 3.230 10.433 9.874 1.00 0.00 N ATOM 169 CD2 HIS A 12 1.767 9.131 10.878 1.00 0.00 C ATOM 170 CE1 HIS A 12 3.818 9.826 10.921 1.00 0.00 C ATOM 171 NE2 HIS A 12 2.971 9.022 11.568 1.00 0.00 N ATOM 0 H HIS A 12 -1.537 10.660 10.397 1.00 0.00 H new ATOM 0 HA HIS A 12 0.686 12.447 9.597 1.00 0.00 H new ATOM 0 HB2 HIS A 12 0.334 9.648 8.430 1.00 0.00 H new ATOM 0 HB3 HIS A 12 1.499 10.848 7.908 1.00 0.00 H new ATOM 0 HD2 HIS A 12 0.856 8.609 11.131 1.00 0.00 H new ATOM 0 HE1 HIS A 12 4.850 9.972 11.204 1.00 0.00 H new ATOM 0 HE2 HIS A 12 3.164 8.451 12.391 1.00 0.00 H new ATOM 179 N CYS A 13 -0.680 12.931 7.468 1.00 0.00 N ATOM 180 CA CYS A 13 -1.670 13.349 6.437 1.00 0.00 C ATOM 181 C CYS A 13 -1.531 12.431 5.223 1.00 0.00 C ATOM 182 O CYS A 13 -0.452 12.248 4.693 1.00 0.00 O ATOM 183 CB CYS A 13 -1.408 14.801 6.029 1.00 0.00 C ATOM 184 SG CYS A 13 -2.963 15.563 5.502 1.00 0.00 S ATOM 0 H CYS A 13 0.208 13.432 7.448 1.00 0.00 H new ATOM 0 HA CYS A 13 -2.681 13.276 6.839 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -0.983 15.355 6.866 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -0.679 14.838 5.220 1.00 0.00 H new ATOM 189 N TYR A 14 -2.610 11.836 4.788 1.00 0.00 N ATOM 190 CA TYR A 14 -2.534 10.913 3.619 1.00 0.00 C ATOM 191 C TYR A 14 -3.013 11.625 2.356 1.00 0.00 C ATOM 192 O TYR A 14 -3.927 12.422 2.393 1.00 0.00 O ATOM 193 CB TYR A 14 -3.413 9.687 3.882 1.00 0.00 C ATOM 194 CG TYR A 14 -2.853 8.906 5.049 1.00 0.00 C ATOM 195 CD1 TYR A 14 -2.907 9.442 6.341 1.00 0.00 C ATOM 196 CD2 TYR A 14 -2.276 7.647 4.840 1.00 0.00 C ATOM 197 CE1 TYR A 14 -2.387 8.720 7.421 1.00 0.00 C ATOM 198 CE2 TYR A 14 -1.756 6.926 5.922 1.00 0.00 C ATOM 199 CZ TYR A 14 -1.812 7.463 7.212 1.00 0.00 C ATOM 200 OH TYR A 14 -1.300 6.753 8.280 1.00 0.00 O ATOM 0 H TYR A 14 -3.540 11.949 5.192 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.500 10.599 3.477 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -4.435 9.999 4.096 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -3.451 9.057 2.994 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.350 10.413 6.504 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -2.232 7.232 3.844 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.430 9.134 8.417 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -1.312 5.955 5.760 1.00 0.00 H new ATOM 0 HH TYR A 14 -0.939 5.899 7.962 1.00 0.00 H new ATOM 210 N ALA A 15 -2.401 11.340 1.239 1.00 0.00 N ATOM 211 CA ALA A 15 -2.815 11.993 -0.036 1.00 0.00 C ATOM 212 C ALA A 15 -2.773 10.965 -1.168 1.00 0.00 C ATOM 213 O ALA A 15 -1.854 10.176 -1.272 1.00 0.00 O ATOM 214 CB ALA A 15 -1.854 13.141 -0.355 1.00 0.00 C ATOM 0 H ALA A 15 -1.628 10.680 1.154 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.828 12.384 0.065 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -2.155 13.619 -1.287 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.880 13.872 0.453 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.842 12.750 -0.459 1.00 0.00 H new ATOM 220 N LEU A 16 -3.765 10.965 -2.016 1.00 0.00 N ATOM 221 CA LEU A 16 -3.794 9.988 -3.143 1.00 0.00 C ATOM 222 C LEU A 16 -3.257 10.657 -4.411 1.00 0.00 C ATOM 223 O LEU A 16 -3.633 11.761 -4.749 1.00 0.00 O ATOM 224 CB LEU A 16 -5.243 9.532 -3.366 1.00 0.00 C ATOM 225 CG LEU A 16 -5.374 8.784 -4.699 1.00 0.00 C ATOM 226 CD1 LEU A 16 -4.435 7.576 -4.713 1.00 0.00 C ATOM 227 CD2 LEU A 16 -6.817 8.305 -4.868 1.00 0.00 C ATOM 0 H LEU A 16 -4.560 11.602 -1.977 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.171 9.125 -2.906 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.556 8.885 -2.547 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.907 10.396 -3.361 1.00 0.00 H new ATOM 0 HG LEU A 16 -5.108 9.455 -5.516 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.533 7.050 -5.662 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.406 7.914 -4.590 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.696 6.903 -3.896 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.915 7.773 -5.814 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.077 7.637 -4.047 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.488 9.164 -4.863 1.00 0.00 H new ATOM 239 N PHE A 17 -2.391 9.984 -5.124 1.00 0.00 N ATOM 240 CA PHE A 17 -1.834 10.550 -6.379 1.00 0.00 C ATOM 241 C PHE A 17 -2.109 9.555 -7.500 1.00 0.00 C ATOM 242 O PHE A 17 -1.632 8.436 -7.481 1.00 0.00 O ATOM 243 CB PHE A 17 -0.324 10.757 -6.226 1.00 0.00 C ATOM 244 CG PHE A 17 -0.064 12.034 -5.460 1.00 0.00 C ATOM 245 CD1 PHE A 17 -0.138 13.268 -6.116 1.00 0.00 C ATOM 246 CD2 PHE A 17 0.251 11.982 -4.097 1.00 0.00 C ATOM 247 CE1 PHE A 17 0.103 14.452 -5.407 1.00 0.00 C ATOM 248 CE2 PHE A 17 0.493 13.165 -3.390 1.00 0.00 C ATOM 249 CZ PHE A 17 0.418 14.400 -4.045 1.00 0.00 C ATOM 0 H PHE A 17 -2.045 9.055 -4.883 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.295 11.512 -6.603 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.118 9.910 -5.702 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.148 10.807 -7.207 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -0.381 13.307 -7.168 1.00 0.00 H new ATOM 0 HD2 PHE A 17 0.307 11.029 -3.591 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.046 15.405 -5.912 1.00 0.00 H new ATOM 0 HE2 PHE A 17 0.738 13.125 -2.339 1.00 0.00 H new ATOM 0 HZ PHE A 17 0.603 15.313 -3.499 1.00 0.00 H new ATOM 259 N LEU A 18 -2.874 9.948 -8.473 1.00 0.00 N ATOM 260 CA LEU A 18 -3.178 9.026 -9.593 1.00 0.00 C ATOM 261 C LEU A 18 -1.923 8.882 -10.433 1.00 0.00 C ATOM 262 O LEU A 18 -1.946 8.368 -11.534 1.00 0.00 O ATOM 263 CB LEU A 18 -4.315 9.602 -10.442 1.00 0.00 C ATOM 264 CG LEU A 18 -5.376 10.217 -9.527 1.00 0.00 C ATOM 265 CD1 LEU A 18 -6.605 10.597 -10.354 1.00 0.00 C ATOM 266 CD2 LEU A 18 -5.777 9.202 -8.452 1.00 0.00 C ATOM 0 H LEU A 18 -3.303 10.871 -8.541 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.490 8.053 -9.213 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.926 10.358 -11.125 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.759 8.817 -11.055 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.970 11.109 -9.050 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.361 11.035 -9.702 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.320 11.321 -11.117 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.011 9.706 -10.833 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.533 9.641 -7.801 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.182 8.309 -8.928 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.901 8.933 -7.861 1.00 0.00 H new ATOM 278 N SER A 19 -0.819 9.338 -9.912 1.00 0.00 N ATOM 279 CA SER A 19 0.453 9.233 -10.683 1.00 0.00 C ATOM 280 C SER A 19 1.145 7.901 -10.357 1.00 0.00 C ATOM 281 O SER A 19 1.440 7.618 -9.213 1.00 0.00 O ATOM 282 CB SER A 19 1.387 10.388 -10.322 1.00 0.00 C ATOM 283 OG SER A 19 0.720 11.277 -9.435 1.00 0.00 O ATOM 0 H SER A 19 -0.741 9.775 -8.994 1.00 0.00 H new ATOM 0 HA SER A 19 0.223 9.278 -11.748 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.294 10.004 -9.855 1.00 0.00 H new ATOM 0 HB3 SER A 19 1.693 10.918 -11.224 1.00 0.00 H new ATOM 0 HG SER A 19 1.319 12.017 -9.202 1.00 0.00 H new ATOM 289 N PRO A 20 1.409 7.085 -11.350 1.00 0.00 N ATOM 290 CA PRO A 20 2.084 5.777 -11.118 1.00 0.00 C ATOM 291 C PRO A 20 3.505 5.949 -10.560 1.00 0.00 C ATOM 292 O PRO A 20 4.185 6.907 -10.865 1.00 0.00 O ATOM 293 CB PRO A 20 2.131 5.171 -12.524 1.00 0.00 C ATOM 294 CG PRO A 20 1.504 6.160 -13.516 1.00 0.00 C ATOM 295 CD PRO A 20 1.050 7.404 -12.758 1.00 0.00 C ATOM 0 HA PRO A 20 1.564 5.162 -10.383 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.161 4.956 -12.807 1.00 0.00 H new ATOM 0 HB3 PRO A 20 1.591 4.224 -12.544 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.227 6.431 -14.285 1.00 0.00 H new ATOM 0 HG3 PRO A 20 0.657 5.698 -14.023 1.00 0.00 H new ATOM 0 HD2 PRO A 20 1.559 8.301 -13.111 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -0.020 7.579 -12.872 1.00 0.00 H new ATOM 303 N LYS A 21 3.964 5.022 -9.757 1.00 0.00 N ATOM 304 CA LYS A 21 5.346 5.143 -9.201 1.00 0.00 C ATOM 305 C LYS A 21 5.818 3.777 -8.690 1.00 0.00 C ATOM 306 O LYS A 21 5.151 3.139 -7.905 1.00 0.00 O ATOM 307 CB LYS A 21 5.347 6.146 -8.040 1.00 0.00 C ATOM 308 CG LYS A 21 5.417 7.583 -8.578 1.00 0.00 C ATOM 309 CD LYS A 21 5.971 8.509 -7.494 1.00 0.00 C ATOM 310 CE LYS A 21 6.049 9.939 -8.035 1.00 0.00 C ATOM 311 NZ LYS A 21 7.165 10.038 -9.018 1.00 0.00 N ATOM 0 H LYS A 21 3.446 4.193 -9.464 1.00 0.00 H new ATOM 0 HA LYS A 21 6.019 5.491 -9.985 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.446 6.019 -7.439 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.197 5.954 -7.385 1.00 0.00 H new ATOM 0 HG2 LYS A 21 6.053 7.621 -9.463 1.00 0.00 H new ATOM 0 HG3 LYS A 21 4.425 7.917 -8.884 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.332 8.477 -6.612 1.00 0.00 H new ATOM 0 HD3 LYS A 21 6.960 8.172 -7.183 1.00 0.00 H new ATOM 0 HE2 LYS A 21 5.107 10.211 -8.510 1.00 0.00 H new ATOM 0 HE3 LYS A 21 6.208 10.641 -7.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 7.374 11.039 -9.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 8.012 9.575 -8.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 6.890 9.569 -9.904 1.00 0.00 H new ATOM 325 N SER A 22 6.969 3.328 -9.115 1.00 0.00 N ATOM 326 CA SER A 22 7.479 2.008 -8.638 1.00 0.00 C ATOM 327 C SER A 22 7.329 1.932 -7.117 1.00 0.00 C ATOM 328 O SER A 22 7.421 2.927 -6.429 1.00 0.00 O ATOM 329 CB SER A 22 8.953 1.870 -9.013 1.00 0.00 C ATOM 330 OG SER A 22 9.094 2.020 -10.420 1.00 0.00 O ATOM 0 H SER A 22 7.578 3.817 -9.771 1.00 0.00 H new ATOM 0 HA SER A 22 6.910 1.203 -9.102 1.00 0.00 H new ATOM 0 HB2 SER A 22 9.545 2.624 -8.494 1.00 0.00 H new ATOM 0 HB3 SER A 22 9.331 0.897 -8.699 1.00 0.00 H new ATOM 0 HG SER A 22 8.732 1.229 -10.871 1.00 0.00 H new ATOM 336 N TRP A 23 7.107 0.762 -6.583 1.00 0.00 N ATOM 337 CA TRP A 23 6.963 0.647 -5.105 1.00 0.00 C ATOM 338 C TRP A 23 8.247 1.152 -4.459 1.00 0.00 C ATOM 339 O TRP A 23 8.272 1.547 -3.313 1.00 0.00 O ATOM 340 CB TRP A 23 6.736 -0.817 -4.720 1.00 0.00 C ATOM 341 CG TRP A 23 6.805 -0.960 -3.232 1.00 0.00 C ATOM 342 CD1 TRP A 23 5.735 -1.045 -2.409 1.00 0.00 C ATOM 343 CD2 TRP A 23 7.985 -1.037 -2.380 1.00 0.00 C ATOM 344 NE1 TRP A 23 6.181 -1.169 -1.106 1.00 0.00 N ATOM 345 CE2 TRP A 23 7.561 -1.168 -1.037 1.00 0.00 C ATOM 346 CE3 TRP A 23 9.367 -1.006 -2.639 1.00 0.00 C ATOM 347 CZ2 TRP A 23 8.476 -1.266 0.013 1.00 0.00 C ATOM 348 CZ3 TRP A 23 10.290 -1.103 -1.586 1.00 0.00 C ATOM 349 CH2 TRP A 23 9.846 -1.233 -0.262 1.00 0.00 C ATOM 0 H TRP A 23 7.020 -0.112 -7.101 1.00 0.00 H new ATOM 0 HA TRP A 23 6.112 1.236 -4.764 1.00 0.00 H new ATOM 0 HB2 TRP A 23 5.765 -1.153 -5.083 1.00 0.00 H new ATOM 0 HB3 TRP A 23 7.489 -1.449 -5.192 1.00 0.00 H new ATOM 0 HD1 TRP A 23 4.701 -1.020 -2.719 1.00 0.00 H new ATOM 0 HE1 TRP A 23 5.567 -1.251 -0.296 1.00 0.00 H new ATOM 0 HE3 TRP A 23 9.720 -0.907 -3.655 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 8.128 -1.367 1.030 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 11.349 -1.077 -1.797 1.00 0.00 H new ATOM 0 HH2 TRP A 23 10.561 -1.307 0.544 1.00 0.00 H new ATOM 360 N THR A 24 9.316 1.144 -5.201 1.00 0.00 N ATOM 361 CA THR A 24 10.617 1.621 -4.657 1.00 0.00 C ATOM 362 C THR A 24 10.767 3.110 -4.964 1.00 0.00 C ATOM 363 O THR A 24 11.556 3.811 -4.362 1.00 0.00 O ATOM 364 CB THR A 24 11.754 0.834 -5.314 1.00 0.00 C ATOM 365 OG1 THR A 24 12.952 1.029 -4.576 1.00 0.00 O ATOM 366 CG2 THR A 24 11.953 1.312 -6.753 1.00 0.00 C ATOM 0 H THR A 24 9.345 0.825 -6.169 1.00 0.00 H new ATOM 0 HA THR A 24 10.653 1.469 -3.578 1.00 0.00 H new ATOM 0 HB THR A 24 11.500 -0.226 -5.323 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.680 0.524 -4.995 1.00 0.00 H new ATOM 0 HG21 THR A 24 12.763 0.748 -7.215 1.00 0.00 H new ATOM 0 HG22 THR A 24 11.034 1.156 -7.318 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.203 2.373 -6.753 1.00 0.00 H new ATOM 374 N ASP A 25 10.007 3.589 -5.905 1.00 0.00 N ATOM 375 CA ASP A 25 10.080 5.028 -6.283 1.00 0.00 C ATOM 376 C ASP A 25 9.143 5.831 -5.393 1.00 0.00 C ATOM 377 O ASP A 25 9.486 6.894 -4.915 1.00 0.00 O ATOM 378 CB ASP A 25 9.662 5.195 -7.743 1.00 0.00 C ATOM 379 CG ASP A 25 9.565 6.684 -8.084 1.00 0.00 C ATOM 380 OD1 ASP A 25 10.219 7.468 -7.415 1.00 0.00 O ATOM 381 OD2 ASP A 25 8.837 7.015 -9.006 1.00 0.00 O ATOM 0 H ASP A 25 9.330 3.040 -6.435 1.00 0.00 H new ATOM 0 HA ASP A 25 11.102 5.386 -6.156 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.386 4.709 -8.397 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.701 4.709 -7.914 1.00 0.00 H new ATOM 386 N ALA A 26 7.965 5.329 -5.145 1.00 0.00 N ATOM 387 CA ALA A 26 7.035 6.067 -4.268 1.00 0.00 C ATOM 388 C ALA A 26 7.537 5.890 -2.847 1.00 0.00 C ATOM 389 O ALA A 26 7.394 6.751 -2.006 1.00 0.00 O ATOM 390 CB ALA A 26 5.630 5.495 -4.410 1.00 0.00 C ATOM 0 H ALA A 26 7.614 4.445 -5.513 1.00 0.00 H new ATOM 0 HA ALA A 26 6.994 7.123 -4.533 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.947 6.043 -3.761 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.301 5.590 -5.445 1.00 0.00 H new ATOM 0 HB3 ALA A 26 5.635 4.443 -4.126 1.00 0.00 H new ATOM 396 N ASP A 27 8.149 4.772 -2.583 1.00 0.00 N ATOM 397 CA ASP A 27 8.694 4.528 -1.231 1.00 0.00 C ATOM 398 C ASP A 27 9.755 5.587 -0.926 1.00 0.00 C ATOM 399 O ASP A 27 9.779 6.174 0.138 1.00 0.00 O ATOM 400 CB ASP A 27 9.333 3.142 -1.208 1.00 0.00 C ATOM 401 CG ASP A 27 10.106 2.948 0.097 1.00 0.00 C ATOM 402 OD1 ASP A 27 9.873 3.712 1.020 1.00 0.00 O ATOM 403 OD2 ASP A 27 10.919 2.039 0.153 1.00 0.00 O ATOM 0 H ASP A 27 8.294 4.016 -3.252 1.00 0.00 H new ATOM 0 HA ASP A 27 7.902 4.582 -0.485 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.564 2.376 -1.303 1.00 0.00 H new ATOM 0 HB3 ASP A 27 10.004 3.027 -2.059 1.00 0.00 H new