USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 986 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 33 GLN : amide:sc= 0.764 K(o=-0.11,f=-0.71) USER MOD Set 1.2: A 124 TYR OH : rot -130:sc= -0.876 USER MOD Set 2.1: A 17 MET CE :methyl -118:sc= -3.37! (180deg=-4.71!) USER MOD Set 2.2: A 97 LYS NZ :NH3+ 172:sc= -0.611 (180deg=0) USER MOD Set 3.1: A 66 ASN : amide:sc= -5.63! C(o=-14!,f=-14!) USER MOD Set 3.2: A 75 ASN : amide:sc= -7.92! C(o=-14!,f=-16!) USER MOD Set 4.1: A 1 LYS N :NH3+ 179:sc= 0.626 (180deg=-0.0864) USER MOD Set 4.2: A 40 THR OG1 : rot 171:sc= 0.164 USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 TYR OH : rot -48:sc= 0.984 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= -2.82 X(o=-2.8,f=-2.7!) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= -0.0976 USER MOD Single : A 34 HIS : no HE2:sc= -6.45! C(o=-6.4!,f=-6.5!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= -3.79! C(o=-3.8!,f=-7!) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -1.67 K(o=-1.7,f=-5.7!) USER MOD Single : A 43 THR OG1 : rot -92:sc= 1 USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -2.72 K(o=-2.7,f=-3.4!) USER MOD Single : A 50 GLN : amide:sc= -0.794 X(o=-0.79,f=-0.54) USER MOD Single : A 51 SER OG : rot 19:sc= 0.951 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot -37:sc= -3.05! USER MOD Single : A 58 GLN : amide:sc= -0.169 K(o=-0.17,f=-0.99) USER MOD Single : A 60 ASN : amide:sc= -3.85! C(o=-3.8!,f=-4.3!) USER MOD Single : A 61 SER OG : rot 105:sc= 1.71 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 163:sc= -0.0318 (180deg=-0.308) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 HIS : no HD1:sc=-0.00952 X(o=-0.0095,f=-0.0017) USER MOD Single : A 117 GLN : amide:sc= -2.71! C(o=-2.7!,f=-3.5!) USER MOD Single : A 118 ASN : amide:sc=-0.00959 X(o=-0.0096,f=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 127 ASN : amide:sc= -0.125 X(o=-0.12,f=-0.38) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 1 -2.225 9.452 8.066 1.00 0.00 N ATOM 2 CA LYS A 1 -3.047 8.920 9.139 1.00 0.00 C ATOM 3 C LYS A 1 -2.249 7.871 9.917 1.00 0.00 C ATOM 4 O LYS A 1 -1.033 7.771 9.760 1.00 0.00 O ATOM 5 CB LYS A 1 -4.375 8.397 8.588 1.00 0.00 C ATOM 6 CG LYS A 1 -5.556 9.181 9.166 1.00 0.00 C ATOM 7 CD LYS A 1 -5.816 10.453 8.358 1.00 0.00 C ATOM 8 CE LYS A 1 -5.889 11.679 9.273 1.00 0.00 C ATOM 9 NZ LYS A 1 -4.716 12.555 9.059 1.00 0.00 N ATOM 0 H1 LYS A 1 -2.771 10.153 7.525 1.00 0.00 H new ATOM 0 H2 LYS A 1 -1.380 9.906 8.468 1.00 0.00 H new ATOM 0 H3 LYS A 1 -1.934 8.678 7.435 1.00 0.00 H new ATOM 0 HA LYS A 1 -3.309 9.709 9.844 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -4.378 8.477 7.501 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -4.482 7.340 8.831 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -6.449 8.555 9.164 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -5.351 9.441 10.205 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -5.023 10.590 7.623 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -6.749 10.352 7.804 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -6.806 12.234 9.075 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -5.928 11.361 10.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -4.781 13.382 9.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -3.845 12.027 9.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -4.696 12.873 8.069 1.00 0.00 H new ATOM 23 N VAL A 2 -2.964 7.117 10.738 1.00 0.00 N ATOM 24 CA VAL A 2 -2.337 6.080 11.539 1.00 0.00 C ATOM 25 C VAL A 2 -2.810 4.709 11.052 1.00 0.00 C ATOM 26 O VAL A 2 -3.943 4.309 11.317 1.00 0.00 O ATOM 27 CB VAL A 2 -2.625 6.319 13.023 1.00 0.00 C ATOM 28 CG1 VAL A 2 -2.155 5.135 13.870 1.00 0.00 C ATOM 29 CG2 VAL A 2 -1.988 7.624 13.501 1.00 0.00 C ATOM 0 H VAL A 2 -3.972 7.204 10.866 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.254 6.110 11.423 1.00 0.00 H new ATOM 0 HB VAL A 2 -3.704 6.410 13.145 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -2.371 5.330 14.920 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -2.677 4.232 13.554 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -1.081 4.998 13.740 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -2.208 7.770 14.559 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -0.909 7.576 13.358 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -2.393 8.458 12.928 1.00 0.00 H new ATOM 39 N TYR A 3 -1.919 4.026 10.347 1.00 0.00 N ATOM 40 CA TYR A 3 -2.231 2.709 9.820 1.00 0.00 C ATOM 41 C TYR A 3 -1.523 1.616 10.623 1.00 0.00 C ATOM 42 O TYR A 3 -0.334 1.367 10.428 1.00 0.00 O ATOM 43 CB TYR A 3 -1.702 2.693 8.385 1.00 0.00 C ATOM 44 CG TYR A 3 -2.589 3.442 7.387 1.00 0.00 C ATOM 45 CD1 TYR A 3 -3.583 4.284 7.844 1.00 0.00 C ATOM 46 CD2 TYR A 3 -2.395 3.275 6.031 1.00 0.00 C ATOM 47 CE1 TYR A 3 -4.417 4.988 6.906 1.00 0.00 C ATOM 48 CE2 TYR A 3 -3.230 3.979 5.093 1.00 0.00 C ATOM 49 CZ TYR A 3 -4.199 4.802 5.576 1.00 0.00 C ATOM 50 OH TYR A 3 -4.987 5.468 4.690 1.00 0.00 O ATOM 0 H TYR A 3 -0.981 4.361 10.129 1.00 0.00 H new ATOM 0 HA TYR A 3 -3.303 2.518 9.873 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -0.705 3.133 8.371 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -1.598 1.658 8.058 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -3.735 4.414 8.905 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -1.617 2.617 5.674 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -5.199 5.649 7.250 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -3.090 3.856 4.029 1.00 0.00 H new ATOM 0 HH TYR A 3 -5.927 5.367 4.948 1.00 0.00 H new ATOM 60 N GLU A 4 -2.283 0.992 11.511 1.00 0.00 N ATOM 61 CA GLU A 4 -1.744 -0.069 12.345 1.00 0.00 C ATOM 62 C GLU A 4 -2.006 -1.434 11.703 1.00 0.00 C ATOM 63 O GLU A 4 -2.970 -1.598 10.957 1.00 0.00 O ATOM 64 CB GLU A 4 -2.327 -0.007 13.757 1.00 0.00 C ATOM 65 CG GLU A 4 -3.474 -1.007 13.922 1.00 0.00 C ATOM 66 CD GLU A 4 -4.530 -0.475 14.894 1.00 0.00 C ATOM 67 OE1 GLU A 4 -4.881 0.716 14.753 1.00 0.00 O ATOM 68 OE2 GLU A 4 -4.962 -1.272 15.754 1.00 0.00 O ATOM 0 H GLU A 4 -3.268 1.201 11.671 1.00 0.00 H new ATOM 0 HA GLU A 4 -0.666 0.072 12.426 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -1.546 -0.221 14.486 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -2.687 1.001 13.962 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -3.933 -1.203 12.953 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -3.083 -1.957 14.288 1.00 0.00 H new ATOM 75 N ARG A 5 -1.131 -2.378 12.017 1.00 0.00 N ATOM 76 CA ARG A 5 -1.256 -3.723 11.481 1.00 0.00 C ATOM 77 C ARG A 5 -2.701 -4.210 11.601 1.00 0.00 C ATOM 78 O ARG A 5 -3.332 -4.542 10.600 1.00 0.00 O ATOM 79 CB ARG A 5 -0.333 -4.697 12.217 1.00 0.00 C ATOM 80 CG ARG A 5 -0.449 -4.523 13.733 1.00 0.00 C ATOM 81 CD ARG A 5 0.900 -4.757 14.415 1.00 0.00 C ATOM 82 NE ARG A 5 0.765 -4.579 15.879 1.00 0.00 N ATOM 83 CZ ARG A 5 0.633 -3.389 16.481 1.00 0.00 C ATOM 84 NH1 ARG A 5 0.619 -2.265 15.751 1.00 0.00 N ATOM 85 NH2 ARG A 5 0.516 -3.323 17.815 1.00 0.00 N ATOM 0 H ARG A 5 -0.332 -2.238 12.636 1.00 0.00 H new ATOM 0 HA ARG A 5 -0.967 -3.690 10.431 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -0.588 -5.721 11.944 1.00 0.00 H new ATOM 0 HB3 ARG A 5 0.699 -4.531 11.906 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -0.807 -3.519 13.961 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -1.186 -5.222 14.128 1.00 0.00 H new ATOM 0 HD2 ARG A 5 1.259 -5.762 14.194 1.00 0.00 H new ATOM 0 HD3 ARG A 5 1.641 -4.061 14.022 1.00 0.00 H new ATOM 0 HE ARG A 5 0.773 -5.414 16.465 1.00 0.00 H new ATOM 0 HH11 ARG A 5 0.709 -2.315 14.736 1.00 0.00 H new ATOM 0 HH12 ARG A 5 0.518 -1.360 16.210 1.00 0.00 H new ATOM 0 HH21 ARG A 5 0.528 -4.178 18.371 1.00 0.00 H new ATOM 0 HH22 ARG A 5 0.416 -2.418 18.274 1.00 0.00 H new ATOM 99 N CYS A 6 -3.182 -4.237 12.835 1.00 0.00 N ATOM 100 CA CYS A 6 -4.541 -4.678 13.099 1.00 0.00 C ATOM 101 C CYS A 6 -5.472 -3.992 12.099 1.00 0.00 C ATOM 102 O CYS A 6 -5.881 -4.596 11.109 1.00 0.00 O ATOM 103 CB CYS A 6 -4.954 -4.402 14.546 1.00 0.00 C ATOM 104 SG CYS A 6 -5.207 -5.898 15.571 1.00 0.00 S ATOM 0 H CYS A 6 -2.655 -3.961 13.663 1.00 0.00 H new ATOM 0 HA CYS A 6 -4.606 -5.759 12.972 1.00 0.00 H new ATOM 0 HB2 CYS A 6 -4.190 -3.782 15.015 1.00 0.00 H new ATOM 0 HB3 CYS A 6 -5.877 -3.822 14.541 1.00 0.00 H new ATOM 109 N GLU A 7 -5.780 -2.736 12.392 1.00 0.00 N ATOM 110 CA GLU A 7 -6.656 -1.960 11.530 1.00 0.00 C ATOM 111 C GLU A 7 -6.464 -2.372 10.069 1.00 0.00 C ATOM 112 O GLU A 7 -7.375 -2.919 9.450 1.00 0.00 O ATOM 113 CB GLU A 7 -6.415 -0.460 11.712 1.00 0.00 C ATOM 114 CG GLU A 7 -7.570 0.191 12.478 1.00 0.00 C ATOM 115 CD GLU A 7 -7.899 1.571 11.904 1.00 0.00 C ATOM 116 OE1 GLU A 7 -8.284 1.614 10.716 1.00 0.00 O ATOM 117 OE2 GLU A 7 -7.758 2.550 12.668 1.00 0.00 O ATOM 0 H GLU A 7 -5.439 -2.237 13.214 1.00 0.00 H new ATOM 0 HA GLU A 7 -7.688 -2.166 11.813 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -5.481 -0.301 12.251 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -6.306 0.016 10.737 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -8.451 -0.448 12.426 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -7.306 0.285 13.531 1.00 0.00 H new ATOM 124 N PHE A 8 -5.273 -2.094 9.560 1.00 0.00 N ATOM 125 CA PHE A 8 -4.949 -2.430 8.184 1.00 0.00 C ATOM 126 C PHE A 8 -5.397 -3.852 7.847 1.00 0.00 C ATOM 127 O PHE A 8 -6.102 -4.069 6.861 1.00 0.00 O ATOM 128 CB PHE A 8 -3.428 -2.341 8.046 1.00 0.00 C ATOM 129 CG PHE A 8 -2.935 -2.311 6.599 1.00 0.00 C ATOM 130 CD1 PHE A 8 -2.678 -3.474 5.944 1.00 0.00 C ATOM 131 CD2 PHE A 8 -2.751 -1.120 5.968 1.00 0.00 C ATOM 132 CE1 PHE A 8 -2.221 -3.447 4.600 1.00 0.00 C ATOM 133 CE2 PHE A 8 -2.293 -1.092 4.624 1.00 0.00 C ATOM 134 CZ PHE A 8 -2.037 -2.256 3.969 1.00 0.00 C ATOM 0 H PHE A 8 -4.520 -1.639 10.076 1.00 0.00 H new ATOM 0 HA PHE A 8 -5.459 -1.746 7.505 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -3.079 -1.443 8.556 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -2.977 -3.193 8.555 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -2.822 -4.419 6.446 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -2.953 -0.196 6.489 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -2.020 -4.371 4.079 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -2.148 -0.147 4.122 1.00 0.00 H new ATOM 0 HZ PHE A 8 -1.687 -2.235 2.947 1.00 0.00 H new ATOM 144 N ALA A 9 -4.971 -4.787 8.684 1.00 0.00 N ATOM 145 CA ALA A 9 -5.320 -6.184 8.486 1.00 0.00 C ATOM 146 C ALA A 9 -6.842 -6.320 8.416 1.00 0.00 C ATOM 147 O ALA A 9 -7.375 -6.903 7.473 1.00 0.00 O ATOM 148 CB ALA A 9 -4.710 -7.025 9.609 1.00 0.00 C ATOM 0 H ALA A 9 -4.388 -4.605 9.501 1.00 0.00 H new ATOM 0 HA ALA A 9 -4.913 -6.552 7.544 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -4.971 -8.073 9.462 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -3.626 -6.916 9.597 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -5.098 -6.686 10.569 1.00 0.00 H new ATOM 154 N ARG A 10 -7.500 -5.773 9.427 1.00 0.00 N ATOM 155 CA ARG A 10 -8.951 -5.827 9.493 1.00 0.00 C ATOM 156 C ARG A 10 -9.560 -5.335 8.178 1.00 0.00 C ATOM 157 O ARG A 10 -10.210 -6.101 7.467 1.00 0.00 O ATOM 158 CB ARG A 10 -9.482 -4.970 10.644 1.00 0.00 C ATOM 159 CG ARG A 10 -10.842 -5.479 11.124 1.00 0.00 C ATOM 160 CD ARG A 10 -10.683 -6.715 12.012 1.00 0.00 C ATOM 161 NE ARG A 10 -11.989 -7.086 12.601 1.00 0.00 N ATOM 162 CZ ARG A 10 -12.602 -6.390 13.568 1.00 0.00 C ATOM 163 NH1 ARG A 10 -12.033 -5.282 14.059 1.00 0.00 N ATOM 164 NH2 ARG A 10 -13.786 -6.802 14.042 1.00 0.00 N ATOM 0 H ARG A 10 -7.055 -5.290 10.208 1.00 0.00 H new ATOM 0 HA ARG A 10 -9.237 -6.865 9.665 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -8.772 -4.985 11.471 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -9.572 -3.933 10.319 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -11.354 -4.692 11.678 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -11.467 -5.722 10.265 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -10.290 -7.546 11.426 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -9.962 -6.514 12.804 1.00 0.00 H new ATOM 0 HE ARG A 10 -12.451 -7.924 12.249 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -11.133 -4.968 13.697 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -12.500 -4.752 14.795 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -14.220 -7.645 13.667 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -14.253 -6.272 14.778 1.00 0.00 H new ATOM 178 N THR A 11 -9.327 -4.062 7.894 1.00 0.00 N ATOM 179 CA THR A 11 -9.845 -3.461 6.676 1.00 0.00 C ATOM 180 C THR A 11 -9.588 -4.377 5.479 1.00 0.00 C ATOM 181 O THR A 11 -10.511 -4.704 4.734 1.00 0.00 O ATOM 182 CB THR A 11 -9.214 -2.075 6.528 1.00 0.00 C ATOM 183 OG1 THR A 11 -9.829 -1.302 7.555 1.00 0.00 O ATOM 184 CG2 THR A 11 -9.631 -1.376 5.233 1.00 0.00 C ATOM 0 H THR A 11 -8.787 -3.430 8.486 1.00 0.00 H new ATOM 0 HA THR A 11 -10.927 -3.338 6.724 1.00 0.00 H new ATOM 0 HB THR A 11 -8.128 -2.166 6.556 1.00 0.00 H new ATOM 0 HG1 THR A 11 -9.476 -0.388 7.532 1.00 0.00 H new ATOM 0 HG21 THR A 11 -9.155 -0.397 5.179 1.00 0.00 H new ATOM 0 HG22 THR A 11 -9.321 -1.978 4.379 1.00 0.00 H new ATOM 0 HG23 THR A 11 -10.714 -1.254 5.218 1.00 0.00 H new ATOM 192 N LEU A 12 -8.330 -4.764 5.329 1.00 0.00 N ATOM 193 CA LEU A 12 -7.940 -5.636 4.234 1.00 0.00 C ATOM 194 C LEU A 12 -8.905 -6.821 4.163 1.00 0.00 C ATOM 195 O LEU A 12 -9.575 -7.022 3.151 1.00 0.00 O ATOM 196 CB LEU A 12 -6.472 -6.044 4.370 1.00 0.00 C ATOM 197 CG LEU A 12 -5.565 -5.690 3.190 1.00 0.00 C ATOM 198 CD1 LEU A 12 -4.578 -4.585 3.569 1.00 0.00 C ATOM 199 CD2 LEU A 12 -4.853 -6.935 2.654 1.00 0.00 C ATOM 0 H LEU A 12 -7.567 -4.490 5.948 1.00 0.00 H new ATOM 0 HA LEU A 12 -8.012 -5.109 3.283 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -6.067 -5.576 5.267 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.428 -7.122 4.526 1.00 0.00 H new ATOM 0 HG LEU A 12 -6.188 -5.302 2.384 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -3.945 -4.353 2.712 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -5.128 -3.692 3.867 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.956 -4.921 4.399 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -4.214 -6.656 1.816 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -4.244 -7.374 3.444 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -5.593 -7.662 2.320 1.00 0.00 H new ATOM 211 N LYS A 13 -8.944 -7.577 5.251 1.00 0.00 N ATOM 212 CA LYS A 13 -9.814 -8.737 5.325 1.00 0.00 C ATOM 213 C LYS A 13 -11.266 -8.294 5.130 1.00 0.00 C ATOM 214 O LYS A 13 -12.109 -9.083 4.706 1.00 0.00 O ATOM 215 CB LYS A 13 -9.576 -9.504 6.627 1.00 0.00 C ATOM 216 CG LYS A 13 -9.698 -11.013 6.405 1.00 0.00 C ATOM 217 CD LYS A 13 -11.093 -11.512 6.786 1.00 0.00 C ATOM 218 CE LYS A 13 -11.193 -11.763 8.292 1.00 0.00 C ATOM 219 NZ LYS A 13 -12.556 -11.454 8.779 1.00 0.00 N ATOM 0 H LYS A 13 -8.387 -7.408 6.088 1.00 0.00 H new ATOM 0 HA LYS A 13 -9.583 -9.437 4.522 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -8.585 -9.269 7.016 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -10.297 -9.184 7.379 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -9.497 -11.248 5.360 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -8.947 -11.534 6.999 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -11.840 -10.778 6.486 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -11.314 -12.432 6.245 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -10.949 -12.803 8.510 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -10.464 -11.147 8.