USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 554 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 138 ASN : amide:sc= -0.0603 K(o=-1.5,f=-4.6!) USER MOD Set 1.2: A 141 GLN : amide:sc= -1.43 K(o=-1.5,f=-0.79) USER MOD Set 2.1: A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 131 THR OG1 : rot 89:sc= 1.22 USER MOD Single : A 101 ASN : amide:sc= -1.09! X(o=-1.1!,f=-0.62) USER MOD Single : A 104 GLN : amide:sc=-0.000422 K(o=-0.00042,f=-0.99) USER MOD Single : A 106 SER OG : rot -90:sc= -3.83! USER MOD Single : A 107 ASN : amide:sc= -4.39! C(o=-4.4!,f=-4.8!) USER MOD Single : A 109 GLN : amide:sc= -0.26 X(o=-0.26,f=-0.65) USER MOD Single : A 112 HIS : no HD1:sc= -1.84 X(o=-1.8,f=-1.4) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0877) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -0.393 K(o=-0.39,f=-2.6!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.975 K(o=-0.97,f=-0.038) USER MOD Single : A 144 ASN : amide:sc= -0.22 X(o=-0.22,f=0) USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 148 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 150 HIS : no HD1:sc= -3.05! C(o=-3!,f=-3.4!) USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=-0.072) USER MOD Single : A 152 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 96 1.488 12.452 -2.087 1.00 0.00 N ATOM 60 CA GLY A 96 1.916 11.197 -1.497 1.00 0.00 C ATOM 61 C GLY A 96 0.749 10.315 -1.100 1.00 0.00 C ATOM 62 O GLY A 96 -0.374 10.794 -0.943 1.00 0.00 O ATOM 0 HA2 GLY A 96 2.547 10.662 -2.207 1.00 0.00 H new ATOM 0 HA3 GLY A 96 2.528 11.402 -0.618 1.00 0.00 H new ATOM 66 N ILE A 97 1.014 9.023 -0.937 1.00 0.00 N ATOM 67 CA ILE A 97 -0.023 8.073 -0.556 1.00 0.00 C ATOM 68 C ILE A 97 0.518 7.027 0.412 1.00 0.00 C ATOM 69 O ILE A 97 1.726 6.800 0.486 1.00 0.00 O ATOM 70 CB ILE A 97 -0.613 7.360 -1.788 1.00 0.00 C ATOM 71 CG1 ILE A 97 0.502 6.706 -2.607 1.00 0.00 C ATOM 72 CG2 ILE A 97 -1.400 8.342 -2.642 1.00 0.00 C ATOM 73 CD1 ILE A 97 -0.005 5.718 -3.635 1.00 0.00 C ATOM 0 H ILE A 97 1.938 8.610 -1.063 1.00 0.00 H new ATOM 0 HA ILE A 97 -0.810 8.645 -0.065 1.00 0.00 H new ATOM 0 HB ILE A 97 -1.294 6.580 -1.448 1.00 0.00 H new ATOM 0 HG12 ILE A 97 1.074 7.483 -3.113 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.187 6.195 -1.931 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -1.810 7.823 -3.508 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -2.214 8.765 -2.053 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.740 9.142 -2.977 1.00 0.00 H new ATOM 0 HD11 ILE A 97 0.839 5.293 -4.178 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -0.553 4.920 -3.134 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -0.667 6.228 -4.334 1.00 0.00 H new ATOM 85 N LEU A 98 -0.383 6.392 1.153 1.00 0.00 N ATOM 86 CA LEU A 98 0.003 5.367 2.117 1.00 0.00 C ATOM 87 C LEU A 98 -0.368 3.977 1.611 1.00 0.00 C ATOM 88 O LEU A 98 -1.523 3.714 1.275 1.00 0.00 O ATOM 89 CB LEU A 98 -0.670 5.629 3.465 1.00 0.00 C ATOM 90 CG LEU A 98 -0.547 7.051 4.013 1.00 0.00 C ATOM 91 CD1 LEU A 98 -1.316 7.189 5.317 1.00 0.00 C ATOM 92 CD2 LEU A 98 0.915 7.421 4.212 1.00 0.00 C ATOM 0 H LEU A 98 -1.386 6.569 1.105 1.00 0.00 H new ATOM 0 HA LEU A 98 1.085 5.410 2.244 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.729 5.387 3.373 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.249 4.941 4.198 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.979 7.739 3.286 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.217 8.208 5.692 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -2.369 6.967 5.144 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.914 6.491 6.052 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.983 8.436 4.602 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.373 6.729 4.919 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.438 7.363 3.257 1.00 0.00 H new ATOM 104 N VAL A 99 0.619 3.088 1.562 1.00 0.00 N ATOM 105 CA VAL A 99 0.397 1.723 1.101 1.00 0.00 C ATOM 106 C VAL A 99 0.197 0.772 2.276 1.00 0.00 C ATOM 107 O VAL A 99 1.148 0.161 2.764 1.00 0.00 O ATOM 108 CB VAL A 99 1.573 1.221 0.244 1.00 0.00 C ATOM 109 CG1 VAL A 99 1.507 -0.289 0.076 1.00 0.00 C ATOM 110 CG2 VAL A 99 1.580 1.916 -1.109 1.00 0.00 C ATOM 0 H VAL A 99 1.581 3.289 1.836 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.506 1.738 0.491 1.00 0.00 H new ATOM 0 HB VAL A 99 2.503 1.464 0.758 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.347 -0.624 -0.533 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.555 -0.766 1.055 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.572 -0.560 -0.415 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.418 1.549 -1.702 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.646 1.706 -1.631 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.681 2.992 -0.965 1.00 0.00 H new ATOM 120 N LYS A 100 -1.048 0.650 2.726 1.00 0.00 N ATOM 121 CA LYS A 100 -1.375 -0.228 3.843 1.00 0.00 C ATOM 122 C LYS A 100 -1.867 -1.583 3.344 1.00 0.00 C ATOM 123 O LYS A 100 -2.237 -1.729 2.180 1.00 0.00 O ATOM 124 CB LYS A 100 -2.442 0.418 4.731 1.00 0.00 C ATOM 125 CG LYS A 100 -2.017 1.751 5.321 1.00 0.00 C ATOM 126 CD LYS A 100 -2.854 2.117 6.534 1.00 0.00 C ATOM 127 CE LYS A 100 -2.188 3.203 7.365 1.00 0.00 C ATOM 128 NZ LYS A 100 -1.092 2.658 8.213 1.00 0.00 N ATOM 0 H LYS A 100 -1.847 1.148 2.334 1.00 0.00 H new ATOM 0 HA LYS A 100 -0.469 -0.383 4.428 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -3.351 0.562 4.146 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -2.690 -0.266 5.542 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -0.965 1.706 5.604 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -2.110 2.531 4.565 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -3.837 2.458 6.209 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -3.011 1.231 7.150 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -1.788 3.972 6.704 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -2.933 3.684 7.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -0.663 3.429 8.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -1.478 1.942 8.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -0.368 2.222 7.607 1.00 0.00 H new ATOM 142 N ASN A 101 -1.867 -2.571 4.233 1.00 0.00 N ATOM 143 CA ASN A 101 -2.314 -3.914 3.882 1.00 0.00 C ATOM 144 C ASN A 101 -1.292 -4.612 2.989 1.00 0.00 C ATOM 145 O ASN A 101 -1.652 -5.270 2.012 1.00 0.00 O ATOM 146 CB ASN A 101 -3.670 -3.855 3.175 1.00 0.00 C ATOM 147 CG ASN A 101 -4.507 -5.095 3.424 1.00 0.00 C ATOM 148 OD1 ASN A 101 -4.664 -5.532 4.564 1.00 0.00 O ATOM 149 ND2 ASN A 101 -5.048 -5.668 2.356 1.00 0.00 N ATOM 0 H ASN A 101 -1.563 -2.467 5.201 1.00 0.00 H new ATOM 0 HA ASN A 101 -2.417 -4.488 4.803 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -4.217 -2.976 3.517 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -3.513 -3.735 2.103 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -5.621 -6.505 2.462 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -4.891 -5.271 1.430 1.00 0.00 H new ATOM 156 N LEU A 102 -0.017 -4.463 3.332 1.00 0.00 N ATOM 157 CA LEU A 102 1.058 -5.079 2.562 1.00 0.00 C ATOM 158 C LEU A 102 1.339 -6.495 3.055 1.00 0.00 C ATOM 159 O LEU A 102 1.039 -6.853 4.194 1.00 0.00 O ATOM 160 CB LEU A 102 2.329 -4.233 2.656 1.00 0.00 C ATOM 161 CG LEU A 102 2.366 -2.978 1.783 1.00 0.00 C ATOM 162 CD1 LEU A 102 3.570 -2.119 2.134 1.00 0.00 C ATOM 163 CD2 LEU A 102 2.388 -3.355 0.309 1.00 0.00 C ATOM 0 H LEU A 102 0.297 -3.922 4.137 1.00 0.00 H new ATOM 0 HA LEU A 102 0.741 -5.133 1.521 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.466 -3.933 3.695 1.00 0.00 H new ATOM 0 HB3 LEU A 102 3.180 -4.861 2.391 1.00 0.00 H new ATOM 0 HG LEU A 102 1.464 -2.397 1.976 1.00 0.00 H new ATOM 0 HD11 LEU A 102 3.580 -1.231 1.503 1.00 0.00 H new ATOM 0 HD12 LEU A 102 3.511 -1.820 3.180 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.484 -2.690 1.971 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.414 -2.450 -0.298 1.00 0.00 H new ATOM 0 HD22 LEU A 102 3.272 -3.957 0.101 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.493 -3.928 0.067 1.00 0.00 H new ATOM 175 N PRO A 