USER MOD reduce.3.24.130724 H: found=0, std=0, add=617, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 618 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 67 ASN : amide:sc= -1.37 X(o=-2.5,f=-2!) USER MOD Set 1.2: A 70 ASN : amide:sc= -1.13 X(o=-2.5,f=-2!) USER MOD Set 2.1: A 62 THR OG1 : rot -167:sc= 0.926 USER MOD Set 2.2: A 78 ASN : amide:sc= 1.09 K(o=2,f=-0.63!) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0.53 USER MOD Single : A 58 LYS NZ :NH3+ -161:sc= -0.133 (180deg=-0.84) USER MOD Single : A 64 LYS NZ :NH3+ -141:sc= 0.0419 (180deg=0) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= 0.145 X(o=0.14,f=-0.013) USER MOD Single : A 80 THR OG1 : rot 160:sc= -0.73 USER MOD Single : A 81 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.173) USER MOD Single : A 87 HIS : no HD1:sc= -0.404 K(o=-0.4,f=-1.8) USER MOD Single : A 88 GLN : amide:sc= 0.141 K(o=0.14,f=-5.5!) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 171:sc= -0.363 (180deg=-0.603) USER MOD Single : A 94 ASN : amide:sc= -1.38 K(o=-1.4,f=-2) USER MOD Single : A 95 ASN : amide:sc= -4.17 K(o=-4.2,f=-7.4!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 80:sc= -0.272 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 126 THR OG1 : rot 108:sc= 0.163 USER MOD Single : A 134 GLN : amide:sc= -2 K(o=-2,f=-3.8!) USER MOD Single : A 136 SER OG : rot 64:sc= 0.758 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 57 N VAL A 54 21.821 -19.140 15.322 1.00 0.00 N ATOM 58 CA VAL A 54 21.752 -20.497 15.828 1.00 0.00 C ATOM 59 C VAL A 54 22.141 -21.469 14.722 1.00 0.00 C ATOM 60 O VAL A 54 21.348 -21.755 13.823 1.00 0.00 O ATOM 61 CB VAL A 54 20.333 -20.789 16.305 1.00 0.00 C ATOM 62 CG1 VAL A 54 20.257 -22.218 16.841 1.00 0.00 C ATOM 63 CG2 VAL A 54 19.961 -19.800 17.412 1.00 0.00 C ATOM 0 HA VAL A 54 22.441 -20.614 16.665 1.00 0.00 H new ATOM 0 HB VAL A 54 19.637 -20.683 15.473 1.00 0.00 H new ATOM 0 HG11 VAL A 54 19.243 -22.425 17.182 1.00 0.00 H new ATOM 0 HG12 VAL A 54 20.524 -22.918 16.050 1.00 0.00 H new ATOM 0 HG13 VAL A 54 20.950 -22.331 17.675 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.947 -20.004 17.757 1.00 0.00 H new ATOM 0 HG22 VAL A 54 20.656 -19.908 18.245 1.00 0.00 H new ATOM 0 HG23 VAL A 54 20.014 -18.783 17.024 1.00 0.00 H new ATOM 73 N ILE A 55 23.371 -21.959 14.789 1.00 0.00 N ATOM 74 CA ILE A 55 23.871 -22.890 13.789 1.00 0.00 C ATOM 75 C ILE A 55 23.083 -24.196 13.813 1.00 0.00 C ATOM 76 O ILE A 55 22.718 -24.730 12.766 1.00 0.00 O ATOM 77 CB ILE A 55 25.349 -23.179 14.049 1.00 0.00 C ATOM 78 CG1 ILE A 55 26.168 -21.912 13.799 1.00 0.00 C ATOM 79 CG2 ILE A 55 25.826 -24.275 13.098 1.00 0.00 C ATOM 80 CD1 ILE A 55 27.582 -22.105 14.348 1.00 0.00 C ATOM 0 H ILE A 55 24.039 -21.728 15.524 1.00 0.00 H new ATOM 0 HA ILE A 55 23.751 -22.434 12.806 1.00 0.00 H new ATOM 0 HB ILE A 55 25.478 -23.503 15.082 1.00 0.00 H new ATOM 0 HG12 ILE A 55 26.207 -21.696 12.731 1.00 0.00 H new ATOM 0 HG13 ILE A 55 25.693 -21.057 14.280 1.00 0.00 H new ATOM 0 HG21 ILE A 55 26.880 -24.483 13.282 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.243 -25.181 13.265 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.696 -23.945 12.067 1.00 0.00 H new ATOM 0 HD11 ILE A 55 28.167 -21.203 14.171 1.00 0.00 H new ATOM 0 HD12 ILE A 55 27.533 -22.301 15.419 1.00 0.00 H new ATOM 0 HD13 ILE A 55 28.055 -22.949 13.846 1.00 0.00 H new ATOM 92 N ALA A 56 22.834 -24.709 15.013 1.00 0.00 N ATOM 93 CA ALA A 56 22.098 -25.958 15.156 1.00 0.00 C ATOM 94 C ALA A 56 21.418 -26.041 16.521 1.00 0.00 C ATOM 95 O ALA A 56 21.759 -25.302 17.445 1.00 0.00 O ATOM 96 CB ALA A 56 23.049 -27.144 14.990 1.00 0.00 C ATOM 0 H ALA A 56 23.128 -24.284 15.892 1.00 0.00 H new ATOM 0 HA ALA A 56 21.330 -25.989 14.383 1.00 0.00 H new ATOM 0 HB1 ALA A 56 22.492 -28.075 15.098 1.00 0.00 H new ATOM 0 HB2 ALA A 56 23.507 -27.108 14.001 1.00 0.00 H new ATOM 0 HB3 ALA A 56 23.827 -27.096 15.752 1.00 0.00 H new ATOM 102 N THR A 57 20.457 -26.949 16.632 1.00 0.00 N ATOM 103 CA THR A 57 19.727 -27.146 17.877 1.00 0.00 C ATOM 104 C THR A 57 20.351 -28.300 18.663 1.00 0.00 C ATOM 105 O THR A 57 21.556 -28.520 18.578 1.00 0.00 O ATOM 106 CB THR A 57 18.248 -27.421 17.568 1.00 0.00 C ATOM 107 OG1 THR A 57 17.520 -27.502 18.785 1.00 0.00 O ATOM 108 CG2 THR A 57 18.106 -28.736 16.795 1.00 0.00 C ATOM 0 H THR A 57 20.164 -27.563 15.872 1.00 0.00 H new ATOM 0 HA THR A 57 19.788 -26.246 18.488 1.00 0.00 H new ATOM 0 HB THR A 57 17.853 -26.609 16.958 1.00 0.00 H new ATOM 0 HG1 THR A 57 16.575 -27.676 18.590 1.00 0.00 H new ATOM 0 HG21 THR A 57 17.053 -28.921 16.581 1.00 0.00 H new ATOM 0 HG22 THR A 57 18.660 -28.669 15.859 1.00 0.00 H new ATOM 0 HG23 THR A 57 18.504 -29.555 17.394 1.00 0.00 H new ATOM 116 N LYS A 58 19.551 -29.023 19.440 1.00 0.00 N ATOM 117 CA LYS A 58 20.092 -30.125 20.226 1.00 0.00 C ATOM 118 C LYS A 58 20.835 -31.109 19.327 1.00 0.00 C ATOM 119 O LYS A 58 20.249 -31.719 18.434 1.00 0.00 O ATOM 120 CB LYS A 58 18.962 -30.848 20.959 1.00 0.00 C ATOM 121 CG LYS A 58 18.344 -29.909 21.998 1.00 0.00 C ATOM 122 CD LYS A 58 17.334 -30.680 22.847 1.00 0.00 C ATOM 123 CE LYS A 58 16.131 -31.071 21.984 1.00 0.00 C ATOM 124 NZ LYS A 58 15.481 -29.844 21.441 1.00 0.00 N ATOM 0 H LYS A 58 18.548 -28.871 19.542 1.00 0.00 H new ATOM 0 HA LYS A 58 20.793 -29.718 20.955 1.00 0.00 H new ATOM 0 HB2 LYS A 58 18.202 -31.172 20.248 1.00 0.00 H new ATOM 0 HB3 LYS A 58 19.345 -31.745 21.446 1.00 0.00 H new ATOM 0 HG2 LYS A 58 19.124 -29.489 22.634 1.00 0.00 H new ATOM 0 HG3 LYS A 58 17.853 -29.072 21.501 1.00 0.00 H new ATOM 0 HD2 LYS A 58 17.800 -31.572 23.264 1.00 0.00 H new ATOM 0 HD3 LYS A 58 17.008 -30.068 23.688 1.00 0.00 H new ATOM 0 HE2 LYS A 58 16.452 -31.716 21.166 1.00 0.00 H new ATOM 0 HE3 LYS A 58 15.416 -31.641 22.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 14.512 -30.070 21.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 15.451 -29.112 22.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 16.026 -29.494 20.627 1.00 0.00 H new ATOM 138 N VAL A 59 22.132 -31.256 19.580 1.00 0.00 N ATOM 139 CA VAL A 59 22.967 -32.164 18.804 1.00 0.00 C ATOM 140 C VAL A 59 23.764 -33.077 19.721 1.00 0.00 C ATOM 141 O VAL A 59 24.448 -32.609 20.631 1.00 0.00 O ATOM 142 CB VAL A 59 23.935 -31.367 17.927 1.00 0.00 C ATOM 143 CG1 VAL A 59 24.887 -32.332 17.210 1.00 0.00 C ATOM 144 CG2 VAL A 59 23.151 -30.549 16.885 1.00 0.00 C ATOM 0 H VAL A 59 22.628 -30.756 20.318 1.00 0.00 H new ATOM 0 HA VAL A 59 22.315 -32.771 18.176 1.00 0.00 H new ATOM 0 HB VAL A 59 24.509 -30.686 18.556 1.00 0.00 H new ATOM 0 HG11 VAL A 59 25.577 -31.765 16.585 1.00 0.00 H new ATOM 0 HG12 VAL A 59 25.451 -32.902 17.948 1.00 0.00 H new ATOM 0 HG13 VAL A 59 24.311 -33.016 16.587 1.00 0.00 H new ATOM 0 HG21 VAL A 59 23.848 -29.985 16.266 1.00 0.00 H new ATOM 0 HG22 VAL A 59 22.570 -31.223 16.256 1.00 0.00 H new ATOM 0 HG23 VAL A 59 22.479 -29.859 17.395 1.00 0.00 H new ATOM 154 N LEU A 60 23.692 -34.379 19.473 1.00 0.00 N ATOM 155 CA LEU A 60 24.431 -35.332 20.286 1.00 0.00 C ATOM 156 C LEU A 60 25.923 -35.182 20.025 1.00 0.00 C ATOM 157 O LEU A 60 26.361 -35.073 18.879 1.00 0.00 O ATOM 158 CB LEU A 60 23.995 -36.762 19.946 1.00 0.00 C ATOM 159 CG LEU A 60 22.502 -36.931 20.235 1.00 0.00 C ATOM 160 CD1 LEU A 60 22.057 -38.328 19.802 1.00 0.00 C ATOM 161 CD2 LEU A 60 22.250 -36.763 21.737 1.00 0.00 C ATOM 0 H LEU A 60 23.136 -34.794 18.725 1.00 0.00 H new ATOM 0 HA LEU A 60 24.224 -35.134 21.338 1.00 0.00 H new ATOM 0 HB2 LEU A 60 24.198 -36.974 18.896 1.00 0.00 H new ATOM 0 HB3 LEU A 60 24.572 -37.477 20.533 1.00 0.00 H new ATOM 0 HG LEU A 60 21.938 -36.179 19.684 1.00 0.00 H new ATOM 0 HD11 LEU A 60 20.994 -38.451 20.007 1.00 0.00 H new ATOM 0 HD12 LEU A 60 22.238 -38.453 18.734 1.00 0.00 H new ATOM 0 HD13 LEU A 60 22.622 -39.078 20.356 1.00 0.00 H new ATOM 0 HD21 LEU A 60 21.186 -36.883 21.943 1.00 0.00 H new ATOM 0 HD22 LEU A 60 22.814 -37.516 22.287 1.00 0.00 H new ATOM 0 HD23 LEU A 60 22.570 -35.769 22.051 1.00 0.00 H new ATOM 173 N GLY A 61 26.695 -35.180 21.101 1.00 0.00 N ATOM 174 CA GLY A 61 28.137 -35.043 20.997 1.00 0.00 C ATOM 175 C GLY A 61 28.810 -35.709 22.187 1.00 0.00 C ATOM 176 O GLY A 61 28.143 -36.296 23.034 1.00 0.00 O ATOM 0 H GLY A 61 26.346 -35.272 22.055 1.00 0.00 H new ATOM 0 HA2 GLY A 61 28.488 -35.496 20.070 1.00 0.00 H new ATOM 0 HA3 GLY A 61 28.409 -33.988 20.959 1.00 0.00 H new ATOM 180 N THR A 62 30.128 -35.618 22.239 1.00 0.00 N ATOM 181 CA THR A 62 30.885 -36.223 23.324 1.00 0.00 C ATOM 182 C THR A 62 31.824 -35.201 23.950 1.00 0.00 C ATOM 183 O THR A 62 32.497 -34.448 23.247 1.00 0.00 O ATOM 184 CB THR A 62 31.690 -37.413 22.802 1.00 0.00 C ATOM 185 OG1 THR A 62 30.806 -38.381 22.255 1.00 0.00 O ATOM 186 CG2 THR A 62 32.486 -38.036 23.952 1.00 0.00 C ATOM 0 H THR A 62 30.696 -35.132 21.545 1.00 0.00 H new ATOM 0 HA THR A 62 30.185 -36.570 24.084 1.00 0.00 H new ATOM 0 HB THR A 62 32.378 -37.074 22.028 1.00 0.00 H new ATOM 0 HG1 THR A 62 31.290 -39.221 22.110 1.00 0.00 H new ATOM 