USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 908 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 20 MET CE :methyl 179:sc= -0.327 (180deg=-0.0422) USER MOD Set 1.2: A 24 GLN :FLIP amide:sc= -0.287 F(o=-1.8,f=-0.61) USER MOD Single : A 1 GLY N :NH3+ 143:sc= 0.0152 (180deg=0) USER MOD Single : A 2 MET CE :methyl 176:sc= 0 (180deg=-0.0104) USER MOD Single : A 3 ASN : amide:sc= -0.207 K(o=-0.21,f=-0.95) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 159:sc= 2.03 (180deg=1.58) USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= -0.0294 K(o=-0.029,f=-0.63) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.077) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -127:sc= 1.2 (180deg=0.463) USER MOD Single : A 37 THR OG1 : rot -9:sc= 0.296 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0.626 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 30:sc= -0.211 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ -141:sc= 1.01 (180deg=-0.0514) USER MOD Single : A 66 THR OG1 : rot -67:sc= 1.32 USER MOD Single : A 71 ASN : amide:sc= 0.949 K(o=0.95,f=0) USER MOD Single : A 74 LYS NZ :NH3+ -168:sc= 0.892 (180deg=0.172) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= 0.857 K(o=0.86,f=-0.031) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.879 8.053 18.415 1.00 0.00 N ATOM 2 CA GLY A 1 -18.672 8.575 17.058 1.00 0.00 C ATOM 3 C GLY A 1 -18.788 10.080 17.106 1.00 0.00 C ATOM 4 O GLY A 1 -19.783 10.568 17.635 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.407 7.159 18.366 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.957 7.886 18.867 1.00 0.00 H new ATOM 0 H3 GLY A 1 -19.419 8.744 18.974 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.691 8.282 16.684 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -19.412 8.159 16.374 1.00 0.00 H new ATOM 8 N MET A 2 -17.792 10.813 16.596 1.00 0.00 N ATOM 9 CA MET A 2 -17.785 12.281 16.639 1.00 0.00 C ATOM 10 C MET A 2 -18.100 12.925 15.283 1.00 0.00 C ATOM 11 O MET A 2 -18.421 14.114 15.246 1.00 0.00 O ATOM 12 CB MET A 2 -16.469 12.799 17.251 1.00 0.00 C ATOM 13 CG MET A 2 -15.185 12.420 16.502 1.00 0.00 C ATOM 14 SD MET A 2 -14.845 13.266 14.940 1.00 0.00 S ATOM 15 CE MET A 2 -14.380 14.909 15.542 1.00 0.00 C ATOM 0 H MET A 2 -16.972 10.409 16.144 1.00 0.00 H new ATOM 0 HA MET A 2 -18.601 12.590 17.293 1.00 0.00 H new ATOM 0 HB2 MET A 2 -16.523 13.886 17.312 1.00 0.00 H new ATOM 0 HB3 MET A 2 -16.394 12.425 18.272 1.00 0.00 H new ATOM 0 HG2 MET A 2 -14.342 12.597 17.170 1.00 0.00 H new ATOM 0 HG3 MET A 2 -15.216 11.349 16.304 1.00 0.00 H new ATOM 0 HE1 MET A 2 -14.072 15.531 14.701 1.00 0.00 H new ATOM 0 HE2 MET A 2 -15.234 15.369 16.040 1.00 0.00 H new ATOM 0 HE3 MET A 2 -13.554 14.818 16.248 1.00 0.00 H new ATOM 25 N ASN A 3 -18.047 12.161 14.188 1.00 0.00 N ATOM 26 CA ASN A 3 -18.323 12.588 12.814 1.00 0.00 C ATOM 27 C ASN A 3 -18.989 11.426 12.067 1.00 0.00 C ATOM 28 O ASN A 3 -19.009 10.303 12.589 1.00 0.00 O ATOM 29 CB ASN A 3 -17.025 13.047 12.109 1.00 0.00 C ATOM 30 CG ASN A 3 -16.875 14.568 12.103 1.00 0.00 C ATOM 31 OD1 ASN A 3 -17.853 15.302 11.964 1.00 0.00 O ATOM 32 ND2 ASN A 3 -15.674 15.095 12.252 1.00 0.00 N ATOM 0 H ASN A 3 -17.797 11.174 14.240 1.00 0.00 H new ATOM 0 HA ASN A 3 -18.998 13.444 12.820 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -16.165 12.601 12.609 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -17.022 12.680 11.083 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -15.558 16.108 12.252 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -14.862 14.489 12.367 1.00 0.00 H new ATOM 39 N PRO A 4 -19.594 11.633 10.886 1.00 0.00 N ATOM 40 CA PRO A 4 -20.234 10.545 10.154 1.00 0.00 C ATOM 41 C PRO A 4 -19.229 9.514 9.625 1.00 0.00 C ATOM 42 O PRO A 4 -19.515 8.314 9.662 1.00 0.00 O ATOM 43 CB PRO A 4 -21.001 11.214 9.016 1.00 0.00 C ATOM 44 CG PRO A 4 -20.258 12.523 8.783 1.00 0.00 C ATOM 45 CD PRO A 4 -19.787 12.897 10.187 1.00 0.00 C ATOM 0 HA PRO A 4 -20.893 9.975 10.809 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -21.005 10.594 8.120 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -22.042 11.390 9.287 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -19.422 12.397 8.096 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -20.908 13.287 8.357 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -18.860 13.470 10.150 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -20.525 13.517 10.696 1.00 0.00 H new ATOM 53 N ALA A 5 -18.038 9.963 9.208 1.00 0.00 N ATOM 54 CA ALA A 5 -17.129 9.226 8.331 1.00 0.00 C ATOM 55 C ALA A 5 -17.838 8.796 7.036 1.00 0.00 C ATOM 56 O ALA A 5 -18.927 9.281 6.714 1.00 0.00 O ATOM 57 CB ALA A 5 -16.447 8.063 9.070 1.00 0.00 C ATOM 0 H ALA A 5 -17.673 10.875 9.481 1.00 0.00 H new ATOM 0 HA ALA A 5 -16.324 9.896 8.031 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -15.779 7.539 8.386 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -15.873 8.453 9.910 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -17.205 7.372 9.438 1.00 0.00 H new ATOM 63 N TYR A 6 -17.174 7.932 6.268 1.00 0.00 N ATOM 64 CA TYR A 6 -17.641 7.329 5.037 1.00 0.00 C ATOM 65 C TYR A 6 -17.455 5.822 5.116 1.00 0.00 C ATOM 66 O TYR A 6 -16.415 5.346 5.585 1.00 0.00 O ATOM 67 CB TYR A 6 -16.950 7.904 3.800 1.00 0.00 C ATOM 68 CG TYR A 6 -15.600 8.531 4.028 1.00 0.00 C ATOM 69 CD1 TYR A 6 -15.632 9.825 4.552 1.00 0.00 C ATOM 70 CD2 TYR A 6 -14.378 7.910 3.714 1.00 0.00 C ATOM 71 CE1 TYR A 6 -14.442 10.552 4.695 1.00 0.00 C ATOM 72 CE2 TYR A 6 -13.175 8.628 3.874 1.00 0.00 C ATOM 73 CZ TYR A 6 -13.209 9.965 4.338 1.00 0.00 C ATOM 74 OH TYR A 6 -12.083 10.727 4.407 1.00 0.00 O ATOM 0 H TYR A 6 -16.234 7.620 6.513 1.00 0.00 H new ATOM 0 HA TYR A 6 -18.700 7.564 4.927 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -16.838 7.105 3.067 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -17.606 8.653 3.357 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -16.573 10.265 4.847 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -14.361 6.892 3.353 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -14.469 11.561 5.078 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -12.230 8.159 3.643 1.00 0.00 H new ATOM 0 HH TYR A 6 -11.309 10.192 4.133 1.00 0.00 H new ATOM 84 N ARG A 7 -18.407 5.061 4.568 1.00 0.00 N ATOM 85 CA ARG A 7 -18.321 3.599 4.490 1.00 0.00 C ATOM 86 C ARG A 7 -17.053 3.159 3.746 1.00 0.00 C ATOM 87 O ARG A 7 -16.470 2.141 4.091 1.00 0.00 O ATOM 88 CB ARG A 7 -19.600 3.034 3.835 1.00 0.00 C ATOM 89 CG ARG A 7 -20.200 1.808 4.546 1.00 0.00 C ATOM 90 CD ARG A 7 -20.890 2.158 5.876 1.00 0.00 C ATOM 91 NE ARG A 7 -21.762 1.055 6.331 1.00 0.00 N ATOM 92 CZ ARG A 7 -23.099 1.065 6.447 1.00 0.00 C ATOM 93 NH1 ARG A 7 -23.810 2.176 6.295 1.00 0.00 N ATOM 94 NH2 ARG A 7 -23.726 -0.071 6.720 1.00 0.00 N ATOM 0 H ARG A 7 -19.262 5.443 4.164 1.00 0.00 H new ATOM 0 HA ARG A 7 -18.249 3.193 5.499 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -20.353 3.822 3.801 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -19.375 2.764 2.803 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -20.922 1.329 3.884 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -19.409 1.082 4.734 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -20.137 2.367 6.636 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -21.481 3.066 5.755 1.00 0.00 H new ATOM 0 HE ARG A 7 -21.294 0.186 6.586 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -23.341 3.057 6.083 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -24.825 2.149 6.390 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -23.193 -0.932 6.838 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -24.742 -0.084 6.812 1.00 0.00 H new ATOM 108 N LYS A 8 -16.571 3.950 2.777 1.00 0.00 N ATOM 109 CA LYS A 8 -15.311 3.730 2.054 1.00 0.00 C ATOM 110 C LYS A 8 -14.155 3.382 2.993 1.00 0.00 C ATOM 111 O LYS A 8 -13.430 2.421 2.714 1.00 0.00 O ATOM 112 CB LYS A 8 -14.984 4.973 1.198 1.00 0.00 C ATOM 113 CG LYS A 8 -14.780 4.737 -0.307 1.00 0.00 C ATOM 114 CD LYS A 8 -13.519 3.933 -0.672 1.00 0.00 C ATOM 115 CE LYS A 8 -12.784 4.522 -1.888 1.00 0.00 C ATOM 116 NZ LYS A 8 -11.890 5.646 -1.531 1.00 0.00 N ATOM 0 H LYS A 8 -17.063 4.787 2.465 1.00 0.00 H new ATOM 0 HA LYS A 8 -15.441 2.868 1.400 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -15.791 5.695 1.323 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -14.080 5.433 1.597 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -15.652 4.215 -0.700 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -14.735 5.704 -0.809 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -12.844 3.912 0.183 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -13.797 2.901 -0.883 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -12.199 3.737 -2.368 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -13.517 4.865 -2.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -11.175 5.771 -2.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -12.449 6.518 -1.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -11.417 5.440 -0.628 1.00 0.00 H new ATOM 130 N ALA A 9 -14.015 4.128 4.095 1.00 0.00 N ATOM 131 CA ALA A 9 -12.872 4.023 4.992 1.00 0.00 C ATOM 132 C ALA A 9 -12.745 2.628 5.609 1.00 0.00 C ATOM 133 O ALA A 9 -11.627 2.196 5.881 1.00 0.00 O ATOM 134 CB ALA A 9 -12.980 5.084 6.094 1.00 0.00 C ATOM 0 H ALA A 9 -14.700 4.825 4.386 1.00 0.00 H new ATOM 0 HA ALA A 9 -11.972 4.195 4.402 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.123 5.002 6.763 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.995 6.076 5.643 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -13.898 4.928 6.660 1.00 0.00 H new ATOM 140 N MET A 10 -13.856 1.898 5.772 1.00 0.00 N ATOM 141 CA MET A 10 -13.879 0.579 6.395 1.00 0.00 C ATOM 142 C MET A 10 -13.023 -0.432 5.648 1.00 0.00 C ATOM 143 O MET A 10 -12.730 -1.476 6.223 1.00 0.00 O ATOM 144 CB MET A 10 -15.317 0.039 6.456 1.00 0.00 C ATOM 145 CG MET A 10 -16.064 0.521 7.693 1.00 0.00 C ATOM 146 SD MET A 10 -15.660 -0.458 9.163 1.00 0.00 S ATOM 147 CE MET A 10 -16.556 0.536 10.368 1.00 0.00 C ATOM 0 H MET A 10 -14.776 2.217 5.468 1.00 0.00 H new ATOM 0 HA MET A 10 -13.472 0.707 7.398 1.00 0.00 H new ATOM 0 HB2 MET A 10 -15.858 0.351 5.563 1.00 0.00 H new ATOM 0 HB3 MET A 10 -15.294 -1.051 6.450 1.00 0.00 H new ATOM 0 HG2 MET A 10 -15.820 1.567 7.877 1.00 0.00 H new ATOM 0 HG3 MET A 10 -17.137 0.471 7.509 1.00 0.00 H new ATOM 0 HE1 MET A 10 -16.437 0.100 11.360 1.00 0.00 H new ATOM 0 HE2 MET A 10 -16.160 1.552 10.368 1.00 0.00 H new ATOM 0 HE3 MET A 10 -17.614 0.559 10.106 1.00 0.00 H new ATOM 157 N LEU A 11 -12.662 -0.186 4.384 1.00 0.00 N ATOM 158 CA LEU A 11 -11.801 -1.085 3.625 1.00 0.00 C ATOM 159 C LEU A 11 -10.356 -0.583 3.614 1.00 0.00 C ATOM 160 O LEU A 11 -9.416 -1.372 3.548 1.00 0.00 O ATOM 161 CB LEU A 11 -12.344 -1.215 2.195 1.00 0.00 C ATOM 162 CG LEU A 11 -11.861 -2.491 1.475 1.00 0.00 C ATOM 163 CD1 LEU A 11 -12.424 -3.790 2.074 1.00 0.00 C ATOM 164 CD2 LEU A 11 -12.312 -2.418 0.014 1.00 0.00 C ATOM 0 H LEU A 11 -12.960 0.640 3.864 1.00 0.00 H new ATOM 0 HA LEU A 11 -11.801 -2.065 4.102 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.434 -1.213 2.225 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -12.040 -0.342 1.617 1.00 0.00 H new ATOM 0 HG LEU A 11 -10.777 -2.524 1.584 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -12.040 -4.644 1.516 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -12.119 -3.872 3.117 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -13.512 -3.777 2.014 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -11.980 -3.312 -0.514 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.399 -2.354 -0.028 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -11.878 -1.536 -0.457 1.00 0.00 H new ATOM 176 N GLU A 12 -10.172 0.732 3.689 1.00 0.00 N ATOM 177 CA GLU A 12 -8.890 1.397 3.492 1.00 0.00 C ATOM 178 C GLU A 12 -7.968 1.170 4.704 1.00 0.00 C ATOM 179 O GLU A 12 -6.747 1.298 4.589 1.00 0.00 O ATOM 180 CB GLU A 12 -9.154 2.883 3.157 1.00 0.00 C ATOM 181 CG GLU A 12 -9.966 2.986 1.845 1.00 0.00 C ATOM 182 CD GLU A 12 -10.365 4.397 1.402 1.00 0.00 C ATOM 183 OE1 GLU A 12 -11.149 5.076 2.101 1.00 0.00 O ATOM 184 OE2 GLU A 12 -10.017 4.758 0.254 1.00 0.00 O ATOM 0 H GLU A 12 -10.932 1.381 3.894 1.00 0.00 H new ATOM 0 HA GLU A 12 -8.350 0.969 2.648 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -9.700 3.358 3.972 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -8.209 3.416 3.054 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -9.383 2.528 1.045 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -10.874 2.393 1.957 1.00 0.00 H new ATOM 191 N SER A 13 -8.521 0.760 5.850 1.00 0.00 N ATOM 192 CA SER A 13 -7.769 0.360 7.040 1.00 0.00 C ATOM 193 C SER A 13 -7.561 -1.164 7.124 1.00 0.00 C ATOM 194 O SER A 13 -6.680 -1.609 7.857 1.00 0.00 O ATOM 195 CB SER A 13 -8.496 0.863 8.300 1.00 0.00 C ATOM 196 OG SER A 13 -9.370 1.953 8.051 1.00 0.00 O ATOM 0 H SER A 13 -9.531 0.696 5.977 1.00 0.00 H new ATOM 0 HA SER A 13 -6.780 0.812 6.970 1.00 0.00 H new ATOM 0 HB2 SER A 13 -9.067 0.041 8.733 1.00 0.00 H new ATOM 0 HB3 SER A 13 -7.756 1.163 9.042 