USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1085 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 88 SER OG : rot 81:sc= -2.06! USER MOD Set 1.2: A 89 HIS : no HE2:sc= 0.976! C(o=0.022!,f=-20!) USER MOD Set 1.3: A 187 SER OG : rot 162:sc= 1.11 USER MOD Single : A 61 GLN :FLIP amide:sc= -0.0219 F(o=-3.4!,f=-0.022) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 MET CE :methyl -146:sc= -0.0177 (180deg=-0.161) USER MOD Single : A 80 THR OG1 : rot -170:sc= -1.05! USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -162:sc= -0.0193 (180deg=-0.248) USER MOD Single : A 94 LYS NZ :NH3+ -104:sc= -2.54 (180deg=-5.32!) USER MOD Single : A 102 HIS : no HD1:sc= -5! C(o=-5!,f=-8.4!) USER MOD Single : A 103 SER OG : rot -170:sc= 0 USER MOD Single : A 104 GLN : amide:sc= -0.182 K(o=-0.18,f=-0.82) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 TYR OH : rot 5:sc= 0.323 USER MOD Single : A 116 HIS : no HD1:sc= -1.1 K(o=-1.1,f=-1.7) USER MOD Single : A 117 THR OG1 : rot -32:sc= -0.601! USER MOD Single : A 118 GLN : amide:sc= -1.17 X(o=-1.2,f=-1.5!) USER MOD Single : A 120 TYR OH : rot 180:sc= -0.0697 USER MOD Single : A 125 GLN : amide:sc= -4.5! C(o=-4.5!,f=-12!) USER MOD Single : A 126 ASN : amide:sc= -3.18! C(o=-3.2!,f=-4!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= -0.968 USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot -118:sc= 1.28 USER MOD Single : A 142 CYS SG : rot 56:sc= -2.55 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 ASN : amide:sc= -0.0867 K(o=-0.087,f=-1) USER MOD Single : A 158 LYS NZ :NH3+ -161:sc= -0.171 (180deg=-0.814) USER MOD Single : A 192 HIS :FLIP no HE2:sc= -4.32! F(o=-5.9,f=-4.3!) USER MOD Single : A 193 HIS : no HE2:sc= -7.75! C(o=-7.7!,f=-13!) USER MOD Single : A 194 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 199 HIS : no HD1:sc= -3.65! C(o=-3.6!,f=-3.2!) USER MOD Single : A 202 TYR OH : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ -105:sc= -2.03! (180deg=-4.37!) USER MOD Single : A 205 ASN : amide:sc= -0.0309 X(o=-0.031,f=-0.031) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 56 10.402 13.108 0.913 1.00 4.61 N ATOM 2 CA ALA A 56 9.448 14.246 1.021 1.00 3.98 C ATOM 3 C ALA A 56 8.339 14.081 -0.020 1.00 3.15 C ATOM 4 O ALA A 56 7.760 15.044 -0.483 1.00 3.23 O ATOM 5 CB ALA A 56 10.191 15.560 0.770 1.00 4.70 C ATOM 0 HA ALA A 56 9.011 14.261 2.019 1.00 3.98 H new ATOM 0 HB1 ALA A 56 9.493 16.393 0.849 1.00 4.70 H new ATOM 0 HB2 ALA A 56 10.982 15.678 1.511 1.00 4.70 H new ATOM 0 HB3 ALA A 56 10.628 15.546 -0.229 1.00 4.70 H new ATOM 11 N TRP A 57 8.038 12.867 -0.390 1.00 2.75 N ATOM 12 CA TRP A 57 6.966 12.641 -1.400 1.00 2.31 C ATOM 13 C TRP A 57 5.603 12.916 -0.763 1.00 1.71 C ATOM 14 O TRP A 57 4.608 13.076 -1.442 1.00 2.05 O ATOM 15 CB TRP A 57 7.021 11.189 -1.884 1.00 2.59 C ATOM 16 CG TRP A 57 6.714 10.267 -0.745 1.00 2.15 C ATOM 17 CD1 TRP A 57 7.565 9.966 0.263 1.00 2.38 C ATOM 18 CD2 TRP A 57 5.490 9.523 -0.483 1.00 1.56 C ATOM 19 NE1 TRP A 57 6.939 9.086 1.127 1.00 2.03 N ATOM 20 CE2 TRP A 57 5.659 8.782 0.710 1.00 1.45 C ATOM 21 CE3 TRP A 57 4.259 9.421 -1.157 1.00 1.38 C ATOM 22 CZ2 TRP A 57 4.646 7.968 1.217 1.00 1.05 C ATOM 23 CZ3 TRP A 57 3.236 8.601 -0.650 1.00 1.05 C ATOM 24 CH2 TRP A 57 3.430 7.876 0.535 1.00 0.77 C ATOM 0 H TRP A 57 8.488 12.022 -0.037 1.00 2.75 H new ATOM 0 HA TRP A 57 7.114 13.312 -2.246 1.00 2.31 H new ATOM 0 HB2 TRP A 57 6.304 11.037 -2.691 1.00 2.59 H new ATOM 0 HB3 TRP A 57 8.009 10.967 -2.288 1.00 2.59 H new ATOM 0 HD1 TRP A 57 8.568 10.350 0.375 1.00 2.38 H new ATOM 0 HE1 TRP A 57 7.371 8.708 1.970 1.00 2.03 H new ATOM 0 HE3 TRP A 57 4.099 9.976 -2.069 1.00 1.38 H new ATOM 0 HZ2 TRP A 57 4.801 7.413 2.130 1.00 1.05 H new ATOM 0 HZ3 TRP A 57 2.295 8.529 -1.176 1.00 1.05 H new ATOM 0 HH2 TRP A 57 2.640 7.247 0.920 1.00 0.77 H new ATOM 35 N LEU A 58 5.550 12.975 0.539 1.00 1.60 N ATOM 36 CA LEU A 58 4.256 13.242 1.227 1.00 1.99 C ATOM 37 C LEU A 58 3.995 14.750 1.235 1.00 2.51 C ATOM 38 O LEU A 58 2.869 15.197 1.313 1.00 3.09 O ATOM 39 CB LEU A 58 4.337 12.719 2.667 1.00 2.55 C ATOM 40 CG LEU A 58 3.034 13.014 3.424 1.00 2.63 C ATOM 41 CD1 LEU A 58 1.843 12.350 2.713 1.00 2.73 C ATOM 42 CD2 LEU A 58 3.157 12.464 4.849 1.00 3.22 C ATOM 0 H LEU A 58 6.351 12.849 1.158 1.00 1.60 H new ATOM 0 HA LEU A 58 3.443 12.738 0.705 1.00 1.99 H new ATOM 0 HB2 LEU A 58 4.524 11.645 2.660 1.00 2.55 H new ATOM 0 HB3 LEU A 58 5.177 13.185 3.182 1.00 2.55 H new ATOM 0 HG LEU A 58 2.865 14.090 3.452 1.00 2.63 H new ATOM 0 HD11 LEU A 58 0.926 12.567 3.260 1.00 2.73 H new ATOM 0 HD12 LEU A 58 1.761 12.740 1.698 1.00 2.73 H new ATOM 0 HD13 LEU A 58 1.997 11.272 2.676 1.00 2.73 H new ATOM 0 HD21 LEU A 58 2.238 12.667 5.398 1.00 3.22 H new ATOM 0 HD22 LEU A 58 3.326 11.388 4.810 1.00 3.22 H new ATOM 0 HD23 LEU A 58 3.995 12.945 5.354 1.00 3.22 H new ATOM 54 N GLU A 59 5.034 15.535 1.157 1.00 2.68 N ATOM 55 CA GLU A 59 4.857 17.014 1.162 1.00 3.25 C ATOM 56 C GLU A 59 4.369 17.483 -0.208 1.00 3.14 C ATOM 57 O GLU A 59 3.203 17.381 -0.536 1.00 3.52 O ATOM 58 CB GLU A 59 6.195 17.683 1.484 1.00 3.87 C ATOM 59 CG GLU A 59 6.514 17.495 2.969 1.00 4.68 C ATOM 60 CD GLU A 59 5.605 18.397 3.805 1.00 5.43 C ATOM 61 OE1 GLU A 59 5.630 19.597 3.586 1.00 5.81 O ATOM 62 OE2 GLU A 59 4.898 17.873 4.652 1.00 5.92 O ATOM 0 H GLU A 59 6.000 15.215 1.090 1.00 2.68 H new ATOM 0 HA GLU A 59 4.119 17.286 1.917 1.00 3.25 H new ATOM 0 HB2 GLU A 59 6.987 17.250 0.873 1.00 3.87 H new ATOM 0 HB3 GLU A 59 6.151 18.745 1.242 1.00 3.87 H new ATOM 0 HG2 GLU A 59 6.371 16.453 3.253 1.00 4.68 H new ATOM 0 HG3 GLU A 59 7.559 17.737 3.161 1.00 4.68 H new ATOM 69 N ALA A 60 5.255 18.003 -1.003 1.00 3.25 N ATOM 70 CA ALA A 60 4.858 18.494 -2.353 1.00 3.79 C ATOM 71 C ALA A 60 4.496 17.310 -3.253 1.00 3.93 C ATOM 72 O ALA A 60 5.348 16.546 -3.660 1.00 4.34 O ATOM 73 CB ALA A 60 6.023 19.264 -2.978 1.00 4.57 C ATOM 0 H ALA A 60 6.244 18.111 -0.778 1.00 3.25 H new ATOM 0 HA ALA A 60 3.993 19.150 -2.254 1.00 3.79 H new ATOM 0 HB1 ALA A 60 5.733 19.623 -3.965 1.00 4.57 H new ATOM 0 HB2 ALA A 60 6.280 20.113 -2.344 1.00 4.57 H new ATOM 0 HB3 ALA A 60 6.887 18.605 -3.070 1.00 4.57 H new ATOM 79 N GLN A 61 3.232 17.164 -3.569 1.00 4.11 N ATOM 80 CA GLN A 61 2.778 16.041 -4.452 1.00 4.74 C ATOM 81 C GLN A 61 2.101 16.635 -5.693 1.00 4.98 C ATOM 82 O GLN A 61 1.290 16.004 -6.338 1.00 5.45 O ATOM 83 CB GLN A 61 1.776 15.168 -3.679 1.00 5.31 C ATOM 84 CG GLN A 61 1.688 13.779 -4.320 1.00 5.77 C ATOM 85 CD GLN A 61 0.577 12.977 -3.639 1.00 6.31 C ATOM 86 OE1 GLN A 61 -0.593 12.894 -4.210 1.00 6.59 O flip ATOM 87 NE2 GLN A 61 0.777 12.418 -2.580 1.00 6.81 N flip ATOM 0 H GLN A 61 2.486 17.782 -3.249 1.00 4.11 H new ATOM 0 HA GLN A 61 3.628 15.430 -4.756 1.00 4.74 H new ATOM 0 HB2 GLN A 61 2.087 15.078 -2.638 1.00 5.31 H new ATOM 0 HB3 GLN A 61 0.794 15.640 -3.679 1.00 5.31 H new ATOM 0 HG2 GLN A 61 1.485 13.871 -5.387 1.00 5.77 H new ATOM 0 HG3 GLN A 61 2.641 13.259 -4.221 1.00 5.77 H new ATOM 0 HE21 GLN A 61 1.692 12.483 -2.134 1.00 6.81 H new ATOM 0 HE22 GLN A 61 0.030 11.883 -2.137 1.00 6.81 H new ATOM 96 N GLU A 62 2.429 17.855 -6.026 1.00 5.00 N ATOM 97 CA GLU A 62 1.804 18.497 -7.217 1.00 5.58 C ATOM 98 C GLU A 62 2.445 17.948 -8.494 1.00 5.55 C ATOM 99 O GLU A 62 1.796 17.311 -9.299 1.00 5.67 O ATOM 100 CB GLU A 62 2.018 20.011 -7.150 1.00 6.14 C ATOM 101 CG GLU A 62 1.097 20.608 -6.084 1.00 6.74 C ATOM 102 CD GLU A 62 1.403 19.973 -4.727 1.00 7.42 C ATOM 103 OE1 GLU A 62 2.334 20.421 -4.081 1.00 7.69 O ATOM 104 OE2 GLU A 62 0.700 19.045 -4.357 1.00 7.91 O ATOM 0 H GLU A 62 3.103 18.434 -5.524 1.00 5.00 H new ATOM 0 HA GLU A 62 0.736 18.279 -7.226 1.00 5.58 H new ATOM 0 HB2 GLU A 62 3.059 20.232 -6.912 1.00 6.14 H new ATOM 0 HB3 GLU A 62 1.810 20.462 -8.120 1.00 6.14 H new ATOM 0 HG2 GLU A 62 1.237 21.688 -6.031 1.00 6.74 H new ATOM 0 HG3 GLU A 62 0.055 20.434 -6.351 1.00 6.74 H new ATOM 111 N GLU A 63 3.714 18.196 -8.687 1.00 5.72 N ATOM 112 CA GLU A 63 4.406 17.694 -9.915 1.00 6.01 C ATOM 113 C GLU A 63 5.827 17.255 -9.554 1.00 5.97 C ATOM 114 O GLU A 63 6.741 17.367 -10.347 1.00 6.17 O ATOM 115 CB GLU A 63 4.468 18.813 -10.957 1.00 6.54 C ATOM 116 CG GLU A 63 5.124 20.053 -10.344 1.00 6.72 C ATOM 117 CD GLU A 63 4.999 21.230 -11.313 1.00 7.22 C ATOM 118 OE1 GLU A 63 4.774 20.984 -12.486 1.00 7.67 O ATOM 119 OE2 GLU A 63 5.129 22.357 -10.865 1.00 7.44 O ATOM 0 H GLU A 63 4.304 18.726 -8.046 1.00 5.72 H new ATOM 0 HA GLU A 63 3.856 16.846 -10.323 1.00 6.01 H new ATOM 0 HB2 GLU A 63 5.035 18.482 -11.827 1.00 6.54 H new ATOM 0 HB3 GLU A 63 3.464 19.055 -11.305 1.00 6.54 H new ATOM 0 HG2 GLU A 63 4.647 20.298 -9.395 1.00 6.72 H new ATOM 0 HG3 GLU A 63 6.174 19.854 -10.131 1.00 6.72 H new ATOM 126 N GLU A 64 6.017 16.755 -8.359 1.00 6.07 N ATOM 127 CA GLU A 64 7.376 16.300 -7.927 1.00 6.34 C ATOM 128 C GLU A 64 7.246 14.969 -7.183 1.00 6.12 C ATOM 129 O GLU A 64 7.281 14.919 -5.970 1.00 6.31 O ATOM 130 CB GLU A 64 7.991 17.343 -6.988 1.00 6.85 C ATOM 131 CG GLU A 64 8.217 18.652 -7.747 1.00 7.36 C ATOM 132 CD GLU A 64 9.313 18.456 -8.796 1.00 8.01 C ATOM 133 OE1 GLU A 64 9.994 17.446 -8.730 1.00 8.36 O ATOM 134 OE2 GLU A 64 9.452 19.319 -9.646 1.00 8.39 O ATOM 0 H GLU A 64 5.284 16.641 -7.659 1.00 6.07 H new ATOM 0 HA GLU A 64 8.014 16.176 -8.802 1.00 6.34 H new ATOM 0 HB2 GLU A 64 7.331 17.514 -6.137 1.00 6.85 H new ATOM 0 HB3 GLU A 64 8.936 16.975 -6.589 1.00 6.85 H new ATOM 0 HG2 GLU A 64 7.292 18.969 -8.228 1.00 7.36 H new ATOM 0 HG3 GLU A 64 8.502 19.442 -7.052 1.00 7.36 H new ATOM 141 N GLU A 65 7.089 13.891 -7.902 1.00 6.04 N ATOM 142 CA GLU A 65 6.952 12.564 -7.239 1.00 6.09 C ATOM 143 C GLU A 65 8.331 12.048 -6.827 1.00 5.38 C ATOM 144 O GLU A 65 8.606 10.866 -6.896 1.00 5.46 O ATOM 145 CB GLU A 65 6.310 11.575 -8.214 1.00 6.80 C ATOM 146 CG GLU A 65 5.099 12.229 -8.883 1.00 7.45 C ATOM 147 CD GLU A 65 4.124 12.716 -7.810 1.00 7.99 C ATOM 148 OE1 GLU A 65 3.597 11.882 -7.092 1.00 8.49 O ATOM 149 OE2 GLU A 65 3.919 13.916 -7.725 1.00 8.13 O ATOM 0 H GLU A 65 7.050 13.873 -8.921 1.00 6.04 H new ATOM 0 HA GLU A 65 6.326 12.666 -6.353 1.00 6.09 H new ATOM 0 HB2 GLU A 65 7.035 11.270 -8.969 1.00 6.80 H new ATOM 0 HB3 GLU A 65 6.003 10.673 -7.684 1.00 6.80 H new ATOM 0 HG2 GLU A 65 5.421 13.065 -9.504 1.00 7.45 H new ATOM 0 HG3 GLU A 65 4.604 11.515 -9.542 1.00 7.45 H new ATOM 156 N VAL A 66 9.202 12.921 -6.396 1.00 4.95 N ATOM 157 CA VAL A 66 10.565 12.481 -5.978 1.00 4.48 C ATOM 158 C VAL A 66 11.149 13.510 -5.007 1.00 4.72 C ATOM 159 O VAL A 66 11.284 14.674 -5.327 1.00 5.03 O ATOM 160 CB VAL A 66 11.481 12.378 -7.204 1.00 4.18 C ATOM 161 CG1 VAL A 66 12.919 12.101 -6.753 1.00 3.90 C ATOM 162 CG2 VAL A 66 11.011 11.240 -8.116 1.00 4.35 C ATOM 0 H VAL A 66 9.028 13.923 -6.315 1.00 4.95 H new ATOM 0 HA VAL A 66 10.494 11.506 -5.496 1.00 4.48 H new ATOM 0 HB VAL A 66 11.443 13.319 -7.752 1.00 4.18 H new ATOM 0 HG11 VAL A 66 13.567 12.028 -7.627 1.00 3.90 H new ATOM 0 HG12 VAL A 66 13.263 12.914 -6.113 1.00 3.90 H new ATOM 0 HG13 VAL A 66 12.952 11.163 -6.198 1.00 3.90 H new ATOM 0 HG21 VAL A 66 11.667 11.174 -8.984 1.00 4.35 H new ATOM 0 HG22 VAL A 66 11.040 10.299 -7.567 1.00 4.35 H new ATOM 0 HG23 VAL A 66 9.991 11.436 -8.447 1.00 4.35 H new ATOM 172 N GLY A 67 11.505 13.085 -3.829 1.00 4.94 N ATOM 173 CA GLY A 67 12.092 14.035 -2.841 1.00 5.45 C ATOM 174 C GLY A 67 13.415 14.565 -3.392 1.00 5.43 C ATOM 175 O GLY A 67 13.596 15.753 -3.572 1.00 5.79 O ATOM 0 H GLY A 67 11.416 12.122 -3.506 1.00 4.94 H new ATOM 0 HA2 GLY A 67 11.403 14.859 -2.655 1.00 5.45 H new ATOM 0 HA3 GLY A 67 12.254 13.534 -1.887 1.00 5.45 H new ATOM 179 N PHE A 68 14.338 13.685 -3.677 1.00 5.26 N ATOM 180 CA PHE A 68 15.651 14.121 -4.236 1.00 5.45 C ATOM 181 C PHE A 68 16.238 12.964 -5.062 1.00 4.79 C ATOM 182 O PHE A 68 16.064 11.814 -4.713 1.00 4.49 O ATOM 183 CB PHE A 68 16.606 14.472 -3.093 1.00 6.13 C ATOM 184 CG PHE A 68 16.762 13.282 -2.177 1.00 6.37 C ATOM 185 CD1 PHE A 68 15.873 13.098 -1.110 1.00 6.71 C ATOM 186 CD2 PHE A 68 17.796 12.364 -2.392 1.00 6.59 C ATOM 187 CE1 PHE A 68 16.020 11.997 -0.259 1.00 7.20 C ATOM 188 CE2 PHE A 68 17.943 11.262 -1.541 1.00 7.13 C ATOM 189 CZ PHE A 68 17.054 11.079 -0.474 1.00 7.40 C ATOM 0 H PHE A 68 14.238 12.678 -3.546 1.00 5.26 H new ATOM 0 HA PHE A 68 15.515 15.000 -4.866 1.00 5.45 H new ATOM 0 HB2 PHE A 68 17.577 14.764 -3.494 1.00 6.13 H new ATOM 0 HB3 PHE A 68 16.222 15.325 -2.534 1.00 6.13 H new ATOM 0 HD1 PHE A 68 15.074 13.806 -0.944 1.00 6.71 H new ATOM 0 HD2 PHE A 68 18.481 12.506 -3.215 1.00 6.59 H new ATOM 0 HE1 PHE A 68 15.335 11.856 0.564 1.00 7.20 H new ATOM 0 HE2 PHE A 68 18.741 10.554 -1.707 1.00 7.13 H new ATOM 0 HZ PHE A 68 17.167 10.229 0.183 1.00 7.40 H new ATOM 199 N PRO A 69 16.924 13.246 -6.147 1.00 4.86 N ATOM 200 CA PRO A 69 17.522 12.182 -7.003 1.00 4.45 C ATOM 201 C PRO A 69 18.092 11.018 -6.181 1.00 4.09 C ATOM 202 O PRO A 69 19.202 11.078 -5.691 1.00 4.61 O ATOM 203 CB PRO A 69 18.639 12.923 -7.743 1.00 5.21 C ATOM 204 CG PRO A 69 18.136 14.326 -7.890 1.00 5.88 C ATOM 205 CD PRO A 69 17.214 14.592 -6.685 1.00 5.67 C ATOM 0 HA PRO A 69 16.786 11.720 -7.662 1.00 4.45 H new ATOM 0 HB2 PRO A 69 19.572 12.894 -7.181 1.00 5.21 H new ATOM 0 HB3 PRO A 69 18.838 12.470 -8.714 1.00 5.21 H new ATOM 0 HG2 PRO A 69 18.964 15.035 -7.908 1.00 5.88 H new ATOM 0 HG3 PRO A 69 17.593 14.447 -8.827 1.00 5.88 H new ATOM 0 HD2 PRO A 69 17.702 15.222 -5.941 1.00 5.67 H new ATOM 0 HD3 PRO A 69 16.301 15.105 -6.987 1.00 5.67 H new ATOM 213 N VAL A 70 17.346 9.954 -6.040 1.00 3.53 N ATOM 214 CA VAL A 70 17.851 8.782 -5.265 1.00 3.48 C ATOM 215 C VAL A 70 18.677 7.893 -6.197 1.00 3.20 C ATOM 216 O VAL A 70 19.060 8.299 -7.277 1.00 3.15 O ATOM 217 CB VAL A 70 16.668 7.985 -4.710 1.00 3.52 C ATOM 218 CG1 VAL A 70 16.085 8.708 -3.494 1.00 4.19 C ATOM 219 CG2 VAL A 70 15.589 7.857 -5.788 1.00 3.47 C ATOM 0 H VAL A 70 16.409 9.846 -6.428 1.00 3.53 H new ATOM 0 HA VAL A 70 18.470 9.125 -4.436 1.00 3.48 H new ATOM 0 HB VAL A 70 17.009 6.993 -4.413 1.00 3.52 H new ATOM 0 HG11 VAL A 70 15.243 8.138 -3.101 1.00 4.19 H new ATOM 0 HG12 VAL A 70 16.851 8.801 -2.724 1.00 4.19 H new ATOM 0 HG13 VAL A 70 15.745 9.701 -3.789 1.00 4.19 H new ATOM 0 HG21 VAL A 70 14.746 7.289 -5.394 1.00 3.47 H new ATOM 0 HG22 VAL A 70 15.251 8.850 -6.084 1.00 3.47 H new ATOM 0 HG23 VAL A 70 16.000 7.340 -6.655 1.00 3.47 H new ATOM 229 N THR A 71 18.951 6.677 -5.799 1.00 3.33 N ATOM 230 CA THR A 71 19.745 5.767 -6.676 1.00 3.19 C ATOM 231 C THR A 71 18.784 5.026 -7.625 1.00 2.33 C ATOM 232 O THR A 71 17.705 4.642 -7.223 1.00 2.20 O ATOM 233 CB THR A 71 20.490 4.746 -5.811 1.00 3.92 C ATOM 234 OG1 THR A 71 19.555 4.041 -5.005 1.00 4.10 O ATOM 235 CG2 THR A 71 21.496 5.470 -4.916 1.00 4.65 C ATOM 0 H THR A 71 18.660 6.276 -4.907 1.00 3.33 H new ATOM 0 HA THR A 71 20.466 6.346 -7.253 1.00 3.19 H new ATOM 0 HB THR A 71 21.021 4.043 -6.453 1.00 3.92 H new ATOM 0 HG1 THR A 71 20.029 3.386 -4.452 1.00 4.10 H new ATOM 0 HG21 THR A 71 22.025 4.742 -4.301 1.00 4.65 H new ATOM 0 HG22 THR A 71 22.212 6.010 -5.536 1.00 4.65 H new ATOM 0 HG23 THR A 71 20.969 6.174 -4.272 1.00 4.65 H new ATOM 243 N PRO A 72 19.155 4.820 -8.869 1.00 2.04 N ATOM 244 CA PRO A 72 18.282 4.111 -9.856 1.00 1.36 C ATOM 245 C PRO A 72 18.280 2.593 -9.642 1.00 1.25 C ATOM 246 O PRO A 72 18.593 2.107 -8.576 1.00 1.81 O ATOM 247 CB PRO A 72 18.916 4.473 -11.204 1.00 1.84 C ATOM 248 CG PRO A 72 20.368 4.627 -10.898 1.00 2.59 C ATOM 249 CD PRO A 72 20.435 5.231 -9.490 1.00 2.69 C ATOM 0 HA PRO A 72 17.236 4.405 -9.772 1.00 1.36 H new ATOM 0 HB2 PRO A 72 18.746 3.693 -11.946 1.00 1.84 H new ATOM 0 HB3 PRO A 72 18.495 5.394 -11.608 1.00 1.84 H new ATOM 0 HG2 PRO A 72 20.880 3.665 -10.936 1.00 2.59 H new ATOM 0 HG3 PRO A 72 20.855 5.276 -11.626 