103 1.930 -7.321 2.179 1.00 0.00 N ATOM 176 CA PRO A 103 2.267 -8.710 2.504 1.00 0.00 C ATOM 177 C PRO A 103 3.404 -8.810 3.515 1.00 0.00 C ATOM 178 O PRO A 103 3.838 -7.803 4.074 1.00 0.00 O ATOM 179 CB PRO A 103 2.697 -9.295 1.156 1.00 0.00 C ATOM 180 CG PRO A 103 3.166 -8.123 0.366 1.00 0.00 C ATOM 181 CD PRO A 103 2.316 -6.962 0.804 1.00 0.00 C ATOM 0 HA PRO A 103 1.430 -9.235 2.965 1.00 0.00 H new ATOM 0 HB2 PRO A 103 3.490 -10.032 1.280 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.867 -9.800 0.661 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.222 -7.925 0.551 1.00 0.00 H new ATOM 0 HG3 PRO A 103 3.058 -8.305 -0.703 1.00 0.00 H new ATOM 0 HD2 PRO A 103 2.871 -6.024 0.774 1.00 0.00 H new ATOM 0 HD3 PRO A 103 1.444 -6.837 0.162 1.00 0.00 H new ATOM 189 N GLN A 104 3.882 -10.029 3.744 1.00 0.00 N ATOM 190 CA GLN A 104 4.969 -10.258 4.688 1.00 0.00 C ATOM 191 C GLN A 104 6.320 -9.968 4.043 1.00 0.00 C ATOM 192 O GLN A 104 7.235 -9.466 4.696 1.00 0.00 O ATOM 193 CB GLN A 104 4.933 -11.699 5.199 1.00 0.00 C ATOM 194 CG GLN A 104 5.607 -11.883 6.549 1.00 0.00 C ATOM 195 CD GLN A 104 5.876 -13.339 6.874 1.00 0.00 C ATOM 196 OE1 GLN A 104 5.467 -14.237 6.138 1.00 0.00 O ATOM 197 NE2 GLN A 104 6.570 -13.581 7.980 1.00 0.00 N ATOM 0 H GLN A 104 3.534 -10.873 3.289 1.00 0.00 H new ATOM 0 HA GLN A 104 4.836 -9.578 5.529 1.00 0.00 H new ATOM 0 HB2 GLN A 104 3.895 -12.023 5.273 1.00 0.00 H new ATOM 0 HB3 GLN A 104 5.418 -12.347 4.469 1.00 0.00 H new ATOM 0 HG2 GLN A 104 6.548 -11.333 6.559 1.00 0.00 H new ATOM 0 HG3 GLN A 104 4.977 -11.452 7.327 1.00 0.00 H new ATOM 0 HE21 GLN A 104 6.890 -12.806 8.561 1.00 0.00 H new ATOM 0 HE22 GLN A 104 6.783 -14.542 8.248 1.00 0.00 H new ATOM 206 N ASP A 105 6.438 -10.287 2.759 1.00 0.00 N ATOM 207 CA ASP A 105 7.678 -10.061 2.026 1.00 0.00 C ATOM 208 C ASP A 105 7.554 -8.846 1.111 1.00 0.00 C ATOM 209 O ASP A 105 8.147 -8.804 0.034 1.00 0.00 O ATOM 210 CB ASP A 105 8.043 -11.298 1.204 1.00 0.00 C ATOM 211 CG ASP A 105 9.478 -11.266 0.717 1.00 0.00 C ATOM 212 OD1 ASP A 105 10.389 -11.497 1.539 1.00 0.00 O ATOM 213 OD2 ASP A 105 9.691 -11.009 -0.487 1.00 0.00 O ATOM 0 H ASP A 105 5.690 -10.703 2.204 1.00 0.00 H new ATOM 0 HA ASP A 105 8.470 -9.870 2.750 1.00 0.00 H new ATOM 0 HB2 ASP A 105 7.887 -12.191 1.809 1.00 0.00 H new ATOM 0 HB3 ASP A 105 7.373 -11.372 0.347 1.00 0.00 H new ATOM 218 N SER A 106 6.777 -7.859 1.548 1.00 0.00 N ATOM 219 CA SER A 106 6.571 -6.646 0.767 1.00 0.00 C ATOM 220 C SER A 106 7.867 -5.849 0.649 1.00 0.00 C ATOM 221 O SER A 106 8.732 -5.917 1.521 1.00 0.00 O ATOM 222 CB SER A 106 5.483 -5.781 1.407 1.00 0.00 C ATOM 223 OG SER A 106 4.901 -4.907 0.455 1.00 0.00 O ATOM 0 H SER A 106 6.280 -7.877 2.439 1.00 0.00 H new ATOM 0 HA SER A 106 6.252 -6.937 -0.234 1.00 0.00 H new ATOM 0 HB2 SER A 106 4.712 -6.420 1.838 1.00 0.00 H new ATOM 0 HB3 SER A 106 5.910 -5.201 2.225 1.00 0.00 H new ATOM 0 HG SER A 106 5.397 -4.062 0.441 1.00 0.00 H new ATOM 229 N ASN A 107 7.992 -5.092 -0.437 1.00 0.00 N ATOM 230 CA ASN A 107 9.182 -4.282 -0.670 1.00 0.00 C ATOM 231 C ASN A 107 8.882 -3.143 -1.640 1.00 0.00 C ATOM 232 O ASN A 107 7.847 -3.136 -2.306 1.00 0.00 O ATOM 233 CB ASN A 107 10.316 -5.150 -1.221 1.00 0.00 C ATOM 234 CG ASN A 107 10.380 -6.510 -0.552 1.00 0.00 C ATOM 235 OD1 ASN A 107 10.925 -6.650 0.543 1.00 0.00 O ATOM 236 ND2 ASN A 107 9.821 -7.519 -1.210 1.00 0.00 N ATOM 0 H ASN A 107 7.284 -5.023 -1.168 1.00 0.00 H new ATOM 0 HA ASN A 107 9.492 -3.853 0.283 1.00 0.00 H new ATOM 0 HB2 ASN A 107 10.180 -5.282 -2.294 1.00 0.00 H new ATOM 0 HB3 ASN A 107 11.266 -4.634 -1.081 1.00 0.00 H new ATOM 0 HD21 ASN A 107 9.832 -8.457 -0.810 1.00 0.00 H new ATOM 0 HD22 ASN A 107 9.380 -7.356 -2.115 1.00 0.00 H new ATOM 243 N CYS A 108 9.796 -2.180 -1.713 1.00 0.00 N ATOM 244 CA CYS A 108 9.631 -1.035 -2.601 1.00 0.00 C ATOM 245 C CYS A 108 9.591 -1.479 -4.060 1.00 0.00 C ATOM 246 O CYS A 108 8.605 -1.252 -4.761 1.00 0.00 O ATOM 247 CB CYS A 108 10.769 -0.034 -2.392 1.00 0.00 C ATOM 248 SG CYS A 108 10.445 1.616 -3.092 1.00 0.00 S ATOM 0 H CYS A 108 10.658 -2.170 -1.168 1.00 0.00 H new ATOM 0 HA CYS A 108 8.683 -0.554 -2.360 1.00 0.00 H new ATOM 0 HB2 CYS A 108 10.958 0.067 -1.323 1.00 0.00 H new ATOM 0 HB3 CYS A 108 11.678 -0.435 -2.840 1.00 0.00 H new ATOM 253 N GLN A 109 10.669 -2.113 -4.510 1.00 0.00 N ATOM 254 CA GLN A 109 10.757 -2.589 -5.885 1.00 0.00 C ATOM 255 C GLN A 109 9.395 -3.057 -6.387 1.00 0.00 C ATOM 256 O GLN A 109 9.028 -2.808 -7.535 1.00 0.00 O ATOM 257 CB GLN A 109 11.772 -3.728 -5.989 1.00 0.00 C ATOM 258 CG GLN A 109 12.312 -3.936 -7.395 1.00 0.00 C ATOM 259 CD GLN A 109 12.978 -2.694 -7.954 1.00 0.00 C ATOM 260 OE1 GLN A 109 13.609 -1.931 -7.221 1.00 0.00 O ATOM 261 NE2 GLN A 109 12.840 -2.483 -9.258 1.00 0.00 N ATOM 0 H GLN A 109 11.493 -2.309 -3.942 1.00 0.00 H new ATOM 0 HA GLN A 109 11.088 -1.759 -6.510 1.00 0.00 H new ATOM 0 HB2 GLN A 109 12.605 -3.524 -5.316 1.00 0.00 H new ATOM 0 HB3 GLN A 109 11.305 -4.652 -5.648 1.00 0.00 H new ATOM 0 HG2 GLN A 109 13.030 -4.756 -7.387 1.00 0.00 H new ATOM 0 HG3 GLN A 109 11.496 -4.234 -8.053 1.00 0.00 H new ATOM 0 HE21 GLN A 109 12.309 -3.141 -9.828 1.00 0.00 H new ATOM 0 HE22 GLN A 109 13.265 -1.663 -9.690 1.00 0.00 H new ATOM 270 N GLU A 110 8.652 -3.737 -5.520 1.00 0.00 N ATOM 271 CA GLU A 110 7.331 -4.241 -5.877 1.00 0.00 C ATOM 272 C GLU A 110 6.356 -3.092 -6.113 1.00 0.00 C ATOM 273 O GLU A 110 5.647 -3.061 -7.119 1.00 0.00 O ATOM 274 CB GLU A 110 6.797 -5.160 -4.777 1.00 0.00 C ATOM 275 CG GLU A 110 7.170 -6.621 -4.969 1.00 0.00 C ATOM 276 CD GLU A 110 8.658 -6.868 -4.815 1.00 0.00 C ATOM 277 OE1 GLU A 110 9.336 -6.034 -4.179 1.00 0.00 O ATOM 278 OE2 GLU A 110 9.144 -7.896 -5.330 1.00 0.00 O ATOM 0 H GLU A 110 8.942 -3.952 -4.566 1.00 0.00 H new ATOM 0 HA GLU A 110 7.425 -4.810 -6.802 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.179 -4.820 -3.814 1.00 0.00 H new ATOM 0 HB3 GLU A 110 5.711 -5.073 -4.738 1.00 0.00 H new ATOM 0 HG2 GLU A 110 6.628 -7.229 -4.245 1.00 0.00 H new ATOM 0 HG3 GLU A 110 6.852 -6.946 -5.960 1.00 0.00 H new ATOM 285 N VAL A 111 6.325 -2.148 -5.178 1.00 0.00 N ATOM 286 CA VAL A 111 5.438 -0.996 -5.283 1.00 0.00 C ATOM 287 C VAL A 111 5.860 -0.079 -6.426 1.00 0.00 C ATOM 288 O VAL A 111 5.058 0.254 -7.299 1.00 0.00 O ATOM 289 CB VAL A 111 5.411 -0.186 -3.973 1.00 0.00 C ATOM 290 CG1 VAL A 111 4.511 1.032 -4.116 1.00 0.00 C ATOM 291 CG2 VAL A 111 4.957 -1.062 -2.815 1.00 0.00 C ATOM 0 H VAL A 111 6.904 -2.159 -4.339 1.00 0.00 H new ATOM 0 HA VAL A 111 4.439 -1.384 -5.482 1.00 0.00 H new ATOM 0 HB VAL A 111 6.422 0.163 -3.761 1.00 0.00 H new ATOM 0 HG11 VAL A 111 4.505 1.592 -3.181 1.00 0.00 H new ATOM 0 HG12 VAL A 111 4.885 1.669 -4.917 1.00 0.00 H new ATOM 0 HG13 VAL A 111 3.497 0.709 -4.353 1.00 0.00 H new ATOM 0 HG21 VAL A 111 4.944 -0.474 -1.897 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.956 -1.442 -3.017 1.00 0.00 H new ATOM 0 HG23 VAL A 111 5.646 -1.899 -2.700 1.00 0.00 H new ATOM 301 N HIS A 112 7.126 0.326 -6.415 1.00 0.00 N ATOM 302 CA HIS A 112 7.657 1.205 -7.451 1.00 0.00 C ATOM 303 C HIS A 112 7.105 0.824 -8.821 1.00 0.00 C ATOM 304 O HIS A 112 6.431 1.621 -9.474 1.00 0.00 O ATOM 305 CB HIS A 112 9.185 1.143 -7.469 1.00 0.00 C ATOM 306 CG HIS A 112 9.829 2.387 -7.998 1.00 0.00 C ATOM 307 ND1 HIS A 112 10.868 3.028 -7.357 1.00 0.00 N ATOM 308 CD2 HIS A 112 9.576 3.108 -9.115 1.00 0.00 C ATOM 309 CE1 HIS A 112 11.226 4.090 -8.056 1.00 0.00 C ATOM 310 NE2 HIS A 112 10.458 4.161 -9.128 1.00 0.00 N ATOM 0 H HIS A 112 7.803 0.060 -5.700 1.00 0.00 H new ATOM 0 HA HIS A 112 7.345 2.224 -7.223 1.00 0.00 H new ATOM 0 HB2 HIS A 112 9.545 0.960 -6.457 1.00 0.00 H new ATOM 0 HB3 HIS A 112 9.499 0.295 -8.077 1.00 0.00 H new ATOM 0 HD2 HIS A 112 8.821 2.895 -9.858 1.00 0.00 H new ATOM 0 HE1 HIS A 112 12.013 4.782 -7.795 1.00 0.00 H new ATOM 0 HE2 HIS A 112 10.511 4.881 -9.849 1.00 0.00 H new ATOM 319 N ASP A 113 7.395 -0.399 -9.251 1.00 0.00 N ATOM 320 CA ASP A 113 6.927 -0.886 -10.544 1.00 0.00 C ATOM 321 C ASP A 113 5.410 -0.771 -10.652 1.00 0.00 C ATOM 322 O ASP A 113 4.877 -0.412 -11.703 1.00 0.00 O ATOM 323 CB