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -12.607 -11.630 9.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -12.775 -10.455 8.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -13.245 -12.060 8.289 1.00 0.00 H new ATOM 233 N ARG A 14 -11.513 -7.031 5.450 1.00 0.00 N ATOM 234 CA ARG A 14 -12.848 -6.473 5.315 1.00 0.00 C ATOM 235 C ARG A 14 -13.083 -6.001 3.879 1.00 0.00 C ATOM 236 O ARG A 14 -14.227 -5.840 3.454 1.00 0.00 O ATOM 237 CB ARG A 14 -13.053 -5.298 6.273 1.00 0.00 C ATOM 238 CG ARG A 14 -14.534 -4.933 6.385 1.00 0.00 C ATOM 239 CD ARG A 14 -14.764 -3.461 6.039 1.00 0.00 C ATOM 240 NE ARG A 14 -16.101 -3.033 6.508 1.00 0.00 N ATOM 241 CZ ARG A 14 -16.657 -1.850 6.216 1.00 0.00 C ATOM 242 NH1 ARG A 14 -15.995 -0.967 5.456 1.00 0.00 N ATOM 243 NH2 ARG A 14 -17.875 -1.547 6.685 1.00 0.00 N ATOM 0 H ARG A 14 -10.812 -6.379 5.802 1.00 0.00 H new ATOM 0 HA ARG A 14 -13.563 -7.257 5.564 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -12.663 -5.555 7.258 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -12.488 -4.435 5.921 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -15.119 -5.563 5.715 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -14.885 -5.131 7.398 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -13.993 -2.845 6.502 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -14.684 -3.315 4.962 1.00 0.00 H new ATOM 0 HE ARG A 14 -16.633 -3.680 7.090 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -15.067 -1.196 5.099 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -16.419 -0.066 5.234 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -18.380 -2.217 7.265 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -18.298 -0.646 6.462 1.00 0.00 H new ATOM 257 N ASN A 15 -11.983 -5.791 3.171 1.00 0.00 N ATOM 258 CA ASN A 15 -12.055 -5.339 1.793 1.00 0.00 C ATOM 259 C ASN A 15 -12.134 -6.553 0.866 1.00 0.00 C ATOM 260 O ASN A 15 -12.900 -6.557 -0.096 1.00 0.00 O ATOM 261 CB ASN A 15 -10.812 -4.533 1.411 1.00 0.00 C ATOM 262 CG ASN A 15 -11.184 -3.326 0.548 1.00 0.00 C ATOM 263 OD1 ASN A 15 -12.345 -3.042 0.299 1.00 0.00 O ATOM 264 ND2 ASN A 15 -10.139 -2.635 0.104 1.00 0.00 N ATOM 0 H ASN A 15 -11.037 -5.926 3.527 1.00 0.00 H new ATOM 0 HA ASN A 15 -12.938 -4.709 1.691 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -10.302 -4.196 2.313 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -10.113 -5.170 0.869 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -10.283 -1.813 -0.482 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -9.193 -2.927 0.350 1.00 0.00 H new ATOM 271 N GLY A 16 -11.330 -7.556 1.188 1.00 0.00 N ATOM 272 CA GLY A 16 -11.298 -8.774 0.397 1.00 0.00 C ATOM 273 C GLY A 16 -9.930 -8.966 -0.260 1.00 0.00 C ATOM 274 O GLY A 16 -9.837 -9.504 -1.363 1.00 0.00 O ATOM 0 H GLY A 16 -10.695 -7.550 1.987 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -11.523 -9.630 1.032 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -12.071 -8.734 -0.370 1.00 0.00 H new ATOM 278 N MET A 17 -8.902 -8.516 0.444 1.00 0.00 N ATOM 279 CA MET A 17 -7.543 -8.631 -0.057 1.00 0.00 C ATOM 280 C MET A 17 -6.699 -9.530 0.848 1.00 0.00 C ATOM 281 O MET A 17 -5.846 -10.275 0.367 1.00 0.00 O ATOM 282 CB MET A 17 -6.907 -7.241 -0.133 1.00 0.00 C ATOM 283 CG MET A 17 -7.241 -6.557 -1.461 1.00 0.00 C ATOM 284 SD MET A 17 -6.554 -7.490 -2.818 1.00 0.00 S ATOM 285 CE MET A 17 -8.010 -7.677 -3.834 1.00 0.00 C ATOM 0 H MET A 17 -8.983 -8.071 1.358 1.00 0.00 H new ATOM 0 HA MET A 17 -7.579 -9.079 -1.050 1.00 0.00 H new ATOM 0 HB2 MET A 17 -7.263 -6.628 0.695 1.00 0.00 H new ATOM 0 HB3 MET A 17 -5.826 -7.326 -0.025 1.00 0.00 H new ATOM 0 HG2 MET A 17 -8.322 -6.475 -1.576 1.00 0.00 H new ATOM 0 HG3 MET A 17 -6.842 -5.543 -1.467 1.00 0.00 H new ATOM 0 HE1 MET A 17 -8.250 -8.736 -3.935 1.00 0.00 H new ATOM 0 HE2 MET A 17 -8.848 -7.158 -3.368 1.00 0.00 H new ATOM 0 HE3 MET A 17 -7.823 -7.252 -4.820 1.00 0.00 H new ATOM 295 N ALA A 18 -6.966 -9.431 2.142 1.00 0.00 N ATOM 296 CA ALA A 18 -6.242 -10.226 3.118 1.00 0.00 C ATOM 297 C ALA A 18 -6.294 -11.699 2.710 1.00 0.00 C ATOM 298 O ALA A 18 -7.353 -12.323 2.755 1.00 0.00 O ATOM 299 CB ALA A 18 -6.831 -9.986 4.510 1.00 0.00 C ATOM 0 H ALA A 18 -7.674 -8.812 2.537 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.193 -9.930 3.152 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -6.288 -10.583 5.243 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -6.743 -8.930 4.765 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -7.882 -10.274 4.515 1.00 0.00 H new ATOM 305 N GLY A 19 -5.137 -12.213 2.319 1.00 0.00 N ATOM 306 CA GLY A 19 -5.037 -13.602 1.902 1.00 0.00 C ATOM 307 C GLY A 19 -5.394 -13.757 0.422 1.00 0.00 C ATOM 308 O GLY A 19 -5.972 -14.768 0.023 1.00 0.00 O ATOM 0 H GLY A 19 -4.261 -11.693 2.282 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -4.024 -13.966 2.076 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -5.704 -14.216 2.507 1.00 0.00 H new ATOM 312 N TYR A 20 -5.037 -12.742 -0.349 1.00 0.00 N ATOM 313 CA TYR A 20 -5.312 -12.753 -1.776 1.00 0.00 C ATOM 314 C TYR A 20 -4.760 -14.021 -2.431 1.00 0.00 C ATOM 315 O TYR A 20 -4.300 -14.930 -1.742 1.00 0.00 O ATOM 316 CB TYR A 20 -4.587 -11.537 -2.355 1.00 0.00 C ATOM 317 CG TYR A 20 -5.166 -11.042 -3.681 1.00 0.00 C ATOM 318 CD1 TYR A 20 -6.533 -10.987 -3.861 1.00 0.00 C ATOM 319 CD2 TYR A 20 -4.321 -10.648 -4.699 1.00 0.00 C ATOM 320 CE1 TYR A 20 -7.078 -10.522 -5.111 1.00 0.00 C ATOM 321 CE2 TYR A 20 -4.865 -10.181 -5.948 1.00 0.00 C ATOM 322 CZ TYR A 20 -6.216 -10.141 -6.092 1.00 0.00 C ATOM 323 OH TYR A 20 -6.731 -9.701 -7.272 1.00 0.00 O ATOM 0 H TYR A 20 -4.559 -11.906 -0.013 1.00 0.00 H new ATOM 0 HA TYR A 20 -6.386 -12.726 -1.960 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.623 -10.725 -1.629 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -3.536 -11.788 -2.500 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -7.195 -11.293 -3.064 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -3.251 -10.690 -4.559 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -8.146 -10.477 -5.266 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -4.214 -9.870 -6.752 1.00 0.00 H new ATOM 0 HH TYR A 20 -6.000 -9.462 -7.879 1.00 0.00 H new ATOM 333 N TYR A 21 -4.824 -14.040 -3.754 1.00 0.00 N ATOM 334 CA TYR A 21 -4.336 -15.181 -4.510 1.00 0.00 C ATOM 335 C TYR A 21 -3.089 -15.781 -3.855 1.00 0.00 C ATOM 336 O TYR A 21 -2.862 -16.987 -3.934 1.00 0.00 O ATOM 337 CB TYR A 21 -3.961 -14.642 -5.893 1.00 0.00 C ATOM 338 CG TYR A 21 -4.871 -15.135 -7.020 1.00 0.00 C ATOM 339 CD1 TYR A 21 -6.095 -14.535 -7.230 1.00 0.00 C ATOM 340 CD2 TYR A 21 -4.465 -16.179 -7.826 1.00 0.00 C ATOM 341 CE1 TYR A 21 -6.951 -14.999 -8.291 1.00 0.00 C ATOM 342 CE2 TYR A 21 -5.322 -16.643 -8.887 1.00 0.00 C ATOM 343 CZ TYR A 21 -6.522 -16.030 -9.068 1.00 0.00 C ATOM 344 OH TYR A 21 -7.331 -16.467 -10.070 1.00 0.00 O ATOM 0 H TYR A 21 -5.206 -13.284 -4.322 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.095 -15.962 -4.557 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -3.989 -13.553 -5.867 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.934 -14.929 -6.117 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -6.411 -13.718 -6.599 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -3.506 -16.648 -7.662 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -7.912 -14.539 -8.466 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -5.018 -17.460 -9.525 1.00 0.00 H new ATOM 0 HH TYR A 21 -6.896 -17.207 -10.543 1.00 0.00 H new ATOM 354 N GLY A 22 -2.315 -14.911 -3.223 1.00 0.00 N ATOM 355 CA GLY A 22 -1.098 -15.339 -2.555 1.00 0.00 C ATOM 356 C GLY A 22 -0.718 -14.370 -1.433 1.00 0.00 C ATOM 357 O GLY A 22 -0.689 -14.749 -0.264 1.00 0.00 O ATOM 0 H GLY A 22 -2.507 -13.911 -3.159 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -1.237 -16.339 -2.145 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -0.285 -15.401 -3.278 1.00 0.00 H new ATOM 361 N VAL A 23 -0.438 -13.137 -1.830 1.00 0.00 N ATOM 362 CA VAL A 23 -0.060 -12.110 -0.874 1.00 0.00 C ATOM 363 C VAL A 23 -1.102 -12.056 0.245 1.00 0.00 C ATOM 364 O VAL A 23 -2.217 -11.582 0.038 1.00 0.00 O ATOM 365 CB VAL A 23 0.121 -10.770 -1.588 1.00 0.00 C ATOM 366 CG1 VAL A 23 1.421 -10.750 -2.395 1.00 0.00 C ATOM 367 CG2 VAL A 23 -1.083 -10.458 -2.480 1.00 0.00 C ATOM 0 H VAL A 23 -0.465 -12.826 -2.801 1.00 0.00 H new ATOM 0 HA VAL A 23 0.899 -12.349 -0.415 1.00 0.00 H new ATOM 0 HB VAL A 23 0.187 -9.991 -0.828 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.525 -9.786 -2.893 1.00 0.00 H new ATOM 0 HG12 VAL A 23 2.267 -10.906 -1.726 1.00 0.00 H new ATOM 0 HG13 VAL A 23 1.398 -11.543 -3.142 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -0.929 -9.500 -2.976 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -1.193 -11.242 -3.230 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -1.985 -10.410 -1.870 1.00 0.00 H new ATOM 377 N SER A 24 -0.701 -12.548 1.409 1.00 0.00 N ATOM 378 CA SER A 24 -1.585 -12.560 2.561 1.00 0.00 C ATOM 379 C SER A 24 -1.407 -11.275 3.372 1.00 0.00 C ATOM 380 O SER A 24 -0.483 -10.503 3.123 1.00 0.00 O ATOM 381 CB SER A 24 -1.325 -13.784 3.442 1.00 0.00 C ATOM 382 OG SER A 24 -1.928 -14.962 2.911 1.00 0.00 O ATOM 0 H SER A 24 0.225 -12.941 1.578 1.00 0.00 H new ATOM 0 HA SER A 24 -2.613 -12.616 2.202 1.00 0.00 H new ATOM 0 HB2 SER A 24 -0.250 -13.939 3.539 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.712 -13.598 4.444 1.00 0.00 H new ATOM 0 HG SER A 24 -1.738 -15.721 3.501 1.00 0.00 H new ATOM 388 N LEU A 25 -2.306 -11.086 4.326 1.00 0.00 N ATOM 389 CA LEU A 25 -2.261 -9.908 5.175 1.00 0.00 C ATOM 390 C LEU A 25 -0.847 -9.745 5.738 1.00 0.00 C ATOM 391 O LEU A 25 -0.406 -8.627 6.003 1.00 0.00 O ATOM 392 CB LEU A 25 -3.346 -9.980 6.251 1.00 0.00 C ATOM 393 CG LEU A 25 -3.843 -11.382 6.609 1.00 0.00 C ATOM 394 CD1 LEU A 25 -4.216 -11.470 8.090 1.00 0.00 C ATOM 395 CD2 LEU A 25 -5.001 -11.802 5.702 1.00 0.00 C ATOM 0 H LEU A 25 -3.071 -11.729 4.530 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.480 -9.012 4.594 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.964 -9.509 7.157 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.199 -9.387 5.919 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.028 -12.086 6.439 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.566 -12.477 8.318 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.341 -11.243 8.700 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.007 -10.753 8.309 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.335 -12.802 5.978 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.826 -11.099 5.817 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -4.668 -11.804 4.664 1.00 0.00 H new ATOM 407 N ALA A 26 -0.176 -10.876 5.903 1.00 0.00 N ATOM 408 CA ALA A 26 1.178 -10.872 6.428 1.00 0.00 C ATOM 409 C ALA A 26 2.095 -10.124 5.459 1.00 0.00 C ATOM 410 O ALA A 26 2.813 -9.208 5.858 1.00 0.00 O ATOM 411 CB ALA A 26 1.636 -12.312 6.670 1.00 0.00 C ATOM 0 H ALA A 26 -0.545 -11.801 5.682 1.00 0.00 H new ATOM 0 HA ALA A 26 1.216 -10.352 7.385 1.00 0.00 H new ATOM 0 HB1 ALA A 26 2.652 -12.309 7.064 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.970 -12.790 7.388 1.00 0.00 H new ATOM 0 HB3 ALA A 26 1.613 -12.864 5.730 1.00 0.00 H new ATOM 417 N ASP A 27 2.043 -10.542 4.202 1.00 0.00 N ATOM 418 CA ASP A 27 2.860 -9.923 3.173 1.00 0.00 C ATOM 419 C ASP A 27 2.425 -8.468 2.989 1.00 0.00 C ATOM 420 O ASP A 27 3.252 -7.599 2.717 1.00 0.00 O ATOM 421 CB ASP A 27 2.691 -10.641 1.832 1.00 0.00 C ATOM 422 CG ASP A 27 2.373 -12.133 1.931 1.00 0.00 C ATOM 423 OD1 ASP A 27 1.510 -12.475 2.770 1.00 0.00 O ATOM 424 OD2 ASP A 27 2.999 -12.900 1.168 1.00 0.00 O ATOM 0 H ASP A 27 1.447 -11.302 3.874 1.00 0.00 H new ATOM 0 HA ASP A 27 3.902 -9.984 3.487 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.893 -10.152 1.273 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.607 -10.518 1.254 1.00 0.00 H new ATOM 429 N TRP A 28 1.128 -8.247 3.144 1.00 0.00 N ATOM 430 CA TRP A 28 0.573 -6.913 2.999 1.00 0.00 C ATOM 431 C TRP A 28 1.076 -6.062 4.167 1.00 0.00 C ATOM 432 O TRP A 28 1.755 -5.056 3.960 1.00 0.00 O ATOM 433 CB TRP A 28 -0.953 -6.960 2.909 1.00 0.00 C ATOM 434 CG TRP A 28 -1.481 -7.488 1.574 1.00 0.00 C ATOM 435 CD1 TRP A 28 -2.062 -8.670 1.326 1.00 0.00 C ATOM 436 CD2 TRP A 28 -1.453 -6.802 0.305 1.00 0.00 C ATOM 437 NE1 TRP A 28 -2.410 -8.796 -0.003 1.00 0.00 N ATOM 438 CE2 TRP A 28 -2.027 -7.623 -0.645 1.00 0.00 C ATOM 439 CE3 TRP A 28 -0.958 -5.529 -0.030 1.00 0.00 C ATOM 440 CZ2 TRP A 28 -2.160 -7.262 -1.990 1.00 0.00 C ATOM 441 CZ3 TRP A 28 -1.098 -5.183 -1.380 1.00 0.00 C ATOM 442 CH2 TRP A 28 -1.674 -5.998 -2.347 1.00 0.00 C ATOM 0 H TRP A 28 0.445 -8.971 3.369 1.00 0.00 H new ATOM 0 HA TRP A 28 0.906 -6.457 2.066 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.335 -7.589 3.713 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -1.348 -5.957 3.073 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -2.236 -9.430 2.074 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -2.864 -9.601 -0.435 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -0.506 -4.870 0.696 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -2.613 -7.923 -2.714 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -0.733 -4.215 -1.691 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -1.747 -5.658 -3.370 1.00 0.00 H new ATOM 453 N VAL A 29 0.724 -6.495 5.369 1.00 0.00 N ATOM 454 CA VAL A 29 1.132 -5.786 6.570 1.00 0.00 C ATOM 455 C VAL A 29 2.655 -5.638 6.578 1.00 0.00 C ATOM 456 O VAL A 29 3.174 -4.529 6.683 1.00 0.00 O ATOM 457 CB VAL A 29 0.594 -6.503 7.809 1.00 0.00 C ATOM 458 CG1 VAL A 29 1.038 -5.793 9.089 1.00 0.00 C ATOM 459 CG2 VAL A 29 -0.929 -6.628 7.752 1.00 0.00 C ATOM 0 H VAL A 29 0.160 -7.328 5.537 1.00 0.00 H new ATOM 0 HA VAL A 29 0.708 -4.782 6.583 1.00 0.00 H new ATOM 0 HB VAL A 29 1.012 -7.509 7.822 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.642 -6.323 9.955 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.127 -5.779 9.139 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.662 -4.770 9.087 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.286 -7.142 8.645 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.374 -5.634 7.703 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -1.214 -7.197 6.868 1.00 0.00 H new ATOM 469 