USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 770 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 96 ASN : amide:sc= 0.73 K(o=1.3,f=-14!) USER MOD Set 1.2: A 101 ASN : amide:sc= 0.585 K(o=1.3,f=-3.6!) USER MOD Set 2.1: A 80 LYS NZ :NH3+ -166:sc= 0.276 (180deg=-0.363) USER MOD Set 2.2: A 106 THR OG1 : rot -153:sc= 1.18 USER MOD Set 3.1: A 59 SER OG : rot -108:sc= 0.906 USER MOD Set 3.2: A 71 THR OG1 : rot -82:sc= 1.05 USER MOD Set 4.1: A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 67 TYR OH : rot 130:sc= 0 USER MOD Set 5.1: A 26 TYR OH : rot 30:sc= 0.029 USER MOD Set 5.2: A 65 SER OG : rot -156:sc= 0.0294 USER MOD Set 6.1: A 13 SER OG : rot -101:sc= 2.23 USER MOD Set 6.2: A 24 LYS NZ :NH3+ -152:sc= 1.07 (180deg=0) USER MOD Set 7.1: A 2 SER OG : rot 92:sc= 0.898 USER MOD Set 7.2: A 6 SER OG : rot -160:sc= 0.771 USER MOD Single : A 1 ALA N :NH3+ -112:sc= 0.0651 (180deg=0) USER MOD Single : A 5 SER OG : rot -34:sc= 0.96 USER MOD Single : A 8 SER OG : rot 171:sc= 0.641 USER MOD Single : A 10 GLN : amide:sc= -1.8 K(o=-1.8,f=-2.5!) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.0513 K(o=-0.051,f=-1.1) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 87:sc= 0.00496 USER MOD Single : A 22 SER OG : rot 180:sc= -0.232 USER MOD Single : A 29 ASN : amide:sc= 0.614 K(o=0.61,f=-5.9!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0.0419 USER MOD Single : A 34 LYS NZ :NH3+ -155:sc= -1.2! (180deg=-2.6!) USER MOD Single : A 35 LYS NZ :NH3+ -177:sc= 1.28 (180deg=1.19) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0964 USER MOD Single : A 40 TYR OH : rot -15:sc= -0.449 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 ASN : amide:sc= 0.297 K(o=0.3,f=-0.49) USER MOD Single : A 49 ASN : amide:sc= -0.296 X(o=-0.3,f=-0.16) USER MOD Single : A 50 ASN : amide:sc= 0.509 K(o=0.51,f=-7.6!) USER MOD Single : A 52 ASN : amide:sc= 0.429 X(o=0.43,f=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= 0.26 K(o=0.26,f=-4.3!) USER MOD Single : A 69 TYR OH : rot 180:sc= -0.421 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 153:sc= 1.24 (180deg=1.17) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -163:sc= 1.29 (180deg=1.14) USER MOD Single : A 86 TYR OH : rot 88:sc= 1.27 USER MOD Single : A 89 SER OG : rot -51:sc= 0.179 USER MOD Single : A 91 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0552) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0488 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= 0.999 K(o=1,f=-0.26) USER MOD Single : A 98 ASN : amide:sc= -0.0107 K(o=-0.011,f=-0.89) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -1.26 K(o=-1.3,f=-0.034) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -11.479 7.871 10.631 1.00 0.00 N ATOM 2 CA ALA A 1 -10.056 7.518 10.824 1.00 0.00 C ATOM 3 C ALA A 1 -9.173 8.730 10.589 1.00 0.00 C ATOM 4 O ALA A 1 -9.555 9.662 9.880 1.00 0.00 O ATOM 5 CB ALA A 1 -9.652 6.389 9.894 1.00 0.00 C ATOM 0 H1 ALA A 1 -11.975 7.827 11.544 1.00 0.00 H new ATOM 0 H2 ALA A 1 -11.548 8.835 10.246 1.00 0.00 H new ATOM 0 H3 ALA A 1 -11.916 7.200 9.967 1.00 0.00 H new ATOM 0 HA ALA A 1 -9.925 7.182 11.853 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -8.602 6.145 10.053 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -10.264 5.511 10.101 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -9.800 6.699 8.860 1.00 0.00 H new ATOM 13 N SER A 2 -7.995 8.709 11.184 1.00 0.00 N ATOM 14 CA SER A 2 -7.061 9.813 11.080 1.00 0.00 C ATOM 15 C SER A 2 -5.956 9.490 10.083 1.00 0.00 C ATOM 16 O SER A 2 -5.363 8.414 10.128 1.00 0.00 O ATOM 17 CB SER A 2 -6.462 10.106 12.457 1.00 0.00 C ATOM 18 OG SER A 2 -5.895 8.937 13.026 1.00 0.00 O ATOM 0 H SER A 2 -7.660 7.930 11.750 1.00 0.00 H new ATOM 0 HA SER A 2 -7.594 10.694 10.723 1.00 0.00 H new ATOM 0 HB2 SER A 2 -5.698 10.878 12.368 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.235 10.498 13.118 1.00 0.00 H new ATOM 0 HG SER A 2 -4.945 8.887 12.791 1.00 0.00 H new ATOM 24 N ILE A 3 -5.708 10.411 9.162 1.00 0.00 N ATOM 25 CA ILE A 3 -4.607 10.269 8.223 1.00 0.00 C ATOM 26 C ILE A 3 -3.341 10.897 8.819 1.00 0.00 C ATOM 27 O ILE A 3 -2.330 10.213 8.990 1.00 0.00 O ATOM 28 CB ILE A 3 -4.914 10.898 6.837 1.00 0.00 C ATOM 29 CG1 ILE A 3 -6.192 10.310 6.221 1.00 0.00 C ATOM 30 CG2 ILE A 3 -3.740 10.690 5.893 1.00 0.00 C ATOM 31 CD1 ILE A 3 -7.479 10.848 6.809 1.00 0.00 C ATOM 0 H ILE A 3 -6.255 11.264 9.046 1.00 0.00 H new ATOM 0 HA ILE A 3 -4.456 9.202 8.057 1.00 0.00 H new ATOM 0 HB ILE A 3 -5.073 11.966 6.986 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -6.187 10.507 5.149 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -6.175 9.227 6.346 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.968 11.136 4.925 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -2.850 11.162 6.309 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.559 9.623 5.767 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -8.329 10.378 6.315 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -7.512 10.627 7.876 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -7.524 11.927 6.660 1.00 0.00 H new ATOM 43 N PRO A 4 -3.368 12.209 9.154 1.00 0.00 N ATOM 44 CA PRO A 4 -2.272 12.846 9.881 1.00 0.00 C ATOM 45 C PRO A 4 -2.210 12.351 11.323 1.00 0.00 C ATOM 46 O PRO A 4 -3.218 11.890 11.868 1.00 0.00 O ATOM 47 CB PRO A 4 -2.611 14.344 9.843 1.00 0.00 C ATOM 48 CG PRO A 4 -3.697 14.480 8.830 1.00 0.00 C ATOM 49 CD PRO A 4 -4.434 13.175 8.846 1.00 0.00 C ATOM 0 HA PRO A 4 -1.301 12.622 9.440 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -2.939 14.697 10.821 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -1.739 14.937 9.566 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -4.362 15.308 9.078 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -3.286 14.685 7.841 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -5.222 13.163 9.599 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -4.907 12.965 7.887 1.00 0.00 H new ATOM 57 N SER A 5 -1.022 12.435 11.919 1.00 0.00 N ATOM 58 CA SER A 5 -0.777 11.971 13.281 1.00 0.00 C ATOM 59 C SER A 5 -0.870 10.446 13.384 1.00 0.00 C ATOM 60 O SER A 5 -0.826 9.880 14.478 1.00 0.00 O ATOM 61 CB SER A 5 -1.740 12.650 14.255 1.00 0.00 C ATOM 62 OG SER A 5 -1.516 12.229 15.591 1.00 0.00 O ATOM 0 H SER A 5 -0.198 12.830 11.466 1.00 0.00 H new ATOM 0 HA SER A 5 0.242 12.248 13.552 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.622 13.732 14.189 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.767 12.423 13.969 1.00 0.00 H new ATOM 0 HG SER A 5 -1.230 11.292 15.595 1.00 0.00 H new ATOM 68 N SER A 6 -0.997 9.783 12.246 1.00 0.00 N ATOM 69 CA SER A 6 -0.925 8.336 12.203 1.00 0.00 C ATOM 70 C SER A 6 0.315 7.915 11.426 1.00 0.00 C ATOM 71 O SER A 6 1.243 7.335 11.987 1.00 0.00 O ATOM 72 CB SER A 6 -2.195 7.752 11.581 1.00 0.00 C ATOM 73 OG SER A 6 -3.334 8.027 12.387 1.00 0.00 O ATOM 0 H SER A 6 -1.151 10.226 11.340 1.00 0.00 H new ATOM 0 HA SER A 6 -0.850 7.947 13.218 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.341 8.170 10.585 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.082 6.675 11.461 1.00 0.00 H new ATOM 0 HG SER A 6 -4.054 7.402 12.161 1.00 0.00 H new ATOM 79 N ALA A 7 0.342 8.239 10.141 1.00 0.00 N ATOM 80 CA ALA A 7 1.498 7.989 9.312 1.00 0.00 C ATOM 81 C ALA A 7 1.534 8.982 8.159 1.00 0.00 C ATOM 82 O ALA A 7 0.806 9.975 8.170 1.00 0.00 O ATOM 83 CB ALA A 7 1.455 6.570 8.782 1.00 0.00 C ATOM 0 H ALA A 7 -0.436 8.680 9.651 1.00 0.00 H new ATOM 0 HA ALA A 7 2.401 8.113 9.910 1.00 0.00 H new ATOM 0 HB1 ALA A 7 2.330 6.388 8.158 1.00 0.00 H new ATOM 0 HB2 ALA A 7 1.453 5.870 9.617 1.00 0.00 H new ATOM 0 HB3 ALA A 7 0.551 6.430 8.189 1.00 0.00 H new ATOM 89 N SER A 8 2.379 8.724 7.175 1.00 0.00 N ATOM 90 CA SER A 8 2.402 9.533 5.967 1.00 0.00 C ATOM 91 C SER A 8 1.341 9.021 5.002 1.00 0.00 C ATOM 92 O SER A 8 0.929 9.712 4.069 1.00 0.00 O ATOM 93 CB SER A 8 3.781 9.462 5.314 1.00 0.00 C ATOM 94 OG SER A 8 4.800 9.615 6.287 1.00 0.00 O ATOM 0 H SER A 8 3.057 7.962 7.188 1.00 0.00 H new ATOM 0 HA SER A 8 2.192 10.572 6.222 1.00 0.00 H new ATOM 0 HB2 SER A 8 3.899 8.507 4.803 1.00 0.00 H new ATOM 0 HB3 SER A 8 3.872 10.242 4.558 1.00 0.00 H new ATOM 0 HG SER A 8 5.671 9.419 5.882 1.00 0.00 H new ATOM 100 N VAL A 9 0.895 7.805 5.254 1.00 0.00 N ATOM 101 CA VAL A 9 -0.057 7.141 4.399 1.00 0.00 C ATOM 102 C VAL A 9 -0.938 6.203 5.217 1.00 0.00 C ATOM 103 O VAL A 9 -0.547 5.752 6.294 1.00 0.00 O ATOM 104 CB VAL A 9 0.678 6.369 3.278 1.00 0.00 C ATOM 105 CG1 VAL A 9 1.877 5.641 3.840 1.00 0.00 C ATOM 106 CG2 VAL A 9 -0.238 5.393 2.561 1.00 0.00 C ATOM 0 H VAL A 9 1.186 7.253 6.061 1.00 0.00 H new ATOM 0 HA VAL A 9 -0.697 7.891 3.934 1.00 0.00 H new ATOM 0 HB VAL A 9 1.012 7.103 2.545 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.384 5.102 3.039 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.564 6.361 4.285 1.00 0.00 H new ATOM 0 HG13 VAL A 9 1.549 4.934 4.602 1.00 0.00 H new ATOM 0 HG21 VAL A 9 0.321 4.874 1.783 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -0.626 4.666 3.275 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -1.068 5.937 2.110 1.00 0.00 H new ATOM 116 N GLN A 10 -2.136 5.966 4.715 1.00 0.00 N ATOM 117 CA GLN A 10 -3.076 5.054 5.331 1.00 0.00 C ATOM 118 C GLN A 10 -3.837 4.306 4.246 1.00 0.00 C ATOM 119 O GLN A 10 -4.386 4.916 3.325 1.00 0.00 O ATOM 120 CB GLN A 10 -4.055 5.815 6.231 1.00 0.00 C ATOM 121 CG GLN A 10 -5.149 4.937 6.817 1.00 0.00 C ATOM 122 CD GLN A 10 -6.113 5.695 7.709 1.00 0.00 C ATOM 123 OE1 GLN A 10 -6.688 5.130 8.638 1.00 0.00 O ATOM 124 NE2 GLN A 10 -6.303 6.975 7.432 1.00 0.00 N ATOM 0 H GLN A 10 -2.484 6.405 3.863 1.00 0.00 H new ATOM 0 HA GLN A 10 -2.528 4.342 5.948 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -3.500 6.282 7.045 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -4.514 6.619 5.656 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -5.706 4.472 6.004 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -4.691 4.132 7.391 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -5.807 7.407 6.653 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -6.945 7.529 7.998 1.00 0.00 H new ATOM 133 N LEU A 11 -3.855 2.990 4.339 1.00 0.00 N ATOM 134 CA LEU A 11 -4.571 2.176 3.375 1.00 0.00 C ATOM 135 C LEU A 11 -6.072 2.363 3.537 1.00 0.00 C ATOM 136 O LEU A 11 -6.588 2.418 4.657 1.00 0.00 O ATOM 137 CB LEU A 11 -4.208 0.709 3.558 1.00 0.00 C ATOM 138 CG LEU A 11 -4.826 -0.249 2.540 1.00 0.00 C ATOM 139 CD1 LEU A 11 -4.247 -0.008 1.157 1.00 0.00 C ATOM 140 CD2 LEU A 11 -4.592 -1.684 2.974 1.00 0.00 C ATOM 0 H LEU A 11 -3.382 2.462 5.072 1.00 0.00 H new ATOM 0 HA LEU A 11 -4.284 2.491 2.372 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -3.123 0.612 3.512 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.514 0.398 4.557 1.00 0.00 H new ATOM 0 HG LEU A 11 -5.899 -0.066 2.493 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -4.700 -0.700 0.447 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.456 1.016 0.849 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.169 -0.167 1.181 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -5.035 -2.362 2.244 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.521 -1.874 3.042 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.052 -1.849 3.948 1.00 0.00 H new ATOM 152 N ASP A 12 -6.764 2.470 2.413 1.00 0.00 N ATOM 153 CA ASP A 12 -8.205 2.663 2.416 1.00 0.00 C ATOM 154 C ASP A 12 -8.915 1.332 2.558 1.00 0.00 C ATOM 155 O ASP A 12 -9.631 1.095 3.531 1.00 0.00 O ATOM 156 CB ASP A 12 -8.660 3.332 1.122 1.00 0.00 C ATOM 157 CG ASP A 12 -10.136 3.681 1.143 1.00 0.00 C ATOM 158 OD1 ASP A 12 -10.972 2.778 0.936 1.00 0.00 O ATOM 159 OD2 ASP A 12 -10.469 4.861 1.375 1.00 0.00 O ATOM 0 H ASP A 12 -6.348 2.426 1.483 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.456 