ASP A 113 7.356 -2.340 -10.751 1.00 0.00 C ATOM 324 CG ASP A 113 7.192 -2.793 -12.188 1.00 0.00 C ATOM 325 OD1 ASP A 113 6.065 -2.693 -12.716 1.00 0.00 O ATOM 326 OD2 ASP A 113 8.190 -3.249 -12.785 1.00 0.00 O ATOM 0 H ASP A 113 7.952 -1.071 -8.723 1.00 0.00 H new ATOM 0 HA ASP A 113 7.376 -0.268 -11.321 1.00 0.00 H new ATOM 0 HB2 ASP A 113 8.399 -2.454 -10.454 1.00 0.00 H new ATOM 0 HB3 ASP A 113 6.767 -2.986 -10.100 1.00 0.00 H new ATOM 331 N LEU A 114 4.720 -1.078 -9.559 1.00 0.00 N ATOM 332 CA LEU A 114 3.263 -1.009 -9.530 1.00 0.00 C ATOM 333 C LEU A 114 2.779 0.409 -9.813 1.00 0.00 C ATOM 334 O LEU A 114 1.851 0.615 -10.597 1.00 0.00 O ATOM 335 CB LEU A 114 2.737 -1.478 -8.172 1.00 0.00 C ATOM 336 CG LEU A 114 1.217 -1.506 -8.014 1.00 0.00 C ATOM 337 CD1 LEU A 114 0.610 -2.601 -8.879 1.00 0.00 C ATOM 338 CD2 LEU A 114 0.835 -1.704 -6.554 1.00 0.00 C ATOM 0 H LEU A 114 5.146 -1.377 -8.682 1.00 0.00 H new ATOM 0 HA LEU A 114 2.878 -1.667 -10.309 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.120 -2.481 -7.983 1.00 0.00 H new ATOM 0 HB3 LEU A 114 3.150 -0.828 -7.401 1.00 0.00 H new ATOM 0 HG LEU A 114 0.819 -0.547 -8.346 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -0.473 -2.606 -8.753 1.00 0.00 H new ATOM 0 HD12 LEU A 114 0.853 -2.415 -9.925 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.014 -3.568 -8.579 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.251 -1.721 -6.461 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.245 -2.648 -6.195 1.00 0.00 H new ATOM 0 HD23 LEU A 114 1.237 -0.884 -5.958 1.00 0.00 H new ATOM 350 N LEU A 115 3.414 1.385 -9.173 1.00 0.00 N ATOM 351 CA LEU A 115 3.050 2.785 -9.357 1.00 0.00 C ATOM 352 C LEU A 115 4.033 3.485 -10.289 1.00 0.00 C ATOM 353 O LEU A 115 4.404 4.638 -10.065 1.00 0.00 O ATOM 354 CB LEU A 115 3.008 3.504 -8.007 1.00 0.00 C ATOM 355 CG LEU A 115 1.760 3.264 -7.158 1.00 0.00 C ATOM 356 CD1 LEU A 115 1.973 3.772 -5.740 1.00 0.00 C ATOM 357 CD2 LEU A 115 0.548 3.934 -7.789 1.00 0.00 C ATOM 0 H LEU A 115 4.184 1.232 -8.522 1.00 0.00 H new ATOM 0 HA LEU A 115 2.060 2.821 -9.811 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.880 3.200 -7.429 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.101 4.575 -8.185 1.00 0.00 H new ATOM 0 HG LEU A 115 1.575 2.191 -7.114 1.00 0.00 H new ATOM 0 HD11 LEU A 115 1.074 3.593 -5.150 1.00 0.00 H new ATOM 0 HD12 LEU A 115 2.814 3.247 -5.288 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.184 4.841 -5.764 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -0.331 3.752 -7.171 1.00 0.00 H new ATOM 0 HD22 LEU A 115 0.723 5.007 -7.864 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.382 3.523 -8.785 1.00 0.00 H new ATOM 369 N LYS A 116 4.451 2.782 -11.336 1.00 0.00 N ATOM 370 CA LYS A 116 5.389 3.336 -12.305 1.00 0.00 C ATOM 371 C LYS A 116 4.792 4.551 -13.008 1.00 0.00 C ATOM 372 O LYS A 116 5.434 5.595 -13.117 1.00 0.00 O ATOM 373 CB LYS A 116 5.774 2.275 -13.338 1.00 0.00 C ATOM 374 CG LYS A 116 4.589 1.718 -14.109 1.00 0.00 C ATOM 375 CD LYS A 116 4.901 0.354 -14.701 1.00 0.00 C ATOM 376 CE LYS A 116 5.635 0.476 -16.027 1.00 0.00 C ATOM 377 NZ LYS A 116 6.516 -0.696 -16.284 1.00 0.00 N ATOM 0 H LYS A 116 4.155 1.827 -11.535 1.00 0.00 H new ATOM 0 HA LYS A 116 6.283 3.652 -11.767 1.00 0.00 H new ATOM 0 HB2 LYS A 116 6.485 2.707 -14.043 1.00 0.00 H new ATOM 0 HB3 LYS A 116 6.285 1.456 -12.832 1.00 0.00 H new ATOM 0 HG2 LYS A 116 3.727 1.640 -13.447 1.00 0.00 H new ATOM 0 HG3 LYS A 116 4.316 2.408 -14.907 1.00 0.00 H new ATOM 0 HD2 LYS A 116 5.508 -0.218 -13.999 1.00 0.00 H new ATOM 0 HD3 LYS A 116 3.974 -0.201 -14.847 1.00 0.00 H new ATOM 0 HE2 LYS A 116 4.910 0.570 -16.836 1.00 0.00 H new ATOM 0 HE3 LYS A 116 6.233 1.387 -16.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 6.998 -0.574 -17.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 7.224 -0.771 -15.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 5.942 -1.563 -16.309 1.00 0.00 H new ATOM 391 N ASP A 117 3.559 4.408 -13.481 1.00 0.00 N ATOM 392 CA ASP A 117 2.873 5.495 -14.171 1.00 0.00 C ATOM 393 C ASP A 117 3.164 6.833 -13.499 1.00 0.00 C ATOM 394 O ASP A 117 3.487 7.816 -14.166 1.00 0.00 O ATOM 395 CB ASP A 117 1.366 5.239 -14.198 1.00 0.00 C ATOM 396 CG ASP A 117 0.623 6.249 -15.051 1.00 0.00 C ATOM 397 OD1 ASP A 117 0.464 7.403 -14.602 1.00 0.00 O ATOM 398 OD2 ASP A 117 0.199 5.884 -16.168 1.00 0.00 O ATOM 0 H ASP A 117 3.014 3.550 -13.399 1.00 0.00 H new ATOM 0 HA ASP A 117 3.244 5.535 -15.195 1.00 0.00 H new ATOM 0 HB2 ASP A 117 1.177 4.236 -14.581 1.00 0.00 H new ATOM 0 HB3 ASP A 117 0.977 5.271 -13.180 1.00 0.00 H new ATOM 403 N TYR A 118 3.044 6.864 -12.177 1.00 0.00 N ATOM 404 CA TYR A 118 3.290 8.082 -11.415 1.00 0.00 C ATOM 405 C TYR A 118 4.765 8.204 -11.043 1.00 0.00 C ATOM 406 O TYR A 118 5.477 7.204 -10.946 1.00 0.00 O ATOM 407 CB TYR A 118 2.430 8.101 -10.150 1.00 0.00 C ATOM 408 CG TYR A 118 1.007 7.645 -10.380 1.00 0.00 C ATOM 409 CD1 TYR A 118 0.673 6.296 -10.337 1.00 0.00 C ATOM 410 CD2 TYR A 118 -0.004 8.561 -10.640 1.00 0.00 C ATOM 411 CE1 TYR A 118 -0.625 5.875 -10.546 1.00 0.00 C ATOM 412 CE2 TYR A 118 -1.306 8.149 -10.849 1.00 0.00 C ATOM 413 CZ TYR A 118 -1.611 6.805 -10.801 1.00 0.00 C ATOM 414 OH TYR A 118 -2.907 6.390 -11.011 1.00 0.00 O ATOM 0 H TYR A 118 2.778 6.059 -11.610 1.00 0.00 H new ATOM 0 HA TYR A 118 3.021 8.932 -12.042 1.00 0.00 H new ATOM 0 HB2 TYR A 118 2.891 7.461 -9.398 1.00 0.00 H new ATOM 0 HB3 TYR A 118 2.418 9.112 -9.744 1.00 0.00 H new ATOM 0 HD1 TYR A 118 1.442 5.565 -10.137 1.00 0.00 H new ATOM 0 HD2 TYR A 118 0.232 9.614 -10.680 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -0.867 4.823 -10.510 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -2.080 8.875 -11.049 1.00 0.00 H new ATOM 0 HH TYR A 118 -3.477 7.170 -11.176 1.00 0.00 H new ATOM 424 N ASP A 119 5.216 9.435 -10.834 1.00 0.00 N ATOM 425 CA ASP A 119 6.605 9.690 -10.470 1.00 0.00 C ATOM 426 C ASP A 119 6.835 9.426 -8.985 1.00 0.00 C ATOM 427 O ASP A 119 6.096 9.923 -8.134 1.00 0.00 O ATOM 428 CB ASP A 119 6.988 11.131 -10.810 1.00 0.00 C ATOM 429 CG ASP A 119 8.489 11.344 -10.820 1.00 0.00 C ATOM 430 OD1 ASP A 119 9.085 11.414 -9.725 1.00 0.00 O ATOM 431 OD2 ASP A 119 9.068 11.441 -11.923 1.00 0.00 O ATOM 0 H ASP A 119 4.640 10.273 -10.910 1.00 0.00 H new ATOM 0 HA ASP A 119 7.235 9.010 -11.043 1.00 0.00 H new ATOM 0 HB2 ASP A 119 6.580 11.391 -11.787 1.00 0.00 H new ATOM 0 HB3 ASP A 119 6.533 11.806 -10.085 1.00 0.00 H new ATOM 436 N LEU A 120 7.862 8.641 -8.681 1.00 0.00 N ATOM 437 CA LEU A 120 8.189 8.310 -7.298 1.00 0.00 C ATOM 438 C LEU A 120 9.445 9.046 -6.844 1.00 0.00 C ATOM 439 O LEU A 120 10.529 8.844 -7.393 1.00 0.00 O ATOM 440 CB LEU A 120 8.386 6.800 -7.147 1.00 0.00 C ATOM 441 CG LEU A 120 7.112 5.954 -7.140 1.00 0.00 C ATOM 442 CD1 LEU A 120 6.506 5.890 -8.534 1.00 0.00 C ATOM 443 CD2 LEU A 120 7.404 4.555 -6.618 1.00 0.00 C ATOM 0 H LEU A 120 8.483 8.222 -9.373 1.00 0.00 H new ATOM 0 HA LEU A 120 7.357 8.627 -6.668 1.00 0.00 H new ATOM 0 HB2 LEU A 120 9.024 6.454 -7.961 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.926 6.615 -6.218 1.00 0.00 H new ATOM 0 HG LEU A 120 6.389 6.425 -6.474 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.600 5.284 -8.510 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.260 6.897 -8.870 1.00 0.00 H new ATOM 0 HD13 LEU A 120 7.223 5.443 -9.222 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.486 3.967 -6.620 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.144 4.075 -7.258 1.00 0.00 H new ATOM 0 HD23 LEU A 120 7.791 4.620 -5.601 1.00 0.00 H new ATOM 455 N LYS A 121 9.293 9.899 -5.837 1.00 0.00 N ATOM 456 CA LYS A 121 10.415 10.664 -5.306 1.00 0.00 C ATOM 457 C LYS A 121 11.112 9.900 -4.185 1.00 0.00 C ATOM 458 O LYS A 121 12.337 9.777 -4.172 1.00 0.00 O ATOM 459 CB LYS A 121 9.935 12.022 -4.790 1.00 0.00 C ATOM 460 CG LYS A 121 9.257 12.871 -5.852 1.00 0.00 C ATOM 461 CD LYS A 121 8.860 14.233 -5.307 1.00 0.00 C ATOM 462 CE LYS A 121 8.796 15.277 -6.411 1.00 0.00 C ATOM 463 NZ LYS A 121 10.154 15.685 -6.868 1.00 0.00 N ATOM 0 H LYS A 121 8.403 10.078 -5.372 1.00 0.00 H new ATOM 0 HA LYS A 121 11.130 10.821 -6.114 1.00 0.00 H new ATOM 0 HB2 LYS A 121 9.240 11.863 -3.965 1.00 0.00 H new ATOM 0 HB3 LYS A 121 10.787 12.570 -4.388 1.00 0.00 H new ATOM 0 HG2 LYS A 121 9.929 12.999 -6.700 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.372 12.354 -6.222 1.00 0.00 H new ATOM 0 HD2 LYS A 121 7.890 14.161 -4.816 1.00 0.00 H new ATOM 0 HD3 LYS A 121 9.578 14.546 -4.549 1.00 0.00 H new ATOM 0 HE2 LYS A 121 8.233 14.879 -7.255 1.00 0.00 H new ATOM 0 HE3 LYS A 121 8.255 16.153 -6.