1.00 0.00 H new ATOM 0 HG SER A 13 -9.801 2.224 8.888 1.00 0.00 H new ATOM 202 N GLU A 14 -8.335 -1.973 6.392 1.00 0.00 N ATOM 203 CA GLU A 14 -8.179 -3.419 6.322 1.00 0.00 C ATOM 204 C GLU A 14 -6.908 -3.698 5.529 1.00 0.00 C ATOM 205 O GLU A 14 -5.991 -4.370 5.988 1.00 0.00 O ATOM 206 CB GLU A 14 -9.384 -4.016 5.575 1.00 0.00 C ATOM 207 CG GLU A 14 -10.745 -3.794 6.248 1.00 0.00 C ATOM 208 CD GLU A 14 -11.197 -4.859 7.238 1.00 0.00 C ATOM 209 OE1 GLU A 14 -10.840 -6.042 7.066 1.00 0.00 O ATOM 210 OE2 GLU A 14 -12.078 -4.547 8.078 1.00 0.00 O ATOM 0 H GLU A 14 -9.105 -1.626 5.820 1.00 0.00 H new ATOM 0 HA GLU A 14 -8.120 -3.858 7.318 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -9.418 -3.589 4.573 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -9.225 -5.088 5.459 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -10.716 -2.836 6.767 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -11.502 -3.711 5.468 1.00 0.00 H new ATOM 217 N ILE A 15 -6.862 -3.129 4.325 1.00 0.00 N ATOM 218 CA ILE A 15 -5.792 -3.269 3.353 1.00 0.00 C ATOM 219 C ILE A 15 -4.469 -2.867 4.004 1.00 0.00 C ATOM 220 O ILE A 15 -3.479 -3.574 3.847 1.00 0.00 O ATOM 221 CB ILE A 15 -6.202 -2.433 2.117 1.00 0.00 C ATOM 222 CG1 ILE A 15 -7.383 -3.160 1.429 1.00 0.00 C ATOM 223 CG2 ILE A 15 -5.042 -2.185 1.138 1.00 0.00 C ATOM 224 CD1 ILE A 15 -8.101 -2.303 0.388 1.00 0.00 C ATOM 0 H ILE A 15 -7.613 -2.527 3.989 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.637 -4.294 3.015 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.502 -1.439 2.448 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -7.012 -4.066 0.949 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -8.100 -3.472 2.189 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -5.398 -1.593 0.295 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.244 -1.646 1.648 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -4.661 -3.140 0.776 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -8.917 -2.875 -0.054 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -8.502 -1.409 0.866 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -7.397 -2.013 -0.392 1.00 0.00 H new ATOM 236 N GLN A 16 -4.459 -1.793 4.795 1.00 0.00 N ATOM 237 CA GLN A 16 -3.295 -1.332 5.518 1.00 0.00 C ATOM 238 C GLN A 16 -2.705 -2.412 6.432 1.00 0.00 C ATOM 239 O GLN A 16 -1.487 -2.594 6.471 1.00 0.00 O ATOM 240 CB GLN A 16 -3.712 -0.073 6.286 1.00 0.00 C ATOM 241 CG GLN A 16 -2.494 0.723 6.748 1.00 0.00 C ATOM 242 CD GLN A 16 -2.830 1.743 7.828 1.00 0.00 C ATOM 243 OE1 GLN A 16 -3.995 2.056 8.070 1.00 0.00 O ATOM 244 NE2 GLN A 16 -1.829 2.227 8.535 1.00 0.00 N ATOM 0 H GLN A 16 -5.284 -1.213 4.948 1.00 0.00 H new ATOM 0 HA GLN A 16 -2.489 -1.097 4.823 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -4.338 0.553 5.650 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -4.315 -0.354 7.150 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -1.739 0.035 7.127 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -2.056 1.237 5.893 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -0.871 1.953 8.316 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -2.012 2.875 9.301 1.00 0.00 H new ATOM 253 N LYS A 17 -3.547 -3.142 7.163 1.00 0.00 N ATOM 254 CA LYS A 17 -3.101 -4.185 8.078 1.00 0.00 C ATOM 255 C LYS A 17 -2.571 -5.377 7.294 1.00 0.00 C ATOM 256 O LYS A 17 -1.559 -5.959 7.693 1.00 0.00 O ATOM 257 CB LYS A 17 -4.263 -4.583 8.971 1.00 0.00 C ATOM 258 CG LYS A 17 -4.463 -3.615 10.148 1.00 0.00 C ATOM 259 CD LYS A 17 -5.802 -3.854 10.861 1.00 0.00 C ATOM 260 CE LYS A 17 -5.880 -5.213 11.569 1.00 0.00 C ATOM 261 NZ LYS A 17 -5.108 -5.252 12.829 1.00 0.00 N ATOM 0 H LYS A 17 -4.560 -3.024 7.135 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.288 -3.814 8.702 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -5.176 -4.621 8.377 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -4.092 -5.588 9.357 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -3.646 -3.734 10.860 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -4.423 -2.588 9.785 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -5.963 -3.062 11.592 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -6.610 -3.785 10.133 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.923 -5.447 11.781 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -5.510 -5.988 10.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -5.198 -6.193 13.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -4.106 -5.057 12.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -5.476 -4.533 13.484 1.00 0.00 H new ATOM 275 N LEU A 18 -3.240 -5.737 6.200 1.00 0.00 N ATOM 276 CA LEU A 18 -2.842 -6.843 5.341 1.00 0.00 C ATOM 277 C LEU A 18 -1.490 -6.551 4.683 1.00 0.00 C ATOM 278 O LEU A 18 -0.663 -7.454 4.563 1.00 0.00 O ATOM 279 CB LEU A 18 -3.960 -7.124 4.314 1.00 0.00 C ATOM 280 CG LEU A 18 -5.290 -7.583 4.958 1.00 0.00 C ATOM 281 CD1 LEU A 18 -6.375 -7.806 3.901 1.00 0.00 C ATOM 282 CD2 LEU A 18 -5.127 -8.855 5.791 1.00 0.00 C ATOM 0 H LEU A 18 -4.085 -5.260 5.884 1.00 0.00 H new ATOM 0 HA LEU A 18 -2.707 -7.747 5.935 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -4.141 -6.222 3.730 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -3.619 -7.891 3.618 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.595 -6.776 5.624 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.296 -8.128 4.387 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.555 -6.876 3.362 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.048 -8.574 3.200 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.089 -9.134 6.221 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.766 -9.663 5.155 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.410 -8.676 6.592 1.00 0.00 H new ATOM 294 N LEU A 19 -1.237 -5.298 4.297 1.00 0.00 N ATOM 295 CA LEU A 19 0.050 -4.847 3.778 1.00 0.00 C ATOM 296 C LEU A 19 1.113 -4.914 4.882 1.00 0.00 C ATOM 297 O LEU A 19 2.201 -5.428 4.640 1.00 0.00 O ATOM 298 CB LEU A 19 -0.071 -3.419 3.215 1.00 0.00 C ATOM 299 CG LEU A 19 -0.877 -3.316 1.900 1.00 0.00 C ATOM 300 CD1 LEU A 19 -1.379 -1.881 1.720 1.00 0.00 C ATOM 301 CD2 LEU A 19 -0.044 -3.713 0.674 1.00 0.00 C ATOM 0 H LEU A 19 -1.937 -4.557 4.339 1.00 0.00 H new ATOM 0 HA LEU A 19 0.357 -5.505 2.965 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -0.542 -2.784 3.966 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.930 -3.023 3.045 1.00 0.00 H new ATOM 0 HG LEU A 19 -1.713 -4.011 1.975 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.947 -1.808 0.793 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.019 -1.611 2.560 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.529 -1.201 1.679 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -0.654 -3.624 -0.225 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.820 -3.054 0.592 1.00 0.00 H new ATOM 0 HD23 LEU A 19 0.295 -4.743 0.782 1.00 0.00 H new ATOM 313 N MET A 20 0.830 -4.410 6.088 1.00 0.00 N ATOM 314 CA MET A 20 1.756 -4.438 7.225 1.00 0.00 C ATOM 315 C MET A 20 2.226 -5.854 7.534 1.00 0.00 C ATOM 316 O MET A 20 3.432 -6.051 7.621 1.00 0.00 O ATOM 317 CB MET A 20 1.082 -3.837 8.477 1.00 0.00 C ATOM 318 CG MET A 20 1.366 -2.346 8.660 1.00 0.00 C ATOM 319 SD MET A 20 2.733 -1.947 9.800 1.00 0.00 S ATOM 320 CE MET A 20 4.109 -2.952 9.175 1.00 0.00 C ATOM 0 H MET A 20 -0.062 -3.965 6.305 1.00 0.00 H new ATOM 0 HA MET A 20 2.626 -3.841 6.952 1.00 0.00 H new ATOM 0 HB2 MET A 20 0.005 -3.989 8.409 1.00 0.00 H new ATOM 0 HB3 MET A 20 1.425 -4.376 9.360 1.00 0.00 H new ATOM 0 HG2 MET A 20 1.590 -1.913 7.685 1.00 0.00 H new ATOM 0 HG3 MET A 20 0.459 -1.862 9.023 1.00 0.00 H new ATOM 0 HE1 MET A 20 4.996 -2.773 9.783 1.00 0.00 H new ATOM 0 HE2 MET A 20 3.841 -4.007 9.225 1.00 0.00 H new ATOM 0 HE3 MET A 20 4.318 -2.680 8.140 1.00 0.00 H new ATOM 330 N GLU A 21 1.314 -6.817 7.694 1.00 0.00 N ATOM 331 CA GLU A 21 1.653 -8.204 8.026 1.00 0.00 C ATOM 332 C GLU A 21 2.666 -8.751 7.023 1.00 0.00 C ATOM 333 O GLU A 21 3.745 -9.237 7.369 1.00 0.00 O ATOM 334 CB GLU A 21 0.373 -9.065 8.013 1.00 0.00 C ATOM 335 CG GLU A 21 -0.159 -9.397 9.412 1.00 0.00 C ATOM 336 CD GLU A 21 0.126 -10.850 9.807 1.00 0.00 C ATOM 337 OE1 GLU A 21 1.314 -11.249 9.867 1.00 0.00 O ATOM 338 OE2 GLU A 21 -0.851 -11.603 10.014 1.00 0.00 O ATOM 0 H GLU A 21 0.312 -6.655 7.596 1.00 0.00 H new ATOM 0 HA GLU A 21 2.097 -8.237 9.021 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.402 -8.540 7.454 1.00 0.00 H new ATOM 0 HB3 GLU A 21 0.576 -9.994 7.481 1.00 0.00 H new ATOM 0 HG2 GLU A 21 0.297 -8.727 10.141 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -1.234 -9.217 9.443 1.00 0.00 H new ATOM 345 N ALA A 22 2.314 -8.617 5.749 1.00 0.00 N ATOM 346 CA ALA A 22 3.121 -9.074 4.647 1.00 0.00 C ATOM 347 C ALA A 22 4.498 -8.419 4.659 1.00 0.00 C ATOM 348 O ALA A 22 5.476 -9.090 4.354 1.00 0.00 O ATOM 349 CB ALA A 22 2.378 -8.750 3.363 1.00 0.00 C ATOM 0 H ALA A 22 1.441 -8.178 5.458 1.00 0.00 H new ATOM 0 HA ALA A 22 3.285 -10.149 4.728 1.00 0.00 H new ATOM 0 HB1 ALA A 22 2.966 -9.085 2.508 1.00 0.00 H new ATOM 0 HB2 ALA A 22 1.414 -9.259 3.362 1.00 0.00 H new ATOM 0 HB3 ALA A 22 2.220 -7.674 3.296 1.00 0.00 H new ATOM 355 N LEU A 23 4.592 -7.138 5.016 1.00 0.00 N ATOM 356 CA LEU A 23 5.844 -6.399 5.098 1.00 0.00 C ATOM 357 C LEU A 23 6.808 -7.103 6.051 1.00 0.00 C ATOM 358 O LEU A 23 7.968 -7.340 5.720 1.00 0.00 O ATOM 359 CB LEU A 23 5.536 -4.987 5.648 1.00 0.00 C ATOM 360 CG LEU A 23 6.544 -3.912 5.269 1.00 0.00 C ATOM 361 CD1 LEU A 23 6.310 -2.625 6.066 1.00 0.00 C ATOM 362 CD2 LEU A 23 7.999 -4.299 5.444 1.00 0.00 C ATOM 0 H LEU A 23 3.778 -6.575 5.261 1.00 0.00 H new ATOM 0 HA LEU A 23 6.302 -6.340 4.110 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.552 -4.682 5.292 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.479 -5.042 6.735 1.00 0.00 H new ATOM 0 HG LEU A 23 6.370 -3.766 4.203 1.00 0.00 H new ATOM 0 HD11 LEU A 23 7.046 -1.876 5.773 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.308 -2.248 5.862 1.00 0.00 H new ATOM 0 HD13 LEU A 23 6.410 -2.834 7.131 1.00 0.00 H new ATOM 0 HD21 LEU A 23 8.635 -3.465 5.147 1.00 0.00 H new ATOM 0 HD22 LEU A 23 8.187 -4.545 6.489 1.00 0.00 H new ATOM 0 HD23 LEU A 23 8.222 -5.166 4.822 1.00 0.00 H new ATOM 374 N GLN A 24 6.352 -7.398 7.266 1.00 0.00 N ATOM 375 CA GLN A 24 7.170 -8.091 8.246 1.00 0.00 C ATOM 376 C GLN A 24 7.649 -9.432 7.671 1.00 0.00 C ATOM 377 O GLN A 24 8.848 -9.719 7.726 1.00 0.00 O ATOM 378 CB GLN A 24 6.429 -8.280 9.577 1.00 0.00 C ATOM 379 CG GLN A 24 5.388 -7.234 10.006 1.00 0.00 C ATOM 380 CD GLN A 24 5.860 -5.795 10.256 1.00 0.00 C ATOM 381 OE1 GLN A 24 6.823 -5.267 9.515 1.00 0.00 O flip ATOM 382 NE2 GLN A 24 5.303 -5.107 11.111 1.00 0.00 N flip ATOM 0 H GLN A 24 5.414 -7.164 7.592 1.00 0.00 H new ATOM 0 HA GLN A 24 8.042 -7.474 8.462 1.00 0.00 H new ATOM 0 HB2 GLN A 24 5.928 -9.247 9.540 1.00 0.00 H new ATOM 0 HB3 GLN A 24 7.179 -8.340 10.365 1.00 0.00 H new ATOM 0 HG2 GLN A 24 4.615 -7.201 9.239 1.00 0.00 H new ATOM 0 HG3 GLN A 24 4.915 -7.592 10.920 1.00 0.00 H new ATOM 0 HE21 GLN A 24 4.561 -5.508 11.684 1.00 0.00 H new ATOM 0 HE22 GLN A 24 5.583 -4.136 11.246 1.00 0.00 H new ATOM 391 N GLN A 25 6.750 -10.217 7.059 1.00 0.00 N ATOM 392 CA GLN A 25 7.113 -11.484 6.424 1.00 0.00 C ATOM 393 C GLN A 25 8.160 -11.308 5.323 1.00 0.00 C ATOM 394 O GLN A 25 9.068 -12.132 5.210 1.00 0.00 O ATOM 395 CB GLN A 25 5.904 -12.170 5.781 1.00 0.00 C ATOM 396 CG GLN A 25 4.783 -12.563 6.744 1.00 0.00 C ATOM 397 CD GLN A 25 4.023 -13.750 6.166 1.00 0.00 C ATOM 398 OE1 GLN A 25 3.714 -13.796 4.976 1.00 0.00 O ATOM 399 NE2 GLN A 25 3.829 -14.799 6.948 1.00 0.00 N ATOM 0 H GLN A 25 5.758 -9.990 6.993 1.00 0.00 H new ATOM 0 HA GLN A 25 7.517 -12.094 7.232 1.00 0.00 H new ATOM 0 HB2 GLN A 25 5.491 -11.505 5.022 1.00 0.00 H new ATOM 0 HB3 GLN A 25 6.248 -13.067 5.266 1.00 0.00 H new ATOM 0 HG2 GLN A 25 5.198 -12.820 7.719 1.00 0.00 H new ATOM 0 HG3 GLN A 25 4.107 -11.722 6.897 1.00 0.00 H new ATOM 0 HE21 GLN A 25 4.087 -14.755 7.934 1.00 0.00 H new ATOM 0 HE22 GLN A 25 3.421 -15.652 6.565 1.00 0.00 H new ATOM 408 N LEU A 26 8.003 -10.274 4.498 1.00 0.00 N ATOM 409 CA LEU A 26 8.753 -9.961 3.293 1.00 0.00 C ATOM 410 C LEU A 26 10.224 -9.756 3.637 1.00 0.00 C ATOM 411 O LEU A 26 10.610 -8.637 3.976 1.00 0.00 O ATOM 412 CB LEU A 26 8.135 -8.687 2.679 1.00 0.00 C ATOM 413 CG LEU A 26 8.796 -8.184 1.394 1.00 0.00 C ATOM 414 CD1 LEU A 26 8.397 -9.085 0.237 1.00 0.00 C ATOM 415 CD2 LEU A 26 8.314 -6.764 1.101 1.00 0.00 C ATOM 0 H LEU A 26 7.282 -9.575 4.676 1.00 0.00 H new ATOM 0 HA LEU A 26 8.700 -10.777 2.573 1.00 0.00 H new ATOM 0 HB2 LEU A 26 7.082 -8.879 2.473 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.175 -7.891 3.422 1.00 0.00 H new ATOM 0 HG LEU A 26 9.879 -8.192 1.515 1.00 0.00 H new ATOM 0 HD11 LEU A 26 8.866 -8.729 -0.680 1.00 0.00 H new ATOM 0 HD12 LEU A 26 8.724 -10.105 0.440 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.313 -9.068 0.120 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.783 -6.402 0.186 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.231 -6.766 0.978 1.00 0.00 H new ATOM 0 HD23 LEU A 26 8.584 -6.110 