USER MOD reduce.3.24.130724 H: found=0, std=0, add=809, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 811 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 99 LYS NZ :NH3+ -164:sc= 0.0217 (180deg=0) USER MOD Set 1.2: A 101 ASN : amide:sc= -0.0642 K(o=-0.043,f=-3.1!) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HE2:sc= 0.668 K(o=0.67,f=-2.1!) USER MOD Single : A 29 MET CE :methyl -141:sc= -0.113 (180deg=-1.23) USER MOD Single : A 30 GLN : amide:sc= -0.509 X(o=-0.51,f=-0.52) USER MOD Single : A 33 SER OG : rot 180:sc= 0.171 USER MOD Single : A 34 TYR OH : rot 150:sc= 0.188 USER MOD Single : A 46 ASN : amide:sc= -4.79! C(o=-4.8!,f=-8.7!) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 SER OG : rot 83:sc= 0.13 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 TYR OH : rot 180:sc= -0.925 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ -117:sc= 0.74 (180deg=0.0519) USER MOD Single : A 72 THR OG1 : rot -178:sc= -0.642 USER MOD Single : A 74 LYS NZ :NH3+ 148:sc= 0.347 (180deg=-2.28!) USER MOD Single : A 77 SER OG : rot 180:sc= -0.196 USER MOD Single : A 79 THR OG1 : rot -160:sc= -0.0684 USER MOD Single : A 81 LYS NZ :NH3+ 135:sc= 1.09 (180deg=0.47) USER MOD Single : A 83 THR OG1 : rot 80:sc= -0.936 USER MOD Single : A 89 THR OG1 : rot 79:sc= 1.12 USER MOD Single : A 91 GLN : amide:sc=-0.00716 K(o=-0.0072,f=-0.93) USER MOD Single : A 105 LYS NZ :NH3+ -140:sc= 0.457 (180deg=0.0152) USER MOD Single : A 106 GLN : amide:sc= -1.37 K(o=-1.4,f=-2.3) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot -169:sc= 0.0049 USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 LYS NZ :NH3+ -141:sc= 0 (180deg=-0.0424) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 26 17.779 12.758 8.477 1.00 0.00 N ATOM 2 CA GLY A 26 17.788 11.788 7.343 1.00 0.00 C ATOM 3 C GLY A 26 19.234 11.481 6.936 1.00 0.00 C ATOM 4 O GLY A 26 20.107 11.366 7.776 1.00 0.00 O ATOM 0 HA2 GLY A 26 17.279 10.869 7.634 1.00 0.00 H new ATOM 0 HA3 GLY A 26 17.241 12.200 6.495 1.00 0.00 H new ATOM 10 N SER A 27 19.486 11.350 5.652 1.00 0.00 N ATOM 11 CA SER A 27 20.872 11.050 5.159 1.00 0.00 C ATOM 12 C SER A 27 21.463 9.843 5.906 1.00 0.00 C ATOM 13 O SER A 27 22.445 9.958 6.616 1.00 0.00 O ATOM 14 CB SER A 27 21.684 12.320 5.435 1.00 0.00 C ATOM 15 OG SER A 27 21.186 13.381 4.629 1.00 0.00 O ATOM 0 H SER A 27 18.783 11.439 4.918 1.00 0.00 H new ATOM 0 HA SER A 27 20.882 10.791 4.100 1.00 0.00 H new ATOM 0 HB2 SER A 27 21.616 12.587 6.490 1.00 0.00 H new ATOM 0 HB3 SER A 27 22.738 12.146 5.217 1.00 0.00 H new ATOM 0 HG SER A 27 21.702 14.195 4.805 1.00 0.00 H new ATOM 21 N HIS A 28 20.867 8.688 5.747 1.00 0.00 N ATOM 22 CA HIS A 28 21.384 7.468 6.443 1.00 0.00 C ATOM 23 C HIS A 28 21.735 6.379 5.420 1.00 0.00 C ATOM 24 O HIS A 28 21.471 6.516 4.238 1.00 0.00 O ATOM 25 CB HIS A 28 20.232 7.008 7.344 1.00 0.00 C ATOM 26 CG HIS A 28 20.478 7.467 8.756 1.00 0.00 C ATOM 27 ND1 HIS A 28 20.618 8.806 9.090 1.00 0.00 N ATOM 28 CD2 HIS A 28 20.611 6.772 9.934 1.00 0.00 C ATOM 29 CE1 HIS A 28 20.823 8.874 10.418 1.00 0.00 C ATOM 30 NE2 HIS A 28 20.827 7.664 10.981 1.00 0.00 N ATOM 0 H HIS A 28 20.043 8.536 5.165 1.00 0.00 H new ATOM 0 HA HIS A 28 22.292 7.671 7.012 1.00 0.00 H new ATOM 0 HB2 HIS A 28 19.288 7.413 6.979 1.00 0.00 H new ATOM 0 HB3 HIS A 28 20.146 5.922 7.314 1.00 0.00 H new ATOM 0 HD1 HIS A 28 20.574 9.596 8.446 1.00 0.00 H new ATOM 0 HD2 HIS A 28 20.556 5.698 10.033 1.00 0.00 H new ATOM 0 HE1 HIS A 28 20.967 9.796 10.962 1.00 0.00 H new ATOM 38 N MET A 29 22.324 5.296 5.871 1.00 0.00 N ATOM 39 CA MET A 29 22.694 4.184 4.933 1.00 0.00 C ATOM 40 C MET A 29 21.453 3.651 4.200 1.00 0.00 C ATOM 41 O MET A 29 21.550 3.138 3.101 1.00 0.00 O ATOM 42 CB MET A 29 23.305 3.091 5.819 1.00 0.00 C ATOM 43 CG MET A 29 24.713 2.751 5.322 1.00 0.00 C ATOM 44 SD MET A 29 24.715 1.092 4.596 1.00 0.00 S ATOM 45 CE MET A 29 24.425 1.589 2.880 1.00 0.00 C ATOM 0 H MET A 29 22.565 5.133 6.849 1.00 0.00 H new ATOM 0 HA MET A 29 23.389 4.522 4.164 1.00 0.00 H new ATOM 0 HB2 MET A 29 23.346 3.429 6.854 1.00 0.00 H new ATOM 0 HB3 MET A 29 22.677 2.200 5.800 1.00 0.00 H new ATOM 0 HG2 MET A 29 25.035 3.483 4.582 1.00 0.00 H new ATOM 0 HG3 MET A 29 25.423 2.799 6.148 1.00 0.00 H new ATOM 0 HE1 MET A 29 23.746 0.880 2.406 1.00 0.00 H new ATOM 0 HE2 MET A 29 23.983 2.585 2.859 1.00 0.00 H new ATOM 0 HE3 MET A 29 25.372 1.601 2.340 1.00 0.00 H new ATOM 55 N GLN A 30 20.288 3.773 4.794 1.00 0.00 N ATOM 56 CA GLN A 30 19.042 3.280 4.128 1.00 0.00 C ATOM 57 C GLN A 30 18.486 4.361 3.191 1.00 0.00 C ATOM 58 O GLN A 30 18.067 5.420 3.626 1.00 0.00 O ATOM 59 CB GLN A 30 18.060 2.995 5.269 1.00 0.00 C ATOM 60 CG GLN A 30 18.469 1.708 5.994 1.00 0.00 C ATOM 61 CD GLN A 30 19.422 2.041 7.146 1.00 0.00 C ATOM 62 OE1 GLN A 30 20.544 1.575 7.175 1.00 0.00 O ATOM 63 NE2 GLN A 30 19.026 2.836 8.103 1.00 0.00 N ATOM 0 H GLN A 30 20.148 4.194 5.713 1.00 0.00 H new ATOM 0 HA GLN A 30 19.221 2.392 3.521 1.00 0.00 H new ATOM 0 HB2 GLN A 30 18.049 3.830 5.969 1.00 0.00 H new ATOM 0 HB3 GLN A 30 17.049 2.896 4.875 1.00 0.00 H new ATOM 0 HG2 GLN A 30 17.585 1.199 6.377 1.00 0.00 H new ATOM 0 HG3 GLN A 30 18.953 1.025 5.296 1.00 0.00 H new ATOM 0 HE21 GLN A 30 18.085 3.229 8.083 1.00 0.00 H new ATOM 0 HE22 GLN A 30 19.658 3.064 8.871 1.00 0.00 H new ATOM 72 N ALA A 31 18.490 4.107 1.905 1.00 0.00 N ATOM 73 CA ALA A 31 17.974 5.118 0.932 1.00 0.00 C ATOM 74 C ALA A 31 16.469 4.926 0.698 1.00 0.00 C ATOM 75 O ALA A 31 16.042 3.897 0.208 1.00 0.00 O ATOM 76 CB ALA A 31 18.755 4.865 -0.359 1.00 0.00 C ATOM 0 H ALA A 31 18.829 3.241 1.487 1.00 0.00 H new ATOM 0 HA ALA A 31 18.105 6.137 1.296 1.00 0.00 H new ATOM 0 HB1 ALA A 31 18.431 5.571 -1.124 1.00 0.00 H new ATOM 0 HB2 ALA A 31 19.821 4.997 -0.171 1.00 0.00 H new ATOM 0 HB3 ALA A 31 18.570 3.847 -0.703 1.00 0.00 H new ATOM 82 N LEU A 32 15.675 5.919 1.042 1.00 0.00 N ATOM 83 CA LEU A 32 14.184 5.839 0.850 1.00 0.00 C ATOM 84 C LEU A 32 13.564 4.778 1.773 1.00 0.00 C ATOM 85 O LEU A 32 14.049 3.667 1.878 1.00 0.00 O ATOM 86 CB LEU A 32 13.970 5.472 -0.626 1.00 0.00 C ATOM 87 CG LEU A 32 13.023 6.484 -1.277 1.00 0.00 C ATOM 88 CD1 LEU A 32 13.782 7.779 -1.577 1.00 0.00 C ATOM 89 CD2 LEU A 32 12.477 5.902 -2.582 1.00 0.00 C ATOM 0 H LEU A 32 16.001 6.794 1.453 1.00 0.00 H new ATOM 0 HA LEU A 32 13.701 6.784 1.101 1.00 0.00 H new ATOM 0 HB2 LEU A 32 14.925 5.463 -1.151 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.554 4.467 -0.704 1.00 0.00 H new ATOM 0 HG LEU A 32 12.198 6.697 -0.597 1.00 0.00 H new ATOM 0 HD11 LEU A 32 13.106 8.498 -2.040 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.173 8.195 -0.648 1.00 0.00 H new ATOM 0 HD13 LEU A 32 14.608 7.568 -2.256 1.00 0.00 H new ATOM 0 HD21 LEU A 32 11.803 6.621 -3.047 1.00 0.00 H new ATOM 0 HD22 LEU A 32 13.304 5.689 -3.260 1.00 0.00 H new ATOM 0 HD23 LEU A 32 11.935 4.980 -2.371 1.00 0.00 H new ATOM 101 N SER A 33 12.494 5.120 2.447 1.00 0.00 N ATOM 102 CA SER A 33 11.835 4.146 3.369 1.00 0.00 C ATOM 103 C SER A 33 10.874 3.239 2.593 1.00 0.00 C ATOM 104 O SER A 33 10.113 3.694 1.757 1.00 0.00 O ATOM 105 CB SER A 33 11.068 4.989 4.400 1.00 0.00 C ATOM 106 OG SER A 33 10.864 6.307 3.903 1.00 0.00 O ATOM 0 H SER A 33 12.047 6.036 2.398 1.00 0.00 H new ATOM 0 HA SER A 33 12.566 3.497 3.852 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.108 4.523 4.620 1.00 0.00 H new ATOM 0 HB3 SER A 33 11.625 5.028 5.336 1.00 0.00 H new ATOM 0 HG SER A 33 10.373 6.835 4.567 1.00 0.00 H new ATOM 112 N TYR A 34 10.911 1.958 2.872 1.00 0.00 N ATOM 113 CA TYR A 34 10.009 0.991 2.165 1.00 0.00 C ATOM 114 C TYR A 34 8.548 1.462 2.242 1.00 0.00 C ATOM 115 O TYR A 34 7.805 1.343 1.286 1.00 0.00 O ATOM 116 CB TYR A 34 10.192 -0.342 2.904 1.00 0.00 C ATOM 117 CG TYR A 34 9.119 -1.320 2.476 1.00 0.00 C ATOM 118 CD1 TYR A 34 9.298 -2.095 1.324 1.00 0.00 C ATOM 119 CD2 TYR A 34 7.946 -1.445 3.232 1.00 0.00 C ATOM 120 CE1 TYR A 34 8.305 -2.996 0.927 1.00 0.00 C ATOM 121 CE2 TYR A 34 6.952 -2.346 2.836 1.00 0.00 C ATOM 122 CZ TYR A 34 7.130 -3.122 1.683 1.00 0.00 C ATOM 123 OH TYR A 34 6.149 -4.012 1.294 1.00 0.00 O ATOM 0 H TYR A 34 11.531 1.537 3.564 1.00 0.00 H new ATOM 0 HA TYR A 34 10.252 0.903 1.106 1.00 0.00 H new ATOM 0 HB2 TYR A 34 11.178 -0.754 2.690 1.00 0.00 H new ATOM 0 HB3 TYR A 34 10.141 -0.181 3.981 1.00 0.00 H new ATOM 0 HD1 TYR A 34 10.203 -1.997 0.742 1.00 0.00 H new ATOM 0 HD2 TYR A 34 7.809 -0.846 4.120 1.00 0.00 H new ATOM 0 HE1 TYR A 34 8.443 -3.595 0.039 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.048 -2.443 3.419 1.00 0.00 H new ATOM 0 HH TYR A 34 5.671 -4.338 2.085 1.00 0.00 H new ATOM 133 N ARG A 35 8.137 2.001 3.368 1.00 0.00 N ATOM 134 CA ARG A 35 6.729 2.490 3.502 1.00 0.00 C ATOM 135 C ARG A 35 6.435 3.541 2.423 1.00 0.00 C ATOM 136 O ARG A 35 5.356 3.579 1.862 1.00 0.00 O ATOM 137 CB ARG A 35 6.646 3.108 4.902 1.00 0.00 C ATOM 138 CG ARG A 35 5.178 3.280 5.304 1.00 0.00 C ATOM 139 CD ARG A 35 4.960 2.720 6.715 1.00 0.00 C ATOM 140 NE ARG A 35 4.066 1.540 6.534 1.00 0.00 N ATOM 141 CZ ARG A 35 4.256 0.462 7.247 1.00 0.00 C ATOM 142 NH1 ARG A 35 5.241 -0.348 6.955 1.00 0.00 N ATOM 143 NH2 ARG A 35 3.461 0.197 8.251 1.00 0.00 N ATOM 0 H ARG A 35 8.717 2.122 4.198 1.00 0.00 H new ATOM 0 HA ARG A 35 5.999 1.691 3.375 1.00 0.00 H new ATOM 0 HB2 ARG A 35 7.158 2.470 5.623 1.00 0.00 H new ATOM 0 HB3 ARG A 35 7.152 4.073 4.915 1.00 0.00 H new ATOM 0 HG2 ARG A 35 4.904 4.335 5.274 1.00 0.00 H new ATOM 0 HG3 ARG A 35 4.533 2.763 4.593 1.00 0.00 H new ATOM 0 HD2 ARG A 35 5.905 2.431 7.174 1.00 0.00 H new ATOM 0 HD3 ARG A 35 4.503 3.464 7.368 1.00 0.00 H new ATOM 0 HE ARG A 35 3.307 1.575 5.854 1.00 0.00 H new ATOM 0 HH11 ARG A 35 5.859 -0.137 6.172 1.00 0.00 H new ATOM 0 HH12 ARG A 35 5.391 -1.190 7.511 1.00 0.00 H new ATOM 0 HH21 ARG A 35 2.695 0.831 8.476 1.00 0.00 H new ATOM 0 HH22 ARG A 35 3.607 -0.644 8.809 1.00 0.00 H new ATOM 157 N GLU A 36 7.396 4.378 2.118 1.00 0.00 N ATOM 158 CA GLU A 36 7.193 5.414 1.060 1.00 0.00 C ATOM 159 C GLU A 36 7.051 4.736 -0.306 1.00 0.00 C ATOM 160 O GLU A 36 6.233 5.123 -1.118 1.00 0.00 O ATOM 161 CB GLU A 36 8.452 6.286 1.096 1.00 0.00 C ATOM 162 CG GLU A 36 8.078 7.717 1.484 1.00 0.00 C ATOM 163 CD GLU A 36 9.334 8.471 1.927 1.00 0.00 C ATOM 164 OE1 GLU A 36 10.148 8.782 1.071 1.00 0.00 O ATOM 165 OE2 GLU A 36 9.461 8.722 3.112 1.00 0.00 O ATOM 0 H GLU A 36 8.316 4.388 2.559 1.00 0.00 H new ATOM 0 HA GLU A 36 6.292 6.004 1.227 1.00 0.00 H new ATOM 0 HB2 GLU A 36 9.167 5.880 1.812 1.00 0.00 H new ATOM 0 HB3 GLU A 36 8.939 6.279 0.121 1.00 0.00 H new ATOM 0 HG2 GLU A 36 7.615 8.225 0.638 1.00 0.00 H new ATOM 0 HG3 GLU A 36 7.344 7.707 2.290 1.00 0.00 H new ATOM 172 N ALA A 37 7.837 3.716 -0.555 1.00 0.00 N ATOM 173 CA ALA A 37 7.747 2.995 -1.861 1.00 0.00 C ATOM 174 C ALA A 37 6.370 2.335 -1.996 1.00 0.00 C ATOM 175 O ALA A 37 5.776 2.333 -3.057 1.00 0.00 O ATOM 176 CB ALA A 37 8.852 1.935 -1.818 1.00 0.00 C ATOM 0 H ALA A 37 8.537 3.352 0.091 1.00 0.00 H new ATOM 0 HA ALA A 37 7.869 3.665 -2.712 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.846 1.365 -2.747 1.00 0.00 H new ATOM 0 HB2 ALA A 37 9.819 2.423 -1.698 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.678 1.262 -0.978 1.00 0.00 H new ATOM 182 N VAL A 38 5.857 1.788 -0.919 1.00 0.00 N ATOM 183 CA VAL A 38 4.511 1.138 -0.965 1.00 0.00 C ATOM 184 C VAL A 38 3.433 2.207 -1.172 1.00 0.00 C ATOM 185 O VAL A 38 2.491 2.003 -1.909 1.00 0.00 O ATOM 186 CB VAL A 38 4.336 0.449 0.393 1.00 0.00 C ATOM 187 CG1 VAL A 38 2.966 -0.234 0.454 1.00 0.00 C ATOM 188 CG2 VAL A 38 5.432 -0.606 0.579 1.00 0.00 C ATOM 0 H VAL A 38 6.315 1.765 -0.008 1.00 0.00 H new ATOM 0 HA VAL A 38 4.425 0.423 -1.783 1.00 0.00 H new ATOM 0 HB VAL A 38 4.407 1.196 1.184 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.846 -0.723 1.421 1.00 0.00 H new ATOM 0 HG12 VAL A 38 2.182 0.512 0.324 1.00 0.00 H new ATOM 0 HG13 VAL A 38 2.895 -0.978 -0.340 1.00 0.00 H new ATOM 0 HG21 VAL A 38 5.306 -1.095 1.545 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.361 -1.349 -0.216 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.410 -0.126 0.540 1.00 0.00 H new ATOM 198 N LEU A 39 3.577 3.349 -0.543 1.00 0.00 N ATOM 199 CA LEU A 39 2.570 4.437 -0.723 1.00 0.00 C ATOM 200 C LEU A 39 2.484 4.803 -2.209 1.00 0.00 C ATOM 201 O LEU A 39 1.412 4.982 -2.754 1.00 0.00 O ATOM 202 CB LEU A 39 3.099 5.620 0.096 1.00 0.00 C ATOM 203 CG LEU A 39 1.925 6.406 0.680 1.00 0.00 C ATOM 204 CD1 LEU A 39 1.641 5.920 2.104 1.00 0.00 C ATOM 205 CD2 LEU A 39 2.275 7.896 0.712 1.00 0.00 C ATOM 0 H LEU A 39 4.348 3.572 0.086 1.00 0.00 H new ATOM 0 HA LEU A 39 1.572 4.145 -0.397 1.00 0.00 H new ATOM 0 HB2 LEU A 39 3.744 5.261 0.898 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.706 6.269 -0.535 1.00 0.00 H new ATOM 0 HG LEU A 39 1.042 6.252 0.060 1.00 0.00 H new ATOM 0 HD11 LEU A 39 0.804 6.481 2.520 1.00 0.00 H new ATOM 0 HD12 LEU A 39 1.392 4.859 2.084 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.524 6.074 2.724 1.00 0.00 H new ATOM 0 HD21 LEU A 39 1.439 8.457 1.128 1.00 0.00 H new ATOM 0 HD22 LEU A 39 3.159 8.049 1.331 1.00 0.00 H new ATOM 0 HD23 LEU A 39 2.477 8.244 -0.301 1.00 0.00 H new ATOM 217 N ARG A 40 3.615 4.889 -2.864 1.00 0.00 N ATOM 218 CA ARG A 40 3.625 5.216 -4.320 1.00 0.00 C ATOM 219 C ARG A 40 3.110 4.016 -5.127 1.00 0.00 C ATOM 220 O ARG A 40 2.386 4.173 -6.091 1.00 0.00 O ATOM 221 CB ARG A 40 5.095 5.505 -4.639 1.00 0.00 C ATOM 222 CG ARG A 40 5.224 6.076 -6.052 1.00 0.00 C ATOM 223 CD ARG A 40 6.679 5.956 -6.514 1.00 0.00 C ATOM 224 NE ARG A 40 6.682 4.835 -7.499 1.00 0.00 N ATOM 225 CZ ARG A 40 6.747 3.595 -7.089 1.00 0.00 C ATOM 226 NH1 ARG A 40 7.794 3.174 -6.426 1.00 0.00 N ATOM 227 NH2 ARG A 40 5.765 2.774 -7.350 1.00 0.00 N ATOM 0 H ARG A 40 4.536 4.746 -2.449 1.00 0.00 H new ATOM 0 HA ARG A 40 2.983 6.060 -4.571 1.00 0.00 H new ATOM 0 HB2 ARG A 40 5.500 6.211 -3.915 1.00 0.00 H new ATOM 0 HB3 ARG A 40 5.680 4.590 -4.553 1.00 0.00 H new ATOM 0 HG2 ARG A 40 4.567 5.538 -6.736 1.00 0.00 H new ATOM 0 HG3 ARG A 40 4.911 7.120 -6.065 1.00 0.00 H new ATOM 0 HD2 ARG A 40 7.026 6.883 -6.971 1.00 0.00 H new ATOM 0 HD3 ARG A 40 7.343 5.746 -5.675 1.00 0.00 H new ATOM 0 HE ARG A 40 6.633 5.037 -8.498 1.00 0.00 H new ATOM 0 HH11 ARG A 40 8.563 3.814 -6.227 1.00 0.00 H new ATOM 0 HH12 ARG A 40 7.841 2.206 -6.108 1.00 0.00 H new ATOM 0 HH21 ARG A 40 4.952 3.101 -7.872 1.00 0.00 H new ATOM 0 HH22 ARG A 40 5.811 1.806 -7.032 1.00 0.00 H new ATOM 241 N ALA A 41 3.475 2.819 -4.731 1.00 0.00 N ATOM 242 CA ALA A 41 3.004 1.601 -5.460 1.00 0.00 C ATOM 243 C ALA A 41 1.495 1.416 -5.252 1.00 0.00 C ATOM 244 O ALA A 41 0.774 1.071 -6.168 1.00 0.00 O ATOM 245 CB ALA A 41 3.779 0.436 -4.841 1.00 0.00 C ATOM 0 H ALA A 41 4.081 2.634 -3.931 1.00 0.00 H new ATOM 0 HA ALA A 41 3.173 1.672 -6.534 1.00 0.00 H new ATOM 0 HB1 ALA A 41 3.486 -0.495 -5.326 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.848 0.596 -4.979 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.556 0.376 -3.776 1.00 0.00 H new ATOM 251 N VAL A 42 1.017 1.653 -4.052 1.00 0.00 N ATOM 252 CA VAL A 42 -0.444 1.507 -3.776 1.00 0.00 C ATOM 253 C VAL A 42 -1.230 2.498 -4.639 1.00 0.00 C ATOM 254 O VAL A 42 -2.199 2.133 -5.276 1.00 0.00 O ATOM 255 CB VAL A 42 -0.599 1.816 -2.277 1.00 0.00 C ATOM 256 CG1 VAL A 42 -2.039 2.234 -1.965 1.00 0.00 C ATOM 257 CG2 VAL A 42 -0.254 0.567 -1.464 1.00 0.00 C ATOM 0 H VAL A 42 1.580 1.942 -3.252 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.826 0.514 -4.013 1.00 0.00 H new ATOM 0 HB VAL A 42 0.074 2.632 -2.015 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -2.133 2.449 -0.901 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -2.292 3.125 -2.539 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -2.719 1.425 -2.233 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -0.363 0.783 -0.401 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -0.927 -0.244 -1.740 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.775 0.271 -1.670 1.00 0.00 H new ATOM 267 N ASP A 43 -0.808 3.744 -4.679 1.00 0.00 N ATOM 268 CA ASP A 43 -1.523 4.757 -5.518 1.00 0.00 C ATOM 269 C ASP A 43 -1.510 4.321 -6.987 1.00 0.00 C ATOM 270 O ASP A 43 -2.481 4.483 -7.698 1.00 0.00 O ATOM 271 CB ASP A 43 -0.738 6.064 -5.343 1.00 0.00 C ATOM 272 CG ASP A 43 -1.699 7.260 -5.319 1.00 0.00 C ATOM 273 OD1 ASP A 43 -2.684 7.231 -6.043 1.00 0.00 O ATOM 274 OD2 ASP A 43 -1.428 8.189 -4.578 1.00 0.00 O ATOM 0 H ASP A 43 -0.001 4.100 -4.167 1.00 0.00 H new ATOM 0 HA ASP A 43 -2.566 4.871 -5.221 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -0.164 6.031 -4.417 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.023 6.179 -6.157 1.00 0.00 H new ATOM 279 N ARG A 44 -0.415 3.760 -7.442 1.00 0.00 N ATOM 280 CA ARG A 44 -0.339 3.304 -8.864 1.00 0.00 C ATOM 281 C ARG A 44 -1.355 2.183 -9.118 1.00 0.00 C ATOM 282 O ARG A 44 -1.931 2.094 -10.186 1.00 0.00 O ATOM 283 CB ARG A 44 1.092 2.788 -9.051 1.00 0.00 C ATOM 284 CG ARG A 44 2.065 3.969 -9.116 1.00 0.00 C ATOM 285 CD ARG A 44 2.414 4.273 -10.577 1.00 0.00 C ATOM 286 NE ARG A 44 3.109 5.590 -10.542 1.00 0.00 N ATOM 287 CZ ARG A 44 2.461 6.676 -10.867 1.00 0.00 C ATOM 288 NH1 ARG A 44 1.744 7.300 -9.969 1.00 0.00 N ATOM 289 NH2 ARG A 44 2.524 7.133 -12.091 1.00 0.00 N ATOM 0 H ARG A 44 0.428 3.599 -6.890 1.00 0.00 H new ATOM 0 HA ARG A 44 -0.571 4.107 -9.563 1.00 0.00 H new ATOM 0 HB2 ARG A 44 1.361 2.128 -8.226 1.00 0.00 H new ATOM 0 HB3 ARG A 44 1.159 2.199 -9.966 1.00 0.00 H new ATOM 0 HG2 ARG A 44 1.618 4.847 -8.649 1.00 0.00 H new ATOM 0 HG3 ARG A 44 2.971 3.737 -8.557 1.00 0.00 H new ATOM 0 HD2 ARG A 44 3.056 3.499 -10.999 1.00 0.00 H new ATOM 0 HD3 ARG A 44 1.518 4.316 -11.196 1.00 0.00 H new ATOM 0 HE ARG A 44 4.089 5.643 -10.265 1.00 0.00 H new ATOM 0 HH11 ARG A 44 1.692 6.938 -9.017 1.00 0.00 H new ATOM 0 HH12 ARG A 44 1.237 8.149 -10.221 1.00 0.00 H new ATOM 0 HH21 ARG A 44 3.079 6.641 -12.791 1.00 0.00 H new ATOM 0 HH22 ARG A 44 2.018 7.981 -12.345 1.00 0.00 H new ATOM 303 N LEU A 45 -1.583 1.334 -8.144 1.00 0.00 N ATOM 304 CA LEU A 45 -2.569 0.227 -8.332 1.00 0.00 C ATOM 305 C LEU A 45 -3.987 0.796 -8.455 1.00 0.00 C ATOM 306 O LEU A 45 -4.746 0.395 -9.317 1.00 0.00 O ATOM 307 CB LEU A 45 -2.442 -0.654 -7.082 1.00 0.00 C ATOM 308 CG LEU A 45 -3.490 -1.773 -7.125 1.00 0.00 C ATOM 309 CD1 LEU A 45 -2.845 -3.064 -7.636 1.00 0.00 C ATOM 310 CD2 LEU A 45 -4.047 -2.006 -5.717 1.00 0.00 C ATOM 0 H LEU A 45 -1.130 1.361 -7.231 1.00 0.00 H new ATOM 0 HA LEU A 45 -2.376 -0.342 -9.242 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -1.441 -1.083 -7.028 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -2.578 -0.050 -6.185 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.299 -1.483 -7.795 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -3.592 -3.857 -7.665 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -2.449 -2.901 -8.638 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.034 -3.354 -6.968 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.792 -2.801 -5.747 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.236 -2.294 -5.048 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -4.510 -1.089 -5.353 1.00 0.00 H new ATOM 322 N ASN A 46 -4.351 1.727 -7.608 1.00 0.00 N ATOM 323 CA ASN A 46 -5.730 2.308 -7.700 1.00 0.00 C ATOM 324 C ASN A 46 -5.813 3.356 -8.819 1.00 0.00 C ATOM 325 O ASN A 46 -6.879 3.626 -9.339 1.00 0.00 O ATOM 326 CB ASN A 46 -6.049 2.926 -6.327 1.00 0.00 C ATOM 327 CG ASN A 46 -5.002 3.962 -5.916 1.00 0.00 C ATOM 328 OD1 ASN A 46 -4.232 3.724 -5.012 1.00 0.00 O ATOM 329 ND2 ASN A 46 -4.960 5.120 -6.516 1.00 0.00 N ATOM 0 H ASN A 46 -3.763 2.107 -6.866 1.00 0.00 H new ATOM 0 HA ASN A 46 -6.459 1.537 -7.949 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -7.032 3.395 -6.359 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.096 2.138 -5.575 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -4.280 5.822 -6.223 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -5.607 5.323 -7.278 1.00 0.00 H new ATOM 336 N GLU A 47 -4.704 3.941 -9.199 1.00 0.00 N ATOM 337 CA GLU A 47 -4.732 4.959 -10.293 1.00 0.00 C ATOM 338 C GLU A 47 -4.710 4.270 -11.666 1.00 0.00 C ATOM 339 O GLU A 47 -5.355 4.715 -12.598 1.00 0.00 O ATOM 340 CB GLU A 47 -3.469 5.806 -10.095 1.00 0.00 C ATOM 341 CG GLU A 47 -3.331 6.806 -11.247 1.00 0.00 C ATOM 342 CD GLU A 47 -2.078 7.665 -11.047 1.00 0.00 C ATOM 343 OE1 GLU A 47 -0.991 7.107 -11.036 1.00 0.00 O ATOM 344 OE2 GLU A 47 -2.225 8.869 -10.917 1.00 0.00 O ATOM 0 H GLU A 47 -3.783 3.758 -8.800 1.00 0.00 H new ATOM 0 HA GLU A 47 -5.635 5.568 -10.259 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -3.521 6.337 -9.144 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.591 5.162 -10.053 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.270 6.274 -12.196 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.215 7.442 -11.295 1.00 0.00 H new ATOM 351 N GLN A 48 -3.976 3.192 -11.798 1.00 0.00 N ATOM 352 CA GLN A 48 -3.909 2.482 -13.113 1.00 0.00 C ATOM 353 C GLN A 48 -4.588 1.105 -13.030 1.00 0.00 C ATOM 354 O GLN A 48 -4.194 0.167 -13.700 1.00 0.00 O ATOM 355 CB GLN A 48 -2.414 2.335 -13.402 1.00 0.00 C ATOM 356 CG GLN A 48 -2.179 2.375 -14.914 1.00 0.00 C ATOM 357 CD GLN A 48 -0.763 2.882 -15.200 1.00 0.00 C ATOM 358 OE1 GLN A 48 -0.564 4.053 -15.451 1.00 0.00 O ATOM 359 NE2 GLN A 48 0.238 2.043 -15.174 1.00 0.00 N ATOM 0 H GLN A 48 -3.421 2.773 -11.052 1.00 0.00 H new ATOM 0 HA GLN A 48 -4.428 3.029 -13.900 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -1.858 3.137 -12.916 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -2.044 1.396 -12.991 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -2.313 1.380 -15.340 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -2.912 3.026 -15.389 1.00 0.00 H new ATOM 0 HE21 GLN A 48 0.073 1.059 -14.963 1.00 0.00 H new ATOM 0 HE22 GLN A 48 1.184 2.372 -15.364 1.00 0.00 H new ATOM 368 N SER A 49 -5.611 0.981 -12.221 1.00 0.00 N ATOM 369 CA SER A 49 -6.325 -0.325 -12.095 1.00 0.00 C ATOM 370 C SER A 49 -7.180 -0.587 -13.343 1.00 0.00 C ATOM 371 O SER A 49 -7.281 0.245 -14.226 1.00 0.00 O ATOM 372 CB SER A 49 -7.213 -0.177 -10.854 1.00 0.00 C ATOM 373 OG SER A 49 -7.056 -1.317 -10.019 1.00 0.00 O ATOM 0 H SER A 49 -5.983 1.732 -11.640 1.00 0.00 H new ATOM 0 HA SER A 49 -5.635 -1.164 -12.003 1.00 0.00 H new ATOM 0 HB2 SER A 49 -6.944 0.727 -10.307 1.00 0.00 H new ATOM 0 HB3 SER A 49 -8.256 -0.072 -11.151 1.00 0.00 H new ATOM 0 HG SER A 49 -6.260 -1.204 -9.458 1.00 0.00 H new ATOM 379 N SER A 50 -7.791 -1.740 -13.417 1.00 0.00 N ATOM 380 CA SER A 50 -8.640 -2.075 -14.602 1.00 0.00 C ATOM 381 C SER A 50 -10.132 -2.032 -14.237 1.00 0.00 C ATOM 382 O SER A 50 -10.962 -1.651 -15.042 1.00 0.00 O ATOM 383 CB SER A 50 -8.225 -3.494 -14.993 1.00 0.00 C ATOM 384 OG SER A 50 -8.972 -3.907 -16.128 1.00 0.00 O ATOM 0 H SER A 50 -7.739 -2.469 -12.705 1.00 0.00 H new ATOM 0 HA SER A 50 -8.501 -1.364 -15.416 1.00 0.00 H new ATOM 0 HB2 SER A 50 -7.158 -3.525 -15.215 1.00 0.00 H new ATOM 0 HB3 SER A 50 -8.398 -4.178 -14.162 1.00 0.00 H new ATOM 0 HG SER A 50 -8.707 -4.816 -16.381 1.00 0.00 H new ATOM 390 N GLU A 51 -10.481 -2.421 -13.033 1.00 0.00 N ATOM 391 CA GLU A 51 -11.917 -2.403 -12.622 1.00 0.00 C ATOM 392 C GLU A 51 -12.405 -0.957 -12.425 1.00 0.00 C ATOM 393 O GLU A 51 -11.634 -0.015 -12.483 1.00 0.00 O ATOM 394 CB GLU A 51 -11.966 -3.183 -11.303 1.00 0.00 C ATOM 395 CG GLU A 51 -12.437 -4.617 -11.571 1.00 0.00 C ATOM 396 CD GLU A 51 -11.491 -5.613 -10.893 1.00 0.00 C ATOM 397 OE1 GLU A 51 -11.543 -5.719 -9.677 1.00 0.00 O ATOM 398 OE2 GLU A 51 -10.736 -6.261 -11.602 1.00 0.00 O ATOM 0 H GLU A 51 -9.831 -2.750 -12.319 1.00 0.00 H new ATOM 0 HA GLU A 51 -12.565 -2.847 -13.377 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -10.980 -3.194 -10.839 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -12.642 -2.692 -10.603 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.451 -4.752 -11.195 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -12.467 -4.804 -12.644 1.00 0.00 H new ATOM 405 N ALA A 52 -13.683 -0.779 -12.194 1.00 0.00 N ATOM 406 CA ALA A 52 -14.234 0.597 -11.998 1.00 0.00 C ATOM 407 C ALA A 52 -14.434 0.884 -10.504 1.00 