USER MOD reduce.3.24.130724 H: found=0, std=0, add=768, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 767 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 24 THR OG1 : rot 171:sc= -0.775 USER MOD Set 1.2: A 84 SER OG : rot 160:sc= -0.512 USER MOD Set 2.1: A 76 ASN : amide:sc= -0.699 K(o=-6.1,f=-4.5) USER MOD Set 2.2: A 77 ASN : amide:sc= -5.39! C(o=-6.1!,f=-8.4!) USER MOD Set 3.1: A 26 THR OG1 : rot -94:sc= 0.702 USER MOD Set 3.2: A 29 GLN : amide:sc= -0.635 K(o=0.067,f=-13!) USER MOD Set 4.1: A 20 ASN : amide:sc= -0.737 K(o=-1.3,f=-0.024) USER MOD Set 4.2: A 85 GLN : amide:sc= -0.609 K(o=-1.3,f=-0.024) USER MOD Set 5.1: A 10 SER OG : rot -95:sc= -2.17! USER MOD Set 5.2: A 15 ASN : amide:sc= -5.36! C(o=-7.5!,f=-6.4!) USER MOD Single : A 1 MET CE :methyl 152:sc= -0.048 (180deg=-0.577) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0819 USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 160:sc= -0.636 USER MOD Single : A 17 TYR OH : rot 180:sc= -0.479 USER MOD Single : A 19 THR OG1 : rot 180:sc= -1.07 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.0112 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 68:sc= 1.11 USER MOD Single : A 39 SER OG : rot 65:sc= 0.972 USER MOD Single : A 42 GLN : amide:sc= -1.39 K(o=-1.4,f=-2.9!) USER MOD Single : A 43 LYS NZ :NH3+ -135:sc= -0.416 (180deg=-1.66) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=-0.0098) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 116:sc= 1.03 USER MOD Single : A 62 TYR OH : rot -79:sc= -2.15! USER MOD Single : A 63 ASN : amide:sc= -5.61! C(o=-5.6!,f=-5.5!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot -150:sc= -1.3 USER MOD Single : A 95 HIS : no HE2:sc= -0.514 X(o=-0.51,f=-0.46) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.104 14.334 3.574 1.00 0.00 N ATOM 2 CA MET A 1 -15.937 13.421 3.415 1.00 0.00 C ATOM 3 C MET A 1 -15.872 12.468 4.610 1.00 0.00 C ATOM 4 O MET A 1 -14.855 12.343 5.264 1.00 0.00 O ATOM 5 CB MET A 1 -14.650 14.246 3.342 1.00 0.00 C ATOM 6 CG MET A 1 -14.487 14.808 1.927 1.00 0.00 C ATOM 7 SD MET A 1 -14.552 16.616 1.985 1.00 0.00 S ATOM 8 CE MET A 1 -13.001 16.869 2.882 1.00 0.00 C ATOM 0 H1 MET A 1 -17.150 14.983 2.763 1.00 0.00 H new ATOM 0 H2 MET A 1 -17.979 13.774 3.620 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.998 14.883 4.451 1.00 0.00 H new ATOM 0 HA MET A 1 -16.047 12.843 2.497 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.685 15.059 4.067 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.792 13.625 3.600 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.538 14.481 1.501 1.00 0.00 H new ATOM 0 HG3 MET A 1 -15.276 14.426 1.279 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.581 17.839 2.616 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.192 16.837 3.955 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.294 16.083 2.616 1.00 0.00 H new ATOM 20 N SER A 2 -16.954 11.796 4.900 1.00 0.00 N ATOM 21 CA SER A 2 -16.961 10.852 6.052 1.00 0.00 C ATOM 22 C SER A 2 -17.172 9.424 5.542 1.00 0.00 C ATOM 23 O SER A 2 -17.519 8.532 6.292 1.00 0.00 O ATOM 24 CB SER A 2 -18.095 11.227 7.006 1.00 0.00 C ATOM 25 OG SER A 2 -19.236 10.429 6.717 1.00 0.00 O ATOM 0 H SER A 2 -17.834 11.861 4.388 1.00 0.00 H new ATOM 0 HA SER A 2 -16.008 10.910 6.578 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.782 11.074 8.039 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.340 12.284 6.900 1.00 0.00 H new ATOM 0 HG SER A 2 -19.964 10.666 7.328 1.00 0.00 H new ATOM 31 N TYR A 3 -16.969 9.199 4.273 1.00 0.00 N ATOM 32 CA TYR A 3 -17.159 7.829 3.720 1.00 0.00 C ATOM 33 C TYR A 3 -15.987 6.940 4.142 1.00 0.00 C ATOM 34 O TYR A 3 -15.137 7.342 4.913 1.00 0.00 O ATOM 35 CB TYR A 3 -17.224 7.900 2.193 1.00 0.00 C ATOM 36 CG TYR A 3 -18.436 8.697 1.774 1.00 0.00 C ATOM 37 CD1 TYR A 3 -19.671 8.057 1.607 1.00 0.00 C ATOM 38 CD2 TYR A 3 -18.327 10.074 1.548 1.00 0.00 C ATOM 39 CE1 TYR A 3 -20.795 8.794 1.216 1.00 0.00 C ATOM 40 CE2 TYR A 3 -19.451 10.813 1.158 1.00 0.00 C ATOM 41 CZ TYR A 3 -20.686 10.172 0.991 1.00 0.00 C ATOM 42 OH TYR A 3 -21.793 10.899 0.604 1.00 0.00 O ATOM 0 H TYR A 3 -16.680 9.905 3.596 1.00 0.00 H new ATOM 0 HA TYR A 3 -18.089 7.408 4.103 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -16.318 8.363 1.802 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -17.274 6.895 1.774 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -19.756 6.994 1.780 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -17.375 10.567 1.675 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -21.747 8.300 1.088 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -19.366 11.876 0.986 1.00 0.00 H new ATOM 0 HH TYR A 3 -21.543 11.840 0.492 1.00 0.00 H new ATOM 52 N ALA A 4 -15.933 5.735 3.645 1.00 0.00 N ATOM 53 CA ALA A 4 -14.816 4.822 4.019 1.00 0.00 C ATOM 54 C ALA A 4 -14.288 4.119 2.767 1.00 0.00 C ATOM 55 O ALA A 4 -14.988 3.970 1.785 1.00 0.00 O ATOM 56 CB ALA A 4 -15.327 3.775 5.011 1.00 0.00 C ATOM 0 H ALA A 4 -16.615 5.343 2.995 1.00 0.00 H new ATOM 0 HA ALA A 4 -14.013 5.400 4.477 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -14.512 3.106 5.286 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -15.704 4.273 5.904 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -16.130 3.199 4.551 1.00 0.00 H new ATOM 62 N ARG A 5 -13.058 3.684 2.795 1.00 0.00 N ATOM 63 CA ARG A 5 -12.481 2.988 1.610 1.00 0.00 C ATOM 64 C ARG A 5 -12.483 3.931 0.405 1.00 0.00 C ATOM 65 O ARG A 5 -13.352 3.856 -0.440 1.00 0.00 O ATOM 66 CB ARG A 5 -13.325 1.754 1.279 1.00 0.00 C ATOM 67 CG ARG A 5 -12.956 0.608 2.222 1.00 0.00 C ATOM 68 CD ARG A 5 -14.217 0.107 2.926 1.00 0.00 C ATOM 69 NE ARG A 5 -13.894 -1.113 3.719 1.00 0.00 N ATOM 70 CZ ARG A 5 -14.311 -1.219 4.950 1.00 0.00 C ATOM 71 NH1 ARG A 5 -15.588 -1.155 5.215 1.00 0.00 N ATOM 72 NH2 ARG A 5 -13.453 -1.384 5.919 1.00 0.00 N ATOM 0 H ARG A 5 -12.426 3.781 3.590 1.00 0.00 H new ATOM 0 HA ARG A 5 -11.459 2.686 1.837 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -14.385 1.990 1.375 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -13.158 1.454 0.244 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -12.491 -0.204 1.662 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -12.226 0.947 2.957 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -14.614 0.884 3.580 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -14.991 -0.118 2.192 1.00 0.00 H new ATOM 0 HE ARG A 5 -13.347 -1.865 3.299 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -16.260 -1.022 4.459 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -15.914 -1.238 6.178 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -12.455 -1.430 5.714 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -13.780 -1.467 6.881 1.00 0.00 H new ATOM 86 N PRO A 6 -11.500 4.790 0.363 1.00 0.00 N ATOM 87 CA PRO A 6 -11.430 5.731 -0.776 1.00 0.00 C ATOM 88 C PRO A 6 -11.017 4.985 -2.049 1.00 0.00 C ATOM 89 O PRO A 6 -10.931 3.774 -2.068 1.00 0.00 O ATOM 90 CB PRO A 6 -10.364 6.748 -0.367 1.00 0.00 C ATOM 91 CG PRO A 6 -9.484 6.050 0.687 1.00 0.00 C ATOM 92 CD PRO A 6 -10.311 4.880 1.244 1.00 0.00 C ATOM 0 HA PRO A 6 -12.386 6.207 -0.991 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -9.770 7.056 -1.227 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -10.822 7.648 0.043 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -8.556 5.691 0.241 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -9.208 6.743 1.482 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -9.739 3.952 1.230 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -10.601 5.060 2.279 1.00 0.00 H new ATOM 100 N GLY A 7 -10.766 5.695 -3.115 1.00 0.00 N ATOM 101 CA GLY A 7 -10.364 5.017 -4.381 1.00 0.00 C ATOM 102 C GLY A 7 -9.677 6.019 -5.310 1.00 0.00 C ATOM 103 O GLY A 7 -9.705 7.212 -5.083 1.00 0.00 O ATOM 0 H GLY A 7 -10.822 6.712 -3.165 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.690 4.189 -4.162 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.240 4.594 -4.872 1.00 0.00 H new ATOM 107 N GLY A 8 -9.062 5.543 -6.358 1.00 0.00 N ATOM 108 CA GLY A 8 -8.374 6.464 -7.306 1.00 0.00 C ATOM 109 C GLY A 8 -8.785 6.119 -8.738 1.00 0.00 C ATOM 110 O GLY A 8 -9.884 6.412 -9.163 1.00 0.00 O ATOM 0 H GLY A 8 -9.006 4.553 -6.599 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -8.635 7.498 -7.080 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -7.293 6.377 -7.195 1.00 0.00 H new ATOM 114 N GLU A 9 -7.915 5.496 -9.486 1.00 0.00 N ATOM 115 CA GLU A 9 -8.270 5.133 -10.886 1.00 0.00 C ATOM 116 C GLU A 9 -7.244 4.145 -11.445 1.00 0.00 C ATOM 117 O GLU A 9 -6.810 4.253 -12.574 1.00 0.00 O ATOM 118 CB GLU A 9 -8.300 6.397 -11.748 1.00 0.00 C ATOM 119 CG GLU A 9 -9.554 6.385 -12.627 1.00 0.00 C ATOM 120 CD GLU A 9 -9.665 7.713 -13.377 1.00 0.00 C ATOM 121 OE1 GLU A 9 -9.771 8.735 -12.720 1.00 0.00 O ATOM 122 OE2 GLU A 9 -9.642 7.684 -14.597 1.00 0.00 O ATOM 0 H GLU A 9 -6.978 5.224 -9.189 1.00 0.00 H new ATOM 0 HA GLU A 9 -9.254 4.664 -10.899 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -8.296 7.283 -11.113 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -7.407 6.447 -12.371 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -9.506 5.558 -13.336 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -10.440 6.227 -12.012 1.00 0.00 H new ATOM 129 N SER A 10 -6.877 3.169 -10.664 1.00 0.00 N ATOM 130 CA SER A 10 -5.902 2.144 -11.138 1.00 0.00 C ATOM 131 C SER A 10 -6.609 0.791 -11.132 1.00 0.00 C ATOM 132 O SER A 10 -7.447 0.547 -10.286 1.00 0.00 O ATOM 133 CB SER A 10 -4.694 2.105 -10.200 1.00 0.00 C ATOM 134 OG SER A 10 -4.392 3.425 -9.771 1.00 0.00 O ATOM 0 H SER A 10 -7.212 3.035 -9.710 1.00 0.00 H new ATOM 0 HA SER A 10 -5.551 2.385 -12.141 1.00 0.00 H new ATOM 0 HB2 SER A 10 -4.907 1.470 -9.340 1.00 0.00 H new ATOM 0 HB3 SER A 10 -3.835 1.671 -10.712 1.00 0.00 H new ATOM 0 HG SER A 10 -3.694 3.804 -10.346 1.00 0.00 H new ATOM 140 N ILE A 11 -6.298 -0.084 -12.071 1.00 0.00 N ATOM 141 CA ILE A 11 -6.985 -1.422 -12.137 1.00 0.00 C ATOM 142 C ILE A 11 -8.431 -1.252 -11.642 1.00 0.00 C ATOM 143 O ILE A 11 -8.991 -2.093 -10.976 1.00 0.00 O ATOM 144 CB ILE A 11 -6.198 -2.499 -11.329 1.00 0.00 C ATOM 145 CG1 ILE A 11 -7.126 -3.666 -10.929 1.00 0.00 C ATOM 146 CG2 ILE A 11 -5.563 -1.900 -10.059 1.00 0.00 C ATOM 147 CD1 ILE A 11 -6.378 -5.008 -10.935 1.00 0.00 C ATOM 0 H ILE A 11 -5.597 0.073 -12.795 1.00 0.00 H new ATOM 0 HA ILE A 11 -7.009 -1.781 -13.166 1.00 0.00 H new ATOM 0 HB ILE A 11 -5.403 -2.869 -11.976 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.537 -3.482 -9.936 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.969 -3.715 -11.619 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -5.023 -2.679 -9.521 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -4.872 -1.105 -10.338 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.345 -1.492 -9.419 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.062 -5.807 -10.649 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -5.990 -5.204 -11.934 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.551 -4.967 -10.226 1.00 0.00 H new ATOM 159 N LYS A 12 -9.022 -0.124 -11.986 1.00 0.00 N ATOM 160 CA LYS A 12 -10.431 0.197 -11.571 1.00 0.00 C ATOM 161 C LYS A 12 -10.819 -0.630 -10.349 1.00 0.00 C ATOM 162 O LYS A 12 -11.748 -1.412 -10.387 1.00 0.00 O ATOM 163 CB LYS A 12 -11.412 -0.099 -12.717 1.00 0.00 C ATOM 164 CG LYS A 12 -10.731 -0.927 -13.811 1.00 0.00 C ATOM 165 CD LYS A 12 -10.094 0.012 -14.838 1.00 0.00 C ATOM 166 CE LYS A 12 -11.193 0.690 -15.658 1.00 0.00 C ATOM 167 NZ LYS A 12 -10.850 0.611 -17.105 1.00 0.00 N ATOM 0 H LYS A 12 -8.576 0.601 -12.548 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.481 1.258 -11.324 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -12.278 -0.638 -12.332 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -11.780 0.836 -13.138 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -9.971 -1.574 -13.373 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -11.459 -1.576 -14.298 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -9.487 0.763 -14.333 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -9.428 -0.548 -15.495 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -12.152 0.205 -15.473 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -11.299 1.731 -15.