1.930 1.00 0.00 H new ATOM 427 N ARG A 27 11.068 -10.793 3.578 1.00 0.00 N ATOM 428 CA ARG A 27 12.504 -10.584 3.800 1.00 0.00 C ATOM 429 C ARG A 27 13.036 -9.611 2.752 1.00 0.00 C ATOM 430 O ARG A 27 13.693 -8.641 3.134 1.00 0.00 O ATOM 431 CB ARG A 27 13.316 -11.891 3.853 1.00 0.00 C ATOM 432 CG ARG A 27 13.397 -12.488 5.270 1.00 0.00 C ATOM 433 CD ARG A 27 12.336 -13.560 5.524 1.00 0.00 C ATOM 434 NE ARG A 27 12.708 -14.850 4.922 1.00 0.00 N ATOM 435 CZ ARG A 27 13.627 -15.706 5.391 1.00 0.00 C ATOM 436 NH1 ARG A 27 14.204 -15.510 6.570 1.00 0.00 N ATOM 437 NH2 ARG A 27 13.955 -16.769 4.675 1.00 0.00 N ATOM 0 H ARG A 27 10.794 -11.756 3.385 1.00 0.00 H new ATOM 0 HA ARG A 27 12.630 -10.148 4.791 1.00 0.00 H new ATOM 0 HB2 ARG A 27 12.864 -12.621 3.182 1.00 0.00 H new ATOM 0 HB3 ARG A 27 14.325 -11.702 3.486 1.00 0.00 H new ATOM 0 HG2 ARG A 27 14.386 -12.920 5.421 1.00 0.00 H new ATOM 0 HG3 ARG A 27 13.282 -11.689 6.003 1.00 0.00 H new ATOM 0 HD2 ARG A 27 12.197 -13.687 6.598 1.00 0.00 H new ATOM 0 HD3 ARG A 27 11.381 -13.230 5.115 1.00 0.00 H new ATOM 0 HE ARG A 27 12.221 -15.118 4.067 1.00 0.00 H new ATOM 0 HH11 ARG A 27 13.950 -14.699 7.134 1.00 0.00 H new ATOM 0 HH12 ARG A 27 14.901 -16.171 6.913 1.00 0.00 H new ATOM 0 HH21 ARG A 27 13.509 -16.933 3.772 1.00 0.00 H new ATOM 0 HH22 ARG A 27 14.653 -17.424 5.026 1.00 0.00 H new ATOM 451 N ASP A 28 12.638 -9.775 1.487 1.00 0.00 N ATOM 452 CA ASP A 28 12.995 -8.912 0.351 1.00 0.00 C ATOM 453 C ASP A 28 14.492 -8.982 0.051 1.00 0.00 C ATOM 454 O ASP A 28 15.278 -9.353 0.928 1.00 0.00 O ATOM 455 CB ASP A 28 12.480 -7.464 0.549 1.00 0.00 C ATOM 456 CG ASP A 28 11.511 -6.978 -0.537 1.00 0.00 C ATOM 457 OD1 ASP A 28 11.169 -7.746 -1.473 1.00 0.00 O ATOM 458 OD2 ASP A 28 11.113 -5.804 -0.430 1.00 0.00 O ATOM 0 H ASP A 28 12.031 -10.547 1.212 1.00 0.00 H new ATOM 0 HA ASP A 28 12.486 -9.292 -0.535 1.00 0.00 H new ATOM 0 HB2 ASP A 28 11.983 -7.398 1.517 1.00 0.00 H new ATOM 0 HB3 ASP A 28 13.335 -6.789 0.583 1.00 0.00 H new ATOM 463 N PRO A 29 14.931 -8.655 -1.175 1.00 0.00 N ATOM 464 CA PRO A 29 16.316 -8.856 -1.559 1.00 0.00 C ATOM 465 C PRO A 29 17.213 -7.900 -0.779 1.00 0.00 C ATOM 466 O PRO A 29 18.236 -8.325 -0.244 1.00 0.00 O ATOM 467 CB PRO A 29 16.364 -8.640 -3.074 1.00 0.00 C ATOM 468 CG PRO A 29 15.163 -7.749 -3.364 1.00 0.00 C ATOM 469 CD PRO A 29 14.154 -8.149 -2.297 1.00 0.00 C ATOM 0 HA PRO A 29 16.685 -9.854 -1.324 1.00 0.00 H new ATOM 0 HB2 PRO A 29 17.296 -8.164 -3.379 1.00 0.00 H new ATOM 0 HB3 PRO A 29 16.298 -9.585 -3.613 1.00 0.00 H new ATOM 0 HG2 PRO A 29 15.422 -6.692 -3.295 1.00 0.00 H new ATOM 0 HG3 PRO A 29 14.773 -7.917 -4.368 1.00 0.00 H new ATOM 0 HD2 PRO A 29 13.546 -7.296 -1.996 1.00 0.00 H new ATOM 0 HD3 PRO A 29 13.471 -8.911 -2.673 1.00 0.00 H new ATOM 477 N ARG A 30 16.846 -6.618 -0.711 1.00 0.00 N ATOM 478 CA ARG A 30 17.532 -5.574 0.019 1.00 0.00 C ATOM 479 C ARG A 30 16.540 -4.434 0.188 1.00 0.00 C ATOM 480 O ARG A 30 16.531 -3.494 -0.607 1.00 0.00 O ATOM 481 CB ARG A 30 18.789 -5.103 -0.726 1.00 0.00 C ATOM 482 CG ARG A 30 20.065 -5.810 -0.259 1.00 0.00 C ATOM 483 CD ARG A 30 21.311 -4.999 -0.607 1.00 0.00 C ATOM 484 NE ARG A 30 22.516 -5.750 -0.236 1.00 0.00 N ATOM 485 CZ ARG A 30 23.722 -5.250 0.054 1.00 0.00 C ATOM 486 NH1 ARG A 30 23.941 -3.940 0.077 1.00 0.00 N ATOM 487 NH2 ARG A 30 24.715 -6.089 0.317 1.00 0.00 N ATOM 0 H ARG A 30 16.016 -6.272 -1.193 1.00 0.00 H new ATOM 0 HA ARG A 30 17.871 -5.943 0.987 1.00 0.00 H new ATOM 0 HB2 ARG A 30 18.656 -5.274 -1.794 1.00 0.00 H new ATOM 0 HB3 ARG A 30 18.905 -4.028 -0.587 1.00 0.00 H new ATOM 0 HG2 ARG A 30 20.021 -5.968 0.819 1.00 0.00 H new ATOM 0 HG3 ARG A 30 20.128 -6.794 -0.723 1.00 0.00 H new ATOM 0 HD2 ARG A 30 21.325 -4.777 -1.674 1.00 0.00 H new ATOM 0 HD3 ARG A 30 21.292 -4.044 -0.083 1.00 0.00 H new ATOM 0 HE ARG A 30 22.424 -6.765 -0.195 1.00 0.00 H new ATOM 0 HH11 ARG A 30 23.181 -3.292 -0.129 1.00 0.00 H new ATOM 0 HH12 ARG A 30 24.869 -3.582 0.301 1.00 0.00 H new ATOM 0 HH21 ARG A 30 24.551 -7.096 0.296 1.00 0.00 H new ATOM 0 HH22 ARG A 30 25.642 -5.728 0.540 1.00 0.00 H new ATOM 501 N LEU A 31 15.686 -4.547 1.195 1.00 0.00 N ATOM 502 CA LEU A 31 14.847 -3.474 1.702 1.00 0.00 C ATOM 503 C LEU A 31 15.202 -3.289 3.172 1.00 0.00 C ATOM 504 O LEU A 31 15.357 -4.270 3.897 1.00 0.00 O ATOM 505 CB LEU A 31 13.367 -3.856 1.530 1.00 0.00 C ATOM 506 CG LEU A 31 12.389 -2.839 2.141 1.00 0.00 C ATOM 507 CD1 LEU A 31 12.460 -1.481 1.423 1.00 0.00 C ATOM 508 CD2 LEU A 31 10.970 -3.399 2.106 1.00 0.00 C ATOM 0 H LEU A 31 15.554 -5.423 1.700 1.00 0.00 H new ATOM 0 HA LEU A 31 15.010 -2.543 1.159 1.00 0.00 H new ATOM 0 HB2 LEU A 31 13.150 -3.962 0.467 1.00 0.00 H new ATOM 0 HB3 LEU A 31 13.197 -4.830 1.988 1.00 0.00 H new ATOM 0 HG LEU A 31 12.679 -2.669 3.178 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.755 -0.789 1.883 1.00 0.00 H new ATOM 0 HD12 LEU A 31 13.470 -1.078 1.505 1.00 0.00 H new ATOM 0 HD13 LEU A 31 12.206 -1.612 0.371 1.00 0.00 H new ATOM 0 HD21 LEU A 31 10.282 -2.674 2.540 1.00 0.00 H new ATOM 0 HD22 LEU A 31 10.683 -3.599 1.074 1.00 0.00 H new ATOM 0 HD23 LEU A 31 10.930 -4.325 2.679 1.00 0.00 H new ATOM 520 N LYS A 32 15.315 -2.046 3.633 1.00 0.00 N ATOM 521 CA LYS A 32 15.388 -1.719 5.052 1.00 0.00 C ATOM 522 C LYS A 32 13.964 -1.618 5.599 1.00 0.00 C ATOM 523 O LYS A 32 13.449 -0.511 5.759 1.00 0.00 O ATOM 524 CB LYS A 32 16.143 -0.392 5.201 1.00 0.00 C ATOM 525 CG LYS A 32 17.665 -0.557 5.181 1.00 0.00 C ATOM 526 CD LYS A 32 18.342 0.803 4.968 1.00 0.00 C ATOM 527 CE LYS A 32 19.751 0.781 5.560 1.00 0.00 C ATOM 528 NZ LYS A 32 20.484 2.037 5.311 1.00 0.00 N ATOM 0 H LYS A 32 15.359 -1.229 3.024 1.00 0.00 H new ATOM 0 HA LYS A 32 15.919 -2.487 5.615 1.00 0.00 H new ATOM 0 HB2 LYS A 32 15.846 0.279 4.395 1.00 0.00 H new ATOM 0 HB3 LYS A 32 15.848 0.083 6.137 1.00 0.00 H new ATOM 0 HG2 LYS A 32 18.003 -0.997 6.119 1.00 0.00 H new ATOM 0 HG3 LYS A 32 17.953 -1.244 4.385 1.00 0.00 H new ATOM 0 HD2 LYS A 32 18.389 1.033 3.904 1.00 0.00 H new ATOM 0 HD3 LYS A 32 17.753 1.590 5.438 1.00 0.00 H new ATOM 0 HE2 LYS A 32 19.688 0.607 6.634 1.00 0.00 H new ATOM 0 HE3 LYS A 32 20.309 -0.053 5.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 21.433 1.974 5.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 20.568 2.192 4.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 19.968 2.831 5.740 1.00 0.00 H new ATOM 542 N LYS A 33 13.289 -2.735 5.896 1.00 0.00 N ATOM 543 CA LYS A 33 11.914 -2.681 6.397 1.00 0.00 C ATOM 544 C LYS A 33 11.818 -1.938 7.730 1.00 0.00 C ATOM 545 O LYS A 33 10.747 -1.425 8.037 1.00 0.00 O ATOM 546 CB LYS A 33 11.330 -4.087 6.513 1.00 0.00 C ATOM 547 CG LYS A 33 12.228 -5.045 7.307 1.00 0.00 C ATOM 548 CD LYS A 33 11.407 -6.055 8.092 1.00 0.00 C ATOM 549 CE LYS A 33 10.570 -6.993 7.237 1.00 0.00 C ATOM 550 NZ LYS A 33 11.396 -7.900 6.433 1.00 0.00 N ATOM 0 H LYS A 33 13.669 -3.677 5.799 1.00 0.00 H new ATOM 0 HA LYS A 33 11.324 -2.118 5.674 1.00 0.00 H new ATOM 0 HB2 LYS A 33 10.353 -4.030 6.994 1.00 0.00 H new ATOM 0 HB3 LYS A 33 11.170 -4.492 5.514 1.00 0.00 H new ATOM 0 HG2 LYS A 33 12.896 -5.570 6.624 1.00 0.00 H new ATOM 0 HG3 LYS A 33 12.856 -4.474 7.991 1.00 0.00 H new ATOM 0 HD2 LYS A 33 12.081 -6.650 8.708 1.00 0.00 H new ATOM 0 HD3 LYS A 33 10.746 -5.517 8.771 1.00 0.00 H new ATOM 0 HE2 LYS A 33 9.913 -7.578 7.880 1.00 0.00 H new ATOM 0 HE3 LYS A 33 9.931 -6.406 6.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 11.112 -7.835 5.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 12.397 -7.633 6.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 11.266 -8.876 6.767 1.00 0.00 H new ATOM 564 N ASP A 34 12.923 -1.835 8.474 1.00 0.00 N ATOM 565 CA ASP A 34 13.030 -1.167 9.773 1.00 0.00 C ATOM 566 C ASP A 34 12.602 0.301 9.737 1.00 0.00 C ATOM 567 O ASP A 34 12.293 0.869 10.781 1.00 0.00 O ATOM 568 CB ASP A 34 14.482 -1.258 10.277 1.00 0.00 C ATOM 569 CG ASP A 34 14.564 -2.070 11.563 1.00 0.00 C ATOM 570 OD1 ASP A 34 14.475 -3.316 11.453 1.00 0.00 O ATOM 571 OD2 ASP A 34 14.792 -1.481 12.641 1.00 0.00 O ATOM 0 H ASP A 34 13.811 -2.235 8.171 1.00 0.00 H new ATOM 0 HA ASP A 34 12.347 -1.682 10.448 1.00 0.00 H new ATOM 0 HB2 ASP A 34 15.108 -1.718 9.512 1.00 0.00 H new ATOM 0 HB3 ASP A 34 14.874 -0.256 10.450 1.00 0.00 H new ATOM 576 N PHE A 35 12.581 0.921 8.551 1.00 0.00 N ATOM 577 CA PHE A 35 12.208 2.322 8.393 1.00 0.00 C ATOM 578 C PHE A 35 10.986 2.502 7.490 1.00 0.00 C ATOM 579 O PHE A 35 10.586 3.636 7.242 1.00 0.00 O ATOM 580 CB PHE A 35 13.413 3.145 7.908 1.00 0.00 C ATOM 581 CG PHE A 35 14.755 2.803 8.539 1.00 0.00 C ATOM 582 CD1 PHE A 35 14.921 2.858 9.936 1.00 0.00 C ATOM 583 CD2 PHE A 35 15.828 2.387 7.728 1.00 0.00 C ATOM 584 CE1 PHE A 35 16.130 2.445 10.522 1.00 0.00 C ATOM 585 CE2 PHE A 35 17.036 1.971 8.314 1.00 0.00 C ATOM 586 CZ PHE A 35 17.178 1.984 9.709 1.00 0.00 C ATOM 0 H PHE A 35 12.824 0.459 7.675 1.00 0.00 H new ATOM 0 HA PHE A 35 11.912 2.700 9.372 1.00 0.00 H new ATOM 0 HB2 PHE A 35 13.500 3.022 6.828 1.00 0.00 H new ATOM 0 HB3 PHE A 35 13.205 4.199 8.093 1.00 0.00 H new ATOM 0 HD1 PHE A 35 14.116 3.219 10.560 1.00 0.00 H new ATOM 0 HD2 PHE A 35 15.723 2.388 6.653 1.00 0.00 H new ATOM 0 HE1 PHE A 35 16.253 2.482 11.594 1.00 0.00 H new ATOM 0 HE2 PHE A 35 17.854 1.642 7.690 1.00 0.00 H new ATOM 0 HZ PHE A 35 18.097 1.638 10.160 1.00 0.00 H new ATOM 596 N VAL A 36 10.399 1.424 6.967 1.00 0.00 N ATOM 597 CA VAL A 36 9.232 1.469 6.092 1.00 0.00 C ATOM 598 C VAL A 36 7.991 1.419 6.977 1.00 0.00 C ATOM 599 O VAL A 36 7.875 0.538 7.836 1.00 0.00 O ATOM 600 CB VAL A 36 9.264 0.270 5.119 1.00 0.00 C ATOM 601 CG1 VAL A 36 8.054 0.240 4.176 1.00 0.00 C ATOM 602 CG2 VAL A 36 10.507 0.285 4.221 1.00 0.00 C ATOM 0 H VAL A 36 10.731 0.476 7.145 1.00 0.00 H new ATOM 0 HA VAL A 36 9.225 2.381 5.495 1.00 0.00 H new ATOM 0 HB VAL A 36 9.263 -0.605 5.770 1.00 0.00 H new ATOM 0 HG11 VAL A 36 8.129 -0.623 3.515 1.00 0.00 H new ATOM 0 HG12 VAL A 36 7.138 0.170 4.762 1.00 0.00 H new ATOM 0 HG13 VAL A 36 8.034 1.153 3.580 1.00 0.00 H new ATOM 0 HG21 VAL A 36 10.485 -0.577 3.554 1.00 0.00 H new ATOM 0 HG22 VAL A 36 10.518 1.201 3.630 1.00 0.00 H new ATOM 0 HG23 VAL A 36 11.403 0.242 4.840 1.00 0.00 H new ATOM 612 N THR A 37 7.026 2.309 6.759 1.00 0.00 N ATOM 613 CA THR A 37 5.675 2.126 7.271 1.00 0.00 C ATOM 614 C THR A 37 4.675 2.643 6.223 1.00 0.00 C ATOM 615 O THR A 37 5.019 3.457 5.357 1.00 0.00 O ATOM 616 CB THR A 37 5.552 2.802 8.651 1.00 0.00 C ATOM 617 OG1 THR A 37 6.564 2.319 9.522 1.00 0.00 O ATOM 618 CG2 THR A 37 4.217 2.529 9.345 1.00 0.00 C ATOM 0 H THR A 37 7.159 3.169 6.227 1.00 0.00 H new ATOM 0 HA THR A 37 5.444 1.073 7.432 1.00 0.00 H new ATOM 0 HB THR A 37 5.642 3.871 8.459 1.00 0.00 H new ATOM 0 HG1 THR A 37 7.025 1.564 9.101 1.00 0.00 H new ATOM 0 HG21 THR A 37 4.199 3.035 10.310 1.00 0.00 H new ATOM 0 HG22 THR A 37 3.402 2.902 8.725 1.00 0.00 H new ATOM 0 HG23 THR A 37 4.098 1.456 9.495 1.00 0.00 H new ATOM 626 N PHE A 38 3.445 2.136 6.282 1.00 0.00 N ATOM 627 CA PHE A 38 2.323 2.416 5.408 1.00 0.00 C ATOM 628 C PHE A 38 1.223 2.988 6.292 1.00 0.00 C ATOM 629 O PHE A 38 0.770 2.306 7.218 1.00 0.00 O ATOM 630 CB PHE A 38 1.821 1.120 4.737 1.00 0.00 C ATOM 631 CG PHE A 38 2.861 0.142 4.217 1.00 0.00 C ATOM 632 CD1 PHE A 38 3.968 0.589 3.471 1.00 0.00 C ATOM 633 CD2 PHE A 38 2.677 -1.241 4.418 1.00 0.00 C ATOM 634 CE1 PHE A 38 4.867 -0.338 2.911 1.00 0.00 C ATOM 635 CE2 PHE A 38 3.568 -2.166 3.846 1.00 0.00 C ATOM 636 CZ PHE A 38 4.664 -1.716 3.094 1.00 0.00 C ATOM 0 H PHE A 38 3.194 1.463 7.006 1.00 0.00 H new ATOM 0 HA PHE A 38 2.612 3.109 4.618 1.00 0.00 H new ATOM 0 HB2 PHE A 38 1.195 0.592 5.456 1.00 0.00 H new ATOM 0 HB3 PHE A 38 1.180 1.402 3.902 1.00 0.00 H new ATOM 0 HD1 PHE A 38 4.128 1.647 3.328 1.00 0.00 H new ATOM 0 HD2 PHE A 38 1.848 -1.592 5.014 1.00 0.00 H new ATOM 0 HE1 PHE A 38 5.714 0.011 2.340 1.00 0.00 H new ATOM 0 HE2 PHE A 38 3.409 -3.225 3.986 1.00 0.00 H new ATOM 0 HZ PHE A 38 5.350 -2.427 2.657 1.00 0.00 H new ATOM 646 N SER A 39 0.793 4.215 6.010 1.00 0.00 N ATOM 647 CA SER A 39 -0.233 4.875 6.810 1.00 0.00 C ATOM 648 C SER A 39 -1.387 5.342 5.930 1.00 0.00 C ATOM 649 O SER A 39 -2.508 4.860 6.107 1.00 0.00 O ATOM 650 CB SER A 39 0.431 5.941 7.689 1.00 0.00 C ATOM 651 OG SER A 39 -0.469 6.920 8.163 1.00 0.00 O ATOM 0 H SER A 39 1.141 4.773 5.231 1.00 0.00 H new ATOM 0 HA SER A 39 -0.710 4.184 7.505 1.00 0.00 H new ATOM 0 HB2 SER A 39 0.907 5.454 8.540 1.00 0.00 H new ATOM 0 HB3 SER A 39 1.221 6.430 7.119 1.00 0.00 H new ATOM 0 HG SER A 39 0.014 7.568 8.717 1.00 0.00 H new ATOM 657 N ARG A 40 -1.146 6.275 5.005 1.00 0.00 N ATOM 658 CA ARG A 40 -2.211 6.794 4.151 1.00 0.00 C ATOM 659 C ARG A 40 -2.503 5.778 3.042 1.00 0.00 C ATOM 660 O ARG A 40 -1.580 5.202 2.458 1.00 0.00 O ATOM 661 CB ARG A 40 -1.842 8.208 3.684 1.00 0.00 C ATOM 662 CG ARG A 40 -2.836 8.819 2.681 1.00 0.00 C ATOM 663 CD ARG A 40 -3.212 10.254 3.034 1.00 0.00 C ATOM 664 NE ARG A 40 -2.048 11.146 3.194 1.00 0.00 N ATOM 665 CZ ARG A 40 -2.113 12.387 3.689 1.00 0.00 C ATOM 666 NH1 ARG A 40 -3.284 12.930 4.015 1.00 0.00 N ATOM 667 NH2 ARG A 40 -1.001 13.087 3.855 1.00 0.00 N ATOM 0 H ARG A 