USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 839 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 132 ASN : amide:sc= 0.712 K(o=3.3,f=1.8) USER MOD Set 1.2: A 133 HIS : no HE2:sc= 0.801 K(o=3.3,f=0.22) USER MOD Set 1.3: B 149 C O2' : rot 78:sc= 1.83 USER MOD Set 2.1: A 101 MET CE :methyl -166:sc= -6.18! (180deg=-6.5!) USER MOD Set 2.2: A 110 MET CE :methyl 165:sc= -0.501 (180deg=-1.11) USER MOD Set 3.1: A 87 ASN : amide:sc= 0.483 K(o=0.99,f=-0.079!) USER MOD Set 3.2: A 138 THR OG1 : rot 170:sc= 0.511 USER MOD Set 4.1: A 65 LYS NZ :NH3+ 164:sc= 0.0456 (180deg=-0.00551) USER MOD Set 4.2: A 124 GLN : amide:sc= 0.406 K(o=0.45,f=-3.1!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 HIS : no HD1:sc= -2.32 X(o=-2.3,f=-2.7) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 85:sc= 1.26 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.0136 USER MOD Single : A 90 MET CE :methyl -121:sc= -0.575 (180deg=-0.994) USER MOD Single : A 92 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0125) USER MOD Single : A 94 LYS NZ :NH3+ 173:sc= 1.26 (180deg=1.19) USER MOD Single : A 95 ASN : amide:sc= 0.624 K(o=0.62,f=-0.82) USER MOD Single : A 96 GLN : amide:sc= 0.343 K(o=0.34,f=-9.3!) USER MOD Single : A 102 ASN :FLIP amide:sc= -0.0959 F(o=-0.87,f=-0.096) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.73 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= 0.463 X(o=0.46,f=-0.0089) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 119:sc= -0.112 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0.787 K(o=0.79,f=-2.9!) USER MOD Single : A 131 SER OG : rot 34:sc= 1.79 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 167:sc= 1.29 (180deg=1.03) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 11:sc= 0.351 USER MOD Single : A 143 ASN : amide:sc= -0.101 X(o=-0.1,f=-0.1) USER MOD Single : A 144 GLN : amide:sc= 0.805 K(o=0.81,f=0) USER MOD Single : B 147 C O2' : rot 28:sc= 0.171 USER MOD Single : B 147 C O5' : rot 180:sc= 0 USER MOD Single : B 148 U O2' : rot 22:sc= 0.109 USER MOD Single : B 150 U O2' : rot -57:sc= 0.459 USER MOD Single : B 151 C O2' : rot 162:sc= 0.267 USER MOD Single : B 152 U O2' : rot 180:sc= 0 USER MOD Single : B 152 U O3' : rot 133:sc= 0.0758 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 49 -21.042 7.964 8.563 1.00 0.00 N ATOM 2 CA GLY A 49 -21.288 9.205 9.330 1.00 0.00 C ATOM 3 C GLY A 49 -21.049 10.435 8.470 1.00 0.00 C ATOM 4 O GLY A 49 -21.471 10.479 7.314 1.00 0.00 O ATOM 0 HA2 GLY A 49 -22.313 9.210 9.701 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -20.634 9.234 10.201 1.00 0.00 H new ATOM 8 N ASP A 50 -20.375 11.453 9.014 1.00 0.00 N ATOM 9 CA ASP A 50 -19.987 12.667 8.273 1.00 0.00 C ATOM 10 C ASP A 50 -18.908 12.383 7.202 1.00 0.00 C ATOM 11 O ASP A 50 -18.971 12.906 6.086 1.00 0.00 O ATOM 12 CB ASP A 50 -19.501 13.711 9.282 1.00 0.00 C ATOM 13 CG ASP A 50 -19.210 15.064 8.611 1.00 0.00 C ATOM 14 OD1 ASP A 50 -20.175 15.782 8.250 1.00 0.00 O ATOM 15 OD2 ASP A 50 -18.017 15.425 8.458 1.00 0.00 O ATOM 0 H ASP A 50 -20.079 11.462 9.990 1.00 0.00 H new ATOM 0 HA ASP A 50 -20.855 13.043 7.731 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -20.255 13.845 10.058 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -18.599 13.348 9.774 1.00 0.00 H new ATOM 20 N SER A 51 -17.938 11.524 7.530 1.00 0.00 N ATOM 21 CA SER A 51 -16.911 10.968 6.636 1.00 0.00 C ATOM 22 C SER A 51 -17.435 9.828 5.739 1.00 0.00 C ATOM 23 O SER A 51 -18.607 9.442 5.796 1.00 0.00 O ATOM 24 CB SER A 51 -15.730 10.482 7.493 1.00 0.00 C ATOM 25 OG SER A 51 -16.154 9.486 8.416 1.00 0.00 O ATOM 0 H SER A 51 -17.841 11.176 8.484 1.00 0.00 H new ATOM 0 HA SER A 51 -16.596 11.758 5.955 1.00 0.00 H new ATOM 0 HB2 SER A 51 -14.949 10.079 6.849 1.00 0.00 H new ATOM 0 HB3 SER A 51 -15.295 11.323 8.033 1.00 0.00 H new ATOM 0 HG SER A 51 -15.389 9.188 8.951 1.00 0.00 H new ATOM 31 N ARG A 52 -16.558 9.273 4.891 1.00 0.00 N ATOM 32 CA ARG A 52 -16.791 8.094 4.033 1.00 0.00 C ATOM 33 C ARG A 52 -15.664 7.068 4.207 1.00 0.00 C ATOM 34 O ARG A 52 -14.675 7.329 4.902 1.00 0.00 O ATOM 35 CB ARG A 52 -16.925 8.536 2.554 1.00 0.00 C ATOM 36 CG ARG A 52 -18.046 9.555 2.283 1.00 0.00 C ATOM 37 CD ARG A 52 -19.445 8.963 2.498 1.00 0.00 C ATOM 38 NE ARG A 52 -20.499 9.977 2.289 1.00 0.00 N ATOM 39 CZ ARG A 52 -21.129 10.683 3.213 1.00 0.00 C ATOM 40 NH1 ARG A 52 -20.828 10.605 4.476 1.00 0.00 N ATOM 41 NH2 ARG A 52 -22.093 11.493 2.879 1.00 0.00 N ATOM 0 H ARG A 52 -15.618 9.651 4.776 1.00 0.00 H new ATOM 0 HA ARG A 52 -17.723 7.615 4.334 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -15.977 8.966 2.231 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -17.100 7.653 1.940 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -17.915 10.416 2.938 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -17.962 9.918 1.259 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -19.598 8.130 1.812 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -19.520 8.561 3.508 1.00 0.00 H new ATOM 0 HE ARG A 52 -20.772 10.153 1.322 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -20.082 9.982 4.785 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -21.338 11.167 5.158 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -22.366 11.585 1.900 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -22.575 12.035 3.596 1.00 0.00 H new ATOM 55 N SER A 53 -15.794 5.911 3.558 1.00 0.00 N ATOM 56 CA SER A 53 -14.737 4.892 3.462 1.00 0.00 C ATOM 57 C SER A 53 -13.417 5.466 2.913 1.00 0.00 C ATOM 58 O SER A 53 -13.399 6.516 2.258 1.00 0.00 O ATOM 59 CB SER A 53 -15.221 3.704 2.615 1.00 0.00 C ATOM 60 OG SER A 53 -15.656 4.134 1.333 1.00 0.00 O ATOM 0 H SER A 53 -16.652 5.646 3.073 1.00 0.00 H new ATOM 0 HA SER A 53 -14.525 4.541 4.472 1.00 0.00 H new ATOM 0 HB2 SER A 53 -14.414 2.979 2.505 1.00 0.00 H new ATOM 0 HB3 SER A 53 -16.038 3.196 3.128 1.00 0.00 H new ATOM 0 HG SER A 53 -15.957 3.360 0.813 1.00 0.00 H new ATOM 66 N ALA A 54 -12.295 4.806 3.232 1.00 0.00 N ATOM 67 CA ALA A 54 -10.918 5.282 3.017 1.00 0.00 C ATOM 68 C ALA A 54 -10.584 6.673 3.632 1.00 0.00 C ATOM 69 O ALA A 54 -9.486 7.191 3.418 1.00 0.00 O ATOM 70 CB ALA A 54 -10.588 5.164 1.519 1.00 0.00 C ATOM 0 H ALA A 54 -12.322 3.884 3.667 1.00 0.00 H new ATOM 0 HA ALA A 54 -10.252 4.633 3.586 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -9.571 5.513 1.342 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.674 4.123 1.208 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.286 5.773 0.944 1.00 0.00 H new ATOM 76 N GLY A 55 -11.487 7.280 4.413 1.00 0.00 N ATOM 77 CA GLY A 55 -11.290 8.590 5.046 1.00 0.00 C ATOM 78 C GLY A 55 -11.456 9.771 4.080 1.00 0.00 C ATOM 79 O GLY A 55 -10.796 10.797 4.265 1.00 0.00 O ATOM 0 H GLY A 55 -12.394 6.865 4.627 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -12.001 8.699 5.865 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -10.292 8.627 5.483 1.00 0.00 H new ATOM 83 N VAL A 56 -12.317 9.630 3.056 1.00 0.00 N ATOM 84 CA VAL A 56 -12.528 10.542 1.915 1.00 0.00 C ATOM 85 C VAL A 56 -11.208 10.722 1.133 1.00 0.00 C ATOM 86 O VAL A 56 -10.441 11.658 1.376 1.00 0.00 O ATOM 87 CB VAL A 56 -13.183 11.854 2.367 1.00 0.00 C ATOM 88 CG1 VAL A 56 -13.469 12.802 1.193 1.00 0.00 C ATOM 89 CG2 VAL A 56 -14.522 11.614 3.081 1.00 0.00 C ATOM 0 H VAL A 56 -12.929 8.816 2.999 1.00 0.00 H new ATOM 0 HA VAL A 56 -13.239 10.102 1.216 1.00 0.00 H new ATOM 0 HB VAL A 56 -12.461 12.305 3.047 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -13.932 13.715 1.567 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -12.535 13.049 0.689 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -14.143 12.315 0.488 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -14.950 12.570 3.383 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -15.209 11.107 2.404 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -14.358 10.995 3.963 1.00 0.00 H new ATOM 99 N PRO A 57 -10.877 9.748 0.267 1.00 0.00 N ATOM 100 CA PRO A 57 -9.491 9.384 -0.033 1.00 0.00 C ATOM 101 C PRO A 57 -8.909 10.066 -1.285 1.00 0.00 C ATOM 102 O PRO A 57 -9.623 10.715 -2.059 1.00 0.00 O ATOM 103 CB PRO A 57 -9.604 7.868 -0.149 1.00 0.00 C ATOM 104 CG PRO A 57 -10.896 7.697 -0.943 1.00 0.00 C ATOM 105 CD PRO A 57 -11.778 8.699 -0.204 1.00 0.00 C ATOM 0 HA PRO A 57 -8.781 9.719 0.723 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -8.748 7.435 -0.667 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -9.661 7.389 0.828 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -10.775 7.943 -1.998 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -11.286 6.680 -0.895 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -12.543 9.108 -0.864 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -12.296 8.224 0.630 1.00 0.00 H new ATOM 113 N SER A 58 -7.590 9.930 -1.468 1.00 0.00 N ATOM 114 CA SER A 58 -6.778 10.732 -2.402 1.00 0.00 C ATOM 115 C SER A 58 -5.592 9.938 -3.005 1.00 0.00 C ATOM 116 O SER A 58 -5.564 8.711 -2.968 1.00 0.00 O ATOM 117 CB SER A 58 -6.293 12.006 -1.686 1.00 0.00 C ATOM 118 OG SER A 58 -7.356 12.796 -1.177 1.00 0.00 O ATOM 0 H SER A 58 -7.039 9.240 -0.957 1.00 0.00 H new ATOM 0 HA SER A 58 -7.410 11.005 -3.247 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.632 11.726 -0.866 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.704 12.604 -2.381 1.00 0.00 H new ATOM 0 HG SER A 58 -6.990 13.589 -0.732 1.00 0.00 H new ATOM 124 N ARG A 59 -4.641 10.646 -3.632 1.00 0.00 N ATOM 125 CA ARG A 59 -3.624 10.184 -4.600 1.00 0.00 C ATOM 126 C ARG A 59 -2.676 9.028 -4.214 1.00 0.00 C ATOM 127 O ARG A 59 -2.123 8.429 -5.142 1.00 0.00 O ATOM 128 CB ARG A 59 -2.799 11.413 -5.016 1.00 0.00 C ATOM 129 CG ARG A 59 -3.485 12.216 -6.141 1.00 0.00 C ATOM 130 CD ARG A 59 -2.884 13.615 -6.306 1.00 0.00 C ATOM 131 NE ARG A 59 -1.414 13.571 -6.363 1.00 0.00 N ATOM 132 CZ ARG A 59 -0.562 14.575 -6.353 1.00 0.00 C ATOM 133 NH1 ARG A 59 -0.937 15.820 -6.463 1.00 0.00 N ATOM 134 NH2 ARG A 59 0.704 14.322 -6.220 1.00 0.00 N ATOM 0 H ARG A 59 -4.553 11.648 -3.462 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.207 9.726 -5.399 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.648 12.058 -4.150 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -1.813 11.091 -5.350 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.394 11.671 -7.081 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.550 12.304 -5.925 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.270 14.072 -7.217 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.198 14.246 -5.475 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.001 12.640 -6.417 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -1.926 16.048 -6.562 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.241 16.565 -6.450 1.00 0.00 H new ATOM 0 HH21 ARG A 59 1.024 13.358 -6.125 1.00 0.00 H new ATOM 0 HH22 ARG A 59 1.379 15.087 -6.210 1.00 0.00 H new ATOM 148 N VAL A 60 -2.516 8.653 -2.935 1.00 0.00 N ATOM 149 CA VAL A 60 -1.795 7.414 -2.564 1.00 0.00 C ATOM 150 C VAL A 60 -2.736 6.240 -2.280 1.00 0.00 C ATOM 151 O VAL A 60 -3.677 6.345 -1.496 1.00 0.00 O ATOM 152 CB VAL A 60 -0.673 7.596 -1.530 1.00 0.00 C ATOM 153 CG1 VAL A 60 -0.968 8.236 -0.183 1.00 0.00 C ATOM 154 CG2 VAL A 60 0.056 6.279 -1.309 1.00 0.00 C ATOM 0 H VAL A 60 -2.872 9.184 -2.140 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.246 7.135 -3.463 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.068 8.361 -2.017 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.053 8.277 0.408 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.348 9.246 -0.336 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.715 7.644 0.345 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.849 6.421 -0.574 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.647 5.531 -0.944 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.490 5.941 -2.250 1.00 0.00 H new ATOM 164 N ILE A 61 -2.477 5.096 -2.918 1.00 0.00 N ATOM 165 CA ILE A 61 -3.043 3.776 -2.587 1.00 0.00 C ATOM 166 C ILE A 61 -1.996 2.987 -1.787 1.00 0.00 C ATOM 167 O ILE A 61 -0.800 3.225 -1.933 1.00 0.00 O ATOM 168 CB ILE A 61 -3.431 3.042 -3.893 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.512 3.806 -4.689 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.891 1.579 -3.709 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.439 3.435 -6.171 1.00 0.00 C ATOM 0 H ILE A 61 -1.841 5.057 -3.714 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.944 3.878 -1.982 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.496 3.015 -4.453 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.500 3.568 -4.295 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.371 4.880 -4.568 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.141 1.151 -4.680 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -3.088 1.000 -3.253 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.769 1.552 -3.064 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.206 3.980 -6.721 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.456 3.696 -6.564 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.602 2.364 -6.286 1.00 0.00 H new ATOM 183 N HIS A 62 -2.416 2.027 -0.970 1.00 0.00 N ATOM 184 CA HIS A 62 -1.560 1.096 -0.244 1.00 0.00 C ATOM 185 C HIS A 62 -1.853 -0.360 -0.658 1.00 0.00 C ATOM 186 O HIS A 62 -2.983 -0.723 -0.998 1.00 0.00 O ATOM 187 CB HIS A 62 -1.733 1.360 1.260 1.00 0.00 C ATOM 188 CG HIS A 62 -1.262 0.253 2.180 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.860 -0.979 2.363 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.248 0.347 3.091 1.00 0.00 C ATOM 191 CE1 HIS A 62 -1.192 -1.623 3.340 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.184 -0.861 3.796 1.00 0.00 N ATOM 0 H HIS A 62 -3.407 1.870 -0.788 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.511 1.254 -0.494 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.194 2.273 1.514 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.788 1.548 1.458 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.392 1.204 3.241 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.433 -2.611 3.704 1.00 0.00 H new ATOM 0 HE2 HIS A 62 0.495 -1.113 4.515 1.00 0.00 H new ATOM 200 N ILE A 63 -0.816 -1.198 -0.612 1.00 0.00 N ATOM 201 CA ILE A 63 -0.792 -2.582 -1.092 1.00 0.00 C ATOM 202 C ILE A 63 -0.271 -3.506 0.021 1.00 0.00 C ATOM 203 O ILE A 63 0.679 -3.150 0.722 1.00 0.00 O ATOM 204 CB ILE A 63 0.084 -2.709 -2.368 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.023 -1.483 -3.319 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.317 -3.997 -3.111 1.00 0.00 C ATOM 207 CD1 ILE A 63 0.930 -1.586 -4.555 1.00 0.00 C ATOM 0 H ILE A 63 0.080 -0.914 -0.217 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.806 -2.882 -1.355 1.00 0.00 H new ATOM 0 HB ILE A 63 1.122 -2.751 -2.039 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.007 -1.348 -3.650 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.297 -0.590 -2.757 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.289 -4.102 -4.011 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.154 -4.857 -2.462 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.370 -3.945 -3.387 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.822 -0.687 -5.161 1.00 0.00 H new ATOM 0 HD12 ILE A 63 1.968 -1.688 -4.237 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.644 -2.457 -5.145 1.00 0.00 H new ATOM 219 N ARG A 64 -0.848 -4.705 0.152 1.00 0.00 N ATOM 220 CA ARG A 64 -0.375 -5.864 0.952 1.00 0.00 C ATOM 221 C ARG A 64 -0.269 -7.104 0.060 1.00 0.00 C ATOM 222 O ARG A 64 -0.826 -7.133 -1.038 1.00 0.00 O ATOM 223 CB ARG A 64 -1.241 -6.134 2.227 1.00 0.00 C ATOM 224 CG ARG A 64 -2.534 -5.294 2.331 1.00 0.00 C ATOM 225 CD ARG A 64 -3.429 -5.594 3.543 1.00 0.00 C ATOM 226 NE ARG A 64 -4.834 -5.251 3.232 1.00 0.00 N ATOM 227 CZ ARG A 64 -5.918 -5.958 3.503 1.00 0.00 C ATOM 228 NH1 ARG A 64 -5.911 -6.965 4.326 1.00 0.00 N ATOM 229 NH2 ARG A 64 -7.050 -5.668 2.929 1.00 0.00 N ATOM 0 H ARG A 64 -1.722 -4.917 -0.329 1.00 0.00 H new ATOM 0 HA ARG A 64 0.616 -5.614 1.330 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.510 -7.190 2.248 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.630 -5.943 3.109 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.259 -4.240 2.358 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -3.119 -5.448 1.424 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.354 -6.648 3.809 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.089 -5.022 4.407 1.00 0.00 H new ATOM 0 HE ARG A 64 -4.984 -4.364 2.752 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.045 -7.237 4.792 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.771 -7.483 4.506 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.103 -4.893 2.268 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.884 -6.216 3.141 1.00 0.00 H new ATOM 243 N LYS A 65 0.411 -8.151 0.543 1.00 0.00 N ATOM 244 CA LYS A 65 0.573 -9.457 -0.146 1.00 0.00 C ATOM 245 C LYS A 65 1.426 -9.385 -1.427 1.00 0.00 C ATOM 246 O LYS A 65 1.340 -10.248 -2.302 1.00 0.00 O ATOM 247 CB LYS A 65 -0.804 -10.141 -0.358 1.00 0.00 C ATOM 248 CG LYS A 65 -1.760 -10.058 0.841 1.00 0.00 C ATOM 249 CD LYS A 65 -1.260 -10.694 2.140 1.00 0.00 C ATOM 250 CE LYS A 65 -1.883 -12.079 2.409 1.00 0.00 C ATOM 251 NZ LYS A 65 -1.666 -13.045 1.297 1.00 0.00 N ATOM 0 H LYS A 65 0.880 -8.122 1.448 1.00 0.00 H new ATOM 0 HA LYS A 65 1.156 -10.096 0.518 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.289 -9.688 -1.223 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.638 -11.191 -0.600 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.979 -9.008 1.034 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.701 -10.534 0.565 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.175 -10.791 2.097 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.488 -10.031 2.974 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.459 -12.489 3.326 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -2.954 -11.962 2.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -1.858 -14.010 1.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -2.307 -12.819 0.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.681 -12.982 0.970 1.00 0.00 H new ATOM 265 N LEU A 66 2.283 -8.367 -1.504 1.00 0.00 N ATOM 266 CA LEU A 66 3.400 -8.203 -2.442 1.00 0.00 C ATOM 267 C LEU A 66 4.351 -9.431 -2.407 1.00 0.00 C ATOM 268 O LEU A 66 4.347 -10.191 -1.430 1.00 0.00 O ATOM 269 CB LEU A 66 4.178 -6.949 -1.976 1.00 0.00 C ATOM 270 CG LEU A 66 4.413 -5.867 -3.036 1.00 0.00 C ATOM 271 CD1 LEU A 66 3.180 -5.001 -3.184 1.00 0.00 C ATOM 272 CD2 LEU A 66 5.566 -4.983 -2.587 1.00 0.00 C ATOM 0 H LEU A 66 2.211 -7.575 -0.866 1.00 0.00 H new ATOM 0 HA LEU A 66 3.025 -8.106 -3.461 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.638 -6.501 -1.142 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.147 -7.269 -1.593 1.00 0.00 H new ATOM 0 HG LEU A 66 4.638 -6.347 -3.989 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.361 -4.237 -3.940 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.335 -5.619 -3.488 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.955 -4.522 -2.231 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.743 -4.209 -3.334 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.318 -4.517 -1.633 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.465 -5.588 -2.472 1.00 0.00 H new ATOM 284 N PRO A 67 5.250 -9.587 -3.392 1.00 0.00 N ATOM 285 CA PRO A 67 6.495 -10.335 -3.223 1.00 0.00 C ATOM 286 C PRO A 67 7.404 -9.792 -2.109 1.00 0.00 C ATOM 287 O PRO A 67 7.180 -8.744 -1.504 1.00 0.00 O ATOM 288 CB PRO A 67 7.226 -10.273 -4.571 1.00 0.00 C ATOM 289 CG PRO A 67 6.135 -9.873 -5.560 1.00 0.00 C ATOM 290 CD PRO A 67 5.171 -9.032 -4.726 1.00 0.00 C ATOM 0 HA PRO A 67 6.252 -11.353 -2.920 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.036 -9.544 -4.553 1.00 0.00 H new ATOM 0 HB3 PRO A 67 7.668 -11.235 -4.831 1.00 0.00 H new ATOM 0 HG2 PRO A 67 6.543 -9.303 -6.395 1.00 0.00 H new ATOM 0 HG3 PRO A 67 5.639 -10.747 -5.983 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.456 -7.980 -4.734 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.156 -9.090 -5.118 1.00 0.00 H new ATOM 298 N ILE A 68 8.490 -10.521 -1.891 1.00 0.00 N ATOM 299 CA ILE A 68 9.495 -10.308 -0.834 1.00 0.00 C ATOM 300 C ILE A 68 10.412 -9.111 -1.097 1.00 0.00 C ATOM 301 O ILE A 68 10.883 -8.447 -0.170 1.00 0.00 O ATOM 302 CB ILE A 68 10.335 -11.595 -0.670 1.00 0.00 C ATOM 303 CG1 ILE A 68 11.027 -12.044 -1.984 1.00 0.00 C ATOM 304 CG2 ILE A 68 9.398 -12.691 -0.144 1.00 0.00 C ATOM 305 CD1 ILE A 68 11.883 -13.309 -1.849 1.00 0.00 C ATOM 0 H ILE A 68 8.715 -11.326 -2.476 1.00 0.00 H new ATOM 0 HA ILE A 68 8.954 -10.079 0.084 1.00 0.00 H new ATOM 0 HB ILE A 68 11.147 -11.399 0.030 1.00 0.00 H new ATOM 0 HG12 ILE A 68 10.263 -12.216 -2.742 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.657 -11.231 -2.345 1.00 0.00 H new ATOM 0 HG21 ILE A 68 9.958 -13.617 -0.015 1.00 0.00 H new ATOM 0 HG22 ILE A 68 8.980 -12.383 0.815 1.00 0.00 H new ATOM 0 HG23 ILE A 68 8.589 -12.852 -0.857 1.00 0.00 H new ATOM 0 HD11 ILE A 68 12.329 -13.551 -2.814 1.00 0.00 H new ATOM 0 HD12 ILE A 68 12.672 -13.138 -1.117 1.00 0.00 H new ATOM 0 HD13 ILE A 68 11.257 -14.139 -1.520 1.00 0.00 H new ATOM 317 N ASP A 69 10.681 -8.854 -2.377 1.00 0.00 N ATOM 318 CA ASP A 69 11.712 -7.930 -2.872 1.00 0.00 C ATOM 319 C ASP A 69 11.365 -7.403 -4.281 1.00 0.00 C ATOM 320 O ASP A 69 12.245 -7.194 -5.121 1.00 0.00 O ATOM 321 CB ASP A 69 13.079 -8.651 -2.823 1.00 0.00 C ATOM 322 CG ASP A 69 14.281 -7.712 -3.044 1.00 0.00 C ATOM 323 OD1 ASP A 69 14.314 -6.606 -2.449 1.00 0.00 O ATOM 324 OD2 ASP A 69 15.234 -8.103 -3.761 1.00 0.00 O ATOM 0 H ASP A 69 10.165 -9.302 -3.134 1.00 0.00 H new ATOM 0 HA ASP A 69 11.761 -7.047 -2.234 1.00 0.00 H new ATOM 0 HB2 ASP A 69 13.186 -9.143 -1.856 1.00 0.00 H new ATOM 0 HB3 ASP A 69 13.095 -9.433 -3.582 1.00 0.00 H new ATOM 329 N VAL A 70 10.063 -7.250 -4.572 1.00 0.00 N ATOM 330 CA VAL A 70 9.570 -6.752 -5.871 1.00 0.00 C ATOM 331 C VAL A 70 10.247 -5.433 -6.285 1.00 0.00 C ATOM 332 O VAL A 70 10.587 -4.602 -5.436 1.00 0.00 O ATOM 333 CB VAL A 70 8.027 -6.631 -5.891 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.481 -5.255 -5.514 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.490 -6.962 -7.286 1.00 0.00 C ATOM 0 H VAL A 70 9.317 -7.469 -3.911 1.00 0.00 H new ATOM 0 HA VAL A 70 9.848 -7.497 -6.617 1.00 0.00 H new ATOM 0 HB VAL A 70 7.691 -7.337 -5.132 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.392 -5.271 -5.557 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.800 -5.001 -4.503 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.861 -4.509 -6.212 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.404 -6.874 -7.288 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.912 -6.268 -8.013 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.772 -7.981 -7.552 1.00 0.00 H new ATOM 345 N THR A 71 10.430 -5.222 -7.592 1.00 0.00 N ATOM 346 CA THR A 71 11.071 -4.002 -8.113 1.00 0.00 C ATOM 347 C THR A 71 10.060 -2.885 -8.366 1.00 0.00 C ATOM 348 O THR A 71 8.944 -3.095 -8.858 1.00 0.00 O ATOM 349 CB THR A 71 11.969 -4.289 -9.333 1.00 0.00 C ATOM 350 OG1 THR A 71 12.547 -3.085 -9.791 1.00 0.00 O ATOM 351 CG2 THR A 71 11.261 -4.926 -10.526 1.00 0.00 C ATOM 0 H THR A 71 10.143 -5.882 -8.315 1.00 0.00 H new ATOM 0 HA THR A 71 11.737 -3.636 -7.332 1.00 0.00 H new ATOM 0 HB THR A 71 12.704 -5.007 -8.970 1.00 0.00 H new ATOM 0 HG1 THR A 71 13.119 -3.270 -10.565 1.00 0.00 H new ATOM 0 HG21 THR A 71 11.978 -5.087 -11.331 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.831 -5.882 -10.226 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.468 -4.264 -10.874 1.00 0.00 H new ATOM 359 N GLU A 72 10.475 -1.661 -8.045 1.00 0.00 N ATOM 360 CA GLU A 72 9.694 -0.461 -8.312 1.00 0.00 C ATOM 361 C GLU A 72 9.375 -0.321 -9.805 1.00 0.00 C ATOM 362 O GLU A 72 8.263 0.075 -10.146 1.00 0.00 O ATOM 363 CB GLU A 72 10.415 0.774 -7.734 1.00 0.00 C ATOM 364 CG GLU A 72 10.004 2.135 -8.317 1.00 0.00 C ATOM 365 CD GLU A 72 10.902 3.263 -7.768 1.00 0.00 C ATOM 366 OE1 GLU A 72 10.601 3.824 -6.689 1.00 0.00 O ATOM 367 OE2 GLU A 72 11.922 3.599 -8.419 1.00 0.00 O ATOM 0 H GLU A 72 11.369 -1.476 -7.590 1.00 0.00 H new ATOM 0 HA GLU A 72 8.731 -0.543 -7.809 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.245 0.797 -6.658 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.487 0.646 -7.885 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.074 2.105 -9.404 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.963 2.341 -8.070 1.00 0.00 H new ATOM 374 N GLY A 73 10.299 -0.712 -10.687 1.00 0.00 N ATOM 375 CA GLY A 73 10.096 -0.691 -12.141 1.00 0.00 C ATOM 376 C GLY A 73 8.884 -1.517 -12.585 1.00 0.00 C ATOM 377 O GLY A 73 8.158 -1.111 -13.487 1.00 0.00 O ATOM 0 H GLY A 73 11.219 -1.056 -10.410 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.967 0.340 -12.470 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.990 -1.073 -12.633 1.00 0.00 H new ATOM 381 N GLU A 74 8.622 -2.644 -11.920 1.00 0.00 N ATOM 382 CA GLU A 74 7.423 -3.467 -12.102 1.00 0.00 C ATOM 383 C GLU A 74 6.173 -2.784 -11.561 1.00 0.00 C ATOM 384 O GLU A 74 5.187 -2.654 -12.284 1.00 0.00 O ATOM 385 CB GLU A 74 7.630 -4.847 -11.457 1.00 0.00 C ATOM 386 CG GLU A 74 8.304 -5.780 -12.465 1.00 0.00 C ATOM 387 CD GLU A 74 7.290 -6.408 -13.441 1.00 0.00 C ATOM 388 OE1 GLU A 74 6.711 -7.474 -13.122 1.00 0.00 O ATOM 389 OE2 GLU A 74 7.074 -5.846 -14.542 1.00 0.00 O ATOM 0 H GLU A 74 9.258 -3.022 -11.218 1.00 0.00 H new ATOM 0 HA GLU A 74 7.265 -3.600 -13.172 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.245 -4.754 -10.562 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.672 -5.262 -11.144 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.053 -5.224 -13.029 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.830 -6.571 -11.931 1.00 0.00 H new ATOM 396 N VAL A 75 6.208 -2.313 -10.312 1.00 0.00 N ATOM 397 CA VAL A 75 5.032 -1.701 -9.665 1.00 0.00 C ATOM 398 C VAL A 75 4.571 -0.416 -10.384 1.00 0.00 C ATOM 399 O VAL A 75 3.375 -0.225 -10.625 1.00 0.00 O ATOM 400 CB VAL A 75 5.315 -1.488 -8.166 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.141 -0.827 -7.433 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.581 -2.848 -7.504 1.00 0.00 C ATOM 0 H VAL A 75 7.039 -2.342 -9.722 1.00 0.00 H new ATOM 0 HA VAL A 75 4.190 -2.388 -9.750 1.00 0.00 H new ATOM 0 HB VAL A 75 6.179 -0.828 -8.094 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.394 -0.701 -6.380 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.937 0.147 -7.877 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.256 -1.458 -7.520 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.782 -2.703 -6.443 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.707 -3.488 -7.624 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.443 -3.320 -7.975 1.00 0.00 H new ATOM 412 N ILE A 76 5.492 0.450 -10.816 1.00 0.00 N ATOM 413 CA ILE A 76 5.140 1.626 -11.618 1.00 0.00 C ATOM 414 C ILE A 76 4.748 1.260 -13.046 1.00 0.00 C ATOM 415 O ILE A 76 3.831 1.883 -13.580 1.00 0.00 O ATOM 416 CB ILE A 76 6.237 2.705 -11.587 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.531 2.351 -12.348 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.553 3.049 -10.134 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.491 2.854 -13.790 1.00 0.00 C ATOM 0 H ILE A 76 6.489 0.359 -10.623 1.00 0.00 H new ATOM 0 HA ILE A 76 4.256 2.059 -11.149 1.00 0.00 H new ATOM 0 HB ILE A 76 5.831 3.564 -12.121 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.387 2.787 -11.834 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.673 1.270 -12.343 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.330 3.813 -10.102 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.654 3.424 -9.645 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.901 2.155 -9.616 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.419 2.586 -14.295 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.650 2.397 -14.311 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.375 3.938 -13.794 1.00 0.00 H new ATOM 431 N SER A 77 5.359 0.234 -13.665 1.00 0.00 N ATOM 432 CA SER A 77 4.900 -0.213 -14.999 1.00 0.00 C ATOM 433 C SER A 77 3.504 -0.815 -14.946 1.00 0.00 C ATOM 434 O SER A 77 2.768 -0.794 -15.936 1.00 0.00 O ATOM 435 CB SER A 77 5.855 -1.210 -15.658 1.00 0.00 C ATOM 436 OG SER A 77 7.105 -0.601 -15.928 1.00 0.00 O ATOM 0 H SER A 77 6.146 -0.289 -13.282 1.00 0.00 H new ATOM 0 HA SER A 77 4.880 0.689 -15.611 1.00 0.00 H new ATOM 0 HB2 SER A 77 5.998 -2.071 -15.005 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.418 -1.582 -16.585 1.00 0.00 H new ATOM 0 HG SER A 77 7.668 -0.641 -15.127 1.00 0.00 H new ATOM 442 N LEU A 78 3.109 -1.276 -13.761 1.00 0.00 N ATOM 443 CA LEU A 78 1.758 -1.703 -13.468 1.00 0.00 C ATOM 444 C LEU A 78 0.786 -0.529 -13.267 1.00 0.00 C ATOM 445 O LEU A 78 -0.384 -0.662 -13.630 1.00 0.00 O ATOM 446 CB LEU A 78 1.809 -2.647 -12.250 1.00 0.00 C ATOM 447 CG LEU A 78 1.933 -4.124 -12.647 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.390 -4.944 -11.440 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.593 -4.662 -13.153 1.00 0.00 C ATOM 0 H LEU A 78 3.740 -1.362 -12.965 1.00 0.00 H new ATOM 0 HA LEU A 78 1.357 -2.238 -14.329 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.654 -2.373 -11.619 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.908 -2.511 -11.652 1.00 0.00 H new ATOM 0 HG LEU A 78 2.667 -4.207 -13.448 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.477 -5.993 -11.724 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.358 -4.579 -11.098 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.661 -4.846 -10.636 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.703 -5.711 -13.429 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.156 -4.570 -12.367 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.276 -4.089 -14.024 1.00 0.00 H new ATOM 461 N GLY A 79 1.235 0.630 -12.760 1.00 0.00 N ATOM 462 CA GLY A 79 0.369 1.798 -12.573 1.00 0.00 C ATOM 463 C GLY A 79 0.368 2.816 -13.721 1.00 0.00 C ATOM 464 O GLY A 79 -0.477 3.713 -13.749 1.00 0.00 O ATOM 0 H GLY A 79 2.202 0.780 -12.471 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.652 1.449 -12.420 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.671 2.309 -11.659 1.00 0.00 H new ATOM 468 N LEU A 80 1.297 2.719 -14.674 1.00 0.00 N ATOM 469 CA LEU A 80 1.477 3.730 -15.719 1.00 0.00 C ATOM 470 C LEU A 80 0.319 3.929 -16.722 1.00 0.00 C ATOM 471 O LEU A 80 0.077 5.086 -17.078 1.00 0.00 O ATOM 472 CB LEU A 80 2.827 3.527 -16.432 1.00 0.00 C ATOM 473 CG LEU A 80 3.947 4.394 -15.830 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.262 4.082 -16.540 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.636 5.886 -15.992 1.00 0.00 C ATOM 0 H LEU A 80 1.947 1.936 -14.743 1.00 0.00 H new ATOM 0 HA LEU A 80 1.471 4.675 -15.175 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.112 2.477 -16.371 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.715 3.766 -17.490 1.00 0.00 H new ATOM 0 HG LEU A 80 4.024 4.167 -14.767 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.058 4.694 -16.117 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.506 3.028 -16.408 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.162 4.301 -17.603 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.444 6.475 -15.558 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.541 6.125 -17.051 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.702 6.120 -15.482 1.00 0.00 H new ATOM 487 N PRO A 81 -0.433 2.897 -17.158 1.00 0.00 N ATOM 488 CA PRO A 81 -1.628 3.060 -18.006 1.00 0.00 C ATOM 489 C PRO A 81 -2.760 3.935 -17.472 1.00 0.00 C ATOM 490 O PRO A 81 -3.727 4.169 -18.203 1.00 0.00 O ATOM 491 CB PRO A 81 -2.118 1.637 -18.308 1.00 0.00 C ATOM 492 CG PRO A 81 -0.864 0.781 -18.148 1.00 0.00 C ATOM 493 CD PRO A 81 -0.103 1.483 -17.032 1.00 0.00 C ATOM 0 HA PRO A 81 -1.325 3.623 -18.889 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.904 1.329 -17.618 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.530 1.560 -19.314 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -1.110 -0.247 -17.883 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -0.283 0.742 -19.069 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.397 1.098 -16.056 1.00 0.00 H new ATOM 0 HD3 PRO A 81 0.971 1.321 -17.128 1.00 0.00 H new ATOM 501 N PHE A 82 -2.666 4.422 -16.233 1.00 0.00 N ATOM 502 CA PHE A 82 -3.822 4.948 -15.519 1.00 0.00 C ATOM 503 C PHE A 82 -3.823 6.474 -15.380 1.00 0.00 C ATOM 504 O PHE A 82 -4.884 7.096 -15.438 1.00 0.00 O ATOM 505 CB PHE A 82 -3.929 4.260 -14.150 1.00 0.00 C ATOM 506 CG PHE A 82 -4.111 2.765 -14.282 1.00 0.00 C ATOM 507 CD1 PHE A 82 -3.038 1.921 -14.642 1.00 0.00 C ATOM 508 CD2 PHE A 82 -5.395 2.224 -14.129 1.00 0.00 C ATOM 509 CE1 PHE A 82 -3.264 0.559 -14.891 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.628 0.874 -14.409 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.565 0.042 -14.799 1.00 0.00 C ATOM 0 H PHE A 82 -1.795 4.461 -15.704 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.703 4.720 -16.119 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -3.030 4.466 -13.569 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.769 4.680 -13.597 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -2.040 2.325 -14.726 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -6.207 2.852 -13.794 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -2.440 -0.089 -15.152 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.626 0.470 -14.325 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.750 -0.997 -15.028 1.00 0.00 H new ATOM 521 N GLY A 83 -2.641 7.077 -15.244 1.00 0.00 N ATOM 522 CA GLY A 83 -2.452 8.525 -15.256 1.00 0.00 C ATOM 523 C GLY A 83 -0.987 8.891 -15.450 1.00 0.00 C ATOM 524 O GLY A 83 -0.458 8.846 -16.562 1.00 0.00 O ATOM 0 H GLY A 83 -1.771 6.560 -15.120 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -3.048 8.965 -16.056 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.814 8.949 -14.319 1.00 0.00 H new ATOM 528 N LYS A 84 -0.321 9.185 -14.333 1.00 0.00 N ATOM 529 CA LYS A 84 1.132 9.190 -14.163 1.00 0.00 C ATOM 530 C LYS A 84 1.371 8.809 -12.707 1.00 0.00 C ATOM 531 O LYS A 84 0.540 9.155 -11.870 1.00 0.00 O ATOM 532 CB LYS A 84 1.665 10.591 -14.518 1.00 0.00 C ATOM 533 CG LYS A 84 3.106 10.600 -15.045 1.00 0.00 C ATOM 534 CD LYS A 84 3.239 9.971 -16.441 1.00 0.00 C ATOM 535 CE LYS A 84 4.680 10.111 -16.948 1.00 0.00 C ATOM 536 NZ LYS A 84 4.832 9.551 -18.317 1.00 0.00 N ATOM 0 H LYS A 84 -0.809 9.440 -13.474 1.00 0.00 H new ATOM 0 HA LYS A 84 1.656 8.489 -14.813 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.012 11.036 -15.269 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.610 11.224 -13.632 1.00 0.00 H new ATOM 0 HG2 LYS A 84 3.468 11.628 -15.080 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.746 10.060 -14.347 1.00 0.00 H new ATOM 0 HD2 LYS A 84 2.960 8.918 -16.402 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.553 10.457 -17.134 1.00 0.00 H new ATOM 0 HE2 LYS A 84 4.966 11.163 -16.950 1.00 0.00 H new ATOM 0 HE3 LYS A 84 5.358 9.598 -16.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 5.818 9.662 -18.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 4.583 8.541 -18.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.202 10.058 -18.971 1.00 0.00 H new ATOM 550 N VAL A 85 2.426 8.075 -12.370 1.00 0.00 N ATOM 551 CA VAL A 85 2.578 7.530 -11.003 1.00 0.00 C ATOM 552 C VAL A 85 3.956 7.905 -10.477 1.00 0.00 C ATOM 553 O VAL A 85 4.968 7.258 -10.743 1.00 0.00 O ATOM 554 CB VAL A 85 2.211 6.039 -10.893 1.00 0.00 C ATOM 555 CG1 VAL A 85 1.959 5.495 -9.482 1.00 0.00 C ATOM 556 CG2 VAL A 85 1.427 5.449 -12.058 1.00 0.00 C ATOM 0 H VAL A 85 3.186 7.839 -13.008 1.00 0.00 H new ATOM 0 HA VAL A 85 1.843 7.991 -10.343 1.00 0.00 H new ATOM 0 HB VAL A 85 3.167 5.548 -11.075 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.710 4.435 -9.540 1.00 0.00 H new ATOM 0 HG12 VAL A 85 2.856 5.624 -8.877 1.00 0.00 H new ATOM 0 HG13 VAL A 85 1.132 6.038 -9.025 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.228 4.395 -11.866 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.483 5.982 -12.168 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.008 5.547 -12.975 1.00 0.00 H new ATOM 566 N THR A 86 3.987 9.077 -9.846 1.00 0.00 N ATOM 567 CA THR A 86 5.172 9.890 -9.562 1.00 0.00 C ATOM 568 C THR A 86 5.986 9.366 -8.385 1.00 0.00 C ATOM 569 O THR A 86 7.169 9.696 -8.277 1.00 0.00 O ATOM 570 CB THR A 86 4.755 11.336 -9.264 1.00 0.00 C ATOM 571 OG1 THR A 86 3.746 11.353 -8.273 1.00 0.00 O ATOM 572 CG2 THR A 86 4.165 12.000 -10.508 1.00 0.00 C ATOM 0 H THR A 86 3.133 9.513 -9.497 1.00 0.00 H new ATOM 0 HA THR A 86 5.801 9.840 -10.451 1.00 0.00 H new ATOM 0 HB THR A 86 5.646 11.870 -8.933 1.00 0.00 H new ATOM 0 HG1 THR A 86 3.486 12.279 -8.087 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.877 13.024 -10.272 1.00 0.00 H new ATOM 0 HG22 THR A 86 4.909 12.007 -11.304 1.00 0.00 H new ATOM 0 HG23 THR A 86 3.288 11.443 -10.836 1.00 0.00 H new ATOM 580 N ASN A 87 5.385 8.532 -7.529 1.00 0.00 N ATOM 581 CA ASN A 87 6.112 7.855 -6.460 1.00 0.00 C ATOM 582 C ASN A 87 5.560 6.466 -6.096 1.00 0.00 C ATOM 583 O ASN A 87 4.394 6.139 -6.315 1.00 0.00 O ATOM 584 CB ASN A 87 6.149 8.785 -5.219 1.00 0.00 C ATOM 585 CG ASN A 87 7.533 9.265 -4.816 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.559 8.707 -5.181 1.00 0.00 O ATOM 587 ND2 ASN A 87 7.603 10.293 -4.001 1.00 0.00 N ATOM 0 H ASN A 87 4.390 8.311 -7.560 1.00 0.00 H new ATOM 0 HA ASN A 87 7.120 7.661 -6.828 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.523 9.655 -5.417 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.704 8.258 -4.375 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.511 10.624 -3.674 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.750 10.760 -3.695 1.00 0.00 H new ATOM 594 N LEU A 88 6.394 5.668 -5.434 1.00 0.00 N ATOM 595 CA LEU A 88 5.981 4.575 -4.555 1.00 0.00 C ATOM 596 C LEU A 88 6.863 4.497 -3.303 1.00 0.00 C ATOM 597 O LEU A 88 7.874 5.197 -3.186 1.00 0.00 O ATOM 598 CB LEU A 88 5.910 3.259 -5.347 1.00 0.00 C ATOM 599 CG LEU A 88 7.224 2.580 -5.772 1.00 0.00 C ATOM 600 CD1 LEU A 88 8.059 1.960 -4.654 1.00 0.00 C ATOM 601 CD2 LEU A 88 6.802 1.428 -6.672 1.00 0.00 C ATOM 0 H LEU A 88 7.407 5.766 -5.496 1.00 0.00 H new ATOM 0 HA LEU A 88 4.975 4.772 -4.183 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.347 2.543 -4.748 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.328 3.447 -6.249 1.00 0.00 H new ATOM 0 HG LEU A 88 7.850 3.353 -6.218 1.00 0.00 H new ATOM 0 HD11 LEU A 88 8.959 1.513 -5.077 1.00 0.00 H new ATOM 0 HD12 LEU A 88 8.340 2.733 -3.938 1.00 0.00 H new ATOM 0 HD13 LEU A 88 7.475 1.191 -4.148 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.687 0.893 -7.017 1.00 0.00 H new ATOM 0 HD22 LEU A 88 6.160 0.746 -6.114 1.00 0.00 H new ATOM 0 HD23 LEU A 88 6.256 1.818 -7.531 1.00 0.00 H new ATOM 613 N LEU A 89 6.467 3.639 -2.368 1.00 0.00 N ATOM 614 CA LEU A 89 7.186 3.323 -1.131 1.00 0.00 C ATOM 615 C LEU A 89 7.031 1.836 -0.841 1.00 0.00 C ATOM 616 O LEU A 89 6.031 1.239 -1.236 1.00 0.00 O ATOM 617 CB LEU A 89 6.703 4.299 -0.045 1.00 0.00 C ATOM 618 CG LEU A 89 6.490 3.835 1.399 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.894 5.037 