USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=33 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 110 THR OG1 : rot -133:sc= -1.05! USER MOD Set 1.2: A 139 TYR OH : rot 180:sc= 0.0151 USER MOD Set 2.1: A 126 LYS NZ :NH3+ -152:sc= -0.0477 (180deg=-1.21) USER MOD Set 2.2: A 128 ASN : amide:sc= -0.508 K(o=-0.56,f=-2) USER MOD Set 3.1: A 32 ASN : amide:sc= -3.45 K(o=-3.3,f=-4.9!) USER MOD Set 3.2: A 127 LYS NZ :NH3+ -162:sc= 0.4 (180deg=0) USER MOD Set 3.3: A 141 GLN : amide:sc= -0.249 K(o=-3.3,f=-4.2) USER MOD Set 4.1: A 83 THR OG1 : rot 180:sc= 0.0665 USER MOD Set 4.2: A 113 SER OG : rot 80:sc= 0.0492 USER MOD Set 4.3: A 116 HIS : no HD1:sc= -4.12 K(o=-4.9,f=-3.9!) USER MOD Set 4.4: A 119 LYS NZ :NH3+ -151:sc= -0.86 (180deg=0) USER MOD Set 5.1: A 90 SER OG : rot -86:sc= 1.23 USER MOD Set 5.2: A 97 CYS SG : rot 180:sc= 0.509 USER MOD Set 6.1: A 72 SER OG : rot -106:sc= 0.735 USER MOD Set 6.2: A 75 THR OG1 : rot 154:sc= 0.798 USER MOD Set 7.1: A 52 SER OG : rot 119:sc= 1.11 USER MOD Set 7.2: A 55 HIS : no HD1:sc= -3.07! C(o=-2!,f=-7.5!) USER MOD Single : A 30 CYS SG : rot 150:sc= -3.03! USER MOD Single : A 31 SER OG : rot -62:sc= 0.12 USER MOD Single : A 35 HIS : no HD1:sc= -2.05 X(o=-2,f=-2.1!) USER MOD Single : A 44 THR OG1 : rot -105:sc= 0.498 USER MOD Single : A 48 THR OG1 : rot -140:sc= -0.0158 USER MOD Single : A 54 GLN : amide:sc= 0.688 K(o=0.69,f=-0.1) USER MOD Single : A 57 GLN : amide:sc= -0.173 X(o=-0.17,f=-0.19) USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-2!) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= -0.0854 USER MOD Single : A 69 TYR OH : rot 150:sc= 0.172 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot -27:sc= 0.512 USER MOD Single : A 77 GLN : amide:sc= 0.398 K(o=0.4,f=-0.7) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl -130:sc= -2.64 (180deg=-4.62!) USER MOD Single : A 88 TYR OH : rot 180:sc= -0.248 USER MOD Single : A 91 GLN : amide:sc= -0.487 X(o=-0.49,f=-0.64) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.026 USER MOD Single : A 94 ASN : amide:sc= -0.772 K(o=-0.77,f=-6.6!) USER MOD Single : A 106 ASN : amide:sc= 0.0943 X(o=0.094,f=0) USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= 0.189 K(o=0.19,f=-2.1!) USER MOD Single : A 111 TYR OH : rot 7:sc= -1.5! USER MOD Single : A 114 LYS NZ :NH3+ -151:sc= -1.02 (180deg=-2.01!) USER MOD Single : A 115 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0431) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 SER OG : rot 180:sc= -0.285 USER MOD Single : A 131 CYS SG : rot 160:sc= -1.51 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot -72:sc= 1.47 USER MOD Single : A 138 HIS : no HE2:sc= 0.695 K(o=0.7,f=-2.9!) USER MOD Single : A 142 LYS NZ :NH3+ 164:sc= -0.0304 (180deg=-0.278) USER MOD ----------------------------------------------------------------- ATOM 21 N CYS A 30 -10.406 4.909 2.338 1.00 0.00 N ATOM 22 CA CYS A 30 -10.552 3.463 2.146 1.00 0.00 C ATOM 23 C CYS A 30 -11.964 2.986 2.480 1.00 0.00 C ATOM 24 O CYS A 30 -12.555 3.392 3.484 1.00 0.00 O ATOM 25 CB CYS A 30 -9.531 2.623 2.916 1.00 0.00 C ATOM 26 SG CYS A 30 -9.531 2.910 4.727 1.00 0.00 S ATOM 0 HA CYS A 30 -10.356 3.307 1.085 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -9.729 1.568 2.727 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -8.535 2.835 2.526 1.00 0.00 H new ATOM 0 HG CYS A 30 -9.163 1.823 5.339 1.00 0.00 H new ATOM 27 N SER A 31 -12.395 2.017 1.684 1.00 0.00 N ATOM 28 CA SER A 31 -13.646 1.284 1.939 1.00 0.00 C ATOM 29 C SER A 31 -13.360 0.106 2.894 1.00 0.00 C ATOM 30 O SER A 31 -13.722 -1.044 2.662 1.00 0.00 O ATOM 31 CB SER A 31 -14.241 0.797 0.611 1.00 0.00 C ATOM 32 OG SER A 31 -15.543 0.253 0.861 1.00 0.00 O ATOM 0 H SER A 31 -11.898 1.712 0.847 1.00 0.00 H new ATOM 0 HA SER A 31 -14.376 1.941 2.412 1.00 0.00 H new ATOM 0 HB2 SER A 31 -14.306 1.622 -0.098 1.00 0.00 H new ATOM 0 HB3 SER A 31 -13.596 0.041 0.163 1.00 0.00 H new ATOM 0 HG SER A 31 -15.466 -0.514 1.467 1.00 0.00 H new ATOM 33 N ASN A 32 -12.718 0.474 4.001 1.00 0.00 N ATOM 34 CA ASN A 32 -12.201 -0.447 5.036 1.00 0.00 C ATOM 35 C ASN A 32 -11.995 0.342 6.348 1.00 0.00 C ATOM 36 O ASN A 32 -12.378 1.513 6.435 1.00 0.00 O ATOM 37 CB ASN A 32 -10.854 -0.962 4.487 1.00 0.00 C ATOM 38 CG ASN A 32 -10.089 -1.946 5.376 1.00 0.00 C ATOM 39 OD1 ASN A 32 -10.592 -2.924 5.911 1.00 0.00 O ATOM 40 ND2 ASN A 32 -8.852 -1.593 5.645 1.00 0.00 N ATOM 0 H ASN A 32 -12.532 1.453 4.218 1.00 0.00 H new ATOM 0 HA ASN A 32 -12.879 -1.273 5.249 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -11.038 -1.442 3.526 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -10.211 -0.102 4.297 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.299 -2.137 6.307 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -8.445 -0.775 5.192 1.00 0.00 H new ATOM 41 N GLY A 33 -11.361 -0.296 7.332 1.00 0.00 N ATOM 42 CA GLY A 33 -10.840 0.348 8.552 1.00 0.00 C ATOM 43 C GLY A 33 -9.851 1.448 8.145 1.00 0.00 C ATOM 44 O GLY A 33 -8.852 1.173 7.477 1.00 0.00 O ATOM 0 H GLY A 33 -11.188 -1.301 7.308 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -11.658 0.772 9.134 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -10.346 -0.388 9.186 1.00 0.00 H new ATOM 45 N GLY A 34 -10.385 2.655 8.283 1.00 0.00 N ATOM 46 CA GLY A 34 -9.761 3.948 7.913 1.00 0.00 C ATOM 47 C GLY A 34 -8.360 4.249 8.451 1.00 0.00 C ATOM 48 O GLY A 34 -8.194 5.037 9.380 1.00 0.00 O ATOM 0 H GLY A 34 -11.317 2.780 8.677 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.719 4.000 6.825 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.425 4.746 8.245 1.00 0.00 H new ATOM 49 N HIS A 35 -7.383 3.778 7.679 1.00 0.00 N ATOM 50 CA HIS A 35 -5.951 4.079 7.898 1.00 0.00 C ATOM 51 C HIS A 35 -5.333 4.745 6.656 1.00 0.00 C ATOM 52 O HIS A 35 -6.023 4.961 5.667 1.00 0.00 O ATOM 53 CB HIS A 35 -5.182 2.803 8.261 1.00 0.00 C ATOM 54 CG HIS A 35 -5.788 2.045 9.437 1.00 0.00 C ATOM 55 ND1 HIS A 35 -6.592 0.995 9.305 1.00 0.00 N ATOM 56 CD2 HIS A 35 -5.827 2.430 10.703 1.00 0.00 C ATOM 57 CE1 HIS A 35 -7.162 0.750 10.471 1.00 0.00 C ATOM 58 NE2 HIS A 35 -6.688 1.643 11.334 1.00 0.00 N ATOM 0 H HIS A 35 -7.553 3.172 6.876 1.00 0.00 H new ATOM 0 HA HIS A 35 -5.876 4.778 8.731 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -5.152 2.146 7.392 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.151 3.064 8.499 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -5.261 3.238 11.142 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -7.879 -0.030 10.683 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -6.944 1.712 12.319 1.00 0.00 H new ATOM 59 N PHE A 36 -4.044 5.042 6.726 1.00 0.00 N ATOM 60 CA PHE A 36 -3.271 5.638 5.621 1.00 0.00 C ATOM 61 C PHE A 36 -2.217 4.644 5.098 1.00 0.00 C ATOM 62 O PHE A 36 -1.785 3.761 5.836 1.00 0.00 O ATOM 63 CB PHE A 36 -2.555 6.892 6.105 1.00 0.00 C ATOM 64 CG PHE A 36 -3.481 8.110 6.118 1.00 0.00 C ATOM 65 CD1 PHE A 36 -4.286 8.388 7.244 1.00 0.00 C ATOM 66 CD2 PHE A 36 -3.490 8.953 4.983 1.00 0.00 C ATOM 67 CE1 PHE A 36 -5.120 9.530 7.234 1.00 0.00 C ATOM 68 CE2 PHE A 36 -4.323 10.095 4.973 1.00 0.00 C ATOM 69 CZ PHE A 36 -5.129 10.372 6.099 1.00 0.00 C ATOM 0 H PHE A 36 -3.486 4.876 7.564 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.966 5.887 4.819 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -2.165 6.722 7.108 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.700 7.093 5.460 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.265 7.735 8.104 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.866 8.726 4.131 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -5.744 9.757 8.086 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -4.343 10.749 4.113 1.00 0.00 H new ATOM 0 HZ PHE A 36 -5.765 11.245 6.093 1.00 0.00 H new ATOM 70 N LEU A 37 -1.880 4.770 3.824 1.00 0.00 N ATOM 71 CA LEU A 37 -0.741 4.022 3.243 1.00 0.00 C ATOM 72 C LEU A 37 0.608 4.611 3.689 1.00 0.00 C ATOM 73 O LEU A 37 1.397 5.141 2.913 1.00 0.00 O ATOM 74 CB LEU A 37 -0.814 3.937 1.704 1.00 0.00 C ATOM 75 CG LEU A 37 -1.978 3.064 1.217 1.00 0.00 C ATOM 76 CD1 LEU A 37 -3.197 3.924 0.900 1.00 0.00 C ATOM 77 CD2 LEU A 37 -1.566 2.354 -0.068 1.00 0.00 C ATOM 0 H LEU A 37 -2.367 5.376 3.164 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.815 3.005 3.628 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.920 4.941 1.293 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.123 3.533 1.321 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.224 2.349 2.002 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.012 3.287 0.556 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.508 4.459 1.797 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.943 4.641 0.120 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.389 1.732 -0.420 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.319 3.094 -0.830 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.695 1.728 0.125 1.00 0.00 H new ATOM 78 N ARG A 38 0.849 4.509 4.996 1.00 0.00 N ATOM 79 CA ARG A 38 2.024 5.115 5.618 1.00 0.00 C ATOM 80 C ARG A 38 3.280 4.237 5.501 1.00 0.00 C ATOM 81 O ARG A 38 3.358 3.136 6.043 1.00 0.00 O ATOM 82 CB ARG A 38 1.733 5.548 7.065 1.00 0.00 C ATOM 83 CG ARG A 38 2.973 6.192 7.719 1.00 0.00 C ATOM 84 CD ARG A 38 2.725 6.888 9.054 1.00 0.00 C ATOM 85 NE ARG A 38 2.233 5.959 10.070 1.00 0.00 N ATOM 86 CZ ARG A 38 1.397 6.259 11.046 1.00 0.00 C ATOM 87 NH1 ARG A 38 0.326 7.012 10.825 1.00 0.00 N ATOM 88 NH2 ARG A 38 1.256 5.395 12.045 1.00 0.00 N ATOM 0 H ARG A 38 0.242 4.010 5.646 1.00 0.00 H new ATOM 0 HA ARG A 38 2.250 6.020 5.054 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.905 6.257 7.075 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.419 4.683 7.649 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.727 5.419 7.867 1.00 0.00 H new ATOM 0 HG3 ARG A 38 3.393 6.918 7.023 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.650 7.349 9.401 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.001 7.691 8.916 1.00 0.00 H new ATOM 0 HE ARG A 38 2.565 4.996 10.020 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.138 7.369 9.888 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -0.309 7.233 11.592 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.787 4.524 12.045 1.00 0.00 H new ATOM 0 HH22 ARG A 38 0.616 5.602 12.812 1.00 0.00 H new ATOM 89 N ILE A 39 4.275 4.892 4.920 1.00 0.00 N ATOM 90 CA ILE A 39 5.628 4.330 4.748 1.00 0.00 C ATOM 91 C ILE A 39 6.528 5.001 5.782 1.00 0.00 C ATOM 92 O ILE A 39 6.984 6.136 5.648 1.00 0.00 O ATOM 93 CB ILE A 39 6.107 4.533 3.286 1.00 0.00 C ATOM 94 CG1 ILE A 39 5.042 4.264 2.211 1.00 0.00 C ATOM 95 CG2 ILE A 39 7.211 3.527 2.997 1.00 0.00 C ATOM 96 CD1 ILE A 39 4.467 5.512 1.550 1.00 0.00 C ATOM 0 H ILE A 39 4.176 5.837 4.548 1.00 0.00 H new ATOM 0 HA ILE A 39 5.649 3.253 4.916 1.00 0.00 H new ATOM 0 HB ILE A 39 6.406 5.580 3.229 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.478 3.630 1.439 1.00 0.00 H new ATOM 0 HG13 ILE A 39 4.225 3.701 2.662 1.00 0.00 H new ATOM 0 HG21 ILE A 39 7.561 3.655 1.973 1.00 0.00 H new ATOM 0 HG22 ILE A 39 8.040 3.689 3.686 1.00 0.00 H new ATOM 0 HG23 ILE A 39 6.825 2.516 3.125 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.725 5.221 0.807 1.00 0.00 H new ATOM 0 HD12 ILE A 39 3.996 6.140 2.306 1.00 0.00 H new ATOM 0 HD13 ILE A 39 5.268 6.068 1.064 1.00 0.00 H new ATOM 97 N LEU A 40 6.610 4.278 6.891 1.00 0.00 N ATOM 98 CA LEU A 40 7.216 4.764 8.146 1.00 0.00 C ATOM 99 C LEU A 40 8.717 5.065 8.007 1.00 0.00 C ATOM 100 O LEU A 40 9.426 4.255 7.400 1.00 0.00 O ATOM 101 CB LEU A 40 7.076 3.749 9.296 1.00 0.00 C ATOM 102 CG LEU A 40 5.718 3.648 10.009 1.00 0.00 C ATOM 103 CD1 LEU A 40 5.415 4.977 10.685 1.00 0.00 C ATOM 104 CD2 LEU A 40 4.597 3.253 9.068 1.00 0.00 C ATOM 0 H LEU A 40 6.256 3.324 6.956 1.00 0.00 H new ATOM 0 HA LEU A 40 6.668 5.679 8.370 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.320 2.762 8.902 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.830 3.988 10.046 1.00 0.00 H new ATOM 0 HG LEU A 40 5.782 2.857 10.756 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.453 4.915 11.194 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.196 5.202 11.411 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.379 5.767 9.935 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.660 3.196 9.622 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.506 3.998 8.277 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.818 2.281 8.627 1.00 0.00 H new ATOM 105 N PRO A 41 9.212 6.044 8.784 1.00 0.00 N ATOM 106 CA PRO A 41 10.657 6.323 8.869 1.00 0.00 C ATOM 107 C PRO A 41 11.441 5.102 9.405 1.00 0.00 C ATOM 108 O PRO A 41 12.446 4.714 8.805 1.00 0.00 O ATOM 109 CB PRO A 41 10.763 7.570 9.747 1.00 0.00 C ATOM 110 CG PRO A 41 9.504 7.541 10.620 1.00 0.00 C ATOM 111 CD PRO A 41 8.441 6.882 9.735 1.00 0.00 C ATOM 0 HA PRO A 41 11.113 6.507 7.896 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.667 7.550 10.356 1.00 0.00 H new ATOM 0 HB3 PRO A 41 10.805 8.477 9.143 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.668 6.972 11.535 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.205 8.546 10.919 1.00 0.00 H new ATOM 0 HD2 PRO A 41 7.752 6.279 10.326 1.00 0.00 H new ATOM 0 HD3 PRO A 41 7.843 7.628 9.211 1.00 0.00 H new ATOM 112 N ASP A 42 10.749 4.322 10.228 1.00 0.00 N ATOM 113 CA ASP A 42 11.169 3.031 10.810 1.00 0.00 C ATOM 114 C ASP A 42 11.087 1.821 9.857 1.00 0.00 C ATOM 115 O ASP A 42 10.750 0.702 10.270 1.00 0.00 O ATOM 116 CB ASP A 42 10.296 2.793 12.044 1.00 0.00 C ATOM 117 CG ASP A 42 10.892 3.535 13.233 1.00 0.00 C ATOM 118 OD1 ASP A 42 10.600 4.745 13.318 1.00 0.00 O ATOM 119 OD2 ASP A 42 11.624 2.872 13.988 1.00 0.00 O ATOM 0 H ASP A 42 9.812 4.584 10.534 1.00 0.00 H new ATOM 0 HA ASP A 42 12.229 3.108 11.050 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.280 3.139 11.857 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.235 1.726 12.260 1.00 0.00 H new ATOM 120 N GLY A 43 11.177 2.130 8.573 1.00 0.00 N ATOM 121 CA GLY A 43 11.221 1.184 7.444 1.00 0.00 C ATOM 