USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 794 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 5 SER OG : rot -155:sc= 0.547 USER MOD Set 1.2: A 71 TYR OH : rot 15:sc= 0.361 USER MOD Single : A 1 GLY N :NH3+ -126:sc= 0.113 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= -0.276 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -104:sc= -0.233 (180deg=-2.17!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0676) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= -0.818 X(o=-0.82,f=-1.3) USER MOD Single : A 29 LYS NZ :NH3+ 173:sc= -0.0132 (180deg=-0.0899) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -2.62! C(o=-2.6!,f=-6.4!) USER MOD Single : A 36 HIS : no HE2:sc= 0.867 K(o=0.87,f=-3.1!) USER MOD Single : A 37 CYS SG : rot 57:sc= 0.163 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -18.2! C(o=-18!,f=-33!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -0.625 X(o=-0.63,f=-0.87) USER MOD Single : A 57 GLN : amide:sc= -0.199 X(o=-0.2,f=0.19) USER MOD Single : A 61 MET CE :methyl -168:sc= -1.17 (180deg=-1.33) USER MOD Single : A 63 SER OG : rot 78:sc= 0.887 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.356 X(o=-0.36,f=-0.27) USER MOD Single : A 79 SER OG : rot 180:sc= -0.023 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= -0.303 K(o=-0.3,f=-1.8!) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0.036) USER MOD Single : A 94 SER OG : rot 180:sc= -0.792 USER MOD Single : A 99 TYR OH : rot 165:sc= 0.00409 USER MOD Single : A 100 TYR OH : rot 180:sc=-0.00951 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -19.263 -1.800 -1.109 1.00 0.00 N ATOM 2 CA GLY A 1 -18.915 -1.210 0.173 1.00 0.00 C ATOM 3 C GLY A 1 -17.542 -1.694 0.644 1.00 0.00 C ATOM 4 O GLY A 1 -16.830 -2.369 -0.097 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.504 -1.046 -1.784 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.454 -2.344 -1.472 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.080 -2.432 -0.990 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.912 -0.123 0.089 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -19.670 -1.470 0.914 1.00 0.00 H new ATOM 8 N SER A 2 -17.212 -1.329 1.874 1.00 0.00 N ATOM 9 CA SER A 2 -15.937 -1.717 2.453 1.00 0.00 C ATOM 10 C SER A 2 -16.168 -2.573 3.700 1.00 0.00 C ATOM 11 O SER A 2 -15.790 -3.743 3.734 1.00 0.00 O ATOM 12 CB SER A 2 -15.093 -0.490 2.800 1.00 0.00 C ATOM 13 OG SER A 2 -13.862 -0.847 3.423 1.00 0.00 O ATOM 0 H SER A 2 -17.805 -0.769 2.486 1.00 0.00 H new ATOM 0 HA SER A 2 -15.390 -2.303 1.714 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.889 0.078 1.892 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.659 0.163 3.464 1.00 0.00 H new ATOM 0 HG SER A 2 -13.351 -0.036 3.627 1.00 0.00 H new ATOM 19 N SER A 3 -16.788 -1.956 4.696 1.00 0.00 N ATOM 20 CA SER A 3 -17.073 -2.647 5.942 1.00 0.00 C ATOM 21 C SER A 3 -15.767 -3.075 6.614 1.00 0.00 C ATOM 22 O SER A 3 -14.926 -3.719 5.990 1.00 0.00 O ATOM 23 CB SER A 3 -17.971 -3.862 5.705 1.00 0.00 C ATOM 24 OG SER A 3 -19.342 -3.495 5.570 1.00 0.00 O ATOM 0 H SER A 3 -17.101 -0.986 4.665 1.00 0.00 H new ATOM 0 HA SER A 3 -17.604 -1.960 6.600 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.645 -4.384 4.805 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.863 -4.560 6.535 1.00 0.00 H new ATOM 0 HG SER A 3 -19.882 -4.298 5.418 1.00 0.00 H new ATOM 30 N GLY A 4 -15.639 -2.699 7.878 1.00 0.00 N ATOM 31 CA GLY A 4 -14.449 -3.036 8.642 1.00 0.00 C ATOM 32 C GLY A 4 -13.184 -2.825 7.808 1.00 0.00 C ATOM 33 O GLY A 4 -13.227 -2.180 6.761 1.00 0.00 O ATOM 0 H GLY A 4 -16.339 -2.165 8.392 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.403 -2.421 9.541 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -14.504 -4.074 8.969 1.00 0.00 H new ATOM 37 N SER A 5 -12.088 -3.380 8.303 1.00 0.00 N ATOM 38 CA SER A 5 -10.813 -3.260 7.617 1.00 0.00 C ATOM 39 C SER A 5 -10.368 -1.797 7.591 1.00 0.00 C ATOM 40 O SER A 5 -9.944 -1.292 6.552 1.00 0.00 O ATOM 41 CB SER A 5 -10.899 -3.814 6.193 1.00 0.00 C ATOM 42 OG SER A 5 -11.443 -5.131 6.165 1.00 0.00 O ATOM 0 H SER A 5 -12.056 -3.914 9.171 1.00 0.00 H new ATOM 0 HA SER A 5 -10.075 -3.848 8.163 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.516 -3.154 5.584 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.905 -3.823 5.747 1.00 0.00 H new ATOM 0 HG SER A 5 -11.129 -5.597 5.362 1.00 0.00 H new ATOM 48 N SER A 6 -10.480 -1.157 8.745 1.00 0.00 N ATOM 49 CA SER A 6 -10.094 0.239 8.868 1.00 0.00 C ATOM 50 C SER A 6 -8.643 0.422 8.420 1.00 0.00 C ATOM 51 O SER A 6 -7.724 0.347 9.234 1.00 0.00 O ATOM 52 CB SER A 6 -10.273 0.735 10.304 1.00 0.00 C ATOM 53 OG SER A 6 -10.710 2.091 10.349 1.00 0.00 O ATOM 0 H SER A 6 -10.833 -1.579 9.604 1.00 0.00 H new ATOM 0 HA SER A 6 -10.744 0.832 8.224 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.997 0.103 10.818 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.329 0.640 10.841 1.00 0.00 H new ATOM 0 HG SER A 6 -10.814 2.370 11.283 1.00 0.00 H new ATOM 59 N GLY A 7 -8.482 0.659 7.127 1.00 0.00 N ATOM 60 CA GLY A 7 -7.158 0.854 6.561 1.00 0.00 C ATOM 61 C GLY A 7 -6.994 0.058 5.264 1.00 0.00 C ATOM 62 O GLY A 7 -7.220 0.585 4.175 1.00 0.00 O ATOM 0 H GLY A 7 -9.247 0.720 6.455 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.995 1.914 6.365 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.401 0.543 7.281 1.00 0.00 H new ATOM 66 N LEU A 8 -6.601 -1.197 5.423 1.00 0.00 N ATOM 67 CA LEU A 8 -6.404 -2.070 4.279 1.00 0.00 C ATOM 68 C LEU A 8 -7.511 -1.819 3.254 1.00 0.00 C ATOM 69 O LEU A 8 -7.240 -1.390 2.133 1.00 0.00 O ATOM 70 CB LEU A 8 -6.302 -3.529 4.729 1.00 0.00 C ATOM 71 CG LEU A 8 -4.966 -3.950 5.344 1.00 0.00 C ATOM 72 CD1 LEU A 8 -4.498 -2.932 6.386 1.00 0.00 C ATOM 73 CD2 LEU A 8 -5.049 -5.364 5.922 1.00 0.00 C ATOM 0 H LEU A 8 -6.414 -1.630 6.327 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.457 -1.845 3.788 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.090 -3.720 5.457 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.501 -4.168 3.869 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.217 -3.970 4.552 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -3.546 -3.255 6.808 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.374 -1.958 5.913 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.240 -2.857 7.181 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.086 -5.638 6.353 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.815 -5.396 6.697 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.305 -6.067 5.129 1.00 0.00 H new ATOM 85 N GLY A 9 -8.737 -2.097 3.674 1.00 0.00 N ATOM 86 CA GLY A 9 -9.887 -1.906 2.807 1.00 0.00 C ATOM 87 C GLY A 9 -9.692 -0.691 1.897 1.00 0.00 C ATOM 88 O GLY A 9 -9.484 -0.840 0.693 1.00 0.00 O ATOM 0 H GLY A 9 -8.959 -2.453 4.604 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.042 -2.798 2.200 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -10.784 -1.772 3.411 1.00 0.00 H new ATOM 92 N ALA A 10 -9.766 0.483 2.506 1.00 0.00 N ATOM 93 CA ALA A 10 -9.600 1.722 1.766 1.00 0.00 C ATOM 94 C ALA A 10 -8.416 1.584 0.808 1.00 0.00 C ATOM 95 O ALA A 10 -8.544 1.853 -0.386 1.00 0.00 O ATOM 96 CB ALA A 10 -9.424 2.883 2.747 1.00 0.00 C ATOM 0 H ALA A 10 -9.939 0.602 3.504 1.00 0.00 H new ATOM 0 HA ALA A 10 -10.486 1.933 1.167 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -9.299 3.813 2.192 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -10.304 2.957 3.385 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.542 2.708 3.364 1.00 0.00 H new ATOM 102 N LEU A 11 -7.289 1.165 1.366 1.00 0.00 N ATOM 103 CA LEU A 11 -6.083 0.988 0.576 1.00 0.00 C ATOM 104 C LEU A 11 -6.384 0.064 -0.606 1.00 0.00 C ATOM 105 O LEU A 11 -6.167 0.434 -1.759 1.00 0.00 O ATOM 106 CB LEU A 11 -4.931 0.504 1.458 1.00 0.00 C ATOM 107 CG LEU A 11 -4.164 -0.718 0.948 1.00 0.00 C ATOM 108 CD1 LEU A 11 -3.451 -0.408 -0.369 1.00 0.00 C ATOM 109 CD2 LEU A 11 -3.199 -1.243 2.013 1.00 0.00 C ATOM 0 H LEU A 11 -7.186 0.943 2.356 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.756 1.941 0.160 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.225 1.325 1.583 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.329 0.272 2.446 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.883 -1.512 0.745 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.914 -1.293 -0.709 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.185 -0.118 -1.121 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.745 0.409 -0.217 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.667 -2.111 1.625 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.482 -0.463 2.271 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.760 -1.529 2.903 1.00 0.00 H new ATOM 121 N TYR A 12 -6.879 -1.120 -0.279 1.00 0.00 N ATOM 122 CA TYR A 12 -7.211 -2.100 -1.299 1.00 0.00 C ATOM 123 C TYR A 12 -8.128 -1.494 -2.363 1.00 0.00 C ATOM 124 O TYR A 12 -7.865 -1.620 -3.559 1.00 0.00 O ATOM 125 CB TYR A 12 -7.960 -3.222 -0.577 1.00 0.00 C ATOM 126 CG TYR A 12 -8.487 -4.317 -1.507 1.00 0.00 C ATOM 127 CD1 TYR A 12 -7.635 -4.932 -2.402 1.00 0.00 C ATOM 128 CD2 TYR A 12 -9.815 -4.690 -1.452 1.00 0.00 C ATOM 129 CE1 TYR A 12 -8.131 -5.962 -3.277 1.00 0.00 C ATOM 130 CE2 TYR A 12 -10.311 -5.720 -2.327 1.00 0.00 C ATOM 131 CZ TYR A 12 -9.444 -6.305 -3.197 1.00 0.00 C ATOM 132 OH TYR A 12 -9.913 -7.278 -4.023 1.00 0.00 O ATOM 0 H TYR A 12 -7.058 -1.423 0.678 1.00 0.00 H new ATOM 0 HA TYR A 12 -6.310 -2.453 -1.800 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -7.295 -3.674 0.159 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -8.798 -2.791 -0.028 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -6.596 -4.640 -2.446 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -10.482 -4.209 -0.752 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -7.475 -6.451 -3.981 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -11.348 -6.021 -2.294 1.00 0.00 H new ATOM 0 HH TYR A 12 -10.868 -7.419 -3.854 1.00 0.00 H new ATOM 142 N LEU A 13 -9.184 -0.849 -1.891 1.00 0.00 N ATOM 143 CA LEU A 13 -10.141 -0.222 -2.788 1.00 0.00 C ATOM 144 C LEU A 13 -9.388 0.588 -3.845 1.00 0.00 C ATOM 145 O LEU A 13 -9.798 0.634 -5.004 1.00 0.00 O ATOM 146 CB LEU A 13 -11.160 0.598 -1.995 1.00 0.00 C ATOM 147 CG LEU A 13 -12.231 -0.202 -1.250 1.00 0.00 C ATOM 148 CD1 LEU A 13 -13.038 0.701 -0.315 1.00 0.00 C ATOM 149 CD2 LEU A 13 -13.129 -0.961 -2.229 1.00 0.00 C ATOM 0 H LEU A 13 -9.399 -0.747 -0.899 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.719 -0.979 -3.318 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -10.621 1.208 -1.270 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -11.658 1.283 -2.681 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.731 -0.945 -0.629 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -13.792 0.108 0.202 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -12.370 1.157 0.416 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -13.527 1.483 -0.897 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -13.881 -1.521 -1.673 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -13.622 -0.253 -2.894 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -12.524 -1.651 -2.818 1.00 0.00 H new ATOM 161 N SER A 14 -8.301 1.206 -3.407 1.00 0.00 N ATOM 162 CA SER A 14 -7.488 2.012 -4.302 1.00 0.00 C ATOM 163 C SER A 14 -6.730 1.108 -5.276 1.00 0.00 C ATOM 164 O SER A 14 -6.719 1.359 -6.481 1.00 0.00 O ATOM 165 CB SER A 14 -6.508 2.886 -3.517 1.00 0.00 C ATOM 166 OG SER A 14 -6.862 4.265 -3.571 1.00 0.00 O ATOM 0 H SER A 14 -7.964 1.165 -2.445 1.00 0.00 H new ATOM 0 HA SER A 14 -8.149 2.670 -4.866 1.00 0.00 H new ATOM 0 HB2 SER A 14 -6.483 2.559 -2.478 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.503 2.754 -3.918 1.00 0.00 H new ATOM 0 HG SER A 14 -6.213 4.790 -3.057 1.00 0.00 H new ATOM 172 N MET A 15 -6.113 0.076 -4.719 1.00 0.00 N ATOM 173 CA MET A 15 -5.355 -0.866 -5.524 1.00 0.00 C ATOM 174 C MET A 15 -6.150 -1.298 -6.758 1.00 0.00 C ATOM 175 O MET A 15 -5.569 -1.640 -7.787 1.00 0.00 O ATOM 176 CB MET A 15 -5.010 -2.096 -4.682 1.00 0.00 C ATOM 177 CG MET A 15 -3.914 -1.774 -3.664 1.00 0.00 C ATOM 178 SD MET A 15 -3.526 -3.228 -2.705 1.00 0.00 S ATOM 179 CE MET A 15 -1.744 -3.126 -2.695 1.00 0.00 C ATOM 0 H MET A 15 -6.123 -0.128 -3.720 1.00 0.00 H new ATOM 0 HA MET A 15 -4.441 -0.375 -5.858 1.00 0.00 H new ATOM 0 HB2 MET A 15 -5.902 -2.447 -4.163 1.00 0.00 H new ATOM 0 HB3 MET A 15 -4.680 -2.906 -5.333 1.00 0.00 H new ATOM 0 HG2 MET A 15 -3.021 -1.419 -4.179 1.00 0.00 H new ATOM 0 HG3 MET A 15 -4.243 -0.971 -3.005 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.334 -3.855 -3.394 1.00 0.00 H new ATOM 0 HE2 MET A 15 -1.435 -2.124 -2.993 1.00 0.00 H new ATOM 0 HE3 MET A 15 -1.373 -3.336 -1.692 1.00 0.00 H new ATOM 189 N LYS A 16 -7.467 -1.268 -6.614 1.00 0.00 N ATOM 190 CA LYS A 16 -8.347 -1.652 -7.704 1.00 0.00 C ATOM 191 C LYS A 16 -8.197 -0.653 -8.853 1.00 0.00 C ATOM 192 O LYS A 16 -8.172 -1.042 -10.019 1.00 0.00 O ATOM 193 CB LYS A 16 -9.786 -1.801 -7.203 1.00 0.00 C ATOM 194 CG LYS A 16 -9.883 -2.890 -6.132 1.00 0.00 C ATOM 195 CD LYS A 16 -11.069 -3.818 -6.401 1.00 0.00 C ATOM 196 CE LYS A 16 -12.367 -3.224 -5.850 1.00 0.00 C ATOM 197 NZ LYS A 16 -13.199 -2.688 -6.950 1.00 0.00 N ATOM 0 H LYS A 16 -7.945 -0.984 -5.759 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.065 -2.630 -8.094 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.133 -0.852 -6.794 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.442 -2.047 -8.038 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -8.960 -3.470 -6.113 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -9.991 -2.430 -5.150 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -11.168 -3.985 -7.473 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.886 -4.790 -5.942 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.922 -3.988 -5.306 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -12.138 -2.430 -5.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -14.076 -2.289 -6.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -12.673 -1.944 -7.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -13.433 -3.454 -7.613 1.00 0.00 H new ATOM 211 N ASP A 17 -8.099 0.616 -8.482 1.00 0.00 N ATOM 212 CA ASP A 17 -7.952 1.674 -9.467 1.00 0.00 C ATOM 213 C ASP A 17 -6.703 1.409 -10.310 1.00 0.00 C ATOM 214 O ASP A 17 -5.582 1.490 -9.808 1.00 0.00 O ATOM 215 CB ASP A 17 -7.786 3.036 -8.791 1.00 0.00 C ATOM 216 CG ASP A 17 -8.551 4.184 -9.452 1.00 0.00 C ATOM 217 OD1 ASP A 17 -7.959 4.816 -10.353 1.00 0.00 O ATOM 218 OD2 ASP A 17 -9.711 4.403 -9.042 1.00 0.00 O ATOM 0 H ASP A 17 -8.119 0.935 -7.513 1.00 0.00 H new ATOM 0 HA ASP A 17 -8.849 1.686 -10.086 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -8.112 2.952 -7.754 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.726 3.289 -8.773 1.00 0.00 H new ATOM 223 N PRO A 18 -6.943 1.089 -11.609 1.00 0.00 N ATOM 224 CA PRO A 18 -5.851 0.812 -12.527 1.00 0.00 C ATOM 225 C PRO A 18 -5.141 2.103 -12.940 1.00 0.00 C ATOM 226 O PRO A 18 -4.177 2.069 -13.702 1.00 0.00 O ATOM 227 CB PRO A 18 -6.495 0.088 -13.698 1.00 0.00 C ATOM 228 CG PRO A 18 -7.981 0.396 -13.612 1.00 0.00 C ATOM 229 CD PRO A 18 -8.257 0.984 -12.238 1.00 0.00 C ATOM 0 HA PRO A 18 -5.070 0.199 -12.078 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -6.079 0.431 -14.646 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -6.315 -0.985 -13.641 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -8.271 1.099 -14.393 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -8.568 -0.510 -13.764 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -8.739 1.959 -12.314 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -8.923 0.344 -11.660 1.00 0.00 H new ATOM 237 N GLU A 19 -5.646 3.211 -12.418 1.00 0.00 N ATOM 238 CA GLU A 19 -5.072 4.511 -12.723 1.00 0.00 C ATOM 239 C GLU A 19 -4.535 5.166 -11.449 1.00 0.00 C ATOM 240 O GLU A 19 -3.368 5.550 -11.388 1.00 0.00 O ATOM 241 CB GLU A 19 -6.096 5.414 -13.414 1.00 0.00 C ATOM 242 CG GLU A 19 -6.024 5.260 -14.935 1.00 0.00 C ATOM 243 CD GLU A 19 -6.305 6.591 -15.635 1.00 0.00 C ATOM 244 OE1 GLU A 19 -5.517 7.533 -15.399 1.00 0.00 O ATOM 245 OE2 GLU A 19 -7.300 6.637 -16.390 1.00 0.00 O ATOM 0 H GLU A 19 -6.446 3.236 -11.786 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.240 4.367 -13.412 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.099 5.165 -13.067 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -5.913 6.453 -13.141 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -5.037 4.896 -15.221 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -6.747 4.513 -15.263 1.00 0.00 H new ATOM 252 N LYS A 20 -5.413 5.274 -10.462 1.00 0.00 N ATOM 253 CA LYS A 20 -5.042 5.877 -9.193 1.00 0.00 C ATOM 254 C LYS A 20 -4.668 4.774 -8.200 1.00 0.00 C ATOM 255 O LYS A 20 -4.580 5.020 -6.998 1.00 0.00 O ATOM 256 CB LYS A 20 -6.153 6.803 -8.694 1.00 0.00 C ATOM 257 CG LYS A 20 -6.199 8.094 -9.513 1.00 0.00 C ATOM 258 CD LYS A 20 -5.982 9.318 -8.620 1.00 0.00 C ATOM 259 CE LYS A 20 -6.478 10.592 -9.306 1.00 0.00 C ATOM 260 NZ LYS A 20 -7.955 10.671 -9.249 1.00 0.00 N ATOM 0 H LYS A 20 -6.380 4.954 -10.516 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.163 6.510 -9.314 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.114 6.292 -8.759 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.989 7.040 -7.643 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -5.433 8.065 -10.288 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.161 8.174 -10.018 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.508 9.181 -7.675 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -4.923 9.417 -8.384 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -6.042 11.466 -8.822 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -6.147 10.605 -10.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -8.262 11.628 -9.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.365 9.980 -9.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.277 10.460 -8.283 1.00 0.00 H new ATOM 274 N GLY A 21 -4.457 3.583 -8.740 1.00 0.00 N ATOM 275 CA GLY A 21 -4.094 2.442 -7.917 1.00 0.00 C ATOM 276 C GLY A 21 -3.012 1.599 -8.594 1.00 0.00 C ATOM 277 O GLY A 21 -2.242 2.107 -9.408 1.00 0.00 O ATOM 0 H GLY A 21 -4.530 3.383 -9.738 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -3.737 2.788 -6.947 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -4.975 1.828 -7.731 1.00 0.00 H new ATOM 281 N ILE A 22 -2.988 0.324 -8.233 1.00 0.00 N ATOM 282 CA ILE A 22 -2.013 -0.595 -8.796 1.00 0.00 C ATOM 283 C ILE A 22 -2.368 -0.876 -10.257 1.00 0.00 C ATOM 284 O ILE A 22 -3.519 -0.719 -10.662 1.00 0.00 O ATOM 285 CB ILE A 22 -1.905 -1.855 -7.936 1.00 0.00 C ATOM 286 CG1 ILE A 22 -0.528 -1.954 -7.277 1.00 0.00 C ATOM 287 CG2 ILE A 22 -2.242 -3.106 -8.750 1.00 0.00 C ATOM 288 CD1 ILE A 22 -0.473 -3.123 -6.292 1.00 0.00 C ATOM 0 H ILE A 22 -3.628 -0.094 -7.558 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.019 -0.147 -8.789 1.00 0.00 H new ATOM 0 HB ILE A 22 -2.641 -1.784 -7.135 1.00 0.00 H new ATOM 0 HG12 ILE A 22 0.237 -2.083 -8.043 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -0.303 -1.024 -6.755 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -2.157 -3.987 -8.114 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -3.261 -3.029 -9.130 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -1.548 -3.194 -9.586 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.517 -3.170 -5.838 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.223 -2.979 -5.514 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -0.674 -4.054 -6.821 1.00 0.00 H new ATOM 300 N LYS A 23 -1.358 -1.288 -11.010 1.00 0.00 N ATOM 301 CA LYS A 23 -1.549 -1.593 -12.417 1.00 0.00 C ATOM 302 C LYS A 23 -1.840 -3.087 -12.576 1.00 0.00 C ATOM 303 O LYS A 23 -2.017 -3.797 -11.588 1.00 0.00 O ATOM 304 CB LYS A 23 -0.352 -1.109 -13.238 1.00 0.00 C ATOM 305 CG LYS A 23 -0.541 0.345 -13.678 1.00 0.00 C ATOM 306 CD LYS A 23 -1.033 0.420 -15.124 1.00 0.00 C ATOM 307 CE LYS A 23 0.129 0.267 -16.108 1.00 0.00 C ATOM 308 NZ LYS A 23 0.149 1.394 -17.066 1.00 0.00 N ATOM 0 H LYS A 23 -0.405 -1.418 -10.671 1.00 0.00 H new ATOM 0 HA LYS A 23 -2.413 -1.056 -12.809 1.00 0.00 H new ATOM 0 HB2 LYS A 23 0.559 -1.198 -12.647 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.227 -1.745 -14.115 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -1.257 0.838 -13.020 1.00 0.00 H new ATOM 0 HG3 LYS A 23 0.402 0.883 -13.582 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -1.770 -0.363 -15.302 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -1.534 1.373 -15.292 1.00 0.00 H new ATOM 0 HE2 LYS A 23 1.072 0.229 -15.563 1.00 0.00 H new ATOM 0 HE3 LYS A 23 0.034 -0.675 -16.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 0.944 1.274 -17.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -0.744 1.413 -17.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 0.262 2.288 -16.547 1.00 0.00 H new ATOM 322 N GLU A 24 -1.880 -3.519 -13.828 1.00 0.00 N ATOM 323 CA GLU A 24 -2.146 -4.916 -14.129 1.00 0.00 C ATOM 324 C GLU A 24 -1.224 -5.402 -15.249 1.00 0.00 C ATOM 325 O GLU A 24 -1.427 -5.068 -16.415 1.00 0.00 O ATOM 326 CB GLU A 24 -3.615 -5.127 -14.499 1.00 0.00 C ATOM 327 CG GLU A 24 -4.521 -4.932 -13.281 1.00 0.00 C ATOM 328 CD GLU A 24 -5.845 -5.678 -13.457 1.00 0.00 C ATOM 329 OE1 GLU A 24 -6.433 -5.539 -14.551 1.00 0.00 O ATOM 330 OE2 GLU A 24 -6.238 -6.371 -12.494 1.00 0.00 O ATOM 0 H GLU A 24 -1.733 -2.927 -14.645 1.00 0.00 H new ATOM 0 HA GLU A 24 -1.942 -5.505 -13.235 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -3.900 -4.427 -15.284 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -3.752 -6.131 -14.901 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.014 -5.290 -12.385 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.715 -3.870 -13.134 1.00 0.00 H new ATOM 337 N LEU A 25 -0.229 -6.184 -14.855 1.00 0.00 N ATOM 338 CA LEU A 25 0.725 -6.720 -15.811 1.00 0.00 C ATOM 339 C LEU A 25 0.569 -8.240 -15.882 1.00 0.00 C ATOM 340 O LEU A 25 0.252 -8.883 -14.883 1.00 0.00 O ATOM 341 CB LEU A 25 2.144 -6.263 -15.465 1.00 0.00 C ATOM 342 CG LEU A 25 2.259 -4.916 -14.749 1.00 0.00 C ATOM 343 CD1 LEU A 25 1.292 -3.892 -15.348 1.00 0.00 C ATOM 344 CD2 LEU A 25 2.060 -5.078 -13.241 1.00 0.00 C ATOM 0 H LEU A 25 -0.063 -6.459 -13.887 1.00 0.00 H new ATOM 0 HA LEU A 25 0.524 -6.331 -16.809 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.607 -7.025 -14.839 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.723 -6.212 -16.387 1.00 0.00 H new ATOM 0 HG LEU A 25 3.268 -4.533 -14.901 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.394 -2.943 -14.821 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.523 -3.747 -16.403 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.269 -4.255 -15.247 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.147 -4.106 -12.756 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.071 -5.493 -13.047 1.00 0.00 H new ATOM 0 HD23 LEU A 25 2.820 -5.751 -12.844 1.00 0.00 H new ATOM 356 N ASN A 26 0.799 -8.771 -17.074 1.00 0.00 N ATOM 357 CA ASN A 26 0.689 -10.204 -17.289 1.00 0.00 C ATOM 358 C ASN A 26 2.070 -10.846 -17.144 1.00 0.00 C ATOM 359 O ASN A 26 3.038 -10.388 -17.750 1.00 0.00 O ATOM 360 CB ASN A 26 0.170 -10.511 -18.696 1.00 0.00 C ATOM 361 CG ASN A 26 1.183 -10.083 -19.759 1.00 0.00 C ATOM 362 OD1 ASN A 26 2.070 -10.827 -20.144 1.00 0.00 O ATOM 363 ND2 ASN A 26 1.002 -8.846 -20.212 1.00 0.00 N ATOM 0 H ASN A 26 1.061 -8.235 -17.901 1.00 0.00 H new ATOM 0 HA ASN A 26 -0.008 -10.603 -16.552 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -0.031 -11.578 -18.789 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -0.775 -9.993 -18.860 1.00 0.00 H new ATOM 0 HD21 ASN A 26 1.626 -8.467 -20.925 1.00 0.00 H new ATOM 0 HD22 ASN A 26 0.239 -8.276 -19.847 1.00 0.00 H new ATOM 370 N LEU A 27 2.118 -11.896 -16.338 1.00 0.00 N ATOM 371 CA LEU A 27 3.365 -12.605 -16.105 1.00 0.00 C ATOM 372 C LEU A 27 3.152 -14.098 -16.361 1.00 0.00 C ATOM 373 O LEU A 27 2.078 -14.631 -16.089 1.00 0.00 O ATOM 374 CB LEU A 27 3.908 -12.291 -14.710 1.00 0.00 C ATOM 375 CG LEU A 27 3.552 -10.913 -14.146 1.00 0.00 C ATOM 376 CD1 LEU A 27 3.849 -9.811 -15.164 1.00 0.00 C ATOM 377 CD2 LEU A 27 2.099 -10.875 -13.668 1.00 0.00 C ATOM 0 H LEU A 27 1.313 -12.273 -15.838 1.00 0.00 H new ATOM 0 HA LEU A 27 4.132 -12.267 -16.802 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.541 -13.050 -14.019 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.994 -12.382 -14.736 1.00 0.00 H new ATOM 0 HG LEU A 27 4.182 -10.727 -13.276 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.587 -8.842 -14.738 1.00 0.00 H new ATOM 0 HD12 LEU A 27 4.910 -9.823 -15.414 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.262 -9.981 -16.066 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.872 -9.885 -13.272 1.00 0.00 H new ATOM 0 HD22 LEU A 27 1.435 -11.092 -14.505 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.954 -11.621 -12.886 1.00 0.00 H new ATOM 389 N GLU A 28 4.194 -14.731 -16.880 1.00 0.00 N ATOM 390 CA GLU A 28 4.135 -16.153 -17.175 1.00 0.00 C ATOM 391 C GLU A 28 5.187 -16.908 -16.360 1.00 0.00 C ATOM 392 O GLU A 28 6.381 -16.637 -16.478 1.00 0.00 O ATOM 393 CB GLU A 28 4.313 -16.410 -18.673 1.00 0.00 C ATOM 394 CG GLU A 28 3.245 -17.373 -19.195 1.00 0.00 C ATOM 395 CD GLU A 28 3.721 -18.084 -20.464 1.00 0.00 C ATOM 396 OE1 GLU A 28 4.923 -18.423 -20.508 1.00 0.00 O ATOM 397 OE2 GLU A 28 2.872 -18.272 -21.361 1.00 0.00 O ATOM 0 H GLU A 28 5.084 -14.285 -17.104 1.00 0.00 H new ATOM 0 HA GLU A 28 3.150 -16.523 -16.891 1.00 0.00 H new ATOM 0 HB2 GLU A 28 4.255 -15.467 -19.217 1.00 0.00 H new ATOM 0 HB3 GLU A 28 5.304 -16.824 -18.859 1.00 0.00 H new ATOM 0 HG2 GLU A 28 3.009 -18.110 -18.428 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.326 -16.825 -19.404 1.00 0.00 H new ATOM 404 N LYS A 29 4.705 -17.841 -15.552 1.00 0.00 N ATOM 405 CA LYS A 29 5.589 -18.637 -14.718 1.00 0.00 C ATOM 406 C LYS A 29 5.743 -20.030 -15.330 1.00 0.00 C ATOM 407 O LYS A 29 6.696 -20.288 -16.064 1.00 0.00 O ATOM 408 CB LYS A 29 5.090 -18.653 -13.271 1.00 0.00 C ATOM 409 CG LYS A 29 6.020 -19.479 -12.380 1.00 0.00 C ATOM 410 CD LYS A 29 5.919 -19.032 -10.920 1.00 0.00 C ATOM 411 CE LYS A 29 7.295 -19.035 -10.250 1.00 0.00 C ATOM 412 NZ LYS A 29 7.487 -17.800 -9.456 1.00 0.00 N ATOM 0 H LYS A 29 3.714 -18.063 -15.457 1.00 0.00 H new ATOM 0 HA LYS A 29 6.583 -18.192 -14.683 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.029 -17.633 -12.892 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.083 -19.067 -13.234 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.763 -20.535 -12.459 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.048 -19.375 -12.726 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.489 -18.032 -10.871 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.245 -19.696 -10.378 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.390 -19.908 -9.604 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.075 -19.112 -11.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.372 -17.870 -8.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.536 -16.981 -10.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.688 -17.681 -8.801 1.00 0.00 H new ATOM 426 N ASP A 30 4.791 -20.893 -15.007 1.00 0.00 N ATOM 427 CA ASP A 30 4.809 -22.253 -15.517 1.00 0.00 C ATOM 428 C ASP A 30 3.690 -22.423 -16.547 1.00 0.00 C ATOM 429 O ASP A 30 2.574 -22.805 -16.199 1.00 0.00 O ATOM 430 CB ASP A 30 4.575 -23.266 -14.394 1.00 0.00 C ATOM 431 CG ASP A 30 5.759 -24.188 -14.097 1.00 0.00 C ATOM 432 OD1 ASP A 30 6.796 -24.016 -14.773 1.00 0.00 O ATOM 433 OD2 ASP A 30 5.600 -25.044 -13.200 1.00 0.00 O ATOM 0 H ASP A 30 4.002 -20.676 -14.398 1.00 0.00 H new ATOM 0 HA ASP A 30 5.786 -22.431 -15.966 1.00 0.00 H new ATOM 0 HB2 ASP A 30 4.319 -22.724 -13.484 1.00 0.00 H new ATOM 0 HB3 ASP A 30 3.712 -23.880 -14.653 1.00 0.00 H new ATOM 438 N LYS A 31 4.028 -22.129 -17.794 1.00 0.00 N ATOM 439 CA LYS A 31 3.066 -22.244 -18.877 1.00 0.00 C ATOM 440 C LYS A 31 1.710 -21.713 -18.407 1.00 0.00 C ATOM 441 O LYS A 31 0.666 -22.197 -18.840 1.00 0.00 O ATOM 442 CB LYS A 31 3.016 -23.682 -19.398 1.00 0.00 C ATOM 443 CG LYS A 31 4.339 -24.072 -20.059 1.00 0.00 C ATOM 444 CD LYS A 31 4.177 -24.205 -21.575 1.00 0.00 C ATOM 445 CE LYS A 31 5.483 -23.868 -22.297 1.00 0.00 C ATOM 446 NZ LYS A 31 5.218 -23.013 -23.476 1.00 0.00 N ATOM 0 H LYS A 31 4.955 -21.811 -18.078 1.00 0.00 H new ATOM 0 HA LYS A 31 3.372 -21.632 -19.725 1.00 0.00 H new ATOM 0 HB2 LYS A 31 2.802 -24.364 -18.575 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.203 -23.784 -20.116 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.097 -23.321 -19.835 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.693 -25.015 -19.643 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.871 -25.221 -21.824 1.00 0.00 H new ATOM 0 HD3 LYS A 31 3.385 -23.540 -21.919 1.00 0.00 H new ATOM 0 HE2 LYS A 31 6.161 -23.356 -21.614 1.00 0.00 H new ATOM 0 HE3 LYS A 31 5.979 -24.786 -22.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 6.115 -22.794 -23.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.588 -23.515 -24.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 4.764 -22.129 -23.169 1.00 0.00 H new ATOM 460 N LYS A 32 1.771 -20.724 -17.527 1.00 0.00 N ATOM 461 CA LYS A 32 0.561 -20.121 -16.994 1.00 0.00 C ATOM 462 C LYS A 32 0.583 -18.616 -17.266 1.00 0.00 C ATOM 463 O LYS A 32 1.488 -17.914 -16.818 1.00 0.00 O ATOM 464 CB LYS A 32 0.392 -20.477 -15.516 1.00 0.00 C ATOM 465 CG LYS A 32 -0.383 -21.786 -15.351 1.00 0.00 C ATOM 466 CD LYS A 32 0.330 -22.726 -14.376 1.00 0.00 C ATOM 467 CE LYS A 32 -0.640 -23.255 -13.318 1.00 0.00 C ATOM 468 NZ LYS A 32 -0.268 -22.752 -11.977 1.00 0.00 N ATOM 0 H LYS A 32 2.639 -20.325 -17.170 1.00 0.00 H new ATOM 0 HA LYS A 32 -0.318 -20.523 -17.497 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.371 -20.569 -15.046 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -0.134 -19.672 -15.002 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.389 -21.574 -14.988 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.490 -22.274 -16.320 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.767 -23.561 -14.924 1.00 0.00 H new ATOM 0 HD3 LYS A 32 1.151 -22.198 -13.891 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -1.656 -22.945 -13.560 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -0.630 -24.345 -13.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -0.936 -23.120 -11.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 0.694 -23.069 -11.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -0.300 -21.712 -11.975 1.00 0.00 H new ATOM 482 N VAL A 33 -0.424 -18.164 -18.000 1.00 0.00 N ATOM 483 CA VAL A 33 -0.531 -16.755 -18.337 1.00 0.00 C ATOM 484 C VAL A 33 -1.373 -16.044 -17.276 1.00 0.00 C ATOM 485 O VAL A 33 -2.602 -16.074 -17.331 1.00 0.00 O ATOM 486 CB VAL A 33 -1.092 -16.597 -19.751 1.00 0.00 C ATOM 487 CG1 VAL A 33 -1.217 -15.119 -20.129 1.00 0.00 C ATOM 488 CG2 VAL A 33 -0.236 -17.353 -20.769 1.00 0.00 C ATOM 0 H VAL A 33 -1.173 -18.749 -18.370 1.00 0.00 H new ATOM 0 HA VAL A 33 0.453 -16.286 -18.338 1.00 0.00 H new ATOM 0 HB VAL A 33 -2.091 -17.032 -19.765 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.618 -15.034 -21.139 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.887 -14.620 -19.429 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.235 -14.649 -20.088 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -0.657 -17.224 -21.766 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.781 -16.961 -20.751 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -0.221 -18.413 -20.516 1.00 0.00 H new ATOM 498 N PHE A 34 -0.679 -15.421 -16.335 1.00 0.00 N ATOM 499 CA PHE A 34 -1.348 -14.704 -15.263 1.00 0.00 C ATOM 500 C PHE A 34 -1.758 -13.300 -15.715 1.00 0.00 C ATOM 501 O PHE A 34 -0.925 -12.398 -15.781 1.00 0.00 O ATOM 502 CB PHE A 34 -0.347 -14.584 -14.112 1.00 0.00 C ATOM 503 CG PHE A 34 -0.080 -15.900 -13.380 1.00 0.00 C ATOM 504 CD1 PHE A 34 -1.091 -16.531 -12.725 1.00 0.00 C ATOM 505 CD2 PHE A 34 1.168 -16.440 -13.385 1.00 0.00 C ATOM 506 CE1 PHE A 34 -0.843 -17.753 -12.045 1.00 0.00 C ATOM 507 CE2 PHE A 34 1.416 -17.662 -12.706 1.00 0.00 C ATOM 508 CZ PHE A 34 0.405 -18.293 -12.050 1.00 0.00 C ATOM 0 H PHE A 34 0.340 -15.398 -16.293 1.00 0.00 H new ATOM 0 HA PHE A 34 -2.250 -15.239 -14.964 1.00 0.00 H new ATOM 0 HB2 PHE A 34 0.595 -14.200 -14.502 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -0.718 -13.851 -13.396 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -2.083 -16.103 -12.722 1.00 0.00 H new ATOM 0 HD2 PHE A 34 1.971 -15.939 -13.906 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -1.646 -18.253 -11.524 1.00 0.00 H new ATOM 0 HE2 PHE A 34 2.407 -18.091 -12.710 1.00 0.00 H new ATOM 0 HZ PHE A 34 0.593 -19.222 -11.533 1.00 0.00 H new ATOM 518 N ASN A 35 -3.041 -13.161 -16.014 1.00 0.00 N ATOM 519 CA ASN A 35 -3.572 -11.883 -16.457 1.00 0.00 C ATOM 520 C ASN A 35 -4.175 -11.144 -15.262 1.00 0.00 C ATOM 521 O ASN A 35 -4.555 -11.765 -14.270 1.00 0.00 O ATOM 522 CB ASN A 35 -4.676 -12.077 -17.499 1.00 0.00 C ATOM 523 CG ASN A 35 -4.089 -12.499 -18.848 1.00 0.00 C ATOM 524 OD1 ASN A 35 -2.987 -13.016 -18.940 1.00 0.00 O ATOM 525 ND2 ASN A 35 -4.883 -12.251 -19.885 1.00 0.00 N ATOM 0 H ASN A 35 -3.729 -13.912 -15.958 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.755 -11.313 -16.899 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -5.380 -12.834 -17.152 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -5.237 -11.150 -17.617 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -4.582 -12.496 -20.828 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -5.794 -11.816 -19.737 1.00 0.00 H new ATOM 532 N HIS A 36 -4.245 -9.827 -15.394 1.00 0.00 N ATOM 533 CA HIS A 36 -4.795 -8.996 -14.337 1.00 0.00 C ATOM 534 C HIS A 36 -4.197 -9.413 -12.993 1.00 0.00 C ATOM 535 O HIS A 36 -4.896 -9.446 -11.981 1.00 0.00 O ATOM 536 CB HIS A 36 -6.325 -9.047 -14.347 1.00 0.00 C ATOM 537 CG HIS A 36 -6.936 -8.870 -15.716 1.00 0.00 C ATOM 538 ND1 HIS A 36 -7.117 -7.629 -16.301 1.00 0.00 N ATOM 539 CD2 HIS A 36 -7.405 -9.788 -16.609 1.00 0.00 C ATOM 540 CE1 HIS A 36 -7.672 -7.804 -17.492 1.00 0.00 C ATOM 541 NE2 HIS A 36 -7.850 -9.143 -17.680 1.00 0.00 N ATOM 0 H HIS A 36 -3.930 -9.315 -16.218 1.00 0.00 H new ATOM 0 HA HIS A 36 -4.523 -7.955 -14.509 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -6.649 -10.003 -13.937 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -6.709 -8.270 -13.686 1.00 0.00 H new ATOM 0 HD1 HIS A 36 -6.866 -6.732 -15.886 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -7.413 -10.859 -16.468 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -7.937 -7.024 -18.190 1.00 0.00 H new ATOM 549 N CYS A 37 -2.909 -9.722 -13.024 1.00 0.00 N ATOM 550 CA CYS A 37 -2.208 -10.135 -11.821 1.00 0.00 C ATOM 551 C CYS A 37 -1.181 -9.057 -11.468 1.00 0.00 C ATOM 552 O CYS A 37 -0.889 -8.184 -12.283 1.00 0.00 O ATOM 553 CB CYS A 37 -1.558 -11.510 -11.989 1.00 0.00 C ATOM 554 SG CYS A 37 -2.838 -12.817 -11.940 1.00 0.00 S ATOM 0 H CYS A 37 -2.332 -9.694 -13.865 1.00 0.00 H new ATOM 0 HA CYS A 37 -2.919 -10.240 -11.001 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -1.018 -11.553 -12.935 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.827 -11.675 -11.197 1.00 0.00 H new ATOM 0 HG CYS A 37 -3.723 -12.593 -12.866 1.00 0.00 H new ATOM 560 N LEU A 38 -0.661 -9.155 -10.253 1.00 0.00 N ATOM 561 CA LEU A 38 0.327 -8.199 -9.783 1.00 0.00 C ATOM 562 C LEU A 38 1.652 -8.923 -9.534 1.00 0.00 C ATOM 563 O LEU A 38 1.931 -9.946 -10.156 1.00 0.00 O ATOM 564 CB LEU A 38 -0.199 -7.441 -8.563 1.00 0.00 C ATOM 565 CG LEU A 38 -1.720 -7.327 -8.449 1.00 0.00 C ATOM 566 CD1 LEU A 38 -2.134 -6.910 -7.036 1.00 0.00 C ATOM 567 CD2 LEU A 38 -2.280 -6.380 -9.513 1.00 0.00 C ATOM 0 H LEU A 38 -0.905 -9.882 -9.580 1.00 0.00 H new ATOM 0 HA LEU A 38 0.516 -7.441 -10.543 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.177 -7.932 -7.665 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.221 -6.435 -8.576 