40 -0.227 6.683 4.831 1.00 0.00 H new ATOM 0 HA ARG A 40 -3.153 6.911 4.687 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -1.774 8.860 4.555 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -0.852 8.181 3.228 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -2.400 8.796 1.682 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -3.738 8.208 2.649 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -3.861 10.653 2.254 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -3.788 10.253 3.959 1.00 0.00 H new ATOM 0 HE ARG A 40 -1.134 10.794 2.909 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -4.145 12.399 3.888 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -3.320 13.877 4.392 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -0.100 12.679 3.606 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -1.046 14.034 4.232 1.00 0.00 H new ATOM 681 N VAL A 41 -3.788 5.539 2.784 1.00 0.00 N ATOM 682 CA VAL A 41 -4.324 4.651 1.759 1.00 0.00 C ATOM 683 C VAL A 41 -5.562 5.352 1.183 1.00 0.00 C ATOM 684 O VAL A 41 -6.382 5.862 1.951 1.00 0.00 O ATOM 685 CB VAL A 41 -4.686 3.278 2.385 1.00 0.00 C ATOM 686 CG1 VAL A 41 -5.348 2.336 1.364 1.00 0.00 C ATOM 687 CG2 VAL A 41 -3.461 2.560 2.979 1.00 0.00 C ATOM 0 H VAL A 41 -4.528 5.991 3.321 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.598 4.456 0.970 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.390 3.506 3.185 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.585 1.387 1.845 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.265 2.792 0.990 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.664 2.161 0.533 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.770 1.605 3.404 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.725 2.387 2.194 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -3.020 3.179 3.760 1.00 0.00 H new ATOM 697 N GLU A 42 -5.731 5.366 -0.140 1.00 0.00 N ATOM 698 CA GLU A 42 -6.959 5.775 -0.799 1.00 0.00 C ATOM 699 C GLU A 42 -7.234 4.844 -1.976 1.00 0.00 C ATOM 700 O GLU A 42 -6.448 4.783 -2.921 1.00 0.00 O ATOM 701 CB GLU A 42 -6.848 7.232 -1.267 1.00 0.00 C ATOM 702 CG GLU A 42 -7.497 8.177 -0.247 1.00 0.00 C ATOM 703 CD GLU A 42 -8.011 9.479 -0.863 1.00 0.00 C ATOM 704 OE1 GLU A 42 -7.235 10.445 -1.016 1.00 0.00 O ATOM 705 OE2 GLU A 42 -9.238 9.564 -1.124 1.00 0.00 O ATOM 0 H GLU A 42 -4.998 5.086 -0.792 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.790 5.710 -0.097 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -5.799 7.498 -1.401 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.333 7.346 -2.237 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.326 7.662 0.238 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -6.771 8.414 0.530 1.00 0.00 H new ATOM 712 N LEU A 43 -8.337 4.098 -1.937 1.00 0.00 N ATOM 713 CA LEU A 43 -8.779 3.247 -3.041 1.00 0.00 C ATOM 714 C LEU A 43 -9.581 4.046 -4.063 1.00 0.00 C ATOM 715 O LEU A 43 -10.182 5.064 -3.707 1.00 0.00 O ATOM 716 CB LEU A 43 -9.603 2.071 -2.495 1.00 0.00 C ATOM 717 CG LEU A 43 -8.713 0.835 -2.293 1.00 0.00 C ATOM 718 CD1 LEU A 43 -7.728 0.962 -1.126 1.00 0.00 C ATOM 719 CD2 LEU A 43 -9.598 -0.392 -2.098 1.00 0.00 C ATOM 0 H LEU A 43 -8.957 4.067 -1.127 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.900 2.853 -3.550 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -10.065 2.352 -1.548 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -10.412 1.834 -3.186 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.102 0.737 -3.190 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.136 0.050 -1.049 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.066 1.810 -1.299 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.280 1.116 -0.199 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.972 -1.273 -1.954 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -10.230 -0.249 -1.222 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.225 -0.532 -2.979 1.00 0.00 H new ATOM 731 N SER A 44 -9.606 3.566 -5.311 1.00 0.00 N ATOM 732 CA SER A 44 -10.279 4.224 -6.427 1.00 0.00 C ATOM 733 C SER A 44 -11.796 4.221 -6.208 1.00 0.00 C ATOM 734 O SER A 44 -12.300 3.501 -5.333 1.00 0.00 O ATOM 735 CB SER A 44 -9.829 3.600 -7.770 1.00 0.00 C ATOM 736 OG SER A 44 -10.639 2.554 -8.289 1.00 0.00 O ATOM 0 H SER A 44 -9.149 2.693 -5.575 1.00 0.00 H new ATOM 0 HA SER A 44 -9.987 5.273 -6.476 1.00 0.00 H new ATOM 0 HB2 SER A 44 -9.780 4.394 -8.515 1.00 0.00 H new ATOM 0 HB3 SER A 44 -8.816 3.217 -7.645 1.00 0.00 H new ATOM 0 HG SER A 44 -10.262 2.238 -9.137 1.00 0.00 H new ATOM 742 N LYS A 45 -12.531 4.950 -7.061 1.00 0.00 N ATOM 743 CA LYS A 45 -13.996 5.007 -7.051 1.00 0.00 C ATOM 744 C LYS A 45 -14.569 3.608 -6.913 1.00 0.00 C ATOM 745 O LYS A 45 -15.389 3.357 -6.034 1.00 0.00 O ATOM 746 CB LYS A 45 -14.515 5.620 -8.363 1.00 0.00 C ATOM 747 CG LYS A 45 -14.771 7.126 -8.327 1.00 0.00 C ATOM 748 CD LYS A 45 -13.599 7.982 -7.851 1.00 0.00 C ATOM 749 CE LYS A 45 -13.913 9.433 -8.210 1.00 0.00 C ATOM 750 NZ LYS A 45 -12.913 10.354 -7.656 1.00 0.00 N ATOM 0 H LYS A 45 -12.113 5.527 -7.791 1.00 0.00 H new ATOM 0 HA LYS A 45 -14.308 5.623 -6.208 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.793 5.410 -9.153 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -15.443 5.117 -8.637 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -15.054 7.453 -9.328 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -15.625 7.316 -7.677 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -13.459 7.875 -6.775 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -12.672 7.661 -8.327 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -13.947 9.541 -9.294 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -14.901 9.697 -7.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -13.157 11.330 -7.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -12.898 10.268 -6.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -11.975 10.117 -8.037 1.00 0.00 H new ATOM 764 N ASP A 46 -14.108 2.705 -7.769 1.00 0.00 N ATOM 765 CA ASP A 46 -14.627 1.357 -7.924 1.00 0.00 C ATOM 766 C ASP A 46 -13.655 0.335 -7.316 1.00 0.00 C ATOM 767 O ASP A 46 -13.688 -0.834 -7.696 1.00 0.00 O ATOM 768 CB ASP A 46 -14.928 1.113 -9.420 1.00 0.00 C ATOM 769 CG ASP A 46 -16.352 1.528 -9.808 1.00 0.00 C ATOM 770 OD1 ASP A 46 -17.323 0.955 -9.257 1.00 0.00 O ATOM 771 OD2 ASP A 46 -16.495 2.402 -10.693 1.00 0.00 O ATOM 0 H ASP A 46 -13.330 2.902 -8.399 1.00 0.00 H new ATOM 0 HA ASP A 46 -15.562 1.234 -7.377 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -14.213 1.669 -10.026 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -14.786 0.057 -9.648 1.00 0.00 H new ATOM 776 N LYS A 47 -12.770 0.728 -6.385 1.00 0.00 N ATOM 777 CA LYS A 47 -11.758 -0.144 -5.767 1.00 0.00 C ATOM 778 C LYS A 47 -10.941 -0.938 -6.796 1.00 0.00 C ATOM 779 O LYS A 47 -10.679 -2.129 -6.610 1.00 0.00 O ATOM 780 CB LYS A 47 -12.408 -1.094 -4.743 1.00 0.00 C ATOM 781 CG LYS A 47 -13.116 -0.414 -3.564 1.00 0.00 C ATOM 782 CD LYS A 47 -14.638 -0.607 -3.598 1.00 0.00 C ATOM 783 CE LYS A 47 -15.179 -0.559 -2.170 1.00 0.00 C ATOM 784 NZ LYS A 47 -16.648 -0.579 -2.140 1.00 0.00 N ATOM 0 H LYS A 47 -12.738 1.685 -6.033 1.00 0.00 H new ATOM 0 HA LYS A 47 -11.058 0.513 -5.251 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -13.131 -1.722 -5.264 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -11.637 -1.756 -4.348 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -12.724 -0.815 -2.629 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -12.888 0.652 -3.574 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -15.103 0.172 -4.203 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -14.886 -1.561 -4.062 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -14.793 -1.408 -1.607 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -14.818 0.343 -1.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -16.976 -0.545 -1.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -17.017 0.245 -2.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -16.993 -1.451 -2.589 1.00 0.00 H new ATOM 798 N ARG A 48 -10.563 -0.328 -7.919 1.00 0.00 N ATOM 799 CA ARG A 48 -9.720 -0.980 -8.919 1.00 0.00 C ATOM 800 C ARG A 48 -8.267 -0.528 -8.835 1.00 0.00 C ATOM 801 O ARG A 48 -7.400 -1.229 -9.358 1.00 0.00 O ATOM 802 CB ARG A 48 -10.316 -0.779 -10.317 1.00 0.00 C ATOM 803 CG ARG A 48 -11.728 -1.358 -10.530 1.00 0.00 C ATOM 804 CD ARG A 48 -11.754 -2.878 -10.335 1.00 0.00 C ATOM 805 NE ARG A 48 -13.060 -3.502 -10.629 1.00 0.00 N ATOM 806 CZ ARG A 48 -13.996 -3.875 -9.742 1.00 0.00 C ATOM 807 NH1 ARG A 48 -14.004 -3.400 -8.502 1.00 0.00 N ATOM 808 NH2 ARG A 48 -14.944 -4.730 -10.098 1.00 0.00 N ATOM 0 H ARG A 48 -10.831 0.626 -8.160 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.705 -2.049 -8.708 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -10.346 0.290 -10.529 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -9.644 -1.230 -11.047 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -12.422 -0.890 -9.832 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -12.073 -1.114 -11.535 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -10.996 -3.329 -10.976 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -11.478 -3.106 -9.305 1.00 0.00 H new ATOM 0 HE ARG A 48 -13.274 -3.667 -11.613 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -13.288 -2.737 -8.205 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -14.726 -3.699 -7.846 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -14.963 -5.105 -11.046 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -15.655 -5.013 -9.424 1.00 0.00 H new ATOM 822 N TYR A 49 -7.977 0.551 -8.115 1.00 0.00 N ATOM 823 CA TYR A 49 -6.628 0.925 -7.713 1.00 0.00 C ATOM 824 C TYR A 49 -6.656 1.187 -6.216 1.00 0.00 C ATOM 825 O TYR A 49 -7.733 1.388 -5.645 1.00 0.00 O ATOM 826 CB TYR A 49 -6.125 2.137 -8.512 1.00 0.00 C ATOM 827 CG TYR A 49 -5.997 1.827 -9.988 1.00 0.00 C ATOM 828 CD1 TYR A 49 -7.129 1.898 -10.820 1.00 0.00 C ATOM 829 CD2 TYR A 49 -4.776 1.355 -10.501 1.00 0.00 C ATOM 830 CE1 TYR A 49 -7.060 1.447 -12.146 1.00 0.00 C ATOM 831 CE2 TYR A 49 -4.691 0.915 -11.834 1.00 0.00 C ATOM 832 CZ TYR A 49 -5.841 0.952 -12.656 1.00 0.00 C ATOM 833 OH TYR A 49 -5.790 0.496 -13.935 1.00 0.00 O ATOM 0 H TYR A 49 -8.690 1.203 -7.788 1.00 0.00 H new ATOM 0 HA TYR A 49 -5.924 0.121 -7.928 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -6.812 2.972 -8.375 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -5.157 2.452 -8.122 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -8.054 2.301 -10.436 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -3.900 1.330 -9.869 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -7.937 1.478 -12.775 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -3.753 0.551 -12.227 1.00 0.00 H new ATOM 0 HH TYR A 49 -4.881 0.190 -14.137 1.00 0.00 H new ATOM 843 N ALA A 50 -5.481 1.124 -5.602 1.00 0.00 N ATOM 844 CA ALA A 50 -5.224 1.420 -4.203 1.00 0.00 C ATOM 845 C ALA A 50 -3.953 2.254 -4.158 1.00 0.00 C ATOM 846 O ALA A 50 -2.883 1.765 -4.513 1.00 0.00 O ATOM 847 CB ALA A 50 -5.079 0.126 -3.396 1.00 0.00 C ATOM 0 H ALA A 50 -4.634 0.848 -6.099 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.052 1.970 -3.756 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.887 0.369 -2.351 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.999 -0.454 -3.471 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.248 -0.458 -3.791 1.00 0.00 H new ATOM 853 N ASP A 51 -4.070 3.517 -3.773 1.00 0.00 N ATOM 854 CA ASP A 51 -2.979 4.479 -3.755 1.00 0.00 C ATOM 855 C ASP A 51 -2.455 4.434 -2.324 1.00 0.00 C ATOM 856 O ASP A 51 -3.202 4.751 -1.397 1.00 0.00 O ATOM 857 CB ASP A 51 -3.476 5.881 -4.174 1.00 0.00 C ATOM 858 CG ASP A 51 -3.909 5.988 -5.647 1.00 0.00 C ATOM 859 OD1 ASP A 51 -4.302 4.979 -6.281 1.00 0.00 O ATOM 860 OD2 ASP A 51 -3.952 7.112 -6.190 1.00 0.00 O ATOM 0 H ASP A 51 -4.955 3.912 -3.455 1.00 0.00 H new ATOM 0 HA ASP A 51 -2.188 4.244 -4.467 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -4.317 6.159 -3.539 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -2.683 6.605 -3.988 1.00 0.00 H new ATOM 865 N VAL A 52 -1.236 3.932 -2.121 1.00 0.00 N ATOM 866 CA VAL A 52 -0.705 3.540 -0.819 1.00 0.00 C ATOM 867 C VAL A 52 0.601 4.292 -0.580 1.00 0.00 C ATOM 868 O VAL A 52 1.492 4.292 -1.430 1.00 0.00 O ATOM 869 CB VAL A 52 -0.519 2.011 -0.774 1.00 0.00 C ATOM 870 CG1 VAL A 52 0.104 1.565 0.554 1.00 0.00 C ATOM 871 CG2 VAL A 52 -1.861 1.279 -0.940 1.00 0.00 C ATOM 0 H VAL A 52 -0.573 3.783 -2.882 1.00 0.00 H new ATOM 0 HA VAL A 52 -1.399 3.801 -0.020 1.00 0.00 H new ATOM 0 HB VAL A 52 0.146 1.756 -1.599 1.00 0.00 H new ATOM 0 HG11 VAL A 52 0.222 0.481 0.555 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.079 2.037 0.675 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -0.546 1.859 1.378 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -1.695 0.202 -0.904 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -2.536 1.569 -0.135 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.305 1.546 -1.899 1.00 0.00 H new ATOM 881 N TYR A 53 0.713 4.934 0.579 1.00 0.00 N ATOM 882 CA TYR A 53 1.690 5.972 0.833 