122 C GLY A 43 10.075 0.166 7.371 1.00 0.00 C ATOM 123 O GLY A 43 10.192 -0.812 6.644 1.00 0.00 O ATOM 0 H GLY A 43 11.225 3.100 8.262 1.00 0.00 H new ATOM 0 HA2 GLY A 43 11.231 1.757 6.517 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.163 0.637 7.491 1.00 0.00 H new ATOM 124 N THR A 44 8.902 0.541 7.878 1.00 0.00 N ATOM 125 CA THR A 44 7.758 -0.401 7.911 1.00 0.00 C ATOM 126 C THR A 44 6.501 0.280 7.382 1.00 0.00 C ATOM 127 O THR A 44 6.464 1.503 7.286 1.00 0.00 O ATOM 128 CB THR A 44 7.550 -1.057 9.292 1.00 0.00 C ATOM 129 OG1 THR A 44 6.548 -2.063 9.144 1.00 0.00 O ATOM 130 CG2 THR A 44 7.171 -0.080 10.416 1.00 0.00 C ATOM 0 H THR A 44 8.709 1.465 8.266 1.00 0.00 H new ATOM 0 HA THR A 44 7.995 -1.232 7.246 1.00 0.00 H new ATOM 0 HB THR A 44 8.506 -1.476 9.606 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.706 -1.746 9.533 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.045 -0.630 11.349 1.00 0.00 H new ATOM 0 HG22 THR A 44 7.961 0.661 10.535 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.237 0.422 10.162 1.00 0.00 H new ATOM 131 N VAL A 45 5.582 -0.508 6.850 1.00 0.00 N ATOM 132 CA VAL A 45 4.356 0.082 6.286 1.00 0.00 C ATOM 133 C VAL A 45 3.144 -0.238 7.160 1.00 0.00 C ATOM 134 O VAL A 45 2.619 -1.347 7.203 1.00 0.00 O ATOM 135 CB VAL A 45 4.213 -0.241 4.797 1.00 0.00 C ATOM 136 CG1 VAL A 45 2.904 0.275 4.213 1.00 0.00 C ATOM 137 CG2 VAL A 45 5.353 0.395 4.006 1.00 0.00 C ATOM 0 H VAL A 45 5.645 -1.524 6.792 1.00 0.00 H new ATOM 0 HA VAL A 45 4.428 1.169 6.310 1.00 0.00 H new ATOM 0 HB VAL A 45 4.234 -1.328 4.717 1.00 0.00 H new ATOM 0 HG11 VAL A 45 2.852 0.020 3.155 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.066 -0.183 4.738 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.856 1.358 4.328 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.239 0.157 2.948 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.329 1.477 4.139 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.306 0.006 4.365 1.00 0.00 H new ATOM 138 N ASP A 46 2.742 0.814 7.872 1.00 0.00 N ATOM 139 CA ASP A 46 1.658 0.740 8.862 1.00 0.00 C ATOM 140 C ASP A 46 0.752 1.965 8.804 1.00 0.00 C ATOM 141 O ASP A 46 1.238 3.098 8.750 1.00 0.00 O ATOM 142 CB ASP A 46 2.183 0.588 10.288 1.00 0.00 C ATOM 143 CG ASP A 46 2.870 -0.764 10.477 1.00 0.00 C ATOM 144 OD1 ASP A 46 2.131 -1.726 10.709 1.00 0.00 O ATOM 145 OD2 ASP A 46 4.116 -0.827 10.346 1.00 0.00 O ATOM 0 H ASP A 46 3.155 1.742 7.782 1.00 0.00 H new ATOM 0 HA ASP A 46 1.084 -0.149 8.600 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.886 1.391 10.508 1.00 0.00 H new ATOM 0 HB3 ASP A 46 1.359 0.683 10.995 1.00 0.00 H new ATOM 146 N GLY A 47 -0.547 1.684 8.760 1.00 0.00 N ATOM 147 CA GLY A 47 -1.598 2.703 8.903 1.00 0.00 C ATOM 148 C GLY A 47 -1.620 3.310 10.308 1.00 0.00 C ATOM 149 O GLY A 47 -0.659 3.210 11.070 1.00 0.00 O ATOM 0 H GLY A 47 -0.909 0.740 8.624 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.439 3.493 8.169 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.568 2.256 8.686 1.00 0.00 H new ATOM 150 N THR A 48 -2.824 3.662 10.708 1.00 0.00 N ATOM 151 CA THR A 48 -3.001 4.448 11.945 1.00 0.00 C ATOM 152 C THR A 48 -3.856 3.875 13.066 1.00 0.00 C ATOM 153 O THR A 48 -5.043 4.169 13.220 1.00 0.00 O ATOM 154 CB THR A 48 -3.324 5.924 11.665 1.00 0.00 C ATOM 155 OG1 THR A 48 -3.776 6.564 12.859 1.00 0.00 O ATOM 156 CG2 THR A 48 -4.340 6.151 10.545 1.00 0.00 C ATOM 0 H THR A 48 -3.688 3.430 10.218 1.00 0.00 H new ATOM 0 HA THR A 48 -2.004 4.369 12.378 1.00 0.00 H new ATOM 0 HB THR A 48 -2.390 6.365 11.318 1.00 0.00 H new ATOM 0 HG1 THR A 48 -4.514 7.172 12.645 1.00 0.00 H new ATOM 0 HG21 THR A 48 -4.507 7.220 10.417 1.00 0.00 H new ATOM 0 HG22 THR A 48 -3.957 5.729 9.616 1.00 0.00 H new ATOM 0 HG23 THR A 48 -5.281 5.665 10.803 1.00 0.00 H new ATOM 157 N ARG A 49 -3.118 3.232 13.963 1.00 0.00 N ATOM 158 CA ARG A 49 -3.472 3.233 15.393 1.00 0.00 C ATOM 159 C ARG A 49 -3.197 4.623 16.005 1.00 0.00 C ATOM 160 O ARG A 49 -3.890 5.076 16.901 1.00 0.00 O ATOM 161 CB ARG A 49 -2.675 2.174 16.145 1.00 0.00 C ATOM 162 CG ARG A 49 -3.234 0.775 15.856 1.00 0.00 C ATOM 163 CD ARG A 49 -2.291 -0.345 16.317 1.00 0.00 C ATOM 164 NE ARG A 49 -1.045 -0.312 15.526 1.00 0.00 N ATOM 165 CZ ARG A 49 -0.669 -1.216 14.619 1.00 0.00 C ATOM 166 NH1 ARG A 49 -1.272 -2.389 14.509 1.00 0.00 N ATOM 167 NH2 ARG A 49 0.452 -1.030 13.932 1.00 0.00 N ATOM 0 H ARG A 49 -2.275 2.704 13.736 1.00 0.00 H new ATOM 0 HA ARG A 49 -4.533 3.002 15.484 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -1.627 2.221 15.850 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -2.714 2.373 17.216 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -4.197 0.662 16.355 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -3.416 0.674 14.786 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -2.063 -0.227 17.376 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -2.779 -1.313 16.202 1.00 0.00 H new ATOM 0 HE ARG A 49 -0.414 0.473 15.687 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -2.048 -2.624 15.128 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -0.961 -3.058 13.805 1.00 0.00 H new ATOM 0 HH21 ARG A 49 1.021 -0.200 14.099 1.00 0.00 H new ATOM 0 HH22 ARG A 49 0.745 -1.717 13.238 1.00 0.00 H new ATOM 168 N ASP A 50 -2.233 5.329 15.401 1.00 0.00 N ATOM 169 CA ASP A 50 -1.809 6.695 15.772 1.00 0.00 C ATOM 170 C ASP A 50 -1.112 7.327 14.571 1.00 0.00 C ATOM 171 O ASP A 50 -0.101 6.813 14.088 1.00 0.00 O ATOM 172 CB ASP A 50 -0.862 6.641 16.971 1.00 0.00 C ATOM 173 CG ASP A 50 -0.659 8.009 17.646 1.00 0.00 C ATOM 174 OD1 ASP A 50 -1.317 8.985 17.213 1.00 0.00 O ATOM 175 OD2 ASP A 50 0.237 8.095 18.508 1.00 0.00 O ATOM 0 H ASP A 50 -1.705 4.956 14.612 1.00 0.00 H new ATOM 0 HA ASP A 50 -2.676 7.294 16.051 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -1.254 5.936 17.704 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.105 6.257 16.645 1.00 0.00 H new ATOM 176 N ARG A 51 -1.716 8.375 14.048 1.00 0.00 N ATOM 177 CA ARG A 51 -1.270 9.042 12.799 1.00 0.00 C ATOM 178 C ARG A 51 -0.099 10.005 13.006 1.00 0.00 C ATOM 179 O ARG A 51 -0.252 11.141 13.464 1.00 0.00 O ATOM 180 CB ARG A 51 -2.509 9.654 12.170 1.00 0.00 C ATOM 181 CG ARG A 51 -2.360 9.810 10.655 1.00 0.00 C ATOM 182 CD ARG A 51 -2.107 11.271 10.281 1.00 0.00 C ATOM 183 NE ARG A 51 -3.305 12.057 10.651 1.00 0.00 N ATOM 184 CZ ARG A 51 -3.962 12.921 9.877 1.00 0.00 C ATOM 185 NH1 ARG A 51 -3.598 13.171 8.633 1.00 0.00 N ATOM 186 NH2 ARG A 51 -5.052 13.501 10.324 1.00 0.00 N ATOM 0 H ARG A 51 -2.540 8.807 14.467 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.836 8.322 12.105 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.374 9.028 12.387 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -2.701 10.629 12.619 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -1.535 9.191 10.301 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.262 9.454 10.158 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.228 11.650 10.802 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -1.908 11.361 9.213 1.00 0.00 H new ATOM 0 HE ARG A 51 -3.665 11.924 11.596 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -2.789 12.696 8.233 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -4.126 13.839 8.072 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -5.394 13.290 11.261 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -5.556 14.162 9.734 1.00 0.00 H new ATOM 187 N SER A 52 1.016 9.541 12.469 1.00 0.00 N ATOM 188 CA SER A 52 2.256 10.325 12.420 1.00 0.00 C ATOM 189 C SER A 52 2.254 11.111 11.112 1.00 0.00 C ATOM 190 O SER A 52 2.382 10.585 10.000 1.00 0.00 O ATOM 191 CB SER A 52 3.515 9.477 12.574 1.00 0.00 C ATOM 192 OG SER A 52 3.674 8.519 11.530 1.00 0.00 O ATOM 0 H SER A 52 1.096 8.613 12.053 1.00 0.00 H new ATOM 0 HA SER A 52 2.281 11.003 13.273 1.00 0.00 H new ATOM 0 HB2 SER A 52 4.387 10.131 12.595 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.482 8.959 13.533 1.00 0.00 H new ATOM 0 HG SER A 52 4.505 8.700 11.043 1.00 0.00 H new ATOM 193 N ASP A 53 1.591 12.242 11.309 1.00 0.00 N ATOM 194 CA ASP A 53 1.306 13.246 10.278 1.00 0.00 C ATOM 195 C ASP A 53 2.564 13.860 9.641 1.00 0.00 C ATOM 196 O ASP A 53 3.105 14.857 10.092 1.00 0.00 O ATOM 197 CB ASP A 53 0.361 14.340 10.816 1.00 0.00 C ATOM 198 CG ASP A 53 -0.307 15.178 9.711 1.00 0.00 C ATOM 199 OD1 ASP A 53 0.116 15.063 8.532 1.00 0.00 O ATOM 200 OD2 ASP A 53 -1.251 15.899 10.070 1.00 0.00 O ATOM 0 H ASP A 53 1.220 12.501 12.223 1.00 0.00 H new ATOM 0 HA ASP A 53 0.802 12.711 9.474 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -0.414 13.872 11.423 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.924 15.003 11.473 1.00 0.00 H new ATOM 201 N GLN A 54 3.067 13.031 8.728 1.00 0.00 N ATOM 202 CA GLN A 54 4.156 13.304 7.778 1.00 0.00 C ATOM 203 C GLN A 54 4.226 12.130 6.784 1.00 0.00 C ATOM 204 O GLN A 54 3.551 12.166 5.759 1.00 0.00 O ATOM 205 CB GLN A 54 5.489 13.492 8.530 1.00 0.00 C ATOM 206 CG GLN A 54 6.620 13.990 7.619 1.00 0.00 C ATOM 207 CD GLN A 54 8.009 13.763 8.235 1.00 0.00 C ATOM 208 OE1 GLN A 54 8.228 13.801 9.437 1.00 0.00 O ATOM 209 NE2 GLN A 54 8.959 13.380 7.412 1.00 0.00 N ATOM 0 H GLN A 54 2.703 12.084 8.621 1.00 0.00 H new ATOM 0 HA GLN A 54 3.966 14.228 7.232 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.345 14.202 9.344 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.783 12.545 8.982 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.563 13.477 6.659 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.482 15.053 7.421 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.781 13.347 6.408 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.874 13.116 7.777 1.00 0.00 H new ATOM 210 N HIS A 55 4.723 11.001 7.289 1.00 0.00 N ATOM 211 CA HIS A 55 5.047 9.752 6.551 1.00 0.00 C ATOM 212 C HIS A 55 3.842 9.123 5.820 1.00 0.00 C ATOM 213 O HIS A 55 3.998 8.289 4.926 1.00 0.00 O ATOM 214 CB HIS A 55 5.675 8.726 7.522 1.00 0.00 C ATOM 215 CG HIS A 55 6.405 9.360 8.712 1.00 0.00 C ATOM 216 ND1 HIS A 55 5.956 9.387 9.963 1.00 0.00 N ATOM 217 CD2 HIS A 55 7.459 10.185 8.642 1.00 0.00 C ATOM 218 CE1 HIS A 55 6.718 10.229 10.661 1.00 0.00 C ATOM 219 NE2 HIS A 55 7.624 10.738 9.839 1.00 0.00 N ATOM 0 H HIS A 55 4.927 10.915 8.285 1.00 0.00 H new ATOM 0 HA HIS A 55 5.757 10.029 5.771 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.890 8.069 7.898 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.376 8.101 6.970 1.00 0.00 H new ATOM 0 HD2 HIS A 55 8.066 10.368 7.768 1.00 0.00 H new ATOM 0 HE1 HIS A 55 6.615 10.456 11.712 1.00 0.00 H new ATOM 0 HE2 HIS A 55 8.328 11.435 10.083 1.00 0.00 H new ATOM 220 N ILE A 56 2.663 9.449 6.335 1.00 0.00 N ATOM 221 CA ILE A 56 1.342 9.161 5.741 1.00 0.00 C ATOM 222 C ILE A 56 1.172 9.617 4.272 1.00 0.00 C ATOM 223 O ILE A 56 0.395 9.016 3.542 1.00 0.00 O ATOM 224 CB ILE A 56 0.199 9.754 6.583 1.00 0.00 C ATOM 225 CG1 ILE A 56 0.374 11.251 6.866 1.00 0.00 C ATOM 226 CG2 ILE A 56 0.034 9.002 7.902 1.00 0.00 C ATOM 227 CD1 ILE A 56 -0.933 12.021 6.761 1.00 0.00 C ATOM 0 H ILE A 56 2.587 9.946 7.222 1.00 0.00 H new ATOM 0 HA ILE A 56 1.290 8.072 5.741 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.702 9.636 5.981 1.00 0.00 H new ATOM 0 HG12 ILE A 56 0.790 11.382 7.865 1.00 0.00 H new ATOM 0 HG13 ILE A 56 1.095 11.668 6.163 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.781 9.445 8.474 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.193 7.955 7.698 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.958 9.068 8.477 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -0.752 13.075 6.971 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.338 11.915 5.754 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.648 11.625 7.483 1.00 0.00 H new ATOM 228 N GLN A 57 1.821 10.726 3.918 1.00 0.00 N ATOM 229 CA GLN A 57 1.688 11.341 2.587 1.00 0.00 C ATOM 230 C GLN A 57 2.404 10.550 1.493 1.00 0.00 C ATOM 231 O GLN A 57 3.618 10.559 1.345 1.00 0.00 O ATOM 232 CB GLN A 57 2.138 12.802 2.586 1.00 0.00 C ATOM 233 CG GLN A 57 1.148 13.735 3.302 1.00 0.00 C ATOM 234 CD GLN A 57 -0.190 13.854 2.553 1.00 0.00 C ATOM 235 OE1 GLN A 57 -1.219 13.340 2.958 1.00 0.00 O ATOM 236 NE2 GLN A 57 -0.188 14.532 1.423 1.00 0.00 N ATOM 0 H GLN A 57 2.454 11.227 4.541 1.00 0.00 H new ATOM 0 HA GLN A 57 0.624 11.316 2.353 1.00 0.00 H new ATOM 0 HB2 GLN A 57 3.113 12.877 3.068 1.00 0.00 H new ATOM 0 HB3 GLN A 57 2.265 13.137 1.556 1.00 0.00 H new ATOM 0 HG2 GLN A 57 0.965 13.362 4.310 1.00 0.00 H new ATOM 0 HG3 GLN A 57 1.594 14.724 3.404 1.00 0.00 H new ATOM 0 HE21 GLN A 57 0.674 14.961 1.087 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -1.049 14.628 0.884 1.00 0.00 H new ATOM 237 N LEU A 58 1.567 9.670 0.959 1.00 0.00 N ATOM 238 CA LEU A 58 1.904 8.781 -0.156 1.00 0.00 C ATOM 239 C LEU A 58 1.575 9.428 -1.510 1.00 0.00 C ATOM 240 O LEU A 58 0.731 10.306 -1.659 1.00 0.00 O ATOM 241 CB LEU A 58 1.158 7.453 0.014 1.00 0.00 C ATOM 242 CG LEU A 58 -0.335 7.621 -0.325 1.00 0.00 C ATOM 243 CD1 LEU A 58 -0.711 6.675 -1.467 1.00 0.00 C ATOM 244 CD2 LEU A 58 -1.207 7.518 0.927 1.00 0.00 C ATOM 0 H LEU A 58 0.611 9.548 1.294 1.00 0.00 H new ATOM 0 HA LEU A 58 2.978 8.595 -0.145 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.600 6.696 -0.634 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.266 7.098 1.039 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.529 8.628 -0.695 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.768 6.795 -1.706 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.111 6.910 -2.346 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.522 5.645 -1.164 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.255 7.641 0.652 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -1.066 6.541 1.390 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.923 8.298 1.633 1.00 0.00 H new ATOM 245 N GLN A 59 2.212 8.825 -2.498 1.00 0.00 N ATOM 246 CA GLN A 59 2.123 9.188 -3.914 1.00 0.00 C ATOM 247 C GLN A 59 2.560 8.018 -4.775 1.00 0.00 C ATOM 248 O GLN A 59 3.280 7.143 -4.292 