ATOM 408 N LEU A 28 10.630 5.837 -1.861 1.00 0.00 N ATOM 409 CA LEU A 28 11.696 6.856 -1.638 1.00 0.00 C ATOM 410 C LEU A 28 11.091 8.263 -1.699 1.00 0.00 C ATOM 411 O LEU A 28 11.488 9.151 -0.971 1.00 0.00 O ATOM 412 CB LEU A 28 12.774 6.709 -2.723 1.00 0.00 C ATOM 413 CG LEU A 28 13.961 5.906 -2.180 1.00 0.00 C ATOM 414 CD1 LEU A 28 13.520 4.471 -1.883 1.00 0.00 C ATOM 415 CD2 LEU A 28 15.080 5.884 -3.225 1.00 0.00 C ATOM 0 H LEU A 28 10.653 5.379 -2.772 1.00 0.00 H new ATOM 0 HA LEU A 28 12.143 6.703 -0.656 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.356 6.209 -3.597 1.00 0.00 H new ATOM 0 HB3 LEU A 28 13.110 7.693 -3.049 1.00 0.00 H new ATOM 0 HG LEU A 28 14.322 6.372 -1.263 1.00 0.00 H new ATOM 0 HD11 LEU A 28 14.366 3.903 -1.497 1.00 0.00 H new ATOM 0 HD12 LEU A 28 12.722 4.482 -1.141 1.00 0.00 H new ATOM 0 HD13 LEU A 28 13.157 4.005 -2.799 1.00 0.00 H new ATOM 0 HD21 LEU A 28 15.925 5.313 -2.841 1.00 0.00 H new ATOM 0 HD22 LEU A 28 14.714 5.419 -4.140 1.00 0.00 H new ATOM 0 HD23 LEU A 28 15.398 6.904 -3.439 1.00 0.00 H new ATOM 427 N ALA A 29 10.142 8.478 -2.568 1.00 0.00 N ATOM 428 CA ALA A 29 9.529 9.833 -2.676 1.00 0.00 C ATOM 429 C ALA A 29 8.677 10.122 -1.441 1.00 0.00 C ATOM 430 O ALA A 29 8.900 11.086 -0.740 1.00 0.00 O ATOM 431 CB ALA A 29 8.646 9.897 -3.915 1.00 0.00 C ATOM 0 H ALA A 29 9.765 7.777 -3.206 1.00 0.00 H new ATOM 0 HA ALA A 29 10.324 10.575 -2.749 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.199 10.888 -3.992 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.249 9.701 -4.802 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.858 9.148 -3.839 1.00 0.00 H new ATOM 437 N CYS A 30 7.700 9.303 -1.165 1.00 0.00 N ATOM 438 CA CYS A 30 6.855 9.551 0.029 1.00 0.00 C ATOM 439 C CYS A 30 7.755 9.543 1.263 1.00 0.00 C ATOM 440 O CYS A 30 7.389 10.021 2.317 1.00 0.00 O ATOM 441 CB CYS A 30 5.792 8.456 0.140 1.00 0.00 C ATOM 442 SG CYS A 30 4.726 8.785 1.567 1.00 0.00 S ATOM 0 H CYS A 30 7.454 8.479 -1.713 1.00 0.00 H new ATOM 0 HA CYS A 30 6.352 10.514 -0.053 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.195 8.421 -0.772 1.00 0.00 H new ATOM 0 HB3 CYS A 30 6.269 7.482 0.247 1.00 0.00 H new ATOM 447 N GLN A 31 8.942 9.014 1.132 1.00 0.00 N ATOM 448 CA GLN A 31 9.874 8.991 2.289 1.00 0.00 C ATOM 449 C GLN A 31 10.522 10.368 2.429 1.00 0.00 C ATOM 450 O GLN A 31 10.852 10.801 3.516 1.00 0.00 O ATOM 451 CB GLN A 31 10.958 7.932 2.064 1.00 0.00 C ATOM 452 CG GLN A 31 12.073 8.105 3.100 1.00 0.00 C ATOM 453 CD GLN A 31 12.948 6.851 3.121 1.00 0.00 C ATOM 454 OE1 GLN A 31 14.105 6.897 2.753 1.00 0.00 O ATOM 455 NE2 GLN A 31 12.441 5.724 3.541 1.00 0.00 N ATOM 0 H GLN A 31 9.303 8.598 0.274 1.00 0.00 H new ATOM 0 HA GLN A 31 9.324 8.746 3.198 1.00 0.00 H new ATOM 0 HB2 GLN A 31 10.527 6.934 2.143 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.366 8.024 1.058 1.00 0.00 H new ATOM 0 HG2 GLN A 31 12.677 8.979 2.857 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.644 8.278 4.087 1.00 0.00 H new ATOM 0 HE21 GLN A 31 11.470 5.685 3.850 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.016 4.882 3.560 1.00 0.00 H new ATOM 464 N LYS A 32 10.705 11.060 1.339 1.00 0.00 N ATOM 465 CA LYS A 32 11.327 12.406 1.415 1.00 0.00 C ATOM 466 C LYS A 32 10.390 13.347 2.177 1.00 0.00 C ATOM 467 O LYS A 32 10.665 14.518 2.346 1.00 0.00 O ATOM 468 CB LYS A 32 11.581 12.938 -0.004 1.00 0.00 C ATOM 469 CG LYS A 32 10.377 13.750 -0.495 1.00 0.00 C ATOM 470 CD LYS A 32 10.448 13.899 -2.016 1.00 0.00 C ATOM 471 CE LYS A 32 9.319 14.815 -2.495 1.00 0.00 C ATOM 472 NZ LYS A 32 9.586 15.239 -3.899 1.00 0.00 N ATOM 0 H LYS A 32 10.450 10.750 0.401 1.00 0.00 H new ATOM 0 HA LYS A 32 12.280 12.346 1.940 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.475 13.562 -0.011 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.768 12.106 -0.683 1.00 0.00 H new ATOM 0 HG2 LYS A 32 9.449 13.253 -0.211 1.00 0.00 H new ATOM 0 HG3 LYS A 32 10.370 14.732 -0.023 1.00 0.00 H new ATOM 0 HD2 LYS A 32 11.414 14.313 -2.306 1.00 0.00 H new ATOM 0 HD3 LYS A 32 10.364 12.922 -2.492 1.00 0.00 H new ATOM 0 HE2 LYS A 32 8.364 14.294 -2.437 1.00 0.00 H new ATOM 0 HE3 LYS A 32 9.245 15.689 -1.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 8.819 15.861 -4.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 10.490 15.752 -3.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 9.635 14.400 -4.512 1.00 0.00 H new ATOM 486 N ARG A 33 9.276 12.837 2.631 1.00 0.00 N ATOM 487 CA ARG A 33 8.303 13.687 3.376 1.00 0.00 C ATOM 488 C ARG A 33 8.534 13.531 4.881 1.00 0.00 C ATOM 489 O ARG A 33 9.129 12.568 5.320 1.00 0.00 O ATOM 490 CB ARG A 33 6.880 13.243 3.009 1.00 0.00 C ATOM 491 CG ARG A 33 6.368 14.080 1.832 1.00 0.00 C ATOM 492 CD ARG A 33 5.129 13.414 1.228 1.00 0.00 C ATOM 493 NE ARG A 33 4.725 14.141 -0.008 1.00 0.00 N ATOM 494 CZ ARG A 33 4.694 15.446 -0.019 1.00 0.00 C ATOM 495 NH1 ARG A 33 3.988 16.089 0.872 1.00 0.00 N ATOM 496 NH2 ARG A 33 5.367 16.107 -0.920 1.00 0.00 N ATOM 0 H ARG A 33 8.997 11.863 2.517 1.00 0.00 H new ATOM 0 HA ARG A 33 8.438 14.735 3.109 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.875 12.185 2.746 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.219 13.361 3.867 1.00 0.00 H new ATOM 0 HG2 ARG A 33 6.124 15.088 2.168 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.147 14.176 1.075 1.00 0.00 H new ATOM 0 HD2 ARG A 33 5.341 12.370 0.996 1.00 0.00 H new ATOM 0 HD3 ARG A 33 4.312 13.420 1.949 1.00 0.00 H new ATOM 0 HE ARG A 33 4.472 13.618 -0.847 1.00 0.00 H new ATOM 0 HH11 ARG A 33 3.461 15.571 1.576 1.00 0.00 H new ATOM 0 HH12 ARG A 33 3.963 17.109 0.864 1.00 0.00 H new ATOM 0 HH21 ARG A 33 5.918 15.604 -1.616 1.00 0.00 H new ATOM 0 HH22 ARG A 33 5.343 17.127 -0.928 1.00 0.00 H new ATOM 510 N PRO A 34 8.062 14.468 5.673 1.00 0.00 N ATOM 511 CA PRO A 34 8.239 14.388 7.144 1.00 0.00 C ATOM 512 C PRO A 34 7.906 12.994 7.672 1.00 0.00 C ATOM 513 O PRO A 34 6.797 12.715 8.084 1.00 0.00 O ATOM 514 CB PRO A 34 7.254 15.454 7.653 1.00 0.00 C ATOM 515 CG PRO A 34 6.579 16.112 6.438 1.00 0.00 C ATOM 516 CD PRO A 34 7.318 15.656 5.175 1.00 0.00 C ATOM 0 HA PRO A 34 9.263 14.562 7.474 1.00 0.00 H new ATOM 0 HB2 PRO A 34 6.506 15.000 8.302 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.779 16.203 8.247 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.528 15.828 6.387 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.612 17.198 6.527 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.631 15.400 4.369 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.987 16.427 4.791 1.00 0.00 H new ATOM 524 N SER A 35 8.862 12.111 7.639 1.00 0.00 N ATOM 525 CA SER A 35 8.616 10.726 8.109 1.00 0.00 C ATOM 526 C SER A 35 7.548 10.089 7.225 1.00 0.00 C ATOM 527 O SER A 35 6.963 9.082 7.569 1.00 0.00 O ATOM 528 CB SER A 35 8.145 10.749 9.566 1.00 0.00 C ATOM 529 OG SER A 35 8.417 9.489 10.166 1.00 0.00 O ATOM 0 H SER A 35 9.808 12.292 7.304 1.00 0.00 H new ATOM 0 HA SER A 35 9.536 10.145 8.049 1.00 0.00 H new ATOM 0 HB2 SER A 35 8.654 11.543 10.113 1.00 0.00 H new ATOM 0 HB3 SER A 35 7.077 10.964 9.612 1.00 0.00 H new ATOM 0 HG SER A 35 8.067 8.773 9.596 1.00 0.00 H new ATOM 535 N GLY A 36 7.289 10.674 6.087 1.00 0.00 N ATOM 536 CA GLY A 36 6.256 10.099 5.185 1.00 0.00 C ATOM 537 C GLY A 36 6.748 8.771 4.603 1.00 0.00 C ATOM 538 O GLY A 36 7.848 8.332 4.867 1.00 0.00 O ATOM 0 H GLY A 36 7.746 11.520 5.746 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.328 9.943 5.735 1.00 0.00 H new ATOM 0 HA3 GLY A 36 6.035 10.799 4.379 1.00 0.00 H new ATOM 542 N ASN A 37 5.927 8.131 3.816 1.00 0.00 N ATOM 543 CA ASN A 37 6.308 6.824 3.199 1.00 0.00 C ATOM 544 C ASN A 37 5.035 6.142 2.695 1.00 0.00 C ATOM 545 O ASN A 37 3.987 6.268 3.300 1.00 0.00 O ATOM 546 CB ASN A 37 6.985 5.928 4.253 1.00 0.00 C ATOM 547 CG ASN A 37 8.500 5.924 4.038 1.00 0.00 C ATOM 548 OD1 ASN A 37 9.242 6.464 4.835 1.00 0.00 O ATOM 549 ND2 ASN A 37 8.996 5.329 2.988 1.00 0.00 N ATOM 0 H ASN A 37 4.994 8.462 3.570 1.00 0.00 H new ATOM 0 HA ASN A 37 7.003 6.988 2.375 1.00 0.00 H new ATOM 0 HB2 ASN A 37 6.752 6.290 5.254 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.596 4.912 4.183 1.00 0.00 H new ATOM 0 HD21 ASN A 37 10.005 5.318 2.837 1.00 0.00 H new ATOM 0 HD22 ASN A 37 8.375 4.875 2.318 1.00 0.00 H new ATOM 556 N LEU A 38 5.107 5.428 1.593 1.00 0.00 N ATOM 557 CA LEU A 38 3.895 4.738 1.059 1.00 0.00 C ATOM 558 C LEU A 38 2.885 4.491 2.191 1.00 0.00 C ATOM 559 O LEU A 38 3.241 4.070 3.274 1.00 0.00 O ATOM 560 CB LEU A 38 4.319 3.403 0.449 1.00 0.00 C ATOM 561 CG LEU A 38 5.014 3.642 -0.892 1.00 0.00 C ATOM 562 CD1 LEU A 38 5.787 2.388 -1.305 1.00 0.00 C ATOM 563 CD2 LEU A 38 3.971 3.965 -1.960 1.00 0.00 C ATOM 0 H LEU A 38 5.956 5.296 1.043 1.00 0.00 H new ATOM 0 HA LEU A 38 3.423 5.363 0.301 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.991 2.880 1.129 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.447 2.764 0.308 1.00 0.00 H new ATOM 0 HG LEU A 38 5.706 4.478 -0.791 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.280 2.563 -2.261 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.536 2.156 -0.547 1.00 0.00 H new ATOM 0 HD13 LEU A 38 5.096 1.550 -1.401 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.469 4.135 -2.915 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.278 3.129 -2.056 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.422 4.861 -1.673 1.00 0.00 H new ATOM 575 N VAL A 39 1.635 4.772 1.942 1.00 0.00 N ATOM 576 CA VAL A 39 0.580 4.587 2.988 1.00 0.00 C ATOM 577 C VAL A 39 0.861 3.353 3.853 1.00 0.00 C ATOM 578 O VAL A 39 1.437 2.380 3.409 1.00 0.00 O ATOM 579 CB VAL A 39 -0.777 4.435 2.298 1.00 0.00 C ATOM 580 CG1 VAL A 39 -0.633 3.514 1.085 1.00 0.00 C ATOM 581 CG2 VAL A 39 -1.797 3.836 3.273 1.00 0.00 C ATOM 0 H VAL A 39 1.293 5.126 1.049 1.00 0.00 H new ATOM 0 HA VAL A 39 0.579 5.459 3.642 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.124 5.417 1.975 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.600 3.406 0.594 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.084 3.943 0.385 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.280 2.536 1.411 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.760 3.731 2.773 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.452 2.857 3.604 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -1.905 4.493 4.136 1.00 0.00 H new ATOM 591 N SER A 40 0.438 3.399 5.092 1.00 0.00 N ATOM 592 CA SER A 40 0.649 2.247 6.023 1.00 0.00 C ATOM 593 C SER A 40 -0.699 1.566 6.302 1.00 0.00 C ATOM 594 O SER A 40 -1.744 2.087 5.963 1.00 0.00 O ATOM 595 CB SER A 40 1.240 2.767 7.335 1.00 0.00 C ATOM 596 OG SER A 40 0.658 4.028 7.643 1.00 0.00 O ATOM 0 H SER A 40 -0.050 4.195 5.503 1.00 0.00 H new ATOM 0 HA SER A 40 1.332 1.527 5.573 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.048 2.058 8.140 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.322 2.864 7.247 1.00 0.00 H new ATOM 0 HG SER A 40 0.540 4.106 8.613 1.00 0.00 H new ATOM 602 N VAL A 41 -0.689 0.406 6.914 1.00 0.00 N ATOM 603 CA VAL A 41 -1.979 -0.297 7.202 1.00 0.00 C ATOM 604 C VAL A 41 -1.802 -1.235 8.410 1.00 0.00 C ATOM 605 O VAL A 41 -1.416 -2.377 8.264 1.00 0.00 O ATOM 606 CB VAL A 41 -2.408 -1.126 5.969 1.00 0.00 C ATOM 607 CG1 VAL A 41 -3.922 -1.022 5.774 1.00 0.00 C ATOM 608 CG2 VAL A 41 -1.710 -0.606 4.705 1.00 0.00 C ATOM 0 H VAL A 41 0.151 -0.082 7.225 1.00 0.00 H new ATOM 0 HA VAL A 41 -2.746 0.444 7.427 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.125 -2.165 6.138 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.218 -1.608 4.904 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.430 -1.405 6.659 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.198 0.021 5.620 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.023 -1.200 3.846 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.981 0.437 4.543 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -0.630 -0.685 4.827 1.00 0.00 H new ATOM 618 N LEU A 42 -2.077 -0.762 9.604 1.00 0.00 N ATOM 619 CA LEU A 42 -1.916 -1.630 10.816 1.00 0.00 C ATOM 620 C LEU A 42 -3.267 -1.902 11.486 1.00 0.00 C ATOM 621 O LEU A 42 -3.314 -2.364 12.609 1.00 0.00 O ATOM 622 CB LEU A 42 -1.011 -0.934 11.834 1.00 0.00 C ATOM 623 CG LEU A 42 0.444 -1.021 11.382 1.00 0.00 C ATOM 624 CD1 LEU A 42 1.331 -0.271 12.393 1.00 0.00 C ATOM 625 CD2 LEU A 42 0.878 -2.497 11.292 1.00 0.00 C ATOM 0 H LEU A 42 -2.405 0.185 9.791 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.478 -2.574 10.491 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.306 0.110 11.941 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.125 -1.400 12.813 1.00 0.00 H new ATOM 0 HG LEU A 42 0.549 -0.566 10.397 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.372 -0.329 12.076 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.024 0.774 12.441 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.225 -0.726 13.378 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.918 -2.552 10.969 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.777 -2.966 12.271 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.247 -3.019 10.573 1.00 0.00 H new ATOM 637 N SER A 43 -4.366 -1.614 10.842 1.00 0.00 N ATOM 638 CA SER A 43 -5.681 -1.868 11.503 1.00 0.00 C ATOM 639 C SER A 43 -6.734 -2.264 10.470 1.00 0.00 C ATOM 640 O SER A 43 -6.711 -1.822 9.338 1.00 0.00 O ATOM 641 CB SER A 43 -6.135 -0.600 12.226 1.00 0.00 C ATOM 642 OG SER A 43 -7.268 -0.897 13.031 1.00 0.00 O ATOM 0 H SER A 43 -4.413 -1.220 9.902 1.00 0.00 H new ATOM 0 HA SER A 43 -5.564 -2.685 12.215 1.00 0.00 H new ATOM 0 HB2 SER A 43 -5.326 -0.212 12.845 1.00 0.00 H new ATOM 0 HB3 SER A 43 -6.383 0.176 11.502 1.00 0.00 H new ATOM 0 HG SER A 43 -7.560 -0.086 13.497 1.00 0.00 H new ATOM 648 N GLY A 44 -7.670 -3.091 10.861 1.00 0.00 N ATOM 649 CA GLY A 44 -8.739 -3.510 9.914 1.00 