USER MOD reduce.3.24.130724 H: found=0, std=0, add=713, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 712 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -158:sc= -0.195 (180deg=-0.76) USER MOD Single : A 1 MET N :NH3+ 178:sc= 0.315 (180deg=0.314) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -3.75! C(o=-3.7!,f=-5.9!) USER MOD Single : A 13 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.112) USER MOD Single : A 16 SER OG : rot -81:sc= 0.741 USER MOD Single : A 17 TYR OH : rot 180:sc= -0.2 USER MOD Single : A 22 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0224) USER MOD Single : A 23 MET CE :methyl -164:sc= -4.89! (180deg=-5.95!) USER MOD Single : A 26 THR OG1 : rot 93:sc= 0.554 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 34 MET CE :methyl 156:sc= -0.0368 (180deg=-0.243) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= 0.776 K(o=0.78,f=-0.67) USER MOD Single : B 101 MET CE :methyl 171:sc= -1 (180deg=-1.24) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 105 ASN :FLIP amide:sc= -2.27 F(o=-5.5!,f=-2.3) USER MOD Single : B 113 LYS NZ :NH3+ -136:sc= 1.24 (180deg=0.525) USER MOD Single : B 116 SER OG : rot -81:sc= 0.915 USER MOD Single : B 117 TYR OH : rot 30:sc=-0.00583 USER MOD Single : B 122 LYS NZ :NH3+ -150:sc= 1.27 (180deg=-0.494) USER MOD Single : B 123 MET CE :methyl 176:sc= -0.828 (180deg=-0.89) USER MOD Single : B 126 THR OG1 : rot 92:sc= 0.54 USER MOD Single : B 128 SER OG : rot -86:sc= 0.112 USER MOD Single : B 134 MET CE :methyl -172:sc= -0.256 (180deg=-0.649) USER MOD Single : B 137 TYR OH : rot 180:sc= 0 USER MOD Single : B 141 ASN : amide:sc= 0.717 K(o=0.72,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.590 13.192 11.648 1.00 0.00 N ATOM 2 CA MET A 1 -2.938 11.918 11.262 1.00 0.00 C ATOM 3 C MET A 1 -3.192 10.852 12.315 1.00 0.00 C ATOM 4 O MET A 1 -3.385 11.148 13.492 1.00 0.00 O ATOM 5 CB MET A 1 -1.421 12.116 11.074 1.00 0.00 C ATOM 6 CG MET A 1 -0.602 10.829 11.028 1.00 0.00 C ATOM 7 SD MET A 1 1.152 11.092 10.726 1.00 0.00 S ATOM 8 CE MET A 1 1.098 11.875 9.115 1.00 0.00 C ATOM 0 H1 MET A 1 -3.379 13.920 10.936 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.619 13.052 11.706 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.230 13.500 12.574 1.00 0.00 H new ATOM 0 HA MET A 1 -3.368 11.592 10.315 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.254 12.668 10.149 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.048 12.737 11.888 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.723 10.299 11.973 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.002 10.183 10.247 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.060 11.752 8.618 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.316 11.413 8.512 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.884 12.937 9.234 1.00 0.00 H new ATOM 18 N GLY A 2 -3.183 9.605 11.868 1.00 0.00 N ATOM 19 CA GLY A 2 -3.367 8.476 12.759 1.00 0.00 C ATOM 20 C GLY A 2 -2.512 7.293 12.351 1.00 0.00 C ATOM 21 O GLY A 2 -1.940 7.274 11.256 1.00 0.00 O ATOM 0 H GLY A 2 -3.049 9.352 10.889 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -3.116 8.772 13.778 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -4.417 8.182 12.762 1.00 0.00 H new ATOM 25 N SER A 3 -2.406 6.318 13.243 1.00 0.00 N ATOM 26 CA SER A 3 -1.599 5.143 13.013 1.00 0.00 C ATOM 27 C SER A 3 -2.461 3.889 12.902 1.00 0.00 C ATOM 28 O SER A 3 -3.460 3.752 13.616 1.00 0.00 O ATOM 29 CB SER A 3 -0.550 5.000 14.111 1.00 0.00 C ATOM 30 OG SER A 3 -1.138 5.111 15.397 1.00 0.00 O ATOM 0 H SER A 3 -2.881 6.326 14.146 1.00 0.00 H new ATOM 0 HA SER A 3 -1.084 5.263 12.060 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.051 4.035 14.018 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.215 5.767 13.990 1.00 0.00 H new ATOM 0 HG SER A 3 -0.445 5.014 16.083 1.00 0.00 H new ATOM 36 N ILE A 4 -2.087 2.989 12.005 1.00 0.00 N ATOM 37 CA ILE A 4 -2.817 1.742 11.799 1.00 0.00 C ATOM 38 C ILE A 4 -1.849 0.568 11.844 1.00 0.00 C ATOM 39 O ILE A 4 -0.632 0.753 11.753 1.00 0.00 