2.118 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.497 2.717 1.599 1.00 0.00 C ATOM 0 H LEU A 89 5.594 3.118 -2.453 1.00 0.00 H new ATOM 0 HA LEU A 89 8.264 3.473 -1.193 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.419 5.120 -0.013 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.756 4.715 -0.389 1.00 0.00 H new ATOM 0 HG LEU A 89 7.451 3.464 1.756 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.712 4.783 3.162 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.589 5.875 2.064 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.953 5.315 1.643 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.431 2.475 2.660 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.518 3.031 1.237 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.824 1.837 1.046 1.00 0.00 H new ATOM 632 N MET A 90 7.998 1.237 -0.139 1.00 0.00 N ATOM 633 CA MET A 90 8.055 -0.207 0.120 1.00 0.00 C ATOM 634 C MET A 90 8.330 -0.511 1.597 1.00 0.00 C ATOM 635 O MET A 90 9.455 -0.368 2.082 1.00 0.00 O ATOM 636 CB MET A 90 9.069 -0.855 -0.839 1.00 0.00 C ATOM 637 CG MET A 90 8.626 -0.607 -2.287 1.00 0.00 C ATOM 638 SD MET A 90 9.139 -1.839 -3.498 1.00 0.00 S ATOM 639 CE MET A 90 7.636 -1.724 -4.494 1.00 0.00 C ATOM 0 H MET A 90 8.777 1.750 0.273 1.00 0.00 H new ATOM 0 HA MET A 90 7.080 -0.651 -0.080 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.062 -0.437 -0.674 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.137 -1.926 -0.646 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.538 -0.540 -2.306 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.010 0.363 -2.601 1.00 0.00 H new ATOM 0 HE1 MET A 90 7.153 -2.700 -4.538 1.00 0.00 H new ATOM 0 HE2 MET A 90 6.955 -1.002 -4.043 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.892 -1.400 -5.503 1.00 0.00 H new ATOM 649 N LEU A 91 7.279 -0.893 2.330 1.00 0.00 N ATOM 650 CA LEU A 91 7.345 -1.274 3.748 1.00 0.00 C ATOM 651 C LEU A 91 8.024 -2.652 3.899 1.00 0.00 C ATOM 652 O LEU A 91 7.392 -3.699 3.708 1.00 0.00 O ATOM 653 CB LEU A 91 5.949 -1.300 4.407 1.00 0.00 C ATOM 654 CG LEU A 91 5.083 -0.023 4.507 1.00 0.00 C ATOM 655 CD1 LEU A 91 5.901 1.224 4.812 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.195 0.172 3.284 1.00 0.00 C ATOM 0 H LEU A 91 6.336 -0.948 1.946 1.00 0.00 H new ATOM 0 HA LEU A 91 7.938 -0.517 4.261 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.359 -2.043 3.871 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.084 -1.672 5.422 1.00 0.00 H new ATOM 0 HG LEU A 91 4.424 -0.178 5.361 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.239 2.088 4.870 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.417 1.097 5.764 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.634 1.381 4.021 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.607 1.082 3.403 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.817 0.255 2.393 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.525 -0.682 3.181 1.00 0.00 H new ATOM 668 N LYS A 92 9.313 -2.657 4.260 1.00 0.00 N ATOM 669 CA LYS A 92 10.172 -3.854 4.385 1.00 0.00 C ATOM 670 C LYS A 92 9.660 -4.920 5.370 1.00 0.00 C ATOM 671 O LYS A 92 10.016 -6.094 5.250 1.00 0.00 O ATOM 672 CB LYS A 92 11.600 -3.425 4.785 1.00 0.00 C ATOM 673 CG LYS A 92 12.263 -2.364 3.888 1.00 0.00 C ATOM 674 CD LYS A 92 12.424 -2.815 2.426 1.00 0.00 C ATOM 675 CE LYS A 92 13.127 -1.750 1.570 1.00 0.00 C ATOM 676 NZ LYS A 92 14.566 -1.595 1.920 1.00 0.00 N ATOM 0 H LYS A 92 9.812 -1.796 4.483 1.00 0.00 H new ATOM 0 HA LYS A 92 10.158 -4.329 3.404 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.570 -3.042 5.805 1.00 0.00 H new ATOM 0 HB3 LYS A 92 12.235 -4.311 4.795 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.667 -1.452 3.916 1.00 0.00 H new ATOM 0 HG3 LYS A 92 13.244 -2.117 4.294 1.00 0.00 H new ATOM 0 HD2 LYS A 92 12.996 -3.742 2.393 1.00 0.00 H new ATOM 0 HD3 LYS A 92 11.443 -3.031 2.003 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.039 -2.019 0.517 1.00 0.00 H new ATOM 0 HE3 LYS A 92 12.620 -0.793 1.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 15.014 -0.928 1.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 14.650 -1.231 2.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.041 -2.518 1.855 1.00 0.00 H new ATOM 690 N GLY A 93 8.822 -4.529 6.333 1.00 0.00 N ATOM 691 CA GLY A 93 8.318 -5.373 7.424 1.00 0.00 C ATOM 692 C GLY A 93 7.443 -6.559 7.005 1.00 0.00 C ATOM 693 O GLY A 93 7.570 -7.652 7.562 1.00 0.00 O ATOM 0 H GLY A 93 8.460 -3.576 6.378 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.171 -5.756 7.984 1.00 0.00 H new ATOM 0 HA3 GLY A 93 7.744 -4.746 8.106 1.00 0.00 H new ATOM 697 N LYS A 94 6.497 -6.319 6.084 1.00 0.00 N ATOM 698 CA LYS A 94 5.231 -7.078 5.977 1.00 0.00 C ATOM 699 C LYS A 94 4.808 -7.460 4.544 1.00 0.00 C ATOM 700 O LYS A 94 3.686 -7.922 4.354 1.00 0.00 O ATOM 701 CB LYS A 94 4.129 -6.261 6.695 1.00 0.00 C ATOM 702 CG LYS A 94 4.267 -6.270 8.227 1.00 0.00 C ATOM 703 CD LYS A 94 3.286 -5.304 8.903 1.00 0.00 C ATOM 704 CE LYS A 94 3.842 -3.874 8.865 1.00 0.00 C ATOM 705 NZ LYS A 94 2.894 -2.907 9.478 1.00 0.00 N ATOM 0 H LYS A 94 6.586 -5.585 5.382 1.00 0.00 H new ATOM 0 HA LYS A 94 5.390 -8.044 6.456 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.161 -5.231 6.340 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.153 -6.662 6.422 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.095 -7.280 8.600 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.287 -5.999 8.500 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.321 -5.341 8.397 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.117 -5.609 9.936 1.00 0.00 H new ATOM 0 HE2 LYS A 94 4.794 -3.838 9.395 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.041 -3.586 7.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 3.346 -1.973 9.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.040 -2.837 8.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.632 -3.234 10.430 1.00 0.00 H new ATOM 719 N ASN A 95 5.671 -7.255 3.539 1.00 0.00 N ATOM 720 CA ASN A 95 5.312 -7.272 2.104 1.00 0.00 C ATOM 721 C ASN A 95 4.174 -6.281 1.816 1.00 0.00 C ATOM 722 O ASN A 95 3.093 -6.657 1.349 1.00 0.00 O ATOM 723 CB ASN A 95 5.000 -8.696 1.598 1.00 0.00 C ATOM 724 CG ASN A 95 6.165 -9.677 1.597 1.00 0.00 C ATOM 725 OD1 ASN A 95 7.148 -9.559 2.316 1.00 0.00 O ATOM 726 ND2 ASN A 95 6.070 -10.713 0.795 1.00 0.00 N ATOM 0 H ASN A 95 6.661 -7.068 3.699 1.00 0.00 H new ATOM 0 HA ASN A 95 6.183 -6.941 1.538 1.00 0.00 H new ATOM 0 HB2 ASN A 95 4.202 -9.112 2.213 1.00 0.00 H new ATOM 0 HB3 ASN A 95 4.613 -8.622 0.582 1.00 0.00 H new ATOM 0 HD21 ASN A 95 6.813 -11.412 0.775 1.00 0.00 H new ATOM 0 HD22 ASN A 95 5.254 -10.818 0.193 1.00 0.00 H new ATOM 733 N GLN A 96 4.438 -5.000 2.092 1.00 0.00 N ATOM 734 CA GLN A 96 3.501 -3.908 1.840 1.00 0.00 C ATOM 735 C GLN A 96 4.159 -2.737 1.086 1.00 0.00 C ATOM 736 O GLN A 96 5.384 -2.626 1.031 1.00 0.00 O ATOM 737 CB GLN A 96 2.851 -3.454 3.147 1.00 0.00 C ATOM 738 CG GLN A 96 2.119 -4.594 3.850 1.00 0.00 C ATOM 739 CD GLN A 96 1.216 -4.037 4.924 1.00 0.00 C ATOM 740 OE1 GLN A 96 0.015 -4.223 4.909 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.754 -3.299 5.866 1.00 0.00 N ATOM 0 H GLN A 96 5.320 -4.692 2.502 1.00 0.00 H new ATOM 0 HA GLN A 96 2.717 -4.286 1.184 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.616 -3.051 3.811 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.149 -2.646 2.941 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.533 -5.162 3.128 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.839 -5.284 4.289 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.762 -3.143 5.878 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.164 -2.881 6.586 1.00 0.00 H new ATOM 750 N ALA A 97 3.349 -1.845 0.517 1.00 0.00 N ATOM 751 CA ALA A 97 3.793 -0.679 -0.251 1.00 0.00 C ATOM 752 C ALA A 97 2.742 0.439 -0.255 1.00 0.00 C ATOM 753 O ALA A 97 1.573 0.221 0.070 1.00 0.00 O ATOM 754 CB ALA A 97 4.053 -1.155 -1.695 1.00 0.00 C ATOM 0 H ALA A 97 2.333 -1.915 0.579 1.00 0.00 H new ATOM 0 HA ALA A 97 4.693 -0.266 0.204 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.387 -0.313 -2.301 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.823 -1.927 -1.691 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.133 -1.563 -2.115 1.00 0.00 H new ATOM 760 N PHE A 98 3.153 1.625 -0.695 1.00 0.00 N ATOM 761 CA PHE A 98 2.305 2.724 -1.167 1.00 0.00 C ATOM 762 C PHE A 98 2.521 2.847 -2.683 1.00 0.00 C ATOM 763 O PHE A 98 3.636 2.612 -3.148 1.00 0.00 O ATOM 764 CB PHE A 98 2.737 4.069 -0.565 1.00 0.00 C ATOM 765 CG PHE A 98 2.365 4.417 0.867 1.00 0.00 C ATOM 766 CD1 PHE A 98 2.080 3.418 1.821 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.356 5.773 1.268 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.814 3.767 3.151 1.00 0.00 C ATOM 769 CE2 PHE A 98 2.054 6.126 2.584 1.00 0.00 C ATOM 770 CZ PHE A 98 1.791 5.118 3.516 1.00 0.00 C ATOM 0 H PHE A 98 4.144 1.862 -0.735 1.00 0.00 H new ATOM 0 HA PHE A 98 1.274 2.511 -0.886 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.823 4.123 -0.640 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.334 4.854 -1.204 1.00 0.00 H new ATOM 0 HD1 PHE A 98 2.067 2.380 1.525 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.585 6.544 0.548 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.628 3.000 3.889 1.00 0.00 H new ATOM 0 HE2 PHE A 98 2.024 7.165 2.879 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.566 5.387 4.537 1.00 0.00 H new ATOM 780 N ILE A 99 1.538 3.330 -3.437 1.00 0.00 N ATOM 781 CA ILE A 99 1.671 3.745 -4.837 1.00 0.00 C ATOM 782 C ILE A 99 0.971 5.105 -5.018 1.00 0.00 C ATOM 783 O ILE A 99 -0.253 5.220 -4.928 1.00 0.00 O ATOM 784 CB ILE A 99 1.241 2.589 -5.774 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.498 2.958 -7.243 1.00 0.00 C ATOM 786 CG2 ILE A 99 -0.198 2.100 -5.563 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.331 1.784 -8.219 1.00 0.00 C ATOM 0 H ILE A 99 0.590 3.449 -3.080 1.00 0.00 H new ATOM 0 HA ILE A 99 2.705 3.929 -5.129 1.00 0.00 H new ATOM 0 HB ILE A 99 1.868 1.740 -5.502 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.815 3.757 -7.531 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.509 3.354 -7.336 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.413 1.291 -6.261 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.313 1.739 -4.541 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.891 2.923 -5.737 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.529 2.125 -9.235 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.033 0.992 -7.959 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.312 1.401 -8.157 1.00 0.00 H new ATOM 799 N GLU A 100 1.775 6.162 -5.140 1.00 0.00 N ATOM 800 CA GLU A 100 1.383 7.577 -5.223 1.00 0.00 C ATOM 801 C GLU A 100 1.328 8.038 -6.675 1.00 0.00 C ATOM 802 O GLU A 100 2.321 7.962 -7.408 1.00 0.00 O ATOM 803 CB GLU A 100 2.389 8.440 -4.449 1.00 0.00 C ATOM 804 CG GLU A 100 2.439 9.947 -4.792 1.00 0.00 C ATOM 805 CD GLU A 100 1.132 10.718 -4.548 1.00 0.00 C ATOM 806 OE1 GLU A 100 0.299 10.270 -3.731 1.00 0.00 O ATOM 807 OE2 GLU A 100 0.975 11.810 -5.146 1.00 0.00 O ATOM 0 H GLU A 100 2.788 6.049 -5.187 1.00 0.00 H new ATOM 0 HA GLU A 100 0.391 7.686 -4.784 1.00 0.00 H new ATOM 0 HB2 GLU A 100 2.170 8.343 -3.386 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.384 8.024 -4.609 1.00 0.00 H new ATOM 0 HG2 GLU A 100 3.231 10.411 -4.204 1.00 0.00 H new ATOM 0 HG3 GLU A 100 2.716 10.055 -5.841 1.00 0.00 H new ATOM 814 N MET A 101 0.173 8.560 -7.076 1.00 0.00 N ATOM 815 CA MET A 101 -0.037 8.987 -8.459 1.00 0.00 C ATOM 816 C MET A 101 -0.498 10.433 -8.632 1.00 0.00 C ATOM 817 O MET A 101 -0.999 11.079 -7.722 1.00 0.00 O ATOM 818 CB MET A 101 -0.805 7.891 -9.197 1.00 0.00 C ATOM 819 CG MET A 101 -2.001 8.241 -10.064 1.00 0.00 C ATOM 820 SD MET A 101 -2.833 6.697 -10.485 1.00 0.00 S ATOM 821 CE MET A 101 -1.556 5.790 -11.359 1.00 0.00 C ATOM 0 H MET A 101 -0.632 8.698 -6.465 1.00 0.00 H new ATOM 0 HA MET A 101 0.923 9.078 -8.967 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.090 7.368 -9.831 1.00 0.00 H new ATOM 0 HB3 MET A 101 -1.148 7.178 -8.448 1.00 0.00 H new ATOM 0 HG2 MET A 101 -2.678 8.909 -9.532 1.00 0.00 H new ATOM 0 HG3 MET A 101 -1.681 8.763 -10.966 1.00 0.00 H new ATOM 0 HE1 MET A 101 -2.003 4.944 -11.881 1.00 0.00 H new ATOM 0 HE2 MET A 101 -1.072 6.448 -12.081 1.00 0.00 H new ATOM 0 HE3 MET A 101 -0.815 5.427 -10.647 1.00 0.00 H new ATOM 831 N ASN A 102 -0.241 10.963 -9.823 1.00 0.00 N ATOM 832 CA ASN A 102 -0.298 12.382 -10.181 1.00 0.00 C ATOM 833 C ASN A 102 -1.732 12.946 -10.213 1.00 0.00 C ATOM 834 O ASN A 102 -1.914 14.160 -10.114 1.00 0.00 O ATOM 835 CB ASN A 102 0.487 12.515 -11.505 1.00 0.00 C ATOM 836 CG ASN A 102 -0.183 13.248 -12.645 1.00 0.00 C ATOM 837 OD1 ASN A 102 -0.704 12.508 -13.595 1.00 0.00 O flip ATOM 838 ND2 ASN A 102 -0.208 14.468 -12.725 1.00 0.00 N flip ATOM 0 H ASN A 102 0.030 10.380 -10.615 1.00 0.00 H new ATOM 0 HA ASN A 102 0.165 13.006 -9.416 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.428 13.020 -11.288 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.735 