0.00 C ATOM 650 C GLY A 44 -9.558 -2.284 9.524 1.00 0.00 C ATOM 651 O GLY A 44 -10.207 -2.258 8.498 1.00 0.00 O ATOM 0 H GLY A 44 -7.737 -3.493 11.796 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.300 -3.968 9.028 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.380 -4.261 10.376 1.00 0.00 H new ATOM 655 N ALA A 45 -9.523 -1.262 10.334 1.00 0.00 N ATOM 656 CA ALA A 45 -10.285 -0.027 10.009 1.00 0.00 C ATOM 657 C ALA A 45 -9.468 0.803 9.020 1.00 0.00 C ATOM 658 O ALA A 45 -10.002 1.425 8.123 1.00 0.00 O ATOM 659 CB ALA A 45 -10.518 0.783 11.286 1.00 0.00 C ATOM 0 H ALA A 45 -8.998 -1.230 11.208 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.249 -0.288 9.572 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -11.077 1.688 11.046 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.086 0.184 11.998 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.558 1.055 11.725 1.00 0.00 H new ATOM 665 N GLU A 46 -8.171 0.801 9.168 1.00 0.00 N ATOM 666 CA GLU A 46 -7.315 1.573 8.231 1.00 0.00 C ATOM 667 C GLU A 46 -7.344 0.888 6.866 1.00 0.00 C ATOM 668 O GLU A 46 -7.456 1.527 5.841 1.00 0.00 O ATOM 669 CB GLU A 46 -5.878 1.608 8.757 1.00 0.00 C ATOM 670 CG GLU A 46 -5.045 2.569 7.907 1.00 0.00 C ATOM 671 CD GLU A 46 -3.693 2.807 8.581 1.00 0.00 C ATOM 672 OE1 GLU A 46 -3.309 1.987 9.398 1.00 0.00 O ATOM 673 OE2 GLU A 46 -3.063 3.805 8.268 1.00 0.00 O ATOM 0 H GLU A 46 -7.669 0.297 9.899 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.686 2.594 8.144 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.869 1.927 9.799 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.444 0.609 8.726 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.898 2.155 6.910 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.574 3.514 7.785 1.00 0.00 H new ATOM 680 N GLY A 47 -7.257 -0.415 6.844 1.00 0.00 N ATOM 681 CA GLY A 47 -7.292 -1.139 5.543 1.00 0.00 C ATOM 682 C GLY A 47 -8.564 -0.744 4.793 1.00 0.00 C ATOM 683 O GLY A 47 -8.598 -0.711 3.579 1.00 0.00 O ATOM 0 H GLY A 47 -7.163 -1.007 7.669 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.412 -0.891 4.950 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.271 -2.216 5.710 1.00 0.00 H new ATOM 687 N SER A 48 -9.608 -0.432 5.512 1.00 0.00 N ATOM 688 CA SER A 48 -10.877 -0.025 4.852 1.00 0.00 C ATOM 689 C SER A 48 -10.823 1.474 4.565 1.00 0.00 C ATOM 690 O SER A 48 -11.322 1.948 3.565 1.00 0.00 O ATOM 691 CB SER A 48 -12.057 -0.327 5.777 1.00 0.00 C ATOM 692 OG SER A 48 -13.271 -0.202 5.046 1.00 0.00 O ATOM 0 H SER A 48 -9.635 -0.442 6.532 1.00 0.00 H new ATOM 0 HA SER A 48 -11.004 -0.577 3.921 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.966 -1.334 6.184 1.00 0.00 H new ATOM 0 HB3 SER A 48 -12.056 0.360 6.623 1.00 0.00 H new ATOM 0 HG SER A 48 -14.029 -0.396 5.636 1.00 0.00 H new ATOM 698 N PHE A 49 -10.206 2.225 5.438 1.00 0.00 N ATOM 699 CA PHE A 49 -10.104 3.693 5.220 1.00 0.00 C ATOM 700 C PHE A 49 -9.285 3.951 3.954 1.00 0.00 C ATOM 701 O PHE A 49 -9.658 4.742 3.111 1.00 0.00 O ATOM 702 CB PHE A 49 -9.412 4.341 6.421 1.00 0.00 C ATOM 703 CG PHE A 49 -9.637 5.834 6.390 1.00 0.00 C ATOM 704 CD1 PHE A 49 -10.886 6.361 6.734 1.00 0.00 C ATOM 705 CD2 PHE A 49 -8.594 6.692 6.018 1.00 0.00 C ATOM 706 CE1 PHE A 49 -11.096 7.745 6.705 1.00 0.00 C ATOM 707 CE2 PHE A 49 -8.803 8.075 5.989 1.00 0.00 C ATOM 708 CZ PHE A 49 -10.053 8.602 6.333 1.00 0.00 C ATOM 0 H PHE A 49 -9.768 1.882 6.293 1.00 0.00 H new ATOM 0 HA PHE A 49 -11.100 4.121 5.107 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -9.804 3.923 7.348 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.344 4.123 6.399 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -11.690 5.700 7.022 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -7.629 6.286 5.754 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -12.061 8.151 6.969 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -7.999 8.736 5.701 1.00 0.00 H new ATOM 0 HZ PHE A 49 -10.213 9.670 6.312 1.00 0.00 H new ATOM 718 N VAL A 50 -8.173 3.281 3.812 1.00 0.00 N ATOM 719 CA VAL A 50 -7.338 3.480 2.595 1.00 0.00 C ATOM 720 C VAL A 50 -8.127 3.015 1.372 1.00 0.00 C ATOM 721 O VAL A 50 -8.111 3.646 0.334 1.00 0.00 O ATOM 722 CB VAL A 50 -6.048 2.665 2.711 1.00 0.00 C ATOM 723 CG1 VAL A 50 -5.149 2.964 1.510 1.00 0.00 C ATOM 724 CG2 VAL A 50 -5.316 3.048 3.999 1.00 0.00 C ATOM 0 H VAL A 50 -7.808 2.607 4.485 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.084 4.535 2.494 1.00 0.00 H new ATOM 0 HB VAL A 50 -6.290 1.602 2.732 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.229 2.384 1.591 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.669 2.694 0.591 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -4.908 4.027 1.492 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.397 2.467 4.082 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.073 4.110 3.977 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.955 2.839 4.857 1.00 0.00 H new ATOM 734 N SER A 51 -8.822 1.916 1.487 1.00 0.00 N ATOM 735 CA SER A 51 -9.618 1.410 0.336 1.00 0.00 C ATOM 736 C SER A 51 -10.637 2.471 -0.082 1.00 0.00 C ATOM 737 O SER A 51 -10.868 2.694 -1.253 1.00 0.00 O ATOM 738 CB SER A 51 -10.353 0.133 0.743 1.00 0.00 C ATOM 739 OG SER A 51 -11.429 -0.097 -0.157 1.00 0.00 O ATOM 0 H SER A 51 -8.872 1.346 2.332 1.00 0.00 H new ATOM 0 HA SER A 51 -8.951 1.194 -0.499 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.667 -0.714 0.732 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.729 0.225 1.762 1.00 0.00 H new ATOM 0 HG SER A 51 -11.509 -1.058 -0.333 1.00 0.00 H new ATOM 745 N SER A 52 -11.249 3.126 0.866 1.00 0.00 N ATOM 746 CA SER A 52 -12.253 4.173 0.522 1.00 0.00 C ATOM 747 C SER A 52 -11.537 5.410 -0.023 1.00 0.00 C ATOM 748 O SER A 52 -12.110 6.205 -0.741 1.00 0.00 O ATOM 749 CB SER A 52 -13.042 4.552 1.776 1.00 0.00 C ATOM 750 OG SER A 52 -12.134 4.894 2.816 1.00 0.00 O ATOM 0 H SER A 52 -11.097 2.982 1.864 1.00 0.00 H new ATOM 0 HA SER A 52 -12.935 3.787 -0.235 1.00 0.00 H new ATOM 0 HB2 SER A 52 -13.703 5.392 1.564 1.00 0.00 H new ATOM 0 HB3 SER A 52 -13.674 3.720 2.088 1.00 0.00 H new ATOM 0 HG SER A 52 -11.216 4.854 2.475 1.00 0.00 H new ATOM 756 N LEU A 53 -10.289 5.580 0.315 1.00 0.00 N ATOM 757 CA LEU A 53 -9.532 6.762 -0.179 1.00 0.00 C ATOM 758 C LEU A 53 -9.095 6.511 -1.624 1.00 0.00 C ATOM 759 O LEU A 53 -8.851 7.432 -2.378 1.00 0.00 O ATOM 760 CB LEU A 53 -8.301 6.971 0.720 1.00 0.00 C ATOM 761 CG LEU A 53 -7.208 7.761 -0.015 1.00 0.00 C ATOM 762 CD1 LEU A 53 -7.690 9.189 -0.280 1.00 0.00 C ATOM 763 CD2 LEU A 53 -5.952 7.812 0.859 1.00 0.00 C ATOM 0 H LEU A 53 -9.759 4.948 0.915 1.00 0.00 H new ATOM 0 HA LEU A 53 -10.158 7.654 -0.149 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.594 7.504 1.625 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.907 6.004 1.033 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.985 7.272 -0.963 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.911 9.745 -0.802 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -8.590 9.161 -0.895 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.913 9.679 0.668 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -5.172 8.372 0.343 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.186 8.303 1.804 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.603 6.798 1.054 1.00 0.00 H new ATOM 775 N VAL A 54 -8.982 5.268 -2.010 1.00 0.00 N ATOM 776 CA VAL A 54 -8.546 4.949 -3.399 1.00 0.00 C ATOM 777 C VAL A 54 -9.628 4.135 -4.111 1.00 0.00 C ATOM 778 O VAL A 54 -9.380 3.508 -5.120 1.00 0.00 O ATOM 779 CB VAL A 54 -7.238 4.151 -3.341 1.00 0.00 C ATOM 780 CG1 VAL A 54 -6.212 4.930 -2.515 1.00 0.00 C ATOM 781 CG2 VAL A 54 -7.486 2.791 -2.682 1.00 0.00 C ATOM 0 H VAL A 54 -9.174 4.458 -1.421 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.384 5.873 -3.955 1.00 0.00 H new ATOM 0 HB VAL A 54 -6.864 3.997 -4.353 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.279 4.368 -2.470 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -6.030 5.899 -2.981 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.595 5.079 -1.506 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.553 2.229 -2.644 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -7.861 2.940 -1.669 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.221 2.234 -3.263 1.00 0.00 H new ATOM 791 N LYS A 55 -10.831 4.144 -3.598 1.00 0.00 N ATOM 792 CA LYS A 55 -11.927 3.374 -4.251 1.00 0.00 C ATOM 793 C LYS A 55 -12.289 4.035 -5.585 1.00 0.00 C ATOM 794 O LYS A 55 -12.738 3.388 -6.509 1.00 0.00 O ATOM 795 CB LYS A 55 -13.157 3.359 -3.340 1.00 0.00 C ATOM 796 CG LYS A 55 -14.279 2.556 -4.006 1.00 0.00 C ATOM 797 CD LYS A 55 -15.339 2.181 -2.961 1.00 0.00 C ATOM 798 CE LYS A 55 -14.960 0.860 -2.285 1.00 0.00 C ATOM 799 NZ LYS A 55 -15.346 -0.278 -3.167 1.00 0.00 N ATOM 0 H LYS A 55 -11.100 4.652 -2.755 1.00 0.00 H new ATOM 0 HA LYS A 55 -11.595 2.351 -4.428 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -12.903 2.918 -2.376 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -13.491 4.378 -3.146 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -14.734 3.142 -4.805 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -13.872 1.655 -4.464 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -15.422 2.971 -2.215 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -16.315 2.089 -3.437 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -13.888 0.834 -2.088 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -15.463 0.775 -1.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -14.749 -1.102 -2.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -16.344 -0.521 -3.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -15.215 -0.006 -4.162 1.00 0.00 H new ATOM 813 N SER A 56 -12.083 5.321 -5.690 1.00 0.00 N ATOM 814 CA SER A 56 -12.400 6.035 -6.962 1.00 0.00 C ATOM 815 C SER A 56 -11.107 6.197 -7.756 1.00 0.00 C ATOM 816 O SER A 56 -10.861 7.213 -8.373 1.00 0.00 O ATOM 817 CB SER A 56 -12.982 7.412 -6.643 1.00 0.00 C ATOM 818 OG SER A 56 -11.939 8.276 -6.213 1.00 0.00 O ATOM 0 H SER A 56 -11.707 5.910 -4.947 1.00 0.00 H new ATOM 0 HA SER A 56 -13.128 5.468 -7.542 1.00 0.00 H new ATOM 0 HB2 SER A 56 -13.472 7.825 -7.525 1.00 0.00 H new ATOM 0 HB3 SER A 56 -13.742 7.327 -5.867 1.00 0.00 H new ATOM 0 HG SER A 56 -11.378 8.518 -6.979 1.00 0.00 H new ATOM 824 N ILE A 57 -10.278 5.195 -7.730 1.00 0.00 N ATOM 825 CA ILE A 57 -8.991 5.252 -8.457 1.00 0.00 C ATOM 826 C ILE A 57 -9.243 5.587 -9.931 1.00 0.00 C ATOM 827 O ILE A 57 -8.779 6.590 -10.434 1.00 0.00 O ATOM 828 CB ILE A 57 -8.308 3.884 -8.304 1.00 0.00 C ATOM 829 CG1 ILE A 57 -7.392 3.592 -9.497 1.00 0.00 C ATOM 830 CG2 ILE A 57 -9.376 2.790 -8.207 1.00 0.00 C ATOM 831 CD1 ILE A 57 -6.452 4.777 -9.750 1.00 0.00 C ATOM 0 H ILE A 57 -10.445 4.324 -7.225 1.00 0.00 H new ATOM 0 HA ILE A 57 -8.345 6.030 -8.051 1.00 0.00 H new ATOM 0 HB ILE A 57 -7.703 3.900 -7.397 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -6.809 2.691 -9.304 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -7.992 3.399 -10.386 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -8.893 1.819 -8.098 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -10.012 2.978 -7.342 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -9.984 2.794 -9.112 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -5.807 4.555 -10.600 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -7.041 5.669 -9.964 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -5.839 4.950 -8.866 1.00 0.00 H new ATOM 843 N GLY A 58 -9.975 4.760 -10.628 1.00 0.00 N ATOM 844 CA GLY A 58 -10.252 5.042 -12.069 1.00 0.00 C ATOM 845 C GLY A 58 -10.261 3.731 -12.862 1.00 0.00 C ATOM 846 O GLY A 58 -9.575 2.788 -12.529 1.00 0.00 O ATOM 0 H GLY A 58 -10.393 3.903 -10.265 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -11.213 5.547 -12.172 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -9.494 5.715 -12.470 1.00 0.00 H new ATOM 850 N ASN A 59 -11.041 3.669 -13.906 1.00 0.00 N ATOM 851 CA ASN A 59 -11.106 2.428 -14.722 1.00 0.00 C ATOM 852 C ASN A 59 -9.711 2.070 -15.242 1.00 0.00 C ATOM 853 O ASN A 59 -9.280 0.937 -15.159 1.00 0.00 O ATOM 854 CB ASN A 59 -12.050 2.647 -15.906 1.00 0.00 C ATOM 855 CG ASN A 59 -13.484 2.798 -15.397 1.00 0.00 C ATOM 856 OD1 ASN A 59 -14.400 2.989 -16.172 1.00 0.00 O ATOM 857 ND2 ASN A 59 -13.719 2.723 -14.115 1.00 0.00 N ATOM 0 H ASN A 59 -11.639 4.430 -14.229 1.00 0.00 H new ATOM 0 HA ASN A 59 -11.477 1.611 -14.102 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -11.754 3.538 -16.460 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -11.985 1.806 -16.596 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -14.671 2.825 -13.764 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -12.950 2.563 -13.464 1.00 0.00 H new ATOM 864 N SER A 60 -9.001 3.026 -15.781 1.00 0.00 N ATOM 865 CA SER A 60 -7.636 2.735 -16.311 1.00 0.00 C ATOM 866 C SER A 60 -6.687 2.425 -15.150 1.00 0.00 C ATOM 867 O SER A 60 -5.483 2.528 -15.275 1.00 0.00 O ATOM 868 CB SER A 60 -7.118 3.953 -17.078 1.00 0.00 C ATOM 869 OG SER A 60 -8.147 4.441 -17.929 1.00 0.00 O ATOM 0 H SER A 60 -9.307 3.994 -15.877 1.00 0.00 H new ATOM 0 HA SER A 60 -7.684 1.875 -16.978 1.00 0.00 H new ATOM 0 HB2 SER A 60 -6.806 4.731 -16.381 1.00 0.00 H new ATOM 0 HB3 SER A 60 -6.241 3.682 -17.666 1.00 0.00 H new ATOM 0 HG SER A 60 -7.821 5.223 -18.422 1.00 0.00 H new ATOM 875 N TYR A 61 -7.220 2.045 -14.022 1.00 0.00 N ATOM 876 CA TYR A 61 -6.358 1.727 -12.852 1.00 0.00 C ATOM 877 C TYR A 61 -7.153 0.868 -11.867 1.00 0.00 C ATOM 878 O TYR A 61 -8.199 1.262 -11.390 1.00 0.00 O ATOM 879 CB TYR A 61 -5.924 3.023 -12.178 1.00 0.00 C ATOM 880 CG TYR A 61 -4.876 3.708 -13.024 1.00 0.00 C ATOM 881 CD1 TYR A 61 -3.627 3.106 -13.215 1.00 0.00 C ATOM 882 CD2 TYR A 61 -5.156 4.945 -13.617 1.00 0.00 C ATOM 883 CE1 TYR A 61 -2.657 3.742 -13.999 1.00 0.00 C ATOM 884 CE2 TYR A 61 -4.186 5.581 -14.400 1.00 0.00 C ATOM 885 CZ TYR A 61 -2.937 4.981 -14.591 1.00 0.00 C ATOM 886 OH TYR A 61 -1.980 5.608 -15.365 1.00 0.00 O ATOM 0 H TYR A 61 -8.222 1.941 -13.861 1.00 0.00 H new ATOM 0 HA TYR A 61 -5.473 1.181 -13.178 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -6.783 3.680 -12.043 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -5.525 2.813 -11.186 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -3.412 2.151 -12.758 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -6.120 5.408 -13.470 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -1.693 3.278 -14.148 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -4.402 6.535 -14.857 1.00 0.00 H new ATOM 0 HH TYR A 61 -2.336 6.457 -15.701 1.00 0.00 H new ATOM 896 N SER A 62 -6.673 -0.311 -11.572 1.00 0.00 N ATOM 897 CA SER A 62 -7.407 -1.213 -10.633 1.00 0.00 C ATOM 898 C SER A 62 -6.560 -1.481 -9.388 1.00 0.00 C ATOM 899 O SER A 62 -7.083 -1.674 -8.311 1.00 0.00 O ATOM 900 CB SER A 62 -7.704 -2.536 -11.345 1.00 0.00 C ATOM 901 OG SER A 62 -9.039 -2.516 -11.832 1.00 0.00 O ATOM 0 H SER A 62 -5.801 -0.690 -11.942 1.00 0.00 H new ATOM 0 HA SER A 62 -8.338 -0.736 -10.327 1.00 0.00 H new ATOM 0 HB2 SER A 62 -7.006 -2.684 -12.169 1.00 0.00 H new ATOM 0 HB3 SER A 62 -7.567 -3.371 -10.658 1.00 0.00 H new ATOM 0 HG SER A 62 -9.233 -3.360 -12.290 1.00 0.00 H new ATOM 907 N TYR A 63 -5.263 -1.513 -9.520 1.00 0.00 N ATOM 908 CA TYR A 63 -4.411 -1.794 -8.328 1.00 0.00 C ATOM 909 C TYR A 63 -3.751 -0.508 -7.824 1.00 0.00 C ATOM 910 O TYR A 63 -3.718 0.499 -8.502 1.00 0.00 O ATOM 911 CB TYR A 63 -3.338 -2.814 -8.706 1.00 0.00 C ATOM 912 CG TYR A 63 -3.956 -4.191 -8.793 1.00 0.00 C ATOM 913 CD1 TYR A 63 -4.907 -4.468 -9.782 1.00 0.00 C ATOM 914 CD2 TYR A 63 -3.580 -5.189 -7.886 1.00 0.00 C ATOM 915 CE1 TYR A 63 -5.479 -5.742 -9.866 1.00 0.00 C ATOM 916 CE2 TYR A 63 -4.153 -6.464 -7.970 1.00 0.00 C ATOM 917 CZ TYR A 63 -5.102 -6.740 -8.960 1.00 0.00 C ATOM 918 OH TYR A 63 -5.666 -7.996 -9.042 1.00 0.00 O ATOM 0 H TYR A 63 -4.759 -1.358 -10.393 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.036 -2.195 -7.530 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -2.887 -2.546 -9.661 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -2.539 -2.809 -7.964 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.199 -3.698 -10.481 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -2.848 -4.976 -7.121 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -6.212 -5.955 -10.630 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -3.862 -7.234 -7.271 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.293 -8.569 -8.339 1.00 0.00 H new ATOM 928 N VAL A 64 -3.236 -0.541 -6.622 1.00 0.00 N ATOM 929 CA VAL A 64 -2.584 0.666 -6.036 1.00 0.00 C ATOM 930 C VAL A 64 -1.382 0.218 -5.190 1.00 0.00 C ATOM 931 O VAL A 64 -1.404 -0.825 -4.577 1.00 0.00 O ATOM 932 CB VAL A 64 -3.620 1.391 -5.161 1.00 0.00 C ATOM 933 CG1 VAL A 64 -3.003 2.613 -4.483 1.00 0.00 C ATOM 934 CG2 VAL A 64 -4.790 1.839 -6.041 1.00 0.00 C ATOM 0 H VAL A 64 -3.240 -1.362 -6.016 1.00 0.00 H new ATOM 0 HA VAL A 64 -2.231 1.341 -6.816 1.00 0.00 H new ATOM 0 HB VAL A 64 -3.966 0.705 -4.388 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.756 3.108 -3.870 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.172 2.298 -3.852 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.640 3.306 -5.242 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -5.530 2.354 -5.428 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.425 2.515 -6.815 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.249 0.967 -6.508 1.00 0.00 H new ATOM 944 N TRP A 65 -0.326 0.988 -5.165 1.00 0.00 N ATOM 945 CA TRP A 65 0.875 0.578 -4.370 1.00 0.00 C ATOM 946 C TRP A 65 0.719 1.013 -2.907 1.00 0.00 C ATOM 947 O TRP A 65 0.129 2.033 -2.612 1.00 0.00 O ATOM 948 CB TRP A 65 2.127 1.270 -4.932 1.00 0.00 C ATOM 949 CG TRP A 65 2.921 0.382 -5.845 1.00 0.00 C ATOM 950 CD1 TRP A 65 3.580 0.837 -6.934 1.00 0.00 C ATOM 951 CD2 TRP A 65 3.187 -1.058 -5.784 1.00 0.00 C ATOM 952 NE1 TRP A 65 4.228 -0.213 -7.546 1.00 0.00 N ATOM 953 CE2 TRP A 65 4.014 -1.403 -6.884 1.00 0.00 C ATOM 954 CE3 TRP A 65 2.802 -2.092 -4.905 1.00 0.00 C ATOM 955 CZ2 TRP A 65 4.437 -2.711 -7.102 1.00 0.00 C ATOM 956 CZ3 TRP A 65 3.229 -3.410 -5.127 1.00 0.00 C ATOM 957 CH2 TRP A 65 4.043 -3.719 -6.223 1.00 0.00 C ATOM 0 H TRP A 65 -0.241 1.878 -5.656 1.00 0.00 H new ATOM 0 HA TRP A 65 0.971 -0.506 -4.431 1.00 0.00 H new ATOM 0 HB2 TRP A 65 1.828 2.167 -5.474 1.00 0.00 H new ATOM 0 HB3 TRP A 65 2.760 1.593 -4.106 1.00 0.00 H new ATOM 0 HD1 TRP A 65 3.596 1.863 -7.271 1.00 0.00 H new ATOM 0 HE1 TRP A 65 4.797 -0.121 -8.387 1.00 0.00 H new ATOM 0 HE3 TRP A 65 2.174 -1.868 -4.055 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 5.067 -2.944 -7.948 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 2.927 -4.193 -4.447 1.00 0.00 H new ATOM 0 HH2 TRP A 65 4.365 -4.737 -6.387 1.00 0.00 H new ATOM 968 N ILE A 66 1.293 0.268 -1.994 1.00 0.00 N ATOM 969 CA ILE A 66 1.237 0.662 -0.556 1.00 0.00 C ATOM 970 C ILE A 66 2.631 0.414 0.043 1.00 0.00 C ATOM 971 O ILE A 66 3.508 -0.098 -0.624 1.00 0.00 O ATOM 972 CB ILE A 66 0.174 -0.154 0.190 1.00 0.00 C ATOM 973 CG1 ILE A 66 0.407 -1.650 -0.031 1.00 0.00 C ATOM 974 CG2 ILE A 66 -1.213 0.219 -0.339 1.00 0.00 C ATOM 975 CD1 ILE A 66 -0.734 -2.440 0.615 1.00 0.00 C ATOM 0 H ILE A 66 1.798 -0.597 -2.185 1.00 0.00 H new ATOM 0 HA ILE A 66 0.961 1.712 -0.460 1.00 0.00 H new ATOM 0 HB ILE A 66 0.240 0.066 1.255 1.00 0.00 H new ATOM 0 HG12 ILE A 66 0.458 -1.868 -1.098 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.362 -1.949 0.401 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -1.971 -0.359 0.189 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.390 1.282 -0.178 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.267 -0.000 -1.405 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.572 -3.507 0.460 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.763 -2.229 1.684 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -1.681 -2.147 0.162 1.00 0.00 H new ATOM 987 N GLY A 67 2.870 0.809 1.266 1.00 0.00 N ATOM 988 CA GLY A 67 4.230 0.631 1.849 1.00 0.00 C ATOM 989 C GLY A 67 4.409 -0.729 2.521 1.00 0.00 C ATOM 990 O GLY A 67 4.897 -0.799 3.626 1.00 0.00 O ATOM 0 H GLY A 67 2.185 1.245 1.883 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.976 0.744 1.062 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.414 1.419 2.579 1.00 0.00 H new ATOM 994 N LEU A 68 4.073 -1.809 1.870 1.00 0.00 N ATOM 995 CA LEU A 68 4.301 -3.144 2.504 1.00 0.00 C ATOM 996 C LEU A 68 4.987 -4.061 1.501 1.00 0.00 C ATOM 997 O LEU A 68 4.514 -4.259 0.401 1.00 0.00 O ATOM 998 CB LEU A 68 2.983 -3.773 2.972 1.00 0.00 C ATOM 999 CG LEU A 68 3.252 -5.153 3.609 1.00 0.00 C ATOM 1000 CD1 LEU A 68 4.451 -5.091 4.553 1.00 0.00 C ATOM 1001 CD2 LEU A 68 2.046 -5.584 4.433 1.00 0.00 C ATOM 0 H LEU A 68 3.656 -1.829 0.939 1.00 0.00 H new ATOM 0 HA LEU A 68 4.934 -3.009 3.381 1.00 0.00 H new ATOM 0 HB2 LEU A 68 2.495 -3.119 3.695 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.302 -3.880 2.128 1.00 0.00 H new ATOM 0 HG LEU A 68 3.448 -5.858 2.801 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.621 -6.075 4.990 1.00 0.00 H new ATOM 0 HD12 LEU A 68 5.336 -4.783 3.997 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.252 -4.371 5.347 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.241 -6.559 4.881 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.863 -4.853 5.221 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.169 -5.649 3.788 1.00 0.00 H new ATOM 1013 N HIS A 69 6.103 -4.620 1.877 1.00 0.00 N ATOM 1014 CA HIS A 69 6.841 -5.527 0.957 1.00 0.00 C ATOM 1015 C HIS A 69 7.072 -6.860 1.647 1.00 0.00 C ATOM 1016 O HIS A 69 6.627 -7.087 2.752 1.00 0.00 O ATOM 1017 CB HIS A 69 8.192 -4.910 0.590 1.00 0.00 C ATOM 1018 CG HIS A 69 9.004 -4.737 1.837 1.00 0.00 C ATOM 1019 ND1 HIS A 69 10.213 -5.382 2.036 1.00 0.00 N ATOM 1020 CD2 HIS A 69 8.780 -4.002 2.967 1.00 0.00 C ATOM 1021 CE1 HIS A 69 10.666 -5.025 3.251 1.00 0.00 C ATOM 1022 NE2 HIS A 69 9.829 -4.183 3.863 1.00 0.00 N ATOM 0 H HIS A 69 6.538 -4.486 2.790 1.00 0.00 H new ATOM 0 HA HIS A 69 6.254 -5.674 0.050 1.00 0.00 H new ATOM 0 HB2 HIS A 69 8.719 -5.551 -0.117 1.00 0.00 H new ATOM 0 HB3 HIS A 69 8.046 -3.948 0.099 1.00 0.00 H new ATOM 0 HD2 HIS A 69 7.918 -3.375 3.139 1.00 0.00 H new ATOM 0 HE1 HIS A 69 11.593 -5.376 3.679 1.00 0.00 H new ATOM 0 HE2 HIS A 69 9.936 -3.764 4.787 1.00 0.00 H new ATOM 1030 N ASP A 70 7.766 -7.733 0.988 1.00 0.00 N ATOM 1031 CA ASP A 70 8.066 -9.075 1.564 1.00 0.00 C ATOM 1032 C ASP A 70 9.562 -9.133 1.900 1.00 0.00 C ATOM 1033 O ASP A 70 10.371 -9.474 1.061 1.00 0.00 O ATOM 1034 CB ASP A 70 7.738 -10.155 0.529 1.00 0.00 C ATOM 1035 CG ASP A 70 6.390 -9.847 -0.126 1.00 0.00 C ATOM 1036 OD1 ASP A 70 6.205 -8.720 -0.555 1.00 0.00 O ATOM 1037 OD2 ASP A 70 5.565 -10.744 -0.186 1.00 0.00 O ATOM 0 H ASP A 70 8.148 -7.576 0.056 1.00 0.00 H new ATOM 0 HA ASP A 70 7.470 -9.242 2.461 1.00 0.00 H new ATOM 0 HB2 ASP A 70 8.521 -10.196 -0.229 1.00 0.00 H new ATOM 0 HB3 ASP A 70 7.706 -11.134 1.008 1.00 0.00 H new ATOM 1042 N PRO A 71 9.937 -8.790 3.109 1.00 0.00 N ATOM 1043 CA PRO A 71 11.371 -8.802 3.499 1.00 0.00 C ATOM 1044 C PRO A 71 11.953 -10.219 3.493 1.00 0.00 C ATOM 1045 O PRO A 71 13.126 -10.422 3.733 1.00 0.00 O ATOM 1046 CB PRO A 71 11.337 -8.210 4.914 1.00 0.00 C ATOM 1047 CG PRO A 71 9.890 -7.880 5.282 1.00 0.00 C ATOM 1048 CD PRO A 71 8.975 -8.375 4.162 1.00 0.00 C ATOM 0 HA PRO A 71 12.008 -8.245 2.811 1.00 0.00 H new ATOM 0 HB2 PRO A 71 11.755 -8.919 5.629 1.00 0.00 H new ATOM 0 HB3 PRO A 71 11.952 -7.311 4.961 1.00 0.00 H new ATOM 0 HG2 PRO A 71 9.622 -8.355 6.226 1.00 0.00 H new ATOM 0 HG3 PRO A 71 9.771 -6.805 5.420 1.00 0.00 H new ATOM 0 HD2 PRO A 71 8.350 -9.206 4.488 1.00 0.00 H new ATOM 0 HD3 PRO A 71 8.305 -7.590 3.811 1.00 0.00 H new ATOM 1056 N THR A 72 11.136 -11.199 3.211 1.00 0.00 N ATOM 1057 CA THR A 72 11.634 -12.602 3.181 1.00 0.00 C ATOM 1058 C THR A 72 12.133 -12.934 1.772 1.00 0.00 C ATOM 1059 O THR A 72 12.811 -13.921 1.562 1.00 0.00 O ATOM 1060 CB THR A 72 10.495 -13.553 3.555 1.00 0.00 C ATOM 1061 OG1 THR A 72 10.841 -14.877 3.173 1.00 0.00 O ATOM 1062 CG2 THR A 72 9.215 -13.129 2.833 1.00 0.00 C ATOM 0 H THR A 72 10.144 -11.087 3.000 1.00 0.00 H new ATOM 0 HA THR A 72 12.452 -12.715 3.893 1.00 0.00 H new ATOM 0 HB THR A 72 10.330 -13.517 4.632 1.00 0.00 H new ATOM 0 HG1 THR A 72 11.813 -14.943 3.067 1.00 0.00 H new ATOM 0 HG21 THR A 72 8.405 -13.807 3.100 1.00 0.00 H new ATOM 0 HG22 THR A 72 8.950 -12.114 3.128 1.00 0.00 H new ATOM 0 HG23 THR A 72 9.376 -13.164 1.756 1.00 0.00 H new ATOM 1070 N GLN A 73 11.808 -12.120 0.802 1.00 0.00 N ATOM 1071 CA GLN A 73 12.271 -12.399 -0.586 1.00 0.00 C ATOM 1072 C GLN A 73 11.924 -13.841 -0.960 1.00 0.00 C ATOM 1073 O GLN A 73 12.569 -14.452 -1.789 1.00 0.00 O ATOM 1074 CB GLN A 73 13.788 -12.202 -0.668 1.00 0.00 C ATOM 1075 CG GLN A 73 14.128 -10.732 -0.412 1.00 0.00 C ATOM 1076 CD GLN A 73 15.619 -10.600 -0.093 1.00 0.00 C ATOM 1077 OE1 GLN A 73 16.047 -9.606 0.458 1.00 0.00 O ATOM 1078 NE2 GLN A 73 16.431 -11.569 -0.418 1.00 0.00 N ATOM 0 H GLN A 73 11.244 -11.277 0.912 1.00 0.00 H new ATOM 0 HA GLN A 73 11.778 -11.716 -1.277 1.00 0.00 H new ATOM 0 HB2 GLN A 73 14.287 -12.835 0.066 1.00 0.00 H new ATOM 0 HB3 GLN A 73 14.152 -12.504 -1.650 1.00 0.00 H new ATOM 0 HG2 GLN A 73 13.878 -10.132 -1.287 1.00 0.00 H new ATOM 0 HG3 GLN A 73 13.533 -10.349 0.417 1.00 0.00 H new ATOM 0 HE21 GLN A 73 16.070 -12.403 -0.881 1.00 0.00 H new ATOM 0 HE22 GLN A 73 17.426 -11.492 -0.209 1.00 0.00 H new ATOM 1087 N GLY A 74 10.906 -14.392 -0.354 1.00 0.00 N ATOM 1088 CA GLY A 74 10.514 -15.795 -0.675 1.00 0.00 C ATOM 1089 C GLY A 74 11.321 -16.764 0.192 1.00 0.00 C ATOM 1090 O GLY A 74 11.987 -17.650 -0.307 1.00 0.00 O ATOM 0 H GLY A 74 10.329 -13.931 0.349 1.00 0.00 H new ATOM 0 HA2 GLY A 74 9.448 -15.935 -0.498 1.00 0.00 H new ATOM 0 HA3 GLY A 74 10.692 -16.001 -1.731 1.00 0.00 H new ATOM 1094 N THR A 75 11.264 -16.607 1.487 1.00 0.00 N ATOM 1095 CA THR A 75 12.027 -17.521 2.386 1.00 0.00 C ATOM 1096 C THR A 75 11.319 -17.608 3.739 1.00 0.00 C ATOM 1097 O THR A 75 11.836 -17.168 4.749 1.00 0.00 O ATOM 1098 CB THR A 75 13.445 -16.980 2.585 1.00 0.00 C ATOM 1099 OG1 THR A 75 13.376 -15.647 3.071 1.00 0.00 O ATOM 1100 CG2 THR A 75 14.197 -17.004 1.255 1.00 0.00 C ATOM 0 H THR A 75 10.722 -15.885 1.962 1.00 0.00 H new ATOM 0 HA THR A 75 12.079 -18.513 1.937 1.00 0.00 H new ATOM 0 HB THR A 75 13.974 -17.603 3.306 1.00 0.00 H new ATOM 0 HG1 THR A 75 13.469 -15.021 2.323 1.00 0.00 H new ATOM 0 HG21 THR A 75 15.206 -16.618 1.401 1.00 0.00 H new ATOM 0 HG22 THR A 75 14.250 -18.028 0.885 1.00 0.00 H new ATOM 0 HG23 THR A 75 13.672 -16.383 0.529 1.00 0.00 H new ATOM 1108 N GLU A 76 10.141 -18.170 3.770 1.00 0.00 N ATOM 1109 CA GLU A 76 9.397 -18.284 5.058 1.00 0.00 C ATOM 1110 C GLU A 76 8.649 -19.627 5.087 1.00 0.00 C ATOM 1111 O GLU A 76 8.310 -20.169 4.054 1.00 0.00 O ATOM 1112 CB GLU A 76 8.393 -17.131 5.161 1.00 0.00 C ATOM 1113 CG GLU A 76 9.084 -15.894 5.741 1.00 0.00 C ATOM 1114 CD GLU A 76 9.312 -16.091 7.241 1.00 0.00 C ATOM 1115 OE1 GLU A 76 10.356 -16.613 7.598 1.00 0.00 O ATOM 1116 OE2 GLU A 76 8.439 -15.717 8.007 1.00 0.00 O ATOM 0 H GLU A 76 9.660 -18.556 2.957 1.00 0.00 H new ATOM 0 HA GLU A 76 10.091 -18.236 5.897 1.00 0.00 H new ATOM 0 HB2 GLU A 76 7.985 -16.903 4.177 1.00 0.00 H new ATOM 0 HB3 GLU A 76 7.555 -17.422 5.794 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.036 -15.727 5.237 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.472 -15.009 5.569 1.00 0.00 H new ATOM 1123 N PRO A 77 8.394 -20.165 6.257 1.00 0.00 N ATOM 1124 