1.00 0.00 O ATOM 249 CB GLN A 59 3.118 10.353 -4.077 1.00 0.00 C ATOM 250 CG GLN A 59 3.336 10.890 -5.497 1.00 0.00 C ATOM 251 CD GLN A 59 2.084 11.554 -6.065 1.00 0.00 C ATOM 252 OE1 GLN A 59 1.161 10.934 -6.566 1.00 0.00 O ATOM 253 NE2 GLN A 59 2.067 12.864 -5.970 1.00 0.00 N ATOM 0 H GLN A 59 2.834 8.033 -2.335 1.00 0.00 H new ATOM 0 HA GLN A 59 1.110 9.456 -4.213 1.00 0.00 H new ATOM 0 HB2 GLN A 59 2.778 11.178 -3.451 1.00 0.00 H new ATOM 0 HB3 GLN A 59 4.083 10.032 -3.685 1.00 0.00 H new ATOM 0 HG2 GLN A 59 4.154 11.610 -5.489 1.00 0.00 H new ATOM 0 HG3 GLN A 59 3.638 10.071 -6.150 1.00 0.00 H new ATOM 0 HE21 GLN A 59 2.854 13.355 -5.546 1.00 0.00 H new ATOM 0 HE22 GLN A 59 1.267 13.390 -6.320 1.00 0.00 H new ATOM 254 N LEU A 60 2.035 7.947 -5.980 1.00 0.00 N ATOM 255 CA LEU A 60 2.651 7.042 -6.961 1.00 0.00 C ATOM 256 C LEU A 60 3.364 7.719 -8.120 1.00 0.00 C ATOM 257 O LEU A 60 2.959 8.738 -8.674 1.00 0.00 O ATOM 258 CB LEU A 60 1.843 5.811 -7.434 1.00 0.00 C ATOM 259 CG LEU A 60 0.389 5.992 -7.859 1.00 0.00 C ATOM 260 CD1 LEU A 60 -0.462 6.090 -6.605 1.00 0.00 C ATOM 261 CD2 LEU A 60 0.130 7.120 -8.859 1.00 0.00 C ATOM 0 H LEU A 60 1.223 8.472 -6.306 1.00 0.00 H new ATOM 0 HA LEU A 60 3.415 6.613 -6.312 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.378 5.371 -8.276 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.860 5.078 -6.627 1.00 0.00 H new ATOM 0 HG LEU A 60 0.102 5.114 -8.438 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.508 6.220 -6.884 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.354 5.177 -6.019 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.136 6.943 -6.010 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.934 7.161 -9.093 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.443 8.070 -8.425 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.696 6.934 -9.772 1.00 0.00 H new ATOM 262 N SER A 61 4.437 7.028 -8.441 1.00 0.00 N ATOM 263 CA SER A 61 5.394 7.362 -9.504 1.00 0.00 C ATOM 264 C SER A 61 5.441 6.185 -10.475 1.00 0.00 C ATOM 265 O SER A 61 6.095 5.146 -10.264 1.00 0.00 O ATOM 266 CB SER A 61 6.793 7.543 -8.955 1.00 0.00 C ATOM 267 OG SER A 61 6.811 8.447 -7.847 1.00 0.00 O ATOM 0 H SER A 61 4.689 6.171 -7.949 1.00 0.00 H new ATOM 0 HA SER A 61 5.074 8.289 -9.979 1.00 0.00 H new ATOM 0 HB2 SER A 61 7.190 6.577 -8.643 1.00 0.00 H new ATOM 0 HB3 SER A 61 7.448 7.918 -9.742 1.00 0.00 H new ATOM 0 HG SER A 61 7.729 8.540 -7.516 1.00 0.00 H new ATOM 268 N ALA A 62 4.442 6.235 -11.331 1.00 0.00 N ATOM 269 CA ALA A 62 4.288 5.249 -12.414 1.00 0.00 C ATOM 270 C ALA A 62 5.438 5.211 -13.420 1.00 0.00 C ATOM 271 O ALA A 62 5.691 6.125 -14.192 1.00 0.00 O ATOM 272 CB ALA A 62 2.956 5.494 -13.131 1.00 0.00 C ATOM 0 H ALA A 62 3.713 6.948 -11.308 1.00 0.00 H new ATOM 0 HA ALA A 62 4.303 4.269 -11.938 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.836 4.767 -13.934 1.00 0.00 H new ATOM 0 HB2 ALA A 62 2.136 5.389 -12.421 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.947 6.501 -13.549 1.00 0.00 H new ATOM 273 N GLU A 63 5.971 4.004 -13.481 1.00 0.00 N ATOM 274 CA GLU A 63 7.019 3.621 -14.427 1.00 0.00 C ATOM 275 C GLU A 63 6.390 3.484 -15.829 1.00 0.00 C ATOM 276 O GLU A 63 6.848 4.110 -16.787 1.00 0.00 O ATOM 277 CB GLU A 63 7.614 2.290 -13.973 1.00 0.00 C ATOM 278 CG GLU A 63 8.984 2.085 -14.607 1.00 0.00 C ATOM 279 CD GLU A 63 9.569 0.736 -14.209 1.00 0.00 C ATOM 280 OE1 GLU A 63 8.974 -0.271 -14.636 1.00 0.00 O ATOM 281 OE2 GLU A 63 10.533 0.743 -13.412 1.00 0.00 O ATOM 0 H GLU A 63 5.686 3.243 -12.865 1.00 0.00 H new ATOM 0 HA GLU A 63 7.808 4.372 -14.465 1.00 0.00 H new ATOM 0 HB2 GLU A 63 7.701 2.274 -12.887 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.950 1.472 -14.252 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.900 2.144 -15.692 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.657 2.884 -14.296 1.00 0.00 H new ATOM 282 N SER A 64 5.261 2.784 -15.871 1.00 0.00 N ATOM 283 CA SER A 64 4.543 2.466 -17.120 1.00 0.00 C ATOM 284 C SER A 64 3.065 2.153 -16.836 1.00 0.00 C ATOM 285 O SER A 64 2.541 2.537 -15.788 1.00 0.00 O ATOM 286 CB SER A 64 5.293 1.298 -17.770 1.00 0.00 C ATOM 287 OG SER A 64 5.084 0.102 -17.011 1.00 0.00 O ATOM 0 H SER A 64 4.807 2.414 -15.036 1.00 0.00 H new ATOM 0 HA SER A 64 4.527 3.313 -17.806 1.00 0.00 H new ATOM 0 HB2 SER A 64 4.945 1.155 -18.793 1.00 0.00 H new ATOM 0 HB3 SER A 64 6.358 1.523 -17.824 1.00 0.00 H new ATOM 0 HG SER A 64 5.565 -0.641 -17.432 1.00 0.00 H new ATOM 288 N VAL A 65 2.488 1.296 -17.684 1.00 0.00 N ATOM 289 CA VAL A 65 1.069 0.912 -17.769 1.00 0.00 C ATOM 290 C VAL A 65 0.519 0.264 -16.481 1.00 0.00 C ATOM 291 O VAL A 65 0.644 -0.934 -16.209 1.00 0.00 O ATOM 292 CB VAL A 65 0.934 0.068 -19.050 1.00 0.00 C ATOM 293 CG1 VAL A 65 1.729 -1.247 -19.000 1.00 0.00 C ATOM 294 CG2 VAL A 65 -0.536 -0.176 -19.396 1.00 0.00 C ATOM 0 H VAL A 65 3.044 0.811 -18.388 1.00 0.00 H new ATOM 0 HA VAL A 65 0.425 1.788 -17.844 1.00 0.00 H new ATOM 0 HB VAL A 65 1.382 0.655 -19.852 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.590 -1.792 -19.934 1.00 0.00 H new ATOM 0 HG12 VAL A 65 2.788 -1.027 -18.863 1.00 0.00 H new ATOM 0 HG13 VAL A 65 1.374 -1.855 -18.168 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.601 -0.774 -20.305 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.019 -0.707 -18.576 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.036 0.780 -19.554 1.00 0.00 H new ATOM 295 N GLY A 66 0.003 1.164 -15.654 1.00 0.00 N ATOM 296 CA GLY A 66 -0.483 0.866 -14.287 1.00 0.00 C ATOM 297 C GLY A 66 0.630 0.441 -13.318 1.00 0.00 C ATOM 298 O GLY A 66 0.355 0.273 -12.141 1.00 0.00 O ATOM 0 H GLY A 66 -0.097 2.147 -15.908 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.983 1.748 -13.888 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.229 0.073 -14.340 1.00 0.00 H new ATOM 299 N GLU A 67 1.886 0.526 -13.750 1.00 0.00 N ATOM 300 CA GLU A 67 2.997 -0.018 -12.968 1.00 0.00 C ATOM 301 C GLU A 67 3.657 1.136 -12.244 1.00 0.00 C ATOM 302 O GLU A 67 4.334 1.985 -12.822 1.00 0.00 O ATOM 303 CB GLU A 67 3.974 -0.705 -13.895 1.00 0.00 C ATOM 304 CG GLU A 67 3.323 -1.898 -14.596 1.00 0.00 C ATOM 305 CD GLU A 67 4.213 -2.507 -15.686 1.00 0.00 C ATOM 306 OE1 GLU A 67 5.439 -2.606 -15.453 1.00 0.00 O ATOM 307 OE2 GLU A 67 3.649 -2.808 -16.762 1.00 0.00 O ATOM 0 H GLU A 67 2.160 0.963 -14.630 1.00 0.00 H new ATOM 0 HA GLU A 67 2.647 -0.754 -12.244 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.335 0.005 -14.639 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.842 -1.042 -13.328 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.087 -2.663 -13.857 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.379 -1.582 -15.039 1.00 0.00 H new ATOM 308 N VAL A 68 3.394 1.085 -10.953 1.00 0.00 N ATOM 309 CA VAL A 68 3.440 2.241 -10.049 1.00 0.00 C ATOM 310 C VAL A 68 4.188 1.982 -8.750 1.00 0.00 C ATOM 311 O VAL A 68 3.945 1.043 -8.001 1.00 0.00 O ATOM 312 CB VAL A 68 1.987 2.588 -9.832 1.00 0.00 C ATOM 313 CG1 VAL A 68 1.167 2.114 -8.627 1.00 0.00 C ATOM 314 CG2 VAL A 68 1.235 3.479 -10.785 1.00 0.00 C ATOM 0 H VAL A 68 3.134 0.219 -10.481 1.00 0.00 H new ATOM 0 HA VAL A 68 4.008 3.065 -10.481 1.00 0.00 H new ATOM 0 HB VAL A 68 2.862 1.948 -9.949 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.150 2.499 -8.705 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.142 1.024 -8.610 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.625 2.481 -7.708 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.208 3.596 -10.440 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.717 4.456 -10.827 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.235 3.031 -11.779 1.00 0.00 H new ATOM 315 N TYR A 69 5.178 2.834 -8.620 1.00 0.00 N ATOM 316 CA TYR A 69 6.067 2.864 -7.451 1.00 0.00 C ATOM 317 C TYR A 69 5.489 3.832 -6.422 1.00 0.00 C ATOM 318 O TYR A 69 5.314 5.010 -6.733 1.00 0.00 O ATOM 319 CB TYR A 69 7.447 3.396 -7.854 1.00 0.00 C ATOM 320 CG TYR A 69 8.342 2.394 -8.564 1.00 0.00 C ATOM 321 CD1 TYR A 69 8.703 1.179 -7.934 1.00 0.00 C ATOM 322 CD2 TYR A 69 8.898 2.794 -9.801 1.00 0.00 C ATOM 323 CE1 TYR A 69 9.618 0.329 -8.567 1.00 0.00 C ATOM 324 CE2 TYR A 69 9.833 1.953 -10.427 1.00 0.00 C ATOM 325 CZ TYR A 69 10.174 0.729 -9.803 1.00 0.00 C ATOM 326 OH TYR A 69 11.079 -0.058 -10.431 1.00 0.00 O ATOM 0 H TYR A 69 5.402 3.539 -9.323 1.00 0.00 H new ATOM 0 HA TYR A 69 6.155 1.855 -7.047 1.00 0.00 H new ATOM 0 HB2 TYR A 69 7.310 4.261 -8.503 1.00 0.00 H new ATOM 0 HB3 TYR A 69 7.960 3.747 -6.958 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.278 0.911 -6.978 1.00 0.00 H new ATOM 0 HD2 TYR A 69 8.609 3.730 -10.257 1.00 0.00 H new ATOM 0 HE1 TYR A 69 9.894 -0.614 -8.119 1.00 0.00 H new ATOM 0 HE2 TYR A 69 10.283 2.235 -11.367 1.00 0.00 H new ATOM 0 HH TYR A 69 11.012 0.075 -11.400 1.00 0.00 H new ATOM 327 N ILE A 70 5.084 3.309 -5.273 1.00 0.00 N ATOM 328 CA ILE A 70 4.501 4.175 -4.247 1.00 0.00 C ATOM 329 C ILE A 70 5.557 4.761 -3.307 1.00 0.00 C ATOM 330 O ILE A 70 5.970 4.153 -2.312 1.00 0.00 O ATOM 331 CB ILE A 70 3.270 3.567 -3.545 1.00 0.00 C ATOM 332 CG1 ILE A 70 2.270 3.107 -4.620 1.00 0.00 C ATOM 333 CG2 ILE A 70 2.610 4.595 -2.596 1.00 0.00 C ATOM 334 CD1 ILE A 70 1.099 2.269 -4.111 1.00 0.00 C ATOM 0 H ILE A 70 5.143 2.321 -5.028 1.00 0.00 H new ATOM 0 HA ILE A 70 4.087 5.035 -4.773 1.00 0.00 H new ATOM 0 HB ILE A 70 3.582 2.716 -2.940 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.872 3.989 -5.123 1.00 0.00 H new ATOM 0 HG13 ILE A 70 2.810 2.529 -5.370 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.744 4.141 -2.113 1.00 0.00 H new ATOM 0 HG22 ILE A 70 3.329 4.903 -1.837 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.291 5.466 -3.168 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.455 1.997 -4.948 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.478 1.364 -3.636 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.526 2.847 -3.385 1.00 0.00 H new ATOM 335 N LYS A 71 5.709 6.055 -3.524 1.00 0.00 N ATOM 336 CA LYS A 71 6.682 6.928 -2.853 1.00 0.00 C ATOM 337 C LYS A 71 5.969 7.762 -1.810 1.00 0.00 C ATOM 338 O LYS A 71 4.946 8.398 -2.032 1.00 0.00 O ATOM 339 CB LYS A 71 7.321 7.798 -3.939 1.00 0.00 C ATOM 340 CG LYS A 71 8.495 8.642 -3.431 1.00 0.00 C ATOM 341 CD LYS A 71 8.954 9.651 -4.488 1.00 0.00 C ATOM 342 CE LYS A 71 8.078 10.912 -4.485 1.00 0.00 C ATOM 343 NZ LYS A 71 8.105 11.540 -5.805 1.00 0.00 N ATOM 0 H LYS A 71 5.136 6.558 -4.202 1.00 0.00 H new ATOM 0 HA LYS A 71 7.456 6.360 -2.337 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.668 7.157 -4.750 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.562 8.459 -4.358 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.200 9.171 -2.525 1.00 0.00 H new ATOM 0 HG3 LYS A 71 9.326 7.989 -3.163 1.00 0.00 H new ATOM 0 HD2 LYS A 71 9.992 9.928 -4.301 1.00 0.00 H new ATOM 0 HD3 LYS A 71 8.921 9.187 -5.474 1.00 0.00 H new ATOM 0 HE2 LYS A 71 7.054 10.653 -4.217 1.00 0.00 H new ATOM 0 HE3 LYS A 71 8.437 11.613 -3.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.510 12.393 -5.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 9.082 11.802 -6.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.742 10.872 -6.515 1.00 0.00 H new ATOM 344 N SER A 72 6.643 7.783 -0.676 1.00 0.00 N ATOM 345 CA SER A 72 6.243 8.638 0.430 1.00 0.00 C ATOM 346 C SER A 72 6.745 10.048 0.128 1.00 0.00 C ATOM 347 O SER A 72 7.928 10.338 0.265 1.00 0.00 O ATOM 348 CB SER A 72 6.813 8.064 1.717 1.00 0.00 C ATOM 349 OG SER A 72 8.183 7.678 1.583 1.00 0.00 O ATOM 0 H SER A 72 7.472 7.217 -0.494 1.00 0.00 H new ATOM 0 HA SER A 72 5.161 8.685 0.554 1.00 0.00 H new ATOM 0 HB2 SER A 72 6.723 8.804 2.512 1.00 0.00 H new ATOM 0 HB3 SER A 72 6.223 7.199 2.018 1.00 0.00 H new ATOM 0 HG SER A 72 8.245 6.701 1.542 1.00 0.00 H new ATOM 350 N THR A 73 5.849 10.866 -0.407 1.00 0.00 N ATOM 351 CA THR A 73 6.169 12.292 -0.690 1.00 0.00 C ATOM 352 C THR A 73 6.565 13.110 0.564 1.00 0.00 C ATOM 353 O THR A 73 6.995 14.250 0.441 1.00 0.00 O ATOM 354 CB THR A 73 5.098 12.969 -1.570 1.00 0.00 C ATOM 355 OG1 THR A 73 5.543 14.276 -1.930 1.00 0.00 O ATOM 356 CG2 THR A 73 3.688 13.021 -0.966 1.00 0.00 C ATOM 0 H THR A 73 4.900 10.588 -0.658 1.00 0.00 H new ATOM 0 HA THR A 73 7.080 12.279 -1.288 1.00 0.00 H new ATOM 0 HB THR A 73 4.990 12.336 -2.451 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.157 14.613 -1.245 1.00 0.00 H new ATOM 0 HG21 THR A 73 3.012 13.516 -1.663 1.00 0.00 H new ATOM 0 HG22 THR A 73 3.336 12.007 -0.777 1.00 0.00 H new ATOM 0 HG23 THR A 73 3.714 13.577 -0.029 1.00 0.00 H new ATOM 357 N GLU A 74 6.575 12.433 1.721 1.00 0.00 N ATOM 358 CA GLU A 74 7.094 12.944 3.001 1.00 0.00 C ATOM 359 C GLU A 74 8.262 12.159 3.646 1.00 0.00 C ATOM 360 O GLU A 74 8.866 12.680 4.584 1.00 0.00 O ATOM 361 CB GLU A 74 5.947 13.112 3.993 1.00 0.00 C ATOM 362 CG GLU A 74 5.267 14.485 3.814 1.00 0.00 C ATOM 363 CD GLU A 74 6.227 15.673 3.985 1.00 0.00 C ATOM 364 OE1 GLU A 74 6.813 15.792 5.084 1.00 0.00 O ATOM 365 OE2 GLU A 74 6.326 16.445 3.020 1.00 0.00 O ATOM 0 H GLU A 74 6.210 11.483 1.796 1.00 0.00 H new ATOM 0 HA GLU A 74 7.545 13.903 2.746 1.00 0.00 H new ATOM 0 HB2 GLU A 74 5.216 12.317 3.849 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.324 13.017 5.011 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.817 14.532 2.822 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.456 14.577 4.537 1.00 0.00 H new ATOM 366 N THR A 75 8.466 10.898 3.279 1.00 0.00 N ATOM 367 CA THR A 75 9.624 10.122 3.773 1.00 0.00 C ATOM 368 C THR A 75 10.605 9.533 2.751 1.00 0.00 C ATOM 369 O THR A 75 11.644 8.982 3.150 1.00 0.00 O ATOM 370 CB THR A 75 9.252 9.012 4.767 1.00 0.00 C ATOM 371 OG1 THR A 75 7.846 8.747 4.817 1.00 0.00 O ATOM 372 CG2 THR A 75 9.804 9.360 6.148 1.00 0.00 C ATOM 0 H THR A 75 7.854 10.384 2.645 1.00 0.00 H new ATOM 0 HA THR A 75 10.162 10.933 4.265 1.00 0.00 H new ATOM 0 HB THR A 75 9.709 8.087 4.415 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.697 7.825 5.113 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.540 8.573 6.854 