0 HG21 THR A 62 33.060 -38.885 23.580 1.00 0.00 H new ATOM 0 HG22 THR A 62 33.166 -37.293 24.368 1.00 0.00 H new ATOM 0 HG23 THR A 62 31.800 -38.375 24.728 1.00 0.00 H new ATOM 194 N VAL A 63 31.861 -35.176 25.276 1.00 0.00 N ATOM 195 CA VAL A 63 32.718 -34.231 25.983 1.00 0.00 C ATOM 196 C VAL A 63 34.185 -34.616 25.834 1.00 0.00 C ATOM 197 O VAL A 63 34.630 -35.620 26.388 1.00 0.00 O ATOM 198 CB VAL A 63 32.350 -34.223 27.467 1.00 0.00 C ATOM 199 CG1 VAL A 63 33.299 -33.296 28.232 1.00 0.00 C ATOM 200 CG2 VAL A 63 30.903 -33.741 27.642 1.00 0.00 C ATOM 0 H VAL A 63 31.315 -35.791 25.879 1.00 0.00 H new ATOM 0 HA VAL A 63 32.569 -33.240 25.554 1.00 0.00 H new ATOM 0 HB VAL A 63 32.441 -35.235 27.862 1.00 0.00 H new ATOM 0 HG11 VAL A 63 33.032 -33.294 29.289 1.00 0.00 H new ATOM 0 HG12 VAL A 63 34.324 -33.649 28.117 1.00 0.00 H new ATOM 0 HG13 VAL A 63 33.217 -32.284 27.835 1.00 0.00 H new ATOM 0 HG21 VAL A 63 30.646 -33.737 28.701 1.00 0.00 H new ATOM 0 HG22 VAL A 63 30.805 -32.732 27.241 1.00 0.00 H new ATOM 0 HG23 VAL A 63 30.229 -34.411 27.108 1.00 0.00 H new ATOM 210 N LYS A 64 34.937 -33.809 25.094 1.00 0.00 N ATOM 211 CA LYS A 64 36.353 -34.089 24.898 1.00 0.00 C ATOM 212 C LYS A 64 37.055 -34.062 26.255 1.00 0.00 C ATOM 213 O LYS A 64 37.786 -34.981 26.618 1.00 0.00 O ATOM 214 CB LYS A 64 36.969 -33.025 23.994 1.00 0.00 C ATOM 215 CG LYS A 64 38.435 -33.356 23.746 1.00 0.00 C ATOM 216 CD LYS A 64 39.051 -32.271 22.860 1.00 0.00 C ATOM 217 CE LYS A 64 40.534 -32.566 22.644 1.00 0.00 C ATOM 218 NZ LYS A 64 41.130 -31.512 21.773 1.00 0.00 N ATOM 0 H LYS A 64 34.596 -32.969 24.627 1.00 0.00 H new ATOM 0 HA LYS A 64 36.471 -35.068 24.434 1.00 0.00 H new ATOM 0 HB2 LYS A 64 36.430 -32.980 23.048 1.00 0.00 H new ATOM 0 HB3 LYS A 64 36.880 -32.043 24.458 1.00 0.00 H new ATOM 0 HG2 LYS A 64 38.972 -33.418 24.693 1.00 0.00 H new ATOM 0 HG3 LYS A 64 38.524 -34.330 23.265 1.00 0.00 H new ATOM 0 HD2 LYS A 64 38.534 -32.234 21.901 1.00 0.00 H new ATOM 0 HD3 LYS A 64 38.929 -31.294 23.327 1.00 0.00 H new ATOM 0 HE2 LYS A 64 41.053 -32.597 23.602 1.00 0.00 H new ATOM 0 HE3 LYS A 64 40.657 -33.546 22.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 41.806 -31.948 21.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 40.376 -31.040 21.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 41.624 -30.812 22.363 1.00 0.00 H new ATOM 232 N TRP A 65 36.781 -32.995 27.001 1.00 0.00 N ATOM 233 CA TRP A 65 37.328 -32.816 28.344 1.00 0.00 C ATOM 234 C TRP A 65 36.787 -31.526 28.960 1.00 0.00 C ATOM 235 O TRP A 65 36.666 -30.508 28.278 1.00 0.00 O ATOM 236 CB TRP A 65 38.861 -32.766 28.308 1.00 0.00 C ATOM 237 CG TRP A 65 39.329 -31.501 27.654 1.00 0.00 C ATOM 238 CD1 TRP A 65 39.586 -31.365 26.340 1.00 0.00 C ATOM 239 CD2 TRP A 65 39.627 -30.211 28.260 1.00 0.00 C ATOM 240 NE1 TRP A 65 40.007 -30.080 26.086 1.00 0.00 N ATOM 241 CE2 TRP A 65 40.052 -29.323 27.241 1.00 0.00 C ATOM 242 CE3 TRP A 65 39.566 -29.725 29.577 1.00 0.00 C ATOM 243 CZ2 TRP A 65 40.404 -28.003 27.519 1.00 0.00 C ATOM 244 CZ3 TRP A 65 39.921 -28.397 29.861 1.00 0.00 C ATOM 245 CH2 TRP A 65 40.340 -27.539 28.836 1.00 0.00 C ATOM 0 H TRP A 65 36.176 -32.233 26.694 1.00 0.00 H new ATOM 0 HA TRP A 65 37.022 -33.667 28.953 1.00 0.00 H new ATOM 0 HB2 TRP A 65 39.257 -32.826 29.322 1.00 0.00 H new ATOM 0 HB3 TRP A 65 39.246 -33.628 27.764 1.00 0.00 H new ATOM 0 HD1 TRP A 65 39.478 -32.144 25.600 1.00 0.00 H new ATOM 0 HE1 TRP A 65 40.255 -29.730 25.161 1.00 0.00 H new ATOM 0 HE3 TRP A 65 39.244 -30.377 30.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 40.723 -27.345 26.724 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 39.871 -28.034 30.877 1.00 0.00 H new ATOM 0 HH2 TRP A 65 40.614 -26.519 29.063 1.00 0.00 H new ATOM 256 N PHE A 66 36.468 -31.572 30.248 1.00 0.00 N ATOM 257 CA PHE A 66 35.959 -30.392 30.943 1.00 0.00 C ATOM 258 C PHE A 66 36.615 -30.270 32.314 1.00 0.00 C ATOM 259 O PHE A 66 36.479 -31.159 33.155 1.00 0.00 O ATOM 260 CB PHE A 66 34.440 -30.498 31.111 1.00 0.00 C ATOM 261 CG PHE A 66 33.922 -29.272 31.826 1.00 0.00 C ATOM 262 CD1 PHE A 66 33.700 -28.089 31.112 1.00 0.00 C ATOM 263 CD2 PHE A 66 33.670 -29.317 33.203 1.00 0.00 C ATOM 264 CE1 PHE A 66 33.223 -26.950 31.774 1.00 0.00 C ATOM 265 CE2 PHE A 66 33.193 -28.177 33.864 1.00 0.00 C ATOM 266 CZ PHE A 66 32.971 -26.994 33.148 1.00 0.00 C ATOM 0 H PHE A 66 36.551 -32.406 30.830 1.00 0.00 H new ATOM 0 HA PHE A 66 36.195 -29.508 30.351 1.00 0.00 H new ATOM 0 HB2 PHE A 66 33.962 -30.592 30.136 1.00 0.00 H new ATOM 0 HB3 PHE A 66 34.188 -31.395 31.677 1.00 0.00 H new ATOM 0 HD1 PHE A 66 33.896 -28.054 30.051 1.00 0.00 H new ATOM 0 HD2 PHE A 66 33.843 -30.229 33.755 1.00 0.00 H new ATOM 0 HE1 PHE A 66 33.050 -26.038 31.222 1.00 0.00 H new ATOM 0 HE2 PHE A 66 32.997 -28.211 34.925 1.00 0.00 H new ATOM 0 HZ PHE A 66 32.605 -26.115 33.658 1.00 0.00 H new ATOM 276 N ASN A 67 37.325 -29.170 32.538 1.00 0.00 N ATOM 277 CA ASN A 67 37.987 -28.958 33.822 1.00 0.00 C ATOM 278 C ASN A 67 37.188 -27.997 34.693 1.00 0.00 C ATOM 279 O ASN A 67 36.940 -26.853 34.309 1.00 0.00 O ATOM 280 CB ASN A 67 39.387 -28.397 33.612 1.00 0.00 C ATOM 281 CG ASN A 67 40.308 -29.478 33.060 1.00 0.00 C ATOM 282 OD1 ASN A 67 39.951 -30.657 33.057 1.00 0.00 O ATOM 283 ND2 ASN A 67 41.474 -29.147 32.588 1.00 0.00 N ATOM 0 H ASN A 67 37.457 -28.420 31.859 1.00 0.00 H new ATOM 0 HA ASN A 67 38.053 -29.923 34.325 1.00 0.00 H new ATOM 0 HB2 ASN A 67 39.349 -27.554 32.922 1.00 0.00 H new ATOM 0 HB3 ASN A 67 39.781 -28.020 34.556 1.00 0.00 H new ATOM 0 HD21 ASN A 67 42.095 -29.864 32.214 1.00 0.00 H new ATOM 0 HD22 ASN A 67 41.767 -28.170 32.592 1.00 0.00 H new ATOM 290 N VAL A 68 36.788 -28.474 35.862 1.00 0.00 N ATOM 291 CA VAL A 68 36.014 -27.659 36.787 1.00 0.00 C ATOM 292 C VAL A 68 36.806 -26.442 37.259 1.00 0.00 C ATOM 293 O VAL A 68 36.279 -25.329 37.307 1.00 0.00 O ATOM 294 CB VAL A 68 35.617 -28.510 37.995 1.00 0.00 C ATOM 295 CG1 VAL A 68 34.987 -27.623 39.072 1.00 0.00 C ATOM 296 CG2 VAL A 68 34.612 -29.577 37.554 1.00 0.00 C ATOM 0 H VAL A 68 36.986 -29.419 36.192 1.00 0.00 H new ATOM 0 HA VAL A 68 35.126 -27.301 36.267 1.00 0.00 H new ATOM 0 HB VAL A 68 36.505 -28.991 38.406 1.00 0.00 H new ATOM 0 HG11 VAL A 68 34.707 -28.235 39.929 1.00 0.00 H new ATOM 0 HG12 VAL A 68 35.706 -26.866 39.386 1.00 0.00 H new ATOM 0 HG13 VAL A 68 34.100 -27.135 38.669 1.00 0.00 H new ATOM 0 HG21 VAL A 68 34.327 -30.185 38.412 1.00 0.00 H new ATOM 0 HG22 VAL A 68 33.726 -29.094 37.141 1.00 0.00 H new ATOM 0 HG23 VAL A 68 35.066 -30.213 36.794 1.00 0.00 H new ATOM 306 N ARG A 69 38.063 -26.662 37.630 1.00 0.00 N ATOM 307 CA ARG A 69 38.903 -25.573 38.126 1.00 0.00 C ATOM 308 C ARG A 69 39.115 -24.479 37.080 1.00 0.00 C ATOM 309 O ARG A 69 39.030 -23.293 37.393 1.00 0.00 O ATOM 310 CB ARG A 69 40.260 -26.124 38.575 1.00 0.00 C ATOM 311 CG ARG A 69 41.124 -24.978 39.101 1.00 0.00 C ATOM 312 CD ARG A 69 42.389 -25.536 39.760 1.00 0.00 C ATOM 313 NE ARG A 69 42.046 -26.260 40.978 1.00 0.00 N ATOM 314 CZ ARG A 69 42.978 -26.856 41.725 1.00 0.00 C ATOM 315 NH1 ARG A 69 44.245 -26.785 41.397 1.00 0.00 N ATOM 316 NH2 ARG A 69 42.624 -27.510 42.797 1.00 0.00 N ATOM 0 H ARG A 69 38.520 -27.573 37.598 1.00 0.00 H new ATOM 0 HA ARG A 69 38.382 -25.123 38.971 1.00 0.00 H new ATOM 0 HB2 ARG A 69 40.121 -26.875 39.352 1.00 0.00 H new ATOM 0 HB3 ARG A 69 40.759 -26.617 37.741 1.00 0.00 H new ATOM 0 HG2 ARG A 69 41.394 -24.310 38.283 1.00 0.00 H new ATOM 0 HG3 ARG A 69 40.559 -24.387 39.822 1.00 0.00 H new ATOM 0 HD2 ARG A 69 42.906 -26.200 39.067 1.00 0.00 H new ATOM 0 HD3 ARG A 69 43.075 -24.722 39.993 1.00 0.00 H new ATOM 0 HE ARG A 69 41.069 -26.312 41.267 1.00 0.00 H new ATOM 0 HH11 ARG A 69 44.528 -26.270 40.563 1.00 0.00 H new ATOM 0 HH12 ARG A 69 44.948 -27.245 41.976 1.00 0.00 H new ATOM 0 HH21 ARG A 69 41.640 -27.564 43.060 1.00 0.00 H new ATOM 0 HH22 ARG A 69 43.331 -27.968 43.372 1.00 0.00 H new ATOM 330 N ASN A 70 39.401 -24.874 35.845 1.00 0.00 N ATOM 331 CA ASN A 70 39.626 -23.893 34.785 1.00 0.00 C ATOM 332 C ASN A 70 38.375 -23.052 34.547 1.00 0.00 C ATOM 333 O ASN A 70 38.460 -21.848 34.316 1.00 0.00 O ATOM 334 CB ASN A 70 40.032 -24.583 33.486 1.00 0.00 C ATOM 335 CG ASN A 70 41.459 -25.110 33.598 1.00 0.00 C ATOM 336 OD1 ASN A 70 42.201 -24.709 34.493 1.00 0.00 O ATOM 337 ND2 ASN A 70 41.888 -25.994 32.737 1.00 0.00 N ATOM 0 H ASN A 70 39.482 -25.848 35.554 1.00 0.00 H new ATOM 0 HA ASN A 70 40.436 -23.238 35.108 1.00 0.00 H new ATOM 0 HB2 ASN A 70 39.348 -25.404 33.272 1.00 0.00 H new ATOM 0 HB3 ASN A 70 39.959 -23.882 32.654 1.00 0.00 H new ATOM 0 HD21 ASN A 70 42.840 -26.353 32.806 1.00 0.00 H new ATOM 0 HD22 ASN A 70 41.271 -26.325 31.996 1.00 0.00 H new ATOM 344 N GLY A 71 37.213 -23.695 34.614 1.00 0.00 N ATOM 345 CA GLY A 71 35.949 -22.992 34.415 1.00 0.00 C ATOM 346 C GLY A 71 35.468 -23.056 32.962 1.00 0.00 C ATOM 347 O GLY A 71 34.430 -22.486 32.631 1.00 0.00 O ATOM 0 H GLY A 71 37.120 -24.693 34.803 1.00 0.00 H new ATOM 0 HA2 GLY A 