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.151 -8.311 -8.634 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.220 -6.836 -6.982 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.785 -7.654 -6.320 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.692 -5.942 -6.798 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.363 -6.317 -9.410 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.845 -5.389 -9.384 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.031 -6.759 -10.504 1.00 0.00 H new ATOM 579 N THR A 39 2.432 -8.363 -8.621 1.00 0.00 N ATOM 580 CA THR A 39 3.721 -8.943 -8.282 1.00 0.00 C ATOM 581 C THR A 39 4.108 -8.579 -6.847 1.00 0.00 C ATOM 582 O THR A 39 3.772 -7.498 -6.365 1.00 0.00 O ATOM 583 CB THR A 39 4.739 -8.474 -9.323 1.00 0.00 C ATOM 584 OG1 THR A 39 4.289 -7.172 -9.688 1.00 0.00 O ATOM 585 CG2 THR A 39 4.657 -9.275 -10.624 1.00 0.00 C ATOM 0 H THR A 39 2.197 -7.515 -8.106 1.00 0.00 H new ATOM 0 HA THR A 39 3.685 -10.032 -8.310 1.00 0.00 H new ATOM 0 HB THR A 39 5.744 -8.555 -8.909 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.894 -6.793 -10.359 1.00 0.00 H new ATOM 0 HG21 THR A 39 5.400 -8.902 -11.328 1.00 0.00 H new ATOM 0 HG22 THR A 39 4.850 -10.327 -10.416 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.662 -9.167 -11.056 1.00 0.00 H new ATOM 593 N GLY A 40 4.809 -9.501 -6.205 1.00 0.00 N ATOM 594 CA GLY A 40 5.246 -9.291 -4.835 1.00 0.00 C ATOM 595 C GLY A 40 5.899 -7.917 -4.672 1.00 0.00 C ATOM 596 O GLY A 40 5.514 -7.142 -3.797 1.00 0.00 O ATOM 0 H GLY A 40 5.086 -10.396 -6.608 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.394 -9.375 -4.161 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.954 -10.070 -4.552 1.00 0.00 H new ATOM 600 N SER A 41 6.875 -7.656 -5.529 1.00 0.00 N ATOM 601 CA SER A 41 7.585 -6.389 -5.491 1.00 0.00 C ATOM 602 C SER A 41 6.647 -5.251 -5.898 1.00 0.00 C ATOM 603 O SER A 41 6.452 -4.301 -5.141 1.00 0.00 O ATOM 604 CB SER A 41 8.812 -6.418 -6.405 1.00 0.00 C ATOM 605 OG SER A 41 9.316 -5.110 -6.663 1.00 0.00 O ATOM 0 H SER A 41 7.191 -8.300 -6.254 1.00 0.00 H new ATOM 0 HA SER A 41 7.929 -6.220 -4.471 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.593 -7.023 -5.945 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.551 -6.898 -7.348 1.00 0.00 H new ATOM 0 HG SER A 41 10.100 -5.171 -7.248 1.00 0.00 H new ATOM 611 N GLY A 42 6.090 -5.384 -7.093 1.00 0.00 N ATOM 612 CA GLY A 42 5.177 -4.379 -7.609 1.00 0.00 C ATOM 613 C GLY A 42 4.209 -3.908 -6.523 1.00 0.00 C ATOM 614 O GLY A 42 4.029 -2.708 -6.324 1.00 0.00 O ATOM 0 H GLY A 42 6.254 -6.173 -7.719 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.744 -3.529 -7.990 1.00 0.00 H new ATOM 0 HA3 GLY A 42 4.616 -4.789 -8.448 1.00 0.00 H new ATOM 618 N VAL A 43 3.610 -4.878 -5.848 1.00 0.00 N ATOM 619 CA VAL A 43 2.664 -4.578 -4.786 1.00 0.00 C ATOM 620 C VAL A 43 3.213 -3.436 -3.928 1.00 0.00 C ATOM 621 O VAL A 43 2.477 -2.519 -3.565 1.00 0.00 O ATOM 622 CB VAL A 43 2.365 -5.842 -3.978 1.00 0.00 C ATOM 623 CG1 VAL A 43 1.529 -5.516 -2.739 1.00 0.00 C ATOM 624 CG2 VAL A 43 1.673 -6.896 -4.845 1.00 0.00 C ATOM 0 H VAL A 43 3.761 -5.873 -6.016 1.00 0.00 H new ATOM 0 HA VAL A 43 1.714 -4.244 -5.204 1.00 0.00 H new ATOM 0 HB VAL A 43 3.315 -6.257 -3.641 1.00 0.00 H new ATOM 0 HG11 VAL A 43 1.331 -6.432 -2.183 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.075 -4.817 -2.105 1.00 0.00 H new ATOM 0 HG13 VAL A 43 0.585 -5.066 -3.045 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.472 -7.784 -4.246 1.00 0.00 H new ATOM 0 HG22 VAL A 43 0.734 -6.494 -5.226 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.320 -7.161 -5.681 1.00 0.00 H new ATOM 634 N ILE A 44 4.500 -3.529 -3.629 1.00 0.00 N ATOM 635 CA ILE A 44 5.156 -2.515 -2.821 1.00 0.00 C ATOM 636 C ILE A 44 5.482 -1.303 -3.696 1.00 0.00 C ATOM 637 O ILE A 44 5.272 -0.163 -3.287 1.00 0.00 O ATOM 638 CB ILE A 44 6.374 -3.104 -2.107 1.00 0.00 C ATOM 639 CG1 ILE A 44 6.044 -4.465 -1.491 1.00 0.00 C ATOM 640 CG2 ILE A 44 6.929 -2.124 -1.071 1.00 0.00 C ATOM 641 CD1 ILE A 44 7.318 -5.259 -1.201 1.00 0.00 C ATOM 0 H ILE A 44 5.106 -4.291 -3.932 1.00 0.00 H new ATOM 0 HA ILE A 44 4.490 -2.168 -2.031 1.00 0.00 H new ATOM 0 HB ILE A 44 7.158 -3.268 -2.847 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.481 -4.324 -0.568 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.406 -5.030 -2.170 1.00 0.00 H new ATOM 0 HG21 ILE A 44 7.794 -2.567 -0.578 1.00 0.00 H new ATOM 0 HG22 ILE A 44 7.228 -1.201 -1.567 1.00 0.00 H new ATOM 0 HG23 ILE A 44 6.161 -1.905 -0.329 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.055 -6.222 -0.764 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.866 -5.420 -2.130 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.943 -4.702 -0.503 1.00 0.00 H new ATOM 653 N ASP A 45 5.991 -1.592 -4.885 1.00 0.00 N ATOM 654 CA ASP A 45 6.348 -0.540 -5.822 1.00 0.00 C ATOM 655 C ASP A 45 5.271 0.546 -5.798 1.00 0.00 C ATOM 656 O ASP A 45 5.583 1.733 -5.709 1.00 0.00 O ATOM 657 CB ASP A 45 6.441 -1.082 -7.250 1.00 0.00 C ATOM 658 CG ASP A 45 7.030 -0.110 -8.273 1.00 0.00 C ATOM 659 OD1 ASP A 45 6.780 1.104 -8.112 1.00 0.00 O ATOM 660 OD2 ASP A 45 7.717 -0.603 -9.194 1.00 0.00 O ATOM 0 H ASP A 45 6.165 -2.539 -5.221 1.00 0.00 H new ATOM 0 HA ASP A 45 7.317 -0.139 -5.525 1.00 0.00 H new ATOM 0 HB2 ASP A 45 7.048 -1.987 -7.240 1.00 0.00 H new ATOM 0 HB3 ASP A 45 5.443 -1.371 -7.579 1.00 0.00 H new ATOM 665 N TRP A 46 4.025 0.101 -5.879 1.00 0.00 N ATOM 666 CA TRP A 46 2.900 1.021 -5.867 1.00 0.00 C ATOM 667 C TRP A 46 2.934 1.793 -4.547 1.00 0.00 C ATOM 668 O TRP A 46 2.986 3.022 -4.544 1.00 0.00 O ATOM 669 CB TRP A 46 1.582 0.277 -6.090 1.00 0.00 C ATOM 670 CG TRP A 46 0.347 1.180 -6.068 1.00 0.00 C ATOM 671 CD1 TRP A 46 -0.050 2.059 -6.998 1.00 0.00 C ATOM 672 CD2 TRP A 46 -0.644 1.255 -5.021 1.00 0.00 C ATOM 673 NE1 TRP A 46 -1.218 2.694 -6.629 1.00 0.00 N ATOM 674 CE2 TRP A 46 -1.591 2.189 -5.389 1.00 0.00 C ATOM 675 CE3 TRP A 46 -0.737 0.558 -3.804 1.00 0.00 C ATOM 676 CZ2 TRP A 46 -2.699 2.511 -4.595 1.00 0.00 C ATOM 677 CZ3 TRP A 46 -1.849 0.891 -3.022 1.00 0.00 C ATOM 678 CH2 TRP A 46 -2.811 1.829 -3.378 1.00 0.00 C ATOM 0 H TRP A 46 3.770 -0.884 -5.953 1.00 0.00 H new ATOM 0 HA TRP A 46 2.976 1.733 -6.689 1.00 0.00 H new ATOM 0 HB2 TRP A 46 1.625 -0.239 -7.049 1.00 0.00 H new ATOM 0 HB3 TRP A 46 1.474 -0.488 -5.321 1.00 0.00 H new ATOM 0 HD1 TRP A 46 0.478 2.247 -7.921 1.00 0.00 H new ATOM 0 HE1 TRP A 46 -1.716 3.403 -7.167 1.00 0.00 H new ATOM 0 HE3 TRP A 46 -0.008 -0.177 -3.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 -3.427 3.246 -4.905 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -1.968 0.384 -2.076 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -3.642 2.031 -2.718 1.00 0.00 H new ATOM 689 N LEU A 47 2.905 1.041 -3.457 1.00 0.00 N ATOM 690 CA LEU A 47 2.932 1.639 -2.133 1.00 0.00 C ATOM 691 C LEU A 47 4.047 2.685 -2.074 1.00 0.00 C ATOM 692 O LEU A 47 3.854 3.774 -1.536 1.00 0.00 O ATOM 693 CB LEU A 47 3.045 0.557 -1.058 1.00 0.00 C ATOM 694 CG LEU A 47 1.951 -0.512 -1.064 1.00 0.00 C ATOM 695 CD1 LEU A 47 2.353 -1.713 -0.205 1.00 0.00 C ATOM 696 CD2 LEU A 47 0.606 0.076 -0.634 1.00 0.00 C ATOM 0 H LEU A 47 2.863 0.022 -3.464 1.00 0.00 H new ATOM 0 HA LEU A 47 1.996 2.159 -1.930 1.00 0.00 H new ATOM 0 HB2 LEU A 47 4.010 0.062 -1.169 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.046 1.042 -0.082 1.00 0.00 H new ATOM 0 HG LEU A 47 1.832 -0.872 -2.086 1.00 0.00 H new ATOM 0 HD11 LEU A 47 1.558 -2.458 -0.226 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.271 -2.150 -0.598 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.517 -1.387 0.822 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -0.154 -0.706 -0.647 1.00 0.00 H new ATOM 0 HD22 LEU A 47 0.692 0.482 0.374 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.320 0.872 -1.322 1.00 0.00 H new ATOM 708 N VAL A 48 5.190 2.317 -2.633 1.00 0.00 N ATOM 709 CA VAL A 48 6.336 3.210 -2.651 1.00 0.00 C ATOM 710 C VAL A 48 6.094 4.325 -3.670 1.00 0.00 C ATOM 711 O VAL A 48 6.607 5.432 -3.517 1.00 0.00 O ATOM 712 CB VAL A 48 7.614 2.415 -2.928 1.00 0.00 C ATOM 713 CG1 VAL A 48 8.803 3.350 -3.159 1.00 0.00 C ATOM 714 CG2 VAL A 48 7.904 1.431 -1.793 1.00 0.00 C ATOM 0 H VAL A 48 5.347 1.412 -3.077 1.00 0.00 H new ATOM 0 HA VAL A 48 6.466 3.683 -1.677 1.00 0.00 H new ATOM 0 HB VAL A 48 7.459 1.839 -3.840 1.00 0.00 H new ATOM 0 HG11 VAL A 48 9.698 2.759 -3.354 1.00 0.00 H new ATOM 0 HG12 VAL A 48 8.599 3.993 -4.015 1.00 0.00 H new ATOM 0 HG13 VAL A 48 8.960 3.965 -2.273 1.00 0.00 H new ATOM 0 HG21 VAL A 48 8.817 0.879 -2.015 1.00 0.00 H new ATOM 0 HG22 VAL A 48 8.029 1.979 -0.859 1.00 0.00 H new ATOM 0 HG23 VAL A 48 7.073 0.733 -1.695 1.00 0.00 H new ATOM 724 N SER A 49 5.312 3.993 -4.687 1.00 0.00 N ATOM 725 CA SER A 49 4.995 4.953 -5.731 1.00 0.00 C ATOM 726 C SER A 49 4.010 5.997 -5.200 1.00 0.00 C ATOM 727 O SER A 49 4.185 7.193 -5.429 1.00 0.00 O ATOM 728 CB SER A 49 4.416 4.255 -6.963 1.00 0.00 C ATOM 729 OG SER A 49 5.196 4.498 -8.130 1.00 0.00 O ATOM 0 H SER A 49 4.889 3.073 -4.810 1.00 0.00 H new ATOM 0 HA SER A 49 5.917 5.452 -6.029 1.00 0.00 H new ATOM 0 HB2 SER A 49 4.362 3.182 -6.780 1.00 0.00 H new ATOM 0 HB3 SER A 49 3.396 4.601 -7.130 1.00 0.00 H new ATOM 0 HG SER A 49 4.795 4.034 -8.894 1.00 0.00 H new ATOM 735 N ASN A 50 2.996 5.507 -4.502 1.00 0.00 N ATOM 736 CA ASN A 50 1.983 6.382 -3.937 1.00 0.00 C ATOM 737 C ASN A 50 2.473 6.920 -2.591 1.00 0.00 C ATOM 738 O ASN A 50 1.991 7.947 -2.116 1.00 0.00 O ATOM 739 CB ASN A 50 0.674 5.628 -3.697 1.00 0.00 C ATOM 740 CG ASN A 50 0.934 4.283 -3.016 1.00 0.00 C ATOM 741 OD1 ASN A 50 1.343 4.207 -1.869 1.00 0.00 O ATOM 742 ND2 ASN A 50 0.675 3.228 -3.784 1.00 0.00 N ATOM 0 H ASN A 50 2.854 4.514 -4.315 1.00 0.00 H new ATOM 0 HA ASN A 50 1.807 7.193 -4.644 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.011 6.231 -3.077 1.00 0.00 H new ATOM 0 HB3 ASN A 50 0.164 5.466 -4.647 1.00 0.00 H new ATOM 0 HD21 ASN A 50 0.817 2.286 -3.421 1.00 0.00 H new ATOM 0 HD22 ASN A 50 0.335 3.362 -4.736 1.00 0.00 H new ATOM 749 N LYS A 51 3.425 6.202 -2.015 1.00 0.00 N ATOM 750 CA LYS A 51 3.986 6.594 -0.733 1.00 0.00 C ATOM 751 C LYS A 51 3.055 6.129 0.389 1.00 0.00 C ATOM 752 O LYS A 51 2.881 6.829 1.386 1.00 0.00 O ATOM 753 CB LYS A 51 4.273 8.096 -0.711 1.00 0.00 C ATOM 754 CG LYS A 51 4.978 8.539 -1.995 1.00 0.00 C ATOM 755 CD LYS A 51 6.495 8.392 -1.866 1.00 0.00 C ATOM 756 CE LYS A 51 7.146 8.205 -3.238 1.00 0.00 C ATOM 757 NZ LYS A 51 8.001 9.366 -3.569 1.00 0.00 N ATOM 0 H LYS A 51 3.823 5.351 -2.412 1.00 0.00 H new ATOM 0 HA LYS A 51 4.948 6.107 -0.573 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.339 8.647 -0.596 1.00 0.00 H new ATOM 0 HB3 LYS A 51 4.894 8.339 0.151 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.621 7.942 -2.834 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.727 9.577 -2.212 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.910 9.275 -1.380 1.00 0.00 H new ATOM 0 HD3 LYS A 51 6.729 7.539 -1.229 1.00 0.00 H new ATOM 0 HE2 LYS A 51 7.743 7.293 -3.242 1.00 0.00 H new ATOM 0 HE3 LYS A 51 6.375 8.085 -3.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 8.435 9.222 -4.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 7.422 10.230 -3.