USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 926 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 3 ASN : amide:sc= -0.159 K(o=-0.16,f=-0.82) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0.0778 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ -169:sc= -0.017 (180deg=-0.134) USER MOD Single : A 16 CYS SG : rot -86:sc= 0.248 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= 0 K(o=0,f=0.64) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 52:sc= 0.179 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=-0.0041) USER MOD Single : A 41 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -0.27 K(o=-0.27,f=-3.9!) USER MOD Single : A 45 SER OG : rot 74:sc= 1.31 USER MOD Single : A 46 THR OG1 : rot -69:sc= 1.11 USER MOD Single : A 56 THR OG1 : rot 132:sc= -0.292 USER MOD Single : A 59 GLN : amide:sc= -2.96 K(o=-3,f=-6.5!) USER MOD Single : A 65 CYS SG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= -2.46! USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 169:sc=-0.000337 (180deg=-0.154) USER MOD Single : A 86 THR OG1 : rot 70:sc= 0.476 USER MOD Single : A 88 LYS NZ :NH3+ -118:sc= -0.487 (180deg=-2.08!) USER MOD Single : A 97 ASN : amide:sc= -1.04 K(o=-1,f=-1.7!) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.109 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.206 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 109 MET CE :methyl 174:sc= -0.0049 (180deg=-0.0306) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 GLN : amide:sc= -0.467 K(o=-0.47,f=-2.6) USER MOD Single : A 113 MET CE :methyl -136:sc= -0.437 (180deg=-2.71!) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.339 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 1.404 4.201 1.196 1.00 13.00 N ATOM 2 CA GLY A 2 0.809 3.870 -0.084 1.00 45.03 C ATOM 3 C GLY A 2 1.595 4.432 -1.253 1.00 74.00 C ATOM 4 O GLY A 2 1.330 5.542 -1.712 1.00 74.15 O ATOM 0 HA2 GLY A 2 0.744 2.786 -0.181 1.00 45.03 H new ATOM 0 HA3 GLY A 2 -0.210 4.255 -0.117 1.00 45.03 H new ATOM 8 N ASN A 3 2.568 3.663 -1.733 1.00 3.22 N ATOM 9 CA ASN A 3 3.398 4.091 -2.853 1.00 5.32 C ATOM 10 C ASN A 3 3.589 2.956 -3.853 1.00 54.22 C ATOM 11 O ASN A 3 3.513 1.779 -3.496 1.00 31.22 O ATOM 12 CB ASN A 3 4.758 4.576 -2.350 1.00 22.35 C ATOM 13 CG ASN A 3 4.632 5.680 -1.316 1.00 14.43 C ATOM 14 OD1 ASN A 3 4.255 5.432 -0.170 1.00 63.01 O ATOM 15 ND2 ASN A 3 4.949 6.906 -1.717 1.00 15.31 N ATOM 0 H ASN A 3 2.800 2.741 -1.364 1.00 3.22 H new ATOM 0 HA ASN A 3 2.890 4.913 -3.356 1.00 5.32 H new ATOM 0 HB2 ASN A 3 5.303 3.737 -1.917 1.00 22.35 H new ATOM 0 HB3 ASN A 3 5.347 4.937 -3.193 1.00 22.35 H new ATOM 0 HD21 ASN A 3 4.885 7.688 -1.066 1.00 15.31 H new ATOM 0 HD22 ASN A 3 5.257 7.065 -2.676 1.00 15.31 H new ATOM 22 N LEU A 4 3.839 3.315 -5.108 1.00 54.11 N ATOM 23 CA LEU A 4 4.042 2.326 -6.161 1.00 11.11 C ATOM 24 C LEU A 4 5.095 1.302 -5.751 1.00 14.53 C ATOM 25 O LEU A 4 6.244 1.650 -5.480 1.00 34.31 O ATOM 26 CB LEU A 4 4.465 3.016 -7.459 1.00 64.03 C ATOM 27 CG LEU A 4 5.804 3.753 -7.424 1.00 13.24 C ATOM 28 CD1 LEU A 4 6.905 2.888 -8.017 1.00 34.01 C ATOM 29 CD2 LEU A 4 5.703 5.077 -8.166 1.00 74.45 C ATOM 0 H LEU A 4 3.906 4.284 -5.421 1.00 54.11 H new ATOM 0 HA LEU A 4 3.099 1.805 -6.323 1.00 11.11 H new ATOM 0 HB2 LEU A 4 4.507 2.266 -8.248 1.00 64.03 H new ATOM 0 HB3 LEU A 4 3.689 3.728 -7.738 1.00 64.03 H new ATOM 0 HG LEU A 4 6.056 3.961 -6.384 1.00 13.24 H new ATOM 0 HD11 LEU A 4 7.851 3.429 -7.984 1.00 34.01 H new ATOM 0 HD12 LEU A 4 6.994 1.967 -7.441 1.00 34.01 H new ATOM 0 HD13 LEU A 4 6.661 2.647 -9.052 1.00 34.01 H new ATOM 0 HD21 LEU A 4 6.665 5.588 -8.131 1.00 74.45 H new ATOM 0 HD22 LEU A 4 5.428 4.892 -9.204 1.00 74.45 H new ATOM 0 HD23 LEU A 4 4.943 5.701 -7.695 1.00 74.45 H new ATOM 41 N LYS A 5 4.694 0.035 -5.707 1.00 33.43 N ATOM 42 CA LYS A 5 5.603 -1.042 -5.332 1.00 1.00 C ATOM 43 C LYS A 5 6.544 -1.384 -6.483 1.00 74.10 C ATOM 44 O LYS A 5 6.511 -0.747 -7.535 1.00 60.21 O ATOM 45 CB LYS A 5 4.812 -2.285 -4.919 1.00 44.24 C ATOM 46 CG LYS A 5 5.181 -2.813 -3.545 1.00 2.22 C ATOM 47 CD LYS A 5 4.227 -3.906 -3.092 1.00 61.20 C ATOM 48 CE LYS A 5 4.902 -4.869 -2.126 1.00 43.01 C ATOM 49 NZ LYS A 5 4.482 -4.626 -0.718 1.00 43.22 N ATOM 0 H LYS A 5 3.746 -0.271 -5.926 1.00 33.43 H new ATOM 0 HA LYS A 5 6.200 -0.702 -4.486 1.00 1.00 H new ATOM 0 HB2 LYS A 5 3.748 -2.050 -4.934 1.00 44.24 H new ATOM 0 HB3 LYS A 5 4.975 -3.071 -5.657 1.00 44.24 H new ATOM 0 HG2 LYS A 5 6.199 -3.203 -3.565 1.00 2.22 H new ATOM 0 HG3 LYS A 5 5.167 -1.995 -2.824 1.00 2.22 H new ATOM 0 HD2 LYS A 5 3.358 -3.456 -2.612 1.00 61.20 H new ATOM 0 HD3 LYS A 5 3.862 -4.455 -3.960 1.00 61.20 H new ATOM 0 HE2 LYS A 5 4.659 -5.894 -2.406 1.00 43.01 H new ATOM 0 HE3 LYS A 5 5.984 -4.765 -2.206 1.00 43.01 H new ATOM 0 HZ1 LYS A 5 4.963 -5.302 -0.091 1.00 43.22 H new ATOM 0 HZ2 LYS A 5 4.736 -3.656 -0.442 1.00 43.22 H new ATOM 0 HZ3 LYS A 5 3.453 -4.750 -0.636 1.00 43.22 H new ATOM 63 N SER A 6 7.381 -2.396 -6.276 1.00 40.34 N ATOM 64 CA SER A 6 8.332 -2.822 -7.296 1.00 74.32 C ATOM 65 C SER A 6 7.625 -3.578 -8.417 1.00 23.43 C ATOM 66 O SER A 6 7.558 -3.105 -9.552 1.00 71.24 O ATOM 67 CB SER A 6 9.416 -3.705 -6.675 1.00 41.44 C ATOM 68 OG SER A 6 8.919 -4.407 -5.549 1.00 50.13 O ATOM 0 H SER A 6 7.420 -2.936 -5.411 1.00 40.34 H new ATOM 0 HA SER A 6 8.796 -1.931 -7.719 1.00 74.32 H new ATOM 0 HB2 SER A 6 9.781 -4.414 -7.418 1.00 41.44 H new ATOM 0 HB3 SER A 6 10.265 -3.089 -6.378 1.00 41.44 H new ATOM 0 HG SER A 6 9.630 -4.965 -5.171 1.00 50.13 H new ATOM 74 N ARG A 7 7.099 -4.753 -8.090 1.00 51.32 N ATOM 75 CA ARG A 7 6.397 -5.576 -9.069 1.00 33.52 C ATOM 76 C ARG A 7 5.063 -4.943 -9.454 1.00 65.35 C ATOM 77 O ARG A 7 4.521 -5.217 -10.525 1.00 62.33 O ATOM 78 CB ARG A 7 6.165 -6.982 -8.513 1.00 20.03 C ATOM 79 CG ARG A 7 7.447 -7.765 -8.284 1.00 62.54 C ATOM 80 CD ARG A 7 8.046 -8.249 -9.596 1.00 31.14 C ATOM 81 NE ARG A 7 9.411 -8.739 -9.427 1.00 14.42 N ATOM 82 CZ ARG A 7 10.470 -7.945 -9.318 1.00 64.35 C ATOM 83 NH1 ARG A 7 10.321 -6.627 -9.363 1.00 74.02 N ATOM 84 NH2 ARG A 7 11.680 -8.467 -9.167 1.00 24.34 N ATOM 0 H ARG A 7 7.145 -5.157 -7.155 1.00 51.32 H new ATOM 0 HA ARG A 7 7.019 -5.644 -9.962 1.00 33.52 H new ATOM 0 HB2 ARG A 7 5.622 -6.906 -7.571 1.00 20.03 H new ATOM 0 HB3 ARG A 7 5.529 -7.536 -9.203 1.00 20.03 H new ATOM 0 HG2 ARG A 7 8.170 -7.138 -7.762 1.00 62.54 H new ATOM 0 HG3 ARG A 7 7.243 -8.619 -7.639 1.00 62.54 H new ATOM 0 HD2 ARG A 7 7.424 -9.044 -10.007 1.00 31.14 H new ATOM 0 HD3 ARG A 7 8.041 -7.434 -10.319 1.00 31.14 H new ATOM 0 HE ARG A 7 9.560 -9.747 -9.391 1.00 14.42 H new ATOM 0 HH11 ARG A 7 9.392 -6.223 -9.481 1.00 74.02 H new ATOM 0 HH12 ARG A 7 11.135 -6.019 -9.279 1.00 74.02 H new ATOM 0 HH21 ARG A 7 11.798 -9.480 -9.134 1.00 24.34 H new ATOM 0 HH22 ARG A 7 12.492 -7.856 -9.083 1.00 24.34 H new ATOM 98 N ASP A 8 4.541 -4.095 -8.575 1.00 54.34 N ATOM 99 CA ASP A 8 3.270 -3.424 -8.823 1.00 25.54 C ATOM 100 C ASP A 8 3.437 -2.309 -9.853 1.00 11.20 C ATOM 101 O ASP A 8 2.609 -2.150 -10.749 1.00 2.32 O ATOM 102 CB ASP A 8 2.709 -2.850 -7.521 1.00 13.31 C ATOM 103 CG ASP A 8 1.213 -3.057 -7.395 1.00 41.25 C ATOM 104 OD1 ASP A 8 0.490 -2.059 -7.192 1.00 53.31 O ATOM 105 OD2 ASP A 8 0.764 -4.218 -7.501 1.00 2.11 O ATOM 0 H ASP A 8 4.978 -3.856 -7.685 1.00 54.34 H new ATOM 0 HA ASP A 8 2.570 -4.160 -9.218 1.00 25.54 H new ATOM 0 HB2 ASP A 8 3.210 -3.319 -6.675 1.00 13.31 H new ATOM 0 HB3 ASP A 8 2.931 -1.784 -7.472 1.00 13.31 H new ATOM 110 N TRP A 9 4.512 -1.541 -9.716 1.00 71.23 N ATOM 111 CA TRP A 9 4.787 -0.442 -10.634 1.00 23.21 C ATOM 112 C TRP A 9 5.120 -0.964 -12.027 1.00 55.22 C ATOM 113 O TRP A 9 4.634 -0.444 -13.030 1.00 43.04 O ATOM 114 CB TRP A 9 5.940 0.414 -10.107 1.00 61.32 C ATOM 115 CG TRP A 9 6.399 1.457 -11.081 1.00 24.33 C ATOM 116 CD1 TRP A 9 7.625 1.540 -11.677 1.00 0.11 C ATOM 117 CD2 TRP A 9 5.638 2.567 -11.569 1.00 25.31 C ATOM 118 NE1 TRP A 9 7.672 2.635 -12.506 1.00 52.11 N ATOM 119 CE2 TRP A 9 6.466 3.281 -12.459 1.00 2.31 C ATOM 120 CE3 TRP A 9 4.338 3.027 -11.343 1.00 51.35 C ATOM 121 CZ2 TRP A 9 6.033 4.428 -13.119 1.00 35.45 C ATOM 122 CZ3 TRP A 9 3.910 4.165 -12.000 1.00 30.34 C ATOM 123 CH2 TRP A 9 4.756 4.855 -12.880 1.00 21.04 C ATOM 0 H TRP A 9 5.207 -1.659 -8.979 1.00 71.23 H new ATOM 0 HA TRP A 9 3.889 0.173 -10.703 1.00 23.21 H new ATOM 0 HB2 TRP A 9 5.628 0.902 -9.183 1.00 61.32 H new ATOM 0 HB3 TRP A 9 6.780 -0.234 -9.857 1.00 61.32 H new ATOM 0 HD1 TRP A 9 8.438 0.847 -11.520 1.00 0.11 H new ATOM 0 HE1 TRP A 9 8.476 2.920 -13.066 1.00 52.11 H new ATOM 0 HE3 TRP A 9 3.679 2.502 -10.667 1.00 51.35 H new ATOM 0 HZ2 TRP A 9 6.683 4.962 -13.796 1.00 35.45 H new ATOM 0 HZ3 TRP A 9 2.907 4.529 -11.833 1.00 30.34 H new ATOM 0 HH2 TRP A 9 4.392 5.741 -13.379 1.00 21.04 H new ATOM 134 N LYS A 10 5.954 -1.998 -12.082 1.00 22.14 N ATOM 135 CA LYS A 10 6.353 -2.594 -13.351 1.00 5.21 C ATOM 136 C LYS A 10 5.163 -3.261 -14.036 1.00 24.43 C ATOM 137 O LYS A 10 4.973 -3.121 -15.244 1.00 21.15 O ATOM 138 CB LYS A 10 7.467 -3.618 -13.130 1.00 70.14 C ATOM 139 CG LYS A 10 8.256 -3.940 -14.387 1.00 43.03 C ATOM 140 CD LYS A 10 9.398 -4.900 -14.099 1.00 44.43 C ATOM 141 CE LYS A 10 9.646 -5.839 -15.270 1.00 45.20 C ATOM 142 NZ LYS A 10 10.989 -6.477 -15.195 1.00 64.11 N ATOM 0 H LYS A 10 6.367 -2.441 -11.261 1.00 22.14 H new ATOM 0 HA LYS A 10 6.723 -1.798 -13.997 1.00 5.21 H new ATOM 0 HB2 LYS A 10 8.150 -3.240 -12.369 1.00 70.14 H new ATOM 0 HB3 LYS A 10 7.031 -4.538 -12.739 1.00 70.14 H new ATOM 0 HG2 LYS A 10 7.592 -4.377 -15.133 1.00 43.03 H new ATOM 0 HG3 LYS A 10 8.653 -3.019 -14.814 1.00 43.03 H new ATOM 0 HD2 LYS A 10 10.305 -4.334 -13.886 1.00 44.43 H new ATOM 0 HD3 LYS A 10 9.169 -5.482 -13.207 1.00 44.43 H new ATOM 0 HE2 LYS A 10 8.877 -6.612 -15.285 1.00 45.20 H new ATOM 0 HE3 LYS A 10 9.559 -5.285 -16.205 1.00 45.20 H new ATOM 0 HZ1 LYS A 10 11.119 -7.109 -16.011 1.00 64.11 H new ATOM 0 HZ2 LYS A 10 11.724 -5.741 -15.206 1.00 64.11 H new ATOM 0 HZ3 LYS A 10 11.063 -7.027 -14.315 1.00 64.11 H new ATOM 156 N MET A 11 4.367 -3.984 -13.257 1.00 61.10 N ATOM 157 CA MET A 11 3.194 -4.670 -13.788 1.00 72.44 C ATOM 158 C MET A 11 2.121 -3.670 -14.203 1.00 24.42 C ATOM 159 O MET A 11 1.579 -3.747 -15.305 1.00 41.44 O ATOM 160 CB MET A 11 2.630 -5.640 -12.750 1.00 52.50 C ATOM 161 CG MET A 11 3.441 -6.918 -12.609 1.00 34.21 C ATOM 162 SD MET A 11 2.653 -8.333 -13.401 1.00 64.43 S ATOM 163 CE MET A 11 3.838 -9.628 -13.040 1.00 4.44 C ATOM 0 H MET A 11 4.512 -4.111 -12.255 1.00 61.10 H new ATOM 0 HA MET A 11 3.502 -5.232 -14.670 1.00 72.44 H new ATOM 0 HB2 MET A 11 2.586 -5.139 -11.783 1.00 52.50 H new ATOM 0 HB3 MET A 11 1.607 -5.897 -13.023 1.00 52.50 H new ATOM 0 HG2 MET A 11 4.429 -6.767 -13.044 1.00 34.21 H new ATOM 0 HG3 MET A 11 3.589 -7.135 -11.551 1.00 34.21 H new ATOM 0 HE1 MET A 11 3.490 -10.569 -13.466 1.00 4.44 H new ATOM 0 HE2 MET A 11 4.804 -9.368 -13.473 1.00 4.44 H new ATOM 0 HE3 MET A 11 3.942 -9.735 -11.960 1.00 4.44 H new ATOM 173 N ALA A 12 1.819 -2.729 -13.313 1.00 71.34 N ATOM 174 CA ALA A 12 0.811 -1.713 -13.587 1.00 62.44 C ATOM 175 C ALA A 12 1.143 -0.941 -14.860 1.00 22.45 C ATOM 176 O ALA A 12 0.295 -0.780 -15.739 1.00 41.21 O ATOM 177 CB ALA A 12 0.687 -0.761 -12.408 1.00 44.21 C ATOM 0 H ALA A 12 2.259 -2.650 -12.396 1.00 71.34 H new ATOM 0 HA ALA A 12 -0.145 -2.215 -13.736 1.00 62.44 H new ATOM 0 HB1 ALA A 12 -0.070 -0.007 -12.627 1.00 44.21 H new ATOM 0 HB2 ALA A 12 0.396 -1.320 -11.518 1.00 44.21 H new ATOM 0 HB3 ALA A 12 1.645 -0.273 -12.232 1.00 44.21 H new ATOM 183 N ILE A 13 2.380 -0.464 -14.953 1.00 0.52 N ATOM 184 CA ILE A 13 2.822 0.290 -16.118 1.00 32.35 C ATOM 185 C ILE A 13 2.945 -0.611 -17.342 1.00 21.41 C ATOM 186 O ILE A 13 2.865 -0.145 -18.480 1.00 54.23 O ATOM 187 CB ILE A 13 4.176 0.978 -15.863 1.00 35.21 C ATOM 188 CG1 ILE A 13 4.054 1.986 -14.717 1.00 63.22 C ATOM 189 CG2 ILE A 13 4.670 1.663 -17.127 1.00 64.14 C ATOM 190 CD1 ILE A 13 3.125 3.139 -15.025 1.00 4.15 C ATOM 0 H ILE A 13 3.094 -0.587 -14.235 1.00 0.52 H new ATOM 0 HA ILE A 13 2.066 1.052 -16.306 1.00 32.35 H new ATOM 0 HB ILE A 13 4.903 0.218 -15.578 1.00 35.21 H new ATOM 0 HG12 ILE A 13 3.697 1.470 -13.826 1.00 63.22 H new ATOM 0 HG13 ILE A 13 5.043 2.379 -14.483 1.00 63.22 H new ATOM 0 HG21 ILE A 13 5.628 2.144 -16.929 1.00 64.14 H new ATOM 0 HG22 ILE A 13 4.792 0.923 -17.918 1.00 64.14 H new ATOM 0 HG23 ILE A 13 3.945 2.414 -17.441 1.00 64.14 H new ATOM 0 HD11 ILE A 13 3.086 3.814 -14.170 1.00 4.15 H new ATOM 0 HD12 ILE A 13 3.493 3.680 -15.897 1.00 4.15 H new ATOM 0 HD13 ILE A 13 2.125 2.756 -15.230 1.00 4.15 H new ATOM 202 N LYS A 14 3.139 -1.903 -17.102 1.00 22.10 N ATOM 203 CA LYS A 14 3.270 -2.871 -18.184 1.00 31.21 C ATOM 204 C LYS A 14 1.937 -3.077 -18.896 1.00 25.14 C ATOM 205 O LYS A 14 1.837 -2.898 -20.109 1.00 71.11 O ATOM 206 CB LYS A 14 3.781 -4.208 -17.640 1.00 22.11 C ATOM 207 CG LYS A 14 3.728 -5.337 -18.654 1.00 42.12 C ATOM 208 CD LYS A 14 5.064 -6.053 -18.762 1.00 54.11 C ATOM 209 CE LYS A 14 5.010 -7.183 -19.779 1.00 14.03 C ATOM 210 NZ LYS A 14 4.081 -8.267 -19.355 1.00 22.41 N ATOM 0 H LYS A 14 3.209 -2.304 -16.167 1.00 22.10 H new ATOM 0 HA LYS A 14 3.989 -2.478 -18.903 1.00 31.21 H new ATOM 0 HB2 LYS A 14 4.809 -4.083 -17.301 1.00 22.11 H new ATOM 0 HB3 LYS A 14 3.189 -4.486 -16.768 1.00 22.11 H new ATOM 0 HG2 LYS A 14 2.955 -6.049 -18.367 1.00 42.12 H new ATOM 0 HG3 LYS A 14 3.448 -4.939 -19.629 1.00 42.12 H new ATOM 0 HD2 LYS A 14 5.838 -5.341 -19.049 1.00 54.11 H new ATOM 0 HD3 LYS A 14 5.344 -6.452 -17.787 1.00 54.11 H new ATOM 0 HE2 LYS A 14 4.691 -6.788 -20.744 1.00 14.03 H new ATOM 0 HE3 LYS A 14 6.010 -7.595 -19.918 1.00 14.03 H new ATOM 0 HZ1 LYS A 14 4.209 -9.095 -19.971 1.00 22.41 H new ATOM 0 HZ2 LYS A 14 4.284 -8.533 -18.370 1.00 22.41 H new ATOM 0 HZ3 LYS A 14 3.099 -7.931 -19.427 1.00 22.41 H new ATOM 224 N ARG A 15 0.915 -3.450 -18.132 1.00 23.12 N ATOM 225 CA ARG A 15 -0.412 -3.678 -18.690 1.00 22.35 C ATOM 226 C ARG A 15 -0.951 -2.410 -19.347 1.00 70.33 C ATOM 227 O ARG A 15 -1.461 -2.449 -20.468 1.00 2.05 O ATOM 228 CB ARG A 15 -1.375 -4.147 -17.597 1.00 63.22 C ATOM 229 CG ARG A 15 -0.924 -5.416 -16.893 1.00 60.11 C ATOM 230 CD ARG A 15 -1.528 -6.654 -17.536 1.00 62.01 C ATOM 231 NE ARG A 15 -0.506 -7.615 -17.940 1.00 53.10 N ATOM 232 CZ ARG A 15 -0.765 -8.710 -18.647 1.00 34.51 C ATOM 233 NH1 ARG A 15 -2.005 -8.980 -19.027 1.00 2.11 N ATOM 234 NH2 ARG A 15 0.221 -9.537 -18.976 1.00 10.45 N ATOM 0 H ARG A 15 0.981 -3.601 -17.125 1.00 23.12 H new ATOM 0 HA ARG A 15 -0.330 -4.455 -19.451 1.00 22.35 H new ATOM 0 HB2 ARG A 15 -1.489 -3.353 -16.859 1.00 63.22 H new ATOM 0 HB3 ARG A 15 -2.358 -4.315 -18.038 1.00 63.22 H new ATOM 0 HG2 ARG A 15 0.164 -5.483 -16.923 1.00 60.11 H new ATOM 0 HG3 ARG A 15 -1.212 -5.373 -15.843 1.00 60.11 H new ATOM 0 HD2 ARG A 15 -2.214 -7.128 -16.835 1.00 62.01 H new ATOM 0 HD3 ARG A 15 -2.114 -6.361 -18.407 1.00 62.01 H new ATOM 0 HE ARG A 15 0.460 -7.436 -17.665 1.00 53.10 H new ATOM 0 HH11 ARG A 15 -2.764 -8.347 -18.777 1.00 2.11 H new ATOM 0 HH12 ARG A 15 -2.200 -9.821 -19.570 1.00 2.11 H new ATOM 0 HH21 ARG A 15 1.177 -9.332 -18.686 1.00 10.45 H new ATOM 0 HH22 ARG A 15 0.022 -10.377 -19.519 1.00 10.45 H new ATOM 248 N CYS A 16 -0.834 -1.290 -18.644 1.00 13.11 N ATOM 249 CA CYS A 16 -1.310 -0.010 -19.159 1.00 12.42 C ATOM 250 C CYS A 16 -0.536 0.395 -20.408 1.00 43.51 C ATOM 251 O CYS A 16 -1.076 1.050 -21.299 1.00 45.10 O ATOM 252 CB CYS A 16 -1.179 1.074 -18.088 1.00 4.23 C ATOM 253 SG CYS A 16 -2.725 1.935 -17.716 1.00 22.53 S ATOM 0 H CYS A 16 -0.414 -1.241 -17.716 1.00 13.11 H new ATOM 0 HA CYS A 16 -2.361 -0.121 -19.426 1.00 12.42 H new ATOM 0 HB2 CYS A 16 -0.799 0.621 -17.172 1.00 4.23 H new ATOM 0 HB3 CYS A 16 -0.438 1.804 -18.414 1.00 4.23 H new ATOM 0 HG CYS A 16 -2.884 2.921 -18.548 1.00 22.53 H new ATOM 259 N SER A 17 0.732 0.002 -20.466 1.00 30.34 N ATOM 260 CA SER A 17 1.582 0.330 -21.604 1.00 30.10 C ATOM 261 C SER A 17 1.014 -0.257 -22.893 1.00 32.21 C ATOM 262 O SER A 17 1.350 0.187 -23.990 1.00 40.31 O ATOM 263 CB SER A 17 3.002 -0.193 -21.375 1.00 43.41 C ATOM 264 OG SER A 17 3.549 -0.725 -22.569 1.00 14.53 O ATOM 0 H SER A 17 1.193 -0.544 -19.738 1.00 30.34 H new ATOM 0 HA SER A 17 1.613 1.415 -21.702 1.00 30.10 H new ATOM 0 HB2 SER A 17 3.636 0.615 -21.010 1.00 43.41 H new ATOM 0 HB3 SER A 17 2.989 -0.962 -20.603 1.00 43.41 H new ATOM 0 HG SER A 17 4.457 -1.051 -22.396 1.00 14.53 H new ATOM 270 N ASN A 18 0.152 -1.258 -22.750 1.00 71.35 N ATOM 271 CA ASN A 18 -0.463 -1.908 -23.902 1.00 64.52 C ATOM 272 C ASN A 18 -1.880 -1.389 -24.126 1.00 54.15 C ATOM 273 O ASN A 18 -2.747 -2.113 -24.616 1.00 42.02 O ATOM 274 CB ASN A 18 -0.487 -3.425 -23.706 1.00 41.31 C ATOM 275 CG ASN A 18 0.901 -4.033 -23.729 1.00 52.13 C ATOM 276 OD1 ASN A 18 1.633 -3.975 -22.741 1.00 42.22 O ATOM 277 ND2 ASN A 18 1.270 -4.622 -24.860 1.00 64.12 N ATOM 0 H ASN A 18 -0.137 -1.637 -21.848 1.00 71.35 H new ATOM 0 HA ASN A 18 0.134 -1.673 -24.783 1.00 64.52 H new ATOM 0 HB2 ASN A 18 -0.967 -3.658 -22.756 1.00 41.31 H new ATOM 0 HB3 ASN A 18 -1.093 -3.880 -24.489 1.00 41.31 H new ATOM 0 HD21 ASN A 18 2.193 -5.050 -24.935 1.00 64.12 H new ATOM 0 HD22 ASN A 18 0.631 -4.647 -25.654 1.00 64.12 H new ATOM 284 N VAL A 19 -2.108 -0.130 -23.766 1.00 74.11 N ATOM 285 CA VAL A 19 -3.419 0.486 -23.929 1.00 3.22 C ATOM 286 C VAL A 19 -3.313 1.814 -24.671 1.00 0.34 C ATOM 287 O VAL A 19 -2.447 2.635 -24.373 1.00 33.22 O ATOM 288 CB VAL A 19 -4.101 0.723 -22.568 1.00 31.13 C ATOM 289 CG1 VAL A 19 -5.520 1.234 -22.764 1.00 52.13 C ATOM 290 CG2 VAL A 19 -4.093 -0.552 -21.739 1.00 51.52 C ATOM 0 H VAL A 19 -1.402 0.483 -23.359 1.00 74.11 H new ATOM 0 HA VAL A 19 -4.024 -0.206 -24.514 1.00 3.22 H new ATOM 0 HB VAL A 19 -3.539 1.484 -22.026 1.00 31.13 H new ATOM 0 HG11 VAL A 19 -5.986 1.396 -21.792 1.00 52.13 H new ATOM 0 HG12 VAL A 19 -5.495 2.174 -23.315 1.00 52.13 H new ATOM 0 HG13 VAL A 19 -6.097 0.499 -23.325 1.00 52.13 H new ATOM 0 HG21 VAL A 19 -4.579 -0.366 -20.781 1.00 51.52 H new ATOM 0 HG22 VAL A 19 -4.630 -1.336 -22.272 1.00 51.52 H new ATOM 0 HG23 VAL A 19 -3.064 -0.869 -21.569 1.00 51.52 H new ATOM 300 N ALA A 20 -4.202 2.018 -25.637 1.00 44.41 N ATOM 301 CA ALA A 20 -4.211 3.248 -26.420 1.00 40.12 C ATOM 302 C ALA A 20 -4.512 4.456 -25.540 1.00 61.21 C ATOM 303 O ALA A 20 -5.026 4.317 -24.431 1.00 15.03 O ATOM 304 CB ALA A 20 -5.227 3.148 -27.548 1.00 53.21 C ATOM 0 H ALA A 20 -4.926 1.348 -25.896 1.00 44.41 H new ATOM 0 HA ALA A 20 -3.219 3.383 -26.851 1.00 40.12 H new ATOM 0 HB1 ALA A 20 -5.223 4.073 -28.124 1.00 53.21 H new ATOM 0 HB2 ALA A 20 -4.967 2.314 -28.199 1.00 53.21 H new ATOM 0 HB3 ALA A 20 -6.220 2.985 -27.130 1.00 53.21 H new ATOM 310 N VAL A 21 -4.187 5.644 -26.043 1.00 13.52 N ATOM 311 CA VAL A 21 -4.423 6.877 -25.302 1.00 45.33 C ATOM 312 C VAL A 21 -5.893 7.279 -25.358 1.00 35.22 C ATOM 313 O VAL A 21 -6.403 7.932 -24.450 1.00 13.34 O ATOM 314 CB VAL A 21 -3.565 8.033 -25.850 1.00 42.43 C ATOM 315 CG1 VAL A 21 -2.088 7.672 -25.801 1.00 13.35 C ATOM 316 CG2 VAL A 21 -3.990 8.385 -27.268 1.00 34.41 C ATOM 0 H VAL A 21 -3.760 5.778 -26.960 1.00 13.52 H new ATOM 0 HA VAL A 21 -4.141 6.684 -24.267 1.00 45.33 H new ATOM 0 HB VAL A 21 -3.721 8.909 -25.220 1.00 42.43 H new ATOM 0 HG11 VAL A 21 -1.498 8.501 -26.192 1.00 13.35 H new ATOM 0 HG12 VAL A 21 -1.796 7.473 -24.770 1.00 13.35 H new ATOM 0 HG13 VAL A 21 -1.911 6.783 -26.406 1.00 13.35 H new ATOM 0 HG21 VAL A 21 -3.374 9.204 -27.640 1.00 34.41 H new ATOM 0 HG22 VAL A 21 -3.865 7.515 -27.912 1.00 34.41 H new ATOM 0 HG23 VAL A 21 -5.037 8.689 -27.269 1.00 34.41 H new ATOM 326 N GLY A 22 -6.569 6.884 -26.432 1.00 70.14 N ATOM 327 CA GLY A 22 -7.974 7.211 -26.587 1.00 1.33 C ATOM 328 C GLY A 22 -8.187 8.619 -27.106 1.00 3.53 C ATOM 329 O GLY A 22 -7.227 9.340 -27.381 1.00 11.32 O ATOM 0 H GLY A 22 -6.168 6.343 -27.198 1.00 70.14 H new ATOM 0 HA2 GLY A 22 -8.436 6.501 -27.273 1.00 1.33 H new ATOM 0 HA3 GLY A 22 -8.478 7.101 -25.627 1.00 1.33 H new ATOM 333 N VAL A 23 -9.449 9.013 -27.242 1.00 62.10 N ATOM 334 CA VAL A 23 -9.786 10.345 -27.733 1.00 34.10 C ATOM 335 C VAL A 23 -9.339 10.527 -29.178 1.00 63.44 C ATOM 336 O VAL A 23 -8.685 11.513 -29.518 1.00 13.52 O ATOM 337 CB VAL A 23 -9.142 11.442 -26.864 1.00 72.54 C ATOM 338 CG1 VAL A 23 -9.757 12.798 -27.175 1.00 73.33 C ATOM 339 CG2 VAL A 23 -9.287 11.106 -25.388 1.00 32.52 C ATOM 0 H VAL A 23 -10.255 8.429 -27.019 1.00 62.10 H new ATOM 0 HA VAL A 23 -10.871 10.439 -27.678 1.00 34.10 H new ATOM 0 HB VAL A 23 -8.079 11.490 -27.098 1.00 72.54 H new ATOM 0 HG11 VAL A 23 -9.290 13.561 -26.552 1.00 73.33 H new ATOM 0 HG12 VAL A 23 -9.595 13.039 -28.226 1.00 73.33 H new ATOM 0 HG13 VAL A 23 -10.827 12.768 -26.971 1.00 73.33 H new ATOM 0 HG21 VAL A 23 -8.826 11.892 -24.789 1.00 32.52 H new ATOM 0 HG22 VAL A 23 -10.344 11.029 -25.135 1.00 32.52 H new ATOM 0 HG23 VAL A 23 -8.794 10.156 -25.181 1.00 32.52 H new ATOM 349 N GLY A 24 -9.697 9.569 -30.028 1.00 70.51 N ATOM 350 CA GLY A 24 -9.324 9.643 -31.429 1.00 63.12 C ATOM 351 C GLY A 24 -8.010 8.945 -31.717 1.00 75.34 C ATOM 352 O GLY A 24 -7.029 9.131 -30.999 1.00 22.04 O ATOM 0 H GLY A 24 -10.238 8.743 -29.772 1.00 70.51 H new ATOM 0 HA2 GLY A 24 -10.111 9.194 -32.035 1.00 63.12 H new ATOM 0 HA3 GLY A 24 -9.249 10.689 -31.727 1.00 63.12 H new ATOM 356 N GLY A 25 -7.990 8.135 -32.771 1.00 0.41 N ATOM 357 CA GLY A 25 -6.782 7.416 -33.132 1.00 4.41 C ATOM 358 C GLY A 25 -7.071 6.027 -33.666 1.00 11.30 C ATOM 359 O GLY A 25 -8.073 5.812 -34.349 1.00 63.13 O ATOM 0 H GLY A 25 -8.789 7.964 -33.382 1.00 0.41 H new ATOM 0 HA2 GLY A 25 -6.236 7.985 -33.885 1.00 4.41 H new ATOM 0 HA3 GLY A 25 -6.134 7.339 -32.259 1.00 4.41 H new ATOM 363 N LYS A 26 -6.191 5.081 -33.357 1.00 4.53 N ATOM 364 CA LYS A 26 -6.355 3.705 -33.810 1.00 1.51 C ATOM 365 C LYS A 26 -5.282 2.803 -33.211 1.00 74.45 C ATOM 366 O LYS A 26 -5.573 1.704 -32.739 1.00 74.35 O ATOM 367 CB LYS A 26 -6.298 3.639 -35.338 1.00 23.34 C ATOM 368 CG LYS A 26 -7.561 3.082 -35.971 1.00 10.32 C ATOM 369 CD LYS A 26 -7.269 2.414 -37.304 1.00 10.30 C ATOM 370 CE LYS A 26 -8.547 1.956 -37.990 1.00 5.34 C ATOM 371 NZ LYS A 26 -8.302 1.540 -39.398 1.00 4.03 N ATOM 0 H LYS A 26 -5.356 5.242 -32.794 1.00 4.53 H new ATOM 0 HA LYS A 26 -7.330 3.352 -33.473 1.00 1.51 H new ATOM 0 HB2 LYS A 26 -6.116 4.640 -35.730 1.00 23.34 H new ATOM 0 HB3 LYS A 26 -5.450 3.022 -35.635 1.00 23.34 H new ATOM 0 HG2 LYS A 26 -8.021 2.361 -35.295 1.00 10.32 H new ATOM 0 HG3 LYS A 26 -8.282 3.887 -36.116 1.00 10.32 H new ATOM 0 HD2 LYS A 26 -6.736 3.110 -37.952 1.00 10.30 H new ATOM 0 HD3 LYS A 26 -6.612 1.558 -37.147 1.00 10.30 H new ATOM 0 HE2 LYS A 26 -8.979 1.123 -37.435 1.00 5.34 H new ATOM 0 HE3 LYS A 26 -9.278 2.764 -37.972 1.00 5.34 H new ATOM 0 HZ1 LYS A 26 -9.197 1.235 -39.831 1.00 4.03 H new ATOM 0 HZ2 LYS A 26 -7.914 2.342 -39.934 1.00 4.03 H new ATOM 0 HZ3 LYS A 26 -7.623 0.752 -39.414 1.00 4.03 H new ATOM 385 N SER A 27 -4.039 3.275 -33.231 1.00 24.33 N ATOM 386 CA SER A 27 -2.921 2.510 -32.693 1.00 1.33 C ATOM 387 C SER A 27 -1.882 3.435 -32.066 1.00 35.34 C ATOM 388 O SER A 27 -0.926 3.849 -32.721 1.00 62.23 O ATOM 389 CB SER A 27 -2.274 1.669 -33.794 1.00 32.00 C ATOM 390 OG SER A 27 -2.039 2.444 -34.957 1.00 15.11 O ATOM 0 H SER A 27 -3.781 4.184 -33.614 1.00 24.33 H new ATOM 0 HA SER A 27 -3.306 1.847 -31.919 1.00 1.33 H new ATOM 0 HB2 SER A 27 -1.333 1.254 -33.433 1.00 32.00 H new ATOM 0 HB3 SER A 27 -2.920 0.826 -34.039 1.00 32.00 H new ATOM 0 HG SER A 27 -1.546 3.255 -34.715 1.00 15.11 H new ATOM 396 N LYS A 28 -2.076 3.755 -30.790 1.00 42.04 N ATOM 397 CA LYS A 28 -1.156 4.629 -30.073 1.00 4.45 C ATOM 398 C LYS A 28 -1.183 4.334 -28.576 1.00 21.05 C ATOM 399 O LYS A 28 -1.891 4.995 -27.815 1.00 54.43 O ATOM 400 CB LYS A 28 -1.517 6.096 -30.320 1.00 74.23 C ATOM 401 CG LYS A 28 -0.710 6.740 -31.435 1.00 34.25 C ATOM 402 CD LYS A 28 -0.530 8.231 -31.203 1.00 72.30 C ATOM 403 CE LYS A 28 -0.594 9.009 -32.508 1.00 21.21 C ATOM 404 NZ LYS A 28 0.503 10.011 -32.611 1.00 24.15 N ATOM 0 H LYS A 28 -2.862 3.422 -30.232 1.00 42.04 H new ATOM 0 HA LYS A 28 -0.149 4.441 -30.446 1.00 4.45 H new ATOM 0 HB2 LYS A 28 -2.577 6.165 -30.563 1.00 74.23 H new ATOM 0 HB3 LYS A 28 -1.364 6.659 -29.400 1.00 74.23 H new ATOM 0 HG2 LYS A 28 0.267 6.261 -31.502 1.00 34.25 H new ATOM 0 HG3 LYS A 28 -1.211 6.577 -32.389 1.00 34.25 H new ATOM 0 HD2 LYS A 28 -1.304 8.591 -30.525 1.00 72.30 H new ATOM 0 HD3 LYS A 28 0.429 8.412 -30.717 1.00 72.30 H new ATOM 0 HE2 LYS A 28 -0.533 8.316 -33.347 1.00 21.21 H new ATOM 0 HE3 LYS A 28 -1.556 9.515 -32.582 1.00 21.21 H new ATOM 0 HZ1 LYS A 28 0.424 10.520 -33.514 1.00 24.15 H new ATOM 0 HZ2 LYS A 28 0.430 10.688 -31.825 1.00 24.15 H new ATOM 0 HZ3 LYS A 28 1.422 9.526 -32.566 1.00 24.15 H new ATOM 418 N LYS A 29 -0.406 3.340 -28.160 1.00 22.33 N ATOM 419 CA LYS A 29 -0.337 2.960 -26.754 1.00 11.22 C ATOM 420 C LYS A 29 0.555 3.919 -25.973 1.00 74.30 C ATOM 421 O LYS A 29 1.685 4.200 -26.377 1.00 2.54 O ATOM 422 CB LYS A 29 0.190 1.529 -26.617 1.00 24.13 C ATOM 423 CG LYS A 29 -0.508 0.535 -27.527 1.00 63.14 C ATOM 424 CD LYS A 29 0.388 0.107 -28.677 1.00 32.41 C ATOM 425 CE LYS A 29 -0.424 -0.384 -29.865 1.00 65.43 C ATOM 426 NZ LYS A 29 0.377 -1.262 -30.761 1.00 52.33 N ATOM 0 H LYS A 29 0.185 2.783 -28.777 1.00 22.33 H new ATOM 0 HA LYS A 29 -1.344 3.012 -26.340 1.00 11.22 H new ATOM 0 HB2 LYS A 29 1.258 1.521 -26.836 1.00 24.13 H new ATOM 0 HB3 LYS A 29 0.074 1.205 -25.583 1.00 24.13 H new ATOM 0 HG2 LYS A 29 -0.805 -0.341 -26.950 1.00 63.14 H new ATOM 0 HG3 LYS A 29 -1.421 0.981 -27.922 1.00 63.14 H new ATOM 0 HD2 LYS A 29 1.013 0.946 -28.984 1.00 32.41 H new ATOM 0 HD3 LYS A 29 1.059 -0.684 -28.342 1.00 32.41 H new ATOM 0 HE2 LYS A 29 -1.297 -0.930 -29.507 1.00 65.43 H new ATOM 0 HE3 LYS A 29 -0.793 0.471 -30.431 1.00 65.43 H new ATOM 0 HZ1 LYS A 29 -0.213 -1.575 -31.558 1.00 52.33 H new ATOM 0 HZ2 LYS A 29 1.196 -0.733 -31.123 1.00 52.33 H new ATOM 0 HZ3 LYS A 29 0.708 -2.092 -30.229 1.00 52.33 H new ATOM 440 N PHE A 30 0.044 4.418 -24.853 1.00 13.33 N ATOM 441 CA PHE A 30 0.796 5.346 -24.016 1.00 50.31 C ATOM 442 C PHE A 30 1.833 4.603 -23.178 1.00 1.13 C ATOM 443 O PHE A 30 1.576 3.508 -22.680 1.00 15.30 O ATOM 444 CB PHE A 30 -0.153 6.124 -23.101 1.00 43.22 C ATOM 445 CG PHE A 30 -1.064 5.244 -22.294 1.00 14.42 C ATOM 446 CD1 PHE A 30 -0.619 4.653 -21.122 1.00 24.45 C ATOM 447 CD2 PHE A 30 -2.365 5.007 -22.707 1.00 54.35 C ATOM 448 CE1 PHE A 30 -1.455 3.844 -20.376 1.00 12.33 C ATOM 449 CE2 PHE A 30 -3.205 4.198 -21.966 1.00 54.03 C ATOM 450 CZ PHE A 30 -2.749 3.615 -20.799 1.00 22.12 C ATOM 0 H PHE A 30 -0.888 4.195 -24.503 1.00 13.33 H new ATOM 0 HA PHE A 30 1.316 6.047 -24.669 1.00 50.31 H new ATOM 0 HB2 PHE A 30 0.435 6.743 -22.423 1.00 43.22 H new ATOM 0 HB3 PHE A 30 -0.757 6.799 -23.707 1.00 43.22 H new ATOM 0 HD1 PHE A 30 0.393 4.827 -20.788 1.00 24.45 H new ATOM 0 HD2 PHE A 30 -2.727 5.460 -23.618 1.00 54.35 H new ATOM 0 HE1 PHE A 30 -1.096 3.392 -19.463 1.00 12.33 H new ATOM 0 HE2 PHE A 30 -4.217 4.021 -22.299 1.00 54.03 H new ATOM 0 HZ PHE A 30 -3.404 2.981 -20.219 1.00 22.12 H new ATOM 460 N GLY A 31 3.006 5.210 -23.026 1.00 74.34 N ATOM 461 CA GLY A 31 4.066 4.592 -22.250 1.00 11.42 C ATOM 462 C GLY A 31 4.289 5.286 -20.920 1.00 20.40 C ATOM 463 O GLY A 31 3.477 6.109 -20.499 1.00 43.13 O ATOM 0 H GLY A 31 3.241 6.118 -23.426 1.00 74.34 H new ATOM 0 HA2 GLY A 31 3.820 3.545 -22.074 1.00 11.42 H new ATOM 0 HA3 GLY A 31 4.991 4.610 -22.826 1.00 11.42 H new ATOM 467 N GLU A 32 5.393 4.952 -20.259 1.00 4.34 N ATOM 468 CA GLU A 32 5.718 5.548 -18.968 1.00 33.31 C ATOM 469 C GLU A 32 5.721 7.072 -19.058 1.00 53.41 C ATOM 470 O GLU A 32 5.316 7.759 -18.122 1.00 31.14 O ATOM 471 CB GLU A 32 7.082 5.052 -18.482 1.00 64.22 C ATOM 472 CG GLU A 32 8.207 5.297 -19.473 1.00 24.42 C ATOM 473 CD GLU A 32 9.545 4.787 -18.974 1.00 32.42 C ATOM 474 OE1 GLU A 32 10.378 4.388 -19.815 1.00 50.22 O ATOM 475 OE2 GLU A 32 9.760 4.787 -17.744 1.00 4.41 O ATOM 0 H GLU A 32 6.076 4.273 -20.595 1.00 4.34 H new ATOM 0 HA GLU A 32 4.953 5.245 -18.253 1.00 33.31 H new ATOM 0 HB2 GLU A 32 7.324 5.545 -17.541 1.00 64.22 H new ATOM 0 HB3 GLU A 32 7.018 3.984 -18.275 1.00 64.22 H new ATOM 0 HG2 GLU A 32 7.966 4.810 -20.418 1.00 24.42 H new ATOM 0 HG3 GLU A 32 8.282 6.365 -19.675 1.00 24.42 H new ATOM 482 N GLY A 33 6.181 7.591 -20.191 1.00 20.52 N ATOM 483 CA GLY A 33 6.230 9.029 -20.382 1.00 44.32 C ATOM 484 C GLY A 33 4.854 9.666 -20.338 1.00 52.50 C ATOM 485 O GLY A 33 4.621 10.602 -19.574 1.00 74.41 O ATOM 0 H GLY A 33 6.521 7.042 -20.981 1.00 20.52 H new ATOM 0 HA2 GLY A 33 6.858 9.474 -19.610 1.00 44.32 H new ATOM 0 HA3 GLY A 33 6.699 9.250 -21.341 1.00 44.32 H new ATOM 489 N ASN A 34 3.942 9.158 -21.160 1.00 3.13 N ATOM 490 CA ASN A 34 2.582 9.686 -21.212 1.00 74.55 C ATOM 491 C ASN A 34 1.909 9.590 -19.847 1.00 62.32 C ATOM 492 O ASN A 34 1.356 10.570 -19.345 1.00 73.34 O ATOM 493 CB ASN A 34 1.759 8.927 -22.255 1.00 73.12 C ATOM 494 CG ASN A 34 1.557 9.728 -23.527 1.00 0.11 C ATOM 495 OD1 ASN A 34 2.514 10.222 -24.122 1.00 34.45 O ATOM 496 ND2 ASN A 34 0.305 9.859 -23.950 1.00 25.33 N ATOM 0 H ASN A 34 4.119 8.383 -21.799 1.00 3.13 H new ATOM 0 HA ASN A 34 2.636 10.737 -21.496 1.00 74.55 H new ATOM 0 HB2 ASN A 34 2.259 7.989 -22.495 1.00 73.12 H new ATOM 0 HB3 ASN A 34 0.788 8.672 -21.832 1.00 73.12 H new ATOM 0 HD21 ASN A 34 0.106 10.386 -24.800 1.00 25.33 H new ATOM 0 HD22 ASN A 34 -0.458 9.432 -23.425 1.00 25.33 H new ATOM 503 N PHE A 35 1.958 8.404 -19.251 1.00 75.14 N ATOM 504 CA PHE A 35 1.353 8.179 -17.943 1.00 23.40 C ATOM 505 C PHE A 35 1.995 9.071 -16.886 1.00 34.44 C ATOM 506 O PHE A 35 1.330 9.527 -15.956 1.00 24.23 O ATOM 507 CB PHE A 35 1.492 6.709 -17.539 1.00 25.01 C ATOM 508 CG PHE A 35 1.092 6.439 -16.117 1.00 34.44 C ATOM 509 CD1 PHE A 35 -0.239 6.261 -15.778 1.00 62.23 C ATOM 510 CD2 PHE A 35 2.050 6.364 -15.118 1.00 12.23 C ATOM 511 CE1 PHE A 35 -0.609 6.012 -14.470 1.00 71.34 C ATOM 512 CE2 PHE A 35 1.686 6.115 -13.808 1.00 51.22 C ATOM 513 CZ PHE A 35 0.355 5.939 -13.484 1.00 3.14 C ATOM 0 H PHE A 35 2.411 7.583 -19.653 1.00 75.14 H new ATOM 0 HA PHE A 35 0.295 8.431 -18.012 1.00 23.40 H new ATOM 0 HB2 PHE A 35 0.880 6.098 -18.203 1.00 25.01 H new ATOM 0 HB3 PHE A 35 2.526 6.397 -17.683 1.00 25.01 H new ATOM 0 HD1 PHE A 35 -0.997 6.317 -16.545 1.00 62.23 H new ATOM 0 HD2 PHE A 35 3.092 6.502 -15.366 1.00 12.23 H new ATOM 0 HE1 PHE A 35 -1.650 5.875 -14.219 1.00 71.34 H new ATOM 0 HE2 PHE A 35 2.442 6.058 -13.039 1.00 51.22 H new ATOM 0 HZ PHE A 35 0.069 5.745 -12.461 1.00 3.14 H new ATOM 523 N ARG A 36 3.294 9.315 -17.035 1.00 3.34 N ATOM 524 CA ARG A 36 4.027 10.152 -16.093 1.00 14.33 C ATOM 525 C ARG A 36 3.438 11.559 -16.042 1.00 11.23 C ATOM 526 O ARG A 36 3.240 12.121 -14.964 1.00 34.33 O ATOM 527 CB ARG A 36 5.505 10.220 -16.482 1.00 2.52 C ATOM 528 CG ARG A 36 6.335 11.107 -15.567 1.00 53.13 C ATOM 529 CD ARG A 36 7.788 11.163 -16.015 1.00 4.51 C ATOM 530 NE ARG A 36 8.130 12.457 -16.598 1.00 14.11 N ATOM 531 CZ ARG A 36 8.293 13.565 -15.883 1.00 34.42 C ATOM 532 NH1 ARG A 36 8.146 13.535 -14.565 1.00 65.43 N ATOM 533 NH2 ARG A 36 8.605 14.705 -16.485 1.00 70.45 N ATOM 0 H ARG A 36 3.859 8.945 -17.799 1.00 3.34 H new ATOM 0 HA ARG A 36 3.939 9.704 -15.103 1.00 14.33 H new ATOM 0 HB2 ARG A 36 5.921 9.213 -16.473 1.00 2.52 H new ATOM 0 HB3 ARG A 36 5.586 10.589 -17.504 1.00 2.52 H new ATOM 0 HG2 ARG A 36 5.917 12.114 -15.557 1.00 53.13 H new ATOM 0 HG3 ARG A 36 6.282 10.729 -14.546 1.00 53.13 H new ATOM 0 HD2 ARG A 36 8.438 10.966 -15.163 1.00 4.51 H new ATOM 0 HD3 ARG A 36 7.973 10.376 -16.746 1.00 4.51 H new ATOM 0 HE ARG A 36 8.250 12.514 -17.609 1.00 14.11 H new ATOM 0 HH11 ARG A 36 7.907 12.660 -14.098 1.00 65.43 H new ATOM 0 HH12 ARG A 36 8.272 14.387 -14.018 1.00 65.43 H new ATOM 0 HH21 ARG A 36 8.720 14.732 -17.498 1.00 70.45 H new ATOM 0 HH22 ARG A 36 8.730 15.555 -15.935 1.00 70.45 H new ATOM 547 N TRP A 37 3.160 12.121 -17.212 1.00 72.54 N ATOM 548 CA TRP A 37 2.595 13.462 -17.301 1.00 20.44 C ATOM 549 C TRP A 37 1.188 13.500 -16.714 1.00 22.21 C ATOM 550 O TRP A 37 0.811 14.461 -16.043 1.00 55.11 O ATOM 551 CB TRP A 37 2.566 13.931 -18.757 1.00 52.10 C ATOM 552 CG TRP A 37 1.726 15.153 -18.971 1.00 1.32 C ATOM 553 CD1 TRP A 37 2.156 16.449 -19.009 1.00 74.22 C ATOM 554 CD2 TRP A 37 0.309 15.193 -19.175 1.00 1.04 C ATOM 555 NE1 TRP A 37 1.093 17.291 -19.223 1.00 64.42 N ATOM 556 CE2 TRP A 37 -0.051 16.546 -19.330 1.00 0.03 C ATOM 557 CE3 TRP A 37 -0.690 14.219 -19.243 1.00 13.13 C ATOM 558 CZ2 TRP A 37 -1.368 16.946 -19.547 1.00 32.41 C ATOM 559 CZ3 TRP A 37 -1.995 14.617 -19.458 1.00 42.33 C ATOM 560 CH2 TRP A 37 -2.325 15.971 -19.609 1.00 32.52 C ATOM 0 H TRP A 37 3.317 11.669 -18.113 1.00 72.54 H new ATOM 0 HA TRP A 37 3.228 14.135 -16.723 1.00 20.44 H new ATOM 0 HB2 TRP A 37 3.585 14.137 -19.085 1.00 52.10 H new ATOM 0 HB3 TRP A 37 2.187 13.124 -19.384 1.00 52.10 H new ATOM 0 HD1 TRP A 37 3.182 16.765 -18.888 1.00 74.22 H new ATOM 0 HE1 TRP A 37 1.147 18.307 -19.291 1.00 64.42 H new ATOM 0 HE3 TRP A 37 -0.446 13.173 -19.129 1.00 13.13 H new ATOM 0 HZ2 TRP A 37 -1.624 17.989 -19.662 1.00 32.41 H new ATOM 0 HZ3 TRP A 37 -2.775 13.872 -19.511 1.00 42.33 H new ATOM 0 HH2 TRP A 37 -3.355 16.250 -19.778 1.00 32.52 H new ATOM 571 N ALA A 38 0.416 12.449 -16.971 1.00 32.20 N ATOM 572 CA ALA A 38 -0.948 12.362 -16.465 1.00 52.51 C ATOM 573 C ALA A 38 -0.962 12.163 -14.953 1.00 44.14 C ATOM 574 O ALA A 38 -1.472 13.003 -14.212 1.00 13.23 O ATOM 575 CB ALA A 38 -1.695 11.231 -17.156 1.00 15.53 C ATOM 0 H ALA A 38 0.712 11.646 -17.526 1.00 32.20 H new ATOM 0 HA ALA A 38 -1.452 13.303 -16.685 1.00 52.51 H new ATOM 0 HB1 ALA A 38 -2.712 11.177 -16.769 1.00 15.53 H new ATOM 0 HB2 ALA A 38 -1.725 11.417 -18.230 1.00 15.53 H new ATOM 0 HB3 ALA A 38 -1.184 10.287 -16.965 1.00 15.53 H new ATOM 581 N ILE A 39 -0.400 11.046 -14.503 1.00 33.41 N ATOM 582 CA ILE A 39 -0.348 10.737 -13.080 1.00 34.42 C ATOM 583 C ILE A 39 0.225 11.906 -12.284 1.00 62.44 C ATOM 584 O ILE A 39 -0.146 12.126 -11.132 1.00 21.44 O ATOM 585 CB ILE A 39 0.499 9.481 -12.806 1.00 63.25 C ATOM 586 CG1 ILE A 39 0.350 9.045 -11.347 1.00 63.14 C ATOM 587 CG2 ILE A 39 1.960 9.744 -13.140 1.00 34.32 C ATOM 588 CD1 ILE A 39 -0.961 8.349 -11.056 1.00 43.43 C ATOM 0 H ILE A 39 0.026 10.340 -15.104 1.00 33.41 H new ATOM 0 HA ILE A 39 -1.373 10.550 -12.761 1.00 34.42 H new ATOM 0 HB ILE A 39 0.140 8.673 -13.444 1.00 63.25 H new ATOM 0 HG12 ILE A 39 1.172 8.377 -11.090 1.00 63.14 H new ATOM 0 HG13 ILE A 39 0.438 9.920 -10.704 1.00 63.14 H new ATOM 0 HG21 ILE A 39 2.546 8.847 -12.941 1.00 34.32 H new ATOM 0 HG22 ILE A 39 2.050 10.010 -14.193 1.00 34.32 H new ATOM 0 HG23 ILE A 39 2.332 10.564 -12.525 1.00 34.32 H new ATOM 0 HD11 ILE A 39 -0.998 8.068 -10.004 1.00 43.43 H new ATOM 0 HD12 ILE A 39 -1.788 9.022 -11.281 1.00 43.43 H new ATOM 0 HD13 ILE A 39 -1.043 7.454 -11.673 1.00 43.43 H new ATOM 600 N ARG A 40 1.131 12.652 -12.910 1.00 12.53 N ATOM 601 CA ARG A 40 1.754 13.799 -12.261 1.00 33.20 C ATOM 602 C ARG A 40 0.756 14.941 -12.096 1.00 74.35 C ATOM 603 O ARG A 40 0.439 15.344 -10.977 1.00 71.44 O ATOM 604 CB ARG A 40 2.961 14.275 -13.071 1.00 33.42 C ATOM 605 CG ARG A 40 3.619 15.525 -12.508 1.00 11.25 C ATOM 606 CD ARG A 40 4.784 15.980 -13.372 1.00 25.13 C ATOM 607 NE ARG A 40 5.579 17.016 -12.718 1.00 44.42 N ATOM 608 CZ ARG A 40 6.775 17.404 -13.145 1.00 35.30 C ATOM 609 NH1 ARG A 40 7.312 16.845 -14.220 1.00 54.43 N ATOM 610 NH2 ARG A 40 7.437 18.353 -12.496 1.00 74.42 N ATOM 0 H ARG A 40 1.449 12.482 -13.864 1.00 12.53 H new ATOM 0 HA ARG A 40 2.088 13.487 -11.271 1.00 33.20 H new ATOM 0 HB2 ARG A 40 3.699 13.474 -13.112 1.00 33.42 H new ATOM 0 HB3 ARG A 40 2.646 14.471 -14.096 1.00 33.42 H new ATOM 0 HG2 ARG A 40 2.882 16.325 -12.439 1.00 11.25 H new ATOM 0 HG3 ARG A 40 3.971 15.327 -11.496 1.00 11.25 H new ATOM 0 HD2 ARG A 40 5.421 15.125 -13.601 1.00 25.13 H new ATOM 0 HD3 ARG A 40 4.405 16.359 -14.321 1.00 25.13 H new ATOM 0 HE ARG A 40 5.194 17.466 -11.888 1.00 44.42 H new ATOM 0 HH11 ARG A 40 6.806 16.115 -14.722 1.00 54.43 H new ATOM 0 HH12 ARG A 40 8.231 17.145 -14.546 1.00 54.43 H new ATOM 0 HH21 ARG A 40 7.027 18.785 -11.668 1.00 74.42 H new ATOM 0 HH22 ARG A 40 8.356 18.650 -12.825 1.00 74.42 H new ATOM 624 N MET A 41 0.265 15.456 -13.218 1.00 1.41 N ATOM 625 CA MET A 41 -0.698 16.551 -13.197 1.00 64.42 C ATOM 626 C MET A 41 -1.870 16.227 -12.276 1.00 24.41 C ATOM 627 O MET A 41 -2.467 17.123 -11.679 1.00 55.43 O ATOM 628 CB MET A 41 -1.210 16.835 -14.611 1.00 44.03 C ATOM 629 CG MET A 41 -1.627 18.280 -14.828 1.00 5.33 C ATOM 630 SD MET A 41 -0.639 19.108 -16.087 1.00 64.25 S ATOM 631 CE MET A 41 -0.305 20.673 -15.281 1.00 63.34 C ATOM 0 H MET A 41 0.518 15.133 -14.152 1.00 1.41 H new ATOM 0 HA MET A 41 -0.193 17.438 -12.815 1.00 64.42 H new ATOM 0 HB2 MET A 41 -0.431 16.579 -15.329 1.00 44.03 H new ATOM 0 HB3 MET A 41 -2.060 16.185 -14.818 1.00 44.03 H new ATOM 0 HG2 MET A 41 -2.677 18.311 -15.118 1.00 5.33 H new ATOM 0 HG3 MET A 41 -1.540 18.824 -13.888 1.00 5.33 H new ATOM 0 HE1 MET A 41 0.300 21.299 -15.938 1.00 63.34 H new ATOM 0 HE2 MET A 41 -1.246 21.178 -15.064 1.00 63.34 H new ATOM 0 HE3 MET A 41 0.235 20.495 -14.351 1.00 63.34 H new ATOM 641 N ALA A 42 -2.194 14.943 -12.166 1.00 74.31 N ATOM 642 CA ALA A 42 -3.292 14.503 -11.316 1.00 51.34 C ATOM 643 C ALA A 42 -2.960 14.703 -9.841 1.00 74.10 C ATOM 644 O ALA A 42 -3.738 15.294 -9.094 1.00 53.13 O ATOM 645 CB ALA A 42 -3.619 13.042 -11.591 1.00 11.51 C ATOM 0 H ALA A 42 -1.711 14.189 -12.655 1.00 74.31 H new ATOM 0 HA ALA A 42 -4.166 15.111 -11.550 1.00 51.34 H new ATOM 0 HB1 ALA A 42 -4.441 12.726 -10.949 1.00 11.51 H new ATOM 0 HB2 ALA A 42 -3.908 12.924 -12.635 1.00 11.51 H new ATOM 0 HB3 ALA A 42 -2.742 12.428 -11.386 1.00 11.51 H new ATOM 651 N ASN A 43 -1.798 14.206 -9.428 1.00 75.14 N ATOM 652 CA ASN A 43 -1.363 14.330 -8.041 1.00 65.24 C ATOM 653 C ASN A 43 -1.278 15.796 -7.627 1.00 53.33 C ATOM 654 O ASN A 43 -1.809 16.190 -6.589 1.00 2.51 O ATOM 655 CB ASN A 43 -0.005 13.654 -7.848 1.00 72.45 C ATOM 656 CG ASN A 43 -0.132 12.240 -7.314 1.00 64.21 C ATOM 657 OD1 ASN A 43 -1.237 11.714 -7.179 1.00 13.11 O ATOM 658 ND2 ASN A 43 1.000 11.619 -7.008 1.00 73.52 N ATOM 0 H ASN A 43 -1.141 13.714 -10.034 1.00 75.14 H new ATOM 0 HA ASN A 43 -2.100 13.835 -7.409 1.00 65.24 H new ATOM 0 HB2 ASN A 43 0.526 13.633 -8.800 1.00 72.45 H new ATOM 0 HB3 ASN A 43 0.598 14.246 -7.160 1.00 72.45 H new ATOM 0 HD21 ASN A 43 0.977 10.666 -6.644 1.00 73.52 H new ATOM 0 HD22 ASN A 43 1.893 12.094 -7.136 1.00 73.52 H new ATOM 665 N VAL A 44 -0.606 16.598 -8.446 1.00 2.13 N ATOM 666 CA VAL A 44 -0.452 18.021 -8.166 1.00 71.34 C ATOM 667 C VAL A 44 -1.808 18.702 -8.020 1.00 2.22 C ATOM 668 O VAL A 44 -2.002 19.539 -7.139 1.00 60.10 O ATOM 669 CB VAL A 44 0.349 18.728 -9.276 1.00 4.31 C ATOM 670 CG1 VAL A 44 0.564 20.192 -8.929 1.00 23.30 C ATOM 671 CG2 VAL A 44 1.678 18.024 -9.504 1.00 64.40 C ATOM 0 H VAL A 44 -0.159 16.287 -9.309 1.00 2.13 H new ATOM 0 HA VAL A 44 0.095 18.102 -7.226 1.00 71.34 H new ATOM 0 HB VAL A 44 -0.225 18.680 -10.202 1.00 4.31 H new ATOM 0 HG11 VAL A 44 1.132 20.675 -9.724 1.00 23.30 H new ATOM 0 HG12 VAL A 44 -0.402 20.686 -8.821 1.00 23.30 H new ATOM 0 HG13 VAL A 44 1.117 20.267 -7.992 1.00 23.30 H new ATOM 0 HG21 VAL A 44 2.231 18.537 -10.291 1.00 64.40 H new ATOM 0 HG22 VAL A 44 2.260 18.039 -8.583 1.00 64.40 H new ATOM 0 HG23 VAL A 44 1.496 16.991 -9.802 1.00 64.40 H new ATOM 681 N SER A 45 -2.743 18.337 -8.891 1.00 4.54 N ATOM 682 CA SER A 45 -4.082 18.915 -8.861 1.00 23.12 C ATOM 683 C SER A 45 -4.805 18.548 -7.568 1.00 75.34 C ATOM 684 O SER A 45 -5.678 19.279 -7.100 1.00 24.20 O ATOM 685 CB SER A 45 -4.894 18.438 -10.066 1.00 62.10 C ATOM 686 OG SER A 45 -4.325 18.898 -11.280 1.00 3.53 O ATOM 0 H SER A 45 -2.599 17.644 -9.626 1.00 4.54 H new ATOM 0 HA SER A 45 -3.983 20.000 -8.905 1.00 23.12 H new ATOM 0 HB2 SER A 45 -4.937 17.349 -10.071 1.00 62.10 H new ATOM 0 HB3 SER A 45 -5.920 18.797 -9.982 1.00 62.10 H new ATOM 0 HG SER A 45 -3.508 18.392 -11.471 1.00 3.53 H new ATOM 692 N THR A 46 -4.434 17.407 -6.994 1.00 61.25 N ATOM 693 CA THR A 46 -5.047 16.940 -5.758 1.00 14.30 C ATOM 694 C THR A 46 -4.062 17.010 -4.596 1.00 73.34 C ATOM 695 O THR A 46 -4.192 16.281 -3.614 1.00 3.31 O ATOM 696 CB THR A 46 -5.558 15.493 -5.895 1.00 62.11 C ATOM 697 OG1 THR A 46 -4.570 14.683 -6.543 1.00 32.23 O ATOM 698 CG2 THR A 46 -6.855 15.450 -6.689 1.00 24.41 C ATOM 0 H THR A 46 -3.712 16.790 -7.366 1.00 61.25 H new ATOM 0 HA THR A 46 -5.892 17.598 -5.556 1.00 14.30 H new ATOM 0 HB THR A 46 -5.749 15.103 -4.895 1.00 62.11 H new ATOM 0 HG1 THR A 46 -4.485 14.958 -7.480 1.00 32.23 H new ATOM 0 HG21 THR A 46 -7.196 14.418 -6.773 1.00 24.41 H new ATOM 0 HG22 THR A 46 -7.614 16.043 -6.179 1.00 24.41 H new ATOM 0 HG23 THR A 46 -6.685 15.858 -7.685 1.00 24.41 H new ATOM 706 N GLY A 47 -3.075 17.893 -4.716 1.00 75.11 N ATOM 707 CA GLY A 47 -2.082 18.042 -3.667 1.00 64.21 C ATOM 708 C GLY A 47 -1.451 16.722 -3.274 1.00 43.15 C ATOM 709 O GLY A 47 -1.744 16.179 -2.209 1.00 51.24 O ATOM 0 H GLY A 47 -2.945 18.507 -5.520 1.00 75.11 H new ATOM 0 HA2 GLY A 47 -1.304 18.727 -4.003 1.00 64.21 H new ATOM 0 HA3 GLY A 47 -2.548 18.493 -2.791 1.00 64.21 H new ATOM 713 N ARG A 48 -0.582 16.203 -4.137 1.00 43.40 N ATOM 714 CA ARG A 48 0.089 14.936 -3.875 1.00 20.12 C ATOM 715 C ARG A 48 1.533 14.974 -4.367 1.00 31.34 C ATOM 716 O ARG A 48 1.814 15.473 -5.456 1.00 20.34 O ATOM 717 CB ARG A 48 -0.661 13.787 -4.552 1.00 53.14 C ATOM 718 CG ARG A 48 -1.562 13.008 -3.607 1.00 61.23 C ATOM 719 CD ARG A 48 -2.948 13.627 -3.523 1.00 23.14 C ATOM 720 NE ARG A 48 -4.003 12.619 -3.574 1.00 71.41 N ATOM 721 CZ ARG A 48 -5.241 12.827 -3.140 1.00 34.34 C ATOM 722 NH1 ARG A 48 -5.577 14.001 -2.623 1.00 65.31 N ATOM 723 NH2 ARG A 48 -6.145 11.859 -3.220 1.00 34.41 N ATOM 0 H ARG A 48 -0.327 16.641 -5.022 1.00 43.40 H new ATOM 0 HA ARG A 48 0.094 14.773 -2.797 1.00 20.12 H new ATOM 0 HB2 ARG A 48 -1.263 14.188 -5.367 1.00 53.14 H new ATOM 0 HB3 ARG A 48 0.063 13.104 -4.996 1.00 53.14 H new ATOM 0 HG2 ARG A 48 -1.643 11.976 -3.948 1.00 61.23 H new ATOM 0 HG3 ARG A 48 -1.113 12.981 -2.614 1.00 61.23 H new ATOM 0 HD2 ARG A 48 -3.035 14.196 -2.597 1.00 23.14 H new ATOM 0 HD3 ARG A 48 -3.080 14.332 -4.344 1.00 23.14 H new ATOM 0 HE ARG A 48 -3.777 11.704 -3.965 1.00 71.41 H new ATOM 0 HH11 ARG A 48 -4.884 14.747 -2.558 1.00 65.31 H new ATOM 0 HH12 ARG A 48 -6.528 14.158 -2.290 1.00 65.31 H new ATOM 0 HH21 ARG A 48 -5.890 10.954 -3.615 1.00 34.41 H new ATOM 0 HH22 ARG A 48 -7.095 12.020 -2.886 1.00 34.41 H new ATOM 737 N GLU A 49 2.444 14.445 -3.556 1.00 63.13 N ATOM 738 CA GLU A 49 3.859 14.421 -3.909 1.00 1.32 C ATOM 739 C GLU A 49 4.064 13.814 -5.294 1.00 55.42 C ATOM 740 O GLU A 49 3.206 13.104 -5.822 1.00 4.14 O ATOM 741 CB GLU A 49 4.653 13.628 -2.870 1.00 14.24 C ATOM 742 CG GLU A 49 5.180 14.481 -1.726 1.00 52.45 C ATOM 743 CD GLU A 49 4.070 15.069 -0.878 1.00 2.40 C ATOM 744 OE1 GLU A 49 4.135 16.278 -0.573 1.00 32.13 O ATOM 745 OE2 GLU A 49 3.136 14.322 -0.519 1.00 54.25 O ATOM 0 H GLU A 49 2.228 14.028 -2.651 1.00 63.13 H new ATOM 0 HA GLU A 49 4.221 15.449 -3.925 1.00 1.32 H new ATOM 0 HB2 GLU A 49 4.018 12.841 -2.463 1.00 14.24 H new ATOM 0 HB3 GLU A 49 5.492 13.137 -3.363 1.00 14.24 H new ATOM 0 HG2 GLU A 49 5.831 13.875 -1.096 1.00 52.45 H new ATOM 0 HG3 GLU A 49 5.790 15.289 -2.131 1.00 52.45 H new ATOM 752 N PRO A 50 5.227 14.097 -5.898 1.00 12.54 N ATOM 753 CA PRO A 50 5.573 13.589 -7.228 1.00 14.01 C ATOM 754 C PRO A 50 5.827 12.085 -7.226 1.00 72.42 C ATOM 755 O PRO A 50 5.297 11.355 -8.063 1.00 14.12 O ATOM 756 CB PRO A 50 6.857 14.347 -7.576 1.00 4.44 C ATOM 757 CG PRO A 50 7.454 14.705 -6.259 1.00 14.44 C ATOM 758 CD PRO A 50 6.296 14.935 -5.327 1.00 41.40 C ATOM 0 HA PRO A 50 4.765 13.741 -7.944 1.00 14.01 H new ATOM 0 HB2 PRO A 50 7.535 13.728 -8.163 1.00 4.44 H new ATOM 0 HB3 PRO A 50 6.643 15.236 -8.169 1.00 4.44 H new ATOM 0 HG2 PRO A 50 8.097 13.905 -5.892 1.00 14.44 H new ATOM 0 HG3 PRO A 50 8.072 15.599 -6.341 1.00 14.44 H new ATOM 0 HD2 PRO A 50 6.537 14.639 -4.306 1.00 41.40 H new ATOM 0 HD3 PRO A 50 6.009 15.986 -5.295 1.00 41.40 H new ATOM 766 N GLY A 51 6.643 11.628 -6.281 1.00 4.25 N ATOM 767 CA GLY A 51 6.953 10.214 -6.188 1.00 45.45 C ATOM 768 C GLY A 51 5.952 9.455 -5.338 1.00 34.03 C ATOM 769 O GLY A 51 6.333 8.739 -4.411 1.00 5.43 O ATOM 0 H GLY A 51 7.095 12.213 -5.578 1.00 4.25 H new ATOM 0 HA2 GLY A 51 6.975 9.783 -7.189 1.00 45.45 H new ATOM 0 HA3 GLY A 51 7.950 10.091 -5.766 1.00 45.45 H new ATOM 773 N ASP A 52 4.672 9.613 -5.652 1.00 61.03 N ATOM 774 CA ASP A 52 3.614 8.938 -4.909 1.00 44.04 C ATOM 775 C ASP A 52 2.521 8.441 -5.851 1.00 61.45 C ATOM 776 O ASP A 52 1.495 9.097 -6.030 1.00 30.25 O ATOM 777 CB ASP A 52 3.013 9.880 -3.865 1.00 25.31 C ATOM 778 CG ASP A 52 2.163 9.148 -2.845 1.00 71.31 C ATOM 779 OD1 ASP A 52 2.403 7.941 -2.629 1.00 31.32 O ATOM 780 OD2 ASP A 52 1.259 9.781 -2.261 1.00 64.43 O ATOM 0 H ASP A 52 4.341 10.202 -6.416 1.00 61.03 H new ATOM 0 HA ASP A 52 4.052 8.078 -4.402 1.00 44.04 H new ATOM 0 HB2 ASP A 52 3.816 10.409 -3.352 1.00 25.31 H new ATOM 0 HB3 ASP A 52 2.405 10.633 -4.367 1.00 25.31 H new ATOM 785 N ILE A 53 2.750 7.278 -6.453 1.00 12.01 N ATOM 786 CA ILE A 53 1.785 6.693 -7.376 1.00 53.22 C ATOM 787 C ILE A 53 1.192 5.408 -6.809 1.00 52.33 C ATOM 788 O ILE A 53 1.530 4.300 -7.229 1.00 30.40 O ATOM 789 CB ILE A 53 2.426 6.390 -8.743 1.00 30.52 C ATOM 790 CG1 ILE A 53 3.037 7.662 -9.337 1.00 54.15 C ATOM 791 CG2 ILE A 53 1.396 5.798 -9.692 1.00 74.23 C ATOM 792 CD1 ILE A 53 3.666 7.452 -10.696 1.00 60.34 C ATOM 0 H ILE A 53 3.595 6.723 -6.318 1.00 12.01 H new ATOM 0 HA ILE A 53 0.991 7.428 -7.511 1.00 53.22 H new ATOM 0 HB ILE A 53 3.222 5.659 -8.600 1.00 30.52 H new ATOM 0 HG12 ILE A 53 2.262 8.424 -9.418 1.00 54.15 H new ATOM 0 HG13 ILE A 53 3.792 8.047 -8.652 1.00 54.15 H new ATOM 0 HG21 ILE A 53 1.865 5.589 -10.654 1.00 74.23 H new ATOM 0 HG22 ILE A 53 1.003 4.872 -9.271 1.00 74.23 H new ATOM 0 HG23 ILE A 53 0.580 6.507 -9.832 1.00 74.23 H new ATOM 0 HD11 ILE A 53 4.078 8.395 -11.056 1.00 60.34 H new ATOM 0 HD12 ILE A 53 4.464 6.713 -10.617 1.00 60.34 H new ATOM 0 HD13 ILE A 53 2.910 7.096 -11.396 1.00 60.34 H new ATOM 804 N PRO A 54 0.283 5.555 -5.834 1.00 13.52 N ATOM 805 CA PRO A 54 -0.379 4.416 -5.191 1.00 11.31 C ATOM 806 C PRO A 54 -1.353 3.708 -6.126 1.00 21.13 C ATOM 807 O PRO A 54 -1.724 4.243 -7.170 1.00 74.35 O ATOM 808 CB PRO A 54 -1.130 5.058 -4.021 1.00 51.32 C ATOM 809 CG PRO A 54 -1.357 6.467 -4.444 1.00 32.21 C ATOM 810 CD PRO A 54 -0.168 6.844 -5.284 1.00 50.23 C ATOM 0 HA PRO A 54 0.333 3.648 -4.889 1.00 11.31 H new ATOM 0 HB2 PRO A 54 -2.073 4.546 -3.827 1.00 51.32 H new ATOM 0 HB3 PRO A 54 -0.546 5.010 -3.102 1.00 51.32 H new ATOM 0 HG2 PRO A 54 -2.282 6.559 -5.013 1.00 32.21 H new ATOM 0 HG3 PRO A 54 -1.448 7.124 -3.579 1.00 32.21 H new ATOM 0 HD2 PRO A 54 -0.440 7.545 -6.073 1.00 50.23 H new ATOM 0 HD3 PRO A 54 0.610 7.321 -4.688 1.00 50.23 H new ATOM 818 N GLU A 55 -1.764 2.503 -5.743 1.00 10.21 N ATOM 819 CA GLU A 55 -2.696 1.723 -6.548 1.00 2.11 C ATOM 820 C GLU A 55 -3.780 1.098 -5.674 1.00 73.23 C ATOM 821 O GLU A 55 -3.674 -0.060 -5.267 1.00 42.21 O ATOM 822 CB GLU A 55 -1.950 0.630 -7.315 1.00 54.24 C ATOM 823 CG GLU A 55 -0.671 1.115 -7.978 1.00 34.05 C ATOM 824 CD GLU A 55 0.569 0.771 -7.174 1.00 24.21 C ATOM 825 OE1 GLU A 55 0.509 0.853 -5.929 1.00 1.50 O ATOM 826 OE2 GLU A 55 1.598 0.423 -7.790 1.00 52.51 O ATOM 0 H GLU A 55 -1.466 2.046 -4.881 1.00 10.21 H new ATOM 0 HA GLU A 55 -3.172 2.396 -7.261 1.00 2.11 H new ATOM 0 HB2 GLU A 55 -1.708 -0.182 -6.630 1.00 54.24 H new ATOM 0 HB3 GLU A 55 -2.611 0.218 -8.078 1.00 54.24 H new ATOM 0 HG2 GLU A 55 -0.590 0.672 -8.971 1.00 34.05 H new ATOM 0 HG3 GLU A 55 -0.723 2.195 -8.114 1.00 34.05 H new ATOM 833 N THR A 56 -4.822 1.872 -5.390 1.00 12.12 N ATOM 834 CA THR A 56 -5.924 1.396 -4.563 1.00 20.30 C ATOM 835 C THR A 56 -7.247 2.014 -5.001 1.00 72.15 C ATOM 836 O THR A 56 -7.332 3.220 -5.238 1.00 23.01 O ATOM 837 CB THR A 56 -5.689 1.716 -3.075 1.00 44.43 C ATOM 838 OG1 THR A 56 -5.806 3.126 -2.852 1.00 44.33 O ATOM 839 CG2 THR A 56 -4.315 1.240 -2.629 1.00 23.40 C ATOM 0 H THR A 56 -4.926 2.831 -5.720 1.00 12.12 H new ATOM 0 HA THR A 56 -5.971 0.315 -4.691 1.00 20.30 H new ATOM 0 HB THR A 56 -6.445 1.192 -2.490 1.00 44.43 H new ATOM 0 HG1 THR A 56 -6.387 3.288 -2.079 1.00 44.33 H new ATOM 0 HG21 THR A 56 -4.172 1.477 -1.575 1.00 23.40 H new ATOM 0 HG22 THR A 56 -4.239 0.162 -2.772 1.00 23.40 H new ATOM 0 HG23 THR A 56 -3.547 1.739 -3.220 1.00 23.40 H new ATOM 847 N LEU A 57 -8.277 1.182 -5.108 1.00 74.32 N ATOM 848 CA LEU A 57 -9.597 1.648 -5.519 1.00 15.22 C ATOM 849 C LEU A 57 -10.042 2.837 -4.673 1.00 41.04 C ATOM 850 O LEU A 57 -10.756 3.718 -5.151 1.00 3.20 O ATOM 851 CB LEU A 57 -10.618 0.514 -5.402 1.00 31.34 C ATOM 852 CG LEU A 57 -10.187 -0.838 -5.970 1.00 10.20 C ATOM 853 CD1 LEU A 57 -11.341 -1.828 -5.925 1.00 1.13 C ATOM 854 CD2 LEU A 57 -9.675 -0.679 -7.394 1.00 61.11 C ATOM 0 H LEU A 57 -8.224 0.182 -4.916 1.00 74.32 H new ATOM 0 HA LEU A 57 -9.535 1.968 -6.559 1.00 15.22 H new ATOM 0 HB2 LEU A 57 -10.864 0.381 -4.349 1.00 31.34 H new ATOM 0 HB3 LEU A 57 -11.533 0.823 -5.907 1.00 31.34 H new ATOM 0 HG LEU A 57 -9.376 -1.227 -5.354 1.00 10.20 H new ATOM 0 HD11 LEU A 57 -11.016 -2.785 -6.333 1.00 1.13 H new ATOM 0 HD12 LEU A 57 -11.663 -1.965 -4.893 1.00 1.13 H new ATOM 0 HD13 LEU A 57 -12.172 -1.445 -6.517 1.00 1.13 H new ATOM 0 HD21 LEU A 57 -9.373 -1.651 -7.783 1.00 61.11 H new ATOM 0 HD22 LEU A 57 -10.466 -0.268 -8.021 1.00 61.11 H new ATOM 0 HD23 LEU A 57 -8.819 -0.004 -7.400 1.00 61.11 H new ATOM 866 N ASP A 58 -9.612 2.856 -3.416 1.00 22.13 N ATOM 867 CA ASP A 58 -9.964 3.940 -2.505 1.00 53.24 C ATOM 868 C ASP A 58 -9.233 5.224 -2.881 1.00 62.31 C ATOM 869 O ASP A 58 -9.788 6.317 -2.778 1.00 4.13 O ATOM 870 CB ASP A 58 -9.628 3.550 -1.064 1.00 24.01 C ATOM 871 CG ASP A 58 -10.330 2.278 -0.630 1.00 0.12 C ATOM 872 OD1 ASP A 58 -11.511 2.357 -0.233 1.00 45.22 O ATOM 873 OD2 ASP A 58 -9.696 1.204 -0.686 1.00 62.13 O ATOM 0 H ASP A 58 -9.020 2.134 -3.005 1.00 22.13 H new ATOM 0 HA ASP A 58 -11.036 4.117 -2.586 1.00 53.24 H new ATOM 0 HB2 ASP A 58 -8.550 3.418 -0.968 1.00 24.01 H new ATOM 0 HB3 ASP A 58 -9.910 4.363 -0.395 1.00 24.01 H new ATOM 878 N GLN A 59 -7.985 5.083 -3.316 1.00 22.31 N ATOM 879 CA GLN A 59 -7.177 6.234 -3.706 1.00 43.44 C ATOM 880 C GLN A 59 -7.714 6.866 -4.986 1.00 64.21 C ATOM 881 O GLN A 59 -8.020 8.059 -5.021 1.00 42.14 O ATOM 882 CB GLN A 59 -5.719 5.818 -3.901 1.00 54.03 C ATOM 883 CG GLN A 59 -4.860 6.894 -4.544 1.00 43.13 C ATOM 884 CD GLN A 59 -4.561 6.608 -6.003 1.00 50.33 C ATOM 885 OE1 GLN A 59 -4.792 7.449 -6.873 1.00 15.53 O ATOM 886 NE2 GLN A 59 -4.045 5.416 -6.279 1.00 64.23 N ATOM 0 H GLN A 59 -7.511 4.184 -3.407 1.00 22.31 H new ATOM 0 HA GLN A 59 -7.232 6.973 -2.906 1.00 43.44 H new ATOM 0 HB2 GLN A 59 -5.293 5.555 -2.933 1.00 54.03 H new ATOM 0 HB3 GLN A 59 -5.685 4.921 -4.519 1.00 54.03 H new ATOM 0 HG2 GLN A 59 -5.367 7.855 -4.463 1.00 43.13 H new ATOM 0 HG3 GLN A 59 -3.922 6.981 -3.995 1.00 43.13 H new ATOM 0 HE21 GLN A 59 -3.870 4.750 -5.527 1.00 64.23 H new ATOM 0 HE22 GLN A 59 -3.824 5.167 -7.243 1.00 64.23 H new ATOM 895 N LEU A 60 -7.825 6.060 -6.036 1.00 63.33 N ATOM 896 CA LEU A 60 -8.323 6.541 -7.321 1.00 2.32 C ATOM 897 C LEU A 60 -9.709 7.162 -7.169 1.00 74.22 C ATOM 898 O LEU A 60 -9.991 8.219 -7.732 1.00 33.35 O ATOM 899 CB LEU A 60 -8.374 5.394 -8.333 1.00 14.05 C ATOM 900 CG LEU A 60 -7.505 5.561 -9.580 1.00 12.23 C ATOM 901 CD1 LEU A 60 -7.771 6.904 -10.240 1.00 33.45 C ATOM 902 CD2 LEU A 60 -6.032 5.420 -9.225 1.00 61.22 C ATOM 0 H LEU A 60 -7.577 5.071 -6.023 1.00 63.33 H new ATOM 0 HA LEU A 60 -7.639 7.307 -7.684 1.00 2.32 H new ATOM 0 HB2 LEU A 60 -8.076 4.476 -7.827 1.00 14.05 H new ATOM 0 HB3 LEU A 60 -9.408 5.262 -8.650 1.00 14.05 H new ATOM 0 HG LEU A 60 -7.764 4.775 -10.289 1.00 12.23 H new ATOM 0 HD11 LEU A 60 -7.144 7.005 -11.126 1.00 33.45 H new ATOM 0 HD12 LEU A 60 -8.820 6.966 -10.530 1.00 33.45 H new ATOM 0 HD13 LEU A 60 -7.540 7.706 -9.539 1.00 33.45 H new ATOM 0 HD21 LEU A 60 -5.428 5.542 -10.124 1.00 61.22 H new ATOM 0 HD22 LEU A 60 -5.758 6.184 -8.498 1.00 61.22 H new ATOM 0 HD23 LEU A 60 -5.853 4.433 -8.799 1.00 61.22 H new ATOM 914 N ARG A 61 -10.569 6.497 -6.404 1.00 31.34 N ATOM 915 CA ARG A 61 -11.924 6.984 -6.176 1.00 62.30 C ATOM 916 C ARG A 61 -11.904 8.387 -5.576 1.00 62.34 C ATOM 917 O ARG A 61 -12.601 9.286 -6.049 1.00 71.31 O ATOM 918 CB ARG A 61 -12.682 6.032 -5.250 1.00 31.11 C ATOM 919 CG ARG A 61 -14.046 6.553 -4.825 1.00 32.54 C ATOM 920 CD ARG A 61 -15.148 5.558 -5.149 1.00 35.21 C ATOM 921 NE ARG A 61 -16.475 6.110 -4.893 1.00 51.42 N ATOM 922 CZ ARG A 61 -17.110 6.918 -5.735 1.00 11.34 C ATOM 923 NH1 ARG A 61 -16.540 7.268 -6.880 1.00 2.31 N ATOM 924 NH2 ARG A 61 -18.317 7.379 -5.431 1.00 33.35 N ATOM 0 H ARG A 61 -10.351 5.620 -5.932 1.00 31.34 H new ATOM 0 HA ARG A 61 -12.434 7.027 -7.138 1.00 62.30 H new ATOM 0 HB2 ARG A 61 -12.809 5.074 -5.753 1.00 31.11 H new ATOM 0 HB3 ARG A 61 -12.080 5.847 -4.361 1.00 31.11 H new ATOM 0 HG2 ARG A 61 -14.041 6.756 -3.754 1.00 32.54 H new ATOM 0 HG3 ARG A 61 -14.248 7.498 -5.328 1.00 32.54 H new ATOM 0 HD2 ARG A 61 -15.074 5.263 -6.196 1.00 35.21 H new ATOM 0 HD3 ARG A 61 -15.009 4.656 -4.553 1.00 35.21 H new ATOM 0 HE ARG A 61 -16.940 5.862 -4.020 1.00 51.42 H new ATOM 0 HH11 ARG A 61 -15.612 6.917 -7.116 1.00 2.31 H new ATOM 0 HH12 ARG A 61 -17.030 7.888 -7.525 1.00 2.31 H new ATOM 0 HH21 ARG A 61 -18.758 7.113 -4.550 1.00 33.35 H new ATOM 0 HH22 ARG A 61 -18.804 7.999 -6.078 1.00 33.35 H new ATOM 938 N LEU A 62 -11.103 8.567 -4.533 1.00 14.15 N ATOM 939 CA LEU A 62 -10.992 9.860 -3.867 1.00 34.23 C ATOM 940 C LEU A 62 -10.398 10.907 -4.805 1.00 53.00 C ATOM 941 O LEU A 62 -10.761 12.082 -4.751 1.00 40.24 O ATOM 942 CB LEU A 62 -10.129 9.737 -2.610 1.00 43.21 C ATOM 943 CG LEU A 62 -9.870 11.034 -1.844 1.00 31.43 C ATOM 944 CD1 LEU A 62 -11.143 11.522 -1.171 1.00 44.20 C ATOM 945 CD2 LEU A 62 -8.764 10.836 -0.817 1.00 3.30 C ATOM 0 H LEU A 62 -10.520 7.834 -4.129 1.00 14.15 H new ATOM 0 HA LEU A 62 -11.994 10.181 -3.582 1.00 34.23 H new ATOM 0 HB2 LEU A 62 -10.607 9.028 -1.934 1.00 43.21 H new ATOM 0 HB3 LEU A 62 -9.168 9.308 -2.894 1.00 43.21 H new ATOM 0 HG LEU A 62 -9.546 11.794 -2.556 1.00 31.43 H new ATOM 0 HD11 LEU A 62 -10.938 12.446 -0.631 1.00 44.20 H new ATOM 0 HD12 LEU A 62 -11.907 11.705 -1.927 1.00 44.20 H new ATOM 0 HD13 LEU A 62 -11.498 10.765 -0.472 1.00 44.20 H new ATOM 0 HD21 LEU A 62 -8.593 11.770 -0.281 1.00 3.30 H new ATOM 0 HD22 LEU A 62 -9.059 10.061 -0.110 1.00 3.30 H new ATOM 0 HD23 LEU A 62 -7.847 10.535 -1.323 1.00 3.30 H new ATOM 957 N VAL A 63 -9.482 10.471 -5.665 1.00 11.35 N ATOM 958 CA VAL A 63 -8.840 11.369 -6.617 1.00 15.30 C ATOM 959 C VAL A 63 -9.817 11.812 -7.700 1.00 24.25 C ATOM 960 O VAL A 63 -10.105 13.002 -7.840 1.00 73.01 O ATOM 961 CB VAL A 63 -7.621 10.701 -7.282 1.00 63.43 C ATOM 962 CG1 VAL A 63 -6.989 11.639 -8.301 1.00 15.43 C ATOM 963 CG2 VAL A 63 -6.605 10.278 -6.233 1.00 43.50 C ATOM 0 H VAL A 63 -9.169 9.502 -5.721 1.00 11.35 H new ATOM 0 HA VAL A 63 -8.506 12.241 -6.055 1.00 15.30 H new ATOM 0 HB VAL A 63 -7.960 9.807 -7.806 1.00 63.43 H new ATOM 0 HG11 VAL A 63 -6.130 11.151 -8.761 1.00 15.43 H new ATOM 0 HG12 VAL A 63 -7.720 11.886 -9.070 1.00 15.43 H new ATOM 0 HG13 VAL A 63 -6.664 12.552 -7.802 1.00 15.43 H new ATOM 0 HG21 VAL A 63 -5.751 9.808 -6.722 1.00 43.50 H new ATOM 0 HG22 VAL A 63 -6.269 11.154 -5.678 1.00 43.50 H new ATOM 0 HG23 VAL A 63 -7.065 9.568 -5.546 1.00 43.50 H new ATOM 973 N ILE A 64 -10.324 10.850 -8.461 1.00 41.45 N ATOM 974 CA ILE A 64 -11.271 11.142 -9.531 1.00 10.01 C ATOM 975 C ILE A 64 -12.486 11.895 -8.999 1.00 4.04 C ATOM 976 O ILE A 64 -13.156 12.614 -9.740 1.00 23.42 O ATOM 977 CB ILE A 64 -11.747 9.854 -10.229 1.00 72.34 C ATOM 978 CG1 ILE A 64 -10.547 9.055 -10.743 1.00 52.41 C ATOM 979 CG2 ILE A 64 -12.694 10.190 -11.372 1.00 13.02 C ATOM 980 CD1 ILE A 64 -9.771 9.761 -11.832 1.00 52.44 C ATOM 0 H ILE A 64 -10.096 9.861 -8.358 1.00 41.45 H new ATOM 0 HA ILE A 64 -10.746 11.766 -10.255 1.00 10.01 H new ATOM 0 HB ILE A 64 -12.285 9.243 -9.505 1.00 72.34 H new ATOM 0 HG12 ILE A 64 -9.877 8.845 -9.909 1.00 52.41 H new ATOM 0 HG13 ILE A 64 -10.896 8.094 -11.122 1.00 52.41 H new ATOM 0 HG21 ILE A 64 -13.022 9.270 -11.855 1.00 13.02 H new ATOM 0 HG22 ILE A 64 -13.561 10.723 -10.982 1.00 13.02 H new ATOM 0 HG23 ILE A 64 -12.179 10.818 -12.099 1.00 13.02 H new ATOM 0 HD11 ILE A 64 -8.936 9.136 -12.147 1.00 52.44 H new ATOM 0 HD12 ILE A 64 -10.426 9.947 -12.683 1.00 52.44 H new ATOM 0 HD13 ILE A 64 -9.391 10.709 -11.452 1.00 52.44 H new ATOM 992 N CYS A 65 -12.762 11.727 -7.710 1.00 25.50 N ATOM 993 CA CYS A 65 -13.895 12.393 -7.078 1.00 64.32 C ATOM 994 C CYS A 65 -13.614 13.879 -6.884 1.00 25.42 C ATOM 995 O CYS A 65 -14.266 14.729 -7.491 1.00 72.52 O ATOM 996 CB CYS A 65 -14.210 11.740 -5.731 1.00 25.34 C ATOM 997 SG CYS A 65 -15.537 12.553 -4.810 1.00 55.32 S ATOM 0 H CYS A 65 -12.217 11.136 -7.083 1.00 25.50 H new ATOM 0 HA CYS A 65 -14.759 12.289 -7.735 1.00 64.32 H new ATOM 0 HB2 CYS A 65 -14.484 10.699 -5.899 1.00 25.34 H new ATOM 0 HB3 CYS A 65 -13.307 11.737 -5.120 1.00 25.34 H new ATOM 0 HG CYS A 65 -15.732 11.928 -3.687 1.00 55.32 H new ATOM 1003 N ASP A 66 -12.640 14.185 -6.034 1.00 5.44 N ATOM 1004 CA ASP A 66 -12.273 15.570 -5.759 1.00 43.50 C ATOM 1005 C ASP A 66 -11.826 16.277 -7.034 1.00 11.20 C ATOM 1006 O ASP A 66 -12.166 17.439 -7.265 1.00 12.35 O ATOM 1007 CB ASP A 66 -11.159 15.626 -4.712 1.00 64.22 C ATOM 1008 CG ASP A 66 -11.695 15.796 -3.304 1.00 22.21 C ATOM 1009 OD1 ASP A 66 -12.262 14.823 -2.764 1.00 34.34 O ATOM 1010 OD2 ASP A 66 -11.547 16.901 -2.743 1.00 2.20 O ATOM 0 H ASP A 66 -12.091 13.494 -5.524 1.00 5.44 H new ATOM 0 HA ASP A 66 -13.153 16.083 -5.370 1.00 43.50 H new ATOM 0 HB2 ASP A 66 -10.569 14.711 -4.765 1.00 64.22 H new ATOM 0 HB3 ASP A 66 -10.488 16.453 -4.944 1.00 64.22 H new ATOM 1015 N LEU A 67 -11.062 15.571 -7.860 1.00 54.43 N ATOM 1016 CA LEU A 67 -10.567 16.130 -9.113 1.00 0.31 C ATOM 1017 C LEU A 67 -11.723 16.525 -10.027 1.00 15.42 C ATOM 1018 O LEU A 67 -11.751 17.631 -10.563 1.00 63.54 O ATOM 1019 CB LEU A 67 -9.662 15.122 -9.822 1.00 35.22 C ATOM 1020 CG LEU A 67 -8.725 15.694 -10.886 1.00 13.13 C ATOM 1021 CD1 LEU A 67 -7.769 16.704 -10.269 1.00 5.14 C ATOM 1022 CD2 LEU A 67 -7.952 14.578 -11.573 1.00 54.34 C ATOM 0 H LEU A 67 -10.772 14.609 -7.684 1.00 54.43 H new ATOM 0 HA LEU A 67 -9.990 17.025 -8.880 1.00 0.31 H new ATOM 0 HB2 LEU A 67 -9.058 14.614 -9.070 1.00 35.22 H new ATOM 0 HB3 LEU A 67 -10.291 14.365 -10.290 1.00 35.22 H new ATOM 0 HG LEU A 67 -9.329 16.206 -11.636 1.00 13.13 H new ATOM 0 HD11 LEU A 67 -7.110 17.100 -11.042 1.00 5.14 H new ATOM 0 HD12 LEU A 67 -8.339 17.520 -9.825 1.00 5.14 H new ATOM 0 HD13 LEU A 67 -7.172 16.216 -9.498 1.00 5.14 H new ATOM 0 HD21 LEU A 67 -7.290 15.004 -12.327 1.00 54.34 H new ATOM 0 HD22 LEU A 67 -7.360 14.037 -10.835 1.00 54.34 H new ATOM 0 HD23 LEU A 67 -8.651 13.891 -12.050 1.00 54.34 H new ATOM 1034 N GLN A 68 -12.673 15.612 -10.197 1.00 45.30 N ATOM 1035 CA GLN A 68 -13.833 15.866 -11.046 1.00 74.42 C ATOM 1036 C GLN A 68 -14.624 17.068 -10.540 1.00 55.42 C ATOM 1037 O GLN A 68 -14.924 17.989 -11.299 1.00 74.24 O ATOM 1038 CB GLN A 68 -14.734 14.631 -11.097 1.00 70.31 C ATOM 1039 CG GLN A 68 -16.056 14.872 -11.808 1.00 1.13 C ATOM 1040 CD GLN A 68 -16.347 13.829 -12.869 1.00 12.14 C ATOM 1041 OE1 GLN A 68 -16.043 14.023 -14.046 1.00 61.21 O ATOM 1042 NE2 GLN A 68 -16.938 12.714 -12.457 1.00 11.30 N ATOM 0 H GLN A 68 -12.664 14.691 -9.759 1.00 45.30 H new ATOM 0 HA GLN A 68 -13.475 16.087 -12.052 1.00 74.42 H new ATOM 0 HB2 GLN A 68 -14.202 13.824 -11.600 1.00 70.31 H new ATOM 0 HB3 GLN A 68 -14.934 14.295 -10.080 1.00 70.31 H new ATOM 0 HG2 GLN A 68 -16.863 14.874 -11.075 1.00 1.13 H new ATOM 0 HG3 GLN A 68 -16.041 15.860 -12.269 1.00 1.13 H new ATOM 0 HE21 GLN A 68 -17.172 12.595 -11.471 1.00 11.30 H new ATOM 0 HE22 GLN A 68 -17.158 11.976 -13.126 1.00 11.30 H new ATOM 1051 N GLU A 69 -14.961 17.050 -9.254 1.00 54.34 N ATOM 1052 CA GLU A 69 -15.719 18.138 -8.649 1.00 11.32 C ATOM 1053 C GLU A 69 -14.976 19.463 -8.789 1.00 14.14 C ATOM 1054 O GLU A 69 -15.538 20.457 -9.248 1.00 12.45 O ATOM 1055 CB GLU A 69 -15.986 17.843 -7.171 1.00 73.04 C ATOM 1056 CG GLU A 69 -17.445 17.989 -6.775 1.00 4.21 C ATOM 1057 CD GLU A 69 -17.623 18.245 -5.290 1.00 43.44 C ATOM 1058 OE1 GLU A 69 -17.660 17.262 -4.521 1.00 13.12 O ATOM 1059 OE2 GLU A 69 -17.728 19.426 -4.900 1.00 30.22 O ATOM 0 H GLU A 69 -14.721 16.295 -8.612 1.00 54.34 H new ATOM 0 HA GLU A 69 -16.671 18.219 -9.174 1.00 11.32 H new ATOM 0 HB2 GLU A 69 -15.657 16.828 -6.947 1.00 73.04 H new ATOM 0 HB3 GLU A 69 -15.384 18.516 -6.560 1.00 73.04 H new ATOM 0 HG2 GLU A 69 -17.890 18.810 -7.337 1.00 4.21 H new ATOM 0 HG3 GLU A 69 -17.985 17.083 -7.051 1.00 4.21 H new ATOM 1066 N ARG A 70 -13.708 19.468 -8.387 1.00 64.21 N ATOM 1067 CA ARG A 70 -12.888 20.671 -8.466 1.00 33.21 C ATOM 1068 C ARG A 70 -12.823 21.193 -9.898 1.00 40.33 C ATOM 1069 O ARG A 70 -13.055 22.375 -10.149 1.00 20.34 O ATOM 1070 CB ARG A 70 -11.475 20.384 -7.952 1.00 63.10 C ATOM 1071 CG ARG A 70 -11.320 20.587 -6.454 1.00 60.03 C ATOM 1072 CD ARG A 70 -9.915 20.234 -5.987 1.00 44.11 C ATOM 1073 NE ARG A 70 -9.741 20.463 -4.556 1.00 1.52 N ATOM 1074 CZ ARG A 70 -9.615 21.670 -4.014 1.00 12.31 C ATOM 1075 NH1 ARG A 70 -9.643 22.751 -4.781 1.00 71.14 N ATOM 1076 NH2 ARG A 70 -9.460 21.796 -2.702 1.00 70.41 N ATOM 0 H ARG A 70 -13.228 18.654 -8.004 1.00 64.21 H new ATOM 0 HA ARG A 70 -13.348 21.436 -7.840 1.00 33.21 H new ATOM 0 HB2 ARG A 70 -11.209 19.357 -8.201 1.00 63.10 H new ATOM 0 HB3 ARG A 70 -10.769 21.031 -8.473 1.00 63.10 H new ATOM 0 HG2 ARG A 70 -11.539 21.625 -6.202 1.00 60.03 H new ATOM 0 HG3 ARG A 70 -12.046 19.970 -5.925 1.00 60.03 H new ATOM 0 HD2 ARG A 70 -9.709 19.188 -6.214 1.00 44.11 H new ATOM 0 HD3 ARG A 70 -9.189 20.829 -6.540 1.00 44.11 H new ATOM 0 HE ARG A 70 -9.715 19.652 -3.938 1.00 1.52 H new ATOM 0 HH11 ARG A 70 -9.762 22.658 -5.790 1.00 71.14 H new ATOM 0 HH12 ARG A 70 -9.546 23.676 -4.362 1.00 71.14 H new ATOM 0 HH21 ARG A 70 -9.438 20.966 -2.109 1.00 70.41 H new ATOM 0 HH22 ARG A 70 -9.363 22.723 -2.287 1.00 70.41 H new ATOM 1090 N ARG A 71 -12.508 20.303 -10.833 1.00 53.11 N ATOM 1091 CA ARG A 71 -12.411 20.674 -12.240 1.00 24.22 C ATOM 1092 C ARG A 71 -13.730 21.257 -12.740 1.00 73.33 C ATOM 1093 O ARG A 71 -13.744 22.260 -13.452 1.00 63.45 O ATOM 1094 CB ARG A 71 -12.026 19.458 -13.085 1.00 24.34 C ATOM 1095 CG ARG A 71 -12.101 19.709 -14.582 1.00 72.02 C ATOM 1096 CD ARG A 71 -11.325 20.955 -14.979 1.00 12.14 C ATOM 1097 NE ARG A 71 -10.088 21.096 -14.215 1.00 12.52 N ATOM 1098 CZ ARG A 71 -9.434 22.244 -14.080 1.00 54.32 C ATOM 1099 NH1 ARG A 71 -9.896 23.346 -14.654 1.00 62.14 N ATOM 1100 NH2 ARG A 71 -8.314 22.291 -13.369 1.00 63.00 N ATOM 0 H ARG A 71 -12.316 19.320 -10.642 1.00 53.11 H new ATOM 0 HA ARG A 71 -11.637 21.435 -12.337 1.00 24.22 H new ATOM 0 HB2 ARG A 71 -11.012 19.153 -12.827 1.00 24.34 H new ATOM 0 HB3 ARG A 71 -12.684 18.627 -12.831 1.00 24.34 H new ATOM 0 HG2 ARG A 71 -11.704 18.846 -15.117 1.00 72.02 H new ATOM 0 HG3 ARG A 71 -13.143 19.818 -14.882 1.00 72.02 H new ATOM 0 HD2 ARG A 71 -11.091 20.913 -16.043 1.00 12.14 H new ATOM 0 HD3 ARG A 71 -11.949 21.835 -14.824 1.00 12.14 H new ATOM 0 HE ARG A 71 -9.705 20.267 -13.760 1.00 12.52 H new ATOM 0 HH11 ARG A 71 -10.756 23.314 -15.201 1.00 62.14 H new ATOM 0 HH12 ARG A 71 -9.391 24.226 -14.548 1.00 62.14 H new ATOM 0 HH21 ARG A 71 -7.955 21.445 -12.926 1.00 63.00 H new ATOM 0 HH22 ARG A 71 -7.812 23.173 -13.266 1.00 63.00 H new ATOM 1114 N GLU A 72 -14.833 20.621 -12.361 1.00 64.24 N ATOM 1115 CA GLU A 72 -16.156 21.076 -12.773 1.00 22.51 C ATOM 1116 C GLU A 72 -16.354 22.551 -12.434 1.00 71.11 C ATOM 1117 O GLU A 72 -16.756 23.346 -13.283 1.00 23.31 O ATOM 1118 CB GLU A 72 -17.242 20.237 -12.097 1.00 54.34 C ATOM 1119 CG GLU A 72 -17.695 19.046 -12.926 1.00 65.21 C ATOM 1120 CD GLU A 72 -19.095 19.222 -13.482 1.00 22.13 C ATOM 1121 OE1 GLU A 72 -19.985 18.427 -13.111 1.00 30.32 O ATOM 1122 OE2 GLU A 72 -19.302 20.154 -14.288 1.00 53.03 O ATOM 0 H GLU A 72 -14.837 19.790 -11.770 1.00 64.24 H new ATOM 0 HA GLU A 72 -16.233 20.955 -13.854 1.00 22.51 H new ATOM 0 HB2 GLU A 72 -16.869 19.880 -11.137 1.00 54.34 H new ATOM 0 HB3 GLU A 72 -18.103 20.872 -11.888 1.00 54.34 H new ATOM 0 HG2 GLU A 72 -16.997 18.895 -13.750 1.00 65.21 H new ATOM 0 HG3 GLU A 72 -17.662 18.146 -12.311 1.00 65.21 H new ATOM 1129 N LYS A 73 -16.068 22.909 -11.187 1.00 13.11 N ATOM 1130 CA LYS A 73 -16.212 24.287 -10.734 1.00 3.22 C ATOM 1131 C LYS A 73 -15.145 25.180 -11.358 1.00 32.11 C ATOM 1132 O LYS A 73 -15.294 26.401 -11.408 1.00 1.22 O ATOM 1133 CB LYS A 73 -16.121 24.356 -9.207 1.00 43.42 C ATOM 1134 CG LYS A 73 -16.547 25.695 -8.632 1.00 24.13 C ATOM 1135 CD LYS A 73 -17.056 25.555 -7.208 1.00 44.24 C ATOM 1136 CE LYS A 73 -15.916 25.329 -6.227 1.00 62.34 C ATOM 1137 NZ LYS A 73 -16.227 24.246 -5.255 1.00 74.32 N ATOM 0 H LYS A 73 -15.735 22.263 -10.471 1.00 13.11 H new ATOM 0 HA LYS A 73 -17.191 24.646 -11.050 1.00 3.22 H new ATOM 0 HB2 LYS A 73 -16.744 23.571 -8.779 1.00 43.42 H new ATOM 0 HB3 LYS A 73 -15.095 24.149 -8.903 1.00 43.42 H new ATOM 0 HG2 LYS A 73 -15.703 26.385 -8.651 1.00 24.13 H new ATOM 0 HG3 LYS A 73 -17.328 26.128 -9.257 1.00 24.13 H new ATOM 0 HD2 LYS A 73 -17.606 26.453 -6.927 1.00 44.24 H new ATOM 0 HD3 LYS A 73 -17.756 24.722 -7.151 1.00 44.24 H new ATOM 0 HE2 LYS A 73 -15.009 25.075 -6.776 1.00 62.34 H new ATOM 0 HE3 LYS A 73 -15.713 26.254 -5.687 1.00 62.34 H new ATOM 