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 10.081 16.542 -7.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 10.754 15.880 -6.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 10.576 14.918 -7.429 1.00 0.00 H new ATOM 477 N TYR A 122 10.324 9.387 -3.246 1.00 0.00 N ATOM 478 CA TYR A 122 10.866 8.635 -2.120 1.00 0.00 C ATOM 479 C TYR A 122 9.899 7.540 -1.681 1.00 0.00 C ATOM 480 O TYR A 122 8.681 7.699 -1.766 1.00 0.00 O ATOM 481 CB TYR A 122 11.158 9.573 -0.948 1.00 0.00 C ATOM 482 CG TYR A 122 12.064 8.967 0.100 1.00 0.00 C ATOM 483 CD1 TYR A 122 13.439 8.913 -0.088 1.00 0.00 C ATOM 484 CD2 TYR A 122 11.544 8.449 1.280 1.00 0.00 C ATOM 485 CE1 TYR A 122 14.270 8.360 0.867 1.00 0.00 C ATOM 486 CE2 TYR A 122 12.367 7.895 2.241 1.00 0.00 C ATOM 487 CZ TYR A 122 13.730 7.852 2.030 1.00 0.00 C ATOM 488 OH TYR A 122 14.554 7.301 2.984 1.00 0.00 O ATOM 0 H TYR A 122 9.308 9.478 -3.242 1.00 0.00 H new ATOM 0 HA TYR A 122 11.796 8.166 -2.442 1.00 0.00 H new ATOM 0 HB2 TYR A 122 11.616 10.486 -1.329 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.216 9.861 -0.480 1.00 0.00 H new ATOM 0 HD1 TYR A 122 13.866 9.310 -0.997 1.00 0.00 H new ATOM 0 HD2 TYR A 122 10.478 8.480 1.449 1.00 0.00 H new ATOM 0 HE1 TYR A 122 15.337 8.326 0.704 1.00 0.00 H new ATOM 0 HE2 TYR A 122 11.946 7.498 3.153 1.00 0.00 H new ATOM 0 HH TYR A 122 14.015 6.991 3.742 1.00 0.00 H new ATOM 498 N CYS A 123 10.451 6.427 -1.210 1.00 0.00 N ATOM 499 CA CYS A 123 9.640 5.303 -0.756 1.00 0.00 C ATOM 500 C CYS A 123 10.242 4.668 0.494 1.00 0.00 C ATOM 501 O CYS A 123 11.429 4.343 0.529 1.00 0.00 O ATOM 502 CB CYS A 123 9.518 4.255 -1.864 1.00 0.00 C ATOM 503 SG CYS A 123 10.857 3.021 -1.872 1.00 0.00 S ATOM 0 H CYS A 123 11.457 6.279 -1.133 1.00 0.00 H new ATOM 0 HA CYS A 123 8.647 5.680 -0.510 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.564 3.739 -1.758 1.00 0.00 H new ATOM 0 HB3 CYS A 123 9.500 4.762 -2.829 1.00 0.00 H new ATOM 508 N TYR A 124 9.415 4.496 1.519 1.00 0.00 N ATOM 509 CA TYR A 124 9.864 3.903 2.773 1.00 0.00 C ATOM 510 C TYR A 124 9.016 2.688 3.136 1.00 0.00 C ATOM 511 O TYR A 124 7.890 2.823 3.615 1.00 0.00 O ATOM 512 CB TYR A 124 9.805 4.935 3.900 1.00 0.00 C ATOM 513 CG TYR A 124 10.610 4.546 5.120 1.00 0.00 C ATOM 514 CD1 TYR A 124 11.993 4.429 5.056 1.00 0.00 C ATOM 515 CD2 TYR A 124 9.987 4.295 6.336 1.00 0.00 C ATOM 516 CE1 TYR A 124 12.732 4.073 6.168 1.00 0.00 C ATOM 517 CE2 TYR A 124 10.718 3.940 7.453 1.00 0.00 C ATOM 518 CZ TYR A 124 12.090 3.830 7.364 1.00 0.00 C ATOM 519 OH TYR A 124 12.821 3.476 8.474 1.00 0.00 O ATOM 0 H TYR A 124 8.430 4.759 1.506 1.00 0.00 H new ATOM 0 HA TYR A 124 10.896 3.577 2.642 1.00 0.00 H new ATOM 0 HB2 TYR A 124 10.169 5.892 3.525 1.00 0.00 H new ATOM 0 HB3 TYR A 124 8.765 5.082 4.193 1.00 0.00 H new ATOM 0 HD1 TYR A 124 12.499 4.620 4.121 1.00 0.00 H new ATOM 0 HD2 TYR A 124 8.913 4.379 6.409 1.00 0.00 H new ATOM 0 HE1 TYR A 124 13.806 3.986 6.101 1.00 0.00 H new ATOM 0 HE2 TYR A 124 10.218 3.750 8.391 1.00 0.00 H new ATOM 0 HH TYR A 124 12.217 3.342 9.234 1.00 0.00 H new ATOM 529 N VAL A 125 9.566 1.500 2.905 1.00 0.00 N ATOM 530 CA VAL A 125 8.862 0.260 3.208 1.00 0.00 C ATOM 531 C VAL A 125 9.126 -0.186 4.642 1.00 0.00 C ATOM 532 O VAL A 125 10.276 -0.329 5.056 1.00 0.00 O ATOM 533 CB VAL A 125 9.276 -0.870 2.247 1.00 0.00 C ATOM 534 CG1 VAL A 125 8.568 -2.167 2.610 1.00 0.00 C ATOM 535 CG2 VAL A 125 8.982 -0.479 0.807 1.00 0.00 C ATOM 0 H VAL A 125 10.497 1.370 2.509 1.00 0.00 H new ATOM 0 HA VAL A 125 7.798 0.462 3.083 1.00 0.00 H new ATOM 0 HB VAL A 125 10.350 -1.030 2.345 1.00 0.00 H new ATOM 0 HG11 VAL A 125 8.873 -2.954 1.920 1.00 0.00 H new ATOM 0 HG12 VAL A 125 8.833 -2.454 3.628 1.00 0.00 H new ATOM 0 HG13 VAL A 125 7.490 -2.024 2.543 1.00 0.00 H new ATOM 0 HG21 VAL A 125 9.281 -1.289 0.142 1.00 0.00 H new ATOM 0 HG22 VAL A 125 7.915 -0.290 0.692 1.00 0.00 H new ATOM 0 HG23 VAL A 125 9.539 0.423 0.554 1.00 0.00 H new ATOM 545 N ASP A 126 8.054 -0.403 5.395 1.00 0.00 N ATOM 546 CA ASP A 126 8.169 -0.834 6.784 1.00 0.00 C ATOM 547 C ASP A 126 7.497 -2.187 6.990 1.00 0.00 C ATOM 548 O ASP A 126 6.308 -2.260 7.302 1.00 0.00 O ATOM 549 CB ASP A 126 7.546 0.207 7.716 1.00 0.00 C ATOM 550 CG ASP A 126 8.504 1.332 8.050 1.00 0.00 C ATOM 551 OD1 ASP A 126 9.730 1.104 7.993 1.00 0.00 O ATOM 552 OD2 ASP A 126 8.028 2.442 8.370 1.00 0.00 O ATOM 0 H ASP A 126 7.095 -0.288 5.067 1.00 0.00 H new ATOM 0 HA ASP A 126 9.228 -0.935 7.021 1.00 0.00 H new ATOM 0 HB2 ASP A 126 6.653 0.621 7.248 1.00 0.00 H new ATOM 0 HB3 ASP A 126 7.226 -0.280 8.637 1.00 0.00 H new ATOM 557 N ARG A 127 8.266 -3.257 6.814 1.00 0.00 N ATOM 558 CA ARG A 127 7.744 -4.608 6.978 1.00 0.00 C ATOM 559 C ARG A 127 7.029 -4.756 8.318 1.00 0.00 C ATOM 560 O ARG A 127 5.925 -5.293 8.387 1.00 0.00 O ATOM 561 CB ARG A 127 8.878 -5.631 6.878 1.00 0.00 C ATOM 562 CG ARG A 127 9.365 -5.863 5.457 1.00 0.00 C ATOM 563 CD ARG A 127 10.678 -6.631 5.437 1.00 0.00 C ATOM 564 NE ARG A 127 11.834 -5.740 5.480 1.00 0.00 N ATOM 565 CZ ARG A 127 13.030 -6.109 5.924 1.00 0.00 C ATOM 566 NH1 ARG A 127 13.226 -7.345 6.361 1.00 0.00 N ATOM 567 NH2 ARG A 127 14.034 -5.241 5.931 1.00 0.00 N ATOM 0 H ARG A 127 9.252 -3.214 6.558 1.00 0.00 H new ATOM 0 HA ARG A 127 7.025 -4.792 6.180 1.00 0.00 H new ATOM 0 HB2 ARG A 127 9.715 -5.294 7.489 1.00 0.00 H new ATOM 0 HB3 ARG A 127 8.539 -6.579 7.296 1.00 0.00 H new ATOM 0 HG2 ARG A 127 8.610 -6.416 4.898 1.00 0.00 H new ATOM 0 HG3 ARG A 127 9.495 -4.904 4.955 1.00 0.00 H new ATOM 0 HD2 ARG A 127 10.713 -7.311 6.288 1.00 0.00 H new ATOM 0 HD3 ARG A 127 10.726 -7.244 4.537 1.00 0.00 H new ATOM 0 HE ARG A 127 11.717 -4.782 5.151 1.00 0.00 H new ATOM 0 HH11 ARG A 127 12.457 -8.015 6.357 1.00 0.00 H new ATOM 0 HH12 ARG A 127 14.146 -7.626 6.701 1.00 0.00 H new ATOM 0 HH21 ARG A 127 13.888 -4.289 5.595 1.00 0.00 H new ATOM 0 HH22 ARG A 127 14.952 -5.526 6.272 1.00 0.00 H new ATOM 581 N ASN A 128 7.667 -4.275 9.380 1.00 0.00 N ATOM 582 CA ASN A 128 7.093 -4.354 10.718 1.00 0.00 C ATOM 583 C ASN A 128 5.640 -3.888 10.714 1.00 0.00 C ATOM 584 O ASN A 128 4.769 -4.528 11.305 1.00 0.00 O ATOM 585 CB ASN A 128 7.908 -3.507 11.697 1.00 0.00 C ATOM 586 CG ASN A 128 9.387 -3.842 11.658 1.00 0.00 C ATOM 587 OD1 ASN A 128 9.805 -4.780 10.978 1.00 0.00 O ATOM 588 ND2 ASN A 128 10.187 -3.075 12.389 1.00 0.00 N ATOM 0 H ASN A 128 8.582 -3.826 9.340 1.00 0.00 H new ATOM 0 HA ASN A 128 7.122 -5.396 11.038 1.00 0.00 H new ATOM 0 HB2 ASN A 128 7.771 -2.452 11.462 1.00 0.00 H new ATOM 0 HB3 ASN A 128 7.530 -3.660 12.708 1.00 0.00 H new ATOM 0 HD21 ASN A 128 11.191 -3.252 12.402 1.00 0.00 H new ATOM 0 HD22 ASN A 128 9.797 -2.308 12.937 1.00 0.00 H new ATOM 595 N LYS A 129 5.384 -2.770 10.044 1.00 0.00 N ATOM 596 CA LYS A 129 4.037 -2.218 9.960 1.00 0.00 C ATOM 597 C LYS A 129 3.421 -2.491 8.592 1.00 0.00 C ATOM 598 O LYS A 129 2.417 -1.884 8.221 1.00 0.00 O ATOM 599 CB LYS A 129 4.063 -0.711 10.228 1.00 0.00 C ATOM 600 CG LYS A 129 4.143 -0.357 11.703 1.00 0.00 C ATOM 601 CD LYS A 129 2.842 -0.672 12.423 1.00 0.00 C ATOM 602 CE LYS A 129 2.887 -0.224 13.876 1.00 0.00 C ATOM 603 NZ LYS A 129 2.514 1.209 14.026 1.00 0.00 N ATOM 0 H LYS A 129 6.093 -2.227 9.550 1.00 0.00 H new ATOM 0 HA LYS A 129 3.424 -2.705 10.718 1.00 0.00 H new ATOM 0 HB2 LYS A 129 4.917 -0.273 9.711 1.00 0.00 H new ATOM 0 HB3 LYS A 129 3.167 -0.259 9.803 1.00 0.00 H new ATOM 0 HG2 LYS A 129 4.960 -0.910 12.167 1.00 0.00 H new ATOM 0 HG3 LYS A 129 4.373 0.703 11.812 1.00 0.00 H new ATOM 0 HD2 LYS A 129 2.014 -0.178 11.914 1.00 0.00 H new ATOM 0 HD3 LYS A 129 2.650 -1.744 12.377 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.209 -0.840 14.467 1.00 0.00 H new ATOM 0 HE3 LYS A 129 3.889 -0.382 14.