USER MOD reduce.3.24.130724 H: found=0, std=0, add=696, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 694 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 147:sc= 0.0507 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -53:sc= 1.15 USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 79:sc= 0.322 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -167:sc= -1.64! (180deg=-1.79!) USER MOD Single : A 50 MET CE :methyl -168:sc= 0 (180deg=-0.073) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= -0.218 X(o=-0.22,f=-0.22) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot -110:sc= -0.5 USER MOD Single : A 82 THR OG1 : rot 87:sc= 0.0864 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 39:sc= 0.239 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -20.228 -3.716 4.449 1.00 0.00 N ATOM 2 CA MET A 1 -21.300 -3.894 3.484 1.00 0.00 C ATOM 3 C MET A 1 -21.031 -5.100 2.583 1.00 0.00 C ATOM 4 O MET A 1 -19.891 -5.542 2.453 1.00 0.00 O ATOM 5 CB MET A 1 -21.429 -2.633 2.626 1.00 0.00 C ATOM 6 CG MET A 1 -22.678 -1.836 3.008 1.00 0.00 C ATOM 7 SD MET A 1 -22.255 -0.119 3.251 1.00 0.00 S ATOM 8 CE MET A 1 -22.157 0.420 1.552 1.00 0.00 C ATOM 0 H1 MET A 1 -20.101 -2.702 4.644 1.00 0.00 H new ATOM 0 H2 MET A 1 -20.469 -4.211 5.331 1.00 0.00 H new ATOM 0 H3 MET A 1 -19.345 -4.107 4.063 1.00 0.00 H new ATOM 0 HA MET A 1 -22.228 -4.070 4.028 1.00 0.00 H new ATOM 0 HB2 MET A 1 -20.543 -2.011 2.752 1.00 0.00 H new ATOM 0 HB3 MET A 1 -21.477 -2.909 1.573 1.00 0.00 H new ATOM 0 HG2 MET A 1 -23.431 -1.926 2.225 1.00 0.00 H new ATOM 0 HG3 MET A 1 -23.115 -2.244 3.919 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.900 1.479 1.520 1.00 0.00 H new ATOM 0 HE2 MET A 1 -21.391 -0.155 1.031 1.00 0.00 H new ATOM 0 HE3 MET A 1 -23.120 0.266 1.065 1.00 0.00 H new ATOM 18 N GLY A 2 -22.102 -5.600 1.982 1.00 0.00 N ATOM 19 CA GLY A 2 -21.996 -6.746 1.096 1.00 0.00 C ATOM 20 C GLY A 2 -21.044 -6.456 -0.066 1.00 0.00 C ATOM 21 O GLY A 2 -19.828 -6.577 0.079 1.00 0.00 O ATOM 0 H GLY A 2 -23.047 -5.232 2.092 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -21.639 -7.611 1.656 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -22.982 -7.002 0.708 1.00 0.00 H new ATOM 25 N LYS A 3 -21.632 -6.078 -1.191 1.00 0.00 N ATOM 26 CA LYS A 3 -20.851 -5.769 -2.377 1.00 0.00 C ATOM 27 C LYS A 3 -20.183 -7.047 -2.889 1.00 0.00 C ATOM 28 O LYS A 3 -19.046 -7.345 -2.526 1.00 0.00 O ATOM 29 CB LYS A 3 -19.867 -4.633 -2.089 1.00 0.00 C ATOM 30 CG LYS A 3 -19.149 -4.194 -3.367 1.00 0.00 C ATOM 31 CD LYS A 3 -18.386 -2.886 -3.145 1.00 0.00 C ATOM 32 CE LYS A 3 -17.197 -2.776 -4.101 1.00 0.00 C ATOM 33 NZ LYS A 3 -16.949 -1.362 -4.460 1.00 0.00 N ATOM 0 H LYS A 3 -22.641 -5.979 -1.307 1.00 0.00 H new ATOM 0 HA LYS A 3 -21.497 -5.405 -3.176 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -20.400 -3.786 -1.657 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -19.135 -4.959 -1.350 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -18.457 -4.973 -3.686 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -19.875 -4.064 -4.170 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -19.057 -2.040 -3.294 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -18.034 -2.836 -2.114 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -16.308 -3.200 -3.635 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -17.393 -3.357 -5.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -16.139 -1.306 -5.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -17.793 -0.969 -4.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -16.741 -0.817 -3.599 1.00 0.00 H new ATOM 47 N GLU A 4 -20.917 -7.767 -3.724 1.00 0.00 N ATOM 48 CA GLU A 4 -20.410 -9.005 -4.290 1.00 0.00 C ATOM 49 C GLU A 4 -19.128 -8.741 -5.081 1.00 0.00 C ATOM 50 O GLU A 4 -18.077 -9.303 -4.774 1.00 0.00 O ATOM 51 CB GLU A 4 -21.466 -9.681 -5.166 1.00 0.00 C ATOM 52 CG GLU A 4 -21.699 -11.128 -4.727 1.00 0.00 C ATOM 53 CD GLU A 4 -21.640 -12.080 -5.923 1.00 0.00 C ATOM 54 OE1 GLU A 4 -22.590 -11.935 -6.783 1.00 0.00 O ATOM 55 OE2 GLU A 4 -20.725 -12.912 -6.009 1.00 0.00 O ATOM 0 H GLU A 4 -21.860 -7.516 -4.022 1.00 0.00 H new ATOM 0 HA GLU A 4 -20.175 -9.686 -3.472 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -22.402 -9.125 -5.108 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -21.147 -9.660 -6.208 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -20.947 -11.414 -3.992 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -22.670 -11.212 -4.239 1.00 0.00 H new ATOM 62 N SER A 5 -19.255 -7.886 -6.085 1.00 0.00 N ATOM 63 CA SER A 5 -18.120 -7.540 -6.923 1.00 0.00 C ATOM 64 C SER A 5 -16.861 -7.399 -6.066 1.00 0.00 C ATOM 65 O SER A 5 -16.903 -6.812 -4.986 1.00 0.00 O ATOM 66 CB SER A 5 -18.381 -6.248 -7.700 1.00 0.00 C ATOM 67 OG SER A 5 -18.696 -6.501 -9.066 1.00 0.00 O ATOM 0 H SER A 5 -20.128 -7.422 -6.337 1.00 0.00 H new ATOM 0 HA SER A 5 -17.972 -8.342 -7.646 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.202 -5.704 -7.233 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.501 -5.607 -7.644 1.00 0.00 H new ATOM 0 HG SER A 5 -18.857 -5.652 -9.527 1.00 0.00 H new ATOM 73 N GLY A 6 -15.769 -7.946 -6.580 1.00 0.00 N ATOM 74 CA GLY A 6 -14.500 -7.888 -5.875 1.00 0.00 C ATOM 75 C GLY A 6 -14.328 -9.099 -4.955 1.00 0.00 C ATOM 76 O GLY A 6 -15.237 -9.446 -4.203 1.00 0.00 O ATOM 0 H GLY A 6 -15.737 -8.431 -7.476 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -13.682 -7.854 -6.594 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -14.447 -6.971 -5.288 1.00 0.00 H new ATOM 80 N TRP A 7 -13.155 -9.708 -5.045 1.00 0.00 N ATOM 81 CA TRP A 7 -12.852 -10.873 -4.231 1.00 0.00 C ATOM 82 C TRP A 7 -13.267 -10.564 -2.791 1.00 0.00 C ATOM 83 O TRP A 7 -13.465 -9.403 -2.434 1.00 0.00 O ATOM 84 CB TRP A 7 -11.377 -11.262 -4.357 1.00 0.00 C ATOM 85 CG TRP A 7 -11.101 -12.309 -5.438 1.00 0.00 C ATOM 86 CD1 TRP A 7 -11.634 -12.390 -6.664 1.00 0.00 C ATOM 87 CD2 TRP A 7 -10.195 -13.429 -5.338 1.00 0.00 C ATOM 88 NE1 TRP A 7 -11.142 -13.476 -7.360 1.00 0.00 N ATOM 89 CE2 TRP A 7 -10.239 -14.127 -6.528 1.00 0.00 C ATOM 90 CE3 TRP A 7 -9.367 -13.838 -4.278 1.00 0.00 C ATOM 91 CZ2 TRP A 7 -9.477 -15.276 -6.770 1.00 0.00 C ATOM 92 CZ3 TRP A 7 -8.612 -14.988 -4.536 1.00 0.00 C ATOM 93 CH2 TRP A 7 -8.644 -15.703 -5.728 1.00 0.00 C ATOM 0 H TRP A 7 -12.403 -9.417 -5.669 1.00 0.00 H new ATOM 0 HA TRP A 7 -13.413 -11.741 -4.577 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -10.793 -10.368 -4.574 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -11.029 -11.645 -3.397 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -12.358 -11.693 -7.059 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -11.395 -13.750 -8.309 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -9.317 -13.307 -3.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -9.529 -15.805 -7.710 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -7.958 -15.345 -3.754 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -8.030 -16.583 -5.850 1.00 0.00 H new ATOM 104 N ASP A 8 -13.386 -11.622 -2.003 1.00 0.00 N ATOM 105 CA ASP A 8 -13.774 -11.478 -0.610 1.00 0.00 C ATOM 106 C ASP A 8 -12.632 -11.963 0.286 1.00 0.00 C ATOM 107 O ASP A 8 -12.304 -13.148 0.292 1.00 0.00 O ATOM 108 CB ASP A 8 -15.013 -12.319 -0.294 1.00 0.00 C ATOM 109 CG ASP A 8 -14.989 -13.742 -0.855 1.00 0.00 C ATOM 110 OD1 ASP A 8 -15.361 -13.848 -2.086 1.00 0.00 O ATOM 111 OD2 ASP A 8 -14.634 -14.700 -0.153 1.00 0.00 O ATOM 0 H ASP A 8 -13.221 -12.583 -2.302 1.00 0.00 H new ATOM 0 HA ASP A 8 -13.996 -10.426 -0.428 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -15.130 -12.373 0.788 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -15.891 -11.805 -0.685 1.00 0.00 H new ATOM 116 N SER A 9 -12.059 -11.021 1.020 1.00 0.00 N ATOM 117 CA SER A 9 -10.960 -11.338 1.917 1.00 0.00 C ATOM 118 C SER A 9 -11.489 -12.066 3.155 1.00 0.00 C ATOM 119 O SER A 9 -12.409 -11.587 3.816 1.00 0.00 O ATOM 120 CB SER A 9 -10.203 -10.073 2.329 1.00 0.00 C ATOM 121 OG SER A 9 -8.817 -10.154 2.011 1.00 0.00 O ATOM 0 H SER A 9 -12.334 -10.039 1.012 1.00 0.00 H new ATOM 0 HA SER A 9 -10.264 -11.990 1.389 1.00 0.00 H new ATOM 0 HB2 SER A 9 -10.640 -9.209 1.828 1.00 0.00 H new ATOM 0 HB3 SER A 9 -10.320 -9.913 3.401 1.00 0.00 H new ATOM 0 HG SER A 9 -8.369 -9.327 2.288 1.00 0.00 H new ATOM 127 N GLY A 10 -10.885 -13.212 3.431 1.00 0.00 N ATOM 128 CA GLY A 10 -11.283 -14.011 4.577 1.00 0.00 C ATOM 129 C GLY A 10 -11.150 -13.212 5.875 1.00 0.00 C ATOM 130 O GLY A 10 -10.900 -12.008 5.845 1.00 0.00 O ATOM 0 H GLY A 10 -10.122 -13.607 2.880 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -12.314 -14.342 4.454 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.665 -14.907 4.632 1.00 0.00 H new ATOM 134 N ARG A 11 -11.324 -13.914 6.985 1.00 0.00 N ATOM 135 CA ARG A 11 -11.227 -13.285 8.292 1.00 0.00 C ATOM 136 C ARG A 11 -9.775 -12.908 8.592 1.00 0.00 C ATOM 137 O ARG A 11 -9.464 -11.735 8.793 1.00 0.00 O ATOM 138 CB ARG A 11 -11.743 -14.216 9.391 1.00 0.00 C ATOM 139 CG ARG A 11 -12.748 -13.496 10.292 1.00 0.00 C ATOM 140 CD ARG A 11 -12.034 -12.577 11.285 1.00 0.00 C ATOM 141 NE ARG A 11 -12.590 -12.769 12.643 1.00 0.00 N ATOM 142 CZ ARG A 11 -13.820 -12.362 13.022 1.00 0.00 C ATOM 143 NH1 ARG A 11 -14.634 -11.736 12.146 1.00 0.00 N ATOM 144 NH2 ARG A 11 -14.215 -12.586 14.261 1.00 0.00 N ATOM 0 H ARG A 11 -11.532 -14.912 7.007 1.00 0.00 H new ATOM 0 HA ARG A 11 -11.843 -12.386 8.275 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -12.214 -15.090 8.941 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -10.906 -14.577 9.989 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -13.436 -12.912 9.681 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -13.346 -14.229 10.834 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -10.965 -12.791 11.287 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -12.150 -11.537 10.979 1.00 0.00 H new ATOM 0 HE ARG A 11 -12.007 -13.238 13.336 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -14.321 -11.567 