CA PRO A 77 7.675 -21.464 6.369 1.00 0.00 C ATOM 1125 C PRO A 77 6.324 -21.461 5.648 1.00 0.00 C ATOM 1126 O PRO A 77 5.977 -22.404 4.967 1.00 0.00 O ATOM 1127 CB PRO A 77 7.489 -21.621 7.884 1.00 0.00 C ATOM 1128 CG PRO A 77 8.107 -20.403 8.590 1.00 0.00 C ATOM 1129 CD PRO A 77 8.798 -19.525 7.539 1.00 0.00 C ATOM 0 HA PRO A 77 8.226 -22.281 5.902 1.00 0.00 H new ATOM 0 HB2 PRO A 77 6.430 -21.701 8.128 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.965 -22.539 8.229 1.00 0.00 H new ATOM 0 HG2 PRO A 77 7.335 -19.835 9.109 1.00 0.00 H new ATOM 0 HG3 PRO A 77 8.825 -20.727 9.343 1.00 0.00 H new ATOM 0 HD2 PRO A 77 8.465 -18.489 7.596 1.00 0.00 H new ATOM 0 HD3 PRO A 77 9.881 -19.520 7.665 1.00 0.00 H new ATOM 1137 N ASN A 78 5.558 -20.412 5.795 1.00 0.00 N ATOM 1138 CA ASN A 78 4.229 -20.363 5.118 1.00 0.00 C ATOM 1139 C ASN A 78 4.054 -19.019 4.408 1.00 0.00 C ATOM 1140 O ASN A 78 3.060 -18.781 3.751 1.00 0.00 O ATOM 1141 CB ASN A 78 3.121 -20.528 6.163 1.00 0.00 C ATOM 1142 CG ASN A 78 3.154 -21.951 6.726 1.00 0.00 C ATOM 1143 OD1 ASN A 78 2.467 -22.253 7.683 1.00 0.00 O ATOM 1144 ND2 ASN A 78 3.927 -22.843 6.171 1.00 0.00 N ATOM 0 H ASN A 78 5.794 -19.591 6.352 1.00 0.00 H new ATOM 0 HA ASN A 78 4.171 -21.168 4.385 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.255 -19.805 6.967 1.00 0.00 H new ATOM 0 HB3 ASN A 78 2.149 -20.327 5.712 1.00 0.00 H new ATOM 0 HD21 ASN A 78 3.955 -23.794 6.540 1.00 0.00 H new ATOM 0 HD22 ASN A 78 4.503 -22.590 5.368 1.00 0.00 H new ATOM 1151 N GLY A 79 5.008 -18.137 4.529 1.00 0.00 N ATOM 1152 CA GLY A 79 4.885 -16.810 3.857 1.00 0.00 C ATOM 1153 C GLY A 79 4.246 -15.808 4.819 1.00 0.00 C ATOM 1154 O GLY A 79 3.091 -15.460 4.690 1.00 0.00 O ATOM 0 H GLY A 79 5.866 -18.276 5.063 1.00 0.00 H new ATOM 0 HA2 GLY A 79 5.868 -16.456 3.546 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.279 -16.902 2.956 1.00 0.00 H new ATOM 1158 N GLU A 80 4.990 -15.343 5.787 1.00 0.00 N ATOM 1159 CA GLU A 80 4.425 -14.365 6.758 1.00 0.00 C ATOM 1160 C GLU A 80 5.551 -13.491 7.317 1.00 0.00 C ATOM 1161 O GLU A 80 5.871 -13.549 8.487 1.00 0.00 O ATOM 1162 CB GLU A 80 3.748 -15.118 7.907 1.00 0.00 C ATOM 1163 CG GLU A 80 2.419 -15.706 7.426 1.00 0.00 C ATOM 1164 CD GLU A 80 1.643 -16.255 8.624 1.00 0.00 C ATOM 1165 OE1 GLU A 80 1.721 -15.654 9.682 1.00 0.00 O ATOM 1166 OE2 GLU A 80 0.980 -17.267 8.463 1.00 0.00 O ATOM 0 H GLU A 80 5.964 -15.599 5.946 1.00 0.00 H new ATOM 0 HA GLU A 80 3.692 -13.736 6.253 1.00 0.00 H new ATOM 0 HB2 GLU A 80 4.400 -15.914 8.267 1.00 0.00 H new ATOM 0 HB3 GLU A 80 3.576 -14.443 8.745 1.00 0.00 H new ATOM 0 HG2 GLU A 80 1.832 -14.940 6.919 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.601 -16.500 6.702 1.00 0.00 H new ATOM 1173 N GLY A 81 6.150 -12.681 6.486 1.00 0.00 N ATOM 1174 CA GLY A 81 7.255 -11.795 6.958 1.00 0.00 C ATOM 1175 C GLY A 81 7.007 -10.371 6.461 1.00 0.00 C ATOM 1176 O GLY A 81 7.759 -9.464 6.748 1.00 0.00 O ATOM 0 H GLY A 81 5.921 -12.594 5.496 1.00 0.00 H new ATOM 0 HA2 GLY A 81 7.308 -11.809 8.047 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.213 -12.160 6.588 1.00 0.00 H new ATOM 1180 N TRP A 82 5.956 -10.175 5.712 1.00 0.00 N ATOM 1181 CA TRP A 82 5.646 -8.815 5.178 1.00 0.00 C ATOM 1182 C TRP A 82 5.923 -7.748 6.245 1.00 0.00 C ATOM 1183 O TRP A 82 5.547 -7.896 7.388 1.00 0.00 O ATOM 1184 CB TRP A 82 4.167 -8.755 4.769 1.00 0.00 C ATOM 1185 CG TRP A 82 3.664 -10.135 4.482 1.00 0.00 C ATOM 1186 CD1 TRP A 82 4.266 -11.026 3.660 1.00 0.00 C ATOM 1187 CD2 TRP A 82 2.473 -10.796 5.000 1.00 0.00 C ATOM 1188 NE1 TRP A 82 3.519 -12.190 3.639 1.00 0.00 N ATOM 1189 CE2 TRP A 82 2.403 -12.097 4.448 1.00 0.00 C ATOM 1190 CE3 TRP A 82 1.457 -10.396 5.886 1.00 0.00 C ATOM 1191 CZ2 TRP A 82 1.363 -12.970 4.764 1.00 0.00 C ATOM 1192 CZ3 TRP A 82 0.407 -11.273 6.206 1.00 0.00 C ATOM 1193 CH2 TRP A 82 0.360 -12.557 5.646 1.00 0.00 C ATOM 0 H TRP A 82 5.293 -10.903 5.445 1.00 0.00 H new ATOM 0 HA TRP A 82 6.279 -8.621 4.312 1.00 0.00 H new ATOM 0 HB2 TRP A 82 3.578 -8.302 5.566 1.00 0.00 H new ATOM 0 HB3 TRP A 82 4.049 -8.124 3.888 1.00 0.00 H new ATOM 0 HD1 TRP A 82 5.180 -10.856 3.110 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.762 -13.016 3.093 1.00 0.00 H new ATOM 0 HE3 TRP A 82 1.484 -9.409 6.323 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 1.332 -13.959 4.330 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -0.368 -10.956 6.888 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -0.450 -13.226 5.896 1.00 0.00 H new ATOM 1204 N GLU A 83 6.566 -6.666 5.879 1.00 0.00 N ATOM 1205 CA GLU A 83 6.842 -5.588 6.881 1.00 0.00 C ATOM 1206 C GLU A 83 6.593 -4.220 6.241 1.00 0.00 C ATOM 1207 O GLU A 83 7.121 -3.914 5.188 1.00 0.00 O ATOM 1208 CB GLU A 83 8.300 -5.676 7.346 1.00 0.00 C ATOM 1209 CG GLU A 83 8.440 -5.037 8.730 1.00 0.00 C ATOM 1210 CD GLU A 83 9.917 -4.764 9.019 1.00 0.00 C ATOM 1211 OE1 GLU A 83 10.749 -5.468 8.469 1.00 0.00 O ATOM 1212 OE2 GLU A 83 10.192 -3.856 9.787 1.00 0.00 O ATOM 0 H GLU A 83 6.910 -6.483 4.936 1.00 0.00 H new ATOM 0 HA GLU A 83 6.181 -5.715 7.738 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.618 -6.718 7.382 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.950 -5.169 6.633 1.00 0.00 H new ATOM 0 HG2 GLU A 83 7.872 -4.107 8.772 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.026 -5.698 9.491 1.00 0.00 H new ATOM 1219 N TRP A 84 5.788 -3.390 6.858 1.00 0.00 N ATOM 1220 CA TRP A 84 5.513 -2.051 6.275 1.00 0.00 C ATOM 1221 C TRP A 84 6.797 -1.228 6.284 1.00 0.00 C ATOM 1222 O TRP A 84 7.707 -1.498 7.042 1.00 0.00 O ATOM 1223 CB TRP A 84 4.429 -1.347 7.090 1.00 0.00 C ATOM 1224 CG TRP A 84 3.490 -2.368 7.648 1.00 0.00 C ATOM 1225 CD1 TRP A 84 3.692 -3.065 8.788 1.00 0.00 C ATOM 1226 CD2 TRP A 84 2.211 -2.816 7.114 1.00 0.00 C ATOM 1227 NE1 TRP A 84 2.618 -3.911 8.990 1.00 0.00 N ATOM 1228 CE2 TRP A 84 1.680 -3.797 7.985 1.00 0.00 C ATOM 1229 CE3 TRP A 84 1.469 -2.471 5.973 1.00 0.00 C ATOM 1230 CZ2 TRP A 84 0.456 -4.415 7.731 1.00 0.00 C ATOM 1231 CZ3 TRP A 84 0.236 -3.090 5.714 1.00 0.00 C ATOM 1232 CH2 TRP A 84 -0.268 -4.061 6.591 1.00 0.00 C ATOM 0 H TRP A 84 5.313 -3.586 7.739 1.00 0.00 H new ATOM 0 HA TRP A 84 5.163 -2.160 5.248 1.00 0.00 H new ATOM 0 HB2 TRP A 84 4.881 -0.772 7.898 1.00 0.00 H new ATOM 0 HB3 TRP A 84 3.886 -0.641 6.461 1.00 0.00 H new ATOM 0 HD1 TRP A 84 4.552 -2.976 9.435 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.530 -4.543 9.786 1.00 0.00 H new ATOM 0 HE3 TRP A 84 1.849 -1.725 5.291 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 0.071 -5.161 8.410 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -0.328 -2.817 4.834 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.216 -4.535 6.385 1.00 0.00 H new ATOM 1243 N SER A 85 6.896 -0.236 5.439 1.00 0.00 N ATOM 1244 CA SER A 85 8.145 0.569 5.412 1.00 0.00 C ATOM 1245 C SER A 85 8.042 1.734 6.385 1.00 0.00 C ATOM 1246 O SER A 85 8.965 2.507 6.545 1.00 0.00 O ATOM 1247 CB SER A 85 8.396 1.094 3.998 1.00 0.00 C ATOM 1248 OG SER A 85 8.749 0.009 3.152 1.00 0.00 O ATOM 0 H SER A 85 6.175 0.047 4.776 1.00 0.00 H new ATOM 0 HA SER A 85 8.978 -0.067 5.711 1.00 0.00 H new ATOM 0 HB2 SER A 85 7.503 1.591 3.618 1.00 0.00 H new ATOM 0 HB3 SER A 85 9.194 1.836 4.009 1.00 0.00 H new ATOM 0 HG SER A 85 8.430 0.186 2.242 1.00 0.00 H new ATOM 1254 N SER A 86 6.939 1.856 7.046 1.00 0.00 N ATOM 1255 CA SER A 86 6.788 2.962 8.022 1.00 0.00 C ATOM 1256 C SER A 86 5.676 2.607 8.999 1.00 0.00 C ATOM 1257 O SER A 86 5.133 3.465 9.666 1.00 0.00 O ATOM 1258 CB SER A 86 6.429 4.253 7.285 1.00 0.00 C ATOM 1259 OG SER A 86 5.364 3.995 6.379 1.00 0.00 O ATOM 0 H SER A 86 6.132 1.239 6.956 1.00 0.00 H new ATOM 0 HA SER A 86 7.724 3.108 8.562 1.00 0.00 H new ATOM 0 HB2 SER A 86 6.137 5.023 7.998 1.00 0.00 H new ATOM 0 HB3 SER A 86 7.297 4.631 6.746 1.00 0.00 H new ATOM 0 HG SER A 86 5.713 3.537 5.586 1.00 0.00 H new ATOM 1265 N SER A 87 5.325 1.347 9.090 1.00 0.00 N ATOM 1266 CA SER A 87 4.229 0.964 10.036 1.00 0.00 C ATOM 1267 C SER A 87 4.718 -0.078 11.048 1.00 0.00 C ATOM 1268 O SER A 87 3.937 -0.635 11.787 1.00 0.00 O ATOM 1269 CB SER A 87 3.035 0.422 9.251 1.00 0.00 C ATOM 1270 OG SER A 87 3.162 0.798 7.887 1.00 0.00 O ATOM 0 H SER A 87 5.740 0.580 8.561 1.00 0.00 H new ATOM 0 HA SER A 87 3.922 1.852 10.589 1.00 0.00 H new ATOM 0 HB2 SER A 87 2.990 -0.664 9.338 1.00 0.00 H new ATOM 0 HB3 SER A 87 2.105 0.814 9.663 1.00 0.00 H new ATOM 0 HG SER A 87 2.452 0.372 7.363 1.00 0.00 H new ATOM 1276 N ASP A 88 5.998 -0.334 11.103 1.00 0.00 N ATOM 1277 CA ASP A 88 6.529 -1.325 12.094 1.00 0.00 C ATOM 1278 C ASP A 88 6.383 -2.752 11.562 1.00 0.00 C ATOM 1279 O ASP A 88 6.600 -3.024 10.399 1.00 0.00 O ATOM 1280 CB ASP A 88 5.755 -1.196 13.417 1.00 0.00 C ATOM 1281 CG ASP A 88 6.673 -1.554 14.588 1.00 0.00 C ATOM 1282 OD1 ASP A 88 7.471 -2.464 14.435 1.00 0.00 O ATOM 1283 OD2 ASP A 88 6.563 -0.910 15.620 1.00 0.00 O ATOM 0 H ASP A 88 6.702 0.099 10.505 1.00 0.00 H new ATOM 0 HA ASP A 88 7.586 -1.117 12.259 1.00 0.00 H new ATOM 0 HB2 ASP A 88 5.381 -0.179 13.533 1.00 0.00 H new ATOM 0 HB3 ASP A 88 4.887 -1.855 13.408 1.00 0.00 H new ATOM 1288 N VAL A 89 6.022 -3.668 12.424 1.00 0.00 N ATOM 1289 CA VAL A 89 5.860 -5.087 12.001 1.00 0.00 C ATOM 1290 C VAL A 89 4.404 -5.329 11.599 1.00 0.00 C ATOM 1291 O VAL A 89 3.589 -4.430 11.613 1.00 0.00 O ATOM 1292 CB VAL A 89 6.234 -6.005 13.171 1.00 0.00 C ATOM 1293 CG1 VAL A 89 5.251 -5.785 14.324 1.00 0.00 C ATOM 1294 CG2 VAL A 89 6.180 -7.473 12.723 1.00 0.00 C ATOM 0 H VAL A 89 5.832 -3.490 13.410 1.00 0.00 H new ATOM 0 HA VAL A 89 6.509 -5.299 11.151 1.00 0.00 H new ATOM 0 HB VAL A 89 7.246 -5.770 13.502 1.00 0.00 H new ATOM 0 HG11 VAL A 89 5.515 -6.437 15.157 1.00 0.00 H new ATOM 0 HG12 VAL A 89 5.297 -4.745 14.648 1.00 0.00 H new ATOM 0 HG13 VAL A 89 4.240 -6.016 13.989 1.00 0.00 H new ATOM 0 HG21 VAL A 89 6.447 -8.119 13.560 1.00 0.00 H new ATOM 0 HG22 VAL A 89 5.172 -7.714 12.386 1.00 0.00 H new ATOM 0 HG23 VAL A 89 6.883 -7.630 11.905 1.00 0.00 H new ATOM 1304 N MET A 90 4.073 -6.537 11.237 1.00 0.00 N ATOM 1305 CA MET A 90 2.672 -6.835 10.829 1.00 0.00 C ATOM 1306 C MET A 90 1.751 -6.796 12.047 1.00 0.00 C ATOM 1307 O MET A 90 1.415 -7.818 12.611 1.00 0.00 O ATOM 1308 CB MET A 90 2.609 -8.226 10.199 1.00 0.00 C ATOM 1309 CG MET A 90 3.629 -8.322 9.067 1.00 0.00 C ATOM 1310 SD MET A 90 3.391 -9.875 8.169 1.00 0.00 S ATOM 1311 CE MET A 90 3.719 -10.992 9.555 1.00 0.00 C ATOM 0 H MET A 90 4.712 -7.331 11.206 1.00 0.00 H new ATOM 0 HA MET A 90 2.347 -6.085 10.107 1.00 0.00 H new ATOM 0 HB2 MET A 90 2.814 -8.987 10.952 1.00 0.00 H new ATOM 0 HB3 MET A 90 1.607 -8.418 9.816 1.00 0.00 H new ATOM 0 HG2 MET A 90 3.516 -7.476 8.389 1.00 0.00 H new ATOM 0 HG3 MET A 90 4.641 -8.274 9.470 1.00 0.00 H new ATOM 0 HE1 MET A 90 4.028 -11.965 9.173 1.00 0.00 H new ATOM 0 HE2 MET A 90 4.513 -10.578 10.176 1.00 0.00 H new ATOM 0 HE3 MET A 90 2.814 -11.107 10.152 1.00 0.00 H new ATOM 1321 N ASN A 91 1.312 -5.632 12.442 1.00 0.00 N ATOM 1322 CA ASN A 91 0.384 -5.562 13.603 1.00 0.00 C ATOM 1323 C ASN A 91 -1.013 -5.892 13.086 1.00 0.00 C ATOM 1324 O ASN A 91 -1.942 -6.104 13.841 1.00 0.00 O ATOM 1325 CB ASN A 91 0.409 -4.155 14.222 1.00 0.00 C ATOM 1326 CG ASN A 91 0.493 -4.261 15.748 1.00 0.00 C ATOM 1327 OD1 ASN A 91 -0.003 -5.205 16.331 1.00 0.00 O ATOM 1328 ND2 ASN A 91 1.104 -3.326 16.423 1.00 0.00 N ATOM 0 H ASN A 91 1.553 -4.737 12.016 1.00 0.00 H new ATOM 0 HA ASN A 91 0.682 -6.268 14.378 1.00 0.00 H new ATOM 0 HB2 ASN A 91 1.262 -3.595 13.840 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -0.488 -3.606 13.935 1.00 0.00 H new ATOM 0 HD21 ASN A 91 1.165 -3.388 17.439 1.00 0.00 H new ATOM 0 HD22 ASN A 91 1.520 -2.533 15.934 1.00 0.00 H new ATOM 1335 N TYR A 92 -1.154 -5.955 11.787 1.00 0.00 N ATOM 1336 CA TYR A 92 -2.471 -6.292 11.182 1.00 0.00 C ATOM 1337 C TYR A 92 -2.239 -7.147 9.932 1.00 0.00 C ATOM 1338 O TYR A 92 -1.180 -7.108 9.338 1.00 0.00 O ATOM 1339 CB TYR A 92 -3.216 -5.012 10.800 1.00 0.00 C ATOM 1340 CG TYR A 92 -4.475 -5.362 10.038 1.00 0.00 C ATOM 1341 CD1 TYR A 92 -5.430 -6.214 10.613 1.00 0.00 C ATOM 1342 CD2 TYR A 92 -4.686 -4.839 8.757 1.00 0.00 C ATOM 1343 CE1 TYR A 92 -6.594 -6.540 9.903 1.00 0.00 C ATOM 1344 CE2 TYR A 92 -5.849 -5.165 8.049 1.00 0.00 C ATOM 1345 CZ TYR A 92 -6.803 -6.015 8.622 1.00 0.00 C ATOM 1346 OH TYR A 92 -7.948 -6.337 7.925 1.00 0.00 O ATOM 0 H TYR A 92 -0.404 -5.785 11.116 1.00 0.00 H new ATOM 0 HA TYR A 92 -3.072 -6.845 11.903 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -3.468 -4.445 11.696 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.575 -4.375 10.190 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -5.269 -6.618 11.601 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -3.951 -4.183 8.314 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -7.330 -7.196 10.344 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.010 -4.761 7.061 1.00 0.00 H new ATOM 0 HH TYR A 92 -7.937 -5.889 7.054 1.00 0.00 H new ATOM 1356 N PHE A 93 -3.211 -7.926 9.530 1.00 0.00 N ATOM 1357 CA PHE A 93 -3.029 -8.785 8.319 1.00 0.00 C ATOM 1358 C PHE A 93 -4.267 -8.700 7.420 1.00 0.00 C ATOM 1359 O PHE A 93 -5.373 -8.500 7.884 1.00 0.00 O ATOM 1360 CB PHE A 93 -2.822 -10.237 8.757 1.00 0.00 C ATOM 1361 CG PHE A 93 -3.863 -10.610 9.786 1.00 0.00 C ATOM 1362 CD1 PHE A 93 -5.144 -10.999 9.375 1.00 0.00 C ATOM 1363 CD2 PHE A 93 -3.548 -10.567 11.149 1.00 0.00 C ATOM 1364 CE1 PHE A 93 -6.110 -11.344 10.328 1.00 0.00 C ATOM 1365 CE2 PHE A 93 -4.515 -10.912 12.102 1.00 0.00 C ATOM 1366 CZ PHE A 93 -5.796 -11.302 11.691 1.00 0.00 C ATOM 0 H PHE A 93 -4.120 -8.005 9.986 1.00 0.00 H new ATOM 0 HA PHE A 93 -2.160 -8.436 7.762 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -2.894 -10.901 7.895 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -1.823 -10.363 9.174 