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 2.557 1.476 15.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 3.176 1.799 13.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 1.548 1.355 13.670 1.00 0.00 H new ATOM 617 N ARG A 130 4.029 -3.409 7.847 1.00 0.00 N ATOM 618 CA ARG A 130 3.539 -3.763 6.520 1.00 0.00 C ATOM 619 C ARG A 130 2.930 -2.549 5.825 1.00 0.00 C ATOM 620 O ARG A 130 1.783 -2.587 5.376 1.00 0.00 O ATOM 621 CB ARG A 130 2.501 -4.883 6.618 1.00 0.00 C ATOM 622 CG ARG A 130 3.050 -6.172 7.205 1.00 0.00 C ATOM 623 CD ARG A 130 2.895 -6.206 8.718 1.00 0.00 C ATOM 624 NE ARG A 130 1.492 -6.220 9.124 1.00 0.00 N ATOM 625 CZ ARG A 130 1.078 -6.620 10.321 1.00 0.00 C ATOM 626 NH1 ARG A 130 1.954 -7.036 11.225 1.00 0.00 N ATOM 627 NH2 ARG A 130 -0.216 -6.603 10.616 1.00 0.00 N ATOM 0 H ARG A 130 4.861 -3.921 8.140 1.00 0.00 H new ATOM 0 HA ARG A 130 4.385 -4.113 5.928 1.00 0.00 H new ATOM 0 HB2 ARG A 130 1.667 -4.541 7.231 1.00 0.00 H new ATOM 0 HB3 ARG A 130 2.104 -5.087 5.624 1.00 0.00 H new ATOM 0 HG2 ARG A 130 2.530 -7.023 6.766 1.00 0.00 H new ATOM 0 HG3 ARG A 130 4.103 -6.272 6.944 1.00 0.00 H new ATOM 0 HD2 ARG A 130 3.396 -7.089 9.114 1.00 0.00 H new ATOM 0 HD3 ARG A 130 3.390 -5.337 9.153 1.00 0.00 H new ATOM 0 HE ARG A 130 0.792 -5.906 8.452 1.00 0.00 H new ATOM 0 HH11 ARG A 130 2.949 -7.050 11.002 1.00 0.00 H new ATOM 0 HH12 ARG A 130 1.633 -7.342 12.143 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -0.893 -6.283 9.923 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -0.534 -6.910 11.535 1.00 0.00 H new ATOM 641 N THR A 131 3.705 -1.472 5.737 1.00 0.00 N ATOM 642 CA THR A 131 3.242 -0.247 5.098 1.00 0.00 C ATOM 643 C THR A 131 4.387 0.473 4.395 1.00 0.00 C ATOM 644 O THR A 131 5.511 0.508 4.895 1.00 0.00 O ATOM 645 CB THR A 131 2.598 0.710 6.119 1.00 0.00 C ATOM 646 OG1 THR A 131 1.505 0.062 6.777 1.00 0.00 O ATOM 647 CG2 THR A 131 2.107 1.978 5.436 1.00 0.00 C ATOM 0 H THR A 131 4.657 -1.424 6.101 1.00 0.00 H new ATOM 0 HA THR A 131 2.493 -0.538 4.361 1.00 0.00 H new ATOM 0 HB THR A 131 3.354 0.982 6.856 1.00 0.00 H new ATOM 0 HG1 THR A 131 1.833 -0.406 7.573 1.00 0.00 H new ATOM 0 HG21 THR A 131 1.656 2.639 6.176 1.00 0.00 H new ATOM 0 HG22 THR A 131 2.948 2.485 4.962 1.00 0.00 H new ATOM 0 HG23 THR A 131 1.365 1.720 4.680 1.00 0.00 H new ATOM 655 N ALA A 132 4.094 1.046 3.233 1.00 0.00 N ATOM 656 CA ALA A 132 5.099 1.768 2.462 1.00 0.00 C ATOM 657 C ALA A 132 4.622 3.175 2.118 1.00 0.00 C ATOM 658 O ALA A 132 3.553 3.353 1.534 1.00 0.00 O ATOM 659 CB ALA A 132 5.443 1.001 1.194 1.00 0.00 C ATOM 0 H ALA A 132 3.169 1.025 2.804 1.00 0.00 H new ATOM 0 HA ALA A 132 5.996 1.857 3.075 1.00 0.00 H new ATOM 0 HB1 ALA A 132 6.194 1.552 0.628 1.00 0.00 H new ATOM 0 HB2 ALA A 132 5.835 0.019 1.458 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.546 0.882 0.586 1.00 0.00 H new ATOM 665 N PHE A 133 5.420 4.172 2.485 1.00 0.00 N ATOM 666 CA PHE A 133 5.078 5.564 2.217 1.00 0.00 C ATOM 667 C PHE A 133 5.658 6.019 0.881 1.00 0.00 C ATOM 668 O PHE A 133 6.875 6.103 0.716 1.00 0.00 O ATOM 669 CB PHE A 133 5.592 6.464 3.342 1.00 0.00 C ATOM 670 CG PHE A 133 5.175 6.009 4.711 1.00 0.00 C ATOM 671 CD1 PHE A 133 3.850 6.091 5.109 1.00 0.00 C ATOM 672 CD2 PHE A 133 6.108 5.500 5.601 1.00 0.00 C ATOM 673 CE1 PHE A 133 3.463 5.673 6.369 1.00 0.00 C ATOM 674 CE2 PHE A 133 5.726 5.081 6.861 1.00 0.00 C ATOM 675 CZ PHE A 133 4.402 5.168 7.246 1.00 0.00 C ATOM 0 H PHE A 133 6.308 4.042 2.969 1.00 0.00 H new ATOM 0 HA PHE A 133 3.992 5.642 2.167 1.00 0.00 H new ATOM 0 HB2 PHE A 133 6.680 6.503 3.297 1.00 0.00 H new ATOM 0 HB3 PHE A 133 5.229 7.479 3.179 1.00 0.00 H new ATOM 0 HD1 PHE A 133 3.111 6.486 4.427 1.00 0.00 H new ATOM 0 HD2 PHE A 133 7.145 5.430 5.306 1.00 0.00 H new ATOM 0 HE1 PHE A 133 2.427 5.742 6.667 1.00 0.00 H new ATOM 0 HE2 PHE A 133 6.462 4.685 7.545 1.00 0.00 H new ATOM 0 HZ PHE A 133 4.102 4.842 8.231 1.00 0.00 H new ATOM 685 N VAL A 134 4.777 6.311 -0.071 1.00 0.00 N ATOM 686 CA VAL A 134 5.201 6.758 -1.393 1.00 0.00 C ATOM 687 C VAL A 134 4.940 8.248 -1.579 1.00 0.00 C ATOM 688 O VAL A 134 3.863 8.747 -1.250 1.00 0.00 O ATOM 689 CB VAL A 134 4.478 5.978 -2.507 1.00 0.00 C ATOM 690 CG1 VAL A 134 4.923 6.467 -3.877 1.00 0.00 C ATOM 691 CG2 VAL A 134 4.725 4.484 -2.359 1.00 0.00 C ATOM 0 H VAL A 134 3.766 6.246 0.048 1.00 0.00 H new ATOM 0 HA VAL A 134 6.272 6.569 -1.463 1.00 0.00 H new ATOM 0 HB VAL A 134 3.407 6.157 -2.414 1.00 0.00 H new ATOM 0 HG11 VAL A 134 4.402 5.904 -4.651 1.00 0.00 H new ATOM 0 HG12 VAL A 134 4.689 7.527 -3.979 1.00 0.00 H new ATOM 0 HG13 VAL A 134 5.998 6.321 -3.984 1.00 0.00 H new ATOM 0 HG21 VAL A 134 4.207 3.949 -3.155 1.00 0.00 H new ATOM 0 HG22 VAL A 134 5.794 4.284 -2.424 1.00 0.00 H new ATOM 0 HG23 VAL A 134 4.351 4.147 -1.392 1.00 0.00 H new ATOM 701 N THR A 135 5.933 8.956 -2.109 1.00 0.00 N ATOM 702 CA THR A 135 5.811 10.390 -2.338 1.00 0.00 C ATOM 703 C THR A 135 5.714 10.702 -3.827 1.00 0.00 C ATOM 704 O THR A 135 6.709 10.648 -4.550 1.00 0.00 O ATOM 705 CB THR A 135 7.007 11.157 -1.742 1.00 0.00 C ATOM 706 OG1 THR A 135 7.055 10.963 -0.324 1.00 0.00 O ATOM 707 CG2 THR A 135 6.905 12.643 -2.052 1.00 0.00 C ATOM 0 H THR A 135 6.830 8.559 -2.388 1.00 0.00 H new ATOM 0 HA THR A 135 4.896 10.713 -1.841 1.00 0.00 H new ATOM 0 HB THR A 135 7.921 10.770 -2.193 1.00 0.00 H new ATOM 0 HG1 THR A 135 7.819 11.452 0.047 1.00 0.00 H new ATOM 0 HG21 THR A 135 7.760 13.164 -1.621 1.00 0.00 H new ATOM 0 HG22 THR A 135 6.897 12.790 -3.132 1.00 0.00 H new ATOM 0 HG23 THR A 135 5.985 13.041 -1.625 1.00 0.00 H new ATOM 715 N LEU A 136 4.509 11.030 -4.280 1.00 0.00 N ATOM 716 CA LEU A 136 4.281 11.352 -5.685 1.00 0.00 C ATOM 717 C LEU A 136 4.657 12.800 -5.979 1.00 0.00 C ATOM 718 O LEU A 136 5.050 13.546 -5.081 1.00 0.00 O ATOM 719 CB LEU A 136 2.816 11.108 -6.053 1.00 0.00 C ATOM 720 CG LEU A 136 2.342 9.656 -5.998 1.00 0.00 C ATOM 721 CD1 LEU A 136 0.888 9.551 -6.431 1.00 0.00 C ATOM 722 CD2 LEU A 136 3.225 8.773 -6.868 1.00 0.00 C ATOM 0 H LEU A 136 3.675 11.080 -3.695 1.00 0.00 H new ATOM 0 HA LEU A 136 4.914 10.702 -6.289 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.191 11.699 -5.383 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.648 11.486 -7.062 1.00 0.00 H new ATOM 0 HG LEU A 136 2.418 9.309 -4.968 1.00 0.00 H new ATOM 0 HD11 LEU A 136 0.569 8.510 -6.385 1.00 0.00 H new ATOM 0 HD12 LEU A 136 0.266 10.151 -5.766 1.00 0.00 H new ATOM 0 HD13 LEU A 136 0.785 9.917 -7.452 1.00 0.00 H new ATOM 0 HD21 LEU A 136 2.873 7.743 -6.817 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.182 9.120 -7.900 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.254 8.823 -6.511 1.00 0.00 H new ATOM 734 N LEU A 137 4.532 13.194 -7.242 1.00 0.00 N ATOM 735 CA LEU A 137 4.857 14.555 -7.655 1.00 0.00 C ATOM 736 C LEU A 137 3.858 15.552 -7.077 1.00 0.00 C ATOM 737 O LEU A 137 4.243 16.546 -6.463 1.00 0.00 O ATOM 738 CB LEU A 137 4.871 14.655 -9.181 1.00 0.00 C ATOM 739 CG LEU A 137 5.124 16.048 -9.759 1.00 0.00 C ATOM 740 CD1 LEU A 137 6.555 16.486 -9.491 1.00 0.00 C ATOM 741 CD2 LEU A 137 4.829 16.068 -11.252 1.00 0.00 C ATOM 0 H LEU A 137 4.208 12.590 -7.998 1.00 0.00 H new ATOM 0 HA LEU A 137 5.848 14.799 -7.272 1.00 0.00 H new ATOM 0 HB2 LEU A 137 5.637 13.980 -9.563 1.00 0.00 H new ATOM 0 HB3 LEU A 137 3.913 14.295 -9.558 1.00 0.00 H new ATOM 0 HG LEU A 137 4.453 16.751 -9.267 1.00 0.00 H new ATOM 0 HD11 LEU A 137 6.716 17.479 -9.910 1.00 0.00 H new ATOM 0 HD12 LEU A 137 6.732 16.512 -8.416 1.00 0.00 H new ATOM 0 HD13 LEU A 137 7.244 15.781 -9.955 1.00 0.00 H new ATOM 0 HD21 LEU A 137 5.015 17.067 -11.646 1.00 0.00 H new ATOM 0 HD22 LEU A 137 5.475 15.352 -11.760 1.00 0.00 H new ATOM 0 HD23 LEU A 137 3.786 15.799 -11.420 1.00 0.00 H new ATOM 753 N ASN A 138 2.573 15.278 -7.277 1.00 0.00 N ATOM 754 CA ASN A 138 1.518 16.150 -6.774 1.00 0.00 C ATOM 755 C ASN A 138 0.350 15.334 -6.229 1.00 0.00 C ATOM 756 O ASN A 138 0.364 14.105 -6.274 1.00 0.00 O ATOM 757 CB ASN A 138 1.028 17.084 -7.883 1.00 0.00 C ATOM 758 CG ASN A 