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 8.748 9.463 -2.852 1.00 0.00 H new ATOM 771 N LEU A 52 2.483 4.951 0.190 1.00 0.00 N ATOM 772 CA LEU A 52 1.575 4.384 1.173 1.00 0.00 C ATOM 773 C LEU A 52 2.372 3.935 2.399 1.00 0.00 C ATOM 774 O LEU A 52 1.794 3.609 3.434 1.00 0.00 O ATOM 775 CB LEU A 52 0.733 3.272 0.545 1.00 0.00 C ATOM 776 CG LEU A 52 -0.594 3.707 -0.082 1.00 0.00 C ATOM 777 CD1 LEU A 52 -1.127 2.636 -1.035 1.00 0.00 C ATOM 778 CD2 LEU A 52 -1.615 4.075 0.996 1.00 0.00 C ATOM 0 H LEU A 52 2.631 4.373 -0.638 1.00 0.00 H new ATOM 0 HA LEU A 52 0.864 5.137 1.514 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.331 2.780 -0.223 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.523 2.526 1.311 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.414 4.604 -0.674 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.070 2.970 -1.467 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -0.403 2.466 -1.832 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.288 1.708 -0.486 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.549 4.380 0.524 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.797 3.211 1.635 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.228 4.896 1.599 1.00 0.00 H new ATOM 790 N VAL A 53 3.688 3.932 2.240 1.00 0.00 N ATOM 791 CA VAL A 53 4.571 3.528 3.321 1.00 0.00 C ATOM 792 C VAL A 53 5.761 4.487 3.387 1.00 0.00 C ATOM 793 O VAL A 53 5.781 5.506 2.699 1.00 0.00 O ATOM 794 CB VAL A 53 4.988 2.068 3.138 1.00 0.00 C ATOM 795 CG1 VAL A 53 3.857 1.119 3.539 1.00 0.00 C ATOM 796 CG2 VAL A 53 5.442 1.804 1.701 1.00 0.00 C ATOM 0 H VAL A 53 4.164 4.203 1.379 1.00 0.00 H new ATOM 0 HA VAL A 53 4.054 3.586 4.279 1.00 0.00 H new ATOM 0 HB VAL A 53 5.834 1.877 3.798 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.181 0.088 3.399 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.601 1.280 4.586 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.982 1.312 2.918 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.733 0.759 1.598 1.00 0.00 H new ATOM 0 HG22 VAL A 53 4.624 2.022 1.015 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.293 2.443 1.465 1.00 0.00 H new ATOM 806 N ARG A 54 6.725 4.126 4.222 1.00 0.00 N ATOM 807 CA ARG A 54 7.916 4.941 4.387 1.00 0.00 C ATOM 808 C ARG A 54 9.038 4.431 3.480 1.00 0.00 C ATOM 809 O ARG A 54 9.927 5.191 3.098 1.00 0.00 O ATOM 810 CB ARG A 54 8.397 4.927 5.839 1.00 0.00 C ATOM 811 CG ARG A 54 7.595 5.912 6.692 1.00 0.00 C ATOM 812 CD ARG A 54 8.399 6.362 7.913 1.00 0.00 C ATOM 813 NE ARG A 54 7.483 6.718 9.019 1.00 0.00 N ATOM 814 CZ ARG A 54 7.840 6.745 10.311 1.00 0.00 C ATOM 815 NH1 ARG A 54 9.094 6.436 10.666 1.00 0.00 N ATOM 816 NH2 ARG A 54 6.941 7.080 11.247 1.00 0.00 N ATOM 0 H ARG A 54 6.705 3.280 4.791 1.00 0.00 H new ATOM 0 HA ARG A 54 7.658 5.964 4.112 1.00 0.00 H new ATOM 0 HB2 ARG A 54 8.299 3.922 6.249 1.00 0.00 H new ATOM 0 HB3 ARG A 54 9.455 5.185 5.878 1.00 0.00 H new ATOM 0 HG2 ARG A 54 7.322 6.780 6.092 1.00 0.00 H new ATOM 0 HG3 ARG A 54 6.665 5.444 7.017 1.00 0.00 H new ATOM 0 HD2 ARG A 54 9.072 5.565 8.229 1.00 0.00 H new ATOM 0 HD3 ARG A 54 9.020 7.219 7.654 1.00 0.00 H new ATOM 0 HE ARG A 54 6.520 6.958 8.784 1.00 0.00 H new ATOM 0 HH11 ARG A 54 9.777 6.180 9.953 1.00 0.00 H new ATOM 0 HH12 ARG A 54 9.366 6.457 11.649 1.00 0.00 H new ATOM 0 HH21 ARG A 54 5.986 7.314 10.976 1.00 0.00 H new ATOM 0 HH22 ARG A 54 7.212 7.101 12.230 1.00 0.00 H new ATOM 830 N ASN A 55 8.961 3.147 3.162 1.00 0.00 N ATOM 831 CA ASN A 55 9.959 2.526 2.308 1.00 0.00 C ATOM 832 C ASN A 55 9.458 1.152 1.861 1.00 0.00 C ATOM 833 O ASN A 55 8.330 0.769 2.168 1.00 0.00 O ATOM 834 CB ASN A 55 11.278 2.327 3.057 1.00 0.00 C ATOM 835 CG ASN A 55 11.087 2.515 4.563 1.00 0.00 C ATOM 836 OD1 ASN A 55 11.402 3.548 5.131 1.00 0.00 O ATOM 837 ND2 ASN A 55 10.556 1.461 5.176 1.00 0.00 N ATOM 0 H ASN A 55 8.223 2.520 3.481 1.00 0.00 H new ATOM 0 HA ASN A 55 10.125 3.181 1.453 1.00 0.00 H new ATOM 0 HB2 ASN A 55 11.666 1.328 2.858 1.00 0.00 H new ATOM 0 HB3 ASN A 55 12.020 3.036 2.690 1.00 0.00 H new ATOM 0 HD21 ASN A 55 10.389 1.487 6.182 1.00 0.00 H new ATOM 0 HD22 ASN A 55 10.315 0.627 4.640 1.00 0.00 H new ATOM 844 N ARG A 56 10.320 0.448 1.142 1.00 0.00 N ATOM 845 CA ARG A 56 9.978 -0.876 0.649 1.00 0.00 C ATOM 846 C ARG A 56 9.694 -1.820 1.819 1.00 0.00 C ATOM 847 O ARG A 56 8.791 -2.652 1.744 1.00 0.00 O ATOM 848 CB ARG A 56 11.110 -1.455 -0.202 1.00 0.00 C ATOM 849 CG ARG A 56 10.744 -1.435 -1.687 1.00 0.00 C ATOM 850 CD ARG A 56 9.736 -2.537 -2.019 1.00 0.00 C ATOM 851 NE ARG A 56 10.445 -3.737 -2.519 1.00 0.00 N ATOM 852 CZ ARG A 56 10.760 -3.942 -3.805 1.00 0.00 C ATOM 853 NH1 ARG A 56 10.430 -3.030 -4.729 1.00 0.00 N ATOM 854 NH2 ARG A 56 11.403 -5.060 -4.167 1.00 0.00 N ATOM 0 H ARG A 56 11.254 0.769 0.889 1.00 0.00 H new ATOM 0 HA ARG A 56 9.086 -0.780 0.030 1.00 0.00 H new ATOM 0 HB2 ARG A 56 12.022 -0.880 -0.041 1.00 0.00 H new ATOM 0 HB3 ARG A 56 11.319 -2.478 0.111 1.00 0.00 H new ATOM 0 HG2 ARG A 56 10.325 -0.463 -1.949 1.00 0.00 H new ATOM 0 HG3 ARG A 56 11.643 -1.567 -2.289 1.00 0.00 H new ATOM 0 HD2 ARG A 56 9.156 -2.790 -1.132 1.00 0.00 H new ATOM 0 HD3 ARG A 56 9.030 -2.182 -2.770 1.00 0.00 H new ATOM 0 HE ARG A 56 10.710 -4.452 -1.842 1.00 0.00 H new ATOM 0 HH11 ARG A 56 9.939 -2.179 -4.454 1.00 0.00 H new ATOM 0 HH12 ARG A 56 10.670 -3.186 -5.708 1.00 0.00 H new ATOM 0 HH21 ARG A 56 11.653 -5.755 -3.464 1.00 0.00 H new ATOM 0 HH22 ARG A 56 11.643 -5.216 -5.146 1.00 0.00 H new ATOM 868 N GLN A 57 10.481 -1.660 2.872 1.00 0.00 N ATOM 869 CA GLN A 57 10.325 -2.489 4.056 1.00 0.00 C ATOM 870 C GLN A 57 8.856 -2.539 4.478 1.00 0.00 C ATOM 871 O GLN A 57 8.221 -3.590 4.404 1.00 0.00 O ATOM 872 CB GLN A 57 11.207 -1.983 5.199 1.00 0.00 C ATOM 873 CG GLN A 57 11.797 -3.149 5.994 1.00 0.00 C ATOM 874 CD GLN A 57 10.818 -3.633 7.066 1.00 0.00 C ATOM 875 OE1 GLN A 57 10.473 -2.921 7.995 1.00 0.00 O ATOM 876 NE2 GLN A 57 10.392 -4.880 6.886 1.00 0.00 N ATOM 0 H GLN A 57 11.229 -0.969 2.931 1.00 0.00 H new ATOM 0 HA GLN A 57 10.648 -3.501 3.813 1.00 0.00 H new ATOM 0 HB2 GLN A 57 12.012 -1.368 4.797 1.00 0.00 H new ATOM 0 HB3 GLN A 57 10.620 -1.347 5.861 1.00 0.00 H new ATOM 0 HG2 GLN A 57 12.037 -3.970 5.318 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.731 -2.839 6.463 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.721 -5.421 6.086 1.00 0.00 H new ATOM 0 HE22 GLN A 57 9.736 -5.295 7.548 1.00 0.00 H new ATOM 885 N GLU A 58 8.358 -1.391 4.912 1.00 0.00 N ATOM 886 CA GLU A 58 6.975 -1.291 5.346 1.00 0.00 C ATOM 887 C GLU A 58 6.067 -2.097 4.415 1.00 0.00 C ATOM 888 O GLU A 58 5.269 -2.914 4.873 1.00 0.00 O ATOM 889 CB GLU A 58 6.527 0.170 5.420 1.00 0.00 C ATOM 890 CG GLU A 58 6.434 0.642 6.873 1.00 0.00 C ATOM 891 CD GLU A 58 6.198 2.152 6.944 1.00 0.00 C ATOM 892 OE1 GLU A 58 5.620 2.683 5.971 1.00 0.00 O ATOM 893 OE2 GLU A 58 6.600 2.742 7.970 1.00 0.00 O ATOM 0 H GLU A 58 8.888 -0.521 4.973 1.00 0.00 H new ATOM 0 HA GLU A 58 6.898 -1.711 6.349 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.231 0.798 4.874 1.00 0.00 H new ATOM 0 HB3 GLU A 58 5.557 0.282 4.935 1.00 0.00 H new ATOM 0 HG2 GLU A 58 5.622 0.119 7.378 1.00 0.00 H new ATOM 0 HG3 GLU A 58 7.353 0.389 7.401 1.00 0.00 H new ATOM 900 N GLY A 59 6.218 -1.838 3.124 1.00 0.00 N ATOM 901 CA GLY A 59 5.421 -2.529 2.124 1.00 0.00 C ATOM 902 C GLY A 59 5.488 -4.045 2.321 1.00 0.00 C ATOM 903 O GLY A 59 4.485 -4.739 2.163 1.00 0.00 O ATOM 0 H GLY A 59 6.880 -1.160 2.748 1.00 0.00 H new ATOM 0 HA2 GLY A 59 4.385 -2.196 2.186 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.779 -2.272 1.127 1.00 0.00 H new ATOM 907 N LEU A 60 6.679 -4.513 2.664 1.00 0.00 N ATOM 908 CA LEU A 60 6.889 -5.934 2.885 1.00 0.00 C ATOM 909 C LEU A 60 5.988 -6.407 4.026 1.00 0.00 C ATOM 910 O LEU A 60 5.299 -7.418 3.899 1.00 0.00 O ATOM 911 CB LEU A 60 8.374 -6.226 3.112 1.00 0.00 C ATOM 912 CG LEU A 60 8.783 -7.700 3.058 1.00 0.00 C ATOM 913 CD1 LEU A 60 8.951 -8.274 4.467 1.00 0.00 C ATOM 914 CD2 LEU A 60 7.793 -8.514 2.222 1.00 0.00 C ATOM 0 H LEU A 60 7.508 -3.934 2.794 1.00 0.00 H new ATOM 0 HA LEU A 60 6.607 -6.504 1.999 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.950 -5.682 2.363 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.658 -5.826 4.085 1.00 0.00 H new ATOM 0 HG LEU A 60 9.753 -7.768 2.564 1.00 0.00 H new ATOM 0 HD11 LEU A 60 9.242 -9.322 4.400 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.723 -7.716 4.997 1.00 0.00 H new ATOM 0 HD13 LEU A 60 8.008 -8.193 5.008 1.00 0.00 H new ATOM 0 HD21 LEU A 60 8.107 -9.558 2.200 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.799 -8.443 2.664 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.766 -8.122 1.205 1.00 0.00 H new ATOM 926 N MET A 61 6.021 -5.654 5.116 1.00 0.00 N ATOM 927 CA MET A 61 5.216 -5.984 6.279 1.00 0.00 C ATOM 928 C MET A 61 3.730 -5.741 6.004 1.00 0.00 C ATOM 929 O MET A 61 2.891 -6.582 6.322 1.00 0.00 O ATOM 930 CB MET A 61 5.662 -5.131 7.468 1.00 0.00 C ATOM 931 CG MET A 61 7.183 -5.167 7.629 1.00 0.00 C ATOM 932 SD MET A 61 7.643 -4.518 9.227 1.00 0.00 S ATOM 933 CE MET A 61 6.916 -2.891 9.121 1.00 0.00 C ATOM 0 H MET A 61 6.593 -4.816 5.218 1.00 0.00 H new ATOM 0 HA MET A 61 5.356 -7.041 6.507 1.00 0.00 H new ATOM 0 HB2 MET A 61 5.332 -4.102 7.326 1.00 0.00 H new ATOM 0 HB3 MET A 61 5.188 -5.495 8.379 1.00 0.00 H new ATOM 0 HG2 MET A 61 7.544 -6.190 7.525 1.00 0.00 H new ATOM 0 HG3 MET A 61 7.654 -4.581 6.840 1.00 0.00 H new ATOM 0 HE1 MET A 61 7.285 -2.274 9.940 1.00 0.00 H new ATOM 0 HE2 MET A 61 7.188 -2.432 8.170 1.00 0.00 H new ATOM 0 HE3 MET A 61 5.831 -2.972 9.188 1.00 0.00 H new ATOM 943 N ILE A 62 3.452 -4.587 5.416 1.00 0.00 N ATOM 944 CA ILE A 62 2.082 -4.222 5.095 1.00 0.00 C ATOM 945 C ILE A 62 1.515 -5.224 4.087 1.00 0.00 C ATOM 946 O ILE A 62 0.471 -5.829 4.328 1.00 0.00 O ATOM 947 CB ILE A 62 2.011 -2.768 4.623 1.00 0.00 C ATOM 948 CG1 ILE A 62 2.657 -1.829 5.644 1.00 0.00 C ATOM 949 CG2 ILE A 62 0.571 -2.365 4.304 1.00 0.00 C ATOM 950 CD1 ILE A 62 1.669 -1.461 6.753 1.00 0.00 C ATOM 0 H ILE A 62 4.151 -3.893 5.153 1.00 0.00 H new ATOM 0 HA ILE A 62 1.455 -4.275 5.985 1.00 0.00 H new ATOM 0 HB ILE A 62 2.581 -2.680 3.698 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.535 -2.307 6.078 1.00 0.00 H new ATOM 0 HG13 ILE A 62 3.001 -0.924 5.144 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.549 -1.327 3.971 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.180 -3.008 3.515 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.043 -2.472 5.198 1.00 0.00 H new ATOM 0 HD11 ILE A 62 2.154 -0.793 7.465 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.803 -0.961 6.318 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.345 -2.366 7.267 1.00 0.00 H new ATOM 962 N SER A 63 2.228 -5.369 2.980 1.00 0.00 N ATOM 963 CA SER A 63 1.809 -6.287 1.935 1.00 0.00 C ATOM 964 C SER A 63 1.210 -7.550 2.557 1.00 0.00 C ATOM 965 O SER A 63 0.163 -8.025 2.119 1.00 0.00 O ATOM 966 CB SER A 63 2.980 -6.650 1.019 1.00 0.00 C ATOM 967 OG SER A 63 3.238 -5.634 0.054 1.00 0.00 O ATOM 0 H SER A 63 3.093 -4.866 2.784 1.00 0.00 H new ATOM 0 HA SER A 63 1.049 -5.793 1.330 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.874 -6.814 1.621 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.763 -7.588 0.508 1.00 0.00 H new ATOM 0 HG SER A 63 3.731 -4.900 0.476 1.00 0.00 H new ATOM 973 N ALA A 64 1.900 -8.057 3.568 1.00 0.00 N ATOM 974 CA ALA A 64 1.449 -9.256 4.255 1.00 0.00 C ATOM 975 C ALA A 64 0.027 -9.036 4.775 1.00 0.00 C ATOM 976 O ALA A 64 -0.863 -9.847 4.522 1.00 0.00 O ATOM 977 CB ALA A 64 2.432 -9.603 5.374 1.00 0.00 C ATOM 0 H ALA A 64 2.768 -7.660 3.928 1.00 0.00 H new ATOM 0 HA ALA A 64 1.422 -10.104 3.570 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.094 -10.502 5.889 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.420 -9.778 4.949 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.483 -8.776 6.083 1.00 0.00 H new ATOM 983 N SER A 65 -0.143 -7.935 5.492 1.00 0.00 N ATOM 984 CA SER A 65 -1.442 -7.598 6.050 1.00 0.00 C ATOM 985 C SER A 65 -2.510 -7.645 4.956 1.00 0.00 C ATOM 986 O SER A 65 -3.609 -8.150 5.177 1.00 0.00 O ATOM 987 CB SER A 65 -1.417 -6.217 6.709 1.00 0.00 C ATOM 988 OG SER A 65 -1.960 -6.245 8.026 1.00 0.00 O ATOM 0 H SER A 65 0.597 -7.265 5.700 1.00 0.00 H new ATOM 0 HA SER A 65 -1.685 -8.333 6.818 1.00 0.00 H new ATOM 0 HB2 SER A 65 -0.391 -5.852 6.748 1.00 0.00 H new ATOM 0 HB3 SER A 65 -1.983 -5.513 6.098 1.00 0.00 H new ATOM 0 HG SER A 65 -1.925 -5.346 8.414 1.00 0.00 H new ATOM 994 N LEU A 66 -2.148 -7.111 3.798 1.00 0.00 N ATOM 995 CA LEU A 66 -3.062 -7.086 2.668 1.00 0.00 C ATOM 996 C LEU A 66 -3.397 -8.520 2.256 1.00 0.00 C ATOM 997 O LEU A 66 -4.566 -8.902 2.218 1.00 0.00 O ATOM 998 CB LEU A 66 -2.485 -6.238 1.532 1.00 0.00 C ATOM 999 CG LEU A 66 -2.530 -4.723 1.737 1.00 0.00 C