USER MOD reduce.3.24.130724 H: found=0, std=0, add=863, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 859 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 101 GLN : amide:sc= 0.951 K(o=2.1,f=0.68) USER MOD Set 1.2: A 103 ASN : amide:sc= 1.13 K(o=2.1,f=0.68) USER MOD Set 2.1: A 92 TYR OH : rot 7:sc= 1.01 USER MOD Set 2.2: A 105 HIS : no HE2:sc= 0.0155 K(o=3.5,f=-0.071!) USER MOD Set 2.3: A 107 HIS : no HE2:sc= 0.914 K(o=3.5,f=-2.7!) USER MOD Set 2.4: A 111 SER OG : rot 37:sc= 1.55 USER MOD Set 3.1: A 27 THR OG1 : rot -88:sc= 1.81 USER MOD Set 3.2: A 29 HIS : no HE2:sc= 0.985 K(o=3.7,f=-0.39!) USER MOD Set 3.3: A 31 THR OG1 : rot -175:sc= 0.922 USER MOD Set 4.1: A 19 LYS NZ :NH3+ -165:sc= 2.27 (180deg=0.617) USER MOD Set 4.2: A 37 GLN : amide:sc= 1.01 K(o=3.3,f=-8.1!) USER MOD Set 5.1: A 2 SER OG : rot 162:sc= 2.25 USER MOD Set 5.2: A 7 LYS NZ :NH3+ 158:sc= 3.42 (180deg=2.23) USER MOD Single : A 1 ILE N :NH3+ -166:sc= 2.14 (180deg=1.73) USER MOD Single : A 5 GLN : amide:sc= 0.293 K(o=0.29,f=-4.3!) USER MOD Single : A 9 THR OG1 : rot 59:sc= 0.426 USER MOD Single : A 10 THR OG1 : rot 136:sc= 0.843 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -168:sc= 1.37 (180deg=0.674) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.0214 USER MOD Single : A 38 TYR OH : rot 30:sc= 1.13 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.014 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ -163:sc= 3.23 (180deg=1.48) USER MOD Single : A 50 SER OG : rot -134:sc= 0.823 USER MOD Single : A 51 SER OG : rot -172:sc= 1.18 USER MOD Single : A 54 SER OG : rot -9:sc= 0.863 USER MOD Single : A 56 ASN : amide:sc= -1.68! C(o=-1.7!,f=-4.6!) USER MOD Single : A 59 THR OG1 : rot -16:sc= 1.14 USER MOD Single : A 66 THR OG1 : rot -150:sc= 0.96 USER MOD Single : A 68 ASN : amide:sc= -0.0479 K(o=-0.048,f=-3.6!) USER MOD Single : A 72 SER OG : rot -35:sc= 1.01 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= 1.14 K(o=1.1,f=-3.4!) USER MOD Single : A 79 LYS NZ :NH3+ 177:sc= 1.26 (180deg=1.03) USER MOD Single : A 91 SER OG : rot 4:sc= 1.19 USER MOD Single : A 100 GLN : amide:sc= 0.837 K(o=0.84,f=-1) USER MOD Single : A 104 HIS : no HE2:sc= 0.737 K(o=0.74,f=-2.8!) USER MOD Single : A 108 LYS NZ :NH3+ -169:sc= 2.12 (180deg=1.73) USER MOD Single : A 109 SER OG : rot -56:sc= 0.15 USER MOD Single : A 112 SER OG : rot -27:sc= 0.737 USER MOD Single : A 115 LYS NZ :NH3+ -158:sc= 0.939 (180deg=0.0504) USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 1 0.809 10.024 13.261 1.00 0.00 N ATOM 2 CA ILE A 1 -0.652 9.808 13.175 1.00 0.00 C ATOM 3 C ILE A 1 -0.894 8.365 12.740 1.00 0.00 C ATOM 4 O ILE A 1 -0.130 7.829 11.943 1.00 0.00 O ATOM 5 CB ILE A 1 -1.361 10.834 12.257 1.00 0.00 C ATOM 6 CG1 ILE A 1 -1.014 12.275 12.709 1.00 0.00 C ATOM 7 CG2 ILE A 1 -2.886 10.604 12.298 1.00 0.00 C ATOM 8 CD1 ILE A 1 -1.668 13.389 11.881 1.00 0.00 C ATOM 0 H1 ILE A 1 1.000 10.907 13.776 1.00 0.00 H new ATOM 0 H2 ILE A 1 1.249 9.228 13.765 1.00 0.00 H new ATOM 0 H3 ILE A 1 1.207 10.089 12.303 1.00 0.00 H new ATOM 0 HA ILE A 1 -1.097 9.972 14.157 1.00 0.00 H new ATOM 0 HB ILE A 1 -1.016 10.701 11.232 1.00 0.00 H new ATOM 0 HG12 ILE A 1 -1.312 12.395 13.751 1.00 0.00 H new ATOM 0 HG13 ILE A 1 0.068 12.401 12.670 1.00 0.00 H new ATOM 0 HG21 ILE A 1 -3.381 11.328 11.651 1.00 0.00 H new ATOM 0 HG22 ILE A 1 -3.111 9.595 11.952 1.00 0.00 H new ATOM 0 HG23 ILE A 1 -3.245 10.726 13.320 1.00 0.00 H new ATOM 0 HD11 ILE A 1 -1.365 14.360 12.274 1.00 0.00 H new ATOM 0 HD12 ILE A 1 -1.352 13.303 10.841 1.00 0.00 H new ATOM 0 HD13 ILE A 1 -2.753 13.296 11.939 1.00 0.00 H new ATOM 22 N SER A 2 -1.905 7.716 13.321 1.00 0.00 N ATOM 23 CA SER A 2 -2.126 6.277 13.209 1.00 0.00 C ATOM 24 C SER A 2 -3.620 5.955 13.229 1.00 0.00 C ATOM 25 O SER A 2 -4.412 6.666 13.845 1.00 0.00 O ATOM 26 CB SER A 2 -1.417 5.627 14.395 1.00 0.00 C ATOM 27 OG SER A 2 -1.424 4.218 14.376 1.00 0.00 O ATOM 0 H SER A 2 -2.606 8.187 13.893 1.00 0.00 H new ATOM 0 HA SER A 2 -1.732 5.897 12.266 1.00 0.00 H new ATOM 0 HB2 SER A 2 -0.384 5.973 14.419 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.889 5.968 15.316 1.00 0.00 H new ATOM 0 HG SER A 2 -0.730 3.879 14.979 1.00 0.00 H new ATOM 33 N GLU A 3 -3.984 4.869 12.555 1.00 0.00 N ATOM 34 CA GLU A 3 -5.334 4.343 12.363 1.00 0.00 C ATOM 35 C GLU A 3 -5.369 2.821 12.602 1.00 0.00 C ATOM 36 O GLU A 3 -4.327 2.188 12.794 1.00 0.00 O ATOM 37 CB GLU A 3 -5.824 4.719 10.948 1.00 0.00 C ATOM 38 CG GLU A 3 -5.044 4.070 9.789 1.00 0.00 C ATOM 39 CD GLU A 3 -3.588 4.545 9.712 1.00 0.00 C ATOM 40 OE1 GLU A 3 -3.369 5.640 9.144 1.00 0.00 O ATOM 41 OE2 GLU A 3 -2.710 3.860 10.296 1.00 0.00 O ATOM 0 H GLU A 3 -3.287 4.286 12.091 1.00 0.00 H new ATOM 0 HA GLU A 3 -6.010 4.788 13.093 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -6.874 4.441 10.859 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -5.771 5.802 10.839 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -5.062 2.987 9.907 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -5.545 4.297 8.848 1.00 0.00 H new ATOM 48 N PHE A 4 -6.560 2.214 12.586 1.00 0.00 N ATOM 49 CA PHE A 4 -6.726 0.792 12.894 1.00 0.00 C ATOM 50 C PHE A 4 -6.660 -0.096 11.643 1.00 0.00 C ATOM 51 O PHE A 4 -5.803 -0.973 11.543 1.00 0.00 O ATOM 52 CB PHE A 4 -8.034 0.595 13.674 1.00 0.00 C ATOM 53 CG PHE A 4 -8.281 -0.840 14.101 1.00 0.00 C ATOM 54 CD1 PHE A 4 -7.408 -1.463 15.015 1.00 0.00 C ATOM 55 CD2 PHE A 4 -9.374 -1.560 13.581 1.00 0.00 C ATOM 56 CE1 PHE A 4 -7.622 -2.798 15.400 1.00 0.00 C ATOM 57 CE2 PHE A 4 -9.591 -2.895 13.970 1.00 0.00 C ATOM 58 CZ PHE A 4 -8.712 -3.514 14.877 1.00 0.00 C ATOM 0 H PHE A 4 -7.432 2.693 12.360 1.00 0.00 H new ATOM 0 HA PHE A 4 -5.889 0.474 13.516 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -8.017 1.230 14.560 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -8.868 0.930 13.057 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -6.572 -0.913 15.421 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -10.047 -1.086 12.882 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -6.949 -3.273 16.098 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -10.432 -3.444 13.572 1.00 0.00 H new ATOM 0 HZ PHE A 4 -8.875 -4.540 15.172 1.00 0.00 H new ATOM 68 N GLN A 5 -7.560 0.124 10.679 1.00 0.00 N ATOM 69 CA GLN A 5 -7.804 -0.769 9.544 1.00 0.00 C ATOM 70 C GLN A 5 -6.558 -1.023 8.681 1.00 0.00 C ATOM 71 O GLN A 5 -6.329 -2.151 8.247 1.00 0.00 O ATOM 72 CB GLN A 5 -9.011 -0.258 8.727 1.00 0.00 C ATOM 73 CG GLN A 5 -8.797 0.970 7.815 1.00 0.00 C ATOM 74 CD GLN A 5 -8.358 2.256 8.520 1.00 0.00 C ATOM 75 OE1 GLN A 5 -8.579 2.479 9.703 1.00 0.00 O ATOM 76 NE2 GLN A 5 -7.691 3.143 7.809 1.00 0.00 N ATOM 0 H GLN A 5 -8.155 0.952 10.668 1.00 0.00 H new ATOM 0 HA GLN A 5 -8.052 -1.752 9.944 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -9.366 -1.079 8.104 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -9.812 -0.020 9.427 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -8.048 0.716 7.065 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -9.727 1.170 7.282 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -7.501 2.967 6.822 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -7.364 4.005 8.245 1.00 0.00 H new ATOM 85 N LEU A 6 -5.709 -0.002 8.497 1.00 0.00 N ATOM 86 CA LEU A 6 -4.467 -0.083 7.722 1.00 0.00 C ATOM 87 C LEU A 6 -3.432 -1.050 8.328 1.00 0.00 C ATOM 88 O LEU A 6 -2.498 -1.452 7.636 1.00 0.00 O ATOM 89 CB LEU A 6 -3.909 1.347 7.574 1.00 0.00 C ATOM 90 CG LEU A 6 -2.692 1.524 6.640 1.00 0.00 C ATOM 91 CD1 LEU A 6 -2.925 0.963 5.234 1.00 0.00 C ATOM 92 CD2 LEU A 6 -2.388 3.020 6.519 1.00 0.00 C ATOM 0 H LEU A 6 -5.872 0.924 8.893 1.00 0.00 H new ATOM 0 HA LEU A 6 -4.688 -0.504 6.741 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -4.712 1.990 7.212 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -3.633 1.709 8.565 1.00 0.00 H new ATOM 0 HG LEU A 6 -1.863 0.969 7.079 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -2.033 1.119 4.628 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -3.138 -0.104 5.299 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -3.770 1.474 4.774 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -1.530 3.165 5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -3.254 3.535 6.104 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -2.163 3.426 7.505 1.00 0.00 H new ATOM 104 N LYS A 7 -3.598 -1.455 9.598 1.00 0.00 N ATOM 105 CA LYS A 7 -2.715 -2.417 10.267 1.00 0.00 C ATOM 106 C LYS A 7 -3.106 -3.886 10.008 1.00 0.00 C ATOM 107 O LYS A 7 -2.308 -4.766 10.325 1.00 0.00 O ATOM 108 CB LYS A 7 -2.650 -2.108 11.777 1.00 0.00 C ATOM 109 CG LYS A 7 -2.402 -0.632 12.160 1.00 0.00 C ATOM 110 CD LYS A 7 -1.190 0.027 11.472 1.00 0.00 C ATOM 111 CE LYS A 7 -0.699 1.279 12.220 1.00 0.00 C ATOM 112 NZ LYS A 7 -1.690 2.381 12.258 1.00 0.00 N ATOM 0 H LYS A 7 -4.356 -1.119 10.192 1.00 0.00 H new ATOM 0 HA LYS A 7 -1.722 -2.299 9.834 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -3.587 -2.428 12.233 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -1.858 -2.714 12.217 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -3.295 -0.055 11.919 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -2.265 -0.571 13.240 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -0.376 -0.695 11.406 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -1.459 0.299 10.451 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -0.439 1.002 13.241 1.00 0.00 H new ATOM 0 HE3 LYS A 7 0.213 1.640 11.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -1.473 3.015 13.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -1.649 2.916 11.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -2.644 1.986 12.380 1.00 0.00 H new ATOM 126 N GLY A 8 -4.288 -4.144 9.425 1.00 0.00 N ATOM 127 CA GLY A 8 -4.846 -5.416 8.929 1.00 0.00 C ATOM 128 C GLY A 8 -4.228 -6.732 9.430 1.00 0.00 C ATOM 129 O GLY A 8 -3.387 -7.333 8.756 1.00 0.00 O ATOM 0 H GLY A 8 -4.950 -3.383 9.272 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -5.907 -5.432 9.178 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -4.774 -5.408 7.841 1.00 0.00 H new ATOM 133 N THR A 9 -4.670 -7.232 10.590 1.00 0.00 N ATOM 134 CA THR A 9 -4.308 -8.557 11.127 1.00 0.00 C ATOM 135 C THR A 9 -4.988 -9.697 10.346 1.00 0.00 C ATOM 136 O THR A 9 -5.914 -10.336 10.847 1.00 0.00 O ATOM 137 CB THR A 9 -4.648 -8.654 12.626 1.00 0.00 C ATOM 138 OG1 THR A 9 -6.023 -8.412 12.809 1.00 0.00 O ATOM 139 CG2 THR A 9 -3.853 -7.663 13.479 1.00 0.00 C ATOM 0 H THR A 9 -5.305 -6.717 11.199 1.00 0.00 H new ATOM 0 HA THR A 9 -3.231 -8.670 11.006 1.00 0.00 H new ATOM 0 HB THR A 9 -4.379 -9.659 12.952 1.00 0.00 H new ATOM 0 HG1 THR A 9 -6.541 -9.067 12.297 1.00 0.00 H new ATOM 0 HG21 THR A 9 -4.134 -7.777 14.526 1.00 0.00 H new ATOM 0 HG22 THR A 9 -2.787 -7.859 13.366 1.00 0.00 H new ATOM 0 HG23 THR A 9 -4.071 -6.646 13.153 1.00 0.00 H new ATOM 147 N THR A 10 -4.541 -9.944 9.111 1.00 0.00 N ATOM 148 CA THR A 10 -5.087 -10.967 8.200 1.00 0.00 C ATOM 149 C THR A 10 -4.631 -12.400 8.504 1.00 0.00 C ATOM 150 O THR A 10 -5.278 -13.341 8.048 1.00 0.00 O ATOM 151 CB THR A 10 -4.673 -10.662 6.751 1.00 0.00 C ATOM 152 OG1 THR A 10 -3.277 -10.468 6.691 1.00 0.00 O ATOM 153 CG2 THR A 10 -5.348 -9.408 6.197 1.00 0.00 C ATOM 0 H THR A 10 -3.765 -9.424 8.701 1.00 0.00 H new ATOM 0 HA THR A 10 -6.166 -10.919 8.346 1.00 0.00 H new ATOM 0 HB THR A 10 -4.986 -11.515 6.148 1.00 0.00 H new ATOM 0 HG1 THR A 10 -2.913 -10.950 5.920 1.00 0.00 H new ATOM 0 HG21 THR A 10 -5.019 -9.241 5.171 1.00 0.00 H new ATOM 0 HG22 THR A 10 -6.430 -9.539 6.214 1.00 0.00 H new ATOM 0 HG23 THR A 10 -5.077 -8.548 6.810 1.00 0.00 H new ATOM 161 N TYR A 11 -3.526 -12.584 9.235 1.00 0.00 N ATOM 162 CA TYR A 11 -2.943 -13.896 9.527 1.00 0.00 C ATOM 163 C TYR A 11 -2.085 -13.863 10.805 1.00 0.00 C ATOM 164 O TYR A 11 -1.956 -12.819 11.447 1.00 0.00 O ATOM 165 CB TYR A 11 -2.128 -14.367 8.303 1.00 0.00 C ATOM 166 CG TYR A 11 -2.048 -15.875 8.168 1.00 0.00 C ATOM 167 CD1 TYR A 11 -3.182 -16.587 7.733 1.00 0.00 C ATOM 168 CD2 TYR A 11 -0.858 -16.565 8.476 1.00 0.00 C ATOM 169 CE1 TYR A 11 -3.134 -17.987 7.602 1.00 0.00 C ATOM 170 CE2 TYR A 11 -0.803 -17.965 8.341 1.00 0.00 C ATOM 171 CZ TYR A 11 -1.939 -18.679 7.903 1.00 0.00 C ATOM 172 OH TYR A 11 -1.879 -20.033 7.779 1.00 0.00 O ATOM 0 H TYR A 11 -3.003 -11.811 