O ATOM 40 CB ILE A 4 -3.586 1.746 10.442 1.00 0.00 C ATOM 41 CG1 ILE A 4 -2.627 1.661 9.230 1.00 0.00 C ATOM 42 CG2 ILE A 4 -4.451 3.004 10.345 1.00 0.00 C ATOM 43 CD1 ILE A 4 -2.340 0.244 8.736 1.00 0.00 C ATOM 0 H ILE A 4 -1.273 3.099 11.401 1.00 0.00 H new ATOM 0 HA ILE A 4 -3.552 1.644 12.598 1.00 0.00 H new ATOM 0 HB ILE A 4 -4.220 0.860 10.415 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -3.051 2.238 8.408 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -1.683 2.135 9.498 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.987 3.005 9.396 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.167 3.017 11.167 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.816 3.888 10.403 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -1.659 0.286 7.886 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -1.883 -0.335 9.538 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.273 -0.231 8.431 1.00 0.00 H new ATOM 55 N ASN A 5 -2.378 -0.652 11.968 1.00 0.00 N ATOM 56 CA ASN A 5 -1.543 -1.840 12.082 1.00 0.00 C ATOM 57 C ASN A 5 -1.521 -2.600 10.753 1.00 0.00 C ATOM 58 O ASN A 5 -2.566 -2.854 10.161 1.00 0.00 O ATOM 59 CB ASN A 5 -2.074 -2.751 13.190 1.00 0.00 C ATOM 60 CG ASN A 5 -1.132 -3.914 13.473 1.00 0.00 C ATOM 61 OD1 ASN A 5 -0.215 -3.793 14.276 1.00 0.00 O ATOM 62 ND2 ASN A 5 -1.371 -5.040 12.830 1.00 0.00 N ATOM 0 H ASN A 5 -3.381 -0.838 11.992 1.00 0.00 H new ATOM 0 HA ASN A 5 -0.528 -1.530 12.331 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -2.216 -2.169 14.101 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -3.052 -3.138 12.904 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -0.781 -5.856 12.993 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -2.146 -5.095 12.170 1.00 0.00 H new ATOM 69 N LEU A 6 -0.322 -2.933 10.305 1.00 0.00 N ATOM 70 CA LEU A 6 -0.119 -3.725 9.099 1.00 0.00 C ATOM 71 C LEU A 6 0.468 -5.080 9.509 1.00 0.00 C ATOM 72 O LEU A 6 1.256 -5.145 10.450 1.00 0.00 O ATOM 73 CB LEU A 6 0.824 -2.934 8.166 1.00 0.00 C ATOM 74 CG LEU A 6 1.076 -3.497 6.759 1.00 0.00 C ATOM 75 CD1 LEU A 6 2.231 -4.499 6.748 1.00 0.00 C ATOM 76 CD2 LEU A 6 -0.183 -4.141 6.179 1.00 0.00 C ATOM 0 H LEU A 6 0.544 -2.661 10.769 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.050 -3.912 8.564 1.00 0.00 H new ATOM 0 HB2 LEU A 6 0.420 -1.927 8.057 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.788 -2.838 8.666 1.00 0.00 H new ATOM 0 HG LEU A 6 1.353 -2.652 6.129 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.378 -4.874 5.735 1.00 0.00 H new ATOM 0 HD12 LEU A 6 3.142 -4.007 7.088 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.997 -5.331 7.413 1.00 0.00 H new ATOM 0 HD21 LEU A 6 0.032 -4.528 5.183 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -0.504 -4.958 6.825 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -0.976 -3.396 6.115 1.00 0.00 H new ATOM 88 N ARG A 7 0.077 -6.164 8.834 1.00 0.00 N ATOM 89 CA ARG A 7 0.458 -7.517 9.241 1.00 0.00 C ATOM 90 C ARG A 7 0.853 -8.316 7.994 1.00 0.00 C ATOM 91 O ARG A 7 0.002 -8.634 7.177 1.00 0.00 O ATOM 92 CB ARG A 7 -0.693 -8.224 9.965 1.00 0.00 C ATOM 93 CG ARG A 7 -0.793 -7.917 11.446 1.00 0.00 C ATOM 94 CD ARG A 7 0.138 -8.819 12.267 1.00 0.00 C ATOM 95 NE ARG A 7 0.042 -8.562 13.707 1.00 0.00 N ATOM 96 CZ ARG A 7 0.871 -9.075 14.625 1.00 0.00 C ATOM 97 NH1 ARG A 7 1.787 -9.979 14.267 1.00 0.00 N ATOM 98 NH2 ARG A 7 0.769 -8.711 15.897 1.00 0.00 N ATOM 0 H ARG A 7 -0.507 -6.129 7.998 1.00 0.00 H new ATOM 0 HA ARG A 7 1.299 -7.452 9.932 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -1.631 -7.945 9.486 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -0.578 -9.300 9.838 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -0.537 -6.872 11.621 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -1.822 -8.054 11.779 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -0.106 -9.863 12.070 1.00 0.00 H new ATOM 0 HD3 ARG A 7 1.167 -8.666 11.942 1.00 0.00 H new ATOM 0 HE ARG A 7 -0.707 -7.951 14.032 1.00 0.00 H new ATOM 0 HH11 ARG A 7 1.855 -10.279 