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -5.387 -11.033 8.323 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -2.560 -10.268 11.466 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -7.098 -11.643 10.011 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -4.273 -10.877 13.154 1.00 0.00 H new ATOM 0 HZ PHE A 93 -6.541 -11.570 12.426 1.00 0.00 H new ATOM 1376 N ALA A 94 -4.086 -8.855 6.134 1.00 0.00 N ATOM 1377 CA ALA A 94 -5.246 -8.790 5.199 1.00 0.00 C ATOM 1378 C ALA A 94 -4.793 -9.198 3.790 1.00 0.00 C ATOM 1379 O ALA A 94 -5.380 -8.807 2.799 1.00 0.00 O ATOM 1380 CB ALA A 94 -5.806 -7.364 5.169 1.00 0.00 C ATOM 0 H ALA A 94 -3.183 -9.024 5.691 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.024 -9.473 5.540 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -6.653 -7.320 4.485 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -6.132 -7.080 6.170 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.031 -6.676 4.831 1.00 0.00 H new ATOM 1386 N TRP A 95 -3.754 -9.984 3.694 1.00 0.00 N ATOM 1387 CA TRP A 95 -3.264 -10.417 2.355 1.00 0.00 C ATOM 1388 C TRP A 95 -4.370 -11.196 1.638 1.00 0.00 C ATOM 1389 O TRP A 95 -5.250 -11.760 2.258 1.00 0.00 O ATOM 1390 CB TRP A 95 -2.036 -11.322 2.530 1.00 0.00 C ATOM 1391 CG TRP A 95 -0.798 -10.487 2.612 1.00 0.00 C ATOM 1392 CD1 TRP A 95 -0.409 -9.775 3.694 1.00 0.00 C ATOM 1393 CD2 TRP A 95 0.219 -10.270 1.593 1.00 0.00 C ATOM 1394 NE1 TRP A 95 0.780 -9.132 3.403 1.00 0.00 N ATOM 1395 CE2 TRP A 95 1.209 -9.408 2.119 1.00 0.00 C ATOM 1396 CE3 TRP A 95 0.378 -10.735 0.274 1.00 0.00 C ATOM 1397 CZ2 TRP A 95 2.317 -9.019 1.364 1.00 0.00 C ATOM 1398 CZ3 TRP A 95 1.491 -10.346 -0.488 1.00 0.00 C ATOM 1399 CH2 TRP A 95 2.458 -9.490 0.057 1.00 0.00 C ATOM 0 H TRP A 95 -3.223 -10.345 4.487 1.00 0.00 H new ATOM 0 HA TRP A 95 -2.992 -9.542 1.765 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.141 -11.922 3.434 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -1.962 -12.016 1.693 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -0.940 -9.718 4.632 1.00 0.00 H new ATOM 0 HE1 TRP A 95 1.279 -8.528 4.056 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -0.361 -11.395 -0.155 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 3.059 -8.359 1.788 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 1.603 -10.708 -1.499 1.00 0.00 H new ATOM 0 HH2 TRP A 95 3.312 -9.195 -0.534 1.00 0.00 H new ATOM 1410 N GLU A 96 -4.331 -11.235 0.333 1.00 0.00 N ATOM 1411 CA GLU A 96 -5.377 -11.978 -0.424 1.00 0.00 C ATOM 1412 C GLU A 96 -5.134 -13.482 -0.281 1.00 0.00 C ATOM 1413 O GLU A 96 -6.046 -14.250 -0.045 1.00 0.00 O ATOM 1414 CB GLU A 96 -5.311 -11.588 -1.902 1.00 0.00 C ATOM 1415 CG GLU A 96 -6.589 -12.046 -2.610 1.00 0.00 C ATOM 1416 CD GLU A 96 -6.415 -11.898 -4.122 1.00 0.00 C ATOM 1417 OE1 GLU A 96 -6.501 -10.780 -4.602 1.00 0.00 O ATOM 1418 OE2 GLU A 96 -6.202 -12.905 -4.776 1.00 0.00 O ATOM 0 H GLU A 96 -3.619 -10.784 -0.241 1.00 0.00 H new ATOM 0 HA GLU A 96 -6.361 -11.728 -0.027 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.196 -10.508 -1.999 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -4.439 -12.045 -2.371 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -6.805 -13.084 -2.358 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -7.438 -11.452 -2.271 1.00 0.00 H new ATOM 1425 N ARG A 97 -3.909 -13.908 -0.424 1.00 0.00 N ATOM 1426 CA ARG A 97 -3.602 -15.363 -0.297 1.00 0.00 C ATOM 1427 C ARG A 97 -2.191 -15.533 0.269 1.00 0.00 C ATOM 1428 O ARG A 97 -1.393 -14.618 0.260 1.00 0.00 O ATOM 1429 CB ARG A 97 -3.677 -16.023 -1.676 1.00 0.00 C ATOM 1430 CG ARG A 97 -5.141 -16.153 -2.102 1.00 0.00 C ATOM 1431 CD ARG A 97 -5.221 -16.920 -3.421 1.00 0.00 C ATOM 1432 NE ARG A 97 -6.637 -17.285 -3.700 1.00 0.00 N ATOM 1433 CZ ARG A 97 -6.956 -17.845 -4.835 1.00 0.00 C ATOM 1434 NH1 ARG A 97 -6.901 -17.154 -5.941 1.00 0.00 N ATOM 1435 NH2 ARG A 97 -7.330 -19.095 -4.863 1.00 0.00 N ATOM 0 H ARG A 97 -3.106 -13.312 -0.624 1.00 0.00 H new ATOM 0 HA ARG A 97 -4.325 -15.832 0.370 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -3.127 -15.429 -2.405 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -3.207 -17.006 -1.646 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -5.710 -16.673 -1.331 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -5.587 -15.165 -2.216 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -4.825 -16.310 -4.233 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -4.606 -17.819 -3.369 1.00 0.00 H new ATOM 0 HE ARG A 97 -7.358 -17.097 -3.004 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -6.609 -16.177 -5.918 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -7.150 -17.591 -6.828 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -7.373 -19.634 -3.998 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -7.579 -19.533 -5.750 1.00 0.00 H new ATOM 1449 N ASN A 98 -1.876 -16.699 0.761 1.00 0.00 N ATOM 1450 CA ASN A 98 -0.516 -16.925 1.324 1.00 0.00 C ATOM 1451 C ASN A 98 0.490 -17.074 0.171 1.00 0.00 C ATOM 1452 O ASN A 98 0.288 -17.875 -0.719 1.00 0.00 O ATOM 1453 CB ASN A 98 -0.521 -18.207 2.158 1.00 0.00 C ATOM 1454 CG ASN A 98 -1.741 -18.212 3.081 1.00 0.00 C ATOM 1455 OD1 ASN A 98 -2.838 -18.512 2.654 1.00 0.00 O ATOM 1456 ND2 ASN A 98 -1.595 -17.893 4.338 1.00 0.00 N ATOM 0 H ASN A 98 -2.501 -17.504 0.797 1.00 0.00 H new ATOM 0 HA ASN A 98 -0.233 -16.080 1.952 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -0.543 -19.079 1.504 1.00 0.00 H new ATOM 0 HB3 ASN A 98 0.394 -18.274 2.747 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -2.402 -17.896 4.962 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -0.674 -17.641 4.697 1.00 0.00 H new ATOM 1463 N PRO A 99 1.568 -16.319 0.172 1.00 0.00 N ATOM 1464 CA PRO A 99 2.572 -16.426 -0.923 1.00 0.00 C ATOM 1465 C PRO A 99 3.163 -17.837 -1.026 1.00 0.00 C ATOM 1466 O PRO A 99 3.828 -18.175 -1.985 1.00 0.00 O ATOM 1467 CB PRO A 99 3.645 -15.410 -0.508 1.00 0.00 C ATOM 1468 CG PRO A 99 3.220 -14.753 0.815 1.00 0.00 C ATOM 1469 CD PRO A 99 1.860 -15.321 1.239 1.00 0.00 C ATOM 0 HA PRO A 99 2.142 -16.231 -1.905 1.00 0.00 H new ATOM 0 HB2 PRO A 99 4.609 -15.906 -0.391 1.00 0.00 H new ATOM 0 HB3 PRO A 99 3.768 -14.653 -1.283 1.00 0.00 H new ATOM 0 HG2 PRO A 99 3.965 -14.944 1.587 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.156 -13.672 0.695 1.00 0.00 H new ATOM 0 HD2 PRO A 99 1.906 -15.785 2.224 1.00 0.00 H new ATOM 0 HD3 PRO A 99 1.096 -14.545 1.287 1.00 0.00 H new ATOM 1477 N SER A 100 2.927 -18.660 -0.043 1.00 0.00 N ATOM 1478 CA SER A 100 3.473 -20.044 -0.080 1.00 0.00 C ATOM 1479 C SER A 100 2.640 -20.901 -1.038 1.00 0.00 C ATOM 1480 O SER A 100 2.933 -22.059 -1.259 1.00 0.00 O ATOM 1481 CB SER A 100 3.420 -20.651 1.322 1.00 0.00 C ATOM 1482 OG SER A 100 3.788 -22.022 1.255 1.00 0.00 O ATOM 0 H SER A 100 2.378 -18.433 0.786 1.00 0.00 H new ATOM 0 HA SER A 100 4.506 -20.015 -0.426 1.00 0.00 H new ATOM 0 HB2 SER A 100 4.094 -20.114 1.989 1.00 0.00 H new ATOM 0 HB3 SER A 100 2.417 -20.552 1.736 1.00 0.00 H new ATOM 0 HG SER A 100 3.808 -22.310 0.318 1.00 0.00 H new ATOM 1488 N THR A 101 1.601 -20.341 -1.603 1.00 0.00 N ATOM 1489 CA THR A 101 0.741 -21.125 -2.541 1.00 0.00 C ATOM 1490 C THR A 101 0.596 -20.371 -3.867 1.00 0.00 C ATOM 1491 O THR A 101 -0.335 -20.595 -4.615 1.00 0.00 O ATOM 1492 CB THR A 101 -0.641 -21.323 -1.916 1.00 0.00 C ATOM 1493 OG1 THR A 101 -1.254 -20.055 -1.718 1.00 0.00 O ATOM 1494 CG2 THR A 101 -0.498 -22.038 -0.571 1.00 0.00 C ATOM 0 H THR A 101 1.311 -19.374 -1.455 1.00 0.00 H new ATOM 0 HA THR A 101 1.203 -22.094 -2.728 1.00 0.00 H new ATOM 0 HB THR A 101 -1.258 -21.927 -2.581 1.00 0.00 H new ATOM 0 HG1 THR A 101 -0.636 -19.464 -1.240 1.00 0.00 H new ATOM 0 HG21 THR A 101 -1.484 -22.178 -0.127 1.00 0.00 H new ATOM 0 HG22 THR A 101 -0.027 -23.009 -0.723 1.00 0.00 H new ATOM 0 HG23 THR A 101 0.119 -21.437 0.097 1.00 0.00 H new ATOM 1502 N ILE A 102 1.508 -19.482 -4.165 1.00 0.00 N ATOM 1503 CA ILE A 102 1.424 -18.717 -5.446 1.00 0.00 C ATOM 1504 C ILE A 102 2.685 -18.970 -6.274 1.00 0.00 C ATOM 1505 O ILE A 102 3.740 -19.262 -5.746 1.00 0.00 O ATOM 1506 CB ILE A 102 1.304 -17.222 -5.140 1.00 0.00 C ATOM 1507 CG1 ILE A 102 0.109 -16.989 -4.211 1.00 0.00 C ATOM 1508 CG2 ILE A 102 1.095 -16.448 -6.444 1.00 0.00 C ATOM 1509 CD1 ILE A 102 0.022 -15.505 -3.845 1.00 0.00 C ATOM 0 H ILE A 102 2.308 -19.252 -3.576 1.00 0.00 H new ATOM 0 HA ILE A 102 0.549 -19.043 -6.008 1.00 0.00 H new ATOM 0 HB ILE A 102 2.217 -16.875 -4.655 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -0.812 -17.307 -4.700 1.00 0.00 H new ATOM 0 HG13 ILE A 102 0.215 -17.591 -3.308 1.00 0.00 H new ATOM 0 HG21 ILE A 102 1.010 -15.384 -6.226 1.00 0.00 H new ATOM 0 HG22 ILE A 102 1.944 -16.615 -7.107 1.00 0.00 H new ATOM 0 HG23 ILE A 102 0.182 -16.793 -6.930 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -0.829 -15.343 -3.184 1.00 0.00 H new ATOM 0 HD12 ILE A 102 0.938 -15.201 -3.338 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -0.105 -14.913 -4.752 1.00 0.00 H new ATOM 1521 N SER A 103 2.585 -18.864 -7.572 1.00 0.00 N ATOM 1522 CA SER A 103 3.775 -19.103 -8.438 1.00 0.00 C ATOM 1523 C SER A 103 4.827 -18.022 -8.180 1.00 0.00 C ATOM 1524 O SER A 103 4.799 -16.962 -8.774 1.00 0.00 O ATOM 1525 CB SER A 103 3.353 -19.062 -9.907 1.00 0.00 C ATOM 1526 OG SER A 103 4.493 -18.805 -10.715 1.00 0.00 O ATOM 0 H SER A 103 1.729 -18.622 -8.071 1.00 0.00 H new ATOM 0 HA SER A 103 4.198 -20.081 -8.207 1.00 0.00 H new ATOM 0 HB2 SER A 103 2.896 -20.010 -10.193 1.00 0.00 H new ATOM 0 HB3 SER A 103 2.602 -18.287 -10.060 1.00 0.00 H new ATOM 0 HG SER A 103 4.227 -18.779 -11.658 1.00 0.00 H new ATOM 1532 N SER A 104 5.759 -18.284 -7.304 1.00 0.00 N ATOM 1533 CA SER A 104 6.820 -17.278 -7.008 1.00 0.00 C ATOM 1534 C SER A 104 6.191 -15.885 -6.868 1.00 0.00 C ATOM 1535 O SER A 104 6.120 -15.136 -7.822 1.00 0.00 O ATOM 1536 CB SER A 104 7.827 -17.260 -8.158 1.00 0.00 C ATOM 1537 OG SER A 104 8.480 -18.520 -8.231 1.00 0.00 O ATOM 0 H SER A 104 5.832 -19.155 -6.778 1.00 0.00 H new ATOM 0 HA SER A 104 7.321 -17.543 -6.077 1.00 0.00 H new ATOM 0 HB2 SER A 104 7.319 -17.046 -9.098 1.00 0.00 H new ATOM 0 HB3 SER A 104 8.559 -16.467 -8.003 1.00 0.00 H new ATOM 0 HG SER A 104 9.125 -18.512 -8.969 1.00 0.00 H new ATOM 1543 N PRO A 105 5.743 -15.533 -5.686 1.00 0.00 N ATOM 1544 CA PRO A 105 5.123 -14.198 -5.459 1.00 0.00 C ATOM 1545 C PRO A 105 6.148 -13.060 -5.549 1.00 0.00 C ATOM 1546 O PRO A 105 7.306 -13.229 -5.217 1.00 0.00 O ATOM 1547 CB PRO A 105 4.578 -14.320 -4.029 1.00 0.00 C ATOM 1548 CG PRO A 105 4.915 -15.719 -3.488 1.00 0.00 C ATOM 1549 CD PRO A 105 5.810 -16.436 -4.507 1.00 0.00 C ATOM 0 HA PRO A 105 4.367 -13.955 -6.206 1.00 0.00 H new ATOM 0 HB2 PRO A 105 5.017 -13.553 -3.391 1.00 0.00 H new ATOM 0 HB3 PRO A 105 3.500 -14.162 -4.021 1.00 0.00 H new ATOM 0 HG2 PRO A 105 5.424 -15.640 -2.527 1.00 0.00 H new ATOM 0 HG3 PRO A 105 4.002 -16.289 -3.319 1.00 0.00 H new ATOM 0 HD2 PRO A 105 6.830 -16.551 -4.141 1.00 0.00 H new ATOM 0 HD3 PRO A 105 5.441 -17.435 -4.739 1.00 0.00 H new ATOM 1557 N GLY A 106 5.733 -11.902 -5.984 1.00 0.00 N ATOM 1558 CA GLY A 106 6.686 -10.761 -6.077 1.00 0.00 C ATOM 1559 C GLY A 106 7.209 -10.443 -4.676 1.00 0.00 C ATOM 1560 O GLY A 106 7.334 -11.318 -3.841 1.00 0.00 O ATOM 0 H GLY A 106 4.778 -11.697 -6.278 1.00 0.00 H new ATOM 0 HA2 GLY A 106 7.513 -11.013 -6.741 1.00 0.00 H new ATOM 0 HA3 GLY A 106 6.190 -9.888 -6.502 1.00 0.00 H new ATOM 1564 N HIS A 107 7.511 -9.201 -4.401 1.00 0.00 N ATOM 1565 CA HIS A 107 8.016 -8.842 -3.043 1.00 0.00 C ATOM 1566 C HIS A 107 7.368 -7.533 -2.583 1.00 0.00 C ATOM 1567 O HIS A 107 7.633 -7.050 -1.501 1.00 0.00 O ATOM 1568 CB HIS A 107 9.538 -8.682 -3.080 1.00 0.00 C ATOM 1569 CG HIS A 107 10.132 -9.740 -3.970 1.00 0.00 C ATOM 1570 ND1 HIS A 107 10.402 -11.019 -3.516 1.00 0.00 N ATOM 1571 CD2 HIS A 107 10.515 -9.726 -5.287 1.00 0.00 C ATOM 1572 CE1 HIS A 107 10.923 -11.711 -4.545 1.00 0.00 C ATOM 1573 NE2 HIS A 107 11.013 -10.969 -5.647 1.00 0.00 N ATOM 0 H HIS A 107 7.430 -8.423 -5.055 1.00 0.00 H new ATOM 0 HA HIS A 107 7.759 -9.637 -2.343 1.00 0.00 H new ATOM 0 HB2 HIS A 107 9.801 -7.691 -3.450 1.00 0.00 H new ATOM 0 HB3 HIS A 107 9.948 -8.766 -2.073 1.00 0.00 H new ATOM 0 HD2 HIS A 107 10.440 -8.873 -5.946 1.00 0.00 H new ATOM 0 HE1 HIS A 107 11.231 -12.744 -4.485 1.00 0.00 H new ATOM 0 HE2 HIS A 107 11.371 -11.253 -6.559 1.00 0.00 H new ATOM 1581 N CYS A 108 6.511 -6.961 -3.391 1.00 0.00 N ATOM 1582 CA CYS A 108 5.833 -5.689 -2.995 1.00 0.00 C ATOM 1583 C CYS A 108 4.322 -5.920 -2.947 1.00 0.00 C ATOM 1584 O CYS A 108 3.770 -6.645 -3.751 1.00 0.00 O ATOM 1585 CB CYS A 108 6.164 -4.593 -4.007 1.00 0.00 C ATOM 1586 SG CYS A 108 7.746 -3.840 -3.562 1.00 0.00 S ATOM 0 H CYS A 108 6.251 -7.321 -4.309 1.00 0.00 H new ATOM 0 HA CYS A 108 6.182 -5.376 -2.011 1.00 0.00 H new ATOM 0 HB2 CYS A 108 6.216 -5.012 -5.012 1.00 0.00 H new ATOM 0 HB3 CYS A 108 5.377 -3.839 -4.016 1.00 0.00 H new ATOM 1591 N ALA A 109 3.650 -5.326 -1.996 1.00 0.00 N ATOM 1592 CA ALA A 109 2.176 -5.528 -1.876 1.00 0.00 C ATOM 1593 C ALA A 109 1.417 -4.320 -2.433 1.00 0.00 C ATOM 1594 O ALA A 109 1.801 -3.177 -2.250 1.00 0.00 O ATOM 1595 CB ALA A 109 1.808 -5.719 -0.404 1.00 0.00 C ATOM 0 H ALA A 109 4.060 -4.708 -1.295 1.00 0.00 H new ATOM 0 HA ALA A 109 1.898 -6.412 -2.450 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.732 -5.867 -0.314 1.00 0.00 H new ATOM 0 HB2 ALA A 109 2.328 -6.592 -0.009 1.00 0.00 H new ATOM 0 HB3 ALA A 109 2.101 -4.835 0.162 1.00 0.00 H new ATOM 1601 N SER A 110 0.331 -4.582 -3.106 1.00 0.00 N ATOM 1602 CA SER A 110 -0.498 -3.490 -3.687 1.00 0.00 C ATOM 1603 C SER A 110 -1.974 -3.841 -3.475 1.00 0.00 C ATOM 1604 O SER A 110 -2.313 -4.973 -3.193 1.00 0.00 O ATOM 1605 CB SER A 110 -0.203 -3.372 -5.190 1.00 0.00 C