1.00 0.00 C ATOM 883 C TYR A 53 2.698 5.445 1.839 1.00 0.00 C ATOM 884 O TYR A 53 2.374 5.154 2.997 1.00 0.00 O ATOM 885 CB TYR A 53 0.995 7.198 1.398 1.00 0.00 C ATOM 886 CG TYR A 53 0.011 7.925 0.490 1.00 0.00 C ATOM 887 CD1 TYR A 53 -1.107 7.278 -0.086 1.00 0.00 C ATOM 888 CD2 TYR A 53 0.195 9.300 0.262 1.00 0.00 C ATOM 889 CE1 TYR A 53 -1.993 7.974 -0.925 1.00 0.00 C ATOM 890 CE2 TYR A 53 -0.703 10.005 -0.554 1.00 0.00 C ATOM 891 CZ TYR A 53 -1.793 9.348 -1.169 1.00 0.00 C ATOM 892 OH TYR A 53 -2.666 10.036 -1.952 1.00 0.00 O ATOM 0 H TYR A 53 0.112 4.739 1.380 1.00 0.00 H new ATOM 0 HA TYR A 53 2.195 6.248 -0.093 1.00 0.00 H new ATOM 0 HB2 TYR A 53 0.462 6.898 2.300 1.00 0.00 H new ATOM 0 HB3 TYR A 53 1.762 7.910 1.703 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -1.282 6.233 0.122 1.00 0.00 H new ATOM 0 HD2 TYR A 53 1.029 9.815 0.716 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -2.825 7.458 -1.382 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -0.559 11.063 -0.714 1.00 0.00 H new ATOM 0 HH TYR A 53 -3.558 9.637 -1.876 1.00 0.00 H new ATOM 902 N VAL A 54 3.928 5.324 1.373 1.00 0.00 N ATOM 903 CA VAL A 54 5.002 4.621 2.048 1.00 0.00 C ATOM 904 C VAL A 54 5.973 5.654 2.614 1.00 0.00 C ATOM 905 O VAL A 54 6.782 6.236 1.882 1.00 0.00 O ATOM 906 CB VAL A 54 5.678 3.629 1.078 1.00 0.00 C ATOM 907 CG1 VAL A 54 6.692 2.782 1.856 1.00 0.00 C ATOM 908 CG2 VAL A 54 4.665 2.713 0.364 1.00 0.00 C ATOM 0 H VAL A 54 4.216 5.728 0.482 1.00 0.00 H new ATOM 0 HA VAL A 54 4.619 4.026 2.877 1.00 0.00 H new ATOM 0 HB VAL A 54 6.178 4.210 0.303 1.00 0.00 H new ATOM 0 HG11 VAL A 54 7.174 2.078 1.178 1.00 0.00 H new ATOM 0 HG12 VAL A 54 7.445 3.433 2.300 1.00 0.00 H new ATOM 0 HG13 VAL A 54 6.178 2.232 2.644 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.196 2.036 -0.306 1.00 0.00 H new ATOM 0 HG22 VAL A 54 4.114 2.133 1.104 1.00 0.00 H new ATOM 0 HG23 VAL A 54 3.968 3.321 -0.213 1.00 0.00 H new ATOM 918 N SER A 55 5.883 5.912 3.919 1.00 0.00 N ATOM 919 CA SER A 55 6.854 6.754 4.591 1.00 0.00 C ATOM 920 C SER A 55 8.064 5.883 4.941 1.00 0.00 C ATOM 921 O SER A 55 8.036 5.122 5.912 1.00 0.00 O ATOM 922 CB SER A 55 6.228 7.427 5.813 1.00 0.00 C ATOM 923 OG SER A 55 7.073 8.470 6.260 1.00 0.00 O ATOM 0 H SER A 55 5.147 5.548 4.524 1.00 0.00 H new ATOM 0 HA SER A 55 7.185 7.567 3.944 1.00 0.00 H new ATOM 0 HB2 SER A 55 5.245 7.824 5.559 1.00 0.00 H new ATOM 0 HB3 SER A 55 6.081 6.697 6.609 1.00 0.00 H new ATOM 0 HG SER A 55 6.672 8.903 7.042 1.00 0.00 H new ATOM 929 N PHE A 56 9.114 5.947 4.118 1.00 0.00 N ATOM 930 CA PHE A 56 10.442 5.477 4.501 1.00 0.00 C ATOM 931 C PHE A 56 11.122 6.563 5.335 1.00 0.00 C ATOM 932 O PHE A 56 11.202 7.711 4.885 1.00 0.00 O ATOM 933 CB PHE A 56 11.291 5.157 3.269 1.00 0.00 C ATOM 934 CG PHE A 56 12.651 4.570 3.592 1.00 0.00 C ATOM 935 CD1 PHE A 56 12.729 3.277 4.137 1.00 0.00 C ATOM 936 CD2 PHE A 56 13.836 5.275 3.305 1.00 0.00 C ATOM 937 CE1 PHE A 56 13.976 2.661 4.320 1.00 0.00 C ATOM 938 CE2 PHE A 56 15.084 4.664 3.514 1.00 0.00 C ATOM 939 CZ PHE A 56 15.156 3.352 4.004 1.00 0.00 C ATOM 0 H PHE A 56 9.065 6.325 3.172 1.00 0.00 H new ATOM 0 HA PHE A 56 10.342 4.560 5.082 1.00 0.00 H new ATOM 0 HB2 PHE A 56 10.745 4.457 2.637 1.00 0.00 H new ATOM 0 HB3 PHE A 56 11.429 6.069 2.689 1.00 0.00 H new ATOM 0 HD1 PHE A 56 11.825 2.756 4.416 1.00 0.00 H new ATOM 0 HD2 PHE A 56 13.786 6.285 2.925 1.00 0.00 H new ATOM 0 HE1 PHE A 56 14.028 1.653 4.705 1.00 0.00 H new ATOM 0 HE2 PHE A 56 15.992 5.207 3.296 1.00 0.00 H new ATOM 0 HZ PHE A 56 16.116 2.875 4.138 1.00 0.00 H new ATOM 949 N LEU A 57 11.633 6.208 6.514 1.00 0.00 N ATOM 950 CA LEU A 57 12.232 7.114 7.498 1.00 0.00 C ATOM 951 C LEU A 57 13.695 7.483 7.195 1.00 0.00 C ATOM 952 O LEU A 57 14.478 7.752 8.107 1.00 0.00 O ATOM 953 CB LEU A 57 12.085 6.500 8.907 1.00 0.00 C ATOM 954 CG LEU A 57 11.766 7.586 9.949 1.00 0.00 C ATOM 955 CD1 LEU A 57 10.311 7.509 10.417 1.00 0.00 C ATOM 956 CD2 LEU A 57 12.710 7.502 11.145 1.00 0.00 C ATOM 0 H LEU A 57 11.642 5.237 6.825 1.00 0.00 H new ATOM 0 HA LEU A 57 11.689 8.058 7.444 1.00 0.00 H new ATOM 0 HB2 LEU A 57 11.292 5.752 8.901 1.00 0.00 H new ATOM 0 HB3 LEU A 57 13.006 5.986 9.182 1.00 0.00 H new ATOM 0 HG LEU A 57 11.914 8.549 9.460 1.00 0.00 H new ATOM 0 HD11 LEU A 57 10.123 8.291 11.152 1.00 0.00 H new ATOM 0 HD12 LEU A 57 9.647 7.646 9.564 1.00 0.00 H new ATOM 0 HD13 LEU A 57 10.125 6.535 10.869 1.00 0.00 H new ATOM 0 HD21 LEU A 57 12.458 8.283 11.863 1.00 0.00 H new ATOM 0 HD22 LEU A 57 12.609 6.526 11.620 1.00 0.00 H new ATOM 0 HD23 LEU A 57 13.738 7.637 10.808 1.00 0.00 H new ATOM 968 N GLY A 58 14.091 7.438 5.927 1.00 0.00 N ATOM 969 CA GLY A 58 15.467 7.639 5.481 1.00 0.00 C ATOM 970 C GLY A 58 15.757 9.112 5.216 1.00 0.00 C ATOM 971 O GLY A 58 15.225 10.003 5.885 1.00 0.00 O ATOM 0 H GLY A 58 13.446 7.255 5.159 1.00 0.00 H new ATOM 0 HA2 GLY A 58 16.155 7.262 6.238 1.00 0.00 H new ATOM 0 HA3 GLY A 58 15.645 7.063 4.573 1.00 0.00 H new ATOM 975 N THR A 59 16.609 9.382 4.227 1.00 0.00 N ATOM 976 CA THR A 59 16.514 10.641 3.497 1.00 0.00 C ATOM 977 C THR A 59 15.437 10.456 2.417 1.00 0.00 C ATOM 978 O THR A 59 15.148 9.318 2.033 1.00 0.00 O ATOM 979 CB THR A 59 17.889 11.048 2.928 1.00 0.00 C ATOM 980 OG1 THR A 59 18.573 10.012 2.250 1.00 0.00 O ATOM 981 CG2 THR A 59 18.787 11.547 4.059 1.00 0.00 C ATOM 0 H THR A 59 17.356 8.760 3.919 1.00 0.00 H new ATOM 0 HA THR A 59 16.222 11.464 4.150 1.00 0.00 H new ATOM 0 HB THR A 59 17.680 11.827 2.195 1.00 0.00 H new ATOM 0 HG1 THR A 59 19.432 10.349 1.919 1.00 0.00 H new ATOM 0 HG21 THR A 59 19.757 11.834 3.654 1.00 0.00 H new ATOM 0 HG22 THR A 59 18.324 12.410 4.537 1.00 0.00 H new ATOM 0 HG23 THR A 59 18.921 10.754 4.794 1.00 0.00 H new ATOM 989 N PRO A 60 14.861 11.537 1.866 1.00 0.00 N ATOM 990 CA PRO A 60 13.845 11.447 0.814 1.00 0.00 C ATOM 991 C PRO A 60 14.401 10.913 -0.518 1.00 0.00 C ATOM 992 O PRO A 60 13.638 10.611 -1.437 1.00 0.00 O ATOM 993 CB PRO A 60 13.319 12.876 0.661 1.00 0.00 C ATOM 994 CG PRO A 60 14.539 13.710 1.037 1.00 0.00 C ATOM 995 CD PRO A 60 15.102 12.929 2.213 1.00 0.00 C ATOM 0 HA PRO A 60 13.065 10.736 1.086 1.00 0.00 H new ATOM 0 HB2 PRO A 60 12.984 13.080 -0.356 1.00 0.00 H new ATOM 0 HB3 PRO A 60 12.473 13.071 1.320 1.00 0.00 H new ATOM 0 HG2 PRO A 60 15.252 13.783 0.216 1.00 0.00 H new ATOM 0 HG3 PRO A 60 14.268 14.728 1.315 1.00 0.00 H new ATOM 0 HD2 PRO A 60 16.165 13.127 2.350 1.00 0.00 H new ATOM 0 HD3 PRO A 60 14.605 13.199 3.145 1.00 0.00 H new ATOM 1003 N GLU A 61 15.723 10.810 -0.643 1.00 0.00 N ATOM 1004 CA GLU A 61 16.407 10.319 -1.829 1.00 0.00 C ATOM 1005 C GLU A 61 16.559 8.802 -1.678 1.00 0.00 C ATOM 1006 O GLU A 61 16.077 8.057 -2.528 1.00 0.00 O ATOM 1007 CB GLU A 61 17.703 11.130 -2.033 1.00 0.00 C ATOM 1008 CG GLU A 61 17.308 12.589 -2.351 1.00 0.00 C ATOM 1009 CD GLU A 61 18.466 13.573 -2.519 1.00 0.00 C ATOM 1010 OE1 GLU A 61 19.311 13.408 -3.427 1.00 0.00 O ATOM 1011 OE2 GLU A 61 18.460 14.612 -1.811 1.00 0.00 O ATOM 0 H GLU A 61 16.364 11.075 0.104 1.00 0.00 H new ATOM 0 HA GLU A 61 15.851 10.469 -2.755 1.00 0.00 H new ATOM 0 HB2 GLU A 61 18.323 11.090 -1.137 1.00 0.00 H new ATOM 0 HB3 GLU A 61 18.292 10.709 -2.848 1.00 0.00 H new ATOM 0 HG2 GLU A 61 16.717 12.594 -3.267 1.00 0.00 H new ATOM 0 HG3 GLU A 61 16.661 12.952 -1.552 1.00 0.00 H new ATOM 1018 N GLU A 62 17.048 8.310 -0.532 1.00 0.00 N ATOM 1019 CA GLU A 62 16.986 6.882 -0.202 1.00 0.00 C ATOM 1020 C GLU A 62 15.539 6.366 -0.196 1.00 0.00 C ATOM 1021 O GLU A 62 15.309 5.199 -0.514 1.00 0.00 O ATOM 1022 CB GLU A 62 17.644 6.621 1.163 1.00 0.00 C ATOM 1023 CG GLU A 62 19.172 6.480 1.105 1.00 0.00 C ATOM 1024 CD GLU A 62 19.611 5.033 1.348 1.00 0.00 C ATOM 1025 OE1 GLU A 62 19.712 4.616 2.530 1.00 0.00 O ATOM 1026 OE2 GLU A 62 19.863 4.291 0.374 1.00 0.00 O ATOM 0 H GLU A 62 17.493 8.884 0.184 1.00 0.00 H new ATOM 0 HA GLU A 62 17.532 6.340 -0.974 1.00 0.00 H new ATOM 0 HB2 GLU A 62 17.391 7.438 1.839 1.00 0.00 H new ATOM 0 HB3 GLU A 62 17.222 5.711 1.590 1.00 0.00 H new ATOM 0 HG2 GLU A 62 19.533 6.812 0.131 1.00 0.00 H new ATOM 0 HG3 GLU A 62 19.627 7.130 1.852 1.00 0.00 H new ATOM 1033 N ARG A 63 14.553 7.212 0.138 1.00 0.00 N ATOM 1034 CA ARG A 63 13.152 6.813 0.108 1.00 0.00 C ATOM 1035 C ARG A 63 12.734 6.386 -1.292 1.00 0.00 C ATOM 1036 O ARG A 63 12.024 5.386 -1.391 1.00 0.00 O ATOM 1037 CB ARG A 63 12.262 7.932 0.673 1.00 0.00 C ATOM 1038 CG ARG A 63 10.763 7.617 0.532 1.00 0.00 C ATOM 1039 CD ARG A 63 9.916 8.267 1.628 1.00 0.00 C ATOM 1040 NE ARG A 63 9.978 9.728 1.612 1.00 0.00 N ATOM 1041 CZ ARG A 63 9.807 10.538 2.660 1.00 0.00 C ATOM 1042 NH1 ARG A 63 9.925 10.118 3.919 1.00 0.00 N ATOM 1043 NH2 ARG A 63 9.506 11.801 2.414 1.00 0.00 N ATOM 0 H ARG A 63 14.708 8.177 0.431 1.00 0.00 H new ATOM 0 HA ARG A 63 13.022 5.942 0.750 1.00 0.00 H new ATOM 0 HB2 ARG A 63 12.501 8.086 1.725 1.00 0.00 H new ATOM 0 HB3 ARG A 63 12.484 8.865 0.156 1.00 0.00 H new ATOM 0 HG2 ARG A 63 10.414 7.960 -0.442 1.00 0.00 H new ATOM 0 HG3 ARG A 63 10.619 6.537 0.560 1.00 0.00 H new ATOM 0 HD2 ARG A 63 8.879 7.952 1.512 1.00 0.00 H new ATOM 0 HD3 ARG A 63 10.252 7.906 2.600 1.00 0.00 H new ATOM 0 HE ARG A 63 10.170 10.171 0.714 1.00 0.00 H new ATOM 0 HH11 ARG A 63 10.155 9.143 4.112 1.00 0.00 H new ATOM 0 HH12 ARG A 63 9.786 10.771 4.690 1.00 0.00 H new ATOM 0 HH21 ARG A 63 9.412 12.125 1.451 1.00 0.00 H new ATOM 0 HH22 ARG A 63 9.367 12.452 3.187 1.00 0.00 H new ATOM 1057 N LYS A 64 13.140 7.096 -2.350 1.00 0.00 N ATOM 1058 CA LYS A 64 12.714 6.740 -3.703 1.00 0.00 C ATOM 1059 C LYS A 64 13.143 5.325 -4.067 1.00 0.00 C ATOM 1060 O LYS A 64 12.371 4.632 -4.728 1.00 0.00 O ATOM 1061 CB LYS A 64 13.208 7.761 -4.741 1.00 0.00 C ATOM 1062 CG LYS A 64 12.200 8.910 -4.887 1.00 0.00 C ATOM 1063 CD LYS A 64 12.565 9.808 -6.076 1.00 0.00 C ATOM 1064 CE LYS A 64 11.613 11.000 -6.272 1.00 0.00 C ATOM 1065 NZ LYS A 64 10.269 10.616 -6.765 1.00 0.00 N ATOM 0 H LYS A 64 13.754 7.909 -2.296 1.00 0.00 H new ATOM 0 HA LYS A 64 11.624 6.767 -3.716 1.00 0.00 H new ATOM 0 HB2 LYS A 64 14.178 8.156 -4.438 1.00 0.00 H new ATOM 0 HB3 LYS A 64 13.351 7.270 -5.704 1.00 0.00 H new ATOM 0 HG2 LYS A 64 11.198 8.505 -5.026 1.00 0.00 H new ATOM 0 HG3 LYS A 64 12.181 9.501 -3.972 1.00 0.00 H new ATOM 0 HD2 LYS A 64 13.579 10.184 -5.937 1.00 0.00 H new ATOM 0 HD3 LYS A 64 12.570 9.206 -6.985 1.00 0.00 H new ATOM 0 HE2 LYS A 64 11.505 11.527 -5.324 1.00 0.00 H new ATOM 0 HE3 LYS A 64 12.062 11.700 -6.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 9.939 11.319 -7.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 10.319 9.681 -7.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 9.604 10.578 -5.966 1.00 0.00 H new ATOM 1079 N GLU A 65 14.293 4.867 -3.574 1.00 0.00 N ATOM 1080 CA GLU A 65 14.790 3.511 -3.799 1.00 0.00 C ATOM 1081 C GLU A 65 13.741 2.473 -3.402 1.00 0.00 C ATOM 1082 O GLU A 65 13.472 1.517 -4.132 1.00 0.00 O ATOM 1083 CB GLU A 65 16.069 3.289 -2.976 1.00 0.00 C ATOM 1084 CG GLU A 65 17.041 2.359 -3.707 1.00 0.00 C ATOM 1085 CD GLU A 65 17.874 3.144 -4.713 1.00 0.00 C ATOM 1086 OE1 GLU A 65 17.347 3.536 -5.777 1.00 0.00 O ATOM 1087 OE2 GLU A 65 19.072 3.393 -4.436 1.00 0.00 O ATOM 0 H GLU A 65 14.914 5.436 -2.999 1.00 0.00 H new ATOM 0 HA GLU A 65 15.007 3.395 -4.861 1.00 0.00 H new ATOM 0 HB2 GLU A 65 16.552 4.247 -2.784 1.00 0.00 H new ATOM 0 HB3 GLU A 65 15.812 2.862 -2.007 1.00 0.00 H new ATOM 0 HG2 GLU A 65 17.696 1.869 -2.987 1.00 0.00 H new ATOM 0 HG3 GLU A 65 16.486 1.573 -4.219 1.00 0.00 H new ATOM 1094 N THR A 66 13.135 2.683 -2.234 1.00 0.00 N ATOM 1095 CA THR A 66 12.195 1.741 -1.650 1.00 0.00 C ATOM 1096 C THR A 66 10.967 1.553 -2.533 1.00 0.00 C ATOM 1097 O THR A 66 10.361 0.488 -2.494 1.00 0.00 O ATOM 1098 CB THR A 66 11.807 2.171 -0.225 1.00 0.00 C ATOM 1099 OG1 THR A 66 10.943 3.294 -0.188 1.00 0.00 O ATOM 1100 CG2 THR A 66 13.040 2.495 0.617 1.00 0.00 C ATOM 0 H THR A 66 13.287 3.517 -1.667 1.00 0.00 H new ATOM 0 HA THR A 66 12.690 0.772 -1.584 1.00 0.00 H new ATOM 0 HB THR A 66 11.275 1.314 0.188 1.00 0.00 H new ATOM 0 HG1 THR A 66 11.422 4.086 -0.509 1.00 0.00 H new ATOM 0 HG21 THR A 66 12.729 2.795 1.618 1.00 0.00 H new ATOM 0 HG22 THR A 66 13.677 1.613 0.684 1.00 0.00 H new ATOM 0 HG23 THR A 66 13.596 3.309 0.151 1.00 0.00 H new ATOM 1108 N VAL A 67 10.585 2.562 -3.319 1.00 0.00 N ATOM 1109 CA VAL A 67 9.377 2.535 -4.126 1.00 0.00 C ATOM 1110 C VAL A 67 9.542 1.483 -5.225 1.00 0.00 C ATOM 1111 O VAL A 67 8.589 0.761 -5.510 1.00 0.00 O ATOM 1112 CB VAL A 67 9.053 3.945 -4.669 1.00 0.00 C ATOM 1113 CG1 VAL A 67 7.608 4.036 -5.187 1.00 0.00 C ATOM 1114 CG2 VAL A 67 9.205 5.040 -3.597 1.00 0.00 C ATOM 0 H VAL A 67 11.116 3.428 -3.410 1.00 0.00 H new ATOM 0 HA VAL A 67 8.517 2.248 -3.520 1.00 0.00 H new ATOM 0 HB VAL A 67 9.769 4.106 -5.475 1.00 0.00 H new ATOM 0 HG11 VAL A 67 7.418 5.042 -5.560 1.00 0.00 H new ATOM 0 HG12 VAL A 67 7.465 3.317 -5.993 1.00 0.00 H new ATOM 0 HG13 VAL A 67 6.916 3.814 -4.375 1.00 0.00 H new ATOM 0 HG21 VAL A 67 8.966 6.010 -4.032 1.00 0.00 H new ATOM 0 HG22 VAL A 67 8.526 4.836 -2.769 1.00 0.00 H new ATOM 0 HG23 VAL A 67 10.231 5.050 -3.230 1.00 0.00 H new ATOM 1124 N