9.647 1.00 0.00 H new ATOM 0 HA TYR A 11 -3.745 -14.610 9.716 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -2.575 -13.953 7.399 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -1.118 -13.963 8.373 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -4.093 -16.056 7.499 1.00 0.00 H new ATOM 0 HD2 TYR A 11 0.011 -16.020 8.815 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -4.007 -18.531 7.273 1.00 0.00 H new ATOM 0 HE2 TYR A 11 0.110 -18.494 8.573 1.00 0.00 H new ATOM 0 HH TYR A 11 -0.983 -20.345 8.025 1.00 0.00 H new ATOM 182 N GLY A 12 -1.479 -15.003 11.160 1.00 0.00 N ATOM 183 CA GLY A 12 -0.515 -15.123 12.255 1.00 0.00 C ATOM 184 C GLY A 12 0.690 -14.188 12.087 1.00 0.00 C ATOM 185 O GLY A 12 1.304 -14.141 11.016 1.00 0.00 O ATOM 0 H GLY A 12 -1.651 -15.887 10.681 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -1.013 -14.901 13.199 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.165 -16.154 12.314 1.00 0.00 H new ATOM 189 N VAL A 13 1.019 -13.448 13.158 1.00 0.00 N ATOM 190 CA VAL A 13 2.099 -12.453 13.186 1.00 0.00 C ATOM 191 C VAL A 13 3.485 -13.108 13.091 1.00 0.00 C ATOM 192 O VAL A 13 3.991 -13.714 14.041 1.00 0.00 O ATOM 193 CB VAL A 13 1.933 -11.449 14.344 1.00 0.00 C ATOM 194 CG1 VAL A 13 2.062 -12.034 15.757 1.00 0.00 C ATOM 195 CG2 VAL A 13 2.914 -10.284 14.177 1.00 0.00 C ATOM 0 H VAL A 13 0.529 -13.528 14.049 1.00 0.00 H new ATOM 0 HA VAL A 13 2.019 -11.845 12.285 1.00 0.00 H new ATOM 0 HB VAL A 13 0.899 -11.111 14.269 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.928 -11.241 16.493 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.300 -12.799 15.905 1.00 0.00 H new ATOM 0 HG13 VAL A 13 3.050 -12.478 15.878 1.00 0.00 H new ATOM 0 HG21 VAL A 13 2.788 -9.581 15.001 1.00 0.00 H new ATOM 0 HG22 VAL A 13 3.935 -10.665 14.179 1.00 0.00 H new ATOM 0 HG23 VAL A 13 2.718 -9.776 13.233 1.00 0.00 H new ATOM 205 N CYS A 14 4.064 -13.034 11.889 1.00 0.00 N ATOM 206 CA CYS A 14 5.256 -13.755 11.456 1.00 0.00 C ATOM 207 C CYS A 14 5.857 -13.079 10.210 1.00 0.00 C ATOM 208 O CYS A 14 5.165 -12.400 9.453 1.00 0.00 O ATOM 209 CB CYS A 14 4.859 -15.230 11.215 1.00 0.00 C ATOM 210 SG CYS A 14 5.713 -16.143 9.894 1.00 0.00 S ATOM 0 H CYS A 14 3.689 -12.435 11.154 1.00 0.00 H new ATOM 0 HA CYS A 14 6.035 -13.732 12.218 1.00 0.00 H new ATOM 0 HB2 CYS A 14 5.012 -15.773 12.148 1.00 0.00 H new ATOM 0 HB3 CYS A 14 3.790 -15.257 11.002 1.00 0.00 H new ATOM 215 N SER A 15 7.156 -13.281 9.990 1.00 0.00 N ATOM 216 CA SER A 15 7.878 -12.830 8.793 1.00 0.00 C ATOM 217 C SER A 15 9.183 -13.605 8.609 1.00 0.00 C ATOM 218 O SER A 15 9.503 -14.012 7.495 1.00 0.00 O ATOM 219 CB SER A 15 8.183 -11.333 8.883 1.00 0.00 C ATOM 220 OG SER A 15 8.949 -11.033 10.039 1.00 0.00 O ATOM 0 H SER A 15 7.753 -13.775 10.654 1.00 0.00 H new ATOM 0 HA SER A 15 7.237 -13.018 7.932 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.725 -11.016 7.992 1.00 0.00 H new ATOM 0 HB3 SER A 15 7.250 -10.770 8.906 1.00 0.00 H new ATOM 0 HG SER A 15 9.131 -10.071 10.070 1.00 0.00 H new ATOM 226 N LYS A 16 9.902 -13.842 9.719 1.00 0.00 N ATOM 227 CA LYS A 16 11.127 -14.640 9.859 1.00 0.00 C ATOM 228 C LYS A 16 12.326 -14.046 9.115 1.00 0.00 C ATOM 229 O LYS A 16 13.316 -13.674 9.737 1.00 0.00 O ATOM 230 CB LYS A 16 10.855 -16.105 9.456 1.00 0.00 C ATOM 231 CG LYS A 16 12.007 -17.055 9.828 1.00 0.00 C ATOM 232 CD LYS A 16 12.136 -18.238 8.857 1.00 0.00 C ATOM 233 CE LYS A 16 10.850 -19.063 8.744 1.00 0.00 C ATOM 234 NZ LYS A 16 11.021 -20.189 7.800 1.00 0.00 N ATOM 0 H LYS A 16 9.616 -13.446 10.615 1.00 0.00 H new ATOM 0 HA LYS A 16 11.411 -14.618 10.911 1.00 0.00 H new ATOM 0 HB2 LYS A 16 9.940 -16.445 9.941 1.00 0.00 H new ATOM 0 HB3 LYS A 16 10.684 -16.154 8.381 1.00 0.00 H new ATOM 0 HG2 LYS A 16 12.943 -16.497 9.841 1.00 0.00 H new ATOM 0 HG3 LYS A 16 11.848 -17.434 10.837 1.00 0.00 H new ATOM 0 HD2 LYS A 16 12.408 -17.863 7.870 1.00 0.00 H new ATOM 0 HD3 LYS A 16 12.948 -18.885 9.187 1.00 0.00 H new ATOM 0 HE2 LYS A 16 10.573 -19.446 9.726 1.00 0.00 H new ATOM 0 HE3 LYS A 16 10.033 -18.424 8.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 10.093 -20.606 7.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 11.456 -19.842 6.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 11.634 -20.911 8.229 1.00 0.00 H new ATOM 248 N ALA A 17 12.255 -14.000 7.786 1.00 0.00 N ATOM 249 CA ALA A 17 13.401 -13.850 6.907 1.00 0.00 C ATOM 250 C ALA A 17 13.352 -12.520 6.144 1.00 0.00 C ATOM 251 O ALA A 17 13.019 -12.459 4.961 1.00 0.00 O ATOM 252 CB ALA A 17 13.484 -15.092 6.019 1.00 0.00 C ATOM 0 H ALA A 17 11.371 -14.068 7.282 1.00 0.00 H new ATOM 0 HA ALA A 17 14.328 -13.791 7.478 1.00 0.00 H new ATOM 0 HB1 ALA A 17 14.339 -15.003 5.348 1.00 0.00 H new ATOM 0 HB2 ALA A 17 13.603 -15.978 6.643 1.00 0.00 H new ATOM 0 HB3 ALA A 17 12.570 -15.181 5.432 1.00 0.00 H new ATOM 258 N PHE A 18 13.739 -11.451 6.844 1.00 0.00 N ATOM 259 CA PHE A 18 14.030 -10.133 6.286 1.00 0.00 C ATOM 260 C PHE A 18 15.425 -9.672 6.724 1.00 0.00 C ATOM 261 O PHE A 18 15.946 -10.109 7.750 1.00 0.00 O ATOM 262 CB PHE A 18 12.989 -9.105 6.764 1.00 0.00 C ATOM 263 CG PHE A 18 11.718 -8.982 5.945 1.00 0.00 C ATOM 264 CD1 PHE A 18 11.732 -8.282 4.723 1.00 0.00 C ATOM 265 CD2 PHE A 18 10.499 -9.452 6.461 1.00 0.00 C ATOM 266 CE1 PHE A 18 10.528 -8.005 4.051 1.00 0.00 C ATOM 267 CE2 PHE A 18 9.293 -9.191 5.783 1.00 0.00 C ATOM 268 CZ PHE A 18 9.305 -8.445 4.591 1.00 0.00 C ATOM 0 H PHE A 18 13.862 -11.484 7.856 1.00 0.00 H new ATOM 0 HA PHE A 18 13.992 -10.207 5.199 1.00 0.00 H new ATOM 0 HB2 PHE A 18 12.710 -9.356 7.787 1.00 0.00 H new ATOM 0 HB3 PHE A 18 13.468 -8.127 6.795 1.00 0.00 H new ATOM 0 HD1 PHE A 18 12.671 -7.957 4.300 1.00 0.00 H new ATOM 0 HD2 PHE A 18 10.487 -10.016 7.382 1.00 0.00 H new ATOM 0 HE1 PHE A 18 10.542 -7.455 3.122 1.00 0.00 H new ATOM 0 HE2 PHE A 18 8.359 -9.563 6.178 1.00 0.00 H new ATOM 0 HZ PHE A 18 8.377 -8.210 4.091 1.00 0.00 H new ATOM 278 N LYS A 19 15.982 -8.712 5.982 1.00 0.00 N ATOM 279 CA LYS A 19 17.121 -7.879 6.372 1.00 0.00 C ATOM 280 C LYS A 19 16.898 -6.450 5.850 1.00 0.00 C ATOM 281 O LYS A 19 16.337 -6.275 4.770 1.00 0.00 O ATOM 282 CB LYS A 19 18.405 -8.550 5.829 1.00 0.00 C ATOM 283 CG LYS A 19 19.582 -7.580 5.696 1.00 0.00 C ATOM 284 CD LYS A 19 20.872 -8.226 5.182 1.00 0.00 C ATOM 285 CE LYS A 19 21.937 -7.164 4.853 1.00 0.00 C ATOM 286 NZ LYS A 19 21.457 -6.177 3.853 1.00 0.00 N ATOM 0 H LYS A 19 15.635 -8.484 5.050 1.00 0.00 H new ATOM 0 HA LYS A 19 17.226 -7.796 7.454 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.689 -9.367 6.493 1.00 0.00 H new ATOM 0 HB3 LYS A 19 18.193 -8.990 4.854 1.00 0.00 H new ATOM 0 HG2 LYS A 19 19.299 -6.773 5.020 1.00 0.00 H new ATOM 0 HG3 LYS A 19 19.778 -7.128 6.668 1.00 0.00 H new ATOM 0 HD2 LYS A 19 21.261 -8.914 5.933 1.00 0.00 H new ATOM 0 HD3 LYS A 19 20.656 -8.816 4.291 1.00 0.00 H new ATOM 0 HE2 LYS A 19 22.222 -6.643 5.767 1.00 0.00 H new ATOM 0 HE3 LYS A 19 22.833 -7.656 4.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 22.266 -5.645 3.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 20.976 -6.675 3.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 20.792 -5.519 4.307 1.00 0.00 H new ATOM 300 N PHE A 20 17.384 -5.432 6.573 1.00 0.00 N ATOM 301 CA PHE A 20 17.475 -4.058 6.064 1.00 0.00 C ATOM 302 C PHE A 20 18.405 -3.984 4.840 1.00 0.00 C ATOM 303 O PHE A 20 19.558 -4.425 4.894 1.00 0.00 O ATOM 304 CB PHE A 20 18.001 -3.108 7.155 1.00 0.00 C ATOM 305 CG PHE A 20 17.063 -2.809 8.313 1.00 0.00 C ATOM 306 CD1 PHE A 20 15.846 -2.136 8.082 1.00 0.00 C ATOM 307 CD2 PHE A 20 17.446 -3.114 9.634 1.00 0.00 C ATOM 308 CE1 PHE A 20 15.018 -1.781 9.163 1.00 0.00 C ATOM 309 CE2 PHE A 20 16.621 -2.751 10.715 1.00 0.00 C ATOM 310 CZ PHE A 20 15.404 -2.089 10.479 1.00 0.00 C ATOM 0 H PHE A 20 17.725 -5.539 7.528 1.00 0.00 H new ATOM 0 HA PHE A 20 16.472 -3.751 5.769 1.00 0.00 H new ATOM 0 HB2 PHE A 20 18.919 -3.533 7.562 1.00 0.00 H new ATOM 0 HB3 PHE A 20 18.269 -2.163 6.682 1.00 0.00 H new ATOM 0 HD1 PHE A 20 15.548 -1.892 7.073 1.00 0.00 H new ATOM 0 HD2 PHE A 20 18.377 -3.629 9.818 1.00 0.00 H new ATOM 0 HE1 PHE A 20 14.084 -1.271 8.981 1.00 0.00 H new ATOM 0 HE2 PHE A 20 16.923 -2.981 11.726 1.00 0.00 H new ATOM 0 HZ PHE A 20 14.766 -1.817 11.307 1.00 0.00 H new ATOM 320 N LEU A 21 17.916 -3.396 3.744 1.00 0.00 N ATOM 321 CA LEU A 21 18.724 -3.022 2.580 1.00 0.00 C ATOM 322 C LEU A 21 19.046 -1.519 2.656 1.00 0.00 C ATOM 323 O LEU A 21 20.208 -1.130 2.565 1.00 0.00 O ATOM 324 CB LEU A 21 17.969 -3.427 1.296 1.00 0.00 C ATOM 325 CG LEU A 21 18.821 -3.637 0.024 1.00 0.00 C ATOM 326 CD1 LEU A 21 19.704 -2.447 -0.357 1.00 0.00 C ATOM 327 CD2 LEU A 21 19.711 -4.877 0.131 1.00 0.00 C ATOM 0 H LEU A 21 16.929 -3.162 3.639 1.00 0.00 H new ATOM 0 HA LEU A 21 19.678 -3.549 2.566 1.00 0.00 H new ATOM 0 HB2 LEU A 21 17.426 -4.351 1.498 1.00 0.00 H new ATOM 0 HB3 LEU A 21 17.224 -2.660 1.083 1.00 0.00 H new ATOM 0 HG LEU A 21 18.078 -3.763 -0.764 1.00 0.00 H new ATOM 0 HD11 LEU A 21 20.265 -2.685 -1.261 1.00 0.00 H new ATOM 0 HD12 LEU A 21 19.078 -1.573 -0.538 1.00 0.00 H new ATOM 0 HD13 LEU A 21 20.399 -2.234 0.456 1.00 0.00 H new ATOM 0 HD21 LEU A 21 20.293 -4.987 -0.784 1.00 0.00 H new ATOM 0 HD22 LEU A 21 20.386 -4.768 0.979 1.00 0.00 H new ATOM 0 HD23 LEU A 21 19.089 -5.760 0.274 1.00 0.00 H new ATOM 339 N GLY A 22 18.023 -0.695 2.907 1.00 0.00 N ATOM 340 CA GLY A 22 18.103 0.744 3.130 1.00 0.00 C ATOM 341 C GLY A 22 17.341 1.112 4.399 1.00 0.00 C ATOM 342 O GLY A 22 16.111 1.090 4.410 1.00 0.00 O ATOM 0 H GLY A 22 17.064 -1.039 2.962 1.00 0.00 H new ATOM 0 HA2 GLY A 22 19.145 1.050 3.219 1.00 0.00 H new ATOM 0 HA3 GLY A 22 17.685 1.278 2.276 1.00 0.00 H new ATOM 346 N THR A 23 18.059 1.421 5.482 1.00 0.00 N ATOM 347 CA THR A 23 17.473 1.936 6.727 1.00 0.00 C ATOM 348 C THR A 23 16.683 3.238 6.483 1.00 0.00 C ATOM 349 O THR A 23 16.925 3.922 5.486 1.00 0.00 O ATOM 350 CB THR A 23 18.580 2.134 7.777 1.00 0.00 C ATOM 351 OG1 THR A 23 19.729 2.725 7.212 1.00 0.00 O ATOM 352 CG2 THR A 23 19.003 0.791 8.377 1.00 0.00 C ATOM 0 H THR A 23 19.073 1.321 5.522 1.00 0.00 H new ATOM 0 HA THR A 23 16.760 1.204 7.107 1.00 0.00 H new ATOM 0 HB THR A 23 18.167 2.787 8.546 1.00 0.00 H new ATOM 0 HG1 THR A 23 20.413 2.839 7.905 1.00 0.00 H new ATOM 0 HG21 THR A 23 19.787 0.954 9.117 1.00 0.00 H new ATOM 0 HG22 THR A 23 18.144 0.320 8.855 1.00 0.00 H new ATOM 0 HG23 THR A 23 19.380 0.142 7.587 1.00 0.00 H new ATOM 360 N PRO A 24 15.709 3.586 7.351 1.00 0.00 N ATOM 361 CA PRO A 24 14.719 4.615 7.032 1.00 0.00 C ATOM 362 C PRO A 24 15.337 6.010 6.839 1.00 0.00 C ATOM 363 O PRO A 24 16.228 6.406 7.593 1.00 0.00 O ATOM 364 CB PRO A 24 13.688 4.579 8.168 1.00 0.00 C ATOM 365 CG PRO A 24 14.421 3.895 9.319 1.00 0.00 C ATOM 366 CD PRO A 24 15.380 2.941 8.614 1.00 0.00 C ATOM 0 HA PRO A 24 14.250 4.407 6.071 1.00 0.00 H new ATOM 0 HB2 PRO A 24 13.364 5.583 8.443 1.00 0.00 H new ATOM 0 HB3 PRO A 24 12.796 4.024 7.878 1.00 0.00 H new ATOM 0 HG2 PRO A 24 14.955 4.615 9.939 1.00 0.00 H new ATOM 0 HG3 PRO A 24 13.732 3.361 9.973 1.00 0.00 H new ATOM 0 HD2 PRO A 24 16.275 2.770 9.213 1.00 0.00 H new ATOM 0 HD3 PRO A 24 14.916 1.968 8.449 1.00 0.00 H new ATOM 374 N ALA A 25 14.817 6.776 5.873 1.00 0.00 N ATOM 375 CA ALA A 25 15.244 8.141 5.550 1.00 0.00 C ATOM 376 C ALA A 25 14.039 9.054 5.260 1.00 0.00 C ATOM 377 O ALA A 25 13.258 8.756 4.353 1.00 0.00 O ATOM 378 CB ALA A 25 16.202 8.082 4.353 1.00 0.00 C ATOM 0 H ALA A 25 14.059 6.450 5.273 1.00 0.00 H new ATOM 0 HA ALA A 25 15.760 8.572 6.408 1.00 0.00 H new ATOM 0 HB1 ALA A 25 16.530 9.090 4.099 1.00 0.00 H new ATOM 0 HB2 ALA A 25 17.068 7.473 4.610 1.00 0.00 H new ATOM 0 HB3 ALA A 25 15.689 7.641 3.498 1.00 0.00 H new ATOM 384 N ASP A 26 13.855 10.136 6.040 1.00 0.00 N ATOM 385 CA ASP A 26 12.744 11.079 5.848 1.00 0.00 C ATOM 386 C ASP A 26 12.882 11.808 4.505 1.00 0.00 C ATOM 387 O ASP A 26 13.866 12.493 4.227 1.00 0.00 O ATOM 388 CB ASP A 26 12.567 12.052 7.029 1.00 0.00 C ATOM 389 CG ASP A 26 11.171 12.711 7.031 1.00 0.00 C ATOM 390 OD1 ASP A 26 10.770 13.254 5.973 1.00 0.00 O ATOM 391 OD2 ASP A 26 10.501 12.659 8.095 1.00 0.00 O ATOM 0 H ASP A 26 14.471 10.378 6.817 1.00 0.00 H new ATOM 0 HA ASP A 26 11.825 10.494 5.820 1.00 0.00 H new ATOM 0 HB2 ASP A 26 12.716 11.516 7.966 1.00 0.00 H new ATOM 0 HB3 