0.00 C ATOM 408 O ALA A 52 -15.476 1.357 -10.085 1.00 0.00 O ATOM 409 CB ALA A 52 -15.573 0.597 -12.739 1.00 0.00 C ATOM 0 H ALA A 52 -14.370 -1.531 -12.133 1.00 0.00 H new ATOM 0 HA ALA A 52 -13.564 1.369 -12.375 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.042 1.576 -12.642 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -15.405 0.378 -13.793 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -16.226 -0.163 -12.310 1.00 0.00 H new ATOM 415 N ASN A 53 -13.440 0.605 -9.700 1.00 0.00 N ATOM 416 CA ASN A 53 -13.559 0.862 -8.232 1.00 0.00 C ATOM 417 C ASN A 53 -12.196 1.235 -7.639 1.00 0.00 C ATOM 418 O ASN A 53 -11.172 0.704 -8.031 1.00 0.00 O ATOM 419 CB ASN A 53 -14.058 -0.457 -7.636 1.00 0.00 C ATOM 420 CG ASN A 53 -15.529 -0.314 -7.241 1.00 0.00 C ATOM 421 OD1 ASN A 53 -15.856 0.422 -6.331 1.00 0.00 O ATOM 422 ND2 ASN A 53 -16.436 -0.989 -7.893 1.00 0.00 N ATOM 0 H ASN A 53 -12.548 0.209 -9.997 1.00 0.00 H new ATOM 0 HA ASN A 53 -14.233 1.691 -8.016 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -13.942 -1.263 -8.361 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -13.461 -0.724 -6.764 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.420 -0.899 -7.639 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -16.161 -1.607 -8.657 1.00 0.00 H new ATOM 429 N LEU A 54 -12.177 2.136 -6.688 1.00 0.00 N ATOM 430 CA LEU A 54 -10.878 2.530 -6.058 1.00 0.00 C ATOM 431 C LEU A 54 -10.458 1.461 -5.046 1.00 0.00 C ATOM 432 O LEU A 54 -11.281 0.727 -4.531 1.00 0.00 O ATOM 433 CB LEU A 54 -11.144 3.862 -5.348 1.00 0.00 C ATOM 434 CG LEU A 54 -10.790 5.033 -6.268 1.00 0.00 C ATOM 435 CD1 LEU A 54 -11.134 6.349 -5.566 1.00 0.00 C ATOM 436 CD2 LEU A 54 -9.293 5.010 -6.587 1.00 0.00 C ATOM 0 H LEU A 54 -13.000 2.614 -6.322 1.00 0.00 H new ATOM 0 HA LEU A 54 -10.078 2.627 -6.792 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -12.192 3.924 -5.056 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -10.555 3.918 -4.433 1.00 0.00 H new ATOM 0 HG LEU A 54 -11.358 4.946 -7.194 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -10.883 7.186 -6.218 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -12.200 6.373 -5.339 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -10.564 6.427 -4.640 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -9.048 5.846 -7.242 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -8.723 5.094 -5.662 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -9.041 4.073 -7.084 1.00 0.00 H new ATOM 448 N TYR A 55 -9.187 1.365 -4.754 1.00 0.00 N ATOM 449 CA TYR A 55 -8.726 0.340 -3.776 1.00 0.00 C ATOM 450 C TYR A 55 -7.636 0.915 -2.876 1.00 0.00 C ATOM 451 O TYR A 55 -6.465 0.918 -3.213 1.00 0.00 O ATOM 452 CB TYR A 55 -8.184 -0.819 -4.615 1.00 0.00 C ATOM 453 CG TYR A 55 -9.307 -1.781 -4.919 1.00 0.00 C ATOM 454 CD1 TYR A 55 -9.591 -2.830 -4.035 1.00 0.00 C ATOM 455 CD2 TYR A 55 -10.070 -1.620 -6.081 1.00 0.00 C ATOM 456 CE1 TYR A 55 -10.637 -3.716 -4.316 1.00 0.00 C ATOM 457 CE2 TYR A 55 -11.112 -2.504 -6.362 1.00 0.00 C ATOM 458 CZ TYR A 55 -11.397 -3.552 -5.481 1.00 0.00 C ATOM 459 OH TYR A 55 -12.431 -4.418 -5.758 1.00 0.00 O ATOM 0 H TYR A 55 -8.452 1.951 -5.150 1.00 0.00 H new ATOM 0 HA TYR A 55 -9.534 0.013 -3.121 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -7.752 -0.442 -5.542 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -7.386 -1.331 -4.077 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -9.003 -2.955 -3.138 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -9.852 -0.810 -6.761 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -10.858 -4.525 -3.636 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -11.699 -2.379 -7.260 1.00 0.00 H new ATOM 0 HH TYR A 55 -12.855 -4.162 -6.604 1.00 0.00 H new ATOM 469 N ARG A 56 -8.019 1.390 -1.723 1.00 0.00 N ATOM 470 CA ARG A 56 -7.022 1.954 -0.771 1.00 0.00 C ATOM 471 C ARG A 56 -6.301 0.804 -0.062 1.00 0.00 C ATOM 472 O ARG A 56 -6.850 -0.274 0.093 1.00 0.00 O ATOM 473 CB ARG A 56 -7.843 2.779 0.227 1.00 0.00 C ATOM 474 CG ARG A 56 -6.910 3.480 1.219 1.00 0.00 C ATOM 475 CD ARG A 56 -5.911 4.358 0.459 1.00 0.00 C ATOM 476 NE ARG A 56 -5.681 5.531 1.346 1.00 0.00 N ATOM 477 CZ ARG A 56 -4.579 5.618 2.042 1.00 0.00 C ATOM 478 NH1 ARG A 56 -3.421 5.603 1.435 1.00 0.00 N ATOM 479 NH2 ARG A 56 -4.636 5.722 3.344 1.00 0.00 N ATOM 0 H ARG A 56 -8.986 1.412 -1.398 1.00 0.00 H new ATOM 0 HA ARG A 56 -6.264 2.565 -1.261 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -8.443 3.517 -0.305 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -8.537 2.131 0.763 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -7.491 4.090 1.911 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.377 2.740 1.816 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -4.982 3.822 0.264 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -6.310 4.666 -0.507 1.00 0.00 H new ATOM 0 HE ARG A 56 -6.384 6.267 1.410 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -3.379 5.523 0.419 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -2.560 5.671 1.978 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -5.540 5.735 3.815 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -3.776 5.790 3.888 1.00 0.00 H new ATOM 493 N LEU A 57 -5.085 1.015 0.369 1.00 0.00 N ATOM 494 CA LEU A 57 -4.350 -0.080 1.067 1.00 0.00 C ATOM 495 C LEU A 57 -4.995 -0.371 2.422 1.00 0.00 C ATOM 496 O LEU A 57 -5.242 0.522 3.213 1.00 0.00 O ATOM 497 CB LEU A 57 -2.917 0.419 1.257 1.00 0.00 C ATOM 498 CG LEU A 57 -2.033 -0.762 1.666 1.00 0.00 C ATOM 499 CD1 LEU A 57 -1.750 -1.636 0.443 1.00 0.00 C ATOM 500 CD2 LEU A 57 -0.712 -0.249 2.240 1.00 0.00 C ATOM 0 H LEU A 57 -4.572 1.891 0.269 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.374 -1.004 0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.547 0.865 0.334 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.886 1.196 2.021 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.550 -1.350 2.424 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.121 -2.477 0.734 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.690 -2.010 0.038 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.237 -1.045 -0.316 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.088 -1.095 2.529 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.194 0.344 1.486 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.911 0.370 3.115 1.00 0.00 H new ATOM 512 N LEU A 58 -5.258 -1.621 2.690 1.00 0.00 N ATOM 513 CA LEU A 58 -5.875 -2.006 3.988 1.00 0.00 C ATOM 514 C LEU A 58 -4.774 -2.377 4.987 1.00 0.00 C ATOM 515 O LEU A 58 -4.815 -1.994 6.140 1.00 0.00 O ATOM 516 CB LEU A 58 -6.752 -3.220 3.664 1.00 0.00 C ATOM 517 CG LEU A 58 -7.634 -3.548 4.868 1.00 0.00 C ATOM 518 CD1 LEU A 58 -8.687 -2.448 5.049 1.00 0.00 C ATOM 519 CD2 LEU A 58 -8.335 -4.890 4.639 1.00 0.00 C ATOM 0 H LEU A 58 -5.069 -2.399 2.058 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.457 -1.201 4.436 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -7.372 -3.012 2.792 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -6.127 -4.077 3.414 1.00 0.00 H new ATOM 0 HG LEU A 58 -7.015 -3.609 5.763 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -9.315 -2.683 5.908 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -8.190 -1.492 5.214 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.305 -2.385 4.154 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -8.964 -5.123 5.498 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -8.953 -4.830 3.743 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -7.588 -5.674 4.513 1.00 0.00 H new ATOM 531 N GLU A 59 -3.784 -3.115 4.545 1.00 0.00 N ATOM 532 CA GLU A 59 -2.666 -3.510 5.456 1.00 0.00 C ATOM 533 C GLU A 59 -1.375 -3.739 4.653 1.00 0.00 C ATOM 534 O GLU A 59 -1.399 -4.280 3.563 1.00 0.00 O ATOM 535 CB GLU A 59 -3.127 -4.812 6.118 1.00 0.00 C ATOM 536 CG GLU A 59 -3.202 -4.619 7.636 1.00 0.00 C ATOM 537 CD GLU A 59 -3.599 -5.938 8.303 1.00 0.00 C ATOM 538 OE1 GLU A 59 -2.748 -6.807 8.404 1.00 0.00 O ATOM 539 OE2 GLU A 59 -4.745 -6.057 8.705 1.00 0.00 O ATOM 0 H GLU A 59 -3.703 -3.461 3.589 1.00 0.00 H new ATOM 0 HA GLU A 59 -2.446 -2.737 6.192 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -4.103 -5.103 5.730 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -2.435 -5.619 5.878 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -2.238 -4.283 8.018 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -3.929 -3.844 7.879 1.00 0.00 H new ATOM 546 N LEU A 60 -0.249 -3.336 5.191 1.00 0.00 N ATOM 547 CA LEU A 60 1.048 -3.533 4.474 1.00 0.00 C ATOM 548 C LEU A 60 1.865 -4.626 5.170 1.00 0.00 C ATOM 549 O LEU A 60 1.895 -4.716 6.384 1.00 0.00 O ATOM 550 CB LEU A 60 1.763 -2.180 4.559 1.00 0.00 C ATOM 551 CG LEU A 60 3.183 -2.289 3.988 1.00 0.00 C ATOM 552 CD1 LEU A 60 3.120 -2.649 2.502 1.00 0.00 C ATOM 553 CD2 LEU A 60 3.897 -0.945 4.150 1.00 0.00 C ATOM 0 H LEU A 60 -0.173 -2.878 6.099 1.00 0.00 H new ATOM 0 HA LEU A 60 0.910 -3.848 3.440 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.199 -1.428 4.007 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.806 -1.849 5.597 1.00 0.00 H new ATOM 0 HG LEU A 60 3.727 -3.066 4.525 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.131 -2.725 2.103 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.609 -3.604 2.380 1.00 0.00 H new ATOM 0 HD13 LEU A 60 2.574 -1.875 1.963 1.00 0.00 H new ATOM 0 HD21 LEU A 60 4.907 -1.018 3.745 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.346 -0.173 3.613 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.948 -0.685 5.207 1.00 0.00 H new ATOM 565 N ASP A 61 2.519 -5.454 4.405 1.00 0.00 N ATOM 566 CA ASP A 61 3.335 -6.553 5.000 1.00 0.00 C ATOM 567 C ASP A 61 4.823 -6.192 4.992 1.00 0.00 C ATOM 568 O ASP A 61 5.235 -5.218 4.384 1.00 0.00 O ATOM 569 CB ASP A 61 3.075 -7.765 4.101 1.00 0.00 C ATOM 570 CG ASP A 61 2.957 -9.031 4.956 1.00 0.00 C ATOM 571 OD1 ASP A 61 3.901 -9.336 5.666 1.00 0.00 O ATOM 572 OD2 ASP A 61 1.925 -9.675 4.881 1.00 0.00 O ATOM 0 H ASP A 61 2.524 -5.418 3.386 1.00 0.00 H new ATOM 0 HA ASP A 61 3.067 -6.742 6.039 1.00 0.00 H new ATOM 0 HB2 ASP A 61 2.159 -7.615 3.529 1.00 0.00 H new ATOM 0 HB3 ASP A 61 3.886 -7.876 3.381 1.00 0.00 H new ATOM 577 N GLN A 62 5.629 -6.981 5.656 1.00 0.00 N ATOM 578 CA GLN A 62 7.096 -6.714 5.694 1.00 0.00 C ATOM 579 C GLN A 62 7.844 -7.780 4.876 1.00 0.00 C ATOM 580 O GLN A 62 8.182 -8.831 5.387 1.00 0.00 O ATOM 581 CB GLN A 62 7.479 -6.793 7.175 1.00 0.00 C ATOM 582 CG GLN A 62 8.859 -6.162 7.384 1.00 0.00 C ATOM 583 CD GLN A 62 8.721 -4.900 8.238 1.00 0.00 C ATOM 584 OE1 GLN A 62 8.417 -3.839 7.729 1.00 0.00 O ATOM 585 NE2 GLN A 62 8.933 -4.968 9.524 1.00 0.00 N ATOM 0 H GLN A 62 5.330 -7.805 6.177 1.00 0.00 H new ATOM 0 HA GLN A 62 7.355 -5.746 5.265 1.00 0.00 H new ATOM 0 HB2 GLN A 62 6.736 -6.275 7.781 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.490 -7.832 7.503 1.00 0.00 H new ATOM 0 HG2 GLN A 62 9.525 -6.873 7.873 1.00 0.00 H new ATOM 0 HG3 GLN A 62 9.307 -5.915 6.421 1.00 0.00 H new ATOM 0 HE21 GLN A 62 9.188 -5.858 9.952 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.843 -4.131 10.101 1.00 0.00 H new ATOM 594 N PRO A 63 8.078 -7.467 3.623 1.00 0.00 N ATOM 595 CA PRO A 63 8.794 -8.406 2.720 1.00 0.00 C ATOM 596 C PRO A 63 10.297 -8.428 3.046 1.00 0.00 C ATOM 597 O PRO A 63 10.779 -7.599 3.795 1.00 0.00 O ATOM 598 CB PRO A 63 8.542 -7.825 1.331 1.00 0.00 C ATOM 599 CG PRO A 63 8.276 -6.371 1.556 1.00 0.00 C ATOM 600 CD PRO A 63 7.705 -6.225 2.940 1.00 0.00 C ATOM 0 HA PRO A 63 8.453 -9.437 2.813 1.00 0.00 H new ATOM 0 HB2 PRO A 63 9.404 -7.971 0.681 1.00 0.00 H new ATOM 0 HB3 PRO A 63 7.693 -8.311 0.849 1.00 0.00 H new ATOM 0 HG2 PRO A 63 9.195 -5.793 1.457 1.00 0.00 H new ATOM 0 HG3 PRO A 63 7.578 -5.989 0.811 1.00 0.00 H new ATOM 0 HD2 PRO A 63 8.116 -5.353 3.449 1.00 0.00 H new ATOM 0 HD3 PRO A 63 6.623 -6.097 2.912 1.00 0.00 H new ATOM 608 N PRO A 64 10.990 -9.385 2.471 1.00 0.00 N ATOM 609 CA PRO A 64 12.453 -9.520 2.708 1.00 0.00 C ATOM 610 C PRO A 64 13.220 -8.367 2.047 1.00 0.00 C ATOM 611 O PRO A 64 12.837 -7.880 1.002 1.00 0.00 O ATOM 612 CB PRO A 64 12.800 -10.856 2.054 1.00 0.00 C ATOM 613 CG PRO A 64 11.737 -11.069 1.025 1.00 0.00 C ATOM 614 CD PRO A 64 10.487 -10.418 1.554 1.00 0.00 C ATOM 0 HA PRO A 64 12.719 -9.486 3.765 1.00 0.00 H new ATOM 0 HB2 PRO A 64 13.790 -10.828 1.599 1.00 0.00 H new ATOM 0 HB3 PRO A 64 12.809 -11.664 2.786 1.00 0.00 H new ATOM 0 HG2 PRO A 64 12.028 -10.630 0.071 1.00 0.00 H new ATOM 0 HG3 PRO A 64 11.575 -12.133 0.850 1.00 0.00 H new ATOM 0 HD2 PRO A 64 9.891 -9.984 0.751 1.00 0.00 H new ATOM 0 HD3 PRO A 64 9.850 -11.136 2.071 1.00 0.00 H new ATOM 622 N LYS A 65 14.302 -7.933 2.658 1.00 0.00 N ATOM 623 CA LYS A 65 15.116 -6.811 2.085 1.00 0.00 C ATOM 624 C LYS A 65 14.227 -5.590 1.806 1.00 0.00 C ATOM 625 O LYS A 65 13.782 -5.376 0.693 1.00 0.00 O ATOM 626 CB LYS A 65 15.714 -7.359 0.781 1.00 0.00 C ATOM 627 CG LYS A 65 16.504 -8.642 1.062 1.00 0.00 C ATOM 628 CD LYS A 65 17.811 -8.297 1.780 1.00 0.00 C ATOM 629 CE LYS A 65 18.988 -8.465 0.813 1.00 0.00 C ATOM 630 NZ LYS A 65 20.047 -7.553 1.327 1.00 0.00 N ATOM 0 H LYS A 65 14.657 -8.312 3.536 1.00 0.00 H new ATOM 0 HA LYS A 65 15.894 -6.482 2.774 1.00 0.00 H new ATOM 0 HB2 LYS A 65 14.918 -7.562 0.064 1.00 0.00 H new ATOM 0 HB3 LYS A 65 16.367 -6.612 0.329 1.00 0.00 H new ATOM 0 HG2 LYS A 65 15.909 -9.320 1.675 1.00 0.00 H new ATOM 0 HG3 LYS A 65 16.717 -9.161 0.128 1.00 0.00 H new ATOM 0 HD2 LYS A 65 17.775 -7.273 2.150 1.00 0.00 H new ATOM 0 HD3 LYS A 65 17.944 -8.945 2.647 1.00 0.00 H new ATOM 0 HE2 LYS A 65 19.335 -9.498 0.790 1.00 0.00 H new ATOM 0 HE3 LYS A 65 18.702 -8.202 -0.