USER MOD reduce.3.24.130724 H: found=0, std=0, add=789, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 793 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 64 TYR OH : rot -90:sc= 0.0506 USER MOD Set 1.2: A 68 ASN : amide:sc= -5.13! C(o=-5.1!,f=-2.7!) USER MOD Set 2.1: A 65 LYS NZ :NH3+ 180:sc= 1.38 (180deg=1.23) USER MOD Set 2.2: A 71 TYR OH : rot 180:sc= -0.461 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 0.555 K(o=0.56,f=-4.9!) USER MOD Single : A 46 LYS NZ :NH3+ -167:sc= -0.0736 (180deg=-0.28) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0691) USER MOD Single : A 55 LYS NZ :NH3+ -169:sc= -0.0203 (180deg=-0.151) USER MOD Single : A 63 MET CE :methyl -160:sc= -0.112 (180deg=-0.78) USER MOD Single : A 73 SER OG : rot 170:sc= 0.182 USER MOD Single : A 74 THR OG1 : rot 106:sc= 0.311 USER MOD Single : A 75 GLN : amide:sc= -0.942 K(o=-0.94,f=-5.8!) USER MOD Single : A 76 GLN : amide:sc= -0.213 X(o=-0.21,f=-0.085) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0735) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.105 USER MOD Single : A 88 ASN : amide:sc= -0.049 X(o=-0.049,f=-0.019) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 92 LYS NZ :NH3+ -155:sc= -0.0692 (180deg=-0.546) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN : amide:sc= 0.627 K(o=0.63,f=-5.4!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 15:sc= -2.67! USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -2.56! K(o=-2.6!,f=-0.062) USER MOD Single : A 112 TYR OH : rot 66:sc= 0.681 USER MOD Single : A 113 GLN : amide:sc= -1.38 K(o=-1.4,f=-6.2!) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 TYR OH : rot -106:sc= 0.442 USER MOD Single : A 127 SER OG : rot 151:sc= 1.18 USER MOD Single : A 133 LYS NZ :NH3+ -171:sc= -0.0135 (180deg=-0.116) USER MOD Single : A 137 SER OG : rot 13:sc= 1.19 USER MOD Single : A 139 ASN : amide:sc= -1.34 K(o=-1.3,f=-1.9) USER MOD Single : A 145 ASN : amide:sc= -0.433 K(o=-0.43,f=-1.9!) USER MOD Single : A 148 ASN : amide:sc= -0.914 K(o=-0.91,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 39 3.110 5.396 -1.102 1.00 31.31 N ATOM 2 CA MET A 39 4.373 4.717 -1.386 1.00 14.42 C ATOM 3 C MET A 39 4.089 3.377 -2.031 1.00 24.05 C ATOM 4 O MET A 39 3.793 2.402 -1.344 1.00 64.03 O ATOM 5 CB MET A 39 5.248 4.539 -0.125 1.00 60.11 C ATOM 6 CG MET A 39 5.662 5.831 0.577 1.00 3.03 C ATOM 7 SD MET A 39 4.288 6.695 1.375 1.00 24.04 S ATOM 8 CE MET A 39 5.141 8.149 1.998 1.00 31.10 C ATOM 0 HA MET A 39 4.942 5.345 -2.071 1.00 14.42 H new ATOM 0 HB2 MET A 39 4.706 3.917 0.587 1.00 60.11 H new ATOM 0 HB3 MET A 39 6.149 3.993 -0.404 1.00 60.11 H new ATOM 0 HG2 MET A 39 6.419 5.601 1.326 1.00 3.03 H new ATOM 0 HG3 MET A 39 6.126 6.497 -0.151 1.00 3.03 H new ATOM 0 HE1 MET A 39 4.432 8.791 2.520 1.00 31.10 H new ATOM 0 HE2 MET A 39 5.928 7.842 2.687 1.00 31.10 H new ATOM 0 HE3 MET A 39 5.582 8.697 1.165 1.00 31.10 H new ATOM 20 N SER A 40 4.170 3.330 -3.339 1.00 42.53 N ATOM 21 CA SER A 40 3.801 2.158 -4.096 1.00 73.41 C ATOM 22 C SER A 40 4.994 1.214 -4.362 1.00 32.10 C ATOM 23 O SER A 40 5.400 0.995 -5.511 1.00 20.23 O ATOM 24 CB SER A 40 3.123 2.593 -5.399 1.00 35.12 C ATOM 25 OG SER A 40 2.032 3.478 -5.118 1.00 64.25 O ATOM 0 H SER A 40 4.496 4.109 -3.912 1.00 42.53 H new ATOM 0 HA SER A 40 3.099 1.577 -3.498 1.00 73.41 H new ATOM 0 HB2 SER A 40 3.846 3.090 -6.046 1.00 35.12 H new ATOM 0 HB3 SER A 40 2.761 1.718 -5.939 1.00 35.12 H new ATOM 0 HG SER A 40 1.607 3.751 -5.958 1.00 64.25 H new ATOM 31 N ARG A 41 5.562 0.704 -3.292 1.00 22.25 N ATOM 32 CA ARG A 41 6.618 -0.296 -3.336 1.00 45.15 C ATOM 33 C ARG A 41 6.471 -1.167 -2.108 1.00 61.23 C ATOM 34 O ARG A 41 5.988 -0.673 -1.082 1.00 74.54 O ATOM 35 CB ARG A 41 8.066 0.306 -3.364 1.00 0.15 C ATOM 36 CG ARG A 41 8.467 1.022 -4.657 1.00 62.54 C ATOM 37 CD ARG A 41 9.992 1.217 -4.767 1.00 74.43 C ATOM 38 NE ARG A 41 10.569 2.061 -3.707 1.00 4.43 N ATOM 39 CZ ARG A 41 11.868 2.061 -3.323 1.00 73.11 C ATOM 40 NH1 ARG A 41 12.715 1.160 -3.806 1.00 72.14 N ATOM 41 NH2 ARG A 41 12.291 2.942 -2.423 1.00 54.02 N ATOM 0 H ARG A 41 5.301 0.975 -2.344 1.00 22.25 H new ATOM 0 HA ARG A 41 6.505 -0.854 -4.265 1.00 45.15 H new ATOM 0 HB2 ARG A 41 8.162 1.009 -2.537 1.00 0.15 H new ATOM 0 HB3 ARG A 41 8.777 -0.500 -3.182 1.00 0.15 H new ATOM 0 HG2 ARG A 41 8.113 0.447 -5.513 1.00 62.54 H new ATOM 0 HG3 ARG A 41 7.974 1.993 -4.700 1.00 62.54 H new ATOM 0 HD2 ARG A 41 10.475 0.240 -4.742 1.00 74.43 H new ATOM 0 HD3 ARG A 41 10.222 1.661 -5.735 1.00 74.43 H new ATOM 0 HE ARG A 41 9.938 2.699 -3.222 1.00 4.43 H new ATOM 0 HH11 ARG A 41 12.389 0.460 -4.472 1.00 72.14 H new ATOM 0 HH12 ARG A 41 13.691 1.168 -3.511 1.00 72.14 H new ATOM 0 HH21 ARG A 41 11.638 3.616 -2.023 1.00 54.02 H new ATOM 0 HH22 ARG A 41 13.269 2.944 -2.132 1.00 54.02 H new ATOM 55 N PRO A 42 6.821 -2.475 -2.187 1.00 4.21 N ATOM 56 CA PRO A 42 6.826 -3.363 -1.015 1.00 44.22 C ATOM 57 C PRO A 42 7.679 -2.753 0.093 1.00 64.33 C ATOM 58 O PRO A 42 8.618 -1.976 -0.200 1.00 32.11 O ATOM 59 CB PRO A 42 7.473 -4.643 -1.537 1.00 53.40 C ATOM 60 CG PRO A 42 7.197 -4.633 -2.997 1.00 64.40 C ATOM 61 CD PRO A 42 7.208 -3.191 -3.415 1.00 32.43 C ATOM 0 HA PRO A 42 5.833 -3.530 -0.597 1.00 44.22 H new ATOM 0 HB2 PRO A 42 8.544 -4.656 -1.336 1.00 53.40 H new ATOM 0 HB3 PRO A 42 7.048 -5.526 -1.059 1.00 53.40 H new ATOM 0 HG2 PRO A 42 7.952 -5.202 -3.540 1.00 64.40 H new ATOM 0 HG3 PRO A 42 6.234 -5.094 -3.214 1.00 64.40 H new ATOM 0 HD2 PRO A 42 8.193 -2.882 -3.766 1.00 32.43 H new ATOM 0 HD3 PRO A 42 6.506 -3.003 -4.228 1.00 32.43 H new ATOM 69 N ASP A 43 7.351 -3.072 1.340 1.00 51.24 N ATOM 70 CA ASP A 43 7.974 -2.475 2.544 1.00 31.13 C ATOM 71 C ASP A 43 7.411 -1.083 2.765 1.00 22.10 C ATOM 72 O ASP A 43 6.762 -0.822 3.768 1.00 34.34 O ATOM 73 CB ASP A 43 9.536 -2.466 2.527 1.00 65.12 C ATOM 74 CG ASP A 43 10.163 -3.845 2.605 1.00 4.13 C ATOM 75 OD1 ASP A 43 10.267 -4.537 1.567 1.00 3.44 O ATOM 76 OD2 ASP A 43 10.578 -4.265 3.696 1.00 42.40 O ATOM 0 H ASP A 43 6.634 -3.763 1.560 1.00 51.24 H new ATOM 0 HA ASP A 43 7.716 -3.119 3.384 1.00 31.13 H new ATOM 0 HB2 ASP A 43 9.876 -1.975 1.615 1.00 65.12 H new ATOM 0 HB3 ASP A 43 9.895 -1.867 3.364 1.00 65.12 H new ATOM 81 N GLN A 44 7.544 -0.212 1.767 1.00 44.31 N ATOM 82 CA GLN A 44 7.008 1.142 1.873 1.00 55.50 C ATOM 83 C GLN A 44 5.484 1.137 1.871 1.00 3.42 C ATOM 84 O GLN A 44 4.842 2.122 2.255 1.00 2.05 O ATOM 85 CB GLN A 44 7.521 2.064 0.795 1.00 34.34 C ATOM 86 CG GLN A 44 9.012 2.273 0.801 1.00 13.34 C ATOM 87 CD GLN A 44 9.414 3.350 -0.171 1.00 40.13 C ATOM 88 OE1 GLN A 44 9.651 3.087 -1.321 1.00 60.13 O ATOM 89 NE2 GLN A 44 9.491 4.569 0.285 1.00 51.53 N ATOM 0 H GLN A 44 8.013 -0.417 0.885 1.00 44.31 H new ATOM 0 HA GLN A 44 7.363 1.529 2.828 1.00 55.50 H new ATOM 0 HB2 GLN A 44 7.228 1.664 -0.176 1.00 34.34 H new ATOM 0 HB3 GLN A 44 7.032 3.032 0.901 1.00 34.34 H new ATOM 0 HG2 GLN A 44 9.340 2.544 1.805 1.00 13.34 H new ATOM 0 HG3 GLN A 44 9.514 1.340 0.543 1.00 13.34 H new ATOM 0 HE21 GLN A 44 9.284 4.761 1.265 1.00 51.53 H new ATOM 0 HE22 GLN A 44 9.758 5.331 -0.338 1.00 51.53 H new ATOM 98 N ALA A 45 4.914 0.029 1.448 1.00 52.51 N ATOM 99 CA ALA A 45 3.481 -0.187 1.509 1.00 4.13 C ATOM 100 C ALA A 45 3.041 -0.252 2.966 1.00 61.30 C ATOM 101 O ALA A 45 1.902 0.073 3.304 1.00 23.43 O ATOM 102 CB ALA A 45 3.101 -1.462 0.772 1.00 53.53 C ATOM 0 H ALA A 45 5.433 -0.753 1.049 1.00 52.51 H new ATOM 0 HA ALA A 45 2.971 0.644 1.021 1.00 4.13 H new ATOM 0 HB1 ALA A 45 2.022 -1.607 0.829 1.00 53.53 H new ATOM 0 HB2 ALA A 45 3.402 -1.382 -0.273 1.00 53.53 H new ATOM 0 HB3 ALA A 45 3.606 -2.312 1.231 1.00 53.53 H new ATOM 108 N LYS A 46 3.964 -0.638 3.835 1.00 52.23 N ATOM 109 CA LYS A 46 3.694 -0.683 5.249 1.00 54.34 C ATOM 110 C LYS A 46 3.894 0.699 5.828 1.00 1.41 C ATOM 111 O LYS A 46 3.268 1.064 6.798 1.00 74.54 O ATOM 112 CB LYS A 46 4.639 -1.653 5.950 1.00 1.22 C ATOM 113 CG LYS A 46 4.577 -3.075 5.449 1.00 12.32 C ATOM 114 CD LYS A 46 5.468 -3.968 6.283 1.00 40.33 C ATOM 115 CE LYS A 46 5.450 -5.401 5.803 1.00 52.32 C ATOM 116 NZ LYS A 46 4.086 -5.954 5.723 1.00 1.35 N ATOM 0 H LYS A 46 4.908 -0.924 3.576 1.00 52.23 H new ATOM 0 HA LYS A 46 2.669 -1.021 5.401 1.00 54.34 H new ATOM 0 HB2 LYS A 46 5.660 -1.288 5.838 1.00 1.22 H new ATOM 0 HB3 LYS A 46 4.415 -1.649 7.017 1.00 1.22 H new ATOM 0 HG2 LYS A 46 3.550 -3.437 5.489 1.00 12.32 H new ATOM 0 HG3 LYS A 46 4.888 -3.113 4.405 1.00 12.32 H new ATOM 0 HD2 LYS A 46 6.490 -3.589 6.253 1.00 40.33 H new ATOM 0 HD3 LYS A 46 5.145 -3.931 7.323 1.00 40.33 H new ATOM 0 HE2 LYS A 46 5.919 -5.457 4.821 1.00 52.32 H new ATOM 0 HE3 LYS A 46 6.048 -6.014 6.478 1.00 52.32 H new ATOM 0 HZ1 LYS A 46 4.136 -6.986 5.606 1.00 1.35 H new ATOM 0 HZ2 LYS A 46 3.569 -5.730 6.597 1.00 1.35 H new ATOM 0 HZ3 LYS A 46 3.589 -5.537 4.910 1.00 1.35 H new ATOM 130 N VAL A 47 4.704 1.488 5.159 1.00 3.44 N ATOM 131 CA VAL A 47 5.006 2.835 5.607 1.00 21.52 C ATOM 132 C VAL A 47 3.817 3.756 5.349 1.00 62.52 C ATOM 133 O VAL A 47 3.418 4.537 6.212 1.00 30.24 O ATOM 134 CB VAL A 47 6.259 3.392 4.878 1.00 25.41 C ATOM 135 CG1 VAL A 47 6.585 4.805 5.322 1.00 14.34 C ATOM 136 CG2 VAL A 47 7.445 2.491 5.106 1.00 54.34 C ATOM 0 H VAL A 47 5.171 1.219 4.293 1.00 3.44 H new ATOM 0 HA VAL A 47 5.210 2.796 6.677 1.00 21.52 H new ATOM 0 HB VAL A 47 6.031 3.421 3.812 1.00 25.41 H new ATOM 0 HG11 VAL A 47 7.468 5.159 4.789 1.00 14.34 H new ATOM 0 HG12 VAL A 47 5.741 5.459 5.102 1.00 14.34 H new ATOM 0 HG13 VAL A 47 6.781 4.813 6.394 1.00 14.34 H new ATOM 0 HG21 VAL A 47 8.314 2.896 4.588 1.00 54.34 H new ATOM 0 HG22 VAL A 47 7.655 2.429 6.174 1.00 54.34 H new ATOM 0 HG23 VAL A 47 7.225 1.495 4.721 1.00 54.34 H new ATOM 146 N THR A 48 3.226 3.627 4.174 1.00 23.04 N ATOM 147 CA THR A 48 2.123 4.477 3.789 1.00 15.41 C ATOM 148 C THR A 48 0.871 4.226 4.659 1.00 62.41 C ATOM 149 O THR A 48 0.196 5.179 5.076 1.00 32.11 O ATOM 150 CB THR A 48 1.812 4.379 2.257 1.00 62.11 C ATOM 151 OG1 THR A 48 0.762 5.278 1.890 1.00 14.40 O ATOM 152 CG2 THR A 48 1.441 2.966 1.831 1.00 50.15 C ATOM 0 H THR A 48 3.495 2.939 3.471 1.00 23.04 H new ATOM 0 HA THR A 48 2.433 5.505 3.977 1.00 15.41 H new ATOM 0 HB THR A 48 2.729 4.658 1.738 1.00 62.11 H new ATOM 0 HG1 THR A 48 0.586 5.201 0.929 1.00 14.40 H new ATOM 0 HG21 THR A 48 1.235 2.951 0.761 1.00 50.15 H new ATOM 0 HG22 THR A 48 2.268 2.291 2.051 1.00 50.15 H new ATOM 0 HG23 THR A 48 0.554 2.643 2.376 1.00 50.15 H new ATOM 160 N VAL A 49 0.604 2.966 4.977 1.00 1.32 N ATOM 161 CA VAL A 49 -0.539 2.625 5.808 1.00 15.44 C ATOM 162 C VAL A 49 -0.286 3.047 7.258 1.00 64.02 C ATOM 163 O VAL A 49 -1.182 3.552 7.932 1.00 51.13 O ATOM 164 CB VAL A 49 -0.924 1.103 5.699 1.00 2.54 C ATOM 165 CG1 VAL A 49 0.249 0.200 6.009 1.00 12.15 C ATOM 166 CG2 VAL A 49 -2.105 0.754 6.596 1.00 33.34 C ATOM 0 H VAL A 49 1.162 2.168 4.673 1.00 1.32 H new ATOM 0 HA VAL A 49 -1.399 3.181 5.436 1.00 15.44 H new ATOM 0 HB VAL A 49 -1.218 0.934 4.663 1.00 2.54 H new ATOM 0 HG11 VAL A 49 -0.061 -0.841 5.922 1.00 12.15 H new ATOM 0 HG12 VAL A 49 1.057 0.398 5.305 1.00 12.15 H new ATOM 0 HG13 VAL A 49 0.597 0.391 7.024 1.00 12.15 H new ATOM 0 HG21 VAL A 49 -2.340 -0.305 6.492 1.00 33.34 H new ATOM 0 HG22 VAL A 49 -1.850 0.969 7.634 1.00 33.34 H new ATOM 0 HG23 VAL A 49 -2.971 1.348 6.305 1.00 33.34 H new ATOM 176 N ALA A 50 0.963 2.944 7.684 1.00 1.13 N ATOM 177 CA ALA A 50 1.335 3.271 9.036 1.00 32.35 C ATOM 178 C ALA A 50 1.171 4.750 9.291 1.00 1.04 C ATOM 179 O ALA A 50 0.671 5.154 10.333 1.00 60.01 