71 35.189 -23.425 35.066 1.00 0.00 H new ATOM 0 HA3 GLY A 71 36.066 -21.949 34.711 1.00 0.00 H new ATOM 351 N TYR A 72 36.207 -23.754 32.100 1.00 0.00 N ATOM 352 CA TYR A 72 35.800 -23.872 30.701 1.00 0.00 C ATOM 353 C TYR A 72 36.229 -25.226 30.142 1.00 0.00 C ATOM 354 O TYR A 72 37.087 -25.895 30.716 1.00 0.00 O ATOM 355 CB TYR A 72 36.411 -22.743 29.864 1.00 0.00 C ATOM 356 CG TYR A 72 37.907 -22.929 29.738 1.00 0.00 C ATOM 357 CD1 TYR A 72 38.428 -23.700 28.690 1.00 0.00 C ATOM 358 CD2 TYR A 72 38.770 -22.325 30.654 1.00 0.00 C ATOM 359 CE1 TYR A 72 39.812 -23.867 28.564 1.00 0.00 C ATOM 360 CE2 TYR A 72 40.156 -22.491 30.528 1.00 0.00 C ATOM 361 CZ TYR A 72 40.676 -23.263 29.482 1.00 0.00 C ATOM 362 OH TYR A 72 42.041 -23.427 29.358 1.00 0.00 O ATOM 0 H TYR A 72 37.073 -24.237 32.339 1.00 0.00 H new ATOM 0 HA TYR A 72 34.714 -23.793 30.650 1.00 0.00 H new ATOM 0 HB2 TYR A 72 35.955 -22.729 28.874 1.00 0.00 H new ATOM 0 HB3 TYR A 72 36.196 -21.780 30.328 1.00 0.00 H new ATOM 0 HD1 TYR A 72 37.761 -24.166 27.979 1.00 0.00 H new ATOM 0 HD2 TYR A 72 38.369 -21.729 31.461 1.00 0.00 H new ATOM 0 HE1 TYR A 72 40.213 -24.463 27.757 1.00 0.00 H new ATOM 0 HE2 TYR A 72 40.823 -22.024 31.238 1.00 0.00 H new ATOM 0 HH TYR A 72 42.496 -22.940 30.077 1.00 0.00 H new ATOM 372 N GLY A 73 35.625 -25.637 29.025 1.00 0.00 N ATOM 373 CA GLY A 73 35.963 -26.925 28.431 1.00 0.00 C ATOM 374 C GLY A 73 35.500 -27.012 26.980 1.00 0.00 C ATOM 375 O GLY A 73 34.948 -26.057 26.434 1.00 0.00 O ATOM 0 H GLY A 73 34.913 -25.106 28.524 1.00 0.00 H new ATOM 0 HA2 GLY A 73 37.041 -27.077 28.479 1.00 0.00 H new ATOM 0 HA3 GLY A 73 35.502 -27.726 29.009 1.00 0.00 H new ATOM 379 N PHE A 74 35.748 -28.162 26.359 1.00 0.00 N ATOM 380 CA PHE A 74 35.378 -28.367 24.959 1.00 0.00 C ATOM 381 C PHE A 74 34.541 -29.629 24.763 1.00 0.00 C ATOM 382 O PHE A 74 34.737 -30.635 25.444 1.00 0.00 O ATOM 383 CB PHE A 74 36.641 -28.457 24.107 1.00 0.00 C ATOM 384 CG PHE A 74 37.360 -27.133 24.142 1.00 0.00 C ATOM 385 CD1 PHE A 74 38.253 -26.842 25.180 1.00 0.00 C ATOM 386 CD2 PHE A 74 37.133 -26.196 23.132 1.00 0.00 C ATOM 387 CE1 PHE A 74 38.916 -25.609 25.205 1.00 0.00 C ATOM 388 CE2 PHE A 74 37.795 -24.966 23.153 1.00 0.00 C ATOM 389 CZ PHE A 74 38.687 -24.671 24.191 1.00 0.00 C ATOM 0 H PHE A 74 36.201 -28.963 26.799 1.00 0.00 H new ATOM 0 HA PHE A 74 34.770 -27.516 24.650 1.00 0.00 H new ATOM 0 HB2 PHE A 74 37.291 -29.247 24.482 1.00 0.00 H new ATOM 0 HB3 PHE A 74 36.383 -28.717 23.080 1.00 0.00 H new ATOM 0 HD1 PHE A 74 38.430 -27.567 25.960 1.00 0.00 H new ATOM 0 HD2 PHE A 74 36.444 -26.423 22.332 1.00 0.00 H new ATOM 0 HE1 PHE A 74 39.604 -25.382 26.006 1.00 0.00 H new ATOM 0 HE2 PHE A 74 37.619 -24.244 22.370 1.00 0.00 H new ATOM 0 HZ PHE A 74 39.198 -23.720 24.210 1.00 0.00 H new ATOM 399 N ILE A 75 33.620 -29.563 23.804 1.00 0.00 N ATOM 400 CA ILE A 75 32.764 -30.698 23.474 1.00 0.00 C ATOM 401 C ILE A 75 32.988 -31.110 22.024 1.00 0.00 C ATOM 402 O ILE A 75 32.862 -30.291 21.115 1.00 0.00 O ATOM 403 CB ILE A 75 31.294 -30.325 23.670 1.00 0.00 C ATOM 404 CG1 ILE A 75 31.053 -29.938 25.127 1.00 0.00 C ATOM 405 CG2 ILE A 75 30.412 -31.522 23.310 1.00 0.00 C ATOM 406 CD1 ILE A 75 29.657 -29.325 25.267 1.00 0.00 C ATOM 0 H ILE A 75 33.448 -28.731 23.240 1.00 0.00 H new ATOM 0 HA ILE A 75 33.016 -31.528 24.134 1.00 0.00 H new ATOM 0 HB ILE A 75 31.046 -29.482 23.025 1.00 0.00 H new ATOM 0 HG12 ILE A 75 31.143 -30.816 25.767 1.00 0.00 H new ATOM 0 HG13 ILE A 75 31.810 -29.225 25.455 1.00 0.00 H new ATOM 0 HG21 ILE A 75 29.364 -31.257 23.450 1.00 0.00 H new ATOM 0 HG22 ILE A 75 30.581 -31.798 22.269 1.00 0.00 H new ATOM 0 HG23 ILE A 75 30.662 -32.365 23.954 1.00 0.00 H new ATOM 0 HD11 ILE A 75 29.484 -29.048 26.307 1.00 0.00 H new ATOM 0 HD12 ILE A 75 29.585 -28.437 24.638 1.00 0.00 H new ATOM 0 HD13 ILE A 75 28.907 -30.052 24.955 1.00 0.00 H new ATOM 418 N ASN A 76 33.310 -32.379 21.803 1.00 0.00 N ATOM 419 CA ASN A 76 33.545 -32.857 20.444 1.00 0.00 C ATOM 420 C ASN A 76 32.271 -33.424 19.843 1.00 0.00 C ATOM 421 O ASN A 76 31.802 -34.486 20.245 1.00 0.00 O ATOM 422 CB ASN A 76 34.641 -33.920 20.429 1.00 0.00 C ATOM 423 CG ASN A 76 34.893 -34.372 18.997 1.00 0.00 C ATOM 424 OD1 ASN A 76 34.365 -35.394 18.560 1.00 0.00 O ATOM 425 ND2 ASN A 76 35.676 -33.657 18.237 1.00 0.00 N ATOM 0 H ASN A 76 33.413 -33.085 22.532 1.00 0.00 H new ATOM 0 HA ASN A 76 33.868 -32.007 19.842 1.00 0.00 H new ATOM 0 HB2 ASN A 76 35.558 -33.518 20.861 1.00 0.00 H new ATOM 0 HB3 ASN A 76 34.345 -34.771 21.043 1.00 0.00 H new ATOM 0 HD21 ASN A 76 35.854 -33.944 17.274 1.00 0.00 H new ATOM 0 HD22 ASN A 76 36.111 -32.811 18.605 1.00 0.00 H new ATOM 432 N ARG A 77 31.724 -32.711 18.870 1.00 0.00 N ATOM 433 CA ARG A 77 30.511 -33.168 18.204 1.00 0.00 C ATOM 434 C ARG A 77 30.788 -34.445 17.428 1.00 0.00 C ATOM 435 O ARG A 77 31.787 -34.543 16.719 1.00 0.00 O ATOM 436 CB ARG A 77 29.995 -32.093 17.244 1.00 0.00 C ATOM 437 CG ARG A 77 29.449 -30.908 18.040 1.00 0.00 C ATOM 438 CD ARG A 77 29.071 -29.777 17.080 1.00 0.00 C ATOM 439 NE ARG A 77 28.018 -30.219 16.171 1.00 0.00 N ATOM 440 CZ ARG A 77 27.639 -29.481 15.127 1.00 0.00 C ATOM 441 NH1 ARG A 77 28.204 -28.327 14.880 1.00 0.00 N ATOM 442 NH2 ARG A 77 26.691 -29.916 14.341 1.00 0.00 N ATOM 0 H ARG A 77 32.094 -31.825 18.526 1.00 0.00 H new ATOM 0 HA ARG A 77 29.755 -33.364 18.964 1.00 0.00 H new ATOM 0 HB2 ARG A 77 30.800 -31.762 16.587 1.00 0.00 H new ATOM 0 HB3 ARG A 77 29.213 -32.506 16.607 1.00 0.00 H new ATOM 0 HG2 ARG A 77 28.577 -31.215 18.618 1.00 0.00 H new ATOM 0 HG3 ARG A 77 30.197 -30.560 18.752 1.00 0.00 H new ATOM 0 HD2 ARG A 77 28.733 -28.908 17.645 1.00 0.00 H new ATOM 0 HD3 ARG A 77 29.947 -29.466 16.510 1.00 0.00 H new ATOM 0 HE ARG A 77 27.560 -31.115 16.339 1.00 0.00 H new ATOM 0 HH11 ARG A 77 28.945 -27.981 15.490 1.00 0.00 H new ATOM 0 HH12 ARG A 77 27.904 -27.773 14.078 1.00 0.00 H new ATOM 0 HH21 ARG A 77 26.246 -30.815 14.528 1.00 0.00 H new ATOM 0 HH22 ARG A 77 26.396 -29.357 13.540 1.00 0.00 H new ATOM 456 N ASN A 78 29.897 -35.420 17.555 1.00 0.00 N ATOM 457 CA ASN A 78 30.074 -36.679 16.842 1.00 0.00 C ATOM 458 C ASN A 78 29.517 -36.594 15.418 1.00 0.00 C ATOM 459 O ASN A 78 29.679 -37.525 14.630 1.00 0.00 O ATOM 460 CB ASN A 78 29.403 -37.823 17.610 1.00 0.00 C ATOM 461 CG ASN A 78 30.169 -38.133 18.892 1.00 0.00 C ATOM 462 OD1 ASN A 78 31.338 -37.775 19.022 1.00 0.00 O ATOM 463 ND2 ASN A 78 29.575 -38.783 19.853 1.00 0.00 N ATOM 0 H ASN A 78 29.059 -35.367 18.134 1.00 0.00 H new ATOM 0 HA ASN A 78 31.143 -36.879 16.772 1.00 0.00 H new ATOM 0 HB2 ASN A 78 28.375 -37.552 17.851 1.00 0.00 H new ATOM 0 HB3 ASN A 78 29.359 -38.713 16.982 1.00 0.00 H new ATOM 0 HD21 ASN A 78 30.080 -38.995 20.714 1.00 0.00 H new ATOM 0 HD22 ASN A 78 28.605 -39.080 19.745 1.00 0.00 H new ATOM 470 N ASP A 79 28.876 -35.471 15.083 1.00 0.00 N ATOM 471 CA ASP A 79 28.321 -35.301 13.746 1.00 0.00 C ATOM 472 C ASP A 79 29.295 -34.522 12.867 1.00 0.00 C ATOM 473 O ASP A 79 29.371 -34.742 11.659 1.00 0.00 O ATOM 474 CB ASP A 79 26.990 -34.545 13.806 1.00 0.00 C ATOM 475 CG ASP A 79 25.916 -35.406 14.463 1.00 0.00 C ATOM 476 OD1 ASP A 79 26.130 -36.602 14.574 1.00 0.00 O ATOM 477 OD2 ASP A 79 24.898 -34.857 14.849 1.00 0.00 O ATOM 0 H ASP A 79 28.732 -34.680 15.711 1.00 0.00 H new ATOM 0 HA ASP A 79 28.153 -36.291 13.322 1.00 0.00 H new ATOM 0 HB2 ASP A 79 27.116 -33.619 14.367 1.00 0.00 H new ATOM 0 HB3 ASP A 79 26.677 -34.268 12.799 1.00 0.00 H new ATOM 482 N THR A 80 30.026 -33.601 13.488 1.00 0.00 N ATOM 483 CA THR A 80 30.976 -32.771 12.769 1.00 0.00 C ATOM 484 C THR A 80 32.412 -33.043 13.215 1.00 0.00 C ATOM 485 O THR A 80 33.358 -32.553 12.598 1.00 0.00 O ATOM 486 CB THR A 80 30.645 -31.306 13.027 1.00 0.00 C ATOM 487 OG1 THR A 80 30.721 -31.046 14.421 1.00 0.00 O ATOM 488 CG2 THR A 80 29.234 -31.005 12.521 1.00 0.00 C ATOM 0 H THR A 80 29.976 -33.414 14.489 1.00 0.00 H new ATOM 0 HA THR A 80 30.900 -33.006 11.707 1.00 0.00 H new ATOM 0 HB THR A 80 31.358 -30.671 12.501 1.00 0.00 H new ATOM 0 HG1 THR A 80 30.830 -30.083 14.569 1.00 0.00 H new ATOM 0 HG21 THR A 80 28.997 -29.957 12.706 1.00 0.00 H new ATOM 0 HG22 THR A 80 29.181 -31.206 11.451 1.00 0.00 H new ATOM 0 HG23 THR A 80 28.517 -31.637 13.045 1.00 0.00 H new ATOM 496 N LYS A 81 32.576 -33.811 14.287 1.00 0.00 N ATOM 497 CA LYS A 81 33.905 -34.105 14.792 1.00 0.00 C ATOM 498 C LYS A 81 34.674 -32.812 15.029 1.00 0.00 C ATOM 499 O LYS A 81 35.894 -32.763 14.881 1.00 0.00 O ATOM 500 CB LYS A 81 34.660 -34.980 13.792 1.00 0.00 C ATOM 501 CG LYS A 81 33.822 -36.224 13.479 1.00 0.00 C ATOM 502 CD LYS A 81 33.645 -37.065 14.748 1.00 0.00 C ATOM 503 CE LYS A 81 32.851 -38.335 14.425 1.00 0.00 C ATOM 504 NZ LYS A 81 32.661 -39.150 15.664 1.00 0.00 N ATOM 0 H LYS A 81 31.813 -34.235 14.815 1.00 0.00 H new ATOM 0 HA LYS A 81 33.812 -34.640 15.737 1.00 0.00 H new ATOM 0 HB2 LYS A 81 34.858 -34.421 12.878 1.00 0.00 H new ATOM 0 HB3 LYS A 81 35.627 -35.272 14.203 1.00 0.00 H new ATOM 0 HG2 LYS A 81 32.848 -35.929 13.089 1.00 0.00 H new ATOM 0 HG3 LYS A 81 34.309 -36.816 12.704 1.00 0.00 H new ATOM 0 HD2 LYS A 81 34.620 -37.329 15.158 1.00 0.00 H new ATOM 0 HD3 LYS A 81 33.125 -36.484 15.510 1.00 0.00 H new ATOM 0 HE2 LYS A 81 31.882 -38.070 14.002 1.00 0.00 H new ATOM 0 HE3 LYS A 81 33.378 -38.921 13.