1.00 0.00 H new ATOM 0 HG22 THR A 75 10.889 9.451 6.094 1.00 0.00 H new ATOM 0 HG23 THR A 75 9.377 10.305 6.483 1.00 0.00 H new ATOM 373 N GLY A 76 10.253 9.571 1.466 1.00 0.00 N ATOM 374 CA GLY A 76 11.064 9.021 0.363 1.00 0.00 C ATOM 375 C GLY A 76 10.696 7.569 0.078 1.00 0.00 C ATOM 376 O GLY A 76 9.949 7.271 -0.855 1.00 0.00 O ATOM 0 H GLY A 76 9.380 9.992 1.149 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.914 9.620 -0.535 1.00 0.00 H new ATOM 0 HA3 GLY A 76 12.122 9.087 0.618 1.00 0.00 H new ATOM 377 N GLN A 77 11.095 6.710 1.018 1.00 0.00 N ATOM 378 CA GLN A 77 10.914 5.250 0.980 1.00 0.00 C ATOM 379 C GLN A 77 9.567 4.718 0.435 1.00 0.00 C ATOM 380 O GLN A 77 8.502 5.321 0.578 1.00 0.00 O ATOM 381 CB GLN A 77 11.265 4.632 2.337 1.00 0.00 C ATOM 382 CG GLN A 77 10.487 5.192 3.540 1.00 0.00 C ATOM 383 CD GLN A 77 11.259 4.972 4.842 1.00 0.00 C ATOM 384 OE1 GLN A 77 11.591 5.901 5.560 1.00 0.00 O ATOM 385 NE2 GLN A 77 11.715 3.761 5.103 1.00 0.00 N ATOM 0 H GLN A 77 11.573 7.021 1.863 1.00 0.00 H new ATOM 0 HA GLN A 77 11.619 4.917 0.219 1.00 0.00 H new ATOM 0 HB2 GLN A 77 11.092 3.557 2.283 1.00 0.00 H new ATOM 0 HB3 GLN A 77 12.331 4.775 2.517 1.00 0.00 H new ATOM 0 HG2 GLN A 77 10.305 6.257 3.396 1.00 0.00 H new ATOM 0 HG3 GLN A 77 9.512 4.708 3.605 1.00 0.00 H new ATOM 0 HE21 GLN A 77 11.445 2.976 4.511 1.00 0.00 H new ATOM 0 HE22 GLN A 77 12.337 3.611 5.897 1.00 0.00 H new ATOM 386 N TYR A 78 9.677 3.544 -0.178 1.00 0.00 N ATOM 387 CA TYR A 78 8.604 2.949 -0.980 1.00 0.00 C ATOM 388 C TYR A 78 7.751 1.936 -0.223 1.00 0.00 C ATOM 389 O TYR A 78 8.248 1.146 0.579 1.00 0.00 O ATOM 390 CB TYR A 78 9.218 2.292 -2.222 1.00 0.00 C ATOM 391 CG TYR A 78 9.913 3.316 -3.116 1.00 0.00 C ATOM 392 CD1 TYR A 78 9.146 4.027 -4.061 1.00 0.00 C ATOM 393 CD2 TYR A 78 11.258 3.656 -2.843 1.00 0.00 C ATOM 394 CE1 TYR A 78 9.716 5.143 -4.706 1.00 0.00 C ATOM 395 CE2 TYR A 78 11.833 4.774 -3.475 1.00 0.00 C ATOM 396 CZ TYR A 78 11.043 5.512 -4.391 1.00 0.00 C ATOM 397 OH TYR A 78 11.595 6.585 -5.001 1.00 0.00 O ATOM 0 H TYR A 78 10.519 2.971 -0.134 1.00 0.00 H new ATOM 0 HA TYR A 78 7.928 3.759 -1.255 1.00 0.00 H new ATOM 0 HB2 TYR A 78 9.935 1.531 -1.914 1.00 0.00 H new ATOM 0 HB3 TYR A 78 8.438 1.784 -2.789 1.00 0.00 H new ATOM 0 HD1 TYR A 78 8.135 3.721 -4.288 1.00 0.00 H new ATOM 0 HD2 TYR A 78 11.840 3.062 -2.154 1.00 0.00 H new ATOM 0 HE1 TYR A 78 9.147 5.707 -5.430 1.00 0.00 H new ATOM 0 HE2 TYR A 78 12.853 5.063 -3.267 1.00 0.00 H new ATOM 0 HH TYR A 78 12.511 6.710 -4.677 1.00 0.00 H new ATOM 398 N LEU A 79 6.451 2.039 -0.488 1.00 0.00 N ATOM 399 CA LEU A 79 5.463 1.019 -0.097 1.00 0.00 C ATOM 400 C LEU A 79 5.816 -0.217 -0.925 1.00 0.00 C ATOM 401 O LEU A 79 5.984 -0.132 -2.142 1.00 0.00 O ATOM 402 CB LEU A 79 4.085 1.530 -0.500 1.00 0.00 C ATOM 403 CG LEU A 79 2.933 0.906 0.295 1.00 0.00 C ATOM 404 CD1 LEU A 79 2.462 1.940 1.313 1.00 0.00 C ATOM 405 CD2 LEU A 79 1.769 0.668 -0.651 1.00 0.00 C ATOM 0 H LEU A 79 6.045 2.833 -0.982 1.00 0.00 H new ATOM 0 HA LEU A 79 5.466 0.800 0.971 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.058 2.612 -0.371 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.931 1.331 -1.561 1.00 0.00 H new ATOM 0 HG LEU A 79 3.256 -0.021 0.769 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.640 1.527 1.898 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.286 2.198 1.978 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.123 2.835 0.792 1.00 0.00 H new ATOM 0 HD21 LEU A 79 0.939 0.224 -0.102 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.452 1.617 -1.083 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.080 -0.008 -1.448 1.00 0.00 H new ATOM 406 N ALA A 80 6.267 -1.225 -0.198 1.00 0.00 N ATOM 407 CA ALA A 80 6.885 -2.420 -0.800 1.00 0.00 C ATOM 408 C ALA A 80 6.386 -3.696 -0.138 1.00 0.00 C ATOM 409 O ALA A 80 6.005 -3.670 1.033 1.00 0.00 O ATOM 410 CB ALA A 80 8.383 -2.270 -0.578 1.00 0.00 C ATOM 0 H ALA A 80 6.221 -1.250 0.821 1.00 0.00 H new ATOM 0 HA ALA A 80 6.632 -2.496 -1.857 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.902 -3.129 -1.004 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.733 -1.358 -1.062 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.589 -2.215 0.491 1.00 0.00 H new ATOM 411 N MET A 81 6.517 -4.815 -0.841 1.00 0.00 N ATOM 412 CA MET A 81 6.043 -6.100 -0.287 1.00 0.00 C ATOM 413 C MET A 81 7.133 -7.178 -0.181 1.00 0.00 C ATOM 414 O MET A 81 8.007 -7.272 -1.038 1.00 0.00 O ATOM 415 CB MET A 81 4.844 -6.618 -1.092 1.00 0.00 C ATOM 416 CG MET A 81 4.052 -7.532 -0.163 1.00 0.00 C ATOM 417 SD MET A 81 2.442 -8.163 -0.767 1.00 0.00 S ATOM 418 CE MET A 81 1.660 -6.747 -1.507 1.00 0.00 C ATOM 0 H MET A 81 6.934 -4.872 -1.770 1.00 0.00 H new ATOM 0 HA MET A 81 5.736 -5.891 0.738 1.00 0.00 H new ATOM 0 HB2 MET A 81 4.226 -5.791 -1.440 1.00 0.00 H new ATOM 0 HB3 MET A 81 5.178 -7.161 -1.976 1.00 0.00 H new ATOM 0 HG2 MET A 81 4.679 -8.390 0.080 1.00 0.00 H new ATOM 0 HG3 MET A 81 3.874 -6.993 0.768 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.646 -6.648 -1.121 1.00 0.00 H new ATOM 0 HE2 MET A 81 2.229 -5.849 -1.266 1.00 0.00 H new ATOM 0 HE3 MET A 81 1.625 -6.875 -2.589 1.00 0.00 H new ATOM 419 N ASP A 82 7.063 -7.923 0.923 1.00 0.00 N ATOM 420 CA ASP A 82 7.908 -9.102 1.178 1.00 0.00 C ATOM 421 C ASP A 82 7.081 -10.377 1.015 1.00 0.00 C ATOM 422 O ASP A 82 5.934 -10.471 1.473 1.00 0.00 O ATOM 423 CB ASP A 82 8.421 -9.169 2.615 1.00 0.00 C ATOM 424 CG ASP A 82 8.999 -7.865 3.174 1.00 0.00 C ATOM 425 OD1 ASP A 82 10.227 -7.676 3.019 1.00 0.00 O ATOM 426 OD2 ASP A 82 8.214 -7.125 3.796 1.00 0.00 O ATOM 0 H ASP A 82 6.409 -7.725 1.680 1.00 0.00 H new ATOM 0 HA ASP A 82 8.737 -9.020 0.475 1.00 0.00 H new ATOM 0 HB2 ASP A 82 7.602 -9.488 3.260 1.00 0.00 H new ATOM 0 HB3 ASP A 82 9.190 -9.940 2.672 1.00 0.00 H new ATOM 427 N THR A 83 7.840 -11.424 0.709 1.00 0.00 N ATOM 428 CA THR A 83 7.387 -12.816 0.552 1.00 0.00 C ATOM 429 C THR A 83 6.764 -13.428 1.813 1.00 0.00 C ATOM 430 O THR A 83 6.189 -14.513 1.775 1.00 0.00 O ATOM 431 CB THR A 83 8.561 -13.682 0.099 1.00 0.00 C ATOM 432 OG1 THR A 83 9.428 -12.883 -0.720 1.00 0.00 O ATOM 433 CG2 THR A 83 8.088 -14.893 -0.711 1.00 0.00 C ATOM 0 H THR A 83 8.843 -11.327 0.554 1.00 0.00 H new ATOM 0 HA THR A 83 6.594 -12.792 -0.196 1.00 0.00 H new ATOM 0 HB THR A 83 9.082 -14.049 0.983 1.00 0.00 H new ATOM 0 HG1 THR A 83 10.188 -13.425 -1.017 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.950 -15.486 -1.016 1.00 0.00 H new ATOM 0 HG22 THR A 83 7.426 -15.505 -0.098 1.00 0.00 H new ATOM 0 HG23 THR A 83 7.551 -14.552 -1.596 1.00 0.00 H new ATOM 434 N ASP A 84 6.961 -12.776 2.949 1.00 0.00 N ATOM 435 CA ASP A 84 6.335 -13.141 4.226 1.00 0.00 C ATOM 436 C ASP A 84 4.838 -12.824 4.342 1.00 0.00 C ATOM 437 O ASP A 84 4.215 -13.169 5.340 1.00 0.00 O ATOM 438 CB ASP A 84 7.112 -12.442 5.345 1.00 0.00 C ATOM 439 CG ASP A 84 8.574 -12.866 5.369 1.00 0.00 C ATOM 440 OD1 ASP A 84 9.344 -12.217 4.627 1.00 0.00 O ATOM 441 OD2 ASP A 84 8.883 -13.850 6.074 1.00 0.00 O ATOM 0 H ASP A 84 7.571 -11.961 3.018 1.00 0.00 H new ATOM 0 HA ASP A 84 6.385 -14.227 4.301 1.00 0.00 H new ATOM 0 HB2 ASP A 84 7.049 -11.362 5.211 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.651 -12.672 6.306 1.00 0.00 H new ATOM 442 N GLY A 85 4.322 -12.055 3.382 1.00 0.00 N ATOM 443 CA GLY A 85 2.910 -11.643 3.316 1.00 0.00 C ATOM 444 C GLY A 85 2.616 -10.419 4.182 1.00 0.00 C ATOM 445 O GLY A 85 1.615 -10.381 4.898 1.00 0.00 O ATOM 0 H GLY A 85 4.881 -11.691 2.611 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.647 -11.423 2.281 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.278 -12.471 3.637 1.00 0.00 H new ATOM 446 N LEU A 86 3.345 -9.359 3.838 1.00 0.00 N ATOM 447 CA LEU A 86 3.409 -8.085 4.593 1.00 0.00 C ATOM 448 C LEU A 86 4.242 -7.024 3.862 1.00 0.00 C ATOM 449 O LEU A 86 5.153 -7.344 3.088 1.00 0.00 O ATOM 450 CB LEU A 86 3.855 -8.357 6.032 1.00 0.00 C ATOM 451 CG LEU A 86 5.271 -8.909 6.117 1.00 0.00 C ATOM 452 CD1 LEU A 86 6.203 -7.731 6.400 1.00 0.00 C ATOM 453 CD2 LEU A 86 5.385 -9.940 7.235 1.00 0.00 C ATOM 0 H LEU A 86 3.930 -9.351 3.002 1.00 0.00 H new ATOM 0 HA LEU A 86 2.412 -7.649 4.651 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.795 -7.433 6.607 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.166 -9.064 6.493 1.00 0.00 H new ATOM 0 HG LEU A 86 5.537 -9.404 5.183 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.231 -8.088 6.468 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.125 -7.003 5.593 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.919 -7.261 7.341 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.406 -10.320 7.276 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.133 -9.474 8.187 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.698 -10.764 7.041 1.00 0.00 H new ATOM 454 N LEU A 87 3.936 -5.766 4.187 1.00 0.00 N ATOM 455 CA LEU A 87 4.512 -4.569 3.539 1.00 0.00 C ATOM 456 C LEU A 87 5.606 -3.907 4.403 1.00 0.00 C ATOM 457 O LEU A 87 5.403 -3.596 5.581 1.00 0.00 O ATOM 458 CB LEU A 87 3.442 -3.502 3.234 1.00 0.00 C ATOM 459 CG LEU A 87 2.110 -4.003 2.711 1.00 0.00 C ATOM 460 CD1 LEU A 87 1.075 -2.892 2.732 1.00 0.00 C ATOM 461 CD2 LEU A 87 2.266 -4.624 1.321 1.00 0.00 C ATOM 0 H LEU A 87 3.267 -5.538 4.923 1.00 0.00 H new ATOM 0 HA LEU A 87 4.948 -4.931 2.608 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.258 -2.935 4.146 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.854 -2.806 2.504 1.00 0.00 H new ATOM 0 HG LEU A 87 1.751 -4.792 3.372 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.126 -3.272 2.353 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.942 -2.538 3.754 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.413 -2.068 2.104 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.296 -4.975 0.969 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.654 -3.876 0.630 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.959 -5.464 1.373 1.00 0.00 H new ATOM 462 N TYR A 88 6.685 -3.564 3.711 1.00 0.00 N ATOM 463 CA TYR A 88 7.826 -2.812 4.257 1.00 0.00 C ATOM 464 C TYR A 88 8.118 -1.504 3.499 1.00 0.00 C ATOM 465 O TYR A 88 7.738 -1.341 2.343 1.00 0.00 O ATOM 466 CB TYR A 88 9.118 -3.655 4.336 1.00 0.00 C ATOM 467 CG TYR A 88 9.727 -4.159 3.027 1.00 0.00 C ATOM 468 CD1 TYR A 88 8.922 -4.689 1.995 1.00 0.00 C ATOM 469 CD2 TYR A 88 11.132 -4.154 2.940 1.00 0.00 C ATOM 470 CE1 TYR A 88 9.535 -5.220 0.848 1.00 0.00 C ATOM 471 CE2 TYR A 88 11.748 -4.697 1.786 1.00 0.00 C ATOM 472 CZ TYR A 88 10.933 -5.205 0.756 1.00 0.00 C ATOM 473 OH TYR A 88 11.497 -5.473 -0.442 1.00 0.00 O ATOM 0 H TYR A 88 6.801 -3.804 2.727 1.00 0.00 H new ATOM 0 HA TYR A 88 7.514 -2.554 5.269 1.00 0.00 H new ATOM 0 HB2 TYR A 88 9.874 -3.060 4.849 1.00 0.00 H new ATOM 0 HB3 TYR A 88 8.913 -4.522 4.965 1.00 0.00 H new ATOM 0 HD1 TYR A 88 7.846 -4.686 2.087 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.730 -3.743 3.740 1.00 0.00 H new ATOM 0 HE1 TYR A 88 8.938 -5.634 0.049 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.824 -4.721 1.697 1.00 0.00 H new ATOM 0 HH TYR A 88 12.473 -5.428 -0.362 1.00 0.00 H new ATOM 474 N GLY A 89 8.781 -0.596 4.208 1.00 0.00 N ATOM 475 CA GLY A 89 9.186 0.734 3.693 1.00 0.00 C ATOM 476 C GLY A 89 10.550 0.736 3.003 1.00 0.00 C ATOM 477 O GLY A 89 11.444 1.478 3.412 1.00 0.00 O ATOM 0 H GLY A 89 9.063 -0.754 5.175 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.432 1.086 2.989 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.206 1.444 4.520 1.00 0.00 H new ATOM 478 N SER A 90 10.642 -0.027 1.913 1.00 0.00 N ATOM 479 CA SER A 90 11.877 -0.177 1.121 1.00 0.00 C ATOM 480 C SER A 90 12.349 1.107 0.423 1.00 0.00 C ATOM 481 O SER A 90 11.776 1.586 -0.548 1.00 0.00 O ATOM 482 CB SER A 90 11.791 -1.340 0.135 1.00 0.00 C ATOM 483 OG SER A 90 12.944 -1.374 -0.704 1.00 0.00 O ATOM 0 H SER A 90 9.857 -0.566 1.547 1.00 0.00 H new ATOM 0 HA SER A 90 12.645 -0.408 1.859 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.703 -2.280 0.680 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.893 -1.241 -0.475 1.00 0.00 H new ATOM 0 HG SER A 90 12.803 -0.790 -1.478 1.00 0.00 H new ATOM 484 N GLN A 91 13.419 1.649 1.003 1.00 0.00 N ATOM 485 CA GLN A 91 14.186 2.805 0.512 1.00 0.00 C ATOM 486 C GLN A 91 14.505 2.808 -0.989 1.00 0.00 C ATOM 487 O GLN A 91 14.347 3.829 -1.660 1.00 0.00 O ATOM 488 CB GLN A 91 15.465 2.837 1.338 1.00 0.00 C ATOM 489 CG GLN A 91 15.268 3.577 2.664 1.00 0.00 C ATOM 490 CD GLN A 91 15.099 5.090 2.487 1.00 0.00 C ATOM 491 OE1 GLN A 91 15.510 5.709 1.510 1.00 0.00 O ATOM 492 NE2 GLN A 91 14.463 5.757 3.431 1.00 0.00 N ATOM 0 H GLN A 91 13.798 1.278 1.874 1.00 0.00 H new ATOM 0 HA GLN A 91 13.570 3.697 0.631 1.00 0.00 H new ATOM 0 HB2 GLN A 91 15.795 1.817 1.537 1.00 0.00 H new ATOM 0 HB3 GLN A 91 16.255 3.322 0.765 1.00 0.00 H new ATOM 0 HG2 GLN A 91 14.390 3.176 3.170 1.00 0.00 H new ATOM 0 HG3 GLN A 91 16.124 3.386 3.311 1.00 0.00 H new ATOM 0 HE21 GLN A 91 14.111 5.267 4.253 1.00 0.00 H new ATOM 0 HE22 GLN A 91 14.323 6.763 3.339 1.00 0.00 H new ATOM 493 N THR A 92 14.812 1.624 -1.505 1.00 0.00 N ATOM 494 CA THR A 92 15.098 1.418 -2.933 1.00 0.00 C ATOM 495 C THR A 92 13.857 0.810 -3.628 1.00 0.00 C ATOM 496 O THR A 92 13.126 0.048 -2.991 1.00 0.00 O ATOM 497 CB THR A 92 16.355 0.533 -3.104 1.00 0.00 C ATOM 498 OG1 THR A 92 16.765 0.594 -4.478 1.00 0.00 O ATOM 499 CG2 THR A 92 16.154 -0.920 -2.698 1.00 0.00 C ATOM 0 H THR A 92 14.872 0.771 -0.948 1.00 0.00 H new ATOM 0 HA THR A 92 15.311 2.375 -3.410 1.00 0.00 H new ATOM 0 HB THR A 92 17.118 0.927 -2.432 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.563 0.040 -4.606 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.082 -1.472 -2.848 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.870 -0.968 -1.647 1.00 0.00 H new ATOM 0 HG23 THR A 92 15.366 -1.362 -3.308 1.00 0.00 H new ATOM 500 N PRO A 93 13.575 1.201 -4.877 1.00 0.00 N ATOM 501 CA PRO A 93 12.509 0.579 -5.649 1.00 0.00 C ATOM 502 C PRO A 93 12.953 -0.716 -6.316 1.00 0.00 C ATOM 503 O PRO A 93 