ATOM 1606 OG SER A 110 0.800 -4.315 -5.543 1.00 0.00 O ATOM 0 H SER A 110 -0.022 -5.523 -3.280 1.00 0.00 H new ATOM 0 HA SER A 110 -0.268 -2.540 -3.205 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.110 -3.554 -5.767 1.00 0.00 H new ATOM 0 HB3 SER A 110 0.130 -2.362 -5.430 1.00 0.00 H new ATOM 0 HG SER A 110 1.662 -3.858 -5.633 1.00 0.00 H new ATOM 1612 N LEU A 111 -2.856 -2.895 -3.612 1.00 0.00 N ATOM 1613 CA LEU A 111 -4.303 -3.197 -3.421 1.00 0.00 C ATOM 1614 C LEU A 111 -4.877 -3.692 -4.749 1.00 0.00 C ATOM 1615 O LEU A 111 -4.393 -3.351 -5.807 1.00 0.00 O ATOM 1616 CB LEU A 111 -5.043 -1.925 -2.989 1.00 0.00 C ATOM 1617 CG LEU A 111 -4.530 -1.450 -1.615 1.00 0.00 C ATOM 1618 CD1 LEU A 111 -4.231 0.051 -1.660 1.00 0.00 C ATOM 1619 CD2 LEU A 111 -5.598 -1.706 -0.550 1.00 0.00 C ATOM 0 H LEU A 111 -2.641 -1.926 -3.848 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.425 -3.959 -2.651 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.896 -1.140 -3.731 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.114 -2.119 -2.938 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.621 -1.999 -1.371 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -3.869 0.379 -0.686 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.470 0.248 -2.415 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.141 0.596 -1.911 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.233 -1.369 0.420 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.505 -1.159 -0.806 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -5.818 -2.773 -0.504 1.00 0.00 H new ATOM 1631 N SER A 112 -5.898 -4.504 -4.700 1.00 0.00 N ATOM 1632 CA SER A 112 -6.508 -5.037 -5.959 1.00 0.00 C ATOM 1633 C SER A 112 -7.967 -4.589 -6.054 1.00 0.00 C ATOM 1634 O SER A 112 -8.793 -4.961 -5.245 1.00 0.00 O ATOM 1635 CB SER A 112 -6.454 -6.565 -5.935 1.00 0.00 C ATOM 1636 OG SER A 112 -7.421 -7.053 -5.014 1.00 0.00 O ATOM 0 H SER A 112 -6.340 -4.825 -3.839 1.00 0.00 H new ATOM 0 HA SER A 112 -5.955 -4.658 -6.818 1.00 0.00 H new ATOM 0 HB2 SER A 112 -6.649 -6.963 -6.931 1.00 0.00 H new ATOM 0 HB3 SER A 112 -5.458 -6.901 -5.647 1.00 0.00 H new ATOM 0 HG SER A 112 -8.052 -6.337 -4.791 1.00 0.00 H new ATOM 1642 N ARG A 113 -8.298 -3.793 -7.038 1.00 0.00 N ATOM 1643 CA ARG A 113 -9.712 -3.332 -7.174 1.00 0.00 C ATOM 1644 C ARG A 113 -10.640 -4.549 -7.227 1.00 0.00 C ATOM 1645 O ARG A 113 -11.767 -4.503 -6.774 1.00 0.00 O ATOM 1646 CB ARG A 113 -9.864 -2.515 -8.462 1.00 0.00 C ATOM 1647 CG ARG A 113 -11.349 -2.294 -8.769 1.00 0.00 C ATOM 1648 CD ARG A 113 -11.496 -1.253 -9.880 1.00 0.00 C ATOM 1649 NE ARG A 113 -12.858 -1.354 -10.476 1.00 0.00 N ATOM 1650 CZ ARG A 113 -13.134 -0.719 -11.583 1.00 0.00 C ATOM 1651 NH1 ARG A 113 -13.500 0.533 -11.543 1.00 0.00 N ATOM 1652 NH2 ARG A 113 -13.045 -1.337 -12.729 1.00 0.00 N ATOM 0 H ARG A 113 -7.655 -3.444 -7.749 1.00 0.00 H new ATOM 0 HA ARG A 113 -9.976 -2.710 -6.319 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -9.359 -1.555 -8.355 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -9.386 -3.036 -9.292 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -11.811 -3.233 -9.074 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -11.870 -1.959 -7.872 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -11.336 -0.252 -9.479 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -10.739 -1.414 -10.647 1.00 0.00 H new ATOM 0 HE ARG A 113 -13.574 -1.919 -10.019 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -13.570 1.015 -10.647 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -13.716 1.029 -12.408 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -12.760 -2.316 -12.760 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -13.261 -0.841 -13.594 1.00 0.00 H new ATOM 1666 N SER A 114 -10.178 -5.638 -7.782 1.00 0.00 N ATOM 1667 CA SER A 114 -11.036 -6.854 -7.871 1.00 0.00 C ATOM 1668 C SER A 114 -11.520 -7.251 -6.473 1.00 0.00 C ATOM 1669 O SER A 114 -12.457 -8.010 -6.326 1.00 0.00 O ATOM 1670 CB SER A 114 -10.228 -8.003 -8.473 1.00 0.00 C ATOM 1671 OG SER A 114 -9.677 -7.589 -9.717 1.00 0.00 O ATOM 0 H SER A 114 -9.243 -5.737 -8.178 1.00 0.00 H new ATOM 0 HA SER A 114 -11.898 -6.640 -8.503 1.00 0.00 H new ATOM 0 HB2 SER A 114 -9.432 -8.300 -7.790 1.00 0.00 H new ATOM 0 HB3 SER A 114 -10.866 -8.875 -8.617 1.00 0.00 H new ATOM 0 HG SER A 114 -9.157 -8.323 -10.105 1.00 0.00 H new ATOM 1677 N THR A 115 -10.887 -6.744 -5.448 1.00 0.00 N ATOM 1678 CA THR A 115 -11.304 -7.092 -4.056 1.00 0.00 C ATOM 1679 C THR A 115 -11.734 -5.822 -3.318 1.00 0.00 C ATOM 1680 O THR A 115 -11.622 -5.724 -2.112 1.00 0.00 O ATOM 1681 CB THR A 115 -10.125 -7.732 -3.320 1.00 0.00 C ATOM 1682 OG1 THR A 115 -9.034 -6.822 -3.298 1.00 0.00 O ATOM 1683 CG2 THR A 115 -9.707 -9.017 -4.039 1.00 0.00 C ATOM 0 H THR A 115 -10.097 -6.102 -5.514 1.00 0.00 H new ATOM 0 HA THR A 115 -12.139 -7.792 -4.090 1.00 0.00 H new ATOM 0 HB THR A 115 -10.420 -7.971 -2.298 1.00 0.00 H new ATOM 0 HG1 THR A 115 -8.220 -7.280 -3.594 1.00 0.00 H new ATOM 0 HG21 THR A 115 -8.867 -9.471 -3.513 1.00 0.00 H new ATOM 0 HG22 THR A 115 -10.545 -9.714 -4.055 1.00 0.00 H new ATOM 0 HG23 THR A 115 -9.411 -8.782 -5.061 1.00 0.00 H new ATOM 1691 N ALA A 116 -12.223 -4.847 -4.033 1.00 0.00 N ATOM 1692 CA ALA A 116 -12.656 -3.582 -3.376 1.00 0.00 C ATOM 1693 C ALA A 116 -11.470 -2.964 -2.633 1.00 0.00 C ATOM 1694 O ALA A 116 -11.635 -2.239 -1.673 1.00 0.00 O ATOM 1695 CB ALA A 116 -13.784 -3.880 -2.383 1.00 0.00 C ATOM 0 H ALA A 116 -12.342 -4.872 -5.046 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.016 -2.884 -4.132 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -14.100 -2.954 -1.903 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -14.628 -4.321 -2.913 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -13.427 -4.578 -1.626 1.00 0.00 H new ATOM 1701 N PHE A 117 -10.277 -3.244 -3.077 1.00 0.00 N ATOM 1702 CA PHE A 117 -9.070 -2.678 -2.408 1.00 0.00 C ATOM 1703 C PHE A 117 -9.032 -3.129 -0.949 1.00 0.00 C ATOM 1704 O PHE A 117 -8.406 -2.508 -0.114 1.00 0.00 O ATOM 1705 CB PHE A 117 -9.117 -1.149 -2.468 1.00 0.00 C ATOM 1706 CG PHE A 117 -9.509 -0.709 -3.858 1.00 0.00 C ATOM 1707 CD1 PHE A 117 -8.536 -0.606 -4.858 1.00 0.00 C ATOM 1708 CD2 PHE A 117 -10.845 -0.402 -4.146 1.00 0.00 C ATOM 1709 CE1 PHE A 117 -8.898 -0.196 -6.146 1.00 0.00 C ATOM 1710 CE2 PHE A 117 -11.206 0.006 -5.435 1.00 0.00 C ATOM 1711 CZ PHE A 117 -10.232 0.110 -6.435 1.00 0.00 C ATOM 0 H PHE A 117 -10.084 -3.844 -3.879 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.176 -3.033 -2.921 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.833 -0.768 -1.740 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -8.144 -0.734 -2.205 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -7.506 -0.843 -4.636 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -11.596 -0.480 -3.374 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -8.147 -0.116 -6.918 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -12.236 0.241 -5.658 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.510 0.426 -7.429 1.00 0.00 H new ATOM 1721 N LEU A 118 -9.696 -4.208 -0.635 1.00 0.00 N ATOM 1722 CA LEU A 118 -9.699 -4.706 0.771 1.00 0.00 C ATOM 1723 C LEU A 118 -8.711 -5.865 0.904 1.00 0.00 C ATOM 1724 O LEU A 118 -8.490 -6.382 1.981 1.00 0.00 O ATOM 1725 CB LEU A 118 -11.107 -5.188 1.132 1.00 0.00 C ATOM 1726 CG LEU A 118 -12.064 -3.992 1.207 1.00 0.00 C ATOM 1727 CD1 LEU A 118 -13.480 -4.496 1.495 1.00 0.00 C ATOM 1728 CD2 LEU A 118 -11.624 -3.036 2.329 1.00 0.00 C ATOM 0 H LEU A 118 -10.238 -4.768 -1.293 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.404 -3.902 1.445 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.459 -5.901 0.386 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -11.088 -5.710 2.088 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.047 -3.458 0.257 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -14.164 -3.649 1.549 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -13.797 -5.167 0.697 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -13.490 -5.031 2.444 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -12.309 -2.189 2.375 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -11.635 -3.564 3.282 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -10.616 -2.676 2.126 1.00 0.00 H new ATOM 1740 N ARG A 119 -8.109 -6.273 -0.183 1.00 0.00 N ATOM 1741 CA ARG A 119 -7.126 -7.398 -0.128 1.00 0.00 C ATOM 1742 C ARG A 119 -5.819 -6.951 -0.787 1.00 0.00 C ATOM 1743 O ARG A 119 -5.820 -6.204 -1.745 1.00 0.00 O ATOM 1744 CB ARG A 119 -7.690 -8.608 -0.875 1.00 0.00 C ATOM 1745 CG ARG A 119 -8.950 -9.118 -0.162 1.00 0.00 C ATOM 1746 CD ARG A 119 -8.562 -10.091 0.958 1.00 0.00 C ATOM 1747 NE ARG A 119 -9.571 -10.016 2.051 1.00 0.00 N ATOM 1748 CZ ARG A 119 -9.297 -10.508 3.229 1.00 0.00 C ATOM 1749 NH1 ARG A 119 -8.062 -10.552 3.647 1.00 0.00 N ATOM 1750 NH2 ARG A 119 -10.259 -10.956 3.988 1.00 0.00 N ATOM 0 H ARG A 119 -8.256 -5.874 -1.110 1.00 0.00 H new ATOM 0 HA ARG A 119 -6.939 -7.673 0.910 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -7.928 -8.334 -1.903 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -6.942 -9.399 -0.922 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -9.509 -8.278 0.252 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -9.606 -9.616 -0.876 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -8.507 -11.108 0.568 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -7.573 -9.843 1.344 1.00 0.00 H new ATOM 0 HE ARG A 119 -10.477 -9.580 1.879 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -7.310 -10.202 3.053 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -7.848 -10.936 4.567 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -11.225 -10.922 3.661 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -10.046 -11.340 4.908 1.00 0.00 H new ATOM 1764 N TRP A 120 -4.702 -7.395 -0.274 1.00 0.00 N ATOM 1765 CA TRP A 120 -3.393 -6.989 -0.864 1.00 0.00 C ATOM 1766 C TRP A 120 -2.856 -8.098 -1.771 1.00 0.00 C ATOM 1767 O TRP A 120 -2.988 -9.272 -1.480 1.00 0.00 O ATOM 1768 CB TRP A 120 -2.393 -6.732 0.265 1.00 0.00 C ATOM 1769 CG TRP A 120 -3.013 -5.831 1.283 1.00 0.00 C ATOM 1770 CD1 TRP A 120 -3.708 -4.703 1.008 1.00 0.00 C ATOM 1771 CD2 TRP A 120 -3.004 -5.965 2.729 1.00 0.00 C ATOM 1772 NE1 TRP A 120 -4.128 -4.138 2.200 1.00 0.00 N ATOM 1773 CE2 TRP A 120 -3.719 -4.879 3.290 1.00 0.00 C ATOM 1774 CE3 TRP A 120 -2.451 -6.915 3.602 1.00 0.00 C ATOM 1775 CZ2 TRP A 120 -3.878 -4.744 4.670 1.00 0.00 C ATOM 1776 CZ3 TRP A 120 -2.608 -6.783 4.990 1.00 0.00 C ATOM 1777 CH2 TRP A 120 -3.320 -5.700 5.522 1.00 0.00 C ATOM 0 H TRP A 120 -4.640 -8.022 0.528 1.00 0.00 H new ATOM 0 HA TRP A 120 -3.532 -6.083 -1.455 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -2.100 -7.675 0.728 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -1.486 -6.278 -0.134 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -3.903 -4.309 0.022 1.00 0.00 H new ATOM 0 HE1 TRP A 120 -4.673 -3.279 2.265 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -1.901 -7.754 3.202 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 -4.428 -3.908 5.076 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -2.178 -7.520 5.652 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -3.437 -5.604 6.591 1.00 0.00 H new ATOM 1788 N LYS A 121 -2.248 -7.731 -2.870 1.00 0.00 N ATOM 1789 CA LYS A 121 -1.690 -8.750 -3.810 1.00 0.00 C ATOM 1790 C LYS A 121 -0.220 -8.441 -4.078 1.00 0.00 C ATOM 1791 O LYS A 121 0.205 -7.305 -4.030 1.00 0.00 O ATOM 1792 CB LYS A 121 -2.474 -8.715 -5.125 1.00 0.00 C ATOM 1793 CG LYS A 121 -2.065 -9.899 -6.008 1.00 0.00 C ATOM 1794 CD LYS A 121 -2.560 -11.214 -5.391 1.00 0.00 C ATOM 1795 CE LYS A 121 -2.772 -12.254 -6.494 1.00 0.00 C ATOM 1796 NZ LYS A 121 -4.008 -11.920 -7.259 1.00 0.00 N ATOM 0 H LYS A 121 -2.113 -6.762 -3.159 1.00 0.00 H new ATOM 0 HA LYS A 121 -1.775 -9.742 -3.367 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -3.544 -8.754 -4.922 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -2.283 -7.778 -5.647 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -2.482 -9.778 -7.008 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -0.981 -9.925 -6.116 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -1.835 -11.582 -4.665 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -3.493 -11.046 -4.852 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -1.911 -12.272 -7.162 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -2.858 -13.250 -6.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -4.372 -12.777 -7.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -4.728 -11.545 -6.