3.303 3.262 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -8.077 4.238 0.960 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -8.458 2.668 0.282 1.00 0.00 H new ATOM 164 N SER A 13 -8.695 0.468 1.579 1.00 0.00 N ATOM 165 CA SER A 13 -9.368 -0.832 1.522 1.00 0.00 C ATOM 166 C SER A 13 -8.921 -1.646 0.315 1.00 0.00 C ATOM 167 O SER A 13 -8.305 -1.120 -0.615 1.00 0.00 O ATOM 168 CB SER A 13 -10.889 -0.648 1.486 1.00 0.00 C ATOM 169 OG SER A 13 -11.272 0.225 0.436 1.00 0.00 O ATOM 0 H SER A 13 -8.052 0.640 0.806 1.00 0.00 H new ATOM 0 HA SER A 13 -9.090 -1.380 2.422 1.00 0.00 H new ATOM 0 HB2 SER A 13 -11.373 -1.616 1.353 1.00 0.00 H new ATOM 0 HB3 SER A 13 -11.233 -0.248 2.440 1.00 0.00 H new ATOM 0 HG SER A 13 -11.465 1.113 0.803 1.00 0.00 H new ATOM 175 N TYR A 14 -9.223 -2.935 0.369 1.00 0.00 N ATOM 176 CA TYR A 14 -8.903 -3.881 -0.685 1.00 0.00 C ATOM 177 C TYR A 14 -9.827 -5.085 -0.560 1.00 0.00 C ATOM 178 O TYR A 14 -10.432 -5.286 0.495 1.00 0.00 O ATOM 179 CB TYR A 14 -7.445 -4.315 -0.570 1.00 0.00 C ATOM 180 CG TYR A 14 -7.110 -4.899 0.777 1.00 0.00 C ATOM 181 CD1 TYR A 14 -7.308 -6.241 1.030 1.00 0.00 C ATOM 182 CD2 TYR A 14 -6.596 -4.110 1.790 1.00 0.00 C ATOM 183 CE1 TYR A 14 -7.007 -6.789 2.253 1.00 0.00 C ATOM 184 CE2 TYR A 14 -6.289 -4.643 3.022 1.00 0.00 C ATOM 185 CZ TYR A 14 -6.496 -5.988 3.252 1.00 0.00 C ATOM 186 OH TYR A 14 -6.193 -6.531 4.479 1.00 0.00 O ATOM 0 H TYR A 14 -9.706 -3.358 1.161 1.00 0.00 H new ATOM 0 HA TYR A 14 -9.045 -3.414 -1.659 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -7.229 -5.052 -1.343 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -6.800 -3.457 -0.758 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -7.708 -6.873 0.251 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -6.433 -3.057 1.612 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -7.170 -7.842 2.431 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -5.889 -4.013 3.803 1.00 0.00 H new ATOM 0 HH TYR A 14 -5.842 -5.831 5.069 1.00 0.00 H new ATOM 196 N ASN A 15 -9.927 -5.884 -1.609 1.00 0.00 N ATOM 197 CA ASN A 15 -10.815 -7.046 -1.596 1.00 0.00 C ATOM 198 C ASN A 15 -10.208 -8.213 -2.358 1.00 0.00 C ATOM 199 O ASN A 15 -9.238 -8.046 -3.103 1.00 0.00 O ATOM 200 CB ASN A 15 -12.178 -6.692 -2.201 1.00 0.00 C ATOM 201 CG ASN A 15 -13.084 -5.952 -1.233 1.00 0.00 C ATOM 202 OD1 ASN A 15 -13.066 -6.203 -0.026 1.00 0.00 O ATOM 203 ND2 ASN A 15 -13.882 -5.035 -1.753 1.00 0.00 N ATOM 0 H ASN A 15 -9.409 -5.755 -2.478 1.00 0.00 H new ATOM 0 HA ASN A 15 -10.950 -7.342 -0.556 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -12.027 -6.078 -3.089 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -12.673 -7.607 -2.526 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -14.512 -4.506 -1.150 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -13.867 -4.856 -2.757 1.00 0.00 H new ATOM 210 N TYR A 16 -10.800 -9.389 -2.170 1.00 0.00 N ATOM 211 CA TYR A 16 -10.327 -10.613 -2.799 1.00 0.00 C ATOM 212 C TYR A 16 -11.494 -11.315 -3.485 1.00 0.00 C ATOM 213 O TYR A 16 -12.603 -11.344 -2.955 1.00 0.00 O ATOM 214 CB TYR A 16 -9.718 -11.543 -1.750 1.00 0.00 C ATOM 215 CG TYR A 16 -8.694 -12.521 -2.290 1.00 0.00 C ATOM 216 CD1 TYR A 16 -7.483 -12.074 -2.800 1.00 0.00 C ATOM 217 CD2 TYR A 16 -8.927 -13.891 -2.267 1.00 0.00 C ATOM 218 CE1 TYR A 16 -6.537 -12.957 -3.276 1.00 0.00 C ATOM 219 CE2 TYR A 16 -7.982 -14.783 -2.746 1.00 0.00 C ATOM 220 CZ TYR A 16 -6.788 -14.310 -3.247 1.00 0.00 C ATOM 221 OH TYR A 16 -5.838 -15.189 -3.716 1.00 0.00 O ATOM 0 H TYR A 16 -11.620 -9.518 -1.577 1.00 0.00 H new ATOM 0 HA TYR A 16 -9.564 -10.362 -3.536 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -9.248 -10.937 -0.975 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -10.521 -12.105 -1.272 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -7.278 -11.014 -2.824 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -9.859 -14.266 -1.870 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -5.602 -12.588 -3.670 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -8.180 -15.845 -2.727 1.00 0.00 H new ATOM 0 HH TYR A 16 -6.168 -16.107 -3.625 1.00 0.00 H new ATOM 231 N ASP A 17 -11.230 -11.894 -4.643 1.00 0.00 N ATOM 232 CA ASP A 17 -12.263 -12.543 -5.454 1.00 0.00 C ATOM 233 C ASP A 17 -11.654 -13.675 -6.267 1.00 0.00 C ATOM 234 O ASP A 17 -11.079 -13.436 -7.330 1.00 0.00 O ATOM 235 CB ASP A 17 -12.935 -11.542 -6.405 1.00 0.00 C ATOM 236 CG ASP A 17 -13.927 -10.633 -5.710 1.00 0.00 C ATOM 237 OD1 ASP A 17 -15.105 -11.029 -5.564 1.00 0.00 O ATOM 238 OD2 ASP A 17 -13.547 -9.515 -5.312 1.00 0.00 O ATOM 0 H ASP A 17 -10.297 -11.931 -5.053 1.00 0.00 H new ATOM 0 HA ASP A 17 -13.018 -12.939 -4.775 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -12.167 -10.933 -6.883 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.446 -12.090 -7.196 1.00 0.00 H new ATOM 243 N GLY A 18 -11.780 -14.902 -5.771 1.00 0.00 N ATOM 244 CA GLY A 18 -11.102 -16.030 -6.393 1.00 0.00 C ATOM 245 C GLY A 18 -9.609 -15.873 -6.251 1.00 0.00 C ATOM 246 O GLY A 18 -9.043 -16.183 -5.208 1.00 0.00 O ATOM 0 H GLY A 18 -12.338 -15.137 -4.950 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -11.424 -16.961 -5.927 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -11.371 -16.091 -7.447 1.00 0.00 H new ATOM 250 N SER A 19 -8.970 -15.378 -7.292 1.00 0.00 N ATOM 251 CA SER A 19 -7.640 -14.844 -7.154 1.00 0.00 C ATOM 252 C SER A 19 -7.613 -13.461 -7.793 1.00 0.00 C ATOM 253 O SER A 19 -7.248 -13.291 -8.956 1.00 0.00 O ATOM 254 CB SER A 19 -6.636 -15.770 -7.836 1.00 0.00 C ATOM 255 OG SER A 19 -6.755 -17.099 -7.355 1.00 0.00 O ATOM 0 H SER A 19 -9.352 -15.337 -8.237 1.00 0.00 H new ATOM 0 HA SER A 19 -7.368 -14.768 -6.101 1.00 0.00 H new ATOM 0 HB2 SER A 19 -6.797 -15.755 -8.914 1.00 0.00 H new ATOM 0 HB3 SER A 19 -5.624 -15.406 -7.660 1.00 0.00 H new ATOM 0 HG SER A 19 -6.102 -17.671 -7.809 1.00 0.00 H new ATOM 261 N THR A 20 -8.022 -12.479 -7.015 1.00 0.00 N ATOM 262 CA THR A 20 -7.972 -11.088 -7.417 1.00 0.00 C ATOM 263 C THR A 20 -7.718 -10.227 -6.193 1.00 0.00 C ATOM 264 O THR A 20 -8.345 -10.437 -5.159 1.00 0.00 O ATOM 265 CB THR A 20 -9.277 -10.643 -8.114 1.00 0.00 C ATOM 266 OG1 THR A 20 -9.497 -11.432 -9.292 1.00 0.00 O ATOM 267 CG2 THR A 20 -9.220 -9.167 -8.489 1.00 0.00 C ATOM 0 H THR A 20 -8.401 -12.625 -6.079 1.00 0.00 H new ATOM 0 HA THR A 20 -7.162 -10.969 -8.137 1.00 0.00 H new ATOM 0 HB THR A 20 -10.102 -10.791 -7.417 1.00 0.00 H new ATOM 0 HG1 THR A 20 -9.985 -12.247 -9.053 1.00 0.00 H new ATOM 0 HG21 THR A 20 -10.151 -8.880 -8.978 1.00 0.00 H new ATOM 0 HG22 THR A 20 -9.083 -8.568 -7.589 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.385 -8.996 -9.169 1.00 0.00 H new ATOM 275 N PHE A 21 -6.816 -9.274 -6.297 1.00 0.00 N ATOM 276 CA PHE A 21 -6.541 -8.388 -5.184 1.00 0.00 C ATOM 277 C PHE A 21 -6.518 -6.960 -5.681 1.00 0.00 C ATOM 278 O PHE A 21 -5.629 -6.558 -6.428 1.00 0.00 O ATOM 279 CB PHE A 21 -5.219 -8.756 -4.516 1.00 0.00 C ATOM 280 CG PHE A 21 -5.196 -8.489 -3.043 1.00 0.00 C ATOM 281 CD1 PHE A 21 -6.033 -9.187 -2.194 1.00 0.00 C ATOM 282 CD2 PHE A 21 -4.341 -7.546 -2.508 1.00 0.00 C ATOM 283 CE1 PHE A 21 -6.016 -8.954 -0.838 1.00 0.00 C ATOM 284 CE2 PHE A 21 -4.320 -7.307 -1.150 1.00 0.00 C ATOM 285 CZ PHE A 21 -5.156 -8.012 -0.316 1.00 0.00 C ATOM 0 H PHE A 21 -6.263 -9.093 -7.135 1.00 0.00 H new ATOM 0 HA PHE A 21 -7.326 -8.492 -4.435 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -5.017 -9.813 -4.688 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -4.413 -8.196 -4.991 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.709 -9.925 -2.600 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -3.682 -6.990 -3.159 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -6.674 -9.507 -0.185 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -3.648 -6.567 -0.742 1.00 0.00 H new ATOM 0 HZ PHE A 21 -5.139 -7.827 0.748 1.00 0.00 H new ATOM 295 N SER A 22 -7.526 -6.218 -5.297 1.00 0.00 N ATOM 296 CA SER A 22 -7.690 -4.851 -5.755 1.00 0.00 C ATOM 297 C SER A 22 -8.066 -3.956 -4.588 1.00 0.00 C ATOM 298 O SER A 22 -8.704 -4.410 -3.639 1.00 0.00 O ATOM 299 CB SER A 22 -8.764 -4.795 -6.843 1.00 0.00 C ATOM 300 OG SER A 22 -8.458 -5.701 -7.895 1.00 0.00 O ATOM 0 H SER A 22 -8.256 -6.538 -4.661 1.00 0.00 H new ATOM 0 HA SER A 22 -6.749 -4.496 -6.175 1.00 0.00 H new ATOM 0 HB2 SER A 22 -9.736 -5.041 -6.415 1.00 0.00 H new ATOM 0 HB3 SER A 22 -8.837 -3.782 -7.238 1.00 0.00 H new ATOM 0 HG SER A 22 -9.156 -5.653 -8.581 1.00 0.00 H new ATOM 306 N GLY A 23 -7.664 -2.701 -4.657 1.00 0.00 N ATOM 307 CA GLY A 23 -7.928 -1.777 -3.580 1.00 0.00 C ATOM 308 C GLY A 23 -7.368 -0.411 -3.879 1.00 0.00 C ATOM 309 O GLY A 23 -6.961 -0.139 -5.010 1.00 0.00 O ATOM 0 H GLY A 23 -7.155 -2.303 -5.446 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -9.003 -1.703 -3.417 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.491 -2.157 -2.657 1.00 0.00 H new ATOM 313 N LYS A 24 -7.329 0.447 -2.875 1.00 0.00 N ATOM 314 CA LYS A 24 -6.828 1.793 -3.062 1.00 0.00 C ATOM 315 C LYS A 24 -6.216 2.341 -1.775 1.00 0.00 C ATOM 316 O LYS A 24 -6.482 1.839 -0.680 1.00 0.00 O ATOM 317 CB LYS A 24 -7.926 2.718 -3.598 1.00 0.00 C ATOM 318 CG LYS A 24 -9.129 2.922 -2.680 1.00 0.00 C ATOM 319 CD LYS A 24 -10.116 1.769 -2.744 1.00 0.00 C ATOM 320 CE LYS A 24 -11.435 2.139 -2.089 1.00 0.00 C ATOM 321 NZ LYS A 24 -12.359 0.980 -2.010 1.00 0.00 N ATOM 0 H LYS A 24 -7.637 0.235 -1.926 1.00 0.00 H new ATOM 0 HA LYS A 24 -6.035 1.753 -3.808 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -7.484 3.692 -3.808 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -8.281 2.317 -4.547 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -8.782 3.041 -1.654 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.638 3.846 -2.954 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -10.288 1.492 -3.784 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -9.692 0.896 -2.247 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -11.247 2.522 -1.086 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -11.908 2.942 -2.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.342 1.319 -2.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -12.201 0.354 -2.