GLU A 68 10.747 1.307 -5.776 1.00 0.00 N ATOM 1125 CA GLU A 68 11.004 0.284 -6.780 1.00 0.00 C ATOM 1126 C GLU A 68 10.987 -1.097 -6.137 1.00 0.00 C ATOM 1127 O GLU A 68 10.378 -2.021 -6.677 1.00 0.00 O ATOM 1128 CB GLU A 68 12.335 0.536 -7.502 1.00 0.00 C ATOM 1129 CG GLU A 68 12.152 1.690 -8.491 1.00 0.00 C ATOM 1130 CD GLU A 68 13.358 1.936 -9.393 1.00 0.00 C ATOM 1131 OE1 GLU A 68 13.927 0.967 -9.944 1.00 0.00 O ATOM 1132 OE2 GLU A 68 13.666 3.124 -9.636 1.00 0.00 O ATOM 0 H GLU A 68 11.564 1.869 -5.537 1.00 0.00 H new ATOM 0 HA GLU A 68 10.212 0.330 -7.527 1.00 0.00 H new ATOM 0 HB2 GLU A 68 13.115 0.778 -6.780 1.00 0.00 H new ATOM 0 HB3 GLU A 68 12.655 -0.364 -8.028 1.00 0.00 H new ATOM 0 HG2 GLU A 68 11.282 1.485 -9.114 1.00 0.00 H new ATOM 0 HG3 GLU A 68 11.937 2.602 -7.933 1.00 0.00 H new ATOM 1139 N ILE A 69 11.623 -1.232 -4.971 1.00 0.00 N ATOM 1140 CA ILE A 69 11.686 -2.497 -4.243 1.00 0.00 C ATOM 1141 C ILE A 69 10.259 -2.957 -3.875 1.00 0.00 C ATOM 1142 O ILE A 69 9.918 -4.136 -4.031 1.00 0.00 O ATOM 1143 CB ILE A 69 12.643 -2.344 -3.033 1.00 0.00 C ATOM 1144 CG1 ILE A 69 14.083 -1.955 -3.456 1.00 0.00 C ATOM 1145 CG2 ILE A 69 12.716 -3.668 -2.257 1.00 0.00 C ATOM 1146 CD1 ILE A 69 14.891 -1.291 -2.330 1.00 0.00 C ATOM 0 H ILE A 69 12.109 -0.465 -4.506 1.00 0.00 H new ATOM 0 HA ILE A 69 12.103 -3.291 -4.863 1.00 0.00 H new ATOM 0 HB ILE A 69 12.238 -1.543 -2.414 1.00 0.00 H new ATOM 0 HG12 ILE A 69 14.609 -2.849 -3.792 1.00 0.00 H new ATOM 0 HG13 ILE A 69 14.033 -1.275 -4.307 1.00 0.00 H new ATOM 0 HG21 ILE A 69 13.390 -3.555 -1.408 1.00 0.00 H new ATOM 0 HG22 ILE A 69 11.722 -3.935 -1.899 1.00 0.00 H new ATOM 0 HG23 ILE A 69 13.088 -4.454 -2.914 1.00 0.00 H new ATOM 0 HD11 ILE A 69 15.888 -1.045 -2.694 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.387 -0.380 -2.009 1.00 0.00 H new ATOM 0 HD13 ILE A 69 14.972 -1.977 -1.487 1.00 0.00 H new ATOM 1158 N LEU A 70 9.403 -2.020 -3.451 1.00 0.00 N ATOM 1159 CA LEU A 70 7.979 -2.248 -3.233 1.00 0.00 C ATOM 1160 C LEU A 70 7.289 -2.622 -4.550 1.00 0.00 C ATOM 1161 O LEU A 70 6.515 -3.578 -4.590 1.00 0.00 O ATOM 1162 CB LEU A 70 7.314 -0.992 -2.618 1.00 0.00 C ATOM 1163 CG LEU A 70 7.093 -0.968 -1.093 1.00 0.00 C ATOM 1164 CD1 LEU A 70 6.357 -2.205 -0.587 1.00 0.00 C ATOM 1165 CD2 LEU A 70 8.378 -0.843 -0.281 1.00 0.00 C ATOM 0 H LEU A 70 9.692 -1.063 -3.247 1.00 0.00 H new ATOM 0 HA LEU A 70 7.868 -3.076 -2.533 1.00 0.00 H new ATOM 0 HB2 LEU A 70 7.924 -0.128 -2.881 1.00 0.00 H new ATOM 0 HB3 LEU A 70 6.345 -0.857 -3.099 1.00 0.00 H new ATOM 0 HG LEU A 70 6.488 -0.074 -0.942 1.00 0.00 H new ATOM 0 HD11 LEU A 70 6.228 -2.135 0.493 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.380 -2.268 -1.065 1.00 0.00 H new ATOM 0 HD13 LEU A 70 6.936 -3.097 -0.827 1.00 0.00 H new ATOM 0 HD21 LEU A 70 8.137 -0.833 0.782 1.00 0.00 H new ATOM 0 HD22 LEU A 70 9.029 -1.690 -0.498 1.00 0.00 H new ATOM 0 HD23 LEU A 70 8.887 0.084 -0.546 1.00 0.00 H new ATOM 1177 N ASN A 71 7.543 -1.878 -5.632 1.00 0.00 N ATOM 1178 CA ASN A 71 6.924 -2.108 -6.940 1.00 0.00 C ATOM 1179 C ASN A 71 7.233 -3.501 -7.492 1.00 0.00 C ATOM 1180 O ASN A 71 6.414 -4.050 -8.226 1.00 0.00 O ATOM 1181 CB ASN A 71 7.355 -1.058 -7.974 1.00 0.00 C ATOM 1182 CG ASN A 71 6.321 0.048 -8.123 1.00 0.00 C ATOM 1183 OD1 ASN A 71 5.387 -0.054 -8.914 1.00 0.00 O ATOM 1184 ND2 ASN A 71 6.428 1.101 -7.336 1.00 0.00 N ATOM 0 H ASN A 71 8.191 -1.091 -5.623 1.00 0.00 H new ATOM 0 HA ASN A 71 5.850 -2.025 -6.772 1.00 0.00 H new ATOM 0 HB2 ASN A 71 8.310 -0.625 -7.676 1.00 0.00 H new ATOM 0 HB3 ASN A 71 7.512 -1.541 -8.938 1.00 0.00 H new ATOM 0 HD21 ASN A 71 5.730 1.843 -7.380 1.00 0.00 H new ATOM 0 HD22 ASN A 71 7.209 1.173 -6.684 1.00 0.00 H new ATOM 1191 N ARG A 72 8.387 -4.087 -7.168 1.00 0.00 N ATOM 1192 CA ARG A 72 8.668 -5.508 -7.410 1.00 0.00 C ATOM 1193 C ARG A 72 7.726 -6.365 -6.569 1.00 0.00 C ATOM 1194 O ARG A 72 6.986 -7.187 -7.111 1.00 0.00 O ATOM 1195 CB ARG A 72 10.117 -5.864 -7.042 1.00 0.00 C ATOM 1196 CG ARG A 72 11.206 -5.173 -7.862 1.00 0.00 C ATOM 1197 CD ARG A 72 11.259 -5.635 -9.322 1.00 0.00 C ATOM 1198 NE ARG A 72 12.643 -5.655 -9.817 1.00 0.00 N ATOM 1199 CZ ARG A 72 13.464 -4.602 -9.887 1.00 0.00 C ATOM 1200 NH1 ARG A 72 13.011 -3.356 -9.810 1.00 0.00 N ATOM 1201 NH2 ARG A 72 14.767 -4.795 -10.007 1.00 0.00 N ATOM 0 H ARG A 72 9.160 -3.588 -6.727 1.00 0.00 H new ATOM 0 HA ARG A 72 8.519 -5.702 -8.472 1.00 0.00 H new ATOM 0 HB2 ARG A 72 10.274 -5.623 -5.991 1.00 0.00 H new ATOM 0 HB3 ARG A 72 10.242 -6.942 -7.144 1.00 0.00 H new ATOM 0 HG2 ARG A 72 11.041 -4.096 -7.836 1.00 0.00 H new ATOM 0 HG3 ARG A 72 12.173 -5.358 -7.395 1.00 0.00 H new ATOM 0 HD2 ARG A 72 10.823 -6.630 -9.408 1.00 0.00 H new ATOM 0 HD3 ARG A 72 10.657 -4.969 -9.940 1.00 0.00 H new ATOM 0 HE ARG A 72 13.010 -6.552 -10.135 1.00 0.00 H new ATOM 0 HH11 ARG A 72 12.013 -3.183 -9.694 1.00 0.00 H new ATOM 0 HH12 ARG A 72 13.662 -2.572 -9.867 1.00 0.00 H new ATOM 0 HH21 ARG A 72 15.141 -5.743 -10.046 1.00 0.00 H new ATOM 0 HH22 ARG A 72 15.398 -3.996 -10.061 1.00 0.00 H new ATOM 1215 N ALA A 73 7.729 -6.158 -5.249 1.00 0.00 N ATOM 1216 CA ALA A 73 6.945 -6.917 -4.282 1.00 0.00 C ATOM 1217 C ALA A 73 5.423 -6.776 -4.467 1.00 0.00 C ATOM 1218 O ALA A 73 4.679 -7.502 -3.805 1.00 0.00 O ATOM 1219 CB ALA A 73 7.365 -6.508 -2.864 1.00 0.00 C ATOM 0 H ALA A 73 8.298 -5.432 -4.814 1.00 0.00 H new ATOM 0 HA ALA A 73 7.158 -7.973 -4.451 1.00 0.00 H new ATOM 0 HB1 ALA A 73 6.783 -7.072 -2.135 1.00 0.00 H new ATOM 0 HB2 ALA A 73 8.425 -6.719 -2.723 1.00 0.00 H new ATOM 0 HB3 ALA A 73 7.186 -5.442 -2.725 1.00 0.00 H new ATOM 1225 N LYS A 74 4.935 -5.907 -5.367 1.00 0.00 N ATOM 1226 CA LYS A 74 3.521 -5.714 -5.685 1.00 0.00 C ATOM 1227 C LYS A 74 2.775 -7.031 -5.846 1.00 0.00 C ATOM 1228 O LYS A 74 1.640 -7.111 -5.382 1.00 0.00 O ATOM 1229 CB LYS A 74 3.371 -4.927 -7.000 1.00 0.00 C ATOM 1230 CG LYS A 74 2.955 -3.470 -6.793 1.00 0.00 C ATOM 1231 CD LYS A 74 2.316 -2.837 -8.035 1.00 0.00 C ATOM 1232 CE LYS A 74 0.816 -3.114 -8.218 1.00 0.00 C ATOM 1233 NZ LYS A 74 0.492 -4.500 -8.617 1.00 0.00 N ATOM 0 H LYS A 74 5.544 -5.297 -5.912 1.00 0.00 H new ATOM 0 HA LYS A 74 3.092 -5.165 -4.847 1.00 0.00 H new ATOM 0 HB2 LYS A 74 4.317 -4.953 -7.540 1.00 0.00 H new ATOM 0 HB3 LYS A 74 2.631 -5.422 -7.629 1.00 0.00 H new ATOM 0 HG2 LYS A 74 2.250 -3.415 -5.963 1.00 0.00 H new ATOM 0 HG3 LYS A 74 3.830 -2.887 -6.507 1.00 0.00 H new ATOM 0 HD2 LYS A 74 2.466 -1.758 -7.990 1.00 0.00 H new ATOM 0 HD3 LYS A 74 2.845 -3.196 -8.918 1.00 0.00 H new ATOM 0 HE2 LYS A 74 0.301 -2.889 -7.284 1.00 0.00 H new ATOM 0 HE3 LYS A 74 0.423 -2.431 -8.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -0.503 -4.552 -8.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 1.105 -4.786 -9.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 0.646 -5.138 -7.811 1.00 0.00 H new ATOM 1247 N GLY A 75 3.356 -8.017 -6.529 1.00 0.00 N ATOM 1248 CA GLY A 75 2.711 -9.297 -6.758 1.00 0.00 C ATOM 1249 C GLY A 75 2.404 -9.989 -5.435 1.00 0.00 C ATOM 1250 O GLY A 75 1.248 -10.324 -5.173 1.00 0.00 O ATOM 0 H GLY A 75 4.288 -7.945 -6.937 1.00 0.00 H new ATOM 0 HA2 GLY A 75 1.789 -9.150 -7.320 1.00 0.00 H new ATOM 0 HA3 GLY A 75 3.356 -9.932 -7.365 1.00 0.00 H new ATOM 1254 N PHE A 76 3.421 -10.163 -4.583 1.00 0.00 N ATOM 1255 CA PHE A 76 3.264 -10.738 -3.252 1.00 0.00 C ATOM 1256 C PHE A 76 2.235 -9.952 -2.440 1.00 0.00 C ATOM 1257 O PHE A 76 1.352 -10.567 -1.842 1.00 0.00 O ATOM 1258 CB PHE A 76 4.616 -10.806 -2.525 1.00 0.00 C ATOM 1259 CG PHE A 76 4.525 -11.204 -1.063 1.00 0.00 C ATOM 1260 CD1 PHE A 76 4.017 -12.464 -0.686 1.00 0.00 C ATOM 1261 CD2 PHE A 76 4.912 -10.289 -0.068 1.00 0.00 C ATOM 1262 CE1 PHE A 76 3.892 -12.799 0.675 1.00 0.00 C ATOM 1263 CE2 PHE A 76 4.839 -10.645 1.288 1.00 0.00 C ATOM 1264 CZ PHE A 76 4.309 -11.891 1.664 1.00 0.00 C ATOM 0 H PHE A 76 4.383 -9.905 -4.805 1.00 0.00 H new ATOM 0 HA PHE A 76 2.893 -11.757 -3.360 1.00 0.00 H new ATOM 0 HB2 PHE A 76 5.257 -11.519 -3.043 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.101 -9.832 -2.594 1.00 0.00 H new ATOM 0 HD1 PHE A 76 3.723 -13.174 -1.444 1.00 0.00 H new ATOM 0 HD2 PHE A 76 5.267 -9.308 -0.348 1.00 0.00 H new ATOM 0 HE1 PHE A 76 3.476 -13.754 0.960 1.00 0.00 H new ATOM 0 HE2 PHE A 76 5.191 -9.959 2.044 1.00 0.00 H new ATOM 0 HZ PHE A 76 4.222 -12.150 2.709 1.00 0.00 H new ATOM 1274 N PHE A 77 2.330 -8.619 -2.404 1.00 0.00 N ATOM 1275 CA PHE A 77 1.374 -7.795 -1.668 1.00 0.00 C ATOM 1276 C PHE A 77 -0.047 -8.052 -2.170 1.00 0.00 C ATOM 1277 O PHE A 77 -0.890 -8.527 -1.414 1.00 0.00 O ATOM 1278 CB PHE A 77 1.778 -6.314 -1.697 1.00 0.00 C ATOM 1279 CG PHE A 77 2.895 -5.985 -0.717 1.00 0.00 C ATOM 1280 CD1 PHE A 77 2.680 -6.136 0.668 1.00 0.00 C ATOM 1281 CD2 PHE A 77 4.156 -5.553 -1.168 1.00 0.00 C ATOM 1282 CE1 PHE A 77 3.698 -5.842 1.590 1.00 0.00 C ATOM 1283 CE2 PHE A 77 5.185 -5.299 -0.243 1.00 0.00 C ATOM 1284 CZ PHE A 77 4.954 -5.416 1.140 1.00 0.00 C ATOM 0 H PHE A 77 3.062 -8.090 -2.878 1.00 0.00 H new ATOM 0 HA PHE A 77 1.389 -8.082 -0.617 1.00 0.00 H new ATOM 0 HB2 PHE A 77 2.097 -6.049 -2.705 1.00 0.00 H new ATOM 0 HB3 PHE A 77 0.907 -5.701 -1.467 1.00 0.00 H new ATOM 0 HD1 PHE A 77 1.721 -6.482 1.024 1.00 0.00 H new ATOM 0 HD2 PHE A 77 4.334 -5.416 -2.224 1.00 0.00 H new ATOM 0 HE1 PHE A 77 3.512 -5.945 2.649 1.00 0.00 H new ATOM 0 HE2 PHE A 77 6.163 -5.011 -0.598 1.00 0.00 H new ATOM 0 HZ PHE A 77 5.736 -5.180 1.846 1.00 0.00 H new ATOM 1294 N ARG A 78 -0.319 -7.805 -3.454 1.00 0.00 N ATOM 1295 CA ARG A 78 -1.659 -7.928 -4.024 1.00 0.00 C ATOM 1296 C ARG A 78 -2.232 -9.330 -3.805 1.00 0.00 C ATOM 1297 O ARG A 78 -3.415 -9.466 -3.479 1.00 0.00 O ATOM 1298 CB ARG A 78 -1.620 -7.549 -5.517 1.00 0.00 C ATOM 1299 CG ARG A 78 -3.006 -7.153 -6.032 1.00 0.00 C ATOM 1300 CD ARG A 78 -3.029 -6.932 -7.549 1.00 0.00 C ATOM 1301 NE ARG A 78 -3.356 -8.170 -8.274 1.00 0.00 N ATOM 1302 CZ ARG A 78 -3.538 -8.265 -9.598 1.00 0.00 C ATOM 1303 NH1 ARG A 78 -3.237 -7.253 -10.404 1.00 0.00 N ATOM 1304 NH2 ARG A 78 -4.047 -9.378 -10.111 1.00 0.00 N ATOM 0 H ARG A 78 0.388 -7.513 -4.128 1.00 0.00 H new ATOM 0 HA ARG A 78 -2.328 -7.238 -3.511 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -0.926 -6.722 -5.665 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -1.242 -8.391 -6.097 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -3.723 -7.931 -5.771 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -3.329 -6.241 -5.530 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -3.761 -6.163 -7.794 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -2.057 -6.563 -7.878 1.00 0.00 H new ATOM 0 HE ARG A 78 -3.452 -9.024 -7.725 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -2.861 -6.387 -10.017 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -3.382 -7.342 -11.410 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -4.297 -10.154 -9.498 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -4.188 -9.457 -11.118 1.00 0.00 H new ATOM 1318 N THR A 79 -1.411 -10.370 -3.958 1.00 0.00 N ATOM 1319 CA THR A 79 -1.889 -11.736 -3.850 1.00 0.00 C ATOM 1320 C THR A 79 -2.252 -12.086 -2.401 1.00 0.00 C ATOM 1321 O THR A 79 -3.225 -12.796 -2.176 1.00 0.00 O ATOM 1322 CB THR A 79 -0.958 -12.686 -4.605 1.00 0.00 C ATOM 1323 OG1 THR A 79 -1.619 -13.855 -5.037 1.00 0.00 O ATOM 1324 CG2 THR A 79 0.181 -13.129 -3.728 1.00 0.00 C ATOM 0 H THR A 79 -0.414 -10.286 -4.157 1.00 0.00 H new ATOM 0 HA THR A 79 -2.843 -11.861 -4.362 1.00 0.00 H new ATOM 0 HB THR A 79 -0.600 -12.124 -5.467 1.00 0.00 H new ATOM 0 HG1 THR A 79 -0.986 -14.431 -5.515 1.00 0.00 H new ATOM 0 HG21 THR A 79 0.829 -13.804 -4.287 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.753 -12.258 -3.407 1.00 0.00 H new ATOM 0 HG23 THR A 79 -0.213 -13.646 -2.853 1.00 0.00 H new ATOM 1332 N PHE A 80 -1.549 -11.538 -1.410 1.00 0.00 N ATOM 1333 CA PHE A 80 -1.853 -11.748 0.005 1.00 0.00 C ATOM 1334 C PHE A 80 -3.206 -11.126 0.355 1.00 0.00 C ATOM 1335 O PHE A 80 -4.008 -11.744 1.061 1.00 0.00 O ATOM 1336 CB PHE A 80 -0.710 -11.160 0.831 1.00 0.00 C ATOM 1337 CG PHE A 80 -0.750 -11.281 2.347 1.00 0.00 C ATOM 1338 CD1 PHE A 80 -1.649 -10.510 3.112 1.00 0.00 C ATOM 1339 CD2 PHE A 80 0.222 -12.057 3.011 1.00 0.00 C ATOM 1340 CE1 PHE A 80 -1.625 -10.583 4.517 1.00 0.00 C ATOM 1341 CE2 PHE A 80 0.265 -12.107 4.415 1.00 0.00 C ATOM 1342 CZ PHE A 80 -0.680 -11.393 5.168 1.00 0.00 C ATOM 0 H PHE A 80 -0.745 -10.930 -1.568 1.00 0.00 H new ATOM 0 HA PHE A 80 -1.934 -12.811 0.230 1.00 0.00 H new ATOM 0 HB2 PHE A 80 0.215 -11.625 0.489 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -0.642 -10.100 0.588 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -2.358 -9.862 2.618 1.00 0.00 H new ATOM 0 HD2 PHE A 80 0.942 -12.619 2.434 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -2.336 -10.014 5.097 1.00 0.00 H new ATOM 0 HE2 PHE A 80 1.023 -12.693 4.913 1.00 0.00 H new ATOM 0 HZ PHE A 80 -0.681 -11.466 6.246 1.00 0.00 H new ATOM 1352 N ILE A 81 -3.514 -9.933 -0.166 1.00 0.00 N ATOM 1353 CA ILE A 81 -4.835 -9.332 0.048 1.00 0.00 C ATOM 1354 C ILE A 81 -5.906 -10.222 -0.595 1.00 0.00 C ATOM 1355 O ILE A 81 -6.995 -10.410 -0.045 1.00 