11.190 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -15.562 -11.432 12.440 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -13.594 -13.060 14.916 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -15.141 -12.285 14.563 1.00 0.00 H new ATOM 158 N ALA A 12 -8.925 -13.924 8.614 1.00 0.00 N ATOM 159 CA ALA A 12 -7.514 -13.714 8.887 1.00 0.00 C ATOM 160 C ALA A 12 -7.038 -12.458 8.153 1.00 0.00 C ATOM 161 O ALA A 12 -6.138 -11.764 8.622 1.00 0.00 O ATOM 162 CB ALA A 12 -6.724 -14.960 8.483 1.00 0.00 C ATOM 0 H ALA A 12 -9.187 -14.896 8.447 1.00 0.00 H new ATOM 0 HA ALA A 12 -7.349 -13.555 9.953 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.665 -14.802 8.688 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -7.080 -15.818 9.054 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.863 -15.150 7.419 1.00 0.00 H new ATOM 168 N ALA A 13 -7.665 -12.205 7.013 1.00 0.00 N ATOM 169 CA ALA A 13 -7.318 -11.046 6.210 1.00 0.00 C ATOM 170 C ALA A 13 -7.113 -9.838 7.126 1.00 0.00 C ATOM 171 O ALA A 13 -6.048 -9.222 7.120 1.00 0.00 O ATOM 172 CB ALA A 13 -8.407 -10.805 5.162 1.00 0.00 C ATOM 0 H ALA A 13 -8.411 -12.783 6.627 1.00 0.00 H new ATOM 0 HA ALA A 13 -6.383 -11.216 5.675 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -8.146 -9.935 4.560 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -8.492 -11.680 4.518 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -9.360 -10.628 5.661 1.00 0.00 H new ATOM 178 N VAL A 14 -8.151 -9.535 7.892 1.00 0.00 N ATOM 179 CA VAL A 14 -8.099 -8.411 8.813 1.00 0.00 C ATOM 180 C VAL A 14 -6.770 -8.440 9.571 1.00 0.00 C ATOM 181 O VAL A 14 -6.091 -7.421 9.679 1.00 0.00 O ATOM 182 CB VAL A 14 -9.316 -8.437 9.739 1.00 0.00 C ATOM 183 CG1 VAL A 14 -9.048 -9.299 10.974 1.00 0.00 C ATOM 184 CG2 VAL A 14 -9.730 -7.019 10.139 1.00 0.00 C ATOM 0 H VAL A 14 -9.033 -10.048 7.894 1.00 0.00 H new ATOM 0 HA VAL A 14 -8.142 -7.468 8.268 1.00 0.00 H new ATOM 0 HB VAL A 14 -10.144 -8.886 9.191 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -9.929 -9.300 11.615 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -8.824 -10.320 10.664 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -8.199 -8.892 11.524 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -10.597 -7.065 10.797 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.905 -6.532 10.659 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.983 -6.448 9.246 1.00 0.00 H new ATOM 194 N ALA A 15 -6.440 -9.619 10.077 1.00 0.00 N ATOM 195 CA ALA A 15 -5.204 -9.794 10.822 1.00 0.00 C ATOM 196 C ALA A 15 -4.028 -9.308 9.972 1.00 0.00 C ATOM 197 O ALA A 15 -3.160 -8.588 10.463 1.00 0.00 O ATOM 198 CB ALA A 15 -5.060 -11.261 11.234 1.00 0.00 C ATOM 0 H ALA A 15 -7.006 -10.462 9.986 1.00 0.00 H new ATOM 0 HA ALA A 15 -5.218 -9.199 11.735 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.133 -11.393 11.793 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.905 -11.548 11.860 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.039 -11.889 10.343 1.00 0.00 H new ATOM 204 N ALA A 16 -4.038 -9.722 8.714 1.00 0.00 N ATOM 205 CA ALA A 16 -2.983 -9.337 7.792 1.00 0.00 C ATOM 206 C ALA A 16 -2.974 -7.815 7.639 1.00 0.00 C ATOM 207 O ALA A 16 -1.928 -7.219 7.390 1.00 0.00 O ATOM 208 CB ALA A 16 -3.186 -10.056 6.456 1.00 0.00 C ATOM 0 H ALA A 16 -4.760 -10.320 8.311 1.00 0.00 H new ATOM 0 HA ALA A 16 -2.008 -9.635 8.179 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.395 -9.768 5.764 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -3.154 -11.134 6.614 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.153 -9.779 6.037 1.00 0.00 H new ATOM 214 N VAL A 17 -4.153 -7.230 7.794 1.00 0.00 N ATOM 215 CA VAL A 17 -4.294 -5.789 7.677 1.00 0.00 C ATOM 216 C VAL A 17 -3.862 -5.130 8.989 1.00 0.00 C ATOM 217 O VAL A 17 -3.522 -3.948 9.011 1.00 0.00 O ATOM 218 CB VAL A 17 -5.727 -5.434 7.274 1.00 0.00 C ATOM 219 CG1 VAL A 17 -5.965 -3.926 7.368 1.00 0.00 C ATOM 220 CG2 VAL A 17 -6.045 -5.953 5.871 1.00 0.00 C ATOM 0 H VAL A 17 -5.019 -7.728 8.000 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.644 -5.405 6.891 1.00 0.00 H new ATOM 0 HB VAL A 17 -6.404 -5.924 7.974 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -6.991 -3.701 7.076 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -5.798 -3.594 8.393 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -5.276 -3.407 6.702 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -7.069 -5.688 5.608 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -5.358 -5.505 5.153 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -5.934 -7.037 5.850 1.00 0.00 H new ATOM 230 N VAL A 18 -3.889 -5.923 10.049 1.00 0.00 N ATOM 231 CA VAL A 18 -3.504 -5.432 11.362 1.00 0.00 C ATOM 232 C VAL A 18 -1.978 -5.424 11.471 1.00 0.00 C ATOM 233 O VAL A 18 -1.380 -4.395 11.781 1.00 0.00 O ATOM 234 CB VAL A 18 -4.178 -6.268 12.452 1.00 0.00 C ATOM 235 CG1 VAL A 18 -3.506 -6.043 13.808 1.00 0.00 C ATOM 236 CG2 VAL A 18 -5.676 -5.969 12.525 1.00 0.00 C ATOM 0 H VAL A 18 -4.172 -6.903 10.026 1.00 0.00 H new ATOM 0 HA VAL A 18 -3.845 -4.406 11.502 1.00 0.00 H new ATOM 0 HB VAL A 18 -4.060 -7.319 12.190 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -4.004 -6.648 14.566 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.456 -6.330 13.746 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -3.579 -4.990 14.080 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -6.131 -6.576 13.308 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -5.826 -4.913 12.752 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -6.141 -6.204 11.567 1.00 0.00 H new ATOM 246 N GLY A 19 -1.392 -6.583 11.211 1.00 0.00 N ATOM 247 CA GLY A 19 0.053 -6.722 11.276 1.00 0.00 C ATOM 248 C GLY A 19 0.739 -5.790 10.276 1.00 0.00 C ATOM 249 O GLY A 19 1.113 -6.212 9.183 1.00 0.00 O ATOM 0 H GLY A 19 -1.891 -7.435 10.955 1.00 0.00 H new ATOM 0 HA2 GLY A 19 0.399 -6.496 12.285 1.00 0.00 H new ATOM 0 HA3 GLY A 19 0.332 -7.755 11.067 1.00 0.00 H new ATOM 253 N GLY A 20 0.885 -4.538 10.687 1.00 0.00 N ATOM 254 CA GLY A 20 1.520 -3.542 9.841 1.00 0.00 C ATOM 255 C GLY A 20 1.275 -2.130 10.378 1.00 0.00 C ATOM 256 O GLY A 20 1.017 -1.206 9.609 1.00 0.00 O ATOM 0 H GLY A 20 0.574 -4.191 11.595 1.00 0.00 H new ATOM 0 HA2 GLY A 20 2.592 -3.734 9.788 1.00 0.00 H new ATOM 0 HA3 GLY A 20 1.132 -3.621 8.826 1.00 0.00 H new ATOM 260 N VAL A 21 1.365 -2.009 11.694 1.00 0.00 N ATOM 261 CA VAL A 21 1.157 -0.725 12.343 1.00 0.00 C ATOM 262 C VAL A 21 2.259 0.244 11.911 1.00 0.00 C ATOM 263 O VAL A 21 2.003 1.189 11.167 1.00 0.00 O ATOM 264 CB VAL A 21 1.084 -0.911 13.860 1.00 0.00 C ATOM 265 CG1 VAL A 21 1.017 0.439 14.575 1.00 0.00 C ATOM 266 CG2 VAL A 21 -0.101 -1.797 14.247 1.00 0.00 C ATOM 0 H VAL A 21 1.579 -2.778 12.329 1.00 0.00 H new ATOM 0 HA VAL A 21 0.205 -0.292 12.037 1.00 0.00 H new ATOM 0 HB VAL A 21 1.996 -1.414 14.180 1.00 0.00 H new ATOM 0 HG11 VAL A 21 0.966 0.278 15.652 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.907 1.021 14.337 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.130 0.981 14.247 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.130 -1.913 15.330 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.028 -1.334 13.907 1.00 0.00 H new ATOM 0 HG23 VAL A 21 0.009 -2.776 13.780 1.00 0.00 H new ATOM 276 N VAL A 22 3.462 -0.023 12.398 1.00 0.00 N ATOM 277 CA VAL A 22 4.604 0.814 12.072 1.00 0.00 C ATOM 278 C VAL A 22 4.645 1.047 10.560 1.00 0.00 C ATOM 279 O VAL A 22 4.810 2.178 10.107 1.00 0.00 O ATOM 280 CB VAL A 22 5.888 0.182 12.615 1.00 0.00 C ATOM 281 CG1 VAL A 22 5.860 0.111 14.143 1.00 0.00 C ATOM 282 CG2 VAL A 22 6.118 -1.202 12.005 1.00 0.00 C ATOM 0 H VAL A 22 3.671 -0.807 13.016 1.00 0.00 H new ATOM 0 HA VAL A 22 4.511 1.790 12.549 1.00 0.00 H new ATOM 0 HB VAL A 22 6.724 0.819 12.325 1.00 0.00 H new ATOM 0 HG11 VAL A 22 6.784 -0.342 14.503 1.00 0.00 H new ATOM 0 HG12 VAL A 22 5.765 1.117 14.552 1.00 0.00 H new ATOM 0 HG13 VAL A 22 5.011 -0.492 14.464 1.00 0.00 H new ATOM 0 HG21 VAL A 22 7.037 -1.629 12.407 1.00 0.00 H new ATOM 0 HG22 VAL A 22 5.278 -1.852 12.250 1.00 0.00 H new ATOM 0 HG23 VAL A 22 6.204 -1.113 10.922 1.00 0.00 H new ATOM 292 N ALA A 23 4.493 -0.043 9.822 1.00 0.00 N ATOM 293 CA ALA A 23 4.511 0.029 8.370 1.00 0.00 C ATOM 294 C ALA A 23 3.512 1.090 7.904 1.00 0.00 C ATOM 295 O ALA A 23 3.809 1.875 7.005 1.00 0.00 O ATOM 296 CB ALA A 23 4.209 -1.353 7.787 1.00 0.00 C ATOM 0 H ALA A 23 4.357 -0.980 10.201 1.00 0.00 H new ATOM 0 HA ALA A 23 5.497 0.325 8.012 1.00 0.00 H new ATOM 0 HB1 ALA A 23 4.222 -1.300 6.698 1.00 0.00 H new ATOM 0 HB2 ALA A 23 4.964 -2.063 8.125 1.00 0.00 H new ATOM 0 HB3 ALA A 23 3.225 -1.682 8.122 1.00 0.00 H new ATOM 302 N VAL A 24 2.348 1.079 8.537 1.00 0.00 N ATOM 303 CA VAL A 24 1.303 2.031 8.198 1.00 0.00 C ATOM 304 C VAL A 24 1.767 3.442 8.564 1.00 0.00 C ATOM 305 O VAL A 24 1.409 4.410 7.895 1.00 0.00 O ATOM 306 CB VAL A 24 -0.007 1.635 8.882 1.00 0.00 C ATOM 307 CG1 VAL A 24 -1.024 2.777 8.820 1.00 0.00 C ATOM 308 CG2 VAL A 24 -0.580 0.356 8.270 1.00 0.00 C ATOM 0 H VAL A 24 2.105 0.426 9.282 1.00 0.00 H new ATOM 0 HA VAL A 24 1.109 2.021 7.125 1.00 0.00 H new ATOM 0 HB VAL A 24 0.209 1.436 9.932 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -1.946 2.470 9.313 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -0.618 3.654 9.324 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -1.233 3.022 7.779 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -1.511 0.097 8.774 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -0.774 0.515 7.209 1.00 0.00 H new ATOM 0 HG23 VAL A 24 0.136 -0.457 8.390 1.00 0.00 H new ATOM 318 N GLY A 25 2.556 3.514 9.625 1.00 0.00 N ATOM 319 CA GLY A 25 3.073 4.791 10.089 1.00 0.00 C ATOM 320 C GLY A 25 4.097 5.358 9.104 1.00 0.00 C ATOM 321 O GLY A 25 4.055 6.542 8.772 1.00 0.00 O ATOM 0 H GLY A 25 2.850 2.709 10.177 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.252 5.497 10.212 1.00 0.00 H new ATOM 0 HA3 GLY A 25 3.535 4.666 11.068 1.00 0.00 H new ATOM 325 N THR A 26 4.993 4.487 8.664 1.00 