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.182 0.454 -1.130 1.00 0.00 H new ATOM 335 N ILE A 25 -5.393 3.372 -1.927 1.00 0.00 N ATOM 336 CA ILE A 25 -4.563 3.887 -0.851 1.00 0.00 C ATOM 337 C ILE A 25 -4.764 5.397 -0.674 1.00 0.00 C ATOM 338 O ILE A 25 -5.114 6.103 -1.622 1.00 0.00 O ATOM 339 CB ILE A 25 -3.078 3.608 -1.166 1.00 0.00 C ATOM 340 CG1 ILE A 25 -2.895 2.154 -1.612 1.00 0.00 C ATOM 341 CG2 ILE A 25 -2.198 3.896 0.036 1.00 0.00 C ATOM 342 CD1 ILE A 25 -1.460 1.788 -1.915 1.00 0.00 C ATOM 0 H ILE A 25 -5.284 3.876 -2.807 1.00 0.00 H new ATOM 0 HA ILE A 25 -4.853 3.386 0.073 1.00 0.00 H new ATOM 0 HB ILE A 25 -2.776 4.272 -1.976 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -3.272 1.493 -0.831 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.501 1.976 -2.500 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.158 3.690 -0.217 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -2.302 4.943 0.320 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -2.501 3.262 0.869 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -1.408 0.744 -2.224 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -1.084 2.423 -2.717 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -0.851 1.933 -1.022 1.00 0.00 H new ATOM 354 N TYR A 26 -4.531 5.879 0.542 1.00 0.00 N ATOM 355 CA TYR A 26 -4.678 7.296 0.875 1.00 0.00 C ATOM 356 C TYR A 26 -3.365 7.810 1.481 1.00 0.00 C ATOM 357 O TYR A 26 -3.001 7.409 2.584 1.00 0.00 O ATOM 358 CB TYR A 26 -5.826 7.441 1.888 1.00 0.00 C ATOM 359 CG TYR A 26 -6.276 8.853 2.187 1.00 0.00 C ATOM 360 CD1 TYR A 26 -5.371 9.821 2.584 1.00 0.00 C ATOM 361 CD2 TYR A 26 -7.619 9.201 2.108 1.00 0.00 C ATOM 362 CE1 TYR A 26 -5.782 11.096 2.892 1.00 0.00 C ATOM 363 CE2 TYR A 26 -8.040 10.481 2.411 1.00 0.00 C ATOM 364 CZ TYR A 26 -7.117 11.426 2.805 1.00 0.00 C ATOM 365 OH TYR A 26 -7.528 12.699 3.118 1.00 0.00 O ATOM 0 H TYR A 26 -4.234 5.300 1.327 1.00 0.00 H new ATOM 0 HA TYR A 26 -4.904 7.879 -0.018 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -6.683 6.879 1.517 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -5.519 6.974 2.824 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -4.323 9.570 2.653 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -8.344 8.460 1.805 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -5.060 11.837 3.201 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -9.086 10.740 2.340 1.00 0.00 H new ATOM 0 HH TYR A 26 -6.809 13.334 2.916 1.00 0.00 H new ATOM 375 N VAL A 27 -2.644 8.691 0.782 1.00 0.00 N ATOM 376 CA VAL A 27 -1.340 9.139 1.289 1.00 0.00 C ATOM 377 C VAL A 27 -1.187 10.659 1.206 1.00 0.00 C ATOM 378 O VAL A 27 -1.835 11.321 0.387 1.00 0.00 O ATOM 379 CB VAL A 27 -0.149 8.457 0.546 1.00 0.00 C ATOM 380 CG1 VAL A 27 -0.590 7.200 -0.187 1.00 0.00 C ATOM 381 CG2 VAL A 27 0.559 9.411 -0.408 1.00 0.00 C ATOM 0 H VAL A 27 -2.927 9.099 -0.109 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.311 8.838 2.336 1.00 0.00 H new ATOM 0 HB VAL A 27 0.567 8.169 1.315 1.00 0.00 H new ATOM 0 HG11 VAL A 27 0.267 6.754 -0.692 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.002 6.487 0.528 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.352 7.456 -0.923 1.00 0.00 H new ATOM 0 HG21 VAL A 27 1.380 8.890 -0.901 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.148 9.766 -1.158 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.952 10.260 0.151 1.00 0.00 H new ATOM 391 N LYS A 28 -0.324 11.199 2.067 1.00 0.00 N ATOM 392 CA LYS A 28 -0.001 12.614 2.047 1.00 0.00 C ATOM 393 C LYS A 28 1.239 12.854 1.196 1.00 0.00 C ATOM 394 O LYS A 28 2.083 11.970 1.039 1.00 0.00 O ATOM 395 CB LYS A 28 0.221 13.163 3.462 1.00 0.00 C ATOM 396 CG LYS A 28 1.497 12.694 4.137 1.00 0.00 C ATOM 397 CD LYS A 28 1.804 13.523 5.377 1.00 0.00 C ATOM 398 CE LYS A 28 0.697 13.419 6.414 1.00 0.00 C ATOM 399 NZ LYS A 28 0.892 14.382 7.528 1.00 0.00 N ATOM 0 H LYS A 28 0.163 10.668 2.789 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.849 13.143 1.612 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.231 14.252 3.416 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.628 12.878 4.084 1.00 0.00 H new ATOM 0 HG2 LYS A 28 1.400 11.644 4.414 1.00 0.00 H new ATOM 0 HG3 LYS A 28 2.329 12.763 3.436 1.00 0.00 H new ATOM 0 HD2 LYS A 28 2.744 13.188 5.814 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.939 14.567 5.092 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -0.266 13.604 5.938 1.00 0.00 H new ATOM 0 HE3 LYS A 28 0.666 12.405 6.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 0.117 14.280 8.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 1.799 14.189 7.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 0.896 15.352 7.152 1.00 0.00 H new ATOM 413 N ASN A 29 1.325 14.037 0.627 1.00 0.00 N ATOM 414 CA ASN A 29 2.434 14.391 -0.248 1.00 0.00 C ATOM 415 C ASN A 29 3.543 15.123 0.510 1.00 0.00 C ATOM 416 O ASN A 29 3.423 16.307 0.814 1.00 0.00 O ATOM 417 CB ASN A 29 1.943 15.253 -1.427 1.00 0.00 C ATOM 418 CG ASN A 29 1.087 16.443 -1.007 1.00 0.00 C ATOM 419 OD1 ASN A 29 0.341 16.385 -0.028 1.00 0.00 O ATOM 420 ND2 ASN A 29 1.183 17.530 -1.755 1.00 0.00 N ATOM 0 H ASN A 29 0.637 14.779 0.753 1.00 0.00 H new ATOM 0 HA ASN A 29 2.850 13.461 -0.636 1.00 0.00 H new ATOM 0 HB2 ASN A 29 2.807 15.617 -1.983 1.00 0.00 H new ATOM 0 HB3 ASN A 29 1.367 14.626 -2.108 1.00 0.00 H new ATOM 0 HD21 ASN A 29 0.629 18.356 -1.528 1.00 0.00 H new ATOM 0 HD22 ASN A 29 1.811 17.542 -2.558 1.00 0.00 H new ATOM 427 N ILE A 30 4.617 14.404 0.827 1.00 0.00 N ATOM 428 CA ILE A 30 5.807 15.027 1.402 1.00 0.00 C ATOM 429 C ILE A 30 6.626 15.648 0.278 1.00 0.00 C ATOM 430 O ILE A 30 7.103 16.777 0.371 1.00 0.00 O ATOM 431 CB ILE A 30 6.689 14.016 2.179 1.00 0.00 C ATOM 432 CG1 ILE A 30 5.973 13.528 3.436 1.00 0.00 C ATOM 433 CG2 ILE A 30 8.030 14.631 2.555 1.00 0.00 C ATOM 434 CD1 ILE A 30 4.959 12.438 3.186 1.00 0.00 C ATOM 0 H ILE A 30 4.688 13.395 0.697 1.00 0.00 H new ATOM 0 HA ILE A 30 5.477 15.784 2.113 1.00 0.00 H new ATOM 0 HB ILE A 30 6.870 13.166 1.522 1.00 0.00 H new ATOM 0 HG12 ILE A 30 6.716 13.162 4.145 1.00 0.00 H new ATOM 0 HG13 ILE A 30 5.472 14.374 3.907 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.627 13.899 3.099 1.00 0.00 H new ATOM 0 HG22 ILE A 30 8.559 14.931 1.650 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.866 15.505 3.185 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.496 12.148 4.129 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.192 12.804 2.503 1.00 0.00 H new ATOM 0 HD13 ILE A 30 5.455 11.574 2.745 1.00 0.00 H new ATOM 446 N ALA A 31 6.762 14.881 -0.787 1.00 0.00 N ATOM 447 CA ALA A 31 7.407 15.324 -1.995 1.00 0.00 C ATOM 448 C ALA A 31 6.515 14.940 -3.160 1.00 0.00 C ATOM 449 O ALA A 31 5.657 14.067 -3.031 1.00 0.00 O ATOM 450 CB ALA A 31 8.785 14.701 -2.127 1.00 0.00 C ATOM 0 H ALA A 31 6.421 13.921 -0.832 1.00 0.00 H new ATOM 0 HA ALA A 31 7.550 16.404 -1.977 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.255 15.049 -3.047 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.398 14.991 -1.274 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.692 13.615 -2.155 1.00 0.00 H new ATOM 456 N TYR A 32 6.712 15.596 -4.282 1.00 0.00 N ATOM 457 CA TYR A 32 5.784 15.504 -5.395 1.00 0.00 C ATOM 458 C TYR A 32 6.075 14.301 -6.284 1.00 0.00 C ATOM 459 O TYR A 32 5.167 13.744 -6.900 1.00 0.00 O ATOM 460 CB TYR A 32 5.856 16.800 -6.184 1.00 0.00 C ATOM 461 CG TYR A 32 4.698 17.034 -7.126 1.00 0.00 C ATOM 462 CD1 TYR A 32 3.390 16.971 -6.671 1.00 0.00 C ATOM 463 CD2 TYR A 32 4.915 17.354 -8.461 1.00 0.00 C ATOM 464 CE1 TYR A 32 2.327 17.217 -7.518 1.00 0.00 C ATOM 465 CE2 TYR A 32 3.858 17.595 -9.317 1.00 0.00 C ATOM 466 CZ TYR A 32 2.567 17.528 -8.839 1.00 0.00 C ATOM 467 OH TYR A 32 1.510 17.788 -9.678 1.00 0.00 O ATOM 0 H TYR A 32 7.513 16.205 -4.451 1.00 0.00 H new ATOM 0 HA TYR A 32 4.775 15.358 -5.008 1.00 0.00 H new ATOM 0 HB2 TYR A 32 5.910 17.633 -5.483 1.00 0.00 H new ATOM 0 HB3 TYR A 32 6.782 16.807 -6.760 1.00 0.00 H new ATOM 0 HD1 TYR A 32 3.199 16.725 -5.637 1.00 0.00 H new ATOM 0 HD2 TYR A 32 5.926 17.415 -8.835 1.00 0.00 H new ATOM 0 HE1 TYR A 32 1.314 17.166 -7.147 1.00 0.00 H new ATOM 0 HE2 TYR A 32 4.042 17.834 -10.354 1.00 0.00 H new ATOM 0 HH TYR A 32 1.847 17.992 -10.575 1.00 0.00 H new ATOM 477 N SER A 33 7.335 13.904 -6.351 1.00 0.00 N ATOM 478 CA SER A 33 7.715 12.722 -7.106 1.00 0.00 C ATOM 479 C SER A 33 7.701 11.490 -6.203 1.00 0.00 C ATOM 480 O SER A 33 8.656 11.227 -5.466 1.00 0.00 O ATOM 481 CB SER A 33 9.091 12.934 -7.733 1.00 0.00 C ATOM 482 OG SER A 33 9.942 13.652 -6.851 1.00 0.00 O ATOM 0 H SER A 33 8.111 14.382 -5.893 1.00 0.00 H new ATOM 0 HA SER A 33 6.994 12.555 -7.906 1.00 0.00 H new ATOM 0 HB2 SER A 33 9.539 11.970 -7.973 1.00 0.00 H new ATOM 0 HB3 SER A 33 8.988 13.480 -8.671 1.00 0.00 H new ATOM 0 HG SER A 33 10.819 13.776 -7.271 1.00 0.00 H new ATOM 488 N LYS A 34 6.602 10.750 -6.245 1.00 0.00 N ATOM 489 CA LYS A 34 6.402 9.630 -5.355 1.00 0.00 C ATOM 490 C LYS A 34 6.432 8.325 -6.130 1.00 0.00 C ATOM 491 O LYS A 34 6.441 8.321 -7.361 1.00 0.00 O ATOM 492 CB LYS A 34 5.049 9.776 -4.670 1.00 0.00 C ATOM 493 CG LYS A 34 4.748 11.187 -4.229 1.00 0.00 C ATOM 494 CD LYS A 34 3.290 11.350 -3.865 1.00 0.00 C ATOM 495 CE LYS A 34 2.873 12.804 -3.910 1.00 0.00 C ATOM 496 NZ LYS A 34 1.401 12.950 -3.843 1.00 0.00 N ATOM 0 H LYS A 34 5.833 10.913 -6.895 1.00 0.00 H new ATOM 0 HA LYS A 34 7.201 9.617 -4.614 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.267 9.442 -5.352 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.017 9.118 -3.802 1.00 0.00 H new ATOM 0 HG2 LYS A 34 5.370 11.442 -3.371 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.005 11.883 -5.028 1.00 0.00 H new ATOM 0 HD2 LYS A 34 2.674 10.771 -4.553 1.00 0.00 H new ATOM 0 HD3 LYS A 34 3.115 10.950 -2.866 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.331 13.341 -3.079 1.00 0.00 H new ATOM 0 HE3 LYS A 34 3.243 13.261 -4.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.121 13.849 -4.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 0.950 12.160 -4.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 1.096 12.944 -2.849 1.00 0.00 H new ATOM 510 N LYS A 35 6.443 7.225 -5.405 1.00 0.00 N ATOM 511 CA LYS A 35 6.360 5.902 -6.006 1.00 0.00 C ATOM 512 C LYS A 35 5.803 4.915 -4.991 1.00 0.00 C ATOM 513 O LYS A 35 6.484 4.481 -4.061 1.00 0.00 O ATOM 514 CB LYS A 35 7.722 5.425 -6.534 1.00 0.00 C ATOM 515 CG LYS A 35 8.826 5.459 -5.495 1.00 0.00 C ATOM 516 CD LYS A 35 10.004 4.576 -5.876 1.00 0.00 C ATOM 517 CE LYS A 35 9.622 3.102 -5.868 1.00 0.00 C ATOM 518 NZ LYS A 35 10.817 2.217 -5.893 1.00 0.00 N ATOM 0 H LYS A 35 6.509 7.218 -4.387 1.00 0.00 H new ATOM 0 HA LYS A 35 5.689 5.960 -6.863 1.00 0.00 H new ATOM 0 HB2 LYS A 35 7.620 4.407 -6.909 1.00 0.00 H new ATOM 0 HB3 LYS A 35 8.012 6.048 -7.380 1.00 0.00 H new ATOM 0 HG2 LYS A 35 9.170 6.485 -5.367 1.00 0.00 H new ATOM 0 HG3 LYS A 35 8.427 5.135 -4.534 1.00 0.00 H new ATOM 0 HD2 LYS A 35 10.363 4.854 -6.867 1.00 0.00 H new ATOM 0 HD3 LYS A 35 10.826 4.744 -5.180 1.00 0.00 H new ATOM 0 HE2 LYS A 35 9.029 2.886 -4.979 1.00 0.00 H new ATOM 0 HE3 LYS A 35 8.993 2.886 -6.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 10.512 1.224 -5.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 11.396 2.440 -6.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 11.379 2.368 -5.031 1.00 0.00 H new ATOM 532 N VAL A 36 4.555 4.566 -5.160 1.00 0.00 N ATOM 533 CA VAL A 36 3.903 3.694 -4.216 1.00 0.00 C ATOM 534 C VAL A 36 3.912 2.280 -4.731 1.00 0.00 C ATOM 535 O VAL A 36 3.527 2.009 -5.869 1.00 0.00 O ATOM 536 CB VAL A 36 2.472 4.150 -3.899 1.00 0.00 C ATOM 537 CG1 VAL A 36 1.738 3.115 -3.084 1.00 0.00 C ATOM 538 CG2 VAL A 36 2.515 5.445 -3.128 1.00 0.00 C ATOM 0 H VAL A 36 3.971 4.870 -5.939 1.00 0.00 H new ATOM 0 HA VAL A 36 4.463 3.738 -3.282 1.00 0.00 H new ATOM 0 HB VAL A 36 1.943 4.289 -4.842 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.727 3.466 -2.875 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.689 2.180 -3.642 1.00 0.00 H new ATOM 0 HG13 VAL A 36 2.266 2.950 -2.145 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.499 5.768 -2.903 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.063 5.296 -2.197 1.00 0.00 H new ATOM 0 HG23 VAL A 36 3.015 6.208 -3.725 1.00 0.00 H new ATOM 548 N THR A 37 4.358 1.386 -3.887 1.00 0.00 N ATOM 549 CA THR A 37 4.587 0.023 -4.282 1.00 0.00 C ATOM 550 C THR A 37 4.089 -0.936 -3.218 1.00 0.00 C ATOM 551 O THR A 37 4.317 -0.740 -2.026 1.00 0.00 O ATOM 552 CB THR A 37 6.081 -0.207 -4.556 1.00 0.00 C ATOM 553 OG1 THR A 37 6.880 0.568 -3.652 1.00 0.00 O ATOM 554 CG2 THR A 37 6.422 0.148 -5.993 1.00 0.00 C ATOM 0 H THR A 37 4.572 1.583 -2.909 1.00 0.00 H new ATOM 0 HA THR A 37 4.030 -0.168 -5.199 1.00 0.00 H new ATOM 0 HB THR A 37 6.299 -1.263 -4.399 1.00 0.00 H new ATOM 0 HG1 THR A 37 7.829 0.410 -3.837 1.00 0.00 H new ATOM 0 HG21 THR A 37 7.485 -0.022 -6.167 1.00 0.00 H new ATOM 0 HG22 THR A 37 5.839 -0.476 -6.670 1.00 0.00 H new ATOM 0 HG23 THR A 37 6.188 1.197 -6.174 1.00 0.00 H new ATOM 562 N VAL A 38 3.395 -1.964 -3.657 1.00 0.00 N ATOM 563 CA VAL A 38 2.855 -2.948 -2.745 1.00 0.00 C ATOM 564 C VAL A 38 3.821 -4.070 -2.567 1.00 0.00 C ATOM 565 O VAL A 38 4.343 -4.606 -3.534 1.00 0.00 O ATOM 566 CB VAL A 38 1.565 -3.621 -3.223 1.00 0.00 C ATOM 567 CG1 VAL A 38 1.209 -4.747 -2.285 1.00 0.00 C ATOM 