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -11.596 1.072 -17.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -9.944 1.092 -17.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -10.770 -0.386 -17.389 1.00 0.00 H new ATOM 181 N ASP A 13 -10.094 -0.494 -9.273 1.00 0.00 N ATOM 182 CA ASP A 13 -10.414 -1.310 -8.077 1.00 0.00 C ATOM 183 C ASP A 13 -10.059 -0.570 -6.776 1.00 0.00 C ATOM 184 O ASP A 13 -10.889 0.096 -6.190 1.00 0.00 O ATOM 185 CB ASP A 13 -9.637 -2.617 -8.159 1.00 0.00 C ATOM 186 CG ASP A 13 -10.250 -3.504 -9.245 1.00 0.00 C ATOM 187 OD1 ASP A 13 -11.464 -3.501 -9.371 1.00 0.00 O ATOM 188 OD2 ASP A 13 -9.494 -4.170 -9.933 1.00 0.00 O ATOM 0 H ASP A 13 -9.302 0.141 -9.174 1.00 0.00 H new ATOM 0 HA ASP A 13 -11.486 -1.504 -8.061 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.590 -2.417 -8.385 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -9.663 -3.130 -7.197 1.00 0.00 H new ATOM 193 N THR A 14 -8.841 -0.689 -6.310 1.00 0.00 N ATOM 194 CA THR A 14 -8.453 -0.008 -5.045 1.00 0.00 C ATOM 195 C THR A 14 -6.918 0.051 -4.936 1.00 0.00 C ATOM 196 O THR A 14 -6.260 -0.926 -4.648 1.00 0.00 O ATOM 197 CB THR A 14 -9.066 -0.757 -3.843 1.00 0.00 C ATOM 198 OG1 THR A 14 -9.349 0.178 -2.813 1.00 0.00 O ATOM 199 CG2 THR A 14 -8.109 -1.825 -3.303 1.00 0.00 C ATOM 0 H THR A 14 -8.100 -1.230 -6.755 1.00 0.00 H new ATOM 0 HA THR A 14 -8.835 1.013 -5.045 1.00 0.00 H new ATOM 0 HB THR A 14 -9.978 -1.253 -4.175 1.00 0.00 H new ATOM 0 HG1 THR A 14 -10.010 -0.203 -2.198 1.00 0.00 H new ATOM 0 HG21 THR A 14 -8.571 -2.334 -2.457 1.00 0.00 H new ATOM 0 HG22 THR A 14 -7.892 -2.550 -4.088 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.182 -1.352 -2.979 1.00 0.00 H new ATOM 207 N ASN A 15 -6.341 1.189 -5.155 1.00 0.00 N ATOM 208 CA ASN A 15 -4.854 1.295 -5.046 1.00 0.00 C ATOM 209 C ASN A 15 -4.487 1.360 -3.561 1.00 0.00 C ATOM 210 O ASN A 15 -5.347 1.290 -2.705 1.00 0.00 O ATOM 211 CB ASN A 15 -4.374 2.572 -5.741 1.00 0.00 C ATOM 212 CG ASN A 15 -5.230 2.832 -6.981 1.00 0.00 C ATOM 213 OD1 ASN A 15 -5.941 1.959 -7.438 1.00 0.00 O ATOM 214 ND2 ASN A 15 -5.191 4.006 -7.550 1.00 0.00 N ATOM 0 H ASN A 15 -6.824 2.052 -5.404 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.382 0.434 -5.519 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -4.440 3.418 -5.057 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.326 2.472 -6.024 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -5.757 4.190 -8.378 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.594 4.739 -7.167 1.00 0.00 H new ATOM 221 N LEU A 16 -3.229 1.477 -3.237 1.00 0.00 N ATOM 222 CA LEU A 16 -2.856 1.532 -1.796 1.00 0.00 C ATOM 223 C LEU A 16 -1.797 2.614 -1.567 1.00 0.00 C ATOM 224 O LEU A 16 -0.670 2.498 -2.001 1.00 0.00 O ATOM 225 CB LEU A 16 -2.300 0.169 -1.370 1.00 0.00 C ATOM 226 CG LEU A 16 -2.186 0.045 0.165 1.00 0.00 C ATOM 227 CD1 LEU A 16 -3.129 1.003 0.879 1.00 0.00 C ATOM 228 CD2 LEU A 16 -2.553 -1.379 0.568 1.00 0.00 C ATOM 0 H LEU A 16 -2.453 1.536 -3.897 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.738 1.773 -1.203 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -2.947 -0.621 -1.751 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.318 0.021 -1.820 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.163 0.291 0.450 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -3.019 0.886 1.957 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.887 2.028 0.599 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.157 0.782 0.593 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -2.477 -1.482 1.650 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -3.574 -1.594 0.254 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.870 -2.080 0.088 1.00 0.00 H new ATOM 240 N TYR A 17 -2.151 3.662 -0.877 1.00 0.00 N ATOM 241 CA TYR A 17 -1.167 4.748 -0.605 1.00 0.00 C ATOM 242 C TYR A 17 -0.510 4.491 0.754 1.00 0.00 C ATOM 243 O TYR A 17 -1.091 4.746 1.791 1.00 0.00 O ATOM 244 CB TYR A 17 -1.899 6.093 -0.584 1.00 0.00 C ATOM 245 CG TYR A 17 -0.899 7.224 -0.612 1.00 0.00 C ATOM 246 CD1 TYR A 17 0.202 7.167 -1.475 1.00 0.00 C ATOM 247 CD2 TYR A 17 -1.075 8.332 0.226 1.00 0.00 C ATOM 248 CE1 TYR A 17 1.127 8.218 -1.501 1.00 0.00 C ATOM 249 CE2 TYR A 17 -0.150 9.383 0.199 1.00 0.00 C ATOM 250 CZ TYR A 17 0.950 9.325 -0.663 1.00 0.00 C ATOM 251 OH TYR A 17 1.862 10.361 -0.688 1.00 0.00 O ATOM 0 H TYR A 17 -3.082 3.814 -0.488 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.402 4.768 -1.381 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -2.568 6.166 -1.442 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -2.518 6.166 0.310 1.00 0.00 H new ATOM 0 HD1 TYR A 17 0.338 6.312 -2.121 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -1.924 8.376 0.893 1.00 0.00 H new ATOM 0 HE1 TYR A 17 1.976 8.174 -2.167 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -0.286 10.239 0.844 1.00 0.00 H new ATOM 0 HH TYR A 17 1.591 11.051 -0.047 1.00 0.00 H new ATOM 261 N VAL A 18 0.690 3.974 0.762 1.00 0.00 N ATOM 262 CA VAL A 18 1.365 3.688 2.060 1.00 0.00 C ATOM 263 C VAL A 18 2.376 4.793 2.377 1.00 0.00 C ATOM 264 O VAL A 18 3.363 4.960 1.694 1.00 0.00 O ATOM 265 CB VAL A 18 2.071 2.332 1.979 1.00 0.00 C ATOM 266 CG1 VAL A 18 1.146 1.320 1.302 1.00 0.00 C ATOM 267 CG2 VAL A 18 3.360 2.460 1.164 1.00 0.00 C ATOM 0 H VAL A 18 1.230 3.738 -0.071 1.00 0.00 H new ATOM 0 HA VAL A 18 0.622 3.657 2.857 1.00 0.00 H new ATOM 0 HB VAL A 18 2.316 1.996 2.987 1.00 0.00 H new ATOM 0 HG11 VAL A 18 1.646 0.353 1.243 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.229 1.220 1.883 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.903 1.665 0.297 1.00 0.00 H new ATOM 0 HG21 VAL A 18 3.855 1.490 1.112 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.121 2.800 0.156 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.023 3.181 1.643 1.00 0.00 H new ATOM 277 N THR A 19 2.135 5.552 3.412 1.00 0.00 N ATOM 278 CA THR A 19 3.084 6.649 3.769 1.00 0.00 C ATOM 279 C THR A 19 4.242 6.079 4.593 1.00 0.00 C ATOM 280 O THR A 19 4.187 4.962 5.069 1.00 0.00 O ATOM 281 CB THR A 19 2.350 7.717 4.585 1.00 0.00 C ATOM 282 OG1 THR A 19 0.966 7.687 4.265 1.00 0.00 O ATOM 283 CG2 THR A 19 2.922 9.097 4.258 1.00 0.00 C ATOM 0 H THR A 19 1.325 5.461 4.025 1.00 0.00 H new ATOM 0 HA THR A 19 3.477 7.098 2.857 1.00 0.00 H new ATOM 0 HB THR A 19 2.482 7.516 5.648 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.495 8.369 4.788 1.00 0.00 H new ATOM 0 HG21 THR A 19 2.398 9.855 4.840 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.983 9.119 4.505 1.00 0.00 H new ATOM 0 HG23 THR A 19 2.793 9.302 3.195 1.00 0.00 H new ATOM 291 N ASN A 20 5.294 6.839 4.757 1.00 0.00 N ATOM 292 CA ASN A 20 6.463 6.346 5.542 1.00 0.00 C ATOM 293 C ASN A 20 7.267 5.368 4.686 1.00 0.00 C ATOM 294 O ASN A 20 8.278 5.717 4.111 1.00 0.00 O ATOM 295 CB ASN A 20 5.975 5.641 6.810 1.00 0.00 C ATOM 296 CG ASN A 20 6.624 6.288 8.036 1.00 0.00 C ATOM 297 OD1 ASN A 20 5.939 6.775 8.913 1.00 0.00 O ATOM 298 ND2 ASN A 20 7.925 6.312 8.135 1.00 0.00 N ATOM 0 H ASN A 20 5.393 7.782 4.380 1.00 0.00 H new ATOM 0 HA ASN A 20 7.094 7.189 5.824 1.00 0.00 H new ATOM 0 HB2 ASN A 20 4.889 5.709 6.882 1.00 0.00 H new ATOM 0 HB3 ASN A 20 6.226 4.581 6.769 1.00 0.00 H new ATOM 0 HD21 ASN A 20 8.367 6.740 8.949 1.00 0.00 H new ATOM 0 HD22 ASN A 20 8.500 5.903 7.399 1.00 0.00 H new ATOM 305 N LEU A 21 6.821 4.149 4.595 1.00 0.00 N ATOM 306 CA LEU A 21 7.547 3.141 3.774 1.00 0.00 C ATOM 307 C LEU A 21 9.035 3.145 4.131 1.00 0.00 C ATOM 308 O LEU A 21 9.780 3.994 3.686 1.00 0.00 O ATOM 309 CB LEU A 21 7.380 3.467 2.289 1.00 0.00 C ATOM 310 CG LEU A 21 7.514 2.181 1.473 1.00 0.00 C ATOM 311 CD1 LEU A 21 8.760 1.419 1.924 1.00 0.00 C ATOM 312 CD2 LEU A 21 6.277 1.309 1.692 1.00 0.00 C ATOM 0 H LEU A 21 5.979 3.804 5.057 1.00 0.00 H new ATOM 0 HA LEU A 21 7.132 2.154 3.980 1.00 0.00 H new ATOM 0 HB2 LEU A 21 6.406 3.924 2.112 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.133 4.190 1.976 1.00 0.00 H new ATOM 0 HG LEU A 21 7.603 2.429 0.415 1.00 0.00 H new ATOM 0 HD11 LEU A 21 8.856 0.502 1.343 1.00 0.00 H new ATOM 0 HD12 LEU A 21 9.642 2.040 1.770 1.00 0.00 H new ATOM 0 HD13 LEU A 21 8.672 1.170 2.982 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.371 0.392 1.111 1.00 0.00 H new ATOM 0 HD22 LEU A 21 6.189 1.061 2.750 1.00 0.00 H new ATOM 0 HD23 LEU A 21 5.388 1.852 1.372 1.00 0.00 H new ATOM 324 N PRO A 22 9.417 2.178 4.919 1.00 0.00 N ATOM 325 CA PRO A 22 10.839 2.089 5.310 1.00 0.00 C ATOM 326 C PRO A 22 11.659 1.523 4.145 1.00 0.00 C ATOM 327 O PRO A 22 11.224 0.629 3.449 1.00 0.00 O ATOM 328 CB PRO A 22 10.848 1.126 6.498 1.00 0.00 C ATOM 329 CG PRO A 22 9.569 0.277 6.374 1.00 0.00 C ATOM 330 CD PRO A 22 8.610 1.060 5.462 1.00 0.00 C ATOM 0 HA PRO A 22 11.273 3.056 5.565 1.00 0.00 H new ATOM 0 HB2 PRO A 22 11.737 0.495 6.481 1.00 0.00 H new ATOM 0 HB3 PRO A 22 10.863 1.672 7.441 1.00 0.00 H new ATOM 0 HG2 PRO A 22 9.793 -0.702 5.951 1.00 0.00 H new ATOM 0 HG3 PRO A 22 9.121 0.106 7.353 1.00 0.00 H new ATOM 0 HD2 PRO A 22 8.224 0.428 4.662 1.00 0.00 H new ATOM 0 HD3 PRO A 22 7.750 1.430 6.020 1.00 0.00 H new ATOM 338 N ARG A 23 12.837 2.038 3.924 1.00 0.00 N ATOM 339 CA ARG A 23 13.669 1.523 2.796 1.00 0.00 C ATOM 340 C ARG A 23 14.522 0.353 3.287 1.00 0.00 C ATOM 341 O ARG A 23 15.684 0.236 2.952 1.00 0.00 O ATOM 342 CB ARG A 23 14.593 2.625 2.246 1.00 0.00 C ATOM 343 CG ARG A 23 14.233 3.988 2.848 1.00 0.00 C ATOM 344 CD ARG A 23 15.032 4.199 4.134 1.00 0.00 C ATOM 345 NE ARG A 23 14.227 5.004 5.096 1.00 0.00 N ATOM 346 CZ ARG A 23 14.036 4.570 6.310 1.00 0.00 C ATOM 347 NH1 ARG A 23 15.056 4.228 7.049 1.00 0.00 N ATOM 348 NH2 ARG A 23 12.825 4.475 6.787 1.00 0.00 N ATOM 0 H ARG A 23 13.259 2.789 4.471 1.00 0.00 H new ATOM 0 HA ARG A 23 13.003 1.195 1.998 1.00 0.00 H new ATOM 0 HB2 ARG A 23 15.631 2.384 2.476 1.00 0.00 H new ATOM 0 HB3 ARG A 23 14.509 2.668 1.160 1.00 0.00 H new ATOM 0 HG2 ARG A 23 14.453 4.783 2.135 1.00 0.00 H new ATOM 0 HG3 ARG A 23 13.164 4.035 3.058 1.00 0.00 H new ATOM 0 HD2 ARG A 23 15.290 3.237 4.576 1.00 0.00 H new ATOM 0 HD3 ARG A 23 15.969 4.709 3.912 1.00 0.00 H new ATOM 0 HE ARG A 23 13.825 5.895 4.804 1.00 0.00 H new ATOM 0 HH11 ARG A 23 16.003 4.300 