11.512 -11.851 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.199 15.036 -11.982 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.636 14.917 -13.534 1.00 0.00 H new ATOM 845 N THR A 103 -2.749 12.081 -10.310 1.00 0.00 N ATOM 846 CA THR A 103 -4.170 12.470 -10.366 1.00 0.00 C ATOM 847 C THR A 103 -5.041 11.572 -9.489 1.00 0.00 C ATOM 848 O THR A 103 -4.859 10.350 -9.396 1.00 0.00 O ATOM 849 CB THR A 103 -4.726 12.598 -11.807 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.650 11.593 -12.145 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.656 12.591 -12.900 1.00 0.00 C ATOM 0 H THR A 103 -2.608 11.072 -10.353 1.00 0.00 H new ATOM 0 HA THR A 103 -4.216 13.477 -9.950 1.00 0.00 H new ATOM 0 HB THR A 103 -5.214 13.572 -11.776 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.963 11.732 -13.063 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.132 12.685 -13.876 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.974 13.428 -12.747 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.098 11.656 -12.857 1.00 0.00 H new ATOM 859 N GLU A 104 -6.011 12.206 -8.831 1.00 0.00 N ATOM 860 CA GLU A 104 -6.995 11.551 -7.969 1.00 0.00 C ATOM 861 C GLU A 104 -7.851 10.557 -8.763 1.00 0.00 C ATOM 862 O GLU A 104 -8.124 9.457 -8.287 1.00 0.00 O ATOM 863 CB GLU A 104 -7.897 12.615 -7.319 1.00 0.00 C ATOM 864 CG GLU A 104 -7.113 13.577 -6.415 1.00 0.00 C ATOM 865 CD GLU A 104 -8.001 14.728 -5.904 1.00 0.00 C ATOM 866 OE1 GLU A 104 -8.987 14.470 -5.170 1.00 0.00 O ATOM 867 OE2 GLU A 104 -7.707 15.908 -6.221 1.00 0.00 O ATOM 0 H GLU A 104 -6.138 13.217 -8.884 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.462 10.997 -7.196 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.402 13.185 -8.099 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.672 12.121 -6.733 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.704 13.028 -5.567 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.267 13.987 -6.967 1.00 0.00 H new ATOM 874 N GLU A 105 -8.257 10.920 -9.984 1.00 0.00 N ATOM 875 CA GLU A 105 -9.094 10.069 -10.835 1.00 0.00 C ATOM 876 C GLU A 105 -8.340 8.895 -11.459 1.00 0.00 C ATOM 877 O GLU A 105 -8.909 7.810 -11.566 1.00 0.00 O ATOM 878 CB GLU A 105 -9.742 10.885 -11.961 1.00 0.00 C ATOM 879 CG GLU A 105 -10.806 11.878 -11.482 1.00 0.00 C ATOM 880 CD GLU A 105 -12.039 11.163 -10.893 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.888 10.668 -11.674 1.00 0.00 O ATOM 882 OE2 GLU A 105 -12.168 11.090 -9.647 1.00 0.00 O ATOM 0 H GLU A 105 -8.014 11.814 -10.411 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.855 9.661 -10.169 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.964 11.432 -12.493 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.196 10.200 -12.677 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.374 12.537 -10.728 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -11.116 12.508 -12.316 1.00 0.00 H new ATOM 889 N ALA A 106 -7.066 9.069 -11.821 1.00 0.00 N ATOM 890 CA ALA A 106 -6.193 7.965 -12.188 1.00 0.00 C ATOM 891 C ALA A 106 -6.136 6.952 -11.054 1.00 0.00 C ATOM 892 O ALA A 106 -6.464 5.795 -11.269 1.00 0.00 O ATOM 893 CB ALA A 106 -4.803 8.472 -12.542 1.00 0.00 C ATOM 0 H ALA A 106 -6.616 9.983 -11.866 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.598 7.472 -13.072 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.167 7.630 -12.813 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.871 9.162 -13.383 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.374 8.989 -11.683 1.00 0.00 H new ATOM 899 N ALA A 107 -5.778 7.353 -9.835 1.00 0.00 N ATOM 900 CA ALA A 107 -5.688 6.386 -8.753 1.00 0.00 C ATOM 901 C ALA A 107 -7.043 5.801 -8.339 1.00 0.00 C ATOM 902 O ALA A 107 -7.126 4.617 -8.040 1.00 0.00 O ATOM 903 CB ALA A 107 -5.007 7.073 -7.607 1.00 0.00 C ATOM 0 H ALA A 107 -5.552 8.314 -9.580 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.115 5.522 -9.091 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -4.918 6.381 -6.769 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.014 7.398 -7.916 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.594 7.939 -7.301 1.00 0.00 H new ATOM 909 N ASN A 108 -8.126 6.576 -8.393 1.00 0.00 N ATOM 910 CA ASN A 108 -9.478 6.052 -8.244 1.00 0.00 C ATOM 911 C ASN A 108 -9.776 4.951 -9.275 1.00 0.00 C ATOM 912 O ASN A 108 -10.155 3.837 -8.905 1.00 0.00 O ATOM 913 CB ASN A 108 -10.463 7.219 -8.325 1.00 0.00 C ATOM 914 CG ASN A 108 -11.895 6.753 -8.106 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.246 6.234 -7.056 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.754 6.884 -9.090 1.00 0.00 N ATOM 0 H ASN A 108 -8.088 7.584 -8.541 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.584 5.573 -7.271 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.204 7.968 -7.577 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.380 7.700 -9.300 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.712 6.553 -8.978 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.463 7.317 -9.967 1.00 0.00 H new ATOM 923 N THR A 109 -9.535 5.209 -10.562 1.00 0.00 N ATOM 924 CA THR A 109 -9.679 4.182 -11.594 1.00 0.00 C ATOM 925 C THR A 109 -8.687 3.037 -11.370 1.00 0.00 C ATOM 926 O THR A 109 -9.036 1.894 -11.635 1.00 0.00 O ATOM 927 CB THR A 109 -9.621 4.790 -13.014 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.647 4.232 -13.808 1.00 0.00 O ATOM 929 CG2 THR A 109 -8.320 4.576 -13.785 1.00 0.00 C ATOM 0 H THR A 109 -9.239 6.120 -10.914 1.00 0.00 H new ATOM 0 HA THR A 109 -10.672 3.741 -11.509 1.00 0.00 H new ATOM 0 HB THR A 109 -9.722 5.862 -12.843 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.611 4.619 -14.708 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.397 5.046 -14.766 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.492 5.021 -13.233 1.00 0.00 H new ATOM 0 HG23 THR A 109 -8.141 3.508 -13.908 1.00 0.00 H new ATOM 937 N MET A 110 -7.493 3.291 -10.804 1.00 0.00 N ATOM 938 CA MET A 110 -6.455 2.293 -10.561 1.00 0.00 C ATOM 939 C MET A 110 -6.844 1.325 -9.433 1.00 0.00 C ATOM 940 O MET A 110 -6.717 0.110 -9.560 1.00 0.00 O ATOM 941 CB MET A 110 -5.078 2.940 -10.270 1.00 0.00 C ATOM 942 CG MET A 110 -4.019 1.950 -10.780 1.00 0.00 C ATOM 943 SD MET A 110 -2.282 2.394 -10.582 1.00 0.00 S ATOM 944 CE MET A 110 -2.331 2.925 -8.874 1.00 0.00 C ATOM 0 H MET A 110 -7.224 4.226 -10.497 1.00 0.00 H new ATOM 0 HA MET A 110 -6.363 1.718 -11.483 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.986 3.902 -10.775 1.00 0.00 H new ATOM 0 HB3 MET A 110 -4.954 3.127 -9.203 1.00 0.00 H new ATOM 0 HG2 MET A 110 -4.180 0.998 -10.274 1.00 0.00 H new ATOM 0 HG3 MET A 110 -4.202 1.782 -11.841 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.315 2.987 -8.483 1.00 0.00 H new ATOM 0 HE2 MET A 110 -2.804 3.905 -8.811 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.903 2.207 -8.286 1.00 0.00 H new ATOM 954 N VAL A 111 -7.339 1.845 -8.315 1.00 0.00 N ATOM 955 CA VAL A 111 -7.767 1.061 -7.149 1.00 0.00 C ATOM 956 C VAL A 111 -9.014 0.227 -7.464 1.00 0.00 C ATOM 957 O VAL A 111 -9.110 -0.925 -7.054 1.00 0.00 O ATOM 958 CB VAL A 111 -7.957 2.003 -5.944 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.340 2.610 -5.799 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.620 1.319 -4.619 1.00 0.00 C ATOM 0 H VAL A 111 -7.459 2.850 -8.186 1.00 0.00 H new ATOM 0 HA VAL A 111 -6.992 0.340 -6.888 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.260 2.811 -6.166 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.364 3.255 -4.921 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.575 3.197 -6.687 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.076 1.814 -5.685 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.769 2.021 -3.799 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.270 0.455 -4.480 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.580 0.992 -4.633 1.00 0.00 H new ATOM 970 N ASN A 112 -9.944 0.784 -8.250 1.00 0.00 N ATOM 971 CA ASN A 112 -11.158 0.100 -8.713 1.00 0.00 C ATOM 972 C ASN A 112 -10.829 -0.967 -9.767 1.00 0.00 C ATOM 973 O ASN A 112 -11.308 -2.098 -9.694 1.00 0.00 O ATOM 974 CB ASN A 112 -12.133 1.146 -9.263 1.00 0.00 C ATOM 975 CG ASN A 112 -12.892 1.884 -8.163 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.067 1.646 -7.927 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.264 2.787 -7.444 1.00 0.00 N ATOM 0 H ASN A 112 -9.872 1.743 -8.589 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.622 -0.420 -7.875 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.582 1.868 -9.865 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.847 0.657 -9.926 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.757 3.279 -6.699 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.283 2.995 -7.630 1.00 0.00 H new ATOM 984 N TYR A 113 -9.928 -0.657 -10.701 1.00 0.00 N ATOM 985 CA TYR A 113 -9.280 -1.627 -11.580 1.00 0.00 C ATOM 986 C TYR A 113 -8.731 -2.816 -10.772 1.00 0.00 C ATOM 987 O TYR A 113 -9.153 -3.950 -10.951 1.00 0.00 O ATOM 988 CB TYR A 113 -8.210 -0.890 -12.401 1.00 0.00 C ATOM 989 CG TYR A 113 -7.262 -1.770 -13.168 1.00 0.00 C ATOM 990 CD1 TYR A 113 -6.055 -2.189 -12.577 1.00 0.00 C ATOM 991 CD2 TYR A 113 -7.570 -2.105 -14.497 1.00 0.00 C ATOM 992 CE1 TYR A 113 -5.230 -3.082 -13.283 1.00 0.00 C ATOM 993 CE2 TYR A 113 -6.721 -2.967 -15.216 1.00 0.00 C ATOM 994 CZ TYR A 113 -5.555 -3.476 -14.599 1.00 0.00 C ATOM 995 OH TYR A 113 -4.712 -4.303 -15.282 1.00 0.00 O ATOM 0 H TYR A 113 -9.622 0.301 -10.870 1.00 0.00 H new ATOM 0 HA TYR A 113 -9.996 -2.063 -12.277 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.711 -0.225 -13.105 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.629 -0.261 -11.727 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -5.768 -1.831 -11.599 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -8.456 -1.702 -14.966 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -4.338 -3.471 -12.814 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -6.959 -3.238 -16.234 1.00 0.00 H new ATOM 0 HH TYR A 113 -5.079 -4.481 -16.173 1.00 0.00 H new ATOM 1005 N TYR A 114 -7.943 -2.586 -9.731 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.371 -3.591 -8.846 1.00 0.00 C ATOM 1007 C TYR A 114 -8.366 -4.131 -7.820 1.00 0.00 C ATOM 1008 O TYR A 114 -7.976 -4.870 -6.914 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.133 -3.010 -8.161 1.00 0.00 C ATOM 1010 CG TYR A 114 -4.949 -2.803 -9.060 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.533 -3.862 -9.887 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.222 -1.601 -9.005 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.338 -3.750 -10.610 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -3.053 -1.464 -9.772 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.613 -2.541 -10.574 1.00 0.00 C ATOM 1016 OH TYR A 114 -1.522 -2.402 -11.359 1.00 0.00 O ATOM 0 H TYR A 114 -7.670 -1.639 -9.467 1.00 0.00 H new ATOM 0 HA TYR A 114 -7.090 -4.448 -9.458 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.400 -2.054 -7.711 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -5.841 -3.674 -7.348 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -5.132 -4.757 -9.964 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.560 -0.789 -8.378 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -2.974 -4.584 -11.191 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.494 -0.540 -9.749 1.00 0.00 H new ATOM 0 HH TYR A 114 -1.659 -1.657 -11.980 1.00 0.00 H new ATOM 1026 N THR A 115 -9.648 -3.823 -8.025 1.00 0.00 N ATOM 1027 CA THR A 115 -10.758 -4.454 -7.318 1.00 0.00 C ATOM 1028 C THR A 115 -11.692 -5.247 -8.248 1.00 0.00 C ATOM 1029 O THR A 115 -12.484 -6.078 -7.802 1.00 0.00 O ATOM 1030 CB THR A 115 -11.450 -3.494 -6.323 1.00 0.00 C ATOM 1031 OG1 THR A 115 -11.676 -4.167 -5.104 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.798 -2.906 -6.749 1.00 0.00 C ATOM 0 H THR A 115 -9.946 -3.117 -8.698 1.00 0.00 H new ATOM 0 HA THR A 115 -10.335 -5.228 -6.677 1.00 0.00 H new ATOM 0 HB THR A 115 -10.755 -2.657 -6.255 1.00 0.00 H new ATOM 0 HG1 THR A 115 -12.113 -3.560 -4.471 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.174 -2.251 -5.963 1.00 0.00 H new ATOM 0 HG22 THR A 115 -12.671 -2.334 -7.668 1.00 0.00 H new ATOM 0 HG23 THR A 115 -13.510 -3.714 -6.920 1.00 0.00 H new ATOM 1040 N SER A 116 -11.505 -5.076 -9.562 1.00 0.00 N ATOM 1041 CA SER A 116 -11.952 -5.988 -10.625 1.00 0.00 C ATOM 1042 C SER A 116 -10.947 -7.119 -10.851 1.00 0.00 C ATOM 1043 O SER A 116 -11.312 -8.264 -11.119 1.00 0.00 O ATOM 1044 CB SER A 116 -11.994 -5.222 -11.957 1.00 0.00 C ATOM 1045 OG SER A 116 -13.302 -4.788 -12.293 1.00 0.00 O ATOM 0 H SER A 116 -11.016 -4.261 -9.932 1.00 0.00 H new ATOM 0 HA SER A 116 -12.922 -6.382 -10.322 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.332 -4.358 -11.897 1.00 0.00 H new ATOM 0 HB3 SER A 116 -11.611 -5.861 -12.752 1.00 0.00 H new ATOM 0 HG SER A 116 -13.278 -4.305 -13.145 1.00 0.00 H new ATOM 1051 N VAL A 117 -9.670 -6.741 -10.848 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.623 -7.323 -11.685 1.00 0.00 C ATOM 1053 C VAL A 117 -7.554 -8.009 -10.832 1.00 0.00 C ATOM 