N CYS A 30 3.327 -6.775 6.466 1.00 0.00 N ATOM 470 CA CYS A 30 4.781 -6.786 6.459 1.00 0.00 C ATOM 471 C CYS A 30 5.265 -5.754 5.438 1.00 0.00 C ATOM 472 O CYS A 30 6.036 -4.858 5.776 1.00 0.00 O ATOM 473 CB CYS A 30 5.334 -8.182 6.165 1.00 0.00 C ATOM 474 SG CYS A 30 7.126 -8.379 6.477 1.00 0.00 S ATOM 0 H CYS A 30 2.892 -7.694 6.379 1.00 0.00 H new ATOM 0 HA CYS A 30 5.154 -6.519 7.448 1.00 0.00 H new ATOM 0 HB2 CYS A 30 4.792 -8.907 6.772 1.00 0.00 H new ATOM 0 HB3 CYS A 30 5.132 -8.425 5.122 1.00 0.00 H new ATOM 479 N LEU A 31 4.792 -5.915 4.212 1.00 0.00 N ATOM 480 CA LEU A 31 5.167 -5.008 3.140 1.00 0.00 C ATOM 481 C LEU A 31 5.004 -3.565 3.619 1.00 0.00 C ATOM 482 O LEU A 31 5.894 -2.738 3.423 1.00 0.00 O ATOM 483 CB LEU A 31 4.378 -5.326 1.868 1.00 0.00 C ATOM 484 CG LEU A 31 4.648 -4.419 0.666 1.00 0.00 C ATOM 485 CD1 LEU A 31 3.899 -4.912 -0.573 1.00 0.00 C ATOM 486 CD2 LEU A 31 4.316 -2.961 0.994 1.00 0.00 C ATOM 0 H LEU A 31 4.152 -6.660 3.936 1.00 0.00 H new ATOM 0 HA LEU A 31 6.217 -5.141 2.878 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.594 -6.354 1.578 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.315 -5.278 2.102 1.00 0.00 H new ATOM 0 HG LEU A 31 5.713 -4.464 0.437 1.00 0.00 H new ATOM 0 HD11 LEU A 31 4.109 -4.249 -1.413 1.00 0.00 H new ATOM 0 HD12 LEU A 31 4.226 -5.922 -0.818 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.828 -4.916 -0.373 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.517 -2.337 0.123 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.263 -2.879 1.264 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.931 -2.627 1.829 1.00 0.00 H new ATOM 498 N ALA A 32 3.861 -3.305 4.239 1.00 0.00 N ATOM 499 CA ALA A 32 3.571 -1.976 4.748 1.00 0.00 C ATOM 500 C ALA A 32 4.549 -1.642 5.876 1.00 0.00 C ATOM 501 O ALA A 32 4.877 -0.476 6.092 1.00 0.00 O ATOM 502 CB ALA A 32 2.112 -1.910 5.202 1.00 0.00 C ATOM 0 H ALA A 32 3.125 -3.993 4.400 1.00 0.00 H new ATOM 0 HA ALA A 32 3.703 -1.228 3.966 1.00 0.00 H new ATOM 0 HB1 ALA A 32 1.895 -0.913 5.584 1.00 0.00 H new ATOM 0 HB2 ALA A 32 1.458 -2.126 4.357 1.00 0.00 H new ATOM 0 HB3 ALA A 32 1.942 -2.645 5.989 1.00 0.00 H new ATOM 508 N GLN A 33 4.987 -2.685 6.565 1.00 0.00 N ATOM 509 CA GLN A 33 5.919 -2.517 7.667 1.00 0.00 C ATOM 510 C GLN A 33 7.281 -2.056 7.143 1.00 0.00 C ATOM 511 O GLN A 33 7.828 -1.062 7.617 1.00 0.00 O ATOM 512 CB GLN A 33 6.052 -3.809 8.475 1.00 0.00 C ATOM 513 CG GLN A 33 6.526 -3.518 9.900 1.00 0.00 C ATOM 514 CD GLN A 33 7.916 -4.108 10.146 1.00 0.00 C ATOM 515 OE1 GLN A 33 8.915 -3.652 9.614 1.00 0.00 O ATOM 516 NE2 GLN A 33 7.925 -5.142 10.981 1.00 0.00 N ATOM 0 H GLN A 33 4.714 -3.650 6.381 1.00 0.00 H new ATOM 0 HA GLN A 33 5.528 -1.749 8.334 1.00 0.00 H new ATOM 0 HB2 GLN A 33 5.092 -4.324 8.505 1.00 0.00 H new ATOM 0 HB3 GLN A 33 6.757 -4.479 7.983 1.00 0.00 H new ATOM 0 HG2 GLN A 33 6.549 -2.441 10.067 1.00 0.00 H new ATOM 0 HG3 GLN A 33 5.818 -3.936 10.615 1.00 0.00 H new ATOM 0 HE21 GLN A 33 7.052 -5.473 11.392 1.00 0.00 H new ATOM 0 HE22 GLN A 33 8.805 -5.604 11.211 1.00 0.00 H new ATOM 525 N HIS A 34 7.788 -2.800 6.172 1.00 0.00 N ATOM 526 CA HIS A 34 9.075 -2.480 5.578 1.00 0.00 C ATOM 527 C HIS A 34 9.028 -1.074 4.977 1.00 0.00 C ATOM 528 O HIS A 34 10.057 -0.412 4.853 1.00 0.00 O ATOM 529 CB HIS A 34 9.485 -3.546 4.560 1.00 0.00 C ATOM 530 CG HIS A 34 10.975 -3.638 4.333 1.00 0.00 C ATOM 531 ND1 HIS A 34 11.860 -2.663 4.758 1.00 0.00 N ATOM 532 CD2 HIS A 34 11.726 -4.599 3.721 1.00 0.00 C ATOM 533 CE1 HIS A 34 13.085 -3.030 4.412 1.00 0.00 C ATOM 534 NE2 HIS A 34 12.999 -4.229 3.768 1.00 0.00 N ATOM 0 H HIS A 34 7.331 -3.624 5.781 1.00 0.00 H new ATOM 0 HA HIS A 34 9.845 -2.483 6.349 1.00 0.00 H new ATOM 0 HB2 HIS A 34 9.119 -4.516 4.897 1.00 0.00 H new ATOM 0 HB3 HIS A 34 8.996 -3.333 3.610 1.00 0.00 H new ATOM 0 HD1 HIS A 34 11.611 -1.807 5.254 1.00 0.00 H new ATOM 0 HD2 HIS A 34 11.348 -5.507 3.274 1.00 0.00 H new ATOM 0 HE1 HIS A 34 13.992 -2.477 4.606 1.00 0.00 H new ATOM 543 N GLU A 35 7.821 -0.658 4.619 1.00 0.00 N ATOM 544 CA GLU A 35 7.626 0.657 4.034 1.00 0.00 C ATOM 545 C GLU A 35 7.617 1.728 5.127 1.00 0.00 C ATOM 546 O GLU A 35 8.453 2.631 5.124 1.00 0.00 O ATOM 547 CB GLU A 35 6.339 0.705 3.210 1.00 0.00 C ATOM 548 CG GLU A 35 6.469 -0.137 1.939 1.00 0.00 C ATOM 549 CD GLU A 35 7.045 0.691 0.788 1.00 0.00 C ATOM 550 OE1 GLU A 35 8.064 1.372 1.034 1.00 0.00 O ATOM 551 OE2 GLU A 35 6.453 0.625 -0.310 1.00 0.00 O ATOM 0 H GLU A 35 6.969 -1.209 4.723 1.00 0.00 H new ATOM 0 HA GLU A 35 8.458 0.860 3.360 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.506 0.339 3.809 1.00 0.00 H new ATOM 0 HB3 GLU A 35 6.111 1.737 2.945 1.00 0.00 H new ATOM 0 HG2 GLU A 35 7.113 -0.995 2.132 1.00 0.00 H new ATOM 0 HG3 GLU A 35 5.492 -0.528 1.656 1.00 0.00 H new ATOM 558 N SER A 36 6.663 1.593 6.036 1.00 0.00 N ATOM 559 CA SER A 36 6.534 2.537 7.133 1.00 0.00 C ATOM 560 C SER A 36 5.425 2.085 8.085 1.00 0.00 C ATOM 561 O SER A 36 5.635 2.004 9.294 1.00 0.00 O ATOM 562 CB SER A 36 6.246 3.948 6.614 1.00 0.00 C ATOM 563 OG SER A 36 6.250 4.912 7.662 1.00 0.00 O ATOM 0 H SER A 36 5.971 0.843 6.035 1.00 0.00 H new ATOM 0 HA SER A 36 7.480 2.564 7.674 1.00 0.00 H new ATOM 0 HB2 SER A 36 6.993 4.220 5.868 1.00 0.00 H new ATOM 0 HB3 SER A 36 5.278 3.960 6.114 1.00 0.00 H new ATOM 0 HG SER A 36 6.064 5.800 7.291 1.00 0.00 H new ATOM 569 N ASN A 37 4.268 1.803 7.504 1.00 0.00 N ATOM 570 CA ASN A 37 3.126 1.363 8.286 1.00 0.00 C ATOM 571 C ASN A 37 2.947 2.291 9.489 1.00 0.00 C ATOM 572 O ASN A 37 3.641 3.299 9.608 1.00 0.00 O ATOM 573 CB ASN A 37 3.334 -0.060 8.811 1.00 0.00 C ATOM 574 CG ASN A 37 1.993 -0.762 9.038 1.00 0.00 C ATOM 575 OD1 ASN A 37 1.278 -1.104 8.111 1.00 0.00 O ATOM 576 ND2 ASN A 37 1.695 -0.958 10.319 1.00 0.00 N ATOM 0 H ASN A 37 4.097 1.871 6.501 1.00 0.00 H new ATOM 0 HA ASN A 37 2.247 1.385 7.641 1.00 0.00 H new ATOM 0 HB2 ASN A 37 3.931 -0.630 8.100 1.00 0.00 H new ATOM 0 HB3 ASN A 37 3.895 -0.029 9.745 1.00 0.00 H new ATOM 0 HD21 ASN A 37 0.822 -1.420 10.575 1.00 0.00 H new ATOM 0 HD22 ASN A 37 2.339 -0.646 11.046 1.00 0.00 H new ATOM 583 N TYR A 38 2.012 1.917 10.350 1.00 0.00 N ATOM 584 CA TYR A 38 1.734 2.703 11.540 1.00 0.00 C ATOM 585 C TYR A 38 1.238 4.102 11.169 1.00 0.00 C ATOM 586 O TYR A 38 0.134 4.493 11.547 1.00 0.00 O ATOM 587 CB TYR A 38 3.065 2.828 12.284 1.00 0.00 C ATOM 588 CG TYR A 38 3.245 1.811 13.413 1.00 0.00 C ATOM 589 CD1 TYR A 38 2.460 1.891 14.545 1.00 0.00 C ATOM 590 CD2 TYR A 38 4.192 0.813 13.297 1.00 0.00 C ATOM 591 CE1 TYR A 38 2.630 0.933 15.608 1.00 0.00 C ATOM 592 CE2 TYR A 38 4.360 -0.144 14.359 1.00 0.00 C ATOM 593 CZ TYR A 38 3.572 -0.037 15.462 1.00 0.00 C ATOM 594 OH TYR A 38 3.732 -0.941 16.465 1.00 0.00 O ATOM 0 H TYR A 38 1.438 1.080 10.247 1.00 0.00 H new ATOM 0 HA TYR A 38 0.961 2.226 12.143 1.00 0.00 H new ATOM 0 HB2 TYR A 38 3.881 2.711 11.570 1.00 0.00 H new ATOM 0 HB3 TYR A 38 3.145 3.833 12.698 1.00 0.00 H new ATOM 0 HD1 TYR A 38 1.719 2.671 14.634 1.00 0.00 H new ATOM 0 HD2 TYR A 38 4.806 0.750 12.411 1.00 0.00 H new ATOM 0 HE1 TYR A 38 2.023 0.984 16.500 1.00 0.00 H new ATOM 0 HE2 TYR A 38 5.096 -0.930 14.281 1.00 0.00 H new ATOM 0 HH TYR A 38 4.439 -1.576 16.224 1.00 0.00 H new ATOM 604 N ASN A 39 2.076 4.817 10.434 1.00 0.00 N ATOM 605 CA ASN A 39 1.736 6.164 10.007 1.00 0.00 C ATOM 606 C ASN A 39 1.805 6.244 8.481 1.00 0.00 C ATOM 607 O ASN A 39 2.670 5.627 7.862 1.00 0.00 O ATOM 608 CB ASN A 39 2.719 7.187 10.578 1.00 0.00 C ATOM 609 CG ASN A 39 2.816 7.065 12.101 1.00 0.00 C ATOM 610 OD1 ASN A 39 3.122 6.018 12.647 1.00 0.00 O ATOM 611 ND2 ASN A 39 2.537 8.191 12.752 1.00 0.00 N ATOM 0 H ASN A 39 2.990 4.489 10.123 1.00 0.00 H new ATOM 0 HA ASN A 39 0.732 6.388 10.367 1.00 0.00 H new ATOM 0 HB2 ASN A 39 3.703 7.038 10.134 1.00 0.00 H new ATOM 0 HB3 ASN A 39 2.398 8.194 10.310 1.00 0.00 H new ATOM 0 HD21 ASN A 39 2.572 8.213 13.771 1.00 0.00 H new ATOM 0 HD22 ASN A 39 2.288 9.032 12.232 1.00 0.00 H new ATOM 618 N THR A 40 0.880 7.008 7.919 1.00 0.00 N ATOM 619 CA THR A 40 0.824 7.176 6.476 1.00 0.00 C ATOM 620 C THR A 40 1.425 8.524 6.073 1.00 0.00 C ATOM 621 O THR A 40 1.215 8.992 4.955 1.00 0.00 O ATOM 622 CB THR A 40 -0.631 7.003 6.035 1.00 0.00 C ATOM 623 OG1 THR A 40 -1.177 8.316 6.121 1.00 0.00 O ATOM 624 CG2 THR A 40 -1.454 6.191 7.038 1.00 0.00 C ATOM 0 H THR A 40 0.163 7.518 8.436 1.00 0.00 H new ATOM 0 HA THR A 40 1.424 6.422 5.967 1.00 0.00 H new ATOM 0 HB THR A 40 -0.660 6.514 5.061 1.00 0.00 H new ATOM 0 HG1 THR A 40 -2.070 8.326 5.717 1.00 0.00 H new ATOM 0 HG21 THR A 40 -2.478 6.098 6.677 1.00 0.00 H new ATOM 0 HG22 THR A 40 -1.017 5.199 7.149 1.00 0.00 H new ATOM 0 HG23 THR A 40 -1.454 6.697 8.003 1.00 0.00 H new ATOM 632 N ARG A 41 2.161 9.110 7.005 1.00 0.00 N ATOM 633 CA ARG A 41 2.795 10.395 6.761 1.00 0.00 C ATOM 634 C ARG A 41 3.770 10.291 5.587 1.00 0.00 C ATOM 635 O ARG A 41 4.204 11.306 5.044 1.00 0.00 O ATOM 636 CB ARG A 41 3.547 10.882 8.000 1.00 0.00 C ATOM 637 CG ARG A 41 3.909 12.364 7.875 1.00 0.00 C ATOM 638 CD ARG A 41 3.252 13.184 8.987 1.00 0.00 C ATOM 639 NE ARG A 41 1.853 13.499 8.625 1.00 0.00 N ATOM 640 CZ ARG A 41 0.933 13.939 9.494 1.00 0.00 C ATOM 641 NH1 ARG A 41 1.259 14.117 10.781 1.00 0.00 N ATOM 642 NH2 ARG A 41 -0.314 14.199 9.076 1.00 0.00 N ATOM 0 H ARG A 41 2.333 8.719 7.931 1.00 0.00 H new ATOM 0 HA ARG A 41 2.010 11.113 6.522 1.00 0.00 H new ATOM 0 HB2 ARG A 41 2.932 10.728 8.887 1.00 0.00 H new ATOM 0 HB3 ARG A 41 4.454 10.293 8.134 1.00 0.00 H new ATOM 0 HG2 ARG A 41 4.991 12.483 7.922 1.00 0.00 H new ATOM 0 HG3 ARG A 41 3.589 12.740 6.903 1.00 0.00 H new ATOM 0 HD2 ARG A 41 3.277 12.627 9.924 1.00 0.00 H new ATOM 0 HD3 ARG A 41 3.811 14.106 9.149 1.00 0.00 H new ATOM 0 HE ARG A 41 1.571 13.373 7.653 1.00 0.00 H new ATOM 0 HH11 ARG A 41 2.207 13.918 11.099 1.00 0.00 H new ATOM 0 HH12 ARG A 41 0.559 14.452 11.443 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -0.562 14.062 8.096 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -1.014 14.534 9.738 1.00 0.00 H new ATOM 656 N ALA A 42 4.088 9.055 5.231 1.00 0.00 N ATOM 657 CA ALA A 42 5.005 8.805 4.132 1.00 0.00 C ATOM 658 C ALA A 42 4.609 9.673 2.936 1.00 0.00 C ATOM 659 O ALA A 42 3.726 9.304 2.163 1.00 0.00 O ATOM 660 CB ALA A 42 5.005 7.313 3.796 1.00 0.00 C ATOM 0 H ALA A 42 3.727 8.216 5.684 1.00 0.00 H new ATOM 0 HA ALA A 42 6.023 9.075 4.412 1.00 0.00 H new ATOM 0 HB1 ALA A 42 5.693 7.126 2.972 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.322 6.743 4.670 1.00 0.00 H new ATOM 0 HB3 ALA A 42 4.000 7.005 3.507 1.00 0.00 H new ATOM 666 N THR A 43 5.281 10.809 2.820 1.00 0.00 N ATOM 667 CA THR A 43 5.010 11.732 1.731 1.00 0.00 C ATOM 668 C THR A 43 6.312 12.350 1.219 1.00 0.00 C ATOM 669 O THR A 43 7.146 12.791 2.009 1.00 0.00 O ATOM 670 CB THR A 43 3.999 12.766 2.229 1.00 0.00 C ATOM 671 OG1 THR A 43 4.486 13.135 3.517 1.00 0.00 O ATOM 672 CG2 THR A 43 2.625 12.156 2.510 1.00 0.00 C ATOM 0 H THR A 43 6.013 11.111 3.463 1.00 0.00 H new ATOM 0 HA THR A 43 4.574 11.217 0.875 1.00 0.00 H new ATOM 0 HB THR A 43 3.898 13.559 1.489 1.00 0.00 H new ATOM 0 HG1 THR A 43 4.071 12.566 4.199 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.946 12.934 2.861 1.00 0.00 H new ATOM 0 HG22 THR A 43 2.229 11.714 1.596 1.00 0.00 H new ATOM 0 HG23 THR A 43 2.719 11.385 3.274 1.00 0.00 H new ATOM 680 N ASN A 44 6.446 12.363 -0.098 1.00 0.00 N ATOM 681 CA ASN A 44 7.633 12.922 -0.724 1.00 0.00 C ATOM 682 C ASN A 44 7.265 13.479 -2.100 1.00 0.00 C ATOM 683 O ASN A 44 7.201 12.737 -3.078 1.00 0.00 O ATOM 684 CB ASN A 44 8.707 11.850 -0.921 1.00 0.00 C ATOM 685 CG ASN A 44 10.053 12.313 -0.360 1.00 0.00 C ATOM 686 OD1 ASN A 44 10.431 11.998 0.756 1.00 0.00 O ATOM 687 ND2 ASN A 44 10.754 13.077 -1.194 1.00 0.00 N ATOM 0 H ASN A 44 5.753 11.996 -0.750 1.00 0.00 H new ATOM 0 HA ASN A 44 8.020 13.706 -0.073 1.00 0.00 H new ATOM 0 HB2 ASN A 44 8.401 10.928 -0.427 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.810 11.624 -1.982 1.00 0.00 H new ATOM 0 HD21 ASN A 44 11.666 13.436 -0.912 1.00 0.00 H new ATOM 0 HD22 ASN A 44 10.379 13.303 -2.115 1.00 0.00 H new ATOM 694 N TYR A 45 7.031 14.783 -2.132 1.00 0.00 N ATOM 695 CA TYR A 45 6.670 15.450 -3.371 1.00 0.00 C ATOM 696 C TYR A 45 7.916 15.931 -4.118 1.00 0.00 C ATOM 697 O TYR A 45 8.975 16.107 -3.517 1.00 0.00 O ATOM 698 CB TYR A 45 5.831 16.664 -2.969 1.00 0.00 C ATOM 699 CG TYR A 45 6.657 17.877 -2.538 1.00 0.00 C ATOM 700 CD1 TYR A 45 7.064 18.005 -1.226 1.00 0.00 C ATOM 701 CD2 TYR A 45 6.996 18.844 -3.463 1.00 0.00 C ATOM 702 CE1 TYR A 45 7.842 19.147 -0.820 1.00 0.00 C ATOM 703 CE2 TYR A 45 7.774 19.986 -3.058 1.00 0.00 C ATOM 704 CZ TYR A 45 8.158 20.081 -1.757 1.00 0.00 C ATOM 705 OH TYR A 45 8.893 21.160 -1.374 1.00 0.00 O ATOM 0 H TYR A 45 7.085 15.396 -1.318 1.00 0.00 H new ATOM 0 HA TYR A 45 6.131 14.769 -4.029 1.00 0.00 H new ATOM 0 HB2 TYR A 45 5.197 16.949 -3.809 1.00 0.00 H new ATOM 0 HB3 TYR A 45 5.168 16.380 -2.152 1.00 0.00 H new ATOM 0 HD1 TYR A 45 6.799 17.248 -0.503 1.00 0.00 H new ATOM 0 HD2 TYR A 45 6.678 18.744 -4.490 1.00 0.00 H new ATOM 0 HE1 TYR A 45 8.167 19.259 0.204 1.00 0.00 H new ATOM 0 HE2 TYR A 45 8.046 20.750 -3.771 1.00 0.00 H new ATOM 0 HH TYR A 45 9.045 21.744 -2.147 1.00 0.00 H new ATOM 715 N ASN A 46 7.749 16.131 -5.417 1.00 0.00 N ATOM 716 CA ASN A 46 8.846 16.588 -6.251 1.00 0.00 C ATOM 717 C ASN A 46 8.285 17.157 -7.557 1.00 0.00 C ATOM 718 O ASN A 46 7.868 16.405 -8.437 1.00 0.00 O ATOM 719 CB ASN A 46 9.789 15.435 -6.603 1.00 0.00 C ATOM 720 CG ASN A 46 10.542 14.947 -5.366 1.00 0.00 C ATOM 721 OD1 ASN A 46 11.182 15.706 -4.656 1.00 0.00 O ATOM 722 ND2 ASN A 46 10.434 13.639 -5.148 1.00 0.00 N ATOM 0 H ASN A 46 6.869 15.985 -5.912 1.00 0.00 H new ATOM 0 HA ASN A 46 9.398 17.347 -5.697 1.00 0.00 H new ATOM 0 HB2 ASN A 46 9.218 14.612 -7.034 1.00 0.00 H new ATOM 0 HB3 ASN A 46 10.501 15.761 -7.361 1.00 0.00 H new ATOM 0 HD21 ASN A 46 10.903 13.215 -4.347 1.00 0.00 H new ATOM 0 HD22 ASN A 46 9.882 13.060 -5.781 1.00 0.00 H new ATOM 729 N ARG A 47 8.295 18.479 -7.642 1.00 0.00 N ATOM 730 CA ARG A 47 7.794 19.156 -8.824 1.00 0.00 C ATOM 731 C ARG A 47 8.796 19.033 -9.973 1.00 0.00 C ATOM 732 O ARG A 47 8.409 19.003 -11.141 1.00 0.00 O ATOM 733 CB ARG A 47 7.533 20.638 -8.543 1.00 0.00 C ATOM 734 CG ARG A 47 6.323 21.141 -9.332 1.00 0.00 C ATOM 735 CD ARG A 47 5.249 21.700 -8.395 1.00 0.00 C ATOM 736 NE ARG A 47 4.188 22.366 -9.181 1.00 0.00 N ATOM 737 CZ ARG A 47 2.943 22.578 -8.733 1.00 0.00 C ATOM 738 NH1 ARG A 47 2.596 22.177 -7.503 1.00 0.00 N ATOM 739 NH2 ARG A 47 2.044 23.190 -9.517 1.00 0.00 N ATOM 0 H ARG A 47 8.643 19.099 -6.911 1.00 0.00 H new ATOM 0 HA ARG A 47 6.855 18.679 -9.103 1.00 0.00 H new ATOM 0 HB2 ARG A 47 7.363 20.785 -7.476 1.00 0.00 H new ATOM 0 HB3 ARG A 47 8.414 21.223 -8.809 1.00 0.00 H new ATOM 0 HG2 ARG A 47 6.638 21.915 -10.033 1.00 0.00 H new ATOM 0 HG3 ARG A 47 5.906 20.326 -9.923 1.00 0.00 H new ATOM 0 HD2 ARG A 47 4.820 20.895 -7.799 