0 HZ1 LYS A 73 -15.425 24.123 -4.604 1.00 74.32 H new ATOM 0 HZ2 LYS A 73 -17.077 24.500 -4.713 1.00 74.32 H new ATOM 0 HZ3 LYS A 73 -16.396 23.357 -5.768 1.00 74.32 H new ATOM 1151 N PHE A 74 -14.069 24.563 -11.836 1.00 12.45 N ATOM 1152 CA PHE A 74 -12.977 25.303 -12.457 1.00 41.13 C ATOM 1153 C PHE A 74 -13.198 25.437 -13.961 1.00 53.30 C ATOM 1154 O PHE A 74 -12.469 26.153 -14.646 1.00 2.44 O ATOM 1155 CB PHE A 74 -11.642 24.606 -12.186 1.00 62.14 C ATOM 1156 CG PHE A 74 -11.024 24.983 -10.870 1.00 62.31 C ATOM 1157 CD1 PHE A 74 -10.665 24.008 -9.954 1.00 22.33 C ATOM 1158 CD2 PHE A 74 -10.803 26.313 -10.550 1.00 51.44 C ATOM 1159 CE1 PHE A 74 -10.096 24.352 -8.742 1.00 64.22 C ATOM 1160 CE2 PHE A 74 -10.235 26.663 -9.341 1.00 33.04 C ATOM 1161 CZ PHE A 74 -9.882 25.682 -8.435 1.00 55.45 C ATOM 0 H PHE A 74 -13.930 23.553 -11.805 1.00 12.45 H new ATOM 0 HA PHE A 74 -12.953 26.302 -12.021 1.00 41.13 H new ATOM 0 HB2 PHE A 74 -11.793 23.527 -12.211 1.00 62.14 H new ATOM 0 HB3 PHE A 74 -10.945 24.849 -12.988 1.00 62.14 H new ATOM 0 HD1 PHE A 74 -10.832 22.967 -10.189 1.00 22.33 H new ATOM 0 HD2 PHE A 74 -11.078 27.084 -11.254 1.00 51.44 H new ATOM 0 HE1 PHE A 74 -9.819 23.583 -8.036 1.00 64.22 H new ATOM 0 HE2 PHE A 74 -10.067 27.703 -9.104 1.00 33.04 H new ATOM 0 HZ PHE A 74 -9.439 25.954 -7.488 1.00 55.45 H new ATOM 1171 N GLY A 75 -14.210 24.739 -14.469 1.00 25.14 N ATOM 1172 CA GLY A 75 -14.509 24.794 -15.888 1.00 44.52 C ATOM 1173 C GLY A 75 -14.004 23.574 -16.634 1.00 23.24 C ATOM 1174 O GLY A 75 -13.734 22.536 -16.029 1.00 61.51 O ATOM 0 H GLY A 75 -14.827 24.137 -13.924 1.00 25.14 H new ATOM 0 HA2 GLY A 75 -15.587 24.880 -16.026 1.00 44.52 H new ATOM 0 HA3 GLY A 75 -14.060 25.690 -16.317 1.00 44.52 H new ATOM 1178 N SER A 76 -13.877 23.699 -17.950 1.00 62.42 N ATOM 1179 CA SER A 76 -13.406 22.597 -18.781 1.00 55.32 C ATOM 1180 C SER A 76 -11.907 22.715 -19.041 1.00 32.04 C ATOM 1181 O SER A 76 -11.313 23.774 -18.843 1.00 15.04 O ATOM 1182 CB SER A 76 -14.164 22.570 -20.110 1.00 34.33 C ATOM 1183 OG SER A 76 -15.053 21.468 -20.168 1.00 34.31 O ATOM 0 H SER A 76 -14.094 24.553 -18.465 1.00 62.42 H new ATOM 0 HA SER A 76 -13.593 21.666 -18.246 1.00 55.32 H new ATOM 0 HB2 SER A 76 -14.722 23.498 -20.233 1.00 34.33 H new ATOM 0 HB3 SER A 76 -13.455 22.513 -20.936 1.00 34.33 H new ATOM 0 HG SER A 76 -15.526 21.474 -21.026 1.00 34.31 H new ATOM 1189 N SER A 77 -11.302 21.618 -19.486 1.00 33.04 N ATOM 1190 CA SER A 77 -9.871 21.596 -19.769 1.00 52.43 C ATOM 1191 C SER A 77 -9.439 20.224 -20.279 1.00 3.41 C ATOM 1192 O SER A 77 -9.560 19.221 -19.575 1.00 74.44 O ATOM 1193 CB SER A 77 -9.076 21.959 -18.515 1.00 14.14 C ATOM 1194 OG SER A 77 -7.878 21.207 -18.434 1.00 53.20 O ATOM 0 H SER A 77 -11.780 20.733 -19.658 1.00 33.04 H new ATOM 0 HA SER A 77 -9.668 22.334 -20.545 1.00 52.43 H new ATOM 0 HB2 SER A 77 -8.841 23.023 -18.525 1.00 14.14 H new ATOM 0 HB3 SER A 77 -9.684 21.776 -17.629 1.00 14.14 H new ATOM 0 HG SER A 77 -7.388 21.459 -17.624 1.00 53.20 H new ATOM 1200 N LYS A 78 -8.938 20.188 -21.508 1.00 22.42 N ATOM 1201 CA LYS A 78 -8.486 18.941 -22.115 1.00 1.22 C ATOM 1202 C LYS A 78 -7.282 18.378 -21.368 1.00 52.52 C ATOM 1203 O LYS A 78 -6.982 17.188 -21.464 1.00 64.02 O ATOM 1204 CB LYS A 78 -8.128 19.166 -23.586 1.00 4.13 C ATOM 1205 CG LYS A 78 -6.985 20.145 -23.791 1.00 13.44 C ATOM 1206 CD LYS A 78 -6.973 20.701 -25.205 1.00 11.43 C ATOM 1207 CE LYS A 78 -6.130 19.841 -26.135 1.00 4.33 C ATOM 1208 NZ LYS A 78 -5.767 20.566 -27.384 1.00 5.52 N ATOM 0 H LYS A 78 -8.834 21.009 -22.105 1.00 22.42 H new ATOM 0 HA LYS A 78 -9.300 18.219 -22.052 1.00 1.22 H new ATOM 0 HB2 LYS A 78 -7.862 18.210 -24.037 1.00 4.13 H new ATOM 0 HB3 LYS A 78 -9.008 19.533 -24.114 1.00 4.13 H new ATOM 0 HG2 LYS A 78 -7.074 20.964 -23.078 1.00 13.44 H new ATOM 0 HG3 LYS A 78 -6.037 19.647 -23.587 1.00 13.44 H new ATOM 0 HD2 LYS A 78 -7.993 20.756 -25.584 1.00 11.43 H new ATOM 0 HD3 LYS A 78 -6.582 21.718 -25.194 1.00 11.43 H new ATOM 0 HE2 LYS A 78 -5.222 19.530 -25.619 1.00 4.33 H new ATOM 0 HE3 LYS A 78 -6.679 18.934 -26.388 1.00 4.33 H new ATOM 0 HZ1 LYS A 78 -5.193 19.946 -27.991 1.00 5.52 H new ATOM 0 HZ2 LYS A 78 -6.633 20.841 -27.890 1.00 5.52 H new ATOM 0 HZ3 LYS A 78 -5.221 21.418 -27.145 1.00 5.52 H new ATOM 1222 N GLU A 79 -6.597 19.239 -20.622 1.00 43.35 N ATOM 1223 CA GLU A 79 -5.426 18.825 -19.859 1.00 31.40 C ATOM 1224 C GLU A 79 -5.825 17.907 -18.707 1.00 12.33 C ATOM 1225 O GLU A 79 -5.471 16.728 -18.688 1.00 11.34 O ATOM 1226 CB GLU A 79 -4.684 20.049 -19.318 1.00 52.02 C ATOM 1227 CG GLU A 79 -4.005 20.875 -20.397 1.00 33.14 C ATOM 1228 CD GLU A 79 -3.481 22.199 -19.876 1.00 1.25 C ATOM 1229 OE1 GLU A 79 -3.560 23.201 -20.617 1.00 15.41 O ATOM 1230 OE2 GLU A 79 -2.994 22.234 -18.726 1.00 3.20 O ATOM 0 H GLU A 79 -6.833 20.227 -20.530 1.00 43.35 H new ATOM 0 HA GLU A 79 -4.764 18.274 -20.527 1.00 31.40 H new ATOM 0 HB2 GLU A 79 -5.389 20.681 -18.778 1.00 52.02 H new ATOM 0 HB3 GLU A 79 -3.934 19.720 -18.598 1.00 52.02 H new ATOM 0 HG2 GLU A 79 -3.179 20.303 -20.821 1.00 33.14 H new ATOM 0 HG3 GLU A 79 -4.712 21.061 -21.205 1.00 33.14 H new ATOM 1237 N ILE A 80 -6.562 18.457 -17.748 1.00 20.31 N ATOM 1238 CA ILE A 80 -7.009 17.689 -16.593 1.00 23.21 C ATOM 1239 C ILE A 80 -7.867 16.503 -17.020 1.00 1.25 C ATOM 1240 O ILE A 80 -7.861 15.454 -16.376 1.00 35.55 O ATOM 1241 CB ILE A 80 -7.813 18.563 -15.612 1.00 64.31 C ATOM 1242 CG1 ILE A 80 -8.347 17.714 -14.458 1.00 14.53 C ATOM 1243 CG2 ILE A 80 -8.955 19.260 -16.337 1.00 50.43 C ATOM 1244 CD1 ILE A 80 -8.212 18.378 -13.105 1.00 44.02 C ATOM 0 H ILE A 80 -6.862 19.432 -17.748 1.00 20.31 H new ATOM 0 HA ILE A 80 -6.113 17.324 -16.091 1.00 23.21 H new ATOM 0 HB ILE A 80 -7.151 19.325 -15.201 1.00 64.31 H new ATOM 0 HG12 ILE A 80 -9.398 17.489 -14.640 1.00 14.53 H new ATOM 0 HG13 ILE A 80 -7.815 16.763 -14.441 1.00 14.53 H new ATOM 0 HG21 ILE A 80 -9.514 19.874 -15.630 1.00 50.43 H new ATOM 0 HG22 ILE A 80 -8.552 19.893 -17.128 1.00 50.43 H new ATOM 0 HG23 ILE A 80 -9.619 18.513 -16.773 1.00 50.43 H new ATOM 0 HD11 ILE A 80 -8.611 17.718 -12.335 1.00 44.02 H new ATOM 0 HD12 ILE A 80 -7.160 18.579 -12.902 1.00 44.02 H new ATOM 0 HD13 ILE A 80 -8.767 19.316 -13.103 1.00 44.02 H new ATOM 1256 N ASP A 81 -8.605 16.677 -18.111 1.00 42.32 N ATOM 1257 CA ASP A 81 -9.467 15.620 -18.627 1.00 45.30 C ATOM 1258 C ASP A 81 -8.656 14.373 -18.963 1.00 54.11 C ATOM 1259 O ASP A 81 -8.984 13.271 -18.524 1.00 74.12 O ATOM 1260 CB ASP A 81 -10.218 16.106 -19.868 1.00 12.20 C ATOM 1261 CG ASP A 81 -10.940 14.982 -20.584 1.00 51.40 C ATOM 1262 OD1 ASP A 81 -11.573 14.150 -19.899 1.00 12.21 O ATOM 1263 OD2 ASP A 81 -10.875 14.933 -21.830 1.00 45.12 O ATOM 0 H ASP A 81 -8.624 17.540 -18.655 1.00 42.32 H new ATOM 0 HA ASP A 81 -10.189 15.363 -17.852 1.00 45.30 H new ATOM 0 HB2 ASP A 81 -10.939 16.870 -19.577 1.00 12.20 H new ATOM 0 HB3 ASP A 81 -9.514 16.577 -20.554 1.00 12.20 H new ATOM 1268 N MET A 82 -7.597 14.555 -19.745 1.00 61.35 N ATOM 1269 CA MET A 82 -6.739 13.444 -20.140 1.00 54.41 C ATOM 1270 C MET A 82 -6.114 12.777 -18.918 1.00 4.52 C ATOM 1271 O MET A 82 -6.069 11.552 -18.823 1.00 42.50 O ATOM 1272 CB MET A 82 -5.641 13.931 -21.087 1.00 61.02 C ATOM 1273 CG MET A 82 -5.760 13.372 -22.495 1.00 13.10 C ATOM 1274 SD MET A 82 -4.972 11.759 -22.672 1.00 24.14 S ATOM 1275 CE MET A 82 -4.215 11.928 -24.286 1.00 40.35 C ATOM 0 H MET A 82 -7.313 15.461 -20.118 1.00 61.35 H new ATOM 0 HA MET A 82 -7.355 12.709 -20.657 1.00 54.41 H new ATOM 0 HB2 MET A 82 -5.670 15.020 -21.134 1.00 61.02 H new ATOM 0 HB3 MET A 82 -4.670 13.655 -20.676 1.00 61.02 H new ATOM 0 HG2 MET A 82 -6.814 13.288 -22.760 1.00 13.10 H new ATOM 0 HG3 MET A 82 -5.309 14.072 -23.199 1.00 13.10 H new ATOM 0 HE1 MET A 82 -3.532 11.096 -24.456 1.00 40.35 H new ATOM 0 HE2 MET A 82 -4.989 11.925 -25.053 1.00 40.35 H new ATOM 0 HE3 MET A 82 -3.663 12.866 -24.332 1.00 40.35 H new ATOM 1285 N ALA A 83 -5.635 13.594 -17.985 1.00 63.34 N ATOM 1286 CA ALA A 83 -5.015 13.083 -16.769 1.00 30.11 C ATOM 1287 C ALA A 83 -5.966 12.160 -16.015 1.00 32.14 C ATOM 1288 O ALA A 83 -5.562 11.105 -15.525 1.00 72.02 O ATOM 1289 CB ALA A 83 -4.577 14.235 -15.877 1.00 15.03 C ATOM 0 H ALA A 83 -5.665 14.612 -18.048 1.00 63.34 H new ATOM 0 HA ALA A 83 -4.137 12.503 -17.053 1.00 30.11 H new ATOM 0 HB1 ALA A 83 -4.116 13.839 -14.972 1.00 15.03 H new ATOM 0 HB2 ALA A 83 -3.856 14.855 -16.411 1.00 15.03 H new ATOM 0 HB3 ALA A 83 -5.445 14.837 -15.608 1.00 15.03 H new ATOM 1295 N ILE A 84 -7.228 12.564 -15.924 1.00 12.42 N ATOM 1296 CA ILE A 84 -8.236 11.772 -15.229 1.00 33.32 C ATOM 1297 C ILE A 84 -8.400 10.402 -15.877 1.00 1.33 C ATOM 1298 O ILE A 84 -8.318 9.372 -15.207 1.00 64.20 O ATOM 1299 CB ILE A 84 -9.599 12.486 -15.209 1.00 65.31 C ATOM 1300 CG1 ILE A 84 -9.525 13.752 -14.354 1.00 32.45 C ATOM 1301 CG2 ILE A 84 -10.680 11.551 -14.689 1.00 70.31 C ATOM 1302 CD1 ILE A 84 -10.665 14.715 -14.597 1.00 63.33 C ATOM 0 H ILE A 84 -7.578 13.435 -16.323 1.00 12.42 H new ATOM 0 HA ILE A 84 -7.888 11.647 -14.204 1.00 33.32 H new ATOM 0 HB ILE A 84 -9.855 12.774 -16.228 1.00 65.31 H new ATOM 0 HG12 ILE A 84 -9.518 13.469 -13.301 1.00 32.45 H new ATOM 0 HG13 ILE A 84 -8.582 14.261 -14.554 1.00 32.45 H new ATOM 0 HG21 ILE A 84 -11.638 12.071 -14.681 1.00 70.31 H new ATOM 0 HG22 ILE A 84 -10.747 10.677 -15.336 1.00 70.31 H new ATOM 0 HG23 ILE A 84 -10.431 11.234 -13.676 1.00 70.31 H new ATOM 0 HD11 ILE A 84 -10.546 15.589 -13.956 1.00 63.33 H new ATOM 0 HD12 ILE A 84 -10.661 15.028 -15.641 1.00 63.33 H new ATOM 0 HD13 ILE A 84 -11.611 14.224 -14.369 1.00 63.33 H new ATOM 1314 N VAL A 85 -8.633 10.397 -17.186 1.00 74.11 N ATOM 1315 CA VAL A 85 -8.807 9.153 -17.927 1.00 13.23 C ATOM 1316 C VAL A 85 -7.607 8.230 -17.742 1.00 21.22 C ATOM 1317 O VAL A 85 -7.737 7.007 -17.786 1.00 14.40 O ATOM 1318 CB VAL A 85 -9.009 9.419 -19.431 1.00 33.05 C ATOM 1319 CG1 VAL A 85 -9.148 8.109 -20.190 1.00 32.30 C ATOM 1320 CG2 VAL A 85 -10.224 10.306 -19.655 1.00 31.11 C ATOM 0 H VAL A 85 -8.706 11.240 -17.755 1.00 74.11 H new ATOM 0 HA VAL A 85 -9.699 8.669 -17.528 1.00 13.23 H new ATOM 0 HB VAL A 85 -8.131 9.941 -19.812 1.00 33.05 H new ATOM 0 HG11 VAL A 85 -9.290 8.316 -21.251 1.00 32.30 H new ATOM 0 HG12 VAL A 85 -8.246 7.512 -20.054 1.00 32.30 H new ATOM 0 HG13 VAL A 85 -10.008 7.558 -19.810 1.00 32.30 H new ATOM 0 HG21 VAL A 85 -10.353 10.484 -20.723 1.00 31.11 H new ATOM 0 HG22 VAL A 85 -11.112 9.813 -19.260 1.00 31.11 H new ATOM 0 HG23 VAL A 85 -10.079 11.257 -19.143 1.00 31.11 H new ATOM 1330 N THR A 86 -6.437 8.825 -17.533 1.00 24.11 N ATOM 1331 CA THR A 86 -5.213 8.059 -17.342 1.00 35.50 C ATOM 1332 C THR A 86 -5.241 7.299 -16.020 1.00 61.32 C ATOM 1333 O THR A 86 -4.941 6.105 -15.972 1.00 33.30 O ATOM 1334 CB THR A 86 -3.970 8.967 -17.372 1.00 34.33 C ATOM 1335 OG1 THR A 86 -3.829 9.563 -18.667 1.00 41.23 O ATOM 1336 CG2 THR A 86 -2.714 8.178 -17.032 1.00 24.20 C ATOM 0 H THR A 86 -6.312 9.836 -17.492 1.00 24.11 H new ATOM 0 HA THR A 86 -5.154 7.348 -18.166 1.00 35.50 H new ATOM 0 HB THR A 86 -4.102 9.749 -16.625 1.00 34.33 H new ATOM 0 HG1 THR A 86 -4.543 10.220 -18.804 1.00 41.23 H new ATOM 0 HG21 THR A 86 -1.849 8.841 -17.060 1.00 24.20 H new ATOM 0 HG22 THR A 86 -2.812 7.751 -16.034 1.00 24.20 H new ATOM 0 HG23 THR A 86 -2.580 7.376 -17.758 1.00 24.20 H new ATOM 1344 N LEU A 87 -5.603 7.997 -14.950 1.00 22.14 N ATOM 1345 CA LEU A 87 -5.672 7.388 -13.626 1.00 73.52 C ATOM 1346 C LEU A 87 -6.723 6.284 -13.589 1.00 55.14 C ATOM 1347 O LEU A 87 -6.566 5.286 -12.884 1.00 3.52 O ATOM 1348 CB LEU A 87 -5.991 8.448 -12.570 1.00 63.05 C ATOM 1349 CG LEU A 87 -5.152 9.724 -12.627 1.00 3.14 C ATOM 1350 CD1 LEU A 87 -5.938 10.905 -12.076 1.00 15.20 C ATOM 1351 CD2 LEU A 87 -3.852 9.542 -11.857 1.00 72.42 C ATOM 0 H LEU A 87 -5.853 8.986 -14.973 1.00 22.14 H new ATOM 0 HA LEU A 87 -4.700 6.947 -13.405 1.00 73.52 H new ATOM 0 HB2 LEU A 87 -7.041 8.723 -12.666 1.00 63.05 H new ATOM 0 HB3 LEU A 87 -5.867 7.999 -11.584 1.00 63.05 H new ATOM 0 HG LEU A 87 -4.909 9.930 -13.669 1.00 3.14 H new ATOM 0 HD11 LEU A 87 -5.325 11.805 -12.125 1.00 15.20 H new ATOM 0 HD12 LEU A 87 -6.841 11.049 -12.669 1.00 15.20 H new ATOM 0 HD13 LEU A 87 -6.212 10.708 -11.039 1.00 15.20 H new ATOM 0 HD21 LEU A 87 -3.267 10.460 -11.908 1.00 72.42 H new ATOM 0 HD22 LEU A 87 -4.075 9.312 -10.815 1.00 72.42 H new ATOM 0 HD23 LEU A 87 -3.281 8.723 -12.295 1.00 72.42 H new ATOM 1363 N LYS A 88 -7.793 6.466 -14.354 1.00 3.33 N ATOM 1364 CA LYS A 88 -8.870 5.485 -14.412 1.00 53.31 C ATOM 1365 C LYS A 88 -8.373 4.167 -15.000 1.00 63.03 C ATOM 1366 O LYS A 88 -8.480 3.115 -14.370 1.00 4.20 O ATOM 1367 CB LYS A 88 -10.033 6.023 -15.248 1.00 54.45 C ATOM 1368 CG LYS A 88 -10.445 7.437 -14.879 1.00 74.43 C ATOM 1369 CD LYS A 88 -11.899 7.499 -14.444 1.00 22.15 C ATOM 1370 CE LYS A 88 -12.525 8.844 -14.782 1.00 12.54 C ATOM 1371 NZ LYS A 88 -13.987 8.727 -15.037 1.00 3.42 N ATOM 0 H LYS A 88 -7.938 7.285 -14.944 1.00 3.33 H new ATOM 0 HA LYS A 88 -9.217 5.301 -13.395 1.00 53.31 H new ATOM 0 HB2 LYS A 88 -9.754 5.998 -16.301 1.00 54.45 H new ATOM 0 HB3 LYS A 88 -10.891 5.361 -15.130 1.00 54.45 H new ATOM 0 HG2 LYS A 88 -9.808 