1054 O VAL A 117 -7.393 -9.228 -10.928 1.00 0.00 O ATOM 1055 CB VAL A 117 -8.041 -6.211 -12.585 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -6.918 -6.719 -13.428 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -9.036 -5.624 -13.600 1.00 0.00 C ATOM 0 H VAL A 117 -9.324 -5.996 -10.243 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.041 -8.103 -12.322 1.00 0.00 H new ATOM 0 HB VAL A 117 -7.736 -5.451 -11.866 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -6.533 -5.909 -14.048 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.121 -7.094 -12.785 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.278 -7.525 -14.067 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -8.542 -4.851 -14.189 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.389 -6.414 -14.262 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.883 -5.190 -13.069 1.00 0.00 H new ATOM 1067 N THR A 118 -6.849 -7.227 -9.999 1.00 0.00 N ATOM 1068 CA THR A 118 -5.708 -7.613 -9.132 1.00 0.00 C ATOM 1069 C THR A 118 -4.432 -7.964 -9.946 1.00 0.00 C ATOM 1070 O THR A 118 -4.530 -8.643 -10.972 1.00 0.00 O ATOM 1071 CB THR A 118 -6.111 -8.751 -8.167 1.00 0.00 C ATOM 1072 OG1 THR A 118 -7.359 -8.473 -7.560 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.127 -8.939 -7.017 1.00 0.00 C ATOM 0 H THR A 118 -7.072 -6.236 -9.902 1.00 0.00 H new ATOM 0 HA THR A 118 -5.449 -6.741 -8.531 1.00 0.00 H new ATOM 0 HB THR A 118 -6.138 -9.648 -8.786 1.00 0.00 H new ATOM 0 HG1 THR A 118 -7.598 -9.205 -6.954 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.467 -9.753 -6.376 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.142 -9.180 -7.417 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.068 -8.019 -6.435 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.216 -7.511 -9.554 1.00 0.00 N ATOM 1082 CA PRO A 119 -1.998 -7.724 -10.348 1.00 0.00 C ATOM 1083 C PRO A 119 -1.330 -9.105 -10.187 1.00 0.00 C ATOM 1084 O PRO A 119 -0.430 -9.418 -10.961 1.00 0.00 O ATOM 1085 CB PRO A 119 -1.043 -6.600 -9.937 1.00 0.00 C ATOM 1086 CG PRO A 119 -1.461 -6.227 -8.518 1.00 0.00 C ATOM 1087 CD PRO A 119 -2.915 -6.687 -8.391 1.00 0.00 C ATOM 0 HA PRO A 119 -2.262 -7.705 -11.405 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -0.005 -6.932 -9.968 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -1.125 -5.746 -10.610 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -0.827 -6.718 -7.779 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -1.372 -5.154 -8.351 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.059 -7.254 -7.471 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -3.586 -5.829 -8.345 1.00 0.00 H new ATOM 1095 N VAL A 120 -1.776 -9.911 -9.213 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.436 -11.318 -8.885 1.00 0.00 C ATOM 1097 C VAL A 120 -0.035 -11.757 -9.330 1.00 0.00 C ATOM 1098 O VAL A 120 0.214 -12.202 -10.453 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.493 -12.293 -9.389 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -2.391 -13.611 -8.630 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -3.924 -11.772 -9.214 1.00 0.00 C ATOM 0 H VAL A 120 -2.468 -9.556 -8.552 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.424 -11.346 -7.795 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.298 -12.423 -10.453 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -3.150 -14.302 -8.997 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.402 -14.044 -8.783 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.547 -13.431 -7.566 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.629 -12.512 -9.592 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.119 -11.592 -8.157 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.043 -10.841 -9.769 1.00 0.00 H new ATOM 1111 N LEU A 121 0.916 -11.578 -8.421 1.00 0.00 N ATOM 1112 CA LEU A 121 2.117 -10.816 -8.785 1.00 0.00 C ATOM 1113 C LEU A 121 3.378 -11.691 -8.654 1.00 0.00 C ATOM 1114 O LEU A 121 4.010 -12.001 -9.666 1.00 0.00 O ATOM 1115 CB LEU A 121 2.057 -9.480 -8.008 1.00 0.00 C ATOM 1116 CG LEU A 121 2.958 -8.335 -8.513 1.00 0.00 C ATOM 1117 CD1 LEU A 121 2.875 -7.155 -7.540 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.423 -8.711 -8.691 1.00 0.00 C ATOM 0 H LEU A 121 0.890 -11.931 -7.464 1.00 0.00 H new ATOM 0 HA LEU A 121 2.165 -10.535 -9.837 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.025 -9.129 -8.018 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.315 -9.681 -6.968 1.00 0.00 H new ATOM 0 HG LEU A 121 2.580 -8.079 -9.503 1.00 0.00 H new ATOM 0 HD11 LEU A 121 3.511 -6.345 -7.896 1.00 0.00 H new ATOM 0 HD12 LEU A 121 1.844 -6.806 -7.478 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.210 -7.473 -6.553 1.00 0.00 H new ATOM 0 HD21 LEU A 121 4.980 -7.845 -9.049 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.834 -9.037 -7.735 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.505 -9.520 -9.417 1.00 0.00 H new ATOM 1130 N ARG A 122 3.662 -12.221 -7.454 1.00 0.00 N ATOM 1131 CA ARG A 122 4.443 -13.478 -7.292 1.00 0.00 C ATOM 1132 C ARG A 122 3.622 -14.763 -7.520 1.00 0.00 C ATOM 1133 O ARG A 122 4.161 -15.862 -7.413 1.00 0.00 O ATOM 1134 CB ARG A 122 5.202 -13.526 -5.945 1.00 0.00 C ATOM 1135 CG ARG A 122 4.427 -13.152 -4.669 1.00 0.00 C ATOM 1136 CD ARG A 122 3.168 -13.995 -4.412 1.00 0.00 C ATOM 1137 NE ARG A 122 2.866 -14.076 -2.968 1.00 0.00 N ATOM 1138 CZ ARG A 122 3.431 -14.855 -2.063 1.00 0.00 C ATOM 1139 NH1 ARG A 122 4.403 -15.674 -2.352 1.00 0.00 N ATOM 1140 NH2 ARG A 122 3.020 -14.827 -0.828 1.00 0.00 N ATOM 0 H ARG A 122 3.365 -11.803 -6.572 1.00 0.00 H new ATOM 0 HA ARG A 122 5.182 -13.452 -8.093 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.591 -14.536 -5.816 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.062 -12.860 -6.021 1.00 0.00 H new ATOM 0 HG2 ARG A 122 5.094 -13.250 -3.813 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.139 -12.103 -4.730 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.320 -13.558 -4.940 1.00 0.00 H new ATOM 0 HD3 ARG A 122 3.310 -14.998 -4.813 1.00 0.00 H new ATOM 0 HE ARG A 122 2.132 -13.455 -2.628 1.00 0.00 H new ATOM 0 HH11 ARG A 122 4.755 -15.730 -3.308 1.00 0.00 H new ATOM 0 HH12 ARG A 122 4.811 -16.258 -1.623 1.00 0.00 H new ATOM 0 HH21 ARG A 122 2.260 -14.203 -0.557 1.00 0.00 H new ATOM 0 HH22 ARG A 122 3.458 -15.429 -0.131 1.00 0.00 H new ATOM 1154 N GLY A 123 2.325 -14.625 -7.799 1.00 0.00 N ATOM 1155 CA GLY A 123 1.383 -15.734 -7.994 1.00 0.00 C ATOM 1156 C GLY A 123 0.400 -15.961 -6.840 1.00 0.00 C ATOM 1157 O GLY A 123 0.024 -17.104 -6.580 1.00 0.00 O ATOM 0 H GLY A 123 1.885 -13.710 -7.899 1.00 0.00 H new ATOM 0 HA2 GLY A 123 0.814 -15.551 -8.905 1.00 0.00 H new ATOM 0 HA3 GLY A 123 1.952 -16.650 -8.152 1.00 0.00 H new ATOM 1161 N GLN A 124 -0.013 -14.895 -6.139 1.00 0.00 N ATOM 1162 CA GLN A 124 -1.004 -14.921 -5.070 1.00 0.00 C ATOM 1163 C GLN A 124 -1.937 -13.705 -5.163 1.00 0.00 C ATOM 1164 O GLN A 124 -1.489 -12.675 -5.666 1.00 0.00 O ATOM 1165 CB GLN A 124 -0.234 -14.956 -3.740 1.00 0.00 C ATOM 1166 CG GLN A 124 -1.122 -15.120 -2.511 1.00 0.00 C ATOM 1167 CD GLN A 124 -0.308 -15.232 -1.227 1.00 0.00 C ATOM 1168 OE1 GLN A 124 0.213 -14.256 -0.700 1.00 0.00 O ATOM 1169 NE2 GLN A 124 -0.161 -16.411 -0.668 1.00 0.00 N ATOM 0 H GLN A 124 0.352 -13.959 -6.313 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.644 -15.800 -5.150 1.00 0.00 H new ATOM 0 HB2 GLN A 124 0.483 -15.776 -3.769 1.00 0.00 H new ATOM 0 HB3 GLN A 124 0.340 -14.035 -3.640 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -1.799 -14.269 -2.437 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -1.740 -16.010 -2.627 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -0.588 -17.234 -1.093 1.00 0.00 H new ATOM 0 HE22 GLN A 124 0.380 -16.504 0.192 1.00 0.00 H new ATOM 1178 N PRO A 125 -3.210 -13.774 -4.727 1.00 0.00 N ATOM 1179 CA PRO A 125 -4.108 -12.619 -4.679 1.00 0.00 C ATOM 1180 C PRO A 125 -3.529 -11.450 -3.864 1.00 0.00 C ATOM 1181 O PRO A 125 -3.391 -11.534 -2.641 1.00 0.00 O ATOM 1182 CB PRO A 125 -5.438 -13.140 -4.114 1.00 0.00 C ATOM 1183 CG PRO A 125 -5.417 -14.614 -4.511 1.00 0.00 C ATOM 1184 CD PRO A 125 -3.942 -14.976 -4.352 1.00 0.00 C ATOM 0 HA PRO A 125 -4.251 -12.196 -5.673 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.496 -13.013 -3.033 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -6.293 -12.617 -4.543 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -6.055 -15.218 -3.866 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.764 -14.764 -5.533 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -3.717 -15.270 -3.327 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -3.672 -15.817 -4.991 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.145 -10.374 -4.554 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.589 -9.149 -3.961 1.00 0.00 C ATOM 1194 C ILE A 126 -3.735 -8.309 -3.374 1.00 0.00 C ATOM 1195 O ILE A 126 -4.845 -8.301 -3.906 1.00 0.00 O ATOM 1196 CB ILE A 126 -1.758 -8.347 -4.992 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -0.962 -9.226 -5.977 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.759 -7.404 -4.317 1.00 0.00 C ATOM 1199 CD1 ILE A 126 0.032 -10.197 -5.353 1.00 0.00 C ATOM 0 H ILE A 126 -3.213 -10.326 -5.571 1.00 0.00 H new ATOM 0 HA ILE A 126 -1.903 -9.419 -3.158 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.509 -7.786 -5.548 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.670 -9.798 -6.577 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -0.420 -8.572 -6.661 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.198 -6.862 -5.079 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.296 -6.694 -3.688 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -0.070 -7.983 -3.703 1.00 0.00 H new ATOM 0 HD11 ILE A 126 0.532 -10.761 -6.140 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.772 -9.641 -4.778 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.497 -10.885 -4.693 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.489 -7.608 -2.271 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.516 -6.881 -1.521 1.00 0.00 C ATOM 1213 C TYR A 127 -4.292 -5.368 -1.664 1.00 0.00 C ATOM 1214 O TYR A 127 -3.187 -4.894 -1.411 1.00 0.00 O ATOM 1215 CB TYR A 127 -4.421 -7.284 -0.044 1.00 0.00 C ATOM 1216 CG TYR A 127 -4.843 -8.671 0.406 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -5.223 -9.696 -0.483 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.777 -8.950 1.784 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -5.564 -10.975 0.009 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -5.103 -10.223 2.283 1.00 0.00 C ATOM 1221 CZ TYR A 127 -5.503 -11.243 1.396 1.00 0.00 C ATOM 1222 OH TYR A 127 -5.787 -12.484 1.877 1.00 0.00 O ATOM 0 H TYR A 127 -2.557 -7.526 -1.864 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.504 -7.127 -1.910 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -3.383 -7.149 0.260 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -5.015 -6.567 0.524 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -5.254 -9.503 -1.545 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -4.471 -8.173 2.469 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -5.872 -11.751 -0.676 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -5.047 -10.419 3.344 1.00 0.00 H new ATOM 0 HH TYR A 127 -5.693 -12.486 2.853 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.309 -4.589 -2.041 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.213 -3.143 -2.250 1.00 0.00 C ATOM 1234 C ILE A 128 -6.348 -2.389 -1.535 1.00 0.00 C ATOM 1235 O ILE A 128 -7.478 -2.874 -1.464 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.163 -2.886 -3.780 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -4.146 -1.779 -4.065 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.545 -2.578 -4.390 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.892 -1.533 -5.559 1.00 0.00 C ATOM 0 H ILE A 128 -6.245 -4.956 -2.213 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.300 -2.750 -1.802 1.00 0.00 H new ATOM 0 HB ILE A 128 -4.843 -3.806 -4.270 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -4.496 -0.853 -3.609 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -3.202 -2.035 -3.584 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.440 -2.408 -5.462 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.214 -3.422 -4.220 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.959 -1.686 -3.920 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -3.160 -0.734 -5.677 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.511 -2.445 -6.018 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.825 -1.245 -6.044 1.00 0.00 H new ATOM 1251 N GLN A 129 -6.059 -1.184 -1.043 1.00 0.00 N ATOM 1252 CA GLN A 129 -7.030 -0.129 -0.697 1.00 0.00 C ATOM 1253 C GLN A 129 -6.333 1.231 -0.769 1.00 0.00 C ATOM 1254 O GLN A 129 -5.111 1.316 -0.656 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.598 -0.314 0.729 1.00 0.00 C ATOM 1256 CG GLN A 129 -8.997 -0.950 0.748 1.00 0.00 C ATOM 1257 CD GLN A 129 -9.625 -0.907 2.141 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -9.037 -1.309 3.135 