1.00 0.00 H new ATOM 0 HD3 ARG A 47 5.696 22.409 -7.698 1.00 0.00 H new ATOM 0 HE ARG A 47 4.418 22.684 -10.123 1.00 0.00 H new ATOM 0 HH11 ARG A 47 3.280 21.710 -6.907 1.00 0.00 H new ATOM 0 HH12 ARG A 47 1.648 22.339 -7.162 1.00 0.00 H new ATOM 0 HH21 ARG A 47 2.308 23.494 -10.454 1.00 0.00 H new ATOM 0 HH22 ARG A 47 1.096 23.351 -9.176 1.00 0.00 H new ATOM 753 N GLY A 48 10.067 18.964 -9.603 1.00 0.00 N ATOM 754 CA GLY A 48 11.128 18.844 -10.588 1.00 0.00 C ATOM 755 C GLY A 48 10.672 18.011 -11.787 1.00 0.00 C ATOM 756 O GLY A 48 11.040 18.301 -12.925 1.00 0.00 O ATOM 0 H GLY A 48 10.385 18.989 -8.634 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.431 19.836 -10.924 1.00 0.00 H new ATOM 0 HA3 GLY A 48 12.003 18.381 -10.131 1.00 0.00 H new ATOM 760 N ASP A 49 9.877 16.993 -11.492 1.00 0.00 N ATOM 761 CA ASP A 49 9.367 16.116 -12.532 1.00 0.00 C ATOM 762 C ASP A 49 7.919 15.740 -12.211 1.00 0.00 C ATOM 763 O ASP A 49 7.475 14.637 -12.529 1.00 0.00 O ATOM 764 CB ASP A 49 10.184 14.824 -12.613 1.00 0.00 C ATOM 765 CG ASP A 49 10.629 14.429 -14.023 1.00 0.00 C ATOM 766 OD1 ASP A 49 10.827 15.358 -14.837 1.00 0.00 O ATOM 767 OD2 ASP A 49 10.762 13.208 -14.255 1.00 0.00 O ATOM 0 H ASP A 49 9.574 16.756 -10.547 1.00 0.00 H new ATOM 0 HA ASP A 49 9.434 16.645 -13.482 1.00 0.00 H new ATOM 0 HB2 ASP A 49 11.069 14.931 -11.985 1.00 0.00 H new ATOM 0 HB3 ASP A 49 9.592 14.010 -12.193 1.00 0.00 H new ATOM 772 N GLN A 50 7.223 16.677 -11.584 1.00 0.00 N ATOM 773 CA GLN A 50 5.834 16.458 -11.217 1.00 0.00 C ATOM 774 C GLN A 50 5.616 14.998 -10.815 1.00 0.00 C ATOM 775 O GLN A 50 4.840 14.285 -11.449 1.00 0.00 O ATOM 776 CB GLN A 50 4.895 16.859 -12.357 1.00 0.00 C ATOM 777 CG GLN A 50 3.512 17.232 -11.821 1.00 0.00 C ATOM 778 CD GLN A 50 3.590 18.455 -10.905 1.00 0.00 C ATOM 779 OE1 GLN A 50 3.658 19.590 -11.346 1.00 0.00 O ATOM 780 NE2 GLN A 50 3.575 18.161 -9.608 1.00 0.00 N ATOM 0 H GLN A 50 7.595 17.590 -11.321 1.00 0.00 H new ATOM 0 HA GLN A 50 5.601 17.090 -10.360 1.00 0.00 H new ATOM 0 HB2 GLN A 50 5.318 17.703 -12.902 1.00 0.00 H new ATOM 0 HB3 GLN A 50 4.805 16.036 -13.065 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.839 17.439 -12.653 1.00 0.00 H new ATOM 0 HG3 GLN A 50 3.091 16.389 -11.273 1.00 0.00 H new ATOM 0 HE21 GLN A 50 3.517 17.188 -9.306 1.00 0.00 H new ATOM 0 HE22 GLN A 50 3.622 18.908 -8.915 1.00 0.00 H new ATOM 789 N SER A 51 6.313 14.596 -9.762 1.00 0.00 N ATOM 790 CA SER A 51 6.206 13.234 -9.268 1.00 0.00 C ATOM 791 C SER A 51 6.228 13.230 -7.738 1.00 0.00 C ATOM 792 O SER A 51 7.251 13.540 -7.128 1.00 0.00 O ATOM 793 CB SER A 51 7.333 12.358 -9.818 1.00 0.00 C ATOM 794 OG SER A 51 8.597 12.698 -9.255 1.00 0.00 O ATOM 0 H SER A 51 6.954 15.190 -9.237 1.00 0.00 H new ATOM 0 HA SER A 51 5.259 12.818 -9.613 1.00 0.00 H new ATOM 0 HB2 SER A 51 7.113 11.311 -9.609 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.379 12.464 -10.902 1.00 0.00 H new ATOM 0 HG SER A 51 8.461 13.198 -8.423 1.00 0.00 H new ATOM 800 N THR A 52 5.090 12.874 -7.163 1.00 0.00 N ATOM 801 CA THR A 52 4.966 12.825 -5.716 1.00 0.00 C ATOM 802 C THR A 52 4.877 11.374 -5.237 1.00 0.00 C ATOM 803 O THR A 52 4.076 10.595 -5.752 1.00 0.00 O ATOM 804 CB THR A 52 3.756 13.672 -5.315 1.00 0.00 C ATOM 805 OG1 THR A 52 4.043 14.961 -5.851 1.00 0.00 O ATOM 806 CG2 THR A 52 3.679 13.905 -3.805 1.00 0.00 C ATOM 0 H THR A 52 4.245 12.616 -7.673 1.00 0.00 H new ATOM 0 HA THR A 52 5.848 13.242 -5.230 1.00 0.00 H new ATOM 0 HB THR A 52 2.842 13.184 -5.654 1.00 0.00 H new ATOM 0 HG1 THR A 52 3.309 15.574 -5.639 1.00 0.00 H new ATOM 0 HG21 THR A 52 2.803 14.511 -3.575 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.602 12.946 -3.292 1.00 0.00 H new ATOM 0 HG23 THR A 52 4.577 14.424 -3.471 1.00 0.00 H new ATOM 814 N ASP A 53 5.710 11.055 -4.258 1.00 0.00 N ATOM 815 CA ASP A 53 5.735 9.713 -3.704 1.00 0.00 C ATOM 816 C ASP A 53 5.240 9.753 -2.257 1.00 0.00 C ATOM 817 O ASP A 53 5.895 10.325 -1.388 1.00 0.00 O ATOM 818 CB ASP A 53 7.155 9.144 -3.701 1.00 0.00 C ATOM 819 CG ASP A 53 7.954 9.394 -4.982 1.00 0.00 C ATOM 820 OD1 ASP A 53 7.450 10.170 -5.822 1.00 0.00 O ATOM 821 OD2 ASP A 53 9.050 8.804 -5.093 1.00 0.00 O ATOM 0 H ASP A 53 6.373 11.704 -3.834 1.00 0.00 H new ATOM 0 HA ASP A 53 5.095 9.083 -4.321 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.701 9.573 -2.861 1.00 0.00 H new ATOM 0 HB3 ASP A 53 7.099 8.069 -3.529 1.00 0.00 H new ATOM 826 N TYR A 54 4.085 9.138 -2.043 1.00 0.00 N ATOM 827 CA TYR A 54 3.495 9.096 -0.716 1.00 0.00 C ATOM 828 C TYR A 54 2.613 7.857 -0.547 1.00 0.00 C ATOM 829 O TYR A 54 2.323 7.160 -1.518 1.00 0.00 O ATOM 830 CB TYR A 54 2.620 10.347 -0.604 1.00 0.00 C ATOM 831 CG TYR A 54 1.692 10.566 -1.801 1.00 0.00 C ATOM 832 CD1 TYR A 54 0.773 9.597 -2.148 1.00 0.00 C ATOM 833 CD2 TYR A 54 1.773 11.733 -2.532 1.00 0.00 C ATOM 834 CE1 TYR A 54 -0.101 9.803 -3.274 1.00 0.00 C ATOM 835 CE2 TYR A 54 0.899 11.940 -3.658 1.00 0.00 C ATOM 836 CZ TYR A 54 0.005 10.964 -3.974 1.00 0.00 C ATOM 837 OH TYR A 54 -0.820 11.159 -5.037 1.00 0.00 O ATOM 0 H TYR A 54 3.543 8.665 -2.766 1.00 0.00 H new ATOM 0 HA TYR A 54 4.272 9.058 0.048 1.00 0.00 H new ATOM 0 HB2 TYR A 54 2.018 10.277 0.302 1.00 0.00 H new ATOM 0 HB3 TYR A 54 3.264 11.219 -0.492 1.00 0.00 H new ATOM 0 HD1 TYR A 54 0.709 8.684 -1.575 1.00 0.00 H new ATOM 0 HD2 TYR A 54 2.492 12.492 -2.260 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -0.824 9.052 -3.556 1.00 0.00 H new ATOM 0 HE2 TYR A 54 0.952 12.849 -4.238 1.00 0.00 H new ATOM 0 HH TYR A 54 -0.950 10.311 -5.510 1.00 0.00 H new ATOM 847 N GLY A 55 2.214 7.619 0.693 1.00 0.00 N ATOM 848 CA GLY A 55 1.373 6.475 1.003 1.00 0.00 C ATOM 849 C GLY A 55 2.121 5.464 1.874 1.00 0.00 C ATOM 850 O GLY A 55 3.347 5.376 1.816 1.00 0.00 O ATOM 0 H GLY A 55 2.457 8.199 1.496 1.00 0.00 H new ATOM 0 HA2 GLY A 55 0.473 6.810 1.519 1.00 0.00 H new ATOM 0 HA3 GLY A 55 1.050 5.996 0.079 1.00 0.00 H new ATOM 854 N ILE A 56 1.352 4.726 2.661 1.00 0.00 N ATOM 855 CA ILE A 56 1.926 3.725 3.544 1.00 0.00 C ATOM 856 C ILE A 56 2.800 2.772 2.726 1.00 0.00 C ATOM 857 O ILE A 56 3.809 2.270 3.220 1.00 0.00 O ATOM 858 CB ILE A 56 0.827 3.019 4.341 1.00 0.00 C ATOM 859 CG1 ILE A 56 1.416 1.942 5.253 1.00 0.00 C ATOM 860 CG2 ILE A 56 -0.249 2.456 3.410 1.00 0.00 C ATOM 861 CD1 ILE A 56 0.336 1.324 6.142 1.00 0.00 C ATOM 0 H ILE A 56 0.336 4.801 2.706 1.00 0.00 H new ATOM 0 HA ILE A 56 2.572 4.196 4.285 1.00 0.00 H new ATOM 0 HB ILE A 56 0.344 3.755 4.984 1.00 0.00 H new ATOM 0 HG12 ILE A 56 1.883 1.164 4.648 1.00 0.00 H new ATOM 0 HG13 ILE A 56 2.199 2.376 5.875 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.018 1.959 4.001 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.698 3.269 2.840 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.202 1.738 2.725 1.00 0.00 H new ATOM 0 HD11 ILE A 56 0.782 0.561 6.780 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.112 2.100 6.763 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -0.433 0.870 5.518 1.00 0.00 H new ATOM 873 N PHE A 57 2.382 2.551 1.489 1.00 0.00 N ATOM 874 CA PHE A 57 3.115 1.668 0.597 1.00 0.00 C ATOM 875 C PHE A 57 4.062 2.461 -0.304 1.00 0.00 C ATOM 876 O PHE A 57 4.630 1.914 -1.248 1.00 0.00 O ATOM 877 CB PHE A 57 2.079 0.954 -0.275 1.00 0.00 C ATOM 878 CG PHE A 57 1.436 -0.263 0.393 1.00 0.00 C ATOM 879 CD1 PHE A 57 0.973 -0.172 1.668 1.00 0.00 C ATOM 880 CD2 PHE A 57 1.326 -1.434 -0.289 1.00 0.00 C ATOM 881 CE1 PHE A 57 0.376 -1.303 2.289 1.00 0.00 C ATOM 882 CE2 PHE A 57 0.729 -2.563 0.331 1.00 0.00 C ATOM 883 CZ PHE A 57 0.267 -2.473 1.607 1.00 0.00 C ATOM 0 H PHE A 57 1.545 2.968 1.083 1.00 0.00 H new ATOM 0 HA PHE A 57 3.713 0.966 1.178 1.00 0.00 H new ATOM 0 HB2 PHE A 57 1.296 1.663 -0.546 1.00 0.00 H new ATOM 0 HB3 PHE A 57 2.556 0.637 -1.202 1.00 0.00 H new ATOM 0 HD1 PHE A 57 1.059 0.759 2.209 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.693 -1.505 -1.302 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.009 -1.232 3.302 1.00 0.00 H new ATOM 0 HE2 PHE A 57 0.642 -3.493 -0.211 1.00 0.00 H new ATOM 0 HZ PHE A 57 -0.187 -3.332 2.078 1.00 0.00 H new ATOM 893 N GLN A 58 4.206 3.738 0.020 1.00 0.00 N ATOM 894 CA GLN A 58 5.075 4.612 -0.749 1.00 0.00 C ATOM 895 C GLN A 58 4.816 4.436 -2.247 1.00 0.00 C ATOM 896 O GLN A 58 5.508 3.667 -2.913 1.00 0.00 O ATOM 897 CB GLN A 58 6.546 4.355 -0.413 1.00 0.00 C ATOM 898 CG GLN A 58 7.424 5.526 -0.862 1.00 0.00 C ATOM 899 CD GLN A 58 7.837 6.389 0.332 1.00 0.00 C ATOM 900 OE1 GLN A 58 8.087 5.906 1.424 1.00 0.00 O ATOM 901 NE2 GLN A 58 7.897 7.690 0.063 1.00 0.00 N ATOM 0 H GLN A 58 3.735 4.188 0.805 1.00 0.00 H new ATOM 0 HA GLN A 58 4.849 5.644 -0.481 1.00 0.00 H new ATOM 0 HB2 GLN A 58 6.656 4.204 0.661 1.00 0.00 H new ATOM 0 HB3 GLN A 58 6.879 3.438 -0.900 1.00 0.00 H new ATOM 0 HG2 GLN A 58 8.313 5.147 -1.366 1.00 0.00 H new ATOM 0 HG3 GLN A 58 6.882 6.135 -1.586 1.00 0.00 H new ATOM 0 HE21 GLN A 58 7.675 8.028 -0.873 1.00 0.00 H new ATOM 0 HE22 GLN A 58 8.165 8.350 0.793 1.00 0.00 H new ATOM 910 N ILE A 59 3.819 5.161 -2.731 1.00 0.00 N ATOM 911 CA ILE A 59 3.460 5.095 -4.137 1.00 0.00 C ATOM 912 C ILE A 59 3.750 6.444 -4.798 1.00 0.00 C ATOM 913 O ILE A 59 3.639 7.489 -4.157 1.00 0.00 O ATOM 914 CB ILE A 59 2.012 4.628 -4.299 1.00 0.00 C ATOM 915 CG1 ILE A 59 1.863 3.157 -3.906 1.00 0.00 C ATOM 916 CG2 ILE A 59 1.505 4.897 -5.718 1.00 0.00 C ATOM 917 CD1 ILE A 59 0.410 2.829 -3.554 1.00 0.00 C ATOM 0 H ILE A 59 3.248 5.797 -2.174 1.00 0.00 H new ATOM 0 HA ILE A 59 4.069 4.352 -4.651 1.00 0.00 H new ATOM 0 HB ILE A 59 1.388 5.207 -3.619 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.194 2.522 -4.727 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.506 2.937 -3.054 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.474 4.556 -5.807 1.00 0.00 H new ATOM 0 HG22 ILE A 59 1.553 5.966 -5.925 1.00 0.00 H new ATOM 0 HG23 ILE A 59 2.127 4.361 -6.434 1.00 0.00 H new ATOM 0 HD11 ILE A 59 0.331 1.777 -3.278 1.00 0.00 H new ATOM 0 HD12 ILE A 59 0.090 3.449 -2.717 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -0.227 3.027 -4.416 1.00 0.00 H new ATOM 929 N ASN A 60 4.114 6.379 -6.070 1.00 0.00 N ATOM 930 CA ASN A 60 4.420 7.583 -6.824 1.00 0.00 C ATOM 931 C ASN A 60 3.151 8.082 -7.516 1.00 0.00 C ATOM 932 O ASN A 60 2.372 7.288 -8.040 1.00 0.00 O ATOM 933 CB ASN A 60 5.470 7.306 -7.902 1.00 0.00 C ATOM 934 CG ASN A 60 6.842 7.835 -7.480 1.00 0.00 C ATOM 935 OD1 ASN A 60 7.443 7.381 -6.520 1.00 0.00 O ATOM 936 ND2 ASN A 60 7.303 8.816 -8.250 1.00 0.00 N ATOM 0 H ASN A 60 4.204 5.511 -6.598 1.00 0.00 H new ATOM 0 HA ASN A 60 4.806 8.328 -6.128 1.00 0.00 H new ATOM 0 HB2 ASN A 60 5.531 6.234 -8.088 1.00 0.00 H new ATOM 0 HB3 ASN A 60 5.168 7.775 -8.838 1.00 0.00 H new ATOM 0 HD21 ASN A 60 8.211 9.236 -8.052 1.00 0.00 H new ATOM 0 HD22 ASN A 60 6.748 9.149 -9.039 1.00 0.00 H new ATOM 943 N SER A 61 2.981 9.396 -7.496 1.00 0.00 N ATOM 944 CA SER A 61 1.820 10.011 -8.115 1.00 0.00 C ATOM 945 C SER A 61 2.140 10.397 -9.561 1.00 0.00 C ATOM 946 O SER A 61 1.304 10.977 -10.252 1.00 0.00 O ATOM 947 CB SER A 61 1.361 11.240 -7.328 1.00 0.00 C ATOM 948 OG SER A 61 0.601 12.137 -8.133 1.00 0.00 O ATOM 0 H SER A 61 3.629 10.052 -7.060 1.00 0.00 H new ATOM 0 HA SER A 61 1.007 9.285 -8.110 1.00 0.00 H new ATOM 0 HB2 SER A 61 0.761 10.921 -6.476 1.00 0.00 H new ATOM 0 HB3 SER A 61 2.231 11.760 -6.928 1.00 0.00 H new ATOM 0 HG SER A 61 -0.348 12.064 -7.898 1.00 0.00 H new ATOM 954 N ARG A 62 3.352 10.058 -9.976 1.00 0.00 N ATOM 955 CA ARG A 62 3.793 10.361 -11.326 1.00 0.00 C ATOM 956 C ARG A 62 3.392 9.235 -12.281 1.00 0.00 C ATOM 957 O ARG A 62 3.415 9.410 -13.498 1.00 0.00 O ATOM 958 CB ARG A 62 5.310 10.551 -11.381 1.00 0.00 C ATOM 959 CG ARG A 62 5.851 10.239 -12.778 1.00 0.00 C ATOM 960 CD ARG A 62 7.289 10.738 -12.932 1.00 0.00 C ATOM 961 NE ARG A 62 8.064 9.799 -13.773 1.00 0.00 N ATOM 962 CZ ARG A 62 7.896 9.660 -15.095 1.00 0.00 C ATOM 963 NH1 ARG A 62 6.982 10.401 -15.736 1.00 0.00 N ATOM 964 NH2 ARG A 62 8.644 8.783 -15.778 1.00 0.00 N ATOM 0 H ARG A 62 4.042 9.576 -9.400 1.00 0.00 H new ATOM 0 HA ARG A 62 3.311 11.290 -11.631 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.562 11.576 -11.110 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.788 9.901 -10.648 1.00 0.00 H new ATOM 0 HG2 ARG A 62 5.814 9.164 -12.955 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.217 10.708 -13.531 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.292 11.730 -13.383 1.00 0.00 H new ATOM 0 HD3 ARG A 62 7.757 10.832 -11.952 1.00 0.00 H new ATOM 0 HE ARG A 62 8.771 9.221 -13.318 1.00 0.00 H new ATOM 0 HH11 ARG A 62 6.414 11.071 -15.218 1.00 0.00 H new ATOM 0 HH12 ARG A 62 6.854 10.295 -16.742 1.00 0.00 H new ATOM 0 HH21 ARG A 62 9.342 8.220 -15.292 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.515 8.678 -16.784 1.00 0.00 H new ATOM 978 N TYR A 63 3.033 8.103 -11.692 1.00 0.00 N ATOM 979 CA TYR A 63 2.627 6.948 -12.475 1.00 0.00 C ATOM 980 C TYR A 63 1.214 6.499 -12.098 1.00 0.00 C ATOM 981 O TYR A 63 0.469 6.008 -12.944 1.00 0.00 O ATOM 982 CB TYR A 63 3.615 5.833 -12.126 1.00 0.00 C ATOM 983 CG TYR A 63 4.753 5.671 -13.134 1.00 0.00 C ATOM 984 CD1 TYR A 63 5.865 6.485 -13.057 1.00 0.00 C ATOM 985 CD2 TYR A 63 4.669 4.710 -14.121 1.00 0.00 C ATOM 986 CE1 TYR A 63 6.936 6.333 -14.007 1.00 0.00 C ATOM 987 CE2 TYR A 63 5.741 4.557 -15.071 1.00 0.00 C ATOM 988 CZ TYR A 63 6.822 5.376 -14.966 1.00 0.00 C ATOM 989 OH TYR A 63 7.834 5.232 -15.863 1.00 0.00 O ATOM 0 H TYR A 63 3.015 7.961 -10.682 1.00 0.00 H new ATOM 0 HA TYR A 63 2.625 7.187 -13.539 1.00 0.00 H new ATOM 0 HB2 TYR A 63 4.040 6.034 -11.143 1.00 0.00 H new ATOM 0 HB3 TYR A 63 3.072 4.891 -12.052 1.00 0.00 H new ATOM 0 HD1 TYR A 63 5.932 7.236 -12.284 1.00 0.00 H new ATOM 0 HD2 TYR A 63 3.799 4.073 -14.181 1.00 0.00 H new ATOM 0 HE1 TYR A 63 7.810 6.965 -13.959 1.00 0.00 H new ATOM 0 HE2 TYR A 63 5.688 3.809 -15.849 1.00 0.00 H new ATOM 0 HH TYR A 63 7.616 4.510 -16.489 1.00 0.00 H new ATOM 999 N TRP A 64 0.889 6.683 -10.827 1.00 0.00 N ATOM 1000 CA TRP A 64 -0.422 6.303 -10.327 1.00 0.00 C ATOM 1001 C TRP A 64 -1.100 7.559 -9.778 1.00 0.00 C ATOM 1002 O TRP A 64 -0.454 8.589 -9.596 1.00 0.00 O ATOM 1003 CB TRP A 64 -0.309 5.182 -9.291 1.00 0.00 C ATOM 1004 CG TRP A 64 0.169 3.848 -9.867 1.00 0.00 C ATOM 1005 CD1 TRP A 64 -0.574 2.847 -10.357 1.00 0.00 C ATOM 1006 CD2 TRP A 64 1.538 3.408 -9.994 1.00 0.00 C ATOM 1007 NE1 TRP A 64 0.212 1.798 -10.788 1.00 0.00 N ATOM 1008 CE2 TRP A 64 1.537 2.150 -10.561 1.00 0.00 C ATOM 1009 CE3 TRP A 64 2.737 4.052 -9.642 1.00 0.00 C ATOM 1010 CZ2 TRP A 64 2.707 1.428 -10.825 1.00 0.00 C ATOM 1011 CZ3 TRP A 64 3.897 3.317 -9.912 1.00 0.00 C ATOM 1012 CH2 TRP A 64 3.913 2.049 -10.483 1.00 0.00 C ATOM 0 H TRP A 64 1.510 7.090 -10.128 1.00 0.00 H new ATOM 0 HA TRP A 64 -1.039 5.897 -11.129 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.380 5.495 -8.506 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -1.282 5.036 -8.822 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -1.653 2.859 -10.408 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -0.119 0.925 -11.198 1.00 0.00 H new ATOM 0 HE3 TRP A 64 2.761 5.036 -9.198 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 2.680 0.444 -11.