13.294 1.00 0.00 H new ATOM 0 HH12 ARG A 7 2.418 -10.370 14.966 1.00 0.00 H new ATOM 0 HH21 ARG A 7 0.057 -8.038 16.179 1.00 0.00 H new ATOM 0 HH22 ARG A 7 1.403 -9.105 16.593 1.00 0.00 H new ATOM 112 N ILE A 8 2.132 -8.641 7.860 1.00 0.00 N ATOM 113 CA ILE A 8 2.618 -9.446 6.721 1.00 0.00 C ATOM 114 C ILE A 8 3.684 -10.422 7.183 1.00 0.00 C ATOM 115 O ILE A 8 4.132 -10.373 8.332 1.00 0.00 O ATOM 116 CB ILE A 8 3.207 -8.584 5.564 1.00 0.00 C ATOM 117 CG1 ILE A 8 4.593 -7.992 5.933 1.00 0.00 C ATOM 118 CG2 ILE A 8 2.218 -7.498 5.132 1.00 0.00 C ATOM 119 CD1 ILE A 8 4.599 -7.075 7.145 1.00 0.00 C ATOM 0 H ILE A 8 2.860 -8.365 8.519 1.00 0.00 H new ATOM 0 HA ILE A 8 1.746 -9.974 6.334 1.00 0.00 H new ATOM 0 HB ILE A 8 3.367 -9.242 4.710 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.285 -8.814 6.115 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.974 -7.438 5.075 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.653 -6.910 4.324 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.295 -7.963 4.786 1.00 0.00 H new ATOM 0 HG23 ILE A 8 2.001 -6.846 5.978 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.612 -6.712 7.322 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.937 -6.228 6.964 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.253 -7.626 8.020 1.00 0.00 H new ATOM 131 N ASP A 9 4.110 -11.283 6.288 1.00 0.00 N ATOM 132 CA ASP A 9 5.210 -12.184 6.557 1.00 0.00 C ATOM 133 C ASP A 9 6.505 -11.401 6.724 1.00 0.00 C ATOM 134 O ASP A 9 6.780 -10.510 5.925 1.00 0.00 O ATOM 135 CB ASP A 9 5.374 -13.202 5.418 1.00 0.00 C ATOM 136 CG ASP A 9 4.221 -14.176 5.311 1.00 0.00 C ATOM 137 OD1 ASP A 9 4.213 -15.187 6.052 1.00 0.00 O ATOM 138 OD2 ASP A 9 3.325 -13.949 4.476 1.00 0.00 O ATOM 0 H ASP A 9 3.707 -11.380 5.356 1.00 0.00 H new ATOM 0 HA ASP A 9 4.987 -12.719 7.480 1.00 0.00 H new ATOM 0 HB2 ASP A 9 5.476 -12.666 4.474 1.00 0.00 H new ATOM 0 HB3 ASP A 9 6.298 -13.760 5.570 1.00 0.00 H new ATOM 143 N ASP A 10 7.289 -11.723 7.743 1.00 0.00 N ATOM 144 CA ASP A 10 8.523 -11.008 8.040 1.00 0.00 C ATOM 145 C ASP A 10 9.463 -11.050 6.838 1.00 0.00 C ATOM 146 O ASP A 10 10.231 -10.105 6.601 1.00 0.00 O ATOM 147 CB ASP A 10 9.204 -11.587 9.280 1.00 0.00 C ATOM 148 CG ASP A 10 9.741 -12.995 9.075 1.00 0.00 C ATOM 149 OD1 ASP A 10 8.994 -13.960 9.304 1.00 0.00 O ATOM 150 OD2 ASP A 10 10.930 -13.128 8.693 1.00 0.00 O ATOM 0 H ASP A 10 7.088 -12.487 8.388 1.00 0.00 H new ATOM 0 HA ASP A 10 8.275 -9.967 8.249 1.00 0.00 H new ATOM 0 HB2 ASP A 10 10.025 -10.933 9.573 1.00 0.00 H new ATOM 0 HB3 ASP A 10 8.492 -11.595 10.106 1.00 0.00 H new ATOM 155 N GLU A 11 9.379 -12.135 6.064 1.00 0.00 N ATOM 156 CA GLU A 11 10.221 -12.320 4.880 1.00 0.00 C ATOM 157 C GLU A 11 9.925 -11.267 3.824 1.00 0.00 C ATOM 158 O GLU A 11 10.826 -10.807 3.124 1.00 0.00 O ATOM 159 CB GLU A 11 10.007 -13.724 4.288 1.00 0.00 C ATOM 160 CG GLU A 11 8.561 -14.012 3.943 1.00 0.00 C ATOM 161 CD GLU A 11 8.360 -15.397 3.334 1.00 0.00 C ATOM 162 OE1 GLU A 11 8.189 -16.374 4.107 1.00 0.00 O ATOM 163 OE2 GLU A 11 8.365 -15.510 2.089 1.00 0.00 O ATOM 0 H GLU A 11 8.731 -12.904 6.238 1.00 0.00 H new ATOM 0 HA GLU A 11 11.261 -12.213 5.190 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.616 -13.829 3.390 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.359 -14.469 5.001 1.00 0.00 H new ATOM 0 HG2 GLU A 11 7.954 -13.925 4.844 1.00 0.00 H new ATOM 0 HG3 GLU A 11 8.203 -13.257 3.243 1.00 0.00 H new ATOM 170 N LEU A 12 8.666 -10.852 3.736 1.00 0.00 N ATOM 171 CA LEU A 12 8.239 -9.907 2.728 1.00 0.00 C ATOM 172 C LEU A 12 8.547 -8.498 3.211 1.00 0.00 C ATOM 173 O LEU A 12 8.979 -7.622 2.451 1.00 0.00 O ATOM 174 CB LEU A 12 6.737 -10.063 2.447 1.00 0.00 C ATOM 175 CG LEU A 12 6.140 -9.078 1.423 1.00 0.00 C ATOM 176 CD1 LEU A 12 6.844 -9.199 0.073 1.00 0.00 C ATOM 177 CD2 LEU A 12 4.634 -9.298 1.278 1.00 0.00 C ATOM 0 H LEU A 12 7.922 -11.163 4.360 1.00 0.00 H new ATOM 0 HA LEU A 12 8.775 -10.098 1.799 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.556 -11.078 2.094 