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -10.845 -0.429 2.274 1.00 0.00 N ATOM 0 H GLN A 129 -5.097 -0.897 -0.864 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.856 -0.189 -1.406 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.915 -0.937 1.307 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.641 0.656 1.224 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.643 -0.427 0.043 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.930 -1.985 0.412 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -11.351 -0.089 1.457 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -11.283 -0.399 3.195 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.095 2.320 -0.889 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.566 3.675 -0.693 1.00 0.00 C ATOM 1270 C PHE A 130 -5.786 3.826 0.630 1.00 0.00 C ATOM 1271 O PHE A 130 -6.080 3.170 1.636 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.702 4.697 -0.766 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.035 5.191 -2.159 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.050 5.844 -2.922 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.344 5.072 -2.657 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.378 6.388 -4.176 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.674 5.635 -3.902 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.695 6.304 -4.655 1.00 0.00 C ATOM 0 H PHE A 130 -8.087 2.291 -1.123 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.855 3.862 -1.498 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.598 4.253 -0.331 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.439 5.554 -0.147 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -6.042 5.927 -2.544 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.095 4.549 -2.084 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.617 6.871 -4.771 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.682 5.553 -4.280 1.00 0.00 H new ATOM 0 HZ PHE A 130 -8.955 6.754 -5.602 1.00 0.00 H new ATOM 1288 N SER A 131 -4.779 4.702 0.620 1.00 0.00 N ATOM 1289 CA SER A 131 -3.951 4.994 1.790 1.00 0.00 C ATOM 1290 C SER A 131 -4.742 5.730 2.890 1.00 0.00 C ATOM 1291 O SER A 131 -5.738 6.408 2.616 1.00 0.00 O ATOM 1292 CB SER A 131 -2.728 5.801 1.350 1.00 0.00 C ATOM 1293 OG SER A 131 -1.910 6.208 2.426 1.00 0.00 O ATOM 0 H SER A 131 -4.514 5.233 -0.209 1.00 0.00 H new ATOM 0 HA SER A 131 -3.624 4.051 2.228 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.135 5.202 0.659 1.00 0.00 H new ATOM 0 HB3 SER A 131 -3.061 6.683 0.802 1.00 0.00 H new ATOM 0 HG SER A 131 -1.930 5.525 3.128 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.264 5.652 4.135 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.665 6.533 5.237 1.00 0.00 C ATOM 1301 C ASN A 132 -4.205 7.997 5.030 1.00 0.00 C ATOM 1302 O ASN A 132 -4.672 8.899 5.728 1.00 0.00 O ATOM 1303 CB ASN A 132 -4.083 5.981 6.548 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.622 4.613 6.929 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -5.799 4.307 6.776 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -3.787 3.753 7.463 1.00 0.00 N ATOM 0 H ASN A 132 -3.570 4.957 4.412 1.00 0.00 H new ATOM 0 HA ASN A 132 -5.754 6.549 5.274 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -2.998 5.922 6.457 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.297 6.683 7.354 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -4.118 2.832 7.750 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -2.807 4.006 7.591 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.303 8.231 4.075 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.698 9.513 3.707 1.00 0.00 C ATOM 1315 C HIS A 133 -3.179 9.956 2.301 1.00 0.00 C ATOM 1316 O HIS A 133 -3.969 9.264 1.650 1.00 0.00 O ATOM 1317 CB HIS A 133 -1.162 9.379 3.817 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.703 8.632 5.057 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -0.723 9.088 6.361 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.318 7.319 5.098 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.340 8.071 7.158 1.00 0.00 C ATOM 1322 NE2 HIS A 133 -0.063 6.982 6.428 1.00 0.00 N ATOM 0 H HIS A 133 -2.949 7.471 3.494 1.00 0.00 H new ATOM 0 HA HIS A 133 -3.014 10.302 4.389 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.787 8.863 2.933 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.718 10.375 3.818 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -0.981 10.026 6.666 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.227 6.658 4.248 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -0.267 8.126 8.234 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.732 11.127 1.828 1.00 0.00 N ATOM 1331 CA LYS A 134 -3.231 11.787 0.598 1.00 0.00 C ATOM 1332 C LYS A 134 -2.161 12.151 -0.446 1.00 0.00 C ATOM 1333 O LYS A 134 -2.495 12.692 -1.498 1.00 0.00 O ATOM 1334 CB LYS A 134 -4.083 13.013 0.995 1.00 0.00 C ATOM 1335 CG LYS A 134 -3.289 14.130 1.695 1.00 0.00 C ATOM 1336 CD LYS A 134 -4.175 15.313 2.108 1.00 0.00 C ATOM 1337 CE LYS A 134 -4.757 16.068 0.900 1.00 0.00 C ATOM 1338 NZ LYS A 134 -5.559 17.245 1.326 1.00 0.00 N ATOM 0 H LYS A 134 -1.998 11.659 2.295 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.840 11.046 0.081 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -4.552 13.421 0.100 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.887 12.685 1.654 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -2.798 13.723 2.579 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -2.503 14.485 1.028 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -4.991 14.950 2.732 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -3.591 16.004 2.717 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -3.946 16.396 0.250 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -5.382 15.393 0.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -5.936 17.730 0.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -6.347 16.929 1.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -4.956 17.900 1.863 1.00 0.00 H new ATOM 1352 N GLU A 135 -0.905 11.850 -0.138 1.00 0.00 N ATOM 1353 CA GLU A 135 0.344 12.172 -0.840 1.00 0.00 C ATOM 1354 C GLU A 135 1.461 11.267 -0.281 1.00 0.00 C ATOM 1355 O GLU A 135 1.314 10.677 0.795 1.00 0.00 O ATOM 1356 CB GLU A 135 0.766 13.639 -0.591 1.00 0.00 C ATOM 1357 CG GLU A 135 0.012 14.681 -1.429 1.00 0.00 C ATOM 1358 CD GLU A 135 0.695 16.058 -1.330 1.00 0.00 C ATOM 1359 OE1 GLU A 135 1.805 16.230 -1.891 1.00 0.00 O ATOM 1360 OE2 GLU A 135 0.127 16.982 -0.698 1.00 0.00 O ATOM 0 H GLU A 135 -0.709 11.312 0.706 1.00 0.00 H new ATOM 0 HA GLU A 135 0.188 12.020 -1.908 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.621 13.869 0.464 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.833 13.734 -0.794 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -0.023 14.361 -2.470 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -1.019 14.755 -1.084 1.00 0.00 H new ATOM 1367 N LEU A 136 2.608 11.210 -0.964 1.00 0.00 N ATOM 1368 CA LEU A 136 3.809 10.481 -0.548 1.00 0.00 C ATOM 1369 C LEU A 136 5.066 11.340 -0.737 1.00 0.00 C ATOM 1370 O LEU A 136 5.536 11.553 -1.860 1.00 0.00 O ATOM 1371 CB LEU A 136 3.861 9.170 -1.335 1.00 0.00 C ATOM 1372 CG LEU A 136 5.123 8.325 -1.162 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.467 8.079 0.301 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.883 6.983 -1.840 1.00 0.00 C ATOM 0 H LEU A 136 2.730 11.689 -1.856 1.00 0.00 H new ATOM 0 HA LEU A 136 3.770 10.249 0.516 1.00 0.00 H new ATOM 0 HB2 LEU A 136 3.002 8.564 -1.047 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.747 9.402 -2.394 1.00 0.00 H new ATOM 0 HG LEU A 136 5.959 8.866 -1.606 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.371 7.474 0.365 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.632 9.033 0.801 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.644 7.553 0.785 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.769 6.357 -1.732 1.00 0.00 H new ATOM 0 HD22 LEU A 136 4.031 6.488 -1.375 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.677 7.142 -2.899 1.00 0.00 H new ATOM 1386 N LYS A 137 5.604 11.840 0.377 1.00 0.00 N ATOM 1387 CA LYS A 137 6.840 12.623 0.466 1.00 0.00 C ATOM 1388 C LYS A 137 8.021 11.697 0.795 1.00 0.00 C ATOM 1389 O LYS A 137 8.232 11.303 1.943 1.00 0.00 O ATOM 1390 CB LYS A 137 6.668 13.755 1.502 1.00 0.00 C ATOM 1391 CG LYS A 137 5.406 14.638 1.352 1.00 0.00 C ATOM 1392 CD LYS A 137 5.312 15.529 0.098 1.00 0.00 C ATOM 1393 CE LYS A 137 4.948 14.762 -1.180 1.00 0.00 C ATOM 1394 NZ LYS A 137 4.486 15.670 -2.262 1.00 0.00 N ATOM 0 H LYS A 137 5.168 11.703 1.289 1.00 0.00 H new ATOM 0 HA LYS A 137 7.056 13.093 -0.493 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.657 13.309 2.497 1.00 0.00 H new ATOM 0 HB3 LYS A 137 7.545 14.401 1.452 1.00 0.00 H new ATOM 0 HG2 LYS A 137 4.533 13.985 1.368 1.00 0.00 H new ATOM 0 HG3 LYS A 137 5.338 15.282 2.229 1.00 0.00 H new ATOM 0 HD2 LYS A 137 4.566 16.305 0.270 1.00 0.00 H new ATOM 0 HD3 LYS A 137 6.267 16.033 -0.051 1.00 0.00 H new ATOM 0 HE2 LYS A 137 5.816 14.199 -1.525 1.00 0.00 H new ATOM 0 HE3 LYS A 137 4.166 14.036 -0.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 4.461 15.152 -3.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 3.533 16.020 -2.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 5.140 16.474 -2.343 1.00 0.00 H new ATOM 1408 N THR A 138 8.781 11.326 -0.232 1.00 0.00 N ATOM 1409 CA THR A 138 10.029 10.535 -0.146 1.00 0.00 C ATOM 1410 C THR A 138 11.272 11.374 0.199 1.00 0.00 C ATOM 1411 O THR A 138 12.375 10.842 0.322 1.00 0.00 O ATOM 1412 CB THR A 138 10.265 9.758 -1.454 1.00 0.00 C ATOM 1413 OG1 THR A 138 10.165 10.625 -2.572 1.00 0.00 O ATOM 1414 CG2 THR A 138 9.237 8.637 -1.615 1.00 0.00 C ATOM 0 H THR A 138 8.543 11.573 -1.193 1.00 0.00 H new ATOM 0 HA THR A 138 9.886 9.839 0.681 1.00 0.00 H new ATOM 0 HB THR A 138 11.266 9.330 -1.405 1.00 0.00 H new ATOM 0 HG1 THR A 138 10.473 10.158 -3.377 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.424 8.103 -2.546 1.00 0.00 H new ATOM 0 HG22 THR A 138 9.319 7.945 -0.777 1.00 0.00 H new ATOM 0 HG23 THR A 138 8.234 9.063 -1.637 1.00 0.00 H new ATOM 1422 N ASP A 139 11.105 12.686 0.419 1.00 0.00 N ATOM 1423 CA ASP A 139 12.143 13.672 0.772 1.00 0.00 C ATOM 1424 C ASP A 139 12.848 13.430 2.134 1.00 0.00 C ATOM 1425 O ASP A 139 13.803 14.128 2.474 1.00 0.00 O ATOM 1426 CB ASP A 139 11.489 15.064 0.730 1.00 0.00 C ATOM 1427 CG ASP A 139 12.509 16.221 0.736 1.00 0.00 C ATOM 1428 OD1 ASP A 139 13.347 16.292 -0.197 1.00 0.00 O ATOM 1429 OD2 ASP A 139 12.439 17.093 1.636 1.00 0.00 O ATOM 0 H ASP A 139 10.183 13.117 0.351 1.00 0.00 H new ATOM 0 HA ASP A 139 12.948 13.576 0.044 1.00 0.00 H new ATOM 0 HB2 ASP A 139 10.870 15.140 -0.164 1.00 0.00 H new ATOM 0 HB3 ASP A 139 10.824 15.171 1.587 1.00 0.00 H new ATOM 1434 N SER A 140 12.410 12.424 2.901 1.00 0.00 N ATOM 1435 CA SER A 140 13.015 11.937 4.157 1.00 0.00 C ATOM 1436 C SER A 140 13.051 12.961 5.303 1.00 0.00 C ATOM 1437 O SER A 140 13.929 12.937 6.168 1.00 0.00 O ATOM 1438 CB SER A 140 14.380 11.279 3.895 1.00 0.00 C ATOM 1439 OG SER A 140 14.261 10.210 2.967 1.00 0.00 O ATOM 0 H SER A 140 11.575 11.894 2.651 1.00 0.00 H new ATOM 0 HA SER A 140 12.337 11.169 4.529 1.00 0.00 H new ATOM 0 HB2 SER A 140 15.078 12.023 3.511 1.00 0.00 H new ATOM 0 HB3 SER A 140 14.794 10.907 4.832 1.00 0.00 H new ATOM 0 HG SER A 140 15.142 9.809 2.815 1.00 0.00 H new ATOM 1445 N SER A 141 12.045 13.837 5.334 1.00 0.00 N ATOM 1446 CA SER A 141 11.632 14.669 6.479 1.00 0.00 C ATOM 1447 C SER A 141 10.109 14.908 6.443 1.00 0.00 C ATOM 1448 O SER A 141 9.538 14.961 5.348 1.00 0.00 O ATOM 1449 CB SER A 141 12.359 16.023 6.455 1.00 0.00 C ATOM 1450 OG SER A 141 13.735 15.879 6.766 1.00 0.00 O ATOM 0 H SER A 141 11.459 13.998 4.515 1.00 0.00 H new ATOM 0 HA SER A 141 11.895 14.140 7.395 1.00 0.00 H new ATOM 0 HB2 SER A 141 12.253 16.477 5.470 1.00 0.00 H new ATOM 0 HB3 SER A 141 11.892 16.701 7.170 1.00 0.00 H new ATOM 0 HG SER A 141 13.975 14.929 6.754 1.00 0.00 H new ATOM 1456 N PRO A 142 9.429 15.068 7.597 1.00 0.00 N ATOM 1457 CA PRO A 142 7.972 15.256 7.653 1.00 0.00 C ATOM 1458 C PRO A 142 7.515 16.661 7.212 1.00 0.00 C ATOM 1459 O PRO A 142 6.375 16.848 6.785 1.00 0.00 O ATOM 1460 CB PRO A 142 7.601 14.984 9.116 1.00 0.00 C ATOM 1461 CG PRO A 142 8.855 15.401 9.888 1.00 0.00 C ATOM 1462 CD PRO A 142 9.984 14.992 8.944 1.00 0.00 C ATOM 0 HA PRO A 142 7.471 14.585 6.956 1.00 0.00 H new ATOM 0 HB2 PRO A 142 6.730 15.563 9.423 1.00 0.00 H new ATOM 0 HB3 PRO A 142 7.360 13.934 9.280 1.00 0.00 H new ATOM 0 HG2 PRO A 142 8.867 16.472 10.093 1.00 0.00 H new ATOM 0 HG3 PRO A 142 8.927 14.892 10.849 1.00 0.00 H new ATOM 0 HD2 PRO A 142 10.842 15.656 9.051 1.00 0.00 H new ATOM 0 HD3 PRO A 142 10.332 13.983 9.166 1.00 0.00 H new ATOM 1470 N ASN A 143 8.412 17.645 7.289 1.00 0.00 N ATOM 1471 CA ASN A 143 8.284 19.018 6.791 1.00 0.00 C ATOM 1472 C ASN A 143 9.669 19.502 6.296 1.00 0.00 C ATOM 1473 O ASN A 143 10.679 18.846 6.569 1.00 0.00 O ATOM 1474 CB ASN A 143 7.718 19.876 7.942 1.00 0.00 C ATOM 1475 CG ASN A 143 7.419 21.310 7.539 1.00 0.00 C