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 4.846 3.766 -9.659 1.00 0.00 H new ATOM 0 HH2 TRP A 64 4.852 1.546 -10.662 1.00 0.00 H new ATOM 1023 N CYS A 65 -2.396 7.432 -9.530 1.00 0.00 N ATOM 1024 CA CYS A 65 -3.170 8.545 -9.005 1.00 0.00 C ATOM 1025 C CYS A 65 -3.080 9.704 -9.998 1.00 0.00 C ATOM 1026 O CYS A 65 -2.136 9.782 -10.783 1.00 0.00 O ATOM 1027 CB CYS A 65 -2.697 8.953 -7.608 1.00 0.00 C ATOM 1028 SG CYS A 65 -1.587 10.406 -7.568 1.00 0.00 S ATOM 0 H CYS A 65 -2.929 6.576 -9.683 1.00 0.00 H new ATOM 0 HA CYS A 65 -4.212 8.245 -8.892 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -3.571 9.164 -6.991 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -2.182 8.107 -7.153 1.00 0.00 H new ATOM 1033 N ASN A 66 -4.076 10.575 -9.934 1.00 0.00 N ATOM 1034 CA ASN A 66 -4.121 11.726 -10.818 1.00 0.00 C ATOM 1035 C ASN A 66 -4.690 12.927 -10.059 1.00 0.00 C ATOM 1036 O ASN A 66 -4.754 12.914 -8.830 1.00 0.00 O ATOM 1037 CB ASN A 66 -5.026 11.460 -12.024 1.00 0.00 C ATOM 1038 CG ASN A 66 -4.345 11.891 -13.325 1.00 0.00 C ATOM 1039 OD1 ASN A 66 -3.194 12.295 -13.350 1.00 0.00 O ATOM 1040 ND2 ASN A 66 -5.118 11.782 -14.402 1.00 0.00 N ATOM 0 H ASN A 66 -4.858 10.506 -9.283 1.00 0.00 H new ATOM 0 HA ASN A 66 -3.106 11.924 -11.163 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -5.272 10.399 -12.072 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -5.965 12.000 -11.905 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -4.755 12.044 -15.319 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -6.073 11.436 -14.311 1.00 0.00 H new ATOM 1047 N ASP A 67 -5.087 13.935 -10.821 1.00 0.00 N ATOM 1048 CA ASP A 67 -5.647 15.141 -10.234 1.00 0.00 C ATOM 1049 C ASP A 67 -6.747 15.684 -11.149 1.00 0.00 C ATOM 1050 O ASP A 67 -7.877 15.893 -10.712 1.00 0.00 O ATOM 1051 CB ASP A 67 -4.581 16.227 -10.080 1.00 0.00 C ATOM 1052 CG ASP A 67 -5.098 17.575 -9.577 1.00 0.00 C ATOM 1053 OD1 ASP A 67 -6.265 17.890 -9.895 1.00 0.00 O ATOM 1054 OD2 ASP A 67 -4.315 18.261 -8.885 1.00 0.00 O ATOM 0 H ASP A 67 -5.032 13.942 -11.840 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.043 14.885 -9.251 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -3.816 15.869 -9.391 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -4.096 16.378 -11.044 1.00 0.00 H new ATOM 1059 N GLY A 68 -6.377 15.898 -12.404 1.00 0.00 N ATOM 1060 CA GLY A 68 -7.317 16.412 -13.385 1.00 0.00 C ATOM 1061 C GLY A 68 -6.931 17.827 -13.823 1.00 0.00 C ATOM 1062 O GLY A 68 -7.608 18.428 -14.655 1.00 0.00 O ATOM 0 H GLY A 68 -5.438 15.724 -12.763 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -7.340 15.752 -14.252 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -8.322 16.419 -12.963 1.00 0.00 H new ATOM 1066 N LYS A 69 -5.845 18.316 -13.244 1.00 0.00 N ATOM 1067 CA LYS A 69 -5.361 19.648 -13.565 1.00 0.00 C ATOM 1068 C LYS A 69 -3.985 19.540 -14.225 1.00 0.00 C ATOM 1069 O LYS A 69 -3.433 20.540 -14.685 1.00 0.00 O ATOM 1070 CB LYS A 69 -5.379 20.539 -12.321 1.00 0.00 C ATOM 1071 CG LYS A 69 -6.788 21.065 -12.043 1.00 0.00 C ATOM 1072 CD LYS A 69 -7.054 21.152 -10.539 1.00 0.00 C ATOM 1073 CE LYS A 69 -8.503 21.559 -10.261 1.00 0.00 C ATOM 1074 NZ LYS A 69 -9.432 20.489 -10.686 1.00 0.00 N ATOM 0 H LYS A 69 -5.286 17.814 -12.554 1.00 0.00 H new ATOM 0 HA LYS A 69 -6.023 20.131 -14.284 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -5.021 19.974 -11.460 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.695 21.376 -12.459 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -6.908 22.050 -12.495 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -7.523 20.409 -12.509 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -6.847 20.188 -10.073 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -6.376 21.876 -10.087 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -8.633 21.760 -9.198 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -8.736 22.483 -10.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -10.361 20.639 -10.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -9.535 20.509 -11.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -9.054 19.565 -10.394 1.00 0.00 H new ATOM 1088 N THR A 70 -3.471 18.320 -14.251 1.00 0.00 N ATOM 1089 CA THR A 70 -2.169 18.070 -14.848 1.00 0.00 C ATOM 1090 C THR A 70 -2.278 16.995 -15.932 1.00 0.00 C ATOM 1091 O THR A 70 -2.227 15.802 -15.637 1.00 0.00 O ATOM 1092 CB THR A 70 -1.197 17.703 -13.725 1.00 0.00 C ATOM 1093 OG1 THR A 70 -0.776 18.961 -13.206 1.00 0.00 O ATOM 1094 CG2 THR A 70 0.092 17.067 -14.251 1.00 0.00 C ATOM 0 H THR A 70 -3.931 17.494 -13.869 1.00 0.00 H new ATOM 0 HA THR A 70 -1.787 18.958 -15.351 1.00 0.00 H new ATOM 0 HB THR A 70 -1.684 17.016 -13.033 1.00 0.00 H new ATOM 0 HG1 THR A 70 -0.144 18.817 -12.471 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.747 16.826 -13.414 1.00 0.00 H new ATOM 0 HG22 THR A 70 -0.149 16.155 -14.798 1.00 0.00 H new ATOM 0 HG23 THR A 70 0.597 17.766 -14.917 1.00 0.00 H new ATOM 1102 N PRO A 71 -2.429 17.470 -17.199 1.00 0.00 N ATOM 1103 CA PRO A 71 -2.545 16.563 -18.328 1.00 0.00 C ATOM 1104 C PRO A 71 -1.188 15.952 -18.683 1.00 0.00 C ATOM 1105 O PRO A 71 -0.721 16.080 -19.813 1.00 0.00 O ATOM 1106 CB PRO A 71 -3.127 17.407 -19.450 1.00 0.00 C ATOM 1107 CG PRO A 71 -2.883 18.854 -19.055 1.00 0.00 C ATOM 1108 CD PRO A 71 -2.494 18.876 -17.586 1.00 0.00 C ATOM 0 HA PRO A 71 -3.186 15.707 -18.116 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -2.647 17.176 -20.401 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -4.192 17.211 -19.574 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -2.092 19.288 -19.666 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -3.779 19.452 -19.222 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -1.535 19.372 -17.438 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -3.229 19.417 -16.990 1.00 0.00 H new ATOM 1116 N ARG A 72 -0.593 15.300 -17.694 1.00 0.00 N ATOM 1117 CA ARG A 72 0.702 14.669 -17.887 1.00 0.00 C ATOM 1118 C ARG A 72 0.753 13.329 -17.151 1.00 0.00 C ATOM 1119 O ARG A 72 0.850 12.275 -17.778 1.00 0.00 O ATOM 1120 CB ARG A 72 1.833 15.565 -17.380 1.00 0.00 C ATOM 1121 CG ARG A 72 3.193 15.063 -17.870 1.00 0.00 C ATOM 1122 CD ARG A 72 4.219 15.065 -16.735 1.00 0.00 C ATOM 1123 NE ARG A 72 5.386 15.895 -17.112 1.00 0.00 N ATOM 1124 CZ ARG A 72 6.374 15.481 -17.916 1.00 0.00 C ATOM 1125 NH1 ARG A 72 6.343 14.246 -18.436 1.00 0.00 N ATOM 1126 NH2 ARG A 72 7.393 16.302 -18.203 1.00 0.00 N ATOM 0 H ARG A 72 -0.984 15.195 -16.758 1.00 0.00 H new ATOM 0 HA ARG A 72 0.836 14.506 -18.956 1.00 0.00 H new ATOM 0 HB2 ARG A 72 1.674 16.587 -17.723 1.00 0.00 H new ATOM 0 HB3 ARG A 72 1.822 15.589 -16.290 1.00 0.00 H new ATOM 0 HG2 ARG A 72 3.090 14.054 -18.270 1.00 0.00 H new ATOM 0 HG3 ARG A 72 3.546 15.695 -18.685 1.00 0.00 H new ATOM 0 HD2 ARG A 72 3.765 15.453 -15.823 1.00 0.00 H new ATOM 0 HD3 ARG A 72 4.540 14.046 -16.522 1.00 0.00 H new ATOM 0 HE ARG A 72 5.441 16.841 -16.736 1.00 0.00 H new ATOM 0 HH11 ARG A 72 5.567 13.621 -18.220 1.00 0.00 H new ATOM 0 HH12 ARG A 72 7.096 13.931 -19.048 1.00 0.00 H new ATOM 0 HH21 ARG A 72 7.417 17.243 -17.809 1.00 0.00 H new ATOM 0 HH22 ARG A 72 8.145 15.986 -18.815 1.00 0.00 H new ATOM 1140 N ALA A 73 0.687 13.413 -15.830 1.00 0.00 N ATOM 1141 CA ALA A 73 0.725 12.219 -15.003 1.00 0.00 C ATOM 1142 C ALA A 73 -0.112 11.120 -15.660 1.00 0.00 C ATOM 1143 O ALA A 73 -1.224 11.373 -16.119 1.00 0.00 O ATOM 1144 CB ALA A 73 0.236 12.560 -13.593 1.00 0.00 C ATOM 0 H ALA A 73 0.608 14.288 -15.313 1.00 0.00 H new ATOM 0 HA ALA A 73 1.745 11.846 -14.914 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.264 11.665 -12.972 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.881 13.323 -13.159 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -0.786 12.935 -13.643 1.00 0.00 H new ATOM 1150 N VAL A 74 0.456 9.923 -15.684 1.00 0.00 N ATOM 1151 CA VAL A 74 -0.225 8.785 -16.279 1.00 0.00 C ATOM 1152 C VAL A 74 -0.892 7.962 -15.174 1.00 0.00 C ATOM 1153 O VAL A 74 -0.549 6.798 -14.968 1.00 0.00 O ATOM 1154 CB VAL A 74 0.759 7.969 -17.120 1.00 0.00 C ATOM 1155 CG1 VAL A 74 1.887 7.407 -16.253 1.00 0.00 C ATOM 1156 CG2 VAL A 74 0.037 6.850 -17.874 1.00 0.00 C ATOM 0 H VAL A 74 1.379 9.716 -15.302 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.011 9.120 -16.956 1.00 0.00 H new ATOM 0 HB VAL A 74 1.205 8.637 -17.857 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.572 6.831 -16.875 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.428 8.228 -15.782 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.466 6.761 -15.483 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.758 6.285 -18.464 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.449 6.185 -17.160 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.714 7.282 -18.535 1.00 0.00 H new ATOM 1166 N ASN A 75 -1.833 8.598 -14.493 1.00 0.00 N ATOM 1167 CA ASN A 75 -2.552 7.940 -13.415 1.00 0.00 C ATOM 1168 C ASN A 75 -3.038 6.571 -13.894 1.00 0.00 C ATOM 1169 O ASN A 75 -4.107 6.463 -14.493 1.00 0.00 O ATOM 1170 CB ASN A 75 -3.776 8.754 -12.991 1.00 0.00 C ATOM 1171 CG ASN A 75 -4.678 9.053 -14.190 1.00 0.00 C ATOM 1172 OD1 ASN A 75 -4.230 9.215 -15.313 1.00 0.00 O ATOM 1173 ND2 ASN A 75 -5.973 9.116 -13.890 1.00 0.00 N ATOM 0 H ASN A 75 -2.115 9.563 -14.667 1.00 0.00 H new ATOM 0 HA ASN A 75 -1.873 7.842 -12.568 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.339 8.205 -12.236 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -3.454 9.689 -12.531 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -6.657 9.310 -14.621 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -6.281 8.971 -12.929 1.00 0.00 H new ATOM 1180 N ALA A 76 -2.229 5.560 -13.613 1.00 0.00 N ATOM 1181 CA ALA A 76 -2.564 4.202 -14.007 1.00 0.00 C ATOM 1182 C ALA A 76 -3.533 3.603 -12.987 1.00 0.00 C ATOM 1183 O ALA A 76 -4.107 2.540 -13.219 1.00 0.00 O ATOM 1184 CB ALA A 76 -1.281 3.380 -14.145 1.00 0.00 C ATOM 0 H ALA A 76 -1.343 5.654 -13.117 1.00 0.00 H new ATOM 0 HA ALA A 76 -3.062 4.196 -14.977 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -1.532 2.361 -14.441 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -0.640 3.830 -14.903 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.756 3.362 -13.190 1.00 0.00 H new ATOM 1190 N CYS A 77 -3.688 4.311 -11.878 1.00 0.00 N ATOM 1191 CA CYS A 77 -4.578 3.863 -10.820 1.00 0.00 C ATOM 1192 C CYS A 77 -5.971 4.437 -11.090 1.00 0.00 C ATOM 1193 O CYS A 77 -6.975 3.753 -10.898 1.00 0.00 O ATOM 1194 CB CYS A 77 -4.057 4.257 -9.437 1.00 0.00 C ATOM 1195 SG CYS A 77 -4.703 3.244 -8.057 1.00 0.00 S ATOM 0 H CYS A 77 -3.212 5.193 -11.689 1.00 0.00 H new ATOM 0 HA CYS A 77 -4.628 2.774 -10.820 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -2.969 4.189 -9.441 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -4.310 5.301 -9.253 1.00 0.00 H new ATOM 1200 N GLY A 78 -5.986 5.686 -11.532 1.00 0.00 N ATOM 1201 CA GLY A 78 -7.239 6.358 -11.829 1.00 0.00 C ATOM 1202 C GLY A 78 -8.027 6.642 -10.549 1.00 0.00 C ATOM 1203 O GLY A 78 -9.160 6.187 -10.399 1.00 0.00 O ATOM 0 H GLY A 78 -5.151 6.250 -11.691 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -7.039 7.293 -12.352 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -7.837 5.740 -12.499 1.00 0.00 H new ATOM 1207 N ILE A 79 -7.395 7.394 -9.659 1.00 0.00 N ATOM 1208 CA ILE A 79 -8.024 7.745 -8.397 1.00 0.00 C ATOM 1209 C ILE A 79 -7.504 9.108 -7.935 1.00 0.00 C ATOM 1210 O ILE A 79 -6.557 9.643 -8.511 1.00 0.00 O ATOM 1211 CB ILE A 79 -7.821 6.630 -7.369 1.00 0.00 C ATOM 1212 CG1 ILE A 79 -6.564 6.877 -6.532 1.00 0.00 C ATOM 1213 CG2 ILE A 79 -7.797 5.258 -8.047 1.00 0.00 C ATOM 1214 CD1 ILE A 79 -5.299 6.675 -7.368 1.00 0.00 C ATOM 0 H ILE A 79 -6.455 7.769 -9.787 1.00 0.00 H new ATOM 0 HA ILE A 79 -9.103 7.840 -8.522 1.00 0.00 H new ATOM 0 HB ILE A 79 -8.670 6.638 -6.685 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.582 7.891 -6.133 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -6.552 6.199 -5.679 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -7.651 4.483 -7.295 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -8.743 5.090 -8.563 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -6.980 5.222 -8.767 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -4.421 6.857 -6.749 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.272 5.653 -7.745 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -5.302 7.371 -8.207 1.00 0.00 H new ATOM 1226 N ASN A 80 -8.145 9.631 -6.900 1.00 0.00 N ATOM 1227 CA ASN A 80 -7.759 10.920 -6.355 1.00 0.00 C ATOM 1228 C ASN A 80 -6.478 10.760 -5.533 1.00 0.00 C ATOM 1229 O ASN A 80 -6.436 9.969 -4.592 1.00 0.00 O ATOM 1230 CB ASN A 80 -8.847 11.476 -5.432 1.00 0.00 C ATOM 1231 CG ASN A 80 -9.866 12.300 -6.221 1.00 0.00 C ATOM 1232 OD1 ASN A 80 -9.767 13.510 -6.341 1.00 0.00 O ATOM 1233 ND2 ASN A 80 -10.850 11.578 -6.751 1.00 0.00 N ATOM 0 H ASN A 80 -8.929 9.185 -6.425 1.00 0.00 H new ATOM 0 HA ASN A 80 -7.607 11.606 -7.188 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -9.353 10.655 -4.924 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -8.392 12.096 -4.660 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -11.581 12.035 -7.296 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -10.873 10.568 -6.612 1.00 0.00 H new ATOM 1240 N CYS A 81 -5.466 11.524 -5.918 1.00 0.00 N ATOM 1241 CA CYS A 81 -4.189 11.476 -5.227 1.00 0.00 C ATOM 1242 C CYS A 81 -4.442 11.670 -3.732 1.00 0.00 C ATOM 1243 O CYS A 81 -3.785 11.044 -2.900 1.00 0.00 O ATOM 1244 CB CYS A 81 -3.209 12.513 -5.780 1.00 0.00 C ATOM 1245 SG CYS A 81 -2.481 12.093 -7.406 1.00 0.00 S ATOM 0 H CYS A 81 -5.505 12.179 -6.699 1.00 0.00 H new ATOM 0 HA CYS A 81 -3.721 10.505 -5.390 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -3.724 13.470 -5.865 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -2.401 12.649 -5.061 1.00 0.00 H new ATOM 1250 N SER A 82 -5.397 12.538 -3.434 1.00 0.00 N ATOM 1251 CA SER A 82 -5.746 12.822 -2.052 1.00 0.00 C ATOM 1252 C SER A 82 -6.198 11.540 -1.352 1.00 0.00 C ATOM 1253 O SER A 82 -6.074 11.415 -0.134 1.00 0.00 O ATOM 1254 CB SER A 82 -6.842 13.887 -1.968 1.00 0.00 C ATOM 1255 OG SER A 82 -6.662 14.752 -0.850 1.00 0.00 O ATOM 0 H SER A 82 -5.940 13.054 -4.126 1.00 0.00 H new ATOM 0 HA SER A 82 -4.860 13.210 -1.549 1.00 0.00 H new ATOM 0 HB2 SER A 82 -6.846 14.476 -2.885 1.00 0.00 H new ATOM 0 HB3 SER A 82 -7.815 13.401 -1.897 1.00 0.00 H new ATOM 0 HG SER A 82 -7.381 15.418 -0.833 1.00 0.00 H new ATOM 1261 N ALA A 83 -6.713 10.617 -2.151 1.00 0.00 N ATOM 1262 CA ALA A 83 -7.185 9.348 -1.623 1.00 0.00 C ATOM 1263 C ALA A 83 -6.023 8.621 -0.943 1.00 0.00 C ATOM 1264 O ALA A 83 -6.238 7.698 -0.159 1.00 0.00 O ATOM 1265 CB ALA