6.676 1.00 0.00 H new ATOM 0 HH12 ARG A 23 14.906 3.888 7.999 1.00 0.00 H new ATOM 0 HH21 ARG A 23 12.027 4.740 6.210 1.00 0.00 H new ATOM 0 HH22 ARG A 23 12.676 4.135 7.737 1.00 0.00 H new ATOM 362 N THR A 24 13.955 -0.518 4.076 1.00 0.00 N ATOM 363 CA THR A 24 14.737 -1.681 4.582 1.00 0.00 C ATOM 364 C THR A 24 14.389 -2.925 3.760 1.00 0.00 C ATOM 365 O THR A 24 14.951 -3.986 3.955 1.00 0.00 O ATOM 366 CB THR A 24 14.394 -1.925 6.053 1.00 0.00 C ATOM 367 OG1 THR A 24 13.204 -1.222 6.383 1.00 0.00 O ATOM 368 CG2 THR A 24 15.541 -1.431 6.937 1.00 0.00 C ATOM 0 H THR A 24 12.986 -0.475 4.392 1.00 0.00 H new ATOM 0 HA THR A 24 15.803 -1.472 4.489 1.00 0.00 H new ATOM 0 HB THR A 24 14.245 -2.992 6.218 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.901 -1.493 7.275 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.294 -1.606 7.984 1.00 0.00 H new ATOM 0 HG22 THR A 24 16.454 -1.971 6.684 1.00 0.00 H new ATOM 0 HG23 THR A 24 15.693 -0.364 6.773 1.00 0.00 H new ATOM 376 N ILE A 25 13.468 -2.806 2.841 1.00 0.00 N ATOM 377 CA ILE A 25 13.088 -3.983 2.007 1.00 0.00 C ATOM 378 C ILE A 25 12.802 -3.524 0.573 1.00 0.00 C ATOM 379 O ILE A 25 12.896 -2.357 0.255 1.00 0.00 O ATOM 380 CB ILE A 25 11.835 -4.662 2.583 1.00 0.00 C ATOM 381 CG1 ILE A 25 11.130 -3.723 3.570 1.00 0.00 C ATOM 382 CG2 ILE A 25 12.242 -5.946 3.309 1.00 0.00 C ATOM 383 CD1 ILE A 25 9.841 -4.379 4.069 1.00 0.00 C ATOM 0 H ILE A 25 12.963 -1.945 2.632 1.00 0.00 H new ATOM 0 HA ILE A 25 13.912 -4.696 2.009 1.00 0.00 H new ATOM 0 HB ILE A 25 11.152 -4.898 1.767 1.00 0.00 H new ATOM 0 HG12 ILE A 25 11.787 -3.503 4.411 1.00 0.00 H new ATOM 0 HG13 ILE A 25 10.903 -2.773 3.086 1.00 0.00 H new ATOM 0 HG21 ILE A 25 11.355 -6.429 3.718 1.00 0.00 H new ATOM 0 HG22 ILE A 25 12.732 -6.621 2.607 1.00 0.00 H new ATOM 0 HG23 ILE A 25 12.930 -5.704 4.119 1.00 0.00 H new ATOM 0 HD11 ILE A 25 9.341 -3.711 4.770 1.00 0.00 H new ATOM 0 HD12 ILE A 25 9.182 -4.577 3.223 1.00 0.00 H new ATOM 0 HD13 ILE A 25 10.080 -5.317 4.569 1.00 0.00 H new ATOM 395 N THR A 26 12.460 -4.438 -0.296 1.00 0.00 N ATOM 396 CA THR A 26 12.175 -4.057 -1.710 1.00 0.00 C ATOM 397 C THR A 26 10.670 -4.126 -1.972 1.00 0.00 C ATOM 398 O THR A 26 9.948 -4.847 -1.311 1.00 0.00 O ATOM 399 CB THR A 26 12.886 -5.029 -2.656 1.00 0.00 C ATOM 400 OG1 THR A 26 12.160 -6.251 -2.703 1.00 0.00 O ATOM 401 CG2 THR A 26 14.308 -5.296 -2.158 1.00 0.00 C ATOM 0 H THR A 26 12.366 -5.432 -0.088 1.00 0.00 H new ATOM 0 HA THR A 26 12.532 -3.042 -1.882 1.00 0.00 H new ATOM 0 HB THR A 26 12.936 -4.592 -3.653 1.00 0.00 H new ATOM 0 HG1 THR A 26 12.533 -6.878 -2.049 1.00 0.00 H new ATOM 0 HG21 THR A 26 14.807 -5.988 -2.836 1.00 0.00 H new ATOM 0 HG22 THR A 26 14.863 -4.359 -2.123 1.00 0.00 H new ATOM 0 HG23 THR A 26 14.268 -5.732 -1.160 1.00 0.00 H new ATOM 409 N ASP A 27 10.194 -3.396 -2.944 1.00 0.00 N ATOM 410 CA ASP A 27 8.740 -3.439 -3.259 1.00 0.00 C ATOM 411 C ASP A 27 8.376 -4.861 -3.683 1.00 0.00 C ATOM 412 O ASP A 27 7.370 -5.407 -3.273 1.00 0.00 O ATOM 413 CB ASP A 27 8.432 -2.465 -4.401 1.00 0.00 C ATOM 414 CG ASP A 27 9.230 -2.863 -5.644 1.00 0.00 C ATOM 415 OD1 ASP A 27 8.853 -3.832 -6.283 1.00 0.00 O ATOM 416 OD2 ASP A 27 10.206 -2.191 -5.936 1.00 0.00 O ATOM 0 H ASP A 27 10.749 -2.774 -3.532 1.00 0.00 H new ATOM 0 HA ASP A 27 8.159 -3.151 -2.383 1.00 0.00 H new ATOM 0 HB2 ASP A 27 7.365 -2.475 -4.623 1.00 0.00 H new ATOM 0 HB3 ASP A 27 8.686 -1.448 -4.103 1.00 0.00 H new ATOM 421 N ASP A 28 9.202 -5.473 -4.490 1.00 0.00 N ATOM 422 CA ASP A 28 8.923 -6.868 -4.933 1.00 0.00 C ATOM 423 C ASP A 28 8.706 -7.746 -3.702 1.00 0.00 C ATOM 424 O ASP A 28 8.018 -8.743 -3.752 1.00 0.00 O ATOM 425 CB ASP A 28 10.113 -7.395 -5.736 1.00 0.00 C ATOM 426 CG ASP A 28 10.186 -6.665 -7.078 1.00 0.00 C ATOM 427 OD1 ASP A 28 10.573 -5.507 -7.079 1.00 0.00 O ATOM 428 OD2 ASP A 28 9.852 -7.273 -8.080 1.00 0.00 O ATOM 0 H ASP A 28 10.060 -5.065 -4.862 1.00 0.00 H new ATOM 0 HA ASP A 28 8.031 -6.886 -5.559 1.00 0.00 H new ATOM 0 HB2 ASP A 28 11.037 -7.245 -5.178 1.00 0.00 H new ATOM 0 HB3 ASP A 28 10.009 -8.468 -5.899 1.00 0.00 H new ATOM 433 N GLN A 29 9.291 -7.382 -2.594 1.00 0.00 N ATOM 434 CA GLN A 29 9.115 -8.197 -1.361 1.00 0.00 C ATOM 435 C GLN A 29 7.785 -7.836 -0.697 1.00 0.00 C ATOM 436 O GLN A 29 7.134 -8.672 -0.108 1.00 0.00 O ATOM 437 CB GLN A 29 10.265 -7.916 -0.389 1.00 0.00 C ATOM 438 CG GLN A 29 11.252 -9.086 -0.410 1.00 0.00 C ATOM 439 CD GLN A 29 12.683 -8.545 -0.445 1.00 0.00 C ATOM 440 OE1 GLN A 29 12.905 -7.410 -0.816 1.00 0.00 O ATOM 441 NE2 GLN A 29 13.669 -9.314 -0.070 1.00 0.00 N ATOM 0 H GLN A 29 9.882 -6.557 -2.490 1.00 0.00 H new ATOM 0 HA GLN A 29 9.115 -9.255 -1.624 1.00 0.00 H new ATOM 0 HB2 GLN A 29 10.773 -6.993 -0.668 1.00 0.00 H new ATOM 0 HB3 GLN A 29 9.876 -7.773 0.619 1.00 0.00 H new ATOM 0 HG2 GLN A 29 11.110 -9.712 0.471 1.00 0.00 H new ATOM 0 HG3 GLN A 29 11.068 -9.715 -1.281 1.00 0.00 H new ATOM 0 HE21 GLN A 29 13.482 -10.267 0.242 1.00 0.00 H new ATOM 0 HE22 GLN A 29 14.626 -8.962 -0.089 1.00 0.00 H new ATOM 450 N LEU A 30 7.374 -6.600 -0.789 1.00 0.00 N ATOM 451 CA LEU A 30 6.082 -6.204 -0.158 1.00 0.00 C ATOM 452 C LEU A 30 4.976 -7.148 -0.628 1.00 0.00 C ATOM 453 O LEU A 30 4.060 -7.458 0.107 1.00 0.00 O ATOM 454 CB LEU A 30 5.730 -4.769 -0.550 1.00 0.00 C ATOM 455 CG LEU A 30 5.692 -3.895 0.705 1.00 0.00 C ATOM 456 CD1 LEU A 30 7.116 -3.679 1.214 1.00 0.00 C ATOM 457 CD2 LEU A 30 5.062 -2.543 0.361 1.00 0.00 C ATOM 0 H LEU A 30 7.873 -5.852 -1.270 1.00 0.00 H new ATOM 0 HA LEU A 30 6.178 -6.265 0.926 1.00 0.00 H new ATOM 0 HB2 LEU A 30 6.466 -4.382 -1.254 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.763 -4.744 -1.053 1.00 0.00 H new ATOM 0 HG LEU A 30 5.100 -4.387 1.477 1.00 0.00 H new ATOM 0 HD11 LEU A 30 7.092 -3.056 2.108 1.00 0.00 H new ATOM 0 HD12 LEU A 30 7.567 -4.642 1.454 1.00 0.00 H new ATOM 0 HD13 LEU A 30 7.707 -3.184 0.443 1.00 0.00 H new ATOM 0 HD21 LEU A 30 5.033 -1.917 1.253 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.656 -2.050 -0.409 1.00 0.00 H new ATOM 0 HD23 LEU A 30 4.048 -2.697 -0.007 1.00 0.00 H new ATOM 469 N ASP A 31 5.052 -7.618 -1.846 1.00 0.00 N ATOM 470 CA ASP A 31 3.999 -8.548 -2.337 1.00 0.00 C ATOM 471 C ASP A 31 3.990 -9.786 -1.438 1.00 0.00 C ATOM 472 O ASP A 31 2.954 -10.241 -0.994 1.00 0.00 O ATOM 473 CB ASP A 31 4.281 -8.935 -3.803 1.00 0.00 C ATOM 474 CG ASP A 31 5.169 -10.184 -3.883 1.00 0.00 C ATOM 475 OD1 ASP A 31 4.743 -11.224 -3.410 1.00 0.00 O ATOM 476 OD2 ASP A 31 6.255 -10.080 -4.426 1.00 0.00 O ATOM 0 H ASP A 31 5.791 -7.399 -2.514 1.00 0.00 H new ATOM 0 HA ASP A 31 3.022 -8.067 -2.300 1.00 0.00 H new ATOM 0 HB2 ASP A 31 3.340 -9.120 -4.321 1.00 0.00 H new ATOM 0 HB3 ASP A 31 4.768 -8.105 -4.314 1.00 0.00 H new ATOM 481 N THR A 32 5.146 -10.320 -1.152 1.00 0.00 N ATOM 482 CA THR A 32 5.219 -11.514 -0.266 1.00 0.00 C ATOM 483 C THR A 32 4.644 -11.139 1.101 1.00 0.00 C ATOM 484 O THR A 32 3.880 -11.875 1.693 1.00 0.00 O ATOM 485 CB THR A 32 6.682 -11.941 -0.117 1.00 0.00 C ATOM 486 OG1 THR A 32 7.315 -11.902 -1.388 1.00 0.00 O ATOM 487 CG2 THR A 32 6.749 -13.362 0.445 1.00 0.00 C ATOM 0 H THR A 32 6.044 -9.979 -1.495 1.00 0.00 H new ATOM 0 HA THR A 32 4.649 -12.340 -0.691 1.00 0.00 H new ATOM 0 HB THR A 32 7.191 -11.261 0.566 1.00 0.00 H new ATOM 0 HG1 THR A 32 8.252 -12.173 -1.295 1.00 0.00 H new ATOM 0 HG21 THR A 32 7.791 -13.663 0.550 1.00 0.00 H new ATOM 0 HG22 THR A 32 6.263 -13.391 1.420 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.240 -14.046 -0.234 1.00 0.00 H new ATOM 495 N ILE A 33 4.997 -9.981 1.592 1.00 0.00 N ATOM 496 CA ILE A 33 4.468 -9.527 2.906 1.00 0.00 C ATOM 497 C ILE A 33 2.943 -9.626 2.876 1.00 0.00 C ATOM 498 O ILE A 33 2.297 -9.846 3.881 1.00 0.00 O ATOM 499 CB ILE A 33 4.899 -8.067 3.131 1.00 0.00 C ATOM 500 CG1 ILE A 33 6.299 -8.044 3.749 1.00 0.00 C ATOM 501 CG2 ILE A 33 3.918 -7.349 4.067 1.00 0.00 C ATOM 502 CD1 ILE A 33 6.223 -8.507 5.205 1.00 0.00 C ATOM 0 H ILE A 33 5.633 -9.328 1.135 1.00 0.00 H new ATOM 0 HA ILE A 33 4.855 -10.146 3.715 1.00 0.00 H new ATOM 0 HB ILE A 33 4.904 -7.551 2.171 1.00 0.00 H new ATOM 0 HG12 ILE A 33 6.968 -8.694 3.184 1.00 0.00 H new ATOM 0 HG13 ILE A 33 6.714 -7.037 3.698 1.00 0.00 H new ATOM 0 HG21 ILE A 33 4.242 -6.318 4.212 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.921 -7.357 3.625 1.00 0.00 H new ATOM 0 HG23 ILE A 33 3.893 -7.860 5.029 1.00 0.00 H new ATOM 0 HD11 ILE A 33 7.220 -8.490 5.645 1.00 0.00 H new ATOM 0 HD12 ILE A 33 5.568 -7.840 5.765 1.00 0.00 H new ATOM 0 HD13 ILE A 33 5.826 -9.521 5.244 1.00 0.00 H new ATOM 514 N PHE A 34 2.368 -9.452 1.719 1.00 0.00 N ATOM 515 CA PHE A 34 0.889 -9.519 1.596 1.00 0.00 C ATOM 516 C PHE A 34 0.434 -10.982 1.568 1.00 0.00 C ATOM 517 O PHE A 34 -0.051 -11.507 2.551 1.00 0.00 O ATOM 518 CB PHE A 34 0.474 -8.805 0.307 1.00 0.00 C ATOM 519 CG PHE A 34 1.191 -7.475 0.222 1.00 0.00 C ATOM 520 CD1 PHE A 34 1.618 -6.831 1.391 1.00 0.00 C ATOM 521 CD2 PHE A 34 1.431 -6.886 -1.026 1.00 0.00 C ATOM 522 CE1 PHE A 34 2.284 -5.601 1.312 1.00 0.00 C ATOM 523 CE2 PHE A 34 2.101 -5.659 -1.104 1.00 0.00 C ATOM 524 CZ PHE A 34 2.528 -5.017 0.063 1.00 0.00 C ATOM 0 H PHE A 34 2.865 -9.265 0.848 1.00 0.00 H new ATOM 0 HA PHE A 34 0.419 -9.032 2.450 1.00 0.00 H new ATOM 0 HB2 PHE A 34 0.719 -9.420 -0.559 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -0.605 -8.652 0.293 1.00 0.00 H new ATOM 0 HD1 PHE A 34 1.433 -7.283 2.354 1.00 0.00 H new ATOM 0 HD2 PHE A 34 1.099 -7.378 -1.928 1.00 0.00 H new ATOM 0 HE1 PHE A 34 2.609 -5.104 2.214 1.00 0.00 H new ATOM 0 HE2 PHE A 34 2.288 -5.207 -2.067 1.00 0.00 H new ATOM 0 HZ PHE A 34 3.046 -4.071 0.001 1.00 0.00 H new ATOM 534 N GLY A 35 0.579 -11.652 0.460 1.00 0.00 N ATOM 535 CA GLY A 35 0.145 -13.075 0.400 1.00 0.00 C ATOM 536 C GLY A 35 -0.498 -13.357 -0.956 1.00 0.00 C ATOM 537 O GLY A 35 0.136 -13.869 -1.857 1.00 0.00 O ATOM 0 H GLY A 35 0.977 -11.279 -0.402 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.000 -13.733 0.552 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.564 -13.284 1.201 1.00 0.00 H new ATOM 541 N LYS A 36 -1.753 -13.028 -1.114 1.00 0.00 N ATOM 542 CA LYS A 36 -2.420 -13.286 -2.419 1.00 0.00 C ATOM 543 C LYS A 36 -3.941 -13.152 -2.281 1.00 0.00 C ATOM 544 O LYS A 36 -4.675 -14.091 -2.513 1.00 0.00 O ATOM 545 CB LYS A 36 -2.078 -14.699 -2.886 1.00 0.00 C ATOM 546 CG LYS A 36 -1.230 -14.622 -4.154 1.00 0.00 C ATOM 547 CD LYS A 36 -2.085 -14.093 -5.307 1.00 0.00 C ATOM 548 CE LYS A 36 -2.291 -15.202 -6.340 1.00 0.00 C ATOM 549 NZ LYS A 36 -2.247 -14.618 -7.711 1.00 0.00 N ATOM 0 H LYS A 36 -2.339 -12.595 -0.400 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.068 -12.555 -3.147 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.536 -15.231 -2.104 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.992 -15.261 -3.080 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -0.373 -13.968 -3.992 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -0.836 -15.608 -4.402 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -3.048 -13.748 -4.931 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -1.598 -13.235 -5.771 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.518 -15.963 -6.232 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.249 -15.695 -6.