568 CG2 VAL A 38 0.390 -2.703 -3.290 1.00 0.00 C ATOM 0 H VAL A 38 3.192 -2.140 -4.641 1.00 0.00 H new ATOM 0 HA VAL A 38 2.657 -2.382 -1.834 1.00 0.00 H new ATOM 0 HB VAL A 38 1.771 -3.971 -4.234 1.00 0.00 H new ATOM 0 HG11 VAL A 38 0.291 -5.227 -2.624 1.00 0.00 H new ATOM 0 HG12 VAL A 38 2.017 -5.478 -2.271 1.00 0.00 H new ATOM 0 HG13 VAL A 38 1.061 -4.351 -1.280 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -0.484 -3.255 -3.637 1.00 0.00 H new ATOM 0 HG22 VAL A 38 0.191 -2.294 -2.300 1.00 0.00 H new ATOM 0 HG23 VAL A 38 0.603 -1.889 -3.983 1.00 0.00 H new ATOM 578 N VAL A 39 3.995 -4.466 -1.348 1.00 0.00 N ATOM 579 CA VAL A 39 4.740 -5.654 -1.067 1.00 0.00 C ATOM 580 C VAL A 39 3.784 -6.662 -0.451 1.00 0.00 C ATOM 581 O VAL A 39 3.788 -6.868 0.763 1.00 0.00 O ATOM 582 CB VAL A 39 5.930 -5.381 -0.122 1.00 0.00 C ATOM 583 CG1 VAL A 39 7.159 -6.123 -0.601 1.00 0.00 C ATOM 584 CG2 VAL A 39 6.223 -3.890 -0.021 1.00 0.00 C ATOM 0 H VAL A 39 3.631 -3.983 -0.527 1.00 0.00 H new ATOM 0 HA VAL A 39 5.167 -6.042 -1.992 1.00 0.00 H new ATOM 0 HB VAL A 39 5.661 -5.740 0.871 1.00 0.00 H new ATOM 0 HG11 VAL A 39 7.991 -5.922 0.074 1.00 0.00 H new ATOM 0 HG12 VAL A 39 6.955 -7.194 -0.617 1.00 0.00 H new ATOM 0 HG13 VAL A 39 7.418 -5.788 -1.606 1.00 0.00 H new ATOM 0 HG21 VAL A 39 7.066 -3.730 0.651 1.00 0.00 H new ATOM 0 HG22 VAL A 39 6.467 -3.499 -1.009 1.00 0.00 H new ATOM 0 HG23 VAL A 39 5.346 -3.372 0.367 1.00 0.00 H new ATOM 594 N TYR A 40 2.926 -7.269 -1.285 1.00 0.00 N ATOM 595 CA TYR A 40 1.933 -8.194 -0.755 1.00 0.00 C ATOM 596 C TYR A 40 2.346 -9.642 -1.000 1.00 0.00 C ATOM 597 O TYR A 40 2.544 -10.089 -2.129 1.00 0.00 O ATOM 598 CB TYR A 40 0.449 -7.867 -1.156 1.00 0.00 C ATOM 599 CG TYR A 40 0.053 -7.775 -2.631 1.00 0.00 C ATOM 600 CD1 TYR A 40 0.501 -8.681 -3.545 1.00 0.00 C ATOM 601 CD2 TYR A 40 -0.812 -6.783 -3.084 1.00 0.00 C ATOM 602 CE1 TYR A 40 0.143 -8.628 -4.870 1.00 0.00 C ATOM 603 CE2 TYR A 40 -1.185 -6.708 -4.411 1.00 0.00 C ATOM 604 CZ TYR A 40 -0.703 -7.637 -5.302 1.00 0.00 C ATOM 605 OH TYR A 40 -1.062 -7.574 -6.625 1.00 0.00 O ATOM 0 H TYR A 40 2.903 -7.138 -2.296 1.00 0.00 H new ATOM 0 HA TYR A 40 1.922 -8.047 0.325 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -0.184 -8.627 -0.698 1.00 0.00 H new ATOM 0 HB3 TYR A 40 0.191 -6.915 -0.692 1.00 0.00 H new ATOM 0 HD1 TYR A 40 1.162 -9.469 -3.216 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -1.199 -6.058 -2.384 1.00 0.00 H new ATOM 0 HE1 TYR A 40 0.524 -9.360 -5.566 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -1.850 -5.926 -4.746 1.00 0.00 H new ATOM 0 HH TYR A 40 -0.459 -8.136 -7.155 1.00 0.00 H new ATOM 615 N ALA A 41 2.521 -10.342 0.112 1.00 0.00 N ATOM 616 CA ALA A 41 3.138 -11.655 0.150 1.00 0.00 C ATOM 617 C ALA A 41 2.215 -12.732 -0.329 1.00 0.00 C ATOM 618 O ALA A 41 1.013 -12.711 -0.054 1.00 0.00 O ATOM 619 CB ALA A 41 3.614 -11.978 1.556 1.00 0.00 C ATOM 0 H ALA A 41 2.231 -10.004 1.030 1.00 0.00 H new ATOM 0 HA ALA A 41 3.991 -11.623 -0.528 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.074 -12.966 1.566 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.345 -11.234 1.873 1.00 0.00 H new ATOM 0 HB3 ALA A 41 2.765 -11.966 2.239 1.00 0.00 H new ATOM 625 N ASP A 42 2.815 -13.712 -0.969 1.00 0.00 N ATOM 626 CA ASP A 42 2.088 -14.758 -1.645 1.00 0.00 C ATOM 627 C ASP A 42 1.609 -15.782 -0.632 1.00 0.00 C ATOM 628 O ASP A 42 2.101 -15.815 0.499 1.00 0.00 O ATOM 629 CB ASP A 42 2.981 -15.401 -2.712 1.00 0.00 C ATOM 630 CG ASP A 42 4.367 -15.764 -2.200 1.00 0.00 C ATOM 631 OD1 ASP A 42 5.098 -14.860 -1.722 1.00 0.00 O ATOM 632 OD2 ASP A 42 4.751 -16.943 -2.313 1.00 0.00 O ATOM 0 H ASP A 42 3.829 -13.804 -1.034 1.00 0.00 H new ATOM 0 HA ASP A 42 1.214 -14.340 -2.144 1.00 0.00 H new ATOM 0 HB2 ASP A 42 2.494 -16.300 -3.089 1.00 0.00 H new ATOM 0 HB3 ASP A 42 3.080 -14.715 -3.554 1.00 0.00 H new ATOM 637 N GLY A 43 0.656 -16.613 -1.040 1.00 0.00 N ATOM 638 CA GLY A 43 -0.010 -17.523 -0.119 1.00 0.00 C ATOM 639 C GLY A 43 0.854 -18.691 0.315 1.00 0.00 C ATOM 640 O GLY A 43 0.379 -19.824 0.395 1.00 0.00 O ATOM 0 H GLY A 43 0.328 -16.674 -2.004 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -0.324 -16.967 0.764 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.914 -17.907 -0.592 1.00 0.00 H new ATOM 644 N SER A 44 2.113 -18.410 0.591 1.00 0.00 N ATOM 645 CA SER A 44 3.042 -19.406 1.078 1.00 0.00 C ATOM 646 C SER A 44 3.609 -18.991 2.432 1.00 0.00 C ATOM 647 O SER A 44 4.192 -19.807 3.154 1.00 0.00 O ATOM 648 CB SER A 44 4.175 -19.578 0.078 1.00 0.00 C ATOM 649 OG SER A 44 3.681 -19.961 -1.197 1.00 0.00 O ATOM 0 H SER A 44 2.520 -17.481 0.483 1.00 0.00 H new ATOM 0 HA SER A 44 2.513 -20.351 1.197 1.00 0.00 H new ATOM 0 HB2 SER A 44 4.731 -18.644 -0.010 1.00 0.00 H new ATOM 0 HB3 SER A 44 4.873 -20.332 0.442 1.00 0.00 H new ATOM 0 HG SER A 44 4.430 -20.063 -1.821 1.00 0.00 H new ATOM 655 N ASP A 45 3.446 -17.696 2.750 1.00 0.00 N ATOM 656 CA ASP A 45 3.889 -17.135 4.028 1.00 0.00 C ATOM 657 C ASP A 45 5.400 -17.167 4.131 1.00 0.00 C ATOM 658 O ASP A 45 5.939 -17.576 5.159 1.00 0.00 O ATOM 659 CB ASP A 45 3.307 -17.911 5.219 1.00 0.00 C ATOM 660 CG ASP A 45 1.831 -17.686 5.430 1.00 0.00 C ATOM 661 OD1 ASP A 45 1.023 -18.320 4.726 1.00 0.00 O ATOM 662 OD2 ASP A 45 1.473 -16.889 6.325 1.00 0.00 O ATOM 0 H ASP A 45 3.006 -17.016 2.130 1.00 0.00 H new ATOM 0 HA ASP A 45 3.531 -16.106 4.061 1.00 0.00 H new ATOM 0 HB2 ASP A 45 3.485 -18.976 5.068 1.00 0.00 H new ATOM 0 HB3 ASP A 45 3.842 -17.623 6.124 1.00 0.00 H new ATOM 667 N ASN A 46 6.100 -16.726 3.097 1.00 0.00 N ATOM 668 CA ASN A 46 7.548 -16.921 3.094 1.00 0.00 C ATOM 669 C ASN A 46 8.270 -15.750 2.479 1.00 0.00 C ATOM 670 O ASN A 46 8.549 -15.729 1.279 1.00 0.00 O ATOM 671 CB ASN A 46 7.926 -18.220 2.377 1.00 0.00 C ATOM 672 CG ASN A 46 9.355 -18.647 2.664 1.00 0.00 C ATOM 673 OD1 ASN A 46 10.291 -18.261 1.961 1.00 0.00 O ATOM 674 ND2 ASN A 46 9.530 -19.453 3.699 1.00 0.00 N ATOM 0 H ASN A 46 5.714 -16.251 2.281 1.00 0.00 H new ATOM 0 HA ASN A 46 7.863 -16.995 4.135 1.00 0.00 H new ATOM 0 HB2 ASN A 46 7.244 -19.013 2.685 1.00 0.00 H new ATOM 0 HB3 ASN A 46 7.798 -18.089 1.303 1.00 0.00 H new ATOM 0 HD21 ASN A 46 10.466 -19.778 3.940 1.00 0.00 H new ATOM 0 HD22 ASN A 46 8.728 -19.749 4.256 1.00 0.00 H new ATOM 681 N TRP A 47 8.570 -14.777 3.317 1.00 0.00 N ATOM 682 CA TRP A 47 9.080 -13.503 2.866 1.00 0.00 C ATOM 683 C TRP A 47 10.406 -13.108 3.484 1.00 0.00 C ATOM 684 O TRP A 47 10.461 -12.501 4.554 1.00 0.00 O ATOM 685 CB TRP A 47 8.026 -12.484 3.088 1.00 0.00 C ATOM 686 CG TRP A 47 7.287 -12.353 1.824 1.00 0.00 C ATOM 687 CD1 TRP A 47 6.994 -13.345 0.929 1.00 0.00 C ATOM 688 CD2 TRP A 47 6.802 -11.174 1.286 1.00 0.00 C ATOM 689 NE1 TRP A 47 6.351 -12.823 -0.152 1.00 0.00 N ATOM 690 CE2 TRP A 47 6.213 -11.483 0.053 1.00 0.00 C ATOM 691 CE3 TRP A 47 6.803 -9.883 1.736 1.00 0.00 C ATOM 692 CZ2 TRP A 47 5.629 -10.523 -0.727 1.00 0.00 C ATOM 693 CZ3 TRP A 47 6.226 -8.945 0.972 1.00 0.00 C ATOM 694 CH2 TRP A 47 5.640 -9.255 -0.253 1.00 0.00 C ATOM 0 H TRP A 47 8.466 -14.850 4.329 1.00 0.00 H new ATOM 0 HA TRP A 47 9.311 -13.584 1.804 1.00 0.00 H new ATOM 0 HB2 TRP A 47 7.360 -12.787 3.895 1.00 0.00 H new ATOM 0 HB3 TRP A 47 8.466 -11.530 3.379 1.00 0.00 H new ATOM 0 HD1 TRP A 47 7.237 -14.389 1.060 1.00 0.00 H new ATOM 0 HE1 TRP A 47 6.030 -13.342 -0.969 1.00 0.00 H new ATOM 0 HE3 TRP A 47 7.257 -9.626 2.682 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 5.179 -10.766 -1.678 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 6.215 -7.921 1.316 1.00 0.00 H new ATOM 0 HH2 TRP A 47 5.185 -8.468 -0.836 1.00 0.00 H new ATOM 705 N ASN A 48 11.475 -13.459 2.794 1.00 0.00 N ATOM 706 CA ASN A 48 12.808 -13.030 3.176 1.00 0.00 C ATOM 707 C ASN A 48 13.254 -11.875 2.285 1.00 0.00 C ATOM 708 O ASN A 48 14.096 -12.052 1.402 1.00 0.00 O ATOM 709 CB ASN A 48 13.805 -14.179 3.055 1.00 0.00 C ATOM 710 CG ASN A 48 15.159 -13.813 3.627 1.00 0.00 C ATOM 711 OD1 ASN A 48 15.473 -14.132 4.774 1.00 0.00 O ATOM 712 ND2 ASN A 48 15.958 -13.118 2.837 1.00 0.00 N ATOM 0 H ASN A 48 11.445 -14.045 1.959 1.00 0.00 H new ATOM 0 HA ASN A 48 12.777 -12.703 4.215 1.00 0.00 H new ATOM 0 HB2 ASN A 48 13.416 -15.054 3.575 1.00 0.00 H new ATOM 0 HB3 ASN A 48 13.916 -14.455 2.006 1.00 0.00 H new ATOM 0 HD21 ASN A 48 16.876 -12.824 3.171 1.00 0.00 H new ATOM 0 HD22 ASN A 48 15.657 -12.875 1.893 1.00 0.00 H new ATOM 719 N ASN A 49 12.650 -10.707 2.488 1.00 0.00 N ATOM 720 CA ASN A 49 12.976 -9.498 1.719 1.00 0.00 C ATOM 721 C ASN A 49 12.978 -9.776 0.209 1.00 0.00 C ATOM 722 O ASN A 49 13.629 -9.082 -0.572 1.00 0.00 O ATOM 723 CB ASN A 49 14.321 -8.916 2.180 1.00 0.00 C ATOM 724 CG ASN A 49 14.545 -7.487 1.701 1.00 0.00 C ATOM 725 OD1 ASN A 49 13.962 -6.544 2.235 1.00 0.00 O ATOM 726 ND2 ASN A 49 15.413 -7.313 0.715 1.00 0.00 N ATOM 0 H ASN A 49 11.921 -10.567 3.188 1.00 0.00 H new ATOM 0 HA ASN A 49 12.199 -8.757 1.909 1.00 0.00 H new ATOM 0 HB2 ASN A 49 14.367 -8.940 3.269 1.00 0.00 H new ATOM 0 HB3 ASN A 49 15.130 -9.548 1.812 1.00 0.00 H new ATOM 0 HD21 ASN A 49 15.617 -6.373 0.375 1.00 0.00 H new ATOM 0 HD22 ASN A 49 15.877 -8.119 0.296 1.00 0.00 H new ATOM 733 N ASN A 50 12.244 -10.810 -0.187 1.00 0.00 N ATOM 734 CA ASN A 50 12.031 -11.112 -1.593 1.00 0.00 C ATOM 735 C ASN A 50 11.155 -10.029 -2.171 1.00 0.00 C ATOM 736 O ASN A 50 11.343 -9.586 -3.301 1.00 0.00 O ATOM 737 CB ASN A 50 11.381 -12.495 -1.767 1.00 0.00 C ATOM 738 CG ASN A 50 10.111 -12.684 -0.958 1.00 0.00 C ATOM 739 OD1 ASN A 50 9.922 -12.070 0.094 1.00 0.00 O ATOM 740 ND2 ASN A 50 9.234 -13.549 -1.438 1.00 0.00 N ATOM 0 H ASN A 50 11.784 -11.457 0.454 1.00 0.00 H new ATOM 0 HA ASN A 50 12.986 -11.142 -2.118 1.00 0.00 H new ATOM 0 HB2 ASN A 50 11.154 -12.649 -2.822 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.100 -13.262 -1.480 1.00 0.00 H new ATOM 0 HD21 ASN A 50 8.365 -13.727 -0.934 1.00 0.00 H new ATOM 0 HD22 ASN A 50 9.426 -14.038 -2.312 1.00 0.00 H new ATOM 747 N GLY A 51 10.223 -9.590 -1.346 1.00 0.00 N ATOM 748 CA GLY A 51 9.461 -8.406 -1.624 1.00 0.00 C ATOM 749 C GLY A 51 8.698 -8.456 -2.937 1.00 0.00 C ATOM 750 O GLY A 51 9.055 -7.756 -3.888 1.00 0.00 O ATOM 0 H GLY A 51 9.980 -10.049 -0.468 1.00 0.00 H new ATOM 0 HA2 GLY A 51 8.754 -8.242 -0.811 1.00 0.00 H new ATOM 0 HA3 GLY A 51 10.134 -7.549 -1.639 1.00 0.00 H new ATOM 754 N ASN A 52 7.662 -9.286 -2.996 1.00 0.00 N ATOM 755 CA ASN A 52 6.790 -9.335 -4.168 1.00 0.00 C ATOM 756 C ASN A 52 6.059 -8.008 -4.320 1.00 0.00 C ATOM 757 O ASN A 52 5.146 -7.690 -3.548 1.00 0.00 O ATOM 758 CB ASN A 52 5.783 -10.485 -4.063 1.00 0.00 C ATOM 759 CG ASN A 52 6.415 -11.843 -4.303 1.00 0.00 C ATOM 760 OD1 ASN A 52 6.467 -12.321 -5.435 1.00 0.00 O ATOM 761 ND2 ASN A 52 6.914 -12.471 -3.247 1.00 0.00 N ATOM 0 H ASN A 52 7.405 -9.932 -2.250 1.00 0.00 H new ATOM 0 HA ASN A 52 7.408 -9.512 -5.048 1.00 0.00 H new ATOM 0 HB2 ASN A 52 5.325 -10.472 -3.074 1.00 0.00 H new ATOM 0 HB3 ASN A 52 4.983 -10.329 -4.787 1.00 0.00 H new ATOM 0 HD21 ASN A 52 7.359 -13.382 -3.359 1.00 0.00 H new ATOM 0 HD22 ASN A 52 6.852 -12.043 -2.323 1.00 0.00 H new ATOM 768 N ILE A 53 6.457 -7.241 -5.327 1.00 0.00 N ATOM 769 CA ILE A 53 6.016 -5.869 -5.451 1.00 0.00 C ATOM 770 C ILE A 53 5.017 -5.691 -6.584 1.00 0.00 C ATOM 771 O ILE A 53 4.988 -6.462 -7.546 1.00 0.00 O ATOM 772 CB ILE A 53 7.212 -4.916 -5.691 1.00 0.00 C ATOM 773 CG1 ILE A 53 6.840 -3.472 -5.370 1.00 0.00 C ATOM 774 CG2 ILE A 53 7.734 -5.024 -7.115 1.00 0.00 C ATOM 775 CD1 ILE A 53 6.873 -3.181 -3.888 1.00 0.00 C ATOM 0 H ILE A 53 7.085 -7.552 -6.068 1.00 0.00 H new ATOM 0 HA ILE A 53 5.529 -5.619 -4.508 1.00 0.00 H new ATOM 0 HB ILE A 53 8.009 -5.224 -5.015 1.00 0.00 H new ATOM 0 HG12 ILE A 53 7.528 -2.800 -5.884 1.00 0.00 H new ATOM 0 HG13 ILE A 53 5.842 -3.263 -5.756 1.00 0.00 H new ATOM 