ATOM 1000 CD1 LEU A 66 -3.938 -4.177 1.492 1.00 0.00 C ATOM 1001 CD2 LEU A 66 -1.999 -4.340 3.120 1.00 0.00 C ATOM 0 H LEU A 66 -1.235 -6.693 3.618 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.001 -6.608 2.948 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.447 -6.533 1.376 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.025 -6.477 0.616 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.873 -4.260 1.001 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.941 -3.098 1.645 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.242 -4.400 0.469 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.635 -4.644 2.187 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.042 -3.257 3.239 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.609 -4.814 3.888 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -0.966 -4.675 3.219 1.00 0.00 H new ATOM 1013 N LEU A 67 -2.350 -9.277 1.959 1.00 0.00 N ATOM 1014 CA LEU A 67 -2.519 -10.661 1.551 1.00 0.00 C ATOM 1015 C LEU A 67 -3.297 -11.415 2.631 1.00 0.00 C ATOM 1016 O LEU A 67 -4.353 -11.984 2.358 1.00 0.00 O ATOM 1017 CB LEU A 67 -1.165 -11.290 1.216 1.00 0.00 C ATOM 1018 CG LEU A 67 -1.147 -12.814 1.086 1.00 0.00 C ATOM 1019 CD1 LEU A 67 -0.999 -13.238 -0.376 1.00 0.00 C ATOM 1020 CD2 LEU A 67 -0.061 -13.427 1.974 1.00 0.00 C ATOM 0 H LEU A 67 -1.382 -8.958 1.993 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.107 -10.719 0.635 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.809 -10.861 0.279 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.452 -11.003 1.989 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.105 -13.198 1.437 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.989 -14.326 -0.440 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.837 -12.848 -0.954 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.066 -12.842 -0.777 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.069 -14.511 1.863 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.914 -13.039 1.677 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.253 -13.167 3.015 1.00 0.00 H new ATOM 1032 N SER A 68 -2.745 -11.395 3.836 1.00 0.00 N ATOM 1033 CA SER A 68 -3.373 -12.070 4.958 1.00 0.00 C ATOM 1034 C SER A 68 -4.893 -11.913 4.879 1.00 0.00 C ATOM 1035 O SER A 68 -5.610 -12.885 4.648 1.00 0.00 O ATOM 1036 CB SER A 68 -2.852 -11.526 6.290 1.00 0.00 C ATOM 1037 OG SER A 68 -2.113 -12.506 7.014 1.00 0.00 O ATOM 0 H SER A 68 -1.869 -10.922 4.059 1.00 0.00 H new ATOM 0 HA SER A 68 -3.120 -13.129 4.905 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.219 -10.658 6.105 1.00 0.00 H new ATOM 0 HB3 SER A 68 -3.692 -11.184 6.895 1.00 0.00 H new ATOM 0 HG SER A 68 -1.796 -12.120 7.857 1.00 0.00 H new ATOM 1043 N GLU A 69 -5.339 -10.681 5.076 1.00 0.00 N ATOM 1044 CA GLU A 69 -6.761 -10.384 5.030 1.00 0.00 C ATOM 1045 C GLU A 69 -7.426 -11.147 3.882 1.00 0.00 C ATOM 1046 O GLU A 69 -8.540 -11.647 4.028 1.00 0.00 O ATOM 1047 CB GLU A 69 -7.002 -8.879 4.899 1.00 0.00 C ATOM 1048 CG GLU A 69 -6.709 -8.160 6.217 1.00 0.00 C ATOM 1049 CD GLU A 69 -7.717 -8.560 7.296 1.00 0.00 C ATOM 1050 OE1 GLU A 69 -8.858 -8.055 7.223 1.00 0.00 O ATOM 1051 OE2 GLU A 69 -7.323 -9.362 8.171 1.00 0.00 O ATOM 0 H GLU A 69 -4.741 -9.877 5.268 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.211 -10.711 5.967 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.368 -8.473 4.110 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.035 -8.697 4.603 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.700 -8.401 6.550 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.745 -7.082 6.063 1.00 0.00 H new ATOM 1058 N GLY A 70 -6.714 -11.213 2.767 1.00 0.00 N ATOM 1059 CA GLY A 70 -7.221 -11.907 1.595 1.00 0.00 C ATOM 1060 C GLY A 70 -7.457 -10.933 0.440 1.00 0.00 C ATOM 1061 O GLY A 70 -8.298 -11.179 -0.423 1.00 0.00 O ATOM 0 H GLY A 70 -5.790 -10.797 2.650 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -6.512 -12.676 1.288 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.153 -12.415 1.843 1.00 0.00 H new ATOM 1065 N TYR A 71 -6.699 -9.846 0.460 1.00 0.00 N ATOM 1066 CA TYR A 71 -6.815 -8.834 -0.575 1.00 0.00 C ATOM 1067 C TYR A 71 -5.909 -9.160 -1.765 1.00 0.00 C ATOM 1068 O TYR A 71 -6.000 -8.521 -2.812 1.00 0.00 O ATOM 1069 CB TYR A 71 -6.347 -7.524 0.062 1.00 0.00 C ATOM 1070 CG TYR A 71 -7.349 -6.919 1.047 1.00 0.00 C ATOM 1071 CD1 TYR A 71 -8.650 -6.685 0.652 1.00 0.00 C ATOM 1072 CD2 TYR A 71 -6.951 -6.606 2.331 1.00 0.00 C ATOM 1073 CE1 TYR A 71 -9.593 -6.115 1.580 1.00 0.00 C ATOM 1074 CE2 TYR A 71 -7.894 -6.037 3.259 1.00 0.00 C ATOM 1075 CZ TYR A 71 -9.168 -5.820 2.837 1.00 0.00 C ATOM 1076 OH TYR A 71 -10.059 -5.282 3.713 1.00 0.00 O ATOM 0 H TYR A 71 -6.002 -9.645 1.177 1.00 0.00 H new ATOM 0 HA TYR A 71 -7.839 -8.778 -0.943 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -5.405 -7.700 0.580 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -6.146 -6.799 -0.727 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -8.961 -6.929 -0.353 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -5.932 -6.788 2.640 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -10.614 -5.926 1.284 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -7.596 -5.788 4.267 1.00 0.00 H new ATOM 0 HH TYR A 71 -10.969 -5.400 3.368 1.00 0.00 H new ATOM 1086 N LEU A 72 -5.057 -10.154 -1.564 1.00 0.00 N ATOM 1087 CA LEU A 72 -4.136 -10.573 -2.607 1.00 0.00 C ATOM 1088 C LEU A 72 -4.000 -12.096 -2.580 1.00 0.00 C ATOM 1089 O LEU A 72 -3.544 -12.665 -1.589 1.00 0.00 O ATOM 1090 CB LEU A 72 -2.803 -9.834 -2.473 1.00 0.00 C ATOM 1091 CG LEU A 72 -2.883 -8.306 -2.444 1.00 0.00 C ATOM 1092 CD1 LEU A 72 -1.634 -7.704 -1.798 1.00 0.00 C ATOM 1093 CD2 LEU A 72 -3.131 -7.744 -3.845 1.00 0.00 C ATOM 0 H LEU A 72 -4.985 -10.682 -0.694 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.525 -10.305 -3.589 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.314 -10.170 -1.558 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.162 -10.129 -3.304 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.734 -8.020 -1.827 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.716 -6.617 -1.790 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.542 -8.068 -0.775 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.752 -7.997 -2.368 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -3.184 -6.656 -3.797 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.315 -8.039 -4.505 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -4.071 -8.136 -4.233 1.00 0.00 H new ATOM 1105 N GLN A 73 -4.405 -12.714 -3.680 1.00 0.00 N ATOM 1106 CA GLN A 73 -4.334 -14.161 -3.795 1.00 0.00 C ATOM 1107 C GLN A 73 -3.009 -14.578 -4.436 1.00 0.00 C ATOM 1108 O GLN A 73 -2.571 -13.974 -5.414 1.00 0.00 O ATOM 1109 CB GLN A 73 -5.523 -14.707 -4.588 1.00 0.00 C ATOM 1110 CG GLN A 73 -6.802 -14.679 -3.748 1.00 0.00 C ATOM 1111 CD GLN A 73 -6.707 -15.653 -2.571 1.00 0.00 C ATOM 1112 OE1 GLN A 73 -6.801 -16.860 -2.722 1.00 0.00 O ATOM 1113 NE2 GLN A 73 -6.514 -15.063 -1.395 1.00 0.00 N ATOM 0 H GLN A 73 -4.783 -12.239 -4.500 1.00 0.00 H new ATOM 0 HA GLN A 73 -4.381 -14.588 -2.793 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.664 -14.115 -5.492 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.315 -15.729 -4.906 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -6.975 -13.669 -3.376 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.657 -14.939 -4.372 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -6.444 -14.047 -1.340 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -6.436 -15.627 -0.548 1.00 0.00 H new ATOM 1122 N PRO A 74 -2.392 -15.637 -3.845 1.00 0.00 N ATOM 1123 CA PRO A 74 -1.126 -16.142 -4.349 1.00 0.00 C ATOM 1124 C PRO A 74 -1.328 -16.937 -5.640 1.00 0.00 C ATOM 1125 O PRO A 74 -2.315 -17.658 -5.782 1.00 0.00 O ATOM 1126 CB PRO A 74 -0.560 -16.982 -3.216 1.00 0.00 C ATOM 1127 CG PRO A 74 -1.734 -17.297 -2.303 1.00 0.00 C ATOM 1128 CD PRO A 74 -2.882 -16.377 -2.686 1.00 0.00 C ATOM 0 HA PRO A 74 -0.433 -15.346 -4.622 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -0.106 -17.896 -3.597 1.00 0.00 H new ATOM 0 HB3 PRO A 74 0.218 -16.440 -2.679 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.030 -18.341 -2.408 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -1.457 -17.148 -1.259 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -3.780 -16.945 -2.929 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.141 -15.705 -1.868 1.00 0.00 H new ATOM 1136 N ALA A 75 -0.377 -16.779 -6.549 1.00 0.00 N ATOM 1137 CA ALA A 75 -0.438 -17.473 -7.824 1.00 0.00 C ATOM 1138 C ALA A 75 0.977 -17.860 -8.257 1.00 0.00 C ATOM 1139 O ALA A 75 1.782 -16.998 -8.605 1.00 0.00 O ATOM 1140 CB ALA A 75 -1.141 -16.587 -8.855 1.00 0.00 C ATOM 0 H ALA A 75 0.440 -16.181 -6.428 1.00 0.00 H new ATOM 0 HA ALA A 75 -1.018 -18.391 -7.733 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -1.187 -17.108 -9.811 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -2.152 -16.364 -8.514 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.585 -15.657 -8.975 1.00 0.00 H new ATOM 1146 N GLY A 76 1.238 -19.159 -8.222 1.00 0.00 N ATOM 1147 CA GLY A 76 2.542 -19.671 -8.606 1.00 0.00 C ATOM 1148 C GLY A 76 2.976 -20.813 -7.684 1.00 0.00 C ATOM 1149 O GLY A 76 2.505 -21.941 -7.823 1.00 0.00 O ATOM 0 H GLY A 76 0.568 -19.872 -7.933 1.00 0.00 H new ATOM 0 HA2 GLY A 76 2.509 -20.024 -9.637 1.00 0.00 H new ATOM 0 HA3 GLY A 76 3.278 -18.868 -8.567 1.00 0.00 H new ATOM 1153 N ASP A 77 3.869 -20.481 -6.763 1.00 0.00 N ATOM 1154 CA ASP A 77 4.371 -21.464 -5.819 1.00 0.00 C ATOM 1155 C ASP A 77 5.106 -20.747 -4.685 1.00 0.00 C ATOM 1156 O ASP A 77 4.842 -21.002 -3.511 1.00 0.00 O ATOM 1157 CB ASP A 77 5.359 -22.419 -6.492 1.00 0.00 C ATOM 1158 CG ASP A 77 6.034 -23.420 -5.551 1.00 0.00 C ATOM 1159 OD1 ASP A 77 6.423 -22.986 -4.446 1.00 0.00 O ATOM 1160 OD2 ASP A 77 6.145 -24.596 -5.959 1.00 0.00 O ATOM 0 H ASP A 77 4.258 -19.545 -6.651 1.00 0.00 H new ATOM 0 HA ASP A 77 3.521 -22.032 -5.440 1.00 0.00 H new ATOM 0 HB2 ASP A 77 4.833 -22.972 -7.270 1.00 0.00 H new ATOM 0 HB3 ASP A 77 6.132 -21.830 -6.986 1.00 0.00 H new ATOM 1165 N LEU A 78 6.013 -19.864 -5.075 1.00 0.00 N ATOM 1166 CA LEU A 78 6.788 -19.107 -4.106 1.00 0.00 C ATOM 1167 C LEU A 78 5.857 -18.594 -3.005 1.00 0.00 C ATOM 1168 O LEU A 78 5.883 -19.095 -1.882 1.00 0.00 O ATOM 1169 CB LEU A 78 7.585 -18.002 -4.802 1.00 0.00 C ATOM 1170 CG LEU A 78 9.054 -18.316 -5.091 1.00 0.00 C ATOM 1171 CD1 LEU A 78 9.184 -19.364 -6.198 1.00 0.00 C ATOM 1172 CD2 LEU A 78 9.834 -17.040 -5.416 1.00 0.00 C ATOM 0 H LEU A 78 6.229 -19.655 -6.050 1.00 0.00 H new ATOM 0 HA LEU A 78 7.528 -19.747 -3.626 1.00 0.00 H new ATOM 0 HB2 LEU A 78 7.092 -17.765 -5.745 1.00 0.00 H new ATOM 0 HB3 LEU A 78 7.540 -17.105 -4.184 1.00 0.00 H new ATOM 0 HG LEU A 78 9.495 -18.743 -4.190 1.00 0.00 H new ATOM 0 HD11 LEU A 78 10.238 -19.569 -6.383 1.00 0.00 H new ATOM 0 HD12 LEU A 78 8.685 -20.283 -5.890 1.00 0.00 H new ATOM 0 HD13 LEU A 78 8.721 -18.988 -7.111 1.00 0.00 H new ATOM 0 HD21 LEU A 78 10.875 -17.291 -5.617 1.00 0.00 H new ATOM 0 HD22 LEU A 78 9.400 -16.562 -6.294 1.00 0.00 H new ATOM 0 HD23 LEU A 78 9.783 -16.357 -4.568 1.00 0.00 H new ATOM 1184 N SER A 79 5.057 -17.602 -3.365 1.00 0.00 N ATOM 1185 CA SER A 79 4.121 -17.015 -2.422 1.00 0.00 C ATOM 1186 C SER A 79 3.341 -18.119 -1.705 1.00 0.00 C ATOM 1187 O SER A 79 3.203 -18.092 -0.482 1.00 0.00 O ATOM 1188 CB SER A 79 3.158 -16.056 -3.126 1.00 0.00 C ATOM 1189 OG SER A 79 2.388 -16.713 -4.129 1.00 0.00 O ATOM 0 H SER A 79 5.038 -17.189 -4.298 1.00 0.00 H new ATOM 0 HA SER A 79 4.688 -16.443 -1.688 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.489 -15.609 -2.390 1.00 0.00 H new ATOM 0 HB3 SER A 79 3.724 -15.242 -3.579 1.00 0.00 H new ATOM 0 HG SER A 79 1.785 -16.068 -4.553 1.00 0.00 H new ATOM 1195 N LYS A 80 2.850 -19.062 -2.495 1.00 0.00 N ATOM 1196 CA LYS A 80 2.088 -20.173 -1.950 1.00 0.00 C ATOM 1197 C LYS A 80 2.888 -20.833 -0.826 1.00 0.00 C ATOM 1198 O LYS A 80 2.343 -21.136 0.234 1.00 0.00 O ATOM 1199 CB LYS A 80 1.679 -21.139 -3.064 1.00 0.00 C ATOM 1200 CG LYS A 80 0.633 -20.505 -3.984 1.00 0.00 C ATOM 1201 CD LYS A 80 0.472 -21.315 -5.272 1.00 0.00 C ATOM 1202 CE LYS A 80 -0.175 -22.672 -4.989 1.00 0.00 C ATOM 1203 NZ LYS A 80 -0.483 -23.374 -6.255 1.00 0.00 N ATOM 0 H LYS A 80 2.965 -19.080 -3.508 1.00 0.00 H new ATOM 0 HA LYS A 80 1.156 -19.817 -1.510 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.557 -21.421 -3.646 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.278 -22.054 -2.628 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.324 -20.446 -3.466 1.00 0.00 H new ATOM 0 HG3 LYS A 80 0.928 -19.484 -4.227 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.139 -20.758 -5.982 1.00 0.00 H new ATOM 0 HD3 LYS A 80 1.447 -21.463 -5.737 1.00 0.00 H new ATOM 0 HE2 LYS A 80 0.495 -23.281 -4.382 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.089 -22.532 -4.