7.804 -14.075 1.00 74.43 H new ATOM 0 HG3 LYS A 88 -10.292 8.096 -15.733 1.00 74.43 H new ATOM 0 HD2 LYS A 88 -12.460 6.702 -14.932 1.00 22.15 H new ATOM 0 HD3 LYS A 88 -11.966 7.325 -13.370 1.00 22.15 H new ATOM 0 HE2 LYS A 88 -12.354 9.541 -13.961 1.00 12.54 H new ATOM 0 HE3 LYS A 88 -12.035 9.262 -15.662 1.00 12.54 H new ATOM 0 HZ1 LYS A 88 -14.193 9.015 -16.015 1.00 3.42 H new ATOM 0 HZ2 LYS A 88 -14.286 7.741 -14.896 1.00 3.42 H new ATOM 0 HZ3 LYS A 88 -14.505 9.343 -14.378 1.00 3.42 H new ATOM 1385 N VAL A 89 -7.830 4.233 -16.211 1.00 74.45 N ATOM 1386 CA VAL A 89 -7.314 3.046 -16.883 1.00 54.30 C ATOM 1387 C VAL A 89 -6.198 2.396 -16.072 1.00 2.42 C ATOM 1388 O VAL A 89 -5.980 1.187 -16.153 1.00 41.32 O ATOM 1389 CB VAL A 89 -6.783 3.382 -18.288 1.00 64.44 C ATOM 1390 CG1 VAL A 89 -5.643 4.385 -18.202 1.00 31.31 C ATOM 1391 CG2 VAL A 89 -6.338 2.117 -19.007 1.00 21.10 C ATOM 0 H VAL A 89 -7.736 5.096 -16.747 1.00 74.45 H new ATOM 0 HA VAL A 89 -8.146 2.348 -16.975 1.00 54.30 H new ATOM 0 HB VAL A 89 -7.591 3.834 -18.864 1.00 64.44 H new ATOM 0 HG11 VAL A 89 -5.280 4.611 -19.205 1.00 31.31 H new ATOM 0 HG12 VAL A 89 -5.999 5.301 -17.730 1.00 31.31 H new ATOM 0 HG13 VAL A 89 -4.831 3.963 -17.609 1.00 31.31 H new ATOM 0 HG21 VAL A 89 -5.966 2.374 -19.999 1.00 21.10 H new ATOM 0 HG22 VAL A 89 -5.545 1.634 -18.436 1.00 21.10 H new ATOM 0 HG23 VAL A 89 -7.184 1.436 -19.102 1.00 21.10 H new ATOM 1401 N PHE A 90 -5.494 3.207 -15.289 1.00 60.00 N ATOM 1402 CA PHE A 90 -4.399 2.711 -14.463 1.00 10.43 C ATOM 1403 C PHE A 90 -4.925 1.812 -13.347 1.00 33.22 C ATOM 1404 O PHE A 90 -4.359 0.755 -13.069 1.00 62.13 O ATOM 1405 CB PHE A 90 -3.615 3.880 -13.864 1.00 21.33 C ATOM 1406 CG PHE A 90 -2.243 3.499 -13.387 1.00 11.14 C ATOM 1407 CD1 PHE A 90 -1.333 2.911 -14.250 1.00 40.03 C ATOM 1408 CD2 PHE A 90 -1.863 3.728 -12.073 1.00 41.22 C ATOM 1409 CE1 PHE A 90 -0.069 2.559 -13.813 1.00 42.45 C ATOM 1410 CE2 PHE A 90 -0.601 3.378 -11.632 1.00 3.03 C ATOM 1411 CZ PHE A 90 0.296 2.793 -12.503 1.00 14.11 C ATOM 0 H PHE A 90 -5.662 4.210 -15.209 1.00 60.00 H new ATOM 0 HA PHE A 90 -3.735 2.124 -15.097 1.00 10.43 H new ATOM 0 HB2 PHE A 90 -3.525 4.668 -14.612 1.00 21.33 H new ATOM 0 HB3 PHE A 90 -4.179 4.296 -13.029 1.00 21.33 H new ATOM 0 HD1 PHE A 90 -1.614 2.725 -15.276 1.00 40.03 H new ATOM 0 HD2 PHE A 90 -2.561 4.185 -11.387 1.00 41.22 H new ATOM 0 HE1 PHE A 90 0.631 2.102 -14.496 1.00 42.45 H new ATOM 0 HE2 PHE A 90 -0.317 3.562 -10.606 1.00 3.03 H new ATOM 0 HZ PHE A 90 1.282 2.519 -12.159 1.00 14.11 H new ATOM 1421 N ALA A 91 -6.010 2.241 -12.711 1.00 55.15 N ATOM 1422 CA ALA A 91 -6.613 1.476 -11.627 1.00 53.13 C ATOM 1423 C ALA A 91 -7.175 0.153 -12.136 1.00 55.24 C ATOM 1424 O ALA A 91 -6.951 -0.900 -11.538 1.00 12.53 O ATOM 1425 CB ALA A 91 -7.704 2.289 -10.949 1.00 43.53 C ATOM 0 H ALA A 91 -6.490 3.115 -12.928 1.00 55.15 H new ATOM 0 HA ALA A 91 -5.835 1.254 -10.896 1.00 53.13 H new ATOM 0 HB1 ALA A 91 -8.145 1.704 -10.142 1.00 43.53 H new ATOM 0 HB2 ALA A 91 -7.275 3.205 -10.542 1.00 43.53 H new ATOM 0 HB3 ALA A 91 -8.475 2.542 -11.677 1.00 43.53 H new ATOM 1431 N VAL A 92 -7.906 0.212 -13.244 1.00 3.22 N ATOM 1432 CA VAL A 92 -8.500 -0.981 -13.833 1.00 65.24 C ATOM 1433 C VAL A 92 -7.430 -1.897 -14.417 1.00 1.40 C ATOM 1434 O VAL A 92 -7.319 -3.061 -14.034 1.00 53.31 O ATOM 1435 CB VAL A 92 -9.508 -0.618 -14.941 1.00 54.34 C ATOM 1436 CG1 VAL A 92 -10.112 -1.877 -15.548 1.00 32.54 C ATOM 1437 CG2 VAL A 92 -10.595 0.294 -14.393 1.00 14.53 C ATOM 0 H VAL A 92 -8.101 1.075 -13.752 1.00 3.22 H new ATOM 0 HA VAL A 92 -9.023 -1.502 -13.031 1.00 65.24 H new ATOM 0 HB VAL A 92 -8.979 -0.082 -15.729 1.00 54.34 H new ATOM 0 HG11 VAL A 92 -10.821 -1.601 -16.328 1.00 32.54 H new ATOM 0 HG12 VAL A 92 -9.320 -2.490 -15.978 1.00 32.54 H new ATOM 0 HG13 VAL A 92 -10.628 -2.443 -14.773 1.00 32.54 H new ATOM 0 HG21 VAL A 92 -11.298 0.541 -15.188 1.00 14.53 H new ATOM 0 HG22 VAL A 92 -11.123 -0.214 -13.586 1.00 14.53 H new ATOM 0 HG23 VAL A 92 -10.143 1.210 -14.011 1.00 14.53 H new ATOM 1447 N ALA A 93 -6.644 -1.363 -15.345 1.00 72.11 N ATOM 1448 CA ALA A 93 -5.580 -2.132 -15.979 1.00 11.13 C ATOM 1449 C ALA A 93 -4.500 -2.510 -14.971 1.00 33.30 C ATOM 1450 O ALA A 93 -3.650 -3.356 -15.245 1.00 60.32 O ATOM 1451 CB ALA A 93 -4.976 -1.346 -17.133 1.00 30.15 C ATOM 0 H ALA A 93 -6.724 -0.401 -15.675 1.00 72.11 H new ATOM 0 HA ALA A 93 -6.014 -3.053 -16.369 1.00 11.13 H new ATOM 0 HB1 ALA A 93 -4.183 -1.932 -17.597 1.00 30.15 H new ATOM 0 HB2 ALA A 93 -5.749 -1.132 -17.871 1.00 30.15 H new ATOM 0 HB3 ALA A 93 -4.563 -0.409 -16.759 1.00 30.15 H new ATOM 1457 N GLY A 94 -4.538 -1.876 -13.803 1.00 61.43 N ATOM 1458 CA GLY A 94 -3.556 -2.158 -12.772 1.00 45.41 C ATOM 1459 C GLY A 94 -4.072 -3.133 -11.733 1.00 51.12 C ATOM 1460 O GLY A 94 -3.663 -4.296 -11.704 1.00 23.12 O ATOM 0 H GLY A 94 -5.232 -1.172 -13.552 1.00 61.43 H new ATOM 0 HA2 GLY A 94 -2.656 -2.565 -13.233 1.00 45.41 H new ATOM 0 HA3 GLY A 94 -3.270 -1.227 -12.282 1.00 45.41 H new ATOM 1464 N LEU A 95 -4.971 -2.663 -10.876 1.00 23.13 N ATOM 1465 CA LEU A 95 -5.543 -3.500 -9.828 1.00 74.13 C ATOM 1466 C LEU A 95 -6.282 -4.693 -10.427 1.00 1.11 C ATOM 1467 O LEU A 95 -6.155 -5.820 -9.948 1.00 14.21 O ATOM 1468 CB LEU A 95 -6.494 -2.681 -8.955 1.00 52.21 C ATOM 1469 CG LEU A 95 -5.837 -1.741 -7.945 1.00 34.21 C ATOM 1470 CD1 LEU A 95 -4.884 -2.508 -7.041 1.00 72.12 C ATOM 1471 CD2 LEU A 95 -5.105 -0.615 -8.662 1.00 54.31 C ATOM 0 H LEU A 95 -5.320 -1.705 -10.886 1.00 23.13 H new ATOM 0 HA LEU A 95 -4.727 -3.875 -9.210 1.00 74.13 H new ATOM 0 HB2 LEU A 95 -7.135 -2.089 -9.608 1.00 52.21 H new ATOM 0 HB3 LEU A 95 -7.141 -3.370 -8.412 1.00 52.21 H new ATOM 0 HG LEU A 95 -6.619 -1.303 -7.325 1.00 34.21 H new ATOM 0 HD11 LEU A 95 -4.426 -1.821 -6.329 1.00 72.12 H new ATOM 0 HD12 LEU A 95 -5.435 -3.277 -6.500 1.00 72.12 H new ATOM 0 HD13 LEU A 95 -4.107 -2.976 -7.645 1.00 72.12 H new ATOM 0 HD21 LEU A 95 -4.643 0.045 -7.927 1.00 54.31 H new ATOM 0 HD22 LEU A 95 -4.334 -1.035 -9.308 1.00 54.31 H new ATOM 0 HD23 LEU A 95 -5.813 -0.047 -9.265 1.00 54.31 H new ATOM 1483 N LEU A 96 -7.053 -4.436 -11.477 1.00 72.54 N ATOM 1484 CA LEU A 96 -7.812 -5.489 -12.145 1.00 22.11 C ATOM 1485 C LEU A 96 -6.978 -6.153 -13.235 1.00 71.44 C ATOM 1486 O LEU A 96 -7.420 -7.109 -13.873 1.00 21.13 O ATOM 1487 CB LEU A 96 -9.096 -4.916 -12.746 1.00 62.21 C ATOM 1488 CG LEU A 96 -10.400 -5.329 -12.062 1.00 64.21 C ATOM 1489 CD1 LEU A 96 -11.014 -4.147 -11.327 1.00 63.34 C ATOM 1490 CD2 LEU A 96 -11.380 -5.894 -13.080 1.00 11.44 C ATOM 0 H LEU A 96 -7.170 -3.508 -11.885 1.00 72.54 H new ATOM 0 HA LEU A 96 -8.072 -6.243 -11.402 1.00 22.11 H new ATOM 0 HB2 LEU A 96 -9.028 -3.828 -12.728 1.00 62.21 H new ATOM 0 HB3 LEU A 96 -9.148 -5.214 -13.793 1.00 62.21 H new ATOM 0 HG LEU A 96 -10.175 -6.107 -11.333 1.00 64.21 H new ATOM 0 HD11 LEU A 96 -11.941 -4.459 -10.846 1.00 63.34 H new ATOM 0 HD12 LEU A 96 -10.317 -3.787 -10.571 1.00 63.34 H new ATOM 0 HD13 LEU A 96 -11.225 -3.347 -12.037 1.00 63.34 H new ATOM 0 HD21 LEU A 96 -12.302 -6.183 -12.576 1.00 11.44 H new ATOM 0 HD22 LEU A 96 -11.600 -5.137 -13.833 1.00 11.44 H new ATOM 0 HD23 LEU A 96 -10.941 -6.768 -13.562 1.00 11.44 H new ATOM 1502 N ASN A 97 -5.769 -5.642 -13.443 1.00 73.23 N ATOM 1503 CA ASN A 97 -4.872 -6.188 -14.455 1.00 64.41 C ATOM 1504 C ASN A 97 -5.583 -6.317 -15.799 1.00 65.21 C ATOM 1505 O ASN A 97 -5.271 -7.201 -16.597 1.00 15.33 O ATOM 1506 CB ASN A 97 -4.340 -7.552 -14.014 1.00 42.22 C ATOM 1507 CG ASN A 97 -2.875 -7.740 -14.356 1.00 14.40 C ATOM 1508 OD1 ASN A 97 -2.513 -8.636 -15.119 1.00 21.14 O ATOM 1509 ND2 ASN A 97 -2.022 -6.893 -13.790 1.00 4.41 N ATOM 0 H ASN A 97 -5.388 -4.851 -12.924 1.00 73.23 H new ATOM 0 HA ASN A 97 -4.035 -5.500 -14.571 1.00 64.41 H new ATOM 0 HB2 ASN A 97 -4.476 -7.661 -12.938 1.00 42.22 H new ATOM 0 HB3 ASN A 97 -4.925 -8.338 -14.491 1.00 42.22 H new ATOM 0 HD21 ASN A 97 -1.023 -6.971 -13.982 1.00 4.41 H new ATOM 0 HD22 ASN A 97 -2.366 -6.165 -13.164 1.00 4.41 H new ATOM 1516 N MET A 98 -6.541 -5.428 -16.044 1.00 12.44 N ATOM 1517 CA MET A 98 -7.296 -5.442 -17.291 1.00 32.40 C ATOM 1518 C MET A 98 -6.413 -5.028 -18.465 1.00 0.24 C ATOM 1519 O MET A 98 -5.554 -4.155 -18.332 1.00 65.15 O ATOM 1520 CB MET A 98 -8.503 -4.508 -17.192 1.00 42.22 C ATOM 1521 CG MET A 98 -9.829 -5.241 -17.070 1.00 43.22 C ATOM 1522 SD MET A 98 -11.035 -4.705 -18.300 1.00 75.01 S ATOM 1523 CE MET A 98 -11.764 -6.274 -18.764 1.00 44.21 C ATOM 0 H MET A 98 -6.812 -4.689 -15.395 1.00 12.44 H new ATOM 0 HA MET A 98 -7.647 -6.460 -17.463 1.00 32.40 H new ATOM 0 HB2 MET A 98 -8.377 -3.855 -16.328 1.00 42.22 H new ATOM 0 HB3 MET A 98 -8.530 -3.868 -18.074 1.00 42.22 H new ATOM 0 HG2 MET A 98 -9.659 -6.312 -17.177 1.00 43.22 H new ATOM 0 HG3 MET A 98 -10.238 -5.081 -16.072 1.00 43.22 H new ATOM 0 HE1 MET A 98 -12.531 -6.109 -19.520 1.00 44.21 H new ATOM 0 HE2 MET A 98 -10.992 -6.929 -19.167 1.00 44.21 H new ATOM 0 HE3 MET A 98 -12.213 -6.740 -17.887 1.00 44.21 H new ATOM 1533 N THR A 99 -6.629 -5.660 -19.614 1.00 70.02 N ATOM 1534 CA THR A 99 -5.852 -5.359 -20.810 1.00 13.00 C ATOM 1535 C THR A 99 -6.265 -4.020 -21.411 1.00 51.32 C ATOM 1536 O THR A 99 -5.449 -3.108 -21.542 1.00 71.41 O ATOM 1537 CB THR A 99 -6.013 -6.459 -21.876 1.00 2.03 C ATOM 1538 OG1 THR A 99 -7.269 -7.125 -21.708 1.00 23.31 O ATOM 1539 CG2 THR A 99 -4.881 -7.471 -21.785 1.00 31.34 C ATOM 0 H THR A 99 -7.336 -6.384 -19.742 1.00 70.02 H new ATOM 0 HA THR A 99 -4.807 -5.310 -20.504 1.00 13.00 H new ATOM 0 HB THR A 99 -5.981 -5.988 -22.859 1.00 2.03 H new ATOM 0 HG1 THR A 99 -7.364 -7.822 -22.391 1.00 23.31 H new ATOM 0 HG21 THR A 99 -5.016 -8.238 -22.548 1.00 31.34 H new ATOM 0 HG22 THR A 99 -3.928 -6.966 -21.943 1.00 31.34 H new ATOM 0 HG23 THR A 99 -4.886 -7.935 -20.799 1.00 31.34 H new ATOM 1547 N VAL A 100 -7.539 -3.908 -21.775 1.00 12.21 N ATOM 1548 CA VAL A 100 -8.062 -2.679 -22.360 1.00 24.20 C ATOM 1549 C VAL A 100 -7.419 -2.400 -23.713 1.00 64.43 C ATOM 1550 O VAL A 100 -6.284 -2.802 -23.969 1.00 51.42 O ATOM 1551 CB VAL A 100 -7.827 -1.472 -21.433 1.00 63.42 C ATOM 1552 CG1 VAL A 100 -8.579 -0.253 -21.944 1.00 3.13 C ATOM 1553 CG2 VAL A 100 -8.241 -1.806 -20.008 1.00 61.42 C ATOM 0 H VAL A 100 -8.228 -4.654 -21.675 1.00 12.21 H new ATOM 0 HA VAL A 100 -9.134 -2.822 -22.492 1.00 24.20 H new ATOM 0 HB VAL A 100 -6.762 -1.238 -21.432 1.00 63.42 H new ATOM 0 HG11 VAL A 100 -8.401 0.590 -21.277 1.00 3.13 H new ATOM 0 HG12 VAL A 100 -8.229 -0.003 -22.946 1.00 3.13 H new ATOM 0 HG13 VAL A 100 -9.646 -0.471 -21.977 1.00 3.13 H new ATOM 0 HG21 VAL A 100 -8.068 -0.942 -19.367 1.00 61.42 H new ATOM 0 HG22 VAL A 100 -9.299 -2.067 -19.988 1.00 61.42 H new ATOM 0 HG23 VAL A 100 -7.653 -2.649 -19.646 1.00 61.42 H new ATOM 1563 N SER A 101 -8.153 -1.706 -24.579 1.00 70.22 N ATOM 1564 CA SER A 101 -7.656 -1.375 -25.909 1.00 4.45 C ATOM 1565 C SER A 101 -7.484 0.133 -26.064 1.00 21.22 C ATOM 1566 O SER A 101 -6.671 0.599 -26.864 1.00 25.32 O ATOM 1567 CB SER A 101 -8.613 -1.903 -26.980 1.00 33.11 C ATOM 1568 OG SER A 101 -7.949 -2.790 -27.863 1.00 64.31 O ATOM 0 H SER A 101 -9.093 -1.363 -24.383 1.00 70.22 H new ATOM 0 HA SER A 101 -6.683 -1.850 -26.035 1.00 4.45 H new ATOM 0 HB2 SER A 101 -9.449 -2.416 -26.504 1.00 33.11 H new ATOM 0 HB3 SER A 101 -9.030 -1.068 -27.543 1.00 33.11 H new ATOM 0 HG SER A 101 -8.582 -3.115 -28.537 1.00 64.31 H new ATOM 1574 N THR A 102 -8.255 0.893 -25.293 1.00 4.13 N ATOM 1575 CA THR A 102 -8.190 2.348 -25.345 1.00 32.45 C ATOM 1576 C THR A 102 -8.439 2.960 -23.970 1.00 52.35 C ATOM 1577 O THR A 102 -9.296 2.493 -23.219 1.00 15.10 O ATOM 1578 CB THR A 102 -9.214 2.922 -26.341 1.00 62.01 C ATOM 1579 OG1 THR A 102 -10.538 2.793 -25.812 1.00 42.35 O ATOM 1580 CG2 THR A 102 -9.125 2.206 -27.681 1.00 11.11 C ATOM 0 H THR A 102 -8.932 0.525 -24.625 1.00 4.13 H new ATOM 0 HA THR A 102 -7.185 2.606 -25.679 1.00 32.45 H new ATOM 0 HB THR A 102 -8.987 3.977 -26.495 1.00 62.01 H new ATOM 0 HG1 THR A 102 -11.183 3.162 -26.451 1.00 42.35 H new ATOM 0 HG21 THR A 102 -9.858 2.628 -28.369 1.00 11.11 H new ATOM 0 HG22 THR A 102 -8.124 2.332 -28.095 1.00 11.11 H new ATOM 0 HG23 THR A 102 -9.329 1.145 -27.541 1.00 11.11 H new ATOM 1588 N ALA A 103 -7.686 4.005 -23.646 1.00 62.24 N ATOM 1589 CA ALA A 103 -7.828 4.681 -22.363 1.00 35.32 C ATOM 1590 C ALA A 103 -9.282 5.051 -22.095 1.00 24.13 C ATOM 1591 O ALA A 103 -9.737 5.033 -20.952 1.00 11.50 O ATOM 1592 CB ALA A 103 -6.949 5.922 -22.320 1.00 23.42 C ATOM 0 H ALA A 103 -6.971 4.402 -24.255 1.00 62.24 H new ATOM 0 HA ALA A 103 -7.506 3.994 -21.581 1.00 35.32 H new ATOM 0 HB1 ALA A 103 -7.065 6.417 -21.356 1.00 23.42 H new ATOM 0 HB2 ALA A 103 -5.907 5.634 -22.457 1.00 23.42 H new ATOM 0 HB3 ALA A 103 -7.245 6.605 -23.116 1.00 23.42 H new ATOM 1598 N ALA A 104 -10.007 5.389 -23.157 1.00 50.15 N ATOM 1599 CA ALA A 104 -11.411 5.762 -23.036 1.00 10.12 C ATOM 1600 C ALA A 104 -12.246 4.598 -22.512 1.00 14.55 C ATOM 1601 O ALA A 104 -12.982 4.740 -21.535 1.00 60.25 O ATOM 1602 CB ALA A 104 -11.949 6.237 -24.378 1.00 55.20 C ATOM 0 H ALA A 104 -9.645 5.412 -24.110 1.00 50.15 H new ATOM 0 HA ALA A 104 -11.483 6.579 -22.318 1.00 10.12 