USER MOD reduce.3.24.130724 H: found=0, std=0, add=975, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 0 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 128 ASN : amide:sc= -0.187 K(o=-0.1,f=-5.3!) USER MOD Set 1.2: A 130 SER OG : rot -160:sc= 0.0879 USER MOD Set 2.1: A 81 MET CE :methyl -176:sc= -1.39 (180deg=-1.46) USER MOD Set 2.2: A 115 LYS NZ :NH3+ -108:sc= 0.336 (180deg=-0.785) USER MOD Set 3.1: A 29 TYR OH : rot -152:sc= 0.723 USER MOD Set 3.2: A 31 SER OG : rot 51:sc= 2.41! USER MOD Set 3.3: A 108 TYR OH : rot -23:sc= 1.22 USER MOD Set 4.1: A 90 SER OG : rot -64:sc= 0.354 USER MOD Set 4.2: A 92 THR OG1 : rot 21:sc= 0.069 USER MOD Set 4.3: A 94 ASN : amide:sc= 0.0861 K(o=0.51,f=-7.7!) USER MOD Set 5.1: A 72 SER OG : rot -104:sc= -1.5! USER MOD Set 5.2: A 75 THR OG1 : rot -7:sc= 1.11 USER MOD Single : A 30 CYS SG : rot -101:sc= -0.867 USER MOD Single : A 32 ASN : amide:sc= -1.33 K(o=-1.3,f=-2.3!) USER MOD Single : A 35 HIS : +bothHN:sc= 0.7 K(o=0.7,f=-3.3!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0715 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -1.04 K(o=-1,f=-2) USER MOD Single : A 55 HIS : no HD1:sc= -0.947 K(o=-0.95,f=-5.9!) USER MOD Single : A 57 GLN : amide:sc= 1.19 K(o=1.2,f=-0.079) USER MOD Single : A 59 GLN : amide:sc= -0.0332 K(o=-0.033,f=-2.2) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc=-0.000631 USER MOD Single : A 69 TYR OH : rot -43:sc= 0.574 USER MOD Single : A 71 LYS NZ :NH3+ 175:sc= -0.0822 (180deg=-0.12) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -0.863 K(o=-0.86,f=-1.6!) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.117 USER MOD Single : A 88 TYR OH : rot -145:sc= 0.0879 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 CYS SG : rot -28:sc= -2.92! USER MOD Single : A 106 ASN : amide:sc= 0.41 K(o=0.41,f=-7.5!) USER MOD Single : A 107 HIS : no HE2:sc= -0.303 K(o=-0.3,f=-2.6) USER MOD Single : A 109 ASN : amide:sc= -0.683 K(o=-0.68,f=-7.4!) USER MOD Single : A 110 THR OG1 : rot -41:sc= 0.775 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 107:sc= 0.211 USER MOD Single : A 114 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0221) USER MOD Single : A 116 HIS : no HE2:sc= 0.147 K(o=0.15,f=-3.3!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc=-0.00864 X(o=-0.0086,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 158:sc= -0.072 (180deg=-0.54) USER MOD Single : A 131 CYS SG : rot -160:sc= -0.0926 USER MOD Single : A 132 LYS NZ :NH3+ -120:sc= 0 (180deg=-0.164) USER MOD Single : A 137 THR OG1 : rot 34:sc= -0.734 USER MOD Single : A 138 HIS : +bothHN:sc= 0.178 K(o=0.18,f=-0.89) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= -0.661 K(o=-0.66,f=-1.2) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 11 N ALA A 26 1.795 -5.265 11.258 1.00 0.00 N ATOM 12 CA ALA A 26 2.376 -5.572 9.941 1.00 0.00 C ATOM 13 C ALA A 26 3.047 -4.342 9.320 1.00 0.00 C ATOM 14 O ALA A 26 2.648 -3.205 9.572 1.00 0.00 O ATOM 15 CB ALA A 26 1.338 -6.206 9.011 1.00 0.00 C ATOM 0 HA ALA A 26 3.163 -6.312 10.087 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.797 -6.421 8.046 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.971 -7.132 9.453 1.00 0.00 H new ATOM 0 HB3 ALA A 26 0.506 -5.516 8.871 1.00 0.00 H new ATOM 16 N LEU A 27 4.098 -4.619 8.588 1.00 0.00 N ATOM 17 CA LEU A 27 4.967 -3.580 8.009 1.00 0.00 C ATOM 18 C LEU A 27 5.297 -3.927 6.549 1.00 0.00 C ATOM 19 O LEU A 27 5.462 -5.097 6.210 1.00 0.00 O ATOM 20 CB LEU A 27 6.192 -3.515 8.932 1.00 0.00 C ATOM 21 CG LEU A 27 7.359 -2.661 8.442 1.00 0.00 C ATOM 22 CD1 LEU A 27 7.028 -1.178 8.482 1.00 0.00 C ATOM 23 CD2 LEU A 27 8.565 -2.915 9.351 1.00 0.00 C ATOM 0 H LEU A 27 4.391 -5.571 8.366 1.00 0.00 H new ATOM 0 HA LEU A 27 4.499 -2.597 7.960 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.871 -3.133 9.901 1.00 0.00 H new ATOM 0 HB3 LEU A 27 6.554 -4.530 9.093 1.00 0.00 H new ATOM 0 HG LEU A 27 7.573 -2.936 7.409 1.00 0.00 H new ATOM 0 HD11 LEU A 27 7.884 -0.604 8.126 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.167 -0.980 7.843 1.00 0.00 H new ATOM 0 HD13 LEU A 27 6.795 -0.885 9.506 1.00 0.00 H new ATOM 0 HD21 LEU A 27 9.408 -2.312 9.014 1.00 0.00 H new ATOM 0 HD22 LEU A 27 8.312 -2.644 10.376 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.835 -3.970 9.311 1.00 0.00 H new ATOM 24 N LEU A 28 5.289 -2.898 5.703 1.00 0.00 N ATOM 25 CA LEU A 28 5.399 -3.082 4.247 1.00 0.00 C ATOM 26 C LEU A 28 6.585 -2.309 3.655 1.00 0.00 C ATOM 27 O LEU A 28 6.566 -1.083 3.550 1.00 0.00 O ATOM 28 CB LEU A 28 4.090 -2.592 3.643 1.00 0.00 C ATOM 29 CG LEU A 28 3.799 -3.116 2.229 1.00 0.00 C ATOM 30 CD1 LEU A 28 3.750 -4.649 2.157 1.00 0.00 C ATOM 31 CD2 LEU A 28 2.456 -2.554 1.752 1.00 0.00 C ATOM 0 H LEU A 28 5.208 -1.924 5.996 1.00 0.00 H new ATOM 0 HA LEU A 28 5.578 -4.133 4.018 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.271 -2.885 4.300 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.104 -1.502 3.616 1.00 0.00 H new ATOM 0 HG LEU A 28 4.617 -2.786 1.589 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.541 -4.959 1.133 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.710 -5.059 2.471 1.00 0.00 H new ATOM 0 HD13 LEU A 28 2.964 -5.019 2.816 1.00 0.00 H new ATOM 0 HD21 LEU A 28 2.243 -2.922 0.748 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.666 -2.874 2.431 1.00 0.00 H new ATOM 0 HD23 LEU A 28 2.502 -1.465 1.737 1.00 0.00 H new ATOM 32 N TYR A 29 7.584 -3.079 3.239 1.00 0.00 N ATOM 33 CA TYR A 29 8.774 -2.550 2.550 1.00 0.00 C ATOM 34 C TYR A 29 8.494 -2.447 1.051 1.00 0.00 C ATOM 35 O TYR A 29 7.665 -3.185 0.520 1.00 0.00 O ATOM 36 CB TYR A 29 9.920 -3.510 2.880 1.00 0.00 C ATOM 37 CG TYR A 29 11.115 -3.467 1.939 1.00 0.00 C ATOM 38 CD1 TYR A 29 12.033 -2.387 1.966 1.00 0.00 C ATOM 39 CD2 TYR A 29 11.228 -4.519 1.000 1.00 0.00 C ATOM 40 CE1 TYR A 29 13.069 -2.360 1.008 1.00 0.00 C ATOM 41 CE2 TYR A 29 12.253 -4.493 0.053 1.00 0.00 C ATOM 42 CZ TYR A 29 13.151 -3.407 0.050 1.00 0.00 C ATOM 43 OH TYR A 29 14.008 -3.294 -1.004 1.00 0.00 O ATOM 0 H TYR A 29 7.600 -4.091 3.366 1.00 0.00 H new ATOM 0 HA TYR A 29 9.039 -1.544 2.876 1.00 0.00 H new ATOM 0 HB2 TYR A 29 10.269 -3.294 3.890 1.00 0.00 H new ATOM 0 HB3 TYR A 29 9.526 -4.526 2.889 1.00 0.00 H new ATOM 0 HD1 TYR A 29 11.942 -1.603 2.703 1.00 0.00 H new ATOM 0 HD2 TYR A 29 10.525 -5.338 1.016 1.00 0.00 H new ATOM 0 HE1 TYR A 29 13.789 -1.555 1.003 1.00 0.00 H new ATOM 0 HE2 TYR A 29 12.356 -5.292 -0.666 1.00 0.00 H new ATOM 0 HH TYR A 29 13.661 -3.805 -1.764 1.00 0.00 H new ATOM 44 N CYS A 30 9.201 -1.554 0.389 1.00 0.00 N ATOM 45 CA CYS A 30 9.075 -1.343 -1.076 1.00 0.00 C ATOM 46 C CYS A 30 10.451 -1.430 -1.735 1.00 0.00 C ATOM 47 O CYS A 30 11.322 -0.595 -1.491 1.00 0.00 O ATOM 48 CB CYS A 30 8.470 0.040 -1.310 1.00 0.00 C ATOM 49 SG CYS A 30 7.031 0.444 -0.247 1.00 0.00 S ATOM 0 H CYS A 30 9.886 -0.943 0.834 1.00 0.00 H new ATOM 0 HA CYS A 30 8.435 -2.110 -1.512 1.00 0.00 H new ATOM 0 HB2 CYS A 30 9.244 0.791 -1.150 1.00 0.00 H new ATOM 0 HB3 CYS A 30 8.165 0.115 -2.354 1.00 0.00 H new ATOM 0 HG CYS A 30 5.933 0.295 -0.928 1.00 0.00 H new ATOM 50 N SER A 31 10.515 -2.319 -2.713 1.00 0.00 N ATOM 51 CA SER A 31 11.735 -2.567 -3.527 1.00 0.00 C ATOM 52 C SER A 31 11.814 -1.681 -4.775 1.00 0.00 C ATOM 53 O SER A 31 12.627 -1.892 -5.672 1.00 0.00 O ATOM 54 CB SER A 31 11.865 -4.032 -3.953 1.00 0.00 C ATOM 55 OG SER A 31 12.463 -4.800 -2.905 1.00 0.00 O ATOM 0 H SER A 31 9.724 -2.904 -2.981 1.00 0.00 H new ATOM 0 HA SER A 31 12.563 -2.310 -2.866 1.00 0.00 H new ATOM 0 HB2 SER A 31 10.882 -4.437 -4.195 1.00 0.00 H new ATOM 0 HB3 SER A 31 12.470 -4.103 -4.857 1.00 0.00 H new ATOM 0 HG SER A 31 11.986 -4.635 -2.065 1.00 0.00 H new ATOM 56 N ASN A 32 11.051 -0.590 -4.715 1.00 0.00 N ATOM 57 CA ASN A 32 10.997 0.485 -5.720 1.00 0.00 C ATOM 58 C ASN A 32 12.268 1.364 -5.817 1.00 0.00 C ATOM 59 O ASN A 32 12.307 2.353 -6.542 1.00 0.00 O ATOM 60 CB ASN A 32 9.807 1.376 -5.353 1.00 0.00 C ATOM 61 CG ASN A 32 10.071 2.253 -4.123 1.00 0.00 C ATOM 62 OD1 ASN A 32 10.538 1.809 -3.076 1.00 0.00 O ATOM 63 ND2 ASN A 32 9.825 3.537 -4.226 1.00 0.00 N ATOM 0 H ASN A 32 10.423 -0.418 -3.930 1.00 0.00 H new ATOM 0 HA ASN A 32 10.906 0.009 -6.696 1.00 0.00 H new ATOM 0 HB2 ASN A 32 9.563 2.015 -6.202 1.00 0.00 H new ATOM 0 HB3 ASN A 32 8.935 0.749 -5.165 1.00 0.00 H new ATOM 0 HD21 ASN A 32 10.021 4.158 -3.441 1.00 0.00 H new ATOM 0 HD22 ASN A 32 9.438 3.914 -5.091 1.00 0.00 H new ATOM 64 N GLY A 33 13.336 0.888 -5.176 1.00 0.00 N ATOM 65 CA GLY A 33 14.530 1.675 -4.834 1.00 0.00 C ATOM 66 C GLY A 33 14.941 1.282 -3.409 1.00 0.00 C ATOM 67 O GLY A 33 15.918 0.549 -3.229 1.00 0.00 O ATOM 0 H GLY A 33 13.400 -0.083 -4.870 1.00 0.00 H new ATOM 0 HA2 GLY A 33 15.338 1.473 -5.537 1.00 0.00 H new ATOM 0 HA3 GLY A 33 14.317 2.742 -4.892 1.00 0.00 H new ATOM 68 N GLY A 34 14.087 1.648 -2.465 1.00 0.00 N ATOM 69 CA GLY A 34 14.245 1.276 -1.045 1.00 0.00 C ATOM 70 C GLY A 34 13.504 2.225 -0.113 1.00 0.00 C ATOM 71 O GLY A 34 14.102 3.111 0.498 1.00 0.00 O ATOM 0 H GLY A 34 13.259 2.213 -2.651 1.00 0.00 H new ATOM 0 HA2 GLY A 34 13.877 0.261 -0.894 1.00 0.00 H new ATOM 0 HA3 GLY A 34 15.304 1.272 -0.789 1.00 0.00 H new ATOM 72 N HIS A 35 12.185 2.068 -0.104 1.00 0.00 N ATOM 73 CA HIS A 35 11.310 2.744 0.864 1.00 0.00 C ATOM 74 C HIS A 35 10.406 1.724 1.576 1.00 0.00 C ATOM 75 O HIS A 35 10.585 0.516 1.443 1.00 0.00 O ATOM 76 CB HIS A 35 10.415 3.831 0.251 1.00 0.00 C ATOM 77 CG HIS A 35 11.150 5.039 -0.348 1.00 0.00 C ATOM 78 ND1 HIS A 35 12.336 5.483 0.019 1.00 0.00 N ATOM 79 CD2 HIS A 35 10.687 5.875 -1.274 1.00 0.00 C ATOM 80 CE1 HIS A 35 12.628 6.575 -0.665 1.00 0.00 C ATOM 81 NE2 HIS A 35 11.601 6.823 -1.463 1.00 0.00 N ATOM 0 H HIS A 35 11.687 1.471 -0.764 1.00 0.00 H new ATOM 0 HA HIS A 35 11.987 3.233 1.564 1.00 0.00 H new ATOM 0 HB2 HIS A 35 9.805 3.376 -0.530 1.00 0.00 H new ATOM 0 HB3 HIS A 35 9.732 4.190 1.021 1.00 0.00 H new ATOM 0 HD1 HIS A 35 12.935 5.050 0.722 1.00 0.00 H new ATOM 0 HD2 HIS A 35 9.737 5.798 -1.782 1.00 0.00 H new ATOM 0 HE1 HIS A 35 13.535 7.157 -0.588 1.00 0.00 H new ATOM 0 HE2 HIS A 35 11.524 7.607 -2.111 1.00 0.00 H new ATOM 82 N PHE A 36 9.698 2.251 2.558 1.00 0.00 N ATOM 83 CA PHE A 36 8.538 1.617 3.182 1.00 0.00 C ATOM 84 C PHE A 36 7.325 2.511 2.913 1.00 0.00 C ATOM 85 O PHE A 36 7.441 3.735 2.887 1.00 0.00 O ATOM 86 CB PHE A 36 8.723 1.592 4.694 1.00 0.00 C ATOM 87 CG PHE A 36 9.685 0.504 5.145 1.00 0.00 C ATOM 88 CD1 PHE A 36 11.082 0.688 4.939 1.00 0.00 C ATOM 89 CD2 PHE A 36 9.207 -0.641 5.806 1.00 0.00 C ATOM 90 CE1 PHE A 36 11.993 -0.300 5.385 1.00 0.00 C ATOM 91 CE2 PHE A 36 10.118 -1.629 6.252 1.00 0.00 C ATOM 92 CZ PHE A 36 11.494 -1.453 6.036 1.00 0.00 C ATOM 0 H PHE A 36 9.917 3.162 2.961 1.00 0.00 H new ATOM 0 HA PHE A 36 8.415 0.608 2.789 1.00 0.00 H new ATOM 0 HB2 PHE A 36 9.094 2.561 5.028 1.00 0.00 H new ATOM 0 HB3 PHE A 36 7.756 1.439 5.173 1.00 0.00 H new ATOM 0 HD1 PHE A 36 11.445 1.577 4.445 1.00 0.00 H new ATOM 0 HD2 PHE A 36 8.147 -0.767 5.973 1.00 0.00 H new ATOM 0 HE1 PHE A 36 13.055 -0.175 5.230 1.00 0.00 H new ATOM 0 HE2 PHE A 36 9.756 -2.513 6.756 1.00 0.00 H new ATOM 0 HZ PHE A 36 12.185 -2.212 6.373 1.00 0.00 H new ATOM 93 N LEU A 37 6.192 1.858 2.771 1.00 0.00 N ATOM 94 CA LEU A 37 4.894 2.549 2.782 1.00 0.00 C ATOM 95 C LEU A 37 4.758 3.247 4.150 1.00 0.00 C ATOM 96 O LEU A 37 5.245 2.698 5.143 1.00 0.00 O ATOM 97 CB LEU A 37 3.824 1.472 2.650 1.00 0.00 C ATOM 98 CG LEU A 37 2.521 2.101 2.166 1.00 0.00 C ATOM 99 CD1 LEU A 37 2.563 2.337 0.655 1.00 0.00 C ATOM 100 CD2 LEU A 37 1.349 1.197 2.521 1.00 0.00 C ATOM 0 H LEU A 37 6.130 0.848 2.646 1.00 0.00 H new ATOM 0 HA LEU A 37 4.801 3.281 1.980 1.00 0.00 H new ATOM 0 HB2 LEU A 37 4.151 0.704 1.949 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.668 0.981 3.610 1.00 0.00 H new ATOM 0 HG LEU A 37 2.395 3.064 2.660 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.624 2.786 0.331 1.00 0.00 H new ATOM 0 HD12 LEU A 37 3.388 3.007 0.414 1.00 0.00 H new ATOM 0 HD13 LEU A 37 2.707 1.386 0.142 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.421 1.651 2.173 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.480 0.227 2.042 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.305 1.065 3.602 1.00 0.00 H new ATOM 101 N ARG A 38 4.348 4.507 4.173 1.00 0.00 N ATOM 102 CA ARG A 38 4.133 5.196 5.466 1.00 0.00 C ATOM 103 C ARG A 38 2.965 6.174 5.467 1.00 0.00 C ATOM 104 O ARG A 38 2.882 7.083 4.652 1.00 0.00 O ATOM 105 CB ARG A 38 5.384 5.918 5.967 1.00 0.00 C ATOM 106 CG ARG A 38 5.534 5.516 7.436 1.00 0.00 C ATOM 107 CD ARG A 38 6.525 6.344 8.242 1.00 0.00 C ATOM 108 NE ARG A 38 6.045 7.736 8.332 1.00 0.00 N ATOM 109 CZ ARG A 38 6.641 8.758 8.937 1.00 0.00 C ATOM 110 NH1 ARG A 38 7.762 8.633 9.625 1.00 0.00 N ATOM 111 NH2 ARG A 38 6.042 9.930 8.933 1.00 0.00 N ATOM 0 H ARG A 38 4.158 5.071 3.345 1.00 0.00 H new ATOM 0 HA ARG A 38 3.886 4.383 6.149 1.00 0.00 H new ATOM 0 HB2 ARG A 38 6.262 5.627 5.390 1.00 0.00 H new ATOM 0 HB3 ARG A 38 5.280 6.998 5.865 1.00 0.00 H new ATOM 0 HG2 ARG A 38 4.557 5.582 7.915 1.00 0.00 H new ATOM 0 HG3 ARG A 38 5.840 4.471 7.480 1.00 0.00 H new ATOM 0 HD2 ARG A 38 6.640 5.922 9.241 1.00 0.00 H new ATOM 0 HD3 ARG A 38 7.507 6.317 7.770 1.00 0.00 H new ATOM 0 HE ARG A 38 5.154 7.937 7.878 1.00 0.00 H new ATOM 0 HH11 ARG A 38 8.209 7.720 9.710 1.00 0.00 H new ATOM 0 HH12 ARG A 38 8.180 9.449 10.071 1.00 0.00 H new ATOM 0 HH21 ARG A 38 5.139 10.040 8.472 1.00 0.00 H new ATOM 0 HH22 ARG A 38 6.481 10.729 9.391 1.00 0.00 H new ATOM 112 N ILE A 39 2.254 6.091 6.574 1.00 0.00 N ATOM 113 CA ILE A 39 1.016 6.848 6.810 1.00 0.00 C ATOM 114 C ILE A 39 1.187 7.997 7.810 1.00 0.00 C ATOM 115 O ILE A 39 1.744 7.843 8.897 1.00 0.00 O ATOM 116 CB ILE A 39 -0.113 5.882 7.194 1.00 0.00 C ATOM 117 CG1 ILE A 39 -1.451 6.621 7.345 1.00 0.00 C ATOM 118 CG2 ILE A 39 0.238 5.055 8.454 1.00 0.00 C ATOM 119 CD1 ILE A 39 -2.660 5.711 7.090 1.00 0.00 C ATOM 0 H ILE A 39 2.515 5.489 7.355 1.00 0.00 H new ATOM 0 HA ILE A 39 0.742 7.343 5.878 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.226 5.170 6.376 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.520 7.038 8.350 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.479 7.460 6.649 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.588 4.384 8.691 1.00 0.00 H new ATOM 0 HG22 ILE A 39 1.138 4.470 8.266 1.00 0.00 H new ATOM 0 HG23 ILE A 39 0.411 5.728 9.294 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.579 6.285 7.210 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.610 5.315 6.076 