1.00 2.59 H new ATOM 0 HD2 PRO A 72 21.291 4.851 -8.932 1.00 2.69 H new ATOM 0 HD3 PRO A 72 20.533 6.316 -9.524 1.00 2.69 H new ATOM 257 N GLN A 73 17.909 1.850 -10.651 1.00 1.10 N ATOM 258 CA GLN A 73 17.862 0.367 -10.536 1.00 1.44 C ATOM 259 C GLN A 73 19.077 -0.145 -9.769 1.00 1.16 C ATOM 260 O GLN A 73 20.143 -0.346 -10.317 1.00 1.32 O ATOM 261 CB GLN A 73 17.857 -0.253 -11.936 1.00 2.13 C ATOM 262 CG GLN A 73 16.665 0.279 -12.734 1.00 2.59 C ATOM 263 CD GLN A 73 16.858 -0.047 -14.216 1.00 3.31 C ATOM 264 OE1 GLN A 73 17.008 -1.195 -14.582 1.00 3.76 O ATOM 265 NE2 GLN A 73 16.861 0.924 -15.089 1.00 3.98 N ATOM 0 H GLN A 73 17.633 2.216 -11.562 1.00 1.10 H new ATOM 0 HA GLN A 73 16.956 0.086 -9.999 1.00 1.44 H new ATOM 0 HB2 GLN A 73 18.787 -0.015 -12.452 1.00 2.13 H new ATOM 0 HB3 GLN A 73 17.802 -1.339 -11.863 1.00 2.13 H new ATOM 0 HG2 GLN A 73 15.741 -0.169 -12.369 1.00 2.59 H new ATOM 0 HG3 GLN A 73 16.573 1.356 -12.596 1.00 2.59 H new ATOM 0 HE21 GLN A 73 16.735 1.888 -14.780 1.00 3.98 H new ATOM 0 HE22 GLN A 73 16.989 0.719 -16.080 1.00 3.98 H new ATOM 274 N VAL A 74 18.906 -0.376 -8.504 1.00 1.04 N ATOM 275 CA VAL A 74 20.025 -0.901 -7.667 1.00 0.93 C ATOM 276 C VAL A 74 20.011 -2.429 -7.766 1.00 0.86 C ATOM 277 O VAL A 74 18.977 -3.015 -8.019 1.00 0.89 O ATOM 278 CB VAL A 74 19.803 -0.479 -6.204 1.00 1.09 C ATOM 279 CG1 VAL A 74 20.260 0.967 -5.995 1.00 1.17 C ATOM 280 CG2 VAL A 74 18.312 -0.586 -5.873 1.00 1.38 C ATOM 0 H VAL A 74 18.031 -0.224 -8.003 1.00 1.04 H new ATOM 0 HA VAL A 74 20.981 -0.507 -8.012 1.00 0.93 H new ATOM 0 HB VAL A 74 20.382 -1.133 -5.552 1.00 1.09 H new ATOM 0 HG11 VAL A 74 20.098 1.253 -4.956 1.00 1.17 H new ATOM 0 HG12 VAL A 74 21.320 1.052 -6.233 1.00 1.17 H new ATOM 0 HG13 VAL A 74 19.688 1.627 -6.647 1.00 1.17 H new ATOM 0 HG21 VAL A 74 18.147 -0.288 -4.837 1.00 1.38 H new ATOM 0 HG22 VAL A 74 17.745 0.069 -6.534 1.00 1.38 H new ATOM 0 HG23 VAL A 74 17.981 -1.615 -6.012 1.00 1.38 H new ATOM 290 N PRO A 75 21.137 -3.079 -7.567 1.00 0.93 N ATOM 291 CA PRO A 75 21.220 -4.563 -7.635 1.00 1.00 C ATOM 292 C PRO A 75 19.946 -5.227 -7.105 1.00 0.88 C ATOM 293 O PRO A 75 19.628 -5.143 -5.934 1.00 0.84 O ATOM 294 CB PRO A 75 22.425 -4.872 -6.750 1.00 1.18 C ATOM 295 CG PRO A 75 23.346 -3.705 -6.954 1.00 1.37 C ATOM 296 CD PRO A 75 22.451 -2.486 -7.257 1.00 1.13 C ATOM 0 HA PRO A 75 21.323 -4.941 -8.652 1.00 1.00 H new ATOM 0 HB2 PRO A 75 22.135 -4.971 -5.704 1.00 1.18 H new ATOM 0 HB3 PRO A 75 22.901 -5.809 -7.039 1.00 1.18 H new ATOM 0 HG2 PRO A 75 23.952 -3.530 -6.065 1.00 1.37 H new ATOM 0 HG3 PRO A 75 24.035 -3.894 -7.777 1.00 1.37 H new ATOM 0 HD2 PRO A 75 22.393 -1.811 -6.403 1.00 1.13 H new ATOM 0 HD3 PRO A 75 22.836 -1.907 -8.096 1.00 1.13 H new ATOM 304 N LEU A 76 19.202 -5.861 -7.965 1.00 0.86 N ATOM 305 CA LEU A 76 17.934 -6.503 -7.521 1.00 0.77 C ATOM 306 C LEU A 76 18.229 -7.584 -6.484 1.00 0.77 C ATOM 307 O LEU A 76 18.563 -8.705 -6.814 1.00 0.85 O ATOM 308 CB LEU A 76 17.221 -7.138 -8.722 1.00 0.84 C ATOM 309 CG LEU A 76 16.881 -6.069 -9.771 1.00 0.87 C ATOM 310 CD1 LEU A 76 16.461 -6.759 -11.073 1.00 1.01 C ATOM 311 CD2 LEU A 76 15.723 -5.181 -9.278 1.00 0.76 C ATOM 0 H LEU A 76 19.416 -5.963 -8.957 1.00 0.86 H new ATOM 0 HA LEU A 76 17.294 -5.740 -7.078 1.00 0.77 H new ATOM 0 HB2 LEU A 76 17.857 -7.904 -9.167 1.00 0.84 H new ATOM 0 HB3 LEU A 76 16.309 -7.634 -8.391 1.00 0.84 H new ATOM 0 HG LEU A 76 17.760 -5.446 -9.939 1.00 0.87 H new ATOM 0 HD11 LEU A 76 16.218 -6.005 -11.822 1.00 1.01 H new ATOM 0 HD12 LEU A 76 17.280 -7.381 -11.436 1.00 1.01 H new ATOM 0 HD13 LEU A 76 15.586 -7.382 -10.889 1.00 1.01 H new ATOM 0 HD21 LEU A 76 15.495 -4.429 -10.033 1.00 0.76 H new ATOM 0 HD22 LEU A 76 14.842 -5.797 -9.101 1.00 0.76 H new ATOM 0 HD23 LEU A 76 16.012 -4.688 -8.350 1.00 0.76 H new ATOM 323 N ARG A 77 18.086 -7.260 -5.228 1.00 0.74 N ATOM 324 CA ARG A 77 18.330 -8.270 -4.161 1.00 0.79 C ATOM 325 C ARG A 77 17.060 -9.129 -4.036 1.00 0.71 C ATOM 326 O ARG A 77 16.109 -8.922 -4.764 1.00 0.73 O ATOM 327 CB ARG A 77 18.645 -7.547 -2.834 1.00 0.85 C ATOM 328 CG ARG A 77 19.259 -6.169 -3.128 1.00 1.19 C ATOM 329 CD ARG A 77 19.818 -5.542 -1.834 1.00 1.52 C ATOM 330 NE ARG A 77 19.479 -4.083 -1.792 1.00 2.13 N ATOM 331 CZ ARG A 77 19.679 -3.310 -2.829 1.00 2.66 C ATOM 332 NH1 ARG A 77 20.315 -3.758 -3.876 1.00 2.73 N ATOM 333 NH2 ARG A 77 19.278 -2.068 -2.796 1.00 3.61 N ATOM 0 H ARG A 77 17.810 -6.336 -4.895 1.00 0.74 H new ATOM 0 HA ARG A 77 19.181 -8.907 -4.404 1.00 0.79 H new ATOM 0 HB2 ARG A 77 17.734 -7.432 -2.246 1.00 0.85 H new ATOM 0 HB3 ARG A 77 19.336 -8.144 -2.238 1.00 0.85 H new ATOM 0 HG2 ARG A 77 20.056 -6.269 -3.865 1.00 1.19 H new ATOM 0 HG3 ARG A 77 18.504 -5.513 -3.561 1.00 1.19 H new ATOM 0 HD2 ARG A 77 19.400 -6.047 -0.964 1.00 1.52 H new ATOM 0 HD3 ARG A 77 20.899 -5.675 -1.791 1.00 1.52 H new ATOM 0 HE ARG A 77 19.085 -3.685 -0.939 1.00 2.13 H new ATOM 0 HH11 ARG A 77 20.661 -4.717 -3.891 1.00 2.73 H new ATOM 0 HH12 ARG A 77 20.467 -3.149 -4.680 1.00 2.73 H new ATOM 0 HH21 ARG A 77 18.811 -1.705 -1.965 1.00 3.61 H new ATOM 0 HH22 ARG A 77 19.431 -1.461 -3.601 1.00 3.61 H new ATOM 347 N PRO A 78 17.030 -10.083 -3.142 1.00 0.79 N ATOM 348 CA PRO A 78 15.850 -10.963 -2.960 1.00 0.76 C ATOM 349 C PRO A 78 14.883 -10.421 -1.899 1.00 0.67 C ATOM 350 O PRO A 78 15.216 -10.328 -0.735 1.00 0.69 O ATOM 351 CB PRO A 78 16.485 -12.282 -2.511 1.00 0.86 C ATOM 352 CG PRO A 78 17.743 -11.889 -1.771 1.00 1.18 C ATOM 353 CD PRO A 78 18.098 -10.447 -2.199 1.00 1.06 C ATOM 0 HA PRO A 78 15.243 -11.052 -3.861 1.00 0.76 H new ATOM 0 HB2 PRO A 78 15.809 -12.844 -1.867 1.00 0.86 H new ATOM 0 HB3 PRO A 78 16.714 -12.919 -3.365 1.00 0.86 H new ATOM 0 HG2 PRO A 78 17.587 -11.942 -0.694 1.00 1.18 H new ATOM 0 HG3 PRO A 78 18.558 -12.572 -2.010 1.00 1.18 H new ATOM 0 HD2 PRO A 78 18.123 -9.771 -1.344 1.00 1.06 H new ATOM 0 HD3 PRO A 78 19.080 -10.401 -2.670 1.00 1.06 H new ATOM 361 N MET A 79 13.688 -10.064 -2.291 1.00 0.65 N ATOM 362 CA MET A 79 12.715 -9.535 -1.294 1.00 0.61 C ATOM 363 C MET A 79 12.376 -10.647 -0.301 1.00 0.51 C ATOM 364 O MET A 79 12.339 -11.810 -0.649 1.00 0.56 O ATOM 365 CB MET A 79 11.440 -9.060 -2.005 1.00 0.66 C ATOM 366 CG MET A 79 10.610 -8.206 -1.043 1.00 0.74 C ATOM 367 SD MET A 79 9.209 -7.484 -1.933 1.00 1.25 S ATOM 368 CE MET A 79 9.099 -5.952 -0.976 1.00 0.83 C ATOM 0 H MET A 79 13.347 -10.116 -3.251 1.00 0.65 H new ATOM 0 HA MET A 79 13.152 -8.688 -0.765 1.00 0.61 H new ATOM 0 HB2 MET A 79 11.699 -8.481 -2.892 1.00 0.66 H new ATOM 0 HB3 MET A 79 10.858 -9.917 -2.343 1.00 0.66 H new ATOM 0 HG2 MET A 79 10.252 -8.817 -0.214 1.00 0.74 H new ATOM 0 HG3 MET A 79 11.228 -7.417 -0.614 1.00 0.74 H new ATOM 0 HE1 MET A 79 8.056 -5.647 -0.897 1.00 0.83 H new ATOM 0 HE2 MET A 79 9.506 -6.116 0.022 1.00 0.83 H new ATOM 0 HE3 MET A 79 9.669 -5.169 -1.476 1.00 0.83 H new ATOM 378 N THR A 80 12.151 -10.299 0.942 1.00 0.56 N ATOM 379 CA THR A 80 11.838 -11.333 1.979 1.00 0.60 C ATOM 380 C THR A 80 10.623 -10.927 2.794 1.00 0.56 C ATOM 381 O THR A 80 10.365 -9.762 3.007 1.00 0.50 O ATOM 382 CB THR A 80 13.043 -11.482 2.914 1.00 0.77 C ATOM 383 OG1 THR A 80 13.042 -10.423 3.860 1.00 0.94 O ATOM 384 CG2 THR A 80 14.335 -11.437 2.096 1.00 0.73 C ATOM 0 H THR A 80 12.171 -9.339 1.285 1.00 0.56 H new ATOM 0 HA THR A 80 11.624 -12.278 1.480 1.00 0.60 H new ATOM 0 HB THR A 80 12.980 -12.436 3.437 1.00 0.77 H new ATOM 0 HG1 THR A 80 13.889 -10.425 4.354 1.00 0.94 H new ATOM 0 HG21 THR A 80 15.191 -11.543 2.762 1.00 0.73 H new ATOM 0 HG22 THR A 80 14.336 -12.252 1.372 1.00 0.73 H new ATOM 0 HG23 THR A 80 14.400 -10.484 1.571 1.00 0.73 H new ATOM 392 N TYR A 81 9.884 -11.893 3.288 1.00 0.61 N ATOM 393 CA TYR A 81 8.708 -11.557 4.136 1.00 0.60 C ATOM 394 C TYR A 81 9.242 -10.613 5.209 1.00 0.51 C ATOM 395 O TYR A 81 8.675 -9.581 5.508 1.00 0.45 O ATOM 396 CB TYR A 81 8.130 -12.868 4.740 1.00 0.69 C ATOM 397 CG TYR A 81 8.251 -12.896 6.253 1.00 0.60 C ATOM 398 CD1 TYR A 81 7.300 -12.239 7.043 1.00 0.59 C ATOM 399 CD2 TYR A 81 9.317 -13.572 6.859 1.00 0.71 C ATOM 400 CE1 TYR A 81 7.414 -12.257 8.437 1.00 0.66 C ATOM 401 CE2 TYR A 81 9.430 -13.592 8.254 1.00 0.77 C ATOM 402 CZ TYR A 81 8.479 -12.934 9.043 1.00 0.73 C ATOM 403 OH TYR A 81 8.593 -12.951 10.418 1.00 0.90 O ATOM 0 H TYR A 81 10.046 -12.889 3.140 1.00 0.61 H new ATOM 0 HA TYR A 81 7.897 -11.082 3.585 1.00 0.60 H new ATOM 0 HB2 TYR A 81 7.082 -12.966 4.458 1.00 0.69 H new ATOM 0 HB3 TYR A 81 8.655 -13.725 4.318 1.00 0.69 H new ATOM 0 HD1 TYR A 81 6.478 -11.718 6.576 1.00 0.59 H new ATOM 0 HD2 TYR A 81 10.052 -14.078 6.250 1.00 0.71 H new ATOM 0 HE1 TYR A 81 6.681 -11.749 9.046 1.00 0.66 H new ATOM 0 HE2 TYR A 81 10.251 -14.115 8.722 1.00 0.77 H new ATOM 0 HH TYR A 81 9.387 -13.465 10.674 1.00 0.90 H new ATOM 413 N LYS A 82 10.380 -10.962 5.739 1.00 0.52 N ATOM 414 CA LYS A 82 11.030 -10.097 6.743 1.00 0.48 C ATOM 415 C LYS A 82 11.278 -8.740 6.093 1.00 0.40 C ATOM 416 O LYS A 82 11.227 -7.714 6.741 1.00 0.38 O ATOM 417 CB LYS A 82 12.363 -10.717 7.168 1.00 0.55 C ATOM 418 CG LYS A 82 12.949 -9.927 8.342 1.00 0.60 C ATOM 419 CD LYS A 82 14.103 -10.717 8.963 1.00 0.92 C ATOM 420 CE LYS A 82 14.602 -9.993 10.215 1.00 1.49 C ATOM 421 NZ LYS A 82 15.503 -10.896 10.984 1.00 2.32 N ATOM 0 H LYS A 82 10.887 -11.818 5.513 1.00 0.52 H new ATOM 0 HA LYS A 82 10.399 -9.989 7.625 1.00 0.48 H new ATOM 0 HB2 LYS A 82 12.216 -11.758 7.455 1.00 0.55 H new ATOM 0 HB3 LYS A 82 13.060 -10.713 6.330 1.00 0.55 H new ATOM 0 HG2 LYS A 82 13.303 -8.955 7.999 1.00 0.60 H new ATOM 0 HG3 LYS A 82 12.178 -9.740 9.090 1.00 0.60 H new ATOM 0 HD2 LYS A 82 13.772 -11.723 9.220 1.00 0.92 H new ATOM 0 HD3 LYS A 82 14.915 -10.822 8.243 1.00 0.92 H new ATOM 0 HE2 LYS A 82 15.134 -9.084 9.935 1.00 1.49 H new ATOM 0 HE3 LYS A 82 13.758 -9.691 10.834 1.00 1.49 H new ATOM 0 HZ1 LYS A 82 15.843 -10.405 11.835 1.00 2.32 H new ATOM 0 HZ2 LYS A 82 14.981 -11.751 11.263 1.00 2.32 H new ATOM 0 HZ3 LYS A 82 16.315 -11.163 10.391 1.00 2.32 H new ATOM 435 N ALA A 83 11.538 -8.716 4.803 1.00 0.42 N ATOM 436 CA ALA A 83 11.771 -7.398 4.141 1.00 0.41 C ATOM 437 C ALA A 83 10.469 -6.591 4.168 1.00 0.35 C ATOM 438 O ALA A 83 10.475 -5.387 4.327 1.00 0.34 O ATOM 439 CB ALA A 83 12.222 -7.606 2.694 1.00 0.52 C ATOM 0 H ALA A 83 11.597 -9.534 4.196 1.00 0.42 H new ATOM 0 HA ALA A 83 12.553 -6.857 4.674 1.00 0.41 H new ATOM 0 HB1 ALA A 83 12.389 -6.638 2.222 1.00 0.52 H new ATOM 0 HB2 ALA A 83 13.148 -8.180 2.681 1.00 0.52 H new ATOM 0 HB3 ALA A 83 11.451 -8.148 2.147 1.00 0.52 H new ATOM 445 N ALA A 84 9.352 -7.252 4.016 1.00 0.34 N ATOM 446 CA ALA A 84 8.045 -6.535 4.036 1.00 0.31 C ATOM 447 C ALA A 84 7.838 -5.886 5.408 1.00 0.28 C ATOM 448 O ALA A 84 7.470 -4.732 5.507 1.00 0.28 O ATOM 449 CB ALA A 84 6.915 -7.532 3.769 1.00 0.34 C ATOM 0 H ALA A 84 9.289 -8.261 3.878 1.00 0.34 H new ATOM 0 HA ALA A 84 8.042 -5.764 3.266 1.00 0.31 H new ATOM 0 HB1 ALA A 84 5.958 -7.010 3.783 1.00 0.34 H new ATOM 0 HB2 ALA A 84 7.061 -7.995 2.793 1.00 0.34 H new ATOM 0 HB3 ALA A 84 6.919 -8.302 4.540 1.00 0.34 H new ATOM 455 N VAL A 85 8.073 -6.613 6.467 1.00 0.29 N ATOM 456 CA VAL A 85 7.887 -6.026 7.824 1.00 0.29 C ATOM 457 C VAL A 85 8.862 -4.867 8.006 1.00 0.29 C ATOM 458 O VAL A 85 8.508 -3.820 8.514 1.00 0.30 O ATOM 459 CB VAL A 85 8.147 -7.093 8.891 1.00 0.33 C ATOM 460 CG1 VAL A 85 7.727 -6.561 10.263 1.00 0.37 C ATOM 461 CG2 VAL A 85 7.335 -8.348 8.567 1.00 0.38 C ATOM 0 H VAL A 85 8.384 -7.584 6.451 1.00 0.29 H new ATOM 0 HA VAL A 85 6.864 -5.663 7.927 1.00 0.29 H new ATOM 0 HB VAL A 85 9.209 -7.337 8.904 1.00 0.33 H new ATOM 0 HG11 VAL A 85 7.913 -7.322 11.021 1.00 0.37 H new ATOM 0 HG12 VAL A 85 8.303 -5.666 10.498 1.00 0.37 H new ATOM 0 HG13 VAL A 85 6.665 -6.315 10.248 1.00 0.37 H new ATOM 0 HG21 VAL A 85 7.520 -9.107 9.327 1.00 0.38 H new ATOM 0 HG22 VAL A 85 6.273 -8.101 8.552 1.00 0.38 H new ATOM 0 HG23 VAL A 85 7.632 -8.731 7.591 1.00 0.38 H new ATOM 471 N ASP A 86 10.083 -5.031 7.584 1.00 0.30 N ATOM 472 CA ASP A 86 11.060 -3.921 7.725 1.00 0.32 C ATOM 473 C ASP A 86 10.530 -2.729 6.932 1.00 0.30 C ATOM 474 O ASP A 86 10.467 -1.617 7.419 1.00 0.31 O ATOM 475 CB ASP A 86 12.414 -4.356 7.161 1.00 0.36 C ATOM 476 CG ASP A 86 13.090 -5.322 8.135 1.00 0.42 C ATOM 477 OD1 ASP A 86 13.288 -4.939 9.277 1.00 1.05 O ATOM 478 OD2 ASP A 86 13.400 -6.429 7.725 1.00 1.23 O ATOM 0 H ASP A 86 10.444 -5.881 7.150 1.00 0.30 H new ATOM 0 HA ASP A 86 11.188 -3.653 8.774 1.00 0.32 H new ATOM 0 HB2 ASP A 86 12.278 -4.837 6.192 1.00 0.36 H new ATOM 0 HB3 ASP A 86 13.048 -3.485 6.998 1.00 0.36 H new ATOM 483 N LEU A 87 10.132 -2.964 5.713 1.00 0.29 N ATOM 484 CA LEU A 87 9.583 -1.866 4.873 1.00 0.30 C ATOM 485 C LEU A 87 8.306 -1.323 5.519 1.00 0.29 C ATOM 486 O LEU A 87 8.064 -0.132 5.532 1.00 0.30 O ATOM 487 CB LEU A 87 9.261 -2.419 3.480 1.00 0.33 C ATOM 488 CG LEU A 87 8.819 -1.287 2.538 1.00 0.42 C ATOM 489 CD1 LEU A 87 10.001 -0.353 2.224 1.00 0.52 C ATOM 490 CD2 LEU A 87 8.290 -1.904 1.240 1.00 0.44 C ATOM 0 H LEU A 87 10.164 -3.877 5.260 1.00 0.29 H new ATOM 0 HA LEU A 87 10.313 -1.061 4.789 1.00 0.30 H new ATOM 0 HB2 LEU A 87 10.138 -2.919 3.070 1.00 0.33 H new ATOM 0 HB3 LEU A 87 8.472 -3.168 3.553 1.00 0.33 H new ATOM 0 HG LEU A 87 8.037 -0.701 3.021 1.00 0.42 H new ATOM 0 HD11 LEU A 87 9.669 0.442 1.556 1.00 0.52 H new ATOM 0 HD12 LEU A 87 10.376 0.084 3.150 1.00 0.52 H new ATOM 0 HD13 LEU A 87 10.797 -0.922 1.743 1.00 0.52 H new ATOM 0 HD21 LEU A 87 7.973 -1.111 0.563 1.00 0.44 H new ATOM 0 HD22 LEU A 87 9.078 -2.490 0.768 1.00 0.44 H new ATOM 0 HD23 LEU A 87 7.441 -2.551 1.464 1.00 0.44 H new ATOM 502 N SER A 88 7.480 -2.187 6.050 1.00 0.30 N ATOM 503 CA SER A 88 6.217 -1.713 6.683 1.00 0.34 C ATOM 504 C SER A 88 6.526 -0.593 7.680 1.00 0.33 C ATOM 505 O SER A 88 5.970 0.486 7.609 1.00 0.36 O ATOM 506 CB SER A 88 5.545 -2.875 7.415 1.00 0.40 C ATOM 507 OG SER A 88 6.240 -3.135 8.627 1.00 0.44 O ATOM 0 H SER A 88 7.626 -3.196 6.072 1.00 0.30 H new ATOM 0 HA SER A 88 5.549 -1.333 5.910 1.00 0.34 H new ATOM 0 HB2 SER A 88 4.503 -2.633 7.625 1.00 0.40 H new ATOM 0 HB3 SER A 88 5.545 -3.765 6.785 1.00 0.40 H new ATOM 0 HG SER A 88 5.954 -2.495 9.312 1.00 0.44 H new ATOM 513 N HIS A 89 7.406 -0.838 8.613 1.00 0.34 N ATOM 514 CA HIS A 89 7.738 0.213 9.614 1.00 0.36 C ATOM 515 C HIS A 89 8.563 1.318 8.957 1.00 0.36 C ATOM 516 O HIS A 89 8.548 2.453 9.391 1.00 0.41 O ATOM 517 CB HIS A 89 8.539 -0.404 10.762 1.00 0.41 C ATOM 518 CG HIS A 89 7.732 -1.492 11.414 1.00 0.52 C ATOM 519 ND1 HIS A 89 7.340 -2.633 10.731 1.00 1.43 N ATOM 520 CD2 HIS A 89 7.237 -1.631 12.688 1.00 1.01 C ATOM 521 CE1 HIS A 89 6.642 -3.400 11.589 1.00 1.27 C ATOM 522 NE2 HIS A 89 6.550 -2.835 12.796 1.00 0.82 N ATOM 0 H HIS A 89 7.908 -1.719 8.724 1.00 0.34 H new ATOM 0 HA HIS A 89 6.812 0.638 10.002 1.00 0.36 H new ATOM 0 HB2 HIS A 89 9.478 -0.810 10.386 1.00 0.41 H new ATOM 0 HB3 HIS A 89 8.793 0.362 11.494 1.00 0.41 H new ATOM 0 HD1 HIS A 89 7.544 -2.851 9.756 1.00 1.43 H new ATOM 0 HD2 HIS A 89 7.363 -0.913 13.485 1.00 1.01 H new ATOM 0 HE1 HIS A 89 6.209 -4.356 11.333 1.00 1.27 H new ATOM 530 N PHE A 90 9.280 1.006 7.915 1.00 0.34 N ATOM 531 CA PHE A 90 10.093 2.057 7.249 1.00 0.37 C ATOM 532 C PHE A 90 9.169 3.189 6.796 1.00 0.40 C ATOM 533 O PHE A 90 9.279 4.313 7.244 1.00 0.47 O ATOM 534 CB PHE A 90 10.809 1.455 6.035 1.00 0.38 C ATOM 535 CG PHE A 90 11.919 2.381 5.590 1.00 0.47 C ATOM 536 CD1 PHE A 90 13.046 2.560 6.401 1.00 0.57 C ATOM 537 CD2 PHE A 90 11.822 3.060 4.368 1.00 0.59 C ATOM 538 CE1 PHE A 90 14.075 3.416 5.992 1.00 0.69 C ATOM 539 CE2 PHE A 90 12.851 3.916 3.960 1.00 0.70 C ATOM 540 CZ PHE A 90 13.977 4.094 4.771 1.00 0.72 C ATOM 0 H PHE A 90 9.338 0.076 7.499 1.00 0.34 H new ATOM 0 HA PHE A 90 10.836 2.448 7.944 1.00 0.37 