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.387 -15.372 -8.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.000 -13.908 -7.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.323 -14.167 -7.867 1.00 0.00 H new ATOM 563 N TYR A 37 -4.422 -11.993 -1.917 1.00 0.00 N ATOM 564 CA TYR A 37 -5.902 -11.813 -1.780 1.00 0.00 C ATOM 565 C TYR A 37 -6.520 -11.626 -3.166 1.00 0.00 C ATOM 566 O TYR A 37 -7.212 -12.488 -3.670 1.00 0.00 O ATOM 567 CB TYR A 37 -6.184 -10.577 -0.921 1.00 0.00 C ATOM 568 CG TYR A 37 -5.122 -10.481 0.137 1.00 0.00 C ATOM 569 CD1 TYR A 37 -5.137 -11.361 1.225 1.00 0.00 C ATOM 570 CD2 TYR A 37 -4.110 -9.529 0.017 1.00 0.00 C ATOM 571 CE1 TYR A 37 -4.134 -11.285 2.194 1.00 0.00 C ATOM 572 CE2 TYR A 37 -3.111 -9.450 0.987 1.00 0.00 C ATOM 573 CZ TYR A 37 -3.122 -10.328 2.074 1.00 0.00 C ATOM 574 OH TYR A 37 -2.128 -10.248 3.017 1.00 0.00 O ATOM 0 H TYR A 37 -3.861 -11.167 -1.709 1.00 0.00 H new ATOM 0 HA TYR A 37 -6.337 -12.692 -1.305 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -6.186 -9.679 -1.538 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -7.170 -10.651 -0.463 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -5.922 -12.097 1.315 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -4.100 -8.854 -0.826 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -4.140 -11.964 3.034 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -2.329 -8.710 0.898 1.00 0.00 H new ATOM 0 HH TYR A 37 -1.567 -11.050 2.970 1.00 0.00 H new ATOM 584 N GLY A 38 -6.268 -10.513 -3.787 1.00 0.00 N ATOM 585 CA GLY A 38 -6.831 -10.269 -5.147 1.00 0.00 C ATOM 586 C GLY A 38 -5.683 -10.156 -6.144 1.00 0.00 C ATOM 587 O GLY A 38 -4.545 -10.438 -5.825 1.00 0.00 O ATOM 0 H GLY A 38 -5.695 -9.756 -3.414 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -7.498 -11.083 -5.431 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -7.425 -9.355 -5.151 1.00 0.00 H new ATOM 591 N SER A 39 -5.964 -9.734 -7.346 1.00 0.00 N ATOM 592 CA SER A 39 -4.876 -9.592 -8.353 1.00 0.00 C ATOM 593 C SER A 39 -4.126 -8.292 -8.070 1.00 0.00 C ATOM 594 O SER A 39 -4.322 -7.296 -8.739 1.00 0.00 O ATOM 595 CB SER A 39 -5.476 -9.537 -9.761 1.00 0.00 C ATOM 596 OG SER A 39 -6.051 -8.255 -9.977 1.00 0.00 O ATOM 0 H SER A 39 -6.897 -9.482 -7.673 1.00 0.00 H new ATOM 0 HA SER A 39 -4.198 -10.443 -8.291 1.00 0.00 H new ATOM 0 HB2 SER A 39 -4.704 -9.732 -10.506 1.00 0.00 H new ATOM 0 HB3 SER A 39 -6.234 -10.312 -9.876 1.00 0.00 H new ATOM 0 HG SER A 39 -5.345 -7.575 -9.971 1.00 0.00 H new ATOM 602 N ILE A 40 -3.279 -8.295 -7.071 1.00 0.00 N ATOM 603 CA ILE A 40 -2.518 -7.055 -6.726 1.00 0.00 C ATOM 604 C ILE A 40 -2.079 -6.375 -8.030 1.00 0.00 C ATOM 605 O ILE A 40 -1.855 -7.020 -9.034 1.00 0.00 O ATOM 606 CB ILE A 40 -1.302 -7.382 -5.843 1.00 0.00 C ATOM 607 CG1 ILE A 40 -1.505 -8.725 -5.128 1.00 0.00 C ATOM 608 CG2 ILE A 40 -1.154 -6.277 -4.799 1.00 0.00 C ATOM 609 CD1 ILE A 40 -0.505 -8.862 -3.976 1.00 0.00 C ATOM 0 H ILE A 40 -3.082 -9.102 -6.480 1.00 0.00 H new ATOM 0 HA ILE A 40 -3.157 -6.381 -6.156 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.409 -7.448 -6.465 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -2.524 -8.793 -4.746 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -1.374 -9.545 -5.834 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.296 -6.491 -4.162 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -1.005 -5.321 -5.300 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.056 -6.230 -4.189 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -0.656 -9.818 -3.474 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.511 -8.815 -4.368 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -0.657 -8.051 -3.264 1.00 0.00 H new ATOM 621 N VAL A 41 -2.026 -5.070 -8.039 1.00 0.00 N ATOM 622 CA VAL A 41 -1.687 -4.338 -9.304 1.00 0.00 C ATOM 623 C VAL A 41 -0.318 -3.619 -9.321 1.00 0.00 C ATOM 624 O VAL A 41 -0.240 -2.421 -9.507 1.00 0.00 O ATOM 625 CB VAL A 41 -2.775 -3.332 -9.526 1.00 0.00 C ATOM 626 CG1 VAL A 41 -4.033 -4.122 -9.793 1.00 0.00 C ATOM 627 CG2 VAL A 41 -2.958 -2.468 -8.275 1.00 0.00 C ATOM 0 H VAL A 41 -2.202 -4.476 -7.229 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.610 -5.086 -10.093 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.536 -2.668 -10.356 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.864 -3.437 -9.963 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -3.891 -4.746 -10.676 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.255 -4.755 -8.934 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.751 -1.741 -8.448 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -3.226 -3.103 -7.430 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.028 -1.945 -8.055 1.00 0.00 H new ATOM 637 N GLN A 42 0.747 -4.349 -9.196 1.00 0.00 N ATOM 638 CA GLN A 42 2.130 -3.755 -9.271 1.00 0.00 C ATOM 639 C GLN A 42 2.402 -2.738 -8.154 1.00 0.00 C ATOM 640 O GLN A 42 1.891 -1.635 -8.166 1.00 0.00 O ATOM 641 CB GLN A 42 2.300 -3.063 -10.624 1.00 0.00 C ATOM 642 CG GLN A 42 3.787 -2.823 -10.888 1.00 0.00 C ATOM 643 CD GLN A 42 3.963 -2.135 -12.243 1.00 0.00 C ATOM 644 OE1 GLN A 42 3.103 -1.398 -12.682 1.00 0.00 O ATOM 645 NE2 GLN A 42 5.052 -2.349 -12.930 1.00 0.00 N ATOM 0 H GLN A 42 0.730 -5.357 -9.041 1.00 0.00 H new ATOM 0 HA GLN A 42 2.842 -4.571 -9.150 1.00 0.00 H new ATOM 0 HB2 GLN A 42 1.873 -3.679 -11.416 1.00 0.00 H new ATOM 0 HB3 GLN A 42 1.761 -2.116 -10.631 1.00 0.00 H new ATOM 0 HG2 GLN A 42 4.212 -2.205 -10.097 1.00 0.00 H new ATOM 0 HG3 GLN A 42 4.326 -3.770 -10.877 1.00 0.00 H new ATOM 0 HE21 GLN A 42 5.774 -2.968 -12.561 1.00 0.00 H new ATOM 0 HE22 GLN A 42 5.181 -1.897 -13.835 1.00 0.00 H new ATOM 654 N LYS A 43 3.241 -3.091 -7.211 1.00 0.00 N ATOM 655 CA LYS A 43 3.573 -2.138 -6.105 1.00 0.00 C ATOM 656 C LYS A 43 4.529 -1.060 -6.628 1.00 0.00 C ATOM 657 O LYS A 43 5.148 -1.216 -7.662 1.00 0.00 O ATOM 658 CB LYS A 43 4.267 -2.874 -4.946 1.00 0.00 C ATOM 659 CG LYS A 43 3.660 -4.268 -4.730 1.00 0.00 C ATOM 660 CD LYS A 43 4.775 -5.245 -4.353 1.00 0.00 C ATOM 661 CE LYS A 43 5.695 -5.435 -5.557 1.00 0.00 C ATOM 662 NZ LYS A 43 5.131 -6.480 -6.457 1.00 0.00 N ATOM 0 H LYS A 43 3.710 -3.995 -7.159 1.00 0.00 H new ATOM 0 HA LYS A 43 2.645 -1.690 -5.750 1.00 0.00 H new ATOM 0 HB2 LYS A 43 5.332 -2.967 -5.157 1.00 0.00 H new ATOM 0 HB3 LYS A 43 4.173 -2.288 -4.032 1.00 0.00 H new ATOM 0 HG2 LYS A 43 2.908 -4.233 -3.942 1.00 0.00 H new ATOM 0 HG3 LYS A 43 3.156 -4.604 -5.636 1.00 0.00 H new ATOM 0 HD2 LYS A 43 5.340 -4.862 -3.503 1.00 0.00 H new ATOM 0 HD3 LYS A 43 4.351 -6.202 -4.048 1.00 0.00 H new ATOM 0 HE2 LYS A 43 5.802 -4.495 -6.097 1.00 0.00 H new ATOM 0 HE3 LYS A 43 6.691 -5.727 -5.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 5.888 -7.129 -6.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.395 -7.013 -5.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 4.716 -6.028 -7.297 1.00 0.00 H new ATOM 676 N ASN A 44 4.662 0.029 -5.916 1.00 0.00 N ATOM 677 CA ASN A 44 5.586 1.109 -6.371 1.00 0.00 C ATOM 678 C ASN A 44 6.158 1.843 -5.153 1.00 0.00 C ATOM 679 O ASN A 44 5.477 2.612 -4.506 1.00 0.00 O ATOM 680 CB ASN A 44 4.823 2.098 -7.253 1.00 0.00 C ATOM 681 CG ASN A 44 5.378 2.046 -8.677 1.00 0.00 C ATOM 682 OD1 ASN A 44 6.512 2.413 -8.913 1.00 0.00 O ATOM 683 ND2 ASN A 44 4.622 1.602 -9.645 1.00 0.00 N ATOM 0 H ASN A 44 4.172 0.216 -5.041 1.00 0.00 H new ATOM 0 HA ASN A 44 6.402 0.669 -6.944 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.761 1.854 -7.256 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.917 3.107 -6.851 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.984 1.564 -10.598 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.670 1.294 -9.448 1.00 0.00 H new ATOM 690 N ILE A 45 7.407 1.611 -4.836 1.00 0.00 N ATOM 691 CA ILE A 45 8.019 2.297 -3.659 1.00 0.00 C ATOM 692 C ILE A 45 8.594 3.649 -4.091 1.00 0.00 C ATOM 693 O ILE A 45 9.159 3.782 -5.159 1.00 0.00 O ATOM 694 CB ILE A 45 9.142 1.428 -3.078 1.00 0.00 C ATOM 695 CG1 ILE A 45 9.515 1.950 -1.687 1.00 0.00 C ATOM 696 CG2 ILE A 45 10.373 1.491 -3.987 1.00 0.00 C ATOM 697 CD1 ILE A 45 10.604 1.064 -1.079 1.00 0.00 C ATOM 0 H ILE A 45 8.027 0.978 -5.340 1.00 0.00 H new ATOM 0 HA ILE A 45 7.253 2.454 -2.900 1.00 0.00 H new ATOM 0 HB ILE A 45 8.799 0.396 -3.008 1.00 0.00 H new ATOM 0 HG12 ILE A 45 9.867 2.979 -1.757 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.636 1.956 -1.043 1.00 0.00 H new ATOM 0 HG21 ILE A 45 11.166 0.872 -3.568 1.00 0.00 H new ATOM 0 HG22 ILE A 45 10.112 1.124 -4.979 1.00 0.00 H new ATOM 0 HG23 ILE A 45 10.718 2.522 -4.061 1.00 0.00 H new ATOM 0 HD11 ILE A 45 10.867 1.438 -0.090 1.00 0.00 H new ATOM 0 HD12 ILE A 45 10.236 0.041 -0.994 1.00 0.00 H new ATOM 0 HD13 ILE A 45 11.486 1.080 -1.719 1.00 0.00 H new ATOM 709 N LEU A 46 8.454 4.653 -3.268 1.00 0.00 N ATOM 710 CA LEU A 46 8.992 5.995 -3.632 1.00 0.00 C ATOM 711 C LEU A 46 10.026 6.433 -2.590 1.00 0.00 C ATOM 712 O LEU A 46 9.694 6.731 -1.458 1.00 0.00 O ATOM 713 CB LEU A 46 7.849 7.012 -3.678 1.00 0.00 C ATOM 714 CG LEU A 46 7.280 7.077 -5.095 1.00 0.00 C ATOM 715 CD1 LEU A 46 5.943 6.334 -5.142 1.00 0.00 C ATOM 716 CD2 LEU A 46 7.064 8.540 -5.489 1.00 0.00 C ATOM 0 H LEU A 46 7.991 4.602 -2.361 1.00 0.00 H new ATOM 0 HA LEU A 46 9.466 5.940 -4.612 1.00 0.00 H new ATOM 0 HB2 LEU A 46 7.067 6.728 -2.974 1.00 0.00 H new ATOM 0 HB3 LEU A 46 8.210 7.995 -3.374 1.00 0.00 H new ATOM 0 HG LEU A 46 7.979 6.612 -5.790 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.537 6.380 -6.152 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.095 5.292 -4.859 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.243 6.800 -4.448 1.00 0.00 H new ATOM 0 HD21 LEU A 46 6.658 8.589 -6.499 1.00 0.00 H new ATOM 0 HD22 LEU A 46 6.364 9.004 -4.794 1.00 0.00 H new ATOM 0 HD23 LEU A 46 8.016 9.070 -5.454 1.00 0.00 H new ATOM 728 N ARG A 47 11.276 6.476 -2.967 1.00 0.00 N ATOM 729 CA ARG A 47 12.335 6.894 -2.005 1.00 0.00 C ATOM 730 C ARG A 47 13.553 7.407 -2.778 1.00 0.00 C ATOM 731 O ARG A 47 14.665 7.386 -2.289 1.00 0.00 O ATOM 732 CB ARG A 47 12.745 5.696 -1.148 1.00 0.00 C ATOM 733 CG ARG A 47 13.116 4.525 -2.058 1.00 0.00 C ATOM 734 CD ARG A 47 13.301 3.262 -1.216 1.00 0.00 C ATOM 735 NE ARG A 47 14.745 2.902 -1.173 1.00 0.00 N ATOM 736 CZ ARG A 47 15.105 1.687 -0.869 1.00 0.00 C ATOM 737 NH1 ARG A 47 14.498 0.671 -1.417 1.00 0.00 N ATOM 738 NH2 ARG A 47 16.071 1.488 -0.015 1.00 0.00 N ATOM 0 H ARG A 47 11.609 6.239 -3.901 1.00 0.00 H new ATOM 0 HA ARG A 47 11.951 7.687 -1.363 1.00 0.00 H new ATOM 0 HB2 ARG A 47 13.591 5.961 -0.514 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.927 5.412 -0.486 1.00 0.00 H new ATOM 0 HG2 ARG A 47 12.335 4.367 -2.802 1.00 0.00 H new ATOM 0 HG3 ARG A 47 14.034 4.750 -2.602 1.00 0.00 H new ATOM 0 HD2 ARG A 47 12.926 3.427 -0.206 1.00 0.00 H new ATOM 0 HD3 ARG A 47 12.723 2.441 -1.640 1.00 0.00 H new ATOM 0 HE ARG A 47 15.453 3.606 -1.382 1.00 0.00 H new ATOM 0 HH11 ARG A 47 13.742 0.828 -2.083 1.00 0.00 H new ATOM 0 HH12 ARG A 47 14.780 -0.280 -1.179 1.00 0.00 H new ATOM 0 HH21 ARG A 47 16.544 2.283 0.414 1.00 0.00 H new ATOM 0 HH22 ARG A 47 16.353 0.537 0.223 1.00 0.00 H new ATOM 752 N ASP A 48 13.352 7.867 -3.984 1.00 0.00 N ATOM 753 CA ASP A 48 14.497 8.380 -4.789 1.00 0.00 C ATOM 754 C ASP A 48 15.549 7.279 -4.944 1.00 0.00 C ATOM 755 O ASP A 48 15.533 6.287 -4.243 1.00 0.00 O ATOM 756 CB ASP A 48 15.118 9.586 -4.080 1.00 0.00 C ATOM 757 CG ASP A 48 16.133 10.256 -5.008 1.00 0.00 C ATOM 758 OD1 ASP A 48 15.805 10.460 -6.164 1.00 0.00 O ATOM 759 OD2 ASP A 48 17.222 10.553 -4.544 1.00 0.00 O ATOM 0 H ASP A 48 12.444 7.909 -4.446 1.00 0.00 H new ATOM 0 HA ASP A 48 14.142 8.681 -5.775 1.00 0.00 H new ATOM 0 HB2 ASP A 48 14.341 10.297 -3.800 1.00 0.00 H new ATOM 0 HB3 ASP A 48 15.606 9.268 -3.159 1.00 0.00 H new ATOM 764 N LYS A 49 16.465 7.445 -5.861 1.00 0.00 N ATOM 765 CA LYS A 49 17.516 6.408 -6.062 1.00 0.00 C ATOM 766 C LYS A 49 18.870 6.956 -5.602 1.00 0.00 C ATOM 767 O LYS A 49 19.263 6.789 -4.465 1.00 0.00 O ATOM 768 CB LYS A 49 17.588 6.039 -7.546 1.00 0.00 C ATOM 769 CG LYS A 49 16.289 5.346 -7.962 1.00 0.00 C ATOM 770 CD LYS A 49 15.288 6.392 -8.458 1.00 0.00 C ATOM 771 CE LYS A 49 15.624 6.779 -9.899 1.00 0.00 C ATOM 772 NZ LYS A 49 14.847 5.922 -10.840 1.00 0.00 N ATOM 0 H LYS A 49 16.530 8.254 -6.479 1.00 0.00 H new ATOM 0 HA LYS A 49 17.269 5.521 -5.479 1.00 0.00 H new ATOM 0 HB2 LYS A 49 17.744 6.935 -8.147 1.00 0.00 H new ATOM 0 HB3 LYS A 49 18.438 5.381 -7.728 1.00 0.00 H new ATOM 0 HG2 LYS A 49 16.489 4.617 -8.748 1.00 0.00 H new ATOM 0 HG3 LYS A 49 15.870 4.798 -7.118 1.00 0.00 H new ATOM 0 HD2 LYS A 49 14.274 5.995 -8.404 1.00 0.00 H new ATOM 0 HD3 LYS A 49 15.319 7.273 -7.817 1.00 0.00 H new ATOM 0 HE2 LYS A 49 15.388 7.830 -10.069 1.00 0.00 H new ATOM 0 HE3 LYS A 49 16.692 6.659 -10.