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.651 4.886 7.803 1.00 0.00 H new ATOM 120 N LEU A 40 0.691 9.145 7.375 1.00 0.00 N ATOM 121 CA LEU A 40 0.484 10.311 8.249 1.00 0.00 C ATOM 122 C LEU A 40 -0.904 10.221 8.888 1.00 0.00 C ATOM 123 O LEU A 40 -1.878 10.019 8.158 1.00 0.00 O ATOM 124 CB LEU A 40 0.568 11.572 7.395 1.00 0.00 C ATOM 125 CG LEU A 40 1.595 12.557 7.949 1.00 0.00 C ATOM 126 CD1 LEU A 40 3.023 12.008 7.835 1.00 0.00 C ATOM 127 CD2 LEU A 40 1.476 13.862 7.177 1.00 0.00 C ATOM 0 H LEU A 40 0.417 9.304 6.405 1.00 0.00 H new ATOM 0 HA LEU A 40 1.241 10.337 9.033 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.835 11.303 6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.411 12.050 7.354 1.00 0.00 H new ATOM 0 HG LEU A 40 1.393 12.719 9.008 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.726 12.736 8.239 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.101 11.078 8.397 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.258 11.820 6.787 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.203 14.579 7.559 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.669 13.678 6.120 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.471 14.266 7.297 1.00 0.00 H new ATOM 128 N PRO A 41 -1.004 10.428 10.217 1.00 0.00 N ATOM 129 CA PRO A 41 -2.289 10.412 10.958 1.00 0.00 C ATOM 130 C PRO A 41 -3.279 11.555 10.668 1.00 0.00 C ATOM 131 O PRO A 41 -4.014 12.015 11.534 1.00 0.00 O ATOM 132 CB PRO A 41 -1.883 10.328 12.432 1.00 0.00 C ATOM 133 CG PRO A 41 -0.502 10.975 12.478 1.00 0.00 C ATOM 134 CD PRO A 41 0.122 10.542 11.156 1.00 0.00 C ATOM 0 HA PRO A 41 -2.884 9.562 10.623 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.591 10.856 13.071 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -1.850 9.295 12.778 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -0.567 12.060 12.558 1.00 0.00 H new ATOM 0 HG3 PRO A 41 0.079 10.627 13.332 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.853 11.272 10.808 1.00 0.00 H new ATOM 0 HD3 PRO A 41 0.646 9.592 11.260 1.00 0.00 H new ATOM 135 N ASP A 42 -3.318 11.934 9.401 1.00 0.00 N ATOM 136 CA ASP A 42 -4.272 12.890 8.805 1.00 0.00 C ATOM 137 C ASP A 42 -4.330 12.687 7.276 1.00 0.00 C ATOM 138 O ASP A 42 -3.830 13.494 6.502 1.00 0.00 O ATOM 139 CB ASP A 42 -3.902 14.319 9.235 1.00 0.00 C ATOM 140 CG ASP A 42 -2.519 14.791 8.756 1.00 0.00 C ATOM 141 OD1 ASP A 42 -1.513 14.141 9.114 1.00 0.00 O ATOM 142 OD2 ASP A 42 -2.517 15.827 8.057 1.00 0.00 O ATOM 0 H ASP A 42 -2.656 11.572 8.715 1.00 0.00 H new ATOM 0 HA ASP A 42 -5.283 12.711 9.171 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.658 15.006 8.855 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -3.935 14.378 10.323 1.00 0.00 H new ATOM 143 N GLY A 43 -4.701 11.461 6.942 1.00 0.00 N ATOM 144 CA GLY A 43 -4.867 10.995 5.562 1.00 0.00 C ATOM 145 C GLY A 43 -3.537 10.593 4.883 1.00 0.00 C ATOM 146 O GLY A 43 -3.153 9.424 4.898 1.00 0.00 O ATOM 0 H GLY A 43 -4.901 10.740 7.635 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -5.543 10.140 5.554 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.342 11.782 4.976 1.00 0.00 H new ATOM 147 N THR A 44 -2.911 11.596 4.286 1.00 0.00 N ATOM 148 CA THR A 44 -1.701 11.525 3.432 1.00 0.00 C ATOM 149 C THR A 44 -0.745 10.353 3.698 1.00 0.00 C ATOM 150 O THR A 44 -0.036 10.313 4.701 1.00 0.00 O ATOM 151 CB THR A 44 -0.961 12.865 3.566 1.00 0.00 C ATOM 152 OG1 THR A 44 -1.923 13.930 3.552 1.00 0.00 O ATOM 153 CG2 THR A 44 0.038 13.070 2.426 1.00 0.00 C ATOM 0 H THR A 44 -3.246 12.554 4.383 1.00 0.00 H new ATOM 0 HA THR A 44 -2.050 11.335 2.417 1.00 0.00 H new ATOM 0 HB THR A 44 -0.406 12.861 4.504 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.461 14.790 3.639 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.543 14.028 2.553 1.00 0.00 H new ATOM 0 HG22 THR A 44 0.775 12.267 2.439 1.00 0.00 H new ATOM 0 HG23 THR A 44 -0.491 13.062 1.473 1.00 0.00 H new ATOM 154 N VAL A 45 -0.687 9.439 2.733 1.00 0.00 N ATOM 155 CA VAL A 45 0.285 8.329 2.773 1.00 0.00 C ATOM 156 C VAL A 45 1.419 8.649 1.787 1.00 0.00 C ATOM 157 O VAL A 45 1.220 9.117 0.665 1.00 0.00 O ATOM 158 CB VAL A 45 -0.335 6.961 2.420 1.00 0.00 C ATOM 159 CG1 VAL A 45 0.567 5.768 2.712 1.00 0.00 C ATOM 160 CG2 VAL A 45 -1.661 6.708 3.168 1.00 0.00 C ATOM 0 H VAL A 45 -1.295 9.437 1.914 1.00 0.00 H new ATOM 0 HA VAL A 45 0.652 8.245 3.796 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.495 7.033 1.344 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.054 4.847 2.435 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.488 5.858 2.135 1.00 0.00 H new ATOM 0 HG13 VAL A 45 0.806 5.744 3.775 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -2.058 5.733 2.886 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.482 6.730 4.243 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -2.381 7.483 2.904 1.00 0.00 H new ATOM 161 N ASP A 46 2.612 8.326 2.261 1.00 0.00 N ATOM 162 CA ASP A 46 3.908 8.580 1.611 1.00 0.00 C ATOM 163 C ASP A 46 4.822 7.326 1.628 1.00 0.00 C ATOM 164 O ASP A 46 4.386 6.246 2.020 1.00 0.00 O ATOM 165 CB ASP A 46 4.552 9.758 2.357 1.00 0.00 C ATOM 166 CG ASP A 46 4.826 9.509 3.854 1.00 0.00 C ATOM 167 OD1 ASP A 46 5.801 8.772 4.140 1.00 0.00 O ATOM 168 OD2 ASP A 46 4.036 10.037 4.652 1.00 0.00 O ATOM 0 H ASP A 46 2.718 7.853 3.158 1.00 0.00 H new ATOM 0 HA ASP A 46 3.764 8.820 0.557 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.493 10.008 1.867 1.00 0.00 H new ATOM 0 HB3 ASP A 46 3.902 10.628 2.262 1.00 0.00 H new ATOM 169 N GLY A 47 6.086 7.543 1.257 1.00 0.00 N ATOM 170 CA GLY A 47 7.147 6.514 1.278 1.00 0.00 C ATOM 171 C GLY A 47 8.334 7.017 2.118 1.00 0.00 C ATOM 172 O GLY A 47 8.723 8.182 2.017 1.00 0.00 O ATOM 0 H GLY A 47 6.414 8.451 0.927 1.00 0.00 H new ATOM 0 HA2 GLY A 47 6.759 5.585 1.697 1.00 0.00 H new ATOM 0 HA3 GLY A 47 7.474 6.293 0.262 1.00 0.00 H new ATOM 173 N THR A 48 8.952 6.075 2.816 1.00 0.00 N ATOM 174 CA THR A 48 10.030 6.371 3.785 1.00 0.00 C ATOM 175 C THR A 48 11.233 5.432 3.653 1.00 0.00 C ATOM 176 O THR A 48 11.087 4.223 3.758 1.00 0.00 O ATOM 177 CB THR A 48 9.505 6.431 5.221 1.00 0.00 C ATOM 178 OG1 THR A 48 10.544 6.926 6.066 1.00 0.00 O ATOM 179 CG2 THR A 48 8.945 5.121 5.788 1.00 0.00 C ATOM 0 H THR A 48 8.731 5.083 2.736 1.00 0.00 H new ATOM 0 HA THR A 48 10.398 7.365 3.532 1.00 0.00 H new ATOM 0 HB THR A 48 8.644 7.098 5.193 1.00 0.00 H new ATOM 0 HG1 THR A 48 10.220 6.971 6.990 1.00 0.00 H new ATOM 0 HG21 THR A 48 8.603 5.284 6.810 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.108 4.787 5.174 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.725 4.360 5.783 1.00 0.00 H new ATOM 180 N ARG A 49 12.423 6.017 3.542 1.00 0.00 N ATOM 181 CA ARG A 49 13.677 5.224 3.534 1.00 0.00 C ATOM 182 C ARG A 49 14.091 4.722 4.937 1.00 0.00 C ATOM 183 O ARG A 49 15.185 4.195 5.150 1.00 0.00 O ATOM 184 CB ARG A 49 14.833 5.954 2.823 1.00 0.00 C ATOM 185 CG ARG A 49 15.437 7.179 3.514 1.00 0.00 C ATOM 186 CD ARG A 49 14.735 8.498 3.185 1.00 0.00 C ATOM 187 NE ARG A 49 13.590 8.758 4.061 1.00 0.00 N ATOM 188 CZ ARG A 49 12.329 8.968 3.684 1.00 0.00 C ATOM 189 NH1 ARG A 49 11.959 8.843 2.410 1.00 0.00 N ATOM 190 NH2 ARG A 49 11.463 9.498 4.527 1.00 0.00 N ATOM 0 H ARG A 49 12.559 7.024 3.457 1.00 0.00 H new ATOM 0 HA ARG A 49 13.452 4.334 2.946 1.00 0.00 H new ATOM 0 HB2 ARG A 49 15.634 5.233 2.660 1.00 0.00 H new ATOM 0 HB3 ARG A 49 14.478 6.265 1.840 1.00 0.00 H new ATOM 0 HG2 ARG A 49 15.407 7.024 4.593 1.00 0.00 H new ATOM 0 HG3 ARG A 49 16.487 7.260 3.232 1.00 0.00 H new ATOM 0 HD2 ARG A 49 15.449 9.317 3.272 1.00 0.00 H new ATOM 0 HD3 ARG A 49 14.398 8.478 2.149 1.00 0.00 H new ATOM 0 HE ARG A 49 13.777 8.781 5.063 1.00 0.00 H new ATOM 0 HH11 ARG A 49 12.646 8.582 1.703 1.00 0.00 H new ATOM 0 HH12 ARG A 49 10.989 9.008 2.142 1.00 0.00 H new ATOM 0 HH21 ARG A 49 11.758 9.748 5.471 1.00 0.00 H new ATOM 0 HH22 ARG A 49 10.499 9.657 4.235 1.00 0.00 H new ATOM 191 N ASP A 50 13.151 4.822 5.874 1.00 0.00 N ATOM 192 CA ASP A 50 13.339 4.415 7.272 1.00 0.00 C ATOM 193 C ASP A 50 12.288 3.382 7.659 1.00 0.00 C ATOM 194 O ASP A 50 11.164 3.400 7.177 1.00 0.00 O ATOM 195 CB ASP A 50 13.210 5.652 8.166 1.00 0.00 C ATOM 196 CG ASP A 50 14.327 6.660 7.860 1.00 0.00 C ATOM 197 OD1 ASP A 50 15.434 6.432 8.384 1.00 0.00 O ATOM 198 OD2 ASP A 50 14.037 7.616 7.114 1.00 0.00 O ATOM 0 H ASP A 50 12.220 5.194 5.684 1.00 0.00 H new ATOM 0 HA ASP A 50 14.326 3.970 7.397 1.00 0.00 H new ATOM 0 HB2 ASP A 50 12.238 6.120 8.010 1.00 0.00 H new ATOM 0 HB3 ASP A 50 13.257 5.356 9.214 1.00 0.00 H new ATOM 199 N ARG A 51 12.713 2.450 8.504 1.00 0.00 N ATOM 200 CA ARG A 51 11.836 1.394 9.045 1.00 0.00 C ATOM 201 C ARG A 51 10.943 1.922 10.194 1.00 0.00 C ATOM 202 O ARG A 51 10.722 1.299 11.232 1.00 0.00 O ATOM 203 CB ARG A 51 12.761 0.261 9.469 1.00 0.00 C ATOM 204 CG ARG A 51 11.947 -1.019 9.659 1.00 0.00 C ATOM 205 CD ARG A 51 12.808 -2.146 10.207 1.00 0.00 C ATOM 206 NE ARG A 51 11.839 -3.223 10.435 1.00 0.00 N ATOM 207 CZ ARG A 51 11.858 -4.433 9.877 1.00 0.00 C ATOM 208 NH1 ARG A 51 12.838 -4.842 9.090 1.00 0.00 N ATOM 209 NH2 ARG A 51 10.849 -5.261 10.079 1.00 0.00 N ATOM 0 H ARG A 51 13.675 2.397 8.840 1.00 0.00 H new ATOM 0 HA ARG A 51 11.124 1.038 8.300 1.00 0.00 H new ATOM 0 HB2 ARG A 51 13.532 0.105 8.714 1.00 0.00 H new ATOM 0 HB3 ARG A 51 13.271 0.521 10.397 1.00 0.00 H new ATOM 0 HG2 ARG A 51 11.118 -0.827 10.341 1.00 0.00 H new ATOM 0 HG3 ARG A 51 11.513 -1.321 8.706 1.00 0.00 H new ATOM 0 HD2 ARG A 51 13.582 -2.443 9.499 1.00 0.00 H new ATOM 0 HD3 ARG A 51 13.313 -1.856 11.128 1.00 0.00 H new ATOM 0 HE ARG A 51 11.077 -3.027 11.084 1.00 0.00 H new ATOM 0 HH11 ARG A 51 13.622 -4.222 8.888 1.00 0.00 H new ATOM 0 HH12 ARG A 51 12.810 -5.778 8.685 1.00 0.00 H new ATOM 0 HH21 ARG A 51 10.061 -4.973 10.659 1.00 0.00 H new ATOM 0 HH22 ARG A 51 10.858 -6.189 9.655 1.00 0.00 H new ATOM 210 N SER A 52 10.164 2.932 9.825 1.00 0.00 N ATOM 211 CA SER A 52 9.448 3.792 10.787 1.00 0.00 C ATOM 212 C SER A 52 8.028 3.327 11.084 1.00 0.00 C ATOM 213 O SER A 52 7.006 3.983 10.858 1.00 0.00 O ATOM 214 CB SER A 52 9.484 5.247 10.325 1.00 0.00 C ATOM 215 OG SER A 52 10.848 5.640 10.196 1.00 0.00 O ATOM 0 H SER A 52 10.004 3.186 8.850 1.00 0.00 H new ATOM 0 HA SER A 52 9.977 3.711 11.736 1.00 0.00 H new ATOM 0 HB2 SER A 52 8.965 5.356 9.373 1.00 0.00 H new ATOM 0 HB3 SER A 52 8.970 5.887 11.043 1.00 0.00 H new ATOM 0 HG SER A 52 10.893 6.573 9.898 1.00 0.00 H new ATOM 216 N ASP A 53 8.019 2.125 11.642 1.00 0.00 N ATOM 217 CA ASP A 53 6.814 1.454 12.154 1.00 0.00 C ATOM 218 C ASP A 53 6.181 2.111 13.399 1.00 0.00 C ATOM 219 O ASP A 53 5.465 1.474 14.161 1.00 0.00 O ATOM 220 CB ASP A 53 7.061 -0.048 12.374 1.00 0.00 C ATOM 221 CG ASP A 53 8.112 -0.368 13.444 1.00 0.00 C ATOM 222 OD1 ASP A 53 8.046 0.234 14.543 1.00 0.00 O ATOM 223 OD2 ASP A 53 8.986 -1.198 13.122 1.00 0.00 O ATOM 0 H ASP A 53 8.866 1.569 11.758 1.00 0.00 H new ATOM 0 HA ASP A 53 6.070 1.578 11.368 1.00 0.00 H new ATOM 0 HB2 ASP A 53 6.120 -0.521 12.654 1.00 0.00 H new ATOM 0 HB3 ASP A 53 7.374 -0.494 11.430 1.00 0.00 H new ATOM 224 N GLN A 54 6.652 3.320 13.700 1.00 0.00 N ATOM 225 CA GLN A 54 5.953 4.283 14.585 1.00 0.00 C ATOM 226 C GLN A 54 4.595 4.678 13.978 1.00 0.00 C ATOM 227 O GLN A 54 3.629 4.930 14.703 1.00 0.00 O ATOM 228 CB GLN A 54 6.809 5.538 14.737 1.00 0.00 C ATOM 229 CG GLN A 54 8.019 5.362 15.673 1.00 0.00 C ATOM 230 CD GLN A 54 9.040 4.353 15.149 1.00 0.00 C ATOM 231 OE1 GLN A 54 9.596 4.483 14.074 1.00 0.00 O ATOM 232 NE2 GLN A 54 9.107 3.207 15.792 1.00 0.00 N ATOM 0 H GLN A 54 7.538 3.673 13.338 1.00 0.00 H new ATOM 0 HA GLN A 54 5.790 3.815 15.556 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.165 5.844 13.753 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.185 6.347 15.115 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.508 6.327 15.811 1.00 0.00 H new ATOM 0 HG3 GLN A 54 7.669 5.040 16.653 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.641 3.100 16.693 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.625 2.426 15.390 1.00 0.00 H new ATOM 233 N HIS A 55 4.602 4.756 12.652 1.00 0.00 N ATOM 234 CA HIS A 55 3.396 4.997 11.830 1.00 0.00 C ATOM 235 C HIS A 55 2.956 3.735 11.069 1.00 0.00 C ATOM 236 O HIS A 55 1.805 3.310 11.145 1.00 0.00 O ATOM 237 CB HIS A 55 3.684 6.117 10.831 1.00 0.00 C ATOM 238 CG HIS A 55 3.790 7.500 11.487 1.00 0.00 C ATOM 239 ND1 HIS A 55 4.546 8.520 11.073 1.00 0.00 N ATOM 240 CD2 HIS A 55 3.002 7.961 12.459 1.00 0.00 C ATOM 241 CE1 HIS A 55 4.201 9.604 11.764 1.00 0.00 C ATOM 242 NE2 HIS A 55 3.258 9.247 12.628 1.00 0.00 N ATOM 0 H HIS A 55 5.453 4.654 12.099 1.00 0.00 H new ATOM 0 HA HIS A 55 2.585 5.280 12.500 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.615 5.898 10.308 1.00 0.00 H new ATOM 0 HB3 HIS A 55 2.894 6.138 10.080 1.00 0.00 H new ATOM 0 HD2 HIS A 55 2.278 7.382 13.014 1.00 0.00 H new ATOM 0 HE1 HIS A 55 4.613 10.595 11.644 1.00 0.00 H new ATOM 0 HE2 HIS A 55 2.808 9.861 13.307 1.00 0.00 H new ATOM 243 N ILE A 56 3.934 3.041 10.471 1.00 0.00 N ATOM 244 CA ILE A 56 3.651 1.925 9.563 1.00 0.00 C ATOM 245 C ILE A 56 3.562 0.544 10.241 1.00 0.00 C ATOM 246 O ILE A 56 4.449 -0.300 10.203 1.00 0.00 O ATOM 247 CB ILE A 56 4.525 2.004 8.289 1.00 0.00 C ATOM 248 CG1 ILE A 56 4.107 0.913 7.312 1.00 0.00 C ATOM 249 CG2 ILE A 56 6.040 2.080 8.492 1.00 0.00 C ATOM 250 CD1 ILE A 56 2.819 1.365 6.628 1.00 0.00 C ATOM 0 H ILE A 56 4.927 3.234 10.601 1.00 0.00 H new ATOM 0 HA ILE A 56 2.625 2.048 9.218 1.00 0.00 H new ATOM 0 HB ILE A 56 4.319 2.984 7.859 1.00 0.00 H new ATOM 0 HG12 ILE A 56 4.891 0.741 6.574 1.00 0.00 H new ATOM 0 HG13 ILE A 56 3.950 -0.029 7.837 1.00 0.00 H new ATOM 0 HG21 ILE A 56 6.535 2.131 7.522 1.00 0.00 H new ATOM 0 HG22 ILE A 56 6.285 2.970 9.072 1.00 0.00 H new ATOM 0 HG23 ILE A 56 6.380 1.193 9.027 1.00 0.00 H new ATOM 0 HD11 ILE A 56 2.495 0.601 5.921 1.00 0.00 H new ATOM 0 HD12 ILE A 56 2.043 1.517 7.378 1.00 0.00 H new ATOM 0 HD13 ILE A 56 2.998 2.299 6.096 1.00 0.00 H new ATOM 251 N GLN A 57 2.501 0.490 11.036 1.00 0.00 N ATOM 252 CA GLN A 57 1.896 -0.761 11.552 1.00 0.00 C ATOM 253 C GLN A 57 0.453 -0.848 11.056 1.00 0.00 C ATOM 254 O GLN A 57 -0.312 0.122 11.147 1.00 0.00 O ATOM 255 CB GLN A 57 1.960 -0.856 13.071 1.00 0.00 C ATOM 256 CG GLN A 57 3.336 -1.373 13.495 1.00 0.00 C ATOM 257 CD GLN A 57 3.486 -1.415 15.021 1.00 0.00 C ATOM 258 OE1 GLN A 57 2.911 -2.238 15.723 1.00 0.00 O ATOM 259 NE2 GLN A 57 4.262 -0.508 15.567 1.00 0.00 N ATOM 0 H GLN A 57 2.015 1.328 11.356 1.00 0.00 H new ATOM 0 HA GLN A 57 2.472 -1.606 11.174 1.00 0.00 