O ATOM 180 CB ALA A 50 2.748 2.853 9.300 1.00 3.14 C ATOM 0 H ALA A 50 1.738 2.632 7.099 1.00 1.13 H new ATOM 0 HA ALA A 50 0.676 2.730 9.715 1.00 32.35 H new ATOM 0 HB1 ALA A 50 3.017 3.106 10.326 1.00 3.14 H new ATOM 0 HB2 ALA A 50 2.842 1.777 9.155 1.00 3.14 H new ATOM 0 HB3 ALA A 50 3.415 3.372 8.612 1.00 3.14 H new ATOM 186 N LYS A 51 1.528 5.572 8.296 1.00 14.51 N ATOM 187 CA LYS A 51 1.410 7.011 8.441 1.00 51.44 C ATOM 188 C LYS A 51 -0.054 7.437 8.564 1.00 4.40 C ATOM 189 O LYS A 51 -0.382 8.426 9.227 1.00 52.01 O ATOM 190 CB LYS A 51 2.076 7.732 7.275 1.00 4.53 C ATOM 191 CG LYS A 51 3.580 7.544 7.214 1.00 64.21 C ATOM 192 CD LYS A 51 4.160 8.230 5.990 1.00 12.22 C ATOM 193 CE LYS A 51 5.690 8.209 5.978 1.00 32.41 C ATOM 194 NZ LYS A 51 6.284 9.051 7.039 1.00 41.20 N ATOM 0 H LYS A 51 1.895 5.261 7.397 1.00 14.51 H new ATOM 0 HA LYS A 51 1.924 7.292 9.360 1.00 51.44 H new ATOM 0 HB2 LYS A 51 1.637 7.377 6.343 1.00 4.53 H new ATOM 0 HB3 LYS A 51 1.855 8.797 7.346 1.00 4.53 H new ATOM 0 HG2 LYS A 51 4.039 7.950 8.116 1.00 64.21 H new ATOM 0 HG3 LYS A 51 3.817 6.480 7.187 1.00 64.21 H new ATOM 0 HD2 LYS A 51 3.786 7.740 5.091 1.00 12.22 H new ATOM 0 HD3 LYS A 51 3.814 9.263 5.958 1.00 12.22 H new ATOM 0 HE2 LYS A 51 6.035 7.182 6.099 1.00 32.41 H new ATOM 0 HE3 LYS A 51 6.046 8.552 5.007 1.00 32.41 H new ATOM 0 HZ1 LYS A 51 7.311 9.122 6.892 1.00 41.20 H new ATOM 0 HZ2 LYS A 51 5.863 10.001 7.005 1.00 41.20 H new ATOM 0 HZ3 LYS A 51 6.096 8.623 7.968 1.00 41.20 H new ATOM 208 N GLY A 52 -0.930 6.634 8.026 1.00 61.11 N ATOM 209 CA GLY A 52 -2.320 6.932 8.129 1.00 74.33 C ATOM 210 C GLY A 52 -2.850 6.519 9.475 1.00 33.45 C ATOM 211 O GLY A 52 -3.730 7.174 10.056 1.00 41.41 O ATOM 0 H GLY A 52 -0.704 5.779 7.518 1.00 61.11 H new ATOM 0 HA2 GLY A 52 -2.481 8.000 7.980 1.00 74.33 H new ATOM 0 HA3 GLY A 52 -2.868 6.415 7.342 1.00 74.33 H new ATOM 215 N ASP A 53 -2.286 5.471 10.011 1.00 74.34 N ATOM 216 CA ASP A 53 -2.765 4.933 11.251 1.00 12.04 C ATOM 217 C ASP A 53 -2.153 5.563 12.478 1.00 14.22 C ATOM 218 O ASP A 53 -2.749 5.566 13.556 1.00 35.15 O ATOM 219 CB ASP A 53 -2.873 3.417 11.234 1.00 63.35 C ATOM 220 CG ASP A 53 -3.982 3.006 10.255 1.00 44.44 C ATOM 221 OD1 ASP A 53 -5.105 3.579 10.327 1.00 41.34 O ATOM 222 OD2 ASP A 53 -3.765 2.144 9.376 1.00 74.54 O ATOM 0 H ASP A 53 -1.493 4.973 9.606 1.00 74.34 H new ATOM 0 HA ASP A 53 -3.803 5.251 11.348 1.00 12.04 H new ATOM 0 HB2 ASP A 53 -1.923 2.975 10.934 1.00 63.35 H new ATOM 0 HB3 ASP A 53 -3.096 3.044 12.234 1.00 63.35 H new ATOM 227 N ILE A 54 -1.006 6.187 12.311 1.00 51.41 N ATOM 228 CA ILE A 54 -0.468 7.031 13.374 1.00 31.15 C ATOM 229 C ILE A 54 -1.314 8.300 13.468 1.00 74.53 C ATOM 230 O ILE A 54 -1.469 8.891 14.540 1.00 55.52 O ATOM 231 CB ILE A 54 1.016 7.407 13.172 1.00 51.02 C ATOM 232 CG1 ILE A 54 1.215 8.034 11.795 1.00 45.11 C ATOM 233 CG2 ILE A 54 1.903 6.198 13.385 1.00 22.24 C ATOM 234 CD1 ILE A 54 2.627 8.392 11.441 1.00 53.13 C ATOM 0 H ILE A 54 -0.432 6.133 11.469 1.00 51.41 H new ATOM 0 HA ILE A 54 -0.513 6.456 14.299 1.00 31.15 H new ATOM 0 HB ILE A 54 1.305 8.150 13.915 1.00 51.02 H new ATOM 0 HG12 ILE A 54 0.836 7.342 11.043 1.00 45.11 H new ATOM 0 HG13 ILE A 54 0.605 8.936 11.735 1.00 45.11 H new ATOM 0 HG21 ILE A 54 2.945 6.481 13.239 1.00 22.24 H new ATOM 0 HG22 ILE A 54 1.768 5.822 14.399 1.00 22.24 H new ATOM 0 HG23 ILE A 54 1.635 5.420 12.671 1.00 22.24 H new ATOM 0 HD11 ILE A 54 2.652 8.829 10.443 1.00 53.13 H new ATOM 0 HD12 ILE A 54 3.011 9.113 12.163 1.00 53.13 H new ATOM 0 HD13 ILE A 54 3.245 7.495 11.460 1.00 53.13 H new ATOM 246 N LYS A 55 -1.902 8.693 12.335 1.00 1.55 N ATOM 247 CA LYS A 55 -2.810 9.831 12.316 1.00 13.45 C ATOM 248 C LYS A 55 -4.132 9.466 12.951 1.00 33.24 C ATOM 249 O LYS A 55 -4.835 10.322 13.486 1.00 52.30 O ATOM 250 CB LYS A 55 -3.009 10.370 10.910 1.00 44.22 C ATOM 251 CG LYS A 55 -2.047 11.495 10.532 1.00 34.31 C ATOM 252 CD LYS A 55 -0.587 11.104 10.667 1.00 12.33 C ATOM 253 CE LYS A 55 0.340 12.261 10.344 1.00 53.23 C ATOM 254 NZ LYS A 55 0.162 12.762 8.966 1.00 14.01 N ATOM 0 H LYS A 55 -1.765 8.242 11.430 1.00 1.55 H new ATOM 0 HA LYS A 55 -2.354 10.628 12.903 1.00 13.45 H new ATOM 0 HB2 LYS A 55 -2.892 9.552 10.199 1.00 44.22 H new ATOM 0 HB3 LYS A 55 -4.032 10.733 10.813 1.00 44.22 H new ATOM 0 HG2 LYS A 55 -2.241 11.800 9.504 1.00 34.31 H new ATOM 0 HG3 LYS A 55 -2.244 12.361 11.164 1.00 34.31 H new ATOM 0 HD2 LYS A 55 -0.396 10.758 11.683 1.00 12.33 H new ATOM 0 HD3 LYS A 55 -0.372 10.269 10.000 1.00 12.33 H new ATOM 0 HE2 LYS A 55 0.161 13.073 11.048 1.00 53.23 H new ATOM 0 HE3 LYS A 55 1.374 11.943 10.481 1.00 53.23 H new ATOM 0 HZ1 LYS A 55 0.935 13.418 8.733 1.00 14.01 H new ATOM 0 HZ2 LYS A 55 0.174 11.962 8.301 1.00 14.01 H new ATOM 0 HZ3 LYS A 55 -0.748 13.259 8.892 1.00 14.01 H new ATOM 268 N ALA A 56 -4.456 8.194 12.889 1.00 4.22 N ATOM 269 CA ALA A 56 -5.630 7.651 13.536 1.00 42.13 C ATOM 270 C ALA A 56 -5.523 7.833 15.047 1.00 53.10 C ATOM 271 O ALA A 56 -6.489 8.226 15.718 1.00 25.24 O ATOM 272 CB ALA A 56 -5.733 6.185 13.210 1.00 12.13 C ATOM 0 H ALA A 56 -3.906 7.500 12.383 1.00 4.22 H new ATOM 0 HA ALA A 56 -6.518 8.174 13.180 1.00 42.13 H new ATOM 0 HB1 ALA A 56 -6.615 5.766 13.693 1.00 12.13 H new ATOM 0 HB2 ALA A 56 -5.815 6.057 12.131 1.00 12.13 H new ATOM 0 HB3 ALA A 56 -4.843 5.669 13.570 1.00 12.13 H new ATOM 278 N ILE A 57 -4.337 7.557 15.566 1.00 73.11 N ATOM 279 CA ILE A 57 -4.052 7.686 16.999 1.00 2.22 C ATOM 280 C ILE A 57 -4.191 9.141 17.420 1.00 4.12 C ATOM 281 O ILE A 57 -4.784 9.445 18.436 1.00 33.14 O ATOM 282 CB ILE A 57 -2.619 7.236 17.332 1.00 70.14 C ATOM 283 CG1 ILE A 57 -2.330 5.899 16.690 1.00 24.12 C ATOM 284 CG2 ILE A 57 -2.459 7.120 18.846 1.00 52.05 C ATOM 285 CD1 ILE A 57 -0.891 5.503 16.742 1.00 20.45 C ATOM 0 H ILE A 57 -3.542 7.237 15.013 1.00 73.11 H new ATOM 0 HA ILE A 57 -4.762 7.053 17.531 1.00 2.22 H new ATOM 0 HB ILE A 57 -1.917 7.974 16.945 1.00 70.14 H new ATOM 0 HG12 ILE A 57 -2.926 5.132 17.185 1.00 24.12 H new ATOM 0 HG13 ILE A 57 -2.651 5.930 15.649 1.00 24.12 H new ATOM 0 HG21 ILE A 57 -1.444 6.801 19.081 1.00 52.05 H new ATOM 0 HG22 ILE A 57 -2.651 8.089 19.307 1.00 52.05 H new ATOM 0 HG23 ILE A 57 -3.168 6.387 19.232 1.00 52.05 H new ATOM 0 HD11 ILE A 57 -0.763 4.533 16.262 1.00 20.45 H new ATOM 0 HD12 ILE A 57 -0.290 6.248 16.221 1.00 20.45 H new ATOM 0 HD13 ILE A 57 -0.569 5.439 17.781 1.00 20.45 H new ATOM 297 N ALA A 58 -3.681 10.036 16.584 1.00 54.33 N ATOM 298 CA ALA A 58 -3.727 11.481 16.842 1.00 21.23 C ATOM 299 C ALA A 58 -5.164 11.990 17.003 1.00 30.13 C ATOM 300 O ALA A 58 -5.408 12.995 17.672 1.00 64.33 O ATOM 301 CB ALA A 58 -3.029 12.234 15.725 1.00 71.31 C ATOM 0 H ALA A 58 -3.223 9.788 15.707 1.00 54.33 H new ATOM 0 HA ALA A 58 -3.207 11.662 17.783 1.00 21.23 H new ATOM 0 HB1 ALA A 58 -3.069 13.304 15.927 1.00 71.31 H new ATOM 0 HB2 ALA A 58 -1.988 11.915 15.666 1.00 71.31 H new ATOM 0 HB3 ALA A 58 -3.527 12.024 14.778 1.00 71.31 H new ATOM 307 N ALA A 59 -6.102 11.281 16.411 1.00 40.32 N ATOM 308 CA ALA A 59 -7.493 11.646 16.489 1.00 10.20 C ATOM 309 C ALA A 59 -8.116 11.068 17.753 1.00 44.43 C ATOM 310 O ALA A 59 -8.962 11.693 18.389 1.00 23.14 O ATOM 311 CB ALA A 59 -8.234 11.157 15.258 1.00 12.30 C ATOM 0 H ALA A 59 -5.919 10.439 15.865 1.00 40.32 H new ATOM 0 HA ALA A 59 -7.571 12.732 16.529 1.00 10.20 H new ATOM 0 HB1 ALA A 59 -9.284 11.439 15.330 1.00 12.30 H new ATOM 0 HB2 ALA A 59 -7.797 11.608 14.367 1.00 12.30 H new ATOM 0 HB3 ALA A 59 -8.154 10.072 15.192 1.00 12.30 H new ATOM 317 N ALA A 60 -7.676 9.889 18.138 1.00 42.34 N ATOM 318 CA ALA A 60 -8.217 9.245 19.316 1.00 64.33 C ATOM 319 C ALA A 60 -7.589 9.802 20.587 1.00 21.44 C ATOM 320 O ALA A 60 -8.222 9.843 21.627 1.00 11.34 O ATOM 321 CB ALA A 60 -8.061 7.749 19.240 1.00 34.45 C ATOM 0 H ALA A 60 -6.950 9.360 17.656 1.00 42.34 H new ATOM 0 HA ALA A 60 -9.284 9.464 19.352 1.00 64.33 H new ATOM 0 HB1 ALA A 60 -8.477 7.294 20.139 1.00 34.45 H new ATOM 0 HB2 ALA A 60 -8.590 7.372 18.365 1.00 34.45 H new ATOM 0 HB3 ALA A 60 -7.003 7.497 19.161 1.00 34.45 H new ATOM 327 N LEU A 61 -6.367 10.275 20.500 1.00 63.40 N ATOM 328 CA LEU A 61 -5.728 10.894 21.646 1.00 72.32 C ATOM 329 C LEU A 61 -6.433 12.234 21.913 1.00 53.11 C ATOM 330 O LEU A 61 -6.530 12.689 23.042 1.00 40.33 O ATOM 331 CB LEU A 61 -4.218 11.057 21.397 1.00 23.15 C ATOM 332 CG LEU A 61 -3.297 10.880 22.627 1.00 30.54 C ATOM 333 CD1 LEU A 61 -1.851 10.892 22.211 1.00 3.23 C ATOM 334 CD2 LEU A 61 -3.531 11.948 23.670 1.00 53.11 C ATOM 0 H LEU A 61 -5.796 10.245 19.655 1.00 63.40 H new ATOM 0 HA LEU A 61 -5.822 10.267 22.532 1.00 72.32 H new ATOM 0 HB2 LEU A 61 -3.917 10.335 20.638 1.00 23.15 H new ATOM 0 HB3 LEU A 61 -4.045 12.049 20.980 1.00 23.15 H new ATOM 0 HG LEU A 61 -3.542 9.915 23.071 1.00 30.54 H new ATOM 0 HD11 LEU A 61 -1.219 10.766 23.090 1.00 3.23 H new ATOM 0 HD12 LEU A 61 -1.667 10.076 21.512 1.00 3.23 H new ATOM 0 HD13 LEU A 61 -1.619 11.842 21.730 1.00 3.23 H new ATOM 0 HD21 LEU A 61 -2.863 11.784 24.515 1.00 53.11 H new ATOM 0 HD22 LEU A 61 -3.334 12.929 23.237 1.00 53.11 H new ATOM 0 HD23 LEU A 61 -4.565 11.903 24.011 1.00 53.11 H new ATOM 346 N ASP A 62 -7.001 12.806 20.853 1.00 32.40 N ATOM 347 CA ASP A 62 -7.843 14.009 20.946 1.00 23.21 C ATOM 348 C ASP A 62 -9.172 13.649 21.665 1.00 45.34 C ATOM 349 O ASP A 62 -9.827 14.485 22.302 1.00 33.53 O ATOM 350 CB ASP A 62 -8.104 14.579 19.534 1.00 43.51 C ATOM 351 CG ASP A 62 -9.048 15.774 19.498 1.00 65.04 C ATOM 352 OD1 ASP A 62 -10.276 15.567 19.381 1.00 41.43 O ATOM 353 OD2 ASP A 62 -8.576 16.950 19.530 1.00 14.41 O ATOM 0 H ASP A 62 -6.894 12.452 19.902 1.00 32.40 H new ATOM 0 HA ASP A 62 -7.332 14.777 21.527 1.00 23.21 H new ATOM 0 HB2 ASP A 62 -7.151 14.872 19.093 1.00 43.51 H new ATOM 0 HB3 ASP A 62 -8.516 13.788 18.907 1.00 43.51 H new ATOM 358 N MET A 63 -9.524 12.384 21.605 1.00 11.03 N ATOM 359 CA MET A 63 -10.698 11.876 22.293 1.00 4.22 C ATOM 360 C MET A 63 -10.379 11.679 23.786 1.00 72.42 C ATOM 361 O MET A 63 -11.206 11.954 24.628 1.00 35.44 O ATOM 362 CB MET A 63 -11.184 10.578 21.647 1.00 21.11 C ATOM 363 CG MET A 63 -12.397 9.945 22.308 1.00 72.40 C ATOM 364 SD MET A 63 -12.868 8.384 21.522 1.00 73.32 S ATOM 365 CE MET A 63 -13.277 8.961 19.877 1.00 32.41 C ATOM 0 H MET A 63 -9.009 11.677 21.080 1.00 11.03 H new ATOM 0 HA MET A 63 -11.506 12.602 22.208 1.00 4.22 H new ATOM 0 HB2 MET A 63 -11.421 10.777 20.602 1.00 21.11 H new ATOM 0 HB3 MET A 63 -10.367 9.857 21.657 1.00 21.11 H new ATOM 0 HG2 MET A 63 -12.183 9.769 23.362 1.00 72.40 H new ATOM 0 HG3 MET A 63 -13.236 10.639 22.264 1.00 72.40 H new ATOM 0 HE1 MET A 63 -13.908 8.225 19.380 1.00 32.41 H new ATOM 0 HE2 MET A 63 -13.811 9.909 19.946 1.00 32.41 H new ATOM 0 HE3 MET A 63 -12.361 9.101 19.302 1.00 32.41 H new ATOM 375 N TYR A 64 -9.158 11.220 24.098 1.00 43.14 N ATOM 376 CA TYR A 64 -8.690 11.128 25.505 1.00 23.34 C ATOM 377 C TYR A 64 -8.575 12.538 26.056 1.00 43.45 C ATOM 378 O TYR A 64 -8.861 12.807 27.217 1.00 2.14 O ATOM 379 CB TYR A 64 -7.315 10.493 25.567 1.00 31.11 C ATOM 380 CG TYR A 64 -6.784 10.408 26.975 1.00 75.54 C ATOM 381 CD1 TYR A 64 -7.120 9.358 27.798 1.00 3.51 C ATOM 382 CD2 TYR A 64 -5.935 11.372 27.479 1.00 31.15 C ATOM 383 CE1 TYR A 64 -6.643 9.260 29.035 1.00 1.12 C ATOM 384 CE2 TYR A 64 -5.459 11.280 28.743 1.00 4.43 C ATOM 385 CZ TYR A 64 -5.814 10.218 29.516 1.00 74.14 C ATOM 386 OH TYR A 64 -5.320 10.093 30.758 1.00 15.11 O ATOM 0 H TYR A 64 -8.476 10.907 23.407 1.00 43.14 H new ATOM 