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 32.589 -40.156 15.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 33.472 -39.010 16.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 31.789 -38.852 16.145 1.00 0.00 H new ATOM 518 N GLU A 82 33.944 -31.763 15.406 1.00 0.00 N ATOM 519 CA GLU A 82 34.562 -30.468 15.668 1.00 0.00 C ATOM 520 C GLU A 82 34.323 -30.024 17.102 1.00 0.00 C ATOM 521 O GLU A 82 33.203 -30.071 17.609 1.00 0.00 O ATOM 522 CB GLU A 82 34.021 -29.413 14.705 1.00 0.00 C ATOM 523 CG GLU A 82 34.715 -28.086 14.989 1.00 0.00 C ATOM 524 CD GLU A 82 36.208 -28.201 14.712 1.00 0.00 C ATOM 525 OE1 GLU A 82 36.589 -29.109 13.992 1.00 0.00 O ATOM 526 OE2 GLU A 82 36.952 -27.381 15.225 1.00 0.00 O ATOM 0 H GLU A 82 32.932 -31.785 15.535 1.00 0.00 H new ATOM 0 HA GLU A 82 35.636 -30.577 15.515 1.00 0.00 H new ATOM 0 HB2 GLU A 82 34.197 -29.718 13.673 1.00 0.00 H new ATOM 0 HB3 GLU A 82 32.943 -29.309 14.827 1.00 0.00 H new ATOM 0 HG2 GLU A 82 34.282 -27.301 14.368 1.00 0.00 H new ATOM 0 HG3 GLU A 82 34.552 -27.797 16.027 1.00 0.00 H new ATOM 533 N ASP A 83 35.398 -29.599 17.747 1.00 0.00 N ATOM 534 CA ASP A 83 35.328 -29.154 19.136 1.00 0.00 C ATOM 535 C ASP A 83 34.432 -27.923 19.272 1.00 0.00 C ATOM 536 O ASP A 83 34.426 -27.048 18.408 1.00 0.00 O ATOM 537 CB ASP A 83 36.730 -28.830 19.655 1.00 0.00 C ATOM 538 CG ASP A 83 37.525 -30.117 19.846 1.00 0.00 C ATOM 539 OD1 ASP A 83 36.919 -31.174 19.820 1.00 0.00 O ATOM 540 OD2 ASP A 83 38.729 -30.026 20.016 1.00 0.00 O ATOM 0 H ASP A 83 36.330 -29.552 17.334 1.00 0.00 H new ATOM 0 HA ASP A 83 34.899 -29.962 19.729 1.00 0.00 H new ATOM 0 HB2 ASP A 83 37.245 -28.176 18.952 1.00 0.00 H new ATOM 0 HB3 ASP A 83 36.662 -28.291 20.600 1.00 0.00 H new ATOM 545 N VAL A 84 33.678 -27.869 20.366 1.00 0.00 N ATOM 546 CA VAL A 84 32.773 -26.749 20.610 1.00 0.00 C ATOM 547 C VAL A 84 33.024 -26.135 21.988 1.00 0.00 C ATOM 548 O VAL A 84 33.126 -26.848 22.986 1.00 0.00 O ATOM 549 CB VAL A 84 31.322 -27.225 20.519 1.00 0.00 C ATOM 550 CG1 VAL A 84 30.379 -26.053 20.796 1.00 0.00 C ATOM 551 CG2 VAL A 84 31.056 -27.773 19.115 1.00 0.00 C ATOM 0 H VAL A 84 33.675 -28.583 21.094 1.00 0.00 H new ATOM 0 HA VAL A 84 32.958 -25.988 19.852 1.00 0.00 H new ATOM 0 HB VAL A 84 31.150 -28.009 21.257 1.00 0.00 H new ATOM 0 HG11 VAL A 84 29.346 -26.394 20.731 1.00 0.00 H new ATOM 0 HG12 VAL A 84 30.569 -25.661 21.795 1.00 0.00 H new ATOM 0 HG13 VAL A 84 30.549 -25.267 20.060 1.00 0.00 H new ATOM 0 HG21 VAL A 84 30.023 -28.113 19.047 1.00 0.00 H new ATOM 0 HG22 VAL A 84 31.229 -26.988 18.379 1.00 0.00 H new ATOM 0 HG23 VAL A 84 31.727 -28.609 18.918 1.00 0.00 H new ATOM 561 N PHE A 85 33.124 -24.809 22.029 1.00 0.00 N ATOM 562 CA PHE A 85 33.362 -24.099 23.285 1.00 0.00 C ATOM 563 C PHE A 85 32.161 -24.254 24.218 1.00 0.00 C ATOM 564 O PHE A 85 31.015 -24.160 23.780 1.00 0.00 O ATOM 565 CB PHE A 85 33.568 -22.607 23.006 1.00 0.00 C ATOM 566 CG PHE A 85 34.871 -22.381 22.275 1.00 0.00 C ATOM 567 CD1 PHE A 85 34.909 -22.469 20.878 1.00 0.00 C ATOM 568 CD2 PHE A 85 36.034 -22.062 22.987 1.00 0.00 C ATOM 569 CE1 PHE A 85 36.108 -22.239 20.193 1.00 0.00 C ATOM 570 CE2 PHE A 85 37.232 -21.834 22.301 1.00 0.00 C ATOM 571 CZ PHE A 85 37.269 -21.924 20.906 1.00 0.00 C ATOM 0 H PHE A 85 33.044 -24.205 21.211 1.00 0.00 H new ATOM 0 HA PHE A 85 34.250 -24.521 23.755 1.00 0.00 H new ATOM 0 HB2 PHE A 85 32.739 -22.224 22.411 1.00 0.00 H new ATOM 0 HB3 PHE A 85 33.569 -22.052 23.944 1.00 0.00 H new ATOM 0 HD1 PHE A 85 34.012 -22.715 20.328 1.00 0.00 H new ATOM 0 HD2 PHE A 85 36.006 -21.992 24.064 1.00 0.00 H new ATOM 0 HE1 PHE A 85 36.136 -22.305 19.115 1.00 0.00 H new ATOM 0 HE2 PHE A 85 38.129 -21.588 22.850 1.00 0.00 H new ATOM 0 HZ PHE A 85 38.195 -21.750 20.379 1.00 0.00 H new ATOM 581 N VAL A 86 32.418 -24.477 25.504 1.00 0.00 N ATOM 582 CA VAL A 86 31.330 -24.627 26.465 1.00 0.00 C ATOM 583 C VAL A 86 31.743 -24.121 27.836 1.00 0.00 C ATOM 584 O VAL A 86 32.906 -24.221 28.230 1.00 0.00 O ATOM 585 CB VAL A 86 30.888 -26.088 26.565 1.00 0.00 C ATOM 586 CG1 VAL A 86 32.083 -26.975 26.932 1.00 0.00 C ATOM 587 CG2 VAL A 86 29.801 -26.227 27.636 1.00 0.00 C ATOM 0 H VAL A 86 33.355 -24.557 25.900 1.00 0.00 H new ATOM 0 HA VAL A 86 30.491 -24.029 26.108 1.00 0.00 H new ATOM 0 HB VAL A 86 30.491 -26.404 25.600 1.00 0.00 H new ATOM 0 HG11 VAL A 86 31.758 -28.013 27.001 1.00 0.00 H new ATOM 0 HG12 VAL A 86 32.852 -26.886 26.165 1.00 0.00 H new ATOM 0 HG13 VAL A 86 32.490 -26.658 27.892 1.00 0.00 H new ATOM 0 HG21 VAL A 86 29.489 -27.269 27.704 1.00 0.00 H new ATOM 0 HG22 VAL A 86 30.195 -25.903 28.599 1.00 0.00 H new ATOM 0 HG23 VAL A 86 28.945 -25.608 27.368 1.00 0.00 H new ATOM 597 N HIS A 87 30.775 -23.588 28.560 1.00 0.00 N ATOM 598 CA HIS A 87 31.022 -23.083 29.904 1.00 0.00 C ATOM 599 C HIS A 87 29.891 -23.514 30.838 1.00 0.00 C ATOM 600 O HIS A 87 28.810 -23.885 30.380 1.00 0.00 O ATOM 601 CB HIS A 87 31.149 -21.558 29.878 1.00 0.00 C ATOM 602 CG HIS A 87 32.405 -21.186 29.142 1.00 0.00 C ATOM 603 ND1 HIS A 87 32.457 -21.094 27.764 1.00 0.00 N ATOM 604 CD2 HIS A 87 33.658 -20.839 29.584 1.00 0.00 C ATOM 605 CE1 HIS A 87 33.701 -20.703 27.434 1.00 0.00 C ATOM 606 NE2 HIS A 87 34.466 -20.528 28.505 1.00 0.00 N ATOM 0 H HIS A 87 29.810 -23.492 28.243 1.00 0.00 H new ATOM 0 HA HIS A 87 31.958 -23.500 30.276 1.00 0.00 H new ATOM 0 HB2 HIS A 87 30.281 -21.116 29.389 1.00 0.00 H new ATOM 0 HB3 HIS A 87 31.177 -21.165 30.894 1.00 0.00 H new ATOM 0 HD2 HIS A 87 33.966 -20.813 30.619 1.00 0.00 H new ATOM 0 HE1 HIS A 87 34.037 -20.550 26.419 1.00 0.00 H new ATOM 0 HE2 HIS A 87 35.441 -20.228 28.527 1.00 0.00 H new ATOM 614 N GLN A 88 30.152 -23.498 32.143 1.00 0.00 N ATOM 615 CA GLN A 88 29.145 -23.919 33.118 1.00 0.00 C ATOM 616 C GLN A 88 27.887 -23.065 33.039 1.00 0.00 C ATOM 617 O GLN A 88 26.817 -23.484 33.483 1.00 0.00 O ATOM 618 CB GLN A 88 29.723 -23.842 34.530 1.00 0.00 C ATOM 619 CG GLN A 88 30.132 -22.405 34.855 1.00 0.00 C ATOM 620 CD GLN A 88 31.634 -22.237 34.662 1.00 0.00 C ATOM 621 OE1 GLN A 88 32.226 -22.884 33.797 1.00 0.00 O ATOM 622 NE2 GLN A 88 32.292 -21.400 35.417 1.00 0.00 N ATOM 0 H GLN A 88 31.040 -23.202 32.548 1.00 0.00 H new ATOM 0 HA GLN A 88 28.870 -24.947 32.882 1.00 0.00 H new ATOM 0 HB2 GLN A 88 28.985 -24.190 35.253 1.00 0.00 H new ATOM 0 HB3 GLN A 88 30.587 -24.502 34.614 1.00 0.00 H new ATOM 0 HG2 GLN A 88 29.594 -21.710 34.211 1.00 0.00 H new ATOM 0 HG3 GLN A 88 29.859 -22.164 35.882 1.00 0.00 H new ATOM 0 HE21 GLN A 88 31.801 -20.865 36.133 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.297 -21.281 35.291 1.00 0.00 H new ATOM 631 N THR A 89 28.008 -21.881 32.468 1.00 0.00 N ATOM 632 CA THR A 89 26.853 -21.002 32.329 1.00 0.00 C ATOM 633 C THR A 89 26.034 -21.387 31.099 1.00 0.00 C ATOM 634 O THR A 89 24.901 -20.936 30.930 1.00 0.00 O ATOM 635 CB THR A 89 27.306 -19.544 32.215 1.00 0.00 C ATOM 636 OG1 THR A 89 28.099 -19.386 31.048 1.00 0.00 O ATOM 637 CG2 THR A 89 28.122 -19.157 33.452 1.00 0.00 C ATOM 0 H THR A 89 28.881 -21.506 32.096 1.00 0.00 H new ATOM 0 HA THR A 89 26.229 -21.112 33.216 1.00 0.00 H new ATOM 0 HB THR A 89 26.431 -18.897 32.149 1.00 0.00 H new ATOM 0 HG1 THR A 89 28.388 -18.453 30.973 1.00 0.00 H new ATOM 0 HG21 THR A 89 28.442 -18.119 33.366 1.00 0.00 H new ATOM 0 HG22 THR A 89 27.508 -19.275 34.345 1.00 0.00 H new ATOM 0 HG23 THR A 89 28.998 -19.802 33.527 1.00 0.00 H new ATOM 645 N ALA A 90 26.612 -22.229 30.243 1.00 0.00 N ATOM 646 CA ALA A 90 25.922 -22.678 29.040 1.00 0.00 C ATOM 647 C ALA A 90 25.162 -23.980 29.294 1.00 0.00 C ATOM 648 O ALA A 90 24.556 -24.534 28.378 1.00 0.00 O ATOM 649 CB ALA A 90 26.939 -22.900 27.919 1.00 0.00 C ATOM 0 H ALA A 90 27.551 -22.611 30.361 1.00 0.00 H new ATOM 0 HA ALA A 90 25.206 -21.909 28.751 1.00 0.00 H new ATOM 0 HB1 ALA A 90 26.422 -23.236 27.020 1.00 0.00 H new ATOM 0 HB2 ALA A 90 27.460 -21.966 27.710 1.00 0.00 H new ATOM 0 HB3 ALA A 90 27.660 -23.657 28.227 1.00 0.00 H new ATOM 655 N ILE A 91 25.214 -24.477 30.528 1.00 0.00 N ATOM 656 CA ILE A 91 24.554 -25.735 30.856 1.00 0.00 C ATOM 657 C ILE A 91 23.169 -25.491 31.455 1.00 0.00 C ATOM 658 O ILE A 91 23.039 -25.155 32.632 1.00 0.00 O ATOM 659 CB ILE A 91 25.424 -26.504 31.851 1.00 0.00 C ATOM 660 CG1 ILE A 91 26.796 -26.766 31.226 1.00 0.00 C ATOM 661 CG2 ILE A 91 24.761 -27.834 32.199 1.00 0.00 C ATOM 662 CD1 ILE A 91 27.754 -27.282 32.299 1.00 0.00 C ATOM 0 H ILE A 91 25.700 -24.033 31.307 1.00 0.00 H new ATOM 0 HA ILE A 91 24.425 -26.315 29.943 1.00 0.00 H new ATOM 0 HB ILE A 91 25.541 -25.914 32.760 1.00 0.00 H new ATOM 0 HG12 ILE A 91 26.708 -27.496 30.421 1.00 0.00 H new ATOM 0 HG13 ILE A 91 27.187 -25.850 30.784 1.00 0.00 H new ATOM 0 HG21 ILE