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 15.076 6.186 -11.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.093 4.924 -10.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 13.829 6.058 -10.674 1.00 0.00 H new ATOM 786 N LEU A 50 19.585 7.612 -6.475 1.00 0.00 N ATOM 787 CA LEU A 50 20.911 8.171 -6.086 1.00 0.00 C ATOM 788 C LEU A 50 20.900 9.688 -6.278 1.00 0.00 C ATOM 789 O LEU A 50 21.828 10.263 -6.812 1.00 0.00 O ATOM 790 CB LEU A 50 22.003 7.553 -6.961 1.00 0.00 C ATOM 791 CG LEU A 50 22.845 6.588 -6.126 1.00 0.00 C ATOM 792 CD1 LEU A 50 23.358 7.307 -4.877 1.00 0.00 C ATOM 793 CD2 LEU A 50 21.984 5.394 -5.704 1.00 0.00 C ATOM 0 H LEU A 50 19.308 7.785 -7.441 1.00 0.00 H new ATOM 0 HA LEU A 50 21.111 7.938 -5.040 1.00 0.00 H new ATOM 0 HB2 LEU A 50 21.554 7.025 -7.802 1.00 0.00 H new ATOM 0 HB3 LEU A 50 22.636 8.337 -7.378 1.00 0.00 H new ATOM 0 HG LEU A 50 23.690 6.239 -6.719 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.958 6.619 -4.282 1.00 0.00 H new ATOM 0 HD12 LEU A 50 23.970 8.159 -5.173 1.00 0.00 H new ATOM 0 HD13 LEU A 50 22.512 7.656 -4.285 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.584 4.705 -5.109 1.00 0.00 H new ATOM 0 HD22 LEU A 50 21.140 5.746 -5.111 1.00 0.00 H new ATOM 0 HD23 LEU A 50 21.615 4.880 -6.591 1.00 0.00 H new ATOM 805 N THR A 51 19.857 10.343 -5.847 1.00 0.00 N ATOM 806 CA THR A 51 19.789 11.822 -6.007 1.00 0.00 C ATOM 807 C THR A 51 19.928 12.491 -4.636 1.00 0.00 C ATOM 808 O THR A 51 20.282 13.648 -4.532 1.00 0.00 O ATOM 809 CB THR A 51 18.444 12.205 -6.632 1.00 0.00 C ATOM 810 OG1 THR A 51 18.062 11.208 -7.570 1.00 0.00 O ATOM 811 CG2 THR A 51 18.571 13.553 -7.344 1.00 0.00 C ATOM 0 H THR A 51 19.050 9.918 -5.391 1.00 0.00 H new ATOM 0 HA THR A 51 20.599 12.156 -6.656 1.00 0.00 H new ATOM 0 HB THR A 51 17.689 12.282 -5.850 1.00 0.00 H new ATOM 0 HG1 THR A 51 17.236 10.774 -7.269 1.00 0.00 H new ATOM 0 HG21 THR A 51 17.612 13.822 -7.787 1.00 0.00 H new ATOM 0 HG22 THR A 51 18.866 14.318 -6.625 1.00 0.00 H new ATOM 0 HG23 THR A 51 19.326 13.481 -8.127 1.00 0.00 H new ATOM 819 N GLY A 52 19.657 11.770 -3.582 1.00 0.00 N ATOM 820 CA GLY A 52 19.779 12.363 -2.220 1.00 0.00 C ATOM 821 C GLY A 52 18.576 13.265 -1.938 1.00 0.00 C ATOM 822 O GLY A 52 18.722 14.425 -1.608 1.00 0.00 O ATOM 0 H GLY A 52 19.356 10.796 -3.605 1.00 0.00 H new ATOM 0 HA2 GLY A 52 19.835 11.572 -1.473 1.00 0.00 H new ATOM 0 HA3 GLY A 52 20.702 12.938 -2.145 1.00 0.00 H new ATOM 826 N ARG A 53 17.386 12.743 -2.063 1.00 0.00 N ATOM 827 CA ARG A 53 16.178 13.574 -1.797 1.00 0.00 C ATOM 828 C ARG A 53 15.446 13.030 -0.569 1.00 0.00 C ATOM 829 O ARG A 53 15.793 11.986 -0.052 1.00 0.00 O ATOM 830 CB ARG A 53 15.248 13.524 -3.013 1.00 0.00 C ATOM 831 CG ARG A 53 15.699 14.564 -4.040 1.00 0.00 C ATOM 832 CD ARG A 53 14.473 15.168 -4.728 1.00 0.00 C ATOM 833 NE ARG A 53 14.769 16.574 -5.126 1.00 0.00 N ATOM 834 CZ ARG A 53 15.863 16.848 -5.783 1.00 0.00 C ATOM 835 NH1 ARG A 53 15.888 16.738 -7.084 1.00 0.00 N ATOM 836 NH2 ARG A 53 16.932 17.231 -5.139 1.00 0.00 N ATOM 0 H ARG A 53 17.199 11.779 -2.337 1.00 0.00 H new ATOM 0 HA ARG A 53 16.478 14.605 -1.612 1.00 0.00 H new ATOM 0 HB2 ARG A 53 15.264 12.528 -3.456 1.00 0.00 H new ATOM 0 HB3 ARG A 53 14.220 13.720 -2.707 1.00 0.00 H new ATOM 0 HG2 ARG A 53 16.277 15.348 -3.550 1.00 0.00 H new ATOM 0 HG3 ARG A 53 16.353 14.101 -4.779 1.00 0.00 H new ATOM 0 HD2 ARG A 53 14.208 14.578 -5.606 1.00 0.00 H new ATOM 0 HD3 ARG A 53 13.616 15.142 -4.056 1.00 0.00 H new ATOM 0 HE ARG A 53 14.117 17.321 -4.885 1.00 0.00 H new ATOM 0 HH11 ARG A 53 15.053 16.438 -7.587 1.00 0.00 H new ATOM 0 HH12 ARG A 53 16.743 16.952 -7.598 1.00 0.00 H new ATOM 0 HH21 ARG A 53 16.912 17.316 -4.123 1.00 0.00 H new ATOM 0 HH22 ARG A 53 17.787 17.445 -5.652 1.00 0.00 H new ATOM 850 N PRO A 54 14.456 13.763 -0.140 1.00 0.00 N ATOM 851 CA PRO A 54 13.691 13.316 1.045 1.00 0.00 C ATOM 852 C PRO A 54 12.279 12.888 0.639 1.00 0.00 C ATOM 853 O PRO A 54 11.452 13.701 0.279 1.00 0.00 O ATOM 854 CB PRO A 54 13.644 14.545 1.954 1.00 0.00 C ATOM 855 CG PRO A 54 13.862 15.765 1.041 1.00 0.00 C ATOM 856 CD PRO A 54 14.531 15.239 -0.240 1.00 0.00 C ATOM 0 HA PRO A 54 14.146 12.456 1.536 1.00 0.00 H new ATOM 0 HB2 PRO A 54 12.686 14.611 2.469 1.00 0.00 H new ATOM 0 HB3 PRO A 54 14.416 14.491 2.722 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.914 16.252 0.812 1.00 0.00 H new ATOM 0 HG3 PRO A 54 14.492 16.508 1.530 1.00 0.00 H new ATOM 0 HD2 PRO A 54 14.016 15.600 -1.130 1.00 0.00 H new ATOM 0 HD3 PRO A 54 15.565 15.577 -0.311 1.00 0.00 H new ATOM 864 N ARG A 55 11.996 11.615 0.695 1.00 0.00 N ATOM 865 CA ARG A 55 10.638 11.135 0.315 1.00 0.00 C ATOM 866 C ARG A 55 10.054 10.302 1.460 1.00 0.00 C ATOM 867 O ARG A 55 9.317 10.801 2.287 1.00 0.00 O ATOM 868 CB ARG A 55 10.736 10.276 -0.947 1.00 0.00 C ATOM 869 CG ARG A 55 10.163 11.051 -2.137 1.00 0.00 C ATOM 870 CD ARG A 55 10.685 10.446 -3.442 1.00 0.00 C ATOM 871 NE ARG A 55 10.937 11.534 -4.428 1.00 0.00 N ATOM 872 CZ ARG A 55 10.102 12.533 -4.525 1.00 0.00 C ATOM 873 NH1 ARG A 55 9.064 12.441 -5.311 1.00 0.00 N ATOM 874 NH2 ARG A 55 10.307 13.624 -3.839 1.00 0.00 N ATOM 0 H ARG A 55 12.647 10.887 0.988 1.00 0.00 H new ATOM 0 HA ARG A 55 9.990 11.989 0.121 1.00 0.00 H new ATOM 0 HB2 ARG A 55 11.775 10.010 -1.139 1.00 0.00 H new ATOM 0 HB3 ARG A 55 10.189 9.344 -0.809 1.00 0.00 H new ATOM 0 HG2 ARG A 55 9.074 11.014 -2.117 1.00 0.00 H new ATOM 0 HG3 ARG A 55 10.448 12.101 -2.071 1.00 0.00 H new ATOM 0 HD2 ARG A 55 11.604 9.890 -3.256 1.00 0.00 H new ATOM 0 HD3 ARG A 55 9.960 9.738 -3.843 1.00 0.00 H new ATOM 0 HE ARG A 55 11.762 11.498 -5.027 1.00 0.00 H new ATOM 0 HH11 ARG A 55 8.906 11.589 -5.849 1.00 0.00 H new ATOM 0 HH12 ARG A 55 8.411 13.221 -5.387 1.00 0.00 H new ATOM 0 HH21 ARG A 55 11.120 13.696 -3.227 1.00 0.00 H new ATOM 0 HH22 ARG A 55 9.655 14.404 -3.915 1.00 0.00 H new ATOM 888 N GLY A 56 10.377 9.039 1.515 1.00 0.00 N ATOM 889 CA GLY A 56 9.838 8.180 2.608 1.00 0.00 C ATOM 890 C GLY A 56 8.345 7.942 2.381 1.00 0.00 C ATOM 891 O GLY A 56 7.543 8.048 3.288 1.00 0.00 O ATOM 0 H GLY A 56 10.990 8.565 0.852 1.00 0.00 H new ATOM 0 HA2 GLY A 56 10.369 7.228 2.632 1.00 0.00 H new ATOM 0 HA3 GLY A 56 9.998 8.659 3.574 1.00 0.00 H new ATOM 895 N VAL A 57 7.965 7.620 1.175 1.00 0.00 N ATOM 896 CA VAL A 57 6.524 7.373 0.886 1.00 0.00 C ATOM 897 C VAL A 57 6.410 6.326 -0.220 1.00 0.00 C ATOM 898 O VAL A 57 7.341 6.092 -0.965 1.00 0.00 O ATOM 899 CB VAL A 57 5.866 8.673 0.423 1.00 0.00 C ATOM 900 CG1 VAL A 57 6.428 9.072 -0.942 1.00 0.00 C ATOM 901 CG2 VAL A 57 4.353 8.463 0.310 1.00 0.00 C ATOM 0 H VAL A 57 8.591 7.517 0.376 1.00 0.00 H new ATOM 0 HA VAL A 57 6.025 7.016 1.787 1.00 0.00 H new ATOM 0 HB VAL A 57 6.073 9.463 1.145 1.00 0.00 H new ATOM 0 HG11 VAL A 57 5.959 9.999 -1.272 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.505 9.219 -0.863 1.00 0.00 H new ATOM 0 HG13 VAL A 57 6.221 8.283 -1.665 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.881 9.388 -0.020 1.00 0.00 H new ATOM 0 HG22 VAL A 57 4.148 7.673 -0.413 1.00 0.00 H new ATOM 0 HG23 VAL A 57 3.952 8.178 1.282 1.00 0.00 H new ATOM 911 N ALA A 58 5.278 5.691 -0.335 1.00 0.00 N ATOM 912 CA ALA A 58 5.112 4.660 -1.395 1.00 0.00 C ATOM 913 C ALA A 58 3.633 4.421 -1.657 1.00 0.00 C ATOM 914 O ALA A 58 2.769 5.069 -1.101 1.00 0.00 O ATOM 915 CB ALA A 58 5.742 3.342 -0.942 1.00 0.00 C ATOM 0 H ALA A 58 4.462 5.841 0.258 1.00 0.00 H new ATOM 0 HA ALA A 58 5.600 5.014 -2.303 1.00 0.00 H new ATOM 0 HB1 ALA A 58 5.617 2.592 -1.723 1.00 0.00 H new ATOM 0 HB2 ALA A 58 6.804 3.493 -0.751 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.254 3.000 -0.029 1.00 0.00 H new ATOM 921 N PHE A 59 3.344 3.471 -2.493 1.00 0.00 N ATOM 922 CA PHE A 59 1.934 3.145 -2.801 1.00 0.00 C ATOM 923 C PHE A 59 1.887 1.686 -3.264 1.00 0.00 C ATOM 924 O PHE A 59 2.286 1.356 -4.365 1.00 0.00 O ATOM 925 CB PHE A 59 1.409 4.125 -3.879 1.00 0.00 C ATOM 926 CG PHE A 59 1.045 3.415 -5.166 1.00 0.00 C ATOM 927 CD1 PHE A 59 -0.101 2.613 -5.226 1.00 0.00 C ATOM 928 CD2 PHE A 59 1.852 3.569 -6.300 1.00 0.00 C ATOM 929 CE1 PHE A 59 -0.440 1.965 -6.420 1.00 0.00 C ATOM 930 CE2 PHE A 59 1.514 2.920 -7.493 1.00 0.00 C ATOM 931 CZ PHE A 59 0.367 2.119 -7.553 1.00 0.00 C ATOM 0 H PHE A 59 4.034 2.900 -2.981 1.00 0.00 H new ATOM 0 HA PHE A 59 1.290 3.255 -1.928 1.00 0.00 H new ATOM 0 HB2 PHE A 59 0.534 4.650 -3.495 1.00 0.00 H new ATOM 0 HB3 PHE A 59 2.169 4.879 -4.084 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -0.723 2.494 -4.351 1.00 0.00 H new ATOM 0 HD2 PHE A 59 2.735 4.189 -6.254 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -1.324 1.346 -6.467 1.00 0.00 H new ATOM 0 HE2 PHE A 59 2.138 3.037 -8.367 1.00 0.00 H new ATOM 0 HZ PHE A 59 0.105 1.620 -8.474 1.00 0.00 H new ATOM 941 N VAL A 60 1.425 0.803 -2.426 1.00 0.00 N ATOM 942 CA VAL A 60 1.383 -0.621 -2.840 1.00 0.00 C ATOM 943 C VAL A 60 0.171 -0.849 -3.735 1.00 0.00 C ATOM 944 O VAL A 60 -0.782 -0.091 -3.746 1.00 0.00 O ATOM 945 CB VAL A 60 1.334 -1.571 -1.628 1.00 0.00 C ATOM 946 CG1 VAL A 60 0.247 -1.154 -0.643 1.00 0.00 C ATOM 947 CG2 VAL A 60 1.029 -2.984 -2.115 1.00 0.00 C ATOM 0 H VAL A 60 1.080 1.002 -1.487 1.00 0.00 H new ATOM 0 HA VAL A 60 2.299 -0.843 -3.388 1.00 0.00 H new ATOM 0 HB VAL A 60 2.300 -1.531 -1.124 1.00 0.00 H new ATOM 0 HG11 VAL A 60 0.237 -1.843 0.201 1.00 0.00 H new ATOM 0 HG12 VAL A 60 0.448 -0.144 -0.285 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -0.723 -1.176 -1.140 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.993 -3.663 -1.263 1.00 0.00 H new ATOM 0 HG22 VAL A 60 0.067 -2.993 -2.627 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.809 -3.308 -2.804 