14.139 -0.996 -6.517 1.00 0.00 O ATOM 504 CB PRO A 93 12.081 1.623 -6.671 1.00 0.00 C ATOM 505 CG PRO A 93 13.407 2.338 -6.979 1.00 0.00 C ATOM 506 CD PRO A 93 14.195 2.270 -5.668 1.00 0.00 C ATOM 0 HA PRO A 93 11.681 0.286 -5.003 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.648 1.168 -7.561 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.334 2.306 -6.267 1.00 0.00 H new ATOM 0 HG2 PRO A 93 13.944 1.846 -7.790 1.00 0.00 H new ATOM 0 HG3 PRO A 93 13.239 3.370 -7.288 1.00 0.00 H new ATOM 0 HD2 PRO A 93 15.247 2.056 -5.856 1.00 0.00 H new ATOM 0 HD3 PRO A 93 14.153 3.222 -5.138 1.00 0.00 H new ATOM 507 N ASN A 94 11.990 -1.620 -6.291 1.00 0.00 N ATOM 508 CA ASN A 94 12.069 -2.939 -6.954 1.00 0.00 C ATOM 509 C ASN A 94 10.659 -3.315 -7.457 1.00 0.00 C ATOM 510 O ASN A 94 9.680 -2.621 -7.174 1.00 0.00 O ATOM 511 CB ASN A 94 12.550 -3.909 -5.868 1.00 0.00 C ATOM 512 CG ASN A 94 12.878 -5.310 -6.386 1.00 0.00 C ATOM 513 OD1 ASN A 94 12.036 -6.200 -6.434 1.00 0.00 O ATOM 514 ND2 ASN A 94 14.109 -5.533 -6.779 1.00 0.00 N ATOM 0 H ASN A 94 11.107 -1.469 -5.803 1.00 0.00 H new ATOM 0 HA ASN A 94 12.743 -2.956 -7.811 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.437 -3.493 -5.390 1.00 0.00 H new ATOM 0 HB3 ASN A 94 11.781 -3.988 -5.099 1.00 0.00 H new ATOM 0 HD21 ASN A 94 14.374 -6.454 -7.129 1.00 0.00 H new ATOM 0 HD22 ASN A 94 14.802 -4.786 -6.735 1.00 0.00 H new ATOM 515 N GLU A 95 10.553 -4.483 -8.075 1.00 0.00 N ATOM 516 CA GLU A 95 9.260 -5.124 -8.409 1.00 0.00 C ATOM 517 C GLU A 95 8.355 -5.258 -7.187 1.00 0.00 C ATOM 518 O GLU A 95 7.146 -5.022 -7.241 1.00 0.00 O ATOM 519 CB GLU A 95 9.487 -6.555 -8.876 1.00 0.00 C ATOM 520 CG GLU A 95 10.336 -6.688 -10.157 1.00 0.00 C ATOM 521 CD GLU A 95 11.822 -6.885 -9.881 1.00 0.00 C ATOM 522 OE1 GLU A 95 12.178 -7.996 -9.451 1.00 0.00 O ATOM 523 OE2 GLU A 95 12.567 -5.896 -10.072 1.00 0.00 O ATOM 0 H GLU A 95 11.363 -5.029 -8.368 1.00 0.00 H new ATOM 0 HA GLU A 95 8.805 -4.493 -9.172 1.00 0.00 H new ATOM 0 HB2 GLU A 95 9.973 -7.111 -8.075 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.518 -7.025 -9.048 1.00 0.00 H new ATOM 0 HG2 GLU A 95 9.968 -7.531 -10.742 1.00 0.00 H new ATOM 0 HG3 GLU A 95 10.203 -5.794 -10.767 1.00 0.00 H new ATOM 524 N GLU A 96 9.002 -5.571 -6.063 1.00 0.00 N ATOM 525 CA GLU A 96 8.409 -5.582 -4.711 1.00 0.00 C ATOM 526 C GLU A 96 7.637 -4.287 -4.394 1.00 0.00 C ATOM 527 O GLU A 96 6.505 -4.339 -3.915 1.00 0.00 O ATOM 528 CB GLU A 96 9.559 -5.701 -3.710 1.00 0.00 C ATOM 529 CG GLU A 96 10.118 -7.123 -3.761 1.00 0.00 C ATOM 530 CD GLU A 96 11.051 -7.445 -2.591 1.00 0.00 C ATOM 531 OE1 GLU A 96 12.247 -7.095 -2.726 1.00 0.00 O ATOM 532 OE2 GLU A 96 10.613 -8.171 -1.670 1.00 0.00 O ATOM 0 H GLU A 96 9.988 -5.834 -6.062 1.00 0.00 H new ATOM 0 HA GLU A 96 7.705 -6.412 -4.651 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.341 -4.980 -3.948 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.208 -5.470 -2.704 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.290 -7.832 -3.763 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.659 -7.261 -4.697 1.00 0.00 H new ATOM 533 N CYS A 97 8.217 -3.187 -4.865 1.00 0.00 N ATOM 534 CA CYS A 97 7.771 -1.822 -4.556 1.00 0.00 C ATOM 535 C CYS A 97 6.920 -1.232 -5.700 1.00 0.00 C ATOM 536 O CYS A 97 6.385 -0.121 -5.599 1.00 0.00 O ATOM 537 CB CYS A 97 9.038 -0.985 -4.361 1.00 0.00 C ATOM 538 SG CYS A 97 10.359 -1.814 -3.398 1.00 0.00 S ATOM 0 H CYS A 97 9.027 -3.214 -5.485 1.00 0.00 H new ATOM 0 HA CYS A 97 7.144 -1.822 -3.664 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.434 -0.716 -5.340 1.00 0.00 H new ATOM 0 HB3 CYS A 97 8.770 -0.055 -3.859 1.00 0.00 H new ATOM 0 HG CYS A 97 11.384 -1.021 -3.296 1.00 0.00 H new ATOM 539 N LEU A 98 6.850 -1.996 -6.793 1.00 0.00 N ATOM 540 CA LEU A 98 6.102 -1.663 -8.008 1.00 0.00 C ATOM 541 C LEU A 98 4.790 -2.433 -7.993 1.00 0.00 C ATOM 542 O LEU A 98 4.712 -3.616 -7.655 1.00 0.00 O ATOM 543 CB LEU A 98 6.887 -2.009 -9.273 1.00 0.00 C ATOM 544 CG LEU A 98 6.278 -1.275 -10.476 1.00 0.00 C ATOM 545 CD1 LEU A 98 6.402 0.212 -10.302 1.00 0.00 C ATOM 546 CD2 LEU A 98 7.126 -1.541 -11.697 1.00 0.00 C ATOM 0 H LEU A 98 7.329 -2.894 -6.859 1.00 0.00 H new ATOM 0 HA LEU A 98 5.921 -0.588 -8.021 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.933 -1.725 -9.153 1.00 0.00 H new ATOM 0 HB3 LEU A 98 6.866 -3.086 -9.443 1.00 0.00 H new ATOM 0 HG LEU A 98 5.244 -1.608 -10.566 1.00 0.00 H new ATOM 0 HD11 LEU A 98 5.965 0.717 -11.164 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.876 0.518 -9.397 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.455 0.482 -10.218 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.700 -1.023 -12.556 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.139 -1.180 -11.522 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.152 -2.612 -11.896 1.00 0.00 H new ATOM 547 N PHE A 99 3.751 -1.642 -8.208 1.00 0.00 N ATOM 548 CA PHE A 99 2.396 -2.146 -8.154 1.00 0.00 C ATOM 549 C PHE A 99 1.547 -1.980 -9.411 1.00 0.00 C ATOM 550 O PHE A 99 1.743 -1.049 -10.178 1.00 0.00 O ATOM 551 CB PHE A 99 1.648 -1.520 -6.962 1.00 0.00 C ATOM 552 CG PHE A 99 2.317 -1.822 -5.610 1.00 0.00 C ATOM 553 CD1 PHE A 99 2.379 -3.156 -5.139 1.00 0.00 C ATOM 554 CD2 PHE A 99 2.961 -0.782 -4.914 1.00 0.00 C ATOM 555 CE1 PHE A 99 3.113 -3.442 -3.961 1.00 0.00 C ATOM 556 CE2 PHE A 99 3.673 -1.065 -3.736 1.00 0.00 C ATOM 557 CZ PHE A 99 3.746 -2.389 -3.262 1.00 0.00 C ATOM 0 H PHE A 99 3.825 -0.647 -8.422 1.00 0.00 H new ATOM 0 HA PHE A 99 2.527 -3.223 -8.045 1.00 0.00 H new ATOM 0 HB2 PHE A 99 1.592 -0.440 -7.101 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.624 -1.893 -6.946 1.00 0.00 H new ATOM 0 HD1 PHE A 99 1.872 -3.947 -5.672 1.00 0.00 H new ATOM 0 HD2 PHE A 99 2.908 0.231 -5.284 1.00 0.00 H new ATOM 0 HE1 PHE A 99 3.188 -4.457 -3.600 1.00 0.00 H new ATOM 0 HE2 PHE A 99 4.163 -0.269 -3.195 1.00 0.00 H new ATOM 0 HZ PHE A 99 4.292 -2.602 -2.355 1.00 0.00 H new ATOM 558 N LEU A 100 0.705 -2.969 -9.649 1.00 0.00 N ATOM 559 CA LEU A 100 -0.228 -2.969 -10.788 1.00 0.00 C ATOM 560 C LEU A 100 -1.537 -2.286 -10.378 1.00 0.00 C ATOM 561 O LEU A 100 -2.204 -2.737 -9.444 1.00 0.00 O ATOM 562 CB LEU A 100 -0.467 -4.418 -11.218 1.00 0.00 C ATOM 563 CG LEU A 100 -0.705 -4.489 -12.731 1.00 0.00 C ATOM 564 CD1 LEU A 100 0.652 -4.435 -13.423 1.00 0.00 C ATOM 565 CD2 LEU A 100 -1.393 -5.810 -13.090 1.00 0.00 C ATOM 0 H LEU A 100 0.640 -3.802 -9.064 1.00 0.00 H new ATOM 0 HA LEU A 100 0.189 -2.415 -11.629 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.393 -5.031 -10.949 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -1.328 -4.825 -10.688 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.338 -3.660 -13.048 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.512 -4.484 -14.503 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.156 -3.504 -13.164 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.260 -5.279 -13.097 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.559 -5.853 -14.166 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.760 -6.644 -12.787 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.350 -5.874 -12.573 1.00 0.00 H new ATOM 566 N GLU A 101 -1.694 -1.070 -10.899 1.00 0.00 N ATOM 567 CA GLU A 101 -2.814 -0.160 -10.587 1.00 0.00 C ATOM 568 C GLU A 101 -4.160 -0.651 -11.128 1.00 0.00 C ATOM 569 O GLU A 101 -4.583 -0.417 -12.251 1.00 0.00 O ATOM 570 CB GLU A 101 -2.484 1.245 -11.071 1.00 0.00 C ATOM 571 CG GLU A 101 -3.391 2.289 -10.429 1.00 0.00 C ATOM 572 CD GLU A 101 -2.915 3.718 -10.690 1.00 0.00 C ATOM 573 OE1 GLU A 101 -3.157 4.194 -11.818 1.00 0.00 O ATOM 574 OE2 GLU A 101 -2.348 4.297 -9.735 1.00 0.00 O ATOM 0 H GLU A 101 -1.034 -0.673 -11.567 1.00 0.00 H new ATOM 0 HA GLU A 101 -2.932 -0.143 -9.504 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -1.444 1.475 -10.840 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -2.587 1.290 -12.155 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -4.404 2.171 -10.813 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -3.436 2.115 -9.354 1.00 0.00 H new ATOM 575 N ARG A 102 -4.770 -1.387 -10.212 1.00 0.00 N ATOM 576 CA ARG A 102 -6.073 -2.038 -10.350 1.00 0.00 C ATOM 577 C ARG A 102 -7.175 -1.099 -9.825 1.00 0.00 C ATOM 578 O ARG A 102 -7.331 -0.891 -8.618 1.00 0.00 O ATOM 579 CB ARG A 102 -6.058 -3.263 -9.456 1.00 0.00 C ATOM 580 CG ARG A 102 -4.929 -4.279 -9.654 1.00 0.00 C ATOM 581 CD ARG A 102 -4.982 -4.953 -11.023 1.00 0.00 C ATOM 582 NE ARG A 102 -6.289 -5.620 -11.203 1.00 0.00 N ATOM 583 CZ ARG A 102 -7.225 -5.287 -12.089 1.00 0.00 C ATOM 584 NH1 ARG A 102 -7.076 -4.279 -12.936 1.00 0.00 N ATOM 585 NH2 ARG A 102 -8.361 -5.976 -12.137 1.00 0.00 N ATOM 0 H ARG A 102 -4.349 -1.559 -9.299 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.261 -2.290 -11.394 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -6.024 -2.922 -8.421 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -7.005 -3.785 -9.588 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -3.968 -3.777 -9.537 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -4.989 -5.040 -8.876 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -4.830 -4.213 -11.809 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -4.176 -5.682 -11.111 1.00 0.00 H new ATOM 0 HE ARG A 102 -6.493 -6.410 -10.591 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -6.219 -3.725 -12.924 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -7.818 -4.057 -13.600 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -8.512 -6.756 -11.497 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -9.081 -5.725 -12.814 1.00 0.00 H new ATOM 586 N LEU A 103 -8.063 -0.701 -10.715 1.00 0.00 N ATOM 587 CA LEU A 103 -9.093 0.287 -10.347 1.00 0.00 C ATOM 588 C LEU A 103 -10.497 -0.321 -10.348 1.00 0.00 C ATOM 589 O LEU A 103 -10.989 -0.855 -11.346 1.00 0.00 O ATOM 590 CB LEU A 103 -8.979 1.478 -11.289 1.00 0.00 C ATOM 591 CG LEU A 103 -9.910 2.667 -10.997 1.00 0.00 C ATOM 592 CD1 LEU A 103 -9.663 3.345 -9.646 1.00 0.00 C ATOM 593 CD2 LEU A 103 -9.801 3.679 -12.126 1.00 0.00 C ATOM 0 H LEU A 103 -8.104 -1.029 -11.680 1.00 0.00 H new ATOM 0 HA LEU A 103 -8.924 0.623 -9.324 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -7.950 1.835 -11.266 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -9.174 1.132 -12.304 1.00 0.00 H new ATOM 0 HG LEU A 103 -10.920 2.263 -10.936 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -10.362 4.172 -9.521 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.809 2.622 -8.844 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.642 3.724 -9.611 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -10.460 4.523 -11.923 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.772 4.031 -12.201 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -10.093 3.209 -13.065 1.00 0.00 H new ATOM 594 N GLU A 104 -11.177 -0.003 -9.253 1.00 0.00 N ATOM 595 CA GLU A 104 -12.589 -0.334 -8.971 1.00 0.00 C ATOM 596 C GLU A 104 -13.594 0.606 -9.666 1.00 0.00 C ATOM 597 O GLU A 104 -14.789 0.562 -9.393 1.00 0.00 O ATOM 598 CB GLU A 104 -12.838 -0.213 -7.465 1.00 0.00 C ATOM 599 CG GLU A 104 -12.364 -1.394 -6.639 1.00 0.00 C ATOM 600 CD GLU A 104 -13.322 -2.592 -6.741 1.00 0.00 C ATOM 601 OE1 GLU A 104 -13.136 -3.423 -7.655 1.00 0.00 O ATOM 602 OE2 GLU A 104 -14.230 -2.656 -5.877 1.00 0.00 O ATOM 0 H GLU A 104 -10.745 0.520 -8.491 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.745 -1.344 -9.349 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.343 0.687 -7.101 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.907 -0.078 -7.299 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.371 -1.695 -6.973 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -12.271 -1.092 -5.596 1.00 0.00 H new ATOM 603 N GLU A 105 -13.087 1.447 -10.581 1.00 0.00 N ATOM 604 CA GLU A 105 -13.789 2.596 -11.188 1.00 0.00 C ATOM 605 C GLU A 105 -14.206 3.733 -10.257 1.00 0.00 C ATOM 606 O GLU A 105 -13.890 4.884 -10.541 1.00 0.00 O ATOM 607 CB GLU A 105 -14.975 2.168 -12.061 1.00 0.00 C ATOM 608 CG GLU A 105 -14.546 1.696 -13.453 1.00 0.00 C ATOM 609 CD GLU A 105 -13.688 0.422 -13.417 1.00 0.00 C ATOM 610 OE1 GLU A 105 -14.276 -0.654 -13.197 1.00 0.00 O ATOM 611 OE2 GLU A 105 -12.457 0.568 -13.585 1.00 0.00 O ATOM 0 H GLU A 105 -12.136 1.343 -10.935 1.00 0.00 H new ATOM 0 HA GLU A 105 -13.003 3.026 -11.809 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -15.517 1.365 -11.561 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -15.666 3.005 -12.163 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -15.434 1.512 -14.058 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -13.985 2.492 -13.943 1.00 0.00 H new ATOM 612 N ASN A 106 -14.775 3.363 -9.109 1.00 0.00 N ATOM 613 CA ASN A 106 -15.268 4.299 -8.081 1.00 0.00 C ATOM 614 C ASN A 106 -14.159 4.976 -7.247 1.00 0.00 C ATOM 615 O ASN A 106 -14.265 5.157 -6.035 1.00 0.00 O ATOM 616 CB ASN A 106 -16.211 3.486 -7.215 1.00 0.00 C ATOM 617 CG ASN A 106 -17.405 4.337 -6.745 1.00 0.00 C ATOM 618 OD1 ASN A 106 -18.460 4.390 -7.349 1.00 0.00 O ATOM 619 ND2 ASN A 106 -17.207 5.081 -5.672 1.00 0.00 N ATOM 0 H ASN A 106 -14.912 2.384 -8.856 1.00 0.00 H new ATOM 0 HA ASN A 106 -15.765 5.143 -8.559 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.573 2.624 -7.776 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.673 3.100 -6.349 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -17.942 5.707 -5.343 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -16.319 5.030 -5.172 1.00 0.00 H new ATOM 620 N HIS A 107 -13.116 5.369 -7.976 1.00 0.00 N ATOM 621 CA HIS A 107 -11.875 6.017 -7.499 1.00 0.00 C ATOM 622 C HIS A 107 -10.928 5.135 -6.664 1.00 0.00 C ATOM 623 O HIS A 107 -9.726 5.366 -6.629 1.00 0.00 O ATOM 624 CB HIS A 107 -12.153 7.356 -6.804 1.00 0.00 C ATOM 625 CG HIS A 107 -12.932 8.283 -7.742 1.00 0.00 C ATOM 626 ND1 HIS A 107 -14.259 8.395 -7.767 1.00 0.00 N ATOM 627 CD2 HIS A 107 -12.481 8.748 -8.904 1.00 0.00 C ATOM 628 CE1 HIS A 107 -14.623 8.889 -8.939 1.00 0.00 C ATOM 629 NE2 HIS A 107 -13.525 9.106 -9.642 1.00 0.00 N ATOM 0 H HIS A 107 -13.106 5.238 -8.988 1.00 0.00 H new ATOM 0 HA HIS A 107 -11.321 6.206 -8.419 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -12.722 7.189 -5.890 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -11.213 7.826 -6.513 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -11.444 8.822 -9.197 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -15.635 9.081 -9.263 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -13.486 9.484 -10.589 1.00 0.00 H new ATOM 630 N TYR A 108 -11.494 4.092 -6.066 1.00 0.00 N ATOM 631 CA TYR A 108 -10.731 3.055 -5.333 1.00 0.00 C ATOM 632 C TYR A 108 -9.747 2.293 -6.209 1.00 0.00 C ATOM 633 O TYR A 108 -10.097 1.586 -7.156 1.00 0.00 O ATOM 634 CB TYR A 108 -11.608 2.017 -4.625 1.00 0.00 C ATOM 635 CG TYR A 108 -12.445 2.640 -3.526 1.00 0.00 C ATOM 636 CD1 TYR A 108 -11.783 3.275 -2.454 1.00 0.00 C ATOM 637 CD2 TYR A 108 -13.801 2.900 -3.814 1.00 0.00 C ATOM 638 CE1 TYR A 108 -12.459 4.262 -1.724 1.00 0.00 C ATOM 639 CE2 TYR A 108 -14.486 3.888 -3.089 1.00 0.00 C ATOM 640 CZ TYR A 108 -13.783 4.580 -2.077 1.00 0.00 C ATOM 641 OH TYR A 108 -14.312 5.738 -1.584 1.00 0.00 O ATOM 0 H TYR A 108 -12.501 3.930 -6.069 1.00 0.00 H new ATOM 0 HA TYR A 108 -10.191 3.640 -4.588 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -12.263 1.538 -5.353 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -10.976 1.236 -4.202 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -10.769 3.004 -2.199 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -14.309 2.343 -4.587 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -11.972 4.770 -0.905 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -15.521 4.113 -3.299 1.00 0.00 H new ATOM 0 HH TYR A 108 -15.233 5.840 -1.904 1.00 0.00 H new ATOM 642 N ASN A 109 -8.495 2.478 -5.822 1.00 0.00 N ATOM 643 CA ASN A 109 -7.334 1.790 -6.394 1.00 0.00 C ATOM 644 C ASN A 109 -6.920 0.665 -5.450 1.00 0.00 C ATOM 645 O ASN A 109 -7.014 0.755 -4.226 1.00 0.00 O ATOM 646 CB ASN A 109 -6.207 2.790 -6.457 1.00 0.00 C ATOM 647 CG ASN A 109 -6.266 3.695 -7.692 1.00 0.00 C ATOM 648 OD1 ASN A 109 -5.589 3.493 -8.690 1.00 0.00 O ATOM 649 ND2 ASN A 109 -7.108 4.699 -7.678 1.00 0.00 N ATOM 0 H ASN A 109 -8.244 3.130 -5.079 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.565 1.387 -7.380 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -6.230 3.409 -5.560 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -5.257 2.256 -6.452 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -7.194 5.304 -8.495 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -7.677 4.876 -6.850 1.00 0.00 H new ATOM 650 N THR A 110 -6.679 -0.467 -6.082 1.00 0.00 N ATOM 651 CA THR A 110 -6.024 -1.630 -5.469 1.00 0.00 C ATOM 652 C THR A 110 -4.720 -1.879 -6.256 1.00 0.00 C ATOM 653 O THR A 110 -4.530 -1.385 -7.369 1.00 0.00 O ATOM 654 CB THR A 110 -6.937 -2.875 -5.431 1.00 0.00 C ATOM 655 OG1 THR A 110 -7.147 -3.436 -6.724 1.00 0.00 O ATOM 656 CG2 THR A 110 -8.272 -2.595 -4.741 1.00 0.00 C ATOM 0 H THR A 110 -6.935 -0.618 -7.058 1.00 0.00 H new ATOM 0 HA THR A 110 -5.801 -1.426 -4.422 1.00 0.00 H new ATOM 0 HB THR A 110 -6.404 -3.615 -4.834 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.101 -3.622 -6.849 1.00 0.00 H new ATOM 0 HG21 THR A 110 -8.878 -3.501 -4.740 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.091 -2.278 -3.714 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.800 -1.806 -5.277 1.00 0.00 H new ATOM 657 N TYR A 111 -3.824 -2.648 -5.664 1.00 0.00 N ATOM 658 CA TYR A 111 -2.407 -2.677 -6.104 1.00 0.00 C ATOM 659 C TYR A 111 -1.689 -4.026 -5.936 1.00 0.00 C ATOM 660 O TYR A 111 -1.189 -4.315 -4.846 1.00 0.00 O ATOM 661 CB TYR A 111 -1.621 -1.619 -5.307 1.00 0.00 C ATOM 662 CG TYR A 111 -2.003 -0.187 -5.658 1.00 0.00 C ATOM 663 CD1 TYR A 111 -1.693 0.287 -6.948 1.00 0.00 C ATOM 664 CD2 TYR A 111 -2.574 0.642 -4.664 1.00 0.00 C ATOM 665 CE1 TYR A 111 -1.949 1.629 -7.249 1.00 0.00 C ATOM 666 CE2 TYR A 111 -2.816 1.992 -4.973 1.00 0.00 C ATOM 667 CZ TYR A 111 -2.506 2.466 -6.262 1.00 0.00 C ATOM 668 OH TYR A 111 -2.779 3.757 -6.583 1.00 0.00 O ATOM 0 H TYR A 111 -4.033 -3.265 -4.879 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.433 -2.479 -7.175 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.787 -1.780 -4.242 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.555 -1.757 -5.488 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -1.266 -0.372 -7.689 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.819 0.247 -3.689 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -1.722 2.020 -8.230 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.234 2.657 -4.231 1.00 0.00 H new ATOM 0 HH TYR A 111 -2.639 3.892 -7.544 1.00 0.00 H new ATOM 669 N ILE A 112 -1.565 -4.792 -7.022 1.00 0.00 N ATOM 670 CA ILE A 112 -0.794 -6.058 -6.937 1.00 0.00 C ATOM 671 C ILE A 112 0.707 -5.757 -6.999 1.00 0.00 C ATOM 672 O ILE A 112 1.182 -5.141 -7.948 1.00 0.00 O ATOM 673 CB ILE A 112 -1.040 -7.141 -7.996 1.00 0.00 C ATOM 674 CG1 ILE A 112 -2.442 -7.069 -8.630 1.00 0.00 C ATOM 675 CG2 ILE A 112 -0.591 -8.511 -7.441 1.00 0.00 C ATOM 676 CD1 ILE A 112 -3.226 -8.350 -8.940 1.00 0.00 C ATOM 0 H ILE A 112 -1.964 -4.582 -7.937 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.153 -6.469 -5.994 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.412 -6.957 -8.868 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.063 -6.465 -7.969 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.343 -6.519 -9.566 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.765 -9.282 -8.191 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.471 -8.475 -7.197 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -1.162 -8.744 -6.542 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.188 -8.090 -9.382 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.659 -8.963 -9.640 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.389 -8.909 -8.018 1.00 0.00 H new ATOM 677 N SER A 113 1.429 -6.417 -6.094 1.00 0.00 N ATOM 678 CA SER A 113 2.900 -6.420 -6.107 1.00 0.00 C ATOM 679 C SER A 113 3.377 -7.162 -7.347 1.00 0.00 C ATOM 680 O SER A 113 2.972 -8.289 -7.602 1.00 0.00 O ATOM 681 CB SER A 113 3.468 -7.101 -4.854 1.00 0.00 C ATOM 682 OG SER A 113 4.894 -6.942 -4.842 1.00 0.00 O ATOM 0 H SER A 113 1.019 -6.962 -5.335 1.00 0.00 H new ATOM 0 HA SER A 113 3.251 -5.388 -6.118 1.00 0.00 H new ATOM 0 HB2 SER A 113 3.033 -6.662 -3.957 1.00 0.00 H new ATOM 0 HB3 SER A 113 3.207 -8.159 -4.850 1.00 0.00 H new ATOM 0 HG SER A 113 5.121 -6.047 -4.514 1.00 0.00 H new ATOM 683 N LYS A 114 4.042 -6.405 -8.210 1.00 0.00 N ATOM 684 CA LYS A 114 4.701 -6.902 -9.432 1.00 0.00 C ATOM 685 C LYS A 114 5.467 -8.226 -9.193 1.00 0.00 C ATOM 686 O LYS A 114 5.278 -9.195 -9.919 1.00 0.00 O ATOM 687 CB LYS A 114 5.631 -5.784 -9.901 1.00 0.00 C ATOM 688 CG LYS A 114 6.122 -5.936 -11.342 1.00 0.00 C ATOM 689 CD LYS A 114 5.003 -5.980 -12.385 1.00 0.00 C ATOM 690 CE LYS A 114 4.379 -4.613 -12.694 1.00 0.00 C ATOM 691 NZ LYS A 114 3.455 -4.148 -11.644 1.00 0.00 N ATOM 0 H LYS A 114 4.146 -5.398 -8.084 1.00 0.00 H new ATOM 0 HA LYS A 114 3.960 -7.143 -10.195 1.00 0.00 H new ATOM 0 HB2 LYS A 114 5.111 -4.831 -9.805 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.495 -5.744 -9.238 1.00 0.00 H new ATOM 0 HG2 LYS A 114 6.789 -5.106 -11.576 1.00 0.00 H new ATOM 0 HG3 LYS A 114 6.711 -6.850 -11.419 1.00 0.00 H new ATOM 0 HD2 LYS A 114 5.398 -6.404 -13.308 1.00 0.00 H new ATOM 0 HD3 LYS A 114 4.221 -6.653 -12.034 1.00 0.00 H new ATOM 0 HE2 LYS A 114 5.174 -3.878 -12.822 1.00 0.00 H new ATOM 0 HE3 LYS A 114 3.843 -4.671 -13.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 2.727 -3.538 -12.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 3.001 -4.968 -11.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 3.985 -3.609 -10.929 1.00 0.00 H new ATOM 692 N LYS A 115 6.126 -8.291 -8.037 1.00 0.00 N ATOM 693 CA LYS A 115 6.811 -9.521 -7.575 1.00 0.00 C ATOM 694 C LYS A 115 5.773 -10.617 -7.256 1.00 0.00 C ATOM 695 O LYS A 115 5.761 -11.685 -7.875 1.00 0.00 O ATOM 696 CB LYS A 115 7.676 -9.213 -6.339 1.00 0.00 C ATOM 697 CG LYS A 115 8.398 -10.512 -5.969 1.00 0.00 C ATOM 698 CD LYS A 115 8.664 -10.693 -4.482 1.00 0.00 C ATOM 699 CE LYS A 115 8.883 -12.186 -4.266 1.00 0.00 C ATOM 700 NZ LYS A 115 10.157 -12.618 -4.862 1.00 0.00 N ATOM 0 H LYS A 115 6.206 -7.506 -7.391 1.00 0.00 H new ATOM 0 HA LYS A 115 7.463 -9.885 -8.369 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.393 -8.421 -6.556 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.058 -8.865 -5.511 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.804 -11.355 -6.323 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.349 -10.547 -6.501 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.539 -10.123 -4.171 1.00 0.00 H new ATOM 0 HD3 LYS A 115 7.822 -10.334 -3.890 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.882 -12.408 -3.199 1.00 0.00 H new ATOM 0 HE3 LYS A 115 8.060 -12.747 -4.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 10.360 -13.597 -4.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 10.090 -12.568 -5.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.923 -11.995 -4.534 1.00 0.00 H new ATOM 701 N HIS A 116 4.887 -10.306 -6.314 1.00 0.00 N ATOM 702 CA HIS A 116 3.874 -11.244 -5.806 1.00 0.00 C ATOM 703 C HIS A 116 2.623 -11.349 -6.683 1.00 0.00 C ATOM 704 O HIS A 116 1.559 -11.761 -6.236 1.00 0.00 O ATOM 705 CB HIS A 116 3.485 -10.824 -4.387 1.00 0.00 C ATOM 706 CG HIS A 116 4.665 -10.738 -3.425 1.00 0.00 C ATOM 707 ND1 HIS A 116 5.061 -9.637 -2.803 1.00 0.00 N ATOM 708 CD2 HIS A 116 5.457 -11.740 -3.052 1.00 0.00 C ATOM 709 CE1 HIS A 116 6.084 -9.948 -2.039 1.00 0.00 C ATOM 710 NE2 HIS A 116 6.345 -11.236 -2.189 1.00 0.00 N ATOM 0 H HIS A 116 4.847 -9.387 -5.873 1.00 0.00 H new ATOM 0 HA HIS A 116 4.324 -12.237 -5.817 1.00 0.00 H new ATOM 0 HB2 HIS A 116 2.990 -9.854 -4.428 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.759 -11.535 -3.994 1.00 0.00 H new ATOM 0 HD2 HIS A 116 5.394 -12.766 -3.384 1.00 0.00 H new ATOM 0 HE1 HIS A 116 6.621 -9.266 -1.396 1.00 0.00 H new ATOM 0 HE2 HIS A 116 7.093 -11.754 -1.727 1.00 0.00 H new ATOM 711 N ALA A 117 2.810 -11.053 -7.967 1.00 0.00 N ATOM 712 CA ALA A 117 1.840 -11.354 -9.039 1.00 0.00 C ATOM 713 C ALA A 117 1.730 -12.874 -9.223 1.00 0.00 C ATOM 714 O ALA A 117 0.647 -13.389 -9.493 1.00 0.00 O ATOM 715 CB ALA A 117 2.299 -10.676 -10.339 1.00 0.00 C ATOM 0 H ALA A 117 3.652 -10.589 -8.307 1.00 0.00 H new ATOM 0 HA ALA A 117 0.856 -10.970 -8.772 1.00 0.00 H new ATOM 0 HB1 ALA A 117 1.587 -10.895 -11.135 1.00 0.00 H new ATOM 0 HB2 ALA A 117 2.354 -9.598 -10.187 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.282 -11.054 -10.619 1.00 0.00 H new ATOM 716 N GLU A 118 2.802 -13.581 -8.823 1.00 0.00 N ATOM 717 CA GLU A 118 2.755 -15.058 -8.722 1.00 0.00 C ATOM 718 C GLU A 118 1.902 -15.603 -7.551 1.00 0.00 C ATOM 719 O GLU A 118 1.666 -16.802 -7.454 1.00 0.00 O ATOM 720 CB GLU A 118 4.179 -15.650 -8.759 1.00 0.00 C ATOM 721 CG GLU A 118 5.150 -15.004 -7.767 1.00 0.00 C ATOM 722 CD GLU A 118 6.573 -15.562 -7.922 1.00 0.00 C ATOM 723 OE1 GLU A 118 6.725 -16.802 -7.840 1.00 0.00 O ATOM 724 OE2 GLU A 118 7.484 -14.726 -8.111 1.00 0.00 O ATOM 0 H GLU A 118 3.698 -13.166 -8.568 1.00 0.00 H new ATOM 0 HA GLU A 118 2.218 -15.405 -9.605 1.00 0.00 H new ATOM 0 HB2 GLU A 118 4.122 -16.719 -8.552 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.580 -15.541 -9.767 1.00 0.00 H new ATOM 0 HG2 GLU A 118 5.163 -13.925 -7.920 1.00 0.00 H new ATOM 0 HG3 GLU A 118 4.800 -15.177 -6.749 1.00 0.00 H new ATOM 725 N LYS A 119 1.471 -14.689 -6.691 1.00 0.00 N ATOM 726 CA LYS A 119 0.594 -14.937 -5.523 1.00 0.00 C ATOM 727 C LYS A 119 -0.669 -14.050 -5.488 1.00 0.00 C ATOM 728 O LYS A 119 -1.519 -14.254 -4.626 1.00 0.00 O ATOM 729 CB LYS A 119 1.436 -14.705 -4.270 1.00 0.00 C ATOM 730 CG LYS A 119 2.239 -15.940 -3.879 1.00 0.00 C ATOM 731 CD LYS A 119 3.591 -15.561 -3.268 1.00 0.00 C ATOM 732 CE LYS A 119 4.558 -15.110 -4.361 1.00 0.00 C ATOM 733 NZ LYS A 119 5.900 -14.897 -3.777 1.00 0.00 N ATOM 0 H LYS A 119 1.727 -13.706 -6.781 1.00 0.00 H new ATOM 0 HA LYS A 119 0.222 -15.960 -5.586 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.116 -13.871 -4.441 1.00 0.00 H new ATOM 0 HB3 LYS A 119 0.784 -14.421 -3.444 1.00 0.00 H new ATOM 0 HG2 LYS A 119 1.669 -16.534 -3.164 1.00 0.00 H new ATOM 0 HG3 LYS A 119 2.398 -16.565 -4.758 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.457 -14.762 -2.539 1.00 0.00 H new ATOM 0 HD3 LYS A 119 4.008 -16.414 -2.733 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.608 -15.861 -5.149 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.200 -14.189 -4.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 6.404 -14.169 -4.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.803 -14.586 -2.