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.197 -9.952 3.387 1.00 0.00 H new ATOM 0 HG LEU A 12 6.301 -8.065 1.792 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.404 -8.493 -0.631 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.904 -8.977 0.194 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.727 -10.213 -0.309 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.232 -8.593 0.551 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.446 -10.317 0.938 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.149 -9.142 2.242 1.00 0.00 H new ATOM 189 N LYS A 13 8.302 -8.288 4.501 1.00 0.00 N ATOM 190 CA LYS A 13 8.657 -7.053 5.185 1.00 0.00 C ATOM 191 C LYS A 13 10.119 -6.683 4.888 1.00 0.00 C ATOM 192 O LYS A 13 10.398 -5.577 4.462 1.00 0.00 O ATOM 193 CB LYS A 13 8.470 -7.214 6.684 1.00 0.00 C ATOM 194 CG LYS A 13 9.096 -6.095 7.505 1.00 0.00 C ATOM 195 CD LYS A 13 9.335 -6.545 8.935 1.00 0.00 C ATOM 196 CE LYS A 13 10.002 -5.444 9.768 1.00 0.00 C ATOM 197 NZ LYS A 13 11.380 -5.115 9.276 1.00 0.00 N ATOM 0 H LYS A 13 7.849 -8.975 5.103 1.00 0.00 H new ATOM 0 HA LYS A 13 8.005 -6.257 4.824 1.00 0.00 H new ATOM 0 HB2 LYS A 13 7.404 -7.261 6.905 1.00 0.00 H new ATOM 0 HB3 LYS A 13 8.902 -8.165 6.995 1.00 0.00 H new ATOM 0 HG2 LYS A 13 10.039 -5.790 7.052 1.00 0.00 H new ATOM 0 HG3 LYS A 13 8.442 -5.223 7.498 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.386 -6.824 9.393 1.00 0.00 H new ATOM 0 HD3 LYS A 13 9.964 -7.435 8.937 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.385 -4.546 9.741 1.00 0.00 H new ATOM 0 HE3 LYS A 13 10.056 -5.762 10.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 11.855 -4.495 9.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 11.928 -5.992 9.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 11.314 -4.630 8.358 1.00 0.00 H new ATOM 211 N ALA A 14 11.022 -7.622 5.137 1.00 0.00 N ATOM 212 CA ALA A 14 12.442 -7.389 4.966 1.00 0.00 C ATOM 213 C ALA A 14 12.774 -6.853 3.567 1.00 0.00 C ATOM 214 O ALA A 14 13.445 -5.836 3.425 1.00 0.00 O ATOM 215 CB ALA A 14 13.231 -8.659 5.255 1.00 0.00 C ATOM 0 H ALA A 14 10.788 -8.560 5.461 1.00 0.00 H new ATOM 0 HA ALA A 14 12.734 -6.622 5.684 1.00 0.00 H new ATOM 0 HB1 ALA A 14 14.295 -8.465 5.121 1.00 0.00 H new ATOM 0 HB2 ALA A 14 13.046 -8.977 6.281 1.00 0.00 H new ATOM 0 HB3 ALA A 14 12.917 -9.446 4.570 1.00 0.00 H new ATOM 221 N ARG A 15 12.289 -7.552 2.544 1.00 0.00 N ATOM 222 CA ARG A 15 12.590 -7.190 1.157 1.00 0.00 C ATOM 223 C ARG A 15 12.023 -5.817 0.784 1.00 0.00 C ATOM 224 O ARG A 15 12.733 -4.979 0.221 1.00 0.00 O ATOM 225 CB ARG A 15 12.062 -8.257 0.182 1.00 0.00 C ATOM 226 CG ARG A 15 12.990 -9.447 0.008 1.00 0.00 C ATOM 227 CD ARG A 15 13.286 -10.163 1.323 1.00 0.00 C ATOM 228 NE ARG A 15 14.141 -11.324 1.125 1.00 0.00 N ATOM 229 CZ ARG A 15 13.748 -12.584 1.314 1.00 0.00 C ATOM 230 NH1 ARG A 15 12.525 -12.807 1.767 1.00 0.00 N ATOM 231 NH2 ARG A 15 14.575 -13.573 1.082 1.00 0.00 N ATOM 0 H ARG A 15 11.688 -8.370 2.646 1.00 0.00 H new ATOM 0 HA ARG A 15 13.676 -7.138 1.075 1.00 0.00 H new ATOM 0 HB2 ARG A 15 11.095 -8.612 0.537 1.00 0.00 H new ATOM 0 HB3 ARG A 15 11.894 -7.795 -0.791 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.542 -10.152 -0.692 1.00 0.00 H new ATOM 0 HG3 ARG A 15 13.927 -9.110 -0.436 1.00 0.00 H new ATOM 0 HD2 ARG A 15 13.767 -9.471 2.014 1.00 0.00 H new ATOM 0 HD3 ARG A 15 12.350 -10.476 1.786 1.00 0.00 H new ATOM 0 HE ARG A 15 15.102 -11.164 0.822 1.00 0.00 H new ATOM 0 HH11 ARG A 15 11.903 -12.023 1.964 1.00 0.00 H new ATOM 0 HH12 ARG A 15 12.204 -13.763 1.919 1.00 0.00 H new ATOM 0 HH21 ARG A 15 15.522 -13.380 0.756 1.00 0.00 H new ATOM 0 HH22 ARG A 15 14.272 -14.536 1.227 1.00 0.00 H new ATOM 245 N SER A 16 10.747 -5.612 1.080 1.00 0.00 N ATOM 246 CA SER A 16 10.077 -4.358 0.742 1.00 0.00 C ATOM 247 C SER A 16 10.759 -3.162 1.395 1.00 0.00 C ATOM 248 O SER A 16 11.118 -2.193 0.728 1.00 0.00 O ATOM 249 CB SER A 16 8.616 -4.434 1.174 1.00 0.00 C ATOM 250 OG SER A 16 8.513 -4.784 2.533 1.00 0.00 O ATOM 0 H SER A 16 10.154 -6.294 1.552 1.00 