A 83 -7.807 8.525 -2.753 1.00 0.00 C ATOM 0 H ALA A 83 -6.814 10.723 -3.160 1.00 0.00 H new ATOM 0 HA ALA A 83 -7.959 9.508 -0.872 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -8.161 7.573 -2.357 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -8.645 9.073 -3.184 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -7.059 8.342 -3.524 1.00 0.00 H new ATOM 1271 N LEU A 84 -4.817 9.064 -1.268 1.00 0.00 N ATOM 1272 CA LEU A 84 -3.622 8.467 -0.698 1.00 0.00 C ATOM 1273 C LEU A 84 -3.126 9.335 0.461 1.00 0.00 C ATOM 1274 O LEU A 84 -1.987 9.195 0.902 1.00 0.00 O ATOM 1275 CB LEU A 84 -2.570 8.232 -1.785 1.00 0.00 C ATOM 1276 CG LEU A 84 -3.043 7.467 -3.022 1.00 0.00 C ATOM 1277 CD1 LEU A 84 -2.953 8.341 -4.274 1.00 0.00 C ATOM 1278 CD2 LEU A 84 -2.273 6.154 -3.182 1.00 0.00 C ATOM 0 H LEU A 84 -4.642 9.830 -1.919 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.847 7.483 -0.286 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.186 9.200 -2.106 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.735 7.688 -1.343 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.093 7.209 -2.884 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.295 7.773 -5.139 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.580 9.223 -4.148 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.919 8.650 -4.428 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.629 5.629 -4.069 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.209 6.367 -3.288 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.432 5.529 -2.303 1.00 0.00 H new ATOM 1290 N LEU A 85 -4.007 10.211 0.920 1.00 0.00 N ATOM 1291 CA LEU A 85 -3.674 11.101 2.020 1.00 0.00 C ATOM 1292 C LEU A 85 -4.857 11.175 2.987 1.00 0.00 C ATOM 1293 O LEU A 85 -4.978 12.131 3.751 1.00 0.00 O ATOM 1294 CB LEU A 85 -3.227 12.464 1.488 1.00 0.00 C ATOM 1295 CG LEU A 85 -2.286 13.262 2.394 1.00 0.00 C ATOM 1296 CD1 LEU A 85 -1.011 12.471 2.690 1.00 0.00 C ATOM 1297 CD2 LEU A 85 -1.982 14.636 1.794 1.00 0.00 C ATOM 0 H LEU A 85 -4.951 10.324 0.551 1.00 0.00 H new ATOM 0 HA LEU A 85 -2.827 10.711 2.584 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.734 12.313 0.528 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.115 13.067 1.299 1.00 0.00 H new ATOM 0 HG LEU A 85 -2.789 13.431 3.346 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.359 13.060 3.335 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -1.270 11.538 3.190 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.494 12.251 1.756 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.312 15.182 2.457 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.507 14.511 0.821 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.910 15.195 1.676 1.00 0.00 H new ATOM 1309 N GLN A 86 -5.699 10.155 2.921 1.00 0.00 N ATOM 1310 CA GLN A 86 -6.868 10.093 3.782 1.00 0.00 C ATOM 1311 C GLN A 86 -6.647 9.079 4.906 1.00 0.00 C ATOM 1312 O GLN A 86 -5.523 8.631 5.130 1.00 0.00 O ATOM 1313 CB GLN A 86 -8.124 9.752 2.977 1.00 0.00 C ATOM 1314 CG GLN A 86 -8.276 10.689 1.777 1.00 0.00 C ATOM 1315 CD GLN A 86 -9.745 10.820 1.367 1.00 0.00 C ATOM 1316 OE1 GLN A 86 -10.544 9.913 1.527 1.00 0.00 O ATOM 1317 NE2 GLN A 86 -10.053 11.997 0.830 1.00 0.00 N ATOM 0 H GLN A 86 -5.595 9.365 2.285 1.00 0.00 H new ATOM 0 HA GLN A 86 -7.017 11.076 4.229 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -8.070 8.719 2.632 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -9.003 9.829 3.617 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -7.875 11.672 2.025 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -7.693 10.309 0.938 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -9.335 12.713 0.725 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -11.008 12.183 0.523 1.00 0.00 H new ATOM 1326 N ASP A 87 -7.735 8.749 5.585 1.00 0.00 N ATOM 1327 CA ASP A 87 -7.674 7.796 6.681 1.00 0.00 C ATOM 1328 C ASP A 87 -7.898 6.384 6.136 1.00 0.00 C ATOM 1329 O ASP A 87 -6.955 5.603 6.017 1.00 0.00 O ATOM 1330 CB ASP A 87 -8.761 8.080 7.719 1.00 0.00 C ATOM 1331 CG ASP A 87 -9.104 6.904 8.635 1.00 0.00 C ATOM 1332 OD1 ASP A 87 -8.398 6.753 9.655 1.00 0.00 O ATOM 1333 OD2 ASP A 87 -10.066 6.181 8.294 1.00 0.00 O ATOM 0 H ASP A 87 -8.665 9.124 5.398 1.00 0.00 H new ATOM 0 HA ASP A 87 -6.695 7.885 7.151 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -8.442 8.920 8.336 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -9.667 8.392 7.199 1.00 0.00 H new ATOM 1338 N ASP A 88 -9.152 6.098 5.820 1.00 0.00 N ATOM 1339 CA ASP A 88 -9.513 4.793 5.292 1.00 0.00 C ATOM 1340 C ASP A 88 -8.448 4.342 4.290 1.00 0.00 C ATOM 1341 O ASP A 88 -8.175 5.038 3.313 1.00 0.00 O ATOM 1342 CB ASP A 88 -10.857 4.847 4.562 1.00 0.00 C ATOM 1343 CG ASP A 88 -11.235 6.220 4.002 1.00 0.00 C ATOM 1344 OD1 ASP A 88 -10.364 6.821 3.339 1.00 0.00 O ATOM 1345 OD2 ASP A 88 -12.386 6.636 4.252 1.00 0.00 O ATOM 0 H ASP A 88 -9.932 6.748 5.919 1.00 0.00 H new ATOM 0 HA ASP A 88 -9.585 4.098 6.129 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -10.837 4.130 3.741 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -11.639 4.524 5.249 1.00 0.00 H new ATOM 1350 N ILE A 89 -7.875 3.179 4.567 1.00 0.00 N ATOM 1351 CA ILE A 89 -6.847 2.628 3.702 1.00 0.00 C ATOM 1352 C ILE A 89 -7.505 1.983 2.480 1.00 0.00 C ATOM 1353 O ILE A 89 -6.817 1.496 1.585 1.00 0.00 O ATOM 1354 CB ILE A 89 -5.943 1.675 4.487 1.00 0.00 C ATOM 1355 CG1 ILE A 89 -6.584 0.291 4.617 1.00 0.00 C ATOM 1356 CG2 ILE A 89 -5.574 2.266 5.849 1.00 0.00 C ATOM 1357 CD1 ILE A 89 -5.606 -0.711 5.232 1.00 0.00 C ATOM 0 H ILE A 89 -8.104 2.604 5.378 1.00 0.00 H new ATOM 0 HA ILE A 89 -6.195 3.420 3.333 1.00 0.00 H new ATOM 0 HB ILE A 89 -5.015 1.548 3.929 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -7.479 0.358 5.236 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -6.901 -0.061 3.635 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -4.931 1.569 6.386 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -5.046 3.209 5.706 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -6.481 2.442 6.427 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -6.087 -1.686 5.313 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -4.723 -0.793 4.598 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -5.310 -0.369 6.224 1.00 0.00 H new ATOM 1369 N THR A 90 -8.829 2.003 2.483 1.00 0.00 N ATOM 1370 CA THR A 90 -9.589 1.427 1.385 1.00 0.00 C ATOM 1371 C THR A 90 -8.984 1.844 0.043 1.00 0.00 C ATOM 1372 O THR A 90 -8.974 1.062 -0.906 1.00 0.00 O ATOM 1373 CB THR A 90 -11.050 1.847 1.551 1.00 0.00 C ATOM 1374 OG1 THR A 90 -11.714 1.234 0.448 1.00 0.00 O ATOM 1375 CG2 THR A 90 -11.259 3.345 1.324 1.00 0.00 C ATOM 0 H THR A 90 -9.396 2.409 3.228 1.00 0.00 H new ATOM 0 HA THR A 90 -9.546 0.338 1.401 1.00 0.00 H new ATOM 0 HB THR A 90 -11.393 1.580 2.551 1.00 0.00 H new ATOM 0 HG1 THR A 90 -12.669 1.453 0.478 1.00 0.00 H new ATOM 0 HG21 THR A 90 -12.313 3.589 1.454 1.00 0.00 H new ATOM 0 HG22 THR A 90 -10.665 3.908 2.043 1.00 0.00 H new ATOM 0 HG23 THR A 90 -10.948 3.607 0.313 1.00 0.00 H new ATOM 1383 N ALA A 91 -8.496 3.076 0.007 1.00 0.00 N ATOM 1384 CA ALA A 91 -7.892 3.606 -1.204 1.00 0.00 C ATOM 1385 C ALA A 91 -6.522 2.958 -1.410 1.00 0.00 C ATOM 1386 O ALA A 91 -6.140 2.651 -2.538 1.00 0.00 O ATOM 1387 CB ALA A 91 -7.808 5.131 -1.107 1.00 0.00 C ATOM 0 H ALA A 91 -8.507 3.722 0.796 1.00 0.00 H new ATOM 0 HA ALA A 91 -8.503 3.368 -2.075 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -7.355 5.529 -2.015 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -8.810 5.544 -0.990 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.199 5.408 -0.246 1.00 0.00 H new ATOM 1393 N ALA A 92 -5.818 2.769 -0.303 1.00 0.00 N ATOM 1394 CA ALA A 92 -4.499 2.164 -0.349 1.00 0.00 C ATOM 1395 C ALA A 92 -4.618 0.731 -0.871 1.00 0.00 C ATOM 1396 O ALA A 92 -3.765 0.270 -1.628 1.00 0.00 O ATOM 1397 CB ALA A 92 -3.859 2.227 1.041 1.00 0.00 C ATOM 0 H ALA A 92 -6.137 3.025 0.631 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.850 2.711 -1.032 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -2.869 1.773 1.007 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -3.770 3.267 1.354 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -4.482 1.686 1.753 1.00 0.00 H new ATOM 1403 N ILE A 93 -5.682 0.066 -0.444 1.00 0.00 N ATOM 1404 CA ILE A 93 -5.924 -1.306 -0.860 1.00 0.00 C ATOM 1405 C ILE A 93 -6.384 -1.318 -2.318 1.00 0.00 C ATOM 1406 O ILE A 93 -5.832 -2.046 -3.141 1.00 0.00 O ATOM 1407 CB ILE A 93 -6.898 -1.992 0.100 1.00 0.00 C ATOM 1408 CG1 ILE A 93 -6.509 -1.731 1.556 1.00 0.00 C ATOM 1409 CG2 ILE A 93 -7.006 -3.487 -0.206 1.00 0.00 C ATOM 1410 CD1 ILE A 93 -7.417 -2.505 2.514 1.00 0.00 C ATOM 0 H ILE A 93 -6.386 0.451 0.185 1.00 0.00 H new ATOM 0 HA ILE A 93 -5.004 -1.888 -0.812 1.00 0.00 H new ATOM 0 HB ILE A 93 -7.887 -1.560 -0.050 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -5.471 -2.024 1.717 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -6.576 -0.664 1.768 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -7.704 -3.951 0.490 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -7.365 -3.625 -1.226 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -6.026 -3.952 -0.101 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -7.119 -2.301 3.542 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -8.451 -2.193 2.368 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -7.329 -3.573 2.315 1.00 0.00 H new ATOM 1422 N GLN A 94 -7.395 -0.505 -2.594 1.00 0.00 N ATOM 1423 CA GLN A 94 -7.936 -0.414 -3.939 1.00 0.00 C ATOM 1424 C GLN A 94 -6.817 -0.138 -4.945 1.00 0.00 C ATOM 1425 O GLN A 94 -6.743 -0.784 -5.988 1.00 0.00 O ATOM 1426 CB GLN A 94 -9.024 0.658 -4.019 1.00 0.00 C ATOM 1427 CG GLN A 94 -9.864 0.494 -5.288 1.00 0.00 C ATOM 1428 CD GLN A 94 -10.991 1.526 -5.337 1.00 0.00 C ATOM 1429 OE1 GLN A 94 -11.525 1.950 -4.326 1.00 0.00 O ATOM 1430 NE2 GLN A 94 -11.322 1.908 -6.568 1.00 0.00 N ATOM 0 H GLN A 94 -7.853 0.096 -1.909 1.00 0.00 H new ATOM 0 HA GLN A 94 -8.394 -1.370 -4.191 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -9.668 0.594 -3.142 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -8.566 1.647 -4.007 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -9.228 0.603 -6.166 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -10.285 -0.511 -5.322 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -10.835 1.514 -7.373 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -12.063 2.595 -6.707 1.00 0.00 H new ATOM 1439 N CYS A 95 -5.975 0.823 -4.595 1.00 0.00 N ATOM 1440 CA CYS A 95 -4.863 1.193 -5.455 1.00 0.00 C ATOM 1441 C CYS A 95 -3.837 0.059 -5.428 1.00 0.00 C ATOM 1442 O CYS A 95 -3.369 -0.384 -6.476 1.00 0.00 O ATOM 1443 CB CYS A 95 -4.246 2.530 -5.037 1.00 0.00 C ATOM 1444 SG CYS A 95 -3.619 3.551 -6.421 1.00 0.00 S ATOM 0 H CYS A 95 -6.040 1.357 -3.728 1.00 0.00 H new ATOM 0 HA CYS A 95 -5.220 1.335 -6.475 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -4.994 3.104 -4.490 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -3.425 2.336 -4.346 1.00 0.00 H new ATOM 1449 N ALA A 96 -3.519 -0.381 -4.220 1.00 0.00 N ATOM 1450 CA ALA A 96 -2.557 -1.455 -4.043 1.00 0.00 C ATOM 1451 C ALA A 96 -2.905 -2.606 -4.988 1.00 0.00 C ATOM 1452 O ALA A 96 -2.024 -3.175 -5.630 1.00 0.00 O ATOM 1453 CB ALA A 96 -2.541 -1.890 -2.576 1.00 0.00 C ATOM 0 H ALA A 96 -3.911 -0.013 -3.353 1.00 0.00 H new ATOM 0 HA ALA A 96 -1.552 -1.115 -4.293 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -1.819 -2.696 -2.443 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -2.260 -1.044 -1.949 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.533 -2.240 -2.290 1.00 0.00 H new ATOM 1459 N LYS A 97 -4.193 -2.914 -5.044 1.00 0.00 N ATOM 1460 CA LYS A 97 -4.669 -3.987 -5.901 1.00 0.00 C ATOM 1461 C LYS A 97 -4.664 -3.512 -7.356 1.00 0.00 C ATOM 1462 O LYS A 97 -4.284 -4.261 -8.256 1.00 0.00 O ATOM 1463 CB LYS A 97 -6.032 -4.490 -5.424 1.00 0.00 C ATOM 1464 CG LYS A 97 -7.109 -3.419 -5.615 1.00 0.00 C ATOM 1465 CD LYS A 97 -8.508 -4.041 -5.610 1.00 0.00 C ATOM 1466 CE LYS A 97 -8.952 -4.380 -4.186 1.00 0.00 C ATOM 1467 NZ LYS A 97 -10.151 -5.248 -4.211 1.00 0.00 N ATOM 0 H LYS A 97 -4.921 -2.439 -4.510 1.00 0.00 H new ATOM 0 HA LYS A 97 -4.000 -4.846 -5.843 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.306 -5.389 -5.977 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -5.973 -4.768 -4.372 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -7.034 -2.677 -4.820 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -6.943 -2.895 -6.556 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -9.219 -3.349 -6.061 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -8.511 -4.944 -6.220 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -8.143 -4.882 -3.656 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -9.171 -3.463 -3.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -10.360 -5.579 -3.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -10.962 -4.709 -4.