H new ATOM 0 HB2 PHE A 90 11.218 0.477 6.289 1.00 0.38 H new ATOM 0 HB3 PHE A 90 10.100 1.303 5.221 1.00 0.38 H new ATOM 0 HD1 PHE A 90 13.121 2.037 7.343 1.00 0.57 H new ATOM 0 HD2 PHE A 90 10.953 2.923 3.741 1.00 0.59 H new ATOM 0 HE1 PHE A 90 14.944 3.553 6.618 1.00 0.69 H new ATOM 0 HE2 PHE A 90 12.776 4.440 3.018 1.00 0.70 H new ATOM 0 HZ PHE A 90 14.771 4.755 4.455 1.00 0.72 H new ATOM 550 N LEU A 91 8.256 2.898 5.912 1.00 0.37 N ATOM 551 CA LEU A 91 7.318 3.951 5.427 1.00 0.42 C ATOM 552 C LEU A 91 6.472 4.486 6.589 1.00 0.47 C ATOM 553 O LEU A 91 5.913 5.562 6.510 1.00 0.57 O ATOM 554 CB LEU A 91 6.397 3.357 4.357 1.00 0.41 C ATOM 555 CG LEU A 91 7.235 2.840 3.176 1.00 0.41 C ATOM 556 CD1 LEU A 91 6.386 1.891 2.327 1.00 0.42 C ATOM 557 CD2 LEU A 91 7.708 4.012 2.301 1.00 0.54 C ATOM 0 H LEU A 91 8.118 1.974 5.503 1.00 0.37 H new ATOM 0 HA LEU A 91 7.896 4.773 5.003 1.00 0.42 H new ATOM 0 HB2 LEU A 91 5.809 2.543 4.781 1.00 0.41 H new ATOM 0 HB3 LEU A 91 5.692 4.113 4.011 1.00 0.41 H new ATOM 0 HG LEU A 91 8.106 2.314 3.567 1.00 0.41 H new ATOM 0 HD11 LEU A 91 6.979 1.524 1.489 1.00 0.42 H new ATOM 0 HD12 LEU A 91 6.060 1.049 2.938 1.00 0.42 H new ATOM 0 HD13 LEU A 91 5.514 2.424 1.948 1.00 0.42 H new ATOM 0 HD21 LEU A 91 8.300 3.630 1.469 1.00 0.54 H new ATOM 0 HD22 LEU A 91 6.842 4.549 1.913 1.00 0.54 H new ATOM 0 HD23 LEU A 91 8.318 4.689 2.899 1.00 0.54 H new ATOM 569 N LYS A 92 6.357 3.754 7.665 1.00 0.45 N ATOM 570 CA LYS A 92 5.530 4.257 8.798 1.00 0.53 C ATOM 571 C LYS A 92 6.124 5.562 9.339 1.00 0.63 C ATOM 572 O LYS A 92 5.409 6.436 9.786 1.00 0.85 O ATOM 573 CB LYS A 92 5.501 3.207 9.915 1.00 0.54 C ATOM 574 CG LYS A 92 4.480 3.610 10.989 1.00 0.73 C ATOM 575 CD LYS A 92 4.771 2.857 12.291 1.00 1.20 C ATOM 576 CE LYS A 92 3.836 3.362 13.391 1.00 1.61 C ATOM 577 NZ LYS A 92 4.262 4.725 13.818 1.00 2.27 N ATOM 0 H LYS A 92 6.793 2.843 7.807 1.00 0.45 H new ATOM 0 HA LYS A 92 4.516 4.445 8.445 1.00 0.53 H new ATOM 0 HB2 LYS A 92 5.241 2.232 9.502 1.00 0.54 H new ATOM 0 HB3 LYS A 92 6.491 3.111 10.361 1.00 0.54 H new ATOM 0 HG2 LYS A 92 4.526 4.685 11.162 1.00 0.73 H new ATOM 0 HG3 LYS A 92 3.470 3.385 10.646 1.00 0.73 H new ATOM 0 HD2 LYS A 92 4.631 1.786 12.143 1.00 1.20 H new ATOM 0 HD3 LYS A 92 5.810 3.006 12.585 1.00 1.20 H new ATOM 0 HE2 LYS A 92 2.809 3.388 13.027 1.00 1.61 H new ATOM 0 HE3 LYS A 92 3.856 2.680 14.241 1.00 1.61 H new ATOM 0 HZ1 LYS A 92 3.843 4.945 14.744 1.00 2.27 H new ATOM 0 HZ2 LYS A 92 5.299 4.758 13.890 1.00 2.27 H new ATOM 0 HZ3 LYS A 92 3.941 5.424 13.118 1.00 2.27 H new ATOM 591 N GLU A 93 7.421 5.702 9.316 1.00 0.62 N ATOM 592 CA GLU A 93 8.038 6.947 9.844 1.00 0.76 C ATOM 593 C GLU A 93 7.838 8.101 8.861 1.00 0.77 C ATOM 594 O GLU A 93 6.943 8.912 9.005 1.00 1.05 O ATOM 595 CB GLU A 93 9.536 6.719 10.060 1.00 0.94 C ATOM 596 CG GLU A 93 9.738 5.640 11.126 1.00 1.22 C ATOM 597 CD GLU A 93 9.381 6.210 12.501 1.00 2.00 C ATOM 598 OE1 GLU A 93 9.827 7.306 12.800 1.00 2.54 O ATOM 599 OE2 GLU A 93 8.670 5.540 13.232 1.00 2.73 O ATOM 0 H GLU A 93 8.077 5.009 8.955 1.00 0.62 H new ATOM 0 HA GLU A 93 7.560 7.203 10.790 1.00 0.76 H new ATOM 0 HB2 GLU A 93 10.007 6.415 9.125 1.00 0.94 H new ATOM 0 HB3 GLU A 93 10.015 7.647 10.371 1.00 0.94 H new ATOM 0 HG2 GLU A 93 9.113 4.774 10.906 1.00 1.22 H new ATOM 0 HG3 GLU A 93 10.772 5.297 11.120 1.00 1.22 H new ATOM 606 N LYS A 94 8.689 8.190 7.880 1.00 0.80 N ATOM 607 CA LYS A 94 8.587 9.304 6.890 1.00 1.02 C ATOM 608 C LYS A 94 7.526 9.003 5.827 1.00 0.96 C ATOM 609 O LYS A 94 6.821 9.886 5.381 1.00 1.41 O ATOM 610 CB LYS A 94 9.943 9.498 6.207 1.00 1.39 C ATOM 611 CG LYS A 94 10.331 8.219 5.460 1.00 1.63 C ATOM 612 CD LYS A 94 11.823 8.255 5.117 1.00 2.18 C ATOM 613 CE LYS A 94 12.109 9.411 4.152 1.00 2.61 C ATOM 614 NZ LYS A 94 12.174 10.690 4.915 1.00 2.96 N ATOM 0 H LYS A 94 9.456 7.537 7.718 1.00 0.80 H new ATOM 0 HA LYS A 94 8.296 10.211 7.421 1.00 1.02 H new ATOM 0 HB2 LYS A 94 9.895 10.336 5.512 1.00 1.39 H new ATOM 0 HB3 LYS A 94 10.703 9.742 6.949 1.00 1.39 H new ATOM 0 HG2 LYS A 94 10.110 7.346 6.074 1.00 1.63 H new ATOM 0 HG3 LYS A 94 9.740 8.125 4.549 1.00 1.63 H new ATOM 0 HD2 LYS A 94 12.411 8.375 6.027 1.00 2.18 H new ATOM 0 HD3 LYS A 94 12.124 7.310 4.665 1.00 2.18 H new ATOM 0 HE2 LYS A 94 13.050 9.238 3.630 1.00 2.61 H new ATOM 0 HE3 LYS A 94 11.329 9.467 3.393 1.00 2.61 H new ATOM 0 HZ1 LYS A 94 11.298 11.230 4.763 1.00 2.96 H new ATOM 0 HZ2 LYS A 94 12.283 10.484 5.929 1.00 2.96 H new ATOM 0 HZ3 LYS A 94 12.987 11.249 4.586 1.00 2.96 H new ATOM 628 N GLY A 95 7.420 7.772 5.404 1.00 1.12 N ATOM 629 CA GLY A 95 6.418 7.419 4.352 1.00 1.51 C ATOM 630 C GLY A 95 5.079 8.109 4.635 1.00 1.10 C ATOM 631 O GLY A 95 4.664 8.996 3.915 1.00 1.71 O ATOM 0 H GLY A 95 7.985 6.992 5.741 1.00 1.12 H new ATOM 0 HA2 GLY A 95 6.789 7.720 3.372 1.00 1.51 H new ATOM 0 HA3 GLY A 95 6.278 6.338 4.322 1.00 1.51 H new ATOM 635 N GLY A 96 4.398 7.712 5.676 1.00 1.17 N ATOM 636 CA GLY A 96 3.089 8.349 5.995 1.00 0.99 C ATOM 637 C GLY A 96 2.017 7.832 5.033 1.00 0.81 C ATOM 638 O GLY A 96 1.124 8.553 4.634 1.00 0.83 O ATOM 0 H GLY A 96 4.691 6.976 6.318 1.00 1.17 H new ATOM 0 HA2 GLY A 96 2.806 8.126 7.024 1.00 0.99 H new ATOM 0 HA3 GLY A 96 3.172 9.433 5.915 1.00 0.99 H new ATOM 642 N LEU A 97 2.097 6.585 4.662 1.00 0.67 N ATOM 643 CA LEU A 97 1.087 6.009 3.729 1.00 0.55 C ATOM 644 C LEU A 97 -0.172 5.657 4.525 1.00 0.46 C ATOM 645 O LEU A 97 -1.266 5.614 3.998 1.00 0.49 O ATOM 646 CB LEU A 97 1.675 4.743 3.087 1.00 0.54 C ATOM 647 CG LEU A 97 0.692 4.119 2.078 1.00 0.54 C ATOM 648 CD1 LEU A 97 0.661 4.938 0.783 1.00 0.65 C ATOM 649 CD2 LEU A 97 1.146 2.692 1.758 1.00 0.66 C ATOM 0 H LEU A 97 2.822 5.936 4.966 1.00 0.67 H new ATOM 0 HA LEU A 97 0.832 6.725 2.948 1.00 0.55 H new ATOM 0 HB2 LEU A 97 2.610 4.989 2.583 1.00 0.54 H new ATOM 0 HB3 LEU A 97 1.913 4.016 3.863 1.00 0.54 H new ATOM 0 HG LEU A 97 -0.307 4.111 2.514 1.00 0.54 H new ATOM 0 HD11 LEU A 97 -0.038 4.483 0.081 1.00 0.65 H new ATOM 0 HD12 LEU A 97 0.342 5.957 1.004 1.00 0.65 H new ATOM 0 HD13 LEU A 97 1.657 4.958 0.341 1.00 0.65 H new ATOM 0 HD21 LEU A 97 0.456 2.242 1.044 1.00 0.66 H new ATOM 0 HD22 LEU A 97 2.147 2.717 1.328 1.00 0.66 H new ATOM 0 HD23 LEU A 97 1.158 2.100 2.673 1.00 0.66 H new ATOM 661 N GLU A 98 -0.021 5.403 5.791 1.00 0.44 N ATOM 662 CA GLU A 98 -1.196 5.049 6.632 1.00 0.40 C ATOM 663 C GLU A 98 -2.308 6.082 6.450 1.00 0.40 C ATOM 664 O GLU A 98 -2.066 7.253 6.230 1.00 0.58 O ATOM 665 CB GLU A 98 -0.767 5.015 8.101 1.00 0.49 C ATOM 666 CG GLU A 98 -1.990 4.820 9.004 1.00 0.48 C ATOM 667 CD GLU A 98 -1.526 4.517 10.430 1.00 1.26 C ATOM 668 OE1 GLU A 98 -0.605 5.174 10.884 1.00 2.03 O ATOM 669 OE2 GLU A 98 -2.101 3.632 11.043 1.00 1.94 O ATOM 0 H GLU A 98 0.872 5.425 6.284 1.00 0.44 H new ATOM 0 HA GLU A 98 -1.572 4.071 6.330 1.00 0.40 H new ATOM 0 HB2 GLU A 98 -0.055 4.206 8.261 1.00 0.49 H new ATOM 0 HB3 GLU A 98 -0.258 5.943 8.361 1.00 0.49 H new ATOM 0 HG2 GLU A 98 -2.610 5.717 8.994 1.00 0.48 H new ATOM 0 HG3 GLU A 98 -2.606 4.003 8.629 1.00 0.48 H new ATOM 676 N GLY A 99 -3.526 5.646 6.574 1.00 0.39 N ATOM 677 CA GLY A 99 -4.689 6.568 6.450 1.00 0.42 C ATOM 678 C GLY A 99 -4.642 7.365 5.139 1.00 0.42 C ATOM 679 O GLY A 99 -5.476 8.217 4.905 1.00 0.46 O ATOM 0 H GLY A 99 -3.771 4.673 6.759 1.00 0.39 H new ATOM 0 HA2 GLY A 99 -5.615 5.995 6.495 1.00 0.42 H new ATOM 0 HA3 GLY A 99 -4.700 7.257 7.295 1.00 0.42 H new ATOM 683 N LEU A 100 -3.696 7.106 4.277 1.00 0.41 N ATOM 684 CA LEU A 100 -3.652 7.874 2.996 1.00 0.43 C ATOM 685 C LEU A 100 -4.755 7.357 2.068 1.00 0.42 C ATOM 686 O LEU A 100 -4.713 6.234 1.604 1.00 0.44 O ATOM 687 CB LEU A 100 -2.282 7.700 2.319 1.00 0.45 C ATOM 688 CG LEU A 100 -2.069 8.809 1.260 1.00 0.55 C ATOM 689 CD1 LEU A 100 -1.468 10.060 1.917 1.00 1.15 C ATOM 690 CD2 LEU A 100 -1.111 8.316 0.165 1.00 1.17 C ATOM 0 H LEU A 100 -2.962 6.408 4.399 1.00 0.41 H new ATOM 0 HA LEU A 100 -3.807 8.933 3.203 1.00 0.43 H new ATOM 0 HB2 LEU A 100 -1.490 7.743 3.067 1.00 0.45 H new ATOM 0 HB3 LEU A 100 -2.222 6.719 1.847 1.00 0.45 H new ATOM 0 HG LEU A 100 -3.036 9.054 0.820 1.00 0.55 H new ATOM 0 HD11 LEU A 100 -1.323 10.833 1.162 1.00 1.15 H new ATOM 0 HD12 LEU A 100 -2.146 10.428 2.687 1.00 1.15 H new ATOM 0 HD13 LEU A 100 -0.508 9.809 2.368 1.00 1.15 H new ATOM 0 HD21 LEU A 100 -0.968 9.104 -0.575 1.00 1.17 H new ATOM 0 HD22 LEU A 100 -0.150 8.058 0.611 1.00 1.17 H new ATOM 0 HD23 LEU A 100 -1.534 7.436 -0.319 1.00 1.17 H new ATOM 702 N ILE A 101 -5.753 8.160 1.808 1.00 0.44 N ATOM 703 CA ILE A 101 -6.865 7.704 0.928 1.00 0.45 C ATOM 704 C ILE A 101 -6.334 7.371 -0.471 1.00 0.46 C ATOM 705 O ILE A 101 -5.994 8.239 -1.250 1.00 0.49 O ATOM 706 CB ILE A 101 -7.962 8.789 0.869 1.00 0.50 C ATOM 707 CG1 ILE A 101 -8.836 8.714 2.147 1.00 0.51 C ATOM 708 CG2 ILE A 101 -8.837 8.606 -0.379 1.00 0.54 C ATOM 709 CD1 ILE A 101 -9.899 7.591 2.055 1.00 0.52 C ATOM 0 H ILE A 101 -5.845 9.110 2.167 1.00 0.44 H new ATOM 0 HA ILE A 101 -7.304 6.796 1.341 1.00 0.45 H new ATOM 0 HB ILE A 101 -7.486 9.768 0.813 1.00 0.50 H new ATOM 0 HG12 ILE A 101 -8.198 8.540 3.013 1.00 0.51 H new ATOM 0 HG13 ILE A 101 -9.332 9.672 2.304 1.00 0.51 H new ATOM 0 HG21 ILE A 101 -9.604 9.380 -0.402 1.00 0.54 H new ATOM 0 HG22 ILE A 101 -8.217 8.682 -1.272 1.00 0.54 H new ATOM 0 HG23 ILE A 101 -9.312 7.625 -0.350 1.00 0.54 H new ATOM 0 HD11 ILE A 101 -10.490 7.573 2.971 1.00 0.52 H new ATOM 0 HD12 ILE A 101 -10.554 7.779 1.204 1.00 0.52 H new ATOM 0 HD13 ILE A 101 -9.402 6.630 1.925 1.00 0.52 H new ATOM 721 N HIS A 102 -6.281 6.104 -0.789 1.00 0.47 N ATOM 722 CA HIS A 102 -5.799 5.674 -2.130 1.00 0.51 C ATOM 723 C HIS A 102 -6.775 6.164 -3.199 1.00 0.58 C ATOM 724 O HIS A 102 -7.897 5.686 -3.301 1.00 0.64 O ATOM 725 CB HIS A 102 -5.722 4.145 -2.177 1.00 0.57 C ATOM 726 CG HIS A 102 -5.292 3.702 -3.548 1.00 0.64 C ATOM 727 ND1 HIS A 102 -4.903 4.600 -4.527 1.00 1.41 N ATOM 728 CD2 HIS A 102 -5.188 2.458 -4.116 1.00 0.64 C ATOM 729 CE1 HIS A 102 -4.584 3.889 -5.623 1.00 1.36 C ATOM 730 NE2 HIS A 102 -4.740 2.578 -5.428 1.00 0.70 N ATOM 0 H HIS A 102 -6.555 5.342 -0.168 1.00 0.47 H new ATOM 0 HA HIS A 102 -4.811 6.095 -2.315 1.00 0.51 H new ATOM 0 HB2 HIS A 102 -5.016 3.784 -1.429 1.00 0.57 H new ATOM 0 HB3 HIS A 102 -6.693 3.714 -1.933 1.00 0.57 H new ATOM 0 HD2 HIS A 102 -5.419 1.527 -3.620 1.00 0.64 H new ATOM 0 HE1 HIS A 102 -4.243 4.326 -6.550 1.00 1.36 H new ATOM 0 HE2 HIS A 102 -4.568 1.827 -6.096 1.00 0.70 H new ATOM 738 N SER A 103 -6.353 7.119 -3.988 1.00 0.60 N ATOM 739 CA SER A 103 -7.228 7.663 -5.064 1.00 0.69 C ATOM 740 C SER A 103 -7.363 6.631 -6.187 1.00 0.76 C ATOM 741 O SER A 103 -8.290 5.849 -6.223 1.00 0.85 O ATOM 742 CB SER A 103 -6.605 8.943 -5.621 1.00 0.74 C ATOM 743 OG SER A 103 -6.519 9.912 -4.585 1.00 1.49 O ATOM 0 H SER A 103 -5.429 7.548 -3.930 1.00 0.60 H new ATOM 0 HA SER A 103 -8.214 7.883 -4.655 1.00 0.69 H new ATOM 0 HB2 SER A 103 -5.613 8.734 -6.022 1.00 0.74 H new ATOM 0 HB3 SER A 103 -7.208 9.326 -6.444 1.00 0.74 H new ATOM 0 HG SER A 103 -6.270 10.779 -4.968 1.00 1.49 H new ATOM 749 N GLN A 104 -6.438 6.627 -7.111 1.00 0.81 N ATOM 750 CA GLN A 104 -6.503 5.652 -8.238 1.00 0.92 C ATOM 751 C GLN A 104 -5.086 5.391 -8.759 1.00 0.93 C ATOM 752 O GLN A 104 -4.714 4.268 -9.038 1.00 1.37 O ATOM 753 CB GLN A 104 -7.368 6.235 -9.363 1.00 1.06 C ATOM 754 CG GLN A 104 -7.795 5.118 -10.319 1.00 1.76 C ATOM 755 CD GLN A 104 -8.881 4.266 -9.657 1.00 2.14 C ATOM 756 OE1 GLN A 104 -9.811 4.790 -9.077 1.00 2.64 O ATOM 757 NE2 GLN A 104 -8.802 2.965 -9.722 1.00 2.70 N ATOM 0 H GLN A 104 -5.638 7.259 -7.133 1.00 0.81 H new ATOM 0 HA GLN A 104 -6.942 4.716 -7.893 1.00 0.92 H new ATOM 0 HB2 GLN A 104 -8.248 6.723 -8.943 1.00 1.06 H new ATOM 0 HB3 GLN A 104 -6.810 6.998 -9.906 1.00 1.06 H new ATOM 0 HG2 GLN A 104 -8.170 5.545 -11.249 1.00 1.76 H new ATOM 0 HG3 GLN A 104 -6.937 4.497 -10.576 1.00 1.76 H new ATOM 0 HE21 GLN A 104 -8.021 2.525 -10.209 1.00 2.70 H new ATOM 0 HE22 GLN A 104 -9.521 2.388 -9.286 1.00 2.70 H new ATOM 766 N ARG A 105 -4.292 6.423 -8.885 1.00 0.83 N ATOM 767 CA ARG A 105 -2.889 6.255 -9.380 1.00 0.87 C ATOM 768 C ARG A 105 -1.920 6.301 -8.193 1.00 0.74 C ATOM 769 O ARG A 105 -0.736 6.065 -8.336 1.00 0.70 O ATOM 770 CB ARG A 105 -2.558 7.396 -10.345 1.00 1.06 C ATOM 771 CG ARG A 105 -2.975 8.733 -9.718 1.00 1.71 C ATOM 772 CD ARG A 105 -2.530 9.915 -10.610 1.00 1.99 C ATOM 773 NE ARG A 105 -1.895 10.984 -9.771 1.00 2.86 N ATOM 774 CZ ARG A 105 -2.446 11.391 -8.655 1.00 3.60 C ATOM 775 NH1 ARG A 105 -3.618 10.947 -8.296 1.00 3.73 N ATOM 776 NH2 ARG A 105 -1.830 12.270 -7.912 1.00 4.61 N ATOM 0 H ARG A 105 -4.556 7.383 -8.665 1.00 0.83 H new ATOM 0 HA ARG A 105 -2.793 5.297 -9.892 1.00 0.87 H new ATOM 0 HB2 ARG A 105 -1.490 7.402 -10.565 1.00 1.06 H new ATOM 0 HB3 ARG A 105 -3.078 7.248 -11.292 1.00 1.06 H new ATOM 0 HG2 ARG A 105 -4.057 8.757 -9.586 1.00 1.71 H new ATOM 0 HG3 ARG A 105 -2.531 8.831 -8.727 1.00 1.71 H new ATOM 0 HD2 ARG A 105 -1.824 9.566 -11.364 1.00 1.99 H new ATOM 0 HD3 ARG A 105 -3.389 10.322 -11.143 1.00 1.99 H new ATOM 0 HE ARG A 105 -1.016 11.402 -10.076 1.00 2.86 H new ATOM 0 HH11 ARG A 105 -4.112 10.278 -8.886 1.00 3.73 H new ATOM 0 HH12 ARG A 105 -4.040 11.269 -7.425 1.00 3.73 H new ATOM 0 HH21 ARG A 105 -0.923 12.637 -8.202 1.00 4.61 H new ATOM 0 HH22 ARG A 105 -2.255 12.590 -7.042 1.00 4.61 H new ATOM 790 N ARG A 106 -2.413 6.618 -7.027 1.00 0.71 N ATOM 791 CA ARG A 106 -1.526 6.696 -5.828 1.00 0.65 C ATOM 792 C ARG A 106 -0.776 5.373 -5.635 1.00 0.54 C ATOM 793 O ARG A 106 0.368 5.356 -5.225 1.00 0.50 O ATOM 794 CB ARG A 106 -2.378 6.981 -4.590 1.00 0.70 C ATOM 795 CG ARG A 106 -2.876 8.434 -4.626 1.00 1.01 C ATOM 796 CD ARG A 106 -1.738 9.414 -4.284 1.00 1.24 C ATOM 797 NE ARG A 106 -2.314 10.627 -3.619 1.00 1.86 N ATOM 798 CZ ARG A 106 -3.318 11.275 -4.147 1.00 2.48 C ATOM 799 NH1 ARG A 106 -3.706 11.014 -5.365 1.00 2.86 N ATOM 800 NH2 ARG A 106 -3.899 12.232 -3.475 1.00 3.29 N ATOM 0 H ARG A 106 -3.396 6.827 -6.851 1.00 0.71 H new ATOM 0 HA ARG A 106 -0.800 7.496 -5.973 1.00 0.65 H new ATOM 0 HB2 ARG A 106 -3.226 6.297 -4.555 1.00 0.70 H new ATOM 0 HB3 ARG A 106 -1.793 6.810 -3.687 1.00 0.70 H new ATOM 0 HG2 ARG A 106 -3.273 8.662 -5.615 1.00 1.01 H new ATOM 0 HG3 ARG A 106 -3.695 8.560 -3.917 1.00 1.01 H new ATOM 0 HD2 ARG A 106 -1.014 8.933 -3.626 1.00 1.24 H new ATOM 0 HD3 ARG A 106 -1.204 9.701 -5.190 1.00 1.24 H new ATOM 0 HE ARG A 106 -1.915 10.953 -2.738 1.00 1.86 H new ATOM 0 HH11 ARG A 106 -3.225 10.300 -5.912 1.00 2.86 H new ATOM 0 HH12 ARG A 106 -4.491 11.524 -5.771 1.00 2.86 H new ATOM 0 HH21 ARG A 106 -3.569 12.472 -2.540 1.00 3.29 H new ATOM 0 HH22 ARG A 106 -4.683 12.740 -3.885 1.00 3.29 H new ATOM 814 N GLN A 107 -1.407 4.265 -5.916 1.00 0.55 N ATOM 815 CA GLN A 107 -0.719 2.953 -5.735 1.00 0.52 C ATOM 816 C GLN A 107 0.491 2.877 -6.671 1.00 0.49 C ATOM 817 O GLN A 107 1.535 2.368 -6.313 1.00 0.44 O ATOM 818 CB GLN A 107 -1.690 1.813 -6.057 1.00 0.63 C ATOM 819 CG GLN A 107 -0.942 0.476 -6.050 1.00 1.11 C ATOM 820 CD GLN A 107 -1.946 -0.676 -5.966 1.00 1.53 C ATOM 821 OE1 GLN A 107 -1.828 -1.540 -5.119 1.00 2.13 O ATOM 822 NE2 GLN A 107 -2.938 -0.725 -6.812 1.00 2.12 N ATOM 0 H GLN A 107 -2.365 4.211 -6.262 1.00 0.55 H new ATOM 0 HA GLN A 107 -0.385 2.860 -4.702 1.00 0.52 H new ATOM 0 HB2 GLN A 107 -2.497 1.793 -5.324 1.00 0.63 H new ATOM 0 HB3 GLN A 107 -2.149 1.978 -7.032 1.00 0.63 H new ATOM 0 HG2 GLN A 107 -0.339 0.381 -6.953 1.00 1.11 H new ATOM 0 HG3 GLN A 107 -0.256 0.436 -5.204 1.00 1.11 H new ATOM 0 HE21 GLN A 107 -3.038 -0.001 -7.523 1.00 2.12 H new ATOM 0 HE22 GLN A 107 -3.613 -1.488 -6.762 1.00 2.12 H new ATOM 831 N ASP A 108 0.358 3.378 -7.870 1.00 0.56 N ATOM 832 CA ASP A 108 1.500 3.332 -8.827 1.00 0.59 C ATOM 