H new ATOM 0 HB2 GLN A 57 1.775 0.122 13.515 1.00 0.00 H new ATOM 0 HB3 GLN A 57 1.181 -1.524 13.437 1.00 0.00 H new ATOM 0 HG2 GLN A 57 3.490 -2.372 13.087 1.00 0.00 H new ATOM 0 HG3 GLN A 57 4.110 -0.733 13.072 1.00 0.00 H new ATOM 0 HE21 GLN A 57 4.739 0.176 14.979 1.00 0.00 H new ATOM 0 HE22 GLN A 57 4.388 -0.487 16.579 1.00 0.00 H new ATOM 260 N LEU A 58 0.254 -1.876 10.251 1.00 0.00 N ATOM 261 CA LEU A 58 -0.989 -2.089 9.509 1.00 0.00 C ATOM 262 C LEU A 58 -1.643 -3.470 9.709 1.00 0.00 C ATOM 263 O LEU A 58 -1.030 -4.393 10.247 1.00 0.00 O ATOM 264 CB LEU A 58 -0.776 -1.739 8.021 1.00 0.00 C ATOM 265 CG LEU A 58 0.285 -2.586 7.289 1.00 0.00 C ATOM 266 CD1 LEU A 58 -0.315 -3.874 6.735 1.00 0.00 C ATOM 267 CD2 LEU A 58 0.794 -1.761 6.105 1.00 0.00 C ATOM 0 H LEU A 58 0.955 -2.598 10.088 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.723 -1.406 9.936 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.727 -1.848 7.500 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.492 -0.689 7.949 1.00 0.00 H new ATOM 0 HG LEU A 58 1.078 -2.844 7.991 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.460 -4.447 6.226 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.725 -4.466 7.553 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.110 -3.631 6.030 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.548 -2.330 5.562 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.037 -1.531 5.438 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.233 -0.833 6.470 1.00 0.00 H new ATOM 268 N GLN A 59 -2.915 -3.510 9.328 1.00 0.00 N ATOM 269 CA GLN A 59 -3.773 -4.700 9.451 1.00 0.00 C ATOM 270 C GLN A 59 -4.337 -5.151 8.093 1.00 0.00 C ATOM 271 O GLN A 59 -5.076 -4.399 7.457 1.00 0.00 O ATOM 272 CB GLN A 59 -4.904 -4.343 10.415 1.00 0.00 C ATOM 273 CG GLN A 59 -5.936 -5.442 10.679 1.00 0.00 C ATOM 274 CD GLN A 59 -5.366 -6.689 11.374 1.00 0.00 C ATOM 275 OE1 GLN A 59 -4.501 -7.403 10.873 1.00 0.00 O ATOM 276 NE2 GLN A 59 -6.009 -7.084 12.442 1.00 0.00 N ATOM 0 H GLN A 59 -3.394 -2.708 8.918 1.00 0.00 H new ATOM 0 HA GLN A 59 -3.186 -5.538 9.827 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -4.463 -4.050 11.368 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -5.426 -3.470 10.024 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -6.737 -5.032 11.294 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -6.383 -5.741 9.731 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -6.727 -6.488 12.855 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -5.793 -7.988 12.862 1.00 0.00 H new ATOM 277 N LEU A 60 -4.127 -6.423 7.782 1.00 0.00 N ATOM 278 CA LEU A 60 -4.609 -7.015 6.525 1.00 0.00 C ATOM 279 C LEU A 60 -5.976 -7.704 6.677 1.00 0.00 C ATOM 280 O LEU A 60 -6.140 -8.922 6.658 1.00 0.00 O ATOM 281 CB LEU A 60 -3.565 -8.015 5.965 1.00 0.00 C ATOM 282 CG LEU A 60 -2.204 -7.376 5.679 1.00 0.00 C ATOM 283 CD1 LEU A 60 -1.199 -8.497 5.409 1.00 0.00 C ATOM 284 CD2 LEU A 60 -2.246 -6.410 4.495 1.00 0.00 C ATOM 0 H LEU A 60 -3.623 -7.075 8.383 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.743 -6.194 5.821 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -3.433 -8.829 6.678 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -3.951 -8.456 5.046 1.00 0.00 H new ATOM 0 HG LEU A 60 -1.909 -6.787 6.547 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -0.220 -8.066 5.202 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.133 -9.145 6.283 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.527 -9.081 4.549 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.255 -5.986 4.336 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.559 -6.946 3.599 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.955 -5.609 4.704 1.00 0.00 H new ATOM 285 N SER A 61 -6.979 -6.847 6.586 1.00 0.00 N ATOM 286 CA SER A 61 -8.366 -7.173 6.950 1.00 0.00 C ATOM 287 C SER A 61 -9.202 -7.605 5.736 1.00 0.00 C ATOM 288 O SER A 61 -9.978 -6.860 5.132 1.00 0.00 O ATOM 289 CB SER A 61 -8.891 -5.941 7.683 1.00 0.00 C ATOM 290 OG SER A 61 -10.296 -6.038 7.944 1.00 0.00 O ATOM 0 H SER A 61 -6.861 -5.890 6.254 1.00 0.00 H new ATOM 0 HA SER A 61 -8.430 -8.045 7.601 1.00 0.00 H new ATOM 0 HB2 SER A 61 -8.354 -5.821 8.624 1.00 0.00 H new ATOM 0 HB3 SER A 61 -8.692 -5.051 7.086 1.00 0.00 H new ATOM 0 HG SER A 61 -10.597 -5.233 8.415 1.00 0.00 H new ATOM 291 N ALA A 62 -8.757 -8.752 5.244 1.00 0.00 N ATOM 292 CA ALA A 62 -9.346 -9.512 4.130 1.00 0.00 C ATOM 293 C ALA A 62 -10.874 -9.687 4.174 1.00 0.00 C ATOM 294 O ALA A 62 -11.460 -10.145 5.147 1.00 0.00 O ATOM 295 CB ALA A 62 -8.669 -10.881 4.024 1.00 0.00 C ATOM 0 H ALA A 62 -7.930 -9.210 5.626 1.00 0.00 H new ATOM 0 HA ALA A 62 -9.160 -8.904 3.244 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -9.108 -11.441 3.198 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.602 -10.746 3.845 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -8.814 -11.432 4.953 1.00 0.00 H new ATOM 296 N GLU A 63 -11.456 -9.093 3.142 1.00 0.00 N ATOM 297 CA GLU A 63 -12.872 -9.254 2.805 1.00 0.00 C ATOM 298 C GLU A 63 -13.108 -10.538 1.972 1.00 0.00 C ATOM 299 O GLU A 63 -14.214 -11.042 1.834 1.00 0.00 O ATOM 300 CB GLU A 63 -13.224 -7.973 2.044 1.00 0.00 C ATOM 301 CG GLU A 63 -14.679 -7.840 1.576 1.00 0.00 C ATOM 302 CD GLU A 63 -14.980 -8.583 0.269 1.00 0.00 C ATOM 303 OE1 GLU A 63 -14.063 -8.664 -0.591 1.00 0.00 O ATOM 304 OE2 GLU A 63 -16.150 -8.990 0.114 1.00 0.00 O ATOM 0 H GLU A 63 -10.955 -8.476 2.503 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.508 -9.382 3.681 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -12.990 -7.121 2.682 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.576 -7.905 1.170 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -15.338 -8.218 2.358 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -14.913 -6.784 1.445 1.00 0.00 H new ATOM 305 N SER A 64 -12.020 -10.921 1.337 1.00 0.00 N ATOM 306 CA SER A 64 -11.861 -12.102 0.475 1.00 0.00 C ATOM 307 C SER A 64 -10.354 -12.368 0.381 1.00 0.00 C ATOM 308 O SER A 64 -9.539 -11.542 0.805 1.00 0.00 O ATOM 309 CB SER A 64 -12.448 -11.791 -0.897 1.00 0.00 C ATOM 310 OG SER A 64 -12.407 -12.964 -1.724 1.00 0.00 O ATOM 0 H SER A 64 -11.155 -10.385 1.406 1.00 0.00 H new ATOM 0 HA SER A 64 -12.376 -12.978 0.869 1.00 0.00 H new ATOM 0 HB2 SER A 64 -13.476 -11.445 -0.792 1.00 0.00 H new ATOM 0 HB3 SER A 64 -11.887 -10.984 -1.368 1.00 0.00 H new ATOM 0 HG SER A 64 -12.787 -12.758 -2.603 1.00 0.00 H new ATOM 311 N VAL A 65 -10.024 -13.396 -0.400 1.00 0.00 N ATOM 312 CA VAL A 65 -8.656 -13.871 -0.655 1.00 0.00 C ATOM 313 C VAL A 65 -7.989 -13.044 -1.758 1.00 0.00 C ATOM 314 O VAL A 65 -7.859 -13.407 -2.930 1.00 0.00 O ATOM 315 CB VAL A 65 -8.643 -15.388 -0.921 1.00 0.00 C ATOM 316 CG1 VAL A 65 -9.472 -15.795 -2.148 1.00 0.00 C ATOM 317 CG2 VAL A 65 -7.204 -15.892 -1.023 1.00 0.00 C ATOM 0 H VAL A 65 -10.727 -13.945 -0.894 1.00 0.00 H new ATOM 0 HA VAL A 65 -8.051 -13.719 0.239 1.00 0.00 H new ATOM 0 HB VAL A 65 -9.126 -15.867 -0.070 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -9.421 -16.876 -2.279 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -10.510 -15.496 -2.001 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -9.074 -15.302 -3.035 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.207 -16.966 -1.211 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.697 -15.382 -1.842 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -6.680 -15.689 -0.089 1.00 0.00 H new ATOM 318 N GLY A 66 -7.825 -11.793 -1.366 1.00 0.00 N ATOM 319 CA GLY A 66 -7.114 -10.802 -2.184 1.00 0.00 C ATOM 320 C GLY A 66 -7.283 -9.431 -1.576 1.00 0.00 C ATOM 321 O GLY A 66 -6.379 -8.911 -0.927 1.00 0.00 O ATOM 0 H GLY A 66 -8.175 -11.428 -0.480 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.056 -11.057 -2.244 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -7.502 -10.810 -3.203 1.00 0.00 H new ATOM 322 N GLU A 67 -8.478 -8.916 -1.798 1.00 0.00 N ATOM 323 CA GLU A 67 -8.855 -7.554 -1.378 1.00 0.00 C ATOM 324 C GLU A 67 -8.999 -7.447 0.149 1.00 0.00 C ATOM 325 O GLU A 67 -9.955 -7.910 0.781 1.00 0.00 O ATOM 326 CB GLU A 67 -10.010 -6.947 -2.172 1.00 0.00 C ATOM 327 CG GLU A 67 -11.356 -7.674 -2.100 1.00 0.00 C ATOM 328 CD GLU A 67 -11.510 -8.756 -3.167 1.00 0.00 C ATOM 329 OE1 GLU A 67 -10.958 -9.859 -2.920 1.00 0.00 O ATOM 330 OE2 GLU A 67 -12.133 -8.462 -4.203 1.00 0.00 O ATOM 0 H GLU A 67 -9.225 -9.421 -2.275 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.017 -6.910 -1.644 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -10.158 -5.924 -1.827 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -9.710 -6.891 -3.218 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -11.466 -8.126 -1.114 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -12.161 -6.947 -2.209 1.00 0.00 H new ATOM 331 N VAL A 68 -7.903 -6.947 0.678 1.00 0.00 N ATOM 332 CA VAL A 68 -7.679 -6.713 2.112 1.00 0.00 C ATOM 333 C VAL A 68 -7.888 -5.234 2.415 1.00 0.00 C ATOM 334 O VAL A 68 -7.382 -4.352 1.728 1.00 0.00 O ATOM 335 CB VAL A 68 -6.291 -7.152 2.599 1.00 0.00 C ATOM 336 CG1 VAL A 68 -6.141 -8.670 2.561 1.00 0.00 C ATOM 337 CG2 VAL A 68 -5.099 -6.506 1.870 1.00 0.00 C ATOM 0 H VAL A 68 -7.102 -6.677 0.107 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.400 -7.329 2.650 1.00 0.00 H new ATOM 0 HB VAL A 68 -6.251 -6.788 3.626 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.147 -8.946 2.912 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.893 -9.126 3.205 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.276 -9.023 1.539 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.167 -6.884 2.290 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -5.145 -6.752 0.809 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.140 -5.424 1.994 1.00 0.00 H new ATOM 338 N TYR A 69 -8.710 -5.015 3.421 1.00 0.00 N ATOM 339 CA TYR A 69 -8.864 -3.686 4.031 1.00 0.00 C ATOM 340 C TYR A 69 -7.625 -3.436 4.878 1.00 0.00 C ATOM 341 O TYR A 69 -7.307 -4.222 5.767 1.00 0.00 O ATOM 342 CB TYR A 69 -10.099 -3.620 4.930 1.00 0.00 C ATOM 343 CG TYR A 69 -11.402 -3.655 4.140 1.00 0.00 C ATOM 344 CD1 TYR A 69 -11.732 -2.497 3.404 1.00 0.00 C ATOM 345 CD2 TYR A 69 -12.345 -4.672 4.385 1.00 0.00 C ATOM 346 CE1 TYR A 69 -13.047 -2.339 2.944 1.00 0.00 C ATOM 347 CE2 TYR A 69 -13.660 -4.514 3.925 1.00 0.00 C ATOM 348 CZ TYR A 69 -14.009 -3.335 3.221 1.00 0.00 C ATOM 349 OH TYR A 69 -15.297 -3.109 2.877 1.00 0.00 O ATOM 0 H TYR A 69 -9.291 -5.739 3.845 1.00 0.00 H new ATOM 0 HA TYR A 69 -8.984 -2.938 3.247 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.080 -4.456 5.629 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.063 -2.707 5.524 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -10.984 -1.745 3.199 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -12.058 -5.564 4.922 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -13.323 -1.460 2.381 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -14.398 -5.282 4.105 1.00 0.00 H new ATOM 0 HH TYR A 69 -15.542 -2.190 3.112 1.00 0.00 H new ATOM 350 N ILE A 70 -6.826 -2.455 4.504 1.00 0.00 N ATOM 351 CA ILE A 70 -5.610 -2.169 5.282 1.00 0.00 C ATOM 352 C ILE A 70 -5.844 -1.027 6.257 1.00 0.00 C ATOM 353 O ILE A 70 -5.768 0.157 5.937 1.00 0.00 O ATOM 354 CB ILE A 70 -4.389 -1.949 4.364 1.00 0.00 C ATOM 355 CG1 ILE A 70 -4.204 -3.174 3.427 1.00 0.00 C ATOM 356 CG2 ILE A 70 -3.110 -1.748 5.198 1.00 0.00 C ATOM 357 CD1 ILE A 70 -3.211 -2.962 2.283 1.00 0.00 C ATOM 0 H ILE A 70 -6.978 -1.853 3.695 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.373 -3.045 5.886 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.566 -1.054 3.768 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.873 -4.024 4.024 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.173 -3.440 3.004 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.261 -1.595 4.531 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -3.228 -0.876 5.841 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.934 -2.631 5.812 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.148 -3.870 1.683 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.548 -2.136 1.657 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.228 -2.729 2.693 1.00 0.00 H new ATOM 358 N LYS A 71 -6.103 -1.456 7.483 1.00 0.00 N ATOM 359 CA LYS A 71 -6.284 -0.561 8.623 1.00 0.00 C ATOM 360 C LYS A 71 -4.912 -0.376 9.262 1.00 0.00 C ATOM 361 O LYS A 71 -4.336 -1.284 9.843 1.00 0.00 O ATOM 362 CB LYS A 71 -7.219 -1.216 9.626 1.00 0.00 C ATOM 363 CG LYS A 71 -7.877 -0.188 10.563 1.00 0.00 C ATOM 364 CD LYS A 71 -7.206 -0.060 11.929 1.00 0.00 C ATOM 365 CE LYS A 71 -8.110 0.719 12.894 1.00 0.00 C ATOM 366 NZ LYS A 71 -7.487 0.762 14.229 1.00 0.00 N ATOM 0 H LYS A 71 -6.195 -2.444 7.720 1.00 0.00 H new ATOM 0 HA LYS A 71 -6.707 0.395 8.314 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -7.993 -1.767 9.092 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.663 -1.942 10.219 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -7.870 0.787 10.075 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -8.921 -0.464 10.709 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -6.998 -1.050 12.334 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.248 0.450 11.825 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -8.268 1.732 12.523 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.090 0.245 12.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.058 1.361 14.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -7.435 -0.201 14.