0 HA TYR A 64 -9.394 10.525 26.078 1.00 23.34 H new ATOM 0 HB2 TYR A 64 -7.360 9.492 25.138 1.00 31.11 H new ATOM 0 HB3 TYR A 64 -6.623 11.071 24.955 1.00 31.11 H new ATOM 0 HD1 TYR A 64 -7.788 8.594 27.430 1.00 3.51 H new ATOM 0 HD2 TYR A 64 -5.647 12.208 26.859 1.00 31.15 H new ATOM 0 HE1 TYR A 64 -6.916 8.419 29.655 1.00 1.12 H new ATOM 0 HE2 TYR A 64 -4.803 12.043 29.135 1.00 4.43 H new ATOM 0 HH TYR A 64 -5.925 10.527 31.396 1.00 15.11 H new ATOM 396 N LYS A 65 -8.121 13.422 25.194 1.00 12.41 N ATOM 397 CA LYS A 65 -8.056 14.843 25.444 1.00 70.24 C ATOM 398 C LYS A 65 -9.421 15.359 25.852 1.00 43.32 C ATOM 399 O LYS A 65 -9.536 16.289 26.621 1.00 74.15 O ATOM 400 CB LYS A 65 -7.618 15.481 24.160 1.00 15.40 C ATOM 401 CG LYS A 65 -7.780 16.965 24.018 1.00 70.44 C ATOM 402 CD LYS A 65 -7.459 17.303 22.594 1.00 63.42 C ATOM 403 CE LYS A 65 -7.599 18.745 22.269 1.00 15.25 C ATOM 404 NZ LYS A 65 -7.235 18.975 20.864 1.00 53.33 N ATOM 0 H LYS A 65 -7.776 13.161 24.270 1.00 12.41 H new ATOM 0 HA LYS A 65 -7.362 15.074 26.252 1.00 70.24 H new ATOM 0 HB2 LYS A 65 -6.564 15.245 24.013 1.00 15.40 H new ATOM 0 HB3 LYS A 65 -8.168 15.006 23.347 1.00 15.40 H new ATOM 0 HG2 LYS A 65 -8.797 17.268 24.267 1.00 70.44 H new ATOM 0 HG3 LYS A 65 -7.114 17.493 24.700 1.00 70.44 H new ATOM 0 HD2 LYS A 65 -6.437 16.990 22.379 1.00 63.42 H new ATOM 0 HD3 LYS A 65 -8.113 16.728 21.939 1.00 63.42 H new ATOM 0 HE2 LYS A 65 -8.624 19.070 22.447 1.00 15.25 H new ATOM 0 HE3 LYS A 65 -6.959 19.338 22.922 1.00 15.25 H new ATOM 0 HZ1 LYS A 65 -7.334 19.986 20.641 1.00 53.33 H new ATOM 0 HZ2 LYS A 65 -6.250 18.681 20.708 1.00 53.33 H new ATOM 0 HZ3 LYS A 65 -7.863 18.421 20.247 1.00 53.33 H new ATOM 418 N LEU A 66 -10.443 14.771 25.314 1.00 35.35 N ATOM 419 CA LEU A 66 -11.771 15.104 25.718 1.00 42.34 C ATOM 420 C LEU A 66 -12.161 14.328 26.997 1.00 2.33 C ATOM 421 O LEU A 66 -12.841 14.876 27.868 1.00 70.35 O ATOM 422 CB LEU A 66 -12.756 14.831 24.585 1.00 75.25 C ATOM 423 CG LEU A 66 -14.201 15.251 24.832 1.00 50.14 C ATOM 424 CD1 LEU A 66 -14.306 16.748 25.029 1.00 73.15 C ATOM 425 CD2 LEU A 66 -15.070 14.810 23.687 1.00 11.02 C ATOM 0 H LEU A 66 -10.382 14.055 24.590 1.00 35.35 H new ATOM 0 HA LEU A 66 -11.809 16.169 25.949 1.00 42.34 H new ATOM 0 HB2 LEU A 66 -12.399 15.342 23.691 1.00 75.25 H new ATOM 0 HB3 LEU A 66 -12.742 13.763 24.369 1.00 75.25 H new ATOM 0 HG LEU A 66 -14.547 14.767 25.745 1.00 50.14 H new ATOM 0 HD11 LEU A 66 -15.347 17.020 25.203 1.00 73.15 H new ATOM 0 HD12 LEU A 66 -13.705 17.045 25.888 1.00 73.15 H new ATOM 0 HD13 LEU A 66 -13.942 17.259 24.138 1.00 73.15 H new ATOM 0 HD21 LEU A 66 -16.100 15.115 23.873 1.00 11.02 H new ATOM 0 HD22 LEU A 66 -14.717 15.270 22.764 1.00 11.02 H new ATOM 0 HD23 LEU A 66 -15.024 13.725 23.592 1.00 11.02 H new ATOM 437 N ASP A 67 -11.682 13.077 27.135 1.00 52.14 N ATOM 438 CA ASP A 67 -12.058 12.237 28.290 1.00 55.43 C ATOM 439 C ASP A 67 -11.417 12.734 29.592 1.00 2.04 C ATOM 440 O ASP A 67 -11.979 12.592 30.656 1.00 33.22 O ATOM 441 CB ASP A 67 -11.602 10.784 28.048 1.00 52.51 C ATOM 442 CG ASP A 67 -12.016 9.830 29.170 1.00 53.11 C ATOM 443 OD1 ASP A 67 -13.208 9.411 29.214 1.00 63.31 O ATOM 444 OD2 ASP A 67 -11.156 9.482 30.031 1.00 1.24 O ATOM 0 H ASP A 67 -11.045 12.631 26.475 1.00 52.14 H new ATOM 0 HA ASP A 67 -13.142 12.292 28.391 1.00 55.43 H new ATOM 0 HB2 ASP A 67 -12.021 10.430 27.106 1.00 52.51 H new ATOM 0 HB3 ASP A 67 -10.517 10.763 27.943 1.00 52.51 H new ATOM 449 N ASN A 68 -10.288 13.424 29.501 1.00 32.22 N ATOM 450 CA ASN A 68 -9.666 14.023 30.704 1.00 14.14 C ATOM 451 C ASN A 68 -9.439 15.455 30.517 1.00 65.51 C ATOM 452 O ASN A 68 -8.645 16.042 31.263 1.00 53.33 O ATOM 453 CB ASN A 68 -8.322 13.422 31.113 1.00 24.10 C ATOM 454 CG ASN A 68 -8.319 11.991 31.649 1.00 23.03 C ATOM 455 OD1 ASN A 68 -7.530 11.667 32.537 1.00 4.43 O ATOM 456 ND2 ASN A 68 -9.125 11.133 31.110 1.00 1.03 N ATOM 0 H ASN A 68 -9.782 13.588 28.631 1.00 32.22 H new ATOM 0 HA ASN A 68 -10.387 13.810 31.493 1.00 14.14 H new ATOM 0 HB2 ASN A 68 -7.661 13.457 30.247 1.00 24.10 H new ATOM 0 HB3 ASN A 68 -7.884 14.067 31.875 1.00 24.10 H new ATOM 0 HD21 ASN A 68 -9.117 10.161 31.419 1.00 1.03 H new ATOM 0 HD22 ASN A 68 -9.768 11.429 30.376 1.00 1.03 H new ATOM 463 N PHE A 69 -10.160 16.048 29.553 1.00 70.21 N ATOM 464 CA PHE A 69 -10.096 17.495 29.233 1.00 73.04 C ATOM 465 C PHE A 69 -8.665 18.052 29.193 1.00 1.30 C ATOM 466 O PHE A 69 -8.435 19.245 29.429 1.00 21.04 O ATOM 467 CB PHE A 69 -11.024 18.297 30.166 1.00 62.34 C ATOM 468 CG PHE A 69 -10.951 17.924 31.620 1.00 53.23 C ATOM 469 CD1 PHE A 69 -10.015 18.461 32.419 1.00 0.41 C ATOM 470 CD2 PHE A 69 -11.845 17.047 32.155 1.00 43.25 C ATOM 471 CE1 PHE A 69 -9.946 18.149 33.748 1.00 70.10 C ATOM 472 CE2 PHE A 69 -11.815 16.718 33.480 1.00 30.55 C ATOM 473 CZ PHE A 69 -10.860 17.275 34.293 1.00 2.22 C ATOM 0 H PHE A 69 -10.814 15.535 28.962 1.00 70.21 H new ATOM 0 HA PHE A 69 -10.463 17.614 28.214 1.00 73.04 H new ATOM 0 HB2 PHE A 69 -10.785 19.356 30.067 1.00 62.34 H new ATOM 0 HB3 PHE A 69 -12.052 18.170 29.826 1.00 62.34 H new ATOM 0 HD1 PHE A 69 -9.300 19.155 32.002 1.00 0.41 H new ATOM 0 HD2 PHE A 69 -12.594 16.602 31.517 1.00 43.25 H new ATOM 0 HE1 PHE A 69 -9.178 18.586 34.368 1.00 70.10 H new ATOM 0 HE2 PHE A 69 -12.537 16.025 33.885 1.00 30.55 H new ATOM 0 HZ PHE A 69 -10.826 17.032 35.345 1.00 2.22 H new ATOM 483 N ALA A 70 -7.738 17.208 28.754 1.00 75.54 N ATOM 484 CA ALA A 70 -6.334 17.498 28.778 1.00 51.35 C ATOM 485 C ALA A 70 -5.585 16.327 28.177 1.00 3.22 C ATOM 486 O ALA A 70 -6.140 15.228 28.069 1.00 41.40 O ATOM 487 CB ALA A 70 -5.914 17.669 30.231 1.00 70.52 C ATOM 0 H ALA A 70 -7.959 16.290 28.367 1.00 75.54 H new ATOM 0 HA ALA A 70 -6.115 18.403 28.211 1.00 51.35 H new ATOM 0 HB1 ALA A 70 -4.848 17.891 30.278 1.00 70.52 H new ATOM 0 HB2 ALA A 70 -6.475 18.490 30.678 1.00 70.52 H new ATOM 0 HB3 ALA A 70 -6.118 16.749 30.779 1.00 70.52 H new ATOM 493 N TYR A 71 -4.363 16.563 27.754 1.00 50.24 N ATOM 494 CA TYR A 71 -3.507 15.496 27.291 1.00 3.40 C ATOM 495 C TYR A 71 -2.835 14.818 28.477 1.00 4.12 C ATOM 496 O TYR A 71 -2.646 15.449 29.531 1.00 13.45 O ATOM 497 CB TYR A 71 -2.454 15.989 26.283 1.00 24.25 C ATOM 498 CG TYR A 71 -3.018 16.347 24.936 1.00 4.50 C ATOM 499 CD1 TYR A 71 -3.815 15.448 24.236 1.00 43.31 C ATOM 500 CD2 TYR A 71 -2.761 17.574 24.365 1.00 10.04 C ATOM 501 CE1 TYR A 71 -4.335 15.768 23.008 1.00 71.53 C ATOM 502 CE2 TYR A 71 -3.276 17.906 23.135 1.00 33.33 C ATOM 503 CZ TYR A 71 -4.061 17.008 22.457 1.00 72.23 C ATOM 504 OH TYR A 71 -4.588 17.352 21.225 1.00 3.41 O ATOM 0 H TYR A 71 -3.939 17.490 27.722 1.00 50.24 H new ATOM 0 HA TYR A 71 -4.134 14.774 26.768 1.00 3.40 H new ATOM 0 HB2 TYR A 71 -1.949 16.862 26.698 1.00 24.25 H new ATOM 0 HB3 TYR A 71 -1.698 15.214 26.155 1.00 24.25 H new ATOM 0 HD1 TYR A 71 -4.028 14.481 24.667 1.00 43.31 H new ATOM 0 HD2 TYR A 71 -2.145 18.287 24.893 1.00 10.04 H new ATOM 0 HE1 TYR A 71 -4.952 15.059 22.476 1.00 71.53 H new ATOM 0 HE2 TYR A 71 -3.063 18.872 22.703 1.00 33.33 H new ATOM 0 HH TYR A 71 -4.298 18.257 20.986 1.00 3.41 H new ATOM 514 N PRO A 72 -2.485 13.532 28.329 1.00 41.10 N ATOM 515 CA PRO A 72 -1.848 12.722 29.389 1.00 14.40 C ATOM 516 C PRO A 72 -0.455 13.246 29.791 1.00 70.34 C ATOM 517 O PRO A 72 0.126 14.060 29.081 1.00 42.52 O ATOM 518 CB PRO A 72 -1.694 11.350 28.696 1.00 11.35 C ATOM 519 CG PRO A 72 -1.707 11.639 27.250 1.00 22.33 C ATOM 520 CD PRO A 72 -2.673 12.743 27.093 1.00 0.13 C ATOM 0 HA PRO A 72 -2.431 12.722 30.310 1.00 14.40 H new ATOM 0 HB2 PRO A 72 -0.765 10.863 28.991 1.00 11.35 H new ATOM 0 HB3 PRO A 72 -2.507 10.678 28.970 1.00 11.35 H new ATOM 0 HG2 PRO A 72 -0.717 11.927 26.896 1.00 22.33 H new ATOM 0 HG3 PRO A 72 -2.010 10.764 26.675 1.00 22.33 H new ATOM 0 HD2 PRO A 72 -2.467 13.335 26.202 1.00 0.13 H new ATOM 0 HD3 PRO A 72 -3.695 12.375 27.002 1.00 0.13 H new ATOM 528 N SER A 73 0.073 12.797 30.930 1.00 53.35 N ATOM 529 CA SER A 73 1.434 13.127 31.268 1.00 35.35 C ATOM 530 C SER A 73 2.261 11.947 30.856 1.00 1.25 C ATOM 531 O SER A 73 1.725 10.848 30.736 1.00 72.34 O ATOM 532 CB SER A 73 1.590 13.418 32.762 1.00 74.34 C ATOM 533 OG SER A 73 1.144 12.330 33.546 1.00 3.31 O ATOM 0 H SER A 73 -0.417 12.218 31.612 1.00 53.35 H new ATOM 0 HA SER A 73 1.753 14.034 30.755 1.00 35.35 H new ATOM 0 HB2 SER A 73 2.636 13.626 32.987 1.00 74.34 H new ATOM 0 HB3 SER A 73 1.024 14.312 33.022 1.00 74.34 H new ATOM 0 HG SER A 73 1.401 12.473 34.481 1.00 3.31 H new ATOM 539 N THR A 74 3.515 12.132 30.609 1.00 43.10 N ATOM 540 CA THR A 74 4.346 11.055 30.144 1.00 33.42 C ATOM 541 C THR A 74 4.494 9.967 31.242 1.00 31.12 C ATOM 542 O THR A 74 4.928 8.846 30.980 1.00 2.10 O ATOM 543 CB THR A 74 5.721 11.604 29.661 1.00 62.12 C ATOM 544 OG1 THR A 74 6.139 10.902 28.473 1.00 1.23 O ATOM 545 CG2 THR A 74 6.798 11.483 30.749 1.00 54.33 C ATOM 0 H THR A 74 3.997 13.024 30.720 1.00 43.10 H new ATOM 0 HA THR A 74 3.870 10.578 29.287 1.00 33.42 H new ATOM 0 HB THR A 74 5.596 12.663 29.436 1.00 62.12 H new ATOM 0 HG1 THR A 74 6.024 11.483 27.692 1.00 1.23 H new ATOM 0 HG21 THR A 74 7.742 11.877 30.372 1.00 54.33 H new ATOM 0 HG22 THR A 74 6.493 12.051 31.628 1.00 54.33 H new ATOM 0 HG23 THR A 74 6.925 10.435 31.020 1.00 54.33 H new ATOM 553 N GLN A 75 4.121 10.313 32.464 1.00 43.13 N ATOM 554 CA GLN A 75 4.177 9.378 33.533 1.00 71.35 C ATOM 555 C GLN A 75 2.757 8.848 33.825 1.00 2.31 C ATOM 556 O GLN A 75 2.418 7.710 33.475 1.00 65.40 O ATOM 557 CB GLN A 75 4.761 10.033 34.809 1.00 60.43 C ATOM 558 CG GLN A 75 5.881 11.052 34.592 1.00 41.30 C ATOM 559 CD GLN A 75 5.343 12.460 34.337 1.00 15.25 C ATOM 560 OE1 GLN A 75 5.071 12.851 33.208 1.00 64.14 O ATOM 561 NE2 GLN A 75 5.190 13.217 35.381 1.00 50.32 N ATOM 0 H GLN A 75 3.779 11.239 32.722 1.00 43.13 H new ATOM 0 HA GLN A 75 4.828 8.554 33.241 1.00 71.35 H new ATOM 0 HB2 GLN A 75 3.949 10.525 35.344 1.00 60.43 H new ATOM 0 HB3 GLN A 75 5.138 9.243 35.458 1.00 60.43 H new ATOM 0 HG2 GLN A 75 6.530 11.067 35.467 1.00 41.30 H new ATOM 0 HG3 GLN A 75 6.493 10.741 33.746 1.00 41.30 H new ATOM 0 HE21 GLN A 75 5.426 12.862 36.308 1.00 50.32 H new ATOM 0 HE22 GLN A 75 4.834 14.167 35.274 1.00 50.32 H new ATOM 570 N GLN A 76 1.881 9.739 34.303 1.00 51.03 N ATOM 571 CA GLN A 76 0.541 9.349 34.754 1.00 54.34 C ATOM 572 C GLN A 76 -0.376 9.172 33.607 1.00 64.42 C ATOM 573 O GLN A 76 -1.208 8.283 33.626 1.00 62.12 O ATOM 574 CB GLN A 76 -0.039 10.369 35.732 1.00 62.11 C ATOM 575 CG GLN A 76 0.753 10.523 37.021 1.00 72.53 C ATOM 576 CD GLN A 76 0.742 9.261 37.855 1.00 55.13 C ATOM 577 OE1 GLN A 76 -0.136 9.067 38.685 1.00 3.41 O ATOM 578 NE2 GLN A 76 1.696 8.395 37.645 1.00 31.13 N ATOM 0 H GLN A 76 2.077 10.736 34.387 1.00 51.03 H new ATOM 0 HA GLN A 76 0.642 8.396 35.273 1.00 54.34 H new ATOM 0 HB2 GLN A 76 -0.096 11.338 35.236 1.00 62.11 H new ATOM 0 HB3 GLN A 76 -1.060 10.078 35.979 1.00 62.11 H new ATOM 0 HG2 GLN A 76 1.783 10.790 36.783 1.00 72.53 H new ATOM 0 HG3 GLN A 76 0.338 11.345 37.604 1.00 72.53 H new ATOM 0 HE21 GLN A 76 2.414 8.586 36.946 1.00 31.13 H new ATOM 0 HE22 GLN A 76 1.724 7.527 38.180 1.00 31.13 H new ATOM 587 N GLY A 77 -0.225 9.989 32.589 1.00 33.55 N ATOM 588 CA GLY A 77 -1.069 9.820 31.474 1.00 31.10 C ATOM 589 C GLY A 77 -0.656 8.647 30.608 1.00 54.24 C ATOM 590 O GLY A 77 -1.471 8.121 29.896 1.00 24.35 O ATOM 0 H GLY A 77 0.455 10.746 32.527 1.00 33.55 H new ATOM 0 HA2 GLY A 77 -2.093 9.672 31.816 1.00 31.10 H new ATOM 0 HA3 GLY A 77 -1.061 10.731 