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -0.922 -24.293 -6.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.139 -22.799 -6.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 0.395 -23.524 -6.791 1.00 0.00 H new ATOM 1217 N ASN A 81 4.169 -21.038 -1.097 1.00 0.00 N ATOM 1218 CA ASN A 81 5.050 -21.657 -0.122 1.00 0.00 C ATOM 1219 C ASN A 81 5.057 -20.818 1.158 1.00 0.00 C ATOM 1220 O ASN A 81 4.841 -21.343 2.249 1.00 0.00 O ATOM 1221 CB ASN A 81 6.486 -21.731 -0.645 1.00 0.00 C ATOM 1222 CG ASN A 81 6.977 -23.179 -0.698 1.00 0.00 C ATOM 1223 OD1 ASN A 81 6.472 -24.058 -0.018 1.00 0.00 O ATOM 1224 ND2 ASN A 81 7.987 -23.378 -1.540 1.00 0.00 N ATOM 0 H ASN A 81 4.617 -20.786 -1.978 1.00 0.00 H new ATOM 0 HA ASN A 81 4.683 -22.665 0.070 1.00 0.00 H new ATOM 0 HB2 ASN A 81 6.537 -21.289 -1.640 1.00 0.00 H new ATOM 0 HB3 ASN A 81 7.142 -21.144 -0.002 1.00 0.00 H new ATOM 0 HD21 ASN A 81 8.386 -24.311 -1.647 1.00 0.00 H new ATOM 0 HD22 ASN A 81 8.363 -22.598 -2.079 1.00 0.00 H new ATOM 1231 N ALA A 82 5.307 -19.529 0.982 1.00 0.00 N ATOM 1232 CA ALA A 82 5.344 -18.613 2.109 1.00 0.00 C ATOM 1233 C ALA A 82 4.012 -18.680 2.859 1.00 0.00 C ATOM 1234 O ALA A 82 3.988 -18.862 4.075 1.00 0.00 O ATOM 1235 CB ALA A 82 5.662 -17.202 1.611 1.00 0.00 C ATOM 0 H ALA A 82 5.486 -19.097 0.075 1.00 0.00 H new ATOM 0 HA ALA A 82 6.131 -18.897 2.808 1.00 0.00 H new ATOM 0 HB1 ALA A 82 5.690 -16.515 2.457 1.00 0.00 H new ATOM 0 HB2 ALA A 82 6.631 -17.202 1.112 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.892 -16.882 0.909 1.00 0.00 H new ATOM 1241 N ALA A 83 2.935 -18.528 2.102 1.00 0.00 N ATOM 1242 CA ALA A 83 1.602 -18.569 2.680 1.00 0.00 C ATOM 1243 C ALA A 83 1.379 -19.931 3.341 1.00 0.00 C ATOM 1244 O ALA A 83 0.556 -20.058 4.246 1.00 0.00 O ATOM 1245 CB ALA A 83 0.566 -18.270 1.595 1.00 0.00 C ATOM 0 H ALA A 83 2.958 -18.376 1.094 1.00 0.00 H new ATOM 0 HA ALA A 83 1.494 -17.807 3.452 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -0.434 -18.301 2.028 1.00 0.00 H new ATOM 0 HB2 ALA A 83 0.751 -17.280 1.178 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.642 -19.016 0.804 1.00 0.00 H new ATOM 1251 N ASP A 84 2.126 -20.915 2.862 1.00 0.00 N ATOM 1252 CA ASP A 84 2.020 -22.262 3.395 1.00 0.00 C ATOM 1253 C ASP A 84 2.259 -22.229 4.906 1.00 0.00 C ATOM 1254 O ASP A 84 1.366 -22.552 5.687 1.00 0.00 O ATOM 1255 CB ASP A 84 3.068 -23.185 2.771 1.00 0.00 C ATOM 1256 CG ASP A 84 2.663 -24.658 2.684 1.00 0.00 C ATOM 1257 OD1 ASP A 84 2.262 -25.199 3.738 1.00 0.00 O ATOM 1258 OD2 ASP A 84 2.763 -25.210 1.567 1.00 0.00 O ATOM 0 H ASP A 84 2.807 -20.806 2.111 1.00 0.00 H new ATOM 0 HA ASP A 84 1.024 -22.638 3.163 1.00 0.00 H new ATOM 0 HB2 ASP A 84 3.295 -22.826 1.767 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.988 -23.110 3.351 1.00 0.00 H new ATOM 1263 N GLY A 85 3.470 -21.834 5.273 1.00 0.00 N ATOM 1264 CA GLY A 85 3.838 -21.754 6.676 1.00 0.00 C ATOM 1265 C GLY A 85 5.344 -21.540 6.837 1.00 0.00 C ATOM 1266 O GLY A 85 5.990 -22.221 7.632 1.00 0.00 O ATOM 0 H GLY A 85 4.209 -21.566 4.622 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.298 -20.935 7.151 1.00 0.00 H new ATOM 0 HA3 GLY A 85 3.541 -22.670 7.186 1.00 0.00 H new ATOM 1270 N ILE A 86 5.860 -20.592 6.068 1.00 0.00 N ATOM 1271 CA ILE A 86 7.278 -20.280 6.115 1.00 0.00 C ATOM 1272 C ILE A 86 7.613 -19.649 7.469 1.00 0.00 C ATOM 1273 O ILE A 86 8.152 -20.315 8.352 1.00 0.00 O ATOM 1274 CB ILE A 86 7.676 -19.414 4.918 1.00 0.00 C ATOM 1275 CG1 ILE A 86 8.010 -20.281 3.702 1.00 0.00 C ATOM 1276 CG2 ILE A 86 8.824 -18.471 5.282 1.00 0.00 C ATOM 1277 CD1 ILE A 86 9.290 -21.086 3.937 1.00 0.00 C ATOM 0 H ILE A 86 5.321 -20.030 5.409 1.00 0.00 H new ATOM 0 HA ILE A 86 7.871 -21.191 6.032 1.00 0.00 H new ATOM 0 HB ILE A 86 6.823 -18.793 4.646 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.182 -20.960 3.496 1.00 0.00 H new ATOM 0 HG13 ILE A 86 8.130 -19.649 2.822 1.00 0.00 H new ATOM 0 HG21 ILE A 86 9.088 -17.867 4.414 1.00 0.00 H new ATOM 0 HG22 ILE A 86 8.514 -17.818 6.098 1.00 0.00 H new ATOM 0 HG23 ILE A 86 9.690 -19.055 5.594 1.00 0.00 H new ATOM 0 HD11 ILE A 86 9.504 -21.693 3.058 1.00 0.00 H new ATOM 0 HD12 ILE A 86 10.121 -20.404 4.118 1.00 0.00 H new ATOM 0 HD13 ILE A 86 9.158 -21.735 4.803 1.00 0.00 H new ATOM 1289 N ALA A 87 7.279 -18.373 7.589 1.00 0.00 N ATOM 1290 CA ALA A 87 7.537 -17.645 8.820 1.00 0.00 C ATOM 1291 C ALA A 87 6.309 -16.807 9.179 1.00 0.00 C ATOM 1292 O ALA A 87 5.176 -17.235 8.964 1.00 0.00 O ATOM 1293 CB ALA A 87 8.797 -16.792 8.654 1.00 0.00 C ATOM 0 H ALA A 87 6.832 -17.824 6.854 1.00 0.00 H new ATOM 0 HA ALA A 87 7.717 -18.336 9.644 1.00 0.00 H new ATOM 0 HB1 ALA A 87 8.991 -16.246 9.577 1.00 0.00 H new ATOM 0 HB2 ALA A 87 9.646 -17.437 8.429 1.00 0.00 H new ATOM 0 HB3 ALA A 87 8.653 -16.085 7.837 1.00 0.00 H new ATOM 1299 N GLU A 88 6.575 -15.627 9.720 1.00 0.00 N ATOM 1300 CA GLU A 88 5.505 -14.724 10.110 1.00 0.00 C ATOM 1301 C GLU A 88 5.118 -13.821 8.938 1.00 0.00 C ATOM 1302 O GLU A 88 4.064 -13.186 8.960 1.00 0.00 O ATOM 1303 CB GLU A 88 5.905 -13.896 11.332 1.00 0.00 C ATOM 1304 CG GLU A 88 6.837 -12.749 10.936 1.00 0.00 C ATOM 1305 CD GLU A 88 7.788 -12.394 12.081 1.00 0.00 C ATOM 1306 OE1 GLU A 88 8.325 -13.345 12.689 1.00 0.00 O ATOM 1307 OE2 GLU A 88 7.955 -11.179 12.323 1.00 0.00 O ATOM 0 H GLU A 88 7.516 -15.275 9.897 1.00 0.00 H new ATOM 0 HA GLU A 88 4.635 -15.320 10.385 1.00 0.00 H new ATOM 0 HB2 GLU A 88 5.012 -13.495 11.812 1.00 0.00 H new ATOM 0 HB3 GLU A 88 6.400 -14.536 12.063 1.00 0.00 H new ATOM 0 HG2 GLU A 88 7.413 -13.032 10.055 1.00 0.00 H new ATOM 0 HG3 GLU A 88 6.247 -11.874 10.664 1.00 0.00 H new ATOM 1314 N ASN A 89 5.991 -13.791 7.942 1.00 0.00 N ATOM 1315 CA ASN A 89 5.754 -12.976 6.763 1.00 0.00 C ATOM 1316 C ASN A 89 5.377 -13.882 5.589 1.00 0.00 C ATOM 1317 O ASN A 89 6.240 -14.531 4.999 1.00 0.00 O ATOM 1318 CB ASN A 89 7.009 -12.193 6.372 1.00 0.00 C ATOM 1319 CG ASN A 89 6.680 -10.721 6.118 1.00 0.00 C ATOM 1320 OD1 ASN A 89 6.158 -10.345 5.081 1.00 0.00 O ATOM 1321 ND2 ASN A 89 7.015 -9.911 7.118 1.00 0.00 N ATOM 0 H ASN A 89 6.864 -14.318 7.927 1.00 0.00 H new ATOM 0 HA ASN A 89 4.950 -12.277 6.993 1.00 0.00 H new ATOM 0 HB2 ASN A 89 7.753 -12.271 7.165 1.00 0.00 H new ATOM 0 HB3 ASN A 89 7.451 -12.630 5.477 1.00 0.00 H new ATOM 0 HD21 ASN A 89 6.838 -8.909 7.044 1.00 0.00 H new ATOM 0 HD22 ASN A 89 7.449 -10.291 7.959 1.00 0.00 H new ATOM 1328 N PRO A 90 4.054 -13.897 5.276 1.00 0.00 N ATOM 1329 CA PRO A 90 3.552 -14.713 4.183 1.00 0.00 C ATOM 1330 C PRO A 90 3.900 -14.090 2.830 1.00 0.00 C ATOM 1331 O PRO A 90 4.021 -14.796 1.830 1.00 0.00 O ATOM 1332 CB PRO A 90 2.055 -14.815 4.423 1.00 0.00 C ATOM 1333 CG PRO A 90 1.706 -13.678 5.369 1.00 0.00 C ATOM 1334 CD PRO A 90 3.003 -13.142 5.952 1.00 0.00 C ATOM 0 HA PRO A 90 4.005 -15.704 4.155 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.503 -14.728 3.487 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.794 -15.780 4.859 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.172 -12.890 4.838 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.048 -14.030 6.163 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.106 -12.072 5.772 1.00 0.00 H new ATOM 0 HD3 PRO A 90 3.042 -13.288 7.031 1.00 0.00 H new ATOM 1342 N PHE A 91 4.051 -12.774 2.842 1.00 0.00 N ATOM 1343 CA PHE A 91 4.382 -12.047 1.628 1.00 0.00 C ATOM 1344 C PHE A 91 5.882 -12.122 1.336 1.00 0.00 C ATOM 1345 O PHE A 91 6.694 -12.208 2.256 1.00 0.00 O ATOM 1346 CB PHE A 91 3.992 -10.586 1.860 1.00 0.00 C ATOM 1347 CG PHE A 91 3.554 -9.850 0.592 1.00 0.00 C ATOM 1348 CD1 PHE A 91 2.268 -9.945 0.160 1.00 0.00 C ATOM 1349 CD2 PHE A 91 4.452 -9.100 -0.103 1.00 0.00 C ATOM 1350 CE1 PHE A 91 1.862 -9.261 -1.017 1.00 0.00 C ATOM 1351 CE2 PHE A 91 4.045 -8.417 -1.279 1.00 0.00 C ATOM 1352 CZ PHE A 91 2.759 -8.512 -1.711 1.00 0.00 C ATOM 0 H PHE A 91 3.950 -12.192 3.673 1.00 0.00 H new ATOM 0 HA PHE A 91 3.852 -12.479 0.780 1.00 0.00 H new ATOM 0 HB2 PHE A 91 3.182 -10.548 2.588 1.00 0.00 H new ATOM 0 HB3 PHE A 91 4.840 -10.060 2.299 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.556 -10.540 0.712 1.00 0.00 H new ATOM 0 HD2 PHE A 91 5.473 -9.024 0.240 1.00 0.00 H new ATOM 0 HE1 PHE A 91 0.841 -9.336 -1.360 1.00 0.00 H new ATOM 0 HE2 PHE A 91 4.757 -7.822 -1.831 1.00 0.00 H new ATOM 0 HZ PHE A 91 2.450 -7.992 -2.606 1.00 0.00 H new ATOM 1362 N LEU A 92 6.205 -12.088 0.051 1.00 0.00 N ATOM 1363 CA LEU A 92 7.593 -12.151 -0.373 1.00 0.00 C ATOM 1364 C LEU A 92 7.898 -10.960 -1.285 1.00 0.00 C ATOM 1365 O LEU A 92 7.354 -10.861 -2.384 1.00 0.00 O ATOM 1366 CB LEU A 92 7.898 -13.508 -1.011 1.00 0.00 C ATOM 1367 CG LEU A 92 7.792 -14.722 -0.086 1.00 0.00 C ATOM 1368 CD1 LEU A 92 7.664 -16.016 -0.892 1.00 0.00 C ATOM 1369 CD2 LEU A 92 8.969 -14.770 0.891 1.00 0.00 C ATOM 0 H LEU A 92 5.529 -12.018 -0.710 1.00 0.00 H new ATOM 0 HA LEU A 92 8.258 -12.073 0.487 1.00 0.00 H new ATOM 0 HB2 LEU A 92 7.217 -13.654 -1.850 1.00 0.00 H new ATOM 0 HB3 LEU A 92 8.907 -13.476 -1.422 1.00 0.00 H new ATOM 0 HG LEU A 92 6.883 -14.621 0.508 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.590 -16.863 -0.210 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.769 -15.971 -1.513 1.00 0.00 H new ATOM 0 HD13 LEU A 92 8.541 -16.137 -1.528 1.00 0.00 H new ATOM 0 HD21 LEU A 92 8.870 -15.642 1.537 1.00 0.00 H new ATOM 0 HD22 LEU A 92 9.903 -14.836 0.333 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.974 -13.866 1.500 1.00 0.00 H new ATOM 1381 N ASP A 93 8.765 -10.087 -0.795 1.00 0.00 N ATOM 1382 CA ASP A 93 9.149 -8.908 -1.553 1.00 0.00 C ATOM 1383 C ASP A 93 10.057 -9.324 -2.711 1.00 0.00 C ATOM 1384 O ASP A 93 11.250 -9.024 -2.708 1.00 0.00 O ATOM 1385 CB ASP A 93 9.922 -7.919 -0.678 1.00 0.00 C ATOM 1386 CG ASP A 93 10.688 -6.839 -1.445 1.00 0.00 C ATOM 1387 OD1 ASP A 93 10.135 -6.363 -2.459 1.00 0.00 O ATOM 1388 OD2 ASP A 93 11.810 -6.514 -0.999 1.00 0.00 O ATOM 0 H ASP A 93 9.213 -10.172 0.118 1.00 0.00 H new ATOM 0 HA ASP A 93 8.239 -8.432 -1.919 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.221 -7.433 0.001 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.628 -8.476 -0.063 1.00 0.00 H new ATOM 1393 N SER A 94 9.457 -10.008 -3.675 1.00 0.00 N ATOM 1394 CA SER A 94 10.197 -10.468 -4.837 1.00 0.00 C ATOM 1395 C SER A 94 9.389 -10.205 -6.110 1.00 0.00 C ATOM 1396 O SER A 94 8.160 -10.225 -6.084 1.00 0.00 O ATOM 1397 CB SER A 94 10.535 -11.956 -4.722 1.00 0.00 C ATOM 1398 OG SER A 94 11.787 -12.268 -5.328 1.00 0.00 O ATOM 0 H SER A 94 8.467 -10.254 -3.674 1.00 0.00 H new ATOM 0 HA SER A 94 11.134 -9.913 -4.887 1.00 0.00 H new ATOM 0 HB2 SER A 94 10.560 -12.242 -3.670 1.00 0.00 H new ATOM 0 HB3 SER A 94 9.748 -12.544 -5.193 1.00 0.00 H new ATOM 0 HG SER A 94 11.967 -13.226 -5.232 1.00 0.00 H new ATOM 1404 N PRO A 95 10.132 -9.958 -7.222 1.00 0.00 N ATOM 1405 CA PRO A 95 9.498 -9.691 -8.502 1.00 0.00 C ATOM 1406 C PRO A 95 8.942 -10.977 -9.117 1.00 0.00 C ATOM 1407 O PRO A 95 8.235 -10.933 -10.122 1.00 0.00 O ATOM 1408 CB PRO A 95 10.582 -9.047 -9.351 1.00 0.00 C ATOM 1409 CG PRO A 95 11.900 -9.399 -8.681 1.00 0.00 C ATOM 1410 CD PRO A 95 11.590 -9.927 -7.290 1.00 0.00 C ATOM 