0 HG21 ILE A 53 8.573 -4.341 -7.248 1.00 0.00 H new ATOM 0 HG22 ILE A 53 8.064 -6.045 -7.305 1.00 0.00 H new ATOM 0 HG23 ILE A 53 6.940 -4.763 -7.814 1.00 0.00 H new ATOM 0 HD11 ILE A 53 6.600 -2.140 -3.715 1.00 0.00 H new ATOM 0 HD12 ILE A 53 6.166 -3.831 -3.374 1.00 0.00 H new ATOM 0 HD13 ILE A 53 7.877 -3.361 -3.504 1.00 0.00 H new ATOM 787 N ILE A 54 4.176 -4.695 -6.422 1.00 0.00 N ATOM 788 CA ILE A 54 3.335 -4.196 -7.494 1.00 0.00 C ATOM 789 C ILE A 54 3.251 -2.680 -7.361 1.00 0.00 C ATOM 790 O ILE A 54 3.205 -2.160 -6.249 1.00 0.00 O ATOM 791 CB ILE A 54 1.923 -4.825 -7.466 1.00 0.00 C ATOM 792 CG1 ILE A 54 1.286 -4.708 -8.841 1.00 0.00 C ATOM 793 CG2 ILE A 54 1.036 -4.169 -6.415 1.00 0.00 C ATOM 794 CD1 ILE A 54 0.051 -5.552 -8.993 1.00 0.00 C ATOM 0 H ILE A 54 4.053 -4.203 -5.537 1.00 0.00 H new ATOM 0 HA ILE A 54 3.776 -4.473 -8.452 1.00 0.00 H new ATOM 0 HB ILE A 54 2.024 -5.877 -7.198 1.00 0.00 H new ATOM 0 HG12 ILE A 54 1.031 -3.665 -9.029 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.014 -5.000 -9.598 1.00 0.00 H new ATOM 0 HG21 ILE A 54 0.052 -4.638 -6.425 1.00 0.00 H new ATOM 0 HG22 ILE A 54 1.486 -4.293 -5.430 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.934 -3.107 -6.637 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -0.356 -5.424 -9.996 1.00 0.00 H new ATOM 0 HD12 ILE A 54 0.305 -6.600 -8.835 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -0.693 -5.244 -8.258 1.00 0.00 H new ATOM 806 N ALA A 55 3.281 -1.958 -8.464 1.00 0.00 N ATOM 807 CA ALA A 55 3.240 -0.508 -8.385 1.00 0.00 C ATOM 808 C ALA A 55 1.801 -0.009 -8.380 1.00 0.00 C ATOM 809 O ALA A 55 0.990 -0.412 -9.214 1.00 0.00 O ATOM 810 CB ALA A 55 4.025 0.131 -9.516 1.00 0.00 C ATOM 0 H ALA A 55 3.333 -2.340 -9.408 1.00 0.00 H new ATOM 0 HA ALA A 55 3.711 -0.214 -7.447 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.974 1.216 -9.427 1.00 0.00 H new ATOM 0 HB2 ALA A 55 5.066 -0.189 -9.463 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.600 -0.175 -10.472 1.00 0.00 H new ATOM 816 N ALA A 56 1.492 0.855 -7.425 1.00 0.00 N ATOM 817 CA ALA A 56 0.161 1.425 -7.299 1.00 0.00 C ATOM 818 C ALA A 56 -0.065 2.503 -8.354 1.00 0.00 C ATOM 819 O ALA A 56 0.885 3.130 -8.829 1.00 0.00 O ATOM 820 CB ALA A 56 -0.027 1.987 -5.898 1.00 0.00 C ATOM 0 H ALA A 56 2.154 1.179 -6.719 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.578 0.640 -7.463 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -1.026 2.413 -5.808 1.00 0.00 H new ATOM 0 HB2 ALA A 56 0.094 1.188 -5.166 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.716 2.763 -5.714 1.00 0.00 H new ATOM 826 N SER A 57 -1.320 2.721 -8.718 1.00 0.00 N ATOM 827 CA SER A 57 -1.646 3.665 -9.764 1.00 0.00 C ATOM 828 C SER A 57 -2.225 4.936 -9.165 1.00 0.00 C ATOM 829 O SER A 57 -3.126 4.898 -8.323 1.00 0.00 O ATOM 830 CB SER A 57 -2.636 3.046 -10.746 1.00 0.00 C ATOM 831 OG SER A 57 -2.180 1.776 -11.180 1.00 0.00 O ATOM 0 H SER A 57 -2.126 2.255 -8.301 1.00 0.00 H new ATOM 0 HA SER A 57 -0.732 3.917 -10.302 1.00 0.00 H new ATOM 0 HB2 SER A 57 -3.612 2.945 -10.272 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.765 3.705 -11.605 1.00 0.00 H new ATOM 0 HG SER A 57 -2.828 1.393 -11.808 1.00 0.00 H new ATOM 837 N PHE A 58 -1.687 6.054 -9.596 1.00 0.00 N ATOM 838 CA PHE A 58 -2.124 7.347 -9.125 1.00 0.00 C ATOM 839 C PHE A 58 -3.501 7.672 -9.674 1.00 0.00 C ATOM 840 O PHE A 58 -3.819 7.341 -10.818 1.00 0.00 O ATOM 841 CB PHE A 58 -1.179 8.467 -9.563 1.00 0.00 C ATOM 842 CG PHE A 58 0.266 8.315 -9.156 1.00 0.00 C ATOM 843 CD1 PHE A 58 1.020 7.237 -9.590 1.00 0.00 C ATOM 844 CD2 PHE A 58 0.874 9.271 -8.357 1.00 0.00 C ATOM 845 CE1 PHE A 58 2.347 7.109 -9.233 1.00 0.00 C ATOM 846 CE2 PHE A 58 2.204 9.152 -8.002 1.00 0.00 C ATOM 847 CZ PHE A 58 2.940 8.068 -8.439 1.00 0.00 C ATOM 0 H PHE A 58 -0.934 6.092 -10.283 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.139 7.290 -8.037 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -1.223 8.547 -10.649 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.552 9.408 -9.159 1.00 0.00 H new ATOM 0 HD1 PHE A 58 0.563 6.486 -10.217 1.00 0.00 H new ATOM 0 HD2 PHE A 58 0.302 10.118 -8.008 1.00 0.00 H new ATOM 0 HE1 PHE A 58 2.920 6.260 -9.575 1.00 0.00 H new ATOM 0 HE2 PHE A 58 2.668 9.906 -7.383 1.00 0.00 H new ATOM 0 HZ PHE A 58 3.979 7.972 -8.159 1.00 0.00 H new ATOM 857 N SER A 59 -4.310 8.318 -8.861 1.00 0.00 N ATOM 858 CA SER A 59 -5.584 8.842 -9.313 1.00 0.00 C ATOM 859 C SER A 59 -5.555 10.361 -9.240 1.00 0.00 C ATOM 860 O SER A 59 -6.090 11.051 -10.108 1.00 0.00 O ATOM 861 CB SER A 59 -6.724 8.273 -8.471 1.00 0.00 C ATOM 862 OG SER A 59 -6.702 6.856 -8.507 1.00 0.00 O ATOM 0 H SER A 59 -4.107 8.494 -7.877 1.00 0.00 H new ATOM 0 HA SER A 59 -5.756 8.542 -10.347 1.00 0.00 H new ATOM 0 HB2 SER A 59 -6.633 8.619 -7.441 1.00 0.00 H new ATOM 0 HB3 SER A 59 -7.680 8.638 -8.846 1.00 0.00 H new ATOM 0 HG SER A 59 -7.451 6.531 -9.049 1.00 0.00 H new ATOM 868 N GLY A 60 -4.917 10.875 -8.197 1.00 0.00 N ATOM 869 CA GLY A 60 -4.679 12.301 -8.104 1.00 0.00 C ATOM 870 C GLY A 60 -5.070 12.846 -6.755 1.00 0.00 C ATOM 871 O GLY A 60 -5.484 12.078 -5.886 1.00 0.00 O ATOM 0 H GLY A 60 -4.560 10.329 -7.413 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -3.624 12.506 -8.287 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -5.244 12.815 -8.882 1.00 0.00 H new ATOM 875 N PRO A 61 -4.937 14.160 -6.540 1.00 0.00 N ATOM 876 CA PRO A 61 -5.377 14.801 -5.302 1.00 0.00 C ATOM 877 C PRO A 61 -6.846 14.506 -5.017 1.00 0.00 C ATOM 878 O PRO A 61 -7.680 14.500 -5.926 1.00 0.00 O ATOM 879 CB PRO A 61 -5.159 16.292 -5.568 1.00 0.00 C ATOM 880 CG PRO A 61 -4.108 16.337 -6.619 1.00 0.00 C ATOM 881 CD PRO A 61 -4.336 15.125 -7.476 1.00 0.00 C ATOM 0 HA PRO A 61 -4.833 14.442 -4.429 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -6.077 16.773 -5.905 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -4.839 16.813 -4.665 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -4.182 17.252 -7.207 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -3.112 16.322 -6.177 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -5.000 15.342 -8.312 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -3.404 14.749 -7.899 1.00 0.00 H new ATOM 889 N ILE A 62 -7.152 14.241 -3.763 1.00 0.00 N ATOM 890 CA ILE A 62 -8.493 13.838 -3.379 1.00 0.00 C ATOM 891 C ILE A 62 -9.396 15.053 -3.231 1.00 0.00 C ATOM 892 O ILE A 62 -9.060 15.999 -2.518 1.00 0.00 O ATOM 893 CB ILE A 62 -8.480 13.049 -2.054 1.00 0.00 C ATOM 894 CG1 ILE A 62 -7.360 12.013 -2.067 1.00 0.00 C ATOM 895 CG2 ILE A 62 -9.821 12.367 -1.831 1.00 0.00 C ATOM 896 CD1 ILE A 62 -7.338 11.130 -0.849 1.00 0.00 C ATOM 0 H ILE A 62 -6.489 14.297 -2.989 1.00 0.00 H new ATOM 0 HA ILE A 62 -8.879 13.194 -4.169 1.00 0.00 H new ATOM 0 HB ILE A 62 -8.303 13.747 -1.236 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -7.464 11.389 -2.955 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -6.402 12.527 -2.149 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -9.796 11.814 -0.892 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -10.609 13.119 -1.789 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.020 11.679 -2.652 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -6.515 10.419 -0.930 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -7.202 11.743 0.042 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -8.280 10.587 -0.776 1.00 0.00 H new ATOM 908 N SER A 63 -10.529 15.034 -3.919 1.00 0.00 N ATOM 909 CA SER A 63 -11.491 16.121 -3.835 1.00 0.00 C ATOM 910 C SER A 63 -12.048 16.215 -2.421 1.00 0.00 C ATOM 911 O SER A 63 -12.681 15.282 -1.926 1.00 0.00 O ATOM 912 CB SER A 63 -12.623 15.901 -4.836 1.00 0.00 C ATOM 913 OG SER A 63 -12.115 15.691 -6.144 1.00 0.00 O ATOM 0 H SER A 63 -10.804 14.275 -4.543 1.00 0.00 H new ATOM 0 HA SER A 63 -10.988 17.057 -4.078 1.00 0.00 H new ATOM 0 HB2 SER A 63 -13.219 15.041 -4.532 1.00 0.00 H new ATOM 0 HB3 SER A 63 -13.287 16.766 -4.835 1.00 0.00 H new ATOM 0 HG SER A 63 -12.860 15.551 -6.766 1.00 0.00 H new ATOM 919 N GLY A 64 -11.792 17.339 -1.768 1.00 0.00 N ATOM 920 CA GLY A 64 -12.213 17.509 -0.394 1.00 0.00 C ATOM 921 C GLY A 64 -11.039 17.489 0.555 1.00 0.00 C ATOM 922 O GLY A 64 -11.140 17.931 1.697 1.00 0.00 O ATOM 0 H GLY A 64 -11.299 18.138 -2.167 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -12.748 18.453 -0.291 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -12.911 16.716 -0.126 1.00 0.00 H new ATOM 926 N SER A 65 -9.919 16.982 0.072 1.00 0.00 N ATOM 927 CA SER A 65 -8.710 16.893 0.871 1.00 0.00 C ATOM 928 C SER A 65 -7.539 17.521 0.119 1.00 0.00 C ATOM 929 O SER A 65 -7.674 17.916 -1.041 1.00 0.00 O ATOM 930 CB SER A 65 -8.415 15.425 1.190 1.00 0.00 C ATOM 931 OG SER A 65 -9.536 14.801 1.793 1.00 0.00 O ATOM 0 H SER A 65 -9.822 16.623 -0.878 1.00 0.00 H new ATOM 0 HA SER A 65 -8.852 17.437 1.805 1.00 0.00 H new ATOM 0 HB2 SER A 65 -8.149 14.897 0.275 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.555 15.360 1.857 1.00 0.00 H new ATOM 0 HG SER A 65 -9.237 14.035 2.326 1.00 0.00 H new ATOM 937 N ASN A 66 -6.402 17.634 0.787 1.00 0.00 N ATOM 938 CA ASN A 66 -5.202 18.185 0.165 1.00 0.00 C ATOM 939 C ASN A 66 -4.188 17.084 -0.099 1.00 0.00 C ATOM 940 O ASN A 66 -3.062 17.341 -0.523 1.00 0.00 O ATOM 941 CB ASN A 66 -4.580 19.268 1.054 1.00 0.00 C ATOM 942 CG ASN A 66 -4.063 18.733 2.381 1.00 0.00 C ATOM 943 OD1 ASN A 66 -4.611 17.786 2.949 1.00 0.00 O ATOM 944 ND2 ASN A 66 -3.002 19.342 2.884 1.00 0.00 N ATOM 0 H ASN A 66 -6.282 17.352 1.760 1.00 0.00 H new ATOM 0 HA ASN A 66 -5.488 18.636 -0.785 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -3.759 19.742 0.517 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -5.323 20.041 1.247 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -2.609 19.031 3.772 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -2.577 20.122 2.383 1.00 0.00 H new ATOM 951 N TYR A 67 -4.591 15.853 0.172 1.00 0.00 N ATOM 952 CA TYR A 67 -3.739 14.707 -0.054 1.00 0.00 C ATOM 953 C TYR A 67 -4.107 13.991 -1.339 1.00 0.00 C ATOM 954 O TYR A 67 -5.018 14.409 -2.053 1.00 0.00 O ATOM 955 CB TYR A 67 -3.803 13.764 1.110 1.00 0.00 C ATOM 956 CG TYR A 67 -3.233 14.370 2.359 1.00 0.00 C ATOM 957 CD1 TYR A 67 -2.188 15.286 2.329 1.00 0.00 C ATOM 958 CD2 TYR A 67 -3.746 14.010 3.559 1.00 0.00 C ATOM 959 CE1 TYR A 67 -1.682 15.821 3.498 1.00 0.00 C ATOM 960 CE2 TYR A 67 -3.256 14.528 4.745 1.00 0.00 C ATOM 961 CZ TYR A 67 -2.219 15.435 4.709 1.00 0.00 C ATOM 962 OH TYR A 67 -1.716 15.951 5.881 1.00 0.00 O ATOM 0 H TYR A 67 -5.510 15.626 0.551 1.00 0.00 H new ATOM 0 HA TYR A 67 -2.715 15.068 -0.154 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -4.840 13.477 1.287 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -3.257 12.852 0.868 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.766 15.583 1.380 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -4.559 13.300 3.592 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -0.873 16.535 3.464 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.682 14.224 5.690 1.00 0.00 H new ATOM 0 HH TYR A 67 -2.453 16.287 6.433 1.00 0.00 H new ATOM 972 N GLU A 68 -3.404 12.909 -1.622 1.00 0.00 N ATOM 973 CA GLU A 68 -3.517 12.252 -2.917 1.00 0.00 C ATOM 974 C GLU A 68 -4.144 10.862 -2.789 1.00 0.00 C ATOM 975 O GLU A 68 -4.270 10.325 -1.681 1.00 0.00 O ATOM 976 CB GLU A 68 -2.137 12.187 -3.570 1.00 0.00 C ATOM 977 CG GLU A 68 -2.165 11.957 -5.065 1.00 0.00 C ATOM 978 CD GLU A 68 -0.833 12.269 -5.705 1.00 0.00 C ATOM 979 OE1 GLU A 68 0.095 11.448 -5.581 1.00 0.00 O ATOM 980 OE2 GLU A 68 -0.689 13.366 -6.276 1.00 0.00 O ATOM 0 H GLU A 68 -2.750 12.466 -0.977 1.00 0.00 H new ATOM 0 HA GLU A 68 -4.183 12.835 -3.553 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -1.608 13.118 -3.367 