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -6.528 1.156 14.152 1.00 0.00 H new ATOM 367 N SER A 72 -4.424 0.847 9.179 1.00 0.00 N ATOM 368 CA SER A 72 -3.166 1.251 9.809 1.00 0.00 C ATOM 369 C SER A 72 -3.428 1.498 11.298 1.00 0.00 C ATOM 370 O SER A 72 -3.929 2.554 11.693 1.00 0.00 O ATOM 371 CB SER A 72 -2.572 2.461 9.095 1.00 0.00 C ATOM 372 OG SER A 72 -1.545 3.058 9.894 1.00 0.00 O ATOM 0 H SER A 72 -4.888 1.600 8.670 1.00 0.00 H new ATOM 0 HA SER A 72 -2.420 0.461 9.723 1.00 0.00 H new ATOM 0 HB2 SER A 72 -2.162 2.158 8.132 1.00 0.00 H new ATOM 0 HB3 SER A 72 -3.355 3.192 8.892 1.00 0.00 H new ATOM 0 HG SER A 72 -1.886 3.881 10.303 1.00 0.00 H new ATOM 373 N THR A 73 -3.586 0.348 11.932 1.00 0.00 N ATOM 374 CA THR A 73 -3.745 0.110 13.379 1.00 0.00 C ATOM 375 C THR A 73 -3.255 1.214 14.337 1.00 0.00 C ATOM 376 O THR A 73 -4.016 1.672 15.188 1.00 0.00 O ATOM 377 CB THR A 73 -3.119 -1.244 13.762 1.00 0.00 C ATOM 378 OG1 THR A 73 -1.791 -1.352 13.233 1.00 0.00 O ATOM 379 CG2 THR A 73 -3.988 -2.392 13.252 1.00 0.00 C ATOM 0 H THR A 73 -3.610 -0.529 11.411 1.00 0.00 H new ATOM 0 HA THR A 73 -4.825 0.112 13.523 1.00 0.00 H new ATOM 0 HB THR A 73 -3.063 -1.304 14.849 1.00 0.00 H new ATOM 0 HG1 THR A 73 -1.407 -2.217 13.487 1.00 0.00 H new ATOM 0 HG21 THR A 73 -3.534 -3.343 13.530 1.00 0.00 H new ATOM 0 HG22 THR A 73 -4.981 -2.321 13.695 1.00 0.00 H new ATOM 0 HG23 THR A 73 -4.070 -2.332 12.167 1.00 0.00 H new ATOM 380 N GLU A 74 -2.071 1.747 14.024 1.00 0.00 N ATOM 381 CA GLU A 74 -1.372 2.786 14.796 1.00 0.00 C ATOM 382 C GLU A 74 -1.930 4.201 14.667 1.00 0.00 C ATOM 383 O GLU A 74 -1.795 5.034 15.568 1.00 0.00 O ATOM 384 CB GLU A 74 0.085 2.805 14.357 1.00 0.00 C ATOM 385 CG GLU A 74 0.987 2.206 15.428 1.00 0.00 C ATOM 386 CD GLU A 74 2.476 2.274 15.070 1.00 0.00 C ATOM 387 OE1 GLU A 74 2.794 2.191 13.855 1.00 0.00 O ATOM 388 OE2 GLU A 74 3.276 2.343 16.028 1.00 0.00 O ATOM 0 H GLU A 74 -1.551 1.458 13.196 1.00 0.00 H new ATOM 0 HA GLU A 74 -1.508 2.514 15.843 1.00 0.00 H new ATOM 0 HB2 GLU A 74 0.196 2.245 13.429 1.00 0.00 H new ATOM 0 HB3 GLU A 74 0.392 3.830 14.150 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.822 2.731 16.369 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.706 1.165 15.590 1.00 0.00 H new ATOM 389 N THR A 75 -2.431 4.482 13.473 1.00 0.00 N ATOM 390 CA THR A 75 -3.021 5.791 13.132 1.00 0.00 C ATOM 391 C THR A 75 -4.554 5.751 13.216 1.00 0.00 C ATOM 392 O THR A 75 -5.216 6.787 13.184 1.00 0.00 O ATOM 393 CB THR A 75 -2.622 6.228 11.717 1.00 0.00 C ATOM 394 OG1 THR A 75 -3.070 5.266 10.757 1.00 0.00 O ATOM 395 CG2 THR A 75 -1.120 6.503 11.616 1.00 0.00 C ATOM 0 H THR A 75 -2.445 3.813 12.703 1.00 0.00 H new ATOM 0 HA THR A 75 -2.635 6.507 13.858 1.00 0.00 H new ATOM 0 HB THR A 75 -3.118 7.172 11.491 1.00 0.00 H new ATOM 0 HG1 THR A 75 -3.432 4.483 11.223 1.00 0.00 H new ATOM 0 HG21 THR A 75 -0.874 6.810 10.600 1.00 0.00 H new ATOM 0 HG22 THR A 75 -0.848 7.297 12.311 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.567 5.598 11.865 1.00 0.00 H new ATOM 396 N GLY A 76 -5.079 4.521 13.136 1.00 0.00 N ATOM 397 CA GLY A 76 -6.508 4.206 13.179 1.00 0.00 C ATOM 398 C GLY A 76 -7.210 4.562 11.856 1.00 0.00 C ATOM 399 O GLY A 76 -8.407 4.850 11.825 1.00 0.00 O ATOM 0 H GLY A 76 -4.497 3.690 13.036 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.640 3.144 13.387 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.976 4.752 13.998 1.00 0.00 H new ATOM 400 N GLN A 77 -6.442 4.465 10.776 1.00 0.00 N ATOM 401 CA GLN A 77 -6.874 4.879 9.429 1.00 0.00 C ATOM 402 C GLN A 77 -6.728 3.780 8.382 1.00 0.00 C ATOM 403 O GLN A 77 -5.739 3.067 8.301 1.00 0.00 O ATOM 404 CB GLN A 77 -6.057 6.113 9.035 1.00 0.00 C ATOM 405 CG GLN A 77 -6.586 7.337 9.782 1.00 0.00 C ATOM 406 CD GLN A 77 -5.591 8.483 9.865 1.00 0.00 C ATOM 407 OE1 GLN A 77 -5.074 9.035 8.900 1.00 0.00 O ATOM 408 NE2 GLN A 77 -5.327 8.878 11.092 1.00 0.00 N ATOM 0 H GLN A 77 -5.492 4.095 10.802 1.00 0.00 H new ATOM 0 HA GLN A 77 -7.940 5.105 9.464 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -5.005 5.956 9.272 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -6.120 6.275 7.959 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -7.491 7.689 9.288 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -6.869 7.040 10.792 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -5.765 8.408 11.884 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -4.684 9.654 11.251 1.00 0.00 H new ATOM 409 N TYR A 78 -7.749 3.735 7.538 1.00 0.00 N ATOM 410 CA TYR A 78 -7.901 2.790 6.420 1.00 0.00 C ATOM 411 C TYR A 78 -7.243 3.331 5.149 1.00 0.00 C ATOM 412 O TYR A 78 -7.689 4.315 4.558 1.00 0.00 O ATOM 413 CB TYR A 78 -9.390 2.560 6.166 1.00 0.00 C ATOM 414 CG TYR A 78 -10.039 1.729 7.285 1.00 0.00 C ATOM 415 CD1 TYR A 78 -9.990 0.315 7.176 1.00 0.00 C ATOM 416 CD2 TYR A 78 -10.685 2.373 8.352 1.00 0.00 C ATOM 417 CE1 TYR A 78 -10.615 -0.458 8.164 1.00 0.00 C ATOM 418 CE2 TYR A 78 -11.310 1.600 9.341 1.00 0.00 C ATOM 419 CZ TYR A 78 -11.280 0.194 9.223 1.00 0.00 C ATOM 420 OH TYR A 78 -12.032 -0.573 10.063 1.00 0.00 O ATOM 0 H TYR A 78 -8.534 4.382 7.610 1.00 0.00 H new ATOM 0 HA TYR A 78 -7.412 1.852 6.683 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -9.898 3.521 6.086 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -9.521 2.050 5.212 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -9.481 -0.156 6.348 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -10.700 3.451 8.411 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -10.588 -1.537 8.115 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -11.805 2.072 10.177 1.00 0.00 H new ATOM 0 HH TYR A 78 -12.437 -0.004 10.751 1.00 0.00 H new ATOM 421 N LEU A 79 -6.226 2.588 4.733 1.00 0.00 N ATOM 422 CA LEU A 79 -5.396 2.859 3.543 1.00 0.00 C ATOM 423 C LEU A 79 -6.254 2.703 2.302 1.00 0.00 C ATOM 424 O LEU A 79 -6.733 1.615 1.979 1.00 0.00 O ATOM 425 CB LEU A 79 -4.271 1.823 3.566 1.00 0.00 C ATOM 426 CG LEU A 79 -3.137 2.187 2.602 1.00 0.00 C ATOM 427 CD1 LEU A 79 -2.014 2.875 3.389 1.00 0.00 C ATOM 428 CD2 LEU A 79 -2.599 0.919 1.949 1.00 0.00 C ATOM 0 H LEU A 79 -5.937 1.744 5.228 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.985 3.868 3.540 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.874 1.741 4.578 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.673 0.845 3.301 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.510 2.859 1.829 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.202 3.138 2.711 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.401 3.779 3.860 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -1.640 2.198 4.157 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.792 1.177 1.263 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.220 0.246 2.718 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.400 0.426 1.398 1.00 0.00 H new ATOM 429 N ALA A 80 -6.560 3.856 1.744 1.00 0.00 N ATOM 430 CA ALA A 80 -7.631 4.002 0.754 1.00 0.00 C ATOM 431 C ALA A 80 -7.173 4.881 -0.398 1.00 0.00 C ATOM 432 O ALA A 80 -6.530 5.913 -0.216 1.00 0.00 O ATOM 433 CB ALA A 80 -8.857 4.576 1.471 1.00 0.00 C ATOM 0 H ALA A 80 -6.076 4.728 1.959 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.893 3.038 0.319 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -9.672 4.696 0.758 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -9.166 3.896 2.264 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.606 5.545 1.902 1.00 0.00 H new ATOM 434 N MET A 81 -7.398 4.321 -1.575 1.00 0.00 N ATOM 435 CA MET A 81 -6.884 4.909 -2.825 1.00 0.00 C ATOM 436 C MET A 81 -7.952 5.721 -3.556 1.00 0.00 C ATOM 437 O MET A 81 -9.143 5.462 -3.461 1.00 0.00 O ATOM 438 CB MET A 81 -6.386 3.726 -3.668 1.00 0.00 C ATOM 439 CG MET A 81 -5.523 4.113 -4.870 1.00 0.00 C ATOM 440 SD MET A 81 -4.432 2.708 -5.306 1.00 0.00 S ATOM 441 CE MET A 81 -4.467 2.797 -7.082 1.00 0.00 C ATOM 0 H MET A 81 -7.931 3.461 -1.703 1.00 0.00 H new ATOM 0 HA MET A 81 -6.080 5.618 -2.626 1.00 0.00 H new ATOM 0 HB2 MET A 81 -5.812 3.057 -3.027 1.00 0.00 H new ATOM 0 HB3 MET A 81 -7.249 3.163 -4.024 1.00 0.00 H new ATOM 0 HG2 MET A 81 -6.156 4.374 -5.718 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.925 4.994 -4.635 1.00 0.00 H new ATOM 0 HE1 MET A 81 -3.906 1.961 -7.499 1.00 0.00 H new ATOM 0 HE2 MET A 81 -5.499 2.750 -7.428 1.00 0.00 H new ATOM 0 HE3 MET A 81 -4.017 3.735 -7.408 1.00 0.00 H new ATOM 442 N ASP A 82 -7.497 6.887 -3.945 1.00 0.00 N ATOM 443 CA ASP A 82 -8.216 7.828 -4.807 1.00 0.00 C ATOM 444 C ASP A 82 -7.876 7.503 -6.266 1.00 0.00 C ATOM 445 O ASP A 82 -6.721 7.241 -6.577 1.00 0.00 O ATOM 446 CB ASP A 82 -7.714 9.219 -4.371 1.00 0.00 C ATOM 447 CG ASP A 82 -8.316 10.386 -5.130 1.00 0.00 C ATOM 448 OD1 ASP A 82 -7.830 10.591 -6.268 1.00 0.00 O ATOM 449 OD2 ASP A 82 -9.240 11.017 -4.582 1.00 0.00 O ATOM 0 H ASP A 82 -6.579 7.232 -3.665 1.00 0.00 H new ATOM 0 HA ASP A 82 -9.302 7.778 -4.723 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.925 9.348 -3.309 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -6.631 9.250 -4.487 1.00 0.00 H new ATOM 450 N THR A 83 -8.816 7.884 -7.111 1.00 0.00 N ATOM 451 CA THR A 83 -8.874 7.715 -8.589 1.00 0.00 C ATOM 452 C THR A 83 -7.946 8.582 -9.433 1.00 0.00 C ATOM 453 O THR A 83 -8.094 8.730 -10.649 1.00 0.00 O ATOM 454 CB THR A 83 -10.322 7.986 -9.005 1.00 0.00 C ATOM 455 OG1 THR A 83 -10.721 9.204 -8.350 1.00 0.00 O ATOM 456 CG2 THR A 83 -11.256 6.842 -8.621 1.00 0.00 C ATOM 0 H THR A 83 -9.646 8.368 -6.768 1.00 0.00 H new ATOM 0 HA THR A 83 -8.522 6.702 -8.786 1.00 0.00 H new ATOM 0 HB THR A 83 -10.385 8.075 -10.090 1.00 0.00 H new ATOM 0 HG1 THR A 83 -11.647 9.417 -8.591 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.272 7.080 -8.937 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.929 5.925 -9.112 1.00 0.00 H new ATOM 0 HG23 THR A 83 -11.235 6.702 -7.540 1.00 0.00 H new ATOM 457 N ASP A 84 -6.956 9.110 -8.740 1.00 0.00 N ATOM 458 CA ASP A 84 -5.748 9.712 -9.339 1.00 0.00 C ATOM 459 C ASP A 84 -4.465 8.956 -8.939 1.00 0.00 C ATOM 460 O ASP A 84 -3.349 9.378 -9.214 1.00 0.00 O ATOM 461 CB ASP A 84 -5.621 11.164 -8.856 1.00 0.00 C ATOM 462 CG ASP A 84 -6.692 12.067 -9.487 1.00 0.00 C ATOM 463 OD1 ASP A 84 -7.790 12.126 -8.908 1.00 0.00 O ATOM 464 OD2 ASP A 84 -6.369 12.680 -10.527 1.00 0.00 O ATOM 0 H ASP A 84 -6.955 9.140 -7.720 1.00 0.00 H new ATOM 0 HA ASP A 84 -5.855 9.659 -10.422 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -5.711 11.196 -7.770 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -4.631 11.545 -9.105 1.00 0.00 H new ATOM 465 N GLY A 85 -4.696 7.761 -8.396 1.00 0.00 N ATOM 466 CA GLY A 85 -3.702 6.945 -7.697 1.00 0.00 C ATOM 467 C GLY A 85 -3.059 7.641 -6.506 1.00 0.00 C ATOM 468 O GLY A 85 -1.838 7.749 -6.434 1.00 0.00 O ATOM 0 H GLY A 85 -5.614 7.318 -8.432 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -4.177 6.026 -7.355 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -2.922 6.658 -8.402 1.00 0.00 H new ATOM 469 N LEU A 86 -3.908 8.036 -5.565 1.00 0.00 N ATOM 470 CA LEU A 86 -3.416 8.665 -4.327 1.00 0.00 C ATOM 471 C LEU A 86 -3.971 7.987 -3.081 1.00 0.00 C ATOM 472 O LEU A 86 -5.189 7.867 -2.916 1.00 0.00 O ATOM 473 CB LEU A 86 -3.758 10.151 -4.335 1.00 0.00 C ATOM 474 CG LEU A 86 -2.719 10.878 -3.479 1.00 0.00 C ATOM 475 CD1 LEU A 86 -2.219 12.120 -4.213 1.00 0.00 C ATOM 476 CD2 LEU A 86 -3.262 11.222 -2.085 1.00 0.00 C ATOM 0 H LEU A 86 -4.922 7.939 -5.624 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.333 8.545 -4.295 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.751 10.538 -5.354 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.760 10.314 -3.939 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.876 10.206 -3.321 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -1.480 12.633 -3.598 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.763 11.825 -5.158 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.057 12.790 -4.407 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.491 11.737 -1.511 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -4.134 11.868 -2.184 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.547 10.305 -1.569 1.00 0.00 H new ATOM 477 N LEU A 87 -3.054 7.501 -2.263 1.00 0.00 N ATOM 478 CA LEU A 87 -3.412 6.933 -0.943 1.00 0.00 C ATOM 479 C LEU A 87 -3.575 7.961 0.163 1.00 0.00 C ATOM 480 O LEU A 87 -2.730 8.811 0.440 1.00 0.00 O ATOM 481 CB LEU A 87 -2.362 5.939 -0.471 1.00 0.00 C ATOM 482 CG LEU A 87 -2.308 4.627 -1.244 1.00 0.00 C ATOM 483 CD1 LEU A 87 -1.136 3.773 -0.739 1.00 0.00 C ATOM 484 CD2 LEU A 87 -3.613 3.857 -1.028 1.00 0.00 C ATOM 0 H LEU A 87 -2.056 7.481 -2.474 1.00 0.00 H new ATOM 0 HA LEU A 87 -4.377 6.457 -1.115 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.383 6.416 -0.529 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.545 5.714 0.580 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.173 4.842 -2.304 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.102 2.836 -1.295 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.202 4.315 -0.884 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.271 3.561 0.322 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.577 2.918 -1.580 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.741 3.649 0.034 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.452 4.455 -1.384 1.00 0.00 H new ATOM 485 N TYR A 88 -4.612 7.651 0.929 1.00 0.00 N ATOM 486 CA TYR A 88 -4.978 8.370 2.158 1.00 0.00 C ATOM 487 C TYR A 88 -5.601 7.437 3.200 1.00 0.00 C ATOM 488 O TYR A 88 -6.309 6.485 2.872 1.00 0.00 O ATOM 489 CB TYR A 88 -5.890 9.585 1.888 1.00 0.00 C ATOM 490 CG TYR A 88 -7.185 9.244 1.138 1.00 0.00 C ATOM 491 CD1 TYR A 88 -8.291 8.742 1.860 1.00 0.00 C ATOM 492 CD2 TYR A 88 -7.134 9.188 -0.270 1.00 0.00 C ATOM 493 CE1 TYR A 88 -9.325 8.091 1.158 1.00 0.00 C ATOM 494 CE2 TYR A 88 -8.156 8.539 -0.960 1.00 0.00 C ATOM 495 CZ TYR A 88 -9.228 7.964 -0.239 1.00 0.00 C ATOM 496 OH TYR A 88 -10.047 7.096 -0.893 1.00 0.00 O ATOM 0 H TYR A 88 -5.241 6.877 0.715 1.00 0.00 H new ATOM 0 HA TYR A 88 -4.046 8.757 2.569 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -6.146 10.052 2.839 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -5.332 10.323 1.311 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -8.343 8.855 2.933 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -6.314 9.642 -0.806 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -10.180 7.695 1.686 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -8.130 8.476 -2.038 1.00 0.00 H new ATOM 0 HH TYR A 88 -9.568 6.704 -1.653 1.00 0.00 H new ATOM 497 N GLY A 89 -5.221 7.689 4.441 1.00 0.00 N ATOM 498 CA GLY A 89 -5.742 6.999 5.630 1.00 0.00 C ATOM 499 C GLY A 89 -7.103 7.599 6.025 1.00 0.00 C ATOM 500 O GLY A 89 -7.191 8.727 6.514 1.00 0.00 O ATOM 0 H GLY A 89 -4.522 8.397 4.666 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.849 5.934 5.426 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.038 7.096 6.456 1.00 0.00 H new ATOM 501 N SER A 90 -8.123 6.871 5.597 1.00 0.00 N ATOM 502 CA SER A 90 -9.541 7.203 5.818 1.00 0.00 C ATOM 503 C SER A 90 -10.168 6.542 7.044 1.00 0.00 C ATOM 504 O SER A 90 -9.779 5.481 7.518 1.00 0.00 O ATOM 505 CB SER A 90 -10.296 6.814 4.536 1.00 0.00 C ATOM 506 OG SER A 90 -10.588 5.409 4.483 1.00 0.00 O ATOM 0 H SER A 90 -7.994 6.007 5.071 1.00 0.00 H new ATOM 0 HA SER A 90 -9.613 8.270 6.030 1.00 0.00 H new ATOM 0 HB2 SER A 90 -11.226 7.379 4.479 1.00 0.00 H new ATOM 0 HB3 SER A 90 -9.700 7.092 3.667 1.00 0.00 H new ATOM 0 HG SER A 90 -9.750 4.902 4.449 1.00 0.00 H new ATOM 507 N GLN A 91 -11.333 7.098 7.321 1.00 0.00 N ATOM 508 CA GLN A 91 -12.272 6.632 8.359 1.00 0.00 C ATOM 509 