138 0.570 16.329 -9.115 1.00 0.00 C ATOM 759 OD1 ASN A 138 -0.553 15.826 -9.166 1.00 0.00 O ATOM 760 ND2 ASN A 138 1.439 16.246 -10.115 1.00 0.00 N ATOM 0 H ASN A 138 2.237 14.459 -7.784 1.00 0.00 H new ATOM 0 HA ASN A 138 1.932 16.747 -5.961 1.00 0.00 H new ATOM 0 HB2 ASN A 138 0.205 17.691 -7.506 1.00 0.00 H new ATOM 0 HB3 ASN A 138 1.830 17.769 -8.158 1.00 0.00 H new ATOM 0 HD21 ASN A 138 1.187 15.750 -10.970 1.00 0.00 H new ATOM 0 HD22 ASN A 138 2.359 16.678 -10.029 1.00 0.00 H new ATOM 767 N GLY A 139 -0.661 16.028 -5.715 1.00 0.00 N ATOM 768 CA GLY A 139 -1.824 15.351 -5.169 1.00 0.00 C ATOM 769 C GLY A 139 -2.745 14.819 -6.249 1.00 0.00 C ATOM 770 O GLY A 139 -3.084 13.636 -6.256 1.00 0.00 O ATOM 0 H GLY A 139 -0.696 17.046 -5.667 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -1.497 14.526 -4.536 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -2.377 16.041 -4.532 1.00 0.00 H new ATOM 774 N GLU A 140 -3.151 15.694 -7.163 1.00 0.00 N ATOM 775 CA GLU A 140 -4.040 15.305 -8.251 1.00 0.00 C ATOM 776 C GLU A 140 -3.725 13.892 -8.733 1.00 0.00 C ATOM 777 O GLU A 140 -4.628 13.117 -9.048 1.00 0.00 O ATOM 778 CB GLU A 140 -3.921 16.291 -9.415 1.00 0.00 C ATOM 779 CG GLU A 140 -4.808 17.516 -9.269 1.00 0.00 C ATOM 780 CD GLU A 140 -5.094 18.190 -10.597 1.00 0.00 C ATOM 781 OE1 GLU A 140 -4.229 18.125 -11.495 1.00 0.00 O ATOM 782 OE2 GLU A 140 -6.184 18.784 -10.737 1.00 0.00 O ATOM 0 H GLU A 140 -2.879 16.677 -7.172 1.00 0.00 H new ATOM 0 HA GLU A 140 -5.062 15.322 -7.873 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -2.883 16.613 -9.503 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -4.175 15.778 -10.342 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -5.749 17.225 -8.803 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -4.328 18.230 -8.599 1.00 0.00 H new ATOM 789 N GLN A 141 -2.438 13.565 -8.786 1.00 0.00 N ATOM 790 CA GLN A 141 -2.003 12.246 -9.230 1.00 0.00 C ATOM 791 C GLN A 141 -2.395 11.174 -8.218 1.00 0.00 C ATOM 792 O GLN A 141 -2.914 10.120 -8.585 1.00 0.00 O ATOM 793 CB GLN A 141 -0.489 12.230 -9.447 1.00 0.00 C ATOM 794 CG GLN A 141 -0.066 12.735 -10.817 1.00 0.00 C ATOM 795 CD GLN A 141 1.332 12.289 -11.197 1.00 0.00 C ATOM 796 OE1 GLN A 141 1.521 11.204 -11.749 1.00 0.00 O ATOM 797 NE2 GLN A 141 2.321 13.124 -10.903 1.00 0.00 N ATOM 0 H GLN A 141 -1.679 14.195 -8.527 1.00 0.00 H new ATOM 0 HA GLN A 141 -2.500 12.027 -10.175 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -0.014 12.842 -8.681 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -0.122 11.212 -9.315 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -0.773 12.378 -11.566 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.112 13.824 -10.829 1.00 0.00 H new ATOM 0 HE21 GLN A 141 2.119 14.013 -10.445 1.00 0.00 H new ATOM 0 HE22 GLN A 141 3.283 12.877 -11.135 1.00 0.00 H new ATOM 806 N ALA A 142 -2.141 11.451 -6.943 1.00 0.00 N ATOM 807 CA ALA A 142 -2.468 10.511 -5.878 1.00 0.00 C ATOM 808 C ALA A 142 -3.978 10.353 -5.730 1.00 0.00 C ATOM 809 O ALA A 142 -4.498 9.238 -5.741 1.00 0.00 O ATOM 810 CB ALA A 142 -1.852 10.968 -4.564 1.00 0.00 C ATOM 0 H ALA A 142 -1.710 12.318 -6.623 1.00 0.00 H new ATOM 0 HA ALA A 142 -2.052 9.539 -6.144 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -2.104 10.257 -3.777 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -0.769 11.023 -4.670 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -2.241 11.952 -4.302 1.00 0.00 H new ATOM 816 N GLN A 143 -4.675 11.476 -5.591 1.00 0.00 N ATOM 817 CA GLN A 143 -6.125 11.461 -5.439 1.00 0.00 C ATOM 818 C GLN A 143 -6.747 10.337 -6.262 1.00 0.00 C ATOM 819 O GLN A 143 -7.762 9.760 -5.875 1.00 0.00 O ATOM 820 CB GLN A 143 -6.718 12.806 -5.862 1.00 0.00 C ATOM 821 CG GLN A 143 -6.485 13.918 -4.851 1.00 0.00 C ATOM 822 CD GLN A 143 -7.514 13.920 -3.738 1.00 0.00 C ATOM 823 OE1 GLN A 143 -8.588 14.507 -3.871 1.00 0.00 O ATOM 824 NE2 GLN A 143 -7.192 13.260 -2.632 1.00 0.00 N ATOM 0 H GLN A 143 -4.259 12.407 -5.581 1.00 0.00 H new ATOM 0 HA GLN A 143 -6.353 11.286 -4.387 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -6.286 13.100 -6.819 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -7.790 12.688 -6.019 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -5.490 13.809 -4.420 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -6.507 14.880 -5.363 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -6.291 12.787 -2.564 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -7.846 13.226 -1.850 1.00 0.00 H new ATOM 833 N ASN A 144 -6.130 10.033 -7.400 1.00 0.00 N ATOM 834 CA ASN A 144 -6.624 8.979 -8.278 1.00 0.00 C ATOM 835 C ASN A 144 -5.959 7.644 -7.953 1.00 0.00 C ATOM 836 O ASN A 144 -6.624 6.689 -7.553 1.00 0.00 O ATOM 837 CB ASN A 144 -6.370 9.345 -9.742 1.00 0.00 C ATOM 838 CG ASN A 144 -7.287 10.451 -10.228 1.00 0.00 C ATOM 839 OD1 ASN A 144 -8.152 10.227 -11.075 1.00 0.00 O ATOM 840 ND2 ASN A 144 -7.100 11.652 -9.695 1.00 0.00 N ATOM 0 H ASN A 144 -5.288 10.501 -7.735 1.00 0.00 H new ATOM 0 HA ASN A 144 -7.697 8.879 -8.116 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -5.333 9.658 -9.861 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -6.510 8.461 -10.364 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -7.686 12.435 -9.985 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -6.371 11.792 -8.996 1.00 0.00 H new ATOM 847 N ALA A 145 -4.643 7.587 -8.129 1.00 0.00 N ATOM 848 CA ALA A 145 -3.888 6.371 -7.852 1.00 0.00 C ATOM 849 C ALA A 145 -4.443 5.646 -6.631 1.00 0.00 C ATOM 850 O ALA A 145 -4.510 4.417 -6.605 1.00 0.00 O ATOM 851 CB ALA A 145 -2.416 6.699 -7.650 1.00 0.00 C ATOM 0 H ALA A 145 -4.078 8.368 -8.462 1.00 0.00 H new ATOM 0 HA ALA A 145 -3.987 5.708 -8.711 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -1.864 5.782 -7.444 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -2.020 7.166 -8.552 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -2.308 7.384 -6.809 1.00 0.00 H new ATOM 857 N ILE A 146 -4.839 6.414 -5.622 1.00 0.00 N ATOM 858 CA ILE A 146 -5.388 5.844 -4.398 1.00 0.00 C ATOM 859 C ILE A 146 -6.494 4.841 -4.707 1.00 0.00 C ATOM 860 O ILE A 146 -6.350 3.646 -4.452 1.00 0.00 O ATOM 861 CB ILE A 146 -5.948 6.938 -3.469 1.00 0.00 C ATOM 862 CG1 ILE A 146 -4.838 7.912 -3.066 1.00 0.00 C ATOM 863 CG2 ILE A 146 -6.584 6.312 -2.237 1.00 0.00 C ATOM 864 CD1 ILE A 146 -5.353 9.263 -2.621 1.00 0.00 C ATOM 0 H ILE A 146 -4.790 7.433 -5.628 1.00 0.00 H new ATOM 0 HA ILE A 146 -4.568 5.334 -3.892 1.00 0.00 H new ATOM 0 HB ILE A 146 -6.716 7.494 -4.007 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -4.254 7.471 -2.258 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -4.162 8.050 -3.910 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -6.975 7.098 -1.590 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -7.398 5.654 -2.542 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -5.835 5.735 -1.695 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.512 9.902 -2.350 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -5.913 9.725 -3.434 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -6.006 9.137 -1.757 1.00 0.00 H new ATOM 876 N GLN A 147 -7.597 5.336 -5.260 1.00 0.00 N ATOM 877 CA GLN A 147 -8.727 4.482 -5.605 1.00 0.00 C ATOM 878 C GLN A 147 -8.363 3.530 -6.739 1.00 0.00 C ATOM 879 O GLN A 147 -8.522 2.315 -6.618 1.00 0.00 O ATOM 880 CB GLN A 147 -9.934 5.333 -6.005 1.00 0.00 C ATOM 881 CG GLN A 147 -10.539 6.112 -4.848 1.00 0.00 C ATOM 882 CD GLN A 147 -11.460 5.265 -3.993 1.00 0.00 C ATOM 883 OE1 GLN A 147 -12.463 4.738 -4.475 1.00 0.00 O ATOM 884 NE2 GLN A 147 -11.124 5.131 -2.715 1.00 0.00 N ATOM 0 H GLN A 147 -7.732 6.323 -5.478 1.00 0.00 H new ATOM 0 HA GLN A 147 -8.984 3.890 -4.726 1.00 0.00 H new ATOM 0 HB2 GLN A 147 -9.633 6.032 -6.785 1.00 0.00 H new ATOM 0 HB3 GLN A 147 -10.698 4.686 -6.435 1.00 0.00 H new ATOM 0 HG2 GLN A 147 -9.738 6.512 -4.226 1.00 0.00 H new ATOM 0 HG3 GLN A 147 -11.095 6.964 -5.240 1.00 0.00 H new ATOM 0 HE21 GLN A 147 -10.284 5.586 -2.358 1.00 0.00 H new ATOM 0 HE22 GLN A 147 -11.706 4.573 -2.090 1.00 0.00 H new ATOM 893 N MET A 148 -7.875 4.089 -7.841 1.00 0.00 N ATOM 894 