A 91 25.386 -28.377 32.908 1.00 0.00 H new ATOM 0 HG22 ILE A 91 23.784 -27.648 32.644 1.00 0.00 H new ATOM 0 HG23 ILE A 91 24.640 -28.428 31.293 1.00 0.00 H new ATOM 0 HD11 ILE A 91 28.732 -27.469 31.855 1.00 0.00 H new ATOM 0 HD12 ILE A 91 27.851 -26.537 33.089 1.00 0.00 H new ATOM 0 HD13 ILE A 91 27.364 -28.209 32.720 1.00 0.00 H new ATOM 674 N LYS A 92 22.140 -25.671 30.630 1.00 0.00 N ATOM 675 CA LYS A 92 20.762 -25.478 31.072 1.00 0.00 C ATOM 676 C LYS A 92 20.386 -26.470 32.171 1.00 0.00 C ATOM 677 O LYS A 92 19.766 -26.101 33.168 1.00 0.00 O ATOM 678 CB LYS A 92 19.807 -25.633 29.883 1.00 0.00 C ATOM 679 CG LYS A 92 18.353 -25.427 30.330 1.00 0.00 C ATOM 680 CD LYS A 92 17.411 -25.568 29.131 1.00 0.00 C ATOM 681 CE LYS A 92 15.968 -25.362 29.591 1.00 0.00 C ATOM 682 NZ LYS A 92 15.052 -25.481 28.421 1.00 0.00 N ATOM 0 H LYS A 92 22.235 -25.950 29.653 1.00 0.00 H new ATOM 0 HA LYS A 92 20.677 -24.471 31.481 1.00 0.00 H new ATOM 0 HB2 LYS A 92 20.061 -24.910 29.108 1.00 0.00 H new ATOM 0 HB3 LYS A 92 19.922 -26.624 29.444 1.00 0.00 H new ATOM 0 HG2 LYS A 92 18.092 -26.158 31.096 1.00 0.00 H new ATOM 0 HG3 LYS A 92 18.238 -24.440 30.779 1.00 0.00 H new ATOM 0 HD2 LYS A 92 17.668 -24.836 28.365 1.00 0.00 H new ATOM 0 HD3 LYS A 92 17.523 -26.554 28.680 1.00 0.00 H new ATOM 0 HE2 LYS A 92 15.707 -26.102 30.348 1.00 0.00 H new ATOM 0 HE3 LYS A 92 15.859 -24.381 30.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 14.070 -25.341 28.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.297 -24.759 27.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.149 -26.426 27.999 1.00 0.00 H new ATOM 696 N LYS A 93 20.748 -27.734 31.971 1.00 0.00 N ATOM 697 CA LYS A 93 20.412 -28.775 32.940 1.00 0.00 C ATOM 698 C LYS A 93 21.669 -29.356 33.577 1.00 0.00 C ATOM 699 O LYS A 93 22.654 -29.626 32.894 1.00 0.00 O ATOM 700 CB LYS A 93 19.635 -29.900 32.254 1.00 0.00 C ATOM 701 CG LYS A 93 18.292 -29.368 31.755 1.00 0.00 C ATOM 702 CD LYS A 93 17.512 -30.497 31.079 1.00 0.00 C ATOM 703 CE LYS A 93 16.158 -29.969 30.606 1.00 0.00 C ATOM 704 NZ LYS A 93 16.368 -28.902 29.587 1.00 0.00 N ATOM 0 H LYS A 93 21.268 -28.061 31.157 1.00 0.00 H new ATOM 0 HA LYS A 93 19.799 -28.321 33.718 1.00 0.00 H new ATOM 0 HB2 LYS A 93 20.212 -30.298 31.419 1.00 0.00 H new ATOM 0 HB3 LYS A 93 19.475 -30.722 32.951 1.00 0.00 H new ATOM 0 HG2 LYS A 93 17.717 -28.964 32.588 1.00 0.00 H new ATOM 0 HG3 LYS A 93 18.452 -28.551 31.052 1.00 0.00 H new ATOM 0 HD2 LYS A 93 18.077 -30.888 30.233 1.00 0.00 H new ATOM 0 HD3 LYS A 93 17.369 -31.323 31.776 1.00 0.00 H new ATOM 0 HE2 LYS A 93 15.568 -30.781 30.181 1.00 0.00 H new ATOM 0 HE3 LYS A 93 15.595 -29.573 31.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 15.456 -28.650 29.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 16.779 -28.063 30.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 17.016 -29.248 28.851 1.00 0.00 H new ATOM 718 N ASN A 94 21.618 -29.551 34.889 1.00 0.00 N ATOM 719 CA ASN A 94 22.752 -30.111 35.611 1.00 0.00 C ATOM 720 C ASN A 94 22.268 -31.032 36.723 1.00 0.00 C ATOM 721 O ASN A 94 21.312 -30.717 37.431 1.00 0.00 O ATOM 722 CB ASN A 94 23.594 -28.986 36.216 1.00 0.00 C ATOM 723 CG ASN A 94 24.817 -29.571 36.916 1.00 0.00 C ATOM 724 OD1 ASN A 94 25.652 -30.213 36.280 1.00 0.00 O ATOM 725 ND2 ASN A 94 24.975 -29.382 38.199 1.00 0.00 N ATOM 0 H ASN A 94 20.809 -29.331 35.471 1.00 0.00 H new ATOM 0 HA ASN A 94 23.359 -30.684 34.910 1.00 0.00 H new ATOM 0 HB2 ASN A 94 23.908 -28.294 35.434 1.00 0.00 H new ATOM 0 HB3 ASN A 94 22.996 -28.414 36.926 1.00 0.00 H new ATOM 0 HD21 ASN A 94 25.791 -29.767 38.674 1.00 0.00 H new ATOM 0 HD22 ASN A 94 24.282 -28.850 38.725 1.00 0.00 H new ATOM 732 N ASN A 95 22.934 -32.169 36.874 1.00 0.00 N ATOM 733 CA ASN A 95 22.542 -33.133 37.895 1.00 0.00 C ATOM 734 C ASN A 95 22.606 -32.469 39.283 1.00 0.00 C ATOM 735 O ASN A 95 23.543 -31.721 39.558 1.00 0.00 O ATOM 736 CB ASN A 95 23.495 -34.331 37.854 1.00 0.00 C ATOM 737 CG ASN A 95 24.919 -33.890 38.172 1.00 0.00 C ATOM 738 OD1 ASN A 95 25.265 -32.724 37.993 1.00 0.00 O ATOM 739 ND2 ASN A 95 25.774 -34.760 38.636 1.00 0.00 N ATOM 0 H ASN A 95 23.738 -32.445 36.311 1.00 0.00 H new ATOM 0 HA ASN A 95 21.524 -33.472 37.705 1.00 0.00 H new ATOM 0 HB2 ASN A 95 23.172 -35.085 38.572 1.00 0.00 H new ATOM 0 HB3 ASN A 95 23.463 -34.795 36.868 1.00 0.00 H new ATOM 0 HD21 ASN A 95 26.729 -34.472 38.850 1.00 0.00 H new ATOM 0 HD22 ASN A 95 25.487 -35.728 38.785 1.00 0.00 H new ATOM 746 N PRO A 96 21.646 -32.705 40.160 1.00 0.00 N ATOM 747 CA PRO A 96 21.649 -32.089 41.525 1.00 0.00 C ATOM 748 C PRO A 96 22.722 -32.682 42.430 1.00 0.00 C ATOM 749 O PRO A 96 22.980 -32.171 43.521 1.00 0.00 O ATOM 750 CB PRO A 96 20.248 -32.383 42.071 1.00 0.00 C ATOM 751 CG PRO A 96 19.799 -33.611 41.356 1.00 0.00 C ATOM 752 CD PRO A 96 20.462 -33.564 39.967 1.00 0.00 C ATOM 0 HA PRO A 96 21.877 -31.024 41.483 1.00 0.00 H new ATOM 0 HB2 PRO A 96 20.271 -32.541 43.149 1.00 0.00 H new ATOM 0 HB3 PRO A 96 19.570 -31.550 41.886 1.00 0.00 H new ATOM 0 HG2 PRO A 96 20.096 -34.508 41.899 1.00 0.00 H new ATOM 0 HG3 PRO A 96 18.713 -33.636 41.269 1.00 0.00 H new ATOM 0 HD2 PRO A 96 20.744 -34.560 39.626 1.00 0.00 H new ATOM 0 HD3 PRO A 96 19.787 -33.150 39.218 1.00 0.00 H new ATOM 760 N ARG A 97 23.351 -33.751 41.968 1.00 0.00 N ATOM 761 CA ARG A 97 24.400 -34.398 42.744 1.00 0.00 C ATOM 762 C ARG A 97 25.550 -33.425 43.001 1.00 0.00 C ATOM 763 O ARG A 97 26.170 -33.455 44.063 1.00 0.00 O ATOM 764 CB ARG A 97 24.925 -35.626 41.995 1.00 0.00 C ATOM 765 CG ARG A 97 23.857 -36.725 41.979 1.00 0.00 C ATOM 766 CD ARG A 97 24.383 -37.950 41.226 1.00 0.00 C ATOM 767 NE ARG A 97 23.376 -39.008 41.220 1.00 0.00 N ATOM 768 CZ ARG A 97 23.597 -40.183 40.628 1.00 0.00 C ATOM 769 NH1 ARG A 97 24.735 -40.429 40.026 1.00 0.00 N ATOM 770 NH2 ARG A 97 22.669 -41.100 40.649 1.00 0.00 N ATOM 0 H ARG A 97 23.156 -34.187 41.067 1.00 0.00 H new ATOM 0 HA ARG A 97 23.980 -34.710 43.700 1.00 0.00 H new ATOM 0 HB2 ARG A 97 25.193 -35.353 40.974 1.00 0.00 H new ATOM 0 HB3 ARG A 97 25.831 -35.995 42.475 1.00 0.00 H new ATOM 0 HG2 ARG A 97 23.591 -37.001 42.999 1.00 0.00 H new ATOM 0 HG3 ARG A 97 22.949 -36.356 41.502 1.00 0.00 H new ATOM 0 HD2 ARG A 97 24.639 -37.675 40.203 1.00 0.00 H new ATOM 0 HD3 ARG A 97 25.297 -38.311 41.697 1.00 0.00 H new ATOM 0 HE ARG A 97 22.481 -38.844 41.680 1.00 0.00 H new ATOM 0 HH11 ARG A 97 25.466 -39.718 40.006 1.00 0.00 H new ATOM 0 HH12 ARG A 97 24.890 -41.332 39.578 1.00 0.00 H new ATOM 0 HH21 ARG A 97 21.781 -40.916 41.116 1.00 0.00 H new ATOM 0 HH22 ARG A 97 22.832 -42.000 40.198 1.00 0.00 H new ATOM 784 N LYS A 98 25.838 -32.566 42.020 1.00 0.00 N ATOM 785 CA LYS A 98 26.929 -31.610 42.155 1.00 0.00 C ATOM 786 C LYS A 98 26.387 -30.207 42.414 1.00 0.00 C ATOM 787 O LYS A 98 25.409 -29.787 41.795 1.00 0.00 O ATOM 788 CB LYS A 98 27.759 -31.612 40.871 1.00 0.00 C ATOM 789 CG LYS A 98 28.209 -33.041 40.566 1.00 0.00 C ATOM 790 CD LYS A 98 29.099 -33.553 41.699 1.00 0.00 C ATOM 791 CE LYS A 98 29.637 -34.937 41.337 1.00 0.00 C ATOM 792 NZ LYS A 98 30.486 -35.450 42.451 1.00 0.00 N ATOM 0 H LYS A 98 25.334 -32.516 41.134 1.00 0.00 H new ATOM 0 HA LYS A 98 27.552 -31.900 43.001 1.00 0.00 H new ATOM 0 HB2 LYS A 98 27.170 -31.219 40.042 1.00 0.00 H new ATOM 0 HB3 LYS A 98 28.626 -30.961 40.983 1.00 0.00 H new ATOM 0 HG2 LYS A 98 27.340 -33.690 40.451 1.00 0.00 H new ATOM 0 HG3 LYS A 98 28.754 -33.068 39.622 1.00 0.00 H new ATOM 0 HD2 LYS A 98 29.925 -32.862 41.867 1.00 0.00 H new ATOM 0 HD3 LYS A 98 28.531 -33.603 42.628 1.00 0.00 H new ATOM 0 HE2 LYS A 98 28.810 -35.623 41.151 1.00 0.00 H new ATOM 0 HE3 LYS A 98 30.220 -34.883 40.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 30.852 -36.392 42.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 31.282 -34.800 42.