0.00 H new ATOM 0 HA SER A 16 10.136 -4.217 -0.337 1.00 0.00 H new ATOM 0 HB2 SER A 16 8.132 -3.472 1.004 1.00 0.00 H new ATOM 0 HB3 SER A 16 8.090 -5.168 0.564 1.00 0.00 H new ATOM 0 HG SER A 16 8.607 -5.755 2.629 1.00 0.00 H new ATOM 256 N TYR A 17 10.956 -3.264 2.696 1.00 0.00 N ATOM 257 CA TYR A 17 11.637 -2.226 3.457 1.00 0.00 C ATOM 258 C TYR A 17 13.042 -1.972 2.910 1.00 0.00 C ATOM 259 O TYR A 17 13.489 -0.823 2.848 1.00 0.00 O ATOM 260 CB TYR A 17 11.716 -2.620 4.946 1.00 0.00 C ATOM 261 CG TYR A 17 10.435 -2.344 5.718 1.00 0.00 C ATOM 262 CD1 TYR A 17 9.223 -2.905 5.341 1.00 0.00 C ATOM 263 CD2 TYR A 17 10.438 -1.488 6.813 1.00 0.00 C ATOM 264 CE1 TYR A 17 8.060 -2.634 6.035 1.00 0.00 C ATOM 265 CE2 TYR A 17 9.274 -1.204 7.516 1.00 0.00 C ATOM 266 CZ TYR A 17 8.087 -1.793 7.112 1.00 0.00 C ATOM 267 OH TYR A 17 6.923 -1.527 7.801 1.00 0.00 O ATOM 0 H TYR A 17 10.652 -4.062 3.255 1.00 0.00 H new ATOM 0 HA TYR A 17 11.061 -1.306 3.359 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.953 -3.681 5.020 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.537 -2.076 5.414 1.00 0.00 H new ATOM 0 HD1 TYR A 17 9.188 -3.567 4.488 1.00 0.00 H new ATOM 0 HD2 TYR A 17 11.367 -1.033 7.125 1.00 0.00 H new ATOM 0 HE1 TYR A 17 7.129 -3.087 5.727 1.00 0.00 H new ATOM 0 HE2 TYR A 17 9.294 -0.535 8.364 1.00 0.00 H new ATOM 0 HH TYR A 17 7.113 -0.912 8.540 1.00 0.00 H new ATOM 277 N ALA A 18 13.711 -3.038 2.476 1.00 0.00 N ATOM 278 CA ALA A 18 15.053 -2.936 1.895 1.00 0.00 C ATOM 279 C ALA A 18 15.028 -2.067 0.630 1.00 0.00 C ATOM 280 O ALA A 18 15.861 -1.181 0.453 1.00 0.00 O ATOM 281 CB ALA A 18 15.616 -4.313 1.577 1.00 0.00 C ATOM 0 H ALA A 18 13.345 -3.989 2.515 1.00 0.00 H new ATOM 0 HA ALA A 18 15.703 -2.463 2.632 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.612 -4.208 1.147 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.676 -4.902 2.492 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.964 -4.817 0.863 1.00 0.00 H new ATOM 287 N ALA A 19 14.030 -2.309 -0.212 1.00 0.00 N ATOM 288 CA ALA A 19 13.885 -1.591 -1.476 1.00 0.00 C ATOM 289 C ALA A 19 13.616 -0.098 -1.255 1.00 0.00 C ATOM 290 O ALA A 19 14.196 0.759 -1.935 1.00 0.00 O ATOM 291 CB ALA A 19 12.749 -2.211 -2.284 1.00 0.00 C ATOM 0 H ALA A 19 13.302 -3.003 -0.041 1.00 0.00 H new ATOM 0 HA ALA A 19 14.823 -1.678 -2.024 1.00 0.00 H new ATOM 0 HB1 ALA A 19 12.640 -1.676 -3.227 1.00 0.00 H new ATOM 0 HB2 ALA A 19 12.975 -3.258 -2.485 1.00 0.00 H new ATOM 0 HB3 ALA A 19 11.820 -2.142 -1.718 1.00 0.00 H new ATOM 297 N LEU A 20 12.743 0.223 -0.304 1.00 0.00 N ATOM 298 CA LEU A 20 12.336 1.612 -0.093 1.00 0.00 C ATOM 299 C LEU A 20 13.428 2.401 0.639 1.00 0.00 C ATOM 300 O LEU A 20 13.617 3.585 0.356 1.00 0.00 O ATOM 301 CB LEU A 20 10.974 1.675 0.632 1.00 0.00 C ATOM 302 CG LEU A 20 10.913 1.025 2.026 1.00 0.00 C ATOM 303 CD1 LEU A 20 11.425 1.981 3.107 1.00 0.00 C ATOM 304 CD2 LEU A 20 9.491 0.558 2.337 1.00 0.00 C ATOM 0 H LEU A 20 12.307 -0.450 0.327 1.00 0.00 H new ATOM 0 HA LEU A 20 12.205 2.089 -1.064 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.687 2.722 0.730 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.227 1.197 -0.001 1.00 0.00 H new ATOM 0 HG LEU A 20 11.567 0.153 2.022 1.00 0.00 H new ATOM 0 HD11 LEU A 20 11.369 1.493 4.080 1.00 0.00 H new ATOM 0 HD12 LEU A 20 12.460 2.250 2.895 1.00 0.00 H new ATOM 0 HD13 LEU A 20 10.811 2.881 3.117 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.466 0.101 3.326 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.814 1.412 2.315 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.177 -0.173 1.592 1.00 0.00 H new ATOM 316 N GLU A 21 14.162 1.753 1.554 1.00 0.00 N ATOM 317 CA GLU A 21 15.273 2.429 2.242 1.00 0.00 C ATOM 318 C GLU A 21 16.445 2.602 1.280 1.00 0.00 C ATOM 319 O GLU A 21 17.279 3.490 1.463 1.00 0.00 O ATOM 320 CB GLU A 21 15.727 1.639 3.473 1.00 0.00 C ATOM 321 CG GLU A 21 16.226 0.234 3.157 1.00 0.00 C ATOM 322 CD GLU A 21 16.884 -0.429 4.351 1.00 0.00 C ATOM 323 OE1 GLU A 21 18.058 -0.111 4.637 1.00 0.00 O ATOM 