833 C ASP A 108 2.709 4.048 -8.223 1.00 0.54 C ATOM 834 O ASP A 108 3.803 3.521 -8.192 1.00 0.54 O ATOM 835 CB ASP A 108 1.098 4.023 -10.133 1.00 0.72 C ATOM 836 CG ASP A 108 0.001 3.211 -10.824 1.00 0.81 C ATOM 837 OD1 ASP A 108 -0.459 2.249 -10.233 1.00 1.33 O ATOM 838 OD2 ASP A 108 -0.358 3.565 -11.935 1.00 1.42 O ATOM 0 H ASP A 108 -0.491 3.816 -8.227 1.00 0.56 H new ATOM 0 HA ASP A 108 1.760 2.293 -9.028 1.00 0.59 H new ATOM 0 HB2 ASP A 108 0.743 5.033 -9.928 1.00 0.72 H new ATOM 0 HB3 ASP A 108 1.964 4.116 -10.789 1.00 0.72 H new ATOM 843 N ILE A 109 2.524 5.249 -7.746 1.00 0.55 N ATOM 844 CA ILE A 109 3.666 5.998 -7.149 1.00 0.54 C ATOM 845 C ILE A 109 4.364 5.122 -6.107 1.00 0.47 C ATOM 846 O ILE A 109 5.568 4.962 -6.123 1.00 0.53 O ATOM 847 CB ILE A 109 3.148 7.273 -6.480 1.00 0.59 C ATOM 848 CG1 ILE A 109 2.326 8.081 -7.487 1.00 0.70 C ATOM 849 CG2 ILE A 109 4.331 8.115 -6.000 1.00 0.63 C ATOM 850 CD1 ILE A 109 1.697 9.285 -6.784 1.00 1.47 C ATOM 0 H ILE A 109 1.632 5.744 -7.744 1.00 0.55 H new ATOM 0 HA ILE A 109 4.375 6.262 -7.934 1.00 0.54 H new ATOM 0 HB ILE A 109 2.522 7.006 -5.629 1.00 0.59 H new ATOM 0 HG12 ILE A 109 2.962 8.416 -8.306 1.00 0.70 H new ATOM 0 HG13 ILE A 109 1.548 7.454 -7.924 1.00 0.70 H new ATOM 0 HG21 ILE A 109 3.962 9.023 -5.524 1.00 0.63 H new ATOM 0 HG22 ILE A 109 4.918 7.542 -5.283 1.00 0.63 H new ATOM 0 HG23 ILE A 109 4.957 8.381 -6.851 1.00 0.63 H new ATOM 0 HD11 ILE A 109 1.112 9.860 -7.501 1.00 1.47 H new ATOM 0 HD12 ILE A 109 1.047 8.939 -5.980 1.00 1.47 H new ATOM 0 HD13 ILE A 109 2.483 9.915 -6.369 1.00 1.47 H new ATOM 862 N LEU A 110 3.619 4.555 -5.197 1.00 0.43 N ATOM 863 CA LEU A 110 4.243 3.694 -4.154 1.00 0.39 C ATOM 864 C LEU A 110 5.147 2.657 -4.827 1.00 0.38 C ATOM 865 O LEU A 110 6.355 2.737 -4.760 1.00 0.38 O ATOM 866 CB LEU A 110 3.140 2.983 -3.359 1.00 0.42 C ATOM 867 CG LEU A 110 3.744 2.160 -2.209 1.00 0.44 C ATOM 868 CD1 LEU A 110 4.360 3.089 -1.147 1.00 0.56 C ATOM 869 CD2 LEU A 110 2.637 1.314 -1.570 1.00 0.66 C ATOM 0 H LEU A 110 2.606 4.651 -5.131 1.00 0.43 H new ATOM 0 HA LEU A 110 4.839 4.306 -3.477 1.00 0.39 H new ATOM 0 HB2 LEU A 110 2.442 3.718 -2.959 1.00 0.42 H new ATOM 0 HB3 LEU A 110 2.571 2.330 -4.021 1.00 0.42 H new ATOM 0 HG LEU A 110 4.530 1.515 -2.603 1.00 0.44 H new ATOM 0 HD11 LEU A 110 4.783 2.490 -0.341 1.00 0.56 H new ATOM 0 HD12 LEU A 110 5.146 3.691 -1.602 1.00 0.56 H new ATOM 0 HD13 LEU A 110 3.588 3.745 -0.745 1.00 0.56 H new ATOM 0 HD21 LEU A 110 3.054 0.726 -0.753 1.00 0.66 H new ATOM 0 HD22 LEU A 110 1.856 1.969 -1.184 1.00 0.66 H new ATOM 0 HD23 LEU A 110 2.212 0.645 -2.318 1.00 0.66 H new ATOM 881 N ASP A 111 4.568 1.683 -5.476 1.00 0.40 N ATOM 882 CA ASP A 111 5.392 0.637 -6.150 1.00 0.42 C ATOM 883 C ASP A 111 6.509 1.300 -6.960 1.00 0.43 C ATOM 884 O ASP A 111 7.636 0.847 -6.970 1.00 0.42 O ATOM 885 CB ASP A 111 4.503 -0.180 -7.089 1.00 0.50 C ATOM 886 CG ASP A 111 3.209 -0.558 -6.367 1.00 0.59 C ATOM 887 OD1 ASP A 111 3.220 -0.580 -5.147 1.00 1.19 O ATOM 888 OD2 ASP A 111 2.230 -0.818 -7.045 1.00 1.30 O ATOM 0 H ASP A 111 3.559 1.566 -5.569 1.00 0.40 H new ATOM 0 HA ASP A 111 5.832 -0.017 -5.397 1.00 0.42 H new ATOM 0 HB2 ASP A 111 4.276 0.397 -7.986 1.00 0.50 H new ATOM 0 HB3 ASP A 111 5.027 -1.079 -7.412 1.00 0.50 H new ATOM 893 N LEU A 112 6.203 2.369 -7.639 1.00 0.48 N ATOM 894 CA LEU A 112 7.243 3.062 -8.450 1.00 0.52 C ATOM 895 C LEU A 112 8.320 3.626 -7.522 1.00 0.48 C ATOM 896 O LEU A 112 9.488 3.320 -7.656 1.00 0.47 O ATOM 897 CB LEU A 112 6.583 4.200 -9.239 1.00 0.60 C ATOM 898 CG LEU A 112 7.483 4.636 -10.404 1.00 0.70 C ATOM 899 CD1 LEU A 112 6.719 5.635 -11.279 1.00 1.45 C ATOM 900 CD2 LEU A 112 8.771 5.292 -9.869 1.00 1.26 C ATOM 0 H LEU A 112 5.276 2.794 -7.668 1.00 0.48 H new ATOM 0 HA LEU A 112 7.705 2.359 -9.143 1.00 0.52 H new ATOM 0 HB2 LEU A 112 5.616 3.873 -9.621 1.00 0.60 H new ATOM 0 HB3 LEU A 112 6.395 5.047 -8.579 1.00 0.60 H new ATOM 0 HG LEU A 112 7.758 3.761 -10.993 1.00 0.70 H new ATOM 0 HD11 LEU A 112 7.352 5.950 -12.109 1.00 1.45 H new ATOM 0 HD12 LEU A 112 5.818 5.162 -11.669 1.00 1.45 H new ATOM 0 HD13 LEU A 112 6.444 6.505 -10.683 1.00 1.45 H new ATOM 0 HD21 LEU A 112 9.399 5.596 -10.706 1.00 1.26 H new ATOM 0 HD22 LEU A 112 8.513 6.167 -9.272 1.00 1.26 H new ATOM 0 HD23 LEU A 112 9.313 4.578 -9.249 1.00 1.26 H new ATOM 912 N TRP A 113 7.940 4.441 -6.579 1.00 0.48 N ATOM 913 CA TRP A 113 8.950 5.017 -5.648 1.00 0.48 C ATOM 914 C TRP A 113 9.845 3.895 -5.112 1.00 0.43 C ATOM 915 O TRP A 113 11.053 4.020 -5.072 1.00 0.45 O ATOM 916 CB TRP A 113 8.234 5.708 -4.485 1.00 0.52 C ATOM 917 CG TRP A 113 9.242 6.201 -3.497 1.00 0.56 C ATOM 918 CD1 TRP A 113 9.884 7.390 -3.568 1.00 0.66 C ATOM 919 CD2 TRP A 113 9.730 5.542 -2.294 1.00 0.55 C ATOM 920 NE1 TRP A 113 10.737 7.500 -2.484 1.00 0.70 N ATOM 921 CE2 TRP A 113 10.678 6.385 -1.670 1.00 0.65 C ATOM 922 CE3 TRP A 113 9.444 4.305 -1.691 1.00 0.51 C ATOM 923 CZ2 TRP A 113 11.320 6.013 -0.488 1.00 0.70 C ATOM 924 CZ3 TRP A 113 10.087 3.925 -0.503 1.00 0.58 C ATOM 925 CH2 TRP A 113 11.024 4.778 0.098 1.00 0.67 C ATOM 0 H TRP A 113 6.977 4.733 -6.412 1.00 0.48 H new ATOM 0 HA TRP A 113 9.563 5.746 -6.177 1.00 0.48 H new ATOM 0 HB2 TRP A 113 7.636 6.541 -4.856 1.00 0.52 H new ATOM 0 HB3 TRP A 113 7.547 5.012 -4.003 1.00 0.52 H new ATOM 0 HD1 TRP A 113 9.752 8.131 -4.343 1.00 0.66 H new ATOM 0 HE1 TRP A 113 11.336 8.306 -2.307 1.00 0.70 H new ATOM 0 HE3 TRP A 113 8.723 3.641 -2.146 1.00 0.51 H new ATOM 0 HZ2 TRP A 113 12.040 6.674 -0.029 1.00 0.70 H new ATOM 0 HZ3 TRP A 113 9.859 2.972 -0.050 1.00 0.58 H new ATOM 0 HH2 TRP A 113 11.516 4.482 1.012 1.00 0.67 H new ATOM 936 N ILE A 114 9.267 2.796 -4.708 1.00 0.39 N ATOM 937 CA ILE A 114 10.096 1.674 -4.187 1.00 0.37 C ATOM 938 C ILE A 114 11.078 1.225 -5.273 1.00 0.39 C ATOM 939 O ILE A 114 12.163 0.757 -4.987 1.00 0.44 O ATOM 940 CB ILE A 114 9.192 0.500 -3.789 1.00 0.37 C ATOM 941 CG1 ILE A 114 8.223 0.963 -2.692 1.00 0.37 C ATOM 942 CG2 ILE A 114 10.055 -0.655 -3.261 1.00 0.42 C ATOM 943 CD1 ILE A 114 7.270 -0.174 -2.318 1.00 1.00 C ATOM 0 H ILE A 114 8.261 2.628 -4.716 1.00 0.39 H new ATOM 0 HA ILE A 114 10.650 2.009 -3.310 1.00 0.37 H new ATOM 0 HB ILE A 114 8.627 0.158 -4.657 1.00 0.37 H new ATOM 0 HG12 ILE A 114 8.783 1.283 -1.813 1.00 0.37 H new ATOM 0 HG13 ILE A 114 7.654 1.826 -3.039 1.00 0.37 H new ATOM 0 HG21 ILE A 114 9.413 -1.489 -2.978 1.00 0.42 H new ATOM 0 HG22 ILE A 114 10.747 -0.977 -4.039 1.00 0.42 H new ATOM 0 HG23 ILE A 114 10.619 -0.320 -2.390 1.00 0.42 H new ATOM 0 HD11 ILE A 114 6.587 0.165 -1.539 1.00 1.00 H new ATOM 0 HD12 ILE A 114 6.699 -0.474 -3.197 1.00 1.00 H new ATOM 0 HD13 ILE A 114 7.845 -1.025 -1.952 1.00 1.00 H new ATOM 955 N TYR A 115 10.703 1.352 -6.518 1.00 0.40 N ATOM 956 CA TYR A 115 11.610 0.918 -7.621 1.00 0.46 C ATOM 957 C TYR A 115 12.894 1.767 -7.629 1.00 0.51 C ATOM 958 O TYR A 115 13.981 1.261 -7.436 1.00 0.54 O ATOM 959 CB TYR A 115 10.873 1.067 -8.962 1.00 0.53 C ATOM 960 CG TYR A 115 11.476 0.139 -9.997 1.00 0.59 C ATOM 961 CD1 TYR A 115 11.215 -1.238 -9.941 1.00 0.56 C ATOM 962 CD2 TYR A 115 12.291 0.656 -11.012 1.00 0.74 C ATOM 963 CE1 TYR A 115 11.770 -2.094 -10.900 1.00 0.65 C ATOM 964 CE2 TYR A 115 12.846 -0.202 -11.969 1.00 0.82 C ATOM 965 CZ TYR A 115 12.585 -1.576 -11.913 1.00 0.77 C ATOM 966 OH TYR A 115 13.131 -2.420 -12.857 1.00 0.87 O ATOM 0 H TYR A 115 9.808 1.737 -6.819 1.00 0.40 H new ATOM 0 HA TYR A 115 11.891 -0.124 -7.467 1.00 0.46 H new ATOM 0 HB2 TYR A 115 9.815 0.839 -8.831 1.00 0.53 H new ATOM 0 HB3 TYR A 115 10.936 2.099 -9.307 1.00 0.53 H new ATOM 0 HD1 TYR A 115 10.587 -1.638 -9.159 1.00 0.56 H new ATOM 0 HD2 TYR A 115 12.491 1.716 -11.056 1.00 0.74 H new ATOM 0 HE1 TYR A 115 11.569 -3.154 -10.858 1.00 0.65 H new ATOM 0 HE2 TYR A 115 13.476 0.196 -12.751 1.00 0.82 H new ATOM 0 HH TYR A 115 12.786 -3.327 -12.723 1.00 0.87 H new ATOM 976 N HIS A 116 12.777 3.048 -7.866 1.00 0.58 N ATOM 977 CA HIS A 116 13.991 3.926 -7.905 1.00 0.67 C ATOM 978 C HIS A 116 14.689 3.961 -6.539 1.00 0.67 C ATOM 979 O HIS A 116 15.548 4.787 -6.307 1.00 0.81 O ATOM 980 CB HIS A 116 13.572 5.346 -8.291 1.00 0.79 C ATOM 981 CG HIS A 116 13.166 5.368 -9.739 1.00 1.20 C ATOM 982 ND1 HIS A 116 11.891 5.734 -10.144 1.00 1.99 N ATOM 983 CD2 HIS A 116 13.854 5.072 -10.889 1.00 2.05 C ATOM 984 CE1 HIS A 116 11.853 5.649 -11.487 1.00 2.71 C ATOM 985 NE2 HIS A 116 13.023 5.249 -11.992 1.00 2.74 N ATOM 0 H HIS A 116 11.893 3.527 -8.035 1.00 0.58 H new ATOM 0 HA HIS A 116 14.687 3.522 -8.640 1.00 0.67 H new ATOM 0 HB2 HIS A 116 12.744 5.676 -7.664 1.00 0.79 H new ATOM 0 HB3 HIS A 116 14.396 6.039 -8.122 1.00 0.79 H new ATOM 0 HD2 HIS A 116 14.884 4.750 -10.932 1.00 2.05 H new ATOM 0 HE1 HIS A 116 10.982 5.877 -12.084 1.00 2.71 H new ATOM 0 HE2 HIS A 116 13.257 5.104 -12.974 1.00 2.74 H new ATOM 993 N THR A 117 14.336 3.079 -5.634 1.00 0.63 N ATOM 994 CA THR A 117 14.991 3.067 -4.281 1.00 0.68 C ATOM 995 C THR A 117 15.554 1.674 -3.997 1.00 0.66 C ATOM 996 O THR A 117 16.732 1.422 -4.163 1.00 0.73 O ATOM 997 CB THR A 117 13.959 3.419 -3.210 1.00 0.80 C ATOM 998 OG1 THR A 117 12.931 2.442 -3.210 1.00 0.85 O ATOM 999 CG2 THR A 117 13.360 4.798 -3.496 1.00 0.91 C ATOM 0 H THR A 117 13.621 2.364 -5.772 1.00 0.63 H new ATOM 0 HA THR A 117 15.799 3.799 -4.266 1.00 0.68 H new ATOM 0 HB THR A 117 14.444 3.439 -2.234 1.00 0.80 H new ATOM 0 HG1 THR A 117 12.807 2.098 -4.119 1.00 0.85 H new ATOM 0 HG21 THR A 117 12.625 5.042 -2.729 1.00 0.91 H new ATOM 0 HG22 THR A 117 14.152 5.547 -3.491 1.00 0.91 H new ATOM 0 HG23 THR A 117 12.875 4.789 -4.472 1.00 0.91 H new ATOM 1007 N GLN A 118 14.723 0.768 -3.559 1.00 0.73 N ATOM 1008 CA GLN A 118 15.209 -0.607 -3.253 1.00 0.83 C ATOM 1009 C GLN A 118 15.293 -1.422 -4.547 1.00 0.72 C ATOM 1010 O GLN A 118 16.106 -2.316 -4.675 1.00 0.91 O ATOM 1011 CB GLN A 118 14.236 -1.275 -2.282 1.00 1.06 C ATOM 1012 CG GLN A 118 14.006 -0.355 -1.081 1.00 1.48 C ATOM 1013 CD GLN A 118 13.037 -1.018 -0.098 1.00 2.12 C ATOM 1014 OE1 GLN A 118 13.154 -0.844 1.098 1.00 2.89 O ATOM 1015 NE2 GLN A 118 12.079 -1.775 -0.555 1.00 2.13 N ATOM 0 H GLN A 118 13.727 0.921 -3.400 1.00 0.73 H new ATOM 0 HA GLN A 118 16.199 -0.556 -2.800 1.00 0.83 H new ATOM 0 HB2 GLN A 118 13.290 -1.482 -2.782 1.00 1.06 H new ATOM 0 HB3 GLN A 118 14.637 -2.233 -1.949 1.00 1.06 H new ATOM 0 HG2 GLN A 118 14.954 -0.145 -0.586 1.00 1.48 H new ATOM 0 HG3 GLN A 118 13.602 0.601 -1.415 1.00 1.48 H new ATOM 0 HE21 GLN A 118 11.980 -1.922 -1.560 1.00 2.13 H new ATOM 0 HE22 GLN A 118 11.428 -2.221 0.092 1.00 2.13 H new ATOM 1024 N GLY A 119 14.474 -1.108 -5.513 1.00 0.86 N ATOM 1025 CA GLY A 119 14.521 -1.851 -6.807 1.00 0.85 C ATOM 1026 C GLY A 119 13.745 -3.169 -6.706 1.00 0.65 C ATOM 1027 O GLY A 119 13.836 -4.012 -7.577 1.00 0.67 O ATOM 0 H GLY A 119 13.773 -0.369 -5.463 1.00 0.86 H new ATOM 0 HA2 GLY A 119 14.099 -1.235 -7.601 1.00 0.85 H new ATOM 0 HA3 GLY A 119 15.557 -2.054 -7.078 1.00 0.85 H new ATOM 1031 N TYR A 120 12.975 -3.362 -5.668 1.00 0.54 N ATOM 1032 CA TYR A 120 12.203 -4.635 -5.557 1.00 0.44 C ATOM 1033 C TYR A 120 11.002 -4.575 -6.504 1.00 0.49 C ATOM 1034 O TYR A 120 10.337 -3.564 -6.612 1.00 0.70 O ATOM 1035 CB TYR A 120 11.697 -4.828 -4.120 1.00 0.48 C ATOM 1036 CG TYR A 120 12.826 -5.305 -3.227 1.00 0.52 C ATOM 1037 CD1 TYR A 120 13.448 -6.538 -3.470 1.00 0.58 C ATOM 1038 CD2 TYR A 120 13.248 -4.514 -2.153 1.00 0.60 C ATOM 1039 CE1 TYR A 120 14.489 -6.972 -2.639 1.00 0.71 C ATOM 1040 CE2 TYR A 120 14.287 -4.948 -1.324 1.00 0.71 C ATOM 1041 CZ TYR A 120 14.909 -6.177 -1.566 1.00 0.75 C ATOM 1042 OH TYR A 120 15.934 -6.604 -0.749 1.00 0.91 O ATOM 0 H TYR A 120 12.848 -2.702 -4.901 1.00 0.54 H new ATOM 0 HA TYR A 120 12.853 -5.469 -5.821 1.00 0.44 H new ATOM 0 HB2 TYR A 120 11.294 -3.889 -3.739 1.00 0.48 H new ATOM 0 HB3 TYR A 120 10.883 -5.553 -4.108 1.00 0.48 H new ATOM 0 HD1 TYR A 120 13.125 -7.153 -4.297 1.00 0.58 H new ATOM 0 HD2 TYR A 120 12.769 -3.565 -1.963 1.00 0.60 H new ATOM 0 HE1 TYR A 120 14.968 -7.921 -2.826 1.00 0.71 H new ATOM 0 HE2 TYR A 120 14.609 -4.334 -0.496 1.00 0.71 H new ATOM 0 HH TYR A 120 16.100 -5.933 -0.055 1.00 0.91 H new ATOM 1052 N PHE A 121 10.710 -5.651 -7.182 1.00 0.48 N ATOM 1053 CA PHE A 121 9.542 -5.650 -8.107 1.00 0.57 C ATOM 1054 C PHE A 121 8.260 -5.830 -7.270 1.00 0.55 C ATOM 1055 O PHE A 121 8.293 -6.446 -6.224 1.00 0.59 O ATOM 1056 CB PHE A 121 9.675 -6.819 -9.101 1.00 0.68 C ATOM 1057 CG PHE A 121 10.500 -6.403 -10.301 1.00 1.42 C ATOM 1058 CD1 PHE A 121 11.896 -6.355 -10.212 1.00 2.32 C ATOM 1059 CD2 PHE A 121 9.866 -6.076 -11.506 1.00 2.33 C ATOM 1060 CE1 PHE A 121 12.656 -5.979 -11.326 1.00 3.44 C ATOM 1061 CE2 PHE A 121 10.626 -5.699 -12.619 1.00 3.43 C ATOM 1062 CZ PHE A 121 12.020 -5.652 -12.530 1.00 3.85 C ATOM 0 H PHE A 121 11.228 -6.528 -7.136 1.00 0.48 H new ATOM 0 HA PHE A 121 9.501 -4.713 -8.662 1.00 0.57 H new ATOM 0 HB2 PHE A 121 10.143 -7.672 -8.609 1.00 0.68 H new ATOM 0 HB3 PHE A 121 8.686 -7.142 -9.426 1.00 0.68 H new ATOM 0 HD1 PHE A 121 12.387 -6.608 -9.284 1.00 2.32 H new ATOM 0 HD2 PHE A 121 8.789 -6.115 -11.577 1.00 2.33 H new ATOM 0 HE1 PHE A 121 13.733 -5.941 -11.257 1.00 3.44 H new ATOM 0 HE2 PHE A 121 10.135 -5.444 -13.547 1.00 3.43 H new ATOM 0 HZ PHE A 121 12.607 -5.364 -13.390 1.00 3.85 H new ATOM 1072 N PRO A 122 7.140 -5.309 -7.717 1.00 0.64 N ATOM 1073 CA PRO A 122 5.848 -5.439 -6.978 1.00 0.67 C ATOM 1074 C PRO A 122 5.183 -6.806 -7.195 1.00 0.73 C ATOM 1075 O PRO A 122 3.981 -6.909 -7.329 1.00 1.19 O ATOM 1076 CB PRO A 122 4.996 -4.321 -7.584 1.00 0.80 C ATOM 1077 CG PRO A 122 5.464 -4.230 -9.000 1.00 1.05 C ATOM 1078 CD PRO A 122 6.967 -4.535 -8.965 1.00 0.87 C ATOM 0 HA PRO A 122 5.979 -5.363 -5.899 1.00 0.67 H new ATOM 0 HB2 PRO A 122 3.933 -4.557 -7.530 1.00 0.80 H new ATOM 0 HB3 PRO A 122 5.141 -3.379 -7.055 1.00 0.80 H new ATOM 0 HG2 PRO A 122 4.935 -4.943 -9.633 1.00 1.05 H new ATOM 0 HG3 PRO A 122 5.276 -3.238 -9.411 1.00 1.05 H new ATOM 0 HD2 PRO A 122 7.279 -5.108 -9.838 1.00 0.87 H new ATOM 0 HD3 PRO A 122 7.561 -3.621 -8.955 1.00 0.87 H new ATOM 1086 N ASP A 123 5.957 -7.854 -7.220 1.00 0.56 N ATOM 1087 CA ASP A 123 5.373 -9.212 -7.416 1.00 0.64 C ATOM 1088 C ASP A 123 4.963 -9.768 -6.055 1.00 0.58 C ATOM 1089 O ASP A 123 4.898 -10.965 -5.856 1.00 0.65 O ATOM 1090 CB ASP A 123 6.417 -10.132 -8.052 1.00 0.74 C ATOM 1091 CG ASP A 123 7.702 -10.097 -7.223 1.00 0.77 C ATOM 1092 OD1 ASP A 123 7.604 -9.882 -6.026 1.00 1.27 O ATOM 1093 OD2 ASP A 123 8.761 -10.285 -7.798 1.00 1.38 O ATOM 0 H ASP A 123 6.971 -7.830 -7.113 1.00 0.56 H new ATOM 0 HA ASP A 123 4.504 -9.153 -8.071 1.00 0.64 H new ATOM 0 HB2 ASP A 123 6.034 -11.151 -8.106 1.00 0.74 H new ATOM 0 HB3 ASP A 123 6.623 -9.814 -9.074 1.00 0.74 H new ATOM 1098 N TRP A 124 4.698 -8.898 -5.112 1.00 0.53 N ATOM 1099 CA TRP A 124 4.299 -9.346 -3.740 1.00 0.52 C ATOM 1100 C TRP A 124 3.009 -8.654 -3.329 1.00 0.51 C ATOM 1101 O TRP A 124 2.235 -9.158 -2.540 1.00 0.55 O ATOM 1102 CB TRP A 124 5.409 -8.977 -2.754 1.00 0.49 C ATOM 1103 CG TRP A 124 5.764 -7.532 -2.928 1.00 0.43 C ATOM 1104 CD1 TRP A 124 6.696 -7.056 -3.790 1.00 0.44 C ATOM 1105 CD2 TRP A 124 5.211 -6.368 -2.245 1.00 0.42 C ATOM 1106 NE1 TRP A 124 6.751 -5.680 -3.675 1.00 0.42 N ATOM 1107 CE2 TRP A 124 5.854 -5.208 -2.737 1.00 0.41 C ATOM 1108 CE3 TRP A 124 4.224 -6.209 -1.256 1.00 0.51 C ATOM 1109 CZ2 TRP A 124 5.530 -3.935 -2.266 1.00 0.46 C ATOM 1110 CZ3 TRP A 124 3.895 -4.929 -0.779 1.00 0.58 C ATOM 1111 CH2 TRP A 124 4.548 -3.795 -1.283 1.00 0.55 C ATOM 0 H TRP A 124 4.741 -7.886 -5.235 1.00 0.53 H new ATOM 0 HA TRP A 124 4.143 -10.425 -3.738 1.00 0.52 H new ATOM 0 HB2 TRP A 124 5.080 -9.162 -1.732 1.00 0.49 H new ATOM 0 HB3 TRP A 124 6.286 -9.602 -2.925 1.00 0.49 H new ATOM 0 HD1 TRP A 124 7.298 -7.655 -4.458 1.00 0.44 H new ATOM 0 HE1 TRP A 124 7.378 -5.085 -4.217 1.00 0.42 H new ATOM 0 HE3 TRP A 124 3.716 -7.076 -0.861 1.00 0.51 H new ATOM 0 HZ2 TRP A 124 6.035 -3.065 -2.659 1.00 0.46 H new ATOM 0 HZ3 TRP A 124 3.135 -4.818 -0.020 1.00 0.58 H new ATOM 0 HH2 TRP A 124 4.292 -2.814 -0.911 1.00 0.55 H new ATOM 1122 N GLN A 125 2.779 -7.501 -3.864 1.00 0.53 N ATOM 1123 CA GLN A 125 1.534 -6.747 -3.519 1.00 0.60 C ATOM 1124 C GLN A 125 0.350 -7.319 -4.311 1.00 0.66 C ATOM 1125 O GLN A 125 0.212 -7.078 -5.494 1.00 0.84 O ATOM 1126 CB GLN A 125 1.717 -5.254 -3.845 1.00 0.69 C ATOM 1127 CG GLN A 125 2.598 -5.096 -5.086 1.00 1.56 C ATOM 1128 CD GLN A 125 2.608 -3.629 -5.520 1.00 2.18 C ATOM 1129 OE1 GLN A 125 3.587 -2.935 -5.328 1.00 2.78 O ATOM 1130 NE2 GLN A 125 1.554 -3.124 -6.103 1.00 2.82 N ATOM 0 H GLN A 125 3.396 -7.036 -4.530 1.00 0.53 H new ATOM 0 HA GLN A 125 1.334 -6.851 -2.453 1.00 0.60 H new ATOM 0 HB2 GLN A 125 0.746 -4.789 -4.016 1.00 0.69 H new ATOM 0 HB3 GLN A 125 2.172 -4.741 -2.998 1.00 0.69 H new ATOM 0 HG2 GLN A 125 3.613 -5.429 -4.870 1.00 1.56 H new ATOM 0 HG3 GLN A 125 2.222 -5.723 -5.894 1.00 1.56 H new ATOM 0 HE21 GLN A 125 0.732 -3.706 -6.264 1.00 2.82 H new ATOM 0 HE22 GLN A 125 1.553 -2.147 -6.397 1.00 2.82 H new ATOM 1139 N ASN A 126 -0.508 -8.071 -3.669 1.00 0.64 N ATOM 1140 CA ASN A 126 -1.679 -8.651 -4.394 1.00 0.72 C ATOM 1141 C ASN A 126 -2.779 -9.031 -3.396 1.00 0.69 C ATOM 1142 O ASN A 126 -2.808 -10.126 -2.879 1.00 1.22 O ATOM 1143 CB ASN A 126 -1.239 -9.906 -5.152 1.00 0.84 C ATOM 1144 CG ASN A 126 -0.293 -9.519 -6.288 1.00 0.89 C ATOM 1145 OD1 ASN A 126 -0.638 -8.722 -7.138 1.00 1.53 O ATOM 1146 ND2 ASN A 126 0.897 -10.052 -6.339 1.00 0.88 N ATOM 0 H ASN A 126 -0.449 -8.308 -2.679 1.00 0.64 H new ATOM 0 HA ASN A 126 -2.065 -7.909 -5.093 1.00 0.72 H new ATOM 0 HB2 ASN A 126 -0.742 -10.597 -4.472 1.00 0.84 H new ATOM 0 HB3 ASN A 126 -2.110 -10.424 -5.552 1.00 0.84 H new ATOM 0 HD21 ASN A 126 1.537 -9.800 -7.092 1.00 0.88 H new ATOM 0 HD22 ASN A 126 1.187 -10.721 -5.626 1.00 0.88 H new ATOM 1153 N TYR A 127 -3.688 -8.139 -3.119 1.00 0.69 N ATOM 1154 CA TYR A 127 -4.784 -8.468 -2.161 1.00 0.61 C ATOM 1155 C TYR A 127 -5.725 -9.500 -2.785 1.00 0.63 C ATOM 1156 O TYR A 127 -5.359 -10.219 -3.691 1.00 0.75 O ATOM 1157 CB TYR A 127 -5.561 -7.192 -1.820 1.00 0.65 C ATOM 1158 CG TYR A 127 -4.592 -6.045 -1.678 1.00 0.79 C ATOM 1159 CD1 TYR A 127 -4.224 -5.300 -2.805 1.00 0.93 C ATOM 1160 CD2 TYR A 127 -4.059 -5.727 -0.423 1.00 0.98 C ATOM 1161 CE1 TYR A 127 -3.323 -4.236 -2.677 1.00 1.14 C ATOM 1162 CE2 TYR A 127 -3.158 -4.662 -0.295 1.00 1.19 C ATOM 1163 CZ TYR A 127 -2.790 -3.916 -1.422 1.00 1.23 C ATOM 1164 OH TYR A 127 -1.902 -2.867 -1.296 1.00 1.48 O ATOM 0 H TYR A 127 -3.721 -7.198 -3.512 1.00 0.69 H new ATOM 0 HA TYR A 127 -4.357 -8.885 -1.249 1.00 0.61 H new ATOM 0 HB2 TYR A 127 -6.288 -6.975 -2.602 1.00 0.65 H new ATOM 0 HB3 TYR A 127 -6.120 -7.329 -0.894 1.00 0.65 H new ATOM 0 HD1 TYR A 127 -4.635 -5.546 -3.773 1.00 0.93 H new ATOM 0 HD2 TYR A 127 -4.342 -6.302 0.446 1.00 0.98 H new ATOM 0 HE1 TYR A 127 -3.039 -3.662 -3.546 1.00 1.14 H new ATOM 0 HE2 TYR A 127 -2.747 -4.416 0.673 1.00 1.19 H new ATOM 0 HH TYR A 127 -1.630 -2.780 -0.359 1.00 1.48 H new ATOM 1174 N THR A 128 -6.937 -9.574 -2.306 1.00 0.62 N ATOM 1175 CA THR A 128 -7.898 -10.566 -2.878 1.00 0.68 C ATOM 1176 C THR A 128 -9.333 -10.258 -2.419 1.00 0.75 C ATOM 1177 O THR A 128 -9.545 -9.699 -1.362 1.00 0.97 O ATOM 1178 CB THR A 128 -7.533 -11.970 -2.388 1.00 0.86 C ATOM 1179 OG1 THR A 128 -8.672 -12.815 -2.446 1.00 1.22 O ATOM 1180 CG2 THR A 128 -7.065 -11.889 -0.942 1.00 0.90 C ATOM 0 H THR A 128 -7.303 -8.996 -1.549 1.00 0.62 H new ATOM 0 HA THR A 128 -7.842 -10.508 -3.965 1.00 0.68 H new ATOM 0 HB THR A 128 -6.744 -12.373 -3.022 1.00 0.86 H new ATOM 0 HG1 THR A 128 -8.430 -13.712 -2.133 1.00 1.22 H new ATOM 0 HG21 THR A 128 -6.804 -12.886 -0.588 1.00 0.90 H new ATOM 0 HG22 THR A 128 -6.191 -11.241 -0.878 1.00 0.90 H new ATOM 0 HG23 THR A 128 -7.865 -11.482 -0.323 1.00 0.90 H new ATOM 1188 N PRO A 129 -10.311 -10.634 -3.217 1.00 0.88 N ATOM 1189 CA PRO A 129 -11.754 -10.418 -2.907 1.00 1.15 C ATOM 1190 C PRO A 129 -12.089 -10.600 -1.421 1.00 1.51 C ATOM 1191 O PRO A 129 -11.291 -11.082 -0.643 1.00 2.29 O ATOM 1192 CB PRO A 129 -12.455 -11.496 -3.743 1.00 1.51 C ATOM 1193 CG PRO A 129 -11.574 -11.701 -4.940 1.00 1.27 C ATOM 1194 CD PRO A 129 -10.145 -11.303 -4.522 1.00 1.09 C ATOM 0 HA PRO A 129 -12.062 -9.398 -3.135 1.00 1.15 H new ATOM 0 HB2 PRO A 129 -12.571 -12.420 -3.177 1.00 1.51 H new ATOM 0 HB3 PRO A 129 -13.454 -11.177 -4.040 1.00 1.51 H new ATOM 0 HG2 PRO A 129 -11.604 -12.740 -5.268 1.00 1.27 H new ATOM 0 HG3 PRO A 129 -11.914 -11.092 -5.778 1.00 1.27 H new ATOM 0 HD2 PRO A 129 -9.498 -12.177 -4.440 1.00 1.09 H new ATOM 0 HD3 PRO A 129 -9.689 -10.636 -5.254 1.00 1.09 H new ATOM 1202 N GLY A 130 -13.279 -10.222 -1.033 1.00 1.64 N ATOM 1203 CA GLY A 130 -13.702 -10.366 0.393 1.00 2.18 C ATOM 1204 C GLY A 130 -14.434 -9.096 0.821 1.00 1.76 C ATOM 1205 O GLY A 130 -14.683 -8.217 0.021 1.00 1.92 O ATOM 0 H GLY A 130 -13.983 -9.816 -1.649 1.00 1.64 H new ATOM 0 HA2 GLY A 130 -14.352 -11.233 0.508 1.00 2.18 H new ATOM 0 HA3 GLY A 130 -12.833 -10.533 1.029 1.00 2.18 H new ATOM 1209 N PRO A 131 -14.772 -8.996 2.077 1.00 1.94 N ATOM 1210 CA PRO A 131 -15.481 -7.804 2.618 1.00 2.04 C ATOM 1211 C PRO A 131 -14.805 -6.502 2.174 1.00 1.43 C ATOM 1212 O PRO A 131 -13.731 -6.516 1.606 1.00 1.44 O ATOM 1213 CB PRO A 131 -15.387 -7.989 4.140 1.00 2.91 C ATOM 1214 CG PRO A 131 -15.274 -9.469 4.338 1.00 3.25 C ATOM 1215 CD PRO A 131 -14.514 -10.005 3.120 1.00 2.75 C ATOM 0 HA PRO A 131 -16.509 -7.729 2.263 1.00 2.04 H new ATOM 0 HB2 PRO A 131 -14.522 -7.468 4.549 1.00 2.91 H new ATOM 0 HB3 PRO A 131 -16.267 -7.589 4.643 1.00 2.91 H new ATOM 0 HG2 PRO A 131 -14.742 -9.699 5.261 1.00 3.25 H new ATOM 0 HG3 PRO A 131 -16.260 -9.928 4.415 1.00 3.25 H new ATOM 0 HD2 PRO A 131 -13.448 -10.106 3.325 1.00 2.75 H new ATOM 0 HD3 PRO A 131 -14.876 -10.989 2.823 1.00 2.75 H new ATOM 1223 N GLY A 132 -15.417 -5.378 2.425 1.00 1.58 N ATOM 1224 CA GLY A 132 -14.792 -4.089 2.009 1.00 1.44 C ATOM 1225 C GLY A 132 -13.342 -4.049 2.493 1.00 1.21 C ATOM 1226 O GLY A 132 -12.564 -3.207 2.093 1.00 1.21 O ATOM 0 H GLY A 132 -16.317 -5.295 2.897 1.00 1.58 H new ATOM 0 HA2 GLY A 132 -14.828 -3.988 0.924 1.00 1.44 H new ATOM 0 HA3 GLY A 132 -15.350 -3.250 2.426 1.00 1.44 H new ATOM 1230 N ILE A 133 -12.975 -4.959 3.356 1.00 1.11 N ATOM 1231 CA ILE A 133 -11.579 -4.989 3.880 1.00 0.94 C ATOM 1232 C ILE A 133 -10.731 -5.896 2.979 1.00 0.92 C ATOM 1233 O ILE A 133 -10.710 -7.100 3.142 1.00 1.52 O ATOM 1234 CB ILE A 133 -11.583 -5.550 5.312 1.00 0.99 C ATOM 1235 CG1 ILE A 133 -12.226 -4.540 6.280 1.00 1.14 C ATOM 1236 CG2 ILE A 133 -10.142 -5.819 5.759 1.00 0.98 C ATOM 1237 CD1 ILE A 133 -13.639 -4.175 5.819 1.00 1.56 C ATOM 0 H ILE A 133 -13.587 -5.688 3.723 1.00 1.11 H new ATOM 0 HA ILE A 133 -11.164 -3.981 3.888 1.00 0.94 H new ATOM 0 HB ILE A 133 -12.158 -6.476 5.324 1.00 0.99 H new ATOM 0 HG12 ILE A 133 -12.263 -4.963 7.284 1.00 1.14 H new ATOM 0 HG13 ILE A 133 -11.612 -3.641 6.336 1.00 1.14 H new ATOM 0 HG21 ILE A 133 -10.144 -6.217 6.774 1.00 0.98 H new ATOM 0 HG22 ILE A 133 -9.682 -6.543 5.087 1.00 0.98 H new ATOM 0 HG23 ILE A 133 -9.574 -4.889 5.735 1.00 0.98 H new ATOM 0 HD11 ILE A 133 -14.076 -3.460 6.516 1.00 1.56 H new ATOM 0 HD12 ILE A 133 -13.594 -3.731 4.825 1.00 1.56 H new ATOM 0 HD13 ILE A 133 -14.255 -5.074 5.787 1.00 1.56 H new ATOM 1249 N ARG A 134 -10.030 -5.330 2.035 1.00 0.51 N ATOM 1250 CA ARG A 134 -9.184 -6.172 1.136 1.00 0.49 C ATOM 1251 C ARG A 134 -7.925 -6.611 1.890 1.00 0.40 C ATOM 1252 O ARG A 134 -7.117 -5.792 2.301 1.00 0.38 O ATOM 1253 CB ARG A 134 -8.795 -5.378 -0.112 1.00 0.58 C ATOM 1254 CG ARG A 134 -10.035 -5.168 -0.985 1.00 1.06 C ATOM 1255 CD ARG A 134 -9.705 -4.197 -2.122 1.00 1.37 C ATOM 1256 NE ARG A 134 -10.814 -4.206 -3.117 1.00 1.86 N ATOM 1257 CZ ARG A 134 -10.899 -3.260 -4.012 1.00 2.52 C ATOM 1258 NH1 ARG A 134 -10.009 -2.307 -4.043 1.00 2.83 N ATOM 1259 NH2 ARG A 134 -11.876 -3.269 -4.877 1.00 3.36 N ATOM 0 H ARG A 134 -10.005 -4.328 1.846 1.00 0.51 H new ATOM 0 HA ARG A 134 -9.748 -7.052 0.829 1.00 0.49 H new ATOM 0 HB2 ARG A 134 -8.370 -4.416 0.173 1.00 0.58 H new ATOM 0 HB3 ARG A 134 -8.028 -5.912 -0.672 1.00 0.58 H new ATOM 0 HG2 ARG A 134 -10.370 -6.121 -1.393 1.00 1.06 H new ATOM 0 HG3 ARG A 134 -10.854 -4.774 -0.383 1.00 1.06 H new ATOM 0 HD2 ARG A 134 -9.564 -3.191 -1.727 1.00 1.37 H new ATOM 0 HD3 ARG A 134 -8.769 -4.485 -2.601 1.00 1.37 H new ATOM 0 HE ARG A 134 -11.508 -4.953 -3.099 1.00 1.86 H new ATOM 0 HH11 ARG A 134 -9.245 -2.300 -3.367 1.00 2.83 H new ATOM 0 HH12 ARG A 134 -10.077 -1.568 -4.743 1.00 2.83 H new ATOM 0 HH21 ARG A 134 -12.572 -4.015 -4.853 1.00 3.36 H new ATOM 0 HH22 ARG A 134 -11.944 -2.530 -5.577 1.00 3.36 H new ATOM 1273 N TYR A 135 -7.766 -7.897 2.087 1.00 0.41 N ATOM 1274 CA TYR A 135 -6.578 -8.415 2.831 1.00 0.39 C ATOM 1275 C TYR A 135 -5.404 -8.671 1.865 1.00 0.36 C ATOM 1276 O TYR A 135 -5.618 -8.981 0.705 1.00 0.39 O ATOM 1277 CB TYR A 135 -6.949 -9.741 3.501 1.00 0.46 C ATOM 1278 CG TYR A 135 -7.901 -9.495 4.646 1.00 0.50 C ATOM 1279 CD1 TYR A 135 -9.283 -9.502 4.423 1.00 0.72 C ATOM 1280 CD2 TYR A 135 -7.401 -9.268 5.934 1.00 0.66 C ATOM 1281 CE1 TYR A 135 -10.165 -9.282 5.488 1.00 0.91 C ATOM 1282 CE2 TYR A 135 -8.283 -9.046 6.998 1.00 0.85 C ATOM 1283 CZ TYR A 135 -9.665 -9.055 6.776 1.00 0.92 C ATOM 1284 OH TYR A 135 -10.534 -8.840 7.826 1.00 1.17 O ATOM 0 H TYR A 135 -8.414 -8.614 1.761 1.00 0.41 H new ATOM 0 HA TYR A 135 -6.280 -7.674 3.573 1.00 0.39 H new ATOM 0 HB2 TYR A 135 -7.409 -10.409 2.773 1.00 0.46 H new ATOM 0 HB3 TYR A 135 -6.050 -10.237 3.866 1.00 0.46 H new ATOM 0 HD1 TYR A 135 -9.669 -9.677 3.430 1.00 0.72 H new ATOM 0 HD2 TYR A 135 -6.335 -9.264 6.107 1.00 0.66 H new ATOM 0 HE1 TYR A 135 -11.231 -9.287 5.316 1.00 0.91 H new ATOM 0 HE2 TYR A 135 -7.897 -8.868 7.991 1.00 0.85 H new ATOM 0 HH TYR A 135 -10.023 -8.700 8.650 1.00 1.17 H new ATOM 1294 N PRO A 136 -4.172 -8.577 2.347 1.00 0.37 N ATOM 1295 CA PRO A 136 -2.951 -8.839 1.519 1.00 0.38 C ATOM 1296 C PRO A 136 -2.630 -10.340 1.442 1.00 0.37 C ATOM 1297 O PRO A 136 -2.523 -11.007 2.453 1.00 0.38 O ATOM 1298 CB PRO A 136 -1.856 -8.107 2.294 1.00 0.42 C ATOM 1299 CG PRO A 136 -2.260 -8.260 3.722 1.00 0.51 C ATOM 1300 CD PRO A 136 -3.795 -8.200 3.729 1.00 0.44 C ATOM 0 HA PRO A 136 -3.064 -8.509 0.486 1.00 0.38 H new ATOM 0 HB2 PRO A 136 -0.875 -8.544 2.108 1.00 0.42 H new ATOM 0 HB3 PRO A 136 -1.797 -7.057 2.006 1.00 0.42 H new ATOM 0 HG2 PRO A 136 -1.903 -9.206 4.131 1.00 0.51 H new ATOM 0 HG3 PRO A 136 -1.834 -7.467 4.336 1.00 0.51 H new ATOM 0 HD2 PRO A 136 -4.218 -8.888 4.461 1.00 0.44 H new ATOM 0 HD3 PRO A 136 -4.155 -7.203 3.984 1.00 0.44 H new ATOM 1308 N LEU A 137 -2.476 -10.883 0.264 1.00 0.40 N ATOM 1309 CA LEU A 137 -2.164 -12.341 0.158 1.00 0.43 C ATOM 1310 C LEU A 137 -0.802 -12.627 0.795 1.00 0.41 C ATOM 1311 O LEU A 137 -0.689 -13.442 1.689 1.00 0.38 O ATOM 1312 CB LEU A 137 -2.141 -12.774 -1.315 1.00 0.51 C ATOM 1313 CG LEU A 137 -3.558 -12.693 -1.912 1.00 0.59 C ATOM 1314 CD1 LEU A 137 -3.494 -12.770 -3.448 1.00 0.64 C ATOM 1315 CD2 LEU A 137 -4.432 -13.855 -1.401 1.00 0.92 C ATOM 0 H LEU A 137 -2.552 -10.386 -0.624 1.00 0.40 H new ATOM 0 HA LEU A 137 -2.937 -12.903 0.682 1.00 0.43 H new ATOM 0 HB2 LEU A 137 -1.463 -12.134 -1.880 1.00 0.51 H new ATOM 0 HB3 LEU A 137 -1.761 -13.792 -1.397 1.00 0.51 H new ATOM 0 HG LEU A 137 -3.996 -11.744 -1.603 1.00 0.59 H new ATOM 0 HD11 LEU A 137 -4.502 -12.712 -3.858 1.00 0.64 H new ATOM 0 HD12 LEU A 137 -2.899 -11.940 -3.829 1.00 0.64 H new ATOM 0 HD13 LEU A 137 -3.035 -13.713 -3.746 1.00 0.64 H new ATOM 0 HD21 LEU A 137 -5.429 -13.779 -1.835 1.00 0.92 H new ATOM 0 HD22 LEU A 137 -3.982 -14.804 -1.691 1.00 0.92 H new ATOM 0 HD23 LEU A 137 -4.505 -13.805 -0.315 1.00 0.92 H new ATOM 1327 N THR A 138 0.233 -11.971 0.347 1.00 0.50 N ATOM 1328 CA THR A 138 1.577 -12.228 0.938 1.00 0.55 C ATOM 1329 C THR A 138 1.570 -11.812 2.410 1.00 0.47 C ATOM 1330 O THR A 138 0.843 -10.926 2.816 1.00 0.50 O ATOM 1331 CB THR A 138 2.646 -11.427 0.173 1.00 0.73 C ATOM 1332 OG1 THR A 138 2.087 -10.200 -0.273 1.00 0.98 O ATOM 1333 CG2 THR A 138 3.132 -12.234 -1.035 1.00 1.04 C ATOM 0 H THR A 138 0.208 -11.273 -0.397 1.00 0.50 H new ATOM 0 HA THR A 138 1.810 -13.290 0.862 1.00 0.55 H new ATOM 0 HB THR A 138 3.488 -11.227 0.835 1.00 0.73 H new ATOM 0 HG1 THR A 138 2.106 -10.169 -1.252 1.00 0.98 H new ATOM 0 HG21 THR A 138 3.888 -11.663 -1.573 1.00 1.04 H new ATOM 0 HG22 THR A 138 3.562 -13.176 -0.694 1.00 1.04 H new ATOM 0 HG23 THR A 138 2.291 -12.438 -1.698 1.00 1.04 H new ATOM 1341 N PHE A 139 2.377 -12.454 3.209 1.00 0.51 N ATOM 1342 CA PHE A 139 2.434 -12.115 4.664 1.00 0.49 C ATOM 1343 C PHE A 139 3.575 -11.132 4.917 1.00 0.65 C ATOM 1344 O PHE A 139 4.451 -10.954 4.094 1.00 1.43 O ATOM 1345 CB PHE A 139 2.674 -13.390 5.476 1.00 0.52 C ATOM 1346 CG PHE A 139 2.687 -13.056 6.953 1.00 0.50 C ATOM 1347 CD1 PHE A 139 1.525 -12.577 7.572 1.00 0.67 C ATOM 1348 CD2 PHE A 139 3.858 -13.228 7.705 1.00 0.59 C ATOM 1349 CE1 PHE A 139 1.532 -12.273 8.939 1.00 0.77 C ATOM 1350 CE2 PHE A 139 3.865 -12.922 9.072 1.00 0.62 C ATOM 1351 CZ PHE A 139 2.702 -12.446 9.689 1.00 0.66 C ATOM 0 H PHE A 139 3.004 -13.204 2.917 1.00 0.51 H new ATOM 0 HA PHE A 139 1.490 -11.661 4.966 1.00 0.49 H new ATOM 0 HB2 PHE A 139 1.893 -14.120 5.265 1.00 0.52 H new ATOM 0 HB3 PHE A 139 3.622 -13.844 5.187 1.00 0.52 H new ATOM 0 HD1 PHE A 139 0.623 -12.442 6.994 1.00 0.67 H new ATOM 0 HD2 PHE A 139 4.755 -13.597 7.230 1.00 0.59 H new ATOM 0 HE1 PHE A 139 0.635 -11.905 9.415 1.00 0.77 H new ATOM 0 HE2 PHE A 139 4.768 -13.053 9.650 1.00 0.62 H new ATOM 0 HZ PHE A 139 2.707 -12.212 10.743 1.00 0.66 H new ATOM 1361 N GLY A 140 3.570 -10.486 6.052 1.00 0.46 N ATOM 1362 CA GLY A 140 4.646 -9.504 6.372 1.00 0.43 C ATOM 1363 C GLY A 140 4.156 -8.107 6.008 1.00 0.35 C ATOM 1364 O GLY A 140 4.389 -7.147 6.716 1.00 0.32 O ATOM 0 H GLY A 140 2.861 -10.598 6.777 1.00 0.46 H new ATOM 0 HA2 GLY A 140 4.899 -9.552 7.431 1.00 0.43 H new ATOM 0 HA3 GLY A 140 5.553 -9.743 5.817 1.00 0.43 H new ATOM 1368 N TRP A 141 3.463 -7.991 4.910 1.00 0.34 N ATOM 1369 CA TRP A 141 2.935 -6.663 4.495 1.00 0.29 C ATOM 1370 C TRP A 141 1.715 -6.353 5.354 1.00 0.32 C ATOM 1371 O TRP A 141 0.615 -6.792 5.085 1.00 0.40 O ATOM 1372 CB TRP A 141 2.571 -6.715 3.008 1.00 0.33 C ATOM 1373 CG TRP A 141 2.271 -5.349 2.462 1.00 0.31 C ATOM 1374 CD1 TRP A 141 1.153 -5.045 1.764 1.00 0.35 C ATOM 1375 CD2 TRP A 141 3.063 -4.113 2.520 1.00 0.28 C ATOM 1376 NE1 TRP A 141 1.198 -3.718 1.390 1.00 0.33 N ATOM 1377 CE2 TRP A 141 2.348 -3.099 1.830 1.00 0.30 C ATOM 1378 CE3 TRP A 141 4.310 -3.764 3.092 1.00 0.28 C ATOM 1379 CZ2 TRP A 141 2.844 -1.800 1.709 1.00 0.32 C ATOM 1380 CZ3 TRP A 141 4.807 -2.454 2.969 1.00 0.31 C ATOM 1381 CH2 TRP A 141 4.076 -1.476 2.280 1.00 0.33 C ATOM 0 H TRP A 141 3.239 -8.762 4.280 1.00 0.34 H new ATOM 0 HA TRP A 141 3.678 -5.877 4.634 1.00 0.29 H new ATOM 0 HB2 TRP A 141 3.394 -7.159 2.447 1.00 0.33 H new ATOM 0 HB3 TRP A 141 1.705 -7.361 2.868 1.00 0.33 H new ATOM 0 HD1 TRP A 141 0.352 -5.732 1.536 1.00 0.35 H new ATOM 0 HE1 TRP A 141 0.468 -3.251 0.852 1.00 0.33 H new ATOM 0 HE3 TRP A 141 4.883 -4.508 3.626 1.00 0.28 H new ATOM 0 HZ2 TRP A 141 2.278 -1.050 1.177 1.00 0.32 H new ATOM 0 HZ3 TRP A 141 5.760 -2.199 3.409 1.00 0.31 H new ATOM 0 HH2 TRP A 141 4.466 -0.473 2.191 1.00 0.33 H new ATOM 1392 N CYS A 142 1.924 -5.627 6.417 1.00 0.31 N ATOM 1393 CA CYS A 142 0.806 -5.310 7.344 1.00 0.40 C ATOM 1394 C CYS A 142 -0.017 -4.129 6.840 1.00 0.39 C ATOM 