1.00 0.00 H new ATOM 957 N ARG A 61 0.236 -1.872 -4.517 1.00 0.00 N ATOM 958 CA ARG A 61 -0.855 -2.187 -5.463 1.00 0.00 C ATOM 959 C ARG A 61 -1.962 -2.984 -4.774 1.00 0.00 C ATOM 960 O ARG A 61 -1.708 -3.842 -3.954 1.00 0.00 O ATOM 961 CB ARG A 61 -0.238 -3.038 -6.550 1.00 0.00 C ATOM 962 CG ARG A 61 0.691 -4.062 -5.884 1.00 0.00 C ATOM 963 CD ARG A 61 0.758 -5.334 -6.702 1.00 0.00 C ATOM 964 NE ARG A 61 1.430 -6.406 -5.909 1.00 0.00 N ATOM 965 CZ ARG A 61 1.936 -7.451 -6.516 1.00 0.00 C ATOM 966 NH1 ARG A 61 2.443 -7.335 -7.715 1.00 0.00 N ATOM 967 NH2 ARG A 61 1.949 -8.609 -5.919 1.00 0.00 N ATOM 0 H ARG A 61 1.021 -2.523 -4.543 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.298 -1.271 -5.854 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -1.014 -3.545 -7.123 1.00 0.00 H new ATOM 0 HB3 ARG A 61 0.320 -2.416 -7.250 1.00 0.00 H new ATOM 0 HG2 ARG A 61 1.690 -3.639 -5.777 1.00 0.00 H new ATOM 0 HG3 ARG A 61 0.332 -4.288 -4.880 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -0.246 -5.651 -6.983 1.00 0.00 H new ATOM 0 HD3 ARG A 61 1.306 -5.155 -7.627 1.00 0.00 H new ATOM 0 HE ARG A 61 1.495 -6.325 -4.894 1.00 0.00 H new ATOM 0 HH11 ARG A 61 2.446 -6.428 -8.182 1.00 0.00 H new ATOM 0 HH12 ARG A 61 2.836 -8.151 -8.184 1.00 0.00 H new ATOM 0 HH21 ARG A 61 1.565 -8.702 -4.979 1.00 0.00 H new ATOM 0 HH22 ARG A 61 2.343 -9.422 -6.392 1.00 0.00 H new ATOM 981 N TYR A 62 -3.189 -2.715 -5.120 1.00 0.00 N ATOM 982 CA TYR A 62 -4.328 -3.459 -4.514 1.00 0.00 C ATOM 983 C TYR A 62 -5.552 -3.276 -5.414 1.00 0.00 C ATOM 984 O TYR A 62 -5.568 -2.408 -6.263 1.00 0.00 O ATOM 985 CB TYR A 62 -4.613 -2.901 -3.117 1.00 0.00 C ATOM 986 CG TYR A 62 -4.392 -3.988 -2.097 1.00 0.00 C ATOM 987 CD1 TYR A 62 -3.101 -4.273 -1.633 1.00 0.00 C ATOM 988 CD2 TYR A 62 -5.479 -4.725 -1.626 1.00 0.00 C ATOM 989 CE1 TYR A 62 -2.906 -5.295 -0.699 1.00 0.00 C ATOM 990 CE2 TYR A 62 -5.284 -5.745 -0.692 1.00 0.00 C ATOM 991 CZ TYR A 62 -3.997 -6.030 -0.230 1.00 0.00 C ATOM 992 OH TYR A 62 -3.805 -7.031 0.695 1.00 0.00 O ATOM 0 H TYR A 62 -3.454 -2.005 -5.803 1.00 0.00 H new ATOM 0 HA TYR A 62 -4.090 -4.519 -4.425 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -3.960 -2.053 -2.910 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -5.638 -2.535 -3.060 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.258 -3.704 -1.996 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -6.474 -4.506 -1.985 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -1.912 -5.516 -0.340 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -6.127 -6.313 -0.327 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.472 -7.834 0.243 1.00 0.00 H new ATOM 1002 N ASN A 63 -6.583 -4.067 -5.255 1.00 0.00 N ATOM 1003 CA ASN A 63 -7.765 -3.860 -6.138 1.00 0.00 C ATOM 1004 C ASN A 63 -9.090 -4.142 -5.416 1.00 0.00 C ATOM 1005 O ASN A 63 -9.593 -3.292 -4.714 1.00 0.00 O ATOM 1006 CB ASN A 63 -7.674 -4.725 -7.387 1.00 0.00 C ATOM 1007 CG ASN A 63 -7.057 -6.082 -7.043 1.00 0.00 C ATOM 1008 OD1 ASN A 63 -7.710 -7.101 -7.142 1.00 0.00 O ATOM 1009 ND2 ASN A 63 -5.816 -6.138 -6.642 1.00 0.00 N ATOM 0 H ASN A 63 -6.657 -4.823 -4.574 1.00 0.00 H new ATOM 0 HA ASN A 63 -7.753 -2.808 -6.424 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -8.667 -4.866 -7.814 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -7.070 -4.223 -8.143 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -5.395 -7.038 -6.412 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -5.268 -5.282 -6.559 1.00 0.00 H new ATOM 1016 N LYS A 64 -9.691 -5.298 -5.645 1.00 0.00 N ATOM 1017 CA LYS A 64 -11.030 -5.612 -5.025 1.00 0.00 C ATOM 1018 C LYS A 64 -11.258 -4.752 -3.783 1.00 0.00 C ATOM 1019 O LYS A 64 -10.459 -4.738 -2.872 1.00 0.00 O ATOM 1020 CB LYS A 64 -11.122 -7.098 -4.644 1.00 0.00 C ATOM 1021 CG LYS A 64 -10.826 -7.976 -5.863 1.00 0.00 C ATOM 1022 CD LYS A 64 -11.998 -7.906 -6.845 1.00 0.00 C ATOM 1023 CE LYS A 64 -12.497 -9.322 -7.149 1.00 0.00 C ATOM 1024 NZ LYS A 64 -13.541 -9.706 -6.157 1.00 0.00 N ATOM 0 H LYS A 64 -9.310 -6.037 -6.236 1.00 0.00 H new ATOM 0 HA LYS A 64 -11.801 -5.390 -5.763 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -10.414 -7.321 -3.846 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -12.117 -7.321 -4.259 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -9.910 -7.642 -6.350 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -10.662 -9.007 -5.550 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -12.805 -7.308 -6.422 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -11.685 -7.414 -7.766 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -12.906 -9.366 -8.158 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -11.667 -10.027 -7.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -13.879 -10.667 -6.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -13.136 -9.680 -5.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -14.337 -9.039 -6.215 1.00 0.00 H new ATOM 1038 N ARG A 65 -12.331 -4.008 -3.753 1.00 0.00 N ATOM 1039 CA ARG A 65 -12.593 -3.136 -2.576 1.00 0.00 C ATOM 1040 C ARG A 65 -12.290 -3.928 -1.308 1.00 0.00 C ATOM 1041 O ARG A 65 -11.548 -3.490 -0.451 1.00 0.00 O ATOM 1042 CB ARG A 65 -14.058 -2.700 -2.572 1.00 0.00 C ATOM 1043 CG ARG A 65 -14.477 -2.282 -3.983 1.00 0.00 C ATOM 1044 CD ARG A 65 -13.418 -1.350 -4.575 1.00 0.00 C ATOM 1045 NE ARG A 65 -13.964 -0.685 -5.789 1.00 0.00 N ATOM 1046 CZ ARG A 65 -13.704 -1.170 -6.971 1.00 0.00 C ATOM 1047 NH1 ARG A 65 -13.801 -2.454 -7.187 1.00 0.00 N ATOM 1048 NH2 ARG A 65 -13.344 -0.373 -7.939 1.00 0.00 N ATOM 0 H ARG A 65 -13.034 -3.967 -4.491 1.00 0.00 H new ATOM 0 HA ARG A 65 -11.961 -2.249 -2.622 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -14.689 -3.517 -2.222 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -14.198 -1.870 -1.880 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -14.596 -3.163 -4.614 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -15.443 -1.779 -3.953 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -13.124 -0.602 -3.839 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -12.522 -1.916 -4.829 1.00 0.00 H new ATOM 0 HE ARG A 65 -14.542 0.150 -5.696 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -14.080 -3.079 -6.431 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -13.597 -2.832 -8.112 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -13.266 0.630 -7.771 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -13.141 -0.753 -8.864 1.00 0.00 H new ATOM 1062 N GLU A 66 -12.834 -5.110 -1.195 1.00 0.00 N ATOM 1063 CA GLU A 66 -12.544 -5.936 0.002 1.00 0.00 C ATOM 1064 C GLU A 66 -11.028 -6.072 0.110 1.00 0.00 C ATOM 1065 O GLU A 66 -10.449 -5.923 1.168 1.00 0.00 O ATOM 1066 CB GLU A 66 -13.178 -7.320 -0.159 1.00 0.00 C ATOM 1067 CG GLU A 66 -14.641 -7.265 0.283 1.00 0.00 C ATOM 1068 CD GLU A 66 -15.325 -8.594 -0.045 1.00 0.00 C ATOM 1069 OE1 GLU A 66 -14.777 -9.339 -0.842 1.00 0.00 O ATOM 1070 OE2 GLU A 66 -16.383 -8.845 0.507 1.00 0.00 O ATOM 0 H GLU A 66 -13.462 -5.533 -1.878 1.00 0.00 H new ATOM 0 HA GLU A 66 -12.953 -5.471 0.899 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -13.113 -7.643 -1.198 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -12.634 -8.053 0.437 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -14.701 -7.068 1.353 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.154 -6.446 -0.222 1.00 0.00 H new ATOM 1077 N GLU A 67 -10.380 -6.344 -0.994 1.00 0.00 N ATOM 1078 CA GLU A 67 -8.899 -6.477 -0.981 1.00 0.00 C ATOM 1079 C GLU A 67 -8.283 -5.296 -0.231 1.00 0.00 C ATOM 1080 O GLU A 67 -7.617 -5.476 0.765 1.00 0.00 O ATOM 1081 CB GLU A 67 -8.367 -6.494 -2.415 1.00 0.00 C ATOM 1082 CG GLU A 67 -7.686 -7.834 -2.692 1.00 0.00 C ATOM 1083 CD GLU A 67 -6.250 -7.584 -3.155 1.00 0.00 C ATOM 1084 OE1 GLU A 67 -6.077 -7.183 -4.294 1.00 0.00 O ATOM 1085 OE2 GLU A 67 -5.347 -7.797 -2.363 1.00 0.00 O ATOM 0 H GLU A 67 -10.818 -6.479 -1.905 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.631 -7.408 -0.482 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -9.184 -6.337 -3.119 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.660 -5.678 -2.561 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -7.688 -8.449 -1.792 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -8.236 -8.384 -3.456 1.00 0.00 H new ATOM 1092 N ALA A 68 -8.490 -4.084 -0.690 1.00 0.00 N ATOM 1093 CA ALA A 68 -7.889 -2.929 0.038 1.00 0.00 C ATOM 1094 C ALA A 68 -8.158 -3.113 1.527 1.00 0.00 C ATOM 1095 O ALA A 68 -7.317 -2.833 2.352 1.00 0.00 O ATOM 1096 CB ALA A 68 -8.487 -1.606 -0.443 1.00 0.00 C ATOM 0 H ALA A 68 -9.037 -3.851 -1.519 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.817 -2.896 -0.155 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -8.031 -0.781 0.104 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.294 -1.486 -1.509 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -9.563 -1.608 -0.267 1.00 0.00 H new ATOM 1102 N GLN A 69 -9.310 -3.625 1.878 1.00 0.00 N ATOM 1103 CA GLN A 69 -9.590 -3.866 3.319 1.00 0.00 C ATOM 1104 C GLN A 69 -8.412 -4.668 3.870 1.00 0.00 C ATOM 1105 O GLN A 69 -7.761 -4.277 4.822 1.00 0.00 O ATOM 1106 CB GLN A 69 -10.885 -4.668 3.465 1.00 0.00 C ATOM 1107 CG GLN A 69 -11.750 -4.050 4.564 1.00 0.00 C ATOM 1108 CD GLN A 69 -11.279 -4.555 5.928 1.00 0.00 C ATOM 1109 OE1 GLN A 69 -11.805 -5.521 6.446 1.00 0.00 O ATOM 1110 NE2 GLN A 69 -10.304 -3.940 6.537 1.00 0.00 N ATOM 0 H GLN A 69 -10.059 -3.883 1.235 1.00 0.00 H new ATOM 0 HA GLN A 69 -9.709 -2.928 3.861 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -11.429 -4.674 2.521 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -10.657 -5.706 3.708 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -11.685 -2.963 4.525 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -12.796 -4.312 4.409 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -9.862 -3.130 6.103 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -9.983 -4.269 7.447 1.00 0.00 H new ATOM 1119 N GLU A 70 -8.106 -5.770 3.236 1.00 0.00 N ATOM 1120 CA GLU A 70 -6.937 -6.576 3.671 1.00 0.00 C ATOM 1121 C GLU A 70 -5.754 -5.637 3.763 1.00 0.00 C ATOM 1122 O GLU A 70 -5.241 -5.353 4.821 1.00 0.00 O ATOM 1123 CB GLU A 70 -6.606 -7.624 2.607 1.00 0.00 C ATOM 1124 CG GLU A 70 -7.530 -8.835 2.765 1.00 0.00 C ATOM 1125 CD GLU A 70 -7.107 -9.645 3.991 1.00 0.00 C ATOM 1126 OE1 GLU A 70 -7.209 -9.122 5.088 1.00 0.00 O ATOM 1127 OE2 GLU A 70 -6.688 -10.777 3.812 1.00 0.00 O ATOM 0 H GLU A 70 -8.618 -6.143 2.436 1.00 0.00 H new ATOM 0 HA GLU A 70 -7.153 -7.066 4.621 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -6.722 -7.194 1.612 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -5.565 -7.935 2.701 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -8.563 -8.505 2.873 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -7.486 -9.458 1.872 1.00 0.00 H new ATOM 1134 N ALA A 71 -5.338 -5.162 2.626 1.00 0.00 N ATOM 1135 CA ALA A 71 -4.189 -4.231 2.546 1.00 0.00 C ATOM 1136 C ALA A 71 -4.152 -3.319 3.774 1.00 0.00 C ATOM 1137 O ALA A 71 -3.100 -2.922 4.232 1.00 0.00 O ATOM 1138 CB ALA A 71 -4.345 -3.397 1.276 1.00 0.00 C ATOM 0 H ALA A 71 -5.760 -5.388 1.726 1.00 0.00 H new ATOM 0 HA ALA A 71 -3.255 -4.793 2.519 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -3.510 -2.701 