0.00 N ATOM 326 CA THR A 26 6.026 4.886 7.723 1.00 0.00 C ATOM 327 C THR A 26 5.398 5.390 6.422 1.00 0.00 C ATOM 328 O THR A 26 5.722 6.479 5.953 1.00 0.00 O ATOM 329 CB THR A 26 6.968 3.697 7.523 1.00 0.00 C ATOM 330 OG1 THR A 26 7.739 3.659 8.721 1.00 0.00 O ATOM 331 CG2 THR A 26 8.001 3.947 6.422 1.00 0.00 C ATOM 0 H THR A 26 5.025 3.506 8.942 1.00 0.00 H new ATOM 0 HA THR A 26 6.611 5.721 8.109 1.00 0.00 H new ATOM 0 HB THR A 26 6.385 2.809 7.278 1.00 0.00 H new ATOM 0 HG1 THR A 26 8.376 2.915 8.677 1.00 0.00 H new ATOM 0 HG21 THR A 26 8.644 3.073 6.321 1.00 0.00 H new ATOM 0 HG22 THR A 26 7.489 4.132 5.478 1.00 0.00 H new ATOM 0 HG23 THR A 26 8.607 4.815 6.682 1.00 0.00 H new ATOM 339 N VAL A 27 4.509 4.572 5.877 1.00 0.00 N ATOM 340 CA VAL A 27 3.832 4.921 4.639 1.00 0.00 C ATOM 341 C VAL A 27 3.030 6.207 4.847 1.00 0.00 C ATOM 342 O VAL A 27 2.948 7.044 3.949 1.00 0.00 O ATOM 343 CB VAL A 27 2.970 3.749 4.166 1.00 0.00 C ATOM 344 CG1 VAL A 27 3.823 2.499 3.937 1.00 0.00 C ATOM 345 CG2 VAL A 27 1.837 3.467 5.154 1.00 0.00 C ATOM 0 H VAL A 27 4.242 3.669 6.270 1.00 0.00 H new ATOM 0 HA VAL A 27 4.557 5.114 3.848 1.00 0.00 H new ATOM 0 HB VAL A 27 2.520 4.027 3.213 1.00 0.00 H new ATOM 0 HG11 VAL A 27 3.186 1.680 3.601 1.00 0.00 H new ATOM 0 HG12 VAL A 27 4.577 2.707 3.178 1.00 0.00 H new ATOM 0 HG13 VAL A 27 4.314 2.218 4.869 1.00 0.00 H new ATOM 0 HG21 VAL A 27 1.240 2.629 4.793 1.00 0.00 H new ATOM 0 HG22 VAL A 27 2.257 3.220 6.129 1.00 0.00 H new ATOM 0 HG23 VAL A 27 1.205 4.351 5.245 1.00 0.00 H new ATOM 355 N LEU A 28 2.457 6.324 6.036 1.00 0.00 N ATOM 356 CA LEU A 28 1.665 7.494 6.373 1.00 0.00 C ATOM 357 C LEU A 28 2.554 8.738 6.327 1.00 0.00 C ATOM 358 O LEU A 28 2.372 9.605 5.474 1.00 0.00 O ATOM 359 CB LEU A 28 0.957 7.294 7.715 1.00 0.00 C ATOM 360 CG LEU A 28 -0.015 8.399 8.133 1.00 0.00 C ATOM 361 CD1 LEU A 28 -1.459 8.010 7.813 1.00 0.00 C ATOM 362 CD2 LEU A 28 0.169 8.761 9.608 1.00 0.00 C ATOM 0 H LEU A 28 2.526 5.627 6.778 1.00 0.00 H new ATOM 0 HA LEU A 28 0.873 7.641 5.639 1.00 0.00 H new ATOM 0 HB2 LEU A 28 0.410 6.352 7.678 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.715 7.192 8.491 1.00 0.00 H new ATOM 0 HG LEU A 28 0.213 9.292 7.552 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.129 8.813 8.120 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.562 7.842 6.741 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.717 7.097 8.349 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.534 9.549 9.880 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.016 7.881 10.224 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.188 9.111 9.772 1.00 0.00 H new ATOM 374 N VAL A 29 3.497 8.787 7.257 1.00 0.00 N ATOM 375 CA VAL A 29 4.415 9.911 7.333 1.00 0.00 C ATOM 376 C VAL A 29 5.047 10.141 5.959 1.00 0.00 C ATOM 377 O VAL A 29 5.414 11.266 5.621 1.00 0.00 O ATOM 378 CB VAL A 29 5.450 9.667 8.434 1.00 0.00 C ATOM 379 CG1 VAL A 29 6.461 8.601 8.009 1.00 0.00 C ATOM 380 CG2 VAL A 29 6.154 10.969 8.821 1.00 0.00 C ATOM 0 H VAL A 29 3.645 8.067 7.964 1.00 0.00 H new ATOM 0 HA VAL A 29 3.882 10.823 7.602 1.00 0.00 H new ATOM 0 HB VAL A 29 4.924 9.296 9.314 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.185 8.447 8.809 1.00 0.00 H new ATOM 0 HG12 VAL A 29 5.940 7.666 7.806 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.980 8.930 7.109 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.884 10.769 9.605 1.00 0.00 H new ATOM 0 HG22 VAL A 29 6.662 11.381 7.949 1.00 0.00 H new ATOM 0 HG23 VAL A 29 5.418 11.686 9.185 1.00 0.00 H new ATOM 390 N ALA A 30 5.155 9.058 5.203 1.00 0.00 N ATOM 391 CA ALA A 30 5.737 9.129 3.874 1.00 0.00 C ATOM 392 C ALA A 30 4.827 9.959 2.967 1.00 0.00 C ATOM 393 O ALA A 30 5.287 10.882 2.297 1.00 0.00 O ATOM 394 CB ALA A 30 5.959 7.713 3.338 1.00 0.00 C ATOM 0 H ALA A 30 4.849 8.127 5.486 1.00 0.00 H new ATOM 0 HA ALA A 30 6.709 9.622 3.906 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.396 7.766 2.341 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.635 7.174 4.002 1.00 0.00 H new ATOM 0 HB3 ALA A 30 5.005 7.189 3.289 1.00 0.00 H new ATOM 400 N LEU A 31 3.551 9.601 2.975 1.00 0.00 N ATOM 401 CA LEU A 31 2.572 10.301 2.161 1.00 0.00 C ATOM 402 C LEU A 31 2.533 11.774 2.573 1.00 0.00 C ATOM 403 O LEU A 31 2.359 12.654 1.731 1.00 0.00 O ATOM 404 CB LEU A 31 1.212 9.604 2.241 1.00 0.00 C ATOM 405 CG LEU A 31 0.219 9.943 1.127 1.00 0.00 C ATOM 406 CD1 LEU A 31 -0.994 9.012 1.173 1.00 0.00 C ATOM 407 CD2 LEU A 31 -0.187 11.417 1.184 1.00 0.00 C ATOM 0 H LEU A 31 3.173 8.835 3.532 1.00 0.00 H new ATOM 0 HA LEU A 31 2.859 10.271 1.110 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.377 8.527 2.238 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.754 9.854 3.198 1.00 0.00 H new ATOM 0 HG LEU A 31 0.712 9.782 0.168 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -1.684 9.274 0.371 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -0.666 7.980 1.047 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -1.497 9.118 2.134 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.893 11.631 0.382 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.655 11.629 2.145 1.00 0.00 H new ATOM 0 HD23 LEU A 31 0.698 12.043 1.066 1.00 0.00 H new ATOM 419 N SER A 32 2.698 11.998 3.868 1.00 0.00 N ATOM 420 CA SER A 32 2.684 13.349 4.402 1.00 0.00 C ATOM 421 C SER A 32 3.948 14.096 3.970 1.00 0.00 C ATOM 422 O SER A 32 3.895 15.286 3.662 1.00 0.00 O ATOM 423 CB SER A 32 2.571 13.338 5.928 1.00 0.00 C ATOM 424 OG SER A 32 3.844 13.216 6.557 1.00 0.00 O ATOM 0 H SER A 32 2.842 11.266 4.564 1.00 0.00 H new ATOM 0 HA SER A 32 1.810 13.864 4.003 1.00 0.00 H new ATOM 0 HB2 SER A 32 2.088 14.256 6.262 1.00 0.00 H new ATOM 0 HB3 SER A 32 1.933 12.511 6.238 1.00 0.00 H new ATOM 0 HG SER A 32 4.316 12.439 6.192 1.00 0.00 H new ATOM 430 N ALA A 33 5.054 13.366 3.959 1.00 0.00 N ATOM 431 CA ALA A 33 6.328 13.945 3.569 1.00 0.00 C ATOM 432 C ALA A 33 6.129 14.818 2.329 1.00 0.00 C ATOM 433 O ALA A 33 6.623 15.943 2.271 1.00 0.00 O ATOM 434 CB ALA A 33 7.347 12.827 3.338 1.00 0.00 C ATOM 0 H ALA A 33 5.094 12.379 4.214 1.00 0.00 H new ATOM 0 HA ALA A 33 6.718 14.583 4.362 1.00 0.00 H new ATOM 0 HB1 ALA A 33 8.303 13.261 3.045 1.00 0.00 H new ATOM 0 HB2 ALA A 33 7.474 12.255 4.257 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.990 12.168 2.547 1.00 0.00 H new ATOM 440 N MET A 34 5.405 14.266 1.366 1.00 0.00 N ATOM 441 CA MET A 34 5.135 14.980 0.130 1.00 0.00 C ATOM 442 C MET A 34 3.984 15.972 0.311 1.00 0.00 C ATOM 443 O MET A 34 3.037 15.980 -0.475 1.00 0.00 O ATOM 444 CB MET A 34 4.778 13.979 -0.971 1.00 0.00 C ATOM 445 CG MET A 34 5.428 14.371 -2.299 1.00 0.00 C ATOM 446 SD MET A 34 4.277 14.118 -3.640 1.00 0.00 S ATOM 447 CE MET A 34 4.813 12.513 -4.209 1.00 0.00 C ATOM 0 H MET A 34 4.997 13.332 1.417 1.00 0.00 H new ATOM 0 HA MET A 34 6.030 15.536 -0.149 1.00 0.00 H new ATOM 0 HB2 MET A 34 5.107 12.981 -0.681 1.00 0.00 H new ATOM 0 HB3 MET A 34 3.695 13.935 -1.091 1.00 0.00 H new ATOM 0 HG2 MET A 34 5.738 15.415 -2.267 1.00 0.00 H new ATOM 0 HG3 MET A 34 6.327 13.776 -2.463 1.00 0.00 H new ATOM 0 HE1 MET A 34 4.195 12.201 -5.051 1.00 0.00 H new ATOM 0 HE2 MET A 34 5.855 12.568 -4.524 1.00 0.00 H new ATOM 0 HE3 MET A 34 4.716 11.789 -3.400 1.00 0.00 H new ATOM 457 N GLY A 35 4.103 16.785 1.350 1.00 0.00 N ATOM 458 CA GLY A 35 3.084 17.779 1.644 1.00 0.00 C ATOM 459 C GLY A 35 3.516 18.681 2.801 1.00 0.00 C ATOM 460 O GLY A 35 3.259 19.884 2.784 1.00 0.00 O ATOM 0 H GLY A 35 4.890 16.776 1.999 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.895 18.384 0.757 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.148 17.281 1.896 1.00 0.00 H new ATOM 464 N PHE A 36 4.165 18.066 3.779 1.00 0.00 N ATOM 465 CA PHE A 36 4.635 18.799 4.942 1.00 0.00 C ATOM 466 C PHE A 36 3.461 19.348 5.756 1.00 0.00 C ATOM 467 O PHE A 36 2.418 19.685 5.198 1.00 0.00 O ATOM 468 CB PHE A 36 5.473 19.970 4.425 1.00 0.00 C ATOM 469 CG PHE A 36 6.435 20.553 5.461 1.00 0.00 C ATOM 470 CD1 PHE A 36 7.523 19.838 5.856 1.00 0.00 C ATOM 471 CD2 PHE A 36 6.203 21.784 5.988 1.00 0.00 C ATOM 472 CE1 PHE A 36 8.417 20.379 6.818 1.00 0.00 C ATOM 473 CE2 PHE A 36 7.096 22.325 6.951 1.00 0.00 C ATOM 474 CZ PHE A 36 8.184 21.611 7.345 1.00 0.00 C ATOM 0 H PHE A 36 4.376 17.068 3.790 1.00 0.00 H new ATOM 0 HA PHE A 36 5.213 18.139 5.588 1.00 0.00 H new ATOM 0 HB2 PHE A 36 6.046 19.639 3.559 1.00 0.00 H new ATOM 0 HB3 PHE A 36 4.803 20.759 4.082 1.00 0.00 H new ATOM 0 HD1 PHE A 36 7.707 18.859 5.438 1.00 0.00 H new ATOM 0 HD2 PHE A 36 5.339 22.351 5.674 1.00 0.00 H new ATOM 0 HE1 PHE A 36 9.281 19.812 7.131 1.00 0.00 H new ATOM 0 HE2 PHE A 36 6.911 23.303 7.370 1.00 0.00 H new ATOM 0 HZ PHE A 36 8.863 22.022 8.077 1.00 0.00 H new ATOM 484 N THR A 37 3.670 19.419 7.062 1.00 0.00 N ATOM 485 CA THR A 37 2.642 19.921 7.958 1.00 0.00 C ATOM 486 C THR A 37 1.389 19.048 7.874 1.00 0.00 C ATOM 487 O THR A 37 1.049 18.545 6.804 1.00 0.00 O ATOM 488 CB THR A 37 2.386 21.388 7.609 1.00 0.00 C ATOM 489 OG1 THR A 37 3.528 22.071 8.118 1.00 0.00 O ATOM 490 CG2 THR A 37 1.215 21.982 8.396 1.00 0.00 C ATOM 0 H THR A 37 4.536 19.137 7.521 1.00 0.00 H new ATOM 0 HA THR A 37 2.965 19.871 8.998 1.00 0.00 H new ATOM 0 HB THR A 37 2.188 21.477 6.541 1.00 0.00 H new ATOM 0 HG1 THR A 37 4.280 21.958 7.499 1.00 0.00 H new ATOM 0 HG21 THR A 37 1.076 23.025 8.110 1.00 0.00 H new ATOM 0 HG22 THR A 37 0.307 21.421 8.175 1.00 0.00 H new ATOM 0 HG23 THR A 37 1.427 21.923 9.464 1.00 0.00 H new ATOM 498 N SER A 38 0.735 18.895 9.016 1.00 0.00 N ATOM 499 CA SER A 38 -0.474 18.092 9.085 1.00 0.00 C ATOM 500 C SER A 38 -1.046 18.127 10.504 1.00 0.00 C ATOM 501 O SER A 38 -2.261 18.167 10.686 1.00 0.00 O ATOM 502 CB SER A 38 -0.201 16.648 8.658 1.00 0.00 C ATOM 503 OG SER A 38 -1.050 16.237 7.590 1.00 0.00 O ATOM 0 H SER A 38 1.020 19.314 9.901 1.00 0.00 H new ATOM 0 HA SER A 38 -1.205 18.514 8.395 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.840 16.552 8.351 1.00 0.00 H new ATOM 0 HB3 SER A 38 -0.344 15.985 9.511 