1395 O CYS A 142 -0.366 -3.246 7.598 1.00 0.48 O ATOM 1396 CB CYS A 142 1.390 -4.970 8.703 1.00 0.47 C ATOM 1397 SG CYS A 142 2.175 -6.440 9.410 1.00 1.45 S ATOM 0 H CYS A 142 2.828 -5.238 6.684 1.00 0.31 H new ATOM 0 HA CYS A 142 0.147 -6.176 7.409 1.00 0.40 H new ATOM 0 HB2 CYS A 142 2.120 -4.166 8.606 1.00 0.47 H new ATOM 0 HB3 CYS A 142 0.605 -4.609 9.368 1.00 0.47 H new ATOM 0 HG CYS A 142 3.059 -6.903 8.577 1.00 1.45 H new ATOM 1403 N TYR A 143 -0.341 -4.110 5.576 1.00 0.38 N ATOM 1404 CA TYR A 143 -1.162 -2.986 5.014 1.00 0.40 C ATOM 1405 C TYR A 143 -2.463 -3.563 4.446 1.00 0.43 C ATOM 1406 O TYR A 143 -2.453 -4.430 3.595 1.00 0.65 O ATOM 1407 CB TYR A 143 -0.356 -2.285 3.901 1.00 0.55 C ATOM 1408 CG TYR A 143 0.340 -1.058 4.457 1.00 1.43 C ATOM 1409 CD1 TYR A 143 -0.422 0.045 4.859 1.00 2.16 C ATOM 1410 CD2 TYR A 143 1.736 -1.022 4.568 1.00 2.17 C ATOM 1411 CE1 TYR A 143 0.210 1.184 5.373 1.00 3.14 C ATOM 1412 CE2 TYR A 143 2.368 0.117 5.081 1.00 3.14 C ATOM 1413 CZ TYR A 143 1.604 1.220 5.483 1.00 3.52 C ATOM 1414 OH TYR A 143 2.227 2.343 5.990 1.00 4.57 O ATOM 0 H TYR A 143 -0.074 -4.826 4.901 1.00 0.38 H new ATOM 0 HA TYR A 143 -1.401 -2.260 5.791 1.00 0.40 H new ATOM 0 HB2 TYR A 143 0.380 -2.973 3.485 1.00 0.55 H new ATOM 0 HB3 TYR A 143 -1.020 -1.998 3.086 1.00 0.55 H new ATOM 0 HD1 TYR A 143 -1.498 0.018 4.773 1.00 2.16 H new ATOM 0 HD2 TYR A 143 2.325 -1.873 4.258 1.00 2.17 H new ATOM 0 HE1 TYR A 143 -0.379 2.034 5.684 1.00 3.14 H new ATOM 0 HE2 TYR A 143 3.444 0.145 5.167 1.00 3.14 H new ATOM 0 HH TYR A 143 3.197 2.203 5.999 1.00 4.57 H new ATOM 1424 N LYS A 144 -3.584 -3.082 4.923 1.00 0.39 N ATOM 1425 CA LYS A 144 -4.909 -3.582 4.439 1.00 0.51 C ATOM 1426 C LYS A 144 -5.777 -2.388 4.044 1.00 0.43 C ATOM 1427 O LYS A 144 -5.919 -1.440 4.793 1.00 0.45 O ATOM 1428 CB LYS A 144 -5.590 -4.356 5.570 1.00 0.70 C ATOM 1429 CG LYS A 144 -5.843 -3.417 6.757 1.00 1.21 C ATOM 1430 CD LYS A 144 -6.069 -4.238 8.030 1.00 1.24 C ATOM 1431 CE LYS A 144 -7.344 -5.070 7.885 1.00 1.57 C ATOM 1432 NZ LYS A 144 -7.749 -5.594 9.220 1.00 2.32 N ATOM 0 H LYS A 144 -3.638 -2.355 5.636 1.00 0.39 H new ATOM 0 HA LYS A 144 -4.772 -4.235 3.577 1.00 0.51 H new ATOM 0 HB2 LYS A 144 -6.532 -4.778 5.220 1.00 0.70 H new ATOM 0 HB3 LYS A 144 -4.963 -5.191 5.881 1.00 0.70 H new ATOM 0 HG2 LYS A 144 -4.993 -2.748 6.891 1.00 1.21 H new ATOM 0 HG3 LYS A 144 -6.713 -2.791 6.558 1.00 1.21 H new ATOM 0 HD2 LYS A 144 -5.215 -4.891 8.210 1.00 1.24 H new ATOM 0 HD3 LYS A 144 -6.151 -3.576 8.892 1.00 1.24 H new ATOM 0 HE2 LYS A 144 -8.143 -4.460 7.464 1.00 1.57 H new ATOM 0 HE3 LYS A 144 -7.176 -5.896 7.194 1.00 1.57 H new ATOM 0 HZ1 LYS A 144 -8.616 -6.160 9.122 1.00 2.32 H new ATOM 0 HZ2 LYS A 144 -6.988 -6.190 9.605 1.00 2.32 H new ATOM 0 HZ3 LYS A 144 -7.926 -4.798 9.866 1.00 2.32 H new ATOM 1446 N LEU A 145 -6.362 -2.419 2.877 1.00 0.40 N ATOM 1447 CA LEU A 145 -7.219 -1.271 2.451 1.00 0.37 C ATOM 1448 C LEU A 145 -8.582 -1.383 3.134 1.00 0.38 C ATOM 1449 O LEU A 145 -9.085 -2.467 3.353 1.00 0.41 O ATOM 1450 CB LEU A 145 -7.398 -1.290 0.929 1.00 0.42 C ATOM 1451 CG LEU A 145 -6.089 -0.863 0.232 1.00 0.50 C ATOM 1452 CD1 LEU A 145 -6.056 -1.423 -1.193 1.00 0.63 C ATOM 1453 CD2 LEU A 145 -5.993 0.669 0.164 1.00 0.52 C ATOM 0 H LEU A 145 -6.286 -3.182 2.204 1.00 0.40 H new ATOM 0 HA LEU A 145 -6.742 -0.334 2.738 1.00 0.37 H new ATOM 0 HB2 LEU A 145 -7.683 -2.290 0.602 1.00 0.42 H new ATOM 0 HB3 LEU A 145 -8.207 -0.618 0.642 1.00 0.42 H new ATOM 0 HG LEU A 145 -5.249 -1.253 0.807 1.00 0.50 H new ATOM 0 HD11 LEU A 145 -5.130 -1.119 -1.682 1.00 0.63 H new ATOM 0 HD12 LEU A 145 -6.108 -2.511 -1.158 1.00 0.63 H new ATOM 0 HD13 LEU A 145 -6.907 -1.038 -1.755 1.00 0.63 H new ATOM 0 HD21 LEU A 145 -5.064 0.954 -0.330 1.00 0.52 H new ATOM 0 HD22 LEU A 145 -6.839 1.062 -0.400 1.00 0.52 H new ATOM 0 HD23 LEU A 145 -6.007 1.080 1.174 1.00 0.52 H new ATOM 1465 N VAL A 146 -9.186 -0.269 3.469 1.00 0.43 N ATOM 1466 CA VAL A 146 -10.518 -0.302 4.148 1.00 0.50 C ATOM 1467 C VAL A 146 -11.262 1.019 3.858 1.00 0.59 C ATOM 1468 O VAL A 146 -10.715 2.085 4.063 1.00 0.63 O ATOM 1469 CB VAL A 146 -10.315 -0.394 5.667 1.00 0.56 C ATOM 1470 CG1 VAL A 146 -11.673 -0.556 6.351 1.00 0.68 C ATOM 1471 CG2 VAL A 146 -9.428 -1.591 6.025 1.00 0.56 C ATOM 0 H VAL A 146 -8.812 0.665 3.301 1.00 0.43 H new ATOM 0 HA VAL A 146 -11.085 -1.159 3.784 1.00 0.50 H new ATOM 0 HB VAL A 146 -9.828 0.519 6.008 1.00 0.56 H new ATOM 0 HG11 VAL A 146 -11.532 -0.622 7.430 1.00 0.68 H new ATOM 0 HG12 VAL A 146 -12.302 0.303 6.119 1.00 0.68 H new ATOM 0 HG13 VAL A 146 -12.155 -1.466 5.992 1.00 0.68 H new ATOM 0 HG21 VAL A 146 -9.298 -1.637 7.106 1.00 0.56 H new ATOM 0 HG22 VAL A 146 -9.899 -2.510 5.677 1.00 0.56 H new ATOM 0 HG23 VAL A 146 -8.455 -1.479 5.547 1.00 0.56 H new ATOM 1481 N PRO A 147 -12.500 0.972 3.397 1.00 0.68 N ATOM 1482 CA PRO A 147 -13.291 2.206 3.105 1.00 0.81 C ATOM 1483 C PRO A 147 -13.965 2.775 4.362 1.00 0.91 C ATOM 1484 O PRO A 147 -14.557 2.049 5.136 1.00 1.12 O ATOM 1485 CB PRO A 147 -14.347 1.703 2.122 1.00 0.87 C ATOM 1486 CG PRO A 147 -14.628 0.308 2.576 1.00 0.97 C ATOM 1487 CD PRO A 147 -13.291 -0.242 3.092 1.00 0.75 C ATOM 0 HA PRO A 147 -12.670 3.016 2.722 1.00 0.81 H new ATOM 0 HB2 PRO A 147 -15.245 2.320 2.150 1.00 0.87 H new ATOM 0 HB3 PRO A 147 -13.979 1.722 1.096 1.00 0.87 H new ATOM 0 HG2 PRO A 147 -15.384 0.297 3.361 1.00 0.97 H new ATOM 0 HG3 PRO A 147 -15.011 -0.300 1.756 1.00 0.97 H new ATOM 0 HD2 PRO A 147 -13.429 -0.862 3.978 1.00 0.75 H new ATOM 0 HD3 PRO A 147 -12.798 -0.862 2.343 1.00 0.75 H new ATOM 1495 N VAL A 148 -13.895 4.065 4.567 1.00 1.17 N ATOM 1496 CA VAL A 148 -14.553 4.661 5.770 1.00 1.29 C ATOM 1497 C VAL A 148 -16.024 4.899 5.454 1.00 1.32 C ATOM 1498 O VAL A 148 -16.775 5.442 6.240 1.00 1.88 O ATOM 1499 CB VAL A 148 -13.873 5.988 6.129 1.00 1.89 C ATOM 1500 CG1 VAL A 148 -14.278 6.419 7.542 1.00 2.07 C ATOM 1501 CG2 VAL A 148 -12.353 5.813 6.072 1.00 2.31 C ATOM 0 H VAL A 148 -13.415 4.728 3.959 1.00 1.17 H new ATOM 0 HA VAL A 148 -14.463 3.982 6.618 1.00 1.29 H new ATOM 0 HB VAL A 148 -14.185 6.752 5.417 1.00 1.89 H new ATOM 0 HG11 VAL A 148 -13.790 7.362 7.788 1.00 2.07 H new ATOM 0 HG12 VAL A 148 -15.360 6.547 7.587 1.00 2.07 H new ATOM 0 HG13 VAL A 148 -13.973 5.655 8.257 1.00 2.07 H new ATOM 0 HG21 VAL A 148 -11.868 6.755 6.327 1.00 2.31 H new ATOM 0 HG22 VAL A 148 -12.048 5.045 6.782 1.00 2.31 H new ATOM 0 HG23 VAL A 148 -12.059 5.514 5.066 1.00 2.31 H new ATOM 1511 N GLU A 149 -16.429 4.479 4.301 1.00 1.71 N ATOM 1512 CA GLU A 149 -17.848 4.648 3.883 1.00 2.15 C ATOM 1513 C GLU A 149 -18.724 3.646 4.652 1.00 2.52 C ATOM 1514 O GLU A 149 -18.272 2.574 5.002 1.00 2.96 O ATOM 1515 CB GLU A 149 -17.953 4.380 2.378 1.00 3.00 C ATOM 1516 CG GLU A 149 -17.051 5.361 1.614 1.00 3.61 C ATOM 1517 CD GLU A 149 -15.600 4.872 1.645 1.00 4.55 C ATOM 1518 OE1 GLU A 149 -14.899 5.211 2.584 1.00 5.12 O ATOM 1519 OE2 GLU A 149 -15.213 4.171 0.725 1.00 5.02 O ATOM 0 H GLU A 149 -15.833 4.017 3.614 1.00 1.71 H new ATOM 0 HA GLU A 149 -18.187 5.661 4.100 1.00 2.15 H new ATOM 0 HB2 GLU A 149 -17.657 3.354 2.160 1.00 3.00 H new ATOM 0 HB3 GLU A 149 -18.987 4.490 2.050 1.00 3.00 H new ATOM 0 HG2 GLU A 149 -17.391 5.452 0.582 1.00 3.61 H new ATOM 0 HG3 GLU A 149 -17.119 6.353 2.060 1.00 3.61 H new ATOM 1526 N PRO A 150 -19.968 3.978 4.915 1.00 3.13 N ATOM 1527 CA PRO A 150 -20.893 3.063 5.651 1.00 4.08 C ATOM 1528 C PRO A 150 -21.303 1.858 4.794 1.00 4.33 C ATOM 1529 O PRO A 150 -20.994 1.786 3.621 1.00 4.84 O ATOM 1530 CB PRO A 150 -22.104 3.953 5.971 1.00 4.93 C ATOM 1531 CG PRO A 150 -22.105 4.996 4.900 1.00 4.81 C ATOM 1532 CD PRO A 150 -20.634 5.243 4.549 1.00 3.63 C ATOM 0 HA PRO A 150 -20.432 2.634 6.541 1.00 4.08 H new ATOM 0 HB2 PRO A 150 -23.030 3.378 5.964 1.00 4.93 H new ATOM 0 HB3 PRO A 150 -22.015 4.402 6.960 1.00 4.93 H new ATOM 0 HG2 PRO A 150 -22.663 4.658 4.027 1.00 4.81 H new ATOM 0 HG3 PRO A 150 -22.582 5.912 5.248 1.00 4.81 H new ATOM 0 HD2 PRO A 150 -20.508 5.470 3.490 1.00 3.63 H new ATOM 0 HD3 PRO A 150 -20.226 6.086 5.106 1.00 3.63 H new ATOM 1540 N GLU A 151 -21.992 0.909 5.371 1.00 4.44 N ATOM 1541 CA GLU A 151 -22.411 -0.288 4.587 1.00 5.08 C ATOM 1542 C GLU A 151 -23.315 0.145 3.429 1.00 5.48 C ATOM 1543 O GLU A 151 -23.282 1.278 2.993 1.00 5.61 O ATOM 1544 CB GLU A 151 -23.170 -1.258 5.496 1.00 5.57 C ATOM 1545 CG GLU A 151 -22.283 -1.651 6.679 1.00 5.87 C ATOM 1546 CD GLU A 151 -21.187 -2.604 6.201 1.00 6.47 C ATOM 1547 OE1 GLU A 151 -21.516 -3.557 5.512 1.00 6.96 O ATOM 1548 OE2 GLU A 151 -20.037 -2.367 6.531 1.00 6.74 O ATOM 0 H GLU A 151 -22.282 0.911 6.349 1.00 4.44 H new ATOM 0 HA GLU A 151 -21.527 -0.784 4.188 1.00 5.08 H new ATOM 0 HB2 GLU A 151 -24.088 -0.793 5.855 1.00 5.57 H new ATOM 0 HB3 GLU A 151 -23.461 -2.146 4.935 1.00 5.57 H new ATOM 0 HG2 GLU A 151 -21.837 -0.761 7.124 1.00 5.87 H new ATOM 0 HG3 GLU A 151 -22.883 -2.129 7.454 1.00 5.87 H new ATOM 1555 N LYS A 152 -24.118 -0.754 2.922 1.00 6.06 N ATOM 1556 CA LYS A 152 -25.021 -0.403 1.787 1.00 6.80 C ATOM 1557 C LYS A 152 -26.312 0.222 2.320 1.00 7.18 C ATOM 1558 O LYS A 152 -27.375 -0.360 2.235 1.00 7.59 O ATOM 1559 CB LYS A 152 -25.361 -1.668 0.997 1.00 7.59 C ATOM 1560 CG LYS A 152 -24.119 -2.154 0.247 1.00 7.87 C ATOM 1561 CD LYS A 152 -24.509 -3.287 -0.703 1.00 8.73 C ATOM 1562 CE LYS A 152 -23.245 -3.925 -1.283 1.00 9.22 C ATOM 1563 NZ LYS A 152 -23.627 -4.979 -2.264 1.00 9.63 N ATOM 0 H LYS A 152 -24.187 -1.719 3.246 1.00 6.06 H new ATOM 0 HA LYS A 152 -24.516 0.313 1.138 1.00 6.80 H new ATOM 0 HB2 LYS A 152 -25.718 -2.446 1.672 1.00 7.59 H new ATOM 0 HB3 LYS A 152 -26.167 -1.463 0.292 1.00 7.59 H new ATOM 0 HG2 LYS A 152 -23.674 -1.332 -0.314 1.00 7.87 H new ATOM 0 HG3 LYS A 152 -23.366 -2.501 0.955 1.00 7.87 H new ATOM 0 HD2 LYS A 152 -25.096 -4.036 -0.171 1.00 8.73 H new ATOM 0 HD3 LYS A 152 -25.137 -2.902 -1.507 1.00 8.73 H new ATOM 0 HE2 LYS A 152 -22.632 -3.166 -1.769 1.00 9.22 H new ATOM 0 HE3 LYS A 152 -22.643 -4.358 -0.484 1.00 9.22 H new ATOM 0 HZ1 LYS A 152 -22.768 -5.413 -2.659 1.00 9.63 H new ATOM 0 HZ2 LYS A 152 -24.196 -5.708 -1.787 1.00 9.63 H new ATOM 0 HZ3 LYS A 152 -24.184 -4.553 -3.032 1.00 9.63 H new ATOM 1577 N LEU A 153 -26.232 1.408 2.859 1.00 7.34 N ATOM 1578 CA LEU A 153 -27.461 2.072 3.385 1.00 7.98 C ATOM 1579 C LEU A 153 -28.223 2.699 2.215 1.00 8.11 C ATOM 1580 O LEU A 153 -28.812 3.754 2.340 1.00 8.31 O ATOM 1581 CB LEU A 153 -27.064 3.169 4.383 1.00 8.45 C ATOM 1582 CG LEU A 153 -26.687 2.556 5.743 1.00 8.93 C ATOM 1583 CD1 LEU A 153 -27.935 2.017 6.470 1.00 9.23 C ATOM 1584 CD2 LEU A 153 -25.680 1.419 5.531 1.00 9.46 C ATOM 0 H LEU A 153 -25.371 1.946 2.958 1.00 7.34 H new ATOM 0 HA LEU A 153 -28.091 1.339 3.889 1.00 7.98 H new ATOM 0 HB2 LEU A 153 -26.222 3.739 3.989 1.00 8.45 H new ATOM 0 HB3 LEU A 153 -27.890 3.868 4.510 1.00 8.45 H new ATOM 0 HG LEU A 153 -26.240 3.334 6.362 1.00 8.93 H new ATOM 0 HD11 LEU A 153 -27.641 1.589 7.428 1.00 9.23 H new ATOM 0 HD12 LEU A 153 -28.639 2.832 6.637 1.00 9.23 H new ATOM 0 HD13 LEU A 153 -28.408 1.248 5.859 1.00 9.23 H new ATOM 0 HD21 LEU A 153 -25.413 0.985 6.495 1.00 9.46 H new ATOM 0 HD22 LEU A 153 -26.126 0.651 4.898 1.00 9.46 H new ATOM 0 HD23 LEU A 153 -24.784 1.811 5.049 1.00 9.46 H new ATOM 1596 N GLU A 154 -28.212 2.058 1.078 1.00 8.27 N ATOM 1597 CA GLU A 154 -28.929 2.616 -0.103 1.00 8.64 C ATOM 1598 C GLU A 154 -30.436 2.399 0.056 1.00 8.97 C ATOM 1599 O GLU A 154 -30.955 1.342 -0.238 1.00 9.31 O ATOM 1600 CB GLU A 154 -28.444 1.911 -1.370 1.00 9.08 C ATOM 1601 CG GLU A 154 -29.138 2.520 -2.591 1.00 9.38 C ATOM 1602 CD GLU A 154 -28.417 2.073 -3.863 1.00 9.91 C ATOM 1603 OE1 GLU A 154 -27.478 2.746 -4.255 1.00 10.25 O ATOM 1604 OE2 GLU A 154 -28.813 1.064 -4.421 1.00 10.18 O ATOM 0 H GLU A 154 -27.736 1.170 0.916 1.00 8.27 H new ATOM 0 HA GLU A 154 -28.726 3.684 -0.177 1.00 8.64 H new ATOM 0 HB2 GLU A 154 -27.363 2.013 -1.464 1.00 9.08 H new ATOM 0 HB3 GLU A 154 -28.660 0.844 -1.310 1.00 9.08 H new ATOM 0 HG2 GLU A 154 -30.182 2.207 -2.623 1.00 9.38 H new ATOM 0 HG3 GLU A 154 -29.133 3.608 -2.521 1.00 9.38 H new ATOM 1611 N GLU A 155 -31.142 3.396 0.514 1.00 9.09 N ATOM 1612 CA GLU A 155 -32.614 3.250 0.686 1.00 9.60 C ATOM 1613 C GLU A 155 -33.237 4.630 0.899 1.00 9.70 C ATOM 1614 O GLU A 155 -34.398 4.849 0.610 1.00 10.09 O ATOM 1615 CB GLU A 155 -32.902 2.365 1.900 1.00 10.07 C ATOM 1616 CG GLU A 155 -34.371 1.939 1.884 1.00 10.61 C ATOM 1617 CD GLU A 155 -34.710 1.224 3.194 1.00 11.03 C ATOM 1618 OE1 GLU A 155 -34.477 0.029 3.271 1.00 11.24 O ATOM 1619 OE2 GLU A 155 -35.196 1.884 4.097 1.00 11.33 O ATOM 0 H GLU A 155 -30.762 4.306 0.777 1.00 9.09 H new ATOM 0 HA GLU A 155 -33.042 2.790 -0.205 1.00 9.60 H new ATOM 0 HB2 GLU A 155 -32.257 1.486 1.884 1.00 10.07 H new ATOM 0 HB3 GLU A 155 -32.679 2.907 2.819 1.00 10.07 H new ATOM 0 HG2 GLU A 155 -35.012 2.811 1.757 1.00 10.61 H new ATOM 0 HG3 GLU A 155 -34.560 1.279 1.038 1.00 10.61 H new ATOM 1626 N ALA A 156 -32.476 5.563 1.401 1.00 9.56 N ATOM 1627 CA ALA A 156 -33.024 6.928 1.631 1.00 9.82 C ATOM 1628 C ALA A 156 -33.301 7.596 0.283 1.00 9.59 C ATOM 1629 O ALA A 156 -33.486 6.937 -0.721 1.00 9.64 O ATOM 1630 CB ALA A 156 -32.006 7.762 2.412 1.00 9.95 C ATOM 0 H ALA A 156 -31.498 5.438 1.662 1.00 9.56 H new ATOM 0 HA ALA A 156 -33.950 6.858 2.202 1.00 9.82 H new ATOM 0 HB1 ALA A 156 -32.407 8.761 2.580 1.00 9.95 H new ATOM 0 HB2 ALA A 156 -31.805 7.285 3.371 1.00 9.95 H new ATOM 0 HB3 ALA A 156 -31.080 7.834 1.841 1.00 9.95 H new ATOM 1636 N ASN A 157 -33.332 8.900 0.252 1.00 9.56 N ATOM 1637 CA ASN A 157 -33.596 9.612 -1.031 1.00 9.52 C ATOM 1638 C ASN A 157 -32.302 9.706 -1.841 1.00 9.04 C ATOM 1639 O ASN A 157 -31.470 8.820 -1.809 1.00 9.05 O ATOM 1640 CB ASN A 157 -34.115 11.020 -0.734 1.00 10.08 C ATOM 1641 CG ASN A 157 -35.194 10.946 0.347 1.00 10.54 C ATOM 1642 OD1 ASN A 157 -35.887 9.955 0.465 1.00 10.93 O ATOM 1643 ND2 ASN A 157 -35.368 11.963 1.149 1.00 10.75 N ATOM 0 H ASN A 157 -33.186 9.504 1.061 1.00 9.56 H new ATOM 0 HA ASN A 157 -34.342 9.062 -1.604 1.00 9.52 H new ATOM 0 HB2 ASN A 157 -33.296 11.659 -0.403 1.00 10.08 H new ATOM 0 HB3 ASN A 157 -34.523 11.468 -1.640 1.00 10.08 H new ATOM 0 HD21 ASN A 157 -36.085 11.924 1.873 1.00 10.75 H new ATOM 0 HD22 ASN A 157 -34.787 12.795 1.051 1.00 10.75 H new ATOM 1650 N LYS A 158 -32.125 10.775 -2.568 1.00 8.83 N ATOM 1651 CA LYS A 158 -30.886 10.931 -3.381 1.00 8.52 C ATOM 1652 C LYS A 158 -29.658 10.774 -2.478 1.00 8.03 C ATOM 1653 O LYS A 158 -29.157 11.732 -1.923 1.00 8.18 O ATOM 1654 CB LYS A 158 -30.880 12.318 -4.034 1.00 8.88 C ATOM 1655 CG LYS A 158 -31.441 13.347 -3.049 1.00 9.31 C ATOM 1656 CD LYS A 158 -31.115 14.760 -3.541 1.00 9.87 C ATOM 1657 CE LYS A 158 -31.542 15.781 -2.484 1.00 10.59 C ATOM 1658 NZ LYS A 158 -32.861 15.385 -1.914 1.00 10.96 N ATOM 0 H LYS A 158 -32.786 11.549 -2.634 1.00 8.83 H new ATOM 0 HA LYS A 158 -30.857 10.167 -4.158 1.00 8.52 H new ATOM 0 HB2 LYS A 158 -29.865 12.591 -4.324 1.00 8.88 H new ATOM 0 HB3 LYS A 158 -31.479 12.306 -4.945 1.00 8.88 H new ATOM 0 HG2 LYS A 158 -32.520 13.224 -2.954 1.00 9.31 H new ATOM 0 HG3 LYS A 158 -31.014 13.188 -2.059 1.00 9.31 H new ATOM 0 HD2 LYS A 158 -30.047 14.850 -3.738 1.00 9.87 H new ATOM 0 HD3 LYS A 158 -31.630 14.957 -4.481 1.00 9.87 H new ATOM 0 HE2 LYS A 158 -30.794 15.836 -1.693 1.00 10.59 H new ATOM 0 HE3 LYS A 158 -31.609 16.774 -2.929 1.00 10.59 H new ATOM 0 HZ1 LYS A 158 -33.301 16.207 -1.453 1.00 10.96 H new ATOM 0 HZ2 LYS A 158 -33.480 15.044 -2.677 1.00 10.96 H new ATOM 0 HZ3 LYS A 158 -32.724 14.628 -1.214 1.00 10.96 H new ATOM 1672 N ASP A 174 -29.167 9.572 -2.328 1.00 7.70 N ATOM 1673 CA ASP A 174 -27.969 9.347 -1.462 1.00 7.46 C ATOM 1674 C ASP A 174 -26.701 9.412 -2.317 1.00 6.93 