0 HA PRO A 95 8.635 -9.031 -8.415 1.00 0.00 H new ATOM 0 HB2 PRO A 95 10.551 -9.422 -10.374 1.00 0.00 H new ATOM 0 HB3 PRO A 95 10.447 -7.967 -9.404 1.00 0.00 H new ATOM 0 HG2 PRO A 95 12.436 -10.149 -9.263 1.00 0.00 H new ATOM 0 HG3 PRO A 95 12.544 -8.522 -8.621 1.00 0.00 H new ATOM 0 HD2 PRO A 95 12.015 -10.920 -7.139 1.00 0.00 H new ATOM 0 HD3 PRO A 95 12.009 -9.281 -6.519 1.00 0.00 H new ATOM 1418 N ASP A 96 9.282 -12.091 -8.487 1.00 0.00 N ATOM 1419 CA ASP A 96 8.825 -13.387 -8.959 1.00 0.00 C ATOM 1420 C ASP A 96 7.418 -13.654 -8.422 1.00 0.00 C ATOM 1421 O ASP A 96 6.498 -13.931 -9.191 1.00 0.00 O ATOM 1422 CB ASP A 96 9.741 -14.508 -8.464 1.00 0.00 C ATOM 1423 CG ASP A 96 11.211 -14.366 -8.864 1.00 0.00 C ATOM 1424 OD1 ASP A 96 11.463 -13.645 -9.853 1.00 0.00 O ATOM 1425 OD2 ASP A 96 12.049 -14.982 -8.171 1.00 0.00 O ATOM 0 H ASP A 96 9.869 -12.123 -7.653 1.00 0.00 H new ATOM 0 HA ASP A 96 8.832 -13.370 -10.049 1.00 0.00 H new ATOM 0 HB2 ASP A 96 9.679 -14.554 -7.377 1.00 0.00 H new ATOM 0 HB3 ASP A 96 9.366 -15.458 -8.845 1.00 0.00 H new ATOM 1430 N ALA A 97 7.294 -13.562 -7.106 1.00 0.00 N ATOM 1431 CA ALA A 97 6.014 -13.791 -6.457 1.00 0.00 C ATOM 1432 C ALA A 97 4.924 -13.018 -7.202 1.00 0.00 C ATOM 1433 O ALA A 97 5.089 -11.835 -7.498 1.00 0.00 O ATOM 1434 CB ALA A 97 6.110 -13.389 -4.984 1.00 0.00 C ATOM 0 H ALA A 97 8.059 -13.332 -6.472 1.00 0.00 H new ATOM 0 HA ALA A 97 5.750 -14.848 -6.490 1.00 0.00 H new ATOM 0 HB1 ALA A 97 5.150 -13.561 -4.497 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.878 -13.987 -4.493 1.00 0.00 H new ATOM 0 HB3 ALA A 97 6.370 -12.333 -4.911 1.00 0.00 H new ATOM 1440 N PHE A 98 3.835 -13.718 -7.485 1.00 0.00 N ATOM 1441 CA PHE A 98 2.719 -13.112 -8.190 1.00 0.00 C ATOM 1442 C PHE A 98 1.439 -13.181 -7.353 1.00 0.00 C ATOM 1443 O PHE A 98 1.138 -14.214 -6.758 1.00 0.00 O ATOM 1444 CB PHE A 98 2.515 -13.913 -9.478 1.00 0.00 C ATOM 1445 CG PHE A 98 3.757 -13.985 -10.368 1.00 0.00 C ATOM 1446 CD1 PHE A 98 4.119 -12.910 -11.119 1.00 0.00 C ATOM 1447 CD2 PHE A 98 4.499 -15.124 -10.410 1.00 0.00 C ATOM 1448 CE1 PHE A 98 5.272 -12.977 -11.945 1.00 0.00 C ATOM 1449 CE2 PHE A 98 5.652 -15.191 -11.237 1.00 0.00 C ATOM 1450 CZ PHE A 98 6.014 -14.116 -11.987 1.00 0.00 C ATOM 0 H PHE A 98 3.702 -14.699 -7.239 1.00 0.00 H new ATOM 0 HA PHE A 98 2.933 -12.063 -8.393 1.00 0.00 H new ATOM 0 HB2 PHE A 98 2.207 -14.926 -9.219 1.00 0.00 H new ATOM 0 HB3 PHE A 98 1.699 -13.467 -10.046 1.00 0.00 H new ATOM 0 HD1 PHE A 98 3.529 -12.006 -11.087 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.212 -15.978 -9.814 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.560 -12.123 -12.540 1.00 0.00 H new ATOM 0 HE2 PHE A 98 6.241 -16.096 -11.270 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.891 -14.167 -12.616 1.00 0.00 H new ATOM 1460 N TYR A 99 0.722 -12.067 -7.335 1.00 0.00 N ATOM 1461 CA TYR A 99 -0.518 -11.988 -6.581 1.00 0.00 C ATOM 1462 C TYR A 99 -1.625 -11.337 -7.413 1.00 0.00 C ATOM 1463 O TYR A 99 -1.349 -10.698 -8.427 1.00 0.00 O ATOM 1464 CB TYR A 99 -0.219 -11.104 -5.369 1.00 0.00 C ATOM 1465 CG TYR A 99 0.888 -11.645 -4.462 1.00 0.00 C ATOM 1466 CD1 TYR A 99 0.590 -12.584 -3.495 1.00 0.00 C ATOM 1467 CD2 TYR A 99 2.184 -11.194 -4.610 1.00 0.00 C ATOM 1468 CE1 TYR A 99 1.632 -13.093 -2.641 1.00 0.00 C ATOM 1469 CE2 TYR A 99 3.225 -11.704 -3.756 1.00 0.00 C ATOM 1470 CZ TYR A 99 2.898 -12.628 -2.814 1.00 0.00 C ATOM 1471 OH TYR A 99 3.881 -13.109 -2.007 1.00 0.00 O ATOM 0 H TYR A 99 0.976 -11.212 -7.830 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.859 -12.984 -6.298 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.064 -10.111 -5.718 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -1.131 -10.988 -4.783 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.424 -12.937 -3.379 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.417 -10.459 -5.366 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.413 -13.828 -1.880 1.00 0.00 H new ATOM 0 HE2 TYR A 99 4.243 -11.360 -3.861 1.00 0.00 H new ATOM 0 HH TYR A 99 4.756 -12.882 -2.386 1.00 0.00 H new ATOM 1481 N TYR A 100 -2.853 -11.521 -6.952 1.00 0.00 N ATOM 1482 CA TYR A 100 -4.003 -10.958 -7.640 1.00 0.00 C ATOM 1483 C TYR A 100 -5.198 -10.826 -6.694 1.00 0.00 C ATOM 1484 O TYR A 100 -5.295 -11.551 -5.705 1.00 0.00 O ATOM 1485 CB TYR A 100 -4.355 -11.949 -8.751 1.00 0.00 C ATOM 1486 CG TYR A 100 -4.880 -13.294 -8.243 1.00 0.00 C ATOM 1487 CD1 TYR A 100 -3.994 -14.295 -7.900 1.00 0.00 C ATOM 1488 CD2 TYR A 100 -6.239 -13.504 -8.127 1.00 0.00 C ATOM 1489 CE1 TYR A 100 -4.488 -15.560 -7.422 1.00 0.00 C ATOM 1490 CE2 TYR A 100 -6.733 -14.769 -7.648 1.00 0.00 C ATOM 1491 CZ TYR A 100 -5.833 -15.735 -7.320 1.00 0.00 C ATOM 1492 OH TYR A 100 -6.300 -16.930 -6.868 1.00 0.00 O ATOM 0 H TYR A 100 -3.077 -12.052 -6.110 1.00 0.00 H new ATOM 0 HA TYR A 100 -3.772 -9.964 -8.023 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -5.106 -11.499 -9.400 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.469 -12.124 -9.362 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -2.931 -14.129 -7.990 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -6.932 -12.720 -8.395 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -3.806 -16.352 -7.151 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -7.794 -14.947 -7.551 1.00 0.00 H new ATOM 0 HH TYR A 100 -7.280 -16.911 -6.846 1.00 0.00 H new ATOM 1502 N PHE A 101 -6.077 -9.894 -7.030 1.00 0.00 N ATOM 1503 CA PHE A 101 -7.262 -9.656 -6.223 1.00 0.00 C ATOM 1504 C PHE A 101 -8.316 -10.739 -6.464 1.00 0.00 C ATOM 1505 O PHE A 101 -8.508 -11.182 -7.595 1.00 0.00 O ATOM 1506 CB PHE A 101 -7.831 -8.303 -6.651 1.00 0.00 C ATOM 1507 CG PHE A 101 -6.787 -7.187 -6.736 1.00 0.00 C ATOM 1508 CD1 PHE A 101 -5.944 -6.964 -5.693 1.00 0.00 C ATOM 1509 CD2 PHE A 101 -6.703 -6.419 -7.856 1.00 0.00 C ATOM 1510 CE1 PHE A 101 -4.975 -5.929 -5.772 1.00 0.00 C ATOM 1511 CE2 PHE A 101 -5.734 -5.384 -7.935 1.00 0.00 C ATOM 1512 CZ PHE A 101 -4.890 -5.161 -6.892 1.00 0.00 C ATOM 0 H PHE A 101 -5.993 -9.294 -7.851 1.00 0.00 H new ATOM 0 HA PHE A 101 -7.000 -9.670 -5.165 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.310 -8.413 -7.624 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -8.607 -8.007 -5.945 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -6.011 -7.574 -4.804 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -7.373 -6.596 -8.684 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -4.306 -5.751 -4.943 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -5.667 -4.774 -8.824 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.152 -4.374 -6.953 1.00 0.00 H new ATOM 1522 N PRO A 102 -8.988 -11.144 -5.354 1.00 0.00 N ATOM 1523 CA PRO A 102 -10.018 -12.167 -5.434 1.00 0.00 C ATOM 1524 C PRO A 102 -11.301 -11.605 -6.049 1.00 0.00 C ATOM 1525 O PRO A 102 -12.258 -11.308 -5.334 1.00 0.00 O ATOM 1526 CB PRO A 102 -10.205 -12.649 -4.004 1.00 0.00 C ATOM 1527 CG PRO A 102 -9.616 -11.564 -3.118 1.00 0.00 C ATOM 1528 CD PRO A 102 -8.787 -10.642 -3.998 1.00 0.00 C ATOM 0 HA PRO A 102 -9.740 -12.995 -6.086 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -11.260 -12.806 -3.780 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -9.700 -13.601 -3.844 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -10.409 -11.006 -2.620 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -8.997 -12.004 -2.336 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -9.115 -9.607 -3.906 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -7.734 -10.669 -3.718 1.00 0.00 H new ATOM 1536 N ASP A 103 -11.281 -11.477 -7.367 1.00 0.00 N ATOM 1537 CA ASP A 103 -12.431 -10.957 -8.086 1.00 0.00 C ATOM 1538 C ASP A 103 -12.076 -10.804 -9.567 1.00 0.00 C ATOM 1539 O ASP A 103 -12.909 -11.049 -10.437 1.00 0.00 O ATOM 1540 CB ASP A 103 -12.838 -9.582 -7.553 1.00 0.00 C ATOM 1541 CG ASP A 103 -13.918 -8.866 -8.368 1.00 0.00 C ATOM 1542 OD1 ASP A 103 -13.585 -8.430 -9.491 1.00 0.00 O ATOM 1543 OD2 ASP A 103 -15.050 -8.770 -7.848 1.00 0.00 O ATOM 0 H ASP A 103 -10.486 -11.725 -7.956 1.00 0.00 H new ATOM 0 HA ASP A 103 -13.257 -11.655 -7.951 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -13.193 -9.697 -6.529 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -11.953 -8.947 -7.514 1.00 0.00 H new ATOM 1548 N SER A 104 -10.837 -10.400 -9.806 1.00 0.00 N ATOM 1549 CA SER A 104 -10.361 -10.211 -11.166 1.00 0.00 C ATOM 1550 C SER A 104 -9.454 -11.376 -11.569 1.00 0.00 C ATOM 1551 O SER A 104 -9.838 -12.212 -12.385 1.00 0.00 O ATOM 1552 CB SER A 104 -9.614 -8.883 -11.309 1.00 0.00 C ATOM 1553 OG SER A 104 -10.405 -7.894 -11.962 1.00 0.00 O ATOM 0 H SER A 104 -10.148 -10.198 -9.081 1.00 0.00 H new ATOM 0 HA SER A 104 -11.225 -10.184 -11.830 1.00 0.00 H new ATOM 0 HB2 SER A 104 -9.324 -8.522 -10.322 1.00 0.00 H new ATOM 0 HB3 SER A 104 -8.695 -9.043 -11.873 1.00 0.00 H new ATOM 0 HG SER A 104 -9.894 -7.061 -12.033 1.00 0.00 H new ATOM 1559 N GLY A 105 -8.268 -11.392 -10.978 1.00 0.00 N ATOM 1560 CA GLY A 105 -7.303 -12.440 -11.265 1.00 0.00 C ATOM 1561 C GLY A 105 -7.291 -12.780 -12.757 1.00 0.00 C ATOM 1562 O GLY A 105 -7.639 -11.945 -13.590 1.00 0.00 O ATOM 0 H GLY A 105 -7.954 -10.696 -10.302 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -6.309 -12.119 -10.953 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -7.546 -13.332 -10.687 1.00 0.00 H new ATOM 1566 N PRO A 106 -6.875 -14.040 -13.056 1.00 0.00 N ATOM 1567 CA PRO A 106 -6.812 -14.500 -14.433 1.00 0.00 C ATOM 1568 C PRO A 106 -8.212 -14.796 -14.976 1.00 0.00 C ATOM 1569 O PRO A 106 -9.144 -15.025 -14.208 1.00 0.00 O ATOM 1570 CB PRO A 106 -5.917 -15.728 -14.397 1.00 0.00 C ATOM 1571 CG PRO A 106 -5.890 -16.181 -12.946 1.00 0.00 C ATOM 1572 CD PRO A 106 -6.455 -15.056 -12.095 1.00 0.00 C ATOM 0 HA PRO A 106 -6.407 -13.748 -15.110 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -6.306 -16.514 -15.044 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -4.914 -15.491 -14.751 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -6.480 -17.089 -12.819 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -4.871 -16.417 -12.639 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -7.294 -15.400 -11.490 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -5.705 -14.665 -11.407 1.00 0.00 H new ATOM 1580 N SER A 107 -8.314 -14.781 -16.297 1.00 0.00 N ATOM 1581 CA SER A 107 -9.584 -15.045 -16.953 1.00 0.00 C ATOM 1582 C SER A 107 -9.395 -16.083 -18.061 1.00 0.00 C ATOM 1583 O SER A 107 -8.875 -15.767 -19.129 1.00 0.00 O ATOM 1584 CB SER A 107 -10.185 -13.760 -17.526 1.00 0.00 C ATOM 1585 OG SER A 107 -11.592 -13.872 -17.726 1.00 0.00 O ATOM 0 H SER A 107 -7.538 -14.590 -16.931 1.00 0.00 H new ATOM 0 HA SER A 107 -10.278 -15.439 -16.210 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.980 -12.931 -16.849 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.702 -13.525 -18.474 1.00 0.00 H new ATOM 0 HG SER A 107 -11.938 -13.031 -18.091 1.00 0.00 H new ATOM 1591 N SER A 108 -9.829 -17.300 -17.768 1.00 0.00 N ATOM 1592 CA SER A 108 -9.714 -18.386 -18.726 1.00 0.00 C ATOM 1593 C SER A 108 -8.241 -18.663 -19.029 1.00 0.00 C ATOM 1594 O SER A 108 -7.655 -18.033 -19.909 1.00 0.00 O ATOM 1595 CB SER A 108 -10.471 -18.064 -20.016 1.00 0.00 C ATOM 1596 OG SER A 108 -11.858 -18.372 -19.913 1.00 0.00 O ATOM 0 H SER A 108 -10.261 -17.558 -16.881 1.00 0.00 H new ATOM 0 HA SER A 108 -10.161 -19.278 -18.288 1.00 0.00 H new ATOM 0 HB2 SER A 108 -10.351 -17.007 -20.252 1.00 0.00 H new ATOM 0 HB3 SER A 108 -10.035 -18.626 -20.842 1.00 0.00 H new ATOM 0 HG SER A 108 -12.306 -18.150 -20.756 1.00 0.00 H new ATOM 1602 N GLY A 109 -7.683 -19.606 -18.284 1.00 0.00 N ATOM 1603 CA GLY A 109 -6.289 -19.974 -18.463 1.00 0.00 C ATOM 1604 C GLY A 109 -5.511 -19.828 -17.153 1.00 0.00 C ATOM 1605 O GLY A 109 -4.915 -18.783 -16.894 1.00 0.00 O ATOM 0 H GLY A 109 -8.171 -20.126 -17.555 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -6.223 -21.003 -18.816 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -5.838 -19.344 -19.230 1.00 0.00 H new TER 1609 GLY A 109