1.00 0.00 H new ATOM 0 HG SER A 38 -0.843 15.311 7.346 1.00 0.00 H new ATOM 509 N VAL A 39 -0.142 18.109 11.472 1.00 0.00 N ATOM 510 CA VAL A 39 -0.541 18.139 12.869 1.00 0.00 C ATOM 511 C VAL A 39 -1.549 19.269 13.083 1.00 0.00 C ATOM 512 O VAL A 39 -2.752 19.026 13.163 1.00 0.00 O ATOM 513 CB VAL A 39 0.694 18.262 13.764 1.00 0.00 C ATOM 514 CG1 VAL A 39 1.283 16.885 14.078 1.00 0.00 C ATOM 515 CG2 VAL A 39 1.744 19.174 13.127 1.00 0.00 C ATOM 0 H VAL A 39 0.866 18.074 11.317 1.00 0.00 H new ATOM 0 HA VAL A 39 -1.034 17.207 13.145 1.00 0.00 H new ATOM 0 HB VAL A 39 0.382 18.716 14.705 1.00 0.00 H new ATOM 0 HG11 VAL A 39 2.160 17.001 14.715 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.537 16.279 14.593 1.00 0.00 H new ATOM 0 HG13 VAL A 39 1.572 16.393 13.150 1.00 0.00 H new ATOM 0 HG21 VAL A 39 2.611 19.244 13.783 1.00 0.00 H new ATOM 0 HG22 VAL A 39 2.049 18.761 12.165 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.321 20.167 12.978 1.00 0.00 H new ATOM 525 N GLY A 40 -1.021 20.481 13.170 1.00 0.00 N ATOM 526 CA GLY A 40 -1.860 21.650 13.373 1.00 0.00 C ATOM 527 C GLY A 40 -3.205 21.491 12.661 1.00 0.00 C ATOM 528 O GLY A 40 -4.238 21.326 13.308 1.00 0.00 O ATOM 0 H GLY A 40 -0.023 20.679 13.104 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -2.025 21.803 14.440 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -1.349 22.538 12.999 1.00 0.00 H new ATOM 532 N ILE A 41 -3.147 21.545 11.338 1.00 0.00 N ATOM 533 CA ILE A 41 -4.348 21.409 10.531 1.00 0.00 C ATOM 534 C ILE A 41 -5.256 20.345 11.151 1.00 0.00 C ATOM 535 O ILE A 41 -6.449 20.575 11.339 1.00 0.00 O ATOM 536 CB ILE A 41 -3.983 21.132 9.071 1.00 0.00 C ATOM 537 CG1 ILE A 41 -5.239 20.905 8.227 1.00 0.00 C ATOM 538 CG2 ILE A 41 -3.001 19.964 8.964 1.00 0.00 C ATOM 539 CD1 ILE A 41 -5.649 22.186 7.499 1.00 0.00 C ATOM 0 H ILE A 41 -2.288 21.681 10.805 1.00 0.00 H new ATOM 0 HA ILE A 41 -4.910 22.343 10.523 1.00 0.00 H new ATOM 0 HB ILE A 41 -3.480 22.012 8.670 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -5.055 20.113 7.501 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -6.055 20.569 8.866 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -2.758 19.788 7.916 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -2.090 20.203 9.513 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.454 19.068 9.387 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -6.544 21.997 6.906 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -5.855 22.969 8.229 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.840 22.506 6.842 1.00 0.00 H new ATOM 551 N ALA A 42 -4.656 19.203 11.452 1.00 0.00 N ATOM 552 CA ALA A 42 -5.395 18.102 12.046 1.00 0.00 C ATOM 553 C ALA A 42 -6.184 18.616 13.252 1.00 0.00 C ATOM 554 O ALA A 42 -7.395 18.422 13.335 1.00 0.00 O ATOM 555 CB ALA A 42 -4.426 16.978 12.419 1.00 0.00 C ATOM 0 H ALA A 42 -3.666 19.016 11.295 1.00 0.00 H new ATOM 0 HA ALA A 42 -6.111 17.692 11.334 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -4.981 16.152 12.865 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -3.912 16.629 11.524 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -3.694 17.351 13.135 1.00 0.00 H new ATOM 561 N ALA A 43 -5.464 19.262 14.158 1.00 0.00 N ATOM 562 CA ALA A 43 -6.081 19.806 15.356 1.00 0.00 C ATOM 563 C ALA A 43 -7.229 20.735 14.956 1.00 0.00 C ATOM 564 O ALA A 43 -8.220 20.849 15.676 1.00 0.00 O ATOM 565 CB ALA A 43 -5.021 20.518 16.199 1.00 0.00 C ATOM 0 H ALA A 43 -4.459 19.421 14.086 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.501 19.007 15.968 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.484 20.926 17.097 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.244 19.808 16.482 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.579 21.328 15.619 1.00 0.00 H new ATOM 571 N SER A 44 -7.057 21.376 13.809 1.00 0.00 N ATOM 572 CA SER A 44 -8.066 22.292 13.305 1.00 0.00 C ATOM 573 C SER A 44 -9.313 21.514 12.881 1.00 0.00 C ATOM 574 O SER A 44 -10.393 21.716 13.433 1.00 0.00 O ATOM 575 CB SER A 44 -7.528 23.114 12.132 1.00 0.00 C ATOM 576 OG SER A 44 -7.612 24.515 12.378 1.00 0.00 O ATOM 0 H SER A 44 -6.234 21.279 13.214 1.00 0.00 H new ATOM 0 HA SER A 44 -8.331 22.983 14.105 1.00 0.00 H new ATOM 0 HB2 SER A 44 -6.490 22.841 11.944 1.00 0.00 H new ATOM 0 HB3 SER A 44 -8.090 22.870 11.231 1.00 0.00 H new ATOM 0 HG SER A 44 -7.257 25.004 11.607 1.00 0.00 H new ATOM 582 N SER A 45 -9.122 20.642 11.902 1.00 0.00 N ATOM 583 CA SER A 45 -10.218 19.832 11.397 1.00 0.00 C ATOM 584 C SER A 45 -10.903 19.099 12.552 1.00 0.00 C ATOM 585 O SER A 45 -12.097 19.280 12.786 1.00 0.00 O ATOM 586 CB SER A 45 -9.727 18.831 10.349 1.00 0.00 C ATOM 587 OG SER A 45 -10.103 19.213 9.029 1.00 0.00 O ATOM 0 H SER A 45 -8.225 20.479 11.445 1.00 0.00 H new ATOM 0 HA SER A 45 -10.939 20.494 10.917 1.00 0.00 H new ATOM 0 HB2 SER A 45 -8.642 18.748 10.407 1.00 0.00 H new ATOM 0 HB3 SER A 45 -10.134 17.845 10.571 1.00 0.00 H new ATOM 0 HG SER A 45 -9.770 18.550 8.389 1.00 0.00 H new ATOM 593 N ILE A 46 -10.118 18.286 13.243 1.00 0.00 N ATOM 594 CA ILE A 46 -10.633 17.524 14.368 1.00 0.00 C ATOM 595 C ILE A 46 -11.457 18.447 15.268 1.00 0.00 C ATOM 596 O ILE A 46 -12.607 18.146 15.585 1.00 0.00 O ATOM 597 CB ILE A 46 -9.494 16.809 15.098 1.00 0.00 C ATOM 598 CG1 ILE A 46 -8.935 15.663 14.252 1.00 0.00 C ATOM 599 CG2 ILE A 46 -9.943 16.334 16.481 1.00 0.00 C ATOM 600 CD1 ILE A 46 -10.016 14.622 13.955 1.00 0.00 C ATOM 0 H ILE A 46 -9.128 18.138 13.045 1.00 0.00 H new ATOM 0 HA ILE A 46 -11.301 16.736 14.021 1.00 0.00 H new ATOM 0 HB ILE A 46 -8.684 17.522 15.250 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -8.538 16.057 13.316 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -8.105 15.191 14.777 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -9.115 15.829 16.979 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.256 17.192 17.076 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -10.779 15.642 16.375 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -9.592 13.819 13.352 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -10.394 14.212 14.892 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -10.834 15.092 13.409 1.00 0.00 H new ATOM 612 N ALA A 47 -10.837 19.552 15.655 1.00 0.00 N ATOM 613 CA ALA A 47 -11.498 20.520 16.513 1.00 0.00 C ATOM 614 C ALA A 47 -12.881 20.841 15.941 1.00 0.00 C ATOM 615 O ALA A 47 -13.873 20.834 16.668 1.00 0.00 O ATOM 616 CB ALA A 47 -10.620 21.766 16.649 1.00 0.00 C ATOM 0 H ALA A 47 -9.883 19.798 15.390 1.00 0.00 H new ATOM 0 HA ALA A 47 -11.641 20.111 17.513 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -11.116 22.492 17.293 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -9.661 21.489 17.086 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -10.457 22.205 15.665 1.00 0.00 H new ATOM 622 N ALA A 48 -12.901 21.113 14.645 1.00 0.00 N ATOM 623 CA ALA A 48 -14.145 21.436 13.968 1.00 0.00 C ATOM 624 C ALA A 48 -15.077 20.223 14.016 1.00 0.00 C ATOM 625 O ALA A 48 -16.198 20.316 14.515 1.00 0.00 O ATOM 626 CB ALA A 48 -13.846 21.884 12.535 1.00 0.00 C ATOM 0 H ALA A 48 -12.076 21.116 14.046 1.00 0.00 H new ATOM 0 HA ALA A 48 -14.651 22.261 14.469 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -14.780 22.126 12.027 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -13.205 22.765 12.556 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -13.340 21.080 12.000 1.00 0.00 H new ATOM 632 N LYS A 49 -14.579 19.113 13.493 1.00 0.00 N ATOM 633 CA LYS A 49 -15.352 17.883 13.470 1.00 0.00 C ATOM 634 C LYS A 49 -16.580 18.074 12.577 1.00 0.00 C ATOM 635 O LYS A 49 -17.326 19.038 12.740 1.00 0.00 O ATOM 636 CB LYS A 49 -15.691 17.437 14.894 1.00 0.00 C ATOM 637 CG LYS A 49 -15.660 15.912 15.013 1.00 0.00 C ATOM 638 CD LYS A 49 -15.312 15.480 16.439 1.00 0.00 C ATOM 639 CE LYS A 49 -14.179 14.451 16.439 1.00 0.00 C ATOM 640 NZ LYS A 49 -12.925 15.061 16.935 1.00 0.00 N ATOM 0 H LYS A 49 -13.649 19.039 13.081 1.00 0.00 H new ATOM 0 HA LYS A 49 -14.766 17.072 13.037 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -14.980 17.875 15.595 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -16.679 17.807 15.169 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -16.630 15.502 14.732 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -14.927 15.504 14.317 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -15.017 16.351 17.025 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -16.193 15.056 16.920 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -14.451 13.602 17.067 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -14.029 14.066 15.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -12.125 14.430 16.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -12.775 15.977 16.