C ATOM 1675 O ASP A 174 -26.330 8.455 -2.965 1.00 7.21 O ATOM 1676 CB ASP A 174 -28.068 7.965 -0.813 1.00 7.83 C ATOM 1677 CG ASP A 174 -26.873 7.752 0.118 1.00 8.11 C ATOM 1678 OD1 ASP A 174 -26.782 8.462 1.105 1.00 8.32 O ATOM 1679 OD2 ASP A 174 -26.069 6.882 -0.173 1.00 8.38 O ATOM 0 H ASP A 174 -29.544 8.733 -2.769 1.00 7.70 H new ATOM 0 HA ASP A 174 -27.928 10.115 -0.690 1.00 7.46 H new ATOM 0 HB2 ASP A 174 -28.999 7.881 -0.252 1.00 7.83 H new ATOM 0 HB3 ASP A 174 -28.087 7.191 -1.581 1.00 7.83 H new ATOM 1684 N ASP A 175 -26.027 10.533 -2.322 1.00 6.43 N ATOM 1685 CA ASP A 175 -24.781 10.651 -3.137 1.00 6.11 C ATOM 1686 C ASP A 175 -23.881 11.747 -2.558 1.00 5.51 C ATOM 1687 O ASP A 175 -23.595 12.730 -3.211 1.00 5.46 O ATOM 1688 CB ASP A 175 -25.147 11.007 -4.579 1.00 6.61 C ATOM 1689 CG ASP A 175 -25.819 9.805 -5.247 1.00 7.27 C ATOM 1690 OD1 ASP A 175 -27.017 9.653 -5.079 1.00 7.57 O ATOM 1691 OD2 ASP A 175 -25.122 9.056 -5.912 1.00 7.70 O ATOM 0 H ASP A 175 -26.285 11.370 -1.799 1.00 6.43 H new ATOM 0 HA ASP A 175 -24.249 9.700 -3.116 1.00 6.11 H new ATOM 0 HB2 ASP A 175 -25.817 11.866 -4.594 1.00 6.61 H new ATOM 0 HB3 ASP A 175 -24.252 11.291 -5.133 1.00 6.61 H new ATOM 1696 N PRO A 176 -23.436 11.574 -1.342 1.00 5.43 N ATOM 1697 CA PRO A 176 -22.546 12.560 -0.662 1.00 5.29 C ATOM 1698 C PRO A 176 -21.091 12.441 -1.136 1.00 4.96 C ATOM 1699 O PRO A 176 -20.819 11.955 -2.216 1.00 4.91 O ATOM 1700 CB PRO A 176 -22.681 12.180 0.818 1.00 5.76 C ATOM 1701 CG PRO A 176 -22.933 10.704 0.805 1.00 6.11 C ATOM 1702 CD PRO A 176 -23.730 10.417 -0.476 1.00 5.94 C ATOM 0 HA PRO A 176 -22.822 13.593 -0.872 1.00 5.29 H new ATOM 0 HB2 PRO A 176 -21.776 12.423 1.374 1.00 5.76 H new ATOM 0 HB3 PRO A 176 -23.501 12.718 1.293 1.00 5.76 H new ATOM 0 HG2 PRO A 176 -21.995 10.149 0.813 1.00 6.11 H new ATOM 0 HG3 PRO A 176 -23.492 10.397 1.689 1.00 6.11 H new ATOM 0 HD2 PRO A 176 -23.418 9.481 -0.940 1.00 5.94 H new ATOM 0 HD3 PRO A 176 -24.797 10.331 -0.272 1.00 5.94 H new ATOM 1710 N GLU A 177 -20.155 12.873 -0.336 1.00 5.10 N ATOM 1711 CA GLU A 177 -18.727 12.777 -0.736 1.00 5.19 C ATOM 1712 C GLU A 177 -18.253 11.341 -0.513 1.00 4.50 C ATOM 1713 O GLU A 177 -17.798 10.980 0.555 1.00 4.75 O ATOM 1714 CB GLU A 177 -17.882 13.748 0.107 1.00 6.10 C ATOM 1715 CG GLU A 177 -18.400 13.790 1.559 1.00 6.79 C ATOM 1716 CD GLU A 177 -19.504 14.847 1.697 1.00 7.52 C ATOM 1717 OE1 GLU A 177 -20.625 14.563 1.310 1.00 7.81 O ATOM 1718 OE2 GLU A 177 -19.206 15.923 2.190 1.00 8.01 O ATOM 0 H GLU A 177 -20.321 13.289 0.580 1.00 5.10 H new ATOM 0 HA GLU A 177 -18.616 13.043 -1.787 1.00 5.19 H new ATOM 0 HB2 GLU A 177 -16.838 13.436 0.096 1.00 6.10 H new ATOM 0 HB3 GLU A 177 -17.921 14.746 -0.329 1.00 6.10 H new ATOM 0 HG2 GLU A 177 -18.786 12.811 1.844 1.00 6.79 H new ATOM 0 HG3 GLU A 177 -17.580 14.019 2.239 1.00 6.79 H new ATOM 1725 N ARG A 178 -18.373 10.521 -1.514 1.00 3.95 N ATOM 1726 CA ARG A 178 -17.948 9.099 -1.376 1.00 3.61 C ATOM 1727 C ARG A 178 -16.420 9.016 -1.397 1.00 3.28 C ATOM 1728 O ARG A 178 -15.781 9.305 -2.389 1.00 3.07 O ATOM 1729 CB ARG A 178 -18.524 8.285 -2.538 1.00 3.75 C ATOM 1730 CG ARG A 178 -18.438 6.789 -2.210 1.00 4.06 C ATOM 1731 CD ARG A 178 -18.876 5.945 -3.429 1.00 4.58 C ATOM 1732 NE ARG A 178 -19.782 4.836 -2.983 1.00 5.19 N ATOM 1733 CZ ARG A 178 -19.485 4.089 -1.951 1.00 5.87 C ATOM 1734 NH1 ARG A 178 -18.329 4.208 -1.359 1.00 6.06 N ATOM 1735 NH2 ARG A 178 -20.339 3.194 -1.533 1.00 6.66 N ATOM 0 H ARG A 178 -18.749 10.773 -2.428 1.00 3.95 H new ATOM 0 HA ARG A 178 -18.316 8.697 -0.432 1.00 3.61 H new ATOM 0 HB2 ARG A 178 -19.561 8.570 -2.716 1.00 3.75 H new ATOM 0 HB3 ARG A 178 -17.973 8.499 -3.454 1.00 3.75 H new ATOM 0 HG2 ARG A 178 -17.418 6.530 -1.928 1.00 4.06 H new ATOM 0 HG3 ARG A 178 -19.073 6.561 -1.354 1.00 4.06 H new ATOM 0 HD2 ARG A 178 -19.390 6.577 -4.154 1.00 4.58 H new ATOM 0 HD3 ARG A 178 -18.000 5.532 -3.930 1.00 4.58 H new ATOM 0 HE ARG A 178 -20.647 4.661 -3.495 1.00 5.19 H new ATOM 0 HH11 ARG A 178 -17.649 4.887 -1.700 1.00 6.06 H new ATOM 0 HH12 ARG A 178 -18.105 3.622 -0.555 1.00 6.06 H new ATOM 0 HH21 ARG A 178 -21.233 3.080 -2.011 1.00 6.66 H new ATOM 0 HH22 ARG A 178 -20.112 2.609 -0.729 1.00 6.66 H new ATOM 1749 N GLU A 179 -15.833 8.628 -0.298 1.00 3.66 N ATOM 1750 CA GLU A 179 -14.348 8.525 -0.226 1.00 3.59 C ATOM 1751 C GLU A 179 -13.875 7.247 -0.928 1.00 2.48 C ATOM 1752 O GLU A 179 -14.650 6.345 -1.182 1.00 2.75 O ATOM 1753 CB GLU A 179 -13.926 8.486 1.242 1.00 4.67 C ATOM 1754 CG GLU A 179 -14.140 9.864 1.873 1.00 5.63 C ATOM 1755 CD GLU A 179 -14.015 9.754 3.394 1.00 6.37 C ATOM 1756 OE1 GLU A 179 -14.451 8.750 3.935 1.00 6.71 O ATOM 1757 OE2 GLU A 179 -13.486 10.676 3.993 1.00 6.87 O ATOM 0 H GLU A 179 -16.323 8.376 0.560 1.00 3.66 H new ATOM 0 HA GLU A 179 -13.899 9.386 -0.721 1.00 3.59 H new ATOM 0 HB2 GLU A 179 -14.506 7.735 1.778 1.00 4.67 H new ATOM 0 HB3 GLU A 179 -12.878 8.196 1.322 1.00 4.67 H new ATOM 0 HG2 GLU A 179 -13.405 10.570 1.487 1.00 5.63 H new ATOM 0 HG3 GLU A 179 -15.124 10.250 1.605 1.00 5.63 H new ATOM 1764 N VAL A 180 -12.604 7.158 -1.243 1.00 1.65 N ATOM 1765 CA VAL A 180 -12.075 5.939 -1.922 1.00 0.77 C ATOM 1766 C VAL A 180 -11.593 4.953 -0.854 1.00 0.63 C ATOM 1767 O VAL A 180 -12.279 4.715 0.121 1.00 0.64 O ATOM 1768 CB VAL A 180 -10.921 6.339 -2.857 1.00 1.22 C ATOM 1769 CG1 VAL A 180 -10.727 5.280 -3.950 1.00 2.08 C ATOM 1770 CG2 VAL A 180 -11.248 7.683 -3.511 1.00 1.28 C ATOM 0 H VAL A 180 -11.910 7.882 -1.057 1.00 1.65 H new ATOM 0 HA VAL A 180 -12.854 5.464 -2.519 1.00 0.77 H new ATOM 0 HB VAL A 180 -10.003 6.418 -2.274 1.00 1.22 H new ATOM 0 HG11 VAL A 180 -9.907 5.578 -4.603 1.00 2.08 H new ATOM 0 HG12 VAL A 180 -10.494 4.320 -3.489 1.00 2.08 H new ATOM 0 HG13 VAL A 180 -11.642 5.189 -4.535 1.00 2.08 H new ATOM 0 HG21 VAL A 180 -10.434 7.972 -4.175 1.00 1.28 H new ATOM 0 HG22 VAL A 180 -12.170 7.593 -4.085 1.00 1.28 H new ATOM 0 HG23 VAL A 180 -11.374 8.442 -2.739 1.00 1.28 H new ATOM 1780 N LEU A 181 -10.430 4.372 -1.027 1.00 0.58 N ATOM 1781 CA LEU A 181 -9.913 3.383 -0.013 1.00 0.52 C ATOM 1782 C LEU A 181 -8.625 3.901 0.633 1.00 0.47 C ATOM 1783 O LEU A 181 -7.767 4.431 -0.030 1.00 0.51 O ATOM 1784 CB LEU A 181 -9.620 2.054 -0.711 1.00 0.60 C ATOM 1785 CG LEU A 181 -10.798 1.673 -1.613 1.00 0.74 C ATOM 1786 CD1 LEU A 181 -10.477 0.374 -2.349 1.00 0.95 C ATOM 1787 CD2 LEU A 181 -12.060 1.483 -0.762 1.00 0.87 C ATOM 0 H LEU A 181 -9.813 4.536 -1.823 1.00 0.58 H new ATOM 0 HA LEU A 181 -10.668 3.246 0.761 1.00 0.52 H new ATOM 0 HB2 LEU A 181 -8.708 2.136 -1.303 1.00 0.60 H new ATOM 0 HB3 LEU A 181 -9.450 1.273 0.030 1.00 0.60 H new ATOM 0 HG LEU A 181 -10.970 2.468 -2.338 1.00 0.74 H new ATOM 0 HD11 LEU A 181 -11.315 0.103 -2.991 1.00 0.95 H new ATOM 0 HD12 LEU A 181 -9.584 0.512 -2.958 1.00 0.95 H new ATOM 0 HD13 LEU A 181 -10.303 -0.421 -1.624 1.00 0.95 H new ATOM 0 HD21 LEU A 181 -12.896 1.212 -1.407 1.00 0.87 H new ATOM 0 HD22 LEU A 181 -11.892 0.690 -0.034 1.00 0.87 H new ATOM 0 HD23 LEU A 181 -12.290 2.412 -0.240 1.00 0.87 H new ATOM 1799 N GLU A 182 -8.487 3.746 1.930 1.00 0.45 N ATOM 1800 CA GLU A 182 -7.249 4.225 2.635 1.00 0.45 C ATOM 1801 C GLU A 182 -6.408 3.043 3.122 1.00 0.42 C ATOM 1802 O GLU A 182 -6.915 2.025 3.550 1.00 0.43 O ATOM 1803 CB GLU A 182 -7.656 5.086 3.838 1.00 0.49 C ATOM 1804 CG GLU A 182 -8.860 4.449 4.538 1.00 0.56 C ATOM 1805 CD GLU A 182 -9.029 5.063 5.930 1.00 0.90 C ATOM 1806 OE1 GLU A 182 -8.542 6.162 6.134 1.00 1.49 O ATOM 1807 OE2 GLU A 182 -9.643 4.422 6.767 1.00 1.62 O ATOM 0 H GLU A 182 -9.181 3.306 2.535 1.00 0.45 H new ATOM 0 HA GLU A 182 -6.653 4.811 1.935 1.00 0.45 H new ATOM 0 HB2 GLU A 182 -6.822 5.174 4.534 1.00 0.49 H new ATOM 0 HB3 GLU A 182 -7.905 6.095 3.509 1.00 0.49 H new ATOM 0 HG2 GLU A 182 -9.762 4.608 3.948 1.00 0.56 H new ATOM 0 HG3 GLU A 182 -8.718 3.371 4.620 1.00 0.56 H new ATOM 1814 N TRP A 183 -5.110 3.199 3.071 1.00 0.40 N ATOM 1815 CA TRP A 183 -4.188 2.127 3.538 1.00 0.38 C ATOM 1816 C TRP A 183 -4.206 2.110 5.071 1.00 0.37 C ATOM 1817 O TRP A 183 -3.701 3.012 5.710 1.00 0.43 O ATOM 1818 CB TRP A 183 -2.762 2.446 3.048 1.00 0.41 C ATOM 1819 CG TRP A 183 -2.542 1.917 1.663 1.00 0.42 C ATOM 1820 CD1 TRP A 183 -2.347 0.616 1.348 1.00 0.52 C ATOM 1821 CD2 TRP A 183 -2.475 2.656 0.410 1.00 0.38 C ATOM 1822 NE1 TRP A 183 -2.163 0.510 -0.019 1.00 0.53 N ATOM 1823 CE2 TRP A 183 -2.236 1.740 -0.642 1.00 0.44 C ATOM 1824 CE3 TRP A 183 -2.600 4.018 0.089 1.00 0.38 C ATOM 1825 CZ2 TRP A 183 -2.123 2.166 -1.968 1.00 0.44 C ATOM 1826 CZ3 TRP A 183 -2.488 4.450 -1.242 1.00 0.41 C ATOM 1827 CH2 TRP A 183 -2.249 3.525 -2.268 1.00 0.41 C ATOM 0 H TRP A 183 -4.646 4.037 2.720 1.00 0.40 H new ATOM 0 HA TRP A 183 -4.499 1.158 3.148 1.00 0.38 H new ATOM 0 HB2 TRP A 183 -2.602 3.524 3.060 1.00 0.41 H new ATOM 0 HB3 TRP A 183 -2.032 2.008 3.729 1.00 0.41 H new ATOM 0 HD1 TRP A 183 -2.337 -0.206 2.049 1.00 0.52 H new ATOM 0 HE1 TRP A 183 -1.994 -0.370 -0.507 1.00 0.53 H new ATOM 0 HE3 TRP A 183 -2.784 4.738 0.872 1.00 0.38 H new ATOM 0 HZ2 TRP A 183 -1.940 1.450 -2.755 1.00 0.44 H new ATOM 0 HZ3 TRP A 183 -2.586 5.500 -1.477 1.00 0.41 H new ATOM 0 HH2 TRP A 183 -2.162 3.863 -3.290 1.00 0.41 H new ATOM 1838 N ARG A 184 -4.780 1.100 5.671 1.00 0.35 N ATOM 1839 CA ARG A 184 -4.818 1.049 7.165 1.00 0.35 C ATOM 1840 C ARG A 184 -3.598 0.282 7.676 1.00 0.31 C ATOM 1841 O ARG A 184 -3.554 -0.933 7.655 1.00 0.31 O ATOM 1842 CB ARG A 184 -6.105 0.346 7.620 1.00 0.40 C ATOM 1843 CG ARG A 184 -6.390 0.667 9.099 1.00 0.98 C ATOM 1844 CD ARG A 184 -7.065 2.041 9.238 1.00 1.51 C ATOM 1845 NE ARG A 184 -7.647 2.170 10.602 1.00 1.57 N ATOM 1846 CZ ARG A 184 -7.992 3.344 11.057 1.00 2.13 C ATOM 1847 NH1 ARG A 184 -7.811 4.407 10.322 1.00 2.82 N ATOM 1848 NH2 ARG A 184 -8.513 3.455 12.248 1.00 2.61 N ATOM 0 H ARG A 184 -5.222 0.313 5.196 1.00 0.35 H new ATOM 0 HA ARG A 184 -4.802 2.062 7.568 1.00 0.35 H new ATOM 0 HB2 ARG A 184 -6.943 0.669 7.002 1.00 0.40 H new ATOM 0 HB3 ARG A 184 -6.007 -0.731 7.486 1.00 0.40 H new ATOM 0 HG2 ARG A 184 -7.032 -0.104 9.526 1.00 0.98 H new ATOM 0 HG3 ARG A 184 -5.458 0.655 9.665 1.00 0.98 H new ATOM 0 HD2 ARG A 184 -6.338 2.835 9.064 1.00 1.51 H new ATOM 0 HD3 ARG A 184 -7.846 2.153 8.485 1.00 1.51 H new ATOM 0 HE ARG A 184 -7.776 1.341 11.181 1.00 1.57 H new ATOM 0 HH11 ARG A 184 -7.400 4.320 9.392 1.00 2.82 H new ATOM 0 HH12 ARG A 184 -8.080 5.324 10.677 1.00 2.82 H new ATOM 0 HH21 ARG A 184 -8.651 2.624 12.824 1.00 2.61 H new ATOM 0 HH22 ARG A 184 -8.782 4.372 12.603 1.00 2.61 H new ATOM 1862 N PHE A 185 -2.604 0.993 8.127 1.00 0.31 N ATOM 1863 CA PHE A 185 -1.368 0.333 8.638 1.00 0.31 C ATOM 1864 C PHE A 185 -1.681 -0.427 9.936 1.00 0.31 C ATOM 1865 O PHE A 185 -2.379 0.060 10.802 1.00 0.37 O ATOM 1866 CB PHE A 185 -0.313 1.421 8.894 1.00 0.40 C ATOM 1867 CG PHE A 185 0.790 0.913 9.799 1.00 0.44 C ATOM 1868 CD1 PHE A 185 0.591 0.871 11.184 1.00 0.65 C ATOM 1869 CD2 PHE A 185 2.014 0.504 9.255 1.00 0.62 C ATOM 1870 CE1 PHE A 185 1.614 0.417 12.025 1.00 0.75 C ATOM 1871 CE2 PHE A 185 3.037 0.054 10.097 1.00 0.74 C ATOM 1872 CZ PHE A 185 2.836 0.009 11.481 1.00 0.71 C ATOM 0 H PHE A 185 -2.593 2.012 8.164 1.00 0.31 H new ATOM 0 HA PHE A 185 -0.990 -0.383 7.908 1.00 0.31 H new ATOM 0 HB2 PHE A 185 0.113 1.748 7.946 1.00 0.40 H new ATOM 0 HB3 PHE A 185 -0.787 2.291 9.348 1.00 0.40 H new ATOM 0 HD1 PHE A 185 -0.352 1.189 11.604 1.00 0.65 H new ATOM 0 HD2 PHE A 185 2.168 0.536 8.187 1.00 0.62 H new ATOM 0 HE1 PHE A 185 1.460 0.382 13.093 1.00 0.75 H new ATOM 0 HE2 PHE A 185 3.982 -0.259 9.678 1.00 0.74 H new ATOM 0 HZ PHE A 185 3.625 -0.341 12.130 1.00 0.71 H new ATOM 1882 N ASP A 186 -1.169 -1.624 10.066 1.00 0.28 N ATOM 1883 CA ASP A 186 -1.425 -2.433 11.288 1.00 0.32 C ATOM 1884 C ASP A 186 -0.281 -3.438 11.476 1.00 0.30 C ATOM 1885 O ASP A 186 -0.477 -4.634 11.387 1.00 0.32 O ATOM 1886 CB ASP A 186 -2.741 -3.181 11.090 1.00 0.37 C ATOM 1887 CG ASP A 186 -3.292 -3.638 12.443 1.00 0.47 C ATOM 1888 OD1 ASP A 186 -2.539 -3.632 13.403 1.00 1.16 O ATOM 1889 OD2 ASP A 186 -4.461 -3.989 12.495 1.00 1.23 O ATOM 0 H ASP A 186 -0.579 -2.077 9.368 1.00 0.28 H new ATOM 0 HA ASP A 186 -1.484 -1.794 12.169 1.00 0.32 H new ATOM 0 HB2 ASP A 186 -3.465 -2.535 10.593 1.00 0.37 H new ATOM 0 HB3 ASP A 186 -2.585 -4.043 10.442 1.00 0.37 H new ATOM 1894 N SER A 187 0.913 -2.953 11.717 1.00 0.33 N ATOM 1895 CA SER A 187 2.096 -3.857 11.893 1.00 0.34 C ATOM 1896 C SER A 187 1.755 -5.043 12.806 1.00 0.35 C ATOM 1897 O SER A 187 2.528 -5.972 12.930 1.00 0.37 O ATOM 1898 CB SER A 187 3.250 -3.063 12.514 1.00 0.40 C ATOM 1899 OG SER A 187 4.074 -3.941 13.271 1.00 1.32 O ATOM 0 H SER A 187 1.122 -1.958 11.800 1.00 0.33 H new ATOM 0 HA SER A 187 2.382 -4.243 10.915 1.00 0.34 H new ATOM 0 HB2 SER A 187 3.836 -2.580 11.732 1.00 0.40 H new ATOM 0 HB3 SER A 187 2.859 -2.272 13.154 1.00 0.40 H new ATOM 0 HG SER A 187 4.948 -3.523 13.419 1.00 1.32 H new ATOM 1905 N ARG A 188 0.615 -5.036 13.442 1.00 0.40 N ATOM 1906 CA ARG A 188 0.266 -6.182 14.327 1.00 0.46 C ATOM 1907 C ARG A 188 0.250 -7.462 13.487 1.00 0.42 C ATOM 1908 O ARG A 188 0.615 -8.524 13.946 1.00 0.43 O ATOM 1909 CB ARG A 188 -1.121 -5.957 14.934 1.00 0.58 C ATOM 1910 CG ARG A 188 -1.129 -4.651 15.745 1.00 1.40 C ATOM 1911 CD ARG A 188 -0.286 -4.792 17.034 1.00 1.75 C ATOM 1912 NE ARG A 188 0.943 -3.959 16.908 1.00 2.37 N ATOM 1913 CZ ARG A 188 1.642 -3.664 17.971 1.00 2.99 C ATOM 1914 NH1 ARG A 188 1.274 -4.111 19.140 1.00 3.19 N ATOM 1915 NH2 ARG A 188 2.710 -2.922 17.863 1.00 3.87 N ATOM 0 H ARG A 188 -0.083 -4.294 13.388 1.00 0.40 H new ATOM 0 HA ARG A 188 0.999 -6.268 15.129 1.00 0.46 H new ATOM 0 HB2 ARG A 188 -1.870 -5.910 14.144 1.00 0.58 H new ATOM 0 HB3 ARG A 188 -1.387 -6.796 15.576 1.00 0.58 H new ATOM 0 HG2 ARG A 188 -0.734 -3.838 15.135 1.00 1.40 H new ATOM 0 HG3 ARG A 188 -2.154 -4.386 16.004 1.00 1.40 H new ATOM 0 HD2 ARG A 188 -0.868 -4.475 17.900 1.00 1.75 H new ATOM 0 HD3 ARG A 188 -0.017 -5.836 17.195 1.00 1.75 H new ATOM 0 HE ARG A 188 1.238 -3.620 15.993 1.00 2.37 H new ATOM 0 HH11 ARG A 188 0.440 -4.692 19.224 1.00 3.19 H new ATOM 0 HH12 ARG A 188 1.821 -3.880 19.970 1.00 3.19 H new ATOM 0 HH21 ARG A 188 2.998 -2.573 16.949 1.00 3.87 H new ATOM 0 HH22 ARG A 188 3.257 -2.691 18.693 1.00 3.87 H new ATOM 1929 N LEU A 189 -0.148 -7.357 12.250 1.00 0.43 N ATOM 1930 CA LEU A 189 -0.172 -8.551 11.357 1.00 0.46 C ATOM 1931 C LEU A 189 1.259 -9.058 11.178 1.00 0.41 C ATOM 1932 O LEU A 189 1.512 -9.989 10.442 1.00 0.46 O ATOM 1933 CB LEU A 189 -0.756 -8.162 9.984 1.00 0.57 C ATOM 1934 CG LEU A 189 -2.297 -8.142 10.039 1.00 1.05 C ATOM 1935 CD1 LEU A 189 -2.845 -7.276 8.897 1.00 1.46 C ATOM 1936 CD2 LEU A 189 -2.859 -9.564 9.884 1.00 1.78 C ATOM 0 H LEU A 189 -0.460 -6.489 11.815 1.00 0.43 H new ATOM 0 HA LEU A 189 -0.792 -9.331 11.799 1.00 0.46 H new ATOM 0 HB2 LEU A 189 -0.384 -7.181 9.689 1.00 0.57 H new ATOM 0 HB3 LEU A 189 -0.422 -8.871 9.226 1.00 0.57 H new ATOM 0 HG LEU A 189 -2.600 -7.733 11.003 1.00 1.05 H new ATOM 0 HD11 LEU A 189 -3.934 -7.265 8.939 1.00 1.46 H new ATOM 0 HD12 LEU A 189 -2.467 -6.259 8.998 1.00 1.46 H new ATOM 0 HD13 LEU A 189 -2.524 -7.689 7.941 1.00 1.46 H new ATOM 0 HD21 LEU A 189 -3.948 -9.531 9.925 1.00 1.78 H new ATOM 0 HD22 LEU A 189 -2.544 -9.977 8.926 1.00 1.78 H new ATOM 0 HD23 LEU A 189 -2.484 -10.193 10.691 1.00 1.78 H new ATOM 1948 N ALA A 190 2.199 -8.445 11.839 1.00 0.37 N ATOM 1949 CA ALA A 190 3.610 -8.882 11.698 1.00 0.42 C ATOM 1950 C ALA A 190 3.829 -10.181 12.474 1.00 0.44 C ATOM 1951 O ALA A 190 4.924 -10.706 12.504 1.00 0.53 O ATOM 1952 CB ALA A 190 4.536 -7.798 12.254 1.00 0.47 C ATOM 0 H ALA A 190 2.049 -7.659 12.471 1.00 0.37 H new ATOM 0 HA ALA A 190 3.831 -9.049 10.644 1.00 0.42 H new ATOM 0 HB1 ALA A 190 5.573 -8.118 12.151 1.00 0.47 H new ATOM 0 HB2 ALA A 190 4.385 -6.871 11.700 1.00 0.47 H new ATOM 0 HB3 ALA A 190 4.310 -7.632 13.307 1.00 0.47 H new ATOM 1958 N PHE A 191 2.801 -10.709 13.103 1.00 0.42 N ATOM 1959 CA PHE A 191 2.979 -11.989 13.876 1.00 0.51 C ATOM 1960 C PHE A 191 1.793 -12.939 13.655 1.00 0.56 C ATOM 1961 O PHE A 191 1.718 -13.989 14.263 1.00 0.96 O ATOM 1962 CB PHE A 191 3.128 -11.680 15.372 1.00 0.58 C ATOM 1963 CG PHE A 191 1.830 -11.147 15.930 1.00 1.14 C ATOM 1964 CD1 PHE A 191 0.839 -12.032 16.371 1.00 1.98 C ATOM 1965 CD2 PHE A 191 1.621 -9.766 16.012 1.00 1.81 C ATOM 1966 CE1 PHE A 191 -0.361 -11.535 16.892 1.00 2.87 C ATOM 1967 CE2 PHE A 191 0.420 -9.269 16.533 1.00 2.75 C ATOM 1968 CZ PHE A 191 -0.571 -10.154 16.973 1.00 3.15 C ATOM 0 H PHE A 191 1.859 -10.317 13.116 1.00 0.42 H new ATOM 0 HA PHE A 191 3.882 -12.481 13.515 1.00 0.51 H new ATOM 0 HB2 PHE A 191 3.419 -12.583 15.909 1.00 0.58 H new ATOM 0 HB3 PHE A 191 3.923 -10.950 15.522 1.00 0.58 H new ATOM 0 HD1 PHE A 191 1.001 -13.098 16.309 1.00 1.98 H new ATOM 0 HD2 PHE A 191 2.386 -9.083 15.673 1.00 1.81 H new ATOM 0 HE1 PHE A 191 -1.126 -12.218 17.232 1.00 2.87 H new ATOM 0 HE2 PHE A 191 0.258 -8.203 16.595 1.00 2.75 H new ATOM 0 HZ PHE A 191 -1.497 -9.771 17.375 1.00 3.15 H new ATOM 1978 N HIS A 192 0.879 -12.610 12.779 1.00 0.64 N ATOM 1979 CA HIS A 192 -0.269 -13.538 12.530 1.00 0.72 C ATOM 1980 C HIS A 192 -0.833 -13.305 11.128 1.00 0.67 C ATOM 1981 O HIS A 192 -1.286 -12.226 10.796 1.00 1.26 O ATOM 1982 CB HIS A 192 -1.369 -13.323 13.577 1.00 1.01 C ATOM 1983 CG HIS A 192 -1.815 -11.887 13.582 1.00 1.62 C ATOM 1984 ND1 HIS A 192 -1.186 -10.736 13.975 1.00 2.46 N flip ATOM 1985 CD2 HIS A 192 -3.082 -11.505 13.169 1.00 2.48 C flip ATOM 1986 CE1 HIS A 192 -2.044 -9.653 13.812 1.00 3.29 C flip ATOM 1987 NE2 HIS A 192 -3.174 -10.171 13.324 1.00 3.35 N flip ATOM 0 H HIS A 192 0.875 -11.750 12.230 1.00 0.64 H new ATOM 0 HA HIS A 192 0.090 -14.564 12.606 1.00 0.72 H new ATOM 0 HB2 HIS A 192 -2.217 -13.973 13.361 1.00 1.01 H new ATOM 0 HB3 HIS A 192 -0.999 -13.599 14.564 1.00 1.01 H new ATOM 0 HD1 HIS A 192 -0.233 -10.681 14.333 1.00 2.46 H new ATOM 0 HD2 HIS A 192 -3.855 -12.159 12.792 1.00 2.48 H new ATOM 0 HE1 HIS A 192 -1.840 -8.616 14.033 1.00 3.29 H new ATOM 1995 N HIS A 193 -0.802 -14.318 10.301 1.00 0.77 N ATOM 1996 CA HIS A 193 -1.329 -14.180 8.914 1.00 0.85 C ATOM 1997 C HIS A 193 -2.843 -14.411 8.917 1.00 0.74 C ATOM 1998 O HIS A 193 -3.310 -15.532 8.931 1.00 0.78 O ATOM 1999 CB HIS A 193 -0.651 -15.219 8.013 1.00 1.28 C ATOM 2000 CG HIS A 193 -0.529 -16.522 8.754 1.00 2.09 C ATOM 2001 ND1 HIS A 193 -1.637 -17.255 9.148 1.00 2.84 N ATOM 2002 CD2 HIS A 193 0.564 -17.235 9.183 1.00 2.99 C ATOM 2003 CE1 HIS A 193 -1.191 -18.353 9.784 1.00 3.75 C ATOM 2004 NE2 HIS A 193 0.143 -18.391 9.833 1.00 3.87 N ATOM 0 H HIS A 193 -0.431 -15.240 10.530 1.00 0.77 H new ATOM 0 HA HIS A 193 -1.119 -13.178 8.539 1.00 0.85 H new ATOM 0 HB2 HIS A 193 -1.232 -15.360 7.101 1.00 1.28 H new ATOM 0 HB3 HIS A 193 0.335 -14.866 7.711 1.00 1.28 H new ATOM 0 HD1 HIS A 193 -2.613 -17.007 8.985 1.00 2.84 H new ATOM 0 HD2 HIS A 193 1.594 -16.943 9.038 1.00 2.99 H new ATOM 0 HE1 HIS A 193 -1.834 -19.112 10.204 1.00 3.75 H new ATOM 2012 N MET A 194 -3.613 -13.359 8.900 1.00 0.73 N ATOM 2013 CA MET A 194 -5.093 -13.522 8.898 1.00 0.79 C ATOM 2014 C MET A 194 -5.559 -13.909 7.492 1.00 0.75 C ATOM 2015 O MET A 194 -6.432 -14.737 7.320 1.00 0.90 O ATOM 2016 CB MET A 194 -5.751 -12.202 9.314 1.00 0.91 C ATOM 2017 CG MET A 194 -7.207 -12.455 9.710 1.00 1.47 C ATOM 2018 SD MET A 194 -7.257 -13.340 11.288 1.00 2.35 S ATOM 2019 CE MET A 194 -8.913 -12.813 11.793 1.00 2.94 C ATOM 0 H MET A 194 -3.282 -12.394 8.887 1.00 0.73 H new ATOM 0 HA MET A 194 -5.377 -14.305 9.602 1.00 0.79 H new ATOM 0 HB2 MET A 194 -5.208 -11.761 10.150 1.00 0.91 H new ATOM 0 HB3 MET A 194 -5.706 -11.487 8.492 1.00 0.91 H new ATOM 0 HG2 MET A 194 -7.742 -11.509 9.794 1.00 1.47 H new ATOM 0 HG3 MET A 194 -7.709 -13.038 8.938 1.00 1.47 H new ATOM 0 HE1 MET A 194 -9.155 -13.252 12.761 1.00 2.94 H new ATOM 0 HE2 MET A 194 -8.941 -11.726 11.870 1.00 2.94 H new ATOM 0 HE3 MET A 194 -9.642 -13.144 11.053 1.00 2.94 H new ATOM 2029 N ALA A 195 -4.983 -13.312 6.484 1.00 0.66 N ATOM 2030 CA ALA A 195 -5.389 -13.638 5.088 1.00 0.76 C ATOM 2031 C ALA A 195 -5.267 -15.145 4.843 1.00 0.90 C ATOM 2032 O ALA A 195 -5.952 -15.703 4.011 1.00 1.11 O ATOM 2033 CB ALA A 195 -4.482 -12.890 4.108 1.00 0.82 C ATOM 0 H ALA A 195 -4.247 -12.611 6.568 1.00 0.66 H new ATOM 0 HA ALA A 195 -6.425 -13.335 4.938 1.00 0.76 H new ATOM 0 HB1 ALA A 195 -4.777 -13.127 3.086 1.00 0.82 H new ATOM 0 HB2 ALA A 195 -4.575 -11.817 4.273 1.00 0.82 H new ATOM 0 HB3 ALA A 195 -3.447 -13.193 4.266 1.00 0.82 H new ATOM 2039 N ARG A 196 -4.395 -15.808 5.553 1.00 0.89 N ATOM 2040 CA ARG A 196 -4.232 -17.274 5.343 1.00 1.09 C ATOM 2041 C ARG A 196 -5.453 -18.017 5.888 1.00 1.21 C ATOM 2042 O ARG A 196 -5.964 -18.924 5.265 1.00 1.44 O ATOM 2043 CB ARG A 196 -2.975 -17.765 6.066 1.00 1.11 C ATOM 2044 CG ARG A 196 -2.705 -19.224 5.675 1.00 1.34 C ATOM 2045 CD ARG A 196 -1.355 -19.686 6.240 1.00 1.43 C ATOM 2046 NE ARG A 196 -1.521 -20.087 7.667 1.00 1.90 N ATOM 2047 CZ ARG A 196 -0.591 -20.789 8.258 1.00 2.46 C ATOM 2048 NH1 ARG A 196 0.479 -21.142 7.600 1.00 2.75 N ATOM 2049 NH2 ARG A 196 -0.733 -21.142 9.507 1.00 3.31 N ATOM 0 H ARG A 196 -3.791 -15.400 6.266 1.00 0.89 H new ATOM 0 HA ARG A 196 -4.137 -17.470 4.275 1.00 1.09 H new ATOM 0 HB2 ARG A 196 -2.121 -17.141 5.801 1.00 1.11 H new ATOM 0 HB3 ARG A 196 -3.106 -17.684 7.145 1.00 1.11 H new ATOM 0 HG2 ARG A 196 -3.503 -19.863 6.054 1.00 1.34 H new ATOM 0 HG3 ARG A 196 -2.706 -19.323 4.589 1.00 1.34 H new ATOM 0 HD2 ARG A 196 -0.974 -20.525 5.658 1.00 1.43 H new ATOM 0 HD3 ARG A 196 -0.622 -18.883 6.160 1.00 1.43 H new ATOM 0 HE ARG A 196 -2.359 -19.814 8.180 1.00 1.90 H new ATOM 0 HH11 ARG A 196 0.590 -20.870 6.623 1.00 2.75 H new ATOM 0 HH12 ARG A 196 1.204 -21.690 8.062 1.00 2.75 H new ATOM 0 HH21 ARG A 196 -1.570 -20.870 10.022 1.00 3.31 H new ATOM 0 HH22 ARG A 196 -0.007 -21.690 9.968 1.00 3.31 H new ATOM 2063 N GLU A 197 -5.929 -17.644 7.042 1.00 1.18 N ATOM 2064 CA GLU A 197 -7.114 -18.345 7.613 1.00 1.45 C ATOM 2065 C GLU A 197 -8.340 -18.078 6.738 1.00 1.53 C ATOM 2066 O GLU A 197 -9.182 -18.935 6.559 1.00 1.76 O ATOM 2067 CB GLU A 197 -7.380 -17.826 9.028 1.00 1.53 C ATOM 2068 CG GLU A 197 -6.141 -18.048 9.897 1.00 1.99 C ATOM 2069 CD GLU A 197 -6.511 -17.867 11.371 1.00 2.56 C ATOM 2070 OE1 GLU A 197 -7.345 -18.619 11.850 1.00 3.13 O ATOM 2071 OE2 GLU A 197 -5.953 -16.982 11.997 1.00 3.04 O ATOM 0 H GLU A 197 -5.552 -16.888 7.613 1.00 1.18 H new ATOM 0 HA GLU A 197 -6.918 -19.417 7.646 1.00 1.45 H new ATOM 0 HB2 GLU A 197 -7.629 -16.765 8.996 1.00 1.53 H new ATOM 0 HB3 GLU A 197 -8.237 -18.342 9.460 1.00 1.53 H new ATOM 0 HG2 GLU A 197 -5.743 -19.049 9.732 1.00 1.99 H new ATOM 0 HG3 GLU A 197 -5.358 -17.343 9.619 1.00 1.99 H new ATOM 2078 N LEU A 198 -8.453 -16.898 6.197 1.00 1.41 N ATOM 2079 CA LEU A 198 -9.631 -16.581 5.341 1.00 1.56 C ATOM 2080 C LEU A 198 -9.448 -17.178 3.944 1.00 1.70 C ATOM 2081 O LEU A 198 -10.403 -17.580 3.311 1.00 1.95 O ATOM 2082 CB LEU A 198 -9.781 -15.063 5.214 1.00 1.47 C ATOM 2083 CG LEU A 198 -10.068 -14.441 6.592 1.00 1.53 C ATOM 2084 CD1 LEU A 198 -9.736 -12.946 6.558 1.00 1.82 C ATOM 2085 CD2 LEU A 198 -11.549 -14.615 6.962 1.00 1.83 C ATOM 0 H LEU A 198 -7.781 -16.139 6.310 1.00 1.41 H new ATOM 0 HA LEU A 198 -10.521 -17.007 5.803 1.00 1.56 H new ATOM 0 HB2 LEU A 198 -8.871 -14.634 4.796 1.00 1.47 H new ATOM 0 HB3 LEU A 198 -10.591 -14.827 4.524 1.00 1.47 H new ATOM 0 HG LEU A 198 -9.451 -14.945 7.336 1.00 1.53 H new ATOM 0 HD11 LEU A 198 -9.939 -12.506 7.534 1.00 1.82 H new ATOM 0 HD12 LEU A 198 -8.682 -12.813 6.312 1.00 1.82 H new ATOM 0 HD13 LEU A 198 -10.350 -12.454 5.803 1.00 1.82 H new ATOM 0 HD21 LEU A 198 -11.735 -14.170 7.939 1.00 1.83 H new ATOM 0 HD22 LEU A 198 -12.171 -14.122 6.215 1.00 1.83 H new ATOM 0 HD23 LEU A 198 -11.794 -15.677 6.995 1.00 1.83 H new ATOM 2097 N HIS A 199 -8.236 -17.220 3.443 1.00 1.61 N ATOM 2098 CA HIS A 199 -8.014 -17.768 2.064 1.00 1.79 C ATOM 2099 C HIS A 199 -6.707 -18.580 2.016 1.00 1.68 C ATOM 2100 O HIS A 199 -5.715 -18.149 1.464 1.00 1.85 O ATOM 2101 CB HIS A 199 -7.944 -16.591 1.064 1.00 2.06 C ATOM 2102 CG HIS A 199 -8.789 -15.446 1.559 1.00 2.04 C ATOM 2103 ND1 HIS A 199 -8.237 -14.226 1.916 1.00 2.62 N ATOM 2104 CD2 HIS A 199 -10.143 -15.316 1.761 1.00 2.05 C ATOM 2105 CE1 HIS A 199 -9.243 -13.424 2.311 1.00 2.96 C ATOM 2106 NE2 HIS A 199 -10.426 -14.039 2.236 1.00 2.51 N ATOM 0 H HIS A 199 -7.395 -16.901 3.925 1.00 1.61 H new ATOM 0 HA HIS A 199 -8.838 -18.430 1.798 1.00 1.79 H new ATOM 0 HB2 HIS A 199 -6.911 -16.266 0.943 1.00 2.06 H new ATOM 0 HB3 HIS A 199 -8.293 -16.914 0.083 1.00 2.06 H new ATOM 0 HD2 HIS A 199 -10.876 -16.088 1.579 1.00 2.05 H new ATOM 0 HE1 HIS A 199 -9.110 -12.407 2.648 1.00 2.96 H new ATOM 0 HE2 HIS A 199 -11.340 -13.655 2.475 1.00 2.51 H new ATOM 2114 N PRO A 200 -6.716 -19.760 2.580 1.00 1.59 N ATOM 2115 CA PRO A 200 -5.526 -20.654 2.591 1.00 1.65 C ATOM 2116 C PRO A 200 -5.423 -21.484 1.304 1.00 1.89 C ATOM 2117 O PRO A 200 -4.345 -21.789 0.834 1.00 2.44 O ATOM 2118 CB PRO A 200 -5.789 -21.561 3.798 1.00 1.85 C ATOM 2119 CG PRO A 200 -7.285 -21.672 3.875 1.00 1.95 C ATOM 2120 CD PRO A 200 -7.861 -20.374 3.274 1.00 1.72 C ATOM 0 HA PRO A 200 -4.588 -20.102 2.651 1.00 1.65 H new ATOM 0 HB2 PRO A 200 -5.326 -22.539 3.666 1.00 1.85 H new ATOM 0 HB3 PRO A 200 -5.376 -21.133 4.712 1.00 1.85 H new ATOM 0 HG2 PRO A 200 -7.637 -22.543 3.322 1.00 1.95 H new ATOM 0 HG3 PRO A 200 -7.610 -21.797 4.908 1.00 1.95 H new ATOM 0 HD2 PRO A 200 -8.679 -20.583 2.585 1.00 1.72 H new ATOM 0 HD3 PRO A 200 -8.256 -19.717 4.049 1.00 1.72 H new ATOM 2128 N GLU A 201 -6.541 -21.852 0.739 1.00 1.95 N ATOM 2129 CA GLU A 201 -6.519 -22.668 -0.510 1.00 2.41 C ATOM 2130 C GLU A 201 -5.590 -22.023 -1.540 1.00 2.20 C ATOM 2131 O GLU A 201 -5.220 -22.636 -2.522 1.00 2.62 O ATOM 2132 CB GLU A 201 -7.935 -22.752 -1.087 1.00 2.93 C ATOM 2133 CG GLU A 201 -8.422 -21.349 -1.454 1.00 3.65 C ATOM 2134 CD GLU A 201 -9.912 -21.400 -1.794 1.00 4.31 C ATOM 2135 OE1 GLU A 201 -10.702 -21.566 -0.879 1.00 4.86 O ATOM 2136 OE2 GLU A 201 -10.238 -21.275 -2.963 1.00 4.64 O ATOM 0 H GLU A 201 -7.471 -21.622 1.089 1.00 1.95 H new ATOM 0 HA GLU A 201 -6.155 -23.669 -0.277 1.00 2.41 H new ATOM 0 HB2 GLU A 201 -7.942 -23.393 -1.969 1.00 2.93 H new ATOM 0 HB3 GLU A 201 -8.609 -23.203 -0.359 1.00 2.93 H new ATOM 0 HG2 GLU A 201 -8.251 -20.664 -0.624 1.00 3.65 H new ATOM 0 HG3 GLU A 201 -7.857 -20.967 -2.304 1.00 3.65 H new ATOM 2143 N TYR A 202 -5.207 -20.795 -1.329 1.00 1.91 N ATOM 2144 CA TYR A 202 -4.302 -20.126 -2.304 1.00 2.02 C ATOM 2145 C TYR A 202 -2.870 -20.621 -2.089 1.00 2.17 C ATOM 2146 O TYR A 202 -2.214 -21.070 -3.008 1.00 2.63 O ATOM 2147 CB TYR A 202 -4.359 -18.608 -2.094 1.00 2.25 C ATOM 2148 CG TYR A 202 -5.639 -18.062 -2.685 1.00 2.62 C ATOM 2149 CD1 TYR A 202 -6.844 -18.186 -1.983 1.00 2.97 C ATOM 2150 CD2 TYR A 202 -5.622 -17.435 -3.938 1.00 3.00 C ATOM 2151 CE1 TYR A 202 -8.030 -17.683 -2.531 1.00 3.63 C ATOM 2152 CE2 TYR A 202 -6.808 -16.931 -4.486 1.00 3.60 C ATOM 2153 CZ TYR A 202 -8.012 -17.055 -3.782 1.00 3.90 C ATOM 2154 OH TYR A 202 -9.181 -16.560 -4.323 1.00 4.66 O ATOM 0 H TYR A 202 -5.480 -20.227 -0.527 1.00 1.91 H new ATOM 0 HA TYR A 202 -4.619 -20.363 -3.320 1.00 2.02 H new ATOM 0 HB2 TYR A 202 -4.310 -18.376 -1.030 1.00 2.25 H new ATOM 0 HB3 TYR A 202 -3.498 -18.133 -2.564 1.00 2.25 H new ATOM 0 HD1 TYR A 202 -6.859 -18.670 -1.018 1.00 2.97 H new ATOM 0 HD2 TYR A 202 -4.694 -17.340 -4.482 1.00 3.00 H new ATOM 0 HE1 TYR A 202 -8.959 -17.779 -1.989 1.00 3.63 H new ATOM 0 HE2 TYR A 202 -6.794 -16.447 -5.451 1.00 3.60 H new ATOM 0 HH TYR A 202 -8.992 -16.155 -5.195 1.00 4.66 H new ATOM 2164 N PHE A 203 -2.379 -20.543 -0.881 1.00 2.24 N ATOM 2165 CA PHE A 203 -0.986 -21.008 -0.599 1.00 2.91 C ATOM 2166 C PHE A 203 -1.024 -22.482 -0.171 1.00 3.51 C ATOM 2167 O PHE A 203 -2.045 -22.985 0.257 1.00 4.00 O ATOM 2168 CB PHE A 203 -0.381 -20.147 0.527 1.00 3.09 C ATOM 2169 CG PHE A 203 -0.975 -18.755 0.475 1.00 2.66 C ATOM 2170 CD1 PHE A 203 -0.664 -17.902 -0.591 1.00 2.71 C ATOM 2171 CD2 PHE A 203 -1.838 -18.318 1.490 1.00 2.55 C ATOM 2172 CE1 PHE A 203 -1.215 -16.614 -0.642 1.00 2.44 C ATOM 2173 CE2 PHE A 203 -2.389 -17.031 1.439 1.00 2.24 C ATOM 2174 CZ PHE A 203 -2.077 -16.178 0.373 1.00 2.05 C ATOM 0 H PHE A 203 -2.883 -20.176 -0.074 1.00 2.24 H new ATOM 0 HA PHE A 203 -0.371 -20.909 -1.494 1.00 2.91 H new ATOM 0 HB2 PHE A 203 -0.582 -20.604 1.496 1.00 3.09 H new ATOM 0 HB3 PHE A 203 0.702 -20.096 0.418 1.00 3.09 H new ATOM 0 HD1 PHE A 203 0.000 -18.236 -1.374 1.00 2.71 H new ATOM 0 HD2 PHE A 203 -2.078 -18.975 2.313 1.00 2.55 H new ATOM 0 HE1 PHE A 203 -0.975 -15.957 -1.465 1.00 2.44 H new ATOM 0 HE2 PHE A 203 -3.054 -16.697 2.221 1.00 2.24 H new ATOM 0 HZ PHE A 203 -2.500 -15.185 0.333 1.00 2.05 H new ATOM 2184 N LYS A 204 0.076 -23.178 -0.281 1.00 3.84 N ATOM 2185 CA LYS A 204 0.089 -24.612 0.124 1.00 4.59 C ATOM 2186 C LYS A 204 1.529 -25.130 0.171 1.00 5.09 C ATOM 2187 O LYS A 204 1.869 -25.972 0.978 1.00 5.47 O ATOM 2188 CB LYS A 204 -0.714 -25.437 -0.886 1.00 5.01 C ATOM 2189 CG LYS A 204 -0.979 -26.830 -0.309 1.00 5.49 C ATOM 2190 CD LYS A 204 -1.464 -27.766 -1.421 1.00 6.17 C ATOM 2191 CE LYS A 204 -2.673 -27.151 -2.139 1.00 6.89 C ATOM 2192 NZ LYS A 204 -2.200 -26.202 -3.186 1.00 7.32 N ATOM 0 H LYS A 204 0.963 -22.816 -0.633 1.00 3.84 H new ATOM 0 HA LYS A 204 -0.359 -24.706 1.113 1.00 4.59 H new ATOM 0 HB2 LYS A 204 -1.657 -24.939 -1.111 1.00 5.01 H new ATOM 0 HB3 LYS A 204 -0.165 -25.518 -1.824 1.00 5.01 H new ATOM 0 HG2 LYS A 204 -0.069 -27.226 0.142 1.00 5.49 H new ATOM 0 HG3 LYS A 204 -1.727 -26.770 0.482 1.00 5.49 H new ATOM 0 HD2 LYS A 204 -0.659 -27.943 -2.134 1.00 6.17 H new ATOM 0 HD3 LYS A 204 -1.735 -28.734 -1.000 1.00 6.17 H new ATOM 0 HE2 LYS A 204 -3.279 -27.936 -2.592 1.00 6.89 H new ATOM 0 HE3 LYS A 204 -3.309 -26.631 -1.423 1.00 6.89 H new ATOM 0 HZ1 LYS A 204 -2.347 -25.225 -2.861 1.00 7.32 H new ATOM 0 HZ2 LYS A 204 -1.188 -26.359 -3.365 1.00 7.32 H new ATOM 0 HZ3 LYS A 204 -2.735 -26.359 -4.064 1.00 7.32 H new ATOM 2206 N ASN A 205 2.379 -24.637 -0.688 1.00 5.49 N ATOM 2207 CA ASN A 205 3.794 -25.109 -0.686 1.00 6.31 C ATOM 2208 C ASN A 205 4.516 -24.557 0.544 1.00 6.66 C ATOM 2209 O ASN A 205 4.720 -25.252 1.519 1.00 6.90 O ATOM 2210 CB ASN A 205 4.498 -24.624 -1.956 1.00 6.97 C ATOM 2211 CG ASN A 205 5.980 -25.002 -1.894 1.00 7.47 C ATOM 2212 OD1 ASN A 205 6.840 -24.144 -1.944 1.00 7.58 O ATOM 2213 ND2 ASN A 205 6.317 -26.258 -1.789 1.00 8.08 N ATOM 0 H ASN A 205 2.157 -23.930 -1.389 1.00 5.49 H new ATOM 0 HA ASN A 205 3.812 -26.198 -0.657 1.00 6.31 H new ATOM 0 HB2 ASN A 205 4.034 -25.071 -2.835 1.00 6.97 H new ATOM 0 HB3 ASN A 205 4.391 -23.544 -2.054 1.00 6.97 H new ATOM 0 HD21 ASN A 205 7.302 -26.520 -1.749 1.00 8.08 H new ATOM 0 HD22 ASN A 205 5.596 -26.978 -1.747 1.00 8.08 H new ATOM 2220 N ALA A 206 4.908 -23.312 0.507 1.00 7.01 N ATOM 2221 CA ALA A 206 5.619 -22.722 1.678 1.00 7.67 C ATOM 2222 C ALA A 206 4.599 -22.319 2.744 1.00 7.99 C ATOM 2223 O ALA A 206 3.467 -22.762 2.649 1.00 8.32 O ATOM 2224 CB ALA A 206 6.402 -21.486 1.230 1.00 8.33 C ATOM 2225 OXT ALA A 206 4.968 -21.574 3.636 1.00 8.16 O ATOM 0 H ALA A 206 4.767 -22.679 -0.281 1.00 7.01 H new ATOM 0 HA ALA A 206 6.307 -23.458 2.093 1.00 7.67 H new ATOM 0 HB1 ALA A 206 6.922 -21.055 2.086 1.00 8.33 H new ATOM 0 HB2 ALA A 206 7.129 -21.772 0.470 1.00 8.33 H new ATOM 0 HB3 ALA A 206 5.714 -20.750 0.815 1.00 8.33 H new TER 2231 ALA A 206