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 20.247 -6.819 0.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 19.722 -7.105 2.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 20.913 -8.098 1.515 1.00 0.00 H new ATOM 644 N ALA A 66 13.956 -4.795 2.808 1.00 0.00 N ATOM 645 CA ALA A 66 13.085 -3.594 2.603 1.00 0.00 C ATOM 646 C ALA A 66 13.806 -2.307 3.029 1.00 0.00 C ATOM 647 O ALA A 66 13.650 -1.273 2.408 1.00 0.00 O ATOM 648 CB ALA A 66 11.862 -3.838 3.489 1.00 0.00 C ATOM 0 H ALA A 66 14.299 -4.923 3.760 1.00 0.00 H new ATOM 0 HA ALA A 66 12.819 -3.464 1.554 1.00 0.00 H new ATOM 0 HB1 ALA A 66 11.172 -3.000 3.395 1.00 0.00 H new ATOM 0 HB2 ALA A 66 11.363 -4.755 3.176 1.00 0.00 H new ATOM 0 HB3 ALA A 66 12.178 -3.933 4.528 1.00 0.00 H new ATOM 654 N ASP A 67 14.580 -2.361 4.085 1.00 0.00 N ATOM 655 CA ASP A 67 15.303 -1.141 4.561 1.00 0.00 C ATOM 656 C ASP A 67 16.749 -1.127 4.043 1.00 0.00 C ATOM 657 O ASP A 67 17.678 -0.848 4.778 1.00 0.00 O ATOM 658 CB ASP A 67 15.271 -1.243 6.089 1.00 0.00 C ATOM 659 CG ASP A 67 14.684 0.041 6.678 1.00 0.00 C ATOM 660 OD1 ASP A 67 13.491 0.252 6.521 1.00 0.00 O ATOM 661 OD2 ASP A 67 15.436 0.792 7.277 1.00 0.00 O ATOM 0 H ASP A 67 14.743 -3.201 4.640 1.00 0.00 H new ATOM 0 HA ASP A 67 14.842 -0.221 4.201 1.00 0.00 H new ATOM 0 HB2 ASP A 67 14.672 -2.101 6.394 1.00 0.00 H new ATOM 0 HB3 ASP A 67 16.278 -1.404 6.474 1.00 0.00 H new ATOM 666 N GLU A 68 16.940 -1.425 2.779 1.00 0.00 N ATOM 667 CA GLU A 68 18.315 -1.435 2.182 1.00 0.00 C ATOM 668 C GLU A 68 18.234 -1.824 0.696 1.00 0.00 C ATOM 669 O GLU A 68 17.169 -1.817 0.110 1.00 0.00 O ATOM 670 CB GLU A 68 19.097 -2.495 2.973 1.00 0.00 C ATOM 671 CG GLU A 68 20.276 -1.838 3.706 1.00 0.00 C ATOM 672 CD GLU A 68 21.263 -1.251 2.691 1.00 0.00 C ATOM 673 OE1 GLU A 68 21.824 -2.016 1.924 1.00 0.00 O ATOM 674 OE2 GLU A 68 21.440 -0.044 2.698 1.00 0.00 O ATOM 0 H GLU A 68 16.192 -1.665 2.128 1.00 0.00 H new ATOM 0 HA GLU A 68 18.796 -0.458 2.237 1.00 0.00 H new ATOM 0 HB2 GLU A 68 18.439 -2.984 3.691 1.00 0.00 H new ATOM 0 HB3 GLU A 68 19.463 -3.268 2.298 1.00 0.00 H new ATOM 0 HG2 GLU A 68 19.911 -1.052 4.367 1.00 0.00 H new ATOM 0 HG3 GLU A 68 20.780 -2.573 4.333 1.00 0.00 H new ATOM 681 N ASP A 69 19.352 -2.171 0.089 1.00 0.00 N ATOM 682 CA ASP A 69 19.363 -2.577 -1.362 1.00 0.00 C ATOM 683 C ASP A 69 18.753 -1.473 -2.249 1.00 0.00 C ATOM 684 O ASP A 69 17.633 -1.591 -2.711 1.00 0.00 O ATOM 685 CB ASP A 69 18.526 -3.863 -1.444 1.00 0.00 C ATOM 686 CG ASP A 69 19.038 -4.896 -0.437 1.00 0.00 C ATOM 687 OD1 ASP A 69 20.122 -5.415 -0.645 1.00 0.00 O ATOM 688 OD2 ASP A 69 18.334 -5.160 0.524 1.00 0.00 O ATOM 0 H ASP A 69 20.266 -2.190 0.541 1.00 0.00 H new ATOM 0 HA ASP A 69 20.380 -2.736 -1.721 1.00 0.00 H new ATOM 0 HB2 ASP A 69 17.479 -3.637 -1.243 1.00 0.00 H new ATOM 0 HB3 ASP A 69 18.575 -4.273 -2.453 1.00 0.00 H new ATOM 693 N PRO A 70 19.522 -0.432 -2.454 1.00 0.00 N ATOM 694 CA PRO A 70 19.061 0.713 -3.285 1.00 0.00 C ATOM 695 C PRO A 70 19.088 0.368 -4.784 1.00 0.00 C ATOM 696 O PRO A 70 18.123 0.588 -5.493 1.00 0.00 O ATOM 697 CB PRO A 70 20.063 1.817 -2.955 1.00 0.00 C ATOM 698 CG PRO A 70 21.300 1.108 -2.496 1.00 0.00 C ATOM 699 CD PRO A 70 20.878 -0.227 -1.933 1.00 0.00 C ATOM 0 HA PRO A 70 18.030 0.997 -3.076 1.00 0.00 H new ATOM 0 HB2 PRO A 70 20.267 2.437 -3.828 1.00 0.00 H new ATOM 0 HB3 PRO A 70 19.678 2.478 -2.178 1.00 0.00 H new ATOM 0 HG2 PRO A 70 21.994 0.972 -3.326 1.00 0.00 H new ATOM 0 HG3 PRO A 70 21.820 1.696 -1.739 1.00 0.00 H new ATOM 0 HD2 PRO A 70 21.551 -1.023 -2.252 1.00 0.00 H new ATOM 0 HD3 PRO A 70 20.888 -0.219 -0.843 1.00 0.00 H new ATOM 707 N GLY A 71 20.181 -0.169 -5.272 1.00 0.00 N ATOM 708 CA GLY A 71 20.269 -0.525 -6.722 1.00 0.00 C ATOM 709 C GLY A 71 19.428 -1.777 -7.009 1.00 0.00 C ATOM 710 O GLY A 71 18.912 -1.947 -8.096 1.00 0.00 O ATOM 0 H GLY A 71 21.017 -0.376 -4.726 1.00 0.00 H new ATOM 0 HA2 GLY A 71 19.916 0.307 -7.331 1.00 0.00 H new ATOM 0 HA3 GLY A 71 21.308 -0.704 -6.998 1.00 0.00 H new ATOM 714 N THR A 72 19.294 -2.654 -6.044 1.00 0.00 N ATOM 715 CA THR A 72 18.490 -3.900 -6.257 1.00 0.00 C ATOM 716 C THR A 72 16.987 -3.588 -6.151 1.00 0.00 C ATOM 717 O THR A 72 16.600 -2.631 -5.509 1.00 0.00 O ATOM 718 CB THR A 72 18.911 -4.879 -5.141 1.00 0.00 C ATOM 719 OG1 THR A 72 19.897 -4.288 -4.298 1.00 0.00 O ATOM 720 CG2 THR A 72 19.477 -6.157 -5.767 1.00 0.00 C ATOM 0 H THR A 72 19.707 -2.561 -5.116 1.00 0.00 H new ATOM 0 HA THR A 72 18.667 -4.323 -7.246 1.00 0.00 H new ATOM 0 HB THR A 72 18.034 -5.118 -4.540 1.00 0.00 H new ATOM 0 HG1 THR A 72 20.173 -4.934 -3.615 1.00 0.00 H new ATOM 0 HG21 THR A 72 19.774 -6.848 -4.978 1.00 0.00 H new ATOM 0 HG22 THR A 72 18.715 -6.625 -6.391 1.00 0.00 H new ATOM 0 HG23 THR A 72 20.345 -5.909 -6.378 1.00 0.00 H new ATOM 728 N PRO A 73 16.187 -4.419 -6.782 1.00 0.00 N ATOM 729 CA PRO A 73 14.710 -4.232 -6.755 1.00 0.00 C ATOM 730 C PRO A 73 14.153 -4.518 -5.352 1.00 0.00 C ATOM 731 O PRO A 73 14.652 -5.366 -4.635 1.00 0.00 O ATOM 732 CB PRO A 73 14.199 -5.252 -7.771 1.00 0.00 C ATOM 733 CG PRO A 73 15.266 -6.298 -7.832 1.00 0.00 C ATOM 734 CD PRO A 73 16.573 -5.598 -7.570 1.00 0.00 C ATOM 0 HA PRO A 73 14.403 -3.214 -6.994 1.00 0.00 H new ATOM 0 HB2 PRO A 73 13.245 -5.678 -7.459 1.00 0.00 H new ATOM 0 HB3 PRO A 73 14.039 -4.793 -8.746 1.00 0.00 H new ATOM 0 HG2 PRO A 73 15.088 -7.076 -7.090 1.00 0.00 H new ATOM 0 HG3 PRO A 73 15.276 -6.784 -8.807 1.00 0.00 H new ATOM 0 HD2 PRO A 73 17.266 -6.236 -7.022 1.00 0.00 H new ATOM 0 HD3 PRO A 73 17.068 -5.314 -8.499 1.00 0.00 H new ATOM 742 N LYS A 74 13.125 -3.808 -4.959 1.00 0.00 N ATOM 743 CA LYS A 74 12.530 -4.016 -3.609 1.00 0.00 C ATOM 744 C LYS A 74 11.201 -4.770 -3.713 1.00 0.00 C ATOM 745 O LYS A 74 10.268 -4.299 -4.338 1.00 0.00 O ATOM 746 CB LYS A 74 12.298 -2.608 -3.057 1.00 0.00 C ATOM 747 CG LYS A 74 12.463 -2.623 -1.537 1.00 0.00 C ATOM 748 CD LYS A 74 13.722 -1.842 -1.152 1.00 0.00 C ATOM 749 CE LYS A 74 14.970 -2.607 -1.607 1.00 0.00 C ATOM 750 NZ LYS A 74 15.238 -3.614 -0.538 1.00 0.00 N ATOM 0 H LYS A 74 12.671 -3.089 -5.522 1.00 0.00 H new ATOM 0 HA LYS A 74 13.180 -4.611 -2.967 1.00 0.00 H new ATOM 0 HB2 LYS A 74 13.006 -1.910 -3.503 1.00 0.00 H new ATOM 0 HB3 LYS A 74 11.299 -2.262 -3.322 1.00 0.00 H new ATOM 0 HG2 LYS A 74 11.588 -2.180 -1.061 1.00 0.00 H new ATOM 0 HG3 LYS A 74 12.535 -3.650 -1.179 1.00 0.00 H new ATOM 0 HD2 LYS A 74 13.703 -0.854 -1.612 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.751 -1.691 -0.073 1.00 0.00 H new ATOM 0 HE2 LYS A 74 14.803 -3.092 -2.569 1.00 0.00 H new ATOM 0 HE3 LYS A 74 15.818 -1.934 -1.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 15.661 -4.465 -0.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 15.895 -3.212 0.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.345 -3.868 -0.068 1.00 0.00 H new ATOM 764 N PRO A 75 11.157 -5.915 -3.078 1.00 0.00 N ATOM 765 CA PRO A 75 9.925 -6.737 -3.079 1.00 0.00 C ATOM 766 C PRO A 75 8.876 -6.080 -2.176 1.00 0.00 C ATOM 767 O PRO A 75 9.107 -5.859 -1.005 1.00 0.00 O ATOM 768 CB PRO A 75 10.385 -8.078 -2.514 1.00 0.00 C ATOM 769 CG PRO A 75 11.592 -7.759 -1.693 1.00 0.00 C ATOM 770 CD PRO A 75 12.238 -6.548 -2.312 1.00 0.00 C ATOM 0 HA PRO A 75 9.466 -6.845 -4.062 1.00 0.00 H new ATOM 0 HB2 PRO A 75 9.606 -8.539 -1.907 1.00 0.00 H new ATOM 0 HB3 PRO A 75 10.625 -8.781 -3.312 1.00 0.00 H new ATOM 0 HG2 PRO A 75 11.313 -7.561 -0.658 1.00 0.00 H new ATOM 0 HG3 PRO A 75 12.284 -8.601 -1.681 1.00 0.00 H new ATOM 0 HD2 PRO A 75 12.634 -5.875 -1.551 1.00 0.00 H new ATOM 0 HD3 PRO A 75 13.072 -6.827 -2.956 1.00 0.00 H new ATOM 778 N VAL A 76 7.738 -5.754 -2.721 1.00 0.00 N ATOM 779 CA VAL A 76 6.669 -5.096 -1.909 1.00 0.00 C ATOM 780 C VAL A 76 5.471 -6.037 -1.759 1.00 0.00 C ATOM 781 O VAL A 76 5.124 -6.766 -2.670 1.00 0.00 O ATOM 782 CB VAL A 76 6.261 -3.840 -2.692 1.00 0.00 C ATOM 783 CG1 VAL A 76 5.553 -2.864 -1.754 1.00 0.00 C ATOM 784 CG2 VAL A 76 7.498 -3.155 -3.285 1.00 0.00 C ATOM 0 H VAL A 76 7.498 -5.915 -3.699 1.00 0.00 H new ATOM 0 HA VAL A 76 7.019 -4.848 -0.907 1.00 0.00 H new ATOM 0 HB VAL A 76 5.592 -4.134 -3.501 1.00 0.00 H new ATOM 0 HG11 VAL A 76 5.263 -1.972 -2.309 1.00 0.00 H new ATOM 0 HG12 VAL A 76 4.664 -3.338 -1.339 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.227 -2.584 -0.944 1.00 0.00 H new ATOM 0 HG21 VAL A 76 7.192 -2.266 -3.837 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.175 -2.867 -2.481 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.007 -3.844 -3.959 1.00 0.00 H new ATOM 794 N SER A 77 4.835 -6.019 -0.618 1.00 0.00 N ATOM 795 CA SER A 77 3.654 -6.909 -0.398 1.00 0.00 C ATOM 796 C SER A 77 2.629 -6.210 0.506 1.00 0.00 C ATOM 797 O SER A 77 2.962 -5.732 1.575 1.00 0.00 O ATOM 798 CB SER A 77 4.215 -8.157 0.289 1.00 0.00 C ATOM 799 OG SER A 77 5.325 -8.654 -0.454 1.00 0.00 O ATOM 0 H SER A 77 5.082 -5.425 0.174 1.00 0.00 H new ATOM 0 HA SER A 77 3.143 -7.155 -1.329 1.00 0.00 H new ATOM 0 HB2 SER A 77 4.524 -7.917 1.306 1.00 0.00 H new ATOM 0 HB3 SER A 77 3.442 -8.922 0.363 1.00 0.00 H new ATOM 0 HG SER A 77 5.684 -9.452 -0.012 1.00 0.00 H new ATOM 805 N PHE A 78 1.383 -6.147 0.086 1.00 0.00 N ATOM 806 CA PHE A 78 0.339 -5.475 0.926 1.00 0.00 C ATOM 807 C PHE A 78 -1.070 -5.897 0.500 1.00 0.00 C ATOM 808 O PHE A 78 -1.269 -6.499 -0.538 1.00 0.00 O ATOM 809 CB PHE A 78 0.520 -3.963 0.712 1.00 0.00 C ATOM 810 CG PHE A 78 0.672 -3.632 -0.761 1.00 0.00 C ATOM 811 CD1 PHE A 78 -0.446 -3.642 -1.605 1.00 0.00 C ATOM 812 CD2 PHE A 78 1.930 -3.298 -1.273 1.00 0.00 C ATOM 813 CE1 PHE A 78 -0.304 -3.318 -2.960 1.00 0.00 C ATOM 814 CE2 PHE A 78 2.073 -2.979 -2.630 1.00 0.00 C ATOM 815 CZ PHE A 78 0.955 -2.988 -3.472 1.00 0.00 C ATOM 0 H PHE A 78 1.047 -6.530 -0.798 1.00 0.00 H new ATOM 0 HA PHE A 78 0.453 -5.753 1.974 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -0.338 -3.430 1.121 1.00 0.00 H new ATOM 0 HB3 PHE A 78 1.398 -3.618 1.258 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -1.418 -3.900 -1.211 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.792 -3.286 -0.622 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -1.167 -3.323 -3.610 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.045 -2.726 -3.026 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.065 -2.740 -4.517 1.00 0.00 H new ATOM 825 N THR A 79 -2.047 -5.560 1.300 1.00 0.00 N ATOM 826 CA THR A 79 -3.458 -5.908 0.964 1.00 0.00 C ATOM 827 C THR A 79 -4.253 -4.630 0.706 1.00 0.00 C ATOM 828 O THR A 79 -4.124 -3.652 1.418 1.00 0.00 O ATOM 829 CB