30.875 1.00 31.10 H new ATOM 594 N LEU A 78 0.605 8.214 30.701 1.00 14.41 N ATOM 595 CA LEU A 78 1.052 7.048 29.937 1.00 71.34 C ATOM 596 C LEU A 78 0.358 5.847 30.541 1.00 65.53 C ATOM 597 O LEU A 78 -0.265 5.016 29.829 1.00 65.44 O ATOM 598 CB LEU A 78 2.598 6.916 29.994 1.00 31.55 C ATOM 599 CG LEU A 78 3.295 5.936 29.001 1.00 73.20 C ATOM 600 CD1 LEU A 78 4.793 6.138 29.042 1.00 32.44 C ATOM 601 CD2 LEU A 78 2.985 4.475 29.308 1.00 34.21 C ATOM 0 H LEU A 78 1.321 8.644 31.286 1.00 14.41 H new ATOM 0 HA LEU A 78 0.797 7.139 28.881 1.00 71.34 H new ATOM 0 HB2 LEU A 78 3.022 7.907 29.835 1.00 31.55 H new ATOM 0 HB3 LEU A 78 2.868 6.612 31.005 1.00 31.55 H new ATOM 0 HG LEU A 78 2.904 6.161 28.009 1.00 73.20 H new ATOM 0 HD11 LEU A 78 5.272 5.450 28.346 1.00 32.44 H new ATOM 0 HD12 LEU A 78 5.030 7.164 28.759 1.00 32.44 H new ATOM 0 HD13 LEU A 78 5.159 5.946 30.051 1.00 32.44 H new ATOM 0 HD21 LEU A 78 3.495 3.836 28.587 1.00 34.21 H new ATOM 0 HD22 LEU A 78 3.329 4.234 30.314 1.00 34.21 H new ATOM 0 HD23 LEU A 78 1.910 4.310 29.243 1.00 34.21 H new ATOM 613 N GLU A 79 0.402 5.792 31.869 1.00 51.33 N ATOM 614 CA GLU A 79 -0.313 4.785 32.593 1.00 33.20 C ATOM 615 C GLU A 79 -1.784 4.912 32.305 1.00 50.24 C ATOM 616 O GLU A 79 -2.426 3.956 32.094 1.00 63.52 O ATOM 617 CB GLU A 79 -0.068 4.862 34.095 1.00 54.14 C ATOM 618 CG GLU A 79 1.345 4.532 34.507 1.00 20.11 C ATOM 619 CD GLU A 79 1.483 4.420 35.997 1.00 72.11 C ATOM 620 OE1 GLU A 79 1.004 3.424 36.565 1.00 52.55 O ATOM 621 OE2 GLU A 79 2.089 5.312 36.630 1.00 41.13 O ATOM 0 H GLU A 79 0.930 6.441 32.452 1.00 51.33 H new ATOM 0 HA GLU A 79 0.055 3.815 32.259 1.00 33.20 H new ATOM 0 HB2 GLU A 79 -0.310 5.867 34.441 1.00 54.14 H new ATOM 0 HB3 GLU A 79 -0.751 4.178 34.599 1.00 54.14 H new ATOM 0 HG2 GLU A 79 1.648 3.594 34.043 1.00 20.11 H new ATOM 0 HG3 GLU A 79 2.020 5.303 34.137 1.00 20.11 H new ATOM 628 N ALA A 80 -2.264 6.122 32.186 1.00 25.53 N ATOM 629 CA ALA A 80 -3.669 6.372 31.926 1.00 33.00 C ATOM 630 C ALA A 80 -4.057 6.133 30.455 1.00 41.22 C ATOM 631 O ALA A 80 -5.219 6.301 30.071 1.00 20.00 O ATOM 632 CB ALA A 80 -4.019 7.768 32.332 1.00 24.52 C ATOM 0 H ALA A 80 -1.697 6.966 32.266 1.00 25.53 H new ATOM 0 HA ALA A 80 -4.238 5.657 32.521 1.00 33.00 H new ATOM 0 HB1 ALA A 80 -5.075 7.950 32.135 1.00 24.52 H new ATOM 0 HB2 ALA A 80 -3.821 7.898 33.396 1.00 24.52 H new ATOM 0 HB3 ALA A 80 -3.416 8.475 31.762 1.00 24.52 H new ATOM 638 N LEU A 81 -3.084 5.810 29.637 1.00 5.13 N ATOM 639 CA LEU A 81 -3.332 5.429 28.262 1.00 10.45 C ATOM 640 C LEU A 81 -3.412 3.918 28.144 1.00 65.11 C ATOM 641 O LEU A 81 -3.963 3.383 27.180 1.00 20.22 O ATOM 642 CB LEU A 81 -2.238 5.953 27.324 1.00 33.20 C ATOM 643 CG LEU A 81 -2.190 7.464 27.065 1.00 72.34 C ATOM 644 CD1 LEU A 81 -1.002 7.813 26.175 1.00 61.12 C ATOM 645 CD2 LEU A 81 -3.490 7.946 26.427 1.00 34.34 C ATOM 0 H LEU A 81 -2.099 5.803 29.902 1.00 5.13 H new ATOM 0 HA LEU A 81 -4.281 5.875 27.965 1.00 10.45 H new ATOM 0 HB2 LEU A 81 -1.273 5.651 27.731 1.00 33.20 H new ATOM 0 HB3 LEU A 81 -2.350 5.451 26.363 1.00 33.20 H new ATOM 0 HG LEU A 81 -2.070 7.971 28.023 1.00 72.34 H new ATOM 0 HD11 LEU A 81 -0.982 8.889 26.000 1.00 61.12 H new ATOM 0 HD12 LEU A 81 -0.078 7.508 26.666 1.00 61.12 H new ATOM 0 HD13 LEU A 81 -1.096 7.292 25.222 1.00 61.12 H new ATOM 0 HD21 LEU A 81 -3.433 9.020 26.252 1.00 34.34 H new ATOM 0 HD22 LEU A 81 -3.642 7.432 25.478 1.00 34.34 H new ATOM 0 HD23 LEU A 81 -4.325 7.731 27.094 1.00 34.34 H new ATOM 657 N VAL A 82 -2.816 3.225 29.090 1.00 43.11 N ATOM 658 CA VAL A 82 -2.835 1.758 29.071 1.00 42.40 C ATOM 659 C VAL A 82 -3.768 1.195 30.172 1.00 10.14 C ATOM 660 O VAL A 82 -4.343 0.103 30.040 1.00 31.41 O ATOM 661 CB VAL A 82 -1.400 1.198 29.258 1.00 2.53 C ATOM 662 CG1 VAL A 82 -1.353 -0.306 29.028 1.00 24.45 C ATOM 663 CG2 VAL A 82 -0.423 1.917 28.340 1.00 74.14 C ATOM 0 H VAL A 82 -2.315 3.637 29.877 1.00 43.11 H new ATOM 0 HA VAL A 82 -3.220 1.442 28.102 1.00 42.40 H new ATOM 0 HB VAL A 82 -1.103 1.380 30.291 1.00 2.53 H new ATOM 0 HG11 VAL A 82 -0.333 -0.664 29.167 1.00 24.45 H new ATOM 0 HG12 VAL A 82 -2.012 -0.804 29.739 1.00 24.45 H new ATOM 0 HG13 VAL A 82 -1.680 -0.529 28.012 1.00 24.45 H new ATOM 0 HG21 VAL A 82 0.578 1.511 28.485 1.00 74.14 H new ATOM 0 HG22 VAL A 82 -0.726 1.774 27.303 1.00 74.14 H new ATOM 0 HG23 VAL A 82 -0.420 2.982 28.574 1.00 74.14 H new ATOM 673 N LYS A 83 -3.935 1.971 31.193 1.00 60.12 N ATOM 674 CA LYS A 83 -4.679 1.662 32.394 1.00 31.24 C ATOM 675 C LYS A 83 -5.690 2.803 32.603 1.00 23.15 C ATOM 676 O LYS A 83 -5.416 3.925 32.214 1.00 50.51 O ATOM 677 CB LYS A 83 -3.644 1.633 33.526 1.00 51.22 C ATOM 678 CG LYS A 83 -4.125 1.348 34.918 1.00 63.54 C ATOM 679 CD LYS A 83 -2.960 1.526 35.867 1.00 21.51 C ATOM 680 CE LYS A 83 -3.318 1.196 37.284 1.00 52.43 C ATOM 681 NZ LYS A 83 -2.188 1.465 38.187 1.00 31.02 N ATOM 0 H LYS A 83 -3.530 2.907 31.222 1.00 60.12 H new ATOM 0 HA LYS A 83 -5.217 0.715 32.350 1.00 31.24 H new ATOM 0 HB2 LYS A 83 -2.894 0.884 33.273 1.00 51.22 H new ATOM 0 HB3 LYS A 83 -3.138 2.598 33.540 1.00 51.22 H new ATOM 0 HG2 LYS A 83 -4.939 2.023 35.184 1.00 63.54 H new ATOM 0 HG3 LYS A 83 -4.517 0.333 34.984 1.00 63.54 H new ATOM 0 HD2 LYS A 83 -2.134 0.890 35.547 1.00 21.51 H new ATOM 0 HD3 LYS A 83 -2.608 2.556 35.815 1.00 21.51 H new ATOM 0 HE2 LYS A 83 -4.182 1.784 37.591 1.00 52.43 H new ATOM 0 HE3 LYS A 83 -3.605 0.147 37.356 1.00 52.43 H new ATOM 0 HZ1 LYS A 83 -2.460 1.229 39.163 1.00 31.02 H new ATOM 0 HZ2 LYS A 83 -1.372 0.885 37.905 1.00 31.02 H new ATOM 0 HZ3 LYS A 83 -1.932 2.472 38.133 1.00 31.02 H new ATOM 695 N LYS A 84 -6.854 2.499 33.159 1.00 73.30 N ATOM 696 CA LYS A 84 -7.929 3.458 33.350 1.00 11.24 C ATOM 697 C LYS A 84 -7.454 4.705 34.140 1.00 73.44 C ATOM 698 O LYS A 84 -6.854 4.582 35.223 1.00 5.05 O ATOM 699 CB LYS A 84 -9.028 2.718 34.085 1.00 31.53 C ATOM 700 CG LYS A 84 -10.326 3.445 34.260 1.00 75.12 C ATOM 701 CD LYS A 84 -11.366 2.477 34.769 1.00 44.50 C ATOM 702 CE LYS A 84 -11.197 2.100 36.247 1.00 34.34 C ATOM 703 NZ LYS A 84 -11.401 3.243 37.168 1.00 50.21 N ATOM 0 H LYS A 84 -7.080 1.563 33.495 1.00 73.30 H new ATOM 0 HA LYS A 84 -8.285 3.840 32.393 1.00 11.24 H new ATOM 0 HB2 LYS A 84 -9.228 1.788 33.552 1.00 31.53 H new ATOM 0 HB3 LYS A 84 -8.654 2.446 35.072 1.00 31.53 H new ATOM 0 HG2 LYS A 84 -10.204 4.270 34.962 1.00 75.12 H new ATOM 0 HG3 LYS A 84 -10.646 3.878 33.312 1.00 75.12 H new ATOM 0 HD2 LYS A 84 -12.355 2.914 34.627 1.00 44.50 H new ATOM 0 HD3 LYS A 84 -11.329 1.569 34.167 1.00 44.50 H new ATOM 0 HE2 LYS A 84 -11.905 1.310 36.497 1.00 34.34 H new ATOM 0 HE3 LYS A 84 -10.197 1.693 36.399 1.00 34.34 H new ATOM 0 HZ1 LYS A 84 -11.425 2.898 38.149 1.00 50.21 H new ATOM 0 HZ2 LYS A 84 -10.620 3.921 37.058 1.00 50.21 H new ATOM 0 HZ3 LYS A 84 -12.301 3.713 36.944 1.00 50.21 H new ATOM 717 N PRO A 85 -7.721 5.910 33.599 1.00 2.21 N ATOM 718 CA PRO A 85 -7.294 7.171 34.196 1.00 11.31 C ATOM 719 C PRO A 85 -7.997 7.434 35.514 1.00 74.23 C ATOM 720 O PRO A 85 -9.231 7.301 35.617 1.00 42.13 O ATOM 721 CB PRO A 85 -7.715 8.230 33.156 1.00 24.23 C ATOM 722 CG PRO A 85 -8.798 7.588 32.380 1.00 14.12 C ATOM 723 CD PRO A 85 -8.474 6.127 32.359 1.00 54.23 C ATOM 0 HA PRO A 85 -6.227 7.176 34.418 1.00 11.31 H new ATOM 0 HB2 PRO A 85 -8.063 9.143 33.640 1.00 24.23 H new ATOM 0 HB3 PRO A 85 -6.879 8.508 32.514 1.00 24.23 H new ATOM 0 HG2 PRO A 85 -9.769 7.767 32.842 1.00 14.12 H new ATOM 0 HG3 PRO A 85 -8.847 7.992 31.369 1.00 14.12 H new ATOM 0 HD2 PRO A 85 -9.378 5.519 32.330 1.00 54.23 H new ATOM 0 HD3 PRO A 85 -7.883 5.862 31.482 1.00 54.23 H new ATOM 731 N THR A 86 -7.238 7.772 36.511 1.00 25.11 N ATOM 732 CA THR A 86 -7.795 8.086 37.784 1.00 12.44 C ATOM 733 C THR A 86 -7.991 9.614 37.887 1.00 12.40 C ATOM 734 O THR A 86 -7.694 10.351 36.930 1.00 3.25 O ATOM 735 CB THR A 86 -6.942 7.498 38.958 1.00 31.31 C ATOM 736 OG1 THR A 86 -7.609 7.694 40.213 1.00 61.34 O ATOM 737 CG2 THR A 86 -5.558 8.113 39.015 1.00 3.43 C ATOM 0 H THR A 86 -6.221 7.837 36.463 1.00 25.11 H new ATOM 0 HA THR A 86 -8.771 7.611 37.877 1.00 12.44 H new ATOM 0 HB THR A 86 -6.830 6.430 38.769 1.00 31.31 H new ATOM 0 HG1 THR A 86 -7.063 7.319 40.936 1.00 61.34 H new ATOM 0 HG21 THR A 86 -5.000 7.677 39.844 1.00 3.43 H new ATOM 0 HG22 THR A 86 -5.033 7.915 38.080 1.00 3.43 H new ATOM 0 HG23 THR A 86 -5.644 9.190 39.162 1.00 3.43 H new ATOM 745 N GLY A 87 -8.477 10.075 38.997 1.00 74.41 N ATOM 746 CA GLY A 87 -8.805 11.461 39.133 1.00 1.44 C ATOM 747 C GLY A 87 -10.254 11.633 38.803 1.00 13.21 C ATOM 748 O GLY A 87 -11.083 10.936 39.363 1.00 23.02 O ATOM 0 H GLY A 87 -8.656 9.509 39.826 1.00 74.41 H new ATOM 0 HA2 GLY A 87 -8.603 11.801 40.149 1.00 1.44 H new ATOM 0 HA3 GLY A 87 -8.189 12.065 38.466 1.00 1.44 H new ATOM 752 N ASN A 88 -10.576 12.497 37.876 1.00 31.10 N ATOM 753 CA ASN A 88 -11.966 12.647 37.467 1.00 24.42 C ATOM 754 C ASN A 88 -12.116 12.901 35.961 1.00 61.32 C ATOM 755 O ASN A 88 -12.233 14.036 35.511 1.00 64.15 O ATOM 756 CB ASN A 88 -12.765 13.665 38.352 1.00 2.02 C ATOM 757 CG ASN A 88 -12.201 15.088 38.388 1.00 21.44 C ATOM 758 OD1 ASN A 88 -11.312 15.399 39.179 1.00 40.44 O ATOM 759 ND2 ASN A 88 -12.751 15.972 37.602 1.00 72.53 N ATOM 0 H ASN A 88 -9.914 13.103 37.391 1.00 31.10 H new ATOM 0 HA ASN A 88 -12.437 11.681 37.652 1.00 24.42 H new ATOM 0 HB2 ASN A 88 -13.792 13.708 37.989 1.00 2.02 H new ATOM 0 HB3 ASN A 88 -12.804 13.282 39.372 1.00 2.02 H new ATOM 0 HD21 ASN A 88 -12.445 16.945 37.635 1.00 72.53 H new ATOM 0 HD22 ASN A 88 -13.487 15.691 36.954 1.00 72.53 H new ATOM 766 N PRO A 89 -12.044 11.837 35.150 1.00 13.41 N ATOM 767 CA PRO A 89 -12.238 11.943 33.718 1.00 70.32 C ATOM 768 C PRO A 89 -13.736 11.930 33.376 1.00 22.31 C ATOM 769 O PRO A 89 -14.527 11.211 34.020 1.00 13.22 O ATOM 770 CB PRO A 89 -11.519 10.695 33.147 1.00 24.20 C ATOM 771 CG PRO A 89 -11.313 9.758 34.303 1.00 31.53 C ATOM 772 CD PRO A 89 -11.769 10.453 35.566 1.00 64.01 C ATOM 0 HA PRO A 89 -11.844 12.871 33.303 1.00 70.32 H new ATOM 0 HB2 PRO A 89 -12.118 10.224 32.368 1.00 24.20 H new ATOM 0 HB3 PRO A 89 -10.566 10.969 32.695 1.00 24.20 H new ATOM 0 HG2 PRO A 89 -11.878 8.838 34.151 1.00 31.53 H new ATOM 0 HG3 PRO A 89 -10.263 9.478 34.382 1.00 31.53 H new ATOM 0 HD2 PRO A 89 -12.659 9.979 35.980 1.00 64.01 H new ATOM 0 HD3 PRO A 89 -11.000 10.416 36.338 1.00 64.01 H new ATOM 780 N GLN A 90 -14.124 12.710 32.397 1.00 30.32 N ATOM 781 CA GLN A 90 -15.511 12.793 31.993 1.00 21.55 C ATOM 782 C GLN A 90 -15.772 11.639 31.062 1.00 43.04 C ATOM 783 O GLN A 90 -15.179 11.585 30.009 1.00 31.33 O ATOM 784 CB GLN A 90 -15.811 14.134 31.321 1.00 20.13 C ATOM 785 CG GLN A 90 -15.596 15.318 32.246 1.00 32.23 C ATOM 786 CD GLN A 90 -15.983 16.634 31.632 1.00 33.33 C ATOM 787 OE1 GLN A 90 -15.168 17.310 31.000 1.00 43.51 O ATOM 788 NE2 GLN A 90 -17.210 17.020 31.817 1.00 3.54 N ATOM 0 H GLN A 90 -13.493 13.303 31.859 1.00 30.32 H new ATOM 0 HA GLN A 90 -16.168 12.734 32.861 1.00 21.55 H new ATOM 0 HB2 GLN A 90 -15.175 14.245 30.443 1.00 20.13 H new ATOM 0 HB3 GLN A 90 -16.843 14.136 30.970 1.00 20.13 H new ATOM 0 HG2 GLN A 90 -16.174 15.167 33.158 1.00 32.23 H new ATOM 0 HG3 GLN A 90 -14.546 15.356 32.537 1.00 32.23 H new ATOM 0 HE21 GLN A 90 -17.855 16.433 32.346 1.00 3.54 H new ATOM 0 HE22 GLN A 90 -17.528 17.910 31.434 1.00 3.54 H new ATOM 797 N PRO A 91 -16.658 10.700 31.456 1.00 65.34 N ATOM 798 CA PRO A 91 -16.826 9.417 30.777 1.00 3.00 C ATOM 799 C PRO A 91 -17.036 9.437 29.270 1.00 44.01 C ATOM 