324 OE2 GLU A 21 16.252 -1.277 5.005 1.00 0.00 O ATOM 0 H GLU A 21 14.013 0.783 1.831 1.00 0.00 H new ATOM 0 HA GLU A 21 14.923 3.406 2.575 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.522 2.192 3.974 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.896 1.569 4.174 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.389 -0.378 2.820 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.938 0.281 2.333 1.00 0.00 H new ATOM 331 N LYS A 22 16.491 1.752 0.268 1.00 0.00 N ATOM 332 CA LYS A 22 17.477 1.849 -0.797 1.00 0.00 C ATOM 333 C LYS A 22 17.268 3.157 -1.552 1.00 0.00 C ATOM 334 O LYS A 22 18.202 3.919 -1.807 1.00 0.00 O ATOM 335 CB LYS A 22 17.279 0.637 -1.736 1.00 0.00 C ATOM 336 CG LYS A 22 18.139 0.611 -2.985 1.00 0.00 C ATOM 337 CD LYS A 22 17.631 -0.464 -3.945 1.00 0.00 C ATOM 338 CE LYS A 22 18.494 -0.550 -5.201 1.00 0.00 C ATOM 339 NZ LYS A 22 19.829 -1.122 -4.923 1.00 0.00 N ATOM 0 H LYS A 22 15.843 0.972 0.161 1.00 0.00 H new ATOM 0 HA LYS A 22 18.492 1.841 -0.398 1.00 0.00 H new ATOM 0 HB2 LYS A 22 17.473 -0.272 -1.167 1.00 0.00 H new ATOM 0 HB3 LYS A 22 16.233 0.606 -2.040 1.00 0.00 H new ATOM 0 HG2 LYS A 22 18.117 1.586 -3.472 1.00 0.00 H new ATOM 0 HG3 LYS A 22 19.177 0.411 -2.718 1.00 0.00 H new ATOM 0 HD2 LYS A 22 17.625 -1.430 -3.440 1.00 0.00 H new ATOM 0 HD3 LYS A 22 16.601 -0.245 -4.225 1.00 0.00 H new ATOM 0 HE2 LYS A 22 17.987 -1.162 -5.947 1.00 0.00 H new ATOM 0 HE3 LYS A 22 18.609 0.446 -5.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 20.349 -1.240 -5.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 20.357 -0.482 -4.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 19.721 -2.047 -4.461 1.00 0.00 H new ATOM 353 N MET A 23 16.006 3.397 -1.913 1.00 0.00 N ATOM 354 CA MET A 23 15.596 4.632 -2.580 1.00 0.00 C ATOM 355 C MET A 23 15.622 5.817 -1.608 1.00 0.00 C ATOM 356 O MET A 23 15.566 6.972 -2.038 1.00 0.00 O ATOM 357 CB MET A 23 14.200 4.474 -3.184 1.00 0.00 C ATOM 358 CG MET A 23 14.121 3.453 -4.299 1.00 0.00 C ATOM 359 SD MET A 23 12.475 3.362 -5.028 1.00 0.00 S ATOM 360 CE MET A 23 11.510 2.926 -3.594 1.00 0.00 C ATOM 0 H MET A 23 15.242 2.741 -1.751 1.00 0.00 H new ATOM 0 HA MET A 23 16.306 4.834 -3.382 1.00 0.00 H new ATOM 0 HB2 MET A 23 13.504 4.189 -2.395 1.00 0.00 H new ATOM 0 HB3 MET A 23 13.870 5.440 -3.566 1.00 0.00 H new ATOM 0 HG2 MET A 23 14.845 3.707 -5.073 1.00 0.00 H new ATOM 0 HG3 MET A 23 14.399 2.473 -3.911 1.00 0.00 H new ATOM 0 HE1 MET A 23 10.535 2.556 -3.910 1.00 0.00 H new ATOM 0 HE2 MET A 23 12.027 2.150 -3.030 1.00 0.00 H new ATOM 0 HE3 MET A 23 11.377 3.805 -2.964 1.00 0.00 H new ATOM 370 N GLY A 24 15.674 5.517 -0.312 1.00 0.00 N ATOM 371 CA GLY A 24 15.772 6.541 0.709 1.00 0.00 C ATOM 372 C GLY A 24 14.427 7.042 1.192 1.00 0.00 C ATOM 373 O GLY A 24 14.351 8.066 1.873 1.00 0.00 O ATOM 0 H GLY A 24 15.649 4.564 0.051 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.330 6.145 1.558 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.344 7.381 0.316 1.00 0.00 H new ATOM 377 N VAL A 25 13.361 6.323 0.858 1.00 0.00 N ATOM 378 CA VAL A 25 12.016 6.715 1.265 1.00 0.00 C ATOM 379 C VAL A 25 11.634 5.988 2.563 1.00 0.00 C ATOM 380 O VAL A 25 12.086 4.870 2.809 1.00 0.00 O ATOM 381 CB VAL A 25 10.986 6.358 0.170 1.00 0.00 C ATOM 382 CG1 VAL A 25 9.635 6.988 0.465 1.00 0.00 C ATOM 383 CG2 VAL A 25 11.494 6.715 -1.228 1.00 0.00 C ATOM 0 H VAL A 25 13.402 5.466 0.307 1.00 0.00 H new ATOM 0 HA VAL A 25 12.009 7.793 1.423 1.00 0.00 H new ATOM 0 HB VAL A 25 10.851 5.276 0.184 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.929 6.720 -0.321 1.00 0.00 H new ATOM 0 HG12 VAL A 25 9.265 6.624 1.424 1.00 0.00 H new ATOM 0 HG13 VAL A 25 9.740 8.072 0.505 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.740 6.448 -1.968 1.00 0.00 H new ATOM 0 HG22 VAL A 25 11.691 7.786 -1.281 1.00 0.00 H new ATOM 0 HG23 VAL A 25 12.413 6.166 -1.432 1.00 0.00 H new ATOM 393 N THR A 26 10.817 6.637 3.389 1.00 0.00 N ATOM 394 CA THR A 26 10.350 6.032 4.632 1.00 0.00 C ATOM 395 C THR A 26 9.254 5.000 4.334 1.00 