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.438 -15.787 -3.808 1.00 0.00 H new ATOM 734 N ASN A 120 -0.849 -13.210 -6.507 1.00 0.00 N ATOM 735 CA ASN A 120 -1.898 -12.157 -6.613 1.00 0.00 C ATOM 736 C ASN A 120 -2.037 -11.253 -5.373 1.00 0.00 C ATOM 737 O ASN A 120 -3.123 -10.774 -5.048 1.00 0.00 O ATOM 738 CB ASN A 120 -3.238 -12.821 -6.941 1.00 0.00 C ATOM 739 CG ASN A 120 -3.151 -13.615 -8.248 1.00 0.00 C ATOM 740 OD1 ASN A 120 -3.105 -13.091 -9.351 1.00 0.00 O ATOM 741 ND2 ASN A 120 -3.014 -14.917 -8.116 1.00 0.00 N ATOM 0 H ASN A 120 -0.246 -13.234 -7.329 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.582 -11.488 -7.413 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.528 -13.485 -6.127 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -4.014 -12.060 -7.024 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -2.868 -15.501 -8.940 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -3.054 -15.343 -7.190 1.00 0.00 H new ATOM 742 N TRP A 121 -0.905 -10.929 -4.767 1.00 0.00 N ATOM 743 CA TRP A 121 -0.894 -10.117 -3.533 1.00 0.00 C ATOM 744 C TRP A 121 -0.981 -8.614 -3.772 1.00 0.00 C ATOM 745 O TRP A 121 -0.069 -7.984 -4.317 1.00 0.00 O ATOM 746 CB TRP A 121 0.317 -10.361 -2.636 1.00 0.00 C ATOM 747 CG TRP A 121 0.377 -11.755 -2.020 1.00 0.00 C ATOM 748 CD1 TRP A 121 -0.565 -12.690 -2.046 1.00 0.00 C ATOM 749 CD2 TRP A 121 1.441 -12.236 -1.271 1.00 0.00 C ATOM 750 NE1 TRP A 121 -0.146 -13.754 -1.378 1.00 0.00 N ATOM 751 CE2 TRP A 121 1.060 -13.523 -0.854 1.00 0.00 C ATOM 752 CE3 TRP A 121 2.679 -11.692 -0.875 1.00 0.00 C ATOM 753 CZ2 TRP A 121 1.892 -14.288 -0.014 1.00 0.00 C ATOM 754 CZ3 TRP A 121 3.546 -12.470 -0.094 1.00 0.00 C ATOM 755 CH2 TRP A 121 3.141 -13.748 0.355 1.00 0.00 C ATOM 0 H TRP A 121 0.019 -11.208 -5.097 1.00 0.00 H new ATOM 0 HA TRP A 121 -1.799 -10.460 -3.031 1.00 0.00 H new ATOM 0 HB2 TRP A 121 1.224 -10.195 -3.218 1.00 0.00 H new ATOM 0 HB3 TRP A 121 0.314 -9.623 -1.834 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -1.523 -12.597 -2.535 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -0.669 -14.624 -1.278 1.00 0.00 H new ATOM 0 HE3 TRP A 121 2.956 -10.690 -1.169 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 1.582 -15.261 0.338 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.524 -12.092 0.165 1.00 0.00 H new ATOM 0 HH2 TRP A 121 3.800 -14.320 0.991 1.00 0.00 H new ATOM 756 N PHE A 122 -2.033 -8.067 -3.170 1.00 0.00 N ATOM 757 CA PHE A 122 -2.274 -6.620 -3.166 1.00 0.00 C ATOM 758 C PHE A 122 -1.859 -6.073 -1.794 1.00 0.00 C ATOM 759 O PHE A 122 -1.834 -6.816 -0.805 1.00 0.00 O ATOM 760 CB PHE A 122 -3.743 -6.324 -3.442 1.00 0.00 C ATOM 761 CG PHE A 122 -4.312 -6.816 -4.780 1.00 0.00 C ATOM 762 CD1 PHE A 122 -4.675 -8.176 -4.916 1.00 0.00 C ATOM 763 CD2 PHE A 122 -4.778 -5.855 -5.703 1.00 0.00 C ATOM 764 CE1 PHE A 122 -5.530 -8.579 -5.963 1.00 0.00 C ATOM 765 CE2 PHE A 122 -5.646 -6.246 -6.746 1.00 0.00 C ATOM 766 CZ PHE A 122 -6.016 -7.602 -6.864 1.00 0.00 C ATOM 0 H PHE A 122 -2.741 -8.607 -2.673 1.00 0.00 H new ATOM 0 HA PHE A 122 -1.690 -6.139 -3.950 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.334 -6.765 -2.639 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -3.887 -5.245 -3.388 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.297 -8.907 -4.217 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.471 -4.823 -5.612 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -5.809 -9.616 -6.075 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -6.022 -5.515 -7.446 1.00 0.00 H new ATOM 0 HZ PHE A 122 -6.684 -7.901 -7.658 1.00 0.00 H new ATOM 767 N VAL A 123 -1.468 -4.803 -1.761 1.00 0.00 N ATOM 768 CA VAL A 123 -0.928 -4.160 -0.532 1.00 0.00 C ATOM 769 C VAL A 123 -1.707 -4.398 0.786 1.00 0.00 C ATOM 770 O VAL A 123 -1.215 -5.140 1.632 1.00 0.00 O ATOM 771 CB VAL A 123 -0.483 -2.700 -0.746 1.00 0.00 C ATOM 772 CG1 VAL A 123 0.857 -2.698 -1.458 1.00 0.00 C ATOM 773 CG2 VAL A 123 -1.476 -1.820 -1.501 1.00 0.00 C ATOM 0 H VAL A 123 -1.509 -4.182 -2.569 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.017 -4.731 -0.352 1.00 0.00 H new ATOM 0 HB VAL A 123 -0.415 -2.255 0.247 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.184 -1.670 -1.616 1.00 0.00 H new ATOM 0 HG12 VAL A 123 1.593 -3.223 -0.850 1.00 0.00 H new ATOM 0 HG13 VAL A 123 0.758 -3.199 -2.421 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -1.069 -0.814 -1.599 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -1.652 -2.238 -2.492 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -2.417 -1.779 -0.952 1.00 0.00 H new ATOM 774 N GLY A 124 -2.683 -3.535 1.037 1.00 0.00 N ATOM 775 CA GLY A 124 -3.693 -3.753 2.087 1.00 0.00 C ATOM 776 C GLY A 124 -3.493 -2.959 3.362 1.00 0.00 C ATOM 777 O GLY A 124 -2.401 -2.544 3.722 1.00 0.00 O ATOM 0 H GLY A 124 -2.804 -2.662 0.524 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -4.674 -3.510 1.679 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -3.706 -4.813 2.339 1.00 0.00 H new ATOM 778 N LEU A 125 -4.660 -2.460 3.748 1.00 0.00 N ATOM 779 CA LEU A 125 -4.858 -1.731 4.999 1.00 0.00 C ATOM 780 C LEU A 125 -5.399 -2.669 6.051 1.00 0.00 C ATOM 781 O LEU A 125 -6.536 -3.148 5.983 1.00 0.00 O ATOM 782 CB LEU A 125 -5.749 -0.518 4.729 1.00 0.00 C ATOM 783 CG LEU A 125 -4.866 0.727 4.810 1.00 0.00 C ATOM 784 CD1 LEU A 125 -3.638 0.704 3.902 1.00 0.00 C ATOM 785 CD2 LEU A 125 -5.705 1.969 4.502 1.00 0.00 C ATOM 0 H LEU A 125 -5.511 -2.551 3.193 1.00 0.00 H new ATOM 0 HA LEU A 125 -3.916 -1.349 5.392 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -6.214 -0.595 3.746 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.556 -0.464 5.460 1.00 0.00 H new ATOM 0 HG LEU A 125 -4.479 0.748 5.829 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -3.074 1.628 4.029 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -3.007 -0.145 4.165 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -3.955 0.612 2.863 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -5.075 2.857 4.560 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -6.124 1.886 3.499 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -6.514 2.050 5.227 1.00 0.00 H new ATOM 786 N LYS A 126 -4.446 -3.087 6.862 1.00 0.00 N ATOM 787 CA LYS A 126 -4.670 -4.160 7.822 1.00 0.00 C ATOM 788 C LYS A 126 -5.717 -3.741 8.872 1.00 0.00 C ATOM 789 O LYS A 126 -5.550 -2.701 9.508 1.00 0.00 O ATOM 790 CB LYS A 126 -3.384 -4.585 8.522 1.00 0.00 C ATOM 791 CG LYS A 126 -3.374 -6.088 8.839 1.00 0.00 C ATOM 792 CD LYS A 126 -3.202 -6.400 10.324 1.00 0.00 C ATOM 793 CE LYS A 126 -4.343 -5.873 11.202 1.00 0.00 C ATOM 794 NZ LYS A 126 -4.073 -6.270 12.602 1.00 0.00 N ATOM 0 H LYS A 126 -3.503 -2.699 6.878 1.00 0.00 H new ATOM 0 HA LYS A 126 -5.042 -5.015 7.258 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -2.530 -4.341 7.891 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -3.269 -4.018 9.446 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -4.307 -6.530 8.489 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -2.567 -6.563 8.281 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -3.126 -7.480 10.453 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -2.262 -5.971 10.670 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -4.414 -4.788 11.122 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -5.298 -6.280 10.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -4.972 -6.365 13.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -3.570 -7.180 12.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -3.487 -5.544 13.062 1.00 0.00 H new ATOM 795 N LYS A 127 -6.888 -4.291 8.572 1.00 0.00 N ATOM 796 CA LYS A 127 -8.182 -4.327 9.299 1.00 0.00 C ATOM 797 C LYS A 127 -8.372 -3.690 10.693 1.00 0.00 C ATOM 798 O LYS A 127 -9.499 -3.492 11.145 1.00 0.00 O ATOM 799 CB LYS A 127 -8.566 -5.810 9.344 1.00 0.00 C ATOM 800 CG LYS A 127 -10.085 -6.065 9.356 1.00 0.00 C ATOM 801 CD LYS A 127 -10.724 -5.683 8.023 1.00 0.00 C ATOM 802 CE LYS A 127 -10.432 -6.707 6.916 1.00 0.00 C ATOM 803 NZ LYS A 127 -11.005 -6.207 5.675 1.00 0.00 N ATOM 0 H LYS A 127 -6.979 -4.797 7.691 1.00 0.00 H new ATOM 0 HA LYS A 127 -8.819 -3.648 8.733 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.130 -6.314 8.481 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -8.125 -6.262 10.233 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -10.277 -7.117 9.565 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.546 -5.491 10.160 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.802 -5.592 8.154 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -10.356 -4.704 7.715 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -9.357 -6.854 6.807 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -10.862 -7.676 7.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.095 -6.988 4.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.944 -5.802 5.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -10.385 -5.472 5.278 1.00 0.00 H new ATOM 804 N ASN A 128 -7.274 -3.364 11.350 1.00 0.00 N ATOM 805 CA ASN A 128 -7.245 -2.956 12.762 1.00 0.00 C ATOM 806 C ASN A 128 -6.496 -1.656 13.030 1.00 0.00 C ATOM 807 O ASN A 128 -6.942 -0.839 13.836 1.00 0.00 O ATOM 808 CB ASN A 128 -6.543 -4.062 13.526 1.00 0.00 C ATOM 809 CG ASN A 128 -7.369 -5.339 13.762 1.00 0.00 C ATOM 810 OD1 ASN A 128 -6.826 -6.391 14.073 1.00 0.00 O ATOM 811 ND2 ASN A 128 -8.661 -5.318 13.495 1.00 0.00 N ATOM 0 H ASN A 128 -6.351 -3.372 10.916 1.00 0.00 H new ATOM 0 HA ASN A 128 -8.276 -2.786 13.072 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.636 -4.333 12.985 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -6.232 -3.669 14.494 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -9.207 -6.178 13.548 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -9.114 -4.442 13.236 1.00 0.00 H new ATOM 812 N GLY A 129 -5.404 -1.443 12.292 1.00 0.00 N ATOM 813 CA GLY A 129 -4.472 -0.372 12.684 1.00 0.00 C ATOM 814 C GLY A 129 -3.275 -0.150 11.757 1.00 0.00 C ATOM 815 O GLY A 129 -2.799 0.973 11.624 1.00 0.00 O ATOM 0 H GLY A 129 -5.146 -1.968 11.456 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -5.031 0.561 12.753 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -4.096 -0.593 13.683 1.00 0.00 H new ATOM 816 N SER A 130 -2.776 -1.239 11.216 1.00 0.00 N ATOM 817 CA SER A 130 -1.600 -1.191 10.337 1.00 0.00 C ATOM 818 C SER A 130 -1.948 -1.285 8.847 1.00 0.00 C ATOM 819 O SER A 130 -3.072 -0.970 8.437 1.00 0.00 O ATOM 820 CB SER A 130 -0.698 -2.323 10.816 1.00 0.00 C ATOM 821 OG SER A 130 -1.426 -3.546 10.884 1.00 0.00 O ATOM 0 H SER A 130 -3.157 -2.174 11.361 1.00 0.00 H new ATOM 0 HA SER A 130 -1.097 -0.226 10.406 1.00 0.00 H new ATOM 0 HB2 SER A 130 0.148 -2.434 10.138 1.00 0.00 H new ATOM 0 HB3 SER A 130 -0.290 -2.081 11.797 1.00 0.00 H new ATOM 0 HG SER A 130 -0.833 -4.263 11.191 1.00 0.00 H new ATOM 822 N CYS A 131 -0.903 -1.433 8.040 1.00 0.00 N ATOM 823 CA CYS A 131 -1.040 -1.690 6.596 1.00 0.00 C ATOM 824 C CYS A 131 -0.607 -3.131 6.308 1.00 0.00 C ATOM 825 O CYS A 131 -1.445 -3.967 6.008 1.00 0.00 O ATOM 826 CB CYS A 131 -0.227 -0.739 5.724 1.00 0.00 C ATOM 827 SG CYS A 131 -0.765 1.005 5.697 1.00 0.00 S ATOM 0 H CYS A 131 0.064 -1.380 8.360 1.00 0.00 H new ATOM 0 HA CYS A 131 -2.087 -1.526 6.342 1.00 0.00 H new ATOM 0 HB2 CYS A 131 0.810 -0.771 6.060 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -0.243 -1.116 4.702 1.00 0.00 H new ATOM 0 HG CYS A 131 0.215 1.755 5.290 1.00 0.00 H new ATOM 828 N LYS A 132 0.701 -3.372 6.483 1.00 0.00 N ATOM 829 CA LYS A 132 1.371 -4.678 6.345 1.00 0.00 C ATOM 830 C LYS A 132 0.560 -5.953 6.123 1.00 0.00 C ATOM 831 O LYS A 132 0.250 -6.705 7.049 1.00 0.00 O ATOM 832 CB LYS A 132 2.448 -4.836 7.434 1.00 0.00 C ATOM 833 CG LYS A 132 1.849 -4.706 8.843 1.00 0.00 C ATOM 834 CD LYS A 132 2.738 -5.290 9.926 1.00 0.00 C ATOM 835 CE LYS A 132 1.912 -5.292 11.210 1.00 0.00 C ATOM 836 NZ LYS A 132 2.636 -6.024 12.252 1.00 0.00 N ATOM 0 H LYS A 132 1.352 -2.629 6.736 1.00 0.00 H new ATOM 0 HA LYS A 132 1.806 -4.600 5.349 1.00 0.00 H new ATOM 0 HB2 LYS A 132 2.931 -5.808 7.331 1.00 0.00 H new ATOM 0 HB3 LYS A 132 3.221 -4.080 7.295 1.00 0.00 H new ATOM 0 HG2 LYS A 132 1.669 -3.653 9.059 1.00 0.00 H new ATOM 0 HG3 LYS A 132 0.881 -5.207 8.867 1.00 0.00 H new ATOM 0 HD2 LYS A 132 3.053 -6.300 9.666 1.00 0.00 H new ATOM 0 HD3 LYS A 132 3.643 -4.695 10.048 1.00 0.00 H new ATOM 0 HE2 LYS A 132 1.721 -4.269 11.534 1.00 0.00 H new ATOM 0 HE3 LYS A 132 0.942 -5.756 11.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 2.075 -6.027 13.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 2.797 -7.003 11.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 3.551 -5.562 12.428 1.00 0.00 H new ATOM 837 N ARG A 133 0.256 -6.165 4.842 1.00 0.00 N ATOM 838 CA ARG A 133 -0.350 -7.417 4.404 1.00 0.00 C ATOM 839 C ARG A 133 0.063 -7.900 2.997 1.00 0.00 C ATOM 840 O ARG A 133 0.860 -7.266 2.314 1.00 0.00 O ATOM 841 CB ARG A 133 -1.880 -7.317 4.539 1.00 0.00 C ATOM 842 CG ARG A 133 -2.461 -8.673 4.928 1.00 0.00 C ATOM 843 CD ARG A 133 -2.030 -9.112 6.328 1.00 0.00 C ATOM 844 NE ARG A 133 -2.581 -10.439 6.602 1.00 0.00 N ATOM 845 CZ ARG A 133 -1.922 -11.600 6.608 1.00 0.00 C ATOM 846 NH1 ARG A 133 -0.618 -11.718 6.437 1.00 0.00 N ATOM 847 NH2 ARG A 133 -2.603 -12.718 6.808 1.00 0.00 N ATOM 0 H ARG A 133 0.419 -5.489 4.096 1.00 0.00 H new ATOM 0 HA ARG A 133 0.043 -8.189 5.066 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -2.139 -6.572 5.292 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.315 -6.983 3.597 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -3.549 -8.625 4.884 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -2.145 -9.422 4.202 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -0.942 -9.134 6.397 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -2.382 -8.397 7.072 1.00 0.00 H new ATOM 0 HE ARG A 133 -3.578 -10.482 6.812 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -0.046 -10.887 6.288 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -0.183 -12.640 6.454 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -3.612 -12.681 6.954 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -2.119 -13.616 6.816 1.00 0.00 H new ATOM 848 N GLY A 134 -0.207 -9.187 2.809 1.00 0.00 N ATOM 849 CA GLY A 134 0.061 -9.943 1.571 1.00 0.00 C ATOM 850 C GLY A 134 -1.109 -10.871 1.192 1.00 0.00 C ATOM 851 O GLY A 134 -1.986 -10.420 0.462 1.00 0.00 O ATOM 0 H GLY A 134 -0.634 -9.762 3.535 1.00 0.00 H new ATOM 0 HA2 GLY A 134 0.249 -9.246 0.755 1.00 0.00 H new ATOM 0 HA3 GLY A 134 0.967 -10.536 1.698 1.00 0.00 H new ATOM 852 N PRO A 135 -1.219 -12.075 1.774 1.00 0.00 N ATOM 853 CA PRO A 135 -2.139 -13.122 1.283 1.00 0.00 C ATOM 854 C PRO A 135 -3.619 -13.017 1.703 1.00 0.00 C ATOM 855 O PRO A 135 -4.441 -13.822 1.271 1.00 0.00 O ATOM 856 CB PRO A 135 -1.469 -14.407 1.771 1.00 0.00 C ATOM 857 CG PRO A 135 -0.947 -14.014 3.153 1.00 0.00 C ATOM 858 CD PRO A 135 -0.488 -12.563 2.958 1.00 0.00 C ATOM 0 HA PRO A 135 -2.257 -13.047 0.202 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.175 -15.235 1.826 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -0.662 -14.719 1.108 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -1.724 -14.091 3.913 