1.193 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -4.357 -4.055 0.407 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -5.280 -2.838 1.320 1.00 0.00 H new ATOM 1144 N ILE A 72 -5.283 -2.997 4.324 1.00 0.00 N ATOM 1145 CA ILE A 72 -5.289 -2.134 5.531 1.00 0.00 C ATOM 1146 C ILE A 72 -4.734 -2.945 6.704 1.00 0.00 C ATOM 1147 O ILE A 72 -3.661 -2.674 7.204 1.00 0.00 O ATOM 1148 CB ILE A 72 -6.722 -1.687 5.838 1.00 0.00 C ATOM 1149 CG1 ILE A 72 -7.326 -1.015 4.583 1.00 0.00 C ATOM 1150 CG2 ILE A 72 -6.720 -0.724 7.032 1.00 0.00 C ATOM 1151 CD1 ILE A 72 -7.250 0.519 4.667 1.00 0.00 C ATOM 0 H ILE A 72 -6.201 -3.292 3.992 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.675 -1.249 5.365 1.00 0.00 H new ATOM 0 HB ILE A 72 -7.334 -2.550 6.100 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -6.794 -1.358 3.695 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -8.366 -1.322 4.470 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -7.741 -0.409 7.247 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -6.304 -1.228 7.905 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -6.113 0.149 6.794 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -7.684 0.955 3.767 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -7.804 0.863 5.540 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -6.208 0.827 4.753 1.00 0.00 H new ATOM 1163 N SER A 73 -5.453 -3.947 7.137 1.00 0.00 N ATOM 1164 CA SER A 73 -4.965 -4.778 8.281 1.00 0.00 C ATOM 1165 C SER A 73 -4.035 -5.890 7.778 1.00 0.00 C ATOM 1166 O SER A 73 -3.918 -6.933 8.390 1.00 0.00 O ATOM 1167 CB SER A 73 -6.161 -5.403 8.999 1.00 0.00 C ATOM 1168 OG SER A 73 -6.697 -4.464 9.921 1.00 0.00 O ATOM 0 H SER A 73 -6.355 -4.227 6.750 1.00 0.00 H new ATOM 0 HA SER A 73 -4.410 -4.140 8.969 1.00 0.00 H new ATOM 0 HB2 SER A 73 -6.922 -5.695 8.276 1.00 0.00 H new ATOM 0 HB3 SER A 73 -5.854 -6.309 9.522 1.00 0.00 H new ATOM 0 HG SER A 73 -7.465 -4.861 10.382 1.00 0.00 H new ATOM 1174 N ALA A 74 -3.365 -5.673 6.680 1.00 0.00 N ATOM 1175 CA ALA A 74 -2.436 -6.710 6.145 1.00 0.00 C ATOM 1176 C ALA A 74 -1.190 -6.011 5.603 1.00 0.00 C ATOM 1177 O ALA A 74 -0.078 -6.318 5.986 1.00 0.00 O ATOM 1178 CB ALA A 74 -3.118 -7.498 5.025 1.00 0.00 C ATOM 0 H ALA A 74 -3.421 -4.818 6.127 1.00 0.00 H new ATOM 0 HA ALA A 74 -2.160 -7.405 6.938 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -2.432 -8.253 4.641 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -4.012 -7.985 5.415 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -3.397 -6.818 4.220 1.00 0.00 H new ATOM 1184 N LEU A 75 -1.366 -5.052 4.732 1.00 0.00 N ATOM 1185 CA LEU A 75 -0.187 -4.316 4.197 1.00 0.00 C ATOM 1186 C LEU A 75 0.248 -3.297 5.252 1.00 0.00 C ATOM 1187 O LEU A 75 1.409 -2.956 5.355 1.00 0.00 O ATOM 1188 CB LEU A 75 -0.555 -3.562 2.905 1.00 0.00 C ATOM 1189 CG LEU A 75 -1.056 -4.504 1.785 1.00 0.00 C ATOM 1190 CD1 LEU A 75 -0.134 -4.389 0.580 1.00 0.00 C ATOM 1191 CD2 LEU A 75 -1.099 -5.969 2.234 1.00 0.00 C ATOM 0 H LEU A 75 -2.271 -4.749 4.371 1.00 0.00 H new ATOM 0 HA LEU A 75 0.611 -5.023 3.972 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.327 -2.825 3.127 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.317 -3.013 2.549 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.071 -4.199 1.532 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -0.485 -5.052 -0.211 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -0.134 -3.361 0.218 1.00 0.00 H new ATOM 0 HD13 LEU A 75 0.878 -4.672 0.868 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.457 -6.591 1.413 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.098 -6.290 2.523 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.772 -6.069 3.085 1.00 0.00 H new ATOM 1203 N ASN A 76 -0.676 -2.815 6.051 1.00 0.00 N ATOM 1204 CA ASN A 76 -0.301 -1.831 7.104 1.00 0.00 C ATOM 1205 C ASN A 76 0.750 -2.461 8.017 1.00 0.00 C ATOM 1206 O ASN A 76 0.669 -3.624 8.361 1.00 0.00 O ATOM 1207 CB ASN A 76 -1.535 -1.470 7.931 1.00 0.00 C ATOM 1208 CG ASN A 76 -1.139 -0.497 9.042 1.00 0.00 C ATOM 1209 OD1 ASN A 76 -0.612 0.564 8.779 1.00 0.00 O ATOM 1210 ND2 ASN A 76 -1.374 -0.819 10.286 1.00 0.00 N ATOM 0 H ASN A 76 -1.665 -3.061 6.016 1.00 0.00 H new ATOM 0 HA ASN A 76 0.099 -0.930 6.639 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -2.295 -1.019 7.292 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -1.974 -2.370 8.361 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -1.115 -0.179 11.036 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -1.817 -1.711 10.507 1.00 0.00 H new ATOM 1217 N ASN A 77 1.733 -1.709 8.419 1.00 0.00 N ATOM 1218 CA ASN A 77 2.782 -2.276 9.313 1.00 0.00 C ATOM 1219 C ASN A 77 3.464 -3.469 8.633 1.00 0.00 C ATOM 1220 O ASN A 77 3.398 -4.582 9.113 1.00 0.00 O ATOM 1221 CB ASN A 77 2.140 -2.750 10.621 1.00 0.00 C ATOM 1222 CG ASN A 77 1.891 -1.553 11.539 1.00 0.00 C ATOM 1223 OD1 ASN A 77 1.400 -0.529 11.104 1.00 0.00 O ATOM 1224 ND2 ASN A 77 2.210 -1.639 12.802 1.00 0.00 N ATOM 0 H ASN A 77 1.857 -0.728 8.169 1.00 0.00 H new ATOM 0 HA ASN A 77 3.523 -1.504 9.520 1.00 0.00 H new ATOM 0 HB2 ASN A 77 1.200 -3.261 10.411 1.00 0.00 H new ATOM 0 HB3 ASN A 77 2.791 -3.471 11.116 1.00 0.00 H new ATOM 0 HD21 ASN A 77 2.047 -0.847 13.424 1.00 0.00 H new ATOM 0 HD22 ASN A 77 2.622 -2.498 13.167 1.00 0.00 H new ATOM 1231 N VAL A 78 4.134 -3.246 7.531 1.00 0.00 N ATOM 1232 CA VAL A 78 4.834 -4.373 6.848 1.00 0.00 C ATOM 1233 C VAL A 78 6.218 -4.530 7.491 1.00 0.00 C ATOM 1234 O VAL A 78 7.241 -4.306 6.874 1.00 0.00 O ATOM 1235 CB VAL A 78 4.972 -4.074 5.347 1.00 0.00 C ATOM 1236 CG1 VAL A 78 5.387 -2.615 5.147 1.00 0.00 C ATOM 1237 CG2 VAL A 78 6.035 -4.990 4.734 1.00 0.00 C ATOM 0 H VAL A 78 4.226 -2.337 7.077 1.00 0.00 H new ATOM 0 HA VAL A 78 4.265 -5.296 6.957 1.00 0.00 H new ATOM 0 HB VAL A 78 4.013 -4.250 4.859 1.00 0.00 H new ATOM 0 HG11 VAL A 78 5.484 -2.407 4.081 1.00 0.00 H new ATOM 0 HG12 VAL A 78 4.630 -1.959 5.577 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.343 -2.438 5.640 1.00 0.00 H new ATOM 0 HG21 VAL A 78 6.130 -4.775 3.670 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.992 -4.817 5.226 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.740 -6.031 4.869 1.00 0.00 H new ATOM 1247 N ILE A 79 6.247 -4.896 8.746 1.00 0.00 N ATOM 1248 CA ILE A 79 7.543 -5.055 9.467 1.00 0.00 C ATOM 1249 C ILE A 79 7.285 -5.827 10.765 1.00 0.00 C ATOM 1250 O ILE A 79 6.193 -5.782 11.293 1.00 0.00 O ATOM 1251 CB ILE A 79 8.116 -3.667 9.799 1.00 0.00 C ATOM 1252 CG1 ILE A 79 6.989 -2.628 9.835 1.00 0.00 C ATOM 1253 CG2 ILE A 79 9.138 -3.270 8.733 1.00 0.00 C ATOM 1254 CD1 ILE A 79 6.104 -2.877 11.058 1.00 0.00 C ATOM 0 H ILE A 79 5.418 -5.093 9.307 1.00 0.00 H new ATOM 0 HA ILE A 79 8.256 -5.597 8.845 1.00 0.00 H new ATOM 0 HB ILE A 79 8.598 -3.705 10.776 1.00 0.00 H new ATOM 0 HG12 ILE A 79 7.408 -1.623 9.875 1.00 0.00 H new ATOM 0 HG13 ILE A 79 6.394 -2.690 8.924 1.00 0.00 H new ATOM 0 HG21 ILE A 79 9.545 -2.286 8.967 1.00 0.00 H new ATOM 0 HG22 ILE A 79 9.946 -4.001 8.713 1.00 0.00 H new ATOM 0 HG23 ILE A 79 8.653 -3.239 7.757 1.00 0.00 H new ATOM 0 HD11 ILE A 79 5.303 -2.138 11.084 1.00 0.00 H new ATOM 0 HD12 ILE A 79 5.674 -3.877 10.999 1.00 0.00 H new ATOM 0 HD13 ILE A 79 6.704 -2.793 11.964 1.00 0.00 H new ATOM 1266 N PRO A 80 8.293 -6.518 11.242 1.00 0.00 N ATOM 1267 CA PRO A 80 8.071 -7.279 12.495 1.00 0.00 C ATOM 1268 C PRO A 80 7.305 -6.420 13.506 1.00 0.00 C ATOM 1269 O PRO A 80 6.127 -6.615 13.723 1.00 0.00 O ATOM 1270 CB PRO A 80 9.474 -7.619 13.002 1.00 0.00 C ATOM 1271 CG PRO A 80 10.421 -6.595 12.356 1.00 0.00 C ATOM 1272 CD PRO A 80 9.704 -6.069 11.103 1.00 0.00 C ATOM 0 HA PRO A 80 7.473 -8.177 12.341 1.00 0.00 H new ATOM 0 HB2 PRO A 80 9.520 -7.560 14.089 1.00 0.00 H new ATOM 0 HB3 PRO A 80 9.752 -8.636 12.725 1.00 0.00 H new ATOM 0 HG2 PRO A 80 10.642 -5.781 13.047 1.00 0.00 H new ATOM 0 HG3 PRO A 80 11.372 -7.058 12.093 1.00 0.00 H new ATOM 0 HD2 PRO A 80 9.767 -4.983 11.041 1.00 0.00 H new ATOM 0 HD3 PRO A 80 10.156 -6.467 10.195 1.00 0.00 H new ATOM 1280 N GLU A 81 7.956 -5.466 14.114 1.00 0.00 N ATOM 1281 CA GLU A 81 7.255 -4.588 15.098 1.00 0.00 C ATOM 1282 C GLU A 81 8.289 -3.871 15.971 1.00 0.00 C ATOM 1283 O GLU A 81 9.319 -4.419 16.307 1.00 0.00 O ATOM 1284 CB GLU A 81 6.334 -5.426 15.990 1.00 0.00 C ATOM 1285 CG GLU A 81 7.049 -6.710 16.419 1.00 0.00 C ATOM 1286 CD GLU A 81 6.070 -7.883 16.351 1.00 0.00 C ATOM 1287 OE1 GLU A 81 4.914 -7.647 16.040 1.00 0.00 O ATOM 1288 OE2 GLU A 81 6.492 -8.998 16.612 1.00 0.00 O ATOM 0 H GLU A 81 8.944 -5.255 13.973 1.00 0.00 H new ATOM 0 HA GLU A 81 6.658 -3.855 14.555 1.00 0.00 H new ATOM 0 HB2 GLU A 81 6.043 -4.851 16.869 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.418 -5.672 15.452 1.00 0.00 H new ATOM 0 HG2 GLU A 81 7.904 -6.898 15.770 1.00 0.00 H new ATOM 0 HG3 GLU A 81 7.436 -6.603 17.432 1.00 0.00 H new ATOM 1295 N GLY A 82 8.021 -2.647 16.339 1.00 0.00 N ATOM 1296 CA GLY A 82 8.989 -1.895 17.189 1.00 0.00 C ATOM 1297 C GLY A 82 9.586 -0.737 16.386 1.00 0.00 C ATOM 1298 O GLY A 82 9.406 0.419 16.718 1.00 0.00 O ATOM 0 H GLY A 82 7.175 -2.136 16.088 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.487 -1.514 18.078 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.782 -2.561 17.531 1.00 0.00 H new ATOM 1302 N GLY A 83 10.296 -1.035 15.334 1.00 0.00 N ATOM 1303 CA GLY A 83 10.902 0.051 14.512 1.00 0.00 C ATOM 1304 C GLY A 83 10.612 -0.203 13.033 1.00 0.00 C ATOM 1305 O GLY A 83 9.755 -0.992 12.686 1.00 0.00 O ATOM 0 H GLY A 83 10.483 -1.983 15.007 1.00 0.00 H new ATOM 0 HA2 GLY A 83 10.496 1.017 14.812 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.978 0.091 14.680 1.00 0.00 H new ATOM 1309 N SER A 84 11.317 0.467 12.160 1.00 0.00 N ATOM 1310 CA SER A 84 11.089 0.277 10.698 1.00 0.00 C ATOM 1311 C SER A 84 9.861 1.080 10.259 1.00 0.00 C ATOM 1312 O SER A 84 9.583 1.210 9.084 1.00 0.00 O ATOM 1313 CB SER A 84 10.864 -1.205 10.400 1.00 0.00 C ATOM 1314 OG SER A 84 11.623 -1.571 9.256 1.00 0.00 O ATOM 0 H SER A 84 12.045 1.141 12.398 1.00 0.00 H new ATOM 0 HA SER A 84 11.964 0.627 10.150 1.00 0.00 H new ATOM 0 HB2 SER A 84 11.161 -1.810 11.257 1.00 0.00 H new ATOM 0 HB3 SER A 84 9.805 -1.397 10.226 1.00 0.00 H new ATOM 0 HG SER A 84 11.747 -2.543 9.243 1.00 0.00 H new ATOM 1320 N GLN A 85 9.124 1.625 11.191 1.00 0.00 N ATOM 1321 CA GLN A 85 7.922 2.419 10.816 1.00 0.00 C ATOM 1322 C GLN A 85 6.921 1.517 10.091 1.00 0.00 C ATOM 1323 O GLN A 85 7.298 0.526 9.499 1.00 0.00 O ATOM 1324 CB GLN A 85 8.346 3.566 9.897 1.00 0.00 C ATOM 1325 CG GLN A 85 9.611 4.220 10.461 1.00 0.00 C ATOM 1326 CD GLN A 85 9.296 5.650 10.903 1.00 0.00 C ATOM 1327 OE1 GLN A 85 9.970 6.581 10.511 1.00 0.00 O ATOM 1328 NE2 GLN A 85 8.293 5.865 11.711 1.00 0.00 N ATOM 0 H GLN A 85 9.304 1.554 12.193 1.00 0.00 H new ATOM 0 HA GLN A 85 7.453 2.825 11.712 1.00 0.00 H new ATOM 0 HB2 GLN A 85 8.533 3.192 8.891 1.00 0.00 H new ATOM 0 HB3 GLN A 85 7.545 4.301 9.820 1.00 0.00 H new ATOM 0 HG2 GLN A 85 9.986 3.642 11.306 1.00 0.00 H new ATOM 0 HG3 GLN A 85 10.397 4.227 9.706 1.00 0.00 H new ATOM 0 HE21 GLN A 85 7.727 5.083 12.040 1.00 0.00 H new ATOM 0 HE22 GLN A 85 8.076 6.815 12.013 1.00 0.00 H new ATOM 1337 N PRO A 86 5.672 1.889 10.171 1.00 0.00 N ATOM 1338 CA PRO