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -1.564 11.387 -3.102 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -2.432 10.920 -5.268 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.939 12.579 -5.514 1.00 0.00 H new ATOM 987 N TYR A 69 -4.465 10.263 -3.931 1.00 0.00 N ATOM 988 CA TYR A 69 -5.381 9.144 -3.991 1.00 0.00 C ATOM 989 C TYR A 69 -4.842 8.125 -4.961 1.00 0.00 C ATOM 990 O TYR A 69 -4.511 8.444 -6.106 1.00 0.00 O ATOM 991 CB TYR A 69 -6.769 9.606 -4.438 1.00 0.00 C ATOM 992 CG TYR A 69 -7.854 8.585 -4.188 1.00 0.00 C ATOM 993 CD1 TYR A 69 -7.799 7.761 -3.075 1.00 0.00 C ATOM 994 CD2 TYR A 69 -8.938 8.460 -5.046 1.00 0.00 C ATOM 995 CE1 TYR A 69 -8.793 6.836 -2.818 1.00 0.00 C ATOM 996 CE2 TYR A 69 -9.935 7.535 -4.803 1.00 0.00 C ATOM 997 CZ TYR A 69 -9.859 6.725 -3.686 1.00 0.00 C ATOM 998 OH TYR A 69 -10.856 5.806 -3.434 1.00 0.00 O ATOM 0 H TYR A 69 -4.094 10.545 -4.838 1.00 0.00 H new ATOM 0 HA TYR A 69 -5.473 8.702 -2.999 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -7.022 10.528 -3.915 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -6.740 9.840 -5.502 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -6.963 7.843 -2.396 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -9.003 9.096 -5.917 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.735 6.205 -1.944 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -10.770 7.445 -5.483 1.00 0.00 H new ATOM 0 HH TYR A 69 -11.533 5.856 -4.141 1.00 0.00 H new ATOM 1008 N TRP A 70 -4.724 6.909 -4.487 1.00 0.00 N ATOM 1009 CA TRP A 70 -4.049 5.873 -5.216 1.00 0.00 C ATOM 1010 C TRP A 70 -4.968 4.676 -5.337 1.00 0.00 C ATOM 1011 O TRP A 70 -5.611 4.304 -4.371 1.00 0.00 O ATOM 1012 CB TRP A 70 -2.789 5.502 -4.444 1.00 0.00 C ATOM 1013 CG TRP A 70 -2.034 6.702 -3.948 1.00 0.00 C ATOM 1014 CD1 TRP A 70 -2.421 7.588 -3.008 1.00 0.00 C ATOM 1015 CD2 TRP A 70 -0.754 7.126 -4.359 1.00 0.00 C ATOM 1016 NE1 TRP A 70 -1.463 8.548 -2.856 1.00 0.00 N ATOM 1017 CE2 TRP A 70 -0.424 8.272 -3.657 1.00 0.00 C ATOM 1018 CE3 TRP A 70 0.115 6.635 -5.250 1.00 0.00 C ATOM 1019 CZ2 TRP A 70 0.776 8.937 -3.828 1.00 0.00 C ATOM 1020 CZ3 TRP A 70 1.324 7.261 -5.445 1.00 0.00 C ATOM 1021 CH2 TRP A 70 1.648 8.413 -4.724 1.00 0.00 C ATOM 0 H TRP A 70 -5.095 6.613 -3.584 1.00 0.00 H new ATOM 0 HA TRP A 70 -3.781 6.208 -6.218 1.00 0.00 H new ATOM 0 HB2 TRP A 70 -3.060 4.873 -3.596 1.00 0.00 H new ATOM 0 HB3 TRP A 70 -2.137 4.908 -5.085 1.00 0.00 H new ATOM 0 HD1 TRP A 70 -3.350 7.544 -2.458 1.00 0.00 H new ATOM 0 HE1 TRP A 70 -1.527 9.351 -2.230 1.00 0.00 H new ATOM 0 HE3 TRP A 70 -0.133 5.749 -5.815 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 1.008 9.834 -3.273 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 2.027 6.860 -6.160 1.00 0.00 H new ATOM 0 HH2 TRP A 70 2.603 8.891 -4.882 1.00 0.00 H new ATOM 1032 N THR A 71 -5.039 4.085 -6.510 1.00 0.00 N ATOM 1033 CA THR A 71 -5.926 2.954 -6.735 1.00 0.00 C ATOM 1034 C THR A 71 -5.203 1.876 -7.517 1.00 0.00 C ATOM 1035 O THR A 71 -4.246 2.169 -8.233 1.00 0.00 O ATOM 1036 CB THR A 71 -7.194 3.378 -7.511 1.00 0.00 C ATOM 1037 OG1 THR A 71 -6.836 4.158 -8.659 1.00 0.00 O ATOM 1038 CG2 THR A 71 -8.136 4.178 -6.629 1.00 0.00 C ATOM 0 H THR A 71 -4.495 4.366 -7.326 1.00 0.00 H new ATOM 0 HA THR A 71 -6.227 2.570 -5.760 1.00 0.00 H new ATOM 0 HB THR A 71 -7.706 2.471 -7.832 1.00 0.00 H new ATOM 0 HG1 THR A 71 -6.683 5.087 -8.388 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.018 4.462 -7.203 1.00 0.00 H new ATOM 0 HG22 THR A 71 -8.438 3.572 -5.775 1.00 0.00 H new ATOM 0 HG23 THR A 71 -7.629 5.076 -6.275 1.00 0.00 H new ATOM 1046 N PHE A 72 -5.619 0.626 -7.362 1.00 0.00 N ATOM 1047 CA PHE A 72 -5.087 -0.421 -8.209 1.00 0.00 C ATOM 1048 C PHE A 72 -5.999 -1.633 -8.262 1.00 0.00 C ATOM 1049 O PHE A 72 -6.897 -1.808 -7.437 1.00 0.00 O ATOM 1050 CB PHE A 72 -3.678 -0.854 -7.772 1.00 0.00 C ATOM 1051 CG PHE A 72 -3.649 -1.705 -6.530 1.00 0.00 C ATOM 1052 CD1 PHE A 72 -3.759 -1.126 -5.285 1.00 0.00 C ATOM 1053 CD2 PHE A 72 -3.505 -3.082 -6.614 1.00 0.00 C ATOM 1054 CE1 PHE A 72 -3.728 -1.896 -4.137 1.00 0.00 C ATOM 1055 CE2 PHE A 72 -3.474 -3.860 -5.472 1.00 0.00 C ATOM 1056 CZ PHE A 72 -3.586 -3.266 -4.232 1.00 0.00 C ATOM 0 H PHE A 72 -6.307 0.321 -6.673 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.025 0.007 -9.209 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -3.211 -1.406 -8.588 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -3.073 0.037 -7.602 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -3.871 -0.055 -5.204 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -3.416 -3.551 -7.583 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -3.815 -1.427 -3.168 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -3.362 -4.931 -5.550 1.00 0.00 H new ATOM 0 HZ PHE A 72 -3.563 -3.871 -3.338 1.00 0.00 H new ATOM 1066 N SER A 73 -5.741 -2.462 -9.250 1.00 0.00 N ATOM 1067 CA SER A 73 -6.396 -3.741 -9.393 1.00 0.00 C ATOM 1068 C SER A 73 -5.379 -4.745 -9.901 1.00 0.00 C ATOM 1069 O SER A 73 -4.550 -4.417 -10.755 1.00 0.00 O ATOM 1070 CB SER A 73 -7.580 -3.649 -10.350 1.00 0.00 C ATOM 1071 OG SER A 73 -7.210 -3.018 -11.566 1.00 0.00 O ATOM 0 H SER A 73 -5.062 -2.263 -9.985 1.00 0.00 H new ATOM 0 HA SER A 73 -6.786 -4.059 -8.426 1.00 0.00 H new ATOM 0 HB2 SER A 73 -7.962 -4.649 -10.558 1.00 0.00 H new ATOM 0 HB3 SER A 73 -8.389 -3.091 -9.879 1.00 0.00 H new ATOM 0 HG SER A 73 -7.987 -2.974 -12.161 1.00 0.00 H new ATOM 1077 N ALA A 74 -5.421 -5.952 -9.375 1.00 0.00 N ATOM 1078 CA ALA A 74 -4.397 -6.927 -9.690 1.00 0.00 C ATOM 1079 C ALA A 74 -4.912 -8.355 -9.672 1.00 0.00 C ATOM 1080 O ALA A 74 -5.617 -8.770 -8.748 1.00 0.00 O ATOM 1081 CB ALA A 74 -3.259 -6.786 -8.707 1.00 0.00 C ATOM 0 H ALA A 74 -6.144 -6.279 -8.735 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.059 -6.726 -10.707 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -2.485 -7.518 -8.939 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -2.841 -5.782 -8.776 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -3.628 -6.957 -7.696 1.00 0.00 H new ATOM 1087 N SER A 75 -4.556 -9.101 -10.700 1.00 0.00 N ATOM 1088 CA SER A 75 -4.752 -10.533 -10.695 1.00 0.00 C ATOM 1089 C SER A 75 -3.597 -11.172 -9.932 1.00 0.00 C ATOM 1090 O SER A 75 -2.491 -11.319 -10.461 1.00 0.00 O ATOM 1091 CB SER A 75 -4.815 -11.068 -12.131 1.00 0.00 C ATOM 1092 OG SER A 75 -5.076 -12.460 -12.155 1.00 0.00 O ATOM 0 H SER A 75 -4.128 -8.735 -11.551 1.00 0.00 H new ATOM 0 HA SER A 75 -5.696 -10.780 -10.208 1.00 0.00 H new ATOM 0 HB2 SER A 75 -5.593 -10.541 -12.683 1.00 0.00 H new ATOM 0 HB3 SER A 75 -3.872 -10.865 -12.638 1.00 0.00 H new ATOM 0 HG SER A 75 -5.112 -12.770 -13.084 1.00 0.00 H new ATOM 1098 N VAL A 76 -3.842 -11.524 -8.682 1.00 0.00 N ATOM 1099 CA VAL A 76 -2.790 -12.073 -7.846 1.00 0.00 C ATOM 1100 C VAL A 76 -2.774 -13.588 -7.935 1.00 0.00 C ATOM 1101 O VAL A 76 -3.800 -14.225 -8.169 1.00 0.00 O ATOM 1102 CB VAL A 76 -2.917 -11.634 -6.369 1.00 0.00 C ATOM 1103 CG1 VAL A 76 -2.887 -10.124 -6.257 1.00 0.00 C ATOM 1104 CG2 VAL A 76 -4.182 -12.171 -5.735 1.00 0.00 C ATOM 0 H VAL A 76 -4.751 -11.441 -8.227 1.00 0.00 H new ATOM 0 HA VAL A 76 -1.848 -11.676 -8.225 1.00 0.00 H new ATOM 0 HB VAL A 76 -2.065 -12.050 -5.832 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -2.978 -9.835 -5.210 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.945 -9.748 -6.657 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -3.716 -9.701 -6.823 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -4.237 -11.842 -4.697 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.049 -11.798 -6.280 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -4.172 -13.260 -5.770 1.00 0.00 H new ATOM 1114 N LYS A 77 -1.599 -14.153 -7.746 1.00 0.00 N ATOM 1115 CA LYS A 77 -1.408 -15.588 -7.849 1.00 0.00 C ATOM 1116 C LYS A 77 -1.412 -16.209 -6.461 1.00 0.00 C ATOM 1117 O LYS A 77 -0.653 -17.135 -6.172 1.00 0.00 O ATOM 1118 CB LYS A 77 -0.095 -15.899 -8.578 1.00 0.00 C ATOM 1119 CG LYS A 77 -0.184 -15.826 -10.102 1.00 0.00 C ATOM 1120 CD LYS A 77 -0.550 -14.436 -10.609 1.00 0.00 C ATOM 1121 CE LYS A 77 0.504 -13.399 -10.255 1.00 0.00 C ATOM 1122 NZ LYS A 77 0.172 -12.064 -10.818 1.00 0.00 N ATOM 0 H LYS A 77 -0.751 -13.634 -7.517 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.227 -16.017 -8.426 1.00 0.00 H new ATOM 0 HB2 LYS A 77 0.669 -15.200 -8.237 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.236 -16.898 -8.293 1.00 0.00 H new ATOM 0 HG2 LYS A 77 0.773 -16.124 -10.531 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.927 -16.542 -10.452 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -0.677 -14.468 -11.691 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.508 -14.137 -10.184 1.00 0.00 H new ATOM 0 HE2 LYS A 77 0.592 -13.325 -9.171 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.474 -13.722 -10.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.600 -11.322 -10.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.544 -11.993 -11.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -0.861 -11.941 -10.834 1.00 0.00 H new ATOM 1136 N GLY A 78 -2.270 -15.675 -5.607 1.00 0.00 N ATOM 1137 CA GLY A 78 -2.352 -16.142 -4.242 1.00 0.00 C ATOM 1138 C GLY A 78 -1.619 -15.219 -3.294 1.00 0.00 C ATOM 1139 O GLY A 78 -0.402 -15.052 -3.399 1.00 0.00 O ATOM 0 H GLY A 78 -2.916 -14.920 -5.838 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -3.398 -16.215 -3.944 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.930 -17.145 -4.174 1.00 0.00 H new ATOM 1143 N ILE A 79 -2.351 -14.603 -2.382 1.00 0.00 N ATOM 1144 CA ILE A 79 -1.753 -13.678 -1.431 1.00 0.00 C ATOM 1145 C ILE A 79 -2.119 -14.069 -0.004 1.00 0.00 C ATOM 1146 O ILE A 79 -3.155 -14.695 0.240 1.00 0.00 O ATOM 1147 CB ILE A 79 -2.179 -12.221 -1.723 1.00 0.00 C ATOM 1148 CG1 ILE A 79 -1.458 -11.235 -0.804 1.00 0.00 C ATOM 1149 CG2 ILE A 79 -3.683 -12.056 -1.597 1.00 0.00 C ATOM 1150 CD1 ILE A 79 -1.993 -9.831 -0.897 1.00 0.00 C ATOM 0 H ILE A 79 -3.358 -14.725 -2.279 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.670 -13.737 -1.541 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.892 -11.999 -2.751 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -1.543 -11.581 0.226 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -0.396 -11.229 -1.051 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.954 -11.022 -1.808 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -4.182 -12.714 -2.308 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.994 -12.314 -0.584 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.436 -9.184 -0.219 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.883 -9.467 -1.918 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.047 -9.824 -0.621 1.00 0.00 H new ATOM 1162 N LYS A 80 -1.260 -13.713 0.931 1.00 0.00 N ATOM 1163 CA LYS A 80 -1.428 -14.122 2.315 1.00 0.00 C ATOM 1164 C LYS A 80 -1.274 -12.951 3.287 1.00 0.00 C ATOM 1165 O LYS A 80 -2.047 -12.829 4.231 1.00 0.00 O ATOM 1166 CB LYS A 80 -0.423 -15.225 2.651 1.00 0.00 C ATOM 1167 CG LYS A 80 -0.543 -15.755 4.066 1.00 0.00 C ATOM 1168 CD LYS A 80 -1.920 -16.339 4.342 1.00 0.00 C ATOM 1169 CE LYS A 80 -2.190 -17.571 3.494 1.00 0.00 C ATOM 1170 NZ LYS A 80 -3.547 -18.127 3.738 1.00 0.00 N ATOM 0 H LYS A 80 -0.435 -13.139 0.758 1.00 0.00 H new ATOM 0 HA LYS A 80 -2.444 -14.501 2.428 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -0.557 -16.050 1.952 1.00 0.00 H new ATOM 0 HB3 LYS A 80 0.586 -14.841 2.502 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.215 -16.521 4.232 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.343 -14.950 4.773 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -2.000 -16.599 5.397 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -2.682 -15.585 4.141 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.087 -17.315 2.439 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.441 -18.333 3.