0.00 O ATOM 1356 CB ILE A 81 -4.947 -7.880 -0.485 1.00 0.00 C ATOM 1357 CG1 ILE A 81 -3.595 -7.137 -0.546 1.00 0.00 C ATOM 1358 CG2 ILE A 81 -5.976 -7.139 0.384 1.00 0.00 C ATOM 1359 CD1 ILE A 81 -3.667 -5.615 -0.650 1.00 0.00 C ATOM 0 H ILE A 81 -2.877 -9.371 -0.731 1.00 0.00 H new ATOM 0 HA ILE A 81 -4.989 -9.268 1.125 1.00 0.00 H new ATOM 0 HB ILE A 81 -5.279 -7.912 -1.523 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -3.023 -7.393 0.346 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.036 -7.513 -1.403 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.077 -6.112 0.033 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.940 -7.643 0.315 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.641 -7.136 1.421 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -2.658 -5.205 -0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.204 -5.337 -1.557 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -4.191 -5.215 0.218 1.00 0.00 H new ATOM 1371 N ALA A 82 -5.591 -10.789 -1.760 1.00 0.00 N ATOM 1372 CA ALA A 82 -6.459 -11.702 -2.479 1.00 0.00 C ATOM 1373 C ALA A 82 -6.449 -13.135 -1.930 1.00 0.00 C ATOM 1374 O ALA A 82 -7.165 -13.994 -2.442 1.00 0.00 O ATOM 1375 CB ALA A 82 -6.069 -11.679 -3.957 1.00 0.00 C ATOM 0 H ALA A 82 -4.704 -10.618 -2.234 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.484 -11.357 -2.344 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -6.712 -12.361 -4.514 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -6.186 -10.669 -4.349 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -5.030 -11.991 -4.064 1.00 0.00 H new ATOM 1381 N LYS A 83 -5.638 -13.434 -0.924 1.00 0.00 N ATOM 1382 CA LYS A 83 -5.631 -14.705 -0.212 1.00 0.00 C ATOM 1383 C LYS A 83 -6.540 -14.575 1.001 1.00 0.00 C ATOM 1384 O LYS A 83 -7.325 -15.475 1.282 1.00 0.00 O ATOM 1385 CB LYS A 83 -4.172 -15.023 0.148 1.00 0.00 C ATOM 1386 CG LYS A 83 -3.972 -16.117 1.198 1.00 0.00 C ATOM 1387 CD LYS A 83 -2.469 -16.291 1.443 1.00 0.00 C ATOM 1388 CE LYS A 83 -2.212 -17.301 2.560 1.00 0.00 C ATOM 1389 NZ LYS A 83 -0.804 -17.293 2.996 1.00 0.00 N ATOM 0 H LYS A 83 -4.944 -12.776 -0.569 1.00 0.00 H new ATOM 0 HA LYS A 83 -6.014 -15.532 -0.810 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.648 -15.318 -0.761 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -3.698 -14.109 0.507 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -4.478 -15.848 2.125 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -4.411 -17.054 0.856 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.983 -16.625 0.526 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -2.026 -15.331 1.707 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -2.856 -17.074 3.410 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -2.479 -18.300 2.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -0.672 -17.992 3.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -0.190 -17.534 2.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -0.555 -16.347 3.350 1.00 0.00 H new ATOM 1403 N ASN A 84 -6.427 -13.451 1.711 1.00 0.00 N ATOM 1404 CA ASN A 84 -7.172 -13.184 2.933 1.00 0.00 C ATOM 1405 C ASN A 84 -8.662 -12.968 2.640 1.00 0.00 C ATOM 1406 O ASN A 84 -9.495 -13.554 3.331 1.00 0.00 O ATOM 1407 CB ASN A 84 -6.561 -11.977 3.662 1.00 0.00 C ATOM 1408 CG ASN A 84 -5.323 -12.336 4.470 1.00 0.00 C ATOM 1409 OD1 ASN A 84 -5.379 -12.536 5.680 1.00 0.00 O ATOM 1410 ND2 ASN A 84 -4.170 -12.403 3.837 1.00 0.00 N ATOM 0 H ASN A 84 -5.803 -12.690 1.444 1.00 0.00 H new ATOM 0 HA ASN A 84 -7.099 -14.055 3.585 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -6.302 -11.211 2.931 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.309 -11.544 4.326 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -3.317 -12.622 4.352 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -4.130 -12.236 2.832 1.00 0.00 H new ATOM 1417 N LEU A 85 -9.023 -12.130 1.656 1.00 0.00 N ATOM 1418 CA LEU A 85 -10.423 -11.889 1.280 1.00 0.00 C ATOM 1419 C LEU A 85 -10.821 -12.791 0.114 1.00 0.00 C ATOM 1420 O LEU A 85 -9.963 -13.345 -0.573 1.00 0.00 O ATOM 1421 CB LEU A 85 -10.649 -10.411 0.899 1.00 0.00 C ATOM 1422 CG LEU A 85 -11.134 -9.544 2.073 1.00 0.00 C ATOM 1423 CD1 LEU A 85 -9.981 -9.219 3.030 1.00 0.00 C ATOM 1424 CD2 LEU A 85 -11.766 -8.256 1.534 1.00 0.00 C ATOM 0 H LEU A 85 -8.352 -11.601 1.099 1.00 0.00 H new ATOM 0 HA LEU A 85 -11.047 -12.121 2.143 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.718 -9.997 0.512 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.380 -10.359 0.093 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.883 -10.103 2.634 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -10.352 -8.605 3.851 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -9.566 -10.145 3.428 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.204 -8.675 2.492 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -12.109 -7.643 2.367 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -11.026 -7.702 0.956 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -12.613 -8.506 0.895 1.00 0.00 H new ATOM 1436 N ARG A 86 -12.127 -12.850 -0.175 1.00 0.00 N ATOM 1437 CA ARG A 86 -12.733 -13.710 -1.199 1.00 0.00 C ATOM 1438 C ARG A 86 -13.047 -13.004 -2.527 1.00 0.00 C ATOM 1439 O ARG A 86 -13.682 -13.588 -3.400 1.00 0.00 O ATOM 1440 CB ARG A 86 -13.947 -14.466 -0.606 1.00 0.00 C ATOM 1441 CG ARG A 86 -15.136 -13.588 -0.169 1.00 0.00 C ATOM 1442 CD ARG A 86 -15.164 -13.248 1.336 1.00 0.00 C ATOM 1443 NE ARG A 86 -15.935 -14.222 2.133 1.00 0.00 N ATOM 1444 CZ ARG A 86 -17.253 -14.176 2.383 1.00 0.00 C ATOM 1445 NH1 ARG A 86 -18.039 -13.242 1.860 1.00 0.00 N ATOM 1446 NH2 ARG A 86 -17.802 -15.095 3.167 1.00 0.00 N ATOM 0 H ARG A 86 -12.816 -12.279 0.316 1.00 0.00 H new ATOM 0 HA ARG A 86 -11.977 -14.442 -1.483 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -14.302 -15.183 -1.347 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -13.608 -15.040 0.256 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -15.113 -12.658 -0.738 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -16.063 -14.098 -0.430 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -14.142 -13.207 1.713 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -15.594 -12.255 1.471 1.00 0.00 H new ATOM 0 HE ARG A 86 -15.417 -15.005 2.532 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -17.645 -12.529 1.246 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -19.037 -13.238 2.072 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -17.223 -15.829 3.575 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -18.803 -15.067 3.362 1.00 0.00 H new ATOM 1460 N LEU A 87 -12.580 -11.767 -2.702 1.00 0.00 N ATOM 1461 CA LEU A 87 -12.850 -10.842 -3.801 1.00 0.00 C ATOM 1462 C LEU A 87 -12.305 -11.303 -5.166 1.00 0.00 C ATOM 1463 O LEU A 87 -12.684 -10.741 -6.199 1.00 0.00 O ATOM 1464 CB LEU A 87 -12.182 -9.532 -3.346 1.00 0.00 C ATOM 1465 CG LEU A 87 -12.238 -8.337 -4.293 1.00 0.00 C ATOM 1466 CD1 LEU A 87 -13.669 -7.825 -4.466 1.00 0.00 C ATOM 1467 CD2 LEU A 87 -11.345 -7.207 -3.769 1.00 0.00 C ATOM 0 H LEU A 87 -11.948 -11.352 -2.018 1.00 0.00 H new ATOM 0 HA LEU A 87 -13.922 -10.753 -3.979 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -12.639 -9.233 -2.403 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.133 -9.746 -3.138 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.876 -8.668 -5.266 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -13.671 -6.974 -5.147 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -14.293 -8.619 -4.876 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -14.065 -7.517 -3.498 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.392 -6.359 -4.452 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -11.691 -6.898 -2.783 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.316 -7.559 -3.699 1.00 0.00 H new ATOM 1479 N TYR A 88 -11.413 -12.297 -5.178 1.00 0.00 N ATOM 1480 CA TYR A 88 -10.607 -12.754 -6.303 1.00 0.00 C ATOM 1481 C TYR A 88 -9.590 -11.673 -6.678 1.00 0.00 C ATOM 1482 O TYR A 88 -8.411 -11.794 -6.353 1.00 0.00 O ATOM 1483 CB TYR A 88 -11.500 -13.251 -7.459 1.00 0.00 C ATOM 1484 CG TYR A 88 -10.892 -14.210 -8.471 1.00 0.00 C ATOM 1485 CD1 TYR A 88 -9.661 -13.934 -9.098 1.00 0.00 C ATOM 1486 CD2 TYR A 88 -11.637 -15.332 -8.889 1.00 0.00 C ATOM 1487 CE1 TYR A 88 -9.220 -14.724 -10.172 1.00 0.00 C ATOM 1488 CE2 TYR A 88 -11.190 -16.145 -9.945 1.00 0.00 C ATOM 1489 CZ TYR A 88 -9.989 -15.822 -10.612 1.00 0.00 C ATOM 1490 OH TYR A 88 -9.622 -16.502 -11.731 1.00 0.00 O ATOM 0 H TYR A 88 -11.225 -12.841 -4.336 1.00 0.00 H new ATOM 0 HA TYR A 88 -10.020 -13.629 -6.024 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -12.372 -13.736 -7.022 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -11.860 -12.377 -8.002 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -9.054 -13.111 -8.751 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -12.565 -15.570 -8.390 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -8.287 -14.490 -10.664 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -11.762 -17.011 -10.244 1.00 0.00 H new ATOM 0 HH TYR A 88 -10.257 -17.230 -11.895 1.00 0.00 H new ATOM 1500 N VAL A 89 -10.012 -10.584 -7.310 1.00 0.00 N ATOM 1501 CA VAL A 89 -9.116 -9.661 -7.996 1.00 0.00 C ATOM 1502 C VAL A 89 -9.024 -8.399 -7.154 1.00 0.00 C ATOM 1503 O VAL A 89 -9.961 -7.601 -7.108 1.00 0.00 O ATOM 1504 CB VAL A 89 -9.580 -9.392 -9.439 1.00 0.00 C ATOM 1505 CG1 VAL A 89 -8.594 -8.459 -10.152 1.00 0.00 C ATOM 1506 CG2 VAL A 89 -9.703 -10.684 -10.251 1.00 0.00 C ATOM 0 H VAL A 89 -10.994 -10.315 -7.361 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.121 -10.094 -8.097 1.00 0.00 H new ATOM 0 HB VAL A 89 -10.563 -8.925 -9.373 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -8.936 -8.278 -11.171 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -8.536 -7.512 -9.615 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.608 -8.922 -10.177 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -10.033 -10.448 -11.263 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -8.734 -11.182 -10.292 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -10.430 -11.344 -9.777 1.00 0.00 H new ATOM 1516 N ALA A 90 -7.901 -8.235 -6.463 1.00 0.00 N ATOM 1517 CA ALA A 90 -7.653 -7.033 -5.680 1.00 0.00 C ATOM 1518 C ALA A 90 -7.253 -5.859 -6.596 1.00 0.00 C ATOM 1519 O ALA A 90 -6.825 -6.089 -7.733 1.00 0.00 O ATOM 1520 CB ALA A 90 -6.587 -7.341 -4.619 1.00 0.00 C ATOM 0 H ALA A 90 -7.148 -8.922 -6.430 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.564 -6.725 -5.167 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -6.394 -6.446 -4.027 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -6.943 -8.138 -3.967 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -5.666 -7.657 -5.109 1.00 0.00 H new ATOM 1526 N PRO A 91 -7.379 -4.602 -6.132 1.00 0.00 N ATOM 1527 CA PRO A 91 -6.887 -3.415 -6.824 1.00 0.00 C ATOM 1528 C PRO A 91 -5.382 -3.470 -7.092 1.00 0.00 C ATOM 1529 O PRO A 91 -4.625 -4.178 -6.428 1.00 0.00 O ATOM 1530 CB PRO A 91 -7.223 -2.220 -5.920 1.00 0.00 C ATOM 1531 CG PRO A 91 -7.517 -2.838 -4.559 1.00 0.00 C ATOM 1532 CD PRO A 91 -8.078 -4.205 -4.925 1.00 0.00 C ATOM 0 HA PRO A 91 -7.359 -3.337 -7.803 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -6.391 -1.518 -5.865 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -8.083 -1.666 -6.298 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -6.617 -2.920 -3.949 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -8.234 -2.245 -3.992 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -7.914 -4.924 -4.122 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -9.154 -4.155 -5.093 1.00 0.00 H new ATOM 1540 N GLU A 92 -4.938 -2.667 -8.054 1.00 0.00 N ATOM 1541 CA GLU A 92 -3.532 -2.417 -8.292 1.00 0.00 C ATOM 1542 C GLU A 92 -3.027 -1.463 -7.221 1.00 0.00 C ATOM 1543 O GLU A 92 -3.572 -0.372 -7.062 1.00 0.00 O ATOM 1544 CB GLU A 92 -3.359 -1.823 -9.698 1.00 0.00 C ATOM 1545 CG GLU A 92 -2.245 -2.501 -10.499 1.00 0.00 C ATOM 1546 CD GLU A 92 -2.413 -4.012 -10.694 1.00 0.00 C ATOM 1547 OE1 GLU A 92 -1.979 -4.778 -9.799 1.00 0.00 O ATOM 1548 OE2 GLU A 92 -2.918 -4.433 -11.763 1.00 0.00 O ATOM 0 H GLU A 92 -5.556 -2.169 -8.694 1.00 0.00 H new ATOM 0 HA GLU A 92 -2.954 -3.340 -8.241 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -4.298 -1.914 -10.243 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -3.142 -0.758 -9.613 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -2.184 -2.028 -11.479 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -1.295 -2.318 -9.997 1.00 0.00 H new ATOM 1555 N ILE A 93 -2.002 -1.883 -6.485 1.00 0.00 N ATOM 1556 CA ILE A 93 -1.360 -1.070 -5.471 1.00 0.00 C ATOM 1557 C ILE A 93 -0.445 -0.093 -6.215 1.00 0.00 C ATOM 1558 O ILE A 93 0.550 -0.537 -6.788 1.00 0.00 O ATOM 1559 CB ILE A 93 -0.572 -1.974 -4.491 1.00 0.00 C ATOM 1560 CG1 ILE A 93 -1.350 -3.197 -3.947 1.00 0.00 C ATOM 1561 CG2 ILE A 93 -0.028 -1.128 -3.330 1.00 0.00 C ATOM 1562 CD1 ILE A 93 -2.693 -2.883 -3.280 1.00 0.00 C ATOM 0 H ILE A 93 -1.592 -2.812 -6.582 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.082 -0.518 -4.869 1.00 0.00 H