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -0.126 -14.656 3.470 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -0.715 -11.958 3.836 1.00 0.00 H new ATOM 0 HD3 PRO A 135 0.590 -12.510 2.804 1.00 0.00 H new ATOM 859 N ARG A 136 -3.947 -11.976 2.471 1.00 0.00 N ATOM 860 CA ARG A 136 -5.317 -11.721 2.963 1.00 0.00 C ATOM 861 C ARG A 136 -5.867 -10.432 2.326 1.00 0.00 C ATOM 862 O ARG A 136 -6.437 -9.542 2.976 1.00 0.00 O ATOM 863 CB ARG A 136 -5.124 -11.676 4.473 1.00 0.00 C ATOM 864 CG ARG A 136 -6.386 -11.576 5.319 1.00 0.00 C ATOM 865 CD ARG A 136 -6.296 -10.207 5.978 1.00 0.00 C ATOM 866 NE ARG A 136 -6.945 -10.239 7.278 1.00 0.00 N ATOM 867 CZ ARG A 136 -6.738 -9.358 8.250 1.00 0.00 C ATOM 868 NH1 ARG A 136 -5.990 -8.276 8.141 1.00 0.00 N ATOM 869 NH2 ARG A 136 -6.967 -9.772 9.463 1.00 0.00 N ATOM 0 H ARG A 136 -3.270 -11.277 2.775 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.066 -12.468 2.700 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -4.582 -12.573 4.774 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -4.487 -10.824 4.710 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -7.283 -11.663 4.706 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.430 -12.372 6.062 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.252 -9.916 6.091 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -6.769 -9.457 5.344 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.608 -10.993 7.457 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -5.520 -8.068 7.260 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -5.882 -7.648 8.938 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.287 -10.727 9.624 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.826 -9.141 10.252 1.00 0.00 H new ATOM 870 N THR A 137 -5.628 -10.318 1.023 1.00 0.00 N ATOM 871 CA THR A 137 -5.930 -9.074 0.290 1.00 0.00 C ATOM 872 C THR A 137 -6.780 -9.254 -0.965 1.00 0.00 C ATOM 873 O THR A 137 -7.692 -8.460 -1.193 1.00 0.00 O ATOM 874 CB THR A 137 -4.669 -8.296 -0.058 1.00 0.00 C ATOM 875 OG1 THR A 137 -3.783 -9.059 -0.887 1.00 0.00 O ATOM 876 CG2 THR A 137 -4.025 -7.692 1.201 1.00 0.00 C ATOM 0 H THR A 137 -5.229 -11.061 0.449 1.00 0.00 H new ATOM 0 HA THR A 137 -6.535 -8.502 0.994 1.00 0.00 H new ATOM 0 HB THR A 137 -4.943 -7.440 -0.675 1.00 0.00 H new ATOM 0 HG1 THR A 137 -3.365 -9.767 -0.354 1.00 0.00 H new ATOM 0 HG21 THR A 137 -3.126 -7.142 0.922 1.00 0.00 H new ATOM 0 HG22 THR A 137 -4.731 -7.014 1.681 1.00 0.00 H new ATOM 0 HG23 THR A 137 -3.761 -8.491 1.894 1.00 0.00 H new ATOM 877 N HIS A 138 -6.273 -10.092 -1.863 1.00 0.00 N ATOM 878 CA HIS A 138 -6.907 -10.555 -3.124 1.00 0.00 C ATOM 879 C HIS A 138 -8.344 -10.064 -3.370 1.00 0.00 C ATOM 880 O HIS A 138 -9.238 -10.312 -2.563 1.00 0.00 O ATOM 881 CB HIS A 138 -6.802 -12.074 -3.249 1.00 0.00 C ATOM 882 CG HIS A 138 -7.231 -12.820 -1.977 1.00 0.00 C ATOM 883 ND1 HIS A 138 -8.278 -12.505 -1.216 1.00 0.00 N ATOM 884 CD2 HIS A 138 -6.463 -13.648 -1.274 1.00 0.00 C ATOM 885 CE1 HIS A 138 -8.152 -13.122 -0.043 1.00 0.00 C ATOM 886 NE2 HIS A 138 -7.026 -13.810 -0.088 1.00 0.00 N ATOM 0 H HIS A 138 -5.348 -10.501 -1.735 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.333 -10.079 -3.919 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.420 -12.406 -4.083 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -5.773 -12.341 -3.489 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -9.048 -11.893 -1.487 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -5.545 -14.106 -1.611 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -8.840 -13.070 0.788 1.00 0.00 H new ATOM 887 N TYR A 139 -8.411 -9.090 -4.280 1.00 0.00 N ATOM 888 CA TYR A 139 -9.636 -8.426 -4.759 1.00 0.00 C ATOM 889 C TYR A 139 -10.955 -9.011 -4.253 1.00 0.00 C ATOM 890 O TYR A 139 -11.404 -10.076 -4.673 1.00 0.00 O ATOM 891 CB TYR A 139 -9.621 -8.388 -6.286 1.00 0.00 C ATOM 892 CG TYR A 139 -9.921 -7.002 -6.880 1.00 0.00 C ATOM 893 CD1 TYR A 139 -10.387 -5.921 -6.091 1.00 0.00 C ATOM 894 CD2 TYR A 139 -9.519 -6.812 -8.218 1.00 0.00 C ATOM 895 CE1 TYR A 139 -10.412 -4.632 -6.627 1.00 0.00 C ATOM 896 CE2 TYR A 139 -9.549 -5.514 -8.768 1.00 0.00 C ATOM 897 CZ TYR A 139 -9.960 -4.436 -7.955 1.00 0.00 C ATOM 898 OH TYR A 139 -9.718 -3.174 -8.381 1.00 0.00 O ATOM 0 H TYR A 139 -7.573 -8.721 -4.729 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.609 -7.423 -4.333 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -8.644 -8.719 -6.638 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -10.354 -9.100 -6.664 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -10.722 -6.094 -5.079 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -9.192 -7.651 -8.815 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -10.770 -3.799 -6.040 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -9.262 -5.347 -9.796 1.00 0.00 H new ATOM 0 HH TYR A 139 -9.413 -3.196 -9.312 1.00 0.00 H new ATOM 899 N GLY A 140 -11.440 -8.330 -3.226 1.00 0.00 N ATOM 900 CA GLY A 140 -12.619 -8.739 -2.442 1.00 0.00 C ATOM 901 C GLY A 140 -12.518 -8.127 -1.040 1.00 0.00 C ATOM 902 O GLY A 140 -13.467 -7.510 -0.563 1.00 0.00 O ATOM 0 H GLY A 140 -11.024 -7.458 -2.899 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -13.533 -8.406 -2.934 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -12.670 -9.826 -2.376 1.00 0.00 H new ATOM 903 N GLN A 141 -11.310 -8.205 -0.465 1.00 0.00 N ATOM 904 CA GLN A 141 -10.999 -7.481 0.771 1.00 0.00 C ATOM 905 C GLN A 141 -11.075 -5.982 0.581 1.00 0.00 C ATOM 906 O GLN A 141 -10.309 -5.337 -0.128 1.00 0.00 O ATOM 907 CB GLN A 141 -9.608 -7.802 1.296 1.00 0.00 C ATOM 908 CG GLN A 141 -9.547 -9.136 2.044 1.00 0.00 C ATOM 909 CD GLN A 141 -9.932 -8.903 3.502 1.00 0.00 C ATOM 910 OE1 GLN A 141 -11.085 -8.705 3.866 1.00 0.00 O ATOM 911 NE2 GLN A 141 -8.940 -8.808 4.370 1.00 0.00 N ATOM 0 H GLN A 141 -10.538 -8.759 -0.835 1.00 0.00 H new ATOM 0 HA GLN A 141 -11.750 -7.810 1.489 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -8.907 -7.827 0.462 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -9.283 -7.003 1.962 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -10.225 -9.856 1.586 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -8.544 -9.558 1.982 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -7.980 -8.973 4.067 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -9.134 -8.570 5.343 1.00 0.00 H new ATOM 912 N LYS A 142 -11.991 -5.503 1.388 1.00 0.00 N ATOM 913 CA LYS A 142 -12.160 -4.081 1.771 1.00 0.00 C ATOM 914 C LYS A 142 -10.792 -3.450 2.106 1.00 0.00 C ATOM 915 O LYS A 142 -10.476 -2.360 1.612 1.00 0.00 O ATOM 916 CB LYS A 142 -13.068 -4.072 2.996 1.00 0.00 C ATOM 917 CG LYS A 142 -14.381 -4.814 2.718 1.00 0.00 C ATOM 918 CD LYS A 142 -15.401 -4.662 3.844 1.00 0.00 C ATOM 919 CE LYS A 142 -15.995 -3.248 3.948 1.00 0.00 C ATOM 920 NZ LYS A 142 -16.783 -2.950 2.745 1.00 0.00 N ATOM 0 H LYS A 142 -12.684 -6.107 1.829 1.00 0.00 H new ATOM 0 HA LYS A 142 -12.593 -3.499 0.957 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -12.554 -4.539 3.836 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -13.283 -3.043 3.285 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -14.814 -4.440 1.790 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -14.169 -5.873 2.567 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -16.210 -5.376 3.690 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -14.926 -4.918 4.791 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -16.625 -3.172 4.834 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -15.196 -2.515 4.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -17.395 -2.128 2.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -16.142 -2.737 1.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -17.371 -3.773 2.503 1.00 0.00 H new ATOM 921 N ALA A 143 -9.919 -4.281 2.667 1.00 0.00 N ATOM 922 CA ALA A 143 -8.522 -3.988 3.016 1.00 0.00 C ATOM 923 C ALA A 143 -7.697 -3.329 1.898 1.00 0.00 C ATOM 924 O ALA A 143 -6.918 -2.419 2.169 1.00 0.00 O ATOM 925 CB ALA A 143 -7.820 -5.242 3.534 1.00 0.00 C ATOM 0 H ALA A 143 -10.179 -5.238 2.907 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.579 -3.240 3.807 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -6.787 -5.003 3.786 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.336 -5.607 4.422 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -7.836 -6.013 2.763 1.00 0.00 H new ATOM 926 N ILE A 144 -7.884 -3.765 0.645 1.00 0.00 N ATOM 927 CA ILE A 144 -7.167 -3.191 -0.513 1.00 0.00 C ATOM 928 C ILE A 144 -7.805 -1.995 -1.235 1.00 0.00 C ATOM 929 O ILE A 144 -7.147 -1.351 -2.046 1.00 0.00 O ATOM 930 CB ILE A 144 -6.759 -4.259 -1.540 1.00 0.00 C ATOM 931 CG1 ILE A 144 -7.927 -5.079 -2.083 1.00 0.00 C ATOM 932 CG2 ILE A 144 -5.593 -5.016 -0.912 1.00 0.00 C ATOM 933 CD1 ILE A 144 -7.537 -5.937 -3.292 1.00 0.00 C ATOM 0 H ILE A 144 -8.528 -4.517 0.402 1.00 0.00 H new ATOM 0 HA ILE A 144 -6.289 -2.770 -0.023 1.00 0.00 H new ATOM 0 HB ILE A 144 -6.415 -3.821 -2.477 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -8.310 -5.725 -1.293 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -8.737 -4.407 -2.366 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -5.254 -5.794 -1.596 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -4.774 -4.324 -0.715 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -5.917 -5.471 0.024 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -8.406 -6.498 -3.636 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -7.180 -5.293 -4.095 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -6.747 -6.631 -3.006 1.00 0.00 H new ATOM 934 N LEU A 145 -9.040 -1.656 -0.890 1.00 0.00 N ATOM 935 CA LEU A 145 -9.805 -0.605 -1.594 1.00 0.00 C ATOM 936 C LEU A 145 -9.499 0.809 -1.073 1.00 0.00 C ATOM 937 O LEU A 145 -10.130 1.273 -0.119 1.00 0.00 O ATOM 938 CB LEU A 145 -11.301 -0.884 -1.512 1.00 0.00 C ATOM 939 CG LEU A 145 -11.789 -1.876 -2.582 1.00 0.00 C ATOM 940 CD1 LEU A 145 -11.508 -3.333 -2.203 1.00 0.00 C ATOM 941 CD2 LEU A 145 -13.298 -1.689 -2.733 1.00 0.00 C ATOM 0 H LEU A 145 -9.548 -2.092 -0.120 1.00 0.00 H new ATOM 0 HA LEU A 145 -9.487 -0.636 -2.636 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -11.537 -1.279 -0.524 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -11.846 0.054 -1.619 1.00 0.00 H new ATOM 0 HG LEU A 145 -11.254 -1.674 -3.510 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -11.872 -3.991 -2.992 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -10.435 -3.476 -2.078 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -12.017 -3.571 -1.269 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -13.677 -2.380 -3.487 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -13.787 -1.889 -1.779 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -13.509 -0.665 -3.041 1.00 0.00 H new ATOM 942 N PHE A 146 -8.474 1.419 -1.654 1.00 0.00 N ATOM 943 CA PHE A 146 -8.075 2.807 -1.298 1.00 0.00 C ATOM 944 C PHE A 146 -7.833 3.874 -2.350 1.00 0.00 C ATOM 945 O PHE A 146 -7.562 3.637 -3.524 1.00 0.00 O ATOM 946 CB PHE A 146 -6.921 2.852 -0.284 1.00 0.00 C ATOM 947 CG PHE A 146 -5.921 1.704 -0.379 1.00 0.00 C ATOM 948 CD1 PHE A 146 -5.197 1.448 -1.567 1.00 0.00 C ATOM 949 CD2 PHE A 146 -5.851 0.852 0.739 1.00 0.00 C ATOM 950 CE1 PHE A 146 -4.405 0.290 -1.638 1.00 0.00 C ATOM 951 CE2 PHE A 146 -5.040 -0.298 0.675 1.00 0.00 C ATOM 952 CZ PHE A 146 -4.336 -0.573 -0.517 1.00 0.00 C ATOM 0 H PHE A 146 -7.894 0.989 -2.375 1.00 0.00 H new ATOM 0 HA PHE A 146 -9.039 3.109 -0.889 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -6.383 3.791 -0.413 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -7.343 2.861 0.721 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -5.252 2.129 -2.403 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -6.412 1.077 1.634 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.854 0.060 -2.538 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -4.958 -0.959 1.525 1.00 0.00 H new ATOM 0 HZ PHE A 146 -3.729 -1.464 -0.576 1.00 0.00 H new ATOM 953 N LEU A 147 -8.140 5.082 -1.883 1.00 0.00 N ATOM 954 CA LEU A 147 -7.851 6.340 -2.565 1.00 0.00 C ATOM 955 C LEU A 147 -6.448 6.911 -2.269 1.00 0.00 C ATOM 956 O LEU A 147 -6.180 7.348 -1.148 1.00 0.00 O ATOM 957 CB LEU A 147 -8.964 7.341 -2.257 1.00 0.00 C ATOM 958 CG LEU A 147 -9.961 7.206 -3.395 1.00 0.00 C ATOM 959 CD1 LEU A 147 -11.385 7.505 -2.924 1.00 0.00 C ATOM 960 CD2 LEU A 147 -9.518 8.090 -4.556 1.00 0.00 C ATOM 0 H LEU A 147 -8.613 5.216 -0.989 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.830 6.137 -3.636 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -9.433 7.123 -1.297 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -8.572 8.356 -2.197 1.00 0.00 H new ATOM 0 HG LEU A 147 -9.980 6.175 -3.748 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -12.075 7.400 -3.761 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -11.662 6.805 -2.136 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -11.435 8.523 -2.539 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -10.230 7.997 -5.376 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -9.476 9.128 -4.227 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -8.531 7.777 -4.896 1.00 0.00 H new ATOM 961 N PRO A 148 -5.558 6.815 -3.264 1.00 0.00 N ATOM 962 CA PRO A 148 -4.163 7.273 -3.114 1.00 0.00 C ATOM 963 C PRO A 148 -4.041 8.719 -3.640 1.00 0.00 C ATOM 964 O PRO A 148 -4.995 9.485 -3.604 1.00 0.00 O ATOM 965 CB PRO A 148 -3.426 6.257 -3.989 1.00 0.00 C ATOM 966 CG PRO A 148 -4.362 6.047 -5.175 1.00 0.00 C ATOM 967 CD PRO A 148 -5.761 6.102 -4.545 1.00 0.00 C ATOM 0 HA PRO A 148 -3.777 7.311 -2.095 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -2.455 6.635 -4.309 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.245 5.325 -3.453 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.232 6.822 -5.931 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -4.180 5.090 -5.665 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -6.466 6.631 -5.187 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -6.164 5.102 -4.384 1.00 0.00 H new