ASP A 26 13.333 12.826 6.979 1.00 0.00 H new ATOM 396 N THR A 27 11.872 11.603 3.666 1.00 0.00 N ATOM 397 CA THR A 27 11.720 12.119 2.305 1.00 0.00 C ATOM 398 C THR A 27 11.495 13.628 2.226 1.00 0.00 C ATOM 399 O THR A 27 11.685 14.203 1.156 1.00 0.00 O ATOM 400 CB THR A 27 10.476 11.482 1.667 1.00 0.00 C ATOM 401 OG1 THR A 27 9.357 11.717 2.498 1.00 0.00 O ATOM 402 CG2 THR A 27 10.609 9.980 1.456 1.00 0.00 C ATOM 0 H THR A 27 11.075 11.027 3.939 1.00 0.00 H new ATOM 0 HA THR A 27 12.654 11.878 1.798 1.00 0.00 H new ATOM 0 HB THR A 27 10.356 11.942 0.686 1.00 0.00 H new ATOM 0 HG1 THR A 27 9.287 11.001 3.163 1.00 0.00 H new ATOM 0 HG21 THR A 27 9.696 9.594 1.002 1.00 0.00 H new ATOM 0 HG22 THR A 27 11.454 9.778 0.798 1.00 0.00 H new ATOM 0 HG23 THR A 27 10.772 9.491 2.416 1.00 0.00 H new ATOM 410 N GLY A 28 11.001 14.263 3.296 1.00 0.00 N ATOM 411 CA GLY A 28 10.377 15.582 3.197 1.00 0.00 C ATOM 412 C GLY A 28 8.950 15.566 2.620 1.00 0.00 C ATOM 413 O GLY A 28 8.303 16.609 2.629 1.00 0.00 O ATOM 0 H GLY A 28 11.023 13.881 4.241 1.00 0.00 H new ATOM 0 HA2 GLY A 28 10.350 16.034 4.189 1.00 0.00 H new ATOM 0 HA3 GLY A 28 11.002 16.221 2.573 1.00 0.00 H new ATOM 417 N HIS A 29 8.406 14.408 2.201 1.00 0.00 N ATOM 418 CA HIS A 29 6.960 14.223 1.985 1.00 0.00 C ATOM 419 C HIS A 29 6.187 14.232 3.323 1.00 0.00 C ATOM 420 O HIS A 29 4.959 14.283 3.330 1.00 0.00 O ATOM 421 CB HIS A 29 6.656 12.881 1.272 1.00 0.00 C ATOM 422 CG HIS A 29 7.471 12.500 0.054 1.00 0.00 C ATOM 423 ND1 HIS A 29 7.701 11.210 -0.397 1.00 0.00 N ATOM 424 CD2 HIS A 29 8.104 13.356 -0.810 1.00 0.00 C ATOM 425 CE1 HIS A 29 8.460 11.302 -1.501 1.00 0.00 C ATOM 426 NE2 HIS A 29 8.730 12.584 -1.794 1.00 0.00 N ATOM 0 H HIS A 29 8.958 13.574 2.003 1.00 0.00 H new ATOM 0 HA HIS A 29 6.637 15.055 1.359 1.00 0.00 H new ATOM 0 HB2 HIS A 29 6.769 12.084 2.007 1.00 0.00 H new ATOM 0 HB3 HIS A 29 5.607 12.895 0.976 1.00 0.00 H new ATOM 0 HD1 HIS A 29 7.357 10.350 0.030 1.00 0.00 H new ATOM 0 HD2 HIS A 29 8.117 14.434 -0.743 1.00 0.00 H new ATOM 0 HE1 HIS A 29 8.807 10.457 -2.077 1.00 0.00 H new ATOM 434 N GLY A 30 6.909 14.141 4.451 1.00 0.00 N ATOM 435 CA GLY A 30 6.397 13.881 5.799 1.00 0.00 C ATOM 436 C GLY A 30 6.677 12.452 6.286 1.00 0.00 C ATOM 437 O GLY A 30 6.352 12.131 7.427 1.00 0.00 O ATOM 0 H GLY A 30 7.923 14.254 4.443 1.00 0.00 H new ATOM 0 HA2 GLY A 30 6.846 14.590 6.495 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.322 14.059 5.813 1.00 0.00 H new ATOM 441 N THR A 31 7.266 11.603 5.434 1.00 0.00 N ATOM 442 CA THR A 31 7.368 10.144 5.575 1.00 0.00 C ATOM 443 C THR A 31 8.812 9.656 5.377 1.00 0.00 C ATOM 444 O THR A 31 9.586 10.277 4.645 1.00 0.00 O ATOM 445 CB THR A 31 6.447 9.474 4.539 1.00 0.00 C ATOM 446 OG1 THR A 31 6.804 9.918 3.259 1.00 0.00 O ATOM 447 CG2 THR A 31 4.968 9.815 4.739 1.00 0.00 C ATOM 0 H THR A 31 7.710 11.935 4.578 1.00 0.00 H new ATOM 0 HA THR A 31 7.062 9.873 6.586 1.00 0.00 H new ATOM 0 HB THR A 31 6.572 8.398 4.660 1.00 0.00 H new ATOM 0 HG1 THR A 31 6.170 9.563 2.601 1.00 0.00 H new ATOM 0 HG21 THR A 31 4.372 9.312 3.977 1.00 0.00 H new ATOM 0 HG22 THR A 31 4.649 9.483 5.727 1.00 0.00 H new ATOM 0 HG23 THR A 31 4.829 10.893 4.655 1.00 0.00 H new ATOM 455 N VAL A 32 9.178 8.521 5.989 1.00 0.00 N ATOM 456 CA VAL A 32 10.467 7.837 5.775 1.00 0.00 C ATOM 457 C VAL A 32 10.327 6.769 4.697 1.00 0.00 C ATOM 458 O VAL A 32 9.490 5.880 4.834 1.00 0.00 O ATOM 459 CB VAL A 32 11.070 7.193 7.050 1.00 0.00 C ATOM 460 CG1 VAL A 32 11.843 8.207 7.903 1.00 0.00 C ATOM 461 CG2 VAL A 32 10.073 6.420 7.926 1.00 0.00 C ATOM 0 H VAL A 32 8.577 8.041 6.660 1.00 0.00 H new ATOM 0 HA VAL A 32 11.159 8.619 5.463 1.00 0.00 H new ATOM 0 HB VAL A 32 11.763 6.450 6.656 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.246 7.709 8.784 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.661 8.627 7.317 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.172 9.007 8.214 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.592 6.008 8.792 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.285 7.094 8.262 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.633 5.608 7.347 1.00 0.00 H new ATOM 471 N VAL A 33 11.177 6.817 3.663 1.00 0.00 N ATOM 472 CA VAL A 33 11.419 5.655 2.793 1.00 0.00 C ATOM 473 C VAL A 33 12.368 4.680 3.490 1.00 0.00 C ATOM 474 O VAL A 33 13.362 5.096 4.083 1.00 0.00 O ATOM 475 CB VAL A 33 11.993 6.029 1.410 1.00 0.00 C ATOM 476 CG1 VAL A 33 10.877 6.495 0.473 1.00 0.00 C ATOM 477 CG2 VAL A 33 13.123 7.066 1.437 1.00 0.00 C ATOM 0 H VAL A 33 11.710 7.648 3.407 1.00 0.00 H new ATOM 0 HA VAL A 33 10.448 5.193 2.616 1.00 0.00 H new ATOM 0 HB VAL A 33 12.446 5.111 1.036 1.00 0.00 H new ATOM 0 HG11 VAL A 33 11.301 6.754 -0.497 1.00 0.00 H new ATOM 0 HG12 VAL A 33 10.149 5.694 0.348 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.385 7.369 0.899 1.00 0.00 H new ATOM 0 HG21 VAL A 33 13.460 7.263 0.419 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.758 7.991 1.884 1.00 0.00 H new ATOM 0 HG23 VAL A 33 13.955 6.682 2.027 1.00 0.00 H new ATOM 487 N LEU A 34 12.052 3.387 3.408 1.00 0.00 N ATOM 488 CA LEU A 34 12.733 2.271 4.059 1.00 0.00 C ATOM 489 C LEU A 34 12.753 1.087 3.081 1.00 0.00 C ATOM 490 O LEU A 34 11.714 0.742 2.523 1.00 0.00 O ATOM 491 CB LEU A 34 11.915 1.949 5.324 1.00 0.00 C ATOM 492 CG LEU A 34 12.567 1.055 6.393 1.00 0.00 C ATOM 493 CD1 LEU A 34 11.530 0.845 7.497 1.00 0.00 C ATOM 494 CD2 LEU A 34 13.013 -0.326 5.911 1.00 0.00 C ATOM 0 H LEU A 34 11.260 3.072 2.847 1.00 0.00 H new ATOM 0 HA LEU A 34 13.764 2.497 4.333 1.00 0.00 H new ATOM 0 HB2 LEU A 34 11.644 2.893 5.797 1.00 0.00 H new ATOM 0 HB3 LEU A 34 10.987 1.472 5.010 1.00 0.00 H new ATOM 0 HG LEU A 34 13.473 1.569 6.715 1.00 0.00 H new ATOM 0 HD11 LEU A 34 11.953 0.214 8.278 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.250 1.809 7.921 1.00 0.00 H new ATOM 0 HD13 LEU A 34 10.647 0.362 7.079 1.00 0.00 H new ATOM 0 HD21 LEU A 34 13.459 -0.875 6.741 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.151 -0.876 5.534 1.00 0.00 H new ATOM 0 HD23 LEU A 34 13.748 -0.213 5.114 1.00 0.00 H new ATOM 506 N GLU A 35 13.903 0.443 2.874 1.00 0.00 N ATOM 507 CA GLU A 35 14.020 -0.736 2.017 1.00 0.00 C ATOM 508 C GLU A 35 14.504 -1.965 2.793 1.00 0.00 C ATOM 509 O GLU A 35 15.517 -1.915 3.499 1.00 0.00 O ATOM 510 CB GLU A 35 14.941 -0.436 0.827 1.00 0.00 C ATOM 511 CG GLU A 35 14.656 -1.419 -0.312 1.00 0.00 C ATOM 512 CD GLU A 35 15.584 -1.197 -1.496 1.00 0.00 C ATOM 513 OE1 GLU A 35 16.757 -1.628 -1.420 1.00 0.00 O ATOM 514 OE2 GLU A 35 15.135 -0.673 -2.541 1.00 0.00 O ATOM 0 H GLU A 35 14.785 0.728 3.300 1.00 0.00 H new ATOM 0 HA GLU A 35 13.025 -0.973 1.640 1.00 0.00 H new ATOM 0 HB2 GLU A 35 14.785 0.587 0.484 1.00 0.00 H new ATOM 0 HB3 GLU A 35 15.984 -0.514 1.134 1.00 0.00 H new ATOM 0 HG2 GLU A 35 14.770 -2.440 0.052 1.00 0.00 H new ATOM 0 HG3 GLU A 35 13.621 -1.310 -0.636 1.00 0.00 H new ATOM 521 N LEU A 36 13.814 -3.095 2.608 1.00 0.00 N ATOM 522 CA LEU A 36 14.256 -4.398 3.106 1.00 0.00 C ATOM 523 C LEU A 36 14.456 -5.381 1.948 1.00 0.00 C ATOM 524 O LEU A 36 13.910 -5.207 0.858 1.00 0.00 O ATOM 525 CB LEU A 36 13.257 -4.960 4.136 1.00 0.00 C ATOM 526 CG LEU A 36 13.042 -4.077 5.386 1.00 0.00 C ATOM 527 CD1 LEU A 36 11.605 -3.549 5.431 1.00 0.00 C ATOM 528 CD2 LEU A 36 13.303 -4.859 6.678 1.00 0.00 C ATOM 0 H LEU A 36 12.927 -3.130 2.105 1.00 0.00 H new ATOM 0 HA LEU A 36 15.215 -4.263 3.606 1.00 0.00 H new ATOM 0 HB2 LEU A 36 12.296 -5.108 3.644 1.00 0.00 H new ATOM 0 HB3 LEU A 36 13.604 -5.942 4.458 1.00 0.00 H new ATOM 0 HG LEU A 36 13.748 -3.250 5.315 1.00 0.00 H new ATOM 0 HD11 LEU A 36 11.473 -2.929 6.318 1.00 0.00 H new ATOM 0 HD12 LEU A 36 11.408 -2.953 4.540 1.00 0.00 H new ATOM 0 HD13 LEU A 36 10.910 -4.388 5.467 1.00 0.00 H new ATOM 0 HD21 LEU A 36 13.142 -4.207 7.537 1.00 0.00 H new ATOM 0 HD22 LEU A 36 12.621 -5.707 6.734 1.00 0.00 H new ATOM 0 HD23 LEU A 36 14.332 -5.220 6.684 1.00 0.00 H new ATOM 540 N GLN A 37 15.193 -6.457 2.219 1.00 0.00 N ATOM 541 CA GLN A 37 15.271 -7.647 1.379 1.00 0.00 C ATOM 542 C GLN A 37 14.690 -8.838 2.146 1.00 0.00 C ATOM 543 O GLN A 37 15.043 -9.066 3.306 1.00 0.00 O ATOM 544 CB GLN A 37 16.710 -7.869 0.874 1.00 0.00 C ATOM 545 CG GLN A 37 17.724 -8.234 1.974 1.00 0.00 C ATOM 546 CD GLN A 37 19.166 -8.279 1.481 1.00 0.00 C ATOM 547 OE1 GLN A 37 20.044 -7.607 2.009 1.00 0.00 O ATOM 548 NE2 GLN A 37 19.475 -9.075 0.475 1.00 0.00 N ATOM 0 H GLN A 37 15.770 -6.525 3.057 1.00 0.00 H new ATOM 0 HA GLN A 37 14.669 -7.520 0.479 1.00 0.00 H new ATOM 0 HB2 GLN A 37 16.701 -8.663 0.128 1.00 0.00 H new ATOM 0 HB3 GLN A 37 17.049 -6.963 0.371 1.00 0.00 H new ATOM 0 HG2 GLN A 37 17.647 -7.508 2.783 1.00 0.00 H new ATOM 0 HG3 GLN A 37 17.461 -9.206 2.392 1.00 0.00 H new ATOM 0 HE21 GLN A 37 18.751 -9.638 0.029 1.00 0.00 H new ATOM 0 HE22 GLN A 37 20.438 -9.127 0.143 1.00 0.00 H new ATOM 557 N TYR A 38 13.772 -9.572 1.516 1.00 0.00 N ATOM 558 CA TYR A 38 13.193 -10.798 2.057 1.00 0.00 C ATOM 559 C TYR A 38 14.157 -11.968 1.813 1.00 0.00 C ATOM 560 O TYR A 38 14.266 -12.479 0.699 1.00 0.00 O ATOM 561 CB TYR A 38 11.820 -11.027 1.430 1.00 0.00 C ATOM 562 CG TYR A 38 10.977 -12.059 2.155 1.00 0.00 C ATOM 563 CD1 TYR A 38 11.112 -13.435 1.886 1.00 0.00 C ATOM 564 CD2 TYR A 38 10.057 -11.626 3.124 1.00 0.00 C ATOM 565 CE1 TYR A 38 10.322 -14.371 2.579 1.00 0.00 C ATOM 566 CE2 TYR A 38 9.273 -12.552 3.829 1.00 0.00 C ATOM 567 CZ TYR A 38 9.402 -13.928 3.557 1.00 0.00 C ATOM 568 OH TYR A 38 8.630 -14.806 4.246 1.00 0.00 O ATOM 0 H TYR A 38 13.404 -9.324 0.597 1.00 0.00 H new ATOM 0 HA TYR A 38 13.050 -10.715 3.134 1.00 0.00 H new ATOM 0 HB2 TYR A 38 11.279 -10.081 1.408 1.00 0.00 H new ATOM 0 HB3 TYR A 38 11.952 -11.342 0.395 1.00 0.00 H new ATOM 0 HD1 TYR A 38 11.823 -13.772 1.147 1.00 0.00 H new ATOM 0 HD2 TYR A 38 9.952 -10.571 3.328 1.00 0.00 H new ATOM 0 HE1 TYR A 38 10.418 -15.425 2.364 1.00 0.00 H new ATOM 0 HE2 TYR A 38 8.573 -12.211 4.577 1.00 0.00 H new ATOM 0 HH TYR A 38 9.102 -15.661 4.329 1.00 0.00 H new ATOM 578 N THR A 39 14.912 -12.351 2.843 1.00 0.00 N ATOM 579 CA THR A 39 16.047 -13.285 2.771 1.00 0.00 C ATOM 580 C THR A 39 15.653 -14.764 2.695 1.00 0.00 C ATOM 581 O THR A 39 16.540 -15.604 2.548 1.00 0.00 O ATOM 582 CB THR A 39 16.991 -13.069 3.970 1.00 0.00 C ATOM 583 OG1 THR A 39 16.277 -13.059 5.187 1.00 0.00 O ATOM 584 CG2 THR A 39 17.728 -11.733 3.884 1.00 0.00 C ATOM 0 H THR A 39 14.747 -12.008 3.789 1.00 0.00 H new ATOM 0 HA THR A 39 16.550 -13.055 1.832 1.00 0.00 H new ATOM 0 HB THR A 39 17.701 -13.896 3.938 1.00 0.00 H new ATOM 0 HG1 THR A 39 16.900 -12.922 5.931 1.00 0.00 H new ATOM 0 HG21 THR A 39 18.382 -11.622 4.749 1.00 0.00 H new ATOM 0 HG22 THR A 39 18.324 -11.704 2.972 1.00 0.00 H new ATOM 0 HG23 THR A 39 17.004 -10.918 3.870 1.00 0.00 H new ATOM 592 N GLY A 40 14.361 -15.104 2.789 1.00 0.00 N ATOM 593 CA GLY A 40 13.880 -16.487 2.859 1.00 0.00 C ATOM 594 C GLY A 40 13.078 -16.946 1.643 1.00 0.00 C ATOM 595 O GLY A 40 12.650 -16.149 0.808 1.00 0.00 O ATOM 0 H GLY A 40 13.610 -14.414 2.819 1.00 0.00 H new ATOM 0 HA2 GLY A 40 14.737 -17.149 2.983 1.00 0.00 H new ATOM 0 HA3 GLY A 40 13.260 -16.597 3.749 1.00 0.00 H new ATOM 599 N THR A 41 12.829 -18.258 1.592 1.00 0.00 N ATOM 600 CA THR A 41 12.074 -18.965 0.544 1.00 0.00 C ATOM 601 C THR A 41 10.681 -19.420 1.003 1.00 0.00 C ATOM 602 O THR A 41 9.963 -20.051 0.232 1.00 0.00 O ATOM 603 CB THR A 41 12.878 -20.179 0.047 1.00 0.00 C ATOM 604 OG1 THR A 41 13.253 -20.992 1.141 1.00 0.00 O ATOM 605 CG2 THR A 41 14.150 -19.758 -0.690 1.00 0.00 C ATOM 0 H THR A 41 13.165 -18.892 2.317 1.00 0.00 H new ATOM 0 HA THR A 41 11.923 -18.252 -0.266 1.00 0.00 H new ATOM 0 HB THR A 41 12.235 -20.727 -0.642 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.763 -21.763 0.816 1.00 0.00 H new ATOM 0 HG21 THR A 41 14.688 -20.645 -1.024 1.00 0.00 H new ATOM 0 HG22 THR A 41 13.885 -19.148 -1.554 1.00 0.00 H new ATOM 0 HG23 THR A 41 14.785 -19.180 -0.019 1.00 0.00 H new ATOM 613 N ASP A 42 10.300 -19.126 2.250 1.00 0.00 N ATOM 614 CA ASP A 42 9.017 -19.471 2.864 1.00 0.00 C ATOM 615 C ASP A 42 8.466 -18.302 3.706 1.00 0.00 C ATOM 616 O ASP A 42 9.044 -17.214 3.721 1.00 0.00 O ATOM 617 CB ASP A 42 9.177 -20.762 3.687 1.00 0.00 C ATOM 618 CG ASP A 42 9.812 -20.528 5.062 1.00 0.00 C ATOM 619 OD1 ASP A 42 10.939 -19.984 