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.609 -19.083 3.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -3.724 -18.174 4.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -4.259 -17.514 3.291 1.00 0.00 H new ATOM 1184 N GLU A 81 -0.289 -12.091 3.061 1.00 0.00 N ATOM 1185 CA GLU A 81 -0.016 -10.985 3.983 1.00 0.00 C ATOM 1186 C GLU A 81 0.705 -9.878 3.245 1.00 0.00 C ATOM 1187 O GLU A 81 1.050 -10.076 2.097 1.00 0.00 O ATOM 1188 CB GLU A 81 0.831 -11.482 5.148 1.00 0.00 C ATOM 1189 CG GLU A 81 2.263 -11.818 4.777 1.00 0.00 C ATOM 1190 CD GLU A 81 3.081 -12.227 5.980 1.00 0.00 C ATOM 1191 OE1 GLU A 81 3.034 -13.411 6.358 1.00 0.00 O ATOM 1192 OE2 GLU A 81 3.769 -11.363 6.558 1.00 0.00 O ATOM 0 H GLU A 81 0.333 -12.133 2.254 1.00 0.00 H new ATOM 0 HA GLU A 81 -0.956 -10.597 4.374 1.00 0.00 H new ATOM 0 HB2 GLU A 81 0.839 -10.720 5.928 1.00 0.00 H new ATOM 0 HB3 GLU A 81 0.360 -12.368 5.573 1.00 0.00 H new ATOM 0 HG2 GLU A 81 2.267 -12.625 4.045 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.726 -10.954 4.301 1.00 0.00 H new ATOM 1199 N PHE A 82 0.909 -8.706 3.856 1.00 0.00 N ATOM 1200 CA PHE A 82 1.622 -7.642 3.151 1.00 0.00 C ATOM 1201 C PHE A 82 1.929 -6.433 4.016 1.00 0.00 C ATOM 1202 O PHE A 82 1.554 -6.358 5.187 1.00 0.00 O ATOM 1203 CB PHE A 82 0.808 -7.168 1.946 1.00 0.00 C ATOM 1204 CG PHE A 82 -0.536 -6.572 2.277 1.00 0.00 C ATOM 1205 CD1 PHE A 82 -1.661 -7.374 2.376 1.00 0.00 C ATOM 1206 CD2 PHE A 82 -0.674 -5.206 2.473 1.00 0.00 C ATOM 1207 CE1 PHE A 82 -2.894 -6.828 2.669 1.00 0.00 C ATOM 1208 CE2 PHE A 82 -1.905 -4.655 2.764 1.00 0.00 C ATOM 1209 CZ PHE A 82 -3.016 -5.466 2.863 1.00 0.00 C ATOM 0 H PHE A 82 0.603 -8.477 4.802 1.00 0.00 H new ATOM 0 HA PHE A 82 2.571 -8.082 2.844 1.00 0.00 H new ATOM 0 HB2 PHE A 82 1.393 -6.427 1.401 1.00 0.00 H new ATOM 0 HB3 PHE A 82 0.658 -8.013 1.274 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.572 -8.439 2.222 1.00 0.00 H new ATOM 0 HD2 PHE A 82 0.193 -4.566 2.397 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -3.763 -7.465 2.747 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -1.998 -3.590 2.914 1.00 0.00 H new ATOM 0 HZ PHE A 82 -3.980 -5.037 3.092 1.00 0.00 H new ATOM 1219 N TYR A 83 2.610 -5.488 3.381 1.00 0.00 N ATOM 1220 CA TYR A 83 2.735 -4.130 3.868 1.00 0.00 C ATOM 1221 C TYR A 83 3.014 -3.229 2.666 1.00 0.00 C ATOM 1222 O TYR A 83 3.749 -3.612 1.759 1.00 0.00 O ATOM 1223 CB TYR A 83 3.803 -4.000 4.981 1.00 0.00 C ATOM 1224 CG TYR A 83 5.270 -4.211 4.613 1.00 0.00 C ATOM 1225 CD1 TYR A 83 5.683 -4.859 3.449 1.00 0.00 C ATOM 1226 CD2 TYR A 83 6.258 -3.753 5.480 1.00 0.00 C ATOM 1227 CE1 TYR A 83 7.025 -5.035 3.170 1.00 0.00 C ATOM 1228 CE2 TYR A 83 7.599 -3.927 5.203 1.00 0.00 C ATOM 1229 CZ TYR A 83 7.975 -4.569 4.047 1.00 0.00 C ATOM 1230 OH TYR A 83 9.310 -4.751 3.770 1.00 0.00 O ATOM 0 H TYR A 83 3.097 -5.651 2.500 1.00 0.00 H new ATOM 0 HA TYR A 83 1.806 -3.818 4.345 1.00 0.00 H new ATOM 0 HB2 TYR A 83 3.710 -3.004 5.414 1.00 0.00 H new ATOM 0 HB3 TYR A 83 3.552 -4.714 5.766 1.00 0.00 H new ATOM 0 HD1 TYR A 83 4.943 -5.229 2.755 1.00 0.00 H new ATOM 0 HD2 TYR A 83 5.969 -3.250 6.391 1.00 0.00 H new ATOM 0 HE1 TYR A 83 7.327 -5.538 2.263 1.00 0.00 H new ATOM 0 HE2 TYR A 83 8.348 -3.561 5.890 1.00 0.00 H new ATOM 0 HH TYR A 83 9.849 -4.362 4.490 1.00 0.00 H new ATOM 1240 N ILE A 84 2.372 -2.075 2.598 1.00 0.00 N ATOM 1241 CA ILE A 84 2.527 -1.218 1.428 1.00 0.00 C ATOM 1242 C ILE A 84 3.668 -0.247 1.649 1.00 0.00 C ATOM 1243 O ILE A 84 3.816 0.303 2.735 1.00 0.00 O ATOM 1244 CB ILE A 84 1.242 -0.419 1.097 1.00 0.00 C ATOM 1245 CG1 ILE A 84 0.010 -1.328 1.105 1.00 0.00 C ATOM 1246 CG2 ILE A 84 1.377 0.269 -0.254 1.00 0.00 C ATOM 1247 CD1 ILE A 84 0.147 -2.547 0.224 1.00 0.00 C ATOM 0 H ILE A 84 1.750 -1.713 3.321 1.00 0.00 H new ATOM 0 HA ILE A 84 2.737 -1.873 0.583 1.00 0.00 H new ATOM 0 HB ILE A 84 1.111 0.340 1.869 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.186 -1.650 2.128 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -0.857 -0.752 0.781 1.00 0.00 H new ATOM 0 HG21 ILE A 84 0.466 0.826 -0.471 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.224 0.954 -0.230 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.538 -0.480 -1.029 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -0.765 -3.142 0.282 1.00 0.00 H new ATOM 0 HD12 ILE A 84 0.311 -2.234 -0.807 1.00 0.00 H new ATOM 0 HD13 ILE A 84 0.993 -3.146 0.561 1.00 0.00 H new ATOM 1259 N LYS A 85 4.492 -0.047 0.637 1.00 0.00 N ATOM 1260 CA LYS A 85 5.568 0.875 0.749 1.00 0.00 C ATOM 1261 C LYS A 85 5.177 2.227 0.256 1.00 0.00 C ATOM 1262 O LYS A 85 4.659 2.396 -0.853 1.00 0.00 O ATOM 1263 CB LYS A 85 6.766 0.414 -0.030 1.00 0.00 C ATOM 1264 CG LYS A 85 7.531 -0.673 0.656 1.00 0.00 C ATOM 1265 CD LYS A 85 8.910 -0.747 0.070 1.00 0.00 C ATOM 1266 CE LYS A 85 8.904 -1.217 -1.375 1.00 0.00 C ATOM 1267 NZ LYS A 85 10.225 -1.012 -2.021 1.00 0.00 N ATOM 0 H LYS A 85 4.423 -0.518 -0.265 1.00 0.00 H new ATOM 0 HA LYS A 85 5.820 0.931 1.808 1.00 0.00 H new ATOM 0 HB2 LYS A 85 6.441 0.059 -1.008 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.428 1.263 -0.202 1.00 0.00 H new ATOM 0 HG2 LYS A 85 7.587 -0.475 1.726 1.00 0.00 H new ATOM 0 HG3 LYS A 85 7.019 -1.628 0.535 1.00 0.00 H new ATOM 0 HD2 LYS A 85 9.379 0.235 0.127 1.00 0.00 H new ATOM 0 HD3 LYS A 85 9.519 -1.426 0.667 1.00 0.00 H new ATOM 0 HE2 LYS A 85 8.639 -2.274 -1.414 1.00 0.00 H new ATOM 0 HE3 LYS A 85 8.138 -0.676 -1.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 10.118 -1.066 -3.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 10.598 -0.077 -1.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 10.885 -1.750 -1.702 1.00 0.00 H new ATOM 1281 N TYR A 86 5.451 3.179 1.088 1.00 0.00 N ATOM 1282 CA TYR A 86 5.368 4.556 0.690 1.00 0.00 C ATOM 1283 C TYR A 86 6.763 5.017 0.355 1.00 0.00 C ATOM 1284 O TYR A 86 7.562 5.327 1.242 1.00 0.00 O ATOM 1285 CB TYR A 86 4.767 5.434 1.783 1.00 0.00 C ATOM 1286 CG TYR A 86 4.675 6.884 1.377 1.00 0.00 C ATOM 1287 CD1 TYR A 86 4.158 7.239 0.142 1.00 0.00 C ATOM 1288 CD2 TYR A 86 5.109 7.893 2.219 1.00 0.00 C ATOM 1289 CE1 TYR A 86 4.080 8.556 -0.246 1.00 0.00 C ATOM 1290 CE2 TYR A 86 5.033 9.220 1.840 1.00 0.00 C ATOM 1291 CZ TYR A 86 4.515 9.547 0.606 1.00 0.00 C ATOM 1292 OH TYR A 86 4.441 10.869 0.220 1.00 0.00 O ATOM 0 H TYR A 86 5.737 3.031 2.056 1.00 0.00 H new ATOM 0 HA TYR A 86 4.708 4.643 -0.173 1.00 0.00 H new ATOM 0 HB2 TYR A 86 3.772 5.067 2.033 1.00 0.00 H new ATOM 0 HB3 TYR A 86 5.373 5.351 2.685 1.00 0.00 H new ATOM 0 HD1 TYR A 86 3.810 6.467 -0.529 1.00 0.00 H new ATOM 0 HD2 TYR A 86 5.514 7.639 3.188 1.00 0.00 H new ATOM 0 HE1 TYR A 86 3.679 8.812 -1.215 1.00 0.00 H new ATOM 0 HE2 TYR A 86 5.378 9.996 2.507 1.00 0.00 H new ATOM 0 HH TYR A 86 3.564 11.232 0.463 1.00 0.00 H new ATOM 1302 N GLU A 87 7.063 5.041 -0.923 1.00 0.00 N ATOM 1303 CA GLU A 87 8.376 5.394 -1.372 1.00 0.00 C ATOM 1304 C GLU A 87 8.256 6.652 -2.197 1.00 0.00 C ATOM 1305 O GLU A 87 7.322 6.810 -2.974 1.00 0.00 O ATOM 1306 CB GLU A 87 8.989 4.245 -2.179 1.00 0.00 C ATOM 1307 CG GLU A 87 10.442 3.968 -1.843 1.00 0.00 C ATOM 1308 CD GLU A 87 10.980 2.736 -2.549 1.00 0.00 C ATOM 1309 OE1 GLU A 87 10.610 1.609 -2.158 1.00 0.00 O ATOM 1310 OE2 GLU A 87 11.772 2.892 -3.503 1.00 0.00 O ATOM 0 H GLU A 87 6.405 4.817 -1.670 1.00 0.00 H new ATOM 0 HA GLU A 87 9.040 5.575 -0.527 1.00 0.00 H new ATOM 0 HB2 GLU A 87 8.407 3.340 -2.005 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.909 4.476 -3.241 1.00 0.00 H new ATOM 0 HG2 GLU A 87 11.046 4.833 -2.118 1.00 0.00 H new ATOM 0 HG3 GLU A 87 10.544 3.838 -0.766 1.00 0.00 H new ATOM 1317 N VAL A 88 9.140 7.579 -1.968 1.00 0.00 N ATOM 1318 CA VAL A 88 9.117 8.828 -2.664 1.00 0.00 C ATOM 1319 C VAL A 88 10.551 9.301 -2.848 1.00 0.00 C ATOM 1320 O VAL A 88 11.448 8.794 -2.178 1.00 0.00 O ATOM 1321 CB VAL A 88 8.228 9.821 -1.870 1.00 0.00 C ATOM 1322 CG1 VAL A 88 8.376 9.618 -0.368 1.00 0.00 C ATOM 1323 CG2 VAL A 88 8.516 11.256 -2.215 1.00 0.00 C ATOM 0 H VAL A 88 9.898 7.488 -1.292 1.00 0.00 H new ATOM 0 HA VAL A 88 8.680 8.740 -3.659 1.00 0.00 H new ATOM 0 HB VAL A 88 7.200 9.605 -2.162 1.00 0.00 H new ATOM 0 HG11 VAL A 88 7.740 10.329 0.160 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.079 8.602 -0.107 1.00 0.00 H new ATOM 0 HG13 VAL A 88 9.415 9.777 -0.080 1.00 0.00 H new ATOM 0 HG21 VAL A 88 7.866 11.908 -1.631 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.557 11.483 -1.987 1.00 0.00 H new ATOM 0 HG23 VAL A 88 8.333 11.419 -3.277 1.00 0.00 H new ATOM 1333 N SER A 89 10.774 10.242 -3.764 1.00 0.00 N ATOM 1334 CA SER A 89 12.116 10.702 -4.116 1.00 0.00 C ATOM 1335 C SER A 89 12.710 11.557 -2.991 1.00 0.00 C ATOM 1336 O SER A 89 13.467 12.503 -3.218 1.00 0.00 O ATOM 1337 CB SER A 89 12.065 11.471 -5.433 1.00 0.00 C ATOM 1338 OG SER A 89 13.361 11.681 -5.969 1.00 0.00 O ATOM 0 H SER A 89 10.029 10.707 -4.283 1.00 0.00 H new ATOM 0 HA SER A 89 12.768 9.838 -4.245 1.00 0.00 H new ATOM 0 HB2 SER A 89 11.459 10.921 -6.152 1.00 0.00 H new ATOM 0 HB3 SER A 89 11.577 12.433 -5.274 1.00 0.00 H new ATOM 0 HG SER A 89 13.943 12.062 -5.279 1.00 0.00 H new ATOM 1344 N GLY A 90 12.335 11.207 -1.780 1.00 0.00 N ATOM 1345 CA GLY A 90 12.861 11.833 -0.600 1.00 0.00 C ATOM 1346 C GLY A 90 12.946 10.853 0.553 1.00 0.00 C ATOM 1347 O GLY A 90 14.008 10.675 1.147 1.00 0.00 O ATOM 0 H GLY A 90 11.651 10.474 -1.592 1.00 0.00 H new ATOM 0 HA2 GLY A 90 13.851 12.236 -0.811 1.00 0.00 H new ATOM 0 HA3 GLY A 90 12.227 12.674 -0.319 1.00 0.00 H new ATOM 1351 N LYS A 91 11.828 10.195 0.859 1.00 0.00 N ATOM 1352 CA LYS A 91 11.764 9.290 2.002 1.00 0.00 C ATOM 1353 C LYS A 91 11.141 7.947 1.666 1.00 0.00 C ATOM 1354 O LYS A 91 10.819 7.648 0.514 1.00 0.00 O ATOM 1355 CB LYS A 91 10.940 9.913 3.113 1.00 0.00 C ATOM 1356 CG LYS A 91 11.595 11.096 3.772 1.00 0.00 C ATOM 1357 CD LYS A 91 12.976 10.758 4.306 1.00 0.00 C ATOM 1358 CE LYS A 91 13.729 12.008 4.725 1.00 0.00 C ATOM 1359 NZ LYS A 91 12.994 12.791 5.755 1.00 0.00 N ATOM 0 H LYS A 91 10.958 10.272 0.332 1.00 0.00 H new ATOM 0 HA LYS A 91 12.796 9.124 2.311 1.00 0.00 H new ATOM 0 HB2 LYS A 91 9.977 10.223 2.707 1.00 0.00 H new ATOM 0 HB3 LYS A 91 10.737 9.155 3.870 1.00 0.00 H new ATOM 0 HG2 LYS A 91 11.674 11.913 3.055 1.00 0.00 H new ATOM 0 HG3 LYS A 91 10.967 11.449 4.590 1.00 0.00 H new ATOM 0 HD2 LYS A 91 12.884 10.084 5.158 1.00 0.00 H new ATOM 0 HD3 LYS A 91 13.544 10.228 3.541 1.00 0.00 H new ATOM 0 HE2 LYS A 91 14.707 11.727 5.115 1.00 0.00 H new ATOM 0 HE3 LYS A 91 13.903 12.635 3.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 13.602 13.557 6.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 12.134 13.197 5.