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -12.992 15.206 17.963 1.00 0.00 H new ATOM 654 N MET A 50 -16.751 17.139 11.654 1.00 0.00 N ATOM 655 CA MET A 50 -17.876 17.193 10.735 1.00 0.00 C ATOM 656 C MET A 50 -17.921 15.945 9.851 1.00 0.00 C ATOM 657 O MET A 50 -16.930 15.224 9.737 1.00 0.00 O ATOM 658 CB MET A 50 -17.757 18.438 9.855 1.00 0.00 C ATOM 659 CG MET A 50 -16.521 18.359 8.957 1.00 0.00 C ATOM 660 SD MET A 50 -17.012 18.072 7.265 1.00 0.00 S ATOM 661 CE MET A 50 -15.903 16.739 6.842 1.00 0.00 C ATOM 0 H MET A 50 -16.130 16.340 11.523 1.00 0.00 H new ATOM 0 HA MET A 50 -18.796 17.236 11.318 1.00 0.00 H new ATOM 0 HB2 MET A 50 -18.651 18.540 9.240 1.00 0.00 H new ATOM 0 HB3 MET A 50 -17.698 19.327 10.483 1.00 0.00 H new ATOM 0 HG2 MET A 50 -15.951 19.286 9.027 1.00 0.00 H new ATOM 0 HG3 MET A 50 -15.866 17.556 9.295 1.00 0.00 H new ATOM 0 HE1 MET A 50 -15.922 16.578 5.764 1.00 0.00 H new ATOM 0 HE2 MET A 50 -14.890 16.996 7.152 1.00 0.00 H new ATOM 0 HE3 MET A 50 -16.218 15.828 7.351 1.00 0.00 H new ATOM 671 N MET A 51 -19.080 15.727 9.248 1.00 0.00 N ATOM 672 CA MET A 51 -19.267 14.579 8.377 1.00 0.00 C ATOM 673 C MET A 51 -19.799 15.009 7.009 1.00 0.00 C ATOM 674 O MET A 51 -19.198 14.702 5.981 1.00 0.00 O ATOM 675 CB MET A 51 -20.253 13.603 9.024 1.00 0.00 C ATOM 676 CG MET A 51 -19.717 12.171 8.976 1.00 0.00 C ATOM 677 SD MET A 51 -20.566 11.244 7.709 1.00 0.00 S ATOM 678 CE MET A 51 -19.497 9.820 7.597 1.00 0.00 C ATOM 0 H MET A 51 -19.900 16.326 9.345 1.00 0.00 H new ATOM 0 HA MET A 51 -18.301 14.094 8.234 1.00 0.00 H new ATOM 0 HB2 MET A 51 -20.432 13.894 10.059 1.00 0.00 H new ATOM 0 HB3 MET A 51 -21.212 13.654 8.508 1.00 0.00 H new ATOM 0 HG2 MET A 51 -18.646 12.181 8.775 1.00 0.00 H new ATOM 0 HG3 MET A 51 -19.855 11.690 9.944 1.00 0.00 H new ATOM 0 HE1 MET A 51 -19.884 9.133 6.845 1.00 0.00 H new ATOM 0 HE2 MET A 51 -18.494 10.139 7.315 1.00 0.00 H new ATOM 0 HE3 MET A 51 -19.459 9.317 8.563 1.00 0.00 H new ATOM 688 N SER A 52 -20.921 15.714 7.040 1.00 0.00 N ATOM 689 CA SER A 52 -21.540 16.190 5.815 1.00 0.00 C ATOM 690 C SER A 52 -20.668 17.271 5.173 1.00 0.00 C ATOM 691 O SER A 52 -20.247 18.213 5.844 1.00 0.00 O ATOM 692 CB SER A 52 -22.946 16.731 6.082 1.00 0.00 C ATOM 693 OG SER A 52 -23.869 16.344 5.068 1.00 0.00 O ATOM 0 H SER A 52 -21.417 15.967 7.895 1.00 0.00 H new ATOM 0 HA SER A 52 -21.629 15.349 5.128 1.00 0.00 H new ATOM 0 HB2 SER A 52 -23.296 16.368 7.048 1.00 0.00 H new ATOM 0 HB3 SER A 52 -22.910 17.819 6.143 1.00 0.00 H new ATOM 0 HG SER A 52 -24.755 16.708 5.276 1.00 0.00 H new ATOM 699 N THR A 53 -20.423 17.101 3.882 1.00 0.00 N ATOM 700 CA THR A 53 -19.609 18.050 3.143 1.00 0.00 C ATOM 701 C THR A 53 -19.933 19.481 3.577 1.00 0.00 C ATOM 702 O THR A 53 -21.089 19.899 3.539 1.00 0.00 O ATOM 703 CB THR A 53 -19.833 17.803 1.650 1.00 0.00 C ATOM 704 OG1 THR A 53 -19.086 16.620 1.378 1.00 0.00 O ATOM 705 CG2 THR A 53 -19.173 18.870 0.774 1.00 0.00 C ATOM 0 H THR A 53 -20.774 16.319 3.329 1.00 0.00 H new ATOM 0 HA THR A 53 -18.549 17.911 3.355 1.00 0.00 H new ATOM 0 HB THR A 53 -20.903 17.775 1.444 1.00 0.00 H new ATOM 0 HG1 THR A 53 -19.177 16.386 0.431 1.00 0.00 H new ATOM 0 HG21 THR A 53 -19.363 18.647 -0.276 1.00 0.00 H new ATOM 0 HG22 THR A 53 -19.587 19.848 1.018 1.00 0.00 H new ATOM 0 HG23 THR A 53 -18.098 18.876 0.955 1.00 0.00 H new ATOM 713 N ALA A 54 -18.891 20.193 3.980 1.00 0.00 N ATOM 714 CA ALA A 54 -19.050 21.569 4.421 1.00 0.00 C ATOM 715 C ALA A 54 -19.832 22.351 3.364 1.00 0.00 C ATOM 716 O ALA A 54 -20.913 22.868 3.643 1.00 0.00 O ATOM 717 CB ALA A 54 -17.674 22.179 4.698 1.00 0.00 C ATOM 0 H ALA A 54 -17.933 19.843 4.011 1.00 0.00 H new ATOM 0 HA ALA A 54 -19.618 21.611 5.350 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -17.793 23.211 5.029 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -17.171 21.604 5.476 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -17.076 22.157 3.787 1.00 0.00 H new ATOM 723 N ALA A 55 -19.255 22.414 2.173 1.00 0.00 N ATOM 724 CA ALA A 55 -19.885 23.125 1.073 1.00 0.00 C ATOM 725 C ALA A 55 -19.283 22.645 -0.250 1.00 0.00 C ATOM 726 O ALA A 55 -19.995 22.127 -1.108 1.00 0.00 O ATOM 727 CB ALA A 55 -19.718 24.632 1.277 1.00 0.00 C ATOM 0 H ALA A 55 -18.358 21.985 1.945 1.00 0.00 H new ATOM 0 HA ALA A 55 -20.955 22.917 1.043 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -20.190 25.165 0.452 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -20.187 24.926 2.216 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -18.657 24.879 1.309 1.00 0.00 H new ATOM 733 N ILE A 56 -17.977 22.836 -0.372 1.00 0.00 N ATOM 734 CA ILE A 56 -17.271 22.429 -1.575 1.00 0.00 C ATOM 735 C ILE A 56 -15.763 22.513 -1.330 1.00 0.00 C ATOM 736 O ILE A 56 -15.276 23.492 -0.767 1.00 0.00 O ATOM 737 CB ILE A 56 -17.745 23.250 -2.777 1.00 0.00 C ATOM 738 CG1 ILE A 56 -17.330 22.586 -4.092 1.00 0.00 C ATOM 739 CG2 ILE A 56 -17.250 24.694 -2.684 1.00 0.00 C ATOM 740 CD1 ILE A 56 -18.523 21.898 -4.759 1.00 0.00 C ATOM 0 H ILE A 56 -17.390 23.267 0.342 1.00 0.00 H new ATOM 0 HA ILE A 56 -17.498 21.391 -1.817 1.00 0.00 H new ATOM 0 HB ILE A 56 -18.834 23.281 -2.761 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -16.914 23.335 -4.766 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -16.544 21.855 -3.902 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -17.601 25.255 -3.550 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -17.636 25.153 -1.774 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -16.160 24.704 -2.662 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -18.201 21.434 -5.691 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -18.922 21.133 -4.092 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -19.297 22.636 -4.969 1.00 0.00 H new ATOM 752 N ALA A 57 -15.067 21.472 -1.763 1.00 0.00 N ATOM 753 CA ALA A 57 -13.625 21.415 -1.597 1.00 0.00 C ATOM 754 C ALA A 57 -13.053 20.331 -2.512 1.00 0.00 C ATOM 755 O ALA A 57 -12.696 19.248 -2.050 1.00 0.00 O ATOM 756 CB ALA A 57 -13.290 21.171 -0.124 1.00 0.00 C ATOM 0 H ALA A 57 -15.475 20.661 -2.229 1.00 0.00 H new ATOM 0 HA ALA A 57 -13.168 22.362 -1.883 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -12.208 21.128 0.001 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -13.693 21.984 0.480 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -13.730 20.227 0.198 1.00 0.00 H new ATOM 762 N ASN A 58 -12.984 20.659 -3.794 1.00 0.00 N ATOM 763 CA ASN A 58 -12.462 19.726 -4.778 1.00 0.00 C ATOM 764 C ASN A 58 -13.260 18.423 -4.714 1.00 0.00 C ATOM 765 O ASN A 58 -12.935 17.530 -3.934 1.00 0.00 O ATOM 766 CB ASN A 58 -10.994 19.396 -4.499 1.00 0.00 C ATOM 767 CG ASN A 58 -10.306 18.854 -5.754 1.00 0.00 C ATOM 768 OD1 ASN A 58 -10.309 17.665 -6.030 1.00 0.00 O ATOM 769 ND2 ASN A 58 -9.718 19.788 -6.495 1.00 0.00 N ATOM 0 H ASN A 58 -13.281 21.558 -4.174 1.00 0.00 H new ATOM 0 HA ASN A 58 -12.547 20.190 -5.761 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -10.476 20.290 -4.153 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -10.929 18.660 -3.698 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -9.231 19.527 -7.353 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -9.754 20.766 -6.206 1.00 0.00 H new ATOM 776 N GLY A 59 -14.290 18.356 -5.545 1.00 0.00 N ATOM 777 CA GLY A 59 -15.138 17.177 -5.592 1.00 0.00 C ATOM 778 C GLY A 59 -15.862 16.969 -4.261 1.00 0.00 C ATOM 779 O GLY A 59 -16.893 17.591 -4.007 1.00 0.00 O ATOM 0 H GLY A 59 -14.556 19.099 -6.191 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -15.868 17.282 -6.395 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -14.534 16.299 -5.823 1.00 0.00 H new ATOM 783 N GLY A 60 -15.295 16.091 -3.446 1.00 0.00 N ATOM 784 CA GLY A 60 -15.874 15.793 -2.147 1.00 0.00 C ATOM 785 C GLY A 60 -15.694 14.316 -1.792 1.00 0.00 C ATOM 786 O GLY A 60 -16.669 13.571 -1.707 1.00 0.00 O ATOM 0 H GLY A 60 -14.441 15.577 -3.660 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -15.404 16.414 -1.384 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -16.935 16.043 -2.152 1.00 0.00 H new ATOM 790 N GLY A 61 -14.440 13.937 -1.594 1.00 0.00 N ATOM 791 CA GLY A 61 -14.119 12.562 -1.251 1.00 0.00 C ATOM 792 C GLY A 61 -14.828 11.583 -2.188 1.00 0.00 C ATOM 793 O GLY A 61 -15.372 11.985 -3.215 1.00 0.00 O ATOM 0 H GLY A 61 -13.634 14.558 -1.665 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -13.041 12.411 -1.310 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -14.413 12.362 -0.221 1.00 0.00 H new ATOM 797 N VAL A 62 -14.799 10.316 -1.801 1.00 0.00 N ATOM 798 CA VAL A 62 -15.432 9.276 -2.594 1.00 0.00 C ATOM 799 C VAL A 62 -14.850 9.295 -4.009 1.00 0.00 C ATOM 800 O VAL A 62 -15.527 9.693 -4.957 1.00 0.00 O ATOM 801 CB VAL A 62 -16.951 9.451 -2.570 1.00 0.00 C ATOM 802 CG1 VAL A 62 -17.631 8.482 -3.539 1.00 0.00 C ATOM 803 CG2 VAL A 62 -17.500 9.283 -1.151 1.00 0.00 C ATOM 0 H VAL A 62 -14.347 9.986 -0.948 1.00 0.00 H new ATOM 0 HA VAL A 62 -15.225 8.293 -2.170 1.00 0.00 H new ATOM 0 HB VAL A 62 -17.176 10.466 -2.899 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -18.711 8.628 -3.502 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -17.274 8.670 -4.552 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -17.393 7.457 -3.255 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -18.582 9.412 -1.162 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -17.257 8.286 -0.783 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -17.052 10.031 -0.497 1.00 0.00 H new ATOM 813 N ALA A 63 -13.603 8.860 -4.108 1.00 0.00 N ATOM 814 CA ALA A 63 -12.923 8.822 -5.392 1.00 0.00 C ATOM 815 C ALA A 63 -12.830 10.241 -5.957 1.00 0.00 C ATOM 816 O ALA A 63 -13.380 11.179 -5.382 1.00 0.00 O ATOM 817 CB ALA A 63 -13.661 7.867 -6.333 1.00 0.00 C ATOM 0 H ALA A 63 -13.045 8.531 -3.320 1.00 0.00 H new ATOM 0 HA ALA A 63 -11.907 8.445 -5.277 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -13.151 7.839 -7.296 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -13.674 6.867 -5.900 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -14.684 8.214 -6.475 1.00 0.00 H new ATOM 823 N ALA A 64 -12.130 10.353 -7.076 1.00 0.00 N ATOM 824 CA ALA A 64 -11.957 11.641 -7.725 1.00 0.00 C ATOM 825 C ALA A 64 -11.197 12.582 -6.788 1.00 0.00 C ATOM 826 O ALA A 64 -11.740 13.591 -6.341 1.00 0.00 O ATOM 827 CB ALA A 64 -13.325 12.198 -8.126 1.00 0.00 C ATOM 0 H ALA A 64 -11.676 9.572 -7.550 1.00 0.00 H new ATOM 0 HA ALA A 64 -11.367 11.536 -8.636 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -13.196 13.165 -8.613 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -13.812 11.507 -8.814 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -13.943 12.320 -7.237 1.00 0.00 H new ATOM 833 N GLY A 65 -9.952 12.218 -6.519 1.00 0.00 N ATOM 834 CA GLY A 65 -9.111 13.017 -5.644 1.00 0.00 C ATOM 835 C GLY A 65 -7.632 12.681 -5.848 1.00 0.00 C ATOM 836 O GLY A 65 -7.298 11.604 -6.338 1.00 0.00 O ATOM 0 H GLY A 65 -9.505 11.380 -6.892 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -9.278 14.076 -5.841 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -9.388 12.839 -4.605 1.00 0.00 H new ATOM 840 N SER A 66 -6.786 13.625 -5.463 1.00 0.00 N ATOM 841 CA SER A 66 -5.350 13.444 -5.598 1.00 0.00 C ATOM 842 C SER A 66 -4.942 12.076 -5.047 1.00 0.00 C ATOM 843 O SER A 66 -4.123 11.381 -5.646 1.00 0.00 O ATOM 844 CB SER A 66 -4.585 14.556 -4.878 1.00 0.00 C ATOM 845 OG SER A 66 -3.571 15.125 -5.702 1.00 0.00 O ATOM 0 H SER A 66 -7.067 14.518 -5.058 1.00 0.00 H new ATOM 0 HA SER A 66 -5.096 13.493 -6.657 1.00 0.00 H new ATOM 0 HB2 SER A 66 -5.282 15.335 -4.570 1.00 0.00 H new ATOM 0 HB3 SER A 66 -4.133 14.156 -3.970 1.00 0.00 H new ATOM 0 HG SER A 66 -3.106 15.832 -5.208 1.00 0.00 H new ATOM 851 N LEU A 67 -5.532 11.731 -3.911 1.00 0.00 N ATOM 852 CA LEU A 67 -5.239 10.459 -3.273 1.00 0.00 C ATOM 853 C LEU A 67 -5.294 9.343 -4.319 1.00 0.00 C ATOM 854 O LEU A 67 -4.414 8.485 -4.363 1.00 0.00 O ATOM 855 CB LEU A 67 -6.171 10.230 -2.081 1.00 0.00 C ATOM 856 CG LEU A 67 -5.681 9.237 -1.027 1.00 0.00 C ATOM 857 CD1 LEU A 67 -5.533 7.835 -1.621 1.00 0.00 C ATOM 858 CD2 LEU A 67 -4.384 9.723 -0.376 1.00 0.00 C ATOM 0 H LEU A 67 -6.211 12.310 -3.417 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.229 10.463 -2.863 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -6.347 11.189 -1.594 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -7.133 9.883 -2.459 1.00 0.00 H new ATOM 0 HG LEU A 67 -6.433 9.176 -0.240 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -5.183 7.148 -0.850 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -6.498 7.496 -1.998 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.812 7.860 -2.438 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.057 8.998 0.370 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.613 9.832 -1.138 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.557 10.686 0.105 1.00 0.00 H new ATOM 870 N VAL A 68 -6.336 9.392 -5.136 1.00 0.00 N ATOM 871 CA VAL A 68 -6.517 8.397 -6.178 1.00 0.00 C ATOM 872 C VAL A 68 -5.201 8.214 -6.937 1.00 0.00 C ATOM 873 O VAL A 68 -4.766 7.087 -7.170 1.00 0.00 O ATOM 874 CB VAL A 68 -7.681 8.797 -7.088 1.00 0.00 C ATOM 875 CG1 VAL A 68 -7.865 7.785 -8.220 1.00 0.00 C ATOM 876 CG2 VAL A 68 -8.972 8.963 -6.285 1.00 0.00 C ATOM 0 H VAL A 68 -7.064 10.106 -5.097 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.779 7.432 -5.743 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.440 9.761 -7.537 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.698 8.093 -8.852 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.955 7.738 -8.818 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -8.073 6.802 -7.799 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.783 9.247 -6.955 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.219 8.021 -5.795 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.835 9.739 -5.532 1.00 0.00 H new ATOM 886 N ALA A 69 -4.604 9.339 -7.301 1.00 0.00 N ATOM 887 CA ALA A 69 -3.346 9.317 -8.028 1.00 0.00 C ATOM 888 C ALA A 69 -2.312 8.524 -7.226 1.00 0.00 C ATOM 889 O ALA A 69 -1.552 7.739 -7.791 1.00 0.00 O ATOM 890 CB ALA A 69 -2.893 10.751 -8.308 1.00 0.00 C ATOM 0 H ALA A 69 -4.968 10.272 -7.106 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.467 8.820 -8.991 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -1.949 10.735 -8.853 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.649 11.261 -8.906 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.758 11.281 -7.365 1.00 0.00 H new ATOM 896 N ILE A 70 -2.317 8.757 -5.922 1.00 0.00 N ATOM 897 CA ILE A 70 -1.388 8.075 -5.036 1.00 0.00 C ATOM 898 C ILE A 70 -1.671 6.572 -5.068 1.00 0.00 C ATOM 899 O ILE A 70 -0.779 5.775 -5.354 1.00 0.00 O ATOM 900 CB ILE A 70 -1.443 8.681 -3.633 1.00 0.00 C ATOM 901 CG1 ILE A 70 -0.806 10.072 -3.611 1.00 0.00 C ATOM 902 CG2 ILE A 70 -0.807 7.743 -2.605 1.00 0.00 C ATOM 903 CD1 ILE A 70 -1.627 11.038 -2.754 1.00 0.00 C ATOM 0 H ILE A 70 -2.949 9.408 -5.457 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.363 8.215 -5.378 1.00 0.00 H new ATOM 0 HB ILE A 70 -2.490 8.802 -3.354 1.00 0.00 H new ATOM 0 HG12 ILE A 70 0.209 10.005 -3.219 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -0.730 10.457 -4.628 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -0.859 8.198 -1.616 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.344 6.794 -2.597 1.00 0.00 H new ATOM 0 HG23 ILE A 70 0.236 7.567 -2.869 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.152 12.019 -2.755 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.634 11.122 -3.163 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.681 10.662 -1.732 1.00 0.00 H new ATOM 915 N LEU A 71 -2.916 6.230 -4.771 1.00 0.00 N ATOM 916 CA LEU A 71 -3.328 4.836 -4.762 1.00 0.00 C ATOM 917 C LEU A 71 -2.896 4.173 -6.072 1.00 0.00 C ATOM 918 O LEU A 71 -2.430 3.035 -6.071 1.00 0.00 O ATOM 919 CB LEU A 71 -4.827 4.722 -4.481 1.00 0.00 C ATOM 920 CG LEU A 71 -5.455 3.350 -4.735 1.00 0.00 C ATOM 921 CD1 LEU A 71 -6.576 3.066 -3.734 1.00 0.00 C ATOM 922 CD2 LEU A 71 -5.934 3.227 -6.183 1.00 0.00 C ATOM 0 H LEU A 71 -3.653 6.894 -4.535 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.834 4.298 -3.953 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.003 4.993 -3.440 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.348 5.457 -5.094 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.689 2.590 -4.583 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.005 2.085 -3.937 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.173 3.083 -2.722 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.350 3.827 -3.829 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.376 2.243 -6.338 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.679 3.996 -6.386 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.088 3.355 -6.858 1.00 0.00 H new ATOM 934 N GLN A 72 -3.066 4.914 -7.157 1.00 0.00 N ATOM 935 CA GLN A 72 -2.699 4.412 -8.471 1.00 0.00 C ATOM 936 C GLN A 72 -1.220 4.021 -8.496 1.00 0.00 C ATOM 937 O GLN A 72 -0.888 2.842 -8.611 1.00 0.00 O ATOM 938 CB GLN A 72 -3.013 5.441 -9.558 1.00 0.00 C ATOM 939 CG GLN A 72 -3.404 4.753 -10.868 1.00 0.00 C ATOM 940 CD GLN A 72 -2.173 4.197 -11.584 1.00 0.00 C ATOM 941 OE1 GLN A 72 -1.408 4.914 -12.208 1.00 0.00 O ATOM 942 NE2 GLN A 72 -2.024 2.881 -11.461 1.00 0.00 N ATOM 0 H GLN A 72 -3.453 5.858 -7.154 1.00 0.00 H new ATOM 0 HA GLN A 72 -3.293 3.522 -8.677 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -3.825 6.089 -9.227 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -2.144 6.078 -9.723 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -4.106 3.945 -10.663 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -3.917 5.463 -11.517 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -2.701 2.339 -10.924 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -1.233 2.414 -11.903 1.00 0.00 H new ATOM 951 N SER A 73 -0.372 5.033 -8.386 1.00 0.00 N ATOM 952 CA SER A 73 1.064 4.809 -8.395 1.00 0.00 C ATOM 953 C SER A 73 1.458 3.891 -7.236 1.00 0.00 C ATOM 954 O SER A 73 1.799 2.729 -7.449 1.00 0.00 O ATOM 955 CB SER A 73 1.828 6.132 -8.307 1.00 0.00 C ATOM 956 OG SER A 73 2.255 6.588 -9.588 1.00 0.00 O ATOM 0 H SER A 73 -0.651 6.009 -8.290 1.00 0.00 H new ATOM 0 HA SER A 73 1.329 4.329 -9.337 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.192 6.888 -7.847 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.695 6.007 -7.659 1.00 0.00 H new ATOM 0 HG SER A 73 2.737 7.436 -9.490 1.00 0.00 H new ATOM 962 N VAL A 74 1.398 4.448 -6.035 1.00 0.00 N ATOM 963 CA VAL A 74 1.744 3.694 -4.842 1.00 0.00 C ATOM 964 C VAL A 74 1.199 2.270 -4.968 1.00 0.00 C ATOM 965 O VAL A 74 1.793 1.326 -4.451 1.00 0.00 O ATOM 966 CB VAL A 74 1.233 4.421 -3.597 1.00 0.00 C ATOM 967 CG1 VAL A 74 -0.183 3.966 -3.238 1.00 0.00 C ATOM 968 CG2 VAL A 74 2.188 4.225 -2.418 1.00 0.00 C ATOM 0 H VAL A 74 1.115 5.413 -5.863 1.00 0.00 H new ATOM 0 HA VAL A 74 2.826 3.620 -4.738 1.00 0.00 H new ATOM 0 HB VAL A 74 1.194 5.487 -3.823 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.522 4.498 -2.349 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -0.856 4.181 -4.068 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -0.182 2.894 -3.040 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.802 4.752 -1.545 1.00 0.00 H new ATOM 0 HG22 VAL A 74 2.273 3.162 -2.192 1.00 0.00 H new ATOM 0 HG23 VAL A 74 3.170 4.621 -2.676 1.00 0.00 H new ATOM 978 N GLY A 75 0.073 2.160 -5.659 1.00 0.00 N ATOM 979 CA GLY A 75 -0.559 0.867 -5.860 1.00 0.00 C ATOM 980 C GLY A 75 0.316 -0.042 -6.726 1.00 0.00 C ATOM 981 O GLY A 75 0.634 -1.163 -6.331 1.00 0.00 O ATOM 0 H GLY A 75 -0.418 2.945 -6.087 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -0.740 0.393 -4.895 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.530 1.003 -6.335 1.00 0.00 H new ATOM 985 N ALA A 76 0.680 0.475 -7.890 1.00 0.00 N ATOM 986 CA ALA A 76 1.512 -0.277 -8.815 1.00 0.00 C ATOM 987 C ALA A 76 2.932 -0.373 -8.254 1.00 0.00 C ATOM 988 O ALA A 76 3.421 -1.467 -7.977 1.00 0.00 O ATOM 989 CB ALA A 76 1.472 0.388 -10.192 1.00 0.00 C ATOM 0 H ALA A 76 0.414 1.405 -8.214 1.00 0.00 H new ATOM 0 HA ALA A 76 1.135 -1.293 -8.932 1.00 0.00 H new ATOM 0 HB1 ALA A 76 2.096 -0.175 -10.886 1.00 0.00 H new ATOM 0 HB2 ALA A 76 0.445 0.405 -10.558 1.00 0.00 H new ATOM 0 HB3 ALA A 76 1.846 1.409 -10.114 1.00 0.00 H new ATOM 995 N ALA A 77 3.554 0.787 -8.103 1.00 0.00 N ATOM 996 CA ALA A 77 4.909 0.847 -7.581 1.00 0.00 C ATOM 997 C ALA A 77 4.998 0.002 -6.309 1.00 0.00 C ATOM 998 O ALA A 77 5.914 -0.806 -6.159 1.00 0.00 O ATOM 999 CB ALA A 77 5.298 2.307 -7.339 1.00 0.00 C ATOM 0 H ALA A 77 3.145 1.693 -8.333 1.00 0.00 H new ATOM 0 HA ALA A 77 5.617 0.436 -8.301 1.00 0.00 H new ATOM 0 HB1 ALA A 77 6.314 2.353 -6.947 1.00 0.00 H new ATOM 0 HB2 ALA A 77 5.246 2.858 -8.278 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.611 2.752 -6.619 1.00 0.00 H new ATOM 1005 N GLY A 78 4.034 0.216 -5.425 1.00 0.00 N ATOM 1006 CA GLY A 78 3.993 -0.517 -4.171 1.00 0.00 C ATOM 1007 C GLY A 78 3.898 -2.024 -4.419 1.00 0.00 C ATOM 1008 O GLY A 78 4.867 -2.753 -4.214 1.00 0.00 O ATOM 0 H GLY A 78 3.276 0.886 -5.552 1.00 0.00 H new ATOM 0 HA2 GLY A 78 4.887 -0.297 -3.588 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.138 -0.187 -3.581 1.00 0.00 H new ATOM 1012 N