5.147 1.00 0.00 O ATOM 620 OD2 ASP A 42 9.161 -20.870 6.077 1.00 0.00 O ATOM 0 H ASP A 42 10.909 -18.616 2.889 1.00 0.00 H new ATOM 0 HA ASP A 42 8.280 -19.654 2.082 1.00 0.00 H new ATOM 0 HB2 ASP A 42 8.199 -21.224 3.820 1.00 0.00 H new ATOM 0 HB3 ASP A 42 9.790 -21.468 3.127 1.00 0.00 H new ATOM 625 N GLY A 43 7.346 -18.525 4.404 1.00 0.00 N ATOM 626 CA GLY A 43 6.733 -17.583 5.345 1.00 0.00 C ATOM 627 C GLY A 43 5.525 -16.764 4.848 1.00 0.00 C ATOM 628 O GLY A 43 5.499 -15.571 5.150 1.00 0.00 O ATOM 0 H GLY A 43 6.824 -19.398 4.325 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.420 -18.144 6.226 1.00 0.00 H new ATOM 0 HA3 GLY A 43 7.503 -16.883 5.670 1.00 0.00 H new ATOM 632 N PRO A 44 4.505 -17.332 4.160 1.00 0.00 N ATOM 633 CA PRO A 44 3.190 -16.690 4.034 1.00 0.00 C ATOM 634 C PRO A 44 2.605 -16.348 5.421 1.00 0.00 C ATOM 635 O PRO A 44 2.155 -17.236 6.144 1.00 0.00 O ATOM 636 CB PRO A 44 2.288 -17.659 3.250 1.00 0.00 C ATOM 637 CG PRO A 44 3.253 -18.664 2.633 1.00 0.00 C ATOM 638 CD PRO A 44 4.453 -18.664 3.575 1.00 0.00 C ATOM 0 HA PRO A 44 3.268 -15.742 3.502 1.00 0.00 H new ATOM 0 HB2 PRO A 44 1.569 -18.150 3.906 1.00 0.00 H new ATOM 0 HB3 PRO A 44 1.716 -17.136 2.484 1.00 0.00 H new ATOM 0 HG2 PRO A 44 2.804 -19.654 2.562 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.540 -18.371 1.623 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.342 -19.425 4.347 1.00 0.00 H new ATOM 0 HD3 PRO A 44 5.373 -18.889 3.035 1.00 0.00 H new ATOM 646 N CYS A 45 2.681 -15.077 5.828 1.00 0.00 N ATOM 647 CA CYS A 45 2.491 -14.639 7.214 1.00 0.00 C ATOM 648 C CYS A 45 2.075 -13.161 7.316 1.00 0.00 C ATOM 649 O CYS A 45 2.135 -12.413 6.344 1.00 0.00 O ATOM 650 CB CYS A 45 3.806 -14.831 7.983 1.00 0.00 C ATOM 651 SG CYS A 45 4.212 -16.498 8.559 1.00 0.00 S ATOM 0 H CYS A 45 2.881 -14.307 5.189 1.00 0.00 H new ATOM 0 HA CYS A 45 1.688 -15.241 7.639 1.00 0.00 H new ATOM 0 HB2 CYS A 45 4.620 -14.490 7.344 1.00 0.00 H new ATOM 0 HB3 CYS A 45 3.785 -14.173 8.851 1.00 0.00 H new ATOM 656 N LYS A 46 1.698 -12.695 8.513 1.00 0.00 N ATOM 657 CA LYS A 46 1.405 -11.281 8.781 1.00 0.00 C ATOM 658 C LYS A 46 2.660 -10.579 9.324 1.00 0.00 C ATOM 659 O LYS A 46 2.966 -10.713 10.508 1.00 0.00 O ATOM 660 CB LYS A 46 0.177 -11.227 9.704 1.00 0.00 C ATOM 661 CG LYS A 46 -0.492 -9.857 9.831 1.00 0.00 C ATOM 662 CD LYS A 46 0.305 -8.871 10.700 1.00 0.00 C ATOM 663 CE LYS A 46 -0.460 -7.575 10.950 1.00 0.00 C ATOM 664 NZ LYS A 46 -0.869 -6.943 9.678 1.00 0.00 N ATOM 0 H LYS A 46 1.587 -13.294 9.331 1.00 0.00 H new ATOM 0 HA LYS A 46 1.150 -10.729 7.876 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.562 -11.940 9.339 1.00 0.00 H new ATOM 0 HB3 LYS A 46 0.476 -11.559 10.698 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -0.623 -9.431 8.836 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -1.487 -9.984 10.257 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.543 -9.341 11.655 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.253 -8.643 10.212 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.342 -7.781 11.557 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.164 -6.885 11.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.122 -5.949 9.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -0.082 -6.987 9.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.691 -7.447 9.288 1.00 0.00 H new ATOM 678 N VAL A 47 3.388 -9.843 8.471 1.00 0.00 N ATOM 679 CA VAL A 47 4.641 -9.159 8.850 1.00 0.00 C ATOM 680 C VAL A 47 4.435 -8.126 9.974 1.00 0.00 C ATOM 681 O VAL A 47 3.609 -7.228 9.839 1.00 0.00 O ATOM 682 CB VAL A 47 5.408 -8.548 7.650 1.00 0.00 C ATOM 683 CG1 VAL A 47 4.537 -7.760 6.666 1.00 0.00 C ATOM 684 CG2 VAL A 47 6.581 -7.650 8.077 1.00 0.00 C ATOM 0 H VAL A 47 3.126 -9.703 7.495 1.00 0.00 H new ATOM 0 HA VAL A 47 5.280 -9.949 9.245 1.00 0.00 H new ATOM 0 HB VAL A 47 5.785 -9.432 7.136 1.00 0.00 H new ATOM 0 HG11 VAL A 47 5.159 -7.370 5.860 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.773 -8.417 6.249 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.058 -6.931 7.187 1.00 0.00 H new ATOM 0 HG21 VAL A 47 7.077 -7.253 7.191 1.00 0.00 H new ATOM 0 HG22 VAL A 47 6.206 -6.825 8.683 1.00 0.00 H new ATOM 0 HG23 VAL A 47 7.293 -8.234 8.660 1.00 0.00 H new ATOM 694 N PRO A 48 5.199 -8.207 11.076 1.00 0.00 N ATOM 695 CA PRO A 48 5.279 -7.156 12.085 1.00 0.00 C ATOM 696 C PRO A 48 6.285 -6.055 11.690 1.00 0.00 C ATOM 697 O PRO A 48 7.498 -6.209 11.860 1.00 0.00 O ATOM 698 CB PRO A 48 5.706 -7.887 13.353 1.00 0.00 C ATOM 699 CG PRO A 48 6.614 -8.995 12.816 1.00 0.00 C ATOM 700 CD PRO A 48 5.986 -9.361 11.483 1.00 0.00 C ATOM 0 HA PRO A 48 4.332 -6.631 12.210 1.00 0.00 H new ATOM 0 HB2 PRO A 48 6.236 -7.228 14.041 1.00 0.00 H new ATOM 0 HB3 PRO A 48 4.851 -8.292 13.894 1.00 0.00 H new ATOM 0 HG2 PRO A 48 7.640 -8.648 12.693 1.00 0.00 H new ATOM 0 HG3 PRO A 48 6.645 -9.850 13.492 1.00 0.00 H new ATOM 0 HD2 PRO A 48 6.751 -9.591 10.742 1.00 0.00 H new ATOM 0 HD3 PRO A 48 5.358 -10.247 11.578 1.00 0.00 H new ATOM 708 N ILE A 49 5.779 -4.920 11.197 1.00 0.00 N ATOM 709 CA ILE A 49 6.540 -3.670 11.056 1.00 0.00 C ATOM 710 C ILE A 49 5.711 -2.490 11.593 1.00 0.00 C ATOM 711 O ILE A 49 4.482 -2.522 11.529 1.00 0.00 O ATOM 712 CB ILE A 49 7.063 -3.493 9.609 1.00 0.00 C ATOM 713 CG1 ILE A 49 8.025 -2.288 9.513 1.00 0.00 C ATOM 714 CG2 ILE A 49 5.937 -3.364 8.571 1.00 0.00 C ATOM 715 CD1 ILE A 49 8.860 -2.263 8.227 1.00 0.00 C ATOM 0 H ILE A 49 4.813 -4.841 10.879 1.00 0.00 H new ATOM 0 HA ILE A 49 7.440 -3.709 11.669 1.00 0.00 H new ATOM 0 HB ILE A 49 7.608 -4.406 9.369 1.00 0.00 H new ATOM 0 HG12 ILE A 49 7.446 -1.367 9.577 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.697 -2.302 10.371 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.370 -3.243 7.578 1.00 0.00 H new ATOM 0 HG22 ILE A 49 5.320 -4.262 8.590 1.00 0.00 H new ATOM 0 HG23 ILE A 49 5.322 -2.496 8.807 1.00 0.00 H new ATOM 0 HD11 ILE A 49 9.510 -1.388 8.232 1.00 0.00 H new ATOM 0 HD12 ILE A 49 9.467 -3.166 8.170 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.197 -2.216 7.363 1.00 0.00 H new ATOM 727 N SER A 50 6.373 -1.484 12.178 1.00 0.00 N ATOM 728 CA SER A 50 5.736 -0.479 13.044 1.00 0.00 C ATOM 729 C SER A 50 6.410 0.904 12.982 1.00 0.00 C ATOM 730 O SER A 50 7.574 1.015 12.599 1.00 0.00 O ATOM 731 CB SER A 50 5.806 -1.035 14.466 1.00 0.00 C ATOM 732 OG SER A 50 5.280 -0.149 15.425 1.00 0.00 O ATOM 0 H SER A 50 7.377 -1.342 12.063 1.00 0.00 H new ATOM 0 HA SER A 50 4.713 -0.313 12.707 1.00 0.00 H new ATOM 0 HB2 SER A 50 5.259 -1.977 14.510 1.00 0.00 H new ATOM 0 HB3 SER A 50 6.844 -1.257 14.714 1.00 0.00 H new ATOM 0 HG SER A 50 5.890 -0.096 16.190 1.00 0.00 H new ATOM 738 N SER A 51 5.677 1.946 13.408 1.00 0.00 N ATOM 739 CA SER A 51 6.117 3.342 13.545 1.00 0.00 C ATOM 740 C SER A 51 5.574 3.944 14.849 1.00 0.00 C ATOM 741 O SER A 51 4.357 4.062 15.026 1.00 0.00 O ATOM 742 CB SER A 51 5.650 4.191 12.353 1.00 0.00 C ATOM 743 OG SER A 51 6.173 5.501 12.489 1.00 0.00 O ATOM 0 H SER A 51 4.702 1.827 13.682 1.00 0.00 H new ATOM 0 HA SER A 51 7.207 3.348 13.568 1.00 0.00 H new ATOM 0 HB2 SER A 51 5.988 3.745 11.417 1.00 0.00 H new ATOM 0 HB3 SER A 51 4.561 4.222 12.316 1.00 0.00 H new ATOM 0 HG SER A 51 5.782 6.082 11.804 1.00 0.00 H new ATOM 749 N VAL A 52 6.464 4.325 15.773 1.00 0.00 N ATOM 750 CA VAL A 52 6.115 4.936 17.068 1.00 0.00 C ATOM 751 C VAL A 52 6.988 6.152 17.389 1.00 0.00 C ATOM 752 O VAL A 52 8.030 6.353 16.775 1.00 0.00 O ATOM 753 CB VAL A 52 6.165 3.902 18.212 1.00 0.00 C ATOM 754 CG1 VAL A 52 5.024 2.898 18.097 1.00 0.00 C ATOM 755 CG2 VAL A 52 7.496 3.152 18.311 1.00 0.00 C ATOM 0 H VAL A 52 7.470 4.216 15.642 1.00 0.00 H new ATOM 0 HA VAL A 52 5.088 5.291 16.979 1.00 0.00 H new ATOM 0 HB VAL A 52 6.057 4.484 19.127 1.00 0.00 H new ATOM 0 HG11 VAL A 52 5.085 2.182 18.917 1.00 0.00 H new ATOM 0 HG12 VAL A 52 4.070 3.424 18.145 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.099 2.369 17.147 1.00 0.00 H new ATOM 0 HG21 VAL A 52 7.454 2.443 19.138 1.00 0.00 H new ATOM 0 HG22 VAL A 52 7.680 2.614 17.381 1.00 0.00 H new ATOM 0 HG23 VAL A 52 8.303 3.864 18.484 1.00 0.00 H new ATOM 765 N ALA A 53 6.567 6.968 18.363 1.00 0.00 N ATOM 766 CA ALA A 53 7.199 8.249 18.697 1.00 0.00 C ATOM 767 C ALA A 53 8.209 8.172 19.858 1.00 0.00 C ATOM 768 O ALA A 53 8.907 9.144 20.136 1.00 0.00 O ATOM 769 CB ALA A 53 6.084 9.255 19.005 1.00 0.00 C ATOM 0 H ALA A 53 5.763 6.752 18.952 1.00 0.00 H new ATOM 0 HA ALA A 53 7.793 8.564 17.839 1.00 0.00 H new ATOM 0 HB1 ALA A 53 6.524 10.220 19.258 1.00 0.00 H new ATOM 0 HB2 ALA A 53 5.443 9.366 18.131 1.00 0.00 H new ATOM 0 HB3 ALA A 53 5.491 8.895 19.846 1.00 0.00 H new ATOM 775 N SER A 54 8.289 7.055 20.594 1.00 0.00 N ATOM 776 CA SER A 54 9.190 6.903 21.753 1.00 0.00 C ATOM 777 C SER A 54 9.556 5.436 22.029 1.00 0.00 C ATOM 778 O SER A 54 9.674 5.027 23.179 1.00 0.00 O ATOM 779 CB SER A 54 8.550 7.574 22.977 1.00 0.00 C ATOM 780 OG SER A 54 8.461 8.970 22.751 1.00 0.00 O ATOM 0 H SER A 54 7.728 6.224 20.404 1.00 0.00 H new ATOM 0 HA SER A 54 10.133 7.399 21.524 1.00 0.00 H new ATOM 0 HB2 SER A 54 7.558 7.159 23.157 1.00 0.00 H new ATOM 0 HB3 SER A 54 9.145 7.375 23.868 1.00 0.00 H new ATOM 0 HG SER A 54 8.953 9.201 21.936 1.00 0.00 H new ATOM 786 N LEU A 55 9.682 4.622 20.967 1.00 0.00 N ATOM 787 CA LEU A 55 9.910 3.164 21.001 1.00 0.00 C ATOM 788 C LEU A 55 8.810 2.373 21.750 1.00 0.00 C ATOM 789 O LEU A 55 8.935 1.173 21.985 1.00 0.00 O ATOM 790 CB LEU A 55 11.357 2.863 21.469 1.00 0.00 C ATOM 791 CG LEU A 55 12.147 1.950 20.507 1.00 0.00 C ATOM 792 CD1 LEU A 55 13.637 1.955 20.861 1.00 0.00 C ATOM 793 CD2 LEU A 55 11.655 0.502 20.491 1.00 0.00 C ATOM 0 H LEU A 55 9.625 4.979 20.013 1.00 0.00 H new ATOM 0 HA LEU A 55 9.819 2.787 19.983 1.00 0.00 H new ATOM 0 HB2 LEU A 55 11.894 3.804 21.585 1.00 0.00 H new ATOM 0 HB3 LEU A 55 11.320 2.394 22.452 1.00 0.00 H new ATOM 0 HG LEU A 55 11.983 2.365 19.513 1.00 0.00 H new ATOM 0 HD11 LEU A 55 14.177 1.306 20.172 1.00 0.00 H new ATOM 0 HD12 LEU A 55 14.026 2.970 20.783 1.00 0.00 H new ATOM 0 HD13 LEU A 55 13.770 1.593 21.880 1.00 0.00 H new ATOM 0 HD21 LEU A 55 12.257 -0.079 19.793 1.00 0.00 H new ATOM 0 HD22 LEU A 55 11.746 0.076 21.490 1.00 0.00 H new ATOM 0 HD23 LEU A 55 10.611 0.476 20.179 1.00 0.00 H new ATOM 805 N ASN A 56 7.689 3.032 22.067 1.00 0.00 N ATOM 806 CA ASN A 56 6.472 2.527 22.700 1.00 0.00 C ATOM 807 C ASN A 56 5.658 1.584 21.781 1.00 0.00 C ATOM 808 O ASN A 56 4.456 1.768 21.585 1.00 0.00 O ATOM 809 CB ASN A 56 5.673 3.760 23.169 1.00 0.00 C ATOM 810 CG ASN A 56 5.278 4.694 22.027 1.00 0.00 C ATOM 811 OD1 ASN A 56 6.094 5.435 21.489 1.00 0.00 O ATOM 812 ND2 ASN A 56 4.026 4.666 21.622 1.00 0.00 N ATOM 0 H ASN A 56 7.607 4.029 21.866 1.00 0.00 H new ATOM 0 HA ASN A 56 6.721 1.895 23.552 1.00 0.00 H new ATOM 0 HB2 ASN A 56 4.772 3.426 23.684 1.00 0.00 H new ATOM 0 HB3 ASN A 56 6.268 4.315 23.894 1.00 0.00 H new ATOM 0 HD21 ASN A 56 3.725 5.265 20.853 1.00 0.00 H new ATOM 0 HD22 ASN A 56 3.356 4.046 22.077 1.00 0.00 H new ATOM 819 N ASP A 57 6.319 0.571 21.211 1.00 0.00 N ATOM 820 CA ASP A 57 5.837 -0.249 20.089 1.00 0.00 C ATOM 821 C ASP A 57 4.516 -0.998 20.340 1.00 0.00 C ATOM 822 O ASP A 57 3.830 -1.384 19.397 1.00 0.00 O ATOM 823 CB ASP A 57 6.952 -1.209 19.662 1.00 0.00 C ATOM 824 CG ASP A 57 6.727 -1.721 18.238 1.00 0.00 C ATOM 825 OD1 ASP A 57 6.395 -0.875 17.372 1.00 0.00 O ATOM 826 OD2 ASP A 57 6.932 -2.932 18.014 1.00 0.00 O ATOM 0 H ASP A 57 7.245 0.286 21.531 1.00 0.00 H new ATOM 0 HA ASP A 57 5.591 0.443 19.283 1.00 0.00 H new ATOM 0 HB2 ASP A 57 7.915 -0.701 19.721 1.00 0.00 H new ATOM 0 HB3 ASP A 57 6.994 -2.052 20.352 1.00 0.00 H new ATOM 831 N LEU A 58 4.107 -1.121 21.607 1.00 0.00 N ATOM 832 CA LEU A 58 2.789 -1.593 22.032 1.00 0.00 C ATOM 833 C LEU A 58 1.599 -0.770 21.492 1.00 0.00 C ATOM 834 O LEU A 58 0.452 -1.189 21.656 1.00 0.00 O ATOM 835 CB LEU A 58 2.766 -1.749 23.568 1.00 0.00 C ATOM 836 CG LEU A 58 3.243 -0.554 24.425 1.00 0.00 C ATOM 837 CD1 LEU A 58 2.384 0.706 24.277 1.00 0.00 C ATOM 838 CD2 LEU A 58 3.226 -0.966 25.900 1.00 0.00 C ATOM 0 H LEU A 58 4.711 -0.885 22.394 1.00 0.00 H new ATOM 0 HA LEU A 58 2.640 -2.570 21.573 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.744 -1.986 23.865 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.381 -2.611 