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 29.917 -35.517 43.319 1.00 0.00 H new ATOM 806 N TYR A 99 27.027 -29.487 43.333 1.00 0.00 N ATOM 807 CA TYR A 99 26.587 -28.136 43.672 1.00 0.00 C ATOM 808 C TYR A 99 26.829 -27.180 42.507 1.00 0.00 C ATOM 809 O TYR A 99 25.987 -26.338 42.197 1.00 0.00 O ATOM 810 CB TYR A 99 27.325 -27.636 44.914 1.00 0.00 C ATOM 811 CG TYR A 99 26.991 -28.512 46.099 1.00 0.00 C ATOM 812 CD1 TYR A 99 27.788 -29.627 46.387 1.00 0.00 C ATOM 813 CD2 TYR A 99 25.896 -28.205 46.912 1.00 0.00 C ATOM 814 CE1 TYR A 99 27.486 -30.435 47.489 1.00 0.00 C ATOM 815 CE2 TYR A 99 25.592 -29.015 48.013 1.00 0.00 C ATOM 816 CZ TYR A 99 26.388 -30.130 48.301 1.00 0.00 C ATOM 817 OH TYR A 99 26.091 -30.926 49.389 1.00 0.00 O ATOM 0 H TYR A 99 27.843 -29.812 43.851 1.00 0.00 H new ATOM 0 HA TYR A 99 25.517 -28.168 43.880 1.00 0.00 H new ATOM 0 HB2 TYR A 99 28.400 -27.644 44.736 1.00 0.00 H new ATOM 0 HB3 TYR A 99 27.044 -26.604 45.123 1.00 0.00 H new ATOM 0 HD1 TYR A 99 28.635 -29.863 45.759 1.00 0.00 H new ATOM 0 HD2 TYR A 99 25.284 -27.343 46.691 1.00 0.00 H new ATOM 0 HE1 TYR A 99 28.101 -31.294 47.713 1.00 0.00 H new ATOM 0 HE2 TYR A 99 24.744 -28.780 48.639 1.00 0.00 H new ATOM 0 HH TYR A 99 25.299 -30.573 49.846 1.00 0.00 H new ATOM 827 N LEU A 100 27.985 -27.316 41.871 1.00 0.00 N ATOM 828 CA LEU A 100 28.331 -26.471 40.736 1.00 0.00 C ATOM 829 C LEU A 100 28.037 -27.195 39.429 1.00 0.00 C ATOM 830 O LEU A 100 28.168 -28.416 39.347 1.00 0.00 O ATOM 831 CB LEU A 100 29.813 -26.094 40.794 1.00 0.00 C ATOM 832 CG LEU A 100 30.100 -25.341 42.094 1.00 0.00 C ATOM 833 CD1 LEU A 100 28.897 -24.469 42.456 1.00 0.00 C ATOM 834 CD2 LEU A 100 30.354 -26.347 43.221 1.00 0.00 C ATOM 0 H LEU A 100 28.697 -28.002 42.121 1.00 0.00 H new ATOM 0 HA LEU A 100 27.728 -25.564 40.782 1.00 0.00 H new ATOM 0 HB2 LEU A 100 30.429 -26.991 40.738 1.00 0.00 H new ATOM 0 HB3 LEU A 100 30.075 -25.473 39.937 1.00 0.00 H new ATOM 0 HG LEU A 100 30.980 -24.711 41.961 1.00 0.00 H new ATOM 0 HD11 LEU A 100 29.102 -23.933 43.382 1.00 0.00 H new ATOM 0 HD12 LEU A 100 28.713 -23.753 41.655 1.00 0.00 H new ATOM 0 HD13 LEU A 100 28.018 -25.099 42.589 1.00 0.00 H new ATOM 0 HD21 LEU A 100 30.559 -25.811 44.148 1.00 0.00 H new ATOM 0 HD22 LEU A 100 29.474 -26.976 43.352 1.00 0.00 H new ATOM 0 HD23 LEU A 100 31.211 -26.971 42.966 1.00 0.00 H new ATOM 846 N ARG A 101 27.635 -26.442 38.411 1.00 0.00 N ATOM 847 CA ARG A 101 27.343 -27.042 37.114 1.00 0.00 C ATOM 848 C ARG A 101 28.619 -27.575 36.477 1.00 0.00 C ATOM 849 O ARG A 101 29.620 -26.865 36.373 1.00 0.00 O ATOM 850 CB ARG A 101 26.704 -25.998 36.194 1.00 0.00 C ATOM 851 CG ARG A 101 25.308 -25.649 36.712 1.00 0.00 C ATOM 852 CD ARG A 101 24.672 -24.599 35.799 1.00 0.00 C ATOM 853 NE ARG A 101 23.343 -24.242 36.284 1.00 0.00 N ATOM 854 CZ ARG A 101 22.272 -24.987 36.006 1.00 0.00 C ATOM 855 NH1 ARG A 101 22.380 -26.073 35.281 1.00 0.00 N ATOM 856 NH2 ARG A 101 21.102 -24.633 36.465 1.00 0.00 N ATOM 0 H ARG A 101 27.505 -25.431 38.456 1.00 0.00 H new ATOM 0 HA ARG A 101 26.650 -27.871 37.259 1.00 0.00 H new ATOM 0 HB2 ARG A 101 27.324 -25.102 36.156 1.00 0.00 H new ATOM 0 HB3 ARG A 101 26.640 -26.384 35.177 1.00 0.00 H new ATOM 0 HG2 ARG A 101 24.686 -26.544 36.743 1.00 0.00 H new ATOM 0 HG3 ARG A 101 25.371 -25.269 37.732 1.00 0.00 H new ATOM 0 HD2 ARG A 101 25.303 -23.711 35.761 1.00 0.00 H new ATOM 0 HD3 ARG A 101 24.603 -24.985 34.782 1.00 0.00 H new ATOM 0 HE ARG A 101 23.230 -23.401 36.850 1.00 0.00 H new ATOM 0 HH11 ARG A 101 23.291 -26.358 34.922 1.00 0.00 H new ATOM 0 HH12 ARG A 101 21.553 -26.634 35.076 1.00 0.00 H new ATOM 0 HH21 ARG A 101 21.010 -23.791 37.033 1.00 0.00 H new ATOM 0 HH22 ARG A 101 20.280 -25.199 36.256 1.00 0.00 H new ATOM 870 N SER A 102 28.574 -28.833 36.059 1.00 0.00 N ATOM 871 CA SER A 102 29.733 -29.471 35.445 1.00 0.00 C ATOM 872 C SER A 102 29.291 -30.482 34.396 1.00 0.00 C ATOM 873 O SER A 102 28.141 -30.923 34.394 1.00 0.00 O ATOM 874 CB SER A 102 30.568 -30.173 36.514 1.00 0.00 C ATOM 875 OG SER A 102 31.000 -29.222 37.477 1.00 0.00 O ATOM 0 H SER A 102 27.751 -29.431 36.133 1.00 0.00 H new ATOM 0 HA SER A 102 30.336 -28.702 34.961 1.00 0.00 H new ATOM 0 HB2 SER A 102 29.979 -30.953 36.996 1.00 0.00 H new ATOM 0 HB3 SER A 102 31.429 -30.660 36.056 1.00 0.00 H new ATOM 0 HG SER A 102 30.271 -29.038 38.105 1.00 0.00 H new ATOM 881 N VAL A 103 30.208 -30.856 33.511 1.00 0.00 N ATOM 882 CA VAL A 103 29.895 -31.829 32.475 1.00 0.00 C ATOM 883 C VAL A 103 30.906 -32.973 32.522 1.00 0.00 C ATOM 884 O VAL A 103 32.112 -32.737 32.577 1.00 0.00 O ATOM 885 CB VAL A 103 29.921 -31.167 31.101 1.00 0.00 C ATOM 886 CG1 VAL A 103 29.447 -32.167 30.052 1.00 0.00 C ATOM 887 CG2 VAL A 103 28.999 -29.950 31.113 1.00 0.00 C ATOM 0 H VAL A 103 31.165 -30.503 33.491 1.00 0.00 H new ATOM 0 HA VAL A 103 28.895 -32.225 32.652 1.00 0.00 H new ATOM 0 HB VAL A 103 30.935 -30.848 30.861 1.00 0.00 H new ATOM 0 HG11 VAL A 103 29.464 -31.698 29.068 1.00 0.00 H new ATOM 0 HG12 VAL A 103 30.107 -33.034 30.052 1.00 0.00 H new ATOM 0 HG13 VAL A 103 28.431 -32.484 30.285 1.00 0.00 H new ATOM 0 HG21 VAL A 103 29.014 -29.473 30.133 1.00 0.00 H new ATOM 0 HG22 VAL A 103 27.983 -30.266 31.348 1.00 0.00 H new ATOM 0 HG23 VAL A 103 29.342 -29.241 31.867 1.00 0.00 H new ATOM 897 N GLY A 104 30.412 -34.206 32.515 1.00 0.00 N ATOM 898 CA GLY A 104 31.297 -35.364 32.586 1.00 0.00 C ATOM 899 C GLY A 104 32.239 -35.414 31.389 1.00 0.00 C ATOM 900 O GLY A 104 31.857 -35.069 30.270 1.00 0.00 O ATOM 0 H GLY A 104 29.418 -34.429 32.462 1.00 0.00 H new ATOM 0 HA2 GLY A 104 31.878 -35.325 33.507 1.00 0.00 H new ATOM 0 HA3 GLY A 104 30.703 -36.277 32.622 1.00 0.00 H new ATOM 904 N ASP A 105 33.471 -35.852 31.632 1.00 0.00 N ATOM 905 CA ASP A 105 34.456 -35.957 30.560 1.00 0.00 C ATOM 906 C ASP A 105 34.242 -37.252 29.785 1.00 0.00 C ATOM 907 O ASP A 105 34.247 -38.338 30.364 1.00 0.00 O ATOM 908 CB ASP A 105 35.869 -35.937 31.146 1.00 0.00 C ATOM 909 CG ASP A 105 36.900 -35.936 30.024 1.00 0.00 C ATOM 910 OD1 ASP A 105 36.499 -36.063 28.880 1.00 0.00 O ATOM 911 OD2 ASP A 105 38.075 -35.804 30.324 1.00 0.00 O ATOM 0 H ASP A 105 33.809 -36.137 32.551 1.00 0.00 H new ATOM 0 HA ASP A 105 34.336 -35.110 29.885 1.00 0.00 H new ATOM 0 HB2 ASP A 105 35.999 -35.054 31.771 1.00 0.00 H new ATOM 0 HB3 ASP A 105 36.018 -36.806 31.787 1.00 0.00 H new ATOM 916 N GLY A 106 34.040 -37.131 28.480 1.00 0.00 N ATOM 917 CA GLY A 106 33.815 -38.304 27.646 1.00 0.00 C ATOM 918 C GLY A 106 32.344 -38.715 27.687 1.00 0.00 C ATOM 919 O GLY A 106 31.954 -39.727 27.102 1.00 0.00 O ATOM 0 H GLY A 106 34.027 -36.242 27.980 1.00 0.00 H new ATOM 0 HA2 GLY A 106 34.110 -38.089 26.619 1.00 0.00 H new ATOM 0 HA3 GLY A 106 34.439 -39.128 27.991 1.00 0.00 H new ATOM 923 N GLU A 107 31.526 -37.922 28.381 1.00 0.00 N ATOM 924 CA GLU A 107 30.103 -38.204 28.491 1.00 0.00 C ATOM 925 C GLU A 107 29.355 -37.644 27.292 1.00 0.00 C ATOM 926 O GLU A 107 29.603 -36.519 26.861 1.00 0.00 O ATOM 927 CB GLU A 107 29.556 -37.584 29.777 1.00 0.00 C ATOM 928 CG GLU A 107 28.049 -37.827 29.879 1.00 0.00 C ATOM 929 CD GLU A 107 27.763 -39.323 29.945 1.00 0.00 C ATOM 930 OE1 GLU A 107 28.676 -40.070 30.254 1.00 0.00 O ATOM 931 OE2 GLU A 107 26.630 -39.700 29.689 1.00 0.00 O ATOM 0 H GLU A 107 31.829 -37.081 28.873 1.00 0.00 H new ATOM 0 HA GLU A 107 29.960 -39.284 28.517 1.00 0.00 H new ATOM 0 HB2 GLU A 107 30.061 -38.016 30.641 1.00 0.00 H new ATOM 0 HB3 GLU A 107 29.761 -36.514 29.790 1.00 0.00 H new ATOM 0 HG2 GLU A 107 27.652 -37.334 30.766 1.00 0.00 H new ATOM 0 HG3 GLU A 107 27.543 -37.390 29.018 1.00 0.00 H new ATOM 938 N THR A 108 28.435 -38.436 26.765 1.00 0.00 N ATOM 939 CA THR A 108 27.640 -38.001 25.624 1.00 0.00 C ATOM 940 C THR A 108 26.665 -36.917 26.064 1.00 0.00 C ATOM 941 O THR A 108 25.977 -37.068 27.072 1.00 0.00 O ATOM 942 CB THR A 108 26.869 -39.184 25.039 1.00 0.00 C ATOM 943 OG1 THR A 108 27.784 -40.192 24.632 1.00 0.00 O ATOM 944 CG2 THR A 108 26.043 -38.721 23.838 1.00 0.00 C ATOM 0 H THR A 108 28.220 -39.374 27.103 1.00 0.00 H new ATOM 0 HA THR A 108 28.305 -37.601 24.859 1.00 0.00 H new ATOM 0 HB THR A 108 26.199 -39.589 25.798 1.00 0.00 H new ATOM 0 HG1 THR A 108 27.289 -40.951 24.259 1.00 0.00 H new ATOM 0 HG21 THR A 108 25.495 -39.568 23.425 1.00 0.00 H new ATOM 0 HG22 THR A 108 25.338 -37.953 24.156 1.00 0.00 H new ATOM 0 HG23 THR A 108 26.706 -38.311 23.076 1.00 0.00 H new ATOM 952 N VAL A 109 26.621 -35.813 25.324 1.00 0.00 N ATOM 953 CA VAL A 109 25.737 -34.711 25.696 1.00 0.00 C ATOM 954 C VAL A 109 24.980 -34.170 24.486 1.00 0.00 C ATOM 955 O VAL A 109 25.352 -34.425 23.346 1.00 0.00 O ATOM 956 CB VAL A 109 26.567 -33.586 26.321 1.00 0.00 C ATOM 957 CG1 VAL A 109 27.384 -34.151 27.483 1.00 0.00 C ATOM 958 CG2 VAL A 109 27.516 -32.987 25.279 1.00 0.00 C ATOM 0 H VAL A 109 27.174 -35.658 24.481 1.00 0.00 H new ATOM 0 HA VAL A 109 25.007 -35.086 26.413 1.00 0.00 H new ATOM 0 HB VAL A 109 25.897 -32.805 26.681 1.00 0.00 H new ATOM 0 HG11 VAL A 109 27.977 -33.354 27.932 1.00 0.00 H new ATOM 0 HG12 VAL A 109 26.711 -34.568 28.232 1.00 0.00 H new ATOM 0 HG13 VAL A 109 28.047 -34.934 27.115 1.00 0.00 H new ATOM 0 HG21 VAL A 109 28.100 -32.188 25.736 1.00 0.00 H new ATOM 0 HG22 VAL A 109 28.187 -33.762 24.910 1.00 0.00 H new ATOM 0 HG23 VAL A 109 26.937 -32.583 24.449 1.00 0.00 H new ATOM 968 N GLU A 110 23.933 -33.392 24.748 1.00 0.00 N ATOM 969 CA GLU A 110 23.163 -32.774 23.680 1.00 0.00 C ATOM 970 C GLU A 110 23.124 -31.273 23.918 1.00 0.00 C ATOM 971 O GLU A 110 22.972 -30.830 25.057 1.00 0.00 O ATOM 972 CB GLU A 110 21.737 -33.337 23.658 1.00 0.00 C ATOM 973 CG GLU A 110 21.031 -33.003 24.972 1.00 0.00 C ATOM 974 CD GLU A 110 19.632 -33.612 24.981 1.00 0.00 C ATOM 975 OE1 GLU A 110 19.270 -34.222 23.988 1.00 0.00 O ATOM 976 OE2 GLU A 110 18.946 -33.459 25.978 1.00 0.00 O ATOM 0 H GLU A 110 23.602 -33.177 25.688 1.00 0.00 H new ATOM 0 HA GLU A 110 23.630 -32.988 22.719 1.00 0.00 H new ATOM 0 HB2 GLU A 110 21.183 -32.917 22.819 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.764 -34.417 23.513 1.00 0.00 H new ATOM 0 HG2 GLU A 110 21.609 -33.386 25.813 1.00 0.00 H new ATOM 0 HG3 GLU A 110 20.967 -31.922 