THR A 79 -4.017 -6.650 2.185 1.00 0.00 C ATOM 830 OG1 THR A 79 -3.648 -5.968 3.379 1.00 0.00 O ATOM 831 CG2 THR A 79 -3.472 -8.080 2.211 1.00 0.00 C ATOM 0 H THR A 79 -1.926 -5.055 2.178 1.00 0.00 H new ATOM 0 HA THR A 79 -3.522 -6.525 0.068 1.00 0.00 H new ATOM 0 HB THR A 79 -5.105 -6.681 2.119 1.00 0.00 H new ATOM 0 HG1 THR A 79 -3.718 -6.581 4.141 1.00 0.00 H new ATOM 0 HG21 THR A 79 -3.870 -8.605 3.079 1.00 0.00 H new ATOM 0 HG22 THR A 79 -3.773 -8.601 1.302 1.00 0.00 H new ATOM 0 HG23 THR A 79 -2.384 -8.054 2.271 1.00 0.00 H new ATOM 839 N VAL A 80 -5.076 -4.636 -0.307 1.00 0.00 N ATOM 840 CA VAL A 80 -5.893 -3.422 -0.621 1.00 0.00 C ATOM 841 C VAL A 80 -7.385 -3.765 -0.549 1.00 0.00 C ATOM 842 O VAL A 80 -7.789 -4.880 -0.828 1.00 0.00 O ATOM 843 CB VAL A 80 -5.477 -2.992 -2.037 1.00 0.00 C ATOM 844 CG1 VAL A 80 -3.989 -2.620 -2.042 1.00 0.00 C ATOM 845 CG2 VAL A 80 -5.717 -4.133 -3.032 1.00 0.00 C ATOM 0 H VAL A 80 -5.220 -5.428 -0.933 1.00 0.00 H new ATOM 0 HA VAL A 80 -5.725 -2.613 0.090 1.00 0.00 H new ATOM 0 HB VAL A 80 -6.075 -2.130 -2.333 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.694 -2.315 -3.046 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -3.817 -1.798 -1.348 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -3.397 -3.483 -1.736 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -5.418 -3.814 -4.030 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -5.129 -5.002 -2.737 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -6.775 -4.395 -3.037 1.00 0.00 H new ATOM 855 N LYS A 81 -8.202 -2.818 -0.164 1.00 0.00 N ATOM 856 CA LYS A 81 -9.669 -3.083 -0.050 1.00 0.00 C ATOM 857 C LYS A 81 -10.474 -2.050 -0.853 1.00 0.00 C ATOM 858 O LYS A 81 -10.018 -0.950 -1.108 1.00 0.00 O ATOM 859 CB LYS A 81 -9.963 -2.968 1.453 1.00 0.00 C ATOM 860 CG LYS A 81 -11.459 -2.733 1.683 1.00 0.00 C ATOM 861 CD LYS A 81 -11.851 -3.261 3.061 1.00 0.00 C ATOM 862 CE LYS A 81 -12.776 -4.468 2.891 1.00 0.00 C ATOM 863 NZ LYS A 81 -12.614 -5.264 4.142 1.00 0.00 N ATOM 0 H LYS A 81 -7.916 -1.869 0.077 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.949 -4.057 -0.450 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.648 -3.878 1.963 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -9.388 -2.147 1.882 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -11.686 -1.669 1.611 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -12.040 -3.236 0.910 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -10.961 -3.546 3.622 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -12.352 -2.481 3.634 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.811 -4.155 2.755 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -12.502 -5.054 2.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.549 -5.560 4.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -12.035 -6.105 3.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.145 -4.682 4.865 1.00 0.00 H new ATOM 877 N GLU A 82 -11.670 -2.412 -1.251 1.00 0.00 N ATOM 878 CA GLU A 82 -12.539 -1.478 -2.042 1.00 0.00 C ATOM 879 C GLU A 82 -12.979 -0.275 -1.191 1.00 0.00 C ATOM 880 O GLU A 82 -13.283 -0.409 -0.018 1.00 0.00 O ATOM 881 CB GLU A 82 -13.766 -2.316 -2.426 1.00 0.00 C ATOM 882 CG GLU A 82 -13.989 -2.256 -3.941 1.00 0.00 C ATOM 883 CD GLU A 82 -15.027 -3.308 -4.365 1.00 0.00 C ATOM 884 OE1 GLU A 82 -15.069 -4.365 -3.751 1.00 0.00 O ATOM 885 OE2 GLU A 82 -15.760 -3.038 -5.303 1.00 0.00 O ATOM 0 H GLU A 82 -12.087 -3.323 -1.061 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.011 -1.076 -2.907 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -13.623 -3.350 -2.112 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -14.648 -1.944 -1.905 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -14.331 -1.261 -4.227 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -13.048 -2.432 -4.462 1.00 0.00 H new ATOM 892 N THR A 83 -13.037 0.894 -1.784 1.00 0.00 N ATOM 893 CA THR A 83 -13.483 2.112 -1.029 1.00 0.00 C ATOM 894 C THR A 83 -14.903 2.498 -1.461 1.00 0.00 C ATOM 895 O THR A 83 -15.436 1.960 -2.415 1.00 0.00 O ATOM 896 CB THR A 83 -12.497 3.227 -1.402 1.00 0.00 C ATOM 897 OG1 THR A 83 -12.398 3.328 -2.817 1.00 0.00 O ATOM 898 CG2 THR A 83 -11.121 2.923 -0.810 1.00 0.00 C ATOM 0 H THR A 83 -12.794 1.059 -2.761 1.00 0.00 H new ATOM 0 HA THR A 83 -13.497 1.937 0.047 1.00 0.00 H new ATOM 0 HB THR A 83 -12.859 4.173 -0.998 1.00 0.00 H new ATOM 0 HG1 THR A 83 -13.164 3.832 -3.163 1.00 0.00 H new ATOM 0 HG21 THR A 83 -10.426 3.718 -1.078 1.00 0.00 H new ATOM 0 HG22 THR A 83 -11.198 2.859 0.275 1.00 0.00 H new ATOM 0 HG23 THR A 83 -10.757 1.974 -1.204 1.00 0.00 H new ATOM 906 N VAL A 84 -15.520 3.428 -0.773 1.00 0.00 N ATOM 907 CA VAL A 84 -16.909 3.846 -1.157 1.00 0.00 C ATOM 908 C VAL A 84 -16.910 4.536 -2.533 1.00 0.00 C ATOM 909 O VAL A 84 -17.934 4.623 -3.183 1.00 0.00 O ATOM 910 CB VAL A 84 -17.386 4.822 -0.066 1.00 0.00 C ATOM 911 CG1 VAL A 84 -17.343 4.140 1.306 1.00 0.00 C ATOM 912 CG2 VAL A 84 -16.491 6.066 -0.045 1.00 0.00 C ATOM 0 H VAL A 84 -15.127 3.914 0.033 1.00 0.00 H new ATOM 0 HA VAL A 84 -17.570 2.983 -1.233 1.00 0.00 H new ATOM 0 HB VAL A 84 -18.411 5.119 -0.289 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -17.682 4.839 2.071 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -17.994 3.266 1.298 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -16.322 3.829 1.526 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -16.837 6.750 0.730 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -15.463 5.771 0.164 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -16.536 6.563 -1.014 1.00 0.00 H new ATOM 922 N CYS A 85 -15.777 5.030 -2.978 1.00 0.00 N ATOM 923 CA CYS A 85 -15.727 5.717 -4.305 1.00 0.00 C ATOM 924 C CYS A 85 -15.328 4.739 -5.418 1.00 0.00 C ATOM 925 O CYS A 85 -14.398 3.969 -5.263 1.00 0.00 O ATOM 926 CB CYS A 85 -14.659 6.799 -4.161 1.00 0.00 C ATOM 927 SG CYS A 85 -15.337 8.206 -3.251 1.00 0.00 S ATOM 0 H CYS A 85 -14.888 4.986 -2.479 1.00 0.00 H new ATOM 0 HA CYS A 85 -16.701 6.125 -4.575 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -13.791 6.399 -3.637 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -14.318 7.120 -5.145 1.00 0.00 H new ATOM 932 N PRO A 86 -16.039 4.821 -6.517 1.00 0.00 N ATOM 933 CA PRO A 86 -15.746 3.953 -7.683 1.00 0.00 C ATOM 934 C PRO A 86 -14.517 4.487 -8.437 1.00 0.00 C ATOM 935 O PRO A 86 -13.759 5.285 -7.919 1.00 0.00 O ATOM 936 CB PRO A 86 -17.007 4.062 -8.536 1.00 0.00 C ATOM 937 CG PRO A 86 -17.622 5.378 -8.171 1.00 0.00 C ATOM 938 CD PRO A 86 -17.176 5.719 -6.772 1.00 0.00 C ATOM 0 HA PRO A 86 -15.516 2.922 -7.413 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -16.767 4.022 -9.599 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -17.691 3.239 -8.332 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -17.311 6.153 -8.871 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -18.709 5.320 -8.222 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -16.880 6.765 -6.694 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -17.977 5.559 -6.050 1.00 0.00 H new ATOM 946 N ARG A 87 -14.316 4.054 -9.654 1.00 0.00 N ATOM 947 CA ARG A 87 -13.143 4.538 -10.442 1.00 0.00 C ATOM 948 C ARG A 87 -13.552 4.779 -11.905 1.00 0.00 C ATOM 949 O ARG A 87 -14.440 4.115 -12.407 1.00 0.00 O ATOM 950 CB ARG A 87 -12.112 3.410 -10.348 1.00 0.00 C ATOM 951 CG ARG A 87 -10.918 3.868 -9.505 1.00 0.00 C ATOM 952 CD ARG A 87 -9.696 4.065 -10.406 1.00 0.00 C ATOM 953 NE ARG A 87 -9.292 2.690 -10.823 1.00 0.00 N ATOM 954 CZ ARG A 87 -8.841 2.481 -12.032 1.00 0.00 C ATOM 955 NH1 ARG A 87 -7.838 3.189 -12.486 1.00 0.00 N ATOM 956 NH2 ARG A 87 -9.388 1.564 -12.786 1.00 0.00 N ATOM 0 H ARG A 87 -14.915 3.385 -10.138 1.00 0.00 H new ATOM 0 HA ARG A 87 -12.749 5.481 -10.064 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -12.567 2.526 -9.901 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -11.777 3.127 -11.346 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -11.158 4.800 -8.993 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -10.699 3.128 -8.735 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -9.939 4.683 -11.270 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -8.890 4.567 -9.872 1.00 0.00 H new ATOM 0 HE ARG A 87 -9.368 1.914 -10.165 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -7.409 3.903 -11.897 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -7.485 3.027 -13.429 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -10.168 1.010 -12.431 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -9.035 1.402 -13.729 1.00 0.00 H new ATOM 970 N PRO A 88 -12.896 5.720 -12.552 1.00 0.00 N ATOM 971 CA PRO A 88 -11.812 6.519 -11.916 1.00 0.00 C ATOM 972 C PRO A 88 -12.386 7.702 -11.116 1.00 0.00 C ATOM 973 O PRO A 88 -13.360 8.314 -11.510 1.00 0.00 O ATOM 974 CB PRO A 88 -11.009 7.026 -13.112 1.00 0.00 C ATOM 975 CG PRO A 88 -11.967 7.050 -14.265 1.00 0.00 C ATOM 976 CD PRO A 88 -13.109 6.115 -13.950 1.00 0.00 C ATOM 0 HA PRO A 88 -11.221 5.939 -11.207 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -10.604 8.020 -12.919 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -10.162 6.372 -13.320 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -12.338 8.062 -14.429 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -11.465 6.742 -15.182 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -14.072 6.609 -14.079 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -13.104 5.248 -14.611 1.00 0.00 H new ATOM 984 N THR A 89 -11.771 8.037 -10.006 1.00 0.00 N ATOM 985 CA THR A 89 -12.256 9.192 -9.186 1.00 0.00 C ATOM 986 C THR A 89 -11.352 10.412 -9.439 1.00 0.00 C ATOM 987 O THR A 89 -10.252 10.281 -9.942 1.00 0.00 O ATOM 988 CB THR A 89 -12.159 8.718 -7.724 1.00 0.00 C ATOM 989 OG1 THR A 89 -13.212 7.804 -7.455 1.00 0.00 O ATOM 990 CG2 THR A 89 -12.275 9.906 -6.765 1.00 0.00 C ATOM 0 H THR A 89 -10.952 7.558 -9.632 1.00 0.00 H new ATOM 0 HA THR A 89 -13.274 9.492 -9.434 1.00 0.00 H new ATOM 0 HB THR A 89 -11.193 8.235 -7.577 1.00 0.00 H new ATOM 0 HG1 THR A 89 -12.981 6.923 -7.817 1.00 0.00 H new ATOM 0 HG21 THR A 89 -12.204 9.552 -5.737 1.00 0.00 H new ATOM 0 HG22 THR A 89 -11.469 10.612 -6.962 1.00 0.00 H new ATOM 0 HG23 THR A 89 -13.235 10.401 -6.913 1.00 0.00 H new ATOM 998 N ARG A 90 -11.807 11.594 -9.097 1.00 0.00 N ATOM 999 CA ARG A 90 -10.970 12.816 -9.323 1.00 0.00 C ATOM 1000 C ARG A 90 -9.730 12.801 -8.414 1.00 0.00 C ATOM 1001 O ARG A 90 -8.627 13.043 -8.863 1.00 0.00 O ATOM 1002 CB ARG A 90 -11.880 14.000 -8.976 1.00 0.00 C ATOM 1003 CG ARG A 90 -11.489 15.215 -9.823 1.00 0.00 C ATOM 1004 CD ARG A 90 -12.478 15.377 -10.983 1.00 0.00 C ATOM 1005 NE ARG A 90 -11.877 14.621 -12.121 1.00 0.00 N ATOM 1006 CZ ARG A 90 -12.232 14.896 -13.347 1.00 0.00 C ATOM 1007 NH1 ARG A 90 -13.277 14.308 -13.870 1.00 0.00 N ATOM 1008 NH2 ARG A 90 -11.543 15.758 -14.048 1.00 0.00 N ATOM 0 H ARG A 90 -12.719 11.765 -8.673 1.00 0.00 H new ATOM 0 HA ARG A 90 -10.604 12.872 -10.348 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -12.922 13.737 -9.159 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -11.793 14.240 -7.916 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -11.486 16.114 -9.207 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.478 15.090 -10.210 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -13.459 14.980 -10.722 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -12.616 16.428 -11.238 1.00 0.00 H new ATOM 0 HE ARG A 90 -11.189 13.890 -11.941 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -13.813 13.636 -13.320 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -13.556 14.521 -14.828 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -10.729 16.215 -13.637 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -11.819 15.974 -15.006 1.00 0.00 H new ATOM 1022 N GLN A 91 -9.905 12.527 -7.143 1.00 0.00 N ATOM 1023 CA GLN A 91 -8.744 12.503 -6.205 1.00 0.00 C ATOM 1024 C GLN A 91 -8.339 11.053 -5.875 1.00 0.00 C ATOM 1025 O GLN A 91 -8.974 10.116 -6.327 1.00 0.00 O ATOM 1026 CB GLN A 91 -9.248 13.230 -4.953 1.00 0.00 C ATOM 1027 CG GLN A 91 -8.726 14.669 -4.947 1.00 0.00 C ATOM 1028 CD GLN A 91 -9.814 15.610 -5.475 1.00 0.00 C ATOM 1029 OE1 GLN A 91 -10.570 16.173 -4.708 1.00 0.00 O ATOM 1030 NE2 GLN A 91 -9.928 15.805 -6.760 1.00 0.00 N ATOM 0 H GLN A 91 -10.807 12.318 -6.716 1.00 0.00 H new ATOM 0 HA GLN A 91 -7.858 12.976 -6.628 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -10.338 13.228 -4.934 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -8.912 12.707 -4.057 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -8.439 14.959 -3.936 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -7.832 14.745 -5.566 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -9.295 15.333 -7.406 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -10.651 16.429 -7.119 1.00 0.00 H new ATOM 1039 N PRO A 92 -7.289 10.919 -5.089 1.00 0.00 N ATOM 1040 CA PRO A 92 -6.790 9.571 -4.686 1.00 0.00 C ATOM 1041 C PRO A 92 -7.791 8.869 -3.752 1.00 0.00 C ATOM 1042 O PRO A 92 -8.729 9.482 -3.278 1.00 0.00 O ATOM 1043 CB PRO A 92 -5.478 9.879 -3.960 1.00 0.00 C ATOM 1044 CG PRO A 92 -5.624 11.287 -3.486 1.00 0.00 C ATOM 1045 CD PRO A 92 -6.471 11.995 -4.506 1.00 0.00 C ATOM 0 HA PRO A 92 -6.657 8.896 -5.531 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -5.318 9.196 -3.126 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -4.623 9.773 -4.627 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -6.093 11.319 -2.503 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -4.650 11.767 -3.390 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -7.091 12.765 -4.047 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -5.859 12.487 -5.262 1.00 0.00 H new ATOM 1053 N PRO A 93 -7.556 7.596 -3.518 1.00 0.00 N ATOM 1054 CA PRO A 93 -8.454 6.798 -2.633 1.00 0.00 C ATOM 1055 C PRO A 93 -8.429 7.320 -1.186 1.00 0.00 C ATOM 1056 O PRO A 93 -9.395 7.174 -0.460 1.00 0.00 O ATOM 1057 CB PRO A 93 -7.889 5.380 -2.737 1.00 0.00 C ATOM 1058 CG PRO A 93 -6.465 5.569 -3.146 1.00 0.00 C ATOM 1059 CD PRO A 93 -6.445 6.782 -4.035 1.00 0.00 C ATOM 0 HA PRO A 93 -9.501 6.854 -2.929 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -7.961 4.854 -1.785 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -8.437 4.788 -3.470 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -5.825 5.713 -2.275 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -6.091 4.692 -3.675 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -5.494 7.312 -3.972 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -6.593 6.517 -5.082 1.00 0.00 H new ATOM 1067 N GLU A 94 -7.349 7.942 -0.769 1.00 0.00 N ATOM 1068 CA GLU A 94 -7.287 8.489 0.626 1.00 0.00 C ATOM 1069 C GLU A 94 -8.327 9.605 0.814 1.00 0.00 C ATOM 1070 O GLU A 94 -8.767 9.870 1.917 1.00 0.00 O ATOM 1071 CB GLU A 94 -5.860 9.033 0.798 1.00 0.00 C ATOM 1072 CG GLU A 94 -5.556 10.083 -0.279 1.00 0.00 C ATOM 1073 CD GLU A 94 -4.919 11.316 0.368 1.00 0.00 C ATOM 1074 OE1 GLU A 94 -5.660 12.169 0.828 1.00 0.00 O ATOM 1075 OE2 GLU A 94 -3.702 11.387 0.389 1.00 0.00 O ATOM 0 H GLU A 94 -6.512 8.094 -1.332 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.512 7.725 1.370 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -5.749 9.475 1.788 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -5.142 8.216 0.732 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -4.884 9.665 -1.028 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -6.474 10.364 -0.796 1.00 0.00 H new ATOM 1082 N LEU A 95 -8.732 10.249 -0.256 1.00 0.00 N ATOM 1083 CA LEU A 95 -9.753 11.335 -0.150 1.00 0.00 C ATOM 1084 C LEU A 95 -11.146 10.738 0.114 1.00 0.00 C ATOM 1085 O LEU A 95 -12.005 11.382 0.686 1.00 0.00 O ATOM 1086 CB LEU A 95 -9.716 12.039 -1.514 1.00 0.00 C ATOM 1087 CG LEU A 95 -10.864 13.051 -1.618 1.00 0.00 C ATOM 1088 CD1 LEU A 95 -10.297 14.450 -1.876 1.00 0.00 C ATOM 1089 CD2 LEU A 95 -11.787 12.650 -2.774 1.00 0.00 C ATOM 0 H LEU A 95 -8.396 10.066 -1.202 1.00 0.00 H new ATOM 0 HA LEU A 95 -9.546 12.020 0.672 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -8.760 12.547 -1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -9.797 11.303 -2.314 1.00 0.00 H new ATOM 0 HG LEU A 95 -11.428 13.060 -0.685 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -11.115 15.166 -1.949 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -9.639 14.733 -1.054 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -9.732 14.447 -2.808 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -12.605 13.366 -2.852 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -11.221 12.642 -3.706 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -12.192 11.656 -2.588 1.00 0.00 H new ATOM 1101 N CYS A 96 -11.375 9.519 -0.309 1.00 0.00 N ATOM 1102 CA CYS A 96 -12.710 8.888 -0.098 1.00 0.00 C ATOM 1103 C CYS A 96 -12.702 7.971 1.133 1.00 0.00 C ATOM 1104 O CYS A 96 -11.696 7.809 1.798 1.00 0.00 O ATOM 1105 CB CYS A 96 -12.970 8.091 -1.375 1.00 0.00 C ATOM 1106 SG CYS A 96 -13.696 9.192 -2.615 1.00 0.00 S ATOM 0 H CYS A 96 -10.692 8.935 -0.792 1.00 0.00 H new ATOM 0 HA CYS A 96 -13.487 9.629 0.089 1.00 0.00 H new ATOM 0 HB2 CYS A 96 -12.040 7.664 -1.749 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -13.643 7.259 -1.170 1.00 0.00 H new ATOM 1111 N ASP A 97 -13.833 7.387 1.444 1.00 0.00 N ATOM 1112 CA ASP A 97 -13.929 6.490 2.637 1.00 0.00 C ATOM 1113 C ASP A 97 -13.433 5.069 2.314 1.00 0.00 C ATOM 1114 O ASP A 97 -12.746 4.843 1.335 1.00 0.00 O ATOM 1115 CB ASP A 97 -15.419 6.473 2.998 1.00 0.00 C ATOM 1116 CG ASP A 97 -15.583 6.356 4.515 1.00 0.00 C ATOM 1117 OD1 ASP A 97 -15.521 7.377 5.177 1.00 0.00 O ATOM 1118 OD2 ASP A 97 -15.765 5.246 4.988 1.00 0.00 O ATOM 0 H ASP A 97 -14.700 7.494 0.918 1.00 0.00 H new ATOM 0 HA ASP A 97 -13.306 6.846 3.458 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -15.900 7.383 2.640 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -15.913 5.636 2.504 1.00 0.00 H new ATOM 1123 N PHE A 98 -13.780 4.119 3.149 1.00 0.00 N ATOM 1124 CA PHE A 98 -13.349 2.706 2.945 1.00 0.00 C ATOM 1125 C PHE A 98 -14.541 1.764 3.158 1.00 0.00 C ATOM 1126 O PHE A 98 -15.225 1.845 4.161 1.00 0.00 O ATOM 1127 CB PHE A 98 -12.300 2.474 4.038 1.00 0.00 C ATOM 1128 CG PHE A 98 -11.068 1.794 3.478 1.00 0.00 C ATOM 1129 CD1 PHE A 98 -11.177 0.845 2.453 1.00 0.00 C ATOM 1130 CD2 PHE A 98 -9.810 2.109 4.006 1.00 0.00 C ATOM 1131 CE1 PHE A 98 -10.029 0.218 1.958 1.00 0.00 C ATOM 1132 CE2 PHE A 98 -8.663 1.478 3.511 1.00 0.00 C ATOM 1133 CZ PHE A 98 -8.772 0.534 2.487 1.00 0.00 C ATOM 0 H PHE A 98 -14.355 4.270 3.978 1.00 0.00 H new ATOM 0 HA PHE A 98 -12.962 2.521 1.943 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -12.021 3.428 4.486 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -12.727 1.862 4.832 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -12.146 0.598 2.046 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -9.725 2.840 4.796 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -10.112 -0.511 1.166 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -7.694 1.721 3.921 1.00 0.00 H new ATOM 0 HZ PHE A 98 -7.887 0.048 2.104 1.00 0.00 H new ATOM 1143 N LYS A 99 -14.789 0.866 2.241 1.00 0.00 N ATOM 1144 CA LYS A 99 -15.932 -0.082 2.421 1.00 0.00 C ATOM 1145 C LYS A 99 -15.431 -1.381 3.043 1.00 0.00 C ATOM 1146 O LYS A 99 -14.750 -2.155 2.397 1.00 0.00 O ATOM 1147 CB LYS A 99 -16.483 -0.366 1.022 1.00 0.00 C ATOM 1148 CG LYS A 99 -17.136 0.893 0.452 1.00 0.00 C ATOM 1149 CD LYS A 99 -18.496 0.535 -0.156 1.00 0.00 C ATOM 1150 CE LYS A 99 -19.615 0.945 0.809 1.00 0.00 C ATOM 1151 NZ LYS A 99 -20.739 0.003 0.530 1.00 0.00 N ATOM 0 H LYS A 99 -14.255 0.747 1.380 1.00 0.00 H new ATOM 0 HA LYS A 99 -16.696 0.339 3.075 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -15.678 -0.697 0.366 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -17.212 -1.175 1.067 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -17.262 1.637 1.238 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -16.492 1.337 -0.307 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -18.623 1.042 -1.112 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -18.547 -0.536 -0.354 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -19.287 0.871 1.846 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -19.918 1.979 0.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -21.617 0.378 0.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -20.857 -0.102 -0.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -20.527 -0.924 0.951 1.00 0.00 H new ATOM 1165 N GLU A 100 -15.766 -1.638 4.280 1.00 0.00 N ATOM 1166 CA GLU A 100 -15.307 -2.910 4.918 1.00 0.00 C ATOM 1167 C GLU A 100 -15.925 -4.112 4.189 1.00 0.00 C ATOM 1168 O GLU A 100 -15.382 -5.201 4.199 1.00 0.00 O ATOM 1169 CB GLU A 100 -15.781 -2.844 6.374 1.00 0.00 C ATOM 1170 CG GLU A 100 -14.981 -3.840 7.222 1.00 0.00 C ATOM 1171 CD GLU A 100 -13.541 -3.341 7.392 1.00 0.00 C ATOM 1172 OE1 GLU A 100 -12.721 -3.659 6.545 1.00 0.00 O ATOM 1173 OE2 GLU A 100 -13.282 -2.656 8.368 1.00 0.00 O ATOM 0 H GLU A 100 -16.332 -1.030 4.872 1.00 0.00 H new ATOM 0 HA GLU A 100 -14.225 -3.028 4.866 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -15.652 -1.834 6.763 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -16.845 -3.075 6.431 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -15.451 -3.960 8.198 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -14.982 -4.820 6.745 1.00 0.00 H new ATOM 1180 N ASN A 101 -17.043 -3.911 3.532 1.00 0.00 N ATOM 1181 CA ASN A 101 -17.682 -5.027 2.772 1.00 0.00 C ATOM 1182 C ASN A 101 -17.018 -5.176 1.387 1.00 0.00 C ATOM 1183 O ASN A 101 -17.334 -6.083 0.641 1.00 0.00 O ATOM 1184 CB ASN A 101 -19.162 -4.637 2.630 1.00 0.00 C ATOM 1185 CG ASN A 101 -19.302 -3.415 1.714 1.00 0.00 C ATOM 1186 OD1 ASN A 101 -19.079 -2.296 2.132 1.00 0.00 O ATOM 1187 ND2 ASN A 101 -19.660 -3.584 0.470 1.00 0.00 N ATOM 0 H ASN A 101 -17.539 -3.021 3.491 1.00 0.00 H new ATOM 0 HA ASN A 101 -17.571 -5.984 3.281 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -19.729 -5.474 2.221 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -19.583 -4.416 3.611 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -19.752 -2.778 -0.148 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -19.848 -4.522 0.116 1.00 0.00 H new ATOM 1194 N GLY A 102 -16.096 -4.297 1.039 1.00 0.00 N ATOM 1195 CA GLY A 102 -15.416 -4.396 -0.284 1.00 0.00 C ATOM 1196 C GLY A 102 -14.476 -5.603 -0.285 1.00 0.00 C ATOM 1197 O GLY A 102 -13.979 -6.012 0.746 1.00 0.00 O ATOM 0 H GLY A 102 -15.791 -3.517 1.622 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -16.156 -4.497 -1.078 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -14.854 -3.484 -0.485 1.00 0.00 H new ATOM 1201 N ARG A 103 -14.222 -6.173 -1.434 1.00 0.00 N ATOM 1202 CA ARG A 103 -13.307 -7.352 -1.492 1.00 0.00 C ATOM 1203 C ARG A 103 -11.857 -6.908 -1.264 1.00 0.00 C ATOM 1204 O ARG A 103 -11.447 -5.843 -1.690 1.00 0.00 O ATOM 1205 CB ARG A 103 -13.485 -7.952 -2.893 1.00 0.00 C ATOM 1206 CG ARG A 103 -13.026 -6.954 -3.962 1.00 0.00 C ATOM 1207 CD ARG A 103 -14.081 -6.870 -5.067 1.00 0.00 C ATOM 1208 NE ARG A 103 -13.656 -7.872 -6.082 1.00 0.00 N ATOM 1209 CZ ARG A 103 -12.983 -7.489 -7.133 1.00 0.00 C ATOM 1210 NH1 ARG A 103 -13.591 -6.860 -8.104 1.00 0.00 N ATOM 1211 NH2 ARG A 103 -11.703 -7.735 -7.212 1.00 0.00 N ATOM 0 H ARG A 103 -14.606 -5.875 -2.331 1.00 0.00 H new ATOM 0 HA ARG A 103 -13.538 -8.085 -0.719 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -12.910 -8.874 -2.977 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -14.531 -8.212 -3.054 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -12.872 -5.972 -3.516 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -12.070 -7.267 -4.381 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -15.075 -7.096 -4.681 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -14.125 -5.869 -5.495 1.00 0.00 H new ATOM 0 HE ARG A 103 -13.890 -8.857 -5.957 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -14.591 -6.669 -8.040 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -13.066 -6.561 -8.925 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -11.230 -8.226 -6.453 