23.826 1.00 0.00 H new ATOM 0 HG LEU A 58 4.243 -0.305 24.070 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.786 1.497 24.911 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.394 1.033 23.237 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.360 0.485 24.578 1.00 0.00 H new ATOM 0 HD21 LEU A 58 3.561 -0.131 26.515 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.213 -1.245 26.188 1.00 0.00 H new ATOM 0 HD23 LEU A 58 3.893 -1.816 26.048 1.00 0.00 H new ATOM 850 N THR A 59 1.809 0.387 20.846 1.00 0.00 N ATOM 851 CA THR A 59 0.770 1.077 20.061 1.00 0.00 C ATOM 852 C THR A 59 1.399 1.975 18.978 1.00 0.00 C ATOM 853 O THR A 59 1.894 3.050 19.322 1.00 0.00 O ATOM 854 CB THR A 59 -0.177 1.900 20.960 1.00 0.00 C ATOM 855 OG1 THR A 59 -0.749 1.088 21.960 1.00 0.00 O ATOM 856 CG2 THR A 59 -1.355 2.470 20.164 1.00 0.00 C ATOM 0 H THR A 59 2.706 0.873 20.852 1.00 0.00 H new ATOM 0 HA THR A 59 0.176 0.306 19.570 1.00 0.00 H new ATOM 0 HB THR A 59 0.431 2.698 21.385 1.00 0.00 H new ATOM 0 HG1 THR A 59 -0.637 0.145 21.719 1.00 0.00 H new ATOM 0 HG21 THR A 59 -2.000 3.043 20.829 1.00 0.00 H new ATOM 0 HG22 THR A 59 -0.980 3.120 19.374 1.00 0.00 H new ATOM 0 HG23 THR A 59 -1.925 1.653 19.722 1.00 0.00 H new ATOM 864 N PRO A 60 1.379 1.577 17.685 1.00 0.00 N ATOM 865 CA PRO A 60 1.776 2.405 16.539 1.00 0.00 C ATOM 866 C PRO A 60 1.209 3.833 16.577 1.00 0.00 C ATOM 867 O PRO A 60 -0.008 4.011 16.491 1.00 0.00 O ATOM 868 CB PRO A 60 1.314 1.636 15.296 1.00 0.00 C ATOM 869 CG PRO A 60 1.416 0.183 15.748 1.00 0.00 C ATOM 870 CD PRO A 60 0.979 0.257 17.211 1.00 0.00 C ATOM 0 HA PRO A 60 2.855 2.561 16.546 1.00 0.00 H new ATOM 0 HB2 PRO A 60 0.296 1.901 15.010 1.00 0.00 H new ATOM 0 HB3 PRO A 60 1.950 1.838 14.434 1.00 0.00 H new ATOM 0 HG2 PRO A 60 0.767 -0.470 15.164 1.00 0.00 H new ATOM 0 HG3 PRO A 60 2.431 -0.203 15.647 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -0.098 0.119 17.304 1.00 0.00 H new ATOM 0 HD3 PRO A 60 1.453 -0.529 17.800 1.00 0.00 H new ATOM 878 N VAL A 61 2.088 4.840 16.685 1.00 0.00 N ATOM 879 CA VAL A 61 1.755 6.284 16.735 1.00 0.00 C ATOM 880 C VAL A 61 1.905 6.945 15.355 1.00 0.00 C ATOM 881 O VAL A 61 1.273 7.964 15.069 1.00 0.00 O ATOM 882 CB VAL A 61 2.627 7.042 17.768 1.00 0.00 C ATOM 883 CG1 VAL A 61 2.013 8.402 18.133 1.00 0.00 C ATOM 884 CG2 VAL A 61 2.823 6.282 19.087 1.00 0.00 C ATOM 0 H VAL A 61 3.092 4.671 16.743 1.00 0.00 H new ATOM 0 HA VAL A 61 0.713 6.349 17.047 1.00 0.00 H new ATOM 0 HB VAL A 61 3.590 7.156 17.271 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.651 8.906 18.859 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.929 9.016 17.236 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.023 8.251 18.563 1.00 0.00 H new ATOM 0 HG21 VAL A 61 3.443 6.874 19.760 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.853 6.103 19.551 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.312 5.328 18.888 1.00 0.00 H new ATOM 894 N GLY A 62 2.703 6.337 14.475 1.00 0.00 N ATOM 895 CA GLY A 62 2.733 6.581 13.040 1.00 0.00 C ATOM 896 C GLY A 62 2.014 5.464 12.277 1.00 0.00 C ATOM 897 O GLY A 62 1.387 4.584 12.874 1.00 0.00 O ATOM 0 H GLY A 62 3.377 5.627 14.762 1.00 0.00 H new ATOM 0 HA2 GLY A 62 2.260 7.538 12.821 1.00 0.00 H new ATOM 0 HA3 GLY A 62 3.767 6.651 12.701 1.00 0.00 H new ATOM 901 N ARG A 63 2.133 5.480 10.945 1.00 0.00 N ATOM 902 CA ARG A 63 1.567 4.446 10.071 1.00 0.00 C ATOM 903 C ARG A 63 2.568 3.909 9.052 1.00 0.00 C ATOM 904 O ARG A 63 3.692 4.391 8.935 1.00 0.00 O ATOM 905 CB ARG A 63 0.270 4.945 9.407 1.00 0.00 C ATOM 906 CG ARG A 63 0.480 5.911 8.220 1.00 0.00 C ATOM 907 CD ARG A 63 0.057 7.338 8.547 1.00 0.00 C ATOM 908 NE ARG A 63 -1.391 7.420 8.747 1.00 0.00 N ATOM 909 CZ ARG A 63 -2.156 8.494 8.735 1.00 0.00 C ATOM 910 NH1 ARG A 63 -1.685 9.713 8.614 1.00 0.00 N ATOM 911 NH2 ARG A 63 -3.444 8.296 8.846 1.00 0.00 N ATOM 0 H ARG A 63 2.628 6.215 10.440 1.00 0.00 H new ATOM 0 HA ARG A 63 1.316 3.595 10.704 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -0.299 4.083 9.059 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.338 5.445 10.161 1.00 0.00 H new ATOM 0 HG2 ARG A 63 1.531 5.904 7.932 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.088 5.555 7.361 1.00 0.00 H new ATOM 0 HD2 ARG A 63 0.572 7.678 9.446 1.00 0.00 H new ATOM 0 HD3 ARG A 63 0.355 8.005 7.738 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.868 6.535 8.917 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -0.680 9.865 8.523 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.323 10.508 8.611 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.808 7.348 8.936 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.084 9.090 8.843 1.00 0.00 H new ATOM 925 N LEU A 64 2.100 2.924 8.293 1.00 0.00 N ATOM 926 CA LEU A 64 2.767 2.262 7.183 1.00 0.00 C ATOM 927 C LEU A 64 2.076 2.755 5.908 1.00 0.00 C ATOM 928 O LEU A 64 0.913 2.435 5.675 1.00 0.00 O ATOM 929 CB LEU A 64 2.603 0.749 7.361 1.00 0.00 C ATOM 930 CG LEU A 64 3.448 0.072 8.462 1.00 0.00 C ATOM 931 CD1 LEU A 64 3.481 0.721 9.852 1.00 0.00 C ATOM 932 CD2 LEU A 64 2.842 -1.312 8.643 1.00 0.00 C ATOM 0 H LEU A 64 1.169 2.539 8.453 1.00 0.00 H new ATOM 0 HA LEU A 64 3.833 2.483 7.134 1.00 0.00 H new ATOM 0 HB2 LEU A 64 1.552 0.545 7.568 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.839 0.270 6.411 1.00 0.00 H new ATOM 0 HG LEU A 64 4.480 0.126 8.114 1.00 0.00 H new ATOM 0 HD11 LEU A 64 4.115 0.131 10.514 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.881 1.732 9.772 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.470 0.762 10.259 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.393 -1.853 9.412 1.00 0.00 H new ATOM 0 HD22 LEU A 64 1.799 -1.216 8.944 1.00 0.00 H new ATOM 0 HD23 LEU A 64 2.900 -1.860 7.703 1.00 0.00 H new ATOM 944 N VAL A 65 2.749 3.615 5.143 1.00 0.00 N ATOM 945 CA VAL A 65 2.137 4.394 4.059 1.00 0.00 C ATOM 946 C VAL A 65 1.947 3.529 2.813 1.00 0.00 C ATOM 947 O VAL A 65 0.884 3.568 2.202 1.00 0.00 O ATOM 948 CB VAL A 65 3.000 5.636 3.747 1.00 0.00 C ATOM 949 CG1 VAL A 65 2.426 6.501 2.619 1.00 0.00 C ATOM 950 CG2 VAL A 65 3.180 6.526 4.985 1.00 0.00 C ATOM 0 H VAL A 65 3.747 3.794 5.258 1.00 0.00 H new ATOM 0 HA VAL A 65 1.152 4.732 4.382 1.00 0.00 H new ATOM 0 HB VAL A 65 3.962 5.236 3.426 1.00 0.00 H new ATOM 0 HG11 VAL A 65 3.079 7.357 2.449 1.00 0.00 H new ATOM 0 HG12 VAL A 65 2.358 5.910 1.706 1.00 0.00 H new ATOM 0 HG13 VAL A 65 1.433 6.852 2.899 1.00 0.00 H new ATOM 0 HG21 VAL A 65 3.793 7.390 4.726 1.00 0.00 H new ATOM 0 HG22 VAL A 65 2.205 6.865 5.335 1.00 0.00 H new ATOM 0 HG23 VAL A 65 3.671 5.956 5.774 1.00 0.00 H new ATOM 960 N THR A 66 2.968 2.752 2.429 1.00 0.00 N ATOM 961 CA THR A 66 2.956 1.983 1.174 1.00 0.00 C ATOM 962 C THR A 66 1.972 0.808 1.167 1.00 0.00 C ATOM 963 O THR A 66 1.352 0.574 0.131 1.00 0.00 O ATOM 964 CB THR A 66 4.374 1.498 0.833 1.00 0.00 C ATOM 965 OG1 THR A 66 5.173 2.621 0.560 1.00 0.00 O ATOM 966 CG2 THR A 66 4.487 0.595 -0.396 1.00 0.00 C ATOM 0 H THR A 66 3.822 2.638 2.975 1.00 0.00 H new ATOM 0 HA THR A 66 2.602 2.670 0.405 1.00 0.00 H new ATOM 0 HB THR A 66 4.686 0.913 1.698 1.00 0.00 H new ATOM 0 HG1 THR A 66 5.870 2.377 -0.084 1.00 0.00 H new ATOM 0 HG21 THR A 66 5.529 0.312 -0.545 1.00 0.00 H new ATOM 0 HG22 THR A 66 3.885 -0.301 -0.245 1.00 0.00 H new ATOM 0 HG23 THR A 66 4.127 1.130 -1.275 1.00 0.00 H new ATOM 974 N VAL A 67 1.849 0.033 2.257 1.00 0.00 N ATOM 975 CA VAL A 67 1.073 -1.219 2.232 1.00 0.00 C ATOM 976 C VAL A 67 0.561 -1.651 3.614 1.00 0.00 C ATOM 977 O VAL A 67 1.216 -1.428 4.632 1.00 0.00 O ATOM 978 CB VAL A 67 1.922 -2.329 1.556 1.00 0.00 C ATOM 979 CG1 VAL A 67 3.073 -2.852 2.430 1.00 0.00 C ATOM 980 CG2 VAL A 67 1.068 -3.505 1.068 1.00 0.00 C ATOM 0 H VAL A 67 2.273 0.248 3.160 1.00 0.00 H new ATOM 0 HA VAL A 67 0.172 -1.041 1.646 1.00 0.00 H new ATOM 0 HB VAL A 67 2.369 -1.835 0.693 1.00 0.00 H new ATOM 0 HG11 VAL A 67 3.619 -3.624 1.888 1.00 0.00 H new ATOM 0 HG12 VAL A 67 3.749 -2.031 2.671 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.669 -3.272 3.351 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.710 -4.253 0.603 1.00 0.00 H new ATOM 0 HG22 VAL A 67 0.545 -3.951 1.914 1.00 0.00 H new ATOM 0 HG23 VAL A 67 0.340 -3.148 0.339 1.00 0.00 H new ATOM 990 N ASN A 68 -0.588 -2.339 3.624 1.00 0.00 N ATOM 991 CA ASN A 68 -1.079 -3.152 4.738 1.00 0.00 C ATOM 992 C ASN A 68 -0.084 -4.304 5.024 1.00 0.00 C ATOM 993 O ASN A 68 0.165 -5.112 4.127 1.00 0.00 O ATOM 994 CB ASN A 68 -2.474 -3.690 4.368 1.00 0.00 C ATOM 995 CG ASN A 68 -2.982 -4.752 5.338 1.00 0.00 C ATOM 996 OD1 ASN A 68 -2.721 -4.729 6.529 1.00 0.00 O ATOM 997 ND2 ASN A 68 -3.710 -5.736 4.850 1.00 0.00 N ATOM 0 H ASN A 68 -1.223 -2.343 2.826 1.00 0.00 H new ATOM 0 HA ASN A 68 -1.159 -2.554 5.646 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -3.182 -2.861 4.343 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -2.440 -4.111 3.363 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.052 -6.472 5.468 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -3.932 -5.761 3.855 1.00 0.00 H new ATOM 1004 N PRO A 69 0.508 -4.400 6.229 1.00 0.00 N ATOM 1005 CA PRO A 69 1.620 -5.311 6.503 1.00 0.00 C ATOM 1006 C PRO A 69 1.208 -6.799 6.542 1.00 0.00 C ATOM 1007 O PRO A 69 0.863 -7.340 7.596 1.00 0.00 O ATOM 1008 CB PRO A 69 2.221 -4.798 7.815 1.00 0.00 C ATOM 1009 CG PRO A 69 1.040 -4.151 8.530 1.00 0.00 C ATOM 1010 CD PRO A 69 0.251 -3.543 7.379 1.00 0.00 C ATOM 0 HA PRO A 69 2.355 -5.304 5.698 1.00 0.00 H new ATOM 0 HB2 PRO A 69 2.648 -5.610 8.403 1.00 0.00 H new ATOM 0 HB3 PRO A 69 3.021 -4.080 7.634 1.00 0.00 H new ATOM 0 HG2 PRO A 69 0.451 -4.882 9.084 1.00 0.00 H new ATOM 0 HG3 PRO A 69 1.363 -3.394 9.245 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -0.814 -3.507 7.610 1.00 0.00 H new ATOM 0 HD3 PRO A 69 0.570 -2.519 7.183 1.00 0.00 H new ATOM 1018 N PHE A 70 1.268 -7.468 5.383 1.00 0.00 N ATOM 1019 CA PHE A 70 0.972 -8.892 5.180 1.00 0.00 C ATOM 1020 C PHE A 70 1.845 -9.498 4.058 1.00 0.00 C ATOM 1021 O PHE A 70 1.877 -8.985 2.942 1.00 0.00 O ATOM 1022 CB PHE A 70 -0.531 -9.022 4.883 1.00 0.00 C ATOM 1023 CG PHE A 70 -1.001 -10.382 4.397 1.00 0.00 C ATOM 1024 CD1 PHE A 70 -0.811 -11.534 5.184 1.00 0.00 C ATOM 1025 CD2 PHE A 70 -1.666 -10.488 3.161 1.00 0.00 C ATOM 1026 CE1 PHE A 70 -1.279 -12.783 4.736 1.00 0.00 C ATOM 1027 CE2 PHE A 70 -2.145 -11.732 2.718 1.00 0.00 C ATOM 1028 CZ PHE A 70 -1.953 -12.880 3.507 1.00 0.00 C ATOM 0 H PHE A 70 1.539 -7.005 4.515 1.00 0.00 H new ATOM 0 HA PHE A 70 1.215 -9.459 6.079 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -1.083 -8.772 5.789 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -0.798 -8.278 4.132 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -0.304 -11.459 6.135 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -1.809 -9.609 2.550 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -1.120 -13.667 5.336 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -2.660 -11.807 1.772 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.324 -13.836 3.168 1.00 0.00 H new ATOM 1038 N VAL A 71 2.553 -10.596 4.356 1.00 0.00 N ATOM 1039 CA VAL A 71 3.378 -11.389 3.431 1.00 0.00 C ATOM 1040 C VAL A 71 2.492 -12.464 2.800 1.00 0.00 C ATOM 1041 O VAL A 71 2.361 -13.567 3.327 1.00 0.00 O ATOM 1042 CB VAL A 71 4.592 -12.041 4.141 1.00 0.00 C ATOM 1043 CG1 VAL A 71 5.531 -12.712 3.134 1.00 0.00 C ATOM 1044 CG2 VAL A 71 5.407 -11.018 4.932 1.00 0.00 C ATOM 0 H VAL A 71 2.567 -10.977 5.302 1.00 0.00 H new ATOM 0 HA VAL A 71 3.783 -10.726 2.666 1.00 0.00 H new ATOM 0 HB VAL A 71 4.178 -12.784 4.823 1.00 0.00 H new ATOM 0 HG11 VAL A 71 6.372 -13.160 3.663 1.00 0.00 H new ATOM 0 HG12 VAL A 71 4.989 -13.487 2.592 1.00 0.00 H new ATOM 0 HG13 VAL A 71 5.901 -11.967 2.429 1.00 0.00 H new ATOM 0 HG21 VAL A 71 6.248 -11.517 5.414 1.00 0.00 H new ATOM 0 HG22 VAL A 71 5.780 -10.249 4.256 1.00 0.00 H new ATOM 0 HG23 VAL A 71 4.775 -10.558 5.691 1.00 0.00 H new ATOM 1054 N SER A 72 1.847 -12.138 1.679 1.00 0.00 N ATOM 1055 CA SER A 72 0.808 -12.991 1.088 1.00 0.00 C ATOM 1056 C SER A 72 1.289 -14.308 0.452 1.00 0.00 C ATOM 1057 O SER A 72 0.434 -15.096 0.043 1.00 0.00 O ATOM 1058 CB SER A 72 0.027 -12.190 0.039 1.00 0.00 C ATOM 1059 OG SER A 72 -1.086 -12.948 -0.389 1.00 0.00 O ATOM 0 H SER A 72 2.027 -11.281 1.156 1.00 0.00 H new ATOM 