LEU A 79 2.721 -2.446 -4.857 1.00 0.00 N ATOM 1013 CA LEU A 79 2.487 -3.853 -5.136 1.00 0.00 C ATOM 1014 C LEU A 79 3.713 -4.440 -5.837 1.00 0.00 C ATOM 1015 O LEU A 79 4.046 -5.608 -5.639 1.00 0.00 O ATOM 1016 CB LEU A 79 1.185 -4.035 -5.918 1.00 0.00 C ATOM 1017 CG LEU A 79 0.753 -5.480 -6.175 1.00 0.00 C ATOM 1018 CD1 LEU A 79 0.037 -6.063 -4.955 1.00 0.00 C ATOM 1019 CD2 LEU A 79 -0.100 -5.580 -7.442 1.00 0.00 C ATOM 0 H LEU A 79 1.919 -1.839 -5.026 1.00 0.00 H new ATOM 0 HA LEU A 79 2.354 -4.409 -4.208 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.386 -3.529 -5.377 1.00 0.00 H new ATOM 0 HB3 LEU A 79 1.288 -3.531 -6.879 1.00 0.00 H new ATOM 0 HG LEU A 79 1.648 -6.080 -6.341 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.260 -7.091 -5.164 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.709 -6.046 -4.097 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.849 -5.468 -4.734 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.394 -6.617 -7.602 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.992 -4.963 -7.330 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.477 -5.231 -8.298 1.00 0.00 H new ATOM 1031 N SER A 80 4.351 -3.605 -6.643 1.00 0.00 N ATOM 1032 CA SER A 80 5.533 -4.027 -7.375 1.00 0.00 C ATOM 1033 C SER A 80 6.652 -4.392 -6.397 1.00 0.00 C ATOM 1034 O SER A 80 6.874 -5.568 -6.114 1.00 0.00 O ATOM 1035 CB SER A 80 6.004 -2.935 -8.337 1.00 0.00 C ATOM 1036 OG SER A 80 7.425 -2.885 -8.434 1.00 0.00 O ATOM 0 H SER A 80 4.072 -2.638 -6.806 1.00 0.00 H new ATOM 0 HA SER A 80 5.274 -4.906 -7.965 1.00 0.00 H new ATOM 0 HB2 SER A 80 5.579 -3.114 -9.325 1.00 0.00 H new ATOM 0 HB3 SER A 80 5.629 -1.969 -8.000 1.00 0.00 H new ATOM 0 HG SER A 80 7.753 -2.066 -8.007 1.00 0.00 H new ATOM 1042 N VAL A 81 7.326 -3.361 -5.908 1.00 0.00 N ATOM 1043 CA VAL A 81 8.416 -3.559 -4.968 1.00 0.00 C ATOM 1044 C VAL A 81 8.002 -4.599 -3.925 1.00 0.00 C ATOM 1045 O VAL A 81 8.850 -5.292 -3.364 1.00 0.00 O ATOM 1046 CB VAL A 81 8.822 -2.220 -4.349 1.00 0.00 C ATOM 1047 CG1 VAL A 81 7.961 -1.899 -3.125 1.00 0.00 C ATOM 1048 CG2 VAL A 81 10.309 -2.209 -3.991 1.00 0.00 C ATOM 0 H VAL A 81 7.138 -2.387 -6.145 1.00 0.00 H new ATOM 0 HA VAL A 81 9.297 -3.946 -5.480 1.00 0.00 H new ATOM 0 HB VAL A 81 8.651 -1.442 -5.093 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.270 -0.942 -2.704 1.00 0.00 H new ATOM 0 HG12 VAL A 81 6.914 -1.844 -3.421 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.086 -2.682 -2.377 1.00 0.00 H new ATOM 0 HG21 VAL A 81 10.571 -1.246 -3.553 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.516 -3.002 -3.273 1.00 0.00 H new ATOM 0 HG23 VAL A 81 10.901 -2.371 -4.892 1.00 0.00 H new ATOM 1058 N THR A 82 6.699 -4.675 -3.697 1.00 0.00 N ATOM 1059 CA THR A 82 6.163 -5.619 -2.732 1.00 0.00 C ATOM 1060 C THR A 82 6.452 -7.056 -3.172 1.00 0.00 C ATOM 1061 O THR A 82 7.414 -7.669 -2.711 1.00 0.00 O ATOM 1062 CB THR A 82 4.671 -5.325 -2.561 1.00 0.00 C ATOM 1063 OG1 THR A 82 4.633 -4.266 -1.609 1.00 0.00 O ATOM 1064 CG2 THR A 82 3.923 -6.470 -1.875 1.00 0.00 C ATOM 0 H THR A 82 5.999 -4.098 -4.164 1.00 0.00 H new ATOM 0 HA THR A 82 6.645 -5.507 -1.761 1.00 0.00 H new ATOM 0 HB THR A 82 4.225 -5.134 -3.537 1.00 0.00 H new ATOM 0 HG1 THR A 82 4.710 -3.406 -2.073 1.00 0.00 H new ATOM 0 HG21 THR A 82 2.869 -6.210 -1.779 1.00 0.00 H new ATOM 0 HG22 THR A 82 4.020 -7.377 -2.472 1.00 0.00 H new ATOM 0 HG23 THR A 82 4.347 -6.640 -0.885 1.00 0.00 H new ATOM 1072 N SER A 83 5.602 -7.551 -4.060 1.00 0.00 N ATOM 1073 CA SER A 83 5.755 -8.903 -4.568 1.00 0.00 C ATOM 1074 C SER A 83 7.217 -9.162 -4.937 1.00 0.00 C ATOM 1075 O SER A 83 7.786 -10.183 -4.554 1.00 0.00 O ATOM 1076 CB SER A 83 4.852 -9.142 -5.780 1.00 0.00 C ATOM 1077 OG SER A 83 3.491 -8.820 -5.504 1.00 0.00 O ATOM 0 H SER A 83 4.805 -7.040 -4.440 1.00 0.00 H new ATOM 0 HA SER A 83 5.456 -9.598 -3.783 1.00 0.00 H new ATOM 0 HB2 SER A 83 5.204 -8.541 -6.618 1.00 0.00 H new ATOM 0 HB3 SER A 83 4.923 -10.186 -6.085 1.00 0.00 H new ATOM 0 HG SER A 83 2.947 -8.984 -6.303 1.00 0.00 H new ATOM 1083 N LYS A 84 7.783 -8.220 -5.677 1.00 0.00 N ATOM 1084 CA LYS A 84 9.168 -8.333 -6.101 1.00 0.00 C ATOM 1085 C LYS A 84 10.045 -8.647 -4.888 1.00 0.00 C ATOM 1086 O LYS A 84 10.785 -9.630 -4.890 1.00 0.00 O ATOM 1087 CB LYS A 84 9.599 -7.078 -6.864 1.00 0.00 C ATOM 1088 CG LYS A 84 9.818 -7.386 -8.346 1.00 0.00 C ATOM 1089 CD LYS A 84 8.542 -7.137 -9.152 1.00 0.00 C ATOM 1090 CE LYS A 84 8.827 -6.266 -10.377 1.00 0.00 C ATOM 1091 NZ LYS A 84 7.630 -6.179 -11.242 1.00 0.00 N ATOM 0 H LYS A 84 7.308 -7.375 -5.994 1.00 0.00 H new ATOM 0 HA LYS A 84 9.285 -9.160 -6.801 1.00 0.00 H new ATOM 0 HB2 LYS A 84 8.838 -6.305 -6.758 1.00 0.00 H new ATOM 0 HB3 LYS A 84 10.518 -6.683 -6.431 1.00 0.00 H new ATOM 0 HG2 LYS A 84 10.625 -6.765 -8.735 1.00 0.00 H new ATOM 0 HG3 LYS A 84 10.130 -8.424 -8.463 1.00 0.00 H new ATOM 0 HD2 LYS A 84 8.117 -8.089 -9.470 1.00 0.00 H new ATOM 0 HD3 LYS A 84 7.798 -6.651 -8.521 1.00 0.00 H new ATOM 0 HE2 LYS A 84 9.126 -5.267 -10.059 1.00 0.00 H new ATOM 0 HE3 LYS A 84 9.661 -6.684 -10.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 7.841 -5.584 -12.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 7.362 -7.132 -11.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 6.844 -5.760 -10.706 1.00 0.00 H new ATOM 1105 N VAL A 85 9.934 -7.794 -3.880 1.00 0.00 N ATOM 1106 CA VAL A 85 10.708 -7.968 -2.663 1.00 0.00 C ATOM 1107 C VAL A 85 10.423 -9.352 -2.077 1.00 0.00 C ATOM 1108 O VAL A 85 11.283 -9.943 -1.425 1.00 0.00 O ATOM 1109 CB VAL A 85 10.407 -6.831 -1.685 1.00 0.00 C ATOM 1110 CG1 VAL A 85 10.791 -7.221 -0.256 1.00 0.00 C ATOM 1111 CG2 VAL A 85 11.111 -5.541 -2.110 1.00 0.00 C ATOM 0 H VAL A 85 9.319 -6.980 -3.882 1.00 0.00 H new ATOM 0 HA VAL A 85 11.775 -7.919 -2.878 1.00 0.00 H new ATOM 0 HB VAL A 85 9.333 -6.648 -1.705 1.00 0.00 H new ATOM 0 HG11 VAL A 85 10.567 -6.395 0.419 1.00 0.00 H new ATOM 0 HG12 VAL A 85 10.223 -8.101 0.046 1.00 0.00 H new ATOM 0 HG13 VAL A 85 11.857 -7.445 -0.214 1.00 0.00 H new ATOM 0 HG21 VAL A 85 10.880 -4.749 -1.398 1.00 0.00 H new ATOM 0 HG22 VAL A 85 12.188 -5.705 -2.134 1.00 0.00 H new ATOM 0 HG23 VAL A 85 10.767 -5.248 -3.102 1.00 0.00 H new ATOM 1121 N ILE A 86 9.213 -9.829 -2.329 1.00 0.00 N ATOM 1122 CA ILE A 86 8.804 -11.133 -1.835 1.00 0.00 C ATOM 1123 C ILE A 86 9.412 -12.223 -2.720 1.00 0.00 C ATOM 1124 O ILE A 86 10.423 -12.826 -2.363 1.00 0.00 O ATOM 1125 CB ILE A 86 7.280 -11.210 -1.723 1.00 0.00 C ATOM 1126 CG1 ILE A 86 6.761 -10.257 -0.644 1.00 0.00 C ATOM 1127 CG2 ILE A 86 6.820 -12.650 -1.486 1.00 0.00 C ATOM 1128 CD1 ILE A 86 5.235 -10.158 -0.689 1.00 0.00 C ATOM 0 H ILE A 86 8.502 -9.336 -2.869 1.00 0.00 H new ATOM 0 HA ILE A 86 9.183 -11.294 -0.826 1.00 0.00 H new ATOM 0 HB ILE A 86 6.851 -10.887 -2.671 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.078 -10.607 0.338 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.198 -9.268 -0.786 1.00 0.00 H new ATOM 0 HG21 ILE A 86 5.733 -12.677 -1.410 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.141 -13.276 -2.318 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.258 -13.024 -0.560 1.00 0.00 H new ATOM 0 HD11 ILE A 86 4.892 -9.475 0.088 1.00 0.00 H new ATOM 0 HD12 ILE A 86 4.923 -9.785 -1.664 1.00 0.00 H new ATOM 0 HD13 ILE A 86 4.801 -11.144 -0.522 1.00 0.00 H new ATOM 1140 N GLY A 87 8.769 -12.443 -3.857 1.00 0.00 N ATOM 1141 CA GLY A 87 9.233 -13.450 -4.796 1.00 0.00 C ATOM 1142 C GLY A 87 8.218 -13.660 -5.922 1.00 0.00 C ATOM 1143 O GLY A 87 8.579 -13.654 -7.097 1.00 0.00 O ATOM 0 H GLY A 87 7.930 -11.941 -4.149 1.00 0.00 H new ATOM 0 HA2 GLY A 87 10.191 -13.145 -5.217 1.00 0.00 H new ATOM 0 HA3 GLY A 87 9.400 -14.391 -4.272 1.00 0.00 H new ATOM 1147 N GLY A 88 6.968 -13.842 -5.521 1.00 0.00 N ATOM 1148 CA GLY A 88 5.898 -14.053 -6.482 1.00 0.00 C ATOM 1149 C GLY A 88 5.002 -15.218 -6.056 1.00 0.00 C ATOM 1150 O GLY A 88 4.695 -16.096 -6.861 1.00 0.00 O ATOM 0 H GLY A 88 6.672 -13.848 -4.545 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.302 -13.145 -6.573 1.00 0.00 H new ATOM 0 HA3 GLY A 88 6.322 -14.256 -7.465 1.00 0.00 H new ATOM 1154 N PHE A 89 4.607 -15.188 -4.792 1.00 0.00 N ATOM 1155 CA PHE A 89 3.753 -16.230 -4.249 1.00 0.00 C ATOM 1156 C PHE A 89 4.279 -17.619 -4.619 1.00 0.00 C ATOM 1157 O PHE A 89 3.971 -18.138 -5.691 1.00 0.00 O ATOM 1158 CB PHE A 89 2.367 -16.041 -4.871 1.00 0.00 C ATOM 1159 CG PHE A 89 1.421 -15.180 -4.031 1.00 0.00 C ATOM 1160 CD1 PHE A 89 1.729 -13.880 -3.778 1.00 0.00 C ATOM 1161 CD2 PHE A 89 0.272 -15.716 -3.538 1.00 0.00 C ATOM 1162 CE1 PHE A 89 0.850 -13.081 -2.999 1.00 0.00 C ATOM 1163 CE2 PHE A 89 -0.606 -14.917 -2.759 1.00 0.00 C ATOM 1164 CZ PHE A 89 -0.298 -13.617 -2.506 1.00 0.00 C ATOM 0 H PHE A 89 4.863 -14.458 -4.128 1.00 0.00 H new ATOM 0 HA PHE A 89 3.725 -16.159 -3.162 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.480 -15.585 -5.854 1.00 0.00 H new ATOM 0 HB3 PHE A 89 1.912 -17.020 -5.024 1.00 0.00 H new ATOM 0 HD1 PHE A 89 2.642 -13.455 -4.169 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.028 -16.749 -3.739 1.00 0.00 H new ATOM 0 HE1 PHE A 89 1.094 -12.048 -2.798 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.518 -15.342 -2.367 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.966 -13.010 -1.913 1.00 0.00 H new ATOM 1174 N ALA A 90 5.063 -18.180 -3.711 1.00 0.00 N ATOM 1175 CA ALA A 90 5.635 -19.498 -3.928 1.00 0.00 C ATOM 1176 C ALA A 90 6.246 -20.006 -2.620 1.00 0.00 C ATOM 1177 O ALA A 90 7.359 -20.529 -2.613 1.00 0.00 O ATOM 1178 CB ALA A 90 6.660 -19.429 -5.062 1.00 0.00 C ATOM 0 H ALA A 90 5.316 -17.746 -2.823 1.00 0.00 H new ATOM 0 HA ALA A 90 4.863 -20.207 -4.228 1.00 0.00 H new ATOM 0 HB1 ALA A 90 7.089 -20.418 -5.225 1.00 0.00 H new ATOM 0 HB2 ALA A 90 6.170 -19.091 -5.975 1.00 0.00 H new ATOM 0 HB3 ALA A 90 7.452 -18.729 -4.795 1.00 0.00 H new ATOM 1184 N GLY A 91 5.491 -19.834 -1.546 1.00 0.00 N ATOM 1185 CA GLY A 91 5.944 -20.268 -0.235 1.00 0.00 C ATOM 1186 C GLY A 91 7.060 -19.362 0.287 1.00 0.00 C