25.096 1.00 0.00 H new ATOM 983 N PHE A 111 23.291 -30.484 22.866 1.00 0.00 N ATOM 984 CA PHE A 111 23.320 -29.041 23.042 1.00 0.00 C ATOM 985 C PHE A 111 23.034 -28.289 21.745 1.00 0.00 C ATOM 986 O PHE A 111 23.149 -28.838 20.650 1.00 0.00 O ATOM 987 CB PHE A 111 24.698 -28.644 23.566 1.00 0.00 C ATOM 988 CG PHE A 111 25.752 -29.263 22.682 1.00 0.00 C ATOM 989 CD1 PHE A 111 26.234 -28.570 21.565 1.00 0.00 C ATOM 990 CD2 PHE A 111 26.242 -30.540 22.979 1.00 0.00 C ATOM 991 CE1 PHE A 111 27.207 -29.158 20.748 1.00 0.00 C ATOM 992 CE2 PHE A 111 27.213 -31.126 22.164 1.00 0.00 C ATOM 993 CZ PHE A 111 27.696 -30.435 21.048 1.00 0.00 C ATOM 0 H PHE A 111 23.406 -30.808 21.906 1.00 0.00 H new ATOM 0 HA PHE A 111 22.536 -28.771 23.750 1.00 0.00 H new ATOM 0 HB2 PHE A 111 24.801 -27.559 23.573 1.00 0.00 H new ATOM 0 HB3 PHE A 111 24.822 -28.982 24.595 1.00 0.00 H new ATOM 0 HD1 PHE A 111 25.856 -27.585 21.334 1.00 0.00 H new ATOM 0 HD2 PHE A 111 25.868 -31.073 23.840 1.00 0.00 H new ATOM 0 HE1 PHE A 111 27.581 -28.626 19.886 1.00 0.00 H new ATOM 0 HE2 PHE A 111 27.590 -32.111 22.395 1.00 0.00 H new ATOM 0 HZ PHE A 111 28.447 -30.887 20.417 1.00 0.00 H new ATOM 1003 N ASP A 112 22.688 -27.012 21.893 1.00 0.00 N ATOM 1004 CA ASP A 112 22.421 -26.151 20.749 1.00 0.00 C ATOM 1005 C ASP A 112 23.711 -25.462 20.327 1.00 0.00 C ATOM 1006 O ASP A 112 24.474 -24.998 21.174 1.00 0.00 O ATOM 1007 CB ASP A 112 21.383 -25.088 21.123 1.00 0.00 C ATOM 1008 CG ASP A 112 21.017 -24.252 19.902 1.00 0.00 C ATOM 1009 OD1 ASP A 112 21.906 -23.648 19.333 1.00 0.00 O ATOM 1010 OD2 ASP A 112 19.847 -24.233 19.553 1.00 0.00 O ATOM 0 H ASP A 112 22.586 -26.552 22.798 1.00 0.00 H new ATOM 0 HA ASP A 112 22.036 -26.757 19.929 1.00 0.00 H new ATOM 0 HB2 ASP A 112 20.490 -25.567 21.525 1.00 0.00 H new ATOM 0 HB3 ASP A 112 21.779 -24.444 21.908 1.00 0.00 H new ATOM 1015 N VAL A 113 23.955 -25.392 19.026 1.00 0.00 N ATOM 1016 CA VAL A 113 25.166 -24.753 18.536 1.00 0.00 C ATOM 1017 C VAL A 113 24.838 -23.373 17.979 1.00 0.00 C ATOM 1018 O VAL A 113 23.974 -23.230 17.113 1.00 0.00 O ATOM 1019 CB VAL A 113 25.811 -25.614 17.444 1.00 0.00 C ATOM 1020 CG1 VAL A 113 27.077 -24.930 16.916 1.00 0.00 C ATOM 1021 CG2 VAL A 113 26.180 -26.980 18.030 1.00 0.00 C ATOM 0 H VAL A 113 23.341 -25.764 18.301 1.00 0.00 H new ATOM 0 HA VAL A 113 25.867 -24.646 19.364 1.00 0.00 H new ATOM 0 HB VAL A 113 25.105 -25.741 16.624 1.00 0.00 H new ATOM 0 HG11 VAL A 113 27.529 -25.549 16.141 1.00 0.00 H new ATOM 0 HG12 VAL A 113 26.818 -23.957 16.499 1.00 0.00 H new ATOM 0 HG13 VAL A 113 27.786 -24.797 17.733 1.00 0.00 H new ATOM 0 HG21 VAL A 113 26.639 -27.596 17.257 1.00 0.00 H new ATOM 0 HG22 VAL A 113 26.883 -26.845 18.852 1.00 0.00 H new ATOM 0 HG23 VAL A 113 25.280 -27.472 18.399 1.00 0.00 H new ATOM 1031 N VAL A 114 25.540 -22.363 18.476 1.00 0.00 N ATOM 1032 CA VAL A 114 25.326 -20.998 18.017 1.00 0.00 C ATOM 1033 C VAL A 114 26.641 -20.421 17.516 1.00 0.00 C ATOM 1034 O VAL A 114 27.714 -20.851 17.933 1.00 0.00 O ATOM 1035 CB VAL A 114 24.763 -20.135 19.153 1.00 0.00 C ATOM 1036 CG1 VAL A 114 23.397 -20.670 19.592 1.00 0.00 C ATOM 1037 CG2 VAL A 114 25.723 -20.159 20.346 1.00 0.00 C ATOM 0 H VAL A 114 26.259 -22.463 19.193 1.00 0.00 H new ATOM 0 HA VAL A 114 24.603 -21.003 17.202 1.00 0.00 H new ATOM 0 HB VAL A 114 24.651 -19.112 18.795 1.00 0.00 H new ATOM 0 HG11 VAL A 114 23.006 -20.050 20.399 1.00 0.00 H new ATOM 0 HG12 VAL A 114 22.708 -20.644 18.748 1.00 0.00 H new ATOM 0 HG13 VAL A 114 23.504 -21.697 19.942 1.00 0.00 H new ATOM 0 HG21 VAL A 114 25.319 -19.545 21.151 1.00 0.00 H new ATOM 0 HG22 VAL A 114 25.842 -21.184 20.697 1.00 0.00 H new ATOM 0 HG23 VAL A 114 26.693 -19.765 20.041 1.00 0.00 H new ATOM 1123 N GLU A 121 29.812 -21.806 19.518 1.00 0.00 N ATOM 1124 CA GLU A 121 29.741 -22.001 20.964 1.00 0.00 C ATOM 1125 C GLU A 121 28.508 -22.816 21.336 1.00 0.00 C ATOM 1126 O GLU A 121 27.419 -22.584 20.818 1.00 0.00 O ATOM 1127 CB GLU A 121 29.693 -20.649 21.675 1.00 0.00 C ATOM 1128 CG GLU A 121 29.637 -20.871 23.188 1.00 0.00 C ATOM 1129 CD GLU A 121 29.653 -19.529 23.913 1.00 0.00 C ATOM 1130 OE1 GLU A 121 29.697 -18.514 23.237 1.00 0.00 O ATOM 1131 OE2 GLU A 121 29.616 -19.536 25.132 1.00 0.00 O ATOM 0 HA GLU A 121 30.632 -22.545 21.280 1.00 0.00 H new ATOM 0 HB2 GLU A 121 30.571 -20.058 21.416 1.00 0.00 H new ATOM 0 HB3 GLU A 121 28.820 -20.084 21.347 1.00 0.00 H new ATOM 0 HG2 GLU A 121 28.735 -21.424 23.450 1.00 0.00 H new ATOM 0 HG3 GLU A 121 30.486 -21.476 23.507 1.00 0.00 H new ATOM 1138 N ALA A 122 28.688 -23.773 22.232 1.00 0.00 N ATOM 1139 CA ALA A 122 27.583 -24.619 22.666 1.00 0.00 C ATOM 1140 C ALA A 122 26.695 -23.885 23.669 1.00 0.00 C ATOM 1141 O ALA A 122 27.150 -22.994 24.384 1.00 0.00 O ATOM 1142 CB ALA A 122 28.123 -25.901 23.300 1.00 0.00 C ATOM 0 H ALA A 122 29.583 -23.984 22.672 1.00 0.00 H new ATOM 0 HA ALA A 122 26.984 -24.870 21.791 1.00 0.00 H new ATOM 0 HB1 ALA A 122 27.290 -26.527 23.621 1.00 0.00 H new ATOM 0 HB2 ALA A 122 28.724 -26.443 22.570 1.00 0.00 H new ATOM 0 HB3 ALA A 122 28.741 -25.648 24.162 1.00 0.00 H new ATOM 1148 N ALA A 123 25.421 -24.273 23.714 1.00 0.00 N ATOM 1149 CA ALA A 123 24.474 -23.655 24.636 1.00 0.00 C ATOM 1150 C ALA A 123 23.371 -24.645 24.998 1.00 0.00 C ATOM 1151 O ALA A 123 23.122 -25.603 24.268 1.00 0.00 O ATOM 1152 CB ALA A 123 23.855 -22.412 23.994 1.00 0.00 C ATOM 0 H ALA A 123 25.025 -25.007 23.127 1.00 0.00 H new ATOM 0 HA ALA A 123 25.006 -23.366 25.542 1.00 0.00 H new ATOM 0 HB1 ALA A 123 23.149 -21.957 24.689 1.00 0.00 H new ATOM 0 HB2 ALA A 123 24.641 -21.696 23.755 1.00 0.00 H new ATOM 0 HB3 ALA A 123 23.333 -22.696 23.081 1.00 0.00 H new ATOM 1158 N ASN A 124 22.710 -24.412 26.129 1.00 0.00 N ATOM 1159 CA ASN A 124 21.642 -25.305 26.566 1.00 0.00 C ATOM 1160 C ASN A 124 22.144 -26.745 26.601 1.00 0.00 C ATOM 1161 O ASN A 124 21.490 -27.654 26.090 1.00 0.00 O ATOM 1162 CB ASN A 124 20.450 -25.197 25.613 1.00 0.00 C ATOM 1163 CG ASN A 124 19.944 -23.759 25.568 1.00 0.00 C ATOM 1164 OD1 ASN A 124 19.757 -23.131 26.609 1.00 0.00 O ATOM 1165 ND2 ASN A 124 19.714 -23.195 24.413 1.00 0.00 N ATOM 0 H ASN A 124 22.892 -23.624 26.751 1.00 0.00 H new ATOM 0 HA ASN A 124 21.328 -25.014 27.568 1.00 0.00 H new ATOM 0 HB2 ASN A 124 20.743 -25.519 24.614 1.00 0.00 H new ATOM 0 HB3 ASN A 124 19.651 -25.862 25.941 1.00 0.00 H new ATOM 0 HD21 ASN A 124 19.379 -22.232 24.373 1.00 0.00 H new ATOM 0 HD22 ASN A 124 19.870 -23.717 23.551 1.00 0.00 H new ATOM 1172 N VAL A 125 23.315 -26.939 27.196 1.00 0.00 N ATOM 1173 CA VAL A 125 23.910 -28.268 27.275 1.00 0.00 C ATOM 1174 C VAL A 125 23.193 -29.129 28.309 1.00 0.00 C ATOM 1175 O VAL A 125 23.088 -28.758 29.478 1.00 0.00 O ATOM 1176 CB VAL A 125 25.389 -28.150 27.647 1.00 0.00 C ATOM 1177 CG1 VAL A 125 25.983 -29.551 27.820 1.00 0.00 C ATOM 1178 CG2 VAL A 125 26.143 -27.405 26.542 1.00 0.00 C ATOM 0 H VAL A 125 23.868 -26.199 27.628 1.00 0.00 H new ATOM 0 HA VAL A 125 23.810 -28.745 26.300 1.00 0.00 H new ATOM 0 HB VAL A 125 25.484 -27.596 28.581 1.00 0.00 H new ATOM 0 HG11 VAL A 125 27.037 -29.469 28.085 1.00 0.00 H new ATOM 0 HG12 VAL A 125 25.450 -30.077 28.612 1.00 0.00 H new ATOM 0 HG13 VAL A 125 25.886 -30.105 26.886 1.00 0.00 H new ATOM 0 HG21 VAL A 125 27.196 -27.323 26.811 1.00 0.00 H new ATOM 0 HG22 VAL A 125 26.050 -27.953 25.605 1.00 0.00 H new ATOM 0 HG23 VAL A 125 25.721 -26.407 26.422 1.00 0.00 H new ATOM 1188 N THR A 126 22.711 -30.285 27.866 1.00 0.00 N ATOM 1189 CA THR A 126 22.015 -31.209 28.750 1.00 0.00 C ATOM 1190 C THR A 126 22.426 -32.637 28.430 1.00 0.00 C ATOM 1191 O THR A 126 23.074 -32.886 27.418 1.00 0.00 O ATOM 1192 CB THR A 126 20.500 -31.071 28.583 1.00 0.00 C ATOM 1193 OG1 THR A 126 20.132 -31.492 27.277 1.00 0.00 O ATOM 1194 CG2 THR A 126 20.086 -29.614 28.784 1.00 0.00 C ATOM 0 H THR A 126 22.790 -30.603 26.900 1.00 0.00 H new ATOM 0 HA THR A 126 22.283 -30.971 29.779 1.00 0.00 H new ATOM 0 HB THR A 126 19.997 -31.691 29.325 1.00 0.00 H new ATOM 0 HG1 THR A 126 19.666 -32.352 27.330 1.00 0.00 H new ATOM 0 HG21 THR A 126 19.007 -29.523 28.664 1.00 0.00 H new ATOM 0 HG22 THR A 126 20.368 -29.290 29.786 1.00 0.00 H new ATOM 0 HG23 THR A 126 20.588 -28.988 28.046 1.00 0.00 H new ATOM 1202 N GLY A 127 22.036 -33.575 29.277 1.00 0.00 N ATOM 1203 CA GLY A 127 22.357 -34.976 29.027 1.00 0.00 C ATOM 1204 C GLY A 127 21.467 -35.502 27.907 1.00 0.00 C ATOM 1205 O GLY A 127 20.472 -34.870 27.556 1.00 0.00 O ATOM 0 H GLY A 127 21.506 -33.400 30.130 1.00 0.00 H new ATOM 0 HA2 GLY A 127 23.407 -35.077 28.752 1.00 0.00 H new ATOM 0 HA3 GLY A 127 22.207 -35.563 29.933 1.00 0.00 H new ATOM 1209 N PRO A 128 21.800 -36.622 27.335 1.00 0.00 N ATOM 1210 CA PRO A 128 21.003 -37.206 26.221 1.00 0.00 C ATOM 1211 C PRO A 128 19.561 -37.491 26.632 1.00 0.00 C ATOM 1212 O PRO A 128 19.306 -38.004 27.721 1.00 0.00 O ATOM 1213 CB PRO A 128 21.753 -38.497 25.882 1.00 0.00 C ATOM 1214 CG PRO A 128 23.128 -38.307 26.427 1.00 0.00 C ATOM 1215 CD PRO A 128 22.959 -37.457 27.683 