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -11.176 -7.436 -8.033 1.00 0.00 H new ATOM 1225 N VAL A 104 -11.082 -7.714 -0.588 1.00 0.00 N ATOM 1226 CA VAL A 104 -9.663 -7.340 -0.326 1.00 0.00 C ATOM 1227 C VAL A 104 -8.726 -8.288 -1.079 1.00 0.00 C ATOM 1228 O VAL A 104 -8.948 -9.482 -1.120 1.00 0.00 O ATOM 1229 CB VAL A 104 -9.479 -7.497 1.189 1.00 0.00 C ATOM 1230 CG1 VAL A 104 -8.041 -7.136 1.572 1.00 0.00 C ATOM 1231 CG2 VAL A 104 -10.445 -6.566 1.924 1.00 0.00 C ATOM 0 H VAL A 104 -11.371 -8.615 -0.206 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.434 -6.328 -0.659 1.00 0.00 H new ATOM 0 HB VAL A 104 -9.684 -8.530 1.469 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.912 -7.248 2.649 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.349 -7.799 1.053 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -7.837 -6.104 1.288 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -10.312 -6.680 3.000 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -10.242 -5.533 1.640 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -11.470 -6.821 1.656 1.00 0.00 H new ATOM 1241 N LYS A 105 -7.676 -7.771 -1.661 1.00 0.00 N ATOM 1242 CA LYS A 105 -6.716 -8.652 -2.394 1.00 0.00 C ATOM 1243 C LYS A 105 -5.278 -8.297 -2.004 1.00 0.00 C ATOM 1244 O LYS A 105 -4.971 -7.159 -1.700 1.00 0.00 O ATOM 1245 CB LYS A 105 -6.973 -8.413 -3.888 1.00 0.00 C ATOM 1246 CG LYS A 105 -6.690 -6.955 -4.262 1.00 0.00 C ATOM 1247 CD LYS A 105 -6.772 -6.801 -5.785 1.00 0.00 C ATOM 1248 CE LYS A 105 -6.579 -5.331 -6.171 1.00 0.00 C ATOM 1249 NZ LYS A 105 -7.927 -4.706 -6.035 1.00 0.00 N ATOM 0 H LYS A 105 -7.441 -6.778 -1.661 1.00 0.00 H new ATOM 0 HA LYS A 105 -6.855 -9.705 -2.148 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -6.341 -9.074 -4.481 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -8.007 -8.661 -4.128 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -7.411 -6.296 -3.778 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -5.702 -6.661 -3.907 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -6.009 -7.415 -6.263 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -7.738 -7.157 -6.144 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -5.853 -4.845 -5.519 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -6.204 -5.238 -7.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -8.082 -4.041 -6.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -8.657 -5.446 -6.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -7.983 -4.194 -5.131 1.00 0.00 H new ATOM 1263 N GLN A 106 -4.400 -9.268 -1.994 1.00 0.00 N ATOM 1264 CA GLN A 106 -2.982 -8.991 -1.605 1.00 0.00 C ATOM 1265 C GLN A 106 -2.104 -8.781 -2.843 1.00 0.00 C ATOM 1266 O GLN A 106 -1.696 -9.722 -3.495 1.00 0.00 O ATOM 1267 CB GLN A 106 -2.537 -10.227 -0.820 1.00 0.00 C ATOM 1268 CG GLN A 106 -1.189 -9.952 -0.148 1.00 0.00 C ATOM 1269 CD GLN A 106 -0.203 -11.070 -0.494 1.00 0.00 C ATOM 1270 OE1 GLN A 106 -0.170 -11.545 -1.613 1.00 0.00 O ATOM 1271 NE2 GLN A 106 0.609 -11.515 0.424 1.00 0.00 N ATOM 0 H GLN A 106 -4.602 -10.238 -2.237 1.00 0.00 H new ATOM 0 HA GLN A 106 -2.893 -8.080 -1.014 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -3.284 -10.481 -0.068 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -2.453 -11.084 -1.488 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -0.795 -8.991 -0.480 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -1.317 -9.888 0.933 1.00 0.00 H new ATOM 0 HE21 GLN A 106 0.583 -11.118 1.363 1.00 0.00 H new ATOM 0 HE22 GLN A 106 1.270 -12.260 0.203 1.00 0.00 H new ATOM 1280 N CYS A 107 -1.806 -7.544 -3.158 1.00 0.00 N ATOM 1281 CA CYS A 107 -0.949 -7.249 -4.345 1.00 0.00 C ATOM 1282 C CYS A 107 0.530 -7.275 -3.950 1.00 0.00 C ATOM 1283 O CYS A 107 0.993 -6.458 -3.173 1.00 0.00 O ATOM 1284 CB CYS A 107 -1.367 -5.855 -4.803 1.00 0.00 C ATOM 1285 SG CYS A 107 -3.035 -5.929 -5.506 1.00 0.00 S ATOM 0 H CYS A 107 -2.122 -6.724 -2.641 1.00 0.00 H new ATOM 0 HA CYS A 107 -1.074 -7.986 -5.138 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -1.345 -5.162 -3.962 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -0.664 -5.478 -5.545 1.00 0.00 H new ATOM 1290 N VAL A 108 1.267 -8.216 -4.480 1.00 0.00 N ATOM 1291 CA VAL A 108 2.717 -8.323 -4.147 1.00 0.00 C ATOM 1292 C VAL A 108 3.566 -8.327 -5.424 1.00 0.00 C ATOM 1293 O VAL A 108 3.212 -8.932 -6.419 1.00 0.00 O ATOM 1294 CB VAL A 108 2.869 -9.652 -3.395 1.00 0.00 C ATOM 1295 CG1 VAL A 108 2.085 -9.596 -2.083 1.00 0.00 C ATOM 1296 CG2 VAL A 108 2.336 -10.806 -4.253 1.00 0.00 C ATOM 0 H VAL A 108 0.923 -8.919 -5.134 1.00 0.00 H new ATOM 0 HA VAL A 108 3.056 -7.478 -3.547 1.00 0.00 H new ATOM 0 HB VAL A 108 3.925 -9.817 -3.184 1.00 0.00 H new ATOM 0 HG11 VAL A 108 2.196 -10.542 -1.552 1.00 0.00 H new ATOM 0 HG12 VAL A 108 2.469 -8.785 -1.464 1.00 0.00 H new ATOM 0 HG13 VAL A 108 1.031 -9.421 -2.296 1.00 0.00 H new ATOM 0 HG21 VAL A 108 2.448 -11.745 -3.711 1.00 0.00 H new ATOM 0 HG22 VAL A 108 1.282 -10.638 -4.474 1.00 0.00 H new ATOM 0 HG23 VAL A 108 2.898 -10.856 -5.185 1.00 0.00 H new ATOM 1306 N GLY A 109 4.687 -7.655 -5.395 1.00 0.00 N ATOM 1307 CA GLY A 109 5.580 -7.608 -6.595 1.00 0.00 C ATOM 1308 C GLY A 109 6.904 -6.933 -6.222 1.00 0.00 C ATOM 1309 O GLY A 109 7.147 -6.627 -5.071 1.00 0.00 O ATOM 0 H GLY A 109 5.026 -7.133 -4.587 1.00 0.00 H new ATOM 0 HA2 GLY A 109 5.765 -8.617 -6.963 1.00 0.00 H new ATOM 0 HA3 GLY A 109 5.094 -7.059 -7.401 1.00 0.00 H new ATOM 1313 N THR A 110 7.761 -6.691 -7.183 1.00 0.00 N ATOM 1314 CA THR A 110 9.067 -6.027 -6.870 1.00 0.00 C ATOM 1315 C THR A 110 9.245 -4.762 -7.718 1.00 0.00 C ATOM 1316 O THR A 110 8.977 -4.754 -8.905 1.00 0.00 O ATOM 1317 CB THR A 110 10.157 -7.059 -7.199 1.00 0.00 C ATOM 1318 OG1 THR A 110 10.025 -7.488 -8.547 1.00 0.00 O ATOM 1319 CG2 THR A 110 10.033 -8.263 -6.262 1.00 0.00 C ATOM 0 H THR A 110 7.615 -6.922 -8.166 1.00 0.00 H new ATOM 0 HA THR A 110 9.117 -5.717 -5.826 1.00 0.00 H new ATOM 0 HB THR A 110 11.135 -6.597 -7.063 1.00 0.00 H new ATOM 0 HG1 THR A 110 10.723 -8.144 -8.751 1.00 0.00 H new ATOM 0 HG21 THR A 110 10.808 -8.991 -6.500 1.00 0.00 H new ATOM 0 HG22 THR A 110 10.149 -7.934 -5.229 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.053 -8.723 -6.388 1.00 0.00 H new ATOM 1327 N VAL A 111 9.699 -3.696 -7.109 1.00 0.00 N ATOM 1328 CA VAL A 111 9.903 -2.415 -7.859 1.00 0.00 C ATOM 1329 C VAL A 111 11.272 -1.818 -7.518 1.00 0.00 C ATOM 1330 O VAL A 111 11.897 -2.198 -6.549 1.00 0.00 O ATOM 1331 CB VAL A 111 8.779 -1.475 -7.394 1.00 0.00 C ATOM 1332 CG1 VAL A 111 7.445 -1.939 -7.983 1.00 0.00 C ATOM 1333 CG2 VAL A 111 8.690 -1.477 -5.863 1.00 0.00 C ATOM 0 H VAL A 111 9.939 -3.656 -6.118 1.00 0.00 H new ATOM 0 HA VAL A 111 9.875 -2.569 -8.938 1.00 0.00 H new ATOM 0 HB VAL A 111 8.998 -0.464 -7.737 1.00 0.00 H new ATOM 0 HG11 VAL A 111 6.649 -1.271 -7.652 1.00 0.00 H new ATOM 0 HG12 VAL A 111 7.503 -1.923 -9.071 1.00 0.00 H new ATOM 0 HG13 VAL A 111 7.231 -2.953 -7.646 1.00 0.00 H new ATOM 0 HG21 VAL A 111 7.891 -0.808 -5.544 1.00 0.00 H new ATOM 0 HG22 VAL A 111 8.479 -2.487 -5.512 1.00 0.00 H new ATOM 0 HG23 VAL A 111 9.637 -1.137 -5.443 1.00 0.00 H new ATOM 1343 N THR A 112 11.742 -0.886 -8.305 1.00 0.00 N ATOM 1344 CA THR A 112 13.077 -0.269 -8.021 1.00 0.00 C ATOM 1345 C THR A 112 12.985 0.692 -6.828 1.00 0.00 C ATOM 1346 O THR A 112 12.019 1.421 -6.677 1.00 0.00 O ATOM 1347 CB THR A 112 13.458 0.502 -9.291 1.00 0.00 C ATOM 1348 OG1 THR A 112 13.173 -0.287 -10.438 1.00 0.00 O ATOM 1349 CG2 THR A 112 14.953 0.830 -9.258 1.00 0.00 C ATOM 0 H THR A 112 11.263 -0.525 -9.130 1.00 0.00 H new ATOM 0 HA THR A 112 13.819 -1.026 -7.767 1.00 0.00 H new ATOM 0 HB THR A 112 12.881 1.425 -9.337 1.00 0.00 H new ATOM 0 HG1 THR A 112 13.573 0.130 -11.229 1.00 0.00 H new ATOM 0 HG21 THR A 112 15.225 1.378 -10.160 1.00 0.00 H new ATOM 0 HG22 THR A 112 15.172 1.441 -8.382 1.00 0.00 H new ATOM 0 HG23 THR A 112 15.527 -0.095 -9.208 1.00 0.00 H new ATOM 1357 N LEU A 113 13.993 0.703 -5.988 1.00 0.00 N ATOM 1358 CA LEU A 113 13.990 1.619 -4.806 1.00 0.00 C ATOM 1359 C LEU A 113 14.552 2.995 -5.201 1.00 0.00 C ATOM 1360 O LEU A 113 14.118 4.013 -4.700 1.00 0.00 O ATOM 1361 CB LEU A 113 14.893 0.937 -3.767 1.00 0.00 C ATOM 1362 CG LEU A 113 14.868 1.723 -2.450 1.00 0.00 C ATOM 1363 CD1 LEU A 113 13.509 1.550 -1.765 1.00 0.00 C ATOM 1364 CD2 LEU A 113 15.973 1.203 -1.524 1.00 0.00 C ATOM 0 H LEU A 113 14.821 0.113 -6.072 1.00 0.00 H new ATOM 0 HA LEU A 113 12.986 1.789 -4.416 1.00 0.00 H new ATOM 0 HB2 LEU A 113 14.556 -0.085 -3.596 1.00 0.00 H new ATOM 0 HB3 LEU A 113 15.914 0.877 -4.144 1.00 0.00 H new ATOM 0 HG LEU A 113 15.032 2.780 -2.661 1.00 0.00 H new ATOM 0 HD11 LEU A 113 13.499 2.111 -0.830 1.00 0.00 H new ATOM 0 HD12 LEU A 113 12.721 1.922 -2.420 1.00 0.00 H new ATOM 0 HD13 LEU A 113 13.339 0.494 -1.556 1.00 0.00 H new ATOM 0 HD21 LEU A 113 15.956 1.761 -0.588 1.00 0.00 H new ATOM 0 HD22 LEU A 113 15.808 0.145 -1.319 1.00 0.00 H new ATOM 0 HD23 LEU A 113 16.942 1.332 -2.006 1.00 0.00 H new ATOM 1376 N ASP A 114 15.513 3.033 -6.096 1.00 0.00 N ATOM 1377 CA ASP A 114 16.097 4.340 -6.522 1.00 0.00 C ATOM 1378 C ASP A 114 15.479 4.793 -7.849 1.00 0.00 C ATOM 1379 O ASP A 114 14.807 5.805 -7.914 1.00 0.00 O ATOM 1380 CB ASP A 114 17.598 4.076 -6.690 1.00 0.00 C ATOM 1381 CG ASP A 114 18.318 4.357 -5.371 1.00 0.00 C ATOM 1382 OD1 ASP A 114 18.142 3.579 -4.446 1.00 0.00 O ATOM 1383 OD2 ASP A 114 19.034 5.343 -5.309 1.00 0.00 O ATOM 0 H ASP A 114 15.916 2.212 -6.548 1.00 0.00 H new ATOM 0 HA ASP A 114 15.903 5.130 -5.796 1.00 0.00 H new ATOM 0 HB2 ASP A 114 17.764 3.042 -6.994 1.00 0.00 H new ATOM 0 HB3 ASP A 114 18.003 4.709 -7.479 1.00 0.00 H new ATOM 1388 N GLN A 115 15.706 4.053 -8.906 1.00 0.00 N ATOM 1389 CA GLN A 115 15.139 4.438 -10.233 1.00 0.00 C ATOM 1390 C GLN A 115 13.747 3.820 -10.413 1.00 0.00 C ATOM 1391 O GLN A 115 13.593 2.797 -11.055 1.00 0.00 O ATOM 1392 CB GLN A 115 16.122 3.876 -11.267 1.00 0.00 C ATOM 1393 CG GLN A 115 17.514 4.478 -11.040 1.00 0.00 C ATOM 1394 CD GLN A 115 18.097 4.940 -12.377 1.00 0.00 C ATOM 1395 OE1 GLN A 115 17.659 5.926 -12.935 1.00 0.00 O ATOM 1396 NE2 GLN A 115 19.075 4.267 -12.918 1.00 0.00 N ATOM 0 H GLN A 115 16.261 3.197 -8.906 1.00 0.00 H new ATOM 0 HA GLN A 115 15.020 5.517 -10.335 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.168 2.790 -11.186 1.00 0.00 H new ATOM 0 HB3 GLN A 115 15.776 4.106 -12.275 1.00 0.00 H new ATOM 0 HG2 GLN A 115 17.449 5.319 -10.350 1.00 0.00 H new ATOM 0 HG3 GLN A 115 18.171 3.739 -10.581 1.00 0.00 H new ATOM 0 HE21 GLN A 115 19.444 3.439 -12.451 1.00 0.00 H new ATOM 0 HE22 GLN A 115 19.471 4.569 -13.808 1.00 0.00 H new ATOM 1405 N ILE A 116 12.736 4.437 -9.846 1.00 0.00 N ATOM 1406 CA ILE A 116 11.340 3.897 -9.970 1.00 0.00 C ATOM 1407 C ILE A 116 11.039 3.540 -11.433 1.00 0.00 C ATOM 1408 O ILE A 116 11.220 4.348 -12.326 1.00 0.00 O ATOM 1409 CB ILE A 116 10.425 5.031 -9.487 1.00 0.00 C ATOM 1410 CG1 ILE A 116 10.645 5.268 -7.988 1.00 0.00 C ATOM 1411 CG2 ILE A 116 8.962 4.651 -9.727 1.00 0.00 C ATOM 1412 CD1 ILE A 116 10.689 6.772 -7.707 1.00 0.00 C ATOM 0 H ILE A 116 12.817 5.295 -9.300 1.00 0.00 H new ATOM 0 HA ILE A 116 11.196 2.988 -9.387 1.00 0.00 H new ATOM 0 HB ILE A 116 10.661 5.940 -10.040 1.00 0.00 H new ATOM 0 HG12 ILE A 116 9.843 4.804 -7.415 1.00 0.00 H new ATOM 0 HG13 ILE A 116 11.576 4.801 -7.668 1.00 0.00 H new ATOM 0 HG21 ILE A 116 8.315 5.458 -9.383 1.00 0.00 H new ATOM 0 HG22 ILE A 116 8.799 4.484 -10.792 1.00 0.00 H new ATOM 0 HG23 ILE A 116 8.728 3.739 -9.177 1.00 0.00 H new ATOM 0 HD11 ILE A 116 10.845 6.939 -6.641 1.00 0.00 H new ATOM 0 HD12 ILE A 116 11.507 7.223 -8.269 1.00 0.00 H new ATOM 0 HD13 ILE A 116 9.746 7.227 -8.011 1.00 0.00 H new ATOM 1424 N LYS A 117 10.595 2.333 -11.682 1.00 0.00 N ATOM 1425 CA LYS A 117 10.299 1.917 -13.084 1.00 0.00 C ATOM 1426 C LYS A 117 8.903 1.289 -13.191 1.00 0.00 C ATOM 1427 O LYS A 117 8.376 0.742 -12.238 1.00 0.00 O ATOM 1428 CB LYS A 117 11.377 0.885 -13.426 1.00 0.00 C ATOM 1429 CG LYS A 117 11.897 1.138 -14.843 1.00 0.00 C ATOM 1430 CD LYS A 117 12.827 -0.005 -15.259 1.00 0.00 C ATOM 1431 CE LYS A 117 14.068 0.564 -15.958 1.00 0.00 C ATOM 1432 NZ LYS A 117 13.604 0.975 -17.316 1.00 0.00 N ATOM 0 H LYS A 117 10.425 1.619 -10.974 1.00 0.00 H new ATOM 0 HA LYS A 117 10.307 2.767 -13.767 1.00 0.00 H new ATOM 0 HB2 LYS A 117 12.196 0.949 -12.710 1.00 0.00 H new ATOM 0 HB3 LYS A 117 10.967 -0.122 -13.352 1.00 0.00 H new ATOM 0 HG2 LYS A 117 11.062 1.213 -15.540 1.00 0.00 H new ATOM 0 HG3 LYS A 117 12.431 2.087 -14.881 1.00 0.00 H new ATOM 0 HD2 LYS A 117 13.124 -0.582 -14.383 1.00 0.00 H new ATOM 0 HD3 LYS A 117 12.303 -0.688 -15.927 1.00 0.00 H new ATOM 0 HE2 LYS A 117 14.474 1.413 -15.408 1.00 0.00 H new ATOM 0 HE3 LYS A 117 14.860 -0.182 -16.