C GLN A 91 -13.245 5.540 7.860 1.00 0.00 C ATOM 510 O GLN A 91 -14.145 5.089 8.574 1.00 0.00 O ATOM 511 CB GLN A 91 -12.989 7.897 8.802 1.00 0.00 C ATOM 512 CG GLN A 91 -13.752 8.538 7.660 1.00 0.00 C ATOM 513 CD GLN A 91 -14.535 9.779 8.118 1.00 0.00 C ATOM 514 OE1 GLN A 91 -14.093 10.909 8.056 1.00 0.00 O ATOM 515 NE2 GLN A 91 -15.718 9.533 8.632 1.00 0.00 N ATOM 0 H GLN A 91 -11.676 7.917 6.819 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.753 6.139 9.180 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -13.678 7.660 9.612 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -12.263 8.607 9.198 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.055 8.820 6.871 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -14.442 7.811 7.231 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -16.067 8.576 8.673 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -16.288 10.299 8.990 1.00 0.00 H new ATOM 516 N THR A 92 -13.039 5.128 6.611 1.00 0.00 N ATOM 517 CA THR A 92 -13.960 4.261 5.860 1.00 0.00 C ATOM 518 C THR A 92 -13.330 2.994 5.255 1.00 0.00 C ATOM 519 O THR A 92 -12.474 3.086 4.385 1.00 0.00 O ATOM 520 CB THR A 92 -14.651 5.021 4.733 1.00 0.00 C ATOM 521 OG1 THR A 92 -13.703 5.815 4.013 1.00 0.00 O ATOM 522 CG2 THR A 92 -15.825 5.876 5.260 1.00 0.00 C ATOM 0 H THR A 92 -12.211 5.390 6.076 1.00 0.00 H new ATOM 0 HA THR A 92 -14.672 3.938 6.620 1.00 0.00 H new ATOM 0 HB THR A 92 -15.076 4.292 4.043 1.00 0.00 H new ATOM 0 HG1 THR A 92 -12.800 5.468 4.169 1.00 0.00 H new ATOM 0 HG21 THR A 92 -16.293 6.403 4.429 1.00 0.00 H new ATOM 0 HG22 THR A 92 -16.560 5.229 5.739 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.452 6.600 5.984 1.00 0.00 H new ATOM 523 N PRO A 93 -13.859 1.835 5.653 1.00 0.00 N ATOM 524 CA PRO A 93 -13.568 0.569 4.960 1.00 0.00 C ATOM 525 C PRO A 93 -14.509 0.404 3.757 1.00 0.00 C ATOM 526 O PRO A 93 -15.503 -0.314 3.764 1.00 0.00 O ATOM 527 CB PRO A 93 -13.742 -0.504 6.032 1.00 0.00 C ATOM 528 CG PRO A 93 -14.841 0.071 6.928 1.00 0.00 C ATOM 529 CD PRO A 93 -14.547 1.571 6.929 1.00 0.00 C ATOM 0 HA PRO A 93 -12.565 0.515 4.537 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -14.035 -1.461 5.600 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.819 -0.673 6.586 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -15.834 -0.144 6.534 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -14.800 -0.347 7.934 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -15.466 2.152 7.007 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -13.922 1.848 7.777 1.00 0.00 H new ATOM 530 N ASN A 94 -14.013 0.928 2.643 1.00 0.00 N ATOM 531 CA ASN A 94 -14.764 0.975 1.377 1.00 0.00 C ATOM 532 C ASN A 94 -14.044 0.197 0.256 1.00 0.00 C ATOM 533 O ASN A 94 -12.906 -0.240 0.427 1.00 0.00 O ATOM 534 CB ASN A 94 -14.956 2.459 1.002 1.00 0.00 C ATOM 535 CG ASN A 94 -13.646 3.257 0.909 1.00 0.00 C ATOM 536 OD1 ASN A 94 -12.573 2.724 0.663 1.00 0.00 O ATOM 537 ND2 ASN A 94 -13.749 4.545 1.079 1.00 0.00 N ATOM 0 H ASN A 94 -13.079 1.335 2.583 1.00 0.00 H new ATOM 0 HA ASN A 94 -15.733 0.491 1.502 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -15.473 2.517 0.044 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -15.603 2.929 1.742 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -12.921 5.137 1.008 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -14.657 4.961 1.283 1.00 0.00 H new ATOM 538 N GLU A 95 -14.633 0.280 -0.924 1.00 0.00 N ATOM 539 CA GLU A 95 -14.110 -0.299 -2.183 1.00 0.00 C ATOM 540 C GLU A 95 -12.681 0.170 -2.549 1.00 0.00 C ATOM 541 O GLU A 95 -11.913 -0.572 -3.154 1.00 0.00 O ATOM 542 CB GLU A 95 -15.102 0.046 -3.303 1.00 0.00 C ATOM 543 CG GLU A 95 -14.875 -0.802 -4.553 1.00 0.00 C ATOM 544 CD GLU A 95 -15.963 -0.547 -5.593 1.00 0.00 C ATOM 545 OE1 GLU A 95 -15.799 0.418 -6.366 1.00 0.00 O ATOM 546 OE2 GLU A 95 -16.947 -1.312 -5.560 1.00 0.00 O ATOM 0 H GLU A 95 -15.520 0.766 -1.053 1.00 0.00 H new ATOM 0 HA GLU A 95 -14.021 -1.377 -2.047 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -16.120 -0.104 -2.944 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -15.006 1.101 -3.559 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -13.898 -0.573 -4.980 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -14.865 -1.858 -4.283 1.00 0.00 H new ATOM 547 N GLU A 96 -12.290 1.300 -1.977 1.00 0.00 N ATOM 548 CA GLU A 96 -10.988 1.929 -2.232 1.00 0.00 C ATOM 549 C GLU A 96 -9.895 1.447 -1.286 1.00 0.00 C ATOM 550 O GLU A 96 -8.719 1.540 -1.637 1.00 0.00 O ATOM 551 CB GLU A 96 -11.119 3.435 -2.127 1.00 0.00 C ATOM 552 CG GLU A 96 -11.895 3.960 -3.346 1.00 0.00 C ATOM 553 CD GLU A 96 -12.220 5.444 -3.271 1.00 0.00 C ATOM 554 OE1 GLU A 96 -13.151 5.750 -2.501 1.00 0.00 O ATOM 555 OE2 GLU A 96 -11.615 6.221 -4.035 1.00 0.00 O ATOM 0 H GLU A 96 -12.869 1.817 -1.315 1.00 0.00 H new ATOM 0 HA GLU A 96 -10.690 1.638 -3.239 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.638 3.704 -1.207 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -10.132 3.896 -2.083 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -11.311 3.770 -4.247 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.824 3.398 -3.444 1.00 0.00 H new ATOM 556 N CYS A 97 -10.322 1.193 -0.054 1.00 0.00 N ATOM 557 CA CYS A 97 -9.520 0.552 0.979 1.00 0.00 C ATOM 558 C CYS A 97 -9.300 -0.955 0.773 1.00 0.00 C ATOM 559 O CYS A 97 -8.515 -1.612 1.457 1.00 0.00 O ATOM 560 CB CYS A 97 -10.064 0.774 2.405 1.00 0.00 C ATOM 561 SG CYS A 97 -9.039 0.120 3.766 1.00 0.00 S ATOM 0 H CYS A 97 -11.262 1.434 0.261 1.00 0.00 H new ATOM 0 HA CYS A 97 -8.558 1.054 0.876 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -10.196 1.845 2.559 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -11.052 0.318 2.470 1.00 0.00 H new ATOM 0 HG CYS A 97 -8.356 -0.901 3.342 1.00 0.00 H new ATOM 562 N LEU A 98 -10.062 -1.500 -0.162 1.00 0.00 N ATOM 563 CA LEU A 98 -9.923 -2.881 -0.643 1.00 0.00 C ATOM 564 C LEU A 98 -8.729 -3.007 -1.584 1.00 0.00 C ATOM 565 O LEU A 98 -8.630 -2.382 -2.631 1.00 0.00 O ATOM 566 CB LEU A 98 -11.255 -3.278 -1.264 1.00 0.00 C ATOM 567 CG LEU A 98 -12.174 -3.686 -0.117 1.00 0.00 C ATOM 568 CD1 LEU A 98 -13.657 -3.620 -0.507 1.00 0.00 C ATOM 569 CD2 LEU A 98 -11.838 -5.039 0.507 1.00 0.00 C ATOM 0 H LEU A 98 -10.814 -0.989 -0.624 1.00 0.00 H new ATOM 0 HA LEU A 98 -9.706 -3.575 0.169 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -11.683 -2.447 -1.825 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -11.124 -4.102 -1.966 1.00 0.00 H new ATOM 0 HG LEU A 98 -11.988 -2.941 0.657 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -14.270 -3.920 0.343 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -13.912 -2.601 -0.797 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.843 -4.293 -1.344 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -12.539 -5.252 1.314 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -11.911 -5.818 -0.252 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.824 -5.014 0.905 1.00 0.00 H new ATOM 570 N PHE A 99 -7.729 -3.660 -1.008 1.00 0.00 N ATOM 571 CA PHE A 99 -6.404 -3.825 -1.621 1.00 0.00 C ATOM 572 C PHE A 99 -6.076 -5.283 -1.917 1.00 0.00 C ATOM 573 O PHE A 99 -5.851 -6.111 -1.031 1.00 0.00 O ATOM 574 CB PHE A 99 -5.304 -3.280 -0.726 1.00 0.00 C ATOM 575 CG PHE A 99 -5.127 -1.758 -0.708 1.00 0.00 C ATOM 576 CD1 PHE A 99 -6.205 -0.893 -0.402 1.00 0.00 C ATOM 577 CD2 PHE A 99 -3.978 -1.248 -1.359 1.00 0.00 C ATOM 578 CE1 PHE A 99 -6.174 0.450 -0.815 1.00 0.00 C ATOM 579 CE2 PHE A 99 -3.939 0.100 -1.773 1.00 0.00 C ATOM 580 CZ PHE A 99 -5.049 0.927 -1.509 1.00 0.00 C ATOM 0 H PHE A 99 -7.809 -4.098 -0.090 1.00 0.00 H new ATOM 0 HA PHE A 99 -6.447 -3.266 -2.556 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -5.498 -3.613 0.294 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.360 -3.729 -1.034 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.054 -1.266 0.151 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.130 -1.892 -1.539 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -7.004 1.107 -0.602 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -3.072 0.492 -2.284 1.00 0.00 H new ATOM 0 HZ PHE A 99 -5.035 1.952 -1.848 1.00 0.00 H new ATOM 581 N LEU A 100 -6.168 -5.566 -3.189 1.00 0.00 N ATOM 582 CA LEU A 100 -5.986 -6.891 -3.763 1.00 0.00 C ATOM 583 C LEU A 100 -4.533 -7.374 -3.782 1.00 0.00 C ATOM 584 O LEU A 100 -3.715 -6.983 -4.626 1.00 0.00 O ATOM 585 CB LEU A 100 -6.602 -6.944 -5.161 1.00 0.00 C ATOM 586 CG LEU A 100 -7.277 -8.294 -5.233 1.00 0.00 C ATOM 587 CD1 LEU A 100 -8.754 -8.204 -5.636 1.00 0.00 C ATOM 588 CD2 LEU A 100 -6.546 -9.280 -6.147 1.00 0.00 C ATOM 0 H LEU A 100 -6.380 -4.856 -3.890 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.507 -7.585 -3.103 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.318 -6.135 -5.309 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.840 -6.841 -5.933 1.00 0.00 H new ATOM 0 HG LEU A 100 -7.228 -8.680 -4.215 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.183 -9.205 -5.670 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.294 -7.602 -4.905 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.835 -7.740 -6.619 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -7.079 -10.231 -6.157 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.505 -8.876 -7.159 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.533 -9.436 -5.777 1.00 0.00 H new ATOM 589 N GLU A 101 -4.269 -8.190 -2.771 1.00 0.00 N ATOM 590 CA GLU A 101 -2.960 -8.832 -2.612 1.00 0.00 C ATOM 591 C GLU A 101 -2.642 -9.943 -3.614 1.00 0.00 C ATOM 592 O GLU A 101 -2.965 -11.123 -3.460 1.00 0.00 O ATOM 593 CB GLU A 101 -2.642 -9.224 -1.168 1.00 0.00 C ATOM 594 CG GLU A 101 -3.521 -10.272 -0.483 1.00 0.00 C ATOM 595 CD GLU A 101 -3.026 -10.475 0.943 1.00 0.00 C ATOM 596 OE1 GLU A 101 -1.797 -10.632 1.137 1.00 0.00 O ATOM 597 OE2 GLU A 101 -3.891 -10.466 1.849 1.00 0.00 O ATOM 0 H GLU A 101 -4.943 -8.427 -2.043 1.00 0.00 H new ATOM 0 HA GLU A 101 -2.264 -8.036 -2.876 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -1.614 -9.586 -1.142 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -2.676 -8.317 -0.564 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -4.561 -9.947 -0.478 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -3.484 -11.213 -1.032 1.00 0.00 H new ATOM 598 N ARG A 102 -1.880 -9.480 -4.585 1.00 0.00 N ATOM 599 CA ARG A 102 -1.292 -10.282 -5.656 1.00 0.00 C ATOM 600 C ARG A 102 0.169 -10.562 -5.268 1.00 0.00 C ATOM 601 O ARG A 102 1.092 -9.802 -5.583 1.00 0.00 O ATOM 602 CB ARG A 102 -1.405 -9.486 -6.954 1.00 0.00 C ATOM 603 CG ARG A 102 -1.071 -10.376 -8.153 1.00 0.00 C ATOM 604 CD ARG A 102 -0.934 -9.604 -9.469 1.00 0.00 C ATOM 605 NE ARG A 102 0.203 -8.681 -9.369 1.00 0.00 N ATOM 606 CZ ARG A 102 1.407 -8.779 -9.957 1.00 0.00 C ATOM 607 NH1 ARG A 102 1.706 -9.698 -10.859 1.00 0.00 N ATOM 608 NH2 ARG A 102 2.318 -7.860 -9.673 1.00 0.00 N ATOM 0 H ARG A 102 -1.639 -8.492 -4.658 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.801 -11.235 -5.801 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -2.414 -9.088 -7.058 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.727 -8.633 -6.926 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -0.140 -10.906 -7.953 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -1.850 -11.131 -8.263 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -0.784 -10.297 -10.297 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -1.850 -9.051 -9.678 1.00 0.00 H new ATOM 0 HE ARG A 102 0.061 -7.862 -8.778 1.00 0.00 H new ATOM 0 HH11 ARG A 102 1.004 -10.382 -11.142 1.00 0.00 H new ATOM 0 HH12 ARG A 102 2.638 -9.723 -11.272 1.00 0.00 H new ATOM 0 HH21 ARG A 102 2.096 -7.105 -9.024 1.00 0.00 H new ATOM 0 HH22 ARG A 102 3.242 -7.907 -10.103 1.00 0.00 H new ATOM 609 N LEU A 103 0.243 -11.395 -4.242 1.00 0.00 N ATOM 610 CA LEU A 103 1.482 -12.078 -3.830 1.00 0.00 C ATOM 611 C LEU A 103 1.979 -12.950 -4.991 1.00 0.00 C ATOM 612 O LEU A 103 1.447 -13.989 -5.371 1.00 0.00 O ATOM 613 CB LEU A 103 1.253 -12.861 -2.534 1.00 0.00 C ATOM 614 CG LEU A 103 2.461 -13.727 -2.131 1.00 0.00 C ATOM 615 CD1 LEU A 103 3.625 -12.880 -1.620 1.00 0.00 C ATOM 616 CD2 LEU A 103 2.038 -14.718 -1.040 1.00 0.00 C ATOM 0 H LEU A 103 -0.560 -11.626 -3.658 1.00 0.00 H new ATOM 0 HA LEU A 103 2.266 -11.354 -3.607 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.030 -12.162 -1.728 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.378 -13.500 -2.652 1.00 0.00 H new ATOM 0 HG LEU A 103 2.799 -14.260 -3.020 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.456 -13.530 -1.347 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.945 -12.192 -2.402 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.306 -12.313 -0.746 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.893 -15.331 -0.754 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.678 -14.169 -0.170 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.242 -15.359 -1.419 1.00 0.00 H new ATOM 617 N GLU A 104 3.016 -12.370 -5.559 1.00 0.00 N ATOM 618 CA GLU A 104 3.628 -12.751 -6.831 1.00 0.00 C ATOM 619 C GLU A 104 4.393 -14.074 -6.754 1.00 0.00 C ATOM 620 O GLU A 104 4.885 -14.498 -5.702 1.00 0.00 O ATOM 621 CB GLU A 104 4.587 -11.639 -7.252 1.00 0.00 C ATOM 622 CG GLU A 104 3.886 -10.344 -7.660 1.00 0.00 C ATOM 623 CD GLU A 104 4.944 -9.313 -8.079 1.00 0.00 C ATOM 624 OE1 GLU A 104 5.470 -9.473 -9.196 1.00 0.00 O ATOM 625 OE2 GLU A 104 5.279 -8.452 -7.231 1.00 0.00 O ATOM 0 H GLU A 104 3.486 -11.575 -5.127 1.00 0.00 H new ATOM 0 HA GLU A 104 2.828 -12.891 -7.558 1.00 0.00 H new ATOM 0 HB2 GLU A 104 5.269 -11.428 -6.428 1.00 0.00 H new ATOM 0 HB3 GLU A 104 5.194 -11.991 -8.086 1.00 0.00 H new ATOM 0 HG2 GLU A 104 3.197 -10.532 -8.483 1.00 0.00 H new ATOM 0 HG3 GLU A 104 3.293 -9.959 -6.830 1.00 0.00 H new ATOM 626 N GLU A 105 4.545 -14.667 -7.936 1.00 0.00 N ATOM 627 CA GLU A 105 5.376 -15.859 -8.160 1.00 0.00 C ATOM 628 C GLU A 105 6.871 -15.497 -8.206 1.00 0.00 C ATOM 629 O GLU A 105 7.526 -15.458 -9.251 1.00 0.00 O ATOM 630 CB GLU A 105 4.921 -16.592 -9.428 1.00 0.00 C ATOM 631 CG GLU A 105 3.643 -17.410 -9.228 1.00 0.00 C ATOM 632 CD GLU A 105 2.355 -16.591 -9.055 1.00 0.00 C ATOM 633 OE1 GLU A 105 2.255 -15.507 -9.693 1.00 0.00 O ATOM 634 OE2 GLU A 105 1.481 -17.073 -8.308 1.00 0.00 O ATOM 0 H GLU A 105 4.088 -14.330 -8.783 1.00 0.00 H new ATOM 0 HA GLU A 105 5.245 -16.538 -7.318 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.757 -15.863 -10.222 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.719 -17.254 -9.763 1.00 0.00 H new ATOM 0 HG2 GLU A 105 3.519 -18.073 -10.084 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.771 -18.043 -8.350 1.00 0.00 H new ATOM 635 N ASN A 106 7.318 -15.084 -7.030 1.00 0.00 N ATOM 636 CA ASN A 106 8.707 -14.662 -6.735 1.00 0.00 C ATOM 637 C ASN A 106 8.929 -14.610 -5.214 1.00 0.00 C ATOM 638 O ASN A 106 9.484 -15.549 -4.654 1.00 0.00 O ATOM 639 CB ASN A 106 9.164 -13.362 -7.438 1.00 0.00 C ATOM 640 CG ASN A 106 8.176 -12.206 -7.540 1.00 0.00 C ATOM 641 OD1 ASN A 106 7.796 -11.572 -6.553 1.00 0.00 O ATOM 642 ND2 ASN A 106 7.749 -11.895 -8.750 1.00 0.00 N ATOM 0 H ASN A 106 6.710 -15.026 -6.213 1.00 0.00 H new ATOM 0 HA ASN A 106 9.352 -15.426 -7.170 1.00 0.00 H new ATOM 0 HB2 ASN A 106 10.049 -12.997 -6.917 1.00 0.00 H new ATOM 0 HB3 ASN A 106 9.474 -13.623 -8.450 1.00 0.00 H new ATOM 0 HD21 ASN A 106 7.096 -11.122 -8.877 1.00 0.00 H new ATOM 0 HD22 ASN A 106 8.072 -12.428 -9.557 1.00 0.00 H new ATOM 643 N HIS A 107 8.329 -13.599 -4.603 1.00 0.00 N ATOM 644 CA HIS A 107 8.432 -13.319 -3.155 1.00 0.00 C ATOM 645 C HIS A 107 7.495 -12.187 -2.731 1.00 0.00 C ATOM 646 O HIS A 107 6.806 -12.254 -1.710 1.00 0.00 O ATOM 647 CB HIS A 107 9.885 -12.894 -2.886 1.00 0.00 C ATOM 648 CG HIS A 107 10.231 -13.094 -1.416 1.00 0.00 C ATOM 649 ND1 HIS A 107 9.376 -13.049 -0.401 1.00 0.00 N ATOM 650 CD2 HIS A 107 11.426 -13.401 -0.939 1.00 0.00 C ATOM 651 CE1 HIS A 107 10.034 -13.318 0.718 1.00 0.00 C ATOM 652 NE2 HIS A 107 11.304 -13.524 0.383 1.00 0.00 N ATOM 0 H HIS A 107 7.742 -12.929 -5.099 1.00 0.00 H new ATOM 0 HA HIS A 107 8.150 -14.207 -2.589 1.00 0.00 H new ATOM 0 HB2 HIS A 107 10.563 -13.478 -3.509 1.00 0.00 H new ATOM 0 HB3 HIS A 107 10.022 -11.848 -3.160 1.00 0.00 H new ATOM 0 HD1 HIS A 107 8.380 -12.842 -0.471 1.00 0.00 H new ATOM 0 HD2 HIS A 107 12.332 -13.528 -1.513 1.00 0.00 H new ATOM 0 HE1 HIS A 107 9.617 -13.362 1.713 1.00 0.00 H new ATOM 653 N TYR A 108 7.548 -11.129 -3.537 1.00 0.00 N ATOM 654 CA TYR A 108 6.818 -9.854 -3.387 1.00 0.00 C ATOM 655 C TYR A 108 5.305 -9.986 -3.377 1.00 0.00 C ATOM 656 O TYR A 108 4.700 -10.703 -4.172 1.00 0.00 O ATOM 657 CB TYR A 108 7.257 -8.918 -4.516 1.00 0.00 C ATOM 658 CG TYR A 108 8.703 -8.464 -4.321 1.00 0.00 C ATOM 659 CD1 TYR A 108 8.919 -7.356 -3.477 1.00 0.00 C ATOM 660 CD2 TYR A 108 9.771 -9.282 -4.781 1.00 0.00 C ATOM 661 CE1 TYR A 108 10.228 -7.074 -3.049 1.00 0.00 C ATOM 662 CE2 TYR A 108 11.071 -9.001 -4.343 1.00 0.00 C ATOM 663 CZ TYR A 108 11.277 -7.893 -3.488 1.00 0.00 C ATOM 664 OH TYR A 108 12.550 -7.503 -3.217 1.00 0.00 O ATOM 0 H TYR A 108 8.138 -11.131 -4.369 1.00 0.00 H new ATOM 0 HA TYR A 108 7.072 -9.454 -2.405 1.00 0.00 H new ATOM 0 HB2 TYR A 108 7.158 -9.428 -5.474 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.600 -8.049 -4.548 1.00 0.00 H new ATOM 0 HD1 TYR A 108 8.093 -6.734 -3.164 1.00 0.00 H new ATOM 0 HD2 TYR A 108 9.583 -10.104 -5.455 1.00 0.00 H new ATOM 0 HE1 TYR A 108 10.422 -6.239 -2.392 1.00 0.00 H new ATOM 0 HE2 TYR A 108 11.901 -9.619 -4.652 1.00 0.00 H new ATOM 0 HH TYR A 108 12.570 -6.535 -3.064 1.00 0.00 H new ATOM 665 N ASN A 109 4.752 -9.051 -2.637 1.00 0.00 N ATOM 666 CA ASN A 109 3.303 -8.956 -2.419 1.00 0.00 C ATOM 667 C ASN A 109 2.839 -7.571 -2.851 1.00 0.00 C ATOM 668 O ASN A 109 3.229 -6.542 -2.303 1.00 0.00 O ATOM 669 CB ASN A 109 2.955 -9.190 -0.945 1.00 0.00 C ATOM 670 CG ASN A 109 1.477 -9.470 -0.665 1.00 0.00 C ATOM 671 OD1 ASN A 109 0.568 -9.130 -1.414 1.00 0.00 O ATOM 672 ND2 ASN A 109 1.227 -10.145 0.432 1.00 0.00 N ATOM 0 H ASN A 109 5.288 -8.325 -2.161 1.00 0.00 H new ATOM 0 HA ASN A 109 2.798 -9.723 -3.006 1.00 0.00 H new ATOM 0 HB2 ASN A 109 3.544 -10.030 -0.577 1.00 0.00 H new ATOM 0 HB3 ASN A 109 3.258 -8.313 -0.372 1.00 0.00 H new ATOM 0 HD21 ASN A 109 0.267 -10.393 0.670 1.00 0.00 H new ATOM 0 HD22 ASN A 109 1.993 -10.422 1.046 1.00 0.00 H new ATOM 673 N THR A 110 1.955 -7.609 -3.839 1.00 0.00 N ATOM 674 CA THR A 110 1.503 -6.359 -4.470 1.00 0.00 C ATOM 675 C THR A 110 0.005 -6.127 -4.310 1.00 0.00 C ATOM 676 O THR A 110 -0.789 -7.054 -4.309 1.00 0.00 O ATOM 677 CB THR A 110 1.888 -6.224 -5.942 1.00 0.00 C ATOM 678 OG1 THR A 110 1.249 -7.231 -6.734 1.00 0.00 O ATOM 679 CG2 THR A 110 3.407 -6.241 -6.101 1.00 0.00 C ATOM 0 H THR A 110 1.542 -8.461 -4.218 1.00 0.00 H new ATOM 0 HA THR A 110 2.041 -5.585 -3.923 1.00 0.00 H new ATOM 0 HB THR A 110 1.533 -5.261 -6.309 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.263 -8.084 -6.252 1.00 0.00 H new ATOM 0 HG21 THR A 110 3.664 -6.144 -7.156 1.00 0.00 H new ATOM 0 HG22 THR A 110 3.840 -5.410 -5.544 1.00 0.00 H new ATOM 0 HG23 THR A 110 3.803 -7.181 -5.717 1.00 0.00 H new ATOM 680 N TYR A 111 -0.338 -4.848 -4.311 1.00 0.00 N ATOM 681 CA TYR A 111 -1.694 -4.405 -3.968 1.00 0.00 C ATOM 682 C TYR A 111 -2.298 -3.568 -5.077 1.00 0.00 C ATOM 683 O TYR A 111 -1.751 -2.534 -5.472 1.00 0.00 O ATOM 684 CB TYR A 111 -1.694 -3.617 -2.661 1.00 0.00 C ATOM 685 CG TYR A 111 -1.280 -4.492 -1.481 1.00 0.00 C ATOM 686 CD1 TYR A 111 -2.251 -5.271 -0.841 1.00 0.00 C ATOM 687 CD2 TYR A 111 0.088 -4.535 -1.120 1.00 0.00 C ATOM 688 CE1 TYR A 111 -1.855 -6.140 0.197 1.00 0.00 C ATOM 689 CE2 TYR A 111 0.489 -5.418 -0.109 1.00 0.00 C ATOM 690 CZ TYR A 111 -0.491 -6.203 0.532 1.00 0.00 C ATOM 691 OH TYR A 111 -0.097 -7.016 1.550 1.00 0.00 O ATOM 0 H TYR A 111 0.303 -4.090 -4.546 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.306 -5.298 -3.841 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.012 -2.771 -2.745 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -2.688 -3.208 -2.481 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -3.288 -5.208 -1.137 1.00 0.00 H new ATOM 0 HD2 TYR A 111 0.808 -3.900 -1.614 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.582 -6.742 0.722 1.00 0.00 H new ATOM 0 HE2 TYR A 111 1.528 -5.496 0.174 1.00 0.00 H new ATOM 0 HH TYR A 111 0.875 -6.953 1.662 1.00 0.00 H new ATOM 692 N ILE A 112 -3.294 -4.196 -5.681 1.00 0.00 N ATOM 693 CA ILE A 112 -4.143 -3.553 -6.700 1.00 0.00 C ATOM 694 C ILE A 112 -5.362 -3.052 -5.931 1.00 0.00 C ATOM 695 O ILE A 112 -6.049 -3.848 -5.296 1.00 0.00 O ATOM 696 CB ILE A 112 -4.618 -4.541 -7.776 1.00 0.00 C ATOM 697 CG1 ILE A 112 -3.521 -5.521 -8.235 1.00 0.00 C ATOM 698 CG2 ILE A 112 -5.140 -3.729 -8.974 1.00 0.00 C ATOM 699 CD1 ILE A 112 -4.031 -6.732 -9.012 1.00 0.00 C ATOM 0 H ILE A 112 -3.545 -5.165 -5.487 1.00 0.00 H new ATOM 0 HA ILE A 112 -3.588 -2.770 -7.216 1.00 0.00 H new ATOM 0 HB ILE A 112 -5.405 -5.158 -7.342 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -2.808 -4.981 -8.858 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.977 -5.872 -7.358 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -5.484 -4.410 -9.753 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -5.968 -3.098 -8.652 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -4.338 -3.104 -9.367 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.189 -7.365 -9.293 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -4.720 -7.301 -8.388 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -4.549 -6.396 -9.911 1.00 0.00 H new ATOM 700 N SER A 113 -5.589 -1.741 -5.908 1.00 0.00 N ATOM 701 CA SER A 113 -6.836 -1.257 -5.283 1.00 0.00 C ATOM 702 C SER A 113 -8.024 -1.734 -6.103 1.00 0.00 C ATOM 703 O SER A 113 -8.141 -1.498 -7.305 1.00 0.00 O ATOM 704 CB SER A 113 -6.933 0.267 -5.126 1.00 0.00 C ATOM 705 OG SER A 113 -8.141 0.577 -4.424 1.00 0.00 O ATOM 0 H SER A 113 -4.972 -1.024 -6.288 1.00 0.00 H new ATOM 0 HA SER A 113 -6.836 -1.669 -4.274 1.00 0.00 H new ATOM 0 HB2 SER A 113 -6.070 0.647 -4.580 1.00 0.00 H new ATOM 0 HB3 SER A 113 -6.929 0.749 -6.104 1.00 0.00 H new ATOM 0 HG SER A 113 -7.925 0.864 -3.512 1.00 0.00 H new ATOM 706 N LYS A 114 -8.854 -2.491 -5.396 1.00 0.00 N ATOM 707 CA LYS A 114 -10.036 -3.181 -5.927 1.00 0.00 C ATOM 708 C LYS A 114 -10.845 -2.305 -6.916 1.00 0.00 C ATOM 709 O LYS A 114 -11.054 -2.722 -8.043 1.00 0.00 O ATOM 710 CB LYS A 114 -10.927 -3.677 -4.797 1.00 0.00 C ATOM 711 CG LYS A 114 -12.211 -4.341 -5.278 1.00 0.00 C ATOM 712 CD LYS A 114 -13.003 -4.884 -4.095 1.00 0.00 C ATOM 713 CE LYS A 114 -14.365 -5.401 -4.564 1.00 0.00 C ATOM 714 NZ LYS A 114 -15.085 -5.931 -3.400 1.00 0.00 N ATOM 0 H LYS A 114 -8.722 -2.651 -4.397 1.00 0.00 H new ATOM 0 HA LYS A 114 -9.670 -4.039 -6.490 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -10.367 -4.387 -4.189 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -11.182 -2.837 -4.152 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -12.816 -3.621 -5.829 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -11.973 -5.151 -5.967 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -12.447 -5.688 -3.614 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -13.140 -4.101 -3.349 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -14.936 -4.598 -5.030 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -14.237 -6.179 -5.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -15.993 -6.334 -3.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -14.514 -6.672 -2.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -15.259 -5.163 -2.720 1.00 0.00 H new ATOM 715 N LYS A 115 -11.116 -1.063 -6.518 1.00 0.00 N ATOM 716 CA LYS A 115 -11.939 -0.126 -7.313 1.00 0.00 C ATOM 717 C LYS A 115 -11.579 -0.054 -8.812 1.00 0.00 C ATOM 718 O LYS A 115 -12.473 -0.094 -9.663 1.00 0.00 O ATOM 719 CB LYS A 115 -11.965 1.282 -6.704 1.00 0.00 C ATOM 720 CG LYS A 115 -10.572 1.902 -6.561 1.00 0.00 C ATOM 721 CD LYS A 115 -10.629 3.382 -6.924 1.00 0.00 C ATOM 722 CE LYS A 115 -9.273 4.060 -6.716 1.00 0.00 C ATOM 723 NZ LYS A 115 -8.262 3.462 -7.590 1.00 0.00 N ATOM 0 H LYS A 115 -10.777 -0.670 -5.640 1.00 0.00 H new ATOM 0 HA LYS A 115 -12.940 -0.555 -7.265 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -12.582 1.929 -7.327 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -12.439 1.238 -5.723 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -10.213 1.782 -5.539 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -9.865 1.385 -7.210 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -10.937 3.492 -7.964 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -11.383 3.879 -6.314 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -9.357 5.127 -6.924 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -8.966 3.962 -5.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -7.606 2.890 -7.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.728 2.856 -8.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -7.733 4.215 -8.075 1.00 0.00 H new ATOM 724 N HIS A 116 -10.283 -0.048 -9.132 1.00 0.00 N ATOM 725 CA HIS A 116 -9.810 -0.050 -10.527 1.00 0.00 C ATOM 726 C HIS A 116 -8.914 -1.248 -10.877 1.00 0.00 C ATOM 727 O HIS A 116 -8.040 -1.187 -11.751 1.00 0.00 O ATOM 728 CB HIS A 116 -9.188 1.294 -10.897 1.00 0.00 C ATOM 729 CG HIS A 116 -10.209 2.405 -11.139 1.00 0.00 C ATOM 730 ND1 HIS A 116 -11.513 2.367 -10.838 1.00 0.00 N ATOM 731 CD2 HIS A 116 -9.926 3.643 -11.503 1.00 0.00 C ATOM 732 CE1 HIS A 116 -12.013 3.586 -10.990 1.00 0.00 C ATOM 733 NE2 HIS A 116 -11.027 4.371 -11.401 1.00 0.00 N ATOM 0 H HIS A 116 -9.533 -0.042 -8.441 1.00 0.00 H new ATOM 0 HA HIS A 116 -10.691 -0.184 -11.154 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -8.513 1.602 -10.099 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -8.583 1.168 -11.795 1.00 0.00 H new ATOM 0 HD1 HIS A 116 -12.033 1.541 -10.542 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -8.960 4.001 -11.829 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -13.036 3.884 -10.812 1.00 0.00 H new ATOM 734 N ALA A 117 -9.332 -2.397 -10.353 1.00 0.00 N ATOM 735 CA ALA A 117 -8.674 -3.707 -10.563 1.00 0.00 C ATOM 736 C ALA A 117 -8.571 -4.171 -12.029 1.00 0.00 C ATOM 737 O ALA A 117 -7.599 -4.799 -12.434 1.00 0.00 O ATOM 738 CB ALA A 117 -9.384 -4.776 -9.737 1.00 0.00 C ATOM 0 H ALA A 117 -10.156 -2.457 -9.755 1.00 0.00 H new ATOM 0 HA ALA A 117 -7.644 -3.564 -10.235 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -8.898 -5.739 -9.893 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -9.335 -4.512 -8.681 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -10.427 -4.842 -10.046 1.00 0.00 H new ATOM 739 N GLU A 118 -9.504 -3.673 -12.833 1.00 0.00 N ATOM 740 CA GLU A 118 -9.570 -3.957 -14.284 1.00 0.00 C ATOM 741 C GLU A 118 -8.723 -3.004 -15.141 1.00 0.00 C ATOM 742 O GLU A 118 -8.316 -3.334 -16.254 1.00 0.00 O ATOM 743 CB GLU A 118 -11.025 -4.025 -14.781 1.00 0.00 C ATOM 744 CG GLU A 118 -11.771 -2.688 -14.967 1.00 0.00 C ATOM 745 CD GLU A 118 -12.208 -2.006 -13.670 1.00 0.00 C ATOM 746 OE1 GLU A 118 -13.172 -2.518 -13.059 1.00 0.00 O ATOM 747 OE2 GLU A 118 -11.516 -1.046 -13.269 1.00 0.00 O ATOM 0 H GLU A 118 -10.247 -3.055 -12.505 1.00 0.00 H new ATOM 0 HA GLU A 118 -9.122 -4.942 -14.412 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -11.031 -4.551 -15.736 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -11.594 -4.634 -14.078 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -11.128 -2.004 -15.520 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -12.653 -2.864 -15.582 1.00 0.00 H new ATOM 748 N LYS A 119 -8.436 -1.854 -14.550 1.00 0.00 N ATOM 749 CA LYS A 119 -7.475 -0.872 -15.083 1.00 0.00 C ATOM 750 C LYS A 119 -6.108 -1.090 -14.410 1.00 0.00 C ATOM 751 O LYS A 119 -5.159 -0.349 -14.654 1.00 0.00 O ATOM 752 CB LYS A 119 -8.098 0.500 -14.798 1.00 0.00 C ATOM 753 CG LYS A 119 -7.544 1.573 -15.742 1.00 0.00 C ATOM 754 CD LYS A 119 -8.232 2.924 -15.501 1.00 0.00 C ATOM 755 CE LYS A 119 -7.613 4.013 -16.363 1.00 0.00 C ATOM 756 NZ LYS A 119 -8.304 5.288 -16.128 1.00 0.00 N ATOM 0 H LYS A 119 -8.866 -1.563 -13.672 1.00 0.00 H new ATOM 0 HA LYS A 119 -7.290 -0.966 -16.153 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -9.181 0.440 -14.909 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -7.899 0.784 -13.765 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -6.469 1.676 -15.591 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -7.693 1.264 -16.777 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -9.296 2.839 -15.724 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -8.148 3.196 -14.449 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -6.553 4.115 -16.130 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.683 3.740 -17.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -7.877 6.029 -16.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -9.310 5.188 -16.