ATOM 1187 O GLY A 91 6.843 -18.568 1.201 1.00 0.00 O ATOM 0 H GLY A 91 4.568 -19.400 -1.556 1.00 0.00 H new ATOM 0 HA2 GLY A 91 5.107 -20.260 0.464 1.00 0.00 H new ATOM 0 HA3 GLY A 91 6.302 -21.296 -0.292 1.00 0.00 H new ATOM 1191 N THR A 92 8.231 -19.511 -0.316 1.00 0.00 N ATOM 1192 CA THR A 92 9.382 -18.716 0.077 1.00 0.00 C ATOM 1193 C THR A 92 8.974 -17.257 0.289 1.00 0.00 C ATOM 1194 O THR A 92 8.107 -16.742 -0.415 1.00 0.00 O ATOM 1195 CB THR A 92 10.466 -18.896 -0.987 1.00 0.00 C ATOM 1196 OG1 THR A 92 11.686 -18.716 -0.273 1.00 0.00 O ATOM 1197 CG2 THR A 92 10.468 -17.766 -2.018 1.00 0.00 C ATOM 0 H THR A 92 8.407 -20.171 -1.074 1.00 0.00 H new ATOM 0 HA THR A 92 9.786 -19.050 1.033 1.00 0.00 H new ATOM 0 HB THR A 92 10.322 -19.850 -1.494 1.00 0.00 H new ATOM 0 HG1 THR A 92 12.443 -18.818 -0.887 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.256 -17.943 -2.750 1.00 0.00 H new ATOM 0 HG22 THR A 92 9.503 -17.734 -2.524 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.646 -16.815 -1.515 1.00 0.00 H new ATOM 1205 N ALA A 93 9.620 -16.631 1.263 1.00 0.00 N ATOM 1206 CA ALA A 93 9.336 -15.241 1.576 1.00 0.00 C ATOM 1207 C ALA A 93 7.863 -15.101 1.966 1.00 0.00 C ATOM 1208 O ALA A 93 6.992 -15.032 1.100 1.00 0.00 O ATOM 1209 CB ALA A 93 9.708 -14.361 0.381 1.00 0.00 C ATOM 0 H ALA A 93 10.339 -17.061 1.845 1.00 0.00 H new ATOM 0 HA ALA A 93 9.935 -14.909 2.424 1.00 0.00 H new ATOM 0 HB1 ALA A 93 9.495 -13.318 0.617 1.00 0.00 H new ATOM 0 HB2 ALA A 93 10.770 -14.474 0.163 1.00 0.00 H new ATOM 0 HB3 ALA A 93 9.125 -14.663 -0.489 1.00 0.00 H new ATOM 1215 N LEU A 94 7.630 -15.065 3.270 1.00 0.00 N ATOM 1216 CA LEU A 94 6.277 -14.935 3.785 1.00 0.00 C ATOM 1217 C LEU A 94 6.322 -14.267 5.161 1.00 0.00 C ATOM 1218 O LEU A 94 5.583 -13.318 5.418 1.00 0.00 O ATOM 1219 CB LEU A 94 5.570 -16.292 3.783 1.00 0.00 C ATOM 1220 CG LEU A 94 6.285 -17.422 4.527 1.00 0.00 C ATOM 1221 CD1 LEU A 94 5.984 -17.368 6.026 1.00 0.00 C ATOM 1222 CD2 LEU A 94 5.938 -18.783 3.921 1.00 0.00 C ATOM 0 H LEU A 94 8.355 -15.124 3.985 1.00 0.00 H new ATOM 0 HA LEU A 94 5.683 -14.291 3.137 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.580 -16.164 4.221 1.00 0.00 H new ATOM 0 HB3 LEU A 94 5.423 -16.601 2.748 1.00 0.00 H new ATOM 0 HG LEU A 94 7.360 -17.282 4.409 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.504 -18.182 6.531 1.00 0.00 H new ATOM 0 HD12 LEU A 94 6.322 -16.414 6.431 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.910 -17.469 6.185 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.459 -19.568 4.468 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.862 -18.947 3.987 1.00 0.00 H new ATOM 0 HD23 LEU A 94 6.245 -18.805 2.875 1.00 0.00 H new ATOM 1234 N GLY A 95 7.195 -14.790 6.009 1.00 0.00 N ATOM 1235 CA GLY A 95 7.346 -14.256 7.352 1.00 0.00 C ATOM 1236 C GLY A 95 8.666 -13.494 7.494 1.00 0.00 C ATOM 1237 O GLY A 95 8.705 -12.277 7.325 1.00 0.00 O ATOM 0 H GLY A 95 7.805 -15.578 5.792 1.00 0.00 H new ATOM 0 HA2 GLY A 95 6.512 -13.592 7.579 1.00 0.00 H new ATOM 0 HA3 GLY A 95 7.312 -15.069 8.077 1.00 0.00 H new ATOM 1241 N ALA A 96 9.714 -14.243 7.804 1.00 0.00 N ATOM 1242 CA ALA A 96 11.031 -13.654 7.971 1.00 0.00 C ATOM 1243 C ALA A 96 11.349 -12.775 6.760 1.00 0.00 C ATOM 1244 O ALA A 96 10.599 -12.760 5.785 1.00 0.00 O ATOM 1245 CB ALA A 96 12.065 -14.764 8.173 1.00 0.00 C ATOM 0 H ALA A 96 9.677 -15.253 7.944 1.00 0.00 H new ATOM 0 HA ALA A 96 11.058 -13.018 8.856 1.00 0.00 H new ATOM 0 HB1 ALA A 96 13.053 -14.322 8.298 1.00 0.00 H new ATOM 0 HB2 ALA A 96 11.810 -15.341 9.062 1.00 0.00 H new ATOM 0 HB3 ALA A 96 12.069 -15.420 7.303 1.00 0.00 H new ATOM 1251 N TRP A 97 12.462 -12.063 6.862 1.00 0.00 N ATOM 1252 CA TRP A 97 12.888 -11.183 5.787 1.00 0.00 C ATOM 1253 C TRP A 97 14.060 -11.851 5.065 1.00 0.00 C ATOM 1254 O TRP A 97 14.685 -12.765 5.602 1.00 0.00 O ATOM 1255 CB TRP A 97 13.231 -9.791 6.322 1.00 0.00 C ATOM 1256 CG TRP A 97 14.732 -9.504 6.395 1.00 0.00 C ATOM 1257 CD1 TRP A 97 15.539 -9.074 5.415 1.00 0.00 C ATOM 1258 CD2 TRP A 97 15.579 -9.646 7.555 1.00 0.00 C ATOM 1259 NE1 TRP A 97 16.838 -8.929 5.856 1.00 0.00 N ATOM 1260 CE2 TRP A 97 16.863 -9.287 7.199 1.00 0.00 C ATOM 1261 CE3 TRP A 97 15.270 -10.063 8.862 1.00 0.00 C ATOM 1262 CZ2 TRP A 97 17.941 -9.310 8.093 1.00 0.00 C ATOM 1263 CZ3 TRP A 97 16.358 -10.080 9.743 1.00 0.00 C ATOM 1264 CH2 TRP A 97 17.657 -9.722 9.400 1.00 0.00 C ATOM 0 H TRP A 97 13.081 -12.078 7.672 1.00 0.00 H new ATOM 0 HA TRP A 97 12.080 -11.029 5.071 1.00 0.00 H new ATOM 0 HB2 TRP A 97 12.759 -9.042 5.686 1.00 0.00 H new ATOM 0 HB3 TRP A 97 12.802 -9.680 7.318 1.00 0.00 H new ATOM 0 HD1 TRP A 97 15.213 -8.867 4.406 1.00 0.00 H new ATOM 0 HE1 TRP A 97 17.634 -8.617 5.299 1.00 0.00 H new ATOM 0 HE3 TRP A 97 14.272 -10.348 9.162 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 18.938 -9.025 7.790 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 16.175 -10.393 10.760 1.00 0.00 H new ATOM 0 HH2 TRP A 97 18.444 -9.762 10.139 1.00 0.00 H new ATOM 1275 N LEU A 98 14.323 -11.369 3.859 1.00 0.00 N ATOM 1276 CA LEU A 98 15.408 -11.909 3.058 1.00 0.00 C ATOM 1277 C LEU A 98 15.130 -13.383 2.756 1.00 0.00 C ATOM 1278 O LEU A 98 14.585 -14.100 3.593 1.00 0.00 O ATOM 1279 CB LEU A 98 16.753 -11.666 3.746 1.00 0.00 C ATOM 1280 CG LEU A 98 17.994 -12.121 2.974 1.00 0.00 C ATOM 1281 CD1 LEU A 98 18.878 -10.928 2.606 1.00 0.00 C ATOM 1282 CD2 LEU A 98 18.764 -13.188 3.753 1.00 0.00 C ATOM 0 H LEU A 98 13.803 -10.610 3.417 1.00 0.00 H new ATOM 0 HA LEU A 98 15.467 -11.393 2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 98 16.847 -10.599 3.949 1.00 0.00 H new ATOM 0 HB3 LEU A 98 16.743 -12.175 4.710 1.00 0.00 H new ATOM 0 HG LEU A 98 17.667 -12.579 2.040 1.00 0.00 H new ATOM 0 HD11 LEU A 98 19.753 -11.279 2.058 1.00 0.00 H new ATOM 0 HD12 LEU A 98 18.313 -10.235 1.982 1.00 0.00 H new ATOM 0 HD13 LEU A 98 19.199 -10.419 3.515 1.00 0.00 H new ATOM 0 HD21 LEU A 98 19.641 -13.494 3.182 1.00 0.00 H new ATOM 0 HD22 LEU A 98 19.080 -12.780 4.713 1.00 0.00 H new ATOM 0 HD23 LEU A 98 18.121 -14.052 3.920 1.00 0.00 H new ATOM 1294 N GLY A 99 15.517 -13.791 1.556 1.00 0.00 N ATOM 1295 CA GLY A 99 15.315 -15.166 1.133 1.00 0.00 C ATOM 1296 C GLY A 99 14.938 -15.234 -0.349 1.00 0.00 C ATOM 1297 O GLY A 99 13.810 -14.916 -0.721 1.00 0.00 O ATOM 0 H GLY A 99 15.969 -13.194 0.864 1.00 0.00 H new ATOM 0 HA2 GLY A 99 16.224 -15.741 1.307 1.00 0.00 H new ATOM 0 HA3 GLY A 99 14.528 -15.623 1.733 1.00 0.00 H new ATOM 1301 N SER A 100 15.905 -15.650 -1.154 1.00 0.00 N ATOM 1302 CA SER A 100 15.689 -15.764 -2.586 1.00 0.00 C ATOM 1303 C SER A 100 14.942 -17.061 -2.901 1.00 0.00 C ATOM 1304 O SER A 100 15.080 -18.051 -2.185 1.00 0.00 O ATOM 1305 CB SER A 100 17.014 -15.716 -3.349 1.00 0.00 C ATOM 1306 OG SER A 100 17.900 -16.756 -2.946 1.00 0.00 O ATOM 0 H SER A 100 16.840 -15.912 -0.841 1.00 0.00 H new ATOM 0 HA SER A 100 15.084 -14.916 -2.909 1.00 0.00 H new ATOM 0 HB2 SER A 100 16.820 -15.799 -4.418 1.00 0.00 H new ATOM 0 HB3 SER A 100 17.491 -14.750 -3.186 1.00 0.00 H new ATOM 0 HG SER A 100 18.734 -16.692 -3.457 1.00 0.00 H new ATOM 1312 N PRO A 101 14.146 -17.013 -4.003 1.00 0.00 N ATOM 1313 CA PRO A 101 13.377 -18.173 -4.422 1.00 0.00 C ATOM 1314 C PRO A 101 14.279 -19.221 -5.077 1.00 0.00 C ATOM 1315 O PRO A 101 15.316 -18.885 -5.646 1.00 0.00 O ATOM 1316 CB PRO A 101 12.321 -17.624 -5.368 1.00 0.00 C ATOM 1317 CG PRO A 101 12.823 -16.258 -5.806 1.00 0.00 C ATOM 1318 CD PRO A 101 13.958 -15.858 -4.876 1.00 0.00 C ATOM 0 HA PRO A 101 12.911 -18.694 -3.585 1.00 0.00 H new ATOM 0 HB2 PRO A 101 12.184 -18.283 -6.225 1.00 0.00 H new ATOM 0 HB3 PRO A 101 11.355 -17.544 -4.870 1.00 0.00 H new ATOM 0 HG2 PRO A 101 13.170 -16.292 -6.839 1.00 0.00 H new ATOM 0 HG3 PRO A 101 12.018 -15.524 -5.764 1.00 0.00 H new ATOM 0 HD2 PRO A 101 14.866 -15.632 -5.434 1.00 0.00 H new ATOM 0 HD3 PRO A 101 13.705 -14.966 -4.303 1.00 0.00 H new ATOM 1326 N PRO A 102 13.839 -20.504 -4.971 1.00 0.00 N ATOM 1327 CA PRO A 102 14.595 -21.604 -5.546 1.00 0.00 C ATOM 1328 C PRO A 102 14.440 -21.640 -7.067 1.00 0.00 C ATOM 1329 O PRO A 102 13.990 -22.639 -7.626 1.00 0.00 O ATOM 1330 CB PRO A 102 14.054 -22.851 -4.864 1.00 0.00 C ATOM 1331 CG PRO A 102 12.707 -22.456 -4.281 1.00 0.00 C ATOM 1332 CD PRO A 102 12.615 -20.939 -4.304 1.00 0.00 C ATOM 0 HA PRO A 102 15.668 -21.509 -5.381 1.00 0.00 H new ATOM 0 HB2 PRO A 102 13.947 -23.670 -5.575 1.00 0.00 H new ATOM 0 HB3 PRO A 102 14.732 -23.194 -4.083 1.00 0.00 H new ATOM 0 HG2 PRO A 102 11.896 -22.896 -4.861 1.00 0.00 H new ATOM 0 HG3 PRO A 102 12.608 -22.829 -3.262 1.00 0.00 H new ATOM 0 HD2 PRO A 102 11.729 -20.604 -4.844 1.00 0.00 H new ATOM 0 HD3 PRO A 102 12.547 -20.531 -3.296 1.00 0.00 H new ATOM 1340 N SER A 103 14.820 -20.537 -7.695 1.00 0.00 N ATOM 1341 CA SER A 103 14.729 -20.429 -9.141 1.00 0.00 C ATOM 1342 C SER A 103 15.336 -19.104 -9.607 1.00 0.00 C ATOM 1343 O SER A 103 14.835 -18.034 -9.265 1.00 0.00 O ATOM 1344 CB SER A 103 13.278 -20.542 -9.612 1.00 0.00 C ATOM 1345 OG SER A 103 12.423 -19.630 -8.929 1.00 0.00 O ATOM 0 H SER A 103 15.192 -19.710 -7.228 1.00 0.00 H new ATOM 0 HA SER A 103 15.291 -21.253 -9.581 1.00 0.00 H new ATOM 0 HB2 SER A 103 13.229 -20.351 -10.684 1.00 0.00 H new ATOM 0 HB3 SER A 103 12.923 -21.560 -9.453 1.00 0.00 H new ATOM 0 HG SER A 103 12.889 -18.777 -8.802 1.00 0.00 H new ATOM 1351 N SER A 104 16.407 -19.219 -10.379 1.00 0.00 N ATOM 1352 CA SER A 104 17.087 -18.043 -10.895 1.00 0.00 C ATOM 1353 C SER A 104 16.282 -17.435 -12.045 1.00 0.00 C ATOM 1354 O SER A 104 15.307 -16.721 -11.815 1.00 0.00 O ATOM 1355 CB SER A 104 18.503 -18.387 -11.362 1.00 0.00 C ATOM 1356 OG SER A 104 19.497 -17.719 -10.589 1.00 0.00 O ATOM 0 H SER A 104 16.820 -20.108 -10.659 1.00 0.00 H new ATOM 0 HA SER A 104 17.166 -17.313 -10.090 1.00 0.00 H new ATOM 0 HB2 SER A 104 18.655 -19.464 -11.295 1.00 0.00 H new ATOM 0 HB3 SER A 104 18.615 -18.114 -12.411 1.00 0.00 H new ATOM 0 HG SER A 104 20.387 -17.966 -10.917 1.00 0.00 H new TER 1362 SER A 104