0 HA SER A 72 0.187 -13.292 1.932 1.00 0.00 H new ATOM 0 HB2 SER A 72 -0.304 -11.241 0.461 1.00 0.00 H new ATOM 0 HB3 SER A 72 0.670 -11.955 -0.809 1.00 0.00 H new ATOM 0 HG SER A 72 -0.848 -13.899 -0.403 1.00 0.00 H new ATOM 1065 N VAL A 73 2.600 -14.536 0.299 1.00 0.00 N ATOM 1066 CA VAL A 73 3.171 -15.612 -0.532 1.00 0.00 C ATOM 1067 C VAL A 73 4.579 -16.013 -0.077 1.00 0.00 C ATOM 1068 O VAL A 73 5.329 -15.193 0.445 1.00 0.00 O ATOM 1069 CB VAL A 73 3.258 -15.182 -2.020 1.00 0.00 C ATOM 1070 CG1 VAL A 73 1.952 -15.425 -2.780 1.00 0.00 C ATOM 1071 CG2 VAL A 73 3.692 -13.718 -2.219 1.00 0.00 C ATOM 0 H VAL A 73 3.311 -13.967 0.758 1.00 0.00 H new ATOM 0 HA VAL A 73 2.500 -16.464 -0.419 1.00 0.00 H new ATOM 0 HB VAL A 73 4.038 -15.821 -2.434 1.00 0.00 H new ATOM 0 HG11 VAL A 73 2.069 -15.106 -3.816 1.00 0.00 H new ATOM 0 HG12 VAL A 73 1.707 -16.487 -2.753 1.00 0.00 H new ATOM 0 HG13 VAL A 73 1.148 -14.855 -2.314 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.730 -13.491 -3.285 1.00 0.00 H new ATOM 0 HG22 VAL A 73 2.975 -13.057 -1.733 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.679 -13.568 -1.781 1.00 0.00 H new ATOM 1081 N ALA A 74 4.983 -17.254 -0.386 1.00 0.00 N ATOM 1082 CA ALA A 74 6.370 -17.719 -0.277 1.00 0.00 C ATOM 1083 C ALA A 74 7.294 -17.092 -1.343 1.00 0.00 C ATOM 1084 O ALA A 74 8.510 -17.036 -1.159 1.00 0.00 O ATOM 1085 CB ALA A 74 6.371 -19.247 -0.392 1.00 0.00 C ATOM 0 H ALA A 74 4.343 -17.973 -0.724 1.00 0.00 H new ATOM 0 HA ALA A 74 6.768 -17.404 0.688 1.00 0.00 H new ATOM 0 HB1 ALA A 74 7.393 -19.617 -0.314 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.769 -19.673 0.410 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.952 -19.540 -1.355 1.00 0.00 H new ATOM 1091 N THR A 75 6.716 -16.568 -2.435 1.00 0.00 N ATOM 1092 CA THR A 75 7.403 -15.842 -3.516 1.00 0.00 C ATOM 1093 C THR A 75 7.756 -14.391 -3.141 1.00 0.00 C ATOM 1094 O THR A 75 8.139 -13.608 -4.006 1.00 0.00 O ATOM 1095 CB THR A 75 6.583 -15.857 -4.820 1.00 0.00 C ATOM 1096 OG1 THR A 75 5.427 -15.064 -4.688 1.00 0.00 O ATOM 1097 CG2 THR A 75 6.137 -17.257 -5.247 1.00 0.00 C ATOM 0 H THR A 75 5.712 -16.642 -2.596 1.00 0.00 H new ATOM 0 HA THR A 75 8.339 -16.377 -3.676 1.00 0.00 H new ATOM 0 HB THR A 75 7.253 -15.462 -5.584 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.919 -15.084 -5.526 1.00 0.00 H new ATOM 0 HG21 THR A 75 5.565 -17.190 -6.172 1.00 0.00 H new ATOM 0 HG22 THR A 75 7.013 -17.885 -5.407 1.00 0.00 H new ATOM 0 HG23 THR A 75 5.515 -17.694 -4.466 1.00 0.00 H new ATOM 1105 N ALA A 76 7.608 -13.995 -1.871 1.00 0.00 N ATOM 1106 CA ALA A 76 7.861 -12.649 -1.346 1.00 0.00 C ATOM 1107 C ALA A 76 9.342 -12.207 -1.352 1.00 0.00 C ATOM 1108 O ALA A 76 9.660 -11.178 -0.763 1.00 0.00 O ATOM 1109 CB ALA A 76 7.283 -12.593 0.073 1.00 0.00 C ATOM 0 H ALA A 76 7.292 -14.638 -1.145 1.00 0.00 H new ATOM 0 HA ALA A 76 7.375 -11.941 -2.017 1.00 0.00 H new ATOM 0 HB1 ALA A 76 7.453 -11.603 0.496 1.00 0.00 H new ATOM 0 HB2 ALA A 76 6.212 -12.793 0.038 1.00 0.00 H new ATOM 0 HB3 ALA A 76 7.772 -13.343 0.695 1.00 0.00 H new ATOM 1115 N ASN A 77 10.239 -12.959 -2.005 1.00 0.00 N ATOM 1116 CA ASN A 77 11.717 -12.956 -1.941 1.00 0.00 C ATOM 1117 C ASN A 77 12.398 -11.665 -2.473 1.00 0.00 C ATOM 1118 O ASN A 77 13.544 -11.693 -2.918 1.00 0.00 O ATOM 1119 CB ASN A 77 12.245 -14.225 -2.656 1.00 0.00 C ATOM 1120 CG ASN A 77 11.288 -15.410 -2.593 1.00 0.00 C ATOM 1121 OD1 ASN A 77 10.602 -15.697 -3.558 1.00 0.00 O ATOM 1122 ND2 ASN A 77 11.113 -16.048 -1.456 1.00 0.00 N ATOM 0 H ASN A 77 9.915 -13.665 -2.666 1.00 0.00 H new ATOM 0 HA ASN A 77 11.991 -12.968 -0.886 1.00 0.00 H new ATOM 0 HB2 ASN A 77 12.444 -13.986 -3.701 1.00 0.00 H new ATOM 0 HB3 ASN A 77 13.196 -14.514 -2.208 1.00 0.00 H new ATOM 0 HD21 ASN A 77 10.405 -16.779 -1.385 1.00 0.00 H new ATOM 0 HD22 ASN A 77 11.685 -15.811 -0.645 1.00 0.00 H new ATOM 1129 N ALA A 78 11.674 -10.545 -2.492 1.00 0.00 N ATOM 1130 CA ALA A 78 12.035 -9.285 -3.122 1.00 0.00 C ATOM 1131 C ALA A 78 12.967 -8.400 -2.274 1.00 0.00 C ATOM 1132 O ALA A 78 13.097 -8.550 -1.057 1.00 0.00 O ATOM 1133 CB ALA A 78 10.724 -8.541 -3.422 1.00 0.00 C ATOM 0 H ALA A 78 10.762 -10.496 -2.037 1.00 0.00 H new ATOM 0 HA ALA A 78 12.603 -9.505 -4.026 1.00 0.00 H new ATOM 0 HB1 ALA A 78 10.948 -7.586 -3.897 1.00 0.00 H new ATOM 0 HB2 ALA A 78 10.109 -9.143 -4.090 1.00 0.00 H new ATOM 0 HB3 ALA A 78 10.184 -8.365 -2.491 1.00 0.00 H new ATOM 1139 N LYS A 79 13.538 -7.398 -2.955 1.00 0.00 N ATOM 1140 CA LYS A 79 14.150 -6.175 -2.429 1.00 0.00 C ATOM 1141 C LYS A 79 13.108 -5.063 -2.605 1.00 0.00 C ATOM 1142 O LYS A 79 12.753 -4.730 -3.733 1.00 0.00 O ATOM 1143 CB LYS A 79 15.494 -5.968 -3.160 1.00 0.00 C ATOM 1144 CG LYS A 79 16.121 -4.560 -3.138 1.00 0.00 C ATOM 1145 CD LYS A 79 15.692 -3.684 -4.335 1.00 0.00 C ATOM 1146 CE LYS A 79 16.827 -2.802 -4.878 1.00 0.00 C ATOM 1147 NZ LYS A 79 17.097 -1.634 -4.013 1.00 0.00 N ATOM 0 H LYS A 79 13.587 -7.426 -3.973 1.00 0.00 H new ATOM 0 HA LYS A 79 14.403 -6.202 -1.369 1.00 0.00 H new ATOM 0 HB2 LYS A 79 16.217 -6.662 -2.732 1.00 0.00 H new ATOM 0 HB3 LYS A 79 15.355 -6.255 -4.202 1.00 0.00 H new ATOM 0 HG2 LYS A 79 15.841 -4.059 -2.211 1.00 0.00 H new ATOM 0 HG3 LYS A 79 17.207 -4.653 -3.135 1.00 0.00 H new ATOM 0 HD2 LYS A 79 15.326 -4.328 -5.135 1.00 0.00 H new ATOM 0 HD3 LYS A 79 14.860 -3.048 -4.032 1.00 0.00 H new ATOM 0 HE2 LYS A 79 17.734 -3.399 -4.971 1.00 0.00 H new ATOM 0 HE3 LYS A 79 16.568 -2.457 -5.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 17.903 -1.099 -4.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 16.257 -1.021 -3.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 17.321 -1.959 -3.051 1.00 0.00 H new ATOM 1161 N VAL A 80 12.528 -4.601 -1.492 1.00 0.00 N ATOM 1162 CA VAL A 80 11.223 -3.927 -1.435 1.00 0.00 C ATOM 1163 C VAL A 80 11.278 -2.639 -0.602 1.00 0.00 C ATOM 1164 O VAL A 80 11.646 -2.649 0.575 1.00 0.00 O ATOM 1165 CB VAL A 80 10.119 -4.908 -0.973 1.00 0.00 C ATOM 1166 CG1 VAL A 80 10.452 -5.699 0.303 1.00 0.00 C ATOM 1167 CG2 VAL A 80 8.770 -4.200 -0.788 1.00 0.00 C ATOM 0 H VAL A 80 12.967 -4.688 -0.575 1.00 0.00 H new ATOM 0 HA VAL A 80 10.959 -3.609 -2.443 1.00 0.00 H new ATOM 0 HB VAL A 80 10.055 -5.632 -1.785 1.00 0.00 H new ATOM 0 HG11 VAL A 80 9.621 -6.360 0.549 1.00 0.00 H new ATOM 0 HG12 VAL A 80 11.351 -6.293 0.139 1.00 0.00 H new ATOM 0 HG13 VAL A 80 10.621 -5.006 1.127 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.021 -4.923 -0.463 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.870 -3.418 -0.035 1.00 0.00 H new ATOM 0 HG23 VAL A 80 8.459 -3.756 -1.734 1.00 0.00 H new ATOM 1177 N LEU A 81 10.915 -1.531 -1.261 1.00 0.00 N ATOM 1178 CA LEU A 81 10.892 -0.153 -0.766 1.00 0.00 C ATOM 1179 C LEU A 81 9.486 0.195 -0.248 1.00 0.00 C ATOM 1180 O LEU A 81 8.491 0.002 -0.945 1.00 0.00 O ATOM 1181 CB LEU A 81 11.343 0.746 -1.938 1.00 0.00 C ATOM 1182 CG LEU A 81 11.594 2.248 -1.683 1.00 0.00 C ATOM 1183 CD1 LEU A 81 10.329 3.072 -1.432 1.00 0.00 C ATOM 1184 CD2 LEU A 81 12.597 2.494 -0.560 1.00 0.00 C ATOM 0 H LEU A 81 10.605 -1.582 -2.232 1.00 0.00 H new ATOM 0 HA LEU A 81 11.565 -0.006 0.078 1.00 0.00 H new ATOM 0 HB2 LEU A 81 12.264 0.323 -2.340 1.00 0.00 H new ATOM 0 HB3 LEU A 81 10.588 0.668 -2.720 1.00 0.00 H new ATOM 0 HG LEU A 81 12.019 2.598 -2.624 1.00 0.00 H new ATOM 0 HD11 LEU A 81 10.601 4.114 -1.263 1.00 0.00 H new ATOM 0 HD12 LEU A 81 9.673 3.005 -2.300 1.00 0.00 H new ATOM 0 HD13 LEU A 81 9.811 2.685 -0.554 1.00 0.00 H new ATOM 0 HD21 LEU A 81 12.735 3.567 -0.424 1.00 0.00 H new ATOM 0 HD22 LEU A 81 12.222 2.056 0.365 1.00 0.00 H new ATOM 0 HD23 LEU A 81 13.551 2.035 -0.818 1.00 0.00 H new ATOM 1196 N ILE A 82 9.420 0.702 0.985 1.00 0.00 N ATOM 1197 CA ILE A 82 8.211 1.001 1.757 1.00 0.00 C ATOM 1198 C ILE A 82 8.355 2.410 2.355 1.00 0.00 C ATOM 1199 O ILE A 82 9.359 2.703 3.003 1.00 0.00 O ATOM 1200 CB ILE A 82 8.054 -0.079 2.864 1.00 0.00 C ATOM 1201 CG1 ILE A 82 7.797 -1.486 2.271 1.00 0.00 C ATOM 1202 CG2 ILE A 82 6.927 0.263 3.853 1.00 0.00 C ATOM 1203 CD1 ILE A 82 8.064 -2.630 3.259 1.00 0.00 C ATOM 0 H ILE A 82 10.267 0.930 1.506 1.00 0.00 H new ATOM 0 HA ILE A 82 7.319 0.982 1.131 1.00 0.00 H new ATOM 0 HB ILE A 82 9.002 -0.089 3.401 1.00 0.00 H new ATOM 0 HG12 ILE A 82 6.763 -1.544 1.932 1.00 0.00 H new ATOM 0 HG13 ILE A 82 8.428 -1.621 1.393 1.00 0.00 H new ATOM 0 HG21 ILE A 82 6.855 -0.520 4.608 1.00 0.00 H new ATOM 0 HG22 ILE A 82 7.144 1.215 4.337 1.00 0.00 H new ATOM 0 HG23 ILE A 82 5.981 0.337 3.316 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.863 -3.585 2.773 1.00 0.00 H new ATOM 0 HD12 ILE A 82 9.105 -2.598 3.579 1.00 0.00 H new ATOM 0 HD13 ILE A 82 7.414 -2.520 4.127 1.00 0.00 H new ATOM 1215 N GLU A 83 7.356 3.283 2.182 1.00 0.00 N ATOM 1216 CA GLU A 83 7.201 4.476 3.018 1.00 0.00 C ATOM 1217 C GLU A 83 6.454 4.142 4.326 1.00 0.00 C ATOM 1218 O GLU A 83 5.437 3.440 4.320 1.00 0.00 O ATOM 1219 CB GLU A 83 6.485 5.633 2.288 1.00 0.00 C ATOM 1220 CG GLU A 83 7.409 6.455 1.366 1.00 0.00 C ATOM 1221 CD GLU A 83 6.857 7.849 0.993 1.00 0.00 C ATOM 1222 OE1 GLU A 83 5.933 8.340 1.687 1.00 0.00 O ATOM 1223 OE2 GLU A 83 7.419 8.503 0.085 1.00 0.00 O ATOM 0 H GLU A 83 6.638 3.183 1.464 1.00 0.00 H new ATOM 0 HA GLU A 83 8.211 4.814 3.253 1.00 0.00 H new ATOM 0 HB2 GLU A 83 5.666 5.225 1.696 1.00 0.00 H new ATOM 0 HB3 GLU A 83 6.042 6.298 3.029 1.00 0.00 H new ATOM 0 HG2 GLU A 83 8.375 6.579 1.856 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.586 5.890 0.451 1.00 0.00 H new ATOM 1230 N LEU A 84 6.930 4.717 5.436 1.00 0.00 N ATOM 1231 CA LEU A 84 6.276 4.793 6.750 1.00 0.00 C ATOM 1232 C LEU A 84 6.105 6.272 7.141 1.00 0.00 C ATOM 1233 O LEU A 84 6.853 7.127 6.675 1.00 0.00 O ATOM 1234 CB LEU A 84 7.125 4.043 7.805 1.00 0.00 C ATOM 1235 CG LEU A 84 6.650 2.623 8.162 1.00 0.00 C ATOM 1236 CD1 LEU A 84 6.752 1.647 6.994 1.00 0.00 C ATOM 1237 CD2 LEU A 84 7.504 2.057 9.295 1.00 0.00 C ATOM 0 H LEU A 84 7.843 5.172 5.442 1.00 0.00 H new ATOM 0 HA LEU A 84 5.295 4.321 6.704 1.00 0.00 H new ATOM 0 HB2 LEU A 84 8.151 3.982 7.441 1.00 0.00 H new ATOM 0 HB3 LEU A 84 7.145 4.639 8.717 1.00 0.00 H new ATOM 0 HG LEU A 84 5.603 2.721 8.449 1.00 0.00 H new ATOM 0 HD11 LEU A 84 6.402 0.664 7.310 1.00 0.00 H new ATOM 0 HD12 LEU A 84 6.137 2.003 6.168 1.00 0.00 H new ATOM 0 HD13 LEU A 84 7.790 1.576 6.669 1.00 0.00 H new ATOM 0 HD21 LEU A 84 7.161 1.052 9.542 1.00 0.00 H new ATOM 0 HD22 LEU A 84 8.547 2.018 8.980 1.00 0.00 H new ATOM 0 HD23 LEU A 84 7.414 2.697 10.173 1.00 0.00 H new ATOM 1249 N GLU A 85 5.161 6.580 8.036 1.00 0.00 N ATOM 1250 CA GLU A 85 4.984 7.915 8.623 1.00 0.00 C ATOM 1251 C GLU A 85 5.673 7.959 10.004 1.00 0.00 C ATOM 1252 O GLU A 85 5.203 7.282 10.926 1.00 0.00 O ATOM 1253 CB GLU A 85 3.490 8.281 8.728 1.00 0.00 C ATOM 1254 CG GLU A 85 3.304 9.782 9.017 1.00 0.00 C ATOM 1255 CD GLU A 85 1.908 10.097 9.571 1.00 0.00 C ATOM 1256 OE1 GLU A 85 0.940 10.169 8.779 1.00 0.00 O ATOM 1257 OE2 GLU A 85 1.797 10.232 10.811 1.00 0.00 O ATOM 0 H GLU A 85 4.486 5.897 8.380 1.00 0.00 H new ATOM 0 HA GLU A 85 5.448 8.657 7.973 1.00 0.00 H new ATOM 0 HB2 GLU A 85 2.983 8.021 7.799 1.00 0.00 H new ATOM 0 HB3 GLU A 85 3.024 7.695 9.520 1.00 0.00 H new ATOM 0 HG2 GLU A 85 4.059 10.109 9.732 1.00 0.00 H new ATOM 0 HG3 GLU A 85 3.466 10.350 8.101 1.00 0.00 H new ATOM 1264 N PRO A 86 6.795 8.689 10.163 1.00 0.00 N ATOM 1265 CA PRO A 86 7.440 8.973 11.438 1.00 0.00 C ATOM 1266 C PRO A 86 6.931 10.319 12.009 1.00 0.00 C ATOM 1267 O PRO A 86 7.145 11.364 11.376 1.00 0.00 O ATOM 1268 CB PRO A 86 8.928 9.038 11.092 1.00 0.00 C ATOM 1269 CG PRO A 86 8.940 9.653 9.696 1.00 0.00 C ATOM 1270 CD PRO A 86 7.579 9.299 9.103 1.00 0.00 C ATOM 0 HA PRO A 86 7.230 8.225 12.202 1.00 0.00 H new ATOM 0 HB2 PRO A 86 9.480 9.650 11.805 1.00 0.00 H new ATOM 0 HB3 PRO A 86 9.386 8.049 11.099 1.00 0.00 H new ATOM 0 HG2 PRO A 86 9.084 10.733 9.740 1.00 0.00 H new ATOM 0 HG3 PRO A 86 9.752 9.248 9.092 1.00 0.00 H new ATOM 0 HD2 PRO A 86 7.082 10.191 8.721 1.00 0.00 H new ATOM 0 HD3 PRO A 86 7.692 8.613 8.264 1.00 0.00 H new ATOM 1278 N PRO A 87 6.255 10.326 13.176 1.00 0.00 N ATOM 1279 CA PRO A 87 5.902 11.542 13.916 1.00 0.00 C ATOM 1280 C PRO A 87 7.024 12.592 14.044 1.00 0.00 C ATOM 1281 O PRO A 87 8.216 12.302 13.938 1.00 0.00 O ATOM 1282 CB PRO A 87 5.450 11.041 