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 14.336 0.744 -18.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 12.727 0.468 -17.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 13.425 1.999 -17.326 1.00 0.00 H new ATOM 1446 N ASP A 118 8.310 1.368 -14.357 1.00 0.00 N ATOM 1447 CA ASP A 118 6.951 0.787 -14.573 1.00 0.00 C ATOM 1448 C ASP A 118 6.934 -0.011 -15.891 1.00 0.00 C ATOM 1449 O ASP A 118 7.808 0.161 -16.721 1.00 0.00 O ATOM 1450 CB ASP A 118 6.011 2.001 -14.641 1.00 0.00 C ATOM 1451 CG ASP A 118 6.304 2.833 -15.894 1.00 0.00 C ATOM 1452 OD1 ASP A 118 7.259 3.594 -15.868 1.00 0.00 O ATOM 1453 OD2 ASP A 118 5.567 2.699 -16.856 1.00 0.00 O ATOM 0 H ASP A 118 8.716 1.817 -15.178 1.00 0.00 H new ATOM 0 HA ASP A 118 6.651 0.097 -13.785 1.00 0.00 H new ATOM 0 HB2 ASP A 118 4.974 1.666 -14.653 1.00 0.00 H new ATOM 0 HB3 ASP A 118 6.136 2.617 -13.750 1.00 0.00 H new ATOM 1458 N PRO A 119 5.945 -0.865 -16.051 1.00 0.00 N ATOM 1459 CA PRO A 119 4.890 -1.053 -15.016 1.00 0.00 C ATOM 1460 C PRO A 119 5.424 -1.835 -13.806 1.00 0.00 C ATOM 1461 O PRO A 119 6.516 -2.370 -13.826 1.00 0.00 O ATOM 1462 CB PRO A 119 3.817 -1.860 -15.744 1.00 0.00 C ATOM 1463 CG PRO A 119 4.543 -2.579 -16.835 1.00 0.00 C ATOM 1464 CD PRO A 119 5.727 -1.728 -17.218 1.00 0.00 C ATOM 0 HA PRO A 119 4.523 -0.107 -14.617 1.00 0.00 H new ATOM 0 HB2 PRO A 119 3.325 -2.561 -15.069 1.00 0.00 H new ATOM 0 HB3 PRO A 119 3.041 -1.210 -16.149 1.00 0.00 H new ATOM 0 HG2 PRO A 119 4.869 -3.563 -16.497 1.00 0.00 H new ATOM 0 HG3 PRO A 119 3.889 -2.737 -17.693 1.00 0.00 H new ATOM 0 HD2 PRO A 119 6.604 -2.339 -17.430 1.00 0.00 H new ATOM 0 HD3 PRO A 119 5.523 -1.142 -18.114 1.00 0.00 H new ATOM 1472 N LEU A 120 4.641 -1.908 -12.760 1.00 0.00 N ATOM 1473 CA LEU A 120 5.071 -2.659 -11.541 1.00 0.00 C ATOM 1474 C LEU A 120 4.620 -4.120 -11.649 1.00 0.00 C ATOM 1475 O LEU A 120 3.441 -4.426 -11.642 1.00 0.00 O ATOM 1476 CB LEU A 120 4.415 -1.951 -10.338 1.00 0.00 C ATOM 1477 CG LEU A 120 2.906 -1.761 -10.560 1.00 0.00 C ATOM 1478 CD1 LEU A 120 2.154 -2.056 -9.261 1.00 0.00 C ATOM 1479 CD2 LEU A 120 2.629 -0.315 -10.980 1.00 0.00 C ATOM 0 H LEU A 120 3.718 -1.478 -12.697 1.00 0.00 H new ATOM 0 HA LEU A 120 6.155 -2.668 -11.427 1.00 0.00 H new ATOM 0 HB2 LEU A 120 4.581 -2.536 -9.433 1.00 0.00 H new ATOM 0 HB3 LEU A 120 4.887 -0.981 -10.182 1.00 0.00 H new ATOM 0 HG LEU A 120 2.570 -2.443 -11.341 1.00 0.00 H new ATOM 0 HD11 LEU A 120 1.084 -1.921 -9.421 1.00 0.00 H new ATOM 0 HD12 LEU A 120 2.348 -3.084 -8.954 1.00 0.00 H new ATOM 0 HD13 LEU A 120 2.493 -1.374 -8.481 1.00 0.00 H new ATOM 0 HD21 LEU A 120 1.559 -0.180 -11.137 1.00 0.00 H new ATOM 0 HD22 LEU A 120 2.969 0.363 -10.197 1.00 0.00 H new ATOM 0 HD23 LEU A 120 3.162 -0.096 -11.905 1.00 0.00 H new ATOM 1491 N ASP A 121 5.564 -5.017 -11.770 1.00 0.00 N ATOM 1492 CA ASP A 121 5.231 -6.469 -11.903 1.00 0.00 C ATOM 1493 C ASP A 121 4.731 -7.031 -10.565 1.00 0.00 C ATOM 1494 O ASP A 121 5.467 -7.663 -9.829 1.00 0.00 O ATOM 1495 CB ASP A 121 6.547 -7.141 -12.313 1.00 0.00 C ATOM 1496 CG ASP A 121 7.023 -6.577 -13.656 1.00 0.00 C ATOM 1497 OD1 ASP A 121 7.718 -5.572 -13.641 1.00 0.00 O ATOM 1498 OD2 ASP A 121 6.686 -7.158 -14.674 1.00 0.00 O ATOM 0 H ASP A 121 6.562 -4.804 -11.783 1.00 0.00 H new ATOM 0 HA ASP A 121 4.438 -6.644 -12.631 1.00 0.00 H new ATOM 0 HB2 ASP A 121 7.305 -6.973 -11.548 1.00 0.00 H new ATOM 0 HB3 ASP A 121 6.406 -8.219 -12.390 1.00 0.00 H new ATOM 1503 N ILE A 122 3.485 -6.796 -10.246 1.00 0.00 N ATOM 1504 CA ILE A 122 2.933 -7.310 -8.954 1.00 0.00 C ATOM 1505 C ILE A 122 1.661 -8.142 -9.195 1.00 0.00 C ATOM 1506 O ILE A 122 0.832 -7.809 -10.021 1.00 0.00 O ATOM 1507 CB ILE A 122 2.617 -6.061 -8.109 1.00 0.00 C ATOM 1508 CG1 ILE A 122 1.429 -5.299 -8.710 1.00 0.00 C ATOM 1509 CG2 ILE A 122 3.839 -5.135 -8.064 1.00 0.00 C ATOM 1510 CD1 ILE A 122 0.154 -5.638 -7.935 1.00 0.00 C ATOM 0 H ILE A 122 2.826 -6.272 -10.822 1.00 0.00 H new ATOM 0 HA ILE A 122 3.642 -7.966 -8.449 1.00 0.00 H new ATOM 0 HB ILE A 122 2.365 -6.382 -7.098 1.00 0.00 H new ATOM 0 HG12 ILE A 122 1.615 -4.226 -8.671 1.00 0.00 H new ATOM 0 HG13 ILE A 122 1.309 -5.563 -9.761 1.00 0.00 H new ATOM 0 HG21 ILE A 122 3.607 -4.255 -7.465 1.00 0.00 H new ATOM 0 HG22 ILE A 122 4.681 -5.665 -7.619 1.00 0.00 H new ATOM 0 HG23 ILE A 122 4.099 -4.826 -9.076 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -0.688 -5.095 -8.364 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -0.035 -6.710 -7.997 1.00 0.00 H new ATOM 0 HD13 ILE A 122 0.276 -5.351 -6.891 1.00 0.00 H new ATOM 1522 N THR A 123 1.503 -9.217 -8.464 1.00 0.00 N ATOM 1523 CA THR A 123 0.288 -10.074 -8.622 1.00 0.00 C ATOM 1524 C THR A 123 -0.589 -9.937 -7.370 1.00 0.00 C ATOM 1525 O THR A 123 -0.087 -9.840 -6.265 1.00 0.00 O ATOM 1526 CB THR A 123 0.818 -11.506 -8.770 1.00 0.00 C ATOM 1527 OG1 THR A 123 1.789 -11.551 -9.812 1.00 0.00 O ATOM 1528 CG2 THR A 123 -0.337 -12.452 -9.111 1.00 0.00 C ATOM 0 H THR A 123 2.167 -9.540 -7.760 1.00 0.00 H new ATOM 0 HA THR A 123 -0.322 -9.792 -9.480 1.00 0.00 H new ATOM 0 HB THR A 123 1.276 -11.817 -7.831 1.00 0.00 H new ATOM 0 HG1 THR A 123 2.128 -12.466 -9.904 1.00 0.00 H new ATOM 0 HG21 THR A 123 0.044 -13.468 -9.215 1.00 0.00 H new ATOM 0 HG22 THR A 123 -1.079 -12.423 -8.313 1.00 0.00 H new ATOM 0 HG23 THR A 123 -0.799 -12.140 -10.048 1.00 0.00 H new ATOM 1536 N CYS A 124 -1.890 -9.905 -7.528 1.00 0.00 N ATOM 1537 CA CYS A 124 -2.777 -9.744 -6.333 1.00 0.00 C ATOM 1538 C CYS A 124 -3.536 -11.036 -6.005 1.00 0.00 C ATOM 1539 O CYS A 124 -4.149 -11.649 -6.859 1.00 0.00 O ATOM 1540 CB CYS A 124 -3.756 -8.626 -6.700 1.00 0.00 C ATOM 1541 SG CYS A 124 -2.840 -7.121 -7.126 1.00 0.00 S ATOM 0 H CYS A 124 -2.373 -9.983 -8.423 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.193 -9.507 -5.444 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -4.376 -8.935 -7.541 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -4.427 -8.429 -5.864 1.00 0.00 H new ATOM 1546 N ASN A 125 -3.505 -11.432 -4.755 1.00 0.00 N ATOM 1547 CA ASN A 125 -4.227 -12.664 -4.323 1.00 0.00 C ATOM 1548 C ASN A 125 -5.424 -12.275 -3.448 1.00 0.00 C ATOM 1549 O ASN A 125 -5.262 -11.852 -2.319 1.00 0.00 O ATOM 1550 CB ASN A 125 -3.205 -13.464 -3.508 1.00 0.00 C ATOM 1551 CG ASN A 125 -2.554 -14.521 -4.400 1.00 0.00 C ATOM 1552 OD1 ASN A 125 -3.036 -15.633 -4.495 1.00 0.00 O ATOM 1553 ND2 ASN A 125 -1.471 -14.221 -5.064 1.00 0.00 N ATOM 0 H ASN A 125 -3.004 -10.947 -4.010 1.00 0.00 H new ATOM 0 HA ASN A 125 -4.610 -13.241 -5.165 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -2.444 -12.796 -3.103 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -3.695 -13.941 -2.659 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -1.030 -14.919 -5.662 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -1.066 -13.288 -4.985 1.00 0.00 H new ATOM 1560 N GLU A 126 -6.619 -12.400 -3.972 1.00 0.00 N ATOM 1561 CA GLU A 126 -7.846 -12.030 -3.192 1.00 0.00 C ATOM 1562 C GLU A 126 -7.800 -12.626 -1.777 1.00 0.00 C ATOM 1563 O GLU A 126 -7.721 -13.829 -1.599 1.00 0.00 O ATOM 1564 CB GLU A 126 -9.021 -12.616 -3.985 1.00 0.00 C ATOM 1565 CG GLU A 126 -10.261 -11.732 -3.799 1.00 0.00 C ATOM 1566 CD GLU A 126 -10.456 -10.837 -5.031 1.00 0.00 C ATOM 1567 OE1 GLU A 126 -9.577 -10.033 -5.301 1.00 0.00 O ATOM 1568 OE2 GLU A 126 -11.484 -10.963 -5.680 1.00 0.00 O ATOM 0 H GLU A 126 -6.800 -12.745 -4.915 1.00 0.00 H new ATOM 0 HA GLU A 126 -7.933 -10.950 -3.069 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -8.763 -12.680 -5.042 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -9.231 -13.630 -3.646 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -11.143 -12.355 -3.648 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -10.149 -11.117 -2.906 1.00 0.00 H new ATOM 1575 N VAL A 127 -7.848 -11.787 -0.774 1.00 0.00 N ATOM 1576 CA VAL A 127 -7.811 -12.280 0.635 1.00 0.00 C ATOM 1577 C VAL A 127 -9.239 -12.520 1.143 1.00 0.00 C ATOM 1578 O VAL A 127 -10.085 -11.650 1.060 1.00 0.00 O ATOM 1579 CB VAL A 127 -7.133 -11.159 1.435 1.00 0.00 C ATOM 1580 CG1 VAL A 127 -7.136 -11.512 2.926 1.00 0.00 C ATOM 1581 CG2 VAL A 127 -5.687 -10.991 0.959 1.00 0.00 C ATOM 0 H VAL A 127 -7.912 -10.774 -0.872 1.00 0.00 H new ATOM 0 HA VAL A 127 -7.275 -13.224 0.730 1.00 0.00 H new ATOM 0 HB VAL A 127 -7.680 -10.229 1.281 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -6.654 -10.714 3.490 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -8.164 -11.630 3.270 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -6.593 -12.444 3.080 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -5.207 -10.195 1.528 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -5.143 -11.924 1.110 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -5.680 -10.735 -0.100 1.00 0.00 H new ATOM 1591 N GLN A 128 -9.498 -13.699 1.669 1.00 0.00 N ATOM 1592 CA GLN A 128 -10.862 -14.040 2.198 1.00 0.00 C ATOM 1593 C GLN A 128 -11.888 -14.130 1.058 1.00 0.00 C ATOM 1594 O GLN A 128 -11.859 -13.357 0.118 1.00 0.00 O ATOM 1595 CB GLN A 128 -11.227 -12.914 3.174 1.00 0.00 C ATOM 1596 CG GLN A 128 -12.082 -13.475 4.313 1.00 0.00 C ATOM 1597 CD GLN A 128 -13.427 -12.747 4.351 1.00 0.00 C ATOM 1598 OE1 GLN A 128 -14.427 -13.270 3.901 1.00 0.00 O ATOM 1599 NE2 GLN A 128 -13.496 -11.551 4.868 1.00 0.00 N ATOM 0 H GLN A 128 -8.812 -14.449 1.755 1.00 0.00 H new ATOM 0 HA GLN A 128 -10.864 -15.012 2.691 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -10.321 -12.460 3.576 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -11.772 -12.128 2.650 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -12.240 -14.544 4.171 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -11.564 -13.353 5.264 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -12.658 -11.110 5.246 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -14.388 -11.057 4.894 1.00 0.00 H new ATOM 1608 N GLY A 129 -12.795 -15.072 1.136 1.00 0.00 N ATOM 1609 CA GLY A 129 -13.824 -15.221 0.064 1.00 0.00 C ATOM 1610 C GLY A 129 -13.230 -16.002 -1.109 1.00 0.00 C ATOM 1611 O GLY A 129 -12.999 -15.456 -2.170 1.00 0.00 O ATOM 0 H GLY A 129 -12.866 -15.746 1.899 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -14.699 -15.741 0.455 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -14.160 -14.240 -0.271 1.00 0.00 H new ATOM 1615 N VAL A 130 -12.986 -17.278 -0.914 1.00 0.00 N ATOM 1616 CA VAL A 130 -12.400 -18.136 -1.999 1.00 0.00 C ATOM 1617 C VAL A 130 -11.030 -17.582 -2.436 1.00 0.00 C ATOM 1618 O VAL A 130 -10.076 -17.793 -1.704 1.00 0.00 O ATOM 1619 CB VAL A 130 -13.421 -18.109 -3.154 1.00 0.00 C ATOM 1620 CG1 VAL A 130 -13.023 -19.140 -4.214 1.00 0.00 C ATOM 1621 CG2 VAL A 130 -14.817 -18.451 -2.622 1.00 0.00 C ATOM 1622 OXT VAL A 130 -10.952 -16.958 -3.485 1.00 0.00 O ATOM 0 H VAL A 130 -13.170 -17.768 -0.039 1.00 0.00 H new ATOM 0 HA VAL A 130 -12.224 -19.158 -1.664 1.00 0.00 H new ATOM 0 HB VAL A 130 -13.433 -17.112 -3.595 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -13.745 -19.120 -5.030 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -12.032 -18.901 -4.600 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -13.008 -20.134 -3.767 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -15.534 -18.430 -3.443 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -14.803 -19.446 -2.177 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -15.108 -17.720 -1.867 1.00 0.00 H new TER 1632 VAL A 130