800 O PRO A 91 -18.135 9.706 28.759 1.00 43.42 O ATOM 801 CB PRO A 91 -18.019 8.768 31.474 1.00 35.53 C ATOM 802 CG PRO A 91 -18.071 9.414 32.804 1.00 12.11 C ATOM 803 CD PRO A 91 -17.576 10.815 32.603 1.00 65.24 C ATOM 0 HA PRO A 91 -15.885 8.872 30.858 1.00 3.00 H new ATOM 0 HB2 PRO A 91 -18.941 8.933 30.917 1.00 35.53 H new ATOM 0 HB3 PRO A 91 -17.888 7.689 31.562 1.00 35.53 H new ATOM 0 HG2 PRO A 91 -19.087 9.412 33.199 1.00 12.11 H new ATOM 0 HG3 PRO A 91 -17.449 8.880 33.522 1.00 12.11 H new ATOM 0 HD2 PRO A 91 -18.395 11.503 32.393 1.00 65.24 H new ATOM 0 HD3 PRO A 91 -17.064 11.190 33.489 1.00 65.24 H new ATOM 811 N LYS A 92 -15.962 9.201 28.597 1.00 53.15 N ATOM 812 CA LYS A 92 -15.903 8.843 27.236 1.00 21.13 C ATOM 813 C LYS A 92 -15.436 7.421 27.308 1.00 43.11 C ATOM 814 O LYS A 92 -14.821 7.036 28.320 1.00 22.52 O ATOM 815 CB LYS A 92 -14.877 9.671 26.407 1.00 11.43 C ATOM 816 CG LYS A 92 -15.289 11.071 25.866 1.00 22.11 C ATOM 817 CD LYS A 92 -15.547 12.133 26.935 1.00 33.43 C ATOM 818 CE LYS A 92 -17.006 12.227 27.342 1.00 13.21 C ATOM 819 NZ LYS A 92 -17.874 12.640 26.223 1.00 34.21 N ATOM 0 H LYS A 92 -15.037 9.260 29.024 1.00 53.15 H new ATOM 0 HA LYS A 92 -16.859 9.011 26.740 1.00 21.13 H new ATOM 0 HB2 LYS A 92 -13.990 9.807 27.025 1.00 11.43 H new ATOM 0 HB3 LYS A 92 -14.580 9.064 25.552 1.00 11.43 H new ATOM 0 HG2 LYS A 92 -14.504 11.431 25.201 1.00 22.11 H new ATOM 0 HG3 LYS A 92 -16.190 10.959 25.263 1.00 22.11 H new ATOM 0 HD2 LYS A 92 -14.944 11.908 27.815 1.00 33.43 H new ATOM 0 HD3 LYS A 92 -15.217 13.103 26.562 1.00 33.43 H new ATOM 0 HE2 LYS A 92 -17.339 11.260 27.719 1.00 13.21 H new ATOM 0 HE3 LYS A 92 -17.107 12.940 28.160 1.00 13.21 H new ATOM 0 HZ1 LYS A 92 -18.732 13.092 26.598 1.00 34.21 H new ATOM 0 HZ2 LYS A 92 -17.363 13.315 25.618 1.00 34.21 H new ATOM 0 HZ3 LYS A 92 -18.139 11.805 25.663 1.00 34.21 H new ATOM 833 N ASN A 93 -15.828 6.608 26.388 1.00 53.54 N ATOM 834 CA ASN A 93 -15.346 5.232 26.374 1.00 54.54 C ATOM 835 C ASN A 93 -13.832 5.219 26.207 1.00 71.04 C ATOM 836 O ASN A 93 -13.311 5.467 25.109 1.00 1.11 O ATOM 837 CB ASN A 93 -16.030 4.385 25.289 1.00 24.12 C ATOM 838 CG ASN A 93 -17.503 4.150 25.570 1.00 52.30 C ATOM 839 OD1 ASN A 93 -18.365 4.936 25.174 1.00 62.31 O ATOM 840 ND2 ASN A 93 -17.809 3.091 26.257 1.00 32.45 N ATOM 0 H ASN A 93 -16.473 6.849 25.635 1.00 53.54 H new ATOM 0 HA ASN A 93 -15.605 4.776 27.330 1.00 54.54 H new ATOM 0 HB2 ASN A 93 -15.923 4.882 24.325 1.00 24.12 H new ATOM 0 HB3 ASN A 93 -15.522 3.424 25.210 1.00 24.12 H new ATOM 0 HD21 ASN A 93 -18.784 2.893 26.481 1.00 32.45 H new ATOM 0 HD22 ASN A 93 -17.074 2.457 26.572 1.00 32.45 H new ATOM 847 N TRP A 94 -13.150 5.048 27.326 1.00 12.52 N ATOM 848 CA TRP A 94 -11.732 5.000 27.403 1.00 71.42 C ATOM 849 C TRP A 94 -11.191 3.827 26.606 1.00 5.32 C ATOM 850 O TRP A 94 -11.791 2.741 26.582 1.00 71.40 O ATOM 851 CB TRP A 94 -11.309 4.926 28.884 1.00 53.04 C ATOM 852 CG TRP A 94 -9.844 4.788 29.086 1.00 21.20 C ATOM 853 CD1 TRP A 94 -8.924 5.785 29.137 1.00 61.12 C ATOM 854 CD2 TRP A 94 -9.133 3.568 29.261 1.00 3.43 C ATOM 855 NE1 TRP A 94 -7.673 5.247 29.307 1.00 11.34 N ATOM 856 CE2 TRP A 94 -7.782 3.889 29.386 1.00 14.44 C ATOM 857 CE3 TRP A 94 -9.519 2.227 29.312 1.00 35.22 C ATOM 858 CZ2 TRP A 94 -6.815 2.928 29.561 1.00 2.11 C ATOM 859 CZ3 TRP A 94 -8.555 1.271 29.491 1.00 74.25 C ATOM 860 CH2 TRP A 94 -7.219 1.626 29.612 1.00 45.00 C ATOM 0 H TRP A 94 -13.604 4.936 28.233 1.00 12.52 H new ATOM 0 HA TRP A 94 -11.310 5.904 26.965 1.00 71.42 H new ATOM 0 HB2 TRP A 94 -11.653 5.825 29.395 1.00 53.04 H new ATOM 0 HB3 TRP A 94 -11.812 4.080 29.353 1.00 53.04 H new ATOM 0 HD1 TRP A 94 -9.143 6.839 29.056 1.00 61.12 H new ATOM 0 HE1 TRP A 94 -6.803 5.776 29.365 1.00 11.34 H new ATOM 0 HE3 TRP A 94 -10.558 1.949 29.212 1.00 35.22 H new ATOM 0 HZ2 TRP A 94 -5.773 3.194 29.655 1.00 2.11 H new ATOM 0 HZ3 TRP A 94 -8.838 0.230 29.539 1.00 74.25 H new ATOM 0 HH2 TRP A 94 -6.480 0.851 29.750 1.00 45.00 H new ATOM 871 N ASN A 95 -10.088 4.046 25.961 1.00 24.32 N ATOM 872 CA ASN A 95 -9.455 3.039 25.177 1.00 42.40 C ATOM 873 C ASN A 95 -8.007 2.906 25.607 1.00 41.12 C ATOM 874 O ASN A 95 -7.320 3.910 25.771 1.00 61.53 O ATOM 875 CB ASN A 95 -9.517 3.379 23.683 1.00 14.34 C ATOM 876 CG ASN A 95 -8.745 2.390 22.810 1.00 73.02 C ATOM 877 OD1 ASN A 95 -8.163 2.768 21.821 1.00 70.43 O ATOM 878 ND2 ASN A 95 -8.789 1.124 23.119 1.00 10.31 N ATOM 0 H ASN A 95 -9.598 4.941 25.966 1.00 24.32 H new ATOM 0 HA ASN A 95 -9.981 2.098 25.334 1.00 42.40 H new ATOM 0 HB2 ASN A 95 -10.559 3.399 23.364 1.00 14.34 H new ATOM 0 HB3 ASN A 95 -9.117 4.381 23.528 1.00 14.34 H new ATOM 0 HD21 ASN A 95 -8.328 0.437 22.522 1.00 10.31 H new ATOM 0 HD22 ASN A 95 -9.284 0.821 23.957 1.00 10.31 H new ATOM 885 N LYS A 96 -7.546 1.692 25.802 1.00 62.31 N ATOM 886 CA LYS A 96 -6.171 1.480 26.163 1.00 11.34 C ATOM 887 C LYS A 96 -5.290 1.498 24.924 1.00 30.52 C ATOM 888 O LYS A 96 -5.757 1.766 23.811 1.00 71.31 O ATOM 889 CB LYS A 96 -5.970 0.145 26.875 1.00 54.42 C ATOM 890 CG LYS A 96 -6.134 -1.072 25.986 1.00 3.20 C ATOM 891 CD LYS A 96 -5.878 -2.350 26.754 1.00 40.23 C ATOM 892 CE LYS A 96 -4.436 -2.432 27.241 1.00 22.25 C ATOM 893 NZ LYS A 96 -4.145 -3.715 27.895 1.00 33.13 N ATOM 0 H LYS A 96 -8.103 0.842 25.716 1.00 62.31 H new ATOM 0 HA LYS A 96 -5.894 2.288 26.840 1.00 11.34 H new ATOM 0 HB2 LYS A 96 -4.972 0.128 27.313 1.00 54.42 H new ATOM 0 HB3 LYS A 96 -6.681 0.076 27.699 1.00 54.42 H new ATOM 0 HG2 LYS A 96 -7.142 -1.090 25.572 1.00 3.20 H new ATOM 0 HG3 LYS A 96 -5.444 -1.006 25.144 1.00 3.20 H new ATOM 0 HD2 LYS A 96 -6.554 -2.404 27.607 1.00 40.23 H new ATOM 0 HD3 LYS A 96 -6.097 -3.208 26.118 1.00 40.23 H new ATOM 0 HE2 LYS A 96 -3.760 -2.295 26.397 1.00 22.25 H new ATOM 0 HE3 LYS A 96 -4.243 -1.618 27.939 1.00 22.25 H new ATOM 0 HZ1 LYS A 96 -3.154 -3.727 28.210 1.00 33.13 H new ATOM 0 HZ2 LYS A 96 -4.771 -3.836 28.717 1.00 33.13 H new ATOM 0 HZ3 LYS A 96 -4.304 -4.492 27.222 1.00 33.13 H new ATOM 907 N ASP A 97 -4.009 1.247 25.146 1.00 44.35 N ATOM 908 CA ASP A 97 -3.001 1.088 24.096 1.00 21.00 C ATOM 909 C ASP A 97 -2.704 2.431 23.441 1.00 63.53 C ATOM 910 O ASP A 97 -2.101 2.514 22.378 1.00 42.12 O ATOM 911 CB ASP A 97 -3.420 0.004 23.076 1.00 31.25 C ATOM 912 CG ASP A 97 -2.274 -0.525 22.244 1.00 52.31 C ATOM 913 OD1 ASP A 97 -1.348 -1.122 22.824 1.00 2.31 O ATOM 914 OD2 ASP A 97 -2.318 -0.440 20.992 1.00 52.21 O ATOM 0 H ASP A 97 -3.626 1.144 26.086 1.00 44.35 H new ATOM 0 HA ASP A 97 -2.073 0.737 24.548 1.00 21.00 H new ATOM 0 HB2 ASP A 97 -3.882 -0.826 23.611 1.00 31.25 H new ATOM 0 HB3 ASP A 97 -4.179 0.417 22.412 1.00 31.25 H new ATOM 919 N GLY A 98 -3.124 3.490 24.117 1.00 12.10 N ATOM 920 CA GLY A 98 -2.756 4.820 23.700 1.00 11.23 C ATOM 921 C GLY A 98 -3.888 5.616 23.121 1.00 72.24 C ATOM 922 O GLY A 98 -3.659 6.724 22.650 1.00 73.50 O ATOM 0 H GLY A 98 -3.714 3.448 24.948 1.00 12.10 H new ATOM 0 HA2 GLY A 98 -2.349 5.358 24.556 1.00 11.23 H new ATOM 0 HA3 GLY A 98 -1.959 4.750 22.959 1.00 11.23 H new ATOM 926 N TYR A 99 -5.117 5.074 23.211 1.00 51.41 N ATOM 927 CA TYR A 99 -6.295 5.670 22.569 1.00 41.05 C ATOM 928 C TYR A 99 -6.106 5.648 21.066 1.00 13.15 C ATOM 929 O TYR A 99 -5.509 6.543 20.468 1.00 44.44 O ATOM 930 CB TYR A 99 -6.630 7.089 23.080 1.00 21.30 C ATOM 931 CG TYR A 99 -7.826 7.197 23.946 1.00 52.32 C ATOM 932 CD1 TYR A 99 -7.748 6.947 25.288 1.00 43.41 C ATOM 933 CD2 TYR A 99 -9.031 7.621 23.427 1.00 24.44 C ATOM 934 CE1 TYR A 99 -8.837 7.110 26.088 1.00 63.24 C ATOM 935 CE2 TYR A 99 -10.117 7.805 24.226 1.00 24.42 C ATOM 936 CZ TYR A 99 -10.012 7.548 25.554 1.00 71.05 C ATOM 937 OH TYR A 99 -11.069 7.757 26.358 1.00 51.02 O ATOM 0 H TYR A 99 -5.317 4.217 23.727 1.00 51.41 H new ATOM 0 HA TYR A 99 -7.159 5.064 22.842 1.00 41.05 H new ATOM 0 HB2 TYR A 99 -5.770 7.468 23.632 1.00 21.30 H new ATOM 0 HB3 TYR A 99 -6.769 7.742 22.218 1.00 21.30 H new ATOM 0 HD1 TYR A 99 -6.813 6.617 25.717 1.00 43.41 H new ATOM 0 HD2 TYR A 99 -9.114 7.811 22.367 1.00 24.44 H new ATOM 0 HE1 TYR A 99 -8.770 6.893 27.144 1.00 63.24 H new ATOM 0 HE2 TYR A 99 -11.051 8.151 23.808 1.00 24.42 H new ATOM 0 HH TYR A 99 -10.770 7.782 27.291 1.00 51.02 H new ATOM 947 N LEU A 100 -6.588 4.611 20.471 1.00 0.03 N ATOM 948 CA LEU A 100 -6.388 4.362 19.085 1.00 4.32 C ATOM 949 C LEU A 100 -7.721 3.861 18.524 1.00 61.43 C ATOM 950 O LEU A 100 -8.642 3.575 19.280 1.00 45.02 O ATOM 951 CB LEU A 100 -5.244 3.301 18.997 1.00 23.45 C ATOM 952 CG LEU A 100 -4.507 3.075 17.663 1.00 51.03 C ATOM 953 CD1 LEU A 100 -3.136 2.502 17.949 1.00 4.22 C ATOM 954 CD2 LEU A 100 -5.233 2.095 16.774 1.00 72.21 C ATOM 0 H LEU A 100 -7.143 3.898 20.944 1.00 0.03 H new ATOM 0 HA LEU A 100 -6.094 5.237 18.505 1.00 4.32 H new ATOM 0 HB2 LEU A 100 -4.494 3.570 19.741 1.00 23.45 H new ATOM 0 HB3 LEU A 100 -5.666 2.343 19.301 1.00 23.45 H new ATOM 0 HG LEU A 100 -4.449 4.037 17.154 1.00 51.03 H new ATOM 0 HD11 LEU A 100 -2.607 2.339 17.010 1.00 4.22 H new ATOM 0 HD12 LEU A 100 -2.572 3.200 18.567 1.00 4.22 H new ATOM 0 HD13 LEU A 100 -3.241 1.554 18.476 1.00 4.22 H new ATOM 0 HD21 LEU A 100 -4.678 1.966 15.845 1.00 72.21 H new ATOM 0 HD22 LEU A 100 -5.316 1.135 17.283 1.00 72.21 H new ATOM 0 HD23 LEU A 100 -6.230 2.475 16.551 1.00 72.21 H new ATOM 966 N LYS A 101 -7.848 3.794 17.230 1.00 41.35 N ATOM 967 CA LYS A 101 -9.049 3.253 16.597 1.00 0.43 C ATOM 968 C LYS A 101 -9.052 1.721 16.797 1.00 61.54 C ATOM 969 O LYS A 101 -8.147 1.178 17.429 1.00 42.31 O ATOM 970 CB LYS A 101 -8.993 3.559 15.098 1.00 71.43 C ATOM 971 CG LYS A 101 -8.907 5.035 14.726 1.00 72.14 C ATOM 972 CD LYS A 101 -10.208 5.773 14.963 1.00 44.43 C ATOM 973 CE LYS A 101 -10.090 7.224 14.504 1.00 21.21 C ATOM 974 NZ LYS A 101 -11.397 7.916 14.474 1.00 62.23 N ATOM 0 H LYS A 101 -7.133 4.108 16.573 1.00 41.35 H new ATOM 0 HA LYS A 101 -9.945 3.694 17.033 1.00 0.43 H new ATOM 0 HB2 LYS A 101 -8.130 3.046 14.673 1.00 71.43 H new ATOM 0 HB3 LYS A 101 -9.880 3.136 14.626 1.00 71.43 H new ATOM 0 HG2 LYS A 101 -8.115 5.507 15.308 1.00 72.14 H new ATOM 0 HG3 LYS A 101 -8.628 5.125 13.676 1.00 72.14 H new ATOM 0 HD2 LYS A 101 -11.017 5.279 14.424 1.00 44.43 H new ATOM 0 HD3 LYS A 101 -10.464 5.740 16.022 1.00 44.43 H new ATOM 0 HE2 LYS A 101 -9.414 7.759 15.171 1.00 21.21 H new ATOM 0 HE3 LYS A 101 -9.645 7.252 13.510 1.00 21.21 H new ATOM 0 HZ1 LYS A 101 -11.263 8.897 14.156 1.00 62.23 H new ATOM 0 HZ2 LYS A 101 -12.036 7.423 13.817 1.00 62.23 H new ATOM 0 HZ3 LYS A 101 -11.812 7.915 15.427 1.00 62.23 H new ATOM 988 N LYS A 102 -10.046 1.028 16.310 1.00 12.10 N ATOM 989 CA LYS A 102 -9.989 -0.435 16.345 1.00 11.25 C ATOM 990 C LYS A 102 -9.134 -0.959 15.202 1.00 42.12 C ATOM 991 O LYS A 102 -9.624 -1.355 14.146 1.00 63.05 O ATOM 992 CB LYS A 102 -11.367 -1.110 16.409 1.00 33.44 C ATOM 993 CG LYS A 102 -11.948 -1.225 17.823 1.00 74.54 C ATOM 994 CD LYS A 102 -12.217 0.115 18.496 1.00 22.40 C ATOM 995 CE LYS A 102 -13.373 0.853 17.857 1.00 61.11 C ATOM 996 NZ LYS A 102 -13.661 2.119 18.560 1.00 13.44 N ATOM 0 H LYS A 102 -10.888 1.424 15.893 1.00 12.10 H new ATOM 0 HA LYS A 102 -9.510 -0.710 17.285 1.00 11.25 H new ATOM 0 HB2 LYS A 102 -12.063 -0.547 15.787 1.00 33.44 H new ATOM 0 HB3 LYS A 102 -11.290 -2.108 15.978 1.00 33.44 H new ATOM 0 HG2 LYS A 102 -12.879 -1.790 17.777 1.00 74.54 H new ATOM 0 HG3 LYS A 102 -11.258 -1.798 18.442 1.00 74.54 H new ATOM 0 HD2 LYS A 102 -12.431 -0.047 19.552 1.00 22.40 H new ATOM 0 HD3 LYS A 102 -11.320 0.733 18.444 1.00 22.40 