15.292 1.00 0.00 C ATOM 1283 CG PRO A 87 4.836 9.678 14.977 1.00 0.00 C ATOM 1284 CD PRO A 87 5.747 9.150 13.874 1.00 0.00 C ATOM 0 HA PRO A 87 5.131 12.086 13.371 1.00 0.00 H new ATOM 0 HB2 PRO A 87 6.287 10.956 15.985 1.00 0.00 H new ATOM 0 HB3 PRO A 87 4.725 11.715 15.748 1.00 0.00 H new ATOM 0 HG2 PRO A 87 4.833 9.023 15.849 1.00 0.00 H new ATOM 0 HG3 PRO A 87 3.803 9.767 14.642 1.00 0.00 H new ATOM 0 HD2 PRO A 87 6.564 8.561 14.291 1.00 0.00 H new ATOM 0 HD3 PRO A 87 5.199 8.499 13.193 1.00 0.00 H new ATOM 1292 N PHE A 88 6.637 13.847 14.292 1.00 0.00 N ATOM 1293 CA PHE A 88 7.587 14.935 14.530 1.00 0.00 C ATOM 1294 C PHE A 88 8.213 14.872 15.928 1.00 0.00 C ATOM 1295 O PHE A 88 7.711 14.210 16.837 1.00 0.00 O ATOM 1296 CB PHE A 88 6.905 16.282 14.254 1.00 0.00 C ATOM 1297 CG PHE A 88 6.782 16.558 12.769 1.00 0.00 C ATOM 1298 CD1 PHE A 88 7.887 17.078 12.067 1.00 0.00 C ATOM 1299 CD2 PHE A 88 5.593 16.257 12.076 1.00 0.00 C ATOM 1300 CE1 PHE A 88 7.803 17.304 10.682 1.00 0.00 C ATOM 1301 CE2 PHE A 88 5.509 16.482 10.690 1.00 0.00 C ATOM 1302 CZ PHE A 88 6.612 17.007 9.993 1.00 0.00 C ATOM 0 H PHE A 88 5.659 14.135 14.333 1.00 0.00 H new ATOM 0 HA PHE A 88 8.421 14.821 13.837 1.00 0.00 H new ATOM 0 HB2 PHE A 88 5.914 16.287 14.708 1.00 0.00 H new ATOM 0 HB3 PHE A 88 7.476 17.082 14.726 1.00 0.00 H new ATOM 0 HD1 PHE A 88 8.802 17.304 12.595 1.00 0.00 H new ATOM 0 HD2 PHE A 88 4.745 15.853 12.609 1.00 0.00 H new ATOM 0 HE1 PHE A 88 8.651 17.705 10.147 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.596 16.251 10.160 1.00 0.00 H new ATOM 0 HZ PHE A 88 6.545 17.182 8.929 1.00 0.00 H new ATOM 1312 N GLY A 89 9.345 15.564 16.084 1.00 0.00 N ATOM 1313 CA GLY A 89 10.201 15.471 17.253 1.00 0.00 C ATOM 1314 C GLY A 89 11.092 14.240 17.165 1.00 0.00 C ATOM 1315 O GLY A 89 12.259 14.340 16.790 1.00 0.00 O ATOM 0 H GLY A 89 9.693 16.217 15.381 1.00 0.00 H new ATOM 0 HA2 GLY A 89 10.816 16.367 17.333 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.591 15.422 18.155 1.00 0.00 H new ATOM 1319 N ASP A 90 10.532 13.074 17.479 1.00 0.00 N ATOM 1320 CA ASP A 90 11.253 11.804 17.560 1.00 0.00 C ATOM 1321 C ASP A 90 10.444 10.685 16.892 1.00 0.00 C ATOM 1322 O ASP A 90 9.226 10.786 16.713 1.00 0.00 O ATOM 1323 CB ASP A 90 11.548 11.498 19.048 1.00 0.00 C ATOM 1324 CG ASP A 90 12.997 11.097 19.324 1.00 0.00 C ATOM 1325 OD1 ASP A 90 13.911 11.681 18.697 1.00 0.00 O ATOM 1326 OD2 ASP A 90 13.230 10.267 20.229 1.00 0.00 O ATOM 0 H ASP A 90 9.538 12.983 17.690 1.00 0.00 H new ATOM 0 HA ASP A 90 12.199 11.871 17.023 1.00 0.00 H new ATOM 0 HB2 ASP A 90 11.305 12.377 19.644 1.00 0.00 H new ATOM 0 HB3 ASP A 90 10.890 10.695 19.381 1.00 0.00 H new ATOM 1331 N SER A 91 11.109 9.601 16.488 1.00 0.00 N ATOM 1332 CA SER A 91 10.441 8.418 15.948 1.00 0.00 C ATOM 1333 C SER A 91 11.309 7.173 16.042 1.00 0.00 C ATOM 1334 O SER A 91 12.532 7.245 16.099 1.00 0.00 O ATOM 1335 CB SER A 91 10.061 8.650 14.486 1.00 0.00 C ATOM 1336 OG SER A 91 8.943 9.501 14.453 1.00 0.00 O ATOM 0 H SER A 91 12.125 9.520 16.526 1.00 0.00 H new ATOM 0 HA SER A 91 9.547 8.255 16.551 1.00 0.00 H new ATOM 0 HB2 SER A 91 10.894 9.096 13.943 1.00 0.00 H new ATOM 0 HB3 SER A 91 9.832 7.703 13.998 1.00 0.00 H new ATOM 0 HG SER A 91 8.720 9.784 15.364 1.00 0.00 H new ATOM 1342 N TYR A 92 10.659 6.013 16.036 1.00 0.00 N ATOM 1343 CA TYR A 92 11.300 4.711 16.091 1.00 0.00 C ATOM 1344 C TYR A 92 10.489 3.720 15.261 1.00 0.00 C ATOM 1345 O TYR A 92 9.256 3.702 15.301 1.00 0.00 O ATOM 1346 CB TYR A 92 11.452 4.241 17.545 1.00 0.00 C ATOM 1347 CG TYR A 92 12.213 5.208 18.438 1.00 0.00 C ATOM 1348 CD1 TYR A 92 11.550 6.329 18.981 1.00 0.00 C ATOM 1349 CD2 TYR A 92 13.597 5.047 18.642 1.00 0.00 C ATOM 1350 CE1 TYR A 92 12.274 7.319 19.667 1.00 0.00 C ATOM 1351 CE2 TYR A 92 14.323 6.027 19.348 1.00 0.00 C ATOM 1352 CZ TYR A 92 13.668 7.178 19.839 1.00 0.00 C ATOM 1353 OH TYR A 92 14.387 8.164 20.439 1.00 0.00 O ATOM 0 H TYR A 92 9.642 5.956 15.991 1.00 0.00 H new ATOM 0 HA TYR A 92 12.304 4.779 15.672 1.00 0.00 H new ATOM 0 HB2 TYR A 92 10.461 4.078 17.967 1.00 0.00 H new ATOM 0 HB3 TYR A 92 11.964 3.279 17.552 1.00 0.00 H new ATOM 0 HD1 TYR A 92 10.480 6.427 18.869 1.00 0.00 H new ATOM 0 HD2 TYR A 92 14.102 4.173 18.258 1.00 0.00 H new ATOM 0 HE1 TYR A 92 11.765 8.186 20.062 1.00 0.00 H new ATOM 0 HE2 TYR A 92 15.382 5.898 19.514 1.00 0.00 H new ATOM 0 HH TYR A 92 13.777 8.845 20.793 1.00 0.00 H new ATOM 1363 N ILE A 93 11.216 2.916 14.492 1.00 0.00 N ATOM 1364 CA ILE A 93 10.715 2.045 13.442 1.00 0.00 C ATOM 1365 C ILE A 93 11.109 0.619 13.814 1.00 0.00 C ATOM 1366 O ILE A 93 12.301 0.319 13.899 1.00 0.00 O ATOM 1367 CB ILE A 93 11.309 2.481 12.083 1.00 0.00 C ATOM 1368 CG1 ILE A 93 11.139 3.987 11.756 1.00 0.00 C ATOM 1369 CG2 ILE A 93 10.727 1.606 10.969 1.00 0.00 C ATOM 1370 CD1 ILE A 93 9.696 4.498 11.659 1.00 0.00 C ATOM 0 H ILE A 93 12.229 2.854 14.593 1.00 0.00 H new ATOM 0 HA ILE A 93 9.631 2.104 13.346 1.00 0.00 H new ATOM 0 HB ILE A 93 12.387 2.336 12.156 1.00 0.00 H new ATOM 0 HG12 ILE A 93 11.657 4.565 12.522 1.00 0.00 H new ATOM 0 HG13 ILE A 93 11.640 4.191 10.810 1.00 0.00 H new ATOM 0 HG21 ILE A 93 11.145 1.912 10.010 1.00 0.00 H new ATOM 0 HG22 ILE A 93 10.978 0.562 11.158 1.00 0.00 H new ATOM 0 HG23 ILE A 93 9.643 1.720 10.946 1.00 0.00 H new ATOM 0 HD11 ILE A 93 9.702 5.563 11.427 1.00 0.00 H new ATOM 0 HD12 ILE A 93 9.171 3.958 10.871 1.00 0.00 H new ATOM 0 HD13 ILE A 93 9.188 4.337 12.610 1.00 0.00 H new ATOM 1382 N VAL A 94 10.128 -0.244 14.093 1.00 0.00 N ATOM 1383 CA VAL A 94 10.363 -1.586 14.655 1.00 0.00 C ATOM 1384 C VAL A 94 9.965 -2.652 13.636 1.00 0.00 C ATOM 1385 O VAL A 94 8.980 -2.485 12.916 1.00 0.00 O ATOM 1386 CB VAL A 94 9.639 -1.770 16.009 1.00 0.00 C ATOM 1387 CG1 VAL A 94 10.050 -3.086 16.685 1.00 0.00 C ATOM 1388 CG2 VAL A 94 9.947 -0.613 16.977 1.00 0.00 C ATOM 0 H VAL A 94 9.142 -0.035 13.936 1.00 0.00 H new ATOM 0 HA VAL A 94 11.427 -1.698 14.862 1.00 0.00 H new ATOM 0 HB VAL A 94 8.572 -1.785 15.788 1.00 0.00 H new ATOM 0 HG11 VAL A 94 9.524 -3.187 17.635 1.00 0.00 H new ATOM 0 HG12 VAL A 94 9.793 -3.924 16.037 1.00 0.00 H new ATOM 0 HG13 VAL A 94 11.125 -3.083 16.864 1.00 0.00 H new ATOM 0 HG21 VAL A 94 9.421 -0.776 17.918 1.00 0.00 H new ATOM 0 HG22 VAL A 94 11.020 -0.571 17.163 1.00 0.00 H new ATOM 0 HG23 VAL A 94 9.618 0.328 16.536 1.00 0.00 H new ATOM 1398 N VAL A 95 10.753 -3.731 13.567 1.00 0.00 N ATOM 1399 CA VAL A 95 10.679 -4.821 12.589 1.00 0.00 C ATOM 1400 C VAL A 95 10.830 -6.150 13.336 1.00 0.00 C ATOM 1401 O VAL A 95 11.946 -6.517 13.697 1.00 0.00 O ATOM 1402 CB VAL A 95 11.795 -4.669 11.522 1.00 0.00 C ATOM 1403 CG1 VAL A 95 11.730 -5.792 10.475 1.00 0.00 C ATOM 1404 CG2 VAL A 95 11.729 -3.332 10.770 1.00 0.00 C ATOM 0 H VAL A 95 11.509 -3.875 14.237 1.00 0.00 H new ATOM 0 HA VAL A 95 9.719 -4.792 12.073 1.00 0.00 H new ATOM 0 HB VAL A 95 12.728 -4.718 12.083 1.00 0.00 H new ATOM 0 HG11 VAL A 95 12.526 -5.654 9.743 1.00 0.00 H new ATOM 0 HG12 VAL A 95 11.853 -6.756 10.968 1.00 0.00 H new ATOM 0 HG13 VAL A 95 10.764 -5.763 9.970 1.00 0.00 H new ATOM 0 HG21 VAL A 95 12.535 -3.286 10.038 1.00 0.00 H new ATOM 0 HG22 VAL A 95 10.770 -3.249 10.259 1.00 0.00 H new ATOM 0 HG23 VAL A 95 11.835 -2.510 11.478 1.00 0.00 H new ATOM 1414 N GLY A 96 9.738 -6.883 13.585 1.00 0.00 N ATOM 1415 CA GLY A 96 9.815 -8.221 14.188 1.00 0.00 C ATOM 1416 C GLY A 96 8.789 -8.544 15.272 1.00 0.00 C ATOM 1417 O GLY A 96 7.962 -7.721 15.655 1.00 0.00 O ATOM 0 H GLY A 96 8.789 -6.572 13.378 1.00 0.00 H new ATOM 0 HA2 GLY A 96 9.714 -8.959 13.392 1.00 0.00 H new ATOM 0 HA3 GLY A 96 10.811 -8.346 14.614 1.00 0.00 H new ATOM 1421 N ARG A 97 8.856 -9.787 15.760 1.00 0.00 N ATOM 1422 CA ARG A 97 7.879 -10.437 16.643 1.00 0.00 C ATOM 1423 C ARG A 97 8.584 -11.119 17.818 1.00 0.00 C ATOM 1424 O ARG A 97 9.420 -11.993 17.605 1.00 0.00 O ATOM 1425 CB ARG A 97 7.020 -11.454 15.859 1.00 0.00 C ATOM 1426 CG ARG A 97 7.825 -12.382 14.913 1.00 0.00 C ATOM 1427 CD ARG A 97 7.329 -13.831 14.843 1.00 0.00 C ATOM 1428 NE ARG A 97 7.300 -14.467 16.170 1.00 0.00 N ATOM 1429 CZ ARG A 97 6.250 -14.711 16.940 1.00 0.00 C ATOM 1430 NH1 ARG A 97 5.008 -14.553 16.526 1.00 0.00 N ATOM 1431 NH2 ARG A 97 6.442 -15.104 18.175 1.00 0.00 N ATOM 0 H ARG A 97 9.638 -10.403 15.537 1.00 0.00 H new ATOM 0 HA ARG A 97 7.216 -9.668 17.040 1.00 0.00 H new ATOM 0 HB2 ARG A 97 6.470 -12.070 16.570 1.00 0.00 H new ATOM 0 HB3 ARG A 97 6.281 -10.909 15.271 1.00 0.00 H new ATOM 0 HG2 ARG A 97 7.803 -11.958 13.909 1.00 0.00 H new ATOM 0 HG3 ARG A 97 8.867 -12.386 15.234 1.00 0.00 H new ATOM 0 HD2 ARG A 97 6.329 -13.852 14.409 1.00 0.00 H new ATOM 0 HD3 ARG A 97 7.977 -14.405 14.180 1.00 0.00 H new ATOM 0 HE ARG A 97 8.203 -14.757 16.544 1.00 0.00 H new ATOM 0 HH11 ARG A 97 4.824 -14.230 15.576 1.00 0.00 H new ATOM 0 HH12 ARG A 97 4.231 -14.754 17.156 1.00 0.00 H new ATOM 0 HH21 ARG A 97 7.391 -15.218 18.532 1.00 0.00 H new ATOM 0 HH22 ARG A 97 5.643 -15.295 18.779 1.00 0.00 H new ATOM 1445 N GLY A 98 8.220 -10.730 19.045 1.00 0.00 N ATOM 1446 CA GLY A 98 8.684 -11.301 20.315 1.00 0.00 C ATOM 1447 C GLY A 98 10.169 -11.675 20.347 1.00 0.00 C ATOM 1448 O GLY A 98 11.027 -10.815 20.535 1.00 0.00 O ATOM 0 H GLY A 98 7.558 -9.967 19.187 1.00 0.00 H new ATOM 0 HA2 GLY A 98 8.487 -10.585 21.113 1.00 0.00 H new ATOM 0 HA3 GLY A 98 8.095 -12.192 20.534 1.00 0.00 H new ATOM 1452 N GLU A 99 10.461 -12.964 20.163 1.00 0.00 N ATOM 1453 CA GLU A 99 11.797 -13.562 20.178 1.00 0.00 C ATOM 1454 C GLU A 99 12.719 -13.172 19.005 1.00 0.00 C ATOM 1455 O GLU A 99 13.922 -13.410 19.090 1.00 0.00 O ATOM 1456 CB GLU A 99 11.648 -15.095 20.275 1.00 0.00 C ATOM 1457 CG GLU A 99 11.157 -15.824 19.006 1.00 0.00 C ATOM 1458 CD GLU A 99 9.754 -15.438 18.506 1.00 0.00 C ATOM 1459 OE1 GLU A 99 8.876 -15.040 19.307 1.00 0.00 O ATOM 1460 OE2 GLU A 99 9.517 -15.535 17.282 1.00 0.00 O ATOM 0 H GLU A 99 9.732 -13.656 19.990 1.00 0.00 H new ATOM 0 HA GLU A 99 12.304 -13.153 21.051 1.00 0.00 H new ATOM 0 HB2 GLU A 99 12.614 -15.514 20.556 1.00 0.00 H new ATOM 0 HB3 GLU A 99 10.955 -15.319 21.086 1.00 0.00 H new ATOM 0 HG2 GLU A 99 11.871 -15.636 18.204 1.00 0.00 H new ATOM 0 HG3 GLU A 99 11.170 -16.897 19.199 1.00 0.00 H new ATOM 1467 N GLN A 100 12.191 -12.578 17.925 1.00 0.00 N ATOM 1468 CA GLN A 100 12.952 -12.208 16.726 1.00 0.00 C ATOM 1469 C GLN A 100 12.570 -10.799 16.237 1.00 0.00 C ATOM 1470 O GLN A 100 11.545 -10.618 15.573 1.00 0.00 O ATOM 1471 CB GLN A 100 12.838 -13.318 15.654 1.00 0.00 C ATOM 1472 CG GLN A 100 11.421 -13.612 15.128 1.00 0.00 C ATOM 1473 CD GLN A 100 11.341 -14.930 14.365 1.00 0.00 C ATOM 1474 OE1 GLN A 100 11.827 -15.065 13.253 1.00 0.00 O ATOM 1475 NE2 GLN A 100 10.693 -15.938 14.911 1.00 0.00 N ATOM 0 H GLN A 100 11.202 -12.337 17.861 1.00 0.00 H new ATOM 0 HA GLN A 100 14.012 -12.139 16.970 1.00 0.00 H new ATOM 0 HB2 GLN A 100 13.467 -13.043 14.808 1.00 0.00 H new ATOM 0 HB3 GLN A 100 13.247 -14.239 16.069 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.725 -13.639 15.966 1.00 0.00 H new ATOM 0 HG3 GLN A 100 11.104 -12.799 14.475 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.283 -15.838 15.839 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.602 -16.819 14.406 1.00 0.00 H new ATOM 1484 N GLN A 101 13.379 -9.784 16.585 1.00 0.00 N ATOM 1485 CA GLN A 101 13.169 -8.404 16.130 1.00 0.00 C ATOM 1486 C GLN A 101 14.449 -7.598 15.881 1.00 0.00 C ATOM 1487 O GLN A 101 15.541 -7.964 16.312 1.00 0.00 O ATOM 1488 CB GLN A 101 12.217 -7.657 17.092 1.00 0.00 C ATOM 1489 CG GLN A 101 12.868 -7.117 18.387 1.00 0.00 C ATOM 1490 CD GLN A 101 12.763 -5.592 18.501 1.00 0.00 C ATOM 1491 OE1 GLN A 101 13.685 -4.838 18.212 1.00 0.00 O ATOM 1492 NE2 GLN A 101 11.623 -5.083 18.930 1.00 0.00 N ATOM 0 H GLN A 101 14.194 -9.899 17.188 1.00 0.00 H new ATOM 0 HA GLN A 101 12.706 -8.492 15.147 1.00 0.00 H new ATOM 0 HB2 GLN A 101 11.769 -6.821 16.555 1.00 0.00 H new ATOM 0 HB3 GLN A 101 11.405 -8.330 17.368 1.00 0.00 H new ATOM 0 HG2 GLN A 101 12.388 -7.577 19.251 1.00 0.00 H new ATOM 0 HG3 GLN A 101 13.918 -7.409 18.412 1.00 0.00 H new ATOM 0 HE21 GLN A 101 10.848 -5.700 19.174 1.00 0.00 H new ATOM 0 HE22 GLN A 101 11.517 -4.072 19.018 1.00 0.00 H new ATOM 1501 N ILE A 102 14.254 -6.455 15.221 1.00 0.00 N ATOM 1502 CA ILE A 102 15.176 -5.335 15.043 1.00 0.00 C ATOM 1503 C