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -8.215 5.551 -15.126 1.00 0.00 H new ATOM 757 N ASN A 120 -5.980 -2.251 -13.749 1.00 0.00 N ATOM 758 CA ASN A 120 -4.867 -2.676 -12.889 1.00 0.00 C ATOM 759 C ASN A 120 -4.177 -1.547 -12.120 1.00 0.00 C ATOM 760 O ASN A 120 -2.991 -1.266 -12.239 1.00 0.00 O ATOM 761 CB ASN A 120 -3.872 -3.514 -13.682 1.00 0.00 C ATOM 762 CG ASN A 120 -4.444 -4.864 -14.105 1.00 0.00 C ATOM 763 OD1 ASN A 120 -4.835 -5.713 -13.327 1.00 0.00 O ATOM 764 ND2 ASN A 120 -4.430 -5.092 -15.391 1.00 0.00 N ATOM 0 H ASN A 120 -6.704 -2.968 -13.806 1.00 0.00 H new ATOM 0 HA ASN A 120 -5.315 -3.292 -12.109 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.563 -2.961 -14.569 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -2.978 -3.675 -13.080 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -4.749 -5.990 -15.753 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -4.100 -4.372 -16.033 1.00 0.00 H new ATOM 765 N TRP A 121 -4.976 -0.979 -11.231 1.00 0.00 N ATOM 766 CA TRP A 121 -4.533 0.129 -10.386 1.00 0.00 C ATOM 767 C TRP A 121 -3.813 -0.291 -9.118 1.00 0.00 C ATOM 768 O TRP A 121 -4.372 -0.412 -8.025 1.00 0.00 O ATOM 769 CB TRP A 121 -5.692 1.074 -10.124 1.00 0.00 C ATOM 770 CG TRP A 121 -5.819 2.093 -11.259 1.00 0.00 C ATOM 771 CD1 TRP A 121 -5.616 1.919 -12.568 1.00 0.00 C ATOM 772 CD2 TRP A 121 -6.063 3.431 -11.046 1.00 0.00 C ATOM 773 NE1 TRP A 121 -5.728 3.081 -13.203 1.00 0.00 N ATOM 774 CE2 TRP A 121 -6.004 4.035 -12.316 1.00 0.00 C ATOM 775 CE3 TRP A 121 -6.245 4.200 -9.883 1.00 0.00 C ATOM 776 CZ2 TRP A 121 -6.118 5.422 -12.455 1.00 0.00 C ATOM 777 CZ3 TRP A 121 -6.417 5.582 -10.028 1.00 0.00 C ATOM 778 CH2 TRP A 121 -6.384 6.190 -11.305 1.00 0.00 C ATOM 0 H TRP A 121 -5.942 -1.266 -11.072 1.00 0.00 H new ATOM 0 HA TRP A 121 -3.765 0.664 -10.944 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -6.618 0.507 -10.031 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -5.540 1.592 -9.177 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -5.394 0.974 -13.040 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -5.620 3.220 -14.208 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -6.252 3.738 -8.907 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -6.005 5.892 -13.421 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -6.577 6.193 -9.152 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -6.564 7.251 -11.399 1.00 0.00 H new ATOM 779 N PHE A 122 -2.519 -0.442 -9.330 1.00 0.00 N ATOM 780 CA PHE A 122 -1.578 -0.922 -8.294 1.00 0.00 C ATOM 781 C PHE A 122 -1.057 0.179 -7.376 1.00 0.00 C ATOM 782 O PHE A 122 -1.494 1.325 -7.433 1.00 0.00 O ATOM 783 CB PHE A 122 -0.390 -1.567 -9.012 1.00 0.00 C ATOM 784 CG PHE A 122 -0.609 -3.017 -9.408 1.00 0.00 C ATOM 785 CD1 PHE A 122 -1.310 -3.332 -10.596 1.00 0.00 C ATOM 786 CD2 PHE A 122 0.127 -3.995 -8.707 1.00 0.00 C ATOM 787 CE1 PHE A 122 -1.252 -4.648 -11.102 1.00 0.00 C ATOM 788 CE2 PHE A 122 0.187 -5.316 -9.221 1.00 0.00 C ATOM 789 CZ PHE A 122 -0.497 -5.621 -10.413 1.00 0.00 C ATOM 0 H PHE A 122 -2.073 -0.238 -10.225 1.00 0.00 H new ATOM 0 HA PHE A 122 -2.118 -1.623 -7.658 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -0.165 -0.988 -9.908 1.00 0.00 H new ATOM 0 HB3 PHE A 122 0.486 -1.508 -8.366 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -1.883 -2.574 -11.110 1.00 0.00 H new ATOM 0 HD2 PHE A 122 0.639 -3.741 -7.790 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -1.780 -4.908 -12.007 1.00 0.00 H new ATOM 0 HE2 PHE A 122 0.751 -6.078 -8.704 1.00 0.00 H new ATOM 0 HZ PHE A 122 -0.443 -6.624 -10.810 1.00 0.00 H new ATOM 790 N VAL A 123 -0.245 -0.251 -6.420 1.00 0.00 N ATOM 791 CA VAL A 123 0.580 0.652 -5.612 1.00 0.00 C ATOM 792 C VAL A 123 2.086 0.496 -5.858 1.00 0.00 C ATOM 793 O VAL A 123 2.616 -0.618 -5.838 1.00 0.00 O ATOM 794 CB VAL A 123 0.224 0.556 -4.111 1.00 0.00 C ATOM 795 CG1 VAL A 123 -1.214 1.008 -3.855 1.00 0.00 C ATOM 796 CG2 VAL A 123 0.470 -0.828 -3.496 1.00 0.00 C ATOM 0 H VAL A 123 -0.136 -1.236 -6.178 1.00 0.00 H new ATOM 0 HA VAL A 123 0.336 1.660 -5.948 1.00 0.00 H new ATOM 0 HB VAL A 123 0.911 1.236 -3.608 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -1.436 0.930 -2.791 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -1.332 2.043 -4.175 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -1.900 0.374 -4.416 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.195 -0.811 -2.441 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -0.135 -1.570 -4.017 1.00 0.00 H new ATOM 0 HG23 VAL A 123 1.524 -1.087 -3.592 1.00 0.00 H new ATOM 797 N GLY A 124 2.694 1.622 -6.203 1.00 0.00 N ATOM 798 CA GLY A 124 4.140 1.702 -6.494 1.00 0.00 C ATOM 799 C GLY A 124 4.645 3.132 -6.365 1.00 0.00 C ATOM 800 O GLY A 124 4.743 3.875 -7.338 1.00 0.00 O ATOM 0 H GLY A 124 2.208 2.514 -6.292 1.00 0.00 H new ATOM 0 HA2 GLY A 124 4.689 1.056 -5.809 1.00 0.00 H new ATOM 0 HA3 GLY A 124 4.332 1.334 -7.502 1.00 0.00 H new ATOM 801 N LEU A 125 5.036 3.438 -5.139 1.00 0.00 N ATOM 802 CA LEU A 125 5.380 4.808 -4.727 1.00 0.00 C ATOM 803 C LEU A 125 6.534 5.499 -5.452 1.00 0.00 C ATOM 804 O LEU A 125 7.658 5.018 -5.568 1.00 0.00 O ATOM 805 CB LEU A 125 5.403 4.937 -3.186 1.00 0.00 C ATOM 806 CG LEU A 125 6.251 3.902 -2.460 1.00 0.00 C ATOM 807 CD1 LEU A 125 7.651 4.446 -2.207 1.00 0.00 C ATOM 808 CD2 LEU A 125 5.623 3.626 -1.099 1.00 0.00 C ATOM 0 H LEU A 125 5.127 2.749 -4.393 1.00 0.00 H new ATOM 0 HA LEU A 125 4.555 5.416 -5.099 1.00 0.00 H new ATOM 0 HB2 LEU A 125 5.770 5.930 -2.926 1.00 0.00 H new ATOM 0 HB3 LEU A 125 4.380 4.868 -2.817 1.00 0.00 H new ATOM 0 HG LEU A 125 6.304 3.002 -3.072 1.00 0.00 H new ATOM 0 HD11 LEU A 125 8.245 3.694 -1.687 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.125 4.689 -3.158 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.587 5.345 -1.594 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.220 2.886 -0.566 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.589 4.549 -0.520 1.00 0.00 H new ATOM 0 HD23 LEU A 125 4.611 3.246 -1.236 1.00 0.00 H new ATOM 809 N LYS A 126 6.226 6.784 -5.633 1.00 0.00 N ATOM 810 CA LYS A 126 7.039 7.752 -6.365 1.00 0.00 C ATOM 811 C LYS A 126 8.346 7.947 -5.593 1.00 0.00 C ATOM 812 O LYS A 126 8.367 8.158 -4.372 1.00 0.00 O ATOM 813 CB LYS A 126 6.212 9.027 -6.553 1.00 0.00 C ATOM 814 CG LYS A 126 7.017 10.094 -7.317 1.00 0.00 C ATOM 815 CD LYS A 126 6.311 11.451 -7.346 1.00 0.00 C ATOM 816 CE LYS A 126 7.199 12.550 -7.943 1.00 0.00 C ATOM 817 NZ LYS A 126 7.425 12.339 -9.377 1.00 0.00 N ATOM 0 H LYS A 126 5.370 7.193 -5.259 1.00 0.00 H new ATOM 0 HA LYS A 126 7.314 7.415 -7.365 1.00 0.00 H new ATOM 0 HB2 LYS A 126 5.297 8.795 -7.099 1.00 0.00 H new ATOM 0 HB3 LYS A 126 5.913 9.418 -5.581 1.00 0.00 H new ATOM 0 HG2 LYS A 126 7.996 10.207 -6.852 1.00 0.00 H new ATOM 0 HG3 LYS A 126 7.186 9.754 -8.339 1.00 0.00 H new ATOM 0 HD2 LYS A 126 5.394 11.370 -7.929 1.00 0.00 H new ATOM 0 HD3 LYS A 126 6.021 11.730 -6.333 1.00 0.00 H new ATOM 0 HE2 LYS A 126 6.731 13.522 -7.787 1.00 0.00 H new ATOM 0 HE3 LYS A 126 8.156 12.569 -7.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 8.029 13.100 -9.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 7.893 11.422 -9.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 6.513 12.346 -9.877 1.00 0.00 H new ATOM 818 N LYS A 127 9.391 7.833 -6.391 1.00 0.00 N ATOM 819 CA LYS A 127 10.809 7.764 -5.975 1.00 0.00 C ATOM 820 C LYS A 127 11.228 8.662 -4.802 1.00 0.00 C ATOM 821 O LYS A 127 11.846 8.199 -3.847 1.00 0.00 O ATOM 822 CB LYS A 127 11.634 8.062 -7.226 1.00 0.00 C ATOM 823 CG LYS A 127 13.106 7.767 -7.023 1.00 0.00 C ATOM 824 CD LYS A 127 13.886 8.378 -8.176 1.00 0.00 C ATOM 825 CE LYS A 127 15.359 7.973 -8.142 1.00 0.00 C ATOM 826 NZ LYS A 127 15.462 6.520 -8.349 1.00 0.00 N ATOM 0 H LYS A 127 9.285 7.782 -7.404 1.00 0.00 H new ATOM 0 HA LYS A 127 10.985 6.767 -5.570 1.00 0.00 H new ATOM 0 HB2 LYS A 127 11.257 7.467 -8.058 1.00 0.00 H new ATOM 0 HB3 LYS A 127 11.509 9.109 -7.501 1.00 0.00 H new ATOM 0 HG2 LYS A 127 13.447 8.180 -6.074 1.00 0.00 H new ATOM 0 HG3 LYS A 127 13.274 6.691 -6.981 1.00 0.00 H new ATOM 0 HD2 LYS A 127 13.444 8.063 -9.121 1.00 0.00 H new ATOM 0 HD3 LYS A 127 13.807 9.464 -8.133 1.00 0.00 H new ATOM 0 HE2 LYS A 127 15.913 8.504 -8.916 1.00 0.00 H new ATOM 0 HE3 LYS A 127 15.803 8.249 -7.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 16.414 6.285 -8.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 15.290 6.028 -7.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 14.755 6.218 -9.050 1.00 0.00 H new ATOM 827 N ASN A 128 10.727 9.885 -4.818 1.00 0.00 N ATOM 828 CA ASN A 128 10.988 10.962 -3.836 1.00 0.00 C ATOM 829 C ASN A 128 10.434 10.761 -2.400 1.00 0.00 C ATOM 830 O ASN A 128 10.680 11.599 -1.531 1.00 0.00 O ATOM 831 CB ASN A 128 10.410 12.228 -4.450 1.00 0.00 C ATOM 832 CG ASN A 128 8.872 12.217 -4.486 1.00 0.00 C ATOM 833 OD1 ASN A 128 8.213 11.211 -4.673 1.00 0.00 O ATOM 834 ND2 ASN A 128 8.297 13.341 -4.139 1.00 0.00 N ATOM 0 H ASN A 128 10.088 10.186 -5.554 1.00 0.00 H new ATOM 0 HA ASN A 128 12.065 10.991 -3.669 1.00 0.00 H new ATOM 0 HB2 ASN A 128 10.751 13.092 -3.880 1.00 0.00 H new ATOM 0 HB3 ASN A 128 10.793 12.344 -5.464 1.00 0.00 H new ATOM 0 HD21 ASN A 128 7.285 13.381 -4.022 1.00 0.00 H new ATOM 0 HD22 ASN A 128 8.862 14.177 -3.985 1.00 0.00 H new ATOM 835 N GLY A 129 9.536 9.781 -2.237 1.00 0.00 N ATOM 836 CA GLY A 129 8.839 9.495 -0.961 1.00 0.00 C ATOM 837 C GLY A 129 7.369 9.934 -0.989 1.00 0.00 C ATOM 838 O GLY A 129 6.853 10.492 -0.028 1.00 0.00 O ATOM 0 H GLY A 129 9.265 9.152 -2.993 1.00 0.00 H new ATOM 0 HA2 GLY A 129 8.893 8.427 -0.752 1.00 0.00 H new ATOM 0 HA3 GLY A 129 9.353 10.006 -0.147 1.00 0.00 H new ATOM 839 N SER A 130 6.690 9.646 -2.097 1.00 0.00 N ATOM 840 CA SER A 130 5.262 10.006 -2.294 1.00 0.00 C ATOM 841 C SER A 130 4.483 8.818 -2.837 1.00 0.00 C ATOM 842 O SER A 130 4.969 8.076 -3.680 1.00 0.00 O ATOM 843 CB SER A 130 5.138 11.158 -3.293 1.00 0.00 C ATOM 844 OG SER A 130 5.817 12.279 -2.740 1.00 0.00 O ATOM 0 H SER A 130 7.102 9.157 -2.892 1.00 0.00 H new ATOM 0 HA SER A 130 4.857 10.304 -1.327 1.00 0.00 H new ATOM 0 HB2 SER A 130 5.574 10.881 -4.253 1.00 0.00 H new ATOM 0 HB3 SER A 130 4.090 11.396 -3.475 1.00 0.00 H new ATOM 0 HG SER A 130 5.502 13.099 -3.175 1.00 0.00 H new ATOM 845 N CYS A 131 3.293 8.611 -2.300 1.00 0.00 N ATOM 846 CA CYS A 131 2.385 7.540 -2.755 1.00 0.00 C ATOM 847 C CYS A 131 1.489 7.943 -3.938 1.00 0.00 C ATOM 848 O CYS A 131 0.283 8.166 -3.843 1.00 0.00 O ATOM 849 CB CYS A 131 1.537 6.997 -1.615 1.00 0.00 C ATOM 850 SG CYS A 131 2.483 5.845 -0.558 1.00 0.00 S ATOM 0 H CYS A 131 2.917 9.173 -1.536 1.00 0.00 H new ATOM 0 HA CYS A 131 3.043 6.750 -3.116 1.00 0.00 H new ATOM 0 HB2 CYS A 131 1.167 7.825 -1.010 1.00 0.00 H new ATOM 0 HB3 CYS A 131 0.665 6.485 -2.022 1.00 0.00 H new ATOM 0 HG CYS A 131 1.659 5.099 0.117 1.00 0.00 H new ATOM 851 N LYS A 132 2.214 8.024 -5.041 1.00 0.00 N ATOM 852 CA LYS A 132 1.708 8.350 -6.374 1.00 0.00 C ATOM 853 C LYS A 132 1.786 7.082 -7.259 1.00 0.00 C ATOM 854 O LYS A 132 2.850 6.536 -7.534 1.00 0.00 O ATOM 855 CB LYS A 132 2.470 9.511 -6.990 1.00 0.00 C ATOM 856 CG LYS A 132 1.814 9.971 -8.293 1.00 0.00 C ATOM 857 CD LYS A 132 2.869 10.362 -9.340 1.00 0.00 C ATOM 858 CE LYS A 132 3.681 9.160 -9.838 1.00 0.00 C ATOM 859 NZ LYS A 132 2.827 8.250 -10.624 1.00 0.00 N ATOM 0 H LYS A 132 3.220 7.857 -5.037 1.00 0.00 H new ATOM 0 HA LYS A 132 0.669 8.671 -6.298 1.00 0.00 H new ATOM 0 HB2 LYS A 132 2.506 10.341 -6.285 1.00 0.00 H new ATOM 0 HB3 LYS A 132 3.500 9.212 -7.184 1.00 0.00 H new ATOM 0 HG2 LYS A 132 1.185 9.173 -8.688 1.00 0.00 H new ATOM 0 HG3 LYS A 132 1.163 10.822 -8.094 1.00 0.00 H new ATOM 0 HD2 LYS A 132 2.375 10.838 -10.187 1.00 0.00 H new ATOM 0 HD3 LYS A 132 3.546 11.100 -8.910 1.00 0.00 H new ATOM 0 HE2 LYS A 132 4.515 9.505 -10.450 1.00 0.00 H new ATOM 0 HE3 LYS A 132 4.108 8.625 -8.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 2.812 7.313 -10.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 1.860 8.630 -10.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 3.206 8.165 -11.589 1.00 0.00 H new ATOM 860 N ARG A 133 0.593 6.524 -7.404 1.00 0.00 N ATOM 861 CA ARG A 133 0.307 5.290 -8.145 1.00 0.00 C ATOM 862 C ARG A 133 -0.599 5.506 -9.366 1.00 0.00 C ATOM 863 O ARG A 133 -0.172 6.122 -10.346 1.00 0.00 O ATOM 864 CB ARG A 133 -0.132 4.147 -7.203 1.00 0.00 C ATOM 865 CG ARG A 133 -1.210 4.445 -6.153 1.00 0.00 C ATOM 866 CD ARG A 133 -0.691 5.118 -4.877 1.00 0.00 C ATOM 867 NE ARG A 133 0.125 4.193 -4.078 1.00 0.00 N ATOM 868 CZ ARG A 133 1.465 4.170 -3.997 1.00 0.00 C ATOM 869 NH1 ARG A 133 2.209 4.777 -4.900 1.00 0.00 N ATOM 870 NH2 ARG A 133 2.057 3.355 -3.142 1.00 0.00 N ATOM 0 H ARG A 133 -0.245 6.933 -6.992 1.00 0.00 H new ATOM 0 HA ARG A 133 1.246 4.956 -8.587 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -0.489 3.324 -7.822 1.00 0.00 H new ATOM 0 HB3 ARG A 133 0.754 3.790 -6.678 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -1.969 5.085 -6.603 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -1.701 3.511 -5.881 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -0.098 5.994 -5.141 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -1.533 5.471 -4.281 1.00 0.00 H new ATOM 0 HE ARG A 133 -0.379 3.497 -3.528 1.00 0.00 H new ATOM 0 HH11 ARG A 133 1.768 5.273 -5.674 1.00 0.00 H new ATOM 0 HH12 ARG A 133 3.226 4.750 -4.825 1.00 0.00 H new ATOM 0 HH21 ARG A 133 1.496 2.746 -2.546 1.00 0.00 H new ATOM 0 HH22 ARG A 133 3.075 3.335 -3.078 1.00 0.00 H new ATOM 871 N GLY A 134 -1.798 4.934 -9.332 1.00 0.00 N ATOM 872 CA GLY A 134 -2.838 5.077 -10.362 1.00 0.00 C ATOM 873 C GLY A 134 -2.570 4.305 -11.647 1.00 0.00 C ATOM 874 O GLY A 134 -2.232 3.125 -11.598 1.00 0.00 O ATOM 0 H GLY A 134 -2.090 4.334 -8.560 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -3.790 4.746 -9.947 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.947 6.134 -10.605 1.00 0.00 H new ATOM 875 N PRO A 135 -2.726 4.984 -12.797 1.00 0.00 N ATOM 876 CA PRO A 135 -2.825 4.304 -14.085 1.00 0.00 C ATOM 877 C PRO A 135 -1.503 3.753 -14.661 1.00 0.00 C ATOM 878 O PRO A 135 -1.504 2.992 -15.626 1.00 0.00 O ATOM 879 CB PRO A 135 -3.512 5.306 -15.020 1.00 0.00 C ATOM 880 CG PRO A 135 -3.283 6.674 -14.395 1.00 0.00 C ATOM 881 CD PRO A 135 -2.739 6.449 -12.973 1.00 0.00 C ATOM 0 HA PRO A 135 -3.399 3.385 -13.964 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -3.090 5.258 -16.024 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -4.577 5.090 -15.111 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -2.576 7.253 -14.989 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -4.213 7.242 -14.364 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -1.739 6.869 -12.862 