H new ATOM 0 HE2 LYS A 102 -13.141 1.060 16.812 1.00 61.11 H new ATOM 0 HE3 LYS A 102 -14.260 0.220 17.867 1.00 61.11 H new ATOM 0 HZ1 LYS A 102 -14.458 2.600 18.097 1.00 13.44 H new ATOM 0 HZ2 LYS A 102 -13.906 1.918 19.551 1.00 13.44 H new ATOM 0 HZ3 LYS A 102 -12.822 2.732 18.529 1.00 13.44 H new ATOM 1010 N LEU A 103 -7.854 -0.840 15.406 1.00 75.05 N ATOM 1011 CA LEU A 103 -6.829 -1.186 14.452 1.00 52.52 C ATOM 1012 C LEU A 103 -5.796 -2.033 15.150 1.00 52.04 C ATOM 1013 O LEU A 103 -5.663 -1.927 16.379 1.00 42.12 O ATOM 1014 CB LEU A 103 -6.169 0.078 13.922 1.00 32.32 C ATOM 1015 CG LEU A 103 -7.082 1.054 13.208 1.00 74.00 C ATOM 1016 CD1 LEU A 103 -6.343 2.343 12.949 1.00 64.14 C ATOM 1017 CD2 LEU A 103 -7.588 0.455 11.901 1.00 63.21 C ATOM 0 H LEU A 103 -7.474 -0.482 16.282 1.00 75.05 H new ATOM 0 HA LEU A 103 -7.268 -1.733 13.618 1.00 52.52 H new ATOM 0 HB2 LEU A 103 -5.698 0.596 14.757 1.00 32.32 H new ATOM 0 HB3 LEU A 103 -5.372 -0.212 13.237 1.00 32.32 H new ATOM 0 HG LEU A 103 -7.945 1.261 13.841 1.00 74.00 H new ATOM 0 HD11 LEU A 103 -7.002 3.043 12.435 1.00 64.14 H new ATOM 0 HD12 LEU A 103 -6.022 2.775 13.897 1.00 64.14 H new ATOM 0 HD13 LEU A 103 -5.470 2.143 12.327 1.00 64.14 H new ATOM 0 HD21 LEU A 103 -8.242 1.170 11.402 1.00 63.21 H new ATOM 0 HD22 LEU A 103 -6.741 0.225 11.254 1.00 63.21 H new ATOM 0 HD23 LEU A 103 -8.143 -0.459 12.111 1.00 63.21 H new ATOM 1029 N PRO A 104 -5.126 -2.946 14.440 1.00 22.11 N ATOM 1030 CA PRO A 104 -4.046 -3.732 15.022 1.00 30.52 C ATOM 1031 C PRO A 104 -2.814 -2.852 15.309 1.00 51.51 C ATOM 1032 O PRO A 104 -2.868 -1.617 15.204 1.00 73.45 O ATOM 1033 CB PRO A 104 -3.700 -4.764 13.938 1.00 12.14 C ATOM 1034 CG PRO A 104 -4.777 -4.655 12.919 1.00 22.13 C ATOM 1035 CD PRO A 104 -5.335 -3.274 13.027 1.00 21.31 C ATOM 0 HA PRO A 104 -4.338 -4.184 15.970 1.00 30.52 H new ATOM 0 HB2 PRO A 104 -2.724 -4.558 13.499 1.00 12.14 H new ATOM 0 HB3 PRO A 104 -3.656 -5.770 14.355 1.00 12.14 H new ATOM 0 HG2 PRO A 104 -4.383 -4.835 11.919 1.00 22.13 H new ATOM 0 HG3 PRO A 104 -5.553 -5.400 13.095 1.00 22.13 H new ATOM 0 HD2 PRO A 104 -4.817 -2.576 12.369 1.00 21.31 H new ATOM 0 HD3 PRO A 104 -6.390 -3.242 12.757 1.00 21.31 H new ATOM 1043 N VAL A 105 -1.714 -3.474 15.646 1.00 34.02 N ATOM 1044 CA VAL A 105 -0.512 -2.739 15.936 1.00 30.53 C ATOM 1045 C VAL A 105 0.214 -2.430 14.605 1.00 13.43 C ATOM 1046 O VAL A 105 -0.226 -2.918 13.547 1.00 43.34 O ATOM 1047 CB VAL A 105 0.375 -3.525 16.925 1.00 3.41 C ATOM 1048 CG1 VAL A 105 1.224 -4.604 16.256 1.00 62.22 C ATOM 1049 CG2 VAL A 105 1.188 -2.603 17.783 1.00 30.10 C ATOM 0 H VAL A 105 -1.626 -4.487 15.726 1.00 34.02 H new ATOM 0 HA VAL A 105 -0.752 -1.793 16.421 1.00 30.53 H new ATOM 0 HB VAL A 105 -0.305 -4.067 17.582 1.00 3.41 H new ATOM 0 HG11 VAL A 105 1.822 -5.116 17.010 1.00 62.22 H new ATOM 0 HG12 VAL A 105 0.573 -5.323 15.759 1.00 62.22 H new ATOM 0 HG13 VAL A 105 1.884 -4.144 15.521 1.00 62.22 H new ATOM 0 HG21 VAL A 105 1.801 -3.189 18.468 1.00 30.10 H new ATOM 0 HG22 VAL A 105 1.833 -1.992 17.151 1.00 30.10 H new ATOM 0 HG23 VAL A 105 0.522 -1.957 18.355 1.00 30.10 H new ATOM 1059 N ASP A 106 1.308 -1.666 14.636 1.00 44.10 N ATOM 1060 CA ASP A 106 1.953 -1.239 13.387 1.00 21.24 C ATOM 1061 C ASP A 106 2.716 -2.419 12.797 1.00 33.43 C ATOM 1062 O ASP A 106 2.988 -3.396 13.530 1.00 21.22 O ATOM 1063 CB ASP A 106 2.892 -0.028 13.632 1.00 2.52 C ATOM 1064 CG ASP A 106 2.810 1.003 12.526 1.00 51.12 C ATOM 1065 OD1 ASP A 106 1.671 1.312 12.065 1.00 75.31 O ATOM 1066 OD2 ASP A 106 3.854 1.529 12.136 1.00 71.41 O ATOM 0 H ASP A 106 1.759 -1.335 15.489 1.00 44.10 H new ATOM 0 HA ASP A 106 1.192 -0.914 12.678 1.00 21.24 H new ATOM 0 HB2 ASP A 106 2.634 0.441 14.581 1.00 2.52 H new ATOM 0 HB3 ASP A 106 3.920 -0.381 13.720 1.00 2.52 H new ATOM 1071 N PRO A 107 2.983 -2.427 11.460 1.00 50.10 N ATOM 1072 CA PRO A 107 3.781 -3.461 10.797 1.00 35.04 C ATOM 1073 C PRO A 107 5.105 -3.746 11.497 1.00 44.12 C ATOM 1074 O PRO A 107 5.515 -3.047 12.417 1.00 54.42 O ATOM 1075 CB PRO A 107 4.076 -2.864 9.416 1.00 42.04 C ATOM 1076 CG PRO A 107 3.600 -1.450 9.481 1.00 54.42 C ATOM 1077 CD PRO A 107 2.503 -1.451 10.479 1.00 34.41 C ATOM 0 HA PRO A 107 3.243 -4.409 10.785 1.00 35.04 H new ATOM 0 HB2 PRO A 107 5.141 -2.909 9.189 1.00 42.04 H new ATOM 0 HB3 PRO A 107 3.559 -3.416 8.631 1.00 42.04 H new ATOM 0 HG2 PRO A 107 4.404 -0.778 9.781 1.00 54.42 H new ATOM 0 HG3 PRO A 107 3.246 -1.109 8.508 1.00 54.42 H new ATOM 0 HD2 PRO A 107 2.354 -0.466 10.922 1.00 34.41 H new ATOM 0 HD3 PRO A 107 1.552 -1.749 10.039 1.00 34.41 H new ATOM 1085 N TRP A 108 5.756 -4.797 11.036 1.00 30.43 N ATOM 1086 CA TRP A 108 7.070 -5.279 11.508 1.00 54.44 C ATOM 1087 C TRP A 108 6.964 -5.804 12.943 1.00 4.40 C ATOM 1088 O TRP A 108 7.975 -6.061 13.610 1.00 72.00 O ATOM 1089 CB TRP A 108 8.130 -4.156 11.486 1.00 73.25 C ATOM 1090 CG TRP A 108 8.075 -3.278 10.289 1.00 74.22 C ATOM 1091 CD1 TRP A 108 8.320 -3.626 9.013 1.00 62.22 C ATOM 1092 CD2 TRP A 108 7.730 -1.883 10.274 1.00 53.01 C ATOM 1093 NE1 TRP A 108 8.174 -2.537 8.196 1.00 54.44 N ATOM 1094 CE2 TRP A 108 7.808 -1.456 8.952 1.00 72.04 C ATOM 1095 CE3 TRP A 108 7.366 -0.956 11.265 1.00 74.24 C ATOM 1096 CZ2 TRP A 108 7.539 -0.155 8.582 1.00 54.32 C ATOM 1097 CZ3 TRP A 108 7.089 0.332 10.898 1.00 54.30 C ATOM 1098 CH2 TRP A 108 7.177 0.730 9.579 1.00 11.22 C ATOM 0 H TRP A 108 5.377 -5.376 10.286 1.00 30.43 H new ATOM 0 HA TRP A 108 7.376 -6.077 10.831 1.00 54.44 H new ATOM 0 HB2 TRP A 108 8.007 -3.541 12.378 1.00 73.25 H new ATOM 0 HB3 TRP A 108 9.120 -4.608 11.544 1.00 73.25 H new ATOM 0 HD1 TRP A 108 8.592 -4.617 8.682 1.00 62.22 H new ATOM 0 HE1 TRP A 108 8.315 -2.532 7.186 1.00 54.44 H new ATOM 0 HE3 TRP A 108 7.306 -1.256 12.301 1.00 74.24 H new ATOM 0 HZ2 TRP A 108 7.609 0.160 7.551 1.00 54.32 H new ATOM 0 HZ3 TRP A 108 6.797 1.049 11.651 1.00 54.30 H new ATOM 0 HH2 TRP A 108 6.958 1.756 9.321 1.00 11.22 H new ATOM 1109 N GLY A 109 5.740 -6.014 13.380 1.00 23.23 N ATOM 1110 CA GLY A 109 5.447 -6.493 14.721 1.00 44.45 C ATOM 1111 C GLY A 109 5.686 -5.454 15.829 1.00 63.01 C ATOM 1112 O GLY A 109 5.448 -5.737 17.006 1.00 44.53 O ATOM 0 H GLY A 109 4.909 -5.856 12.810 1.00 23.23 H new ATOM 0 HA2 GLY A 109 4.407 -6.816 14.760 1.00 44.45 H new ATOM 0 HA3 GLY A 109 6.061 -7.371 14.923 1.00 44.45 H new ATOM 1116 N ASN A 110 6.177 -4.280 15.472 1.00 65.04 N ATOM 1117 CA ASN A 110 6.449 -3.230 16.441 1.00 25.44 C ATOM 1118 C ASN A 110 5.193 -2.621 17.035 1.00 60.52 C ATOM 1119 O ASN A 110 4.197 -2.347 16.322 1.00 33.23 O ATOM 1120 CB ASN A 110 7.358 -2.111 15.887 1.00 4.20 C ATOM 1121 CG ASN A 110 8.800 -2.540 15.684 1.00 2.41 C ATOM 1122 OD1 ASN A 110 9.604 -2.503 16.620 1.00 31.22 O ATOM 1123 ND2 ASN A 110 9.164 -2.857 14.473 1.00 22.13 N ATOM 0 H ASN A 110 6.398 -4.028 14.509 1.00 65.04 H new ATOM 0 HA ASN A 110 6.987 -3.740 17.240 1.00 25.44 H new ATOM 0 HB2 ASN A 110 6.954 -1.765 14.936 1.00 4.20 H new ATOM 0 HB3 ASN A 110 7.333 -1.263 16.571 1.00 4.20 H new ATOM 0 HD21 ASN A 110 10.139 -3.084 14.276 1.00 22.13 H new ATOM 0 HD22 ASN A 110 8.474 -2.878 13.722 1.00 22.13 H new ATOM 1130 N PRO A 111 5.194 -2.451 18.367 1.00 61.13 N ATOM 1131 CA PRO A 111 4.135 -1.759 19.059 1.00 32.54 C ATOM 1132 C PRO A 111 4.199 -0.275 18.772 1.00 13.33 C ATOM 1133 O PRO A 111 5.257 0.239 18.418 1.00 34.41 O ATOM 1134 CB PRO A 111 4.429 -2.024 20.545 1.00 64.52 C ATOM 1135 CG PRO A 111 5.890 -2.276 20.600 1.00 4.44 C ATOM 1136 CD PRO A 111 6.232 -2.950 19.307 1.00 44.03 C ATOM 0 HA PRO A 111 3.144 -2.096 18.755 1.00 32.54 H new ATOM 0 HB2 PRO A 111 4.151 -1.170 21.162 1.00 64.52 H new ATOM 0 HB3 PRO A 111 3.865 -2.881 20.914 1.00 64.52 H new ATOM 0 HG2 PRO A 111 6.444 -1.345 20.715 1.00 4.44 H new ATOM 0 HG3 PRO A 111 6.147 -2.907 21.451 1.00 4.44 H new ATOM 0 HD2 PRO A 111 7.236 -2.688 18.972 1.00 44.03 H new ATOM 0 HD3 PRO A 111 6.200 -4.036 19.400 1.00 44.03 H new ATOM 1144 N TYR A 112 3.089 0.412 18.864 1.00 70.43 N ATOM 1145 CA TYR A 112 3.156 1.835 18.763 1.00 65.31 C ATOM 1146 C TYR A 112 3.758 2.339 20.055 1.00 65.24 C ATOM 1147 O TYR A 112 3.447 1.822 21.132 1.00 74.21 O ATOM 1148 CB TYR A 112 1.784 2.485 18.543 1.00 40.01 C ATOM 1149 CG TYR A 112 1.163 2.336 17.157 1.00 15.25 C ATOM 1150 CD1 TYR A 112 1.548 3.179 16.124 1.00 64.53 C ATOM 1151 CD2 TYR A 112 0.147 1.418 16.904 1.00 54.41 C ATOM 1152 CE1 TYR A 112 0.951 3.112 14.876 1.00 45.24 C ATOM 1153 CE2 TYR A 112 -0.470 1.356 15.657 1.00 33.55 C ATOM 1154 CZ TYR A 112 -0.060 2.207 14.646 1.00 72.33 C ATOM 1155 OH TYR A 112 -0.699 2.182 13.413 1.00 44.10 O ATOM 0 H TYR A 112 2.158 0.019 19.004 1.00 70.43 H new ATOM 0 HA TYR A 112 3.759 2.101 17.895 1.00 65.31 H new ATOM 0 HB2 TYR A 112 1.090 2.067 19.272 1.00 40.01 H new ATOM 0 HB3 TYR A 112 1.874 3.549 18.762 1.00 40.01 H new ATOM 0 HD1 TYR A 112 2.330 3.903 16.297 1.00 64.53 H new ATOM 0 HD2 TYR A 112 -0.167 0.744 17.687 1.00 54.41 H new ATOM 0 HE1 TYR A 112 1.279 3.769 14.084 1.00 45.24 H new ATOM 0 HE2 TYR A 112 -1.265 0.647 15.480 1.00 33.55 H new ATOM 0 HH TYR A 112 -0.065 1.897 12.722 1.00 44.10 H new ATOM 1165 N GLN A 113 4.582 3.320 19.976 1.00 32.43 N ATOM 1166 CA GLN A 113 5.226 3.828 21.161 1.00 13.41 C ATOM 1167 C GLN A 113 4.504 5.115 21.524 1.00 41.02 C ATOM 1168 O GLN A 113 4.538 6.091 20.770 1.00 14.52 O ATOM 1169 CB GLN A 113 6.726 4.204 20.934 1.00 11.52 C ATOM 1170 CG GLN A 113 7.529 3.486 19.821 1.00 54.51 C ATOM 1171 CD GLN A 113 7.693 1.974 19.917 1.00 33.34 C ATOM 1172 OE1 GLN A 113 7.837 1.296 18.869 1.00 24.34 O ATOM 1173 NE2 GLN A 113 7.706 1.432 21.119 1.00 12.40 N ATOM 0 H GLN A 113 4.835 3.796 19.110 1.00 32.43 H new ATOM 0 HA GLN A 113 5.186 3.054 21.928 1.00 13.41 H new ATOM 0 HB2 GLN A 113 6.768 5.274 20.729 1.00 11.52 H new ATOM 0 HB3 GLN A 113 7.251 4.039 21.875 1.00 11.52 H new ATOM 0 HG2 GLN A 113 7.051 3.710 18.867 1.00 54.51 H new ATOM 0 HG3 GLN A 113 8.525 3.928 19.790 1.00 54.51 H new ATOM 0 HE21 GLN A 113 7.585 2.019 21.944 1.00 12.40 H new ATOM 0 HE22 GLN A 113 7.837 0.426 21.223 1.00 12.40 H new ATOM 1182 N TYR A 114 3.837 5.093 22.644 1.00 71.21 N ATOM 1183 CA TYR A 114 3.088 6.224 23.137 1.00 54.11 C ATOM 1184 C TYR A 114 3.806 6.951 24.274 1.00 64.43 C ATOM 1185 O TYR A 114 4.162 6.353 25.288 1.00 52.45 O ATOM 1186 CB TYR A 114 1.655 5.788 23.562 1.00 62.55 C ATOM 1187 CG TYR A 114 1.535 4.380 24.189 1.00 42.53 C ATOM 1188 CD1 TYR A 114 2.334 3.961 25.255 1.00 24.34 C ATOM 1189 CD2 TYR A 114 0.615 3.474 23.689 1.00 35.22 C ATOM 1190 CE1 TYR A 114 2.211 2.688 25.785 1.00 54.42 C ATOM 1191 CE2 TYR A 114 0.489 2.200 24.216 1.00 10.23 C ATOM 1192 CZ TYR A 114 1.282 1.817 25.257 1.00 14.30 C ATOM 1193 OH TYR A 114 1.158 0.544 25.766 1.00 52.15 O ATOM 0 H TYR A 114 3.795 4.276 23.253 1.00 71.21 H new ATOM 0 HA TYR A 114 3.005 6.938 22.317 1.00 54.11 H new ATOM 0 HB2 TYR A 114 1.272 6.516 24.276 1.00 62.55 H new ATOM 0 HB3 TYR A 114 1.008 5.830 22.685 1.00 62.55 H new ATOM 0 HD1 TYR A 114 3.061 4.642 25.673 1.00 24.34 H new ATOM 0 HD2 TYR A 114 -0.020 3.769 22.867 1.00 35.22 H new ATOM 0 HE1 TYR A 114 2.839 2.379 26.607 1.00 54.42 H new ATOM 0 HE2 TYR A 114 -0.235 1.512 23.804 1.00 10.23 H new ATOM 0 HH TYR A 114 0.456 0.064 25.279 1.00 52.15 H new ATOM 1203 N LEU A 115 4.091 8.206 24.055 1.00 51.23 N ATOM 1204 CA LEU A 115 4.637 9.082 25.060 1.00 74.35 C ATOM 1205 C LEU A 115 3.813 10.351 25.117 1.00 20.03 C ATOM 1206 O LEU A 115 3.178 10.732 24.130 1.00 53.21 O ATOM 1207 CB LEU A 115 6.106 9.400 24.791 1.00 62.35 C ATOM 1208 CG LEU A 