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 12.731 12.166 6.544 1.00 0.00 H new ATOM 1373 N THR A 92 10.993 7.142 2.706 1.00 0.00 N ATOM 1374 CA THR A 92 10.333 5.841 2.609 1.00 0.00 C ATOM 1375 C THR A 92 9.689 5.468 3.942 1.00 0.00 C ATOM 1376 O THR A 92 10.246 5.732 5.010 1.00 0.00 O ATOM 1377 CB THR A 92 11.299 4.713 2.195 1.00 0.00 C ATOM 1378 OG1 THR A 92 12.125 5.149 1.105 1.00 0.00 O ATOM 1379 CG2 THR A 92 10.535 3.457 1.774 1.00 0.00 C ATOM 0 H THR A 92 11.326 7.368 3.643 1.00 0.00 H new ATOM 0 HA THR A 92 9.574 5.941 1.833 1.00 0.00 H new ATOM 0 HB THR A 92 11.919 4.472 3.058 1.00 0.00 H new ATOM 0 HG1 THR A 92 12.737 4.427 0.849 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.243 2.679 1.488 1.00 0.00 H new ATOM 0 HG22 THR A 92 9.927 3.105 2.607 1.00 0.00 H new ATOM 0 HG23 THR A 92 9.890 3.690 0.927 1.00 0.00 H new ATOM 1387 N TYR A 93 8.523 4.854 3.866 1.00 0.00 N ATOM 1388 CA TYR A 93 7.819 4.355 5.044 1.00 0.00 C ATOM 1389 C TYR A 93 7.095 3.071 4.670 1.00 0.00 C ATOM 1390 O TYR A 93 7.279 2.553 3.567 1.00 0.00 O ATOM 1391 CB TYR A 93 6.804 5.373 5.587 1.00 0.00 C ATOM 1392 CG TYR A 93 7.329 6.784 5.684 1.00 0.00 C ATOM 1393 CD1 TYR A 93 8.001 7.243 6.810 1.00 0.00 C ATOM 1394 CD2 TYR A 93 7.149 7.647 4.629 1.00 0.00 C ATOM 1395 CE1 TYR A 93 8.478 8.541 6.869 1.00 0.00 C ATOM 1396 CE2 TYR A 93 7.620 8.942 4.673 1.00 0.00 C ATOM 1397 CZ TYR A 93 8.283 9.387 5.797 1.00 0.00 C ATOM 1398 OH TYR A 93 8.754 10.678 5.846 1.00 0.00 O ATOM 0 H TYR A 93 8.033 4.685 2.988 1.00 0.00 H new ATOM 0 HA TYR A 93 8.554 4.176 5.829 1.00 0.00 H new ATOM 0 HB2 TYR A 93 5.924 5.369 4.944 1.00 0.00 H new ATOM 0 HB3 TYR A 93 6.478 5.051 6.576 1.00 0.00 H new ATOM 0 HD1 TYR A 93 8.153 6.580 7.649 1.00 0.00 H new ATOM 0 HD2 TYR A 93 6.628 7.303 3.748 1.00 0.00 H new ATOM 0 HE1 TYR A 93 8.999 8.889 7.748 1.00 0.00 H new ATOM 0 HE2 TYR A 93 7.471 9.604 3.833 1.00 0.00 H new ATOM 0 HH TYR A 93 8.534 11.139 5.009 1.00 0.00 H new ATOM 1408 N TYR A 94 6.253 2.587 5.566 1.00 0.00 N ATOM 1409 CA TYR A 94 5.606 1.290 5.389 1.00 0.00 C ATOM 1410 C TYR A 94 4.224 1.260 6.038 1.00 0.00 C ATOM 1411 O TYR A 94 4.079 1.576 7.222 1.00 0.00 O ATOM 1412 CB TYR A 94 6.446 0.165 6.016 1.00 0.00 C ATOM 1413 CG TYR A 94 7.843 -0.009 5.453 1.00 0.00 C ATOM 1414 CD1 TYR A 94 8.046 -0.549 4.191 1.00 0.00 C ATOM 1415 CD2 TYR A 94 8.961 0.328 6.206 1.00 0.00 C ATOM 1416 CE1 TYR A 94 9.318 -0.747 3.692 1.00 0.00 C ATOM 1417 CE2 TYR A 94 10.238 0.141 5.712 1.00 0.00 C ATOM 1418 CZ TYR A 94 10.413 -0.399 4.455 1.00 0.00 C ATOM 1419 OH TYR A 94 11.684 -0.594 3.962 1.00 0.00 O ATOM 0 H TYR A 94 5.998 3.071 6.427 1.00 0.00 H new ATOM 0 HA TYR A 94 5.511 1.136 4.314 1.00 0.00 H new ATOM 0 HB2 TYR A 94 6.527 0.352 7.087 1.00 0.00 H new ATOM 0 HB3 TYR A 94 5.907 -0.775 5.896 1.00 0.00 H new ATOM 0 HD1 TYR A 94 7.192 -0.820 3.587 1.00 0.00 H new ATOM 0 HD2 TYR A 94 8.830 0.743 7.194 1.00 0.00 H new ATOM 0 HE1 TYR A 94 9.455 -1.172 2.709 1.00 0.00 H new ATOM 0 HE2 TYR A 94 11.096 0.417 6.308 1.00 0.00 H new ATOM 0 HH TYR A 94 12.341 -0.295 4.625 1.00 0.00 H new ATOM 1429 N ASP A 95 3.219 0.871 5.262 1.00 0.00 N ATOM 1430 CA ASP A 95 1.903 0.537 5.805 1.00 0.00 C ATOM 1431 C ASP A 95 1.946 -0.874 6.356 1.00 0.00 C ATOM 1432 O ASP A 95 1.517 -1.824 5.698 1.00 0.00 O ATOM 1433 CB ASP A 95 0.807 0.616 4.739 1.00 0.00 C ATOM 1434 CG ASP A 95 0.342 2.024 4.455 1.00 0.00 C ATOM 1435 OD1 ASP A 95 0.979 2.700 3.625 1.00 0.00 O ATOM 1436 OD2 ASP A 95 -0.678 2.442 5.049 1.00 0.00 O ATOM 0 H ASP A 95 3.289 0.778 4.249 1.00 0.00 H new ATOM 0 HA ASP A 95 1.667 1.260 6.586 1.00 0.00 H new ATOM 0 HB2 ASP A 95 1.177 0.171 3.815 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -0.046 0.018 5.061 1.00 0.00 H new ATOM 1441 N ASN A 96 2.500 -1.015 7.541 1.00 0.00 N ATOM 1442 CA ASN A 96 2.651 -2.317 8.153 1.00 0.00 C ATOM 1443 C ASN A 96 1.875 -2.373 9.456 1.00 0.00 C ATOM 1444 O ASN A 96 0.842 -3.036 9.534 1.00 0.00 O ATOM 1445 CB ASN A 96 4.143 -2.605 8.390 1.00 0.00 C ATOM 1446 CG ASN A 96 4.421 -3.964 9.018 1.00 0.00 C ATOM 1447 OD1 ASN A 96 3.644 -4.474 9.825 1.00 0.00 O ATOM 1448 ND2 ASN A 96 5.551 -4.552 8.666 1.00 0.00 N ATOM 0 H ASN A 96 2.855 -0.240 8.102 1.00 0.00 H new ATOM 0 HA ASN A 96 2.250 -3.081 7.487 1.00 0.00 H new ATOM 0 HB2 ASN A 96 4.670 -2.542 7.438 1.00 0.00 H new ATOM 0 HB3 ASN A 96 4.554 -1.828 9.034 1.00 0.00 H new ATOM 0 HD21 ASN A 96 5.802 -5.456 9.066 1.00 0.00 H new ATOM 0 HD22 ASN A 96 6.173 -4.102 7.994 1.00 0.00 H new ATOM 1455 N ASN A 97 2.388 -1.631 10.438 1.00 0.00 N ATOM 1456 CA ASN A 97 1.921 -1.621 11.829 1.00 0.00 C ATOM 1457 C ASN A 97 3.136 -1.340 12.689 1.00 0.00 C ATOM 1458 O ASN A 97 3.165 -0.411 13.494 1.00 0.00 O ATOM 1459 CB ASN A 97 1.315 -2.963 12.265 1.00 0.00 C ATOM 1460 CG ASN A 97 -0.182 -2.894 12.499 1.00 0.00 C ATOM 1461 OD1 ASN A 97 -0.641 -2.593 13.600 1.00 0.00 O ATOM 1462 ND2 ASN A 97 -0.952 -3.179 11.465 1.00 0.00 N ATOM 0 H ASN A 97 3.170 -0.995 10.283 1.00 0.00 H new ATOM 0 HA ASN A 97 1.137 -0.870 11.933 1.00 0.00 H new ATOM 0 HB2 ASN A 97 1.523 -3.713 11.502 1.00 0.00 H new ATOM 0 HB3 ASN A 97 1.805 -3.295 13.180 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -1.967 -3.154 11.563 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -0.532 -3.424 10.568 1.00 0.00 H new ATOM 1469 N ASN A 98 4.146 -2.166 12.453 1.00 0.00 N ATOM 1470 CA ASN A 98 5.464 -2.049 13.062 1.00 0.00 C ATOM 1471 C ASN A 98 6.272 -3.245 12.602 1.00 0.00 C ATOM 1472 O ASN A 98 7.332 -3.109 11.995 1.00 0.00 O ATOM 1473 CB ASN A 98 5.402 -2.033 14.594 1.00 0.00 C ATOM 1474 CG ASN A 98 6.744 -1.686 15.220 1.00 0.00 C ATOM 1475 OD1 ASN A 98 7.509 -0.891 14.675 1.00 0.00 O ATOM 1476 ND2 ASN A 98 7.044 -2.290 16.360 1.00 0.00 N ATOM 0 H ASN A 98 4.069 -2.958 11.815 1.00 0.00 H new ATOM 0 HA ASN A 98 5.916 -1.105 12.757 1.00 0.00 H new ATOM 0 HB2 ASN A 98 4.654 -1.309 14.918 1.00 0.00 H new ATOM 0 HB3 ASN A 98 5.077 -3.010 14.953 1.00 0.00 H new ATOM 0 HD21 ASN A 98 7.936 -2.102 16.817 1.00 0.00 H new ATOM 0 HD22 ASN A 98 6.383 -2.943 16.781 1.00 0.00 H new ATOM 1483 N SER A 99 5.724 -4.422 12.872 1.00 0.00 N ATOM 1484 CA SER A 99 6.281 -5.673 12.395 1.00 0.00 C ATOM 1485 C SER A 99 5.184 -6.738 12.355 1.00 0.00 C ATOM 1486 O SER A 99 5.391 -7.884 12.755 1.00 0.00 O ATOM 1487 CB SER A 99 7.434 -6.114 13.304 1.00 0.00 C ATOM 1488 OG SER A 99 7.035 -6.123 14.667 1.00 0.00 O ATOM 0 H SER A 99 4.878 -4.533 13.430 1.00 0.00 H new ATOM 0 HA SER A 99 6.674 -5.537 11.387 1.00 0.00 H new ATOM 0 HB2 SER A 99 7.770 -7.109 13.014 1.00 0.00 H new ATOM 0 HB3 SER A 99 8.282 -5.441 13.174 1.00 0.00 H new ATOM 0 HG SER A 99 7.787 -6.409 15.226 1.00 0.00 H new ATOM 1494 N ALA A 100 4.018 -6.347 11.859 1.00 0.00 N ATOM 1495 CA ALA A 100 2.837 -7.198 11.911 1.00 0.00 C ATOM 1496 C ALA A 100 2.491 -7.770 10.541 1.00 0.00 C ATOM 1497 O ALA A 100 2.354 -8.987 10.400 1.00 0.00 O ATOM 1498 CB ALA A 100 1.663 -6.405 12.459 1.00 0.00 C ATOM 0 H ALA A 100 3.864 -5.442 11.414 1.00 0.00 H new ATOM 0 HA ALA A 100 3.054 -8.038 12.570 1.00 0.00 H new ATOM 0 HB1 ALA A 100 0.780 -7.042 12.498 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.899 -6.051 13.463 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.466 -5.551 11.811 1.00 0.00 H new ATOM 1504 N ASN A 101 2.357 -6.889 9.541 1.00 0.00 N ATOM 1505 CA ASN A 101 1.931 -7.286 8.189 1.00 0.00 C ATOM 1506 C ASN A 101 0.450 -7.643 8.191 1.00 0.00 C ATOM 1507 O ASN A 101 -0.010 -8.430 9.018 1.00 0.00 O ATOM 1508 CB ASN A 101 2.762 -8.464 7.655 1.00 0.00 C ATOM 1509 CG ASN A 101 4.214 -8.101 7.388 1.00 0.00 C ATOM 1510 OD1 ASN A 101 4.752 -7.161 7.971 1.00 0.00 O ATOM 1511 ND2 ASN A 101 4.868 -8.868 6.535 1.00 0.00 N ATOM 0 H ASN A 101 2.538 -5.890 9.642 1.00 0.00 H new ATOM 0 HA ASN A 101 2.096 -6.438 7.525 1.00 0.00 H new ATOM 0 HB2 ASN A 101 2.725 -9.282 8.375 1.00 0.00 H new ATOM 0 HB3 ASN A 101 2.310 -8.830 6.733 1.00 0.00 H new ATOM 0 HD21 ASN A 101 5.853 -8.690 6.341 1.00 0.00 H new ATOM 0 HD22 ASN A 101 4.388 -9.639 6.070 1.00 0.00 H new ATOM 1518 N TYR A 102 -0.299 -7.050 7.274 1.00 0.00 N ATOM 1519 CA TYR A 102 -1.732 -7.290 7.196 1.00 0.00 C ATOM 1520 C TYR A 102 -2.004 -8.668 6.609 1.00 0.00 C ATOM 1521 O TYR A 102 -1.619 -8.949 5.475 1.00 0.00 O ATOM 1522 CB TYR A 102 -2.416 -6.229 6.333 1.00 0.00 C ATOM 1523 CG TYR A 102 -2.296 -4.814 6.859 1.00 0.00 C ATOM 1524 CD1 TYR A 102 -3.111 -4.361 7.890 1.00 0.00 C ATOM 1525 CD2 TYR A 102 -1.378 -3.928 6.311 1.00 0.00 C ATOM 1526 CE1 TYR A 102 -3.012 -3.064 8.360 1.00 0.00 C ATOM 1527 CE2 TYR A 102 -1.275 -2.630 6.774 1.00 0.00 C ATOM 1528 CZ TYR A 102 -2.092 -2.202 7.798 1.00 0.00 C ATOM 1529 OH TYR A 102 -1.997 -0.906 8.258 1.00 0.00 O ATOM 0 H TYR A 102 0.061 -6.400 6.575 1.00 0.00 H new ATOM 0 HA TYR A 102 -2.137 -7.238 8.207 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -1.991 -6.267 5.330 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -3.473 -6.480 6.242 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -3.833 -5.032 8.331 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -0.734 -4.259 5.510 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -3.651 -2.727 9.163 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -0.557 -1.953 6.335 1.00 0.00 H new ATOM 0 HH TYR A 102 -1.301 -0.432 7.758 1.00 0.00 H new ATOM 1539 N GLN A 103 -2.652 -9.525 7.382 1.00 0.00 N ATOM 1540 CA GLN A 103 -3.015 -10.852 6.904 1.00 0.00 C ATOM 1541 C GLN A 103 -4.252 -10.780 6.018 1.00 0.00 C ATOM 1542 O GLN A 103 -5.299 -10.270 6.428 1.00 0.00 O ATOM 1543 CB GLN A 103 -3.284 -11.818 8.065 1.00 0.00 C ATOM 1544 CG GLN A 103 -2.054 -12.533 8.604 1.00 0.00 C ATOM 1545 CD GLN A 103 -1.020 -11.595 9.169 1.00 0.00 C ATOM 1546 OE1 GLN A 103 -1.035 -11.267 10.354 1.00 0.00 O ATOM 1547 NE2 GLN A 103 -0.120 -11.159 8.318 1.00 0.00 N ATOM 0 H GLN A 103 -2.937 -9.327 8.341 1.00 0.00 H new ATOM 0 HA GLN A 103 -2.170 -11.228 6.328 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -3.749 -11.263 8.880 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -4.006 -12.566 7.736 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -2.361 -13.234 9.380 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -1.603 -13.120 7.804 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -0.150 -11.461 7.344 1.00 0.00 H new ATOM 0 HE22 GLN A 103 0.610 -10.518 8.631 1.00 0.00 H new ATOM 1556 N VAL A 104 -4.125 -11.292 4.809 1.00 0.00 N ATOM 1557 CA VAL A 104 -5.252 -11.407 3.911 1.00 0.00 C ATOM 1558 C VAL A 104 -6.065 -12.629 4.302 1.00 0.00 C ATOM 1559 O VAL A 104 -5.504 -13.646 4.712 1.00 0.00 O ATOM 1560 CB VAL A 104 -4.804 -11.535 2.442 1.00 0.00 C ATOM 1561 CG1 VAL A 104 -6.011 -11.543 1.519 1.00 0.00 C ATOM 1562 CG2 VAL A 104 -3.844 -10.412 2.076 1.00 0.00 C ATOM 0 H VAL A 104 -3.245 -11.637 4.426 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.852 -10.501 3.995 1.00 0.00 H new ATOM 0 HB VAL A 104 -4.277 -12.481 2.320 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.678 -11.634 0.485 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -6.654 -12.387 1.769 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.568 -10.614 1.640 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -3.539 -10.519 1.035 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.340 -9.451 2.212 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -2.965 -10.461 2.719 1.00 0.00 H new ATOM 1572 N SER A 105 -7.371 -12.535 4.170 1.00 0.00 N ATOM 1573 CA SER A 105 -8.256 -13.578 4.657 1.00 0.00 C ATOM 1574 C SER A 105 -8.402 -14.689 3.619 1.00 0.00 C ATOM 1575 O SER A 105 -9.478 -14.900 3.056 1.00 0.00 O ATOM 1576 CB SER A 105 -9.615 -12.978 5.019 1.00 0.00 C ATOM 1577 OG SER A 105 -10.357 -13.850 5.855 1.00 0.00 O ATOM 0 H SER A 105 -7.846 -11.747 3.729 1.00 0.00 H new ATOM 0 HA SER A 105 -7.824 -14.020 5.555 1.00 0.00 H new ATOM 0 HB2 SER A 105 -9.470 -12.023 5.524 1.00 0.00 H new ATOM 0 HB3 SER A 105 -10.180 -12.775 4.109 1.00 0.00 H new ATOM 0 HG SER A 105 -11.220 -13.440 6.071 1.00 0.00 H new ATOM 1583 N THR A 106 -7.306 -15.383 3.363 1.00 0.00 N ATOM 1584 CA THR A 106 -7.299 -16.489 2.428 1.00 0.00 C ATOM 1585 C THR A 106 -7.307 -17.823 3.168 1.00 0.00 C ATOM 1586 O THR A 106 -8.373 -18.470 3.217 1.00 0.00 O ATOM 1587 CB THR A 106 -6.084 -16.406 1.482 1.00 0.00 C ATOM 1588 OG1 THR A 106 -4.909 -16.006 2.208 1.00 0.00 O ATOM 1589 CG2 THR A 106 -6.347 -15.420 0.356 1.00 0.00 C ATOM 1590 OXT THR A 106 -6.259 -18.202 3.737 1.00 0.00 O ATOM 0 H THR A 106 -6.402 -15.195 3.796 1.00 0.00 H new ATOM 0 HA THR A 106 -8.205 -16.423 1.826 1.00 0.00 H new ATOM 0 HB THR A 106 -5.921 -17.395 1.054 1.00 0.00 H new ATOM 0 HG1 THR A 106 -4.290 -15.548 1.602 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.478 -15.376 -0.300 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.217 -15.744 -0.215 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.536 -14.431 0.775 1.00 0.00 H new TER 1598 THR A 106