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -9.974 -6.066 -4.828 1.00 0.00 H new ATOM 1481 N ARG A 98 -5.089 -2.272 -7.542 1.00 0.00 N ATOM 1482 CA ARG A 98 -5.139 -1.688 -8.872 1.00 0.00 C ATOM 1483 C ARG A 98 -3.734 -1.622 -9.475 1.00 0.00 C ATOM 1484 O ARG A 98 -3.580 -1.589 -10.694 1.00 0.00 O ATOM 1485 CB ARG A 98 -5.738 -0.281 -8.834 1.00 0.00 C ATOM 1486 CG ARG A 98 -5.966 0.256 -10.248 1.00 0.00 C ATOM 1487 CD ARG A 98 -7.151 -0.444 -10.915 1.00 0.00 C ATOM 1488 NE ARG A 98 -8.320 0.463 -10.951 1.00 0.00 N ATOM 1489 CZ ARG A 98 -8.496 1.425 -11.867 1.00 0.00 C ATOM 1490 NH1 ARG A 98 -7.581 1.612 -12.829 1.00 0.00 N ATOM 1491 NH2 ARG A 98 -9.588 2.201 -11.823 1.00 0.00 N ATOM 0 H ARG A 98 -5.402 -1.654 -6.793 1.00 0.00 H new ATOM 0 HA ARG A 98 -5.774 -2.323 -9.490 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -6.683 -0.299 -8.291 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -5.071 0.388 -8.290 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -6.149 1.330 -10.208 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -5.067 0.108 -10.847 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -6.883 -0.745 -11.928 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.402 -1.353 -10.368 1.00 0.00 H new ATOM 0 HE ARG A 98 -9.036 0.349 -10.234 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -6.750 1.022 -12.864 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.716 2.345 -13.526 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -10.285 2.059 -11.092 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -9.722 2.933 -12.520 1.00 0.00 H new ATOM 1505 N VAL A 99 -2.746 -1.606 -8.592 1.00 0.00 N ATOM 1506 CA VAL A 99 -1.360 -1.544 -9.022 1.00 0.00 C ATOM 1507 C VAL A 99 -0.822 -2.966 -9.203 1.00 0.00 C ATOM 1508 O VAL A 99 -0.362 -3.326 -10.285 1.00 0.00 O ATOM 1509 CB VAL A 99 -0.540 -0.717 -8.029 1.00 0.00 C ATOM 1510 CG1 VAL A 99 0.960 -0.902 -8.269 1.00 0.00 C ATOM 1511 CG2 VAL A 99 -0.928 0.761 -8.095 1.00 0.00 C ATOM 0 H VAL A 99 -2.878 -1.635 -7.581 1.00 0.00 H new ATOM 0 HA VAL A 99 -1.282 -1.041 -9.986 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.766 -1.078 -7.025 1.00 0.00 H new ATOM 0 HG11 VAL A 99 1.520 -0.304 -7.550 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.221 -1.953 -8.148 1.00 0.00 H new ATOM 0 HG13 VAL A 99 1.209 -0.581 -9.280 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.331 1.326 -7.380 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.745 1.141 -9.100 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -1.985 0.871 -7.852 1.00 0.00 H new ATOM 1521 N VAL A 100 -0.900 -3.735 -8.127 1.00 0.00 N ATOM 1522 CA VAL A 100 -0.428 -5.108 -8.153 1.00 0.00 C ATOM 1523 C VAL A 100 -1.140 -5.867 -9.274 1.00 0.00 C ATOM 1524 O VAL A 100 -0.610 -6.843 -9.802 1.00 0.00 O ATOM 1525 CB VAL A 100 -0.619 -5.754 -6.779 1.00 0.00 C ATOM 1526 CG1 VAL A 100 -0.580 -7.280 -6.880 1.00 0.00 C ATOM 1527 CG2 VAL A 100 0.424 -5.244 -5.782 1.00 0.00 C ATOM 0 H VAL A 100 -1.283 -3.433 -7.231 1.00 0.00 H new ATOM 0 HA VAL A 100 0.640 -5.140 -8.367 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.604 -5.467 -6.409 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.718 -7.714 -5.890 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -1.377 -7.621 -7.540 1.00 0.00 H new ATOM 0 HG13 VAL A 100 0.383 -7.594 -7.282 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.265 -5.719 -4.814 1.00 0.00 H new ATOM 0 HG22 VAL A 100 1.423 -5.485 -6.145 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.328 -4.163 -5.676 1.00 0.00 H new ATOM 1537 N ARG A 101 -2.331 -5.389 -9.605 1.00 0.00 N ATOM 1538 CA ARG A 101 -3.122 -6.010 -10.653 1.00 0.00 C ATOM 1539 C ARG A 101 -2.293 -6.149 -11.932 1.00 0.00 C ATOM 1540 O ARG A 101 -2.621 -6.951 -12.805 1.00 0.00 O ATOM 1541 CB ARG A 101 -4.377 -5.191 -10.955 1.00 0.00 C ATOM 1542 CG ARG A 101 -5.637 -5.927 -10.494 1.00 0.00 C ATOM 1543 CD ARG A 101 -6.879 -5.048 -10.662 1.00 0.00 C ATOM 1544 NE ARG A 101 -7.883 -5.746 -11.495 1.00 0.00 N ATOM 1545 CZ ARG A 101 -8.585 -6.813 -11.090 1.00 0.00 C ATOM 1546 NH1 ARG A 101 -8.397 -7.311 -9.860 1.00 0.00 N ATOM 1547 NH2 ARG A 101 -9.475 -7.382 -11.915 1.00 0.00 N ATOM 0 H ARG A 101 -2.767 -4.578 -9.165 1.00 0.00 H new ATOM 0 HA ARG A 101 -3.422 -6.997 -10.300 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -4.313 -4.224 -10.456 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -4.438 -4.994 -12.025 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -5.757 -6.845 -11.069 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -5.531 -6.217 -9.449 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -7.304 -4.814 -9.686 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -6.604 -4.101 -11.126 1.00 0.00 H new ATOM 0 HE ARG A 101 -8.051 -5.393 -12.437 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -7.720 -6.878 -9.232 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -8.931 -8.123 -9.551 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -9.618 -7.003 -12.851 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -10.009 -8.194 -11.607 1.00 0.00 H new ATOM 1561 N ASP A 102 -1.233 -5.356 -12.000 1.00 0.00 N ATOM 1562 CA ASP A 102 -0.354 -5.380 -13.157 1.00 0.00 C ATOM 1563 C ASP A 102 0.502 -6.647 -13.115 1.00 0.00 C ATOM 1564 O ASP A 102 0.412 -7.430 -12.171 1.00 0.00 O ATOM 1565 CB ASP A 102 0.586 -4.173 -13.160 1.00 0.00 C ATOM 1566 CG ASP A 102 0.434 -3.238 -14.361 1.00 0.00 C ATOM 1567 OD1 ASP A 102 -0.598 -3.366 -15.053 1.00 0.00 O ATOM 1568 OD2 ASP A 102 1.356 -2.416 -14.560 1.00 0.00 O ATOM 0 H ASP A 102 -0.963 -4.693 -11.273 1.00 0.00 H new ATOM 0 HA ASP A 102 -0.975 -5.355 -14.053 1.00 0.00 H new ATOM 0 HB2 ASP A 102 0.419 -3.599 -12.248 1.00 0.00 H new ATOM 0 HB3 ASP A 102 1.614 -4.532 -13.126 1.00 0.00 H new ATOM 1573 N PRO A 103 1.335 -6.814 -14.177 1.00 0.00 N ATOM 1574 CA PRO A 103 2.208 -7.972 -14.270 1.00 0.00 C ATOM 1575 C PRO A 103 3.395 -7.842 -13.314 1.00 0.00 C ATOM 1576 O PRO A 103 4.264 -8.712 -13.276 1.00 0.00 O ATOM 1577 CB PRO A 103 2.625 -8.034 -15.731 1.00 0.00 C ATOM 1578 CG PRO A 103 2.349 -6.652 -16.302 1.00 0.00 C ATOM 1579 CD PRO A 103 1.469 -5.906 -15.313 1.00 0.00 C ATOM 0 HA PRO A 103 1.714 -8.897 -13.971 1.00 0.00 H new ATOM 0 HB2 PRO A 103 3.680 -8.292 -15.826 1.00 0.00 H new ATOM 0 HB3 PRO A 103 2.061 -8.798 -16.266 1.00 0.00 H new ATOM 0 HG2 PRO A 103 3.282 -6.113 -16.465 1.00 0.00 H new ATOM 0 HG3 PRO A 103 1.854 -6.731 -17.270 1.00 0.00 H new ATOM 0 HD2 PRO A 103 1.923 -4.961 -15.013 1.00 0.00 H new ATOM 0 HD3 PRO A 103 0.498 -5.669 -15.747 1.00 0.00 H new ATOM 1587 N GLN A 104 3.395 -6.748 -12.566 1.00 0.00 N ATOM 1588 CA GLN A 104 4.462 -6.493 -11.613 1.00 0.00 C ATOM 1589 C GLN A 104 4.349 -7.447 -10.423 1.00 0.00 C ATOM 1590 O GLN A 104 5.232 -8.274 -10.200 1.00 0.00 O ATOM 1591 CB GLN A 104 4.447 -5.035 -11.151 1.00 0.00 C ATOM 1592 CG GLN A 104 4.433 -4.080 -12.346 1.00 0.00 C ATOM 1593 CD GLN A 104 5.801 -3.422 -12.539 1.00 0.00 C ATOM 1594 OE1 GLN A 104 6.019 -2.272 -12.194 1.00 0.00 O ATOM 1595 NE2 GLN A 104 6.708 -4.214 -13.106 1.00 0.00 N ATOM 0 H GLN A 104 2.673 -6.028 -12.601 1.00 0.00 H new ATOM 0 HA GLN A 104 5.416 -6.673 -12.108 1.00 0.00 H new ATOM 0 HB2 GLN A 104 3.570 -4.856 -10.528 1.00 0.00 H new ATOM 0 HB3 GLN A 104 5.323 -4.837 -10.533 1.00 0.00 H new ATOM 0 HG2 GLN A 104 4.157 -4.625 -13.249 1.00 0.00 H new ATOM 0 HG3 GLN A 104 3.675 -3.312 -12.193 1.00 0.00 H new ATOM 0 HE21 GLN A 104 6.459 -5.167 -13.371 1.00 0.00 H new ATOM 0 HE22 GLN A 104 7.652 -3.868 -13.276 1.00 0.00 H new ATOM 1604 N GLY A 105 3.256 -7.300 -9.688 1.00 0.00 N ATOM 1605 CA GLY A 105 3.017 -8.138 -8.527 1.00 0.00 C ATOM 1606 C GLY A 105 3.710 -7.568 -7.287 1.00 0.00 C ATOM 1607 O GLY A 105 4.652 -6.786 -7.403 1.00 0.00 O ATOM 0 H GLY A 105 2.526 -6.612 -9.875 1.00 0.00 H new ATOM 0 HA2 GLY A 105 1.945 -8.216 -8.345 1.00 0.00 H new ATOM 0 HA3 GLY A 105 3.382 -9.147 -8.721 1.00 0.00 H new ATOM 1611 N ILE A 106 3.218 -7.984 -6.129 1.00 0.00 N ATOM 1612 CA ILE A 106 3.779 -7.524 -4.870 1.00 0.00 C ATOM 1613 C ILE A 106 5.303 -7.640 -4.924 1.00 0.00 C ATOM 1614 O ILE A 106 6.008 -6.926 -4.210 1.00 0.00 O ATOM 1615 CB ILE A 106 3.146 -8.276 -3.696 1.00 0.00 C ATOM 1616 CG1 ILE A 106 1.771 -7.699 -3.353 1.00 0.00 C ATOM 1617 CG2 ILE A 106 4.081 -8.288 -2.485 1.00 0.00 C ATOM 1618 CD1 ILE A 106 1.863 -6.722 -2.180 1.00 0.00 C ATOM 0 H ILE A 106 2.438 -8.634 -6.036 1.00 0.00 H new ATOM 0 HA ILE A 106 3.544 -6.472 -4.709 1.00 0.00 H new ATOM 0 HB ILE A 106 2.994 -9.313 -3.996 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.359 -7.189 -4.224 1.00 0.00 H new ATOM 0 HG13 ILE A 106 1.085 -8.509 -3.104 1.00 0.00 H new ATOM 0 HG21 ILE A 106 3.608 -8.828 -1.665 1.00 0.00 H new ATOM 0 HG22 ILE A 106 5.016 -8.781 -2.752 1.00 0.00 H new ATOM 0 HG23 ILE A 106 4.286 -7.264 -2.174 1.00 0.00 H new ATOM 0 HD11 ILE A 106 0.872 -6.327 -1.957 1.00 0.00 H new ATOM 0 HD12 ILE A 106 2.252 -7.241 -1.304 1.00 0.00 H new ATOM 0 HD13 ILE A 106 2.531 -5.901 -2.442 1.00 0.00 H new ATOM 1630 N ARG A 107 5.767 -8.542 -5.775 1.00 0.00 N ATOM 1631 CA ARG A 107 7.195 -8.760 -5.930 1.00 0.00 C ATOM 1632 C ARG A 107 7.937 -7.421 -5.952 1.00 0.00 C ATOM 1633 O ARG A 107 9.066 -7.325 -5.474 1.00 0.00 O ATOM 1634 CB ARG A 107 7.499 -9.523 -7.220 1.00 0.00 C ATOM 1635 CG ARG A 107 8.929 -10.066 -7.213 1.00 0.00 C ATOM 1636 CD ARG A 107 9.622 -9.804 -8.552 1.00 0.00 C ATOM 1637 NE ARG A 107 10.377 -8.532 -8.490 1.00 0.00 N ATOM 1638 CZ ARG A 107 10.919 -7.928 -9.556 1.00 0.00 C ATOM 1639 NH1 ARG A 107 10.792 -8.475 -10.773 1.00 0.00 N ATOM 1640 NH2 ARG A 107 11.587 -6.776 -9.406 1.00 0.00 N ATOM 0 H ARG A 107 5.179 -9.131 -6.365 1.00 0.00 H new ATOM 0 HA ARG A 107 7.533 -9.354 -5.081 1.00 0.00 H new ATOM 0 HB2 ARG A 107 6.794 -10.347 -7.334 1.00 0.00 H new ATOM 0 HB3 ARG A 107 7.361 -8.864 -8.077 1.00 0.00 H new ATOM 0 HG2 ARG A 107 9.496 -9.597 -6.408 1.00 0.00 H new ATOM 0 HG3 ARG A 107 8.914 -11.137 -7.011 1.00 0.00 H new ATOM 0 HD2 ARG A 107 10.297 -10.626 -8.789 1.00 0.00 H new ATOM 0 HD3 ARG A 107 8.882 -9.759 -9.351 1.00 0.00 H new ATOM 0 HE ARG A 107 10.492 -8.088 -7.579 1.00 0.00 H new ATOM 0 HH11 ARG A 107 10.283 -9.351 -10.888 1.00 0.00 H new ATOM 0 HH12 ARG A 107 11.205 -8.015 -11.584 1.00 0.00 H new ATOM 0 HH21 ARG A 107 11.683 -6.359 -8.480 1.00 0.00 H new ATOM 0 HH22 ARG A 107 12.000 -6.316 -10.218 1.00 0.00 H new ATOM 1654 N ALA A 108 7.271 -6.422 -6.512 1.00 0.00 N ATOM 1655 CA ALA A 108 7.853 -5.093 -6.602 1.00 0.00 C ATOM 1656 C ALA A 108 8.450 -4.709 -5.248 1.00 0.00 C ATOM 1657 O ALA A 108 9.452 -3.998 -5.185 1.00 0.00 O ATOM 1658 CB ALA A 108 6.787 -4.100 -7.073 1.00 0.00 C ATOM 0 H ALA A 108 6.335 -6.506 -6.908 1.00 0.00 H new ATOM 0 HA ALA A 108 8.661 -5.076 -7.334 1.00 0.00 H new ATOM 0 HB1 ALA A 108 7.223 -3.103 -7.141 1.00 0.00 H new ATOM 0 HB2 ALA A 108 6.417 -4.401 -8.053 1.00 0.00 H new ATOM 0 HB3 ALA A 108 5.962 -4.088 -6.361 1.00 0.00 H new ATOM 1664 N TRP A 109 7.811 -5.198 -4.195 1.00 0.00 N ATOM 1665 CA TRP A 109 8.266 -4.914 -2.845 1.00 0.00 C ATOM 1666 C TRP A 109 9.130 -6.089 -2.381 1.00 0.00 C ATOM 1667 O TRP A 109 8.959 -6.591 -1.271 1.00 0.00 O ATOM 1668 CB TRP A 109 7.084 -4.637 -1.913 1.00 0.00 C ATOM 1669 CG TRP A 109 6.251 -3.419 -2.312 1.00 0.00 C ATOM 1670 CD1 TRP A 109 6.546 -2.123 -2.137 1.00 0.00 C ATOM 1671 CD2 TRP A 109 4.963 -3.434 -2.965 1.00 0.00 C ATOM 1672 NE1 TRP A 109 5.548 -1.306 -2.626 1.00 0.00 N ATOM 1673 CE2 TRP A 109 4.555 -2.128 -3.146 1.00 0.00 C ATOM 1674 CE3 TRP A 109 4.170 -4.514 -3.388 1.00 0.00 C ATOM 1675 CZ2 TRP A 109 3.342 -1.781 -3.754 1.00 0.00 C ATOM 1676 CZ3 TRP A 109 2.961 -4.152 -3.994 1.00 0.00 C ATOM 1677 CH2 TRP A 109 2.536 -2.842 -4.183 1.00 0.00 C ATOM 0 H TRP A 109 6.982 -5.789 -4.250 1.00 0.00 H new ATOM 0 HA TRP A 109 8.870 -4.007 -2.825 1.00 0.00 H new ATOM 0 HB2 TRP A 109 6.438 -5.515 -1.891 1.00 0.00 H new ATOM 0 HB3 TRP A 109 7.459 -4.492 -0.900 1.00 0.00 H new ATOM 0 HD1 TRP A 109 7.452 -1.764 -1.671 1.00 0.00 H new ATOM 0 HE1 TRP A 109 5.540 -0.286 -2.609 1.00 0.00 H new ATOM 0 HE3 TRP A 109 4.470 -5.543 -3.256 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 3.045 -0.751 -3.885 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 2.314 -4.945 -4.338 1.00 0.00 H new ATOM 0 HH2 TRP A 109 1.587 -2.644 -4.659 1.00 0.00 H new ATOM 1688 N VAL A 110 10.040 -6.494 -3.256 1.00 0.00 N ATOM 1689 CA VAL A 110 10.931 -7.600 -2.949 1.00 0.00 C ATOM 1690 C VAL A 110 11.379 -7.501 -1.490 1.00 0.00 C ATOM 1691 O VAL A 110 11.674 -8.513 -0.856 1.00 0.00 O ATOM 1692 CB VAL A 110 12.102 -7.616 -3.934 1.00 0.00 C ATOM 1693 CG1 VAL A 110 13.242 -8.496 -3.416 1.00 0.00 C ATOM 1694 CG2 VAL A 110 11.645 -8.073 -5.321 1.00 0.00 C ATOM 0 H VAL A 110 10.179 -6.076 -4.176 1.00 0.00 H new ATOM 0 HA VAL A 110 10.412 -8.551 -3.064 1.00 0.00 H new ATOM 0 HB VAL A 110 12.479 -6.597 -4.023 1.00 0.00 H new ATOM 0 HG11 VAL A 110 14.062 -8.490 -4.135 1.00 0.00 H new ATOM 0 HG12 VAL A 110 13.595 -8.109 -2.460 1.00 0.00 H new ATOM 0 HG13 VAL A 110 12.883 -9.517 -3.284 1.00 0.00 H new ATOM 0 HG21 VAL A 110 12.496 -8.075 -6.002 1.00 0.00 H new ATOM 0 HG22 VAL A 110 11.231 -9.079 -5.254 1.00 0.00 H new ATOM 0 HG23 VAL A 110 10.882 -7.391 -5.696 1.00 0.00 H new ATOM 1704 N ALA A 111 11.415 -6.270 -0.998 1.00 0.00 N ATOM 1705 CA ALA A 111 11.822 -6.026 0.375 1.00 0.00 C ATOM 1706 C ALA A 111 11.203 -7.089 1.284 1.00 0.00 C ATOM 1707 O ALA A 111 11.904 -7.725 2.069 1.00 0.00 O ATOM 1708 CB ALA A 111 11.421 -4.606 0.781 1.00 0.00 C ATOM 0 H ALA A 111 11.169 -5.432 -1.526 1.00 0.00 H new ATOM 0 HA ALA A 111 12.905 -6.100 0.473 1.00 0.00 H new ATOM 0 HB1 ALA A 111 11.726 -4.422 1.811 1.00 0.00 H new ATOM 0 HB2 ALA A 111 11.911 -3.888 0.124 1.00 0.00 H new ATOM 0 HB3 ALA A 111 10.340 -4.495 0.698 1.00 0.00 H new ATOM 1714 N TRP A 112 9.895 -7.251 1.146 1.00 0.00 N ATOM 1715 CA TRP A 112 9.173 -8.226 1.945 1.00 0.00 C ATOM 1716 C TRP A 112 9.795 -9.600 1.688 1.00 0.00 C ATOM 1717 O TRP A 112 10.002 -10.375 2.621 1.00 0.00 O ATOM 1718 CB TRP A 112 7.674 -8.182 1.641 1.00 0.00 C ATOM 1719 CG TRP A 112 7.062 -9.550 1.328 1.00 0.00 C ATOM 1720 CD1 TRP A 112 7.000 -10.175 0.145 1.00 0.00 C ATOM 1721 CD2 TRP A 112 6.425 -10.440 2.268 1.00 0.00 C ATOM 1722 NE1 TRP A 112 6.371 -11.399 0.252 1.00 0.00 N ATOM 1723 CE2 TRP A 112 6.010 -11.566 1.585 1.00 0.00 C ATOM 1724 CE3 TRP A 112 6.205 -10.300 3.650 1.00 0.00 C ATOM 1725 CZ2 TRP A 112 5.351 -12.637 2.199 1.00 0.00 C ATOM 1726 CZ3 TRP A 112 5.545 -11.380 4.249 1.00 0.00 C ATOM 1727 CH2 TRP A 112 5.122 -12.519 3.575 1.00 0.00 C ATOM 0 H TRP A 112 9.317 -6.723 0.492 1.00 0.00 H new ATOM 0 HA TRP A 112 9.261 -7.996 3.007 1.00 0.00 H new ATOM 0 HB2 TRP A 112 7.153 -7.749 2.495 1.00 0.00 H new ATOM 0 HB3 TRP A 112 7.505 -7.517 0.794 1.00 0.00 H new ATOM 0 HD1 TRP A 112 7.393 -9.772 -0.777 1.00 0.00 H new ATOM 0 HE1 TRP A 112 6.202 -12.059 -0.507 1.00 0.00 H new ATOM 0 HE3 TRP A 112 6.520 -9.429 4.205 1.00 0.00 H new ATOM 0 HZ2 TRP A 112 5.036 -13.507 1.642 1.00 0.00 H new ATOM 0 HZ3 TRP A 112 5.351 -11.324 5.310 1.00 0.00 H new ATOM 0 HH2 TRP A 112 4.618 -13.310 4.111 1.00 0.00 H new ATOM 1738 N ARG A 113 10.076 -9.860 0.420 1.00 0.00 N ATOM 1739 CA ARG A 113 10.670 -11.127 0.030 1.00 0.00 C ATOM 1740 C ARG A 113 12.103 -11.228 0.561 1.00 0.00 C ATOM 1741 O ARG A 113 12.728 -12.283 0.474 1.00 0.00 O ATOM 1742 CB ARG A 113 10.686 -11.282 -1.492 1.00 0.00 C ATOM 1743 CG ARG A 113 10.719 -12.759 -1.893 1.00 0.00 C ATOM 1744 CD ARG A 113 11.981 -13.082 -2.695 1.00 0.00 C ATOM 1745 NE ARG A 113 11.798 -14.347 -3.440 1.00 0.00 N ATOM 1746 CZ ARG A 113 12.622 -14.777 -4.405 1.00 0.00 C ATOM 1747 NH1 ARG A 113 13.690 -14.046 -4.748 1.00 0.00 N ATOM 1748 NH2 ARG A 113 12.376 -15.938 -5.027 1.00 0.00 N ATOM 0 H ARG A 113 9.903 -9.215 -0.351 1.00 0.00 H new ATOM 0 HA ARG A 113 10.063 -11.924 0.459 1.00 0.00 H new ATOM 0 HB2 ARG A 113 9.804 -10.805 -1.919 1.00 0.00 H new ATOM 0 HB3 ARG A 113 11.556 -10.770 -1.904 1.00 0.00 H new ATOM 0 HG2 ARG A 113 10.682 -13.383 -1.000 1.00 0.00 H new ATOM 0 HG3 ARG A 113 9.836 -12.998 -2.486 1.00 0.00 H new ATOM 0 HD2 ARG A 113 12.198 -12.270 -3.389 1.00 0.00 H new ATOM 0 HD3 ARG A 113 12.836 -13.166 -2.024 1.00 0.00 H new ATOM 0 HE ARG A 113 10.994 -14.928 -3.204 1.00 0.00 H new ATOM 0 HH11 ARG A 113 13.876 -13.162 -4.275 1.00 0.00 H new ATOM 0 HH12 ARG A 113 14.317 -14.373 -5.483 1.00 0.00 H new ATOM 0 HH21 ARG A 113 11.562 -16.494 -4.766 1.00 0.00 H new ATOM 0 HH22 ARG A 113 13.003 -16.266 -5.762 1.00 0.00 H new ATOM 1762 N ALA A 114 12.580 -10.115 1.097 1.00 0.00 N ATOM 1763 CA ALA A 114 13.926 -10.064 1.643 1.00 0.00 C ATOM 1764 C ALA A 114 13.877 -9.491 3.060 1.00 0.00 C ATOM 1765 O ALA A 114 14.803 -8.804 3.488 1.00 0.00 O ATOM 1766 CB ALA A 114 14.823 -9.245 0.713 1.00 0.00 C ATOM 0 H ALA A 114 12.059 -9.241 1.165 1.00 0.00 H new ATOM 0 HA ALA A 114 14.351 -11.065 1.708 1.00 0.00 H new ATOM 0 HB1 ALA A 114 15.833 -9.206 1.122 1.00 0.00 H new ATOM 0 HB2 ALA A 114 14.848 -9.711 -0.272 1.00 0.00 H new ATOM 0 HB3 ALA A 114 14.428 -8.233 0.625 1.00 0.00 H new ATOM 1772 N HIS A 115 12.786 -9.793 3.749 1.00 0.00 N ATOM 1773 CA HIS A 115 12.604 -9.316 5.109 1.00 0.00 C ATOM 1774 C HIS A 115 11.691 -10.278 5.872 1.00 0.00 C ATOM 1775 O HIS A 115 12.030 -10.724 6.967 1.00 0.00 O ATOM 1776 CB HIS A 115 12.086 -7.877 5.116 1.00 0.00 C ATOM 1777 CG HIS A 115 12.704 -7.007 6.184 1.00 0.00 C ATOM 1778 ND1 HIS A 115 11.961 -6.407 7.185 1.00 0.00 N ATOM 1779 CD2 HIS A 115 14.002 -6.643 6.398 1.00 0.00 C ATOM 1780 CE1 HIS A 115 12.783 -5.714 7.960 1.00 0.00 C ATOM 1781 NE2 HIS A 115 14.047 -5.862 7.469 1.00 0.00 N ATOM 0 H HIS A 115 12.019 -10.362 3.390 1.00 0.00 H new ATOM 0 HA HIS A 115 13.565 -9.297 5.623 1.00 0.00 H new ATOM 0 HB2 HIS A 115 12.277 -7.428 4.141 1.00 0.00 H new ATOM 0 HB3 HIS A 115 11.005 -7.892 5.254 1.00 0.00 H new ATOM 0 HD2 HIS A 115 14.849 -6.940 5.797 1.00 0.00 H new ATOM 0 HE1 HIS A 115 12.502 -5.135 8.827 1.00 0.00 H new ATOM 0 HE2 HIS A 115 14.889 -5.441 7.861 1.00 0.00 H new ATOM 1790 N CYS A 116 10.551 -10.569 5.264 1.00 0.00 N ATOM 1791 CA CYS A 116 9.586 -11.468 5.872 1.00 0.00 C ATOM 1792 C CYS A 116 9.922 -12.897 5.438 1.00 0.00 C ATOM 1793 O CYS A 116 9.966 -13.807 6.265 1.00 0.00 O ATOM 1794 CB CYS A 116 8.149 -11.086 5.511 1.00 0.00 C ATOM 1795 SG CYS A 116 7.154 -10.438 6.905 1.00 0.00 S ATOM 0 H CYS A 116 10.274 -10.198 4.355 1.00 0.00 H new ATOM 0 HA CYS A 116 9.650 -11.393 6.958 1.00 0.00 H new ATOM 0 HB2 CYS A 116 8.175 -10.335 4.721 1.00 0.00 H new ATOM 0 HB3 CYS A 116 7.647 -11.962 5.101 1.00 0.00 H new ATOM 1800 N GLN A 117 10.150 -13.050 4.141 1.00 0.00 N ATOM 1801 CA GLN A 117 10.480 -14.351 3.588 1.00 0.00 C ATOM 1802 C GLN A 117 11.752 -14.897 4.239 1.00 0.00 C ATOM 1803 O GLN A 117 12.755 -15.118 3.562 1.00 0.00 O ATOM 1804 CB GLN A 117 10.631 -14.278 2.067 1.00 0.00 C ATOM 1805 CG GLN A 117 9.472 -14.990 1.367 1.00 0.00 C ATOM 1806 CD GLN A 117 9.869 -15.428 -0.044 1.00 0.00 C ATOM 1807 OE1 GLN A 117 9.217 -15.113 -1.027 1.00 0.00 O ATOM 1808 NE2 GLN A 117 10.973 -16.168 -0.091 1.00 0.00 N ATOM 0 H GLN A 117 10.112 -12.293 3.458 1.00 0.00 H new ATOM 0 HA GLN A 117 9.660 -15.035 3.807 1.00 0.00 H new ATOM 0 HB2 GLN A 117 10.666 -13.235 1.751 1.00 0.00 H new ATOM 0 HB3 GLN A 117 11.575 -14.733 1.769 1.00 0.00 H new ATOM 0 HG2 GLN A 117 9.170 -15.860 1.950 1.00 0.00 H new ATOM 0 HG3 GLN A 117 8.610 -14.325 1.316 1.00 0.00 H new ATOM 0 HE21 GLN A 117 11.471 -16.396 0.769 1.00 0.00 H new ATOM 0 HE22 GLN A 117 11.321 -16.508 -0.987 1.00 0.00 H new ATOM 1817 N ASN A 118 11.671 -15.100 5.546 1.00 0.00 N ATOM 1818 CA ASN A 118 12.802 -15.616 6.296 1.00 0.00 C ATOM 1819 C ASN A 118 12.296 -16.309 7.561 1.00 0.00 C ATOM 1820 O ASN A 118 12.752 -17.400 7.900 1.00 0.00 O ATOM 1821 CB ASN A 118 13.744 -14.486 6.720 1.00 0.00 C ATOM 1822 CG ASN A 118 15.192 -14.974 6.783 1.00 0.00 C ATOM 1823 OD1 ASN A 118 15.575 -15.754 7.639 1.00 0.00 O ATOM 1824 ND2 ASN A 118 15.974 -14.471 5.832 1.00 0.00 N ATOM 0 H ASN A 118 10.838 -14.916 6.105 1.00 0.00 H new ATOM 0 HA ASN A 118 13.341 -16.314 5.655 1.00 0.00 H new ATOM 0 HB2 ASN A 118 13.666 -13.659 6.015 1.00 0.00 H new ATOM 0 HB3 ASN A 118 13.443 -14.103 7.695 1.00 0.00 H new ATOM 0 HD21 ASN A 118 16.959 -14.734 5.789 1.00 0.00 H new ATOM 0 HD22 ASN A 118 15.589 -13.822 5.146 1.00 0.00 H new ATOM 1831 N ARG A 119 11.360 -15.649 8.227 1.00 0.00 N ATOM 1832 CA ARG A 119 10.787 -16.189 9.448 1.00 0.00 C ATOM 1833 C ARG A 119 9.259 -16.194 9.360 1.00 0.00 C ATOM 1834 O ARG A 119 8.694 -15.961 8.292 1.00 0.00 O ATOM 1835 CB ARG A 119 11.218 -15.372 10.667 1.00 0.00 C ATOM 1836 CG ARG A 119 11.358 -16.262 11.903 1.00 0.00 C ATOM 1837 CD ARG A 119 12.778 -16.196 12.469 1.00 0.00 C ATOM 1838 NE ARG A 119 13.235 -17.552 12.850 1.00 0.00 N ATOM 1839 CZ ARG A 119 14.256 -17.793 13.682 1.00 0.00 C ATOM 1840 NH1 ARG A 119 14.934 -16.772 14.226 1.00 0.00 N ATOM 1841 NH2 ARG A 119 14.600 -19.055 13.972 1.00 0.00 N ATOM 0 H ARG A 119 10.984 -14.744 7.944 1.00 0.00 H new ATOM 0 HA ARG A 119 11.151 -17.210 9.562 1.00 0.00 H new ATOM 0 HB2 ARG A 119 12.168 -14.878 10.461 1.00 0.00 H new ATOM 0 HB3 ARG A 119 10.486 -14.588 10.860 1.00 0.00 H new ATOM 0 HG2 ARG A 119 10.644 -15.948 12.665 1.00 0.00 H new ATOM 0 HG3 ARG A 119 11.114 -17.292 11.643 1.00 0.00 H new ATOM 0 HD2 ARG A 119 13.454 -15.770 11.728 1.00 0.00 H new ATOM 0 HD3 ARG A 119 12.802 -15.538 13.338 1.00 0.00 H new ATOM 0 HE ARG A 119 12.741 -18.352 12.454 1.00 0.00 H new ATOM 0 HH11 ARG A 119 14.672 -15.811 14.006 1.00 0.00 H new ATOM 0 HH12 ARG A 119 15.712 -16.956 14.860 1.00 0.00 H new ATOM 0 HH21 ARG A 119 14.084 -19.832 13.559 1.00 0.00 H new ATOM 0 HH22 ARG A 119 15.378 -19.239 14.606 1.00 0.00 H new ATOM 1855 N ASP A 120 8.635 -16.463 10.497 1.00 0.00 N ATOM 1856 CA ASP A 120 7.183 -16.503 10.562 1.00 0.00 C ATOM 1857 C ASP A 120 6.664 -15.162 11.085 1.00 0.00 C ATOM 1858 O ASP A 120 6.701 -14.903 12.287 1.00 0.00 O ATOM 1859 CB ASP A 120 6.704 -17.600 11.515 1.00 0.00 C ATOM 1860 CG ASP A 120 5.224 -17.966 11.387 1.00 0.00 C ATOM 1861 OD1 ASP A 120 4.791 -18.187 10.235 1.00 0.00 O ATOM 1862 OD2 ASP A 120 4.558 -18.016 12.444 1.00 0.00 O ATOM 0 H ASP A 120 9.107 -16.655 11.380 1.00 0.00 H new ATOM 0 HA ASP A 120 6.806 -16.707 9.560 1.00 0.00 H new ATOM 0 HB2 ASP A 120 7.301 -18.496 11.343 1.00 0.00 H new ATOM 0 HB3 ASP A 120 6.897 -17.280 12.539 1.00 0.00 H new ATOM 1867 N LEU A 121 6.192 -14.344 10.156 1.00 0.00 N ATOM 1868 CA LEU A 121 5.666 -13.036 10.508 1.00 0.00 C ATOM 1869 C LEU A 121 4.141 -13.110 10.595 1.00 0.00 C ATOM 1870 O LEU A 121 3.461 -12.087 10.543 1.00 0.00 O ATOM 1871 CB LEU A 121 6.175 -11.974 9.531 1.00 0.00 C ATOM 1872 CG LEU A 121 6.149 -10.529 10.037 1.00 0.00 C ATOM 1873 CD1 LEU A 121 7.568 -9.989 10.223 1.00 0.00 C ATOM 1874 CD2 LEU A 121 5.312 -9.641 9.115 1.00 0.00 C ATOM 0 H LEU A 121 6.163 -14.562 9.160 1.00 0.00 H new ATOM 0 HA LEU A 121 6.027 -12.732 11.491 1.00 0.00 H new ATOM 0 HB2 LEU A 121 7.200 -12.223 9.256 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.578 -12.030 8.621 1.00 0.00 H new ATOM 0 HG LEU A 121 5.670 -10.517 11.016 1.00 0.00 H new ATOM 0 HD11 LEU A 121 7.522 -8.961 10.583 1.00 0.00 H new ATOM 0 HD12 LEU A 121 8.099 -10.604 10.949 1.00 0.00 H new ATOM 0 HD13 LEU A 121 8.096 -10.016 9.270 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.310 -8.620 9.497 1.00 0.00 H new ATOM 0 HD22 LEU A 121 5.739 -9.653 8.112 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.289 -10.017 9.078 1.00 0.00 H new ATOM 1886 N SER A 122 3.646 -14.333 10.724 1.00 0.00 N ATOM 1887 CA SER A 122 2.214 -14.556 10.819 1.00 0.00 C ATOM 1888 C SER A 122 1.704 -14.106 12.190 1.00 0.00 C ATOM 1889 O SER A 122 0.506 -13.895 12.372 1.00 0.00 O ATOM 1890 CB SER A 122 1.867 -16.027 10.580 1.00 0.00 C ATOM 1891 OG SER A 122 1.715 -16.320 9.194 1.00 0.00 O ATOM 0 H SER A 122 4.213 -15.180 10.765 1.00 0.00 H new ATOM 0 HA SER A 122 1.725 -13.966 10.044 1.00 0.00 H new ATOM 0 HB2 SER A 122 2.651 -16.657 11.000 1.00 0.00 H new ATOM 0 HB3 SER A 122 0.944 -16.272 11.106 1.00 0.00 H new ATOM 0 HG SER A 122 1.496 -17.269 9.082 1.00 0.00 H new ATOM 1897 N GLN A 123 2.640 -13.975 13.120 1.00 0.00 N ATOM 1898 CA GLN A 123 2.300 -13.556 14.469 1.00 0.00 C ATOM 1899 C GLN A 123 2.040 -12.049 14.506 1.00 0.00 C ATOM 1900 O GLN A 123 1.558 -11.523 15.509 1.00 0.00 O ATOM 1901 CB GLN A 123 3.399 -13.948 15.458 1.00 0.00 C ATOM 1902 CG GLN A 123 2.945 -13.720 16.901 1.00 0.00 C ATOM 1903 CD GLN A 123 4.047 -14.106 17.890 1.00 0.00 C ATOM 1904 OE1 GLN A 123 5.168 -14.418 17.520 1.00 0.00 O ATOM 1905 NE2 GLN A 123 3.668 -14.066 19.164 1.00 0.00 N ATOM 0 H GLN A 123 3.633 -14.152 12.965 1.00 0.00 H new ATOM 0 HA GLN A 123 1.387 -14.070 14.770 1.00 0.00 H new ATOM 0 HB2 GLN A 123 3.663 -14.996 15.317 1.00 0.00 H new ATOM 0 HB3 GLN A 123 4.297 -13.364 15.259 1.00 0.00 H new ATOM 0 HG2 GLN A 123 2.677 -12.673 17.040 1.00 0.00 H new ATOM 0 HG3 GLN A 123 2.049 -14.308 17.101 1.00 0.00 H new ATOM 0 HE21 GLN A 123 2.714 -13.796 19.404 1.00 0.00 H new ATOM 0 HE22 GLN A 123 4.331 -14.305 19.901 1.00 0.00 H new ATOM 1914 N TYR A 124 2.372 -11.395 13.402 1.00 0.00 N ATOM 1915 CA TYR A 124 2.182 -9.959 13.297 1.00 0.00 C ATOM 1916 C TYR A 124 0.706 -9.616 13.084 1.00 0.00 C ATOM 1917 O TYR A 124 0.246 -8.555 13.501 1.00 0.00 O ATOM 1918 CB TYR A 124 2.978 -9.517 12.067 1.00 0.00 C ATOM 1919 CG TYR A 124 3.711 -8.187 12.246 1.00 0.00 C ATOM 1920 CD1 TYR A 124 4.432 -7.945 13.398 1.00 0.00 C ATOM 1921 CD2 TYR A 124 3.653 -7.228 11.255 1.00 0.00 C ATOM 1922 CE1 TYR A 124 5.122 -6.693 13.566 1.00 0.00 C ATOM 1923 CE2 TYR A 124 4.343 -5.976 11.423 1.00 0.00 C ATOM 1924 CZ TYR A 124 5.044 -5.770 12.571 1.00 0.00 C ATOM 1925 OH TYR A 124 5.697 -4.587 12.729 1.00 0.00 O ATOM 0 H TYR A 124 2.772 -11.834 12.573 1.00 0.00 H new ATOM 0 HA TYR A 124 2.510 -9.461 14.209 1.00 0.00 H new ATOM 0 HB2 TYR A 124 3.705 -10.291 11.820 1.00 0.00 H new ATOM 0 HB3 TYR A 124 2.299 -9.435 11.218 1.00 0.00 H new ATOM 0 HD1 TYR A 124 4.478 -8.695 14.173 1.00 0.00 H new ATOM 0 HD2 TYR A 124 3.090 -7.417 10.353 1.00 0.00 H new ATOM 0 HE1 TYR A 124 5.689 -6.491 14.463 1.00 0.00 H new ATOM 0 HE2 TYR A 124 4.305 -5.217 10.655 1.00 0.00 H new ATOM 0 HH TYR A 124 5.084 -3.847 12.536 1.00 0.00 H new ATOM 1935 N ILE A 125 0.005 -10.535 12.436 1.00 0.00 N ATOM 1936 CA ILE A 125 -1.409 -10.344 12.163 1.00 0.00 C ATOM 1937 C ILE A 125 -2.232 -11.100 13.207 1.00 0.00 C ATOM 1938 O ILE A 125 -3.224 -10.580 13.717 1.00 0.00 O ATOM 1939 CB ILE A 125 -1.734 -10.736 10.721 1.00 0.00 C ATOM 1940 CG1 ILE A 125 -1.047 -12.049 10.341 1.00 0.00 C ATOM 1941 CG2 ILE A 125 -1.384 -9.604 9.752 1.00 0.00 C ATOM 1942 CD1 ILE A 125 -1.598 -12.596 9.024 1.00 0.00 C ATOM 0 H ILE A 125 0.391 -11.414 12.092 1.00 0.00 H new ATOM 0 HA ILE A 125 -1.675 -9.290 12.249 1.00 0.00 H new ATOM 0 HB ILE A 125 -2.809 -10.902 10.647 1.00 0.00 H new ATOM 0 HG12 ILE A 125 0.027 -11.888 10.251 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -1.194 -12.783 11.133 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -1.625 -9.909 8.734 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -1.958 -8.714 10.010 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -0.319 -9.382 9.822 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -1.092 -13.530 8.778 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -2.668 -12.779 9.125 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.427 -11.870 8.229 1.00 0.00 H new ATOM 1954 N ARG A 126 -1.791 -12.316 13.494 1.00 0.00 N ATOM 1955 CA ARG A 126 -2.475 -13.150 14.469 1.00 0.00 C ATOM 1956 C ARG A 126 -2.469 -12.475 15.842 1.00 0.00 C ATOM 1957 O ARG A 126 -1.444 -12.454 16.522 1.00 0.00 O ATOM 1958 CB ARG A 126 -1.812 -14.524 14.580 1.00 0.00 C ATOM 1959 CG ARG A 126 -2.589 -15.432 15.534 1.00 0.00 C ATOM 1960 CD ARG A 126 -3.229 -16.600 14.781 1.00 0.00 C ATOM 1961 NE ARG A 126 -2.471 -17.845 15.039 1.00 0.00 N ATOM 1962 CZ ARG A 126 -2.460 -18.903 14.216 1.00 0.00 C ATOM 1963 NH1 ARG A 126 -3.166 -18.874 13.079 1.00 0.00 N ATOM 1964 NH2 ARG A 126 -1.743 -19.991 14.532 1.00 0.00 N ATOM 0 H ARG A 126 -0.969 -12.744 13.069 1.00 0.00 H new ATOM 0 HA ARG A 126 -3.503 -13.282 14.130 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -1.759 -14.987 13.595 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -0.788 -14.410 14.934 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -1.919 -15.815 16.304 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -3.362 -14.855 16.042 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -4.265 -16.723 15.097 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -3.245 -16.389 13.712 1.00 0.00 H new ATOM 0 HE ARG A 126 -1.922 -17.901 15.897 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -3.712 -18.047 12.839 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -3.158 -19.679 12.453 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -1.206 -20.014 15.399 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -1.735 -20.796 13.906 1.00 0.00 H new ATOM 1978 N ASN A 127 -3.625 -11.942 16.210 1.00 0.00 N ATOM 1979 CA ASN A 127 -3.765 -11.268 17.489 1.00 0.00 C ATOM 1980 C ASN A 127 -5.020 -10.394 17.466 1.00 0.00 C ATOM 1981 O ASN A 127 -5.623 -10.139 18.507 1.00 0.00 O ATOM 1982 CB ASN A 127 -2.564 -10.363 17.770 1.00 0.00 C ATOM 1983 CG ASN A 127 -1.806 -10.830 19.015 1.00 0.00 C ATOM 1984 OD1 ASN A 127 -1.617 -12.012 19.252 1.00 0.00 O ATOM 1985 ND2 ASN A 127 -1.384 -9.838 19.794 1.00 0.00 N ATOM 0 H ASN A 127 -4.473 -11.963 15.644 1.00 0.00 H new ATOM 0 HA ASN A 127 -3.831 -12.030 18.265 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -1.894 -10.364 16.910 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -2.902 -9.336 17.909 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -0.868 -10.045 20.649 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -1.576 -8.870 19.536 1.00 0.00 H new ATOM 1992 N CYS A 128 -5.378 -9.960 16.266 1.00 0.00 N ATOM 1993 CA CYS A 128 -6.550 -9.119 16.093 1.00 0.00 C ATOM 1994 C CYS A 128 -7.796 -9.986 16.290 1.00 0.00 C ATOM 1995 O CYS A 128 -8.858 -9.480 16.649 1.00 0.00 O ATOM 1996 CB CYS A 128 -6.550 -8.421 14.732 1.00 0.00 C ATOM 1997 SG CYS A 128 -7.016 -6.652 14.777 1.00 0.00 S ATOM 0 H CYS A 128 -4.877 -10.175 15.404 1.00 0.00 H new ATOM 0 HA CYS A 128 -6.542 -8.322 16.836 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -5.556 -8.509 14.294 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -7.238 -8.947 14.070 1.00 0.00 H new ATOM 2002 N GLY A 129 -7.623 -11.277 16.047 1.00 0.00 N ATOM 2003 CA GLY A 129 -8.720 -12.219 16.193 1.00 0.00 C ATOM 2004 C GLY A 129 -9.163 -12.760 14.832 1.00 0.00 C ATOM 2005 O GLY A 129 -10.337 -13.072 14.637 1.00 0.00 O ATOM 0 H GLY A 129 -6.740 -11.693 15.750 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -8.412 -13.045 16.834 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -9.561 -11.730 16.685 1.00 0.00 H new ATOM 2009 N VAL A 130 -8.201 -12.854 13.928 1.00 0.00 N ATOM 2010 CA VAL A 130 -8.477 -13.354 12.591 1.00 0.00 C ATOM 2011 C VAL A 130 -8.285 -14.871 12.567 1.00 0.00 C ATOM 2012 O VAL A 130 -8.865 -15.586 13.382 1.00 0.00 O ATOM 2013 CB VAL A 130 -7.601 -12.624 11.569 1.00 0.00 C ATOM 2014 CG1 VAL A 130 -7.607 -13.352 10.223 1.00 0.00 C ATOM 2015 CG2 VAL A 130 -8.044 -11.169 11.407 1.00 0.00 C ATOM 0 H VAL A 130 -7.229 -12.593 14.094 1.00 0.00 H new ATOM 0 HA VAL A 130 -9.512 -13.154 12.315 1.00 0.00 H new ATOM 0 HB VAL A 130 -6.578 -12.623 11.945 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -6.977 -12.813 9.515 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -7.222 -14.363 10.355 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -8.626 -13.399 9.839 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -7.405 -10.674 10.676 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -9.078 -11.140 11.065 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -7.964 -10.656 12.365 1.00 0.00 H new TER 2025 VAL A 130