1.00 0.00 C ATOM 0 HA PRO A 128 20.917 -36.527 25.373 1.00 0.00 H new ATOM 0 HB2 PRO A 128 21.268 -39.363 26.331 1.00 0.00 H new ATOM 0 HB3 PRO A 128 21.776 -38.667 24.806 1.00 0.00 H new ATOM 0 HG2 PRO A 128 23.592 -39.265 26.662 1.00 0.00 H new ATOM 0 HG3 PRO A 128 23.772 -37.810 25.701 1.00 0.00 H new ATOM 0 HD2 PRO A 128 22.771 -38.067 28.566 1.00 0.00 H new ATOM 0 HD3 PRO A 128 23.845 -36.858 27.892 1.00 0.00 H new ATOM 1223 N GLY A 129 18.623 -37.159 25.749 1.00 0.00 N ATOM 1224 CA GLY A 129 17.211 -37.397 26.023 1.00 0.00 C ATOM 1225 C GLY A 129 16.689 -36.463 27.111 1.00 0.00 C ATOM 1226 O GLY A 129 15.674 -36.748 27.747 1.00 0.00 O ATOM 0 H GLY A 129 18.814 -36.728 24.845 1.00 0.00 H new ATOM 0 HA2 GLY A 129 16.633 -37.254 25.110 1.00 0.00 H new ATOM 0 HA3 GLY A 129 17.068 -38.433 26.331 1.00 0.00 H new ATOM 1230 N GLY A 130 17.386 -35.351 27.330 1.00 0.00 N ATOM 1231 CA GLY A 130 16.974 -34.397 28.356 1.00 0.00 C ATOM 1232 C GLY A 130 17.436 -34.841 29.746 1.00 0.00 C ATOM 1233 O GLY A 130 17.141 -34.185 30.744 1.00 0.00 O ATOM 0 H GLY A 130 18.229 -35.090 26.818 1.00 0.00 H new ATOM 0 HA2 GLY A 130 17.388 -33.415 28.129 1.00 0.00 H new ATOM 0 HA3 GLY A 130 15.889 -34.295 28.346 1.00 0.00 H new ATOM 1237 N VAL A 131 18.161 -35.958 29.805 1.00 0.00 N ATOM 1238 CA VAL A 131 18.665 -36.478 31.070 1.00 0.00 C ATOM 1239 C VAL A 131 19.606 -35.462 31.734 1.00 0.00 C ATOM 1240 O VAL A 131 20.386 -34.815 31.043 1.00 0.00 O ATOM 1241 CB VAL A 131 19.421 -37.783 30.814 1.00 0.00 C ATOM 1242 CG1 VAL A 131 20.039 -38.291 32.118 1.00 0.00 C ATOM 1243 CG2 VAL A 131 18.448 -38.833 30.270 1.00 0.00 C ATOM 0 H VAL A 131 18.411 -36.518 28.990 1.00 0.00 H new ATOM 0 HA VAL A 131 17.823 -36.661 31.737 1.00 0.00 H new ATOM 0 HB VAL A 131 20.214 -37.603 30.088 1.00 0.00 H new ATOM 0 HG11 VAL A 131 20.576 -39.221 31.928 1.00 0.00 H new ATOM 0 HG12 VAL A 131 20.732 -37.545 32.507 1.00 0.00 H new ATOM 0 HG13 VAL A 131 19.250 -38.470 32.849 1.00 0.00 H new ATOM 0 HG21 VAL A 131 18.983 -39.765 30.086 1.00 0.00 H new ATOM 0 HG22 VAL A 131 17.656 -39.007 30.998 1.00 0.00 H new ATOM 0 HG23 VAL A 131 18.011 -38.476 29.338 1.00 0.00 H new ATOM 1253 N PRO A 132 19.573 -35.301 33.040 1.00 0.00 N ATOM 1254 CA PRO A 132 20.482 -34.332 33.734 1.00 0.00 C ATOM 1255 C PRO A 132 21.950 -34.625 33.421 1.00 0.00 C ATOM 1256 O PRO A 132 22.327 -35.779 33.216 1.00 0.00 O ATOM 1257 CB PRO A 132 20.191 -34.559 35.222 1.00 0.00 C ATOM 1258 CG PRO A 132 18.822 -35.145 35.266 1.00 0.00 C ATOM 1259 CD PRO A 132 18.693 -35.991 34.003 1.00 0.00 C ATOM 0 HA PRO A 132 20.311 -33.303 33.418 1.00 0.00 H new ATOM 0 HB2 PRO A 132 20.922 -35.233 35.668 1.00 0.00 H new ATOM 0 HB3 PRO A 132 20.237 -33.624 35.780 1.00 0.00 H new ATOM 0 HG2 PRO A 132 18.685 -35.753 36.160 1.00 0.00 H new ATOM 0 HG3 PRO A 132 18.063 -34.364 35.293 1.00 0.00 H new ATOM 0 HD2 PRO A 132 19.012 -37.019 34.174 1.00 0.00 H new ATOM 0 HD3 PRO A 132 17.663 -36.031 33.649 1.00 0.00 H new ATOM 1267 N VAL A 133 22.774 -33.581 33.383 1.00 0.00 N ATOM 1268 CA VAL A 133 24.193 -33.760 33.081 1.00 0.00 C ATOM 1269 C VAL A 133 24.903 -34.469 34.232 1.00 0.00 C ATOM 1270 O VAL A 133 24.819 -34.042 35.383 1.00 0.00 O ATOM 1271 CB VAL A 133 24.862 -32.409 32.818 1.00 0.00 C ATOM 1272 CG1 VAL A 133 26.375 -32.584 32.816 1.00 0.00 C ATOM 1273 CG2 VAL A 133 24.402 -31.869 31.463 1.00 0.00 C ATOM 0 H VAL A 133 22.491 -32.616 33.554 1.00 0.00 H new ATOM 0 HA VAL A 133 24.271 -34.375 32.184 1.00 0.00 H new ATOM 0 HB VAL A 133 24.583 -31.704 33.601 1.00 0.00 H new ATOM 0 HG11 VAL A 133 26.852 -31.622 32.629 1.00 0.00 H new ATOM 0 HG12 VAL A 133 26.698 -32.967 33.784 1.00 0.00 H new ATOM 0 HG13 VAL A 133 26.659 -33.288 32.034 1.00 0.00 H new ATOM 0 HG21 VAL A 133 24.878 -30.907 31.274 1.00 0.00 H new ATOM 0 HG22 VAL A 133 24.681 -32.572 30.678 1.00 0.00 H new ATOM 0 HG23 VAL A 133 23.319 -31.743 31.470 1.00 0.00 H new ATOM 1283 N GLN A 134 25.591 -35.563 33.911 1.00 0.00 N ATOM 1284 CA GLN A 134 26.286 -36.344 34.930 1.00 0.00 C ATOM 1285 C GLN A 134 27.344 -35.496 35.624 1.00 0.00 C ATOM 1286 O GLN A 134 27.516 -35.571 36.841 1.00 0.00 O ATOM 1287 CB GLN A 134 26.958 -37.557 34.285 1.00 0.00 C ATOM 1288 CG GLN A 134 27.521 -38.475 35.369 1.00 0.00 C ATOM 1289 CD GLN A 134 29.005 -38.192 35.584 1.00 0.00 C ATOM 1290 OE1 GLN A 134 29.738 -37.956 34.625 1.00 0.00 O ATOM 1291 NE2 GLN A 134 29.492 -38.201 36.796 1.00 0.00 N ATOM 0 H GLN A 134 25.681 -35.926 32.962 1.00 0.00 H new ATOM 0 HA GLN A 134 25.555 -36.676 35.668 1.00 0.00 H new ATOM 0 HB2 GLN A 134 26.238 -38.101 33.673 1.00 0.00 H new ATOM 0 HB3 GLN A 134 27.758 -37.230 33.621 1.00 0.00 H new ATOM 0 HG2 GLN A 134 26.976 -38.325 36.301 1.00 0.00 H new ATOM 0 HG3 GLN A 134 27.380 -39.517 35.082 1.00 0.00 H new ATOM 0 HE21 GLN A 134 28.882 -38.397 37.589 1.00 0.00 H new ATOM 0 HE22 GLN A 134 30.483 -38.012 36.949 1.00 0.00 H new ATOM 1300 N GLY A 135 28.044 -34.686 34.841 1.00 0.00 N ATOM 1301 CA GLY A 135 29.069 -33.802 35.388 1.00 0.00 C ATOM 1302 C GLY A 135 30.377 -34.544 35.637 1.00 0.00 C ATOM 1303 O GLY A 135 30.517 -35.717 35.287 1.00 0.00 O ATOM 0 H GLY A 135 27.923 -34.621 33.830 1.00 0.00 H new ATOM 0 HA2 GLY A 135 29.244 -32.977 34.698 1.00 0.00 H new ATOM 0 HA3 GLY A 135 28.714 -33.367 36.322 1.00 0.00 H new ATOM 1307 N SER A 136 31.333 -33.846 36.243 1.00 0.00 N ATOM 1308 CA SER A 136 32.634 -34.429 36.543 1.00 0.00 C ATOM 1309 C SER A 136 32.813 -34.589 38.048 1.00 0.00 C ATOM 1310 O SER A 136 32.095 -33.975 38.838 1.00 0.00 O ATOM 1311 CB SER A 136 33.747 -33.540 35.987 1.00 0.00 C ATOM 1312 OG SER A 136 33.630 -33.471 34.573 1.00 0.00 O ATOM 0 H SER A 136 31.230 -32.874 36.536 1.00 0.00 H new ATOM 0 HA SER A 136 32.687 -35.412 36.074 1.00 0.00 H new ATOM 0 HB2 SER A 136 33.680 -32.541 36.418 1.00 0.00 H new ATOM 0 HB3 SER A 136 34.722 -33.942 36.264 1.00 0.00 H new ATOM 0 HG SER A 136 32.784 -33.037 34.336 1.00 0.00 H new ATOM 1318 N LYS A 137 33.778 -35.415 38.434 1.00 0.00 N ATOM 1319 CA LYS A 137 34.054 -35.657 39.845 1.00 0.00 C ATOM 1320 C LYS A 137 34.452 -34.363 40.540 1.00 0.00 C ATOM 1321 O LYS A 137 34.086 -34.125 41.689 1.00 0.00 O ATOM 1322 CB LYS A 137 35.184 -36.676 39.984 1.00 0.00 C ATOM 1323 CG LYS A 137 34.686 -38.046 39.531 1.00 0.00 C ATOM 1324 CD LYS A 137 33.790 -38.651 40.614 1.00 0.00 C ATOM 1325 CE LYS A 137 34.649 -39.111 41.791 1.00 0.00 C ATOM 1326 NZ LYS A 137 33.795 -39.828 42.780 1.00 0.00 N ATOM 0 H LYS A 137 34.382 -35.928 37.791 1.00 0.00 H new ATOM 0 HA LYS A 137 33.150 -36.046 40.313 1.00 0.00 H new ATOM 0 HB2 LYS A 137 36.041 -36.371 39.383 1.00 0.00 H new ATOM 0 HB3 LYS A 137 35.522 -36.723 41.019 1.00 0.00 H new ATOM 0 HG2 LYS A 137 34.132 -37.952 38.597 1.00 0.00 H new ATOM 0 HG3 LYS A 137 35.532 -38.705 39.335 1.00 0.00 H new ATOM 0 HD2 LYS A 137 33.060 -37.915 40.949 1.00 0.00 H new ATOM 0 HD3 LYS A 137 33.230 -39.493 40.208 1.00 0.00 H new ATOM 0 HE2 LYS A 137 35.445 -39.767 41.439 1.00 0.00 H new ATOM 0 HE3 LYS A 137 35.128 -38.253 42.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 34.380 -40.141 43.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 33.050 -39.188 43.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 33.358 -40.655 42.326 1.00 0.00 H new ATOM 1340 N TYR A 138 35.208 -33.536 39.833 1.00 0.00 N ATOM 1341 CA TYR A 138 35.650 -32.260 40.386 1.00 0.00 C ATOM 1342 C TYR A 138 34.487 -31.280 40.501 1.00 0.00 C ATOM 1343 O TYR A 138 34.645 -30.184 41.040 1.00 0.00 O ATOM 1344 CB TYR A 138 36.738 -31.649 39.503 1.00 0.00 C ATOM 1345 CG TYR A 138 37.950 -32.549 39.488 1.00 0.00 C ATOM 1346 CD1 TYR A 138 38.037 -33.590 38.557 1.00 0.00 C ATOM 1347 CD2 TYR A 138 38.986 -32.336 40.402 1.00 0.00 C ATOM 1348 CE1 TYR A 138 39.166 -34.418 38.540 1.00 0.00 C ATOM 1349 CE2 TYR A 138 40.113 -33.163 40.387 1.00 0.00 C ATOM 1350 CZ TYR A 138 40.204 -34.206 39.455 1.00 0.00 C ATOM 1351 OH TYR A 138 41.317 -35.021 39.438 1.00 0.00 O ATOM 0 H TYR A 138 35.527 -33.721 38.882 1.00 0.00 H new ATOM 0 HA TYR A 138 36.050 -32.450 41.382 1.00 0.00 H new ATOM 0 HB2 TYR A 138 36.362 -31.513 38.489 1.00 0.00 H new ATOM 0 HB3 TYR A 138 37.011 -30.662 39.877 1.00 0.00 H new ATOM 0 HD1 TYR A 138 37.235 -33.755 37.853 1.00 0.00 H new ATOM 0 HD2 TYR A 138 38.916 -31.532 41.120 1.00 0.00 H new ATOM 0 HE1 TYR A 138 39.236 -35.221 37.821 1.00 0.00 H new ATOM 0 HE2 TYR A 138 40.913 -32.998 41.093 1.00 0.00 H new ATOM 0 HH TYR A 138 41.942 -34.736 40.137 1.00 0.00 H new ATOM 1361 N ALA A 139 33.320 -31.667 39.991 1.00 0.00 N ATOM 1362 CA ALA A 139 32.163 -30.785 40.039 1.00 0.00 C ATOM 1363 C ALA A 139 31.824 -30.427 41.480 1.00 0.00 C ATOM 1364 O ALA A 139 31.451 -29.291 41.778 1.00 0.00 O ATOM 1365 CB ALA A 139 30.959 -31.460 39.386 1.00 0.00 C ATOM 0 H ALA A 139 33.154 -32.570 39.547 1.00 0.00 H new ATOM 0 HA ALA A 139 32.406 -29.873 39.494 1.00 0.00 H new ATOM 0 HB1 ALA A 139 30.100 -30.791 39.428 1.00 0.00 H new ATOM 0 HB2 ALA A 139 31.190 -31.689 38.346 1.00 0.00 H new ATOM 0 HB3 ALA A 139 30.727 -32.383 39.918 1.00 0.00 H new