ATOM 1476 OD1 ASN A 143 8.087 22.251 7.940 1.00 0.00 O ATOM 1477 ND2 ASN A 143 6.422 21.521 6.711 1.00 0.00 N ATOM 0 H ASN A 143 9.317 17.493 7.735 1.00 0.00 H new ATOM 0 HA ASN A 143 7.603 19.093 5.943 1.00 0.00 H new ATOM 0 HB2 ASN A 143 6.804 19.413 8.314 1.00 0.00 H new ATOM 0 HB3 ASN A 143 8.431 19.880 8.766 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.206 22.469 6.404 1.00 0.00 H new ATOM 0 HD22 ASN A 143 5.863 20.737 6.375 1.00 0.00 H new ATOM 1484 N GLN A 144 9.749 20.626 5.574 1.00 0.00 N ATOM 1485 CA GLN A 144 11.018 21.178 5.079 1.00 0.00 C ATOM 1486 C GLN A 144 11.898 21.722 6.222 1.00 0.00 C ATOM 1487 O GLN A 144 11.774 22.875 6.642 1.00 0.00 O ATOM 1488 CB GLN A 144 10.759 22.226 3.983 1.00 0.00 C ATOM 1489 CG GLN A 144 12.059 22.670 3.276 1.00 0.00 C ATOM 1490 CD GLN A 144 12.459 24.112 3.599 1.00 0.00 C ATOM 1491 OE1 GLN A 144 11.832 25.073 3.170 1.00 0.00 O ATOM 1492 NE2 GLN A 144 13.531 24.333 4.335 1.00 0.00 N ATOM 0 H GLN A 144 8.933 21.181 5.315 1.00 0.00 H new ATOM 0 HA GLN A 144 11.587 20.365 4.628 1.00 0.00 H new ATOM 0 HB2 GLN A 144 10.070 21.814 3.246 1.00 0.00 H new ATOM 0 HB3 GLN A 144 10.272 23.096 4.423 1.00 0.00 H new ATOM 0 HG2 GLN A 144 12.869 22.001 3.566 1.00 0.00 H new ATOM 0 HG3 GLN A 144 11.932 22.568 2.198 1.00 0.00 H new ATOM 0 HE21 GLN A 144 14.068 23.548 4.703 1.00 0.00 H new ATOM 0 HE22 GLN A 144 13.823 25.289 4.537 1.00 0.00 H new ATOM 1501 N ALA A 145 12.796 20.874 6.722 1.00 0.00 N ATOM 1502 CA ALA A 145 13.843 21.205 7.686 1.00 0.00 C ATOM 1503 C ALA A 145 14.936 22.124 7.091 1.00 0.00 C ATOM 1504 O ALA A 145 14.986 22.366 5.878 1.00 0.00 O ATOM 1505 CB ALA A 145 14.437 19.877 8.178 1.00 0.00 C ATOM 0 H ALA A 145 12.813 19.890 6.452 1.00 0.00 H new ATOM 0 HA ALA A 145 13.413 21.772 8.512 1.00 0.00 H new ATOM 0 HB1 ALA A 145 15.226 20.078 8.903 1.00 0.00 H new ATOM 0 HB2 ALA A 145 13.655 19.281 8.649 1.00 0.00 H new ATOM 0 HB3 ALA A 145 14.852 19.329 7.332 1.00 0.00 H new ATOM 1511 N ARG A 146 15.844 22.609 7.947 1.00 0.00 N ATOM 1512 CA ARG A 146 17.066 23.336 7.570 1.00 0.00 C ATOM 1513 C ARG A 146 18.070 22.398 6.877 1.00 0.00 C ATOM 1514 O ARG A 146 18.682 21.551 7.534 1.00 0.00 O ATOM 1515 CB ARG A 146 17.660 24.001 8.827 1.00 0.00 C ATOM 1516 CG ARG A 146 18.890 24.891 8.566 1.00 0.00 C ATOM 1517 CD ARG A 146 18.613 26.119 7.685 1.00 0.00 C ATOM 1518 NE ARG A 146 17.644 27.043 8.304 1.00 0.00 N ATOM 1519 CZ ARG A 146 17.089 28.108 7.755 1.00 0.00 C ATOM 1520 NH1 ARG A 146 17.359 28.478 6.535 1.00 0.00 N ATOM 1521 NH2 ARG A 146 16.245 28.836 8.432 1.00 0.00 N ATOM 1522 OXT ARG A 146 18.256 22.500 5.666 1.00 0.00 O ATOM 0 H ARG A 146 15.746 22.503 8.957 1.00 0.00 H new ATOM 0 HA ARG A 146 16.825 24.117 6.848 1.00 0.00 H new ATOM 0 HB2 ARG A 146 16.886 24.604 9.302 1.00 0.00 H new ATOM 0 HB3 ARG A 146 17.937 23.222 9.537 1.00 0.00 H new ATOM 0 HG2 ARG A 146 19.288 25.229 9.523 1.00 0.00 H new ATOM 0 HG3 ARG A 146 19.665 24.288 8.093 1.00 0.00 H new ATOM 0 HD2 ARG A 146 19.548 26.648 7.498 1.00 0.00 H new ATOM 0 HD3 ARG A 146 18.233 25.791 6.717 1.00 0.00 H new ATOM 0 HE ARG A 146 17.372 26.836 9.265 1.00 0.00 H new ATOM 0 HH11 ARG A 146 18.018 27.939 5.973 1.00 0.00 H new ATOM 0 HH12 ARG A 146 16.912 29.306 6.143 1.00 0.00 H new ATOM 0 HH21 ARG A 146 16.010 28.584 9.392 1.00 0.00 H new ATOM 0 HH22 ARG A 146 15.820 29.657 8.002 1.00 0.00 H new TER 1536 ARG A 146 ATOM 1537 O5' C B 147 -2.817 -12.260 6.483 1.00 0.00 O ATOM 1538 C5' C B 147 -2.528 -11.036 5.820 1.00 0.00 C ATOM 1539 C4' C B 147 -1.660 -10.122 6.689 1.00 0.00 C ATOM 1540 O4' C B 147 -0.356 -10.680 6.842 1.00 0.00 O ATOM 1541 C3' C B 147 -1.497 -8.726 6.062 1.00 0.00 C ATOM 1542 O3' C B 147 -1.663 -7.739 7.068 1.00 0.00 O ATOM 1543 C2' C B 147 -0.047 -8.731 5.576 1.00 0.00 C ATOM 1544 O2' C B 147 0.532 -7.435 5.567 1.00 0.00 O ATOM 1545 C1' C B 147 0.612 -9.678 6.578 1.00 0.00 C ATOM 1546 N1 C B 147 1.863 -10.291 6.048 1.00 0.00 N ATOM 1547 C2 C B 147 3.057 -10.157 6.768 1.00 0.00 C ATOM 1548 O2 C B 147 3.090 -9.630 7.880 1.00 0.00 O ATOM 1549 N3 C B 147 4.224 -10.636 6.262 1.00 0.00 N ATOM 1550 C4 C B 147 4.202 -11.235 5.089 1.00 0.00 C ATOM 1551 N4 C B 147 5.353 -11.664 4.652 1.00 0.00 N ATOM 1552 C5 C B 147 3.018 -11.446 4.334 1.00 0.00 C ATOM 1553 C6 C B 147 1.863 -10.955 4.847 1.00 0.00 C ATOM 0 H5' C B 147 -3.459 -10.527 5.571 1.00 0.00 H new ATOM 0 H5'' C B 147 -2.015 -11.242 4.880 1.00 0.00 H new ATOM 0 H4' C B 147 -2.163 -10.032 7.652 1.00 0.00 H new ATOM 0 H3' C B 147 -2.216 -8.513 5.271 1.00 0.00 H new ATOM 0 H2' C B 147 0.070 -9.049 4.540 1.00 0.00 H new ATOM 0 HO2' C B 147 0.107 -6.882 6.255 1.00 0.00 H new ATOM 0 HO5' C B 147 -3.374 -12.822 5.904 1.00 0.00 H new ATOM 0 H1' C B 147 0.911 -9.136 7.475 1.00 0.00 H new ATOM 0 H41 C B 147 5.412 -12.138 3.751 1.00 0.00 H new ATOM 0 H42 C B 147 6.195 -11.526 5.212 1.00 0.00 H new ATOM 0 H5 C B 147 3.037 -11.974 3.392 1.00 0.00 H new ATOM 0 H6 C B 147 0.937 -11.087 4.307 1.00 0.00 H new ATOM 1566 P U B 148 -3.120 -7.208 7.465 1.00 0.00 P ATOM 1567 OP1 U B 148 -3.544 -7.888 8.710 1.00 0.00 O ATOM 1568 OP2 U B 148 -3.983 -7.277 6.266 1.00 0.00 O ATOM 1569 O5' U B 148 -2.868 -5.655 7.798 1.00 0.00 O ATOM 1570 C5' U B 148 -1.872 -4.935 7.088 1.00 0.00 C ATOM 1571 C4' U B 148 -2.089 -3.419 7.008 1.00 0.00 C ATOM 1572 O4' U B 148 -3.095 -3.105 6.056 1.00 0.00 O ATOM 1573 C3' U B 148 -2.455 -2.775 8.353 1.00 0.00 C ATOM 1574 O3' U B 148 -1.878 -1.476 8.454 1.00 0.00 O ATOM 1575 C2' U B 148 -3.978 -2.700 8.235 1.00 0.00 C ATOM 1576 O2' U B 148 -4.552 -1.657 9.019 1.00 0.00 O ATOM 1577 C1' U B 148 -4.181 -2.497 6.729 1.00 0.00 C ATOM 1578 N1 U B 148 -5.464 -3.044 6.216 1.00 0.00 N ATOM 1579 C2 U B 148 -6.279 -2.203 5.444 1.00 0.00 C ATOM 1580 O2 U B 148 -5.907 -1.110 5.002 1.00 0.00 O ATOM 1581 N3 U B 148 -7.551 -2.657 5.165 1.00 0.00 N ATOM 1582 C4 U B 148 -8.076 -3.865 5.562 1.00 0.00 C ATOM 1583 O4 U B 148 -9.234 -4.156 5.277 1.00 0.00 O ATOM 1584 C5 U B 148 -7.144 -4.721 6.264 1.00 0.00 C ATOM 1585 C6 U B 148 -5.878 -4.315 6.547 1.00 0.00 C ATOM 0 H5' U B 148 -1.815 -5.331 6.074 1.00 0.00 H new ATOM 0 H5'' U B 148 -0.907 -5.123 7.559 1.00 0.00 H new ATOM 0 H4' U B 148 -1.129 -3.004 6.701 1.00 0.00 H new ATOM 0 H3' U B 148 -2.104 -3.315 9.232 1.00 0.00 H new ATOM 0 H2' U B 148 -4.480 -3.587 8.622 1.00 0.00 H new ATOM 0 HO2' U B 148 -3.872 -0.977 9.208 1.00 0.00 H new ATOM 0 H1' U B 148 -4.223 -1.424 6.543 1.00 0.00 H new ATOM 0 H3 U B 148 -8.155 -2.044 4.617 1.00 0.00 H new ATOM 0 H5 U B 148 -7.462 -5.707 6.571 1.00 0.00 H new ATOM 0 H6 U B 148 -5.193 -4.993 7.034 1.00 0.00 H new ATOM 1596 P C B 149 -0.378 -1.299 8.984 1.00 0.00 P ATOM 1597 OP1 C B 149 0.496 -2.241 8.243 1.00 0.00 O ATOM 1598 OP2 C B 149 -0.385 -1.348 10.463 1.00 0.00 O ATOM 1599 O5' C B 149 0.010 0.188 8.534 1.00 0.00 O ATOM 1600 C5' C B 149 1.360 0.534 8.267 1.00 0.00 C ATOM 1601 C4' C B 149 1.531 1.930 7.658 1.00 0.00 C ATOM 1602 O4' C B 149 1.054 1.963 6.318 1.00 0.00 O ATOM 1603 C3' C B 149 0.851 3.063 8.450 1.00 0.00 C ATOM 1604 O3' C B 149 1.618 4.259 8.454 1.00 0.00 O ATOM 1605 C2' C B 149 -0.415 3.297 7.635 1.00 0.00 C ATOM 1606 O2' C B 149 -1.016 4.576 7.772 1.00 0.00 O ATOM 1607 C1' C B 149 0.029 2.944 6.217 1.00 0.00 C ATOM 1608 N1 C B 149 -1.163 2.419 5.511 1.00 0.00 N ATOM 1609 C2 C B 149 -1.901 3.255 4.675 1.00 0.00 C ATOM 1610 O2 C B 149 -1.529 4.389 4.390 1.00 0.00 O ATOM 1611 N3 C B 149 -3.074 2.839 4.147 1.00 0.00 N ATOM 1612 C4 C B 149 -3.478 1.611 4.376 1.00 0.00 C ATOM 1613 N4 C B 149 -4.613 1.265 3.834 1.00 0.00 N ATOM 1614 C5 C B 149 -2.741 0.704 5.179 1.00 0.00 C ATOM 1615 C6 C B 149 -1.607 1.152 5.765 1.00 0.00 C ATOM 0 H5' C B 149 1.787 -0.204 7.587 1.00 0.00 H new ATOM 0 H5'' C B 149 1.930 0.480 9.195 1.00 0.00 H new ATOM 0 H4' C B 149 2.605 2.114 7.695 1.00 0.00 H new ATOM 0 H3' C B 149 0.700 2.803 9.498 1.00 0.00 H new ATOM 0 H2' C B 149 -1.244 2.684 7.988 1.00 0.00 H new ATOM 0 HO2' C B 149 -0.515 5.231 7.243 1.00 0.00 H new ATOM 0 H1' C B 149 0.423 3.799 5.667 1.00 0.00 H new ATOM 0 H41 C B 149 -4.980 0.324 3.976 1.00 0.00 H new ATOM 0 H42 C B 149 -5.134 1.936 3.269 1.00 0.00 H new ATOM 0 H5 C B 149 -3.075 -0.314 5.319 1.00 0.00 H new ATOM 0 H6 C B 149 -1.053 0.509 6.433 1.00 0.00 H new ATOM 1627 P U B 150 2.918 4.425 9.365 1.00 0.00 P ATOM 1628 OP1 U B 150 3.238 3.126 10.008 1.00 0.00 O ATOM 1629 OP2 U B 150 2.726 5.623 10.218 1.00 0.00 O ATOM 1630 O5' U B 150 4.050 4.763 8.278 1.00 0.00 O ATOM 1631 C5' U B 150 4.603 3.760 7.436 1.00 0.00 C ATOM 1632 C4' U B 150 5.865 4.231 6.701 1.00 0.00 C ATOM 1633 O4' U B 150 5.564 4.963 5.538 1.00 0.00 O ATOM 1634 C3' U B 150 6.758 5.147 7.531 1.00 0.00 C ATOM 1635 O3' U B 150 7.561 4.406 8.446 1.00 0.00 O ATOM 1636 C2' U B 150 7.532 5.930 6.460 1.00 0.00 C ATOM 1637 O2' U B 150 8.829 5.393 6.195 1.00 0.00 O ATOM 1638 C1' U B 150 6.682 5.786 5.199 1.00 0.00 C ATOM 1639 N1 U B 150 6.244 7.118 4.668 1.00 0.00 N ATOM 1640 C2 U B 150 7.167 7.946 4.011 1.00 0.00 C ATOM 1641 O2 U B 150 8.365 7.684 3.898 1.00 0.00 O ATOM 1642 N3 U B 150 6.682 9.116 3.454 1.00 0.00 N ATOM 1643 C4 U B 150 5.360 9.490 3.403 1.00 0.00 C ATOM 1644 O4 U B 150 5.031 10.534 2.848 1.00 0.00 O ATOM 1645 C5 U B 150 4.454 8.564 4.040 1.00 0.00 C ATOM 1646 C6 U B 150 4.911 7.459 4.685 1.00 0.00 C ATOM 0 H5' U B 150 3.855 3.453 6.705 1.00 0.00 H new ATOM 0 H5'' U B 150 4.843 2.881 8.035 1.00 0.00 H new ATOM 0 H4' U B 150 6.382 3.298 6.476 1.00 0.00 H new ATOM 0 H3' U B 150 6.223 5.825 8.196 1.00 0.00 H new ATOM 0 H2' U B 150 7.692 6.957 6.789 1.00 0.00 H new ATOM 0 HO2' U B 150 9.350 5.372 7.025 1.00 0.00 H new ATOM 0 H1' U B 150 7.266 5.328 4.401 1.00 0.00 H new ATOM 0 H3 U B 150 7.364 9.756 3.046 1.00 0.00 H new ATOM 0 H5 U B 150 3.391 8.753 4.003 1.00 0.00 H new ATOM 0 H6 U B 150 4.213 6.835 5.223 1.00 0.00 H new ATOM 1657 P C B 151 8.501 5.135 9.516 1.00 0.00 P ATOM 1658 OP1 C B 151 7.847 6.401 9.936 1.00 0.00 O ATOM 1659 OP2 C B 151 9.865 5.191 8.940 1.00 0.00 O ATOM 1660 O5' C B 151 8.505 4.098 10.753 1.00 0.00 O ATOM 1661 C5' C B 151 8.300 4.544 12.084 1.00 0.00 C ATOM 1662 C4' C B 151 8.381 3.419 13.129 1.00 0.00 C ATOM 1663 O4' C B 151 7.216 2.594 13.106 1.00 0.00 O ATOM 1664 C3' C B 151 9.603 2.495 12.959 1.00 0.00 C ATOM 1665 O3' C B 151 10.256 2.279 14.205 1.00 0.00 O ATOM 1666 C2' C B 151 8.922 1.191 12.522 1.00 0.00 C ATOM 1667 O2' C B 151 9.719 0.034 12.771 1.00 0.00 O ATOM 1668 C1' C B 151 7.643 1.266 13.366 1.00 0.00 C ATOM 1669 N1 C B 151 6.569 0.255 13.101 1.00 0.00 N ATOM 1670 C2 C B 151 5.450 0.249 13.953 1.00 0.00 C ATOM 1671 O2 C B 151 5.267 1.121 14.808 1.00 0.00 O ATOM 1672 N3 C B 151 4.533 -0.752 13.894 1.00 0.00 N ATOM 1673 C4 C B 151 4.727 -1.731 13.040 1.00 0.00 C ATOM 1674 N4 C B 151 3.856 -2.700 13.084 1.00 0.00 N ATOM 1675 C5 C B 151 5.827 -1.792 12.147 1.00 0.00 C ATOM 1676 C6 C B 151 6.734 -0.782 12.209 1.00 0.00 C ATOM 0 H5' C B 151 7.323 5.022 12.152 1.00 0.00 H new ATOM 0 H5'' C B 151 9.044 5.304 12.322 1.00 0.00 H new ATOM 0 H4' C B 151 8.471 3.945 14.080 1.00 0.00 H new ATOM 0 H3' C B 151 10.359 2.886 12.278 1.00 0.00 H new ATOM 0 H2' C B 151 8.743 1.098 11.451 1.00 0.00 H new ATOM 0 HO2' C B 151 9.152 -0.765 12.746 1.00 0.00 H new ATOM 0 H1' C B 151 7.853 1.023 14.408 1.00 0.00 H new ATOM 0 H41 C B 151 3.944 -3.494 12.450 1.00 0.00 H new ATOM 0 H42 C B 151 3.087 -2.664 13.753 1.00 0.00 H new ATOM 0 H5 C B 151 5.939 -2.607 11.447 1.00 0.00 H new ATOM 0 H6 C B 151 7.592 -0.792 11.553 1.00 0.00 H new ATOM 1688 P U B 152 11.377 3.287 14.736 1.00 0.00 P ATOM 1689 OP1 U B 152 11.789 2.834 16.086 1.00 0.00 O ATOM 1690 OP2 U B 152 10.890 4.674 14.562 1.00 0.00 O ATOM 1691 O5' U B 152 12.596 3.052 13.713 1.00 0.00 O ATOM 1692 C5' U B 152 13.240 1.792 13.609 1.00 0.00 C ATOM 1693 C4' U B 152 14.431 1.880 12.640 1.00 0.00 C ATOM 1694 O4' U B 152 15.534 2.532 13.273 1.00 0.00 O ATOM 1695 C3' U B 152 14.921 0.487 12.210 1.00 0.00 C ATOM 1696 O3' U B 152 15.446 0.532 10.879 1.00 0.00 O ATOM 1697 C2' U B 152 16.035 0.230 13.228 1.00 0.00 C ATOM 1698 O2' U B 152 16.969 -0.766 12.806 1.00 0.00 O ATOM 1699 C1' U B 152 16.639 1.636 13.331 1.00 0.00 C ATOM 1700 N1 U B 152 17.486 1.806 14.549 1.00 0.00 N ATOM 1701 C2 U B 152 16.913 1.789 15.834 1.00 0.00 C ATOM 1702 O2 U B 152 15.715 1.617 16.066 1.00 0.00 O ATOM 1703 N3 U B 152 17.765 1.965 16.905 1.00 0.00 N ATOM 1704 C4 U B 152 19.129 2.120 16.835 1.00 0.00 C ATOM 1705 O4 U B 152 19.788 2.267 17.860 1.00 0.00 O ATOM 1706 C5 U B 152 19.659 2.086 15.487 1.00 0.00 C ATOM 1707 C6 U B 152 18.850 1.932 14.404 1.00 0.00 C ATOM 0 H5' U B 152 12.532 1.042 13.258 1.00 0.00 H new ATOM 0 H5'' U B 152 13.585 1.470 14.592 1.00 0.00 H new ATOM 0 H4' U B 152 14.084 2.436 11.769 1.00 0.00 H new ATOM 0 H3' U B 152 14.147 -0.280 12.195 1.00 0.00 H new ATOM 0 H2' U B 152 15.695 -0.182 14.178 1.00 0.00 H new ATOM 0 HO2' U B 152 17.655 -0.884 13.495 1.00 0.00 H new ATOM 0 HO3' U B 152 16.312 0.073 10.853 1.00 0.00 H new ATOM 0 H1' U B 152 17.334 1.836 12.515 1.00 0.00 H new ATOM 0 H3 U B 152 17.344 1.982 17.834 1.00 0.00 H new ATOM 0 H5 U B 152 20.724 2.185 15.338 1.00 0.00 H new ATOM 0 H6 U B 152 19.284 1.908 13.415 1.00 0.00 H new TER 1719 U B 152