H new ATOM 0 HB1 ALA A 104 -12.998 6.512 -24.273 1.00 55.20 H new ATOM 0 HB2 ALA A 104 -11.379 7.103 -24.713 1.00 55.20 H new ATOM 0 HB3 ALA A 104 -11.856 5.436 -25.111 1.00 55.20 H new ATOM 1608 N ALA A 105 -12.126 3.448 -23.167 1.00 23.41 N ATOM 1609 CA ALA A 105 -12.869 2.260 -22.766 1.00 12.44 C ATOM 1610 C ALA A 105 -12.629 1.933 -21.296 1.00 0.33 C ATOM 1611 O ALA A 105 -13.551 1.550 -20.576 1.00 53.13 O ATOM 1612 CB ALA A 105 -12.484 1.076 -23.641 1.00 50.12 C ATOM 0 H ALA A 105 -11.521 3.314 -23.977 1.00 23.41 H new ATOM 0 HA ALA A 105 -13.931 2.465 -22.897 1.00 12.44 H new ATOM 0 HB1 ALA A 105 -13.047 0.196 -23.330 1.00 50.12 H new ATOM 0 HB2 ALA A 105 -12.712 1.304 -24.682 1.00 50.12 H new ATOM 0 HB3 ALA A 105 -11.417 0.879 -23.538 1.00 50.12 H new ATOM 1618 N ALA A 106 -11.384 2.085 -20.856 1.00 1.54 N ATOM 1619 CA ALA A 106 -11.024 1.808 -19.471 1.00 75.32 C ATOM 1620 C ALA A 106 -11.755 2.743 -18.515 1.00 60.10 C ATOM 1621 O ALA A 106 -12.423 2.294 -17.584 1.00 23.43 O ATOM 1622 CB ALA A 106 -9.518 1.929 -19.282 1.00 64.15 C ATOM 0 H ALA A 106 -10.608 2.398 -21.439 1.00 1.54 H new ATOM 0 HA ALA A 106 -11.328 0.787 -19.241 1.00 75.32 H new ATOM 0 HB1 ALA A 106 -9.264 1.720 -18.243 1.00 64.15 H new ATOM 0 HB2 ALA A 106 -9.011 1.215 -19.931 1.00 64.15 H new ATOM 0 HB3 ALA A 106 -9.199 2.940 -19.537 1.00 64.15 H new ATOM 1628 N GLU A 107 -11.624 4.045 -18.752 1.00 52.01 N ATOM 1629 CA GLU A 107 -12.272 5.043 -17.909 1.00 42.52 C ATOM 1630 C GLU A 107 -13.789 4.875 -17.935 1.00 63.41 C ATOM 1631 O GLU A 107 -14.468 5.111 -16.937 1.00 62.43 O ATOM 1632 CB GLU A 107 -11.896 6.453 -18.369 1.00 65.33 C ATOM 1633 CG GLU A 107 -12.708 7.549 -17.699 1.00 53.04 C ATOM 1634 CD GLU A 107 -13.839 8.055 -18.573 1.00 10.12 C ATOM 1635 OE1 GLU A 107 -13.591 8.321 -19.768 1.00 72.31 O ATOM 1636 OE2 GLU A 107 -14.971 8.185 -18.062 1.00 65.35 O ATOM 0 H GLU A 107 -11.076 4.433 -19.520 1.00 52.01 H new ATOM 0 HA GLU A 107 -11.925 4.898 -16.886 1.00 42.52 H new ATOM 0 HB2 GLU A 107 -10.838 6.622 -18.168 1.00 65.33 H new ATOM 0 HB3 GLU A 107 -12.030 6.522 -19.449 1.00 65.33 H new ATOM 0 HG2 GLU A 107 -13.119 7.171 -16.763 1.00 53.04 H new ATOM 0 HG3 GLU A 107 -12.050 8.380 -17.446 1.00 53.04 H new ATOM 1643 N ASN A 108 -14.313 4.467 -19.087 1.00 53.01 N ATOM 1644 CA ASN A 108 -15.749 4.268 -19.245 1.00 41.15 C ATOM 1645 C ASN A 108 -16.267 3.232 -18.252 1.00 41.35 C ATOM 1646 O ASN A 108 -17.212 3.489 -17.507 1.00 1.15 O ATOM 1647 CB ASN A 108 -16.070 3.826 -20.675 1.00 34.43 C ATOM 1648 CG ASN A 108 -17.544 3.532 -20.871 1.00 44.25 C ATOM 1649 OD1 ASN A 108 -18.405 4.267 -20.387 1.00 54.14 O ATOM 1650 ND2 ASN A 108 -17.842 2.454 -21.587 1.00 71.42 N ATOM 0 H ASN A 108 -13.765 4.268 -19.924 1.00 53.01 H new ATOM 0 HA ASN A 108 -16.246 5.217 -19.045 1.00 41.15 H new ATOM 0 HB2 ASN A 108 -15.762 4.606 -21.371 1.00 34.43 H new ATOM 0 HB3 ASN A 108 -15.489 2.936 -20.916 1.00 34.43 H new ATOM 0 HD21 ASN A 108 -18.817 2.207 -21.755 1.00 71.42 H new ATOM 0 HD22 ASN A 108 -17.096 1.873 -21.969 1.00 71.42 H new ATOM 1657 N MET A 109 -15.642 2.059 -18.249 1.00 42.41 N ATOM 1658 CA MET A 109 -16.039 0.984 -17.347 1.00 41.21 C ATOM 1659 C MET A 109 -15.761 1.362 -15.896 1.00 13.33 C ATOM 1660 O MET A 109 -16.466 0.927 -14.984 1.00 73.22 O ATOM 1661 CB MET A 109 -15.300 -0.308 -17.701 1.00 23.22 C ATOM 1662 CG MET A 109 -15.752 -1.509 -16.887 1.00 30.22 C ATOM 1663 SD MET A 109 -14.372 -2.422 -16.171 1.00 13.12 S ATOM 1664 CE MET A 109 -13.823 -1.272 -14.912 1.00 24.41 C ATOM 0 H MET A 109 -14.859 1.829 -18.861 1.00 42.41 H new ATOM 0 HA MET A 109 -17.111 0.823 -17.463 1.00 41.21 H new ATOM 0 HB2 MET A 109 -15.445 -0.522 -18.760 1.00 23.22 H new ATOM 0 HB3 MET A 109 -14.231 -0.159 -17.550 1.00 23.22 H new ATOM 0 HG2 MET A 109 -16.414 -1.174 -16.089 1.00 30.22 H new ATOM 0 HG3 MET A 109 -16.333 -2.176 -17.523 1.00 30.22 H new ATOM 0 HE1 MET A 109 -13.042 -1.737 -14.310 1.00 24.41 H new ATOM 0 HE2 MET A 109 -13.429 -0.374 -15.387 1.00 24.41 H new ATOM 0 HE3 MET A 109 -14.664 -1.005 -14.272 1.00 24.41 H new ATOM 1674 N TYR A 110 -14.730 2.174 -15.688 1.00 13.42 N ATOM 1675 CA TYR A 110 -14.357 2.607 -14.347 1.00 33.10 C ATOM 1676 C TYR A 110 -15.515 3.331 -13.667 1.00 31.54 C ATOM 1677 O TYR A 110 -15.850 3.047 -12.517 1.00 5.32 O ATOM 1678 CB TYR A 110 -13.133 3.523 -14.406 1.00 14.12 C ATOM 1679 CG TYR A 110 -12.781 4.150 -13.076 1.00 62.43 C ATOM 1680 CD1 TYR A 110 -11.828 3.573 -12.244 1.00 62.04 C ATOM 1681 CD2 TYR A 110 -13.400 5.318 -12.650 1.00 23.50 C ATOM 1682 CE1 TYR A 110 -11.503 4.142 -11.028 1.00 2.25 C ATOM 1683 CE2 TYR A 110 -13.081 5.895 -11.437 1.00 15.24 C ATOM 1684 CZ TYR A 110 -12.132 5.303 -10.629 1.00 20.21 C ATOM 1685 OH TYR A 110 -11.812 5.874 -9.419 1.00 14.22 O ATOM 0 H TYR A 110 -14.138 2.545 -16.431 1.00 13.42 H new ATOM 0 HA TYR A 110 -14.112 1.721 -13.762 1.00 33.10 H new ATOM 0 HB2 TYR A 110 -12.278 2.950 -14.766 1.00 14.12 H new ATOM 0 HB3 TYR A 110 -13.316 4.314 -15.134 1.00 14.12 H new ATOM 0 HD1 TYR A 110 -11.333 2.664 -12.554 1.00 62.04 H new ATOM 0 HD2 TYR A 110 -14.144 5.783 -13.279 1.00 23.50 H new ATOM 0 HE1 TYR A 110 -10.761 3.681 -10.393 1.00 2.25 H new ATOM 0 HE2 TYR A 110 -13.571 6.804 -11.122 1.00 15.24 H new ATOM 0 HH TYR A 110 -12.344 6.687 -9.290 1.00 14.22 H new ATOM 1695 N SER A 111 -16.122 4.270 -14.387 1.00 12.10 N ATOM 1696 CA SER A 111 -17.240 5.038 -13.853 1.00 4.42 C ATOM 1697 C SER A 111 -18.559 4.306 -14.080 1.00 44.51 C ATOM 1698 O SER A 111 -19.503 4.451 -13.303 1.00 30.31 O ATOM 1699 CB SER A 111 -17.293 6.421 -14.505 1.00 51.41 C ATOM 1700 OG SER A 111 -18.356 7.195 -13.975 1.00 12.24 O ATOM 0 H SER A 111 -15.858 4.517 -15.341 1.00 12.10 H new ATOM 0 HA SER A 111 -17.089 5.155 -12.780 1.00 4.42 H new ATOM 0 HB2 SER A 111 -16.347 6.938 -14.345 1.00 51.41 H new ATOM 0 HB3 SER A 111 -17.419 6.314 -15.582 1.00 51.41 H new ATOM 0 HG SER A 111 -18.367 8.075 -14.407 1.00 12.24 H new ATOM 1706 N GLN A 112 -18.617 3.519 -15.149 1.00 24.41 N ATOM 1707 CA GLN A 112 -19.820 2.765 -15.479 1.00 54.13 C ATOM 1708 C GLN A 112 -20.278 1.925 -14.291 1.00 74.05 C ATOM 1709 O GLN A 112 -21.461 1.905 -13.952 1.00 51.24 O ATOM 1710 CB GLN A 112 -19.567 1.864 -16.688 1.00 62.14 C ATOM 1711 CG GLN A 112 -20.783 1.054 -17.110 1.00 14.35 C ATOM 1712 CD GLN A 112 -20.553 -0.441 -17.006 1.00 72.52 C ATOM 1713 OE1 GLN A 112 -20.259 -0.963 -15.930 1.00 11.02 O ATOM 1714 NE2 GLN A 112 -20.683 -1.140 -18.128 1.00 0.14 N ATOM 0 H GLN A 112 -17.844 3.387 -15.802 1.00 24.41 H new ATOM 0 HA GLN A 112 -20.609 3.476 -15.724 1.00 54.13 H new ATOM 0 HB2 GLN A 112 -19.242 2.479 -17.527 1.00 62.14 H new ATOM 0 HB3 GLN A 112 -18.749 1.182 -16.457 1.00 62.14 H new ATOM 0 HG2 GLN A 112 -21.633 1.331 -16.487 1.00 14.35 H new ATOM 0 HG3 GLN A 112 -21.045 1.307 -18.137 1.00 14.35 H new ATOM 0 HE21 GLN A 112 -20.928 -0.667 -18.998 1.00 0.14 H new ATOM 0 HE22 GLN A 112 -20.538 -2.150 -18.120 1.00 0.14 H new ATOM 1723 N MET A 113 -19.334 1.232 -13.663 1.00 72.33 N ATOM 1724 CA MET A 113 -19.640 0.390 -12.513 1.00 45.22 C ATOM 1725 C MET A 113 -18.998 0.945 -11.246 1.00 21.20 C ATOM 1726 O MET A 113 -18.867 0.242 -10.245 1.00 72.23 O ATOM 1727 CB MET A 113 -19.160 -1.041 -12.759 1.00 14.34 C ATOM 1728 CG MET A 113 -19.824 -2.069 -11.856 1.00 5.21 C ATOM 1729 SD MET A 113 -18.644 -2.932 -10.800 1.00 21.04 S ATOM 1730 CE MET A 113 -17.484 -3.545 -12.018 1.00 61.00 C ATOM 0 H MET A 113 -18.350 1.237 -13.932 1.00 72.33 H new ATOM 0 HA MET A 113 -20.721 0.383 -12.377 1.00 45.22 H new ATOM 0 HB2 MET A 113 -19.351 -1.306 -13.799 1.00 14.34 H new ATOM 0 HB3 MET A 113 -18.081 -1.084 -12.612 1.00 14.34 H new ATOM 0 HG2 MET A 113 -20.568 -1.573 -11.233 1.00 5.21 H new ATOM 0 HG3 MET A 113 -20.356 -2.796 -12.470 1.00 5.21 H new ATOM 0 HE1 MET A 113 -17.231 -4.580 -11.790 1.00 61.00 H new ATOM 0 HE2 MET A 113 -17.935 -3.491 -13.009 1.00 61.00 H new ATOM 0 HE3 MET A 113 -16.579 -2.937 -11.997 1.00 61.00 H new ATOM 1740 N GLY A 114 -18.597 2.212 -11.297 1.00 41.33 N ATOM 1741 CA GLY A 114 -17.972 2.839 -10.147 1.00 63.45 C ATOM 1742 C GLY A 114 -16.827 2.017 -9.590 1.00 31.12 C ATOM 1743 O GLY A 114 -16.535 2.076 -8.394 1.00 63.33 O ATOM 0 H GLY A 114 -18.694 2.815 -12.114 1.00 41.33 H new ATOM 0 HA2 GLY A 114 -17.603 3.825 -10.430 1.00 63.45 H new ATOM 0 HA3 GLY A 114 -18.720 2.990 -9.368 1.00 63.45 H new ATOM 1747 N LEU A 115 -16.178 1.247 -10.455 1.00 71.42 N ATOM 1748 CA LEU A 115 -15.059 0.407 -10.042 1.00 71.40 C ATOM 1749 C LEU A 115 -15.441 -0.461 -8.848 1.00 32.33 C ATOM 1750 O LEU A 115 -14.664 -0.614 -7.905 1.00 40.34 O ATOM 1751 CB LEU A 115 -13.848 1.273 -9.691 1.00 23.22 C ATOM 1752 CG LEU A 115 -12.484 0.723 -10.111 1.00 21.22 C ATOM 1753 CD1 LEU A 115 -12.180 -0.571 -9.374 1.00 1.11 C ATOM 1754 CD2 LEU A 115 -12.439 0.506 -11.616 1.00 75.43 C ATOM 0 H LEU A 115 -16.407 1.186 -11.447 1.00 71.42 H new ATOM 0 HA LEU A 115 -14.801 -0.247 -10.875 1.00 71.40 H new ATOM 0 HB2 LEU A 115 -13.980 2.252 -10.153 1.00 23.22 H new ATOM 0 HB3 LEU A 115 -13.838 1.428 -8.612 1.00 23.22 H new ATOM 0 HG LEU A 115 -11.721 1.454 -9.846 1.00 21.22 H new ATOM 0 HD11 LEU A 115 -11.206 -0.947 -9.686 1.00 1.11 H new ATOM 0 HD12 LEU A 115 -12.170 -0.384 -8.300 1.00 1.11 H new ATOM 0 HD13 LEU A 115 -12.946 -1.311 -9.607 1.00 1.11 H new ATOM 0 HD21 LEU A 115 -11.462 0.114 -11.898 1.00 75.43 H new ATOM 0 HD22 LEU A 115 -13.212 -0.206 -11.904 1.00 75.43 H new ATOM 0 HD23 LEU A 115 -12.611 1.454 -12.126 1.00 75.43 H new ATOM 1766 N ASP A 116 -16.641 -1.029 -8.897 1.00 34.12 N ATOM 1767 CA ASP A 116 -17.125 -1.885 -7.820 1.00 14.13 C ATOM 1768 C ASP A 116 -17.190 -1.118 -6.503 1.00 42.41 C ATOM 1769 O ASP A 116 -16.797 0.046 -6.429 1.00 65.11 O ATOM 1770 CB ASP A 116 -16.222 -3.109 -7.667 1.00 53.25 C ATOM 1771 CG ASP A 116 -16.777 -4.331 -8.373 1.00 2.53 C ATOM 1772 OD1 ASP A 116 -16.281 -4.660 -9.471 1.00 23.20 O ATOM 1773 OD2 ASP A 116 -17.708 -4.959 -7.827 1.00 12.44 O ATOM 0 H ASP A 116 -17.296 -0.912 -9.670 1.00 34.12 H new ATOM 0 HA ASP A 116 -18.131 -2.216 -8.077 1.00 14.13 H new ATOM 0 HB2 ASP A 116 -15.234 -2.880 -8.066 1.00 53.25 H new ATOM 0 HB3 ASP A 116 -16.094 -3.332 -6.608 1.00 53.25 H new ATOM 1778 N THR A 117 -17.690 -1.779 -5.463 1.00 13.41 N ATOM 1779 CA THR A 117 -17.809 -1.159 -4.150 1.00 12.31 C ATOM 1780 C THR A 117 -18.749 0.040 -4.190 1.00 32.11 C ATOM 1781 O THR A 117 -19.169 0.475 -5.262 1.00 21.41 O ATOM 1782 CB THR A 117 -16.437 -0.704 -3.617 1.00 14.21 C ATOM 1783 OG1 THR A 117 -15.390 -1.393 -4.310 1.00 12.23 O ATOM 1784 CG2 THR A 117 -16.322 -0.969 -2.123 1.00 2.33 C ATOM 0 H THR A 117 -18.019 -2.744 -5.505 1.00 13.41 H new ATOM 0 HA THR A 117 -18.218 -1.915 -3.480 1.00 12.31 H new ATOM 0 HB THR A 117 -16.342 0.368 -3.788 1.00 14.21 H new ATOM 0 HG1 THR A 117 -14.521 -1.097 -3.967 1.00 12.23 H new ATOM 0 HG21 THR A 117 -15.345 -0.640 -1.769 1.00 2.33 H new ATOM 0 HG22 THR A 117 -17.103 -0.421 -1.595 1.00 2.33 H new ATOM 0 HG23 THR A 117 -16.436 -2.036 -1.933 1.00 2.33 H new ATOM 1792 N ARG A 118 -19.075 0.571 -3.016 1.00 72.13 N ATOM 1793 CA ARG A 118 -19.966 1.720 -2.919 1.00 21.25 C ATOM 1794 C ARG A 118 -19.527 2.655 -1.795 1.00 15.23 C ATOM 1795 O ARG A 118 -18.787 2.271 -0.888 1.00 73.45 O ATOM 1796 CB ARG A 118 -21.405 1.259 -2.680 1.00 71.22 C ATOM 1797 CG ARG A 118 -22.219 1.122 -3.955 1.00 63.25 C ATOM 1798 CD ARG A 118 -23.649 1.599 -3.757 1.00 1.54 C ATOM 1799 NE ARG A 118 -24.513 1.220 -4.872 1.00 23.42 N ATOM 1800 CZ ARG A 118 -25.667 1.819 -5.144 1.00 60.23 C ATOM 1801 NH1 ARG A 118 -26.094 2.819 -4.386 1.00 11.10 N ATOM 1802 NH2 ARG A 118 -26.397 1.417 -6.177 1.00 53.12 N ATOM 0 H ARG A 118 -18.735 0.224 -2.119 1.00 72.13 H new ATOM 0 HA ARG A 118 -19.918 2.265 -3.862 1.00 21.25 H new ATOM 0 HB2 ARG A 118 -21.389 0.299 -2.164 1.00 71.22 H new ATOM 0 HB3 ARG A 118 -21.900 1.969 -2.017 1.00 71.22 H new ATOM 0 HG2 ARG A 118 -21.749 1.699 -4.752 1.00 63.25 H new ATOM 0 HG3 ARG A 118 -22.223 0.080 -4.275 1.00 63.25 H new ATOM 0 HD2 ARG A 118 -24.046 1.180 -2.832 1.00 1.54 H new ATOM 0 HD3 ARG A 118 -23.657 2.683 -3.645 1.00 1.54 H new ATOM 0 HE ARG A 118 -24.214 0.453 -5.475 1.00 23.42 H new ATOM 0 HH11 ARG A 118 -25.536 3.131 -3.591 1.00 11.10 H new ATOM 0 HH12 ARG A 118 -26.981 3.277 -4.598 1.00 11.10 H new ATOM 0 HH21 ARG A 118 -26.072 0.648 -6.763 1.00 53.12 H new ATOM 0 HH22 ARG A 118 -27.283 1.877 -6.385 1.00 53.12 H new ATOM 1816 N PRO A 119 -19.992 3.911 -1.854 1.00 0.14 N ATOM 1817 CA PRO A 119 -19.661 4.926 -0.849 1.00 13.30 C ATOM 1818 C PRO A 119 -20.314 4.642 0.499 1.00 5.23 C ATOM 1819 O PRO A 119 -19.718 4.874 1.551 1.00 55.02 O ATOM 1820 CB PRO A 119 -20.218 6.218 -1.452 1.00 32.33 C ATOM 1821 CG PRO A 119 -21.311 5.771 -2.360 1.00 3.55 C ATOM 1822 CD PRO A 119 -20.879 4.438 -2.905 1.00 74.20 C ATOM 0 HA PRO A 119 -18.591 4.962 -0.644 1.00 13.30 H new ATOM 0 HB2 PRO A 119 -20.595 6.886 -0.678 1.00 32.33 H new ATOM 0 HB3 PRO A 119 -19.449 6.764 -1.998 1.00 32.33 H new ATOM 0 HG2 PRO A 119 -22.255 5.685 -1.821 1.00 3.55 H new ATOM 0 HG3 PRO A 119 -21.468 6.489 -3.165 1.00 3.55 H new ATOM 0 HD2 PRO A 119 -21.730 3.780 -3.079 1.00 74.20 H new ATOM 0 HD3 PRO A 119 -20.357 4.543 -3.856 1.00 74.20 H new TER 1830 PRO A 119