CA MET A 148 -7.488 3.289 -8.997 1.00 0.00 C ATOM 895 C MET A 148 -6.730 2.038 -8.563 1.00 0.00 C ATOM 896 O MET A 148 -6.910 0.962 -9.134 1.00 0.00 O ATOM 897 CB MET A 148 -6.625 4.116 -9.952 1.00 0.00 C ATOM 898 CG MET A 148 -7.392 5.220 -10.662 1.00 0.00 C ATOM 899 SD MET A 148 -6.415 6.034 -11.939 1.00 0.00 S ATOM 900 CE MET A 148 -7.653 6.274 -13.211 1.00 0.00 C ATOM 0 H MET A 148 -7.738 5.093 -7.958 1.00 0.00 H new ATOM 0 HA MET A 148 -8.397 2.981 -9.515 1.00 0.00 H new ATOM 0 HB2 MET A 148 -5.801 4.559 -9.393 1.00 0.00 H new ATOM 0 HB3 MET A 148 -6.185 3.453 -10.697 1.00 0.00 H new ATOM 0 HG2 MET A 148 -8.292 4.801 -11.111 1.00 0.00 H new ATOM 0 HG3 MET A 148 -7.716 5.960 -9.931 1.00 0.00 H new ATOM 0 HE1 MET A 148 -7.201 6.769 -14.070 1.00 0.00 H new ATOM 0 HE2 MET A 148 -8.052 5.307 -13.518 1.00 0.00 H new ATOM 0 HE3 MET A 148 -8.461 6.892 -12.820 1.00 0.00 H new ATOM 910 N PHE A 149 -5.882 2.187 -7.551 1.00 0.00 N ATOM 911 CA PHE A 149 -5.096 1.069 -7.041 1.00 0.00 C ATOM 912 C PHE A 149 -5.779 0.428 -5.837 1.00 0.00 C ATOM 913 O PHE A 149 -5.592 -0.758 -5.561 1.00 0.00 O ATOM 914 CB PHE A 149 -3.692 1.540 -6.655 1.00 0.00 C ATOM 915 CG PHE A 149 -2.833 1.893 -7.835 1.00 0.00 C ATOM 916 CD1 PHE A 149 -3.223 2.884 -8.722 1.00 0.00 C ATOM 917 CD2 PHE A 149 -1.635 1.235 -8.059 1.00 0.00 C ATOM 918 CE1 PHE A 149 -2.435 3.212 -9.808 1.00 0.00 C ATOM 919 CE2 PHE A 149 -0.842 1.559 -9.143 1.00 0.00 C ATOM 920 CZ PHE A 149 -1.243 2.548 -10.020 1.00 0.00 C ATOM 0 H PHE A 149 -5.721 3.071 -7.068 1.00 0.00 H new ATOM 0 HA PHE A 149 -5.017 0.322 -7.831 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -3.776 2.410 -6.003 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -3.200 0.756 -6.079 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -4.155 3.406 -8.562 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -1.317 0.459 -7.378 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -2.751 3.987 -10.491 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.091 1.039 -9.305 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.626 2.801 -10.869 1.00 0.00 H new ATOM 930 N HIS A 150 -6.571 1.221 -5.122 1.00 0.00 N ATOM 931 CA HIS A 150 -7.282 0.732 -3.946 1.00 0.00 C ATOM 932 C HIS A 150 -7.930 -0.621 -4.227 1.00 0.00 C ATOM 933 O HIS A 150 -8.670 -0.775 -5.198 1.00 0.00 O ATOM 934 CB HIS A 150 -8.347 1.739 -3.513 1.00 0.00 C ATOM 935 CG HIS A 150 -9.193 1.263 -2.372 1.00 0.00 C ATOM 936 ND1 HIS A 150 -8.677 0.607 -1.274 1.00 0.00 N ATOM 937 CD2 HIS A 150 -10.528 1.352 -2.162 1.00 0.00 C ATOM 938 CE1 HIS A 150 -9.657 0.312 -0.439 1.00 0.00 C ATOM 939 NE2 HIS A 150 -10.790 0.754 -0.954 1.00 0.00 N ATOM 0 H HIS A 150 -6.736 2.204 -5.336 1.00 0.00 H new ATOM 0 HA HIS A 150 -6.559 0.609 -3.140 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -7.859 2.671 -3.229 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -8.991 1.963 -4.364 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -11.251 1.808 -2.822 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -9.550 -0.203 0.504 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -11.711 0.665 -0.524 1.00 0.00 H new ATOM 948 N GLN A 151 -7.644 -1.598 -3.372 1.00 0.00 N ATOM 949 CA GLN A 151 -8.197 -2.937 -3.530 1.00 0.00 C ATOM 950 C GLN A 151 -7.643 -3.611 -4.781 1.00 0.00 C ATOM 951 O GLN A 151 -8.381 -4.248 -5.533 1.00 0.00 O ATOM 952 CB GLN A 151 -9.724 -2.876 -3.602 1.00 0.00 C ATOM 953 CG GLN A 151 -10.359 -2.127 -2.442 1.00 0.00 C ATOM 954 CD GLN A 151 -10.684 -3.034 -1.271 1.00 0.00 C ATOM 955 OE1 GLN A 151 -9.830 -3.311 -0.429 1.00 0.00 O ATOM 956 NE2 GLN A 151 -11.926 -3.501 -1.212 1.00 0.00 N ATOM 0 H GLN A 151 -7.033 -1.487 -2.563 1.00 0.00 H new ATOM 0 HA GLN A 151 -7.905 -3.528 -2.662 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -10.016 -2.397 -4.536 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -10.119 -3.892 -3.627 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -9.683 -1.339 -2.110 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -11.272 -1.641 -2.785 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -12.602 -3.245 -1.932 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -12.204 -4.115 -0.447 1.00 0.00 H new ATOM 965 N TYR A 152 -6.341 -3.466 -4.997 1.00 0.00 N ATOM 966 CA TYR A 152 -5.688 -4.058 -6.159 1.00 0.00 C ATOM 967 C TYR A 152 -5.260 -5.494 -5.870 1.00 0.00 C ATOM 968 O TYR A 152 -5.142 -5.898 -4.713 1.00 0.00 O ATOM 969 CB TYR A 152 -4.473 -3.224 -6.568 1.00 0.00 C ATOM 970 CG TYR A 152 -3.518 -3.955 -7.484 1.00 0.00 C ATOM 971 CD1 TYR A 152 -3.853 -4.213 -8.807 1.00 0.00 C ATOM 972 CD2 TYR A 152 -2.279 -4.387 -7.026 1.00 0.00 C ATOM 973 CE1 TYR A 152 -2.983 -4.882 -9.647 1.00 0.00 C ATOM 974 CE2 TYR A 152 -1.402 -5.055 -7.859 1.00 0.00 C ATOM 975 CZ TYR A 152 -1.759 -5.300 -9.168 1.00 0.00 C ATOM 976 OH TYR A 152 -0.889 -5.965 -10.002 1.00 0.00 O ATOM 0 H TYR A 152 -5.716 -2.944 -4.383 1.00 0.00 H new ATOM 0 HA TYR A 152 -6.405 -4.070 -6.980 1.00 0.00 H new ATOM 0 HB2 TYR A 152 -4.816 -2.316 -7.064 1.00 0.00 H new ATOM 0 HB3 TYR A 152 -3.937 -2.914 -5.671 1.00 0.00 H new ATOM 0 HD1 TYR A 152 -4.810 -3.885 -9.186 1.00 0.00 H new ATOM 0 HD2 TYR A 152 -1.997 -4.197 -6.001 1.00 0.00 H new ATOM 0 HE1 TYR A 152 -3.260 -5.076 -10.673 1.00 0.00 H new ATOM 0 HE2 TYR A 152 -0.443 -5.383 -7.487 1.00 0.00 H new ATOM 0 HH TYR A 152 -0.071 -6.189 -9.510 1.00 0.00 H new ATOM 986 N SER A 153 -5.029 -6.260 -6.931 1.00 0.00 N ATOM 987 CA SER A 153 -4.616 -7.652 -6.794 1.00 0.00 C ATOM 988 C SER A 153 -3.100 -7.759 -6.663 1.00 0.00 C ATOM 989 O SER A 153 -2.364 -7.518 -7.620 1.00 0.00 O ATOM 990 CB SER A 153 -5.094 -8.469 -7.996 1.00 0.00 C ATOM 991 OG SER A 153 -5.061 -9.857 -7.715 1.00 0.00 O ATOM 0 H SER A 153 -5.121 -5.940 -7.895 1.00 0.00 H new ATOM 0 HA SER A 153 -5.071 -8.052 -5.888 1.00 0.00 H new ATOM 0 HB2 SER A 153 -6.109 -8.172 -8.261 1.00 0.00 H new ATOM 0 HB3 SER A 153 -4.464 -8.254 -8.859 1.00 0.00 H new ATOM 0 HG SER A 153 -5.373 -10.357 -8.498 1.00 0.00 H new ATOM 997 N PHE A 154 -2.640 -8.122 -5.470 1.00 0.00 N ATOM 998 CA PHE A 154 -1.211 -8.260 -5.212 1.00 0.00 C ATOM 999 C PHE A 154 -0.955 -9.286 -4.112 1.00 0.00 C ATOM 1000 O PHE A 154 -1.296 -9.065 -2.950 1.00 0.00 O ATOM 1001 CB PHE A 154 -0.610 -6.910 -4.816 1.00 0.00 C ATOM 1002 CG PHE A 154 0.891 -6.883 -4.870 1.00 0.00 C ATOM 1003 CD1 PHE A 154 1.552 -6.816 -6.085 1.00 0.00 C ATOM 1004 CD2 PHE A 154 1.640 -6.926 -3.705 1.00 0.00 C ATOM 1005 CE1 PHE A 154 2.933 -6.791 -6.139 1.00 0.00 C ATOM 1006 CE2 PHE A 154 3.021 -6.901 -3.752 1.00 0.00 C ATOM 1007 CZ PHE A 154 3.669 -6.835 -4.970 1.00 0.00 C ATOM 0 H PHE A 154 -3.235 -8.326 -4.667 1.00 0.00 H new ATOM 0 HA PHE A 154 -0.733 -8.607 -6.128 1.00 0.00 H new ATOM 0 HB2 PHE A 154 -1.003 -6.138 -5.478 1.00 0.00 H new ATOM 0 HB3 PHE A 154 -0.934 -6.659 -3.806 1.00 0.00 H new ATOM 0 HD1 PHE A 154 0.982 -6.783 -7.001 1.00 0.00 H new ATOM 0 HD2 PHE A 154 1.139 -6.980 -2.750 1.00 0.00 H new ATOM 0 HE1 PHE A 154 3.436 -6.737 -7.093 1.00 0.00 H new ATOM 0 HE2 PHE A 154 3.593 -6.933 -2.837 1.00 0.00 H new ATOM 0 HZ PHE A 154 4.748 -6.818 -5.009 1.00 0.00 H new ATOM 1017 N ARG A 155 -0.351 -10.409 -4.487 1.00 0.00 N ATOM 1018 CA ARG A 155 -0.050 -11.470 -3.534 1.00 0.00 C ATOM 1019 C ARG A 155 -1.309 -11.905 -2.789 1.00 0.00 C ATOM 1020 O ARG A 155 -1.284 -12.114 -1.577 1.00 0.00 O ATOM 1021 CB ARG A 155 1.011 -11.003 -2.536 1.00 0.00 C ATOM 1022 CG ARG A 155 2.391 -10.833 -3.149 1.00 0.00 C ATOM 1023 CD ARG A 155 3.487 -11.005 -2.109 1.00 0.00 C ATOM 1024 NE ARG A 155 3.785 -12.412 -1.855 1.00 0.00 N ATOM 1025 CZ ARG A 155 4.620 -13.132 -2.594 1.00 0.00 C ATOM 1026 NH1 ARG A 155 5.239 -12.580 -3.629 1.00 0.00 N ATOM 1027 NH2 ARG A 155 4.839 -14.407 -2.299 1.00 0.00 N ATOM 0 H ARG A 155 -0.061 -10.607 -5.444 1.00 0.00 H new ATOM 0 HA ARG A 155 0.336 -12.325 -4.090 1.00 0.00 H new ATOM 0 HB2 ARG A 155 0.696 -10.054 -2.102 1.00 0.00 H new ATOM 0 HB3 ARG A 155 1.072 -11.723 -1.720 1.00 0.00 H new ATOM 0 HG2 ARG A 155 2.528 -11.562 -3.948 1.00 0.00 H new ATOM 0 HG3 ARG A 155 2.470 -9.845 -3.602 1.00 0.00 H new ATOM 0 HD2 ARG A 155 4.391 -10.499 -2.448 1.00 0.00 H new ATOM 0 