115 7.092 8.242 24.933 1.00 72.24 C ATOM 1209 CD1 LEU A 115 8.471 8.675 24.480 1.00 4.25 C ATOM 1210 CD2 LEU A 115 7.138 7.759 26.380 1.00 3.31 C ATOM 0 H LEU A 115 3.947 8.660 23.153 1.00 51.23 H new ATOM 0 HA LEU A 115 4.592 8.576 26.025 1.00 74.35 H new ATOM 0 HB2 LEU A 115 6.189 9.797 23.779 1.00 62.35 H new ATOM 0 HB3 LEU A 115 6.413 10.195 25.471 1.00 62.35 H new ATOM 0 HG LEU A 115 6.758 7.418 24.303 1.00 72.24 H new ATOM 0 HD11 LEU A 115 9.167 7.842 24.585 1.00 4.25 H new ATOM 0 HD12 LEU A 115 8.430 8.984 23.436 1.00 4.25 H new ATOM 0 HD13 LEU A 115 8.810 9.510 25.093 1.00 4.25 H new ATOM 0 HD21 LEU A 115 7.845 6.934 26.466 1.00 3.31 H new ATOM 0 HD22 LEU A 115 7.455 8.577 27.027 1.00 3.31 H new ATOM 0 HD23 LEU A 115 6.147 7.421 26.682 1.00 3.31 H new ATOM 1222 N ALA A 116 3.802 10.988 26.240 1.00 4.51 N ATOM 1223 CA ALA A 116 3.080 12.192 26.396 1.00 74.01 C ATOM 1224 C ALA A 116 4.101 13.366 26.511 1.00 22.31 C ATOM 1225 O ALA A 116 5.309 13.069 26.507 1.00 1.02 O ATOM 1226 CB ALA A 116 2.126 12.025 27.538 1.00 3.50 C ATOM 0 H ALA A 116 4.299 10.681 27.076 1.00 4.51 H new ATOM 0 HA ALA A 116 2.456 12.442 25.538 1.00 74.01 H new ATOM 0 HB1 ALA A 116 1.558 12.945 27.675 1.00 3.50 H new ATOM 0 HB2 ALA A 116 1.441 11.205 27.323 1.00 3.50 H new ATOM 0 HB3 ALA A 116 2.683 11.804 28.448 1.00 3.50 H new ATOM 1232 N PRO A 117 3.677 14.671 26.691 1.00 72.12 N ATOM 1233 CA PRO A 117 4.537 15.836 26.435 1.00 64.22 C ATOM 1234 C PRO A 117 5.887 15.823 27.060 1.00 61.11 C ATOM 1235 O PRO A 117 6.042 15.834 28.288 1.00 71.43 O ATOM 1236 CB PRO A 117 3.728 17.052 26.873 1.00 43.00 C ATOM 1237 CG PRO A 117 2.699 16.502 27.787 1.00 63.34 C ATOM 1238 CD PRO A 117 2.410 15.111 27.283 1.00 22.30 C ATOM 0 HA PRO A 117 4.787 15.840 25.374 1.00 64.22 H new ATOM 0 HB2 PRO A 117 4.356 17.786 27.378 1.00 43.00 H new ATOM 0 HB3 PRO A 117 3.273 17.555 26.020 1.00 43.00 H new ATOM 0 HG2 PRO A 117 3.060 16.479 28.815 1.00 63.34 H new ATOM 0 HG3 PRO A 117 1.799 17.117 27.779 1.00 63.34 H new ATOM 0 HD2 PRO A 117 2.099 14.451 28.093 1.00 22.30 H new ATOM 0 HD3 PRO A 117 1.606 15.113 26.547 1.00 22.30 H new ATOM 1289 N GLY A 121 6.250 19.462 23.354 1.00 23.12 N ATOM 1290 CA GLY A 121 5.275 18.822 22.533 1.00 53.35 C ATOM 1291 C GLY A 121 4.278 18.050 23.305 1.00 22.22 C ATOM 1292 O GLY A 121 4.658 17.106 23.966 1.00 51.54 O ATOM 0 HA2 GLY A 121 4.759 19.576 21.938 1.00 53.35 H new ATOM 0 HA3 GLY A 121 5.780 18.155 21.834 1.00 53.35 H new ATOM 1296 N PRO A 122 2.976 18.477 23.250 1.00 2.32 N ATOM 1297 CA PRO A 122 1.814 17.830 23.915 1.00 15.51 C ATOM 1298 C PRO A 122 1.726 16.295 23.840 1.00 2.31 C ATOM 1299 O PRO A 122 1.054 15.701 24.683 1.00 71.23 O ATOM 1300 CB PRO A 122 0.641 18.458 23.197 1.00 61.41 C ATOM 1301 CG PRO A 122 1.097 19.843 22.983 1.00 21.12 C ATOM 1302 CD PRO A 122 2.529 19.714 22.554 1.00 35.43 C ATOM 0 HA PRO A 122 1.871 17.993 24.991 1.00 15.51 H new ATOM 0 HB2 PRO A 122 0.425 17.953 22.256 1.00 61.41 H new ATOM 0 HB3 PRO A 122 -0.269 18.419 23.796 1.00 61.41 H new ATOM 0 HG2 PRO A 122 0.499 20.343 22.221 1.00 21.12 H new ATOM 0 HG3 PRO A 122 1.009 20.434 23.895 1.00 21.12 H new ATOM 0 HD2 PRO A 122 2.620 19.623 21.472 1.00 35.43 H new ATOM 0 HD3 PRO A 122 3.119 20.581 22.852 1.00 35.43 H new ATOM 1310 N PHE A 123 2.335 15.663 22.834 1.00 14.23 N ATOM 1311 CA PHE A 123 2.396 14.192 22.785 1.00 45.13 C ATOM 1312 C PHE A 123 3.350 13.695 21.721 1.00 32.33 C ATOM 1313 O PHE A 123 3.442 14.286 20.619 1.00 2.15 O ATOM 1314 CB PHE A 123 1.004 13.491 22.684 1.00 44.22 C ATOM 1315 CG PHE A 123 0.159 13.812 21.466 1.00 42.42 C ATOM 1316 CD1 PHE A 123 0.340 13.125 20.273 1.00 23.20 C ATOM 1317 CD2 PHE A 123 -0.842 14.769 21.533 1.00 24.34 C ATOM 1318 CE1 PHE A 123 -0.456 13.386 19.177 1.00 35.41 C ATOM 1319 CE2 PHE A 123 -1.638 15.038 20.436 1.00 1.30 C ATOM 1320 CZ PHE A 123 -1.446 14.345 19.257 1.00 42.54 C ATOM 0 H PHE A 123 2.788 16.134 22.051 1.00 14.23 H new ATOM 0 HA PHE A 123 2.795 13.900 23.756 1.00 45.13 H new ATOM 0 HB2 PHE A 123 1.165 12.413 22.711 1.00 44.22 H new ATOM 0 HB3 PHE A 123 0.429 13.750 23.573 1.00 44.22 H new ATOM 0 HD1 PHE A 123 1.115 12.376 20.202 1.00 23.20 H new ATOM 0 HD2 PHE A 123 -1.001 15.311 22.454 1.00 24.34 H new ATOM 0 HE1 PHE A 123 -0.305 12.841 18.257 1.00 35.41 H new ATOM 0 HE2 PHE A 123 -2.410 15.790 20.501 1.00 1.30 H new ATOM 0 HZ PHE A 123 -2.069 14.553 18.400 1.00 42.54 H new ATOM 1330 N ASP A 124 4.029 12.602 22.032 1.00 24.03 N ATOM 1331 CA ASP A 124 5.025 12.029 21.149 1.00 64.50 C ATOM 1332 C ASP A 124 4.621 10.608 20.873 1.00 12.24 C ATOM 1333 O ASP A 124 4.560 9.793 21.792 1.00 41.52 O ATOM 1334 CB ASP A 124 6.423 11.927 21.802 1.00 50.24 C ATOM 1335 CG ASP A 124 6.874 13.075 22.673 1.00 54.23 C ATOM 1336 OD1 ASP A 124 6.615 14.233 22.371 1.00 61.54 O ATOM 1337 OD2 ASP A 124 7.555 12.801 23.697 1.00 10.30 O ATOM 0 H ASP A 124 3.903 12.089 22.905 1.00 24.03 H new ATOM 0 HA ASP A 124 5.079 12.669 20.268 1.00 64.50 H new ATOM 0 HB2 ASP A 124 6.447 11.019 22.404 1.00 50.24 H new ATOM 0 HB3 ASP A 124 7.157 11.801 21.006 1.00 50.24 H new ATOM 1342 N LEU A 125 4.352 10.280 19.657 1.00 3.14 N ATOM 1343 CA LEU A 125 4.018 8.921 19.344 1.00 54.51 C ATOM 1344 C LEU A 125 4.529 8.523 17.995 1.00 0.03 C ATOM 1345 O LEU A 125 4.498 9.303 17.044 1.00 25.01 O ATOM 1346 CB LEU A 125 2.526 8.592 19.587 1.00 34.24 C ATOM 1347 CG LEU A 125 1.459 9.403 18.852 1.00 32.35 C ATOM 1348 CD1 LEU A 125 1.265 8.927 17.419 1.00 2.52 C ATOM 1349 CD2 LEU A 125 0.172 9.341 19.626 1.00 41.20 C ATOM 0 H LEU A 125 4.355 10.922 18.865 1.00 3.14 H new ATOM 0 HA LEU A 125 4.546 8.286 20.056 1.00 54.51 H new ATOM 0 HB2 LEU A 125 2.375 7.543 19.333 1.00 34.24 H new ATOM 0 HB3 LEU A 125 2.337 8.692 20.656 1.00 34.24 H new ATOM 0 HG LEU A 125 1.793 10.438 18.788 1.00 32.35 H new ATOM 0 HD11 LEU A 125 0.498 9.532 16.935 1.00 2.52 H new ATOM 0 HD12 LEU A 125 2.203 9.026 16.873 1.00 2.52 H new ATOM 0 HD13 LEU A 125 0.955 7.882 17.422 1.00 2.52 H new ATOM 0 HD21 LEU A 125 -0.593 9.918 19.107 1.00 41.20 H new ATOM 0 HD22 LEU A 125 -0.151 8.304 19.712 1.00 41.20 H new ATOM 0 HD23 LEU A 125 0.326 9.757 20.622 1.00 41.20 H new ATOM 1361 N TYR A 126 5.014 7.328 17.922 1.00 40.31 N ATOM 1362 CA TYR A 126 5.644 6.806 16.739 1.00 63.22 C ATOM 1363 C TYR A 126 5.775 5.322 16.892 1.00 52.35 C ATOM 1364 O TYR A 126 5.523 4.818 17.954 1.00 31.42 O ATOM 1365 CB TYR A 126 7.037 7.481 16.501 1.00 45.35 C ATOM 1366 CG TYR A 126 8.044 7.395 17.645 1.00 74.54 C ATOM 1367 CD1 TYR A 126 8.080 8.376 18.634 1.00 64.03 C ATOM 1368 CD2 TYR A 126 8.981 6.369 17.713 1.00 2.05 C ATOM 1369 CE1 TYR A 126 9.005 8.331 19.651 1.00 44.32 C ATOM 1370 CE2 TYR A 126 9.915 6.325 18.728 1.00 70.35 C ATOM 1371 CZ TYR A 126 9.922 7.308 19.692 1.00 25.44 C ATOM 1372 OH TYR A 126 10.855 7.271 20.704 1.00 30.03 O ATOM 0 H TYR A 126 4.986 6.666 18.698 1.00 40.31 H new ATOM 0 HA TYR A 126 5.034 7.029 15.864 1.00 63.22 H new ATOM 0 HB2 TYR A 126 7.487 7.030 15.617 1.00 45.35 H new ATOM 0 HB3 TYR A 126 6.871 8.534 16.272 1.00 45.35 H new ATOM 0 HD1 TYR A 126 7.368 9.187 18.601 1.00 64.03 H new ATOM 0 HD2 TYR A 126 8.977 5.595 16.960 1.00 2.05 H new ATOM 0 HE1 TYR A 126 9.011 9.096 20.414 1.00 44.32 H new ATOM 0 HE2 TYR A 126 10.637 5.523 18.766 1.00 70.35 H new ATOM 0 HH TYR A 126 11.733 7.523 20.349 1.00 30.03 H new ATOM 1382 N SER A 127 6.091 4.642 15.862 1.00 2.40 N ATOM 1383 CA SER A 127 6.345 3.234 15.918 1.00 31.24 C ATOM 1384 C SER A 127 7.723 2.970 15.355 1.00 23.34 C ATOM 1385 O SER A 127 8.133 3.627 14.385 1.00 32.00 O ATOM 1386 CB SER A 127 5.256 2.486 15.145 1.00 71.23 C ATOM 1387 OG SER A 127 4.969 3.152 13.933 1.00 44.42 O ATOM 0 H SER A 127 6.186 5.044 14.929 1.00 2.40 H new ATOM 0 HA SER A 127 6.320 2.875 16.947 1.00 31.24 H new ATOM 0 HB2 SER A 127 5.582 1.466 14.939 1.00 71.23 H new ATOM 0 HB3 SER A 127 4.353 2.416 15.752 1.00 71.23 H new ATOM 0 HG SER A 127 4.668 2.501 13.265 1.00 44.42 H new ATOM 1393 N LEU A 128 8.490 2.107 16.011 1.00 15.21 N ATOM 1394 CA LEU A 128 9.807 1.757 15.483 1.00 12.14 C ATOM 1395 C LEU A 128 9.702 1.074 14.129 1.00 73.42 C ATOM 1396 O LEU A 128 8.862 0.202 13.935 1.00 25.22 O ATOM 1397 CB LEU A 128 10.612 0.903 16.466 1.00 65.23 C ATOM 1398 CG LEU A 128 11.506 1.664 17.479 1.00 73.43 C ATOM 1399 CD1 LEU A 128 10.737 2.694 18.278 1.00 3.54 C ATOM 1400 CD2 LEU A 128 12.192 0.692 18.413 1.00 41.12 C ATOM 0 H LEU A 128 8.235 1.647 16.885 1.00 15.21 H new ATOM 0 HA LEU A 128 10.349 2.693 15.346 1.00 12.14 H new ATOM 0 HB2 LEU A 128 9.914 0.282 17.028 1.00 65.23 H new ATOM 0 HB3 LEU A 128 11.247 0.229 15.891 1.00 65.23 H new ATOM 0 HG LEU A 128 12.254 2.201 16.896 1.00 73.43 H new ATOM 0 HD11 LEU A 128 11.413 3.196 18.971 1.00 3.54 H new ATOM 0 HD12 LEU A 128 10.301 3.428 17.601 1.00 3.54 H new ATOM 0 HD13 LEU A 128 9.943 2.201 18.839 1.00 3.54 H new ATOM 0 HD21 LEU A 128 12.815 1.243 19.117 1.00 41.12 H new ATOM 0 HD22 LEU A 128 11.441 0.123 18.961 1.00 41.12 H new ATOM 0 HD23 LEU A 128 12.814 0.009 17.835 1.00 41.12 H new ATOM 1412 N GLY A 129 10.556 1.495 13.200 1.00 0.53 N ATOM 1413 CA GLY A 129 10.555 0.939 11.864 1.00 11.23 C ATOM 1414 C GLY A 129 11.048 -0.472 11.822 1.00 21.21 C ATOM 1415 O GLY A 129 11.354 -1.086 12.858 1.00 65.32 O ATOM 0 H GLY A 129 11.256 2.221 13.355 1.00 0.53 H new ATOM 0 HA2 GLY A 129 9.543 0.977 11.460 1.00 11.23 H new ATOM 0 HA3 GLY A 129 11.179 1.556 11.218 1.00 11.23 H new ATOM 1419 N ALA A 130 11.215 -0.959 10.627 1.00 3.32 N ATOM 1420 CA ALA A 130 11.586 -2.338 10.366 1.00 30.20 C ATOM 1421 C ALA A 130 12.966 -2.720 10.886 1.00 31.34 C ATOM 1422 O ALA A 130 13.349 -3.884 10.846 1.00 30.23 O ATOM 1423 CB ALA A 130 11.508 -2.594 8.899 1.00 64.14 C ATOM 0 H ALA A 130 11.096 -0.403 9.780 1.00 3.32 H new ATOM 0 HA ALA A 130 10.879 -2.962 10.913 1.00 30.20 H new ATOM 0 HB1 ALA A 130 11.785 -3.628 8.695 1.00 64.14 H new ATOM 0 HB2 ALA A 130 10.490 -2.416 8.552 1.00 64.14 H new ATOM 0 HB3 ALA A 130 12.192 -1.925 8.376 1.00 64.14 H new ATOM 1429 N ASP A 131 13.719 -1.765 11.355 1.00 43.13 N ATOM 1430 CA ASP A 131 15.037 -2.067 11.870 1.00 55.31 C ATOM 1431 C ASP A 131 14.978 -2.265 13.377 1.00 54.42 C ATOM 1432 O ASP A 131 15.946 -2.667 13.996 1.00 25.24 O ATOM 1433 CB ASP A 131 16.039 -0.973 11.496 1.00 3.02 C ATOM 1434 CG ASP A 131 17.476 -1.365 11.779 1.00 70.53 C ATOM 1435 OD1 ASP A 131 17.976 -2.348 11.169 1.00 62.23 O ATOM 1436 OD2 ASP A 131 18.144 -0.696 12.586 1.00 41.35 O ATOM 0 H ASP A 131 13.453 -0.781 11.394 1.00 43.13 H new ATOM 0 HA ASP A 131 15.382 -2.995 11.414 1.00 55.31 H new ATOM 0 HB2 ASP A 131 15.934 -0.738 10.437 1.00 3.02 H new ATOM 0 HB3 ASP A 131 15.800 -0.065 12.049 1.00 3.02 H new ATOM 1441 N GLY A 132 13.812 -1.991 13.960 1.00 15.14 N ATOM 1442 CA GLY A 132 13.635 -2.143 15.398 1.00 11.41 C ATOM 1443 C GLY A 132 14.407 -1.099 16.171 1.00 73.24 C ATOM 1444 O GLY A 132 14.735 -1.284 17.338 1.00 73.24 O ATOM 0 H GLY A 132 12.984 -1.665 13.461 1.00 15.14 H new ATOM 0 HA2 GLY A 132 12.576 -2.068 15.644 1.00 11.41 H new ATOM 0 HA3 GLY A 132 13.963 -3.137 15.702 1.00 11.41 H new ATOM 1448 N LYS A 133 14.708 -0.015 15.507 1.00 32.42 N ATOM 1449 CA LYS A 133 15.450 1.065 16.078 1.00 30.04 C ATOM 1450 C LYS A 133 14.840 2.351 15.581 1.00 31.55 C ATOM 1451 O LYS A 133 14.360 2.398 14.440 1.00 71.13 O ATOM 1452 CB LYS A 133 16.915 0.956 15.628 1.00 34.12 C ATOM 1453 CG LYS A 133 17.854 2.000 16.206 1.00 32.45 C ATOM 1454 CD LYS A 133 19.258 1.817 15.654 1.00 41.03 C ATOM 1455 CE LYS A 133 20.238 2.826 16.233 1.00 5.10 C ATOM 1456 NZ LYS A 133 