new ATOM 0 HB ILE A 93 0.241 -2.400 -5.078 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -1.527 -3.889 -4.771 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -0.719 -3.715 -3.225 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.526 -1.767 -2.642 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.635 -0.356 -3.722 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.858 -0.660 -2.801 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -3.153 -3.809 -2.935 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -2.531 -2.220 -2.430 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -3.352 -2.396 -3.999 1.00 0.00 H new ATOM 1574 N ARG A 94 -0.773 1.197 -6.266 1.00 0.00 N ATOM 1575 CA ARG A 94 0.202 2.224 -6.610 1.00 0.00 C ATOM 1576 C ARG A 94 0.930 2.593 -5.329 1.00 0.00 C ATOM 1577 O ARG A 94 0.295 3.129 -4.421 1.00 0.00 O ATOM 1578 CB ARG A 94 -0.456 3.488 -7.165 1.00 0.00 C ATOM 1579 CG ARG A 94 -0.989 3.382 -8.598 1.00 0.00 C ATOM 1580 CD ARG A 94 -0.806 4.763 -9.232 1.00 0.00 C ATOM 1581 NE ARG A 94 -1.546 4.945 -10.485 1.00 0.00 N ATOM 1582 CZ ARG A 94 -1.085 5.697 -11.488 1.00 0.00 C ATOM 1583 NH1 ARG A 94 0.200 5.671 -11.823 1.00 0.00 N ATOM 1584 NH2 ARG A 94 -1.936 6.477 -12.137 1.00 0.00 N ATOM 0 H ARG A 94 -1.709 1.554 -6.073 1.00 0.00 H new ATOM 0 HA ARG A 94 0.868 1.832 -7.379 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -1.281 3.765 -6.509 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.269 4.301 -7.125 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -0.445 2.622 -9.159 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -2.039 3.090 -8.601 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -1.125 5.524 -8.520 1.00 0.00 H new ATOM 0 HD3 ARG A 94 0.255 4.927 -9.421 1.00 0.00 H new ATOM 0 HE ARG A 94 -2.447 4.480 -10.595 1.00 0.00 H new ATOM 0 HH11 ARG A 94 0.848 5.072 -11.312 1.00 0.00 H new ATOM 0 HH12 ARG A 94 0.539 6.250 -12.591 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -2.920 6.494 -11.867 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -1.608 7.061 -12.907 1.00 0.00 H new ATOM 1598 N PHE A 95 2.228 2.324 -5.239 1.00 0.00 N ATOM 1599 CA PHE A 95 3.019 2.841 -4.133 1.00 0.00 C ATOM 1600 C PHE A 95 3.375 4.306 -4.420 1.00 0.00 C ATOM 1601 O PHE A 95 3.780 4.627 -5.541 1.00 0.00 O ATOM 1602 CB PHE A 95 4.247 1.944 -3.944 1.00 0.00 C ATOM 1603 CG PHE A 95 3.894 0.531 -3.502 1.00 0.00 C ATOM 1604 CD1 PHE A 95 3.322 0.323 -2.230 1.00 0.00 C ATOM 1605 CD2 PHE A 95 4.150 -0.583 -4.332 1.00 0.00 C ATOM 1606 CE1 PHE A 95 3.044 -0.979 -1.781 1.00 0.00 C ATOM 1607 CE2 PHE A 95 3.888 -1.883 -3.858 1.00 0.00 C ATOM 1608 CZ PHE A 95 3.320 -2.082 -2.595 1.00 0.00 C ATOM 0 H PHE A 95 2.748 1.758 -5.910 1.00 0.00 H new ATOM 0 HA PHE A 95 2.462 2.825 -3.196 1.00 0.00 H new ATOM 0 HB2 PHE A 95 4.802 1.897 -4.881 1.00 0.00 H new ATOM 0 HB3 PHE A 95 4.908 2.395 -3.204 1.00 0.00 H new ATOM 0 HD1 PHE A 95 3.096 1.169 -1.598 1.00 0.00 H new ATOM 0 HD2 PHE A 95 4.545 -0.438 -5.327 1.00 0.00 H new ATOM 0 HE1 PHE A 95 2.615 -1.129 -0.801 1.00 0.00 H new ATOM 0 HE2 PHE A 95 4.128 -2.735 -4.476 1.00 0.00 H new ATOM 0 HZ PHE A 95 3.096 -3.081 -2.251 1.00 0.00 H new ATOM 1618 N TYR A 96 3.236 5.196 -3.436 1.00 0.00 N ATOM 1619 CA TYR A 96 3.630 6.605 -3.489 1.00 0.00 C ATOM 1620 C TYR A 96 4.650 6.904 -2.393 1.00 0.00 C ATOM 1621 O TYR A 96 4.608 6.324 -1.305 1.00 0.00 O ATOM 1622 CB TYR A 96 2.402 7.509 -3.300 1.00 0.00 C ATOM 1623 CG TYR A 96 1.574 7.670 -4.554 1.00 0.00 C ATOM 1624 CD1 TYR A 96 0.585 6.722 -4.872 1.00 0.00 C ATOM 1625 CD2 TYR A 96 1.808 8.764 -5.410 1.00 0.00 C ATOM 1626 CE1 TYR A 96 -0.185 6.881 -6.040 1.00 0.00 C ATOM 1627 CE2 TYR A 96 1.053 8.920 -6.584 1.00 0.00 C ATOM 1628 CZ TYR A 96 0.051 7.978 -6.902 1.00 0.00 C ATOM 1629 OH TYR A 96 -0.642 8.091 -8.067 1.00 0.00 O ATOM 0 H TYR A 96 2.826 4.942 -2.537 1.00 0.00 H new ATOM 0 HA TYR A 96 4.075 6.803 -4.464 1.00 0.00 H new ATOM 0 HB2 TYR A 96 1.775 7.096 -2.510 1.00 0.00 H new ATOM 0 HB3 TYR A 96 2.732 8.492 -2.963 1.00 0.00 H new ATOM 0 HD1 TYR A 96 0.417 5.875 -4.223 1.00 0.00 H new ATOM 0 HD2 TYR A 96 2.572 9.486 -5.162 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -0.957 6.164 -6.278 1.00 0.00 H new ATOM 0 HE2 TYR A 96 1.238 9.757 -7.241 1.00 0.00 H new ATOM 0 HH TYR A 96 -0.359 8.902 -8.539 1.00 0.00 H new ATOM 1639 N GLU A 97 5.527 7.878 -2.648 1.00 0.00 N ATOM 1640 CA GLU A 97 6.667 8.246 -1.802 1.00 0.00 C ATOM 1641 C GLU A 97 6.215 9.169 -0.655 1.00 0.00 C ATOM 1642 O GLU A 97 6.868 10.162 -0.334 1.00 0.00 O ATOM 1643 CB GLU A 97 7.800 8.894 -2.637 1.00 0.00 C ATOM 1644 CG GLU A 97 7.916 8.484 -4.111 1.00 0.00 C ATOM 1645 CD GLU A 97 7.155 9.457 -5.010 1.00 0.00 C ATOM 1646 OE1 GLU A 97 5.909 9.323 -5.093 1.00 0.00 O ATOM 1647 OE2 GLU A 97 7.814 10.359 -5.577 1.00 0.00 O ATOM 0 H GLU A 97 5.460 8.457 -3.485 1.00 0.00 H new ATOM 0 HA GLU A 97 7.071 7.335 -1.361 1.00 0.00 H new ATOM 0 HB2 GLU A 97 7.670 9.976 -2.598 1.00 0.00 H new ATOM 0 HB3 GLU A 97 8.748 8.669 -2.149 1.00 0.00 H new ATOM 0 HG2 GLU A 97 8.966 8.458 -4.404 1.00 0.00 H new ATOM 0 HG3 GLU A 97 7.523 7.476 -4.244 1.00 0.00 H new ATOM 1654 N ASP A 98 5.037 8.891 -0.099 1.00 0.00 N ATOM 1655 CA ASP A 98 4.286 9.650 0.904 1.00 0.00 C ATOM 1656 C ASP A 98 4.037 11.131 0.577 1.00 0.00 C ATOM 1657 O ASP A 98 3.624 11.908 1.431 1.00 0.00 O ATOM 1658 CB ASP A 98 4.912 9.389 2.284 1.00 0.00 C ATOM 1659 CG ASP A 98 4.058 9.882 3.453 1.00 0.00 C ATOM 1660 OD1 ASP A 98 3.002 9.250 3.693 1.00 0.00 O ATOM 1661 OD2 ASP A 98 4.483 10.830 4.156 1.00 0.00 O ATOM 0 H ASP A 98 4.533 8.045 -0.365 1.00 0.00 H new ATOM 0 HA ASP A 98 3.262 9.277 0.904 1.00 0.00 H new ATOM 0 HB2 ASP A 98 5.084 8.319 2.398 1.00 0.00 H new ATOM 0 HB3 ASP A 98 5.887 9.875 2.328 1.00 0.00 H new ATOM 1666 N LYS A 99 4.238 11.522 -0.682 1.00 0.00 N ATOM 1667 CA LYS A 99 4.348 12.932 -1.080 1.00 0.00 C ATOM 1668 C LYS A 99 3.203 13.437 -1.952 1.00 0.00 C ATOM 1669 O LYS A 99 2.796 14.587 -1.792 1.00 0.00 O ATOM 1670 CB LYS A 99 5.725 13.214 -1.708 1.00 0.00 C ATOM 1671 CG LYS A 99 5.816 12.857 -3.199 1.00 0.00 C ATOM 1672 CD LYS A 99 7.229 13.051 -3.759 1.00 0.00 C ATOM 1673 CE LYS A 99 7.227 13.245 -5.281 1.00 0.00 C ATOM 1674 NZ LYS A 99 6.817 14.612 -5.663 1.00 0.00 N ATOM 0 H LYS A 99 4.330 10.869 -1.460 1.00 0.00 H new ATOM 0 HA LYS A 99 4.259 13.510 -0.160 1.00 0.00 H new ATOM 0 HB2 LYS A 99 5.960 14.271 -1.583 1.00 0.00 H new ATOM 0 HB3 LYS A 99 6.483 12.652 -1.163 1.00 0.00 H new ATOM 0 HG2 LYS A 99 5.511 11.820 -3.341 1.00 0.00 H new ATOM 0 HG3 LYS A 99 5.117 13.475 -3.762 1.00 0.00 H new ATOM 0 HD2 LYS A 99 7.690 13.917 -3.285 1.00 0.00 H new ATOM 0 HD3 LYS A 99 7.841 12.185 -3.505 1.00 0.00 H new ATOM 0 HE2 LYS A 99 8.223 13.042 -5.674 1.00 0.00 H new ATOM 0 HE3 LYS A 99 6.551 12.522 -5.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 6.829 14.701 -6.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 5.856 14.798 -5.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 7.477 15.301 -5.249 1.00 0.00 H new ATOM 1688 N GLY A 100 2.706 12.624 -2.884 1.00 0.00 N ATOM 1689 CA GLY A 100 1.701 13.032 -3.856 1.00 0.00 C ATOM 1690 C GLY A 100 0.363 12.606 -3.294 1.00 0.00 C ATOM 1691 O GLY A 100 0.133 11.405 -3.206 1.00 0.00 O ATOM 0 H GLY A 100 2.996 11.651 -2.983 1.00 0.00 H new ATOM 0 HA2 GLY A 100 1.730 14.110 -4.015 1.00 0.00 H new ATOM 0 HA3 GLY A 100 1.883 12.563 -4.823 1.00 0.00 H new ATOM 1695 N ILE A 101 -0.441 13.566 -2.838 1.00 0.00 N ATOM 1696 CA ILE A 101 -1.650 13.336 -2.051 1.00 0.00 C ATOM 1697 C ILE A 101 -2.895 13.728 -2.869 1.00 0.00 C ATOM 1698 O ILE A 101 -4.028 13.494 -2.437 1.00 0.00 O ATOM 1699 CB ILE A 101 -1.518 14.060 -0.680 1.00 0.00 C ATOM 1700 CG1 ILE A 101 -0.166 13.831 0.055 1.00 0.00 C ATOM 1701 CG2 ILE A 101 -2.621 13.652 0.308 1.00 0.00 C ATOM 1702 CD1 ILE A 101 0.271 15.069 0.844 1.00 0.00 C ATOM 0 H ILE A 101 -0.263 14.555 -3.012 1.00 0.00 H new ATOM 0 HA ILE A 101 -1.776 12.277 -1.823 1.00 0.00 H new ATOM 0 HB ILE A 101 -1.597 15.110 -0.961 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -0.260 12.983 0.733 1.00 0.00 H new ATOM 0 HG13 ILE A 101 0.604 13.573 -0.672 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -2.483 14.186 1.248 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -3.596 13.902 -0.111 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -2.568 12.578 0.489 1.00 0.00 H new ATOM 0 HD11 ILE A 101 1.219 14.867 1.342 1.00 0.00 H new ATOM 0 HD12 ILE A 101 0.391 15.911 0.162 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -0.486 15.311 1.590 1.00 0.00 H new ATOM 1714 N GLU A 102 -2.704 14.303 -4.061 1.00 0.00 N ATOM 1715 CA GLU A 102 -3.786 14.516 -5.006 1.00 0.00 C ATOM 1716 C GLU A 102 -4.196 13.154 -5.556 1.00 0.00 C ATOM 1717 O GLU A 102 -3.349 12.409 -6.053 1.00 0.00 O ATOM 1718 CB GLU A 102 -3.378 15.440 -6.163 1.00 0.00 C ATOM 1719 CG GLU A 102 -2.557 16.666 -5.758 1.00 0.00 C ATOM 1720 CD GLU A 102 -1.067 16.403 -5.957 1.00 0.00 C ATOM 1721 OE1 GLU A 102 -0.582 16.651 -7.086 1.00 0.00 O ATOM 1722 OE2 GLU A 102 -0.353 16.032 -4.994 1.00 0.00 O ATOM 0 H GLU A 102 -1.795 14.630 -4.390 1.00 0.00 H new ATOM 0 HA GLU A 102 -4.613 15.004 -4.490 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -2.803 14.860 -6.885 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -4.280 15.779 -6.672 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.862 17.527 -6.352 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.752 16.913 -4.714 1.00 0.00 H new ATOM 1729 N ALA A 103 -5.485 12.832 -5.512 1.00 0.00 N ATOM 1730 CA ALA A 103 -6.019 11.562 -5.974 1.00 0.00 C ATOM 1731 C ALA A 103 -6.869 11.814 -7.223 1.00 0.00 C ATOM 1732 O ALA A 103 -8.043 12.163 -7.101 1.00 0.00 O ATOM 1733 CB ALA A 103 -6.797 10.904 -4.825 1.00 0.00 C ATOM 0 H ALA A 103 -6.199 13.462 -5.146 1.00 0.00 H new ATOM 0 HA ALA A 103 -5.229 10.867 -6.259 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.203 9.949 -5.160 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -6.128 10.738 -3.981 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -7.613 11.557 -4.517 1.00 0.00 H new ATOM 1739 N SER A 104 -6.286 11.663 -8.416 1.00 0.00 N ATOM 1740 CA SER A 104 -6.978 11.640 -9.705 1.00 0.00 C ATOM 1741 C SER A 104 -6.571 10.384 -10.479 1.00 0.00 C ATOM 1742 O SER A 104 -5.467 9.868 -10.278 1.00 0.00 O ATOM 1743 CB SER A 104 -6.581 12.859 -10.550 1.00 0.00 C ATOM 1744 OG SER A 104 -7.121 14.086 -10.094 1.00 0.00 O ATOM 0 H SER A 104 -5.277 11.549 -8.512 1.00 0.00 H new ATOM 0 HA SER A 104 -8.052 11.652 -9.517 1.00 0.00 H new ATOM 0 HB2 SER A 104 -5.494 12.937 -10.565 1.00 0.00 H new ATOM 0 HB3 SER A 104 -6.903 12.694 -11.578 1.00 0.00 H new ATOM 0 HG SER A 104 -6.823 14.813 -10.680 1.00 0.00 H new ATOM 1750 N VAL A 105 -7.414 9.945 -11.423 1.00 0.00 N ATOM 1751 CA VAL A 105 -7.039 8.995 -12.473 1.00 0.00 C ATOM 1752 C VAL A 105 -7.660 9.405 -13.824 1.00 0.00 C ATOM 1753 O VAL A 105 -7.127 9.048 -14.879 1.00 0.00 O ATOM 1754 CB VAL A 105 -7.442 7.547 -12.103 1.00 0.00 C ATOM 1755 CG1 VAL A 105 -6.531 6.539 -12.826 1.00 0.00 C ATOM 1756 CG2 VAL A 105 -7.422 7.221 -10.602 1.00 0.00 C ATOM 0 H VAL A 105 -8.387 10.245 -11.478 1.00 0.00 H new ATOM 0 HA VAL A 105 -5.953 9.020 -12.567 1.00 0.00 H new ATOM 0 HB VAL A 105 -8.480 7.465 -12.425 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -6.825 5.525 -12.557 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -6.626 6.671 -13.904 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -5.496 6.707 -12.530 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -7.720 6.183 -10.451 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -6.416 7.370 -10.211 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -8.116 7.878 -10.078 1.00 0.00 H new ATOM 1766 N LYS A 106 -8.782 10.135 -13.862 1.00 0.00 N ATOM 1767 CA LYS A 106 -9.321 10.735 -15.082 1.00 0.00 C ATOM 1768 C LYS A 106 -10.122 11.940 -14.652 1.00 0.00 C ATOM 1769 O LYS A 106 -11.205 11.768 -14.059 1.00 0.00 O ATOM 1770 CB LYS A 106 -10.174 9.713 -15.856 1.00 0.00 C ATOM 1771 CG LYS A 106 -10.593 10.179 -17.263 1.00 0.00 C ATOM 1772 CD LYS A 106 -10.295 9.113 -18.333 1.00 0.00 C ATOM 1773 CE LYS A 106 -8.792 9.078 -18.647 1.00 0.00 C ATOM 1774 NZ LYS A 106 -8.411 7.970 -19.547 1.00 0.00 N ATOM 0 H LYS A 106 -9.346 10.326 -13.034 1.00 0.00 H new ATOM 0 HA LYS A 106 -8.528 11.040 -15.765 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -9.614 8.782 -15.945 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -11.070 9.491 -15.277 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -11.658 10.409 -17.267 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -10.067 11.100 -17.512 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -10.623 8.134 -17.982 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -10.858 9.332 -19.240 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -8.501 10.024 -19.103 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -8.235 8.988 -17.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -7.386 8.001 -19.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -8.660 7.062 -19.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -8.918 8.066 -20.450 1.00 0.00 H new TER 1788 LYS A 106