HD3 ARG A 155 3.182 -10.525 -1.179 1.00 0.00 H new ATOM 0 HE ARG A 155 3.326 -12.867 -1.066 1.00 0.00 H new ATOM 0 HH11 ARG A 155 5.074 -11.600 -3.859 1.00 0.00 H new ATOM 0 HH12 ARG A 155 5.880 -13.135 -4.195 1.00 0.00 H new ATOM 0 HH21 ARG A 155 4.365 -14.835 -1.503 1.00 0.00 H new ATOM 0 HH22 ARG A 155 5.481 -14.959 -2.868 1.00 0.00 H new ATOM 1041 N GLY A 156 -2.409 -12.039 -3.523 1.00 0.00 N ATOM 1042 CA GLY A 156 -3.662 -12.447 -2.915 1.00 0.00 C ATOM 1043 C GLY A 156 -4.092 -11.520 -1.796 1.00 0.00 C ATOM 1044 O GLY A 156 -4.813 -11.927 -0.884 1.00 0.00 O ATOM 0 H GLY A 156 -2.455 -11.872 -4.528 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -4.440 -12.476 -3.678 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -3.560 -13.460 -2.525 1.00 0.00 H new ATOM 1048 N LYS A 157 -3.648 -10.270 -1.862 1.00 0.00 N ATOM 1049 CA LYS A 157 -3.990 -9.281 -0.846 1.00 0.00 C ATOM 1050 C LYS A 157 -4.671 -8.069 -1.474 1.00 0.00 C ATOM 1051 O LYS A 157 -4.510 -7.803 -2.665 1.00 0.00 O ATOM 1052 CB LYS A 157 -2.734 -8.839 -0.091 1.00 0.00 C ATOM 1053 CG LYS A 157 -2.185 -9.898 0.849 1.00 0.00 C ATOM 1054 CD LYS A 157 -3.144 -10.179 1.993 1.00 0.00 C ATOM 1055 CE LYS A 157 -2.483 -11.010 3.083 1.00 0.00 C ATOM 1056 NZ LYS A 157 -1.788 -10.158 4.086 1.00 0.00 N ATOM 0 H LYS A 157 -3.050 -9.917 -2.609 1.00 0.00 H new ATOM 0 HA LYS A 157 -4.684 -9.743 -0.144 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -1.962 -8.570 -0.812 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -2.962 -7.940 0.482 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -2.000 -10.818 0.294 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -1.226 -9.569 1.249 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -3.495 -9.237 2.415 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -4.020 -10.705 1.614 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -3.237 -11.618 3.583 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -1.767 -11.697 2.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -1.351 -10.762 4.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -1.051 -9.596 3.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -2.475 -9.520 4.535 1.00 0.00 H new ATOM 1070 N ASP A 158 -5.431 -7.339 -0.665 1.00 0.00 N ATOM 1071 CA ASP A 158 -6.135 -6.154 -1.141 1.00 0.00 C ATOM 1072 C ASP A 158 -5.442 -4.881 -0.664 1.00 0.00 C ATOM 1073 O ASP A 158 -5.869 -4.256 0.307 1.00 0.00 O ATOM 1074 CB ASP A 158 -7.587 -6.169 -0.661 1.00 0.00 C ATOM 1075 CG ASP A 158 -8.505 -6.909 -1.614 1.00 0.00 C ATOM 1076 OD1 ASP A 158 -8.211 -6.925 -2.828 1.00 0.00 O ATOM 1077 OD2 ASP A 158 -9.516 -7.471 -1.146 1.00 0.00 O ATOM 0 H ASP A 158 -5.575 -7.547 0.323 1.00 0.00 H new ATOM 0 HA ASP A 158 -6.121 -6.168 -2.231 1.00 0.00 H new ATOM 0 HB2 ASP A 158 -7.636 -6.636 0.323 1.00 0.00 H new ATOM 0 HB3 ASP A 158 -7.939 -5.144 -0.545 1.00 0.00 H new ATOM 1082 N LEU A 159 -4.369 -4.505 -1.352 1.00 0.00 N ATOM 1083 CA LEU A 159 -3.615 -3.307 -0.998 1.00 0.00 C ATOM 1084 C LEU A 159 -4.551 -2.129 -0.746 1.00 0.00 C ATOM 1085 O LEU A 159 -5.371 -1.783 -1.596 1.00 0.00 O ATOM 1086 CB LEU A 159 -2.625 -2.958 -2.110 1.00 0.00 C ATOM 1087 CG LEU A 159 -1.505 -3.970 -2.355 1.00 0.00 C ATOM 1088 CD1 LEU A 159 -0.728 -3.613 -3.612 1.00 0.00 C ATOM 1089 CD2 LEU A 159 -0.576 -4.039 -1.152 1.00 0.00 C ATOM 0 H LEU A 159 -4.002 -5.012 -2.157 1.00 0.00 H new ATOM 0 HA LEU A 159 -3.064 -3.512 -0.080 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -3.182 -2.831 -3.038 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -2.172 -1.995 -1.876 1.00 0.00 H new ATOM 0 HG LEU A 159 -1.954 -4.953 -2.498 1.00 0.00 H new ATOM 0 HD11 LEU A 159 0.065 -4.344 -3.770 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.401 -3.617 -4.469 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.290 -2.621 -3.499 1.00 0.00 H new ATOM 0 HD21 LEU A 159 0.215 -4.764 -1.344 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -0.134 -3.058 -0.977 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -1.142 -4.344 -0.272 1.00 0.00 H new ATOM 1101 N ILE A 160 -4.420 -1.517 0.426 1.00 0.00 N ATOM 1102 CA ILE A 160 -5.251 -0.376 0.788 1.00 0.00 C ATOM 1103 C ILE A 160 -4.476 0.931 0.662 1.00 0.00 C ATOM 1104 O ILE A 160 -3.555 1.197 1.435 1.00 0.00 O ATOM 1105 CB ILE A 160 -5.788 -0.504 2.226 1.00 0.00 C ATOM 1106 CG1 ILE A 160 -6.713 -1.717 2.342 1.00 0.00 C ATOM 1107 CG2 ILE A 160 -6.518 0.767 2.634 1.00 0.00 C ATOM 1108 CD1 ILE A 160 -7.015 -2.112 3.770 1.00 0.00 C ATOM 0 H ILE A 160 -3.746 -1.792 1.141 1.00 0.00 H new ATOM 0 HA ILE A 160 -6.092 -0.366 0.094 1.00 0.00 H new ATOM 0 HB ILE A 160 -4.945 -0.648 2.902 1.00 0.00 H new ATOM 0 HG12 ILE A 160 -7.649 -1.500 1.828 1.00 0.00 H new ATOM 0 HG13 ILE A 160 -6.256 -2.563 1.829 1.00 0.00 H new ATOM 0 HG21 ILE A 160 -6.892 0.661 3.652 1.00 0.00 H new ATOM 0 HG22 ILE A 160 -5.832 1.612 2.585 1.00 0.00 H new ATOM 0 HG23 ILE A 160 -7.355 0.939 1.957 1.00 0.00 H new ATOM 0 HD11 ILE A 160 -7.676 -2.979 3.776 1.00 0.00 H new ATOM 0 HD12 ILE A 160 -6.086 -2.361 4.283 1.00 0.00 H new ATOM 0 HD13 ILE A 160 -7.501 -1.282 4.282 1.00 0.00 H new ATOM 1120 N VAL A 161 -4.855 1.746 -0.318 1.00 0.00 N ATOM 1121 CA VAL A 161 -4.198 3.028 -0.544 1.00 0.00 C ATOM 1122 C VAL A 161 -5.002 4.172 0.061 1.00 0.00 C ATOM 1123 O VAL A 161 -6.202 4.296 -0.182 1.00 0.00 O ATOM 1124 CB VAL A 161 -3.995 3.296 -2.048 1.00 0.00 C ATOM 1125 CG1 VAL A 161 -3.048 4.468 -2.257 1.00 0.00 C ATOM 1126 CG2 VAL A 161 -3.476 2.049 -2.746 1.00 0.00 C ATOM 0 H VAL A 161 -5.614 1.541 -0.968 1.00 0.00 H new ATOM 0 HA VAL A 161 -3.224 2.976 -0.057 1.00 0.00 H new ATOM 0 HB VAL A 161 -4.958 3.555 -2.487 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -2.916 4.643 -3.325 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -3.466 5.361 -1.792 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -2.083 4.241 -1.805 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -3.339 2.257 -3.807 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -2.522 1.757 -2.307 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -4.195 1.239 -2.625 1.00 0.00 H new ATOM 1136 N GLN A 162 -4.332 5.006 0.850 1.00 0.00 N ATOM 1137 CA GLN A 162 -4.986 6.141 1.491 1.00 0.00 C ATOM 1138 C GLN A 162 -4.136 7.401 1.364 1.00 0.00 C ATOM 1139 O GLN A 162 -3.025 7.363 0.833 1.00 0.00 O ATOM 1140 CB GLN A 162 -5.251 5.838 2.966 1.00 0.00 C ATOM 1141 CG GLN A 162 -6.277 4.738 3.186 1.00 0.00 C ATOM 1142 CD GLN A 162 -6.797 4.701 4.610 1.00 0.00 C ATOM 1143 OE1 GLN A 162 -7.188 5.727 5.167 1.00 0.00 O ATOM 1144 NE2 GLN A 162 -6.805 3.515 5.207 1.00 0.00 N ATOM 0 H GLN A 162 -3.338 4.917 1.061 1.00 0.00 H new ATOM 0 HA GLN A 162 -5.937 6.313 0.986 1.00 0.00 H new ATOM 0 HB2 GLN A 162 -4.314 5.550 3.443 1.00 0.00 H new ATOM 0 HB3 GLN A 162 -5.594 6.747 3.459 1.00 0.00 H new ATOM 0 HG2 GLN A 162 -7.113 4.884 2.502 1.00 0.00 H new ATOM 0 HG3 GLN A 162 -5.829 3.775 2.942 1.00 0.00 H new ATOM 0 HE21 GLN A 162 -6.472 2.690 4.708 1.00 0.00 H new ATOM 0 HE22 GLN A 162 -7.145 3.429 6.165 1.00 0.00 H new ATOM 1153 N LEU A 163 -4.665 8.517 1.853 1.00 0.00 N ATOM 1154 CA LEU A 163 -3.955 9.790 1.794 1.00 0.00 C ATOM 1155 C LEU A 163 -2.938 9.900 2.925 1.00 0.00 C ATOM 1156 O LEU A 163 -2.987 9.140 3.892 1.00 0.00 O ATOM 1157 CB LEU A 163 -4.946 10.953 1.870 1.00 0.00 C ATOM 1158 CG LEU A 163 -5.490 11.460 0.534 1.00 0.00 C ATOM 1159 CD1 LEU A 163 -6.792 12.218 0.740 1.00 0.00 C ATOM 1160 CD2 LEU A 163 -4.462 12.342 -0.161 1.00 0.00 C ATOM 0 H LEU A 163 -5.583 8.566 2.295 1.00 0.00 H new ATOM 0 HA LEU A 163 -3.421 9.836 0.845 1.00 0.00 H new ATOM 0 HB2 LEU A 163 -5.789 10.646 2.490 1.00 0.00 H new ATOM 0 HB3 LEU A 163 -4.461 11.785 2.381 1.00 0.00 H new ATOM 0 HG LEU A 163 -5.692 10.599 -0.104 1.00 0.00 H new ATOM 0 HD11 LEU A 163 -7.164 12.571 -0.222 1.00 0.00 H new ATOM 0 HD12 LEU A 163 -7.530 11.557 1.194 1.00 0.00 H new ATOM 0 HD13 LEU A 163 -6.617 13.071 1.396 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -4.867 12.694 -1.110 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -4.228 13.197 0.473 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -3.554 11.767 -0.344 1.00 0.00 H new