19.871 4.226 15.922 1.00 70.14 N ATOM 0 H LYS A 133 14.437 0.140 14.536 1.00 32.42 H new ATOM 0 HA LYS A 133 15.418 1.037 17.167 1.00 30.04 H new ATOM 0 HB2 LYS A 133 17.288 -0.032 15.898 1.00 34.12 H new ATOM 0 HB3 LYS A 133 16.949 1.024 14.541 1.00 34.12 H new ATOM 0 HG2 LYS A 133 17.490 2.999 15.965 1.00 32.45 H new ATOM 0 HG3 LYS A 133 17.871 1.920 17.293 1.00 32.45 H new ATOM 0 HD2 LYS A 133 19.605 0.808 15.875 1.00 41.03 H new ATOM 0 HD3 LYS A 133 19.236 1.916 14.569 1.00 41.03 H new ATOM 0 HE2 LYS A 133 20.286 2.700 17.315 1.00 5.10 H new ATOM 0 HE3 LYS A 133 21.235 2.622 15.844 1.00 5.10 H new ATOM 0 HZ1 LYS A 133 20.646 4.859 16.206 1.00 70.14 H new ATOM 0 HZ2 LYS A 133 19.702 4.322 14.900 1.00 70.14 H new ATOM 0 HZ3 LYS A 133 19.007 4.482 16.441 1.00 70.14 H new ATOM 1470 N GLU A 134 14.797 3.362 16.416 1.00 0.34 N ATOM 1471 CA GLU A 134 14.304 4.646 15.986 1.00 64.33 C ATOM 1472 C GLU A 134 15.413 5.415 15.248 1.00 1.44 C ATOM 1473 O GLU A 134 16.416 5.838 15.839 1.00 71.10 O ATOM 1474 CB GLU A 134 13.651 5.439 17.150 1.00 2.20 C ATOM 1475 CG GLU A 134 14.527 5.698 18.367 1.00 72.10 C ATOM 1476 CD GLU A 134 13.767 6.402 19.472 1.00 54.42 C ATOM 1477 OE1 GLU A 134 13.355 7.569 19.283 1.00 42.42 O ATOM 1478 OE2 GLU A 134 13.567 5.813 20.552 1.00 61.21 O ATOM 0 H GLU A 134 15.096 3.320 17.390 1.00 0.34 H new ATOM 0 HA GLU A 134 13.495 4.495 15.271 1.00 64.33 H new ATOM 0 HB2 GLU A 134 13.313 6.400 16.762 1.00 2.20 H new ATOM 0 HB3 GLU A 134 12.763 4.897 17.477 1.00 2.20 H new ATOM 0 HG2 GLU A 134 14.917 4.752 18.741 1.00 72.10 H new ATOM 0 HG3 GLU A 134 15.385 6.303 18.074 1.00 72.10 H new ATOM 1485 N GLY A 135 15.243 5.537 13.951 1.00 13.14 N ATOM 1486 CA GLY A 135 16.241 6.127 13.090 1.00 70.15 C ATOM 1487 C GLY A 135 15.612 6.815 11.904 1.00 2.14 C ATOM 1488 O GLY A 135 14.383 6.907 11.823 1.00 11.43 O ATOM 0 H GLY A 135 14.403 5.228 13.462 1.00 13.14 H new ATOM 0 HA2 GLY A 135 16.833 6.846 13.657 1.00 70.15 H new ATOM 0 HA3 GLY A 135 16.926 5.354 12.742 1.00 70.15 H new ATOM 1492 N GLY A 136 16.431 7.286 10.981 1.00 14.24 N ATOM 1493 CA GLY A 136 15.929 7.965 9.814 1.00 71.03 C ATOM 1494 C GLY A 136 16.189 7.153 8.571 1.00 42.12 C ATOM 1495 O GLY A 136 17.325 6.758 8.305 1.00 20.45 O ATOM 0 H GLY A 136 17.447 7.208 11.023 1.00 14.24 H new ATOM 0 HA2 GLY A 136 14.859 8.141 9.922 1.00 71.03 H new ATOM 0 HA3 GLY A 136 16.405 8.941 9.723 1.00 71.03 H new ATOM 1499 N SER A 137 15.144 6.947 7.817 1.00 41.04 N ATOM 1500 CA SER A 137 15.061 6.085 6.643 1.00 72.44 C ATOM 1501 C SER A 137 13.616 6.167 6.164 1.00 51.12 C ATOM 1502 O SER A 137 12.865 6.982 6.690 1.00 1.32 O ATOM 1503 CB SER A 137 15.453 4.624 6.982 1.00 52.11 C ATOM 1504 OG SER A 137 16.863 4.464 7.132 1.00 24.31 O ATOM 0 H SER A 137 14.255 7.407 8.012 1.00 41.04 H new ATOM 0 HA SER A 137 15.757 6.410 5.869 1.00 72.44 H new ATOM 0 HB2 SER A 137 14.955 4.321 7.903 1.00 52.11 H new ATOM 0 HB3 SER A 137 15.096 3.962 6.193 1.00 52.11 H new ATOM 0 HG SER A 137 17.287 5.345 7.199 1.00 24.31 H new ATOM 1510 N ASP A 138 13.236 5.437 5.150 1.00 61.51 N ATOM 1511 CA ASP A 138 11.821 5.411 4.789 1.00 53.23 C ATOM 1512 C ASP A 138 11.085 4.340 5.570 1.00 71.41 C ATOM 1513 O ASP A 138 10.157 4.639 6.316 1.00 21.01 O ATOM 1514 CB ASP A 138 11.565 5.256 3.280 1.00 64.23 C ATOM 1515 CG ASP A 138 11.963 6.477 2.481 1.00 40.25 C ATOM 1516 OD1 ASP A 138 11.155 7.433 2.372 1.00 4.11 O ATOM 1517 OD2 ASP A 138 13.084 6.510 1.945 1.00 31.41 O ATOM 0 H ASP A 138 13.851 4.867 4.570 1.00 61.51 H new ATOM 0 HA ASP A 138 11.428 6.391 5.060 1.00 53.23 H new ATOM 0 HB2 ASP A 138 12.118 4.392 2.911 1.00 64.23 H new ATOM 0 HB3 ASP A 138 10.507 5.051 3.116 1.00 64.23 H new ATOM 1522 N ASN A 139 11.528 3.109 5.428 1.00 34.11 N ATOM 1523 CA ASN A 139 10.889 1.956 6.077 1.00 72.14 C ATOM 1524 C ASN A 139 11.627 1.556 7.360 1.00 21.33 C ATOM 1525 O ASN A 139 11.039 1.033 8.307 1.00 15.22 O ATOM 1526 CB ASN A 139 10.836 0.781 5.091 1.00 54.10 C ATOM 1527 CG ASN A 139 10.178 -0.469 5.647 1.00 15.24 C ATOM 1528 OD1 ASN A 139 8.977 -0.641 5.566 1.00 75.14 O ATOM 1529 ND2 ASN A 139 10.950 -1.339 6.197 1.00 41.43 N ATOM 0 H ASN A 139 12.341 2.867 4.862 1.00 34.11 H new ATOM 0 HA ASN A 139 9.874 2.234 6.362 1.00 72.14 H new ATOM 0 HB2 ASN A 139 10.297 1.095 4.198 1.00 54.10 H new ATOM 0 HB3 ASN A 139 11.852 0.536 4.780 1.00 54.10 H new ATOM 0 HD21 ASN A 139 10.558 -2.200 6.579 1.00 41.43 H new ATOM 0 HD22 ASN A 139 11.954 -1.168 6.251 1.00 41.43 H new ATOM 1536 N ASP A 140 12.918 1.815 7.403 1.00 31.34 N ATOM 1537 CA ASP A 140 13.716 1.485 8.602 1.00 13.33 C ATOM 1538 C ASP A 140 13.705 2.613 9.611 1.00 32.34 C ATOM 1539 O ASP A 140 14.441 2.591 10.595 1.00 40.25 O ATOM 1540 CB ASP A 140 15.161 1.096 8.261 1.00 73.51 C ATOM 1541 CG ASP A 140 15.284 -0.286 7.675 1.00 43.34 C ATOM 1542 OD1 ASP A 140 15.314 -1.270 8.431 1.00 30.30 O ATOM 1543 OD2 ASP A 140 15.358 -0.427 6.447 1.00 44.34 O ATOM 0 H ASP A 140 13.445 2.246 6.643 1.00 31.34 H new ATOM 0 HA ASP A 140 13.236 0.614 9.049 1.00 13.33 H new ATOM 0 HB2 ASP A 140 15.568 1.820 7.555 1.00 73.51 H new ATOM 0 HB3 ASP A 140 15.769 1.156 9.164 1.00 73.51 H new ATOM 1548 N ALA A 141 12.873 3.585 9.367 1.00 40.20 N ATOM 1549 CA ALA A 141 12.732 4.719 10.244 1.00 30.11 C ATOM 1550 C ALA A 141 11.548 4.559 11.126 1.00 1.11 C ATOM 1551 O ALA A 141 10.620 3.843 10.787 1.00 33.15 O ATOM 1552 CB ALA A 141 12.532 5.960 9.453 1.00 62.34 C ATOM 0 H ALA A 141 12.267 3.616 8.547 1.00 40.20 H new ATOM 0 HA ALA A 141 13.642 4.784 10.841 1.00 30.11 H new ATOM 0 HB1 ALA A 141 12.427 6.809 10.128 1.00 62.34 H new ATOM 0 HB2 ALA A 141 13.391 6.119 8.802 1.00 62.34 H new ATOM 0 HB3 ALA A 141 11.631 5.864 8.848 1.00 62.34 H new ATOM 1558 N ASP A 142 11.579 5.219 12.245 1.00 15.20 N ATOM 1559 CA ASP A 142 10.444 5.263 13.114 1.00 32.02 C ATOM 1560 C ASP A 142 9.495 6.305 12.558 1.00 24.53 C ATOM 1561 O ASP A 142 9.896 7.455 12.264 1.00 20.44 O ATOM 1562 CB ASP A 142 10.847 5.585 14.566 1.00 12.31 C ATOM 1563 CG ASP A 142 11.506 6.938 14.738 1.00 73.15 C ATOM 1564 OD1 ASP A 142 12.625 7.136 14.223 1.00 25.03 O ATOM 1565 OD2 ASP A 142 10.940 7.817 15.413 1.00 33.43 O ATOM 0 H ASP A 142 12.390 5.740 12.579 1.00 15.20 H new ATOM 0 HA ASP A 142 9.961 4.287 13.150 1.00 32.02 H new ATOM 0 HB2 ASP A 142 9.959 5.542 15.196 1.00 12.31 H new ATOM 0 HB3 ASP A 142 11.528 4.813 14.923 1.00 12.31 H new ATOM 1570 N ILE A 143 8.289 5.906 12.338 1.00 61.25 N ATOM 1571 CA ILE A 143 7.306 6.769 11.754 1.00 12.42 C ATOM 1572 C ILE A 143 6.327 7.182 12.833 1.00 11.14 C ATOM 1573 O ILE A 143 6.030 6.384 13.712 1.00 72.04 O ATOM 1574 CB ILE A 143 6.612 6.084 10.495 1.00 15.34 C ATOM 1575 CG1 ILE A 143 5.877 4.764 10.830 1.00 63.55 C ATOM 1576 CG2 ILE A 143 7.638 5.807 9.413 1.00 61.42 C ATOM 1577 CD1 ILE A 143 4.499 4.944 11.403 1.00 45.21 C ATOM 0 H ILE A 143 7.950 4.969 12.557 1.00 61.25 H new ATOM 0 HA ILE A 143 7.776 7.671 11.363 1.00 12.42 H new ATOM 0 HB ILE A 143 5.862 6.796 10.150 1.00 15.34 H new ATOM 0 HG12 ILE A 143 5.804 4.164 9.923 1.00 63.55 H new ATOM 0 HG13 ILE A 143 6.480 4.197 11.539 1.00 63.55 H new ATOM 0 HG21 ILE A 143 7.149 5.339 8.559 1.00 61.42 H new ATOM 0 HG22 ILE A 143 8.098 6.744 9.099 1.00 61.42 H new ATOM 0 HG23 ILE A 143 8.406 5.139 9.802 1.00 61.42 H new ATOM 0 HD11 ILE A 143 4.059 3.968 11.607 1.00 45.21 H new ATOM 0 HD12 ILE A 143 4.562 5.515 12.330 1.00 45.21 H new ATOM 0 HD13 ILE A 143 3.875 5.480 10.688 1.00 45.21 H new ATOM 1589 N GLY A 144 5.874 8.415 12.829 1.00 24.51 N ATOM 1590 CA GLY A 144 4.983 8.813 13.879 1.00 53.44 C ATOM 1591 C GLY A 144 4.404 10.185 13.713 1.00 21.34 C ATOM 1592 O GLY A 144 4.809 10.956 12.831 1.00 71.24 O ATOM 0 H GLY A 144 6.099 9.130 12.138 1.00 24.51 H new ATOM 0 HA2 GLY A 144 4.167 8.093 13.939 1.00 53.44 H new ATOM 0 HA3 GLY A 144 5.517 8.770 14.828 1.00 53.44 H new ATOM 1596 N ASN A 145 3.455 10.483 14.556 1.00 42.00 N ATOM 1597 CA ASN A 145 2.797 11.754 14.582 1.00 45.13 C ATOM 1598 C ASN A 145 3.163 12.404 15.874 1.00 25.12 C ATOM 1599 O ASN A 145 3.089 11.778 16.913 1.00 20.11 O ATOM 1600 CB ASN A 145 1.270 11.610 14.465 1.00 74.01 C ATOM 1601 CG ASN A 145 0.549 12.957 14.535 1.00 34.44 C ATOM 1602 OD1 ASN A 145 0.356 13.629 13.519 1.00 40.23 O ATOM 1603 ND2 ASN A 145 0.148 13.361 15.719 1.00 35.30 N ATOM 0 H ASN A 145 3.111 9.831 15.261 1.00 42.00 H new ATOM 0 HA ASN A 145 3.114 12.356 13.731 1.00 45.13 H new ATOM 0 HB2 ASN A 145 1.025 11.119 13.523 1.00 74.01 H new ATOM 0 HB3 ASN A 145 0.907 10.965 15.265 1.00 74.01 H new ATOM 0 HD21 ASN A 145 -0.338 14.253 15.816 1.00 35.30 H new ATOM 0 HD22 ASN A 145 0.322 12.783 16.541 1.00 35.30 H new ATOM 1610 N TRP A 146 3.456 13.645 15.839 1.00 23.11 N ATOM 1611 CA TRP A 146 4.002 14.301 16.977 1.00 20.25 C ATOM 1612 C TRP A 146 3.395 15.661 17.022 1.00 40.45 C ATOM 1613 O TRP A 146 3.449 16.413 16.039 1.00 0.21 O ATOM 1614 CB TRP A 146 5.512 14.404 16.728 1.00 41.14 C ATOM 1615 CG TRP A 146 6.382 14.924 17.839 1.00 53.13 C ATOM 1616 CD1 TRP A 146 6.436 16.191 18.339 1.00 40.55 C ATOM 1617 CD2 TRP A 146 7.388 14.185 18.518 1.00 35.14 C ATOM 1618 NE1 TRP A 146 7.420 16.287 19.284 1.00 33.44 N ATOM 1619 CE2 TRP A 146 8.020 15.063 19.418 1.00 23.43 C ATOM 1620 CE3 TRP A 146 7.815 12.861 18.451 1.00 51.52 C ATOM 1621 CZ2 TRP A 146 9.062 14.655 20.242 1.00 64.33 C ATOM 1622 CZ3 TRP A 146 8.845 12.453 19.265 1.00 61.04 C ATOM 1623 CH2 TRP A 146 9.463 13.348 20.150 1.00 21.45 C ATOM 0 H TRP A 146 3.327 14.243 15.023 1.00 23.11 H new ATOM 0 HA TRP A 146 3.808 13.779 17.914 1.00 20.25 H new ATOM 0 HB2 TRP A 146 5.873 13.411 16.459 1.00 41.14 H new ATOM 0 HB3 TRP A 146 5.663 15.045 15.859 1.00 41.14 H new ATOM 0 HD1 TRP A 146 5.793 17.003 18.033 1.00 40.55 H new ATOM 0 HE1 TRP A 146 7.666 17.130 19.803 1.00 33.44 H new ATOM 0 HE3 TRP A 146 7.345 12.166 17.771 1.00 51.52 H new ATOM 0 HZ2 TRP A 146 9.537 15.341 20.928 1.00 64.33 H new ATOM 0 HZ3 TRP A 146 9.183 11.428 19.222 1.00 61.04 H new ATOM 0 HH2 TRP A 146 10.273 12.999 20.773 1.00 21.45 H new ATOM 1634 N ASP A 147 2.796 15.973 18.118 1.00 33.13 N ATOM 1635 CA ASP A 147 2.144 17.240 18.260 1.00 13.40 C ATOM 1636 C ASP A 147 3.013 18.113 19.073 1.00 43.33 C ATOM 1637 O ASP A 147 3.280 17.811 20.232 1.00 12.22 O ATOM 1638 CB ASP A 147 0.766 17.119 18.906 1.00 71.23 C ATOM 1639 CG ASP A 147 0.017 18.444 18.932 1.00 65.14 C ATOM 1640 OD1 ASP A 147 -0.688 18.762 17.942 1.00 34.34 O ATOM 1641 OD2 ASP A 147 0.107 19.187 19.914 1.00 43.42 O ATOM 0 H ASP A 147 2.741 15.368 18.937 1.00 33.13 H new ATOM 0 HA ASP A 147 1.984 17.662 17.268 1.00 13.40 H new ATOM 0 HB2 ASP A 147 0.176 16.382 18.361 1.00 71.23 H new ATOM 0 HB3 ASP A 147 0.877 16.748 19.925 1.00 71.23 H new ATOM 1646 N ASN A 148 3.498 19.141 18.454 1.00 12.12 N ATOM 1647 CA ASN A 148 4.373 20.078 19.072 1.00 61.41 C ATOM 1648 C ASN A 148 3.882 21.449 18.738 1.00 12.24 C ATOM 1649 O ASN A 148 3.858 21.815 17.553 1.00 2.24 O ATOM 1650 CB ASN A 148 5.862 19.849 18.676 1.00 73.53 C ATOM 1651 CG ASN A 148 6.187 20.003 17.186 1.00 23.30 C ATOM 1652 OD1 ASN A 148 6.584 21.068 16.725 1.00 41.23 O ATOM 1653 ND2 ASN A 148 6.020 18.948 16.426 1.00 54.03 N ATOM 1654 OXT ASN A 148 3.419 22.145 19.635 1.00 0.00 O ATOM 0 H ASN A 148 3.289 19.356 17.479 1.00 12.12 H new ATOM 0 HA ASN A 148 4.358 19.945 20.154 1.00 61.41 H new ATOM 0 HB2 ASN A 148 6.480 20.550 19.238 1.00 73.53 H new ATOM 0 HB3 ASN A 148 6.152 18.846 18.990 1.00 73.53 H new ATOM 0 HD21 ASN A 148 6.221 19.002 15.428 1.00 54.03 H new ATOM 0 HD22 ASN A 148 5.689 18.073 16.833 1.00 54.03 H new