A 86 4.638 1.065 9.506 1.00 0.00 C ATOM 1339 C PRO A 86 4.096 1.772 8.260 1.00 0.00 C ATOM 1340 O PRO A 86 4.171 2.978 8.131 1.00 0.00 O ATOM 1341 CB PRO A 86 3.539 0.910 10.557 1.00 0.00 C ATOM 1342 CG PRO A 86 3.708 2.086 11.536 1.00 0.00 C ATOM 1343 CD PRO A 86 5.155 2.581 11.376 1.00 0.00 C ATOM 0 HA PRO A 86 5.029 0.106 9.168 1.00 0.00 H new ATOM 0 HB2 PRO A 86 2.553 0.929 10.094 1.00 0.00 H new ATOM 0 HB3 PRO A 86 3.629 -0.044 11.076 1.00 0.00 H new ATOM 0 HG2 PRO A 86 2.998 2.882 11.312 1.00 0.00 H new ATOM 0 HG3 PRO A 86 3.518 1.768 12.561 1.00 0.00 H new ATOM 0 HD2 PRO A 86 5.189 3.664 11.254 1.00 0.00 H new ATOM 0 HD3 PRO A 86 5.753 2.340 12.255 1.00 0.00 H new ATOM 1351 N LEU A 87 3.545 1.021 7.345 1.00 0.00 N ATOM 1352 CA LEU A 87 2.988 1.624 6.103 1.00 0.00 C ATOM 1353 C LEU A 87 1.618 2.233 6.400 1.00 0.00 C ATOM 1354 O LEU A 87 0.718 1.555 6.854 1.00 0.00 O ATOM 1355 CB LEU A 87 2.811 0.525 5.050 1.00 0.00 C ATOM 1356 CG LEU A 87 3.903 0.630 3.986 1.00 0.00 C ATOM 1357 CD1 LEU A 87 5.234 0.171 4.575 1.00 0.00 C ATOM 1358 CD2 LEU A 87 3.536 -0.266 2.802 1.00 0.00 C ATOM 0 H LEU A 87 3.457 0.007 7.407 1.00 0.00 H new ATOM 0 HA LEU A 87 3.667 2.395 5.739 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.851 -0.455 5.526 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.830 0.613 4.584 1.00 0.00 H new ATOM 0 HG LEU A 87 3.992 1.664 3.653 1.00 0.00 H new ATOM 0 HD11 LEU A 87 6.013 0.246 3.816 1.00 0.00 H new ATOM 0 HD12 LEU A 87 5.493 0.803 5.425 1.00 0.00 H new ATOM 0 HD13 LEU A 87 5.148 -0.864 4.906 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.311 -0.196 2.039 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.452 -1.299 3.140 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.583 0.057 2.382 1.00 0.00 H new ATOM 1370 N SER A 88 1.433 3.495 6.123 1.00 0.00 N ATOM 1371 CA SER A 88 0.098 4.105 6.370 1.00 0.00 C ATOM 1372 C SER A 88 -0.804 3.697 5.209 1.00 0.00 C ATOM 1373 O SER A 88 -0.756 4.276 4.143 1.00 0.00 O ATOM 1374 CB SER A 88 0.221 5.629 6.424 1.00 0.00 C ATOM 1375 OG SER A 88 1.526 5.980 6.865 1.00 0.00 O ATOM 0 H SER A 88 2.140 4.123 5.741 1.00 0.00 H new ATOM 0 HA SER A 88 -0.314 3.765 7.320 1.00 0.00 H new ATOM 0 HB2 SER A 88 0.030 6.056 5.439 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.527 6.042 7.101 1.00 0.00 H new ATOM 0 HG SER A 88 1.490 6.833 7.346 1.00 0.00 H new ATOM 1381 N VAL A 89 -1.591 2.671 5.394 1.00 0.00 N ATOM 1382 CA VAL A 89 -2.450 2.176 4.281 1.00 0.00 C ATOM 1383 C VAL A 89 -3.661 3.088 4.060 1.00 0.00 C ATOM 1384 O VAL A 89 -4.310 3.543 4.981 1.00 0.00 O ATOM 1385 CB VAL A 89 -2.920 0.755 4.623 1.00 0.00 C ATOM 1386 CG1 VAL A 89 -4.114 0.358 3.748 1.00 0.00 C ATOM 1387 CG2 VAL A 89 -1.771 -0.225 4.378 1.00 0.00 C ATOM 0 H VAL A 89 -1.676 2.154 6.269 1.00 0.00 H new ATOM 0 HA VAL A 89 -1.869 2.174 3.359 1.00 0.00 H new ATOM 0 HB VAL A 89 -3.225 0.727 5.669 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.433 -0.652 4.005 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -4.937 1.053 3.918 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -3.823 0.391 2.698 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -2.098 -1.237 4.619 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -1.472 -0.180 3.331 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -0.924 0.043 5.009 1.00 0.00 H new ATOM 1397 N ARG A 90 -3.951 3.336 2.811 1.00 0.00 N ATOM 1398 CA ARG A 90 -5.100 4.197 2.426 1.00 0.00 C ATOM 1399 C ARG A 90 -5.206 4.173 0.893 1.00 0.00 C ATOM 1400 O ARG A 90 -5.084 3.131 0.280 1.00 0.00 O ATOM 1401 CB ARG A 90 -4.852 5.624 2.920 1.00 0.00 C ATOM 1402 CG ARG A 90 -6.190 6.328 3.150 1.00 0.00 C ATOM 1403 CD ARG A 90 -6.394 6.554 4.650 1.00 0.00 C ATOM 1404 NE ARG A 90 -7.500 7.527 4.861 1.00 0.00 N ATOM 1405 CZ ARG A 90 -7.942 7.763 6.065 1.00 0.00 C ATOM 1406 NH1 ARG A 90 -8.812 6.958 6.612 1.00 0.00 N ATOM 1407 NH2 ARG A 90 -7.509 8.800 6.726 1.00 0.00 N ATOM 0 H ARG A 90 -3.422 2.965 2.022 1.00 0.00 H new ATOM 0 HA ARG A 90 -6.027 3.836 2.871 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -4.276 5.604 3.845 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -4.261 6.175 2.189 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -6.208 7.281 2.622 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -7.004 5.726 2.748 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -6.628 5.610 5.142 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -5.475 6.929 5.100 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.913 8.010 4.063 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -9.147 6.143 6.098 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -9.157 7.144 7.554 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -6.825 9.426 6.301 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.854 8.985 7.668 1.00 0.00 H new ATOM 1421 N LEU A 91 -5.409 5.298 0.261 1.00 0.00 N ATOM 1422 CA LEU A 91 -5.490 5.301 -1.232 1.00 0.00 C ATOM 1423 C LEU A 91 -5.209 6.714 -1.748 1.00 0.00 C ATOM 1424 O LEU A 91 -5.697 7.689 -1.212 1.00 0.00 O ATOM 1425 CB LEU A 91 -6.881 4.842 -1.682 1.00 0.00 C ATOM 1426 CG LEU A 91 -6.737 3.608 -2.583 1.00 0.00 C ATOM 1427 CD1 LEU A 91 -7.535 2.439 -1.998 1.00 0.00 C ATOM 1428 CD2 LEU A 91 -7.264 3.919 -3.987 1.00 0.00 C ATOM 0 H LEU A 91 -5.522 6.208 0.707 1.00 0.00 H new ATOM 0 HA LEU A 91 -4.749 4.613 -1.639 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -7.497 4.604 -0.815 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -7.385 5.644 -2.221 1.00 0.00 H new ATOM 0 HG LEU A 91 -5.682 3.340 -2.641 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -7.428 1.567 -2.643 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -7.158 2.203 -1.003 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -8.588 2.714 -1.931 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -7.158 3.037 -4.619 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -8.316 4.198 -3.927 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -6.694 4.743 -4.415 1.00 0.00 H new ATOM 1440 N ALA A 92 -4.412 6.835 -2.778 1.00 0.00 N ATOM 1441 CA ALA A 92 -4.086 8.189 -3.315 1.00 0.00 C ATOM 1442 C ALA A 92 -4.804 8.413 -4.651 1.00 0.00 C ATOM 1443 O ALA A 92 -5.746 7.724 -4.988 1.00 0.00 O ATOM 1444 CB ALA A 92 -2.575 8.300 -3.526 1.00 0.00 C ATOM 0 H ALA A 92 -3.974 6.056 -3.269 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.416 8.945 -2.602 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -2.334 9.288 -3.918 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.063 8.152 -2.575 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -2.250 7.539 -4.235 1.00 0.00 H new ATOM 1450 N GLU A 93 -4.364 9.381 -5.412 1.00 0.00 N ATOM 1451 CA GLU A 93 -5.015 9.666 -6.724 1.00 0.00 C ATOM 1452 C GLU A 93 -4.804 8.488 -7.679 1.00 0.00 C ATOM 1453 O GLU A 93 -4.325 7.440 -7.294 1.00 0.00 O ATOM 1454 CB GLU A 93 -4.403 10.933 -7.333 1.00 0.00 C ATOM 1455 CG GLU A 93 -3.016 10.620 -7.903 1.00 0.00 C ATOM 1456 CD GLU A 93 -2.023 11.690 -7.448 1.00 0.00 C ATOM 1457 OE1 GLU A 93 -2.417 12.842 -7.368 1.00 0.00 O ATOM 1458 OE2 GLU A 93 -0.884 11.340 -7.187 1.00 0.00 O ATOM 0 H GLU A 93 -3.578 9.989 -5.180 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.084 9.813 -6.568 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.051 11.318 -8.120 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.327 11.712 -6.574 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -2.687 9.637 -7.567 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.058 10.587 -8.992 1.00 0.00 H new ATOM 1465 N GLU A 94 -5.160 8.656 -8.925 1.00 0.00 N ATOM 1466 CA GLU A 94 -4.982 7.550 -9.907 1.00 0.00 C ATOM 1467 C GLU A 94 -3.492 7.240 -10.059 1.00 0.00 C ATOM 1468 O GLU A 94 -2.650 7.893 -9.478 1.00 0.00 O ATOM 1469 CB GLU A 94 -5.552 7.971 -11.264 1.00 0.00 C ATOM 1470 CG GLU A 94 -4.756 9.159 -11.807 1.00 0.00 C ATOM 1471 CD GLU A 94 -4.017 8.742 -13.080 1.00 0.00 C ATOM 1472 OE1 GLU A 94 -4.670 8.605 -14.102 1.00 0.00 O ATOM 1473 OE2 GLU A 94 -2.813 8.566 -13.011 1.00 0.00 O ATOM 0 H GLU A 94 -5.566 9.512 -9.304 1.00 0.00 H new ATOM 0 HA GLU A 94 -5.507 6.663 -9.552 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -5.504 7.137 -11.965 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -6.603 8.241 -11.161 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -5.426 9.992 -12.020 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -4.044 9.506 -11.058 1.00 0.00 H new ATOM 1480 N HIS A 95 -3.162 6.248 -10.838 1.00 0.00 N ATOM 1481 CA HIS A 95 -1.728 5.899 -11.027 1.00 0.00 C ATOM 1482 C HIS A 95 -1.613 4.759 -12.037 1.00 0.00 C ATOM 1483 O HIS A 95 -2.383 3.819 -12.016 1.00 0.00 O ATOM 1484 CB HIS A 95 -1.128 5.462 -9.690 1.00 0.00 C ATOM 1485 CG HIS A 95 0.210 6.119 -9.505 1.00 0.00 C ATOM 1486 ND1 HIS A 95 0.874 6.117 -8.290 1.00 0.00 N ATOM 1487 CD2 HIS A 95 1.020 6.805 -10.374 1.00 0.00 C ATOM 1488 CE1 HIS A 95 2.029 6.785 -8.459 1.00 0.00 C ATOM 1489 NE2 HIS A 95 2.169 7.225 -9.713 1.00 0.00 N ATOM 0 H HIS A 95 -3.823 5.665 -11.351 1.00 0.00 H new ATOM 0 HA HIS A 95 -1.187 6.769 -11.398 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -1.796 5.735 -8.873 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -1.020 4.378 -9.665 1.00 0.00 H new ATOM 0 HD1 HIS A 95 0.547 5.687 -7.425 1.00 0.00 H new ATOM 0 HD2 HIS A 95 0.799 6.991 -11.415 1.00 0.00 H new ATOM 0 HE1 HIS A 95 2.755 6.946 -7.676 1.00 0.00 H new ATOM 1497 N GLY A 96 -0.661 4.834 -12.924 1.00 0.00 N ATOM 1498 CA GLY A 96 -0.501 3.753 -13.936 1.00 0.00 C ATOM 1499 C GLY A 96 -0.148 2.440 -13.234 1.00 0.00 C ATOM 1500 O GLY A 96 0.821 2.355 -12.505 1.00 0.00 O ATOM 0 H GLY A 96 0.013 5.597 -12.992 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -1.422 3.636 -14.506 1.00 0.00 H new ATOM 0 HA3 GLY A 96 0.282 4.019 -14.646 1.00 0.00 H new ATOM 1504 N LYS A 97 -0.925 1.414 -13.448 1.00 0.00 N ATOM 1505 CA LYS A 97 -0.630 0.110 -12.793 1.00 0.00 C ATOM 1506 C LYS A 97 0.036 -0.827 -13.802 1.00 0.00 C ATOM 1507 O LYS A 97 -0.227 -0.675 -14.984 1.00 0.00 O ATOM 1508 CB LYS A 97 -1.935 -0.518 -12.298 1.00 0.00 C ATOM 1509 CG LYS A 97 -2.849 -0.806 -13.492 1.00 0.00 C ATOM 1510 CD LYS A 97 -3.087 -2.314 -13.599 1.00 0.00 C ATOM 1511 CE LYS A 97 -4.118 -2.590 -14.695 1.00 0.00 C ATOM 1512 NZ LYS A 97 -3.680 -3.760 -15.508 1.00 0.00 N ATOM 1513 OXT LYS A 97 0.797 -1.679 -13.376 1.00 0.00 O ATOM 0 H LYS A 97 -1.750 1.423 -14.047 1.00 0.00 H new ATOM 0 HA LYS A 97 0.040 0.270 -11.948 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.725 -1.440 -11.757 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.433 0.155 -11.600 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -3.799 -0.285 -13.371 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -2.395 -0.432 -14.410 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -2.152 -2.825 -13.827 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -3.440 -2.706 -12.645 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -5.093 -2.788 -14.250 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -4.230 -1.713 -15.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -4.381 -3.947 -16.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -2.758 -3.554 -15.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -3.594 -4.596 -14.895 1.00 0.00 H new TER 1527 LYS A 97