0.00 C ATOM 396 O THR A 26 8.420 5.225 3.447 1.00 0.00 O ATOM 397 CB THR A 26 9.773 7.135 5.544 1.00 0.00 C ATOM 398 OG1 THR A 26 10.754 8.162 5.725 1.00 0.00 O ATOM 399 CG2 THR A 26 9.327 6.591 6.886 1.00 0.00 C ATOM 0 H THR A 26 10.466 7.580 3.220 1.00 0.00 H new ATOM 0 HA THR A 26 11.185 5.535 5.127 1.00 0.00 H new ATOM 0 HB THR A 26 8.889 7.547 5.057 1.00 0.00 H new ATOM 0 HG1 THR A 26 10.627 8.859 5.047 1.00 0.00 H new ATOM 0 HG21 THR A 26 8.928 7.403 7.494 1.00 0.00 H new ATOM 0 HG22 THR A 26 8.554 5.838 6.735 1.00 0.00 H new ATOM 0 HG23 THR A 26 10.178 6.140 7.397 1.00 0.00 H new ATOM 407 N PRO A 27 9.240 3.847 5.050 1.00 0.00 N ATOM 408 CA PRO A 27 8.200 2.835 4.888 1.00 0.00 C ATOM 409 C PRO A 27 6.798 3.459 4.935 1.00 0.00 C ATOM 410 O PRO A 27 5.987 3.268 4.019 1.00 0.00 O ATOM 411 CB PRO A 27 8.421 1.889 6.070 1.00 0.00 C ATOM 412 CG PRO A 27 9.438 2.544 6.954 1.00 0.00 C ATOM 413 CD PRO A 27 10.239 3.439 6.047 1.00 0.00 C ATOM 0 HA PRO A 27 8.259 2.328 3.925 1.00 0.00 H new ATOM 0 HB2 PRO A 27 7.490 1.719 6.610 1.00 0.00 H new ATOM 0 HB3 PRO A 27 8.774 0.916 5.728 1.00 0.00 H new ATOM 0 HG2 PRO A 27 8.958 3.117 7.747 1.00 0.00 H new ATOM 0 HG3 PRO A 27 10.075 1.803 7.437 1.00 0.00 H new ATOM 0 HD2 PRO A 27 10.653 4.294 6.581 1.00 0.00 H new ATOM 0 HD3 PRO A 27 11.077 2.911 5.591 1.00 0.00 H new ATOM 421 N SER A 28 6.555 4.239 5.992 1.00 0.00 N ATOM 422 CA SER A 28 5.280 4.916 6.196 1.00 0.00 C ATOM 423 C SER A 28 4.940 5.820 4.998 1.00 0.00 C ATOM 424 O SER A 28 3.769 6.041 4.691 1.00 0.00 O ATOM 425 CB SER A 28 5.333 5.730 7.505 1.00 0.00 C ATOM 426 OG SER A 28 5.730 4.898 8.580 1.00 0.00 O ATOM 0 H SER A 28 7.239 4.416 6.728 1.00 0.00 H new ATOM 0 HA SER A 28 4.490 4.169 6.276 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.033 6.559 7.399 1.00 0.00 H new ATOM 0 HB3 SER A 28 4.355 6.164 7.713 1.00 0.00 H new ATOM 0 HG SER A 28 5.762 5.424 9.406 1.00 0.00 H new ATOM 432 N GLU A 29 5.966 6.333 4.315 1.00 0.00 N ATOM 433 CA GLU A 29 5.764 7.208 3.173 1.00 0.00 C ATOM 434 C GLU A 29 5.368 6.377 1.936 1.00 0.00 C ATOM 435 O GLU A 29 4.418 6.714 1.235 1.00 0.00 O ATOM 436 CB GLU A 29 7.015 8.047 2.883 1.00 0.00 C ATOM 437 CG GLU A 29 7.283 9.118 3.959 1.00 0.00 C ATOM 438 CD GLU A 29 8.447 10.026 3.596 1.00 0.00 C ATOM 439 OE1 GLU A 29 9.589 9.518 3.487 1.00 0.00 O ATOM 440 OE2 GLU A 29 8.230 11.247 3.416 1.00 0.00 O ATOM 0 H GLU A 29 6.945 6.153 4.539 1.00 0.00 H new ATOM 0 HA GLU A 29 4.954 7.898 3.411 1.00 0.00 H new ATOM 0 HB2 GLU A 29 7.880 7.387 2.811 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.903 8.533 1.914 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.386 9.721 4.099 1.00 0.00 H new ATOM 0 HG3 GLU A 29 7.490 8.629 4.911 1.00 0.00 H new ATOM 447 N ALA A 30 6.098 5.291 1.694 1.00 0.00 N ATOM 448 CA ALA A 30 5.785 4.388 0.589 1.00 0.00 C ATOM 449 C ALA A 30 4.366 3.833 0.740 1.00 0.00 C ATOM 450 O ALA A 30 3.617 3.698 -0.242 1.00 0.00 O ATOM 451 CB ALA A 30 6.792 3.254 0.514 1.00 0.00 C ATOM 0 H ALA A 30 6.909 5.015 2.247 1.00 0.00 H new ATOM 0 HA ALA A 30 5.842 4.955 -0.340 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.537 2.596 -0.316 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.790 3.663 0.359 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.772 2.688 1.445 1.00 0.00 H new ATOM 457 N LEU A 31 4.002 3.521 1.960 1.00 0.00 N ATOM 458 CA LEU A 31 2.676 3.009 2.291 1.00 0.00 C ATOM 459 C LEU A 31 1.634 4.112 2.103 1.00 0.00 C ATOM 460 O LEU A 31 0.479 3.841 1.747 1.00 0.00 O ATOM 461 CB LEU A 31 2.665 2.462 3.724 1.00 0.00 C ATOM 462 CG LEU A 31 3.609 1.258 3.989 1.00 0.00 C ATOM 463 CD1 LEU A 31 3.837 1.071 5.486 1.00 0.00 C ATOM 464 CD2 LEU A 31 3.036 -0.020 3.377 1.00 0.00 C ATOM 0 H LEU A 31 4.619 3.613 2.767 1.00 0.00 H new ATOM 0 HA LEU A 31 2.424 2.188 1.620 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.936 3.270 4.404 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.646 2.164 3.972 1.00 0.00 H new ATOM 0 HG LEU A 31 4.569 1.469 3.517 1.00 0.00 H new ATOM 0 HD11 LEU A 31 4.501 0.222 5.650 