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -3.787 -11.204 -7.980 1.00 0.00 H new ATOM 1810 N ASP A 122 0.563 -9.449 -4.345 1.00 0.00 N ATOM 1811 CA ASP A 122 2.007 -9.215 -4.601 1.00 0.00 C ATOM 1812 C ASP A 122 2.204 -8.657 -6.014 1.00 0.00 C ATOM 1813 O ASP A 122 1.447 -8.951 -6.918 1.00 0.00 O ATOM 1814 CB ASP A 122 2.773 -10.534 -4.461 1.00 0.00 C ATOM 1815 CG ASP A 122 1.975 -11.660 -5.120 1.00 0.00 C ATOM 1816 OD1 ASP A 122 2.138 -11.855 -6.314 1.00 0.00 O ATOM 1817 OD2 ASP A 122 1.214 -12.309 -4.420 1.00 0.00 O ATOM 0 H ASP A 122 0.264 -10.423 -4.396 1.00 0.00 H new ATOM 0 HA ASP A 122 2.385 -8.494 -3.876 1.00 0.00 H new ATOM 0 HB2 ASP A 122 3.754 -10.448 -4.928 1.00 0.00 H new ATOM 0 HB3 ASP A 122 2.939 -10.760 -3.408 1.00 0.00 H new ATOM 1822 N TYR A 123 3.217 -7.852 -6.212 1.00 0.00 N ATOM 1823 CA TYR A 123 3.459 -7.277 -7.567 1.00 0.00 C ATOM 1824 C TYR A 123 4.943 -6.900 -7.710 1.00 0.00 C ATOM 1825 O TYR A 123 5.630 -6.669 -6.736 1.00 0.00 O ATOM 1826 CB TYR A 123 2.578 -6.031 -7.751 1.00 0.00 C ATOM 1827 CG TYR A 123 1.373 -6.377 -8.596 1.00 0.00 C ATOM 1828 CD1 TYR A 123 0.208 -6.861 -7.990 1.00 0.00 C ATOM 1829 CD2 TYR A 123 1.426 -6.214 -9.986 1.00 0.00 C ATOM 1830 CE1 TYR A 123 -0.907 -7.182 -8.775 1.00 0.00 C ATOM 1831 CE2 TYR A 123 0.311 -6.538 -10.771 1.00 0.00 C ATOM 1832 CZ TYR A 123 -0.854 -7.020 -10.165 1.00 0.00 C ATOM 1833 OH TYR A 123 -1.953 -7.338 -10.938 1.00 0.00 O ATOM 0 H TYR A 123 3.885 -7.569 -5.495 1.00 0.00 H new ATOM 0 HA TYR A 123 3.207 -8.013 -8.331 1.00 0.00 H new ATOM 0 HB2 TYR A 123 2.257 -5.655 -6.780 1.00 0.00 H new ATOM 0 HB3 TYR A 123 3.152 -5.236 -8.227 1.00 0.00 H new ATOM 0 HD1 TYR A 123 0.169 -6.987 -6.918 1.00 0.00 H new ATOM 0 HD2 TYR A 123 2.325 -5.839 -10.452 1.00 0.00 H new ATOM 0 HE1 TYR A 123 -1.807 -7.554 -8.308 1.00 0.00 H new ATOM 0 HE2 TYR A 123 0.351 -6.416 -11.843 1.00 0.00 H new ATOM 0 HH TYR A 123 -1.750 -7.167 -11.881 1.00 0.00 H new ATOM 1843 N ASN A 124 5.436 -6.844 -8.920 1.00 0.00 N ATOM 1844 CA ASN A 124 6.873 -6.490 -9.134 1.00 0.00 C ATOM 1845 C ASN A 124 7.173 -5.130 -8.497 1.00 0.00 C ATOM 1846 O ASN A 124 6.636 -4.116 -8.890 1.00 0.00 O ATOM 1847 CB ASN A 124 7.164 -6.424 -10.634 1.00 0.00 C ATOM 1848 CG ASN A 124 8.675 -6.409 -10.861 1.00 0.00 C ATOM 1849 OD1 ASN A 124 9.423 -6.976 -10.089 1.00 0.00 O ATOM 1850 ND2 ASN A 124 9.163 -5.779 -11.896 1.00 0.00 N ATOM 0 H ASN A 124 4.905 -7.028 -9.771 1.00 0.00 H new ATOM 0 HA ASN A 124 7.503 -7.251 -8.672 1.00 0.00 H new ATOM 0 HB2 ASN A 124 6.718 -7.281 -11.140 1.00 0.00 H new ATOM 0 HB3 ASN A 124 6.712 -5.530 -11.064 1.00 0.00 H new ATOM 0 HD21 ASN A 124 10.170 -5.763 -12.055 1.00 0.00 H new ATOM 0 HD22 ASN A 124 8.537 -5.303 -12.545 1.00 0.00 H new ATOM 1857 N CYS A 125 8.029 -5.109 -7.513 1.00 0.00 N ATOM 1858 CA CYS A 125 8.372 -3.827 -6.827 1.00 0.00 C ATOM 1859 C CYS A 125 8.710 -2.730 -7.841 1.00 0.00 C ATOM 1860 O CYS A 125 8.794 -1.570 -7.491 1.00 0.00 O ATOM 1861 CB CYS A 125 9.592 -4.048 -5.931 1.00 0.00 C ATOM 1862 SG CYS A 125 9.112 -5.007 -4.477 1.00 0.00 S ATOM 0 H CYS A 125 8.511 -5.932 -7.150 1.00 0.00 H new ATOM 0 HA CYS A 125 7.508 -3.513 -6.241 1.00 0.00 H new ATOM 0 HB2 CYS A 125 10.371 -4.573 -6.484 1.00 0.00 H new ATOM 0 HB3 CYS A 125 10.009 -3.089 -5.625 1.00 0.00 H new ATOM 1867 N ASN A 126 8.933 -3.074 -9.081 1.00 0.00 N ATOM 1868 CA ASN A 126 9.297 -2.021 -10.076 1.00 0.00 C ATOM 1869 C ASN A 126 8.057 -1.518 -10.822 1.00 0.00 C ATOM 1870 O ASN A 126 7.973 -0.359 -11.176 1.00 0.00 O ATOM 1871 CB ASN A 126 10.297 -2.596 -11.081 1.00 0.00 C ATOM 1872 CG ASN A 126 10.623 -1.542 -12.140 1.00 0.00 C ATOM 1873 OD1 ASN A 126 11.626 -0.862 -12.047 1.00 0.00 O ATOM 1874 ND2 ASN A 126 9.812 -1.376 -13.150 1.00 0.00 N ATOM 0 H ASN A 126 8.880 -4.025 -9.446 1.00 0.00 H new ATOM 0 HA ASN A 126 9.743 -1.181 -9.543 1.00 0.00 H new ATOM 0 HB2 ASN A 126 11.208 -2.904 -10.567 1.00 0.00 H new ATOM 0 HB3 ASN A 126 9.882 -3.486 -11.554 1.00 0.00 H new ATOM 0 HD21 ASN A 126 10.020 -0.675 -13.861 1.00 0.00 H new ATOM 0 HD22 ASN A 126 8.970 -1.947 -13.227 1.00 0.00 H new ATOM 1881 N VAL A 127 7.088 -2.358 -11.062 1.00 0.00 N ATOM 1882 CA VAL A 127 5.870 -1.876 -11.778 1.00 0.00 C ATOM 1883 C VAL A 127 5.330 -0.682 -10.999 1.00 0.00 C ATOM 1884 O VAL A 127 5.144 -0.756 -9.801 1.00 0.00 O ATOM 1885 CB VAL A 127 4.818 -2.993 -11.825 1.00 0.00 C ATOM 1886 CG1 VAL A 127 3.436 -2.395 -12.111 1.00 0.00 C ATOM 1887 CG2 VAL A 127 5.180 -3.985 -12.933 1.00 0.00 C ATOM 0 H VAL A 127 7.084 -3.343 -10.798 1.00 0.00 H new ATOM 0 HA VAL A 127 6.109 -1.591 -12.803 1.00 0.00 H new ATOM 0 HB VAL A 127 4.796 -3.506 -10.864 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.694 -3.193 -12.143 1.00 0.00 H new ATOM 0 HG12 VAL A 127 3.175 -1.688 -11.323 1.00 0.00 H new ATOM 0 HG13 VAL A 127 3.455 -1.878 -13.070 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.434 -4.779 -12.968 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.204 -3.467 -13.892 1.00 0.00 H new ATOM 0 HG23 VAL A 127 6.160 -4.416 -12.729 1.00 0.00 H new ATOM 1897 N ARG A 128 5.110 0.437 -11.640 1.00 0.00 N ATOM 1898 CA ARG A 128 4.630 1.607 -10.872 1.00 0.00 C ATOM 1899 C ARG A 128 3.127 1.583 -10.765 1.00 0.00 C ATOM 1900 O ARG A 128 2.460 1.059 -11.632 1.00 0.00 O ATOM 1901 CB ARG A 128 5.074 2.882 -11.602 1.00 0.00 C ATOM 1902 CG ARG A 128 5.176 2.605 -13.107 1.00 0.00 C ATOM 1903 CD ARG A 128 5.383 3.921 -13.872 1.00 0.00 C ATOM 1904 NE ARG A 128 4.225 4.150 -14.783 1.00 0.00 N ATOM 1905 CZ ARG A 128 4.121 3.470 -15.890 1.00 0.00 C ATOM 1906 NH1 ARG A 128 4.710 2.310 -16.003 1.00 0.00 N ATOM 1907 NH2 ARG A 128 3.428 3.948 -16.887 1.00 0.00 N ATOM 0 H ARG A 128 5.241 0.583 -12.641 1.00 0.00 H new ATOM 0 HA ARG A 128 5.048 1.581 -9.866 1.00 0.00 H new ATOM 0 HB2 ARG A 128 4.361 3.686 -11.418 1.00 0.00 H new ATOM 0 HB3 ARG A 128 6.038 3.216 -11.218 1.00 0.00 H new ATOM 0 HG2 ARG A 128 6.005 1.926 -13.304 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.269 2.111 -13.456 1.00 0.00 H new ATOM 0 HD2 ARG A 128 5.479 4.751 -13.172 1.00 0.00 H new ATOM 0 HD3 ARG A 128 6.309 3.880 -14.446 1.00 0.00 H new ATOM 0 HE ARG A 128 3.514 4.839 -14.540 1.00 0.00 H new ATOM 0 HH11 ARG A 128 5.252 1.935 -15.224 1.00 0.00 H new ATOM 0 HH12 ARG A 128 4.628 1.779 -16.870 1.00 0.00 H new ATOM 0 HH21 ARG A 128 2.968 4.854 -16.800 1.00 0.00 H new ATOM 0 HH22 ARG A 128 3.347 3.416 -17.753 1.00 0.00 H new ATOM 1921 N LEU A 129 2.555 2.138 -9.716 1.00 0.00 N ATOM 1922 CA LEU A 129 1.054 2.073 -9.665 1.00 0.00 C ATOM 1923 C LEU A 129 0.513 3.317 -9.014 1.00 0.00 C ATOM 1924 O LEU A 129 1.213 3.940 -8.238 1.00 0.00 O ATOM 1925 CB LEU A 129 0.641 0.868 -8.808 1.00 0.00 C ATOM 1926 CG LEU A 129 0.633 -0.423 -9.642 1.00 0.00 C ATOM 1927 CD1 LEU A 129 1.587 -1.449 -9.022 1.00 0.00 C ATOM 1928 CD2 LEU A 129 -0.779 -1.001 -9.655 1.00 0.00 C ATOM 0 H LEU A 129 3.025 2.604 -8.940 1.00 0.00 H new ATOM 0 HA LEU A 129 0.662 1.983 -10.678 1.00 0.00 H new ATOM 0 HB2 LEU A 129 1.330 0.760 -7.970 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.349 1.039 -8.386 1.00 0.00 H new ATOM 0 HG LEU A 129 0.955 -0.197 -10.659 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.577 -2.362 -9.618 1.00 0.00 H new ATOM 0 HD12 LEU A 129 2.597 -1.040 -9.001 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.267 -1.676 -8.005 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.792 -1.917 -10.245 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.091 -1.222 -8.634 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.465 -0.277 -10.095 1.00 0.00 H new ATOM 1940 N PRO A 130 -0.719 3.674 -9.227 1.00 0.00 N ATOM 1941 CA PRO A 130 -1.252 4.842 -8.503 1.00 0.00 C ATOM 1942 C PRO A 130 -1.065 4.552 -7.010 1.00 0.00 C ATOM 1943 O PRO A 130 -1.224 3.421 -6.595 1.00 0.00 O ATOM 1944 CB PRO A 130 -2.727 4.856 -8.920 1.00 0.00 C ATOM 1945 CG PRO A 130 -2.974 3.683 -9.890 1.00 0.00 C ATOM 1946 CD PRO A 130 -1.638 2.977 -10.159 1.00 0.00 C ATOM 0 HA PRO A 130 -0.780 5.802 -8.711 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.369 4.764 -8.044 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.976 5.803 -9.400 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -3.692 2.983 -9.462 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -3.403 4.048 -10.823 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -1.694 1.908 -9.952 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -1.323 3.084 -11.197 1.00 0.00 H new ATOM 1954 N TYR A 131 -0.663 5.493 -6.202 1.00 0.00 N ATOM 1955 CA TYR A 131 -0.420 5.128 -4.771 1.00 0.00 C ATOM 1956 C TYR A 131 -0.858 6.216 -3.800 1.00 0.00 C ATOM 1957 O TYR A 131 -1.270 7.293 -4.186 1.00 0.00 O ATOM 1958 CB TYR A 131 1.080 4.906 -4.588 1.00 0.00 C ATOM 1959 CG TYR A 131 1.805 6.214 -4.797 1.00 0.00 C ATOM 1960 CD1 TYR A 131 1.970 6.721 -6.091 1.00 0.00 C ATOM 1961 CD2 TYR A 131 2.311 6.921 -3.699 1.00 0.00 C ATOM 1962 CE1 TYR A 131 2.640 7.935 -6.288 1.00 0.00 C ATOM 1963 CE2 TYR A 131 2.981 8.133 -3.895 1.00 0.00 C ATOM 1964 CZ TYR A 131 3.145 8.640 -5.191 1.00 0.00 C ATOM 1965 OH TYR A 131 3.805 9.837 -5.384 1.00 0.00 O ATOM 0 H TYR A 131 -0.496 6.467 -6.454 1.00 0.00 H new ATOM 0 HA TYR A 131 -1.005 4.234 -4.553 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.283 4.519 -3.589 1.00 0.00 H new ATOM 0 HB3 TYR A 131 1.439 4.160 -5.298 1.00 0.00 H new ATOM 0 HD1 TYR A 131 1.580 6.176 -6.938 1.00 0.00 H new ATOM 0 HD2 TYR A 131 2.184 6.530 -2.700 1.00 0.00 H new ATOM 0 HE1 TYR A 131 2.767 8.326 -7.287 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.372 8.678 -3.048 1.00 0.00 H new ATOM 0 HH TYR A 131 4.091 10.196 -4.518 1.00 0.00 H new ATOM 1975 N VAL A 132 -0.735 5.934 -2.524 1.00 0.00 N ATOM 1976 CA VAL A 132 -1.101 6.938 -1.486 1.00 0.00 C ATOM 1977 C VAL A 132 0.155 7.233 -0.665 1.00 0.00 C ATOM 1978 O VAL A 132 1.072 6.439 -0.628 1.00 0.00 O ATOM 1979 CB VAL A 132 -2.194 6.370 -0.577 1.00 0.00 C ATOM 1980 CG1 VAL A 132 -2.505 7.369 0.540 1.00 0.00 C ATOM 1981 CG2 VAL A 132 -3.463 6.118 -1.397 1.00 0.00 C ATOM 0 H VAL A 132 -0.394 5.044 -2.160 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.479 7.849 -1.950 1.00 0.00 H new ATOM 0 HB VAL A 132 -1.847 5.433 -0.141 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.283 6.962 1.186 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -1.605 7.550 1.127 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -2.849 8.307 0.104 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -4.241 5.714 -0.749 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -3.806 7.056 -1.834 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -3.247 5.405 -2.193 1.00 0.00 H new ATOM 1991 N CYS A 133 0.220 8.364 -0.024 1.00 0.00 N ATOM 1992 CA CYS A 133 1.442 8.689 0.771 1.00 0.00 C ATOM 1993 C CYS A 133 1.049 9.348 2.095 1.00 0.00 C ATOM 1994 O CYS A 133 0.265 10.274 2.127 1.00 0.00 O ATOM 1995 CB CYS A 133 2.318 9.647 -0.043 1.00 0.00 C ATOM 1996 SG CYS A 133 3.597 10.364 1.015 1.00 0.00 S ATOM 0 H CYS A 133 -0.512 9.075 -0.013 1.00 0.00 H new ATOM 0 HA CYS A 133 1.992 7.773 0.988 1.00 0.00 H new ATOM 0 HB2 CYS A 133 2.779 9.114 -0.875 1.00 0.00 H new ATOM 0 HB3 CYS A 133 1.704 10.438 -0.473 1.00 0.00 H new ATOM 2001 N LYS A 134 1.596 8.877 3.189 1.00 0.00 N ATOM 2002 CA LYS A 134 1.262 9.475 4.515 1.00 0.00 C ATOM 2003 C LYS A 134 2.402 10.403 4.942 1.00 0.00 C ATOM 2004 O LYS A 134 3.523 10.245 4.509 1.00 0.00 O ATOM 2005 CB LYS A 134 1.083 8.353 5.547 1.00 0.00 C ATOM 2006 CG LYS A 134 2.447 7.915 6.094 1.00 0.00 C ATOM 2007 CD LYS A 134 2.314 6.544 6.764 1.00 0.00 C ATOM 2008 CE LYS A 134 3.527 6.295 7.660 1.00 0.00 C ATOM 2009 NZ LYS A 134 3.406 4.956 8.302 1.00 0.00 N ATOM 0 H LYS A 134 2.260 8.103 3.219 1.00 0.00 H new ATOM 0 HA LYS A 134 0.336 10.046 4.447 1.00 0.00 H new ATOM 0 HB2 LYS A 134 0.449 8.698 6.364 1.00 0.00 H new ATOM 0 HB3 LYS A 134 0.577 7.504 5.088 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.176 7.867 5.285 1.00 0.00 H new ATOM 0 HG3 LYS A 134 2.815 8.648 6.812 1.00 0.00 H new ATOM 0 HD2 LYS A 134 1.398 6.503 7.354 1.00 0.00 H new ATOM 0 HD3 LYS A 134 2.241 5.763 6.007 1.00 0.00 H new ATOM 0 HE2 LYS A 134 4.443 6.346 7.072 1.00 0.00 H new ATOM 0 HE3 LYS A 134 3.594 7.071 8.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 3.880 4.971 9.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 2.401 4.722 8.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 3.853 4.239 7.696 1.00 0.00 H new ATOM 2023 N PHE A 135 2.126 11.372 5.777 1.00 0.00 N ATOM 2024 CA PHE A 135 3.212 12.307 6.212 1.00 0.00 C ATOM 2025 C PHE A 135 2.650 13.351 7.178 1.00 0.00 C ATOM 2026 O PHE A 135 1.739 14.085 6.852 1.00 0.00 O ATOM 2027 CB PHE A 135 3.797 13.030 4.993 1.00 0.00 C ATOM 2028 CG PHE A 135 2.689 13.680 4.198 1.00 0.00 C ATOM 2029 CD1 PHE A 135 2.295 14.993 4.491 1.00 0.00 C ATOM 2030 CD2 PHE A 135 2.056 12.976 3.164 1.00 0.00 C ATOM 2031 CE1 PHE A 135 1.270 15.598 3.752 1.00 0.00 C ATOM 2032 CE2 PHE A 135 1.032 13.582 2.428 1.00 0.00 C ATOM 2033 CZ PHE A 135 0.639 14.893 2.722 1.00 0.00 C ATOM 0 H PHE A 135 1.205 11.557 6.174 1.00 0.00 H new ATOM 0 HA PHE A 135 3.990 11.727 6.709 1.00 0.00 H new ATOM 0 HB2 PHE A 135 4.514 13.784 5.317 1.00 0.00 H new ATOM 0 HB3 PHE A 135 4.339 12.323 4.366 1.00 0.00 H new ATOM 0 HD1 PHE A 135 2.782 15.538 5.286 1.00 0.00 H new ATOM 0 HD2 PHE A 135 2.359 11.965 2.935 1.00 0.00 H new ATOM 0 HE1 PHE A 135 0.967 16.610 3.978 1.00 0.00 H new ATOM 0 HE2 PHE A 135 0.544 13.038 1.633 1.00 0.00 H new ATOM 0 HZ PHE A 135 -0.152 15.360 2.153 1.00 0.00 H new ATOM 2043 N THR A 136 3.195 13.438 8.360 1.00 0.00 N ATOM 2044 CA THR A 136 2.693 14.445 9.336 1.00 0.00 C ATOM 2045 C THR A 136 3.323 15.807 9.030 1.00 0.00 C ATOM 2046 O THR A 136 3.411 16.219 7.890 1.00 0.00 O ATOM 2047 CB THR A 136 3.067 14.014 10.758 1.00 0.00 C ATOM 2048 OG1 THR A 136 2.965 12.600 10.863 1.00 0.00 O ATOM 2049 CG2 THR A 136 2.120 14.672 11.762 1.00 0.00 C ATOM 0 H THR A 136 3.965 12.857 8.692 1.00 0.00 H new ATOM 0 HA THR A 136 1.608 14.519 9.256 1.00 0.00 H new ATOM 0 HB THR A 136 4.090 14.323 10.974 1.00 0.00 H new ATOM 0 HG1 THR A 136 3.568 12.180 10.215 1.00 0.00 H new ATOM 0 HG21 THR A 136 2.389 14.363 12.772 1.00 0.00 H new ATOM 0 HG22 THR A 136 2.200 15.756 11.681 1.00 0.00 H new ATOM 0 HG23 THR A 136 1.095 14.366 11.550 1.00 0.00 H new ATOM 2057 N ASP A 137 3.764 16.508 10.039 1.00 0.00 N ATOM 2058 CA ASP A 137 4.388 17.840 9.803 1.00 0.00 C ATOM 2059 C ASP A 137 5.181 18.257 11.044 1.00 0.00 C ATOM 2060 O ASP A 137 4.562 18.480 12.071 1.00 0.00 O ATOM 2061 CB ASP A 137 3.295 18.874 9.526 1.00 0.00 C ATOM 2062 CG ASP A 137 3.940 20.211 9.156 1.00 0.00 C ATOM 2063 OD1 ASP A 137 4.329 20.929 10.063 1.00 0.00 O ATOM 2064 OD2 ASP A 137 4.033 20.496 7.973 1.00 0.00 O ATOM 2065 OXT ASP A 137 6.394 18.345 10.946 1.00 0.00 O ATOM 0 H ASP A 137 3.719 16.216 11.015 1.00 0.00 H new ATOM 0 HA ASP A 137 5.058 17.781 8.945 1.00 0.00 H new ATOM 0 HB2 ASP A 137 2.652 18.531 8.715 1.00 0.00 H new ATOM 0 HB3 ASP A 137 2.662 18.994 10.405 1.00 0.00 H new TER 2070 ASP A 137