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.372 6.931 -12.227 1.00 0.00 H new ATOM 882 N ARG A 136 -0.403 4.255 -14.110 1.00 0.00 N ATOM 883 CA ARG A 136 0.967 3.810 -14.450 1.00 0.00 C ATOM 884 C ARG A 136 1.577 2.733 -13.542 1.00 0.00 C ATOM 885 O ARG A 136 2.627 2.177 -13.860 1.00 0.00 O ATOM 886 CB ARG A 136 1.937 4.990 -14.584 1.00 0.00 C ATOM 887 CG ARG A 136 1.861 6.035 -13.464 1.00 0.00 C ATOM 888 CD ARG A 136 0.988 7.217 -13.894 1.00 0.00 C ATOM 889 NE ARG A 136 0.474 7.847 -12.673 1.00 0.00 N ATOM 890 CZ ARG A 136 -0.075 9.054 -12.551 1.00 0.00 C ATOM 891 NH1 ARG A 136 -0.174 9.937 -13.539 1.00 0.00 N ATOM 892 NH2 ARG A 136 -0.481 9.425 -11.357 1.00 0.00 N ATOM 0 H ARG A 136 -0.425 4.992 -13.405 1.00 0.00 H new ATOM 0 HA ARG A 136 0.830 3.325 -15.416 1.00 0.00 H new ATOM 0 HB2 ARG A 136 2.954 4.600 -14.625 1.00 0.00 H new ATOM 0 HB3 ARG A 136 1.748 5.487 -15.535 1.00 0.00 H new ATOM 0 HG2 ARG A 136 1.451 5.581 -12.562 1.00 0.00 H new ATOM 0 HG3 ARG A 136 2.863 6.386 -13.217 1.00 0.00 H new ATOM 0 HD2 ARG A 136 1.568 7.930 -14.479 1.00 0.00 H new ATOM 0 HD3 ARG A 136 0.167 6.878 -14.526 1.00 0.00 H new ATOM 0 HE ARG A 136 0.545 7.296 -11.818 1.00 0.00 H new ATOM 0 HH11 ARG A 136 0.184 9.707 -14.466 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -0.608 10.844 -13.370 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -0.371 8.795 -10.562 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -0.906 10.343 -11.225 1.00 0.00 H new ATOM 893 N THR A 137 0.944 2.478 -12.400 1.00 0.00 N ATOM 894 CA THR A 137 1.448 1.435 -11.493 1.00 0.00 C ATOM 895 C THR A 137 0.814 0.081 -11.809 1.00 0.00 C ATOM 896 O THR A 137 -0.384 -0.121 -11.620 1.00 0.00 O ATOM 897 CB THR A 137 1.263 1.805 -10.011 1.00 0.00 C ATOM 898 OG1 THR A 137 -0.052 2.311 -9.811 1.00 0.00 O ATOM 899 CG2 THR A 137 2.312 2.791 -9.523 1.00 0.00 C ATOM 0 H THR A 137 0.104 2.961 -12.081 1.00 0.00 H new ATOM 0 HA THR A 137 2.522 1.358 -11.664 1.00 0.00 H new ATOM 0 HB THR A 137 1.398 0.901 -9.417 1.00 0.00 H new ATOM 0 HG1 THR A 137 -0.675 1.847 -10.409 1.00 0.00 H new ATOM 0 HG21 THR A 137 2.136 3.019 -8.472 1.00 0.00 H new ATOM 0 HG22 THR A 137 3.304 2.354 -9.639 1.00 0.00 H new ATOM 0 HG23 THR A 137 2.249 3.708 -10.108 1.00 0.00 H new ATOM 900 N HIS A 138 1.662 -0.723 -12.448 1.00 0.00 N ATOM 901 CA HIS A 138 1.414 -2.118 -12.878 1.00 0.00 C ATOM 902 C HIS A 138 2.714 -2.754 -13.343 1.00 0.00 C ATOM 903 O HIS A 138 3.556 -2.136 -13.996 1.00 0.00 O ATOM 904 CB HIS A 138 0.330 -2.227 -13.962 1.00 0.00 C ATOM 905 CG HIS A 138 0.439 -1.181 -15.086 1.00 0.00 C ATOM 906 ND1 HIS A 138 1.520 -0.911 -15.812 1.00 0.00 N ATOM 907 CD2 HIS A 138 -0.495 -0.287 -15.393 1.00 0.00 C ATOM 908 CE1 HIS A 138 1.267 0.158 -16.556 1.00 0.00 C ATOM 909 NE2 HIS A 138 0.023 0.553 -16.285 1.00 0.00 N ATOM 0 H HIS A 138 2.599 -0.409 -12.699 1.00 0.00 H new ATOM 0 HA HIS A 138 1.033 -2.661 -12.013 1.00 0.00 H new ATOM 0 HB2 HIS A 138 0.376 -3.222 -14.404 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -0.648 -2.133 -13.490 1.00 0.00 H new ATOM 0 HD1 HIS A 138 2.394 -1.436 -15.799 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -1.496 -0.249 -14.990 1.00 0.00 H new ATOM 0 HE1 HIS A 138 1.946 0.624 -17.255 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -0.450 1.360 -16.691 1.00 0.00 H new ATOM 910 N TYR A 139 2.851 -3.972 -12.823 1.00 0.00 N ATOM 911 CA TYR A 139 3.974 -4.883 -12.971 1.00 0.00 C ATOM 912 C TYR A 139 4.760 -4.807 -14.280 1.00 0.00 C ATOM 913 O TYR A 139 4.267 -4.485 -15.357 1.00 0.00 O ATOM 914 CB TYR A 139 3.413 -6.266 -12.664 1.00 0.00 C ATOM 915 CG TYR A 139 4.433 -7.374 -12.353 1.00 0.00 C ATOM 916 CD1 TYR A 139 5.627 -7.093 -11.645 1.00 0.00 C ATOM 917 CD2 TYR A 139 4.226 -8.623 -12.971 1.00 0.00 C ATOM 918 CE1 TYR A 139 6.658 -8.050 -11.610 1.00 0.00 C ATOM 919 CE2 TYR A 139 5.250 -9.600 -12.915 1.00 0.00 C ATOM 920 CZ TYR A 139 6.442 -9.289 -12.246 1.00 0.00 C ATOM 921 OH TYR A 139 7.460 -10.187 -12.211 1.00 0.00 O ATOM 0 H TYR A 139 2.117 -4.376 -12.241 1.00 0.00 H new ATOM 0 HA TYR A 139 4.762 -4.592 -12.276 1.00 0.00 H new ATOM 0 HB2 TYR A 139 2.737 -6.177 -11.813 1.00 0.00 H new ATOM 0 HB3 TYR A 139 2.813 -6.586 -13.516 1.00 0.00 H new ATOM 0 HD1 TYR A 139 5.746 -6.149 -11.134 1.00 0.00 H new ATOM 0 HD2 TYR A 139 3.298 -8.833 -13.481 1.00 0.00 H new ATOM 0 HE1 TYR A 139 7.591 -7.840 -11.108 1.00 0.00 H new ATOM 0 HE2 TYR A 139 5.115 -10.566 -13.379 1.00 0.00 H new ATOM 0 HH TYR A 139 7.192 -11.004 -12.682 1.00 0.00 H new ATOM 922 N GLY A 140 5.995 -5.240 -14.085 1.00 0.00 N ATOM 923 CA GLY A 140 7.097 -5.171 -15.054 1.00 0.00 C ATOM 924 C GLY A 140 8.346 -4.535 -14.403 1.00 0.00 C ATOM 925 O GLY A 140 9.465 -4.940 -14.677 1.00 0.00 O ATOM 0 H GLY A 140 6.279 -5.672 -13.206 1.00 0.00 H new ATOM 0 HA2 GLY A 140 7.336 -6.171 -15.414 1.00 0.00 H new ATOM 0 HA3 GLY A 140 6.792 -4.584 -15.921 1.00 0.00 H new ATOM 926 N GLN A 141 8.118 -3.576 -13.500 1.00 0.00 N ATOM 927 CA GLN A 141 9.201 -2.875 -12.818 1.00 0.00 C ATOM 928 C GLN A 141 9.083 -3.005 -11.297 1.00 0.00 C ATOM 929 O GLN A 141 8.009 -3.195 -10.716 1.00 0.00 O ATOM 930 CB GLN A 141 9.198 -1.424 -13.307 1.00 0.00 C ATOM 931 CG GLN A 141 8.090 -0.486 -12.792 1.00 0.00 C ATOM 932 CD GLN A 141 6.662 -0.968 -13.049 1.00 0.00 C ATOM 933 OE1 GLN A 141 6.033 -1.611 -12.223 1.00 0.00 O ATOM 934 NE2 GLN A 141 6.128 -0.660 -14.205 1.00 0.00 N ATOM 0 H GLN A 141 7.185 -3.269 -13.226 1.00 0.00 H new ATOM 0 HA GLN A 141 10.164 -3.324 -13.060 1.00 0.00 H new ATOM 0 HB2 GLN A 141 10.159 -0.981 -13.043 1.00 0.00 H new ATOM 0 HB3 GLN A 141 9.142 -1.439 -14.395 1.00 0.00 H new ATOM 0 HG2 GLN A 141 8.223 -0.347 -11.719 1.00 0.00 H new ATOM 0 HG3 GLN A 141 8.217 0.491 -13.258 1.00 0.00 H new ATOM 0 HE21 GLN A 141 6.663 -0.122 -14.887 1.00 0.00 H new ATOM 0 HE22 GLN A 141 5.177 -0.958 -14.423 1.00 0.00 H new ATOM 935 N LYS A 142 10.218 -2.710 -10.673 1.00 0.00 N ATOM 936 CA LYS A 142 10.375 -2.739 -9.199 1.00 0.00 C ATOM 937 C LYS A 142 9.607 -1.695 -8.414 1.00 0.00 C ATOM 938 O LYS A 142 9.373 -1.888 -7.220 1.00 0.00 O ATOM 939 CB LYS A 142 11.864 -2.653 -8.844 1.00 0.00 C ATOM 940 CG LYS A 142 12.584 -3.973 -9.073 1.00 0.00 C ATOM 941 CD LYS A 142 13.243 -4.021 -10.449 1.00 0.00 C ATOM 942 CE LYS A 142 13.955 -5.374 -10.571 1.00 0.00 C ATOM 943 NZ LYS A 142 14.525 -5.477 -11.908 1.00 0.00 N ATOM 0 H LYS A 142 11.069 -2.441 -11.167 1.00 0.00 H new ATOM 0 HA LYS A 142 9.931 -3.687 -8.896 1.00 0.00 H new ATOM 0 HB2 LYS A 142 12.335 -1.875 -9.444 1.00 0.00 H new ATOM 0 HB3 LYS A 142 11.971 -2.359 -7.800 1.00 0.00 H new ATOM 0 HG2 LYS A 142 13.341 -4.114 -8.301 1.00 0.00 H new ATOM 0 HG3 LYS A 142 11.875 -4.796 -8.979 1.00 0.00 H new ATOM 0 HD2 LYS A 142 12.497 -3.908 -11.236 1.00 0.00 H new ATOM 0 HD3 LYS A 142 13.953 -3.202 -10.563 1.00 0.00 H new ATOM 0 HE2 LYS A 142 14.738 -5.459 -9.818 1.00 0.00 H new ATOM 0 HE3 LYS A 142 13.253 -6.189 -10.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 15.012 -6.390 -12.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 13.765 -5.411 -12.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 15.205 -4.704 -12.056 1.00 0.00 H new ATOM 944 N ALA A 143 9.041 -0.727 -9.129 1.00 0.00 N ATOM 945 CA ALA A 143 8.195 0.340 -8.563 1.00 0.00 C ATOM 946 C ALA A 143 7.013 -0.228 -7.771 1.00 0.00 C ATOM 947 O ALA A 143 6.842 0.104 -6.600 1.00 0.00 O ATOM 948 CB ALA A 143 7.692 1.261 -9.679 1.00 0.00 C ATOM 0 H ALA A 143 9.155 -0.654 -10.140 1.00 0.00 H new ATOM 0 HA ALA A 143 8.808 0.915 -7.869 1.00 0.00 H new ATOM 0 HB1 ALA A 143 7.068 2.045 -9.250 1.00 0.00 H new ATOM 0 HB2 ALA A 143 8.543 1.712 -10.189 1.00 0.00 H new ATOM 0 HB3 ALA A 143 7.106 0.682 -10.393 1.00 0.00 H new ATOM 949 N ILE A 144 6.424 -1.297 -8.305 1.00 0.00 N ATOM 950 CA ILE A 144 5.241 -1.930 -7.673 1.00 0.00 C ATOM 951 C ILE A 144 5.567 -3.039 -6.666 1.00 0.00 C ATOM 952 O ILE A 144 4.698 -3.492 -5.923 1.00 0.00 O ATOM 953 CB ILE A 144 4.217 -2.395 -8.726 1.00 0.00 C ATOM 954 CG1 ILE A 144 4.774 -3.471 -9.665 1.00 0.00 C ATOM 955 CG2 ILE A 144 3.638 -1.215 -9.512 1.00 0.00 C ATOM 956 CD1 ILE A 144 4.266 -4.848 -9.238 1.00 0.00 C ATOM 0 H ILE A 144 6.734 -1.748 -9.166 1.00 0.00 H new ATOM 0 HA ILE A 144 4.785 -1.140 -7.076 1.00 0.00 H new ATOM 0 HB ILE A 144 3.402 -2.860 -8.171 1.00 0.00 H new ATOM 0 HG12 ILE A 144 4.470 -3.264 -10.691 1.00 0.00 H new ATOM 0 HG13 ILE A 144 5.864 -3.454 -9.646 1.00 0.00 H new ATOM 0 HG21 ILE A 144 2.920 -1.583 -10.245 1.00 0.00 H new ATOM 0 HG22 ILE A 144 3.138 -0.531 -8.826 1.00 0.00 H new ATOM 0 HG23 ILE A 144 4.443 -0.690 -10.025 1.00 0.00 H new ATOM 0 HD11 ILE A 144 4.666 -5.608 -9.910 1.00 0.00 H new ATOM 0 HD12 ILE A 144 4.592 -5.056 -8.219 1.00 0.00 H new ATOM 0 HD13 ILE A 144 3.177 -4.863 -9.280 1.00 0.00 H new ATOM 957 N LEU A 145 6.833 -3.443 -6.654 1.00 0.00 N ATOM 958 CA LEU A 145 7.357 -4.540 -5.829 1.00 0.00 C ATOM 959 C LEU A 145 7.491 -4.150 -4.356 1.00 0.00 C ATOM 960 O LEU A 145 8.317 -3.317 -3.979 1.00 0.00 O ATOM 961 CB LEU A 145 8.709 -4.967 -6.400 1.00 0.00 C ATOM 962 CG LEU A 145 8.585 -6.214 -7.281 1.00 0.00 C ATOM 963 CD1 LEU A 145 7.749 -5.988 -8.542 1.00 0.00 C ATOM 964 CD2 LEU A 145 9.982 -6.682 -7.685 1.00 0.00 C ATOM 0 H LEU A 145 7.549 -3.006 -7.234 1.00 0.00 H new ATOM 0 HA LEU A 145 6.650 -5.369 -5.861 1.00 0.00 H new ATOM 0 HB2 LEU A 145 9.132 -4.150 -6.984 1.00 0.00 H new ATOM 0 HB3 LEU A 145 9.402 -5.166 -5.583 1.00 0.00 H new ATOM 0 HG LEU A 145 8.068 -6.969 -6.689 1.00 0.00 H new ATOM 0 HD11 LEU A 145 7.703 -6.912 -9.119 1.00 0.00 H new ATOM 0 HD12 LEU A 145 6.740 -5.686 -8.260 1.00 0.00 H new ATOM 0 HD13 LEU A 145 8.207 -5.205 -9.147 1.00 0.00 H new ATOM 0 HD21 LEU A 145 9.901 -7.570 -8.312 1.00 0.00 H new ATOM 0 HD22 LEU A 145 10.485 -5.890 -8.240 1.00 0.00 H new ATOM 0 HD23 LEU A 145 10.558 -6.921 -6.791 1.00 0.00 H new ATOM 965 N PHE A 146 6.571 -4.680 -3.567 1.00 0.00 N ATOM 966 CA PHE A 146 6.533 -4.462 -2.119 1.00 0.00 C ATOM 967 C PHE A 146 6.627 -5.795 -1.382 1.00 0.00 C ATOM 968 O PHE A 146 5.974 -6.775 -1.708 1.00 0.00 O ATOM 969 CB PHE A 146 5.229 -3.762 -1.723 1.00 0.00 C ATOM 970 CG PHE A 146 5.015 -2.294 -2.139 1.00 0.00 C ATOM 971 CD1 PHE A 146 5.685 -1.681 -3.229 1.00 0.00 C ATOM 972 CD2 PHE A 146 4.035 -1.581 -1.425 1.00 0.00 C ATOM 973 CE1 PHE A 146 5.369 -0.365 -3.612 1.00 0.00 C ATOM 974 CE2 PHE A 146 3.711 -0.249 -1.795 1.00 0.00 C ATOM 975 CZ PHE A 146 4.385 0.340 -2.883 1.00 0.00 C ATOM 0 H PHE A 146 5.821 -5.280 -3.910 1.00 0.00 H new ATOM 0 HA PHE A 146 7.381 -3.834 -1.845 1.00 0.00 H new ATOM 0 HB2 PHE A 146 4.404 -4.344 -2.134 1.00 0.00 H new ATOM 0 HB3 PHE A 146 5.145 -3.812 -0.637 1.00 0.00 H new ATOM 0 HD1 PHE A 146 6.443 -2.229 -3.769 1.00 0.00 H new ATOM 0 HD2 PHE A 146 3.528 -2.048 -0.594 1.00 0.00 H new ATOM 0 HE1 PHE A 146 5.870 0.099 -4.449 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.960 0.304 -1.251 1.00 0.00 H new ATOM 0 HZ PHE A 146 4.144 1.354 -3.166 1.00 0.00 H new ATOM 976 N LEU A 147 7.403 -5.733 -0.320 1.00 0.00 N ATOM 977 CA LEU A 147 7.719 -6.924 0.489 1.00 0.00 C ATOM 978 C LEU A 147 7.218 -6.785 1.932 1.00 0.00 C ATOM 979 O LEU A 147 7.553 -5.818 2.619 1.00 0.00 O ATOM 980 CB LEU A 147 9.226 -7.178 0.434 1.00 0.00 C ATOM 981 CG LEU A 147 9.607 -8.606 0.853 1.00 0.00 C ATOM 982 CD1 LEU A 147 9.470 -9.560 -0.338 1.00 0.00 C ATOM 983 CD2 LEU A 147 11.059 -8.634 1.333 1.00 0.00 C ATOM 0 H LEU A 147 7.835 -4.872 0.016 1.00 0.00 H new ATOM 0 HA LEU A 147 7.197 -7.785 0.071 1.00 0.00 H new ATOM 0 HB2 LEU A 147 9.584 -6.994 -0.579 1.00 0.00 H new ATOM 0 HB3 LEU A 147 9.733 -6.466 1.085 1.00 0.00 H new ATOM 0 HG LEU A 147 8.940 -8.921 1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 147 9.743 -10.569 -0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 147 8.439 -9.555 -0.692 1.00 0.00 H new ATOM 0 HD13 LEU A 147 10.131 -9.236 -1.142 1.00 0.00 H new ATOM 0 HD21 LEU A 147 11.325 -9.649 1.629 1.00 0.00 H new ATOM 0 HD22 LEU A 147 11.715 -8.308 0.526 1.00 0.00 H new ATOM 0 HD23 LEU A 147 11.173 -7.965 2.186 1.00 0.00 H new ATOM 984 N PRO A 148 6.310 -7.681 2.323 1.00 0.00 N ATOM 985 CA PRO A 148 5.758 -7.713 3.691 1.00 0.00 C ATOM 986 C PRO A 148 6.800 -8.167 4.717 1.00 0.00 C ATOM 987 O PRO A 148 7.258 -9.306 4.716 1.00 0.00 O ATOM 988 CB PRO A 148 4.556 -8.651 3.578 1.00 0.00 C ATOM 989 CG PRO A 148 4.917 -9.602 2.450 1.00 0.00 C ATOM 990 CD PRO A 148 5.655 -8.701 1.467 1.00 0.00 C ATOM 0 HA PRO A 148 5.461 -6.730 4.057 1.00 0.00 H new ATOM 0 HB2 PRO A 148 4.384 -9.189 4.510 1.00 0.00 H new ATOM 0 HB3 PRO A 148 3.643 -8.100 3.355 1.00 0.00 H new ATOM 0 HG2 PRO A 148 5.546 -10.421 2.798 1.00 0.00 H new ATOM 0 HG3 PRO A 148 4.031 -10.050 2.000 1.00 0.00 H new ATOM 0 HD2 PRO A 148 6.387 -9.262 0.886 1.00 0.00 H new ATOM 0 HD3 PRO A 148 4.968 -8.242 0.756 1.00 0.00 H new ATOM 991 N LEU A 149 7.180 -7.209 5.554 1.00 0.00 N ATOM 992 CA LEU A 149 8.009 -7.421 6.760 1.00 0.00 C ATOM 993 C LEU A 149 7.171 -7.288 8.039 1.00 0.00 C ATOM 994 O LEU A 149 7.350 -6.352 8.811 1.00 0.00 O ATOM 995 CB LEU A 149 9.211 -6.448 6.670 1.00 0.00 C ATOM 996 CG LEU A 149 10.255 -6.980 5.685 1.00 0.00 C ATOM 997 CD1 LEU A 149 11.345 -5.935 5.424 1.00 0.00 C ATOM 998 CD2 LEU A 149 10.911 -8.264 6.206 1.00 0.00 C ATOM 0 H LEU A 149 6.919 -6.232 5.419 1.00 0.00 H new ATOM 0 HA LEU A 149 8.401 -8.437 6.808 1.00 0.00 H new ATOM 0 HB2 LEU A 149 8.868 -5.464 6.350 1.00 0.00 H new ATOM 0 HB3 LEU A 149 9.661 -6.324 7.655 1.00 0.00 H new ATOM 0 HG LEU A 149 9.732 -7.200 4.754 1.00 0.00 H new ATOM 0 HD11 LEU A 149 12.074 -6.338 4.721 1.00 0.00 H new ATOM 0 HD12 LEU A 149 10.894 -5.036 5.004 1.00 0.00 H new ATOM 0 HD13 LEU A 149 11.843 -5.687 6.361 1.00 0.00 H new ATOM 0 HD21 LEU A 149 11.647 -8.616 5.483 1.00 0.00 H new ATOM 0 HD22 LEU A 149 11.404 -8.061 7.157 1.00 0.00 H new ATOM 0 HD23 LEU A 149 10.149 -9.030 6.349 1.00 0.00 H new ATOM 999 N PRO A 150 6.246 -8.241 8.276 1.00 0.00 N ATOM 1000 CA PRO A 150 5.283 -8.118 9.358 1.00 0.00 C ATOM 1001 C PRO A 150 5.927 -8.431 10.706 1.00 0.00 C ATOM 1002 O PRO A 150 6.300 -9.538 11.065 1.00 0.00 O ATOM 1003 CB PRO A 150 4.130 -9.039 8.980 1.00 0.00 C ATOM 1004 CG PRO A 150 4.788 -10.148 8.155 1.00 0.00 C ATOM 1005 CD PRO A 150 6.099 -9.559 7.613 1.00 0.00 C ATOM 0 HA PRO A 150 4.911 -7.101 9.482 1.00 0.00 H new ATOM 0 HB2 PRO A 150 3.635 -9.441 9.864 1.00 0.00 H new ATOM 0 HB3 PRO A 150 3.371 -8.511 8.403 1.00 0.00 H new ATOM 0 HG2 PRO A 150 4.981 -11.028 8.769 1.00 0.00 H new ATOM 0 HG3 PRO A 150 4.137 -10.465 7.340 1.00 0.00 H new ATOM 0 HD2 PRO A 150 6.944 -10.209 7.840 1.00 0.00 H new ATOM 0 HD3 PRO A 150 6.062 -9.451 6.529 1.00 0.00 H new