ILE A 102 14.380 -4.023 15.140 1.00 0.00 C ATOM 1504 O ILE A 102 13.154 -4.006 15.006 1.00 0.00 O ATOM 1505 CB ILE A 102 15.937 -5.392 13.683 1.00 0.00 C ATOM 1506 CG1 ILE A 102 15.583 -6.583 12.757 1.00 0.00 C ATOM 1507 CG2 ILE A 102 17.445 -5.346 13.986 1.00 0.00 C ATOM 1508 CD1 ILE A 102 16.107 -6.433 11.322 1.00 0.00 C ATOM 0 H ILE A 102 13.365 -6.275 14.755 1.00 0.00 H new ATOM 0 HA ILE A 102 15.930 -5.393 15.828 1.00 0.00 H new ATOM 0 HB ILE A 102 15.613 -4.528 13.103 1.00 0.00 H new ATOM 0 HG12 ILE A 102 15.989 -7.498 13.188 1.00 0.00 H new ATOM 0 HG13 ILE A 102 14.499 -6.698 12.727 1.00 0.00 H new ATOM 0 HG21 ILE A 102 18.005 -5.384 13.052 1.00 0.00 H new ATOM 0 HG22 ILE A 102 17.682 -4.422 14.514 1.00 0.00 H new ATOM 0 HG23 ILE A 102 17.717 -6.199 14.608 1.00 0.00 H new ATOM 0 HD11 ILE A 102 15.819 -7.306 10.736 1.00 0.00 H new ATOM 0 HD12 ILE A 102 15.681 -5.537 10.871 1.00 0.00 H new ATOM 0 HD13 ILE A 102 17.194 -6.350 11.338 1.00 0.00 H new ATOM 1520 N ASN A 103 15.081 -2.902 15.316 1.00 0.00 N ATOM 1521 CA ASN A 103 14.493 -1.567 15.256 1.00 0.00 C ATOM 1522 C ASN A 103 15.520 -0.524 14.783 1.00 0.00 C ATOM 1523 O ASN A 103 16.722 -0.789 14.772 1.00 0.00 O ATOM 1524 CB ASN A 103 13.873 -1.222 16.624 1.00 0.00 C ATOM 1525 CG ASN A 103 14.864 -1.254 17.777 1.00 0.00 C ATOM 1526 OD1 ASN A 103 15.506 -0.264 18.084 1.00 0.00 O ATOM 1527 ND2 ASN A 103 15.004 -2.374 18.462 1.00 0.00 N ATOM 0 H ASN A 103 16.083 -2.898 15.506 1.00 0.00 H new ATOM 0 HA ASN A 103 13.695 -1.552 14.514 1.00 0.00 H new ATOM 0 HB2 ASN A 103 13.427 -0.229 16.569 1.00 0.00 H new ATOM 0 HB3 ASN A 103 13.065 -1.923 16.833 1.00 0.00 H new ATOM 0 HD21 ASN A 103 15.650 -2.412 19.250 1.00 0.00 H new ATOM 0 HD22 ASN A 103 14.466 -3.201 18.203 1.00 0.00 H new ATOM 1534 N HIS A 104 15.033 0.656 14.385 1.00 0.00 N ATOM 1535 CA HIS A 104 15.836 1.803 13.966 1.00 0.00 C ATOM 1536 C HIS A 104 15.184 3.113 14.432 1.00 0.00 C ATOM 1537 O HIS A 104 13.974 3.294 14.313 1.00 0.00 O ATOM 1538 CB HIS A 104 15.992 1.779 12.438 1.00 0.00 C ATOM 1539 CG HIS A 104 17.104 2.662 11.926 1.00 0.00 C ATOM 1540 ND1 HIS A 104 17.093 4.037 11.813 1.00 0.00 N ATOM 1541 CD2 HIS A 104 18.313 2.222 11.460 1.00 0.00 C ATOM 1542 CE1 HIS A 104 18.261 4.408 11.263 1.00 0.00 C ATOM 1543 NE2 HIS A 104 19.038 3.339 11.035 1.00 0.00 N ATOM 0 H HIS A 104 14.031 0.842 14.345 1.00 0.00 H new ATOM 0 HA HIS A 104 16.823 1.743 14.424 1.00 0.00 H new ATOM 0 HB2 HIS A 104 16.177 0.754 12.117 1.00 0.00 H new ATOM 0 HB3 HIS A 104 15.053 2.091 11.981 1.00 0.00 H new ATOM 0 HD1 HIS A 104 16.336 4.659 12.096 1.00 0.00 H new ATOM 0 HD2 HIS A 104 18.647 1.196 11.427 1.00 0.00 H new ATOM 0 HE1 HIS A 104 18.537 5.427 11.036 1.00 0.00 H new ATOM 1551 N HIS A 105 15.991 4.038 14.953 1.00 0.00 N ATOM 1552 CA HIS A 105 15.558 5.364 15.400 1.00 0.00 C ATOM 1553 C HIS A 105 15.421 6.376 14.245 1.00 0.00 C ATOM 1554 O HIS A 105 16.034 6.204 13.185 1.00 0.00 O ATOM 1555 CB HIS A 105 16.589 5.859 16.431 1.00 0.00 C ATOM 1556 CG HIS A 105 18.023 5.900 15.940 1.00 0.00 C ATOM 1557 ND1 HIS A 105 18.442 6.022 14.632 1.00 0.00 N ATOM 1558 CD2 HIS A 105 19.144 5.783 16.719 1.00 0.00 C ATOM 1559 CE1 HIS A 105 19.785 5.964 14.623 1.00 0.00 C ATOM 1560 NE2 HIS A 105 20.254 5.816 15.869 1.00 0.00 N ATOM 0 H HIS A 105 16.991 3.882 15.079 1.00 0.00 H new ATOM 0 HA HIS A 105 14.563 5.282 15.837 1.00 0.00 H new ATOM 0 HB2 HIS A 105 16.304 6.860 16.755 1.00 0.00 H new ATOM 0 HB3 HIS A 105 16.540 5.214 17.308 1.00 0.00 H new ATOM 0 HD1 HIS A 105 17.840 6.136 13.816 1.00 0.00 H new ATOM 0 HD2 HIS A 105 19.166 5.683 17.794 1.00 0.00 H new ATOM 0 HE1 HIS A 105 20.399 6.028 13.737 1.00 0.00 H new ATOM 1568 N TRP A 106 14.703 7.475 14.494 1.00 0.00 N ATOM 1569 CA TRP A 106 14.736 8.728 13.743 1.00 0.00 C ATOM 1570 C TRP A 106 14.496 9.931 14.668 1.00 0.00 C ATOM 1571 O TRP A 106 13.791 9.839 15.670 1.00 0.00 O ATOM 1572 CB TRP A 106 13.717 8.709 12.591 1.00 0.00 C ATOM 1573 CG TRP A 106 14.374 8.833 11.255 1.00 0.00 C ATOM 1574 CD1 TRP A 106 14.886 7.796 10.559 1.00 0.00 C ATOM 1575 CD2 TRP A 106 14.711 10.036 10.496 1.00 0.00 C ATOM 1576 NE1 TRP A 106 15.523 8.271 9.432 1.00 0.00 N ATOM 1577 CE2 TRP A 106 15.471 9.645 9.354 1.00 0.00 C ATOM 1578 CE3 TRP A 106 14.489 11.419 10.674 1.00 0.00 C ATOM 1579 CZ2 TRP A 106 16.004 10.573 8.446 1.00 0.00 C ATOM 1580 CZ3 TRP A 106 14.998 12.359 9.756 1.00 0.00 C ATOM 1581 CH2 TRP A 106 15.757 11.940 8.646 1.00 0.00 C ATOM 0 H TRP A 106 14.045 7.513 15.272 1.00 0.00 H new ATOM 0 HA TRP A 106 15.731 8.831 13.309 1.00 0.00 H new ATOM 0 HB2 TRP A 106 13.146 7.781 12.629 1.00 0.00 H new ATOM 0 HB3 TRP A 106 13.007 9.526 12.722 1.00 0.00 H new ATOM 0 HD1 TRP A 106 14.809 6.756 10.841 1.00 0.00 H new ATOM 0 HE1 TRP A 106 15.978 7.676 8.739 1.00 0.00 H new ATOM 0 HE3 TRP A 106 13.921 11.761 11.526 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 16.595 10.240 7.606 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 14.804 13.411 9.905 1.00 0.00 H new ATOM 0 HH2 TRP A 106 16.148 12.668 7.951 1.00 0.00 H new ATOM 1592 N HIS A 107 15.070 11.079 14.302 1.00 0.00 N ATOM 1593 CA HIS A 107 15.138 12.276 15.140 1.00 0.00 C ATOM 1594 C HIS A 107 14.889 13.500 14.247 1.00 0.00 C ATOM 1595 O HIS A 107 15.657 13.742 13.311 1.00 0.00 O ATOM 1596 CB HIS A 107 16.513 12.302 15.835 1.00 0.00 C ATOM 1597 CG HIS A 107 16.837 11.046 16.617 1.00 0.00 C ATOM 1598 ND1 HIS A 107 16.066 10.473 17.603 1.00 0.00 N ATOM 1599 CD2 HIS A 107 17.912 10.221 16.416 1.00 0.00 C ATOM 1600 CE1 HIS A 107 16.661 9.335 17.989 1.00 0.00 C ATOM 1601 NE2 HIS A 107 17.792 9.140 17.292 1.00 0.00 N ATOM 0 H HIS A 107 15.511 11.204 13.391 1.00 0.00 H new ATOM 0 HA HIS A 107 14.378 12.281 15.922 1.00 0.00 H new ATOM 0 HB2 HIS A 107 17.285 12.457 15.082 1.00 0.00 H new ATOM 0 HB3 HIS A 107 16.550 13.157 16.510 1.00 0.00 H new ATOM 0 HD1 HIS A 107 15.194 10.849 17.975 1.00 0.00 H new ATOM 0 HD2 HIS A 107 18.711 10.379 15.706 1.00 0.00 H new ATOM 0 HE1 HIS A 107 16.284 8.670 18.752 1.00 0.00 H new ATOM 1609 N LYS A 108 13.774 14.214 14.458 1.00 0.00 N ATOM 1610 CA LYS A 108 13.242 15.207 13.512 1.00 0.00 C ATOM 1611 C LYS A 108 12.475 16.355 14.190 1.00 0.00 C ATOM 1612 O LYS A 108 11.243 16.395 14.169 1.00 0.00 O ATOM 1613 CB LYS A 108 12.429 14.510 12.393 1.00 0.00 C ATOM 1614 CG LYS A 108 11.415 13.444 12.861 1.00 0.00 C ATOM 1615 CD LYS A 108 10.598 12.854 11.697 1.00 0.00 C ATOM 1616 CE LYS A 108 9.546 13.840 11.169 1.00 0.00 C ATOM 1617 NZ LYS A 108 8.757 13.250 10.064 1.00 0.00 N ATOM 0 H LYS A 108 13.209 14.117 15.301 1.00 0.00 H new ATOM 0 HA LYS A 108 14.097 15.696 13.045 1.00 0.00 H new ATOM 0 HB2 LYS A 108 11.891 15.274 11.832 1.00 0.00 H new ATOM 0 HB3 LYS A 108 13.128 14.040 11.702 1.00 0.00 H new ATOM 0 HG2 LYS A 108 11.947 12.641 13.371 1.00 0.00 H new ATOM 0 HG3 LYS A 108 10.736 13.888 13.588 1.00 0.00 H new ATOM 0 HD2 LYS A 108 11.272 12.576 10.887 1.00 0.00 H new ATOM 0 HD3 LYS A 108 10.104 11.941 12.028 1.00 0.00 H new ATOM 0 HE2 LYS A 108 8.878 14.130 11.980 1.00 0.00 H new ATOM 0 HE3 LYS A 108 10.039 14.748 10.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 8.189 13.992 9.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 9.401 12.828 9.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 8.126 12.515 10.442 1.00 0.00 H new ATOM 1631 N SER A 109 13.229 17.342 14.689 1.00 0.00 N ATOM 1632 CA SER A 109 12.767 18.672 15.120 1.00 0.00 C ATOM 1633 C SER A 109 11.905 18.649 16.392 1.00 0.00 C ATOM 1634 O SER A 109 10.703 18.923 16.350 1.00 0.00 O ATOM 1635 CB SER A 109 12.092 19.418 13.955 1.00 0.00 C ATOM 1636 OG SER A 109 11.579 20.653 14.403 1.00 0.00 O ATOM 0 H SER A 109 14.235 17.230 14.811 1.00 0.00 H new ATOM 0 HA SER A 109 13.656 19.234 15.407 1.00 0.00 H new ATOM 0 HB2 SER A 109 12.812 19.584 13.153 1.00 0.00 H new ATOM 0 HB3 SER A 109 11.288 18.810 13.541 1.00 0.00 H new ATOM 0 HG SER A 109 10.969 20.500 15.154 1.00 0.00 H new ATOM 1642 N GLY A 110 12.548 18.366 17.527 1.00 0.00 N ATOM 1643 CA GLY A 110 11.951 18.212 18.860 1.00 0.00 C ATOM 1644 C GLY A 110 12.301 16.874 19.528 1.00 0.00 C ATOM 1645 O GLY A 110 11.557 16.404 20.384 1.00 0.00 O ATOM 0 H GLY A 110 13.559 18.230 17.544 1.00 0.00 H new ATOM 0 HA2 GLY A 110 12.288 19.029 19.499 1.00 0.00 H new ATOM 0 HA3 GLY A 110 10.867 18.297 18.778 1.00 0.00 H new ATOM 1649 N SER A 111 13.383 16.227 19.088 1.00 0.00 N ATOM 1650 CA SER A 111 13.823 14.895 19.493 1.00 0.00 C ATOM 1651 C SER A 111 14.231 14.806 20.966 1.00 0.00 C ATOM 1652 O SER A 111 14.819 15.737 21.517 1.00 0.00 O ATOM 1653 CB SER A 111 15.026 14.541 18.617 1.00 0.00 C ATOM 1654 OG SER A 111 15.588 13.309 19.000 1.00 0.00 O ATOM 0 H SER A 111 14.010 16.645 18.400 1.00 0.00 H new ATOM 0 HA SER A 111 12.989 14.204 19.369 1.00 0.00 H new ATOM 0 HB2 SER A 111 14.718 14.494 17.573 1.00 0.00 H new ATOM 0 HB3 SER A 111 15.778 15.326 18.693 1.00 0.00 H new ATOM 0 HG SER A 111 14.874 12.691 19.261 1.00 0.00 H new ATOM 1660 N SER A 112 14.082 13.607 21.550 1.00 0.00 N ATOM 1661 CA SER A 112 14.710 13.225 22.822 1.00 0.00 C ATOM 1662 C SER A 112 16.250 13.246 22.787 1.00 0.00 C ATOM 1663 O SER A 112 16.865 13.090 23.842 1.00 0.00 O ATOM 1664 CB SER A 112 14.237 11.827 23.234 1.00 0.00 C ATOM 1665 OG SER A 112 14.759 11.522 24.513 1.00 0.00 O ATOM 0 H SER A 112 13.512 12.865 21.144 1.00 0.00 H new ATOM 0 HA SER A 112 14.401 13.975 23.550 1.00 0.00 H new ATOM 0 HB2 SER A 112 13.148 11.789 23.253 1.00 0.00 H new ATOM 0 HB3 SER A 112 14.569 11.087 22.506 1.00 0.00 H new ATOM 0 HG SER A 112 15.597 12.011 24.649 1.00 0.00 H new ATOM 1671 N ILE A 113 16.860 13.427 21.606 1.00 0.00 N ATOM 1672 CA ILE A 113 18.300 13.594 21.371 1.00 0.00 C ATOM 1673 C ILE A 113 18.654 15.072 21.074 1.00 0.00 C ATOM 1674 O ILE A 113 19.828 15.416 20.975 1.00 0.00 O ATOM 1675 CB ILE A 113 18.751 12.619 20.246 1.00 0.00 C ATOM 1676 CG1 ILE A 113 18.261 11.162 20.455 1.00 0.00 C ATOM 1677 CG2 ILE A 113 20.278 12.593 20.041 1.00 0.00 C ATOM 1678 CD1 ILE A 113 18.705 10.492 21.762 1.00 0.00 C ATOM 0 H ILE A 113 16.327 13.463 20.737 1.00 0.00 H new ATOM 0 HA ILE A 113 18.853 13.338 22.275 1.00 0.00 H new ATOM 0 HB ILE A 113 18.276 13.025 19.353 1.00 0.00 H new ATOM 0 HG12 ILE A 113 17.172 11.155 20.417 1.00 0.00 H new ATOM 0 HG13 ILE A 113 18.613 10.556 19.620 1.00 0.00 H new ATOM 0 HG21 ILE A 113 20.526 11.894 19.243 1.00 0.00 H new ATOM 0 HG22 ILE A 113 20.626 13.590 19.771 1.00 0.00 H new ATOM 0 HG23 ILE A 113 20.764 12.277 20.964 1.00 0.00 H new ATOM 0 HD11 ILE A 113 18.307 9.478 21.805 1.00 0.00 H new ATOM 0 HD12 ILE A 113 19.794 10.457 21.801 1.00 0.00 H new ATOM 0 HD13 ILE A 113 18.330 11.065 22.610 1.00 0.00 H new ATOM 1690 N GLY A 114 17.664 15.977 20.974 1.00 0.00 N ATOM 1691 CA GLY A 114 17.883 17.427 20.870 1.00 0.00 C ATOM 1692 C GLY A 114 17.860 18.016 19.453 1.00 0.00 C ATOM 1693 O GLY A 114 18.114 19.210 19.306 1.00 0.00 O ATOM 0 H GLY A 114 16.678 15.716 20.963 1.00 0.00 H new ATOM 0 HA2 GLY A 114 17.121 17.932 21.463 1.00 0.00 H new ATOM 0 HA3 GLY A 114 18.846 17.661 21.323 1.00 0.00 H new ATOM 1697 N LYS A 115 17.553 17.213 18.423 1.00 0.00 N ATOM 1698 CA LYS A 115 17.365 17.653 17.027 1.00 0.00 C ATOM 1699 C LYS A 115 16.026 17.196 16.430 1.00 0.00 C ATOM 1700 O LYS A 115 15.016 17.307 17.154 1.00 0.00 O ATOM 1701 CB LYS A 115 18.596 17.281 16.180 1.00 0.00 C ATOM 1702 CG LYS A 115 18.909 15.772 16.151 1.00 0.00 C ATOM 1703 CD LYS A 115 19.642 15.367 14.859 1.00 0.00 C ATOM 1704 CE LYS A 115 18.702 14.778 13.796 1.00 0.00 C ATOM 1705 NZ LYS A 115 17.570 15.661 13.429 1.00 0.00 N ATOM 0 H LYS A 115 17.424 16.208 18.539 1.00 0.00 H new ATOM 0 HA LYS A 115 17.294 18.741 17.018 1.00 0.00 H new ATOM 0 HB2 LYS A 115 18.439 17.628 15.159 1.00 0.00 H new ATOM 0 HB3 LYS A 115 19.464 17.814 16.568 1.00 0.00 H new ATOM 0 HG2 LYS A 115 19.521 15.511 17.014 1.00 0.00 H new ATOM 0 HG3 LYS A 115 17.981 15.206 16.236 1.00 0.00 H new ATOM 0 HD2 LYS A 115 20.148 16.240 14.446 1.00 0.00 H new ATOM 0 HD3 LYS A 115 20.414 14.636 15.099 1.00 0.00 H new ATOM 0 HE2 LYS A 115 19.280 14.556 12.899 1.00 0.00 H new ATOM 0 HE3 LYS A 115 18.305 13.831 14.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 16.803 15.090 13.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 17.222 16.150 14.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 17.889 16.363 12.731 1.00 0.00 H new TER 1719 LYS A 115