1.00 0.00 H new ATOM 0 HD12 LEU A 31 4.290 1.972 5.900 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.883 0.885 5.979 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.712 -0.852 3.573 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.063 -0.231 3.820 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.924 0.110 2.301 1.00 0.00 H new ATOM 476 N ARG A 32 2.035 5.349 2.354 1.00 0.00 N ATOM 477 CA ARG A 32 1.166 6.516 2.173 1.00 0.00 C ATOM 478 C ARG A 32 0.762 6.655 0.709 1.00 0.00 C ATOM 479 O ARG A 32 -0.432 6.765 0.400 1.00 0.00 O ATOM 480 CB ARG A 32 1.857 7.803 2.664 1.00 0.00 C ATOM 481 CG ARG A 32 1.007 9.065 2.517 1.00 0.00 C ATOM 482 CD ARG A 32 1.272 9.814 1.207 1.00 0.00 C ATOM 483 NE ARG A 32 2.464 10.618 1.259 1.00 0.00 N ATOM 484 CZ ARG A 32 2.707 11.689 0.490 1.00 0.00 C ATOM 485 NH1 ARG A 32 1.851 11.999 -0.496 1.00 0.00 N ATOM 486 NH2 ARG A 32 3.792 12.406 0.658 1.00 0.00 N ATOM 0 H ARG A 32 2.971 5.579 2.689 1.00 0.00 H new ATOM 0 HA ARG A 32 0.268 6.365 2.772 1.00 0.00 H new ATOM 0 HB2 ARG A 32 2.126 7.680 3.713 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.786 7.937 2.110 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -0.048 8.794 2.568 1.00 0.00 H new ATOM 0 HG3 ARG A 32 1.206 9.731 3.357 1.00 0.00 H new ATOM 0 HD2 ARG A 32 1.359 9.094 0.393 1.00 0.00 H new ATOM 0 HD3 ARG A 32 0.418 10.452 0.979 1.00 0.00 H new ATOM 0 HE ARG A 32 3.181 10.352 1.934 1.00 0.00 H new ATOM 0 HH11 ARG A 32 1.025 11.422 -0.654 1.00 0.00 H new ATOM 0 HH12 ARG A 32 2.026 12.812 -1.087 1.00 0.00 H new ATOM 0 HH21 ARG A 32 4.465 12.151 1.381 1.00 0.00 H new ATOM 0 HH22 ARG A 32 3.963 13.218 0.065 1.00 0.00 H new ATOM 500 N LEU A 33 1.750 6.641 -0.199 1.00 0.00 N ATOM 501 CA LEU A 33 1.476 6.821 -1.621 1.00 0.00 C ATOM 502 C LEU A 33 0.656 5.662 -2.157 1.00 0.00 C ATOM 503 O LEU A 33 -0.067 5.779 -3.138 1.00 0.00 O ATOM 504 CB LEU A 33 2.764 7.015 -2.412 1.00 0.00 C ATOM 505 CG LEU A 33 3.806 5.908 -2.281 1.00 0.00 C ATOM 506 CD1 LEU A 33 3.547 4.738 -3.246 1.00 0.00 C ATOM 507 CD2 LEU A 33 5.172 6.498 -2.521 1.00 0.00 C ATOM 0 H LEU A 33 2.735 6.508 0.029 1.00 0.00 H new ATOM 0 HA LEU A 33 0.887 7.730 -1.743 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.507 7.121 -3.466 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.220 7.954 -2.099 1.00 0.00 H new ATOM 0 HG LEU A 33 3.742 5.496 -1.274 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.317 3.978 -3.112 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.569 4.304 -3.038 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.571 5.101 -4.273 1.00 0.00 H new ATOM 0 HD21 LEU A 33 5.927 5.717 -2.430 1.00 0.00 H new ATOM 0 HD22 LEU A 33 5.212 6.927 -3.522 1.00 0.00 H new ATOM 0 HD23 LEU A 33 5.366 7.277 -1.784 1.00 0.00 H new ATOM 519 N MET A 34 0.788 4.508 -1.483 1.00 0.00 N ATOM 520 CA MET A 34 -0.025 3.360 -1.812 1.00 0.00 C ATOM 521 C MET A 34 -1.489 3.663 -1.534 1.00 0.00 C ATOM 522 O MET A 34 -2.360 3.432 -2.380 1.00 0.00 O ATOM 523 CB MET A 34 0.415 2.123 -1.004 1.00 0.00 C ATOM 524 CG MET A 34 -0.577 0.965 -1.054 1.00 0.00 C ATOM 525 SD MET A 34 -2.001 1.235 0.031 1.00 0.00 S ATOM 526 CE MET A 34 -2.992 -0.206 -0.337 1.00 0.00 C ATOM 0 H MET A 34 1.446 4.360 -0.718 1.00 0.00 H new ATOM 0 HA MET A 34 0.105 3.143 -2.872 1.00 0.00 H new ATOM 0 HB2 MET A 34 1.378 1.779 -1.381 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.565 2.415 0.035 1.00 0.00 H new ATOM 0 HG2 MET A 34 -0.924 0.830 -2.079 1.00 0.00 H new ATOM 0 HG3 MET A 34 -0.072 0.044 -0.765 1.00 0.00 H new ATOM 0 HE1 MET A 34 -3.651 -0.419 0.505 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.590 -0.018 -1.228 1.00 0.00 H new ATOM 0 HE3 MET A 34 -2.339 -1.061 -0.512 1.00 0.00 H new ATOM 536 N LEU A 35 -1.749 4.213 -0.347 1.00 0.00 N ATOM 537 CA LEU A 35 -3.111 4.538 0.071 1.00 0.00 C ATOM 538 C LEU A 35 -3.701 5.555 -0.887 1.00 0.00 C ATOM 539 O LEU A 35 -4.907 5.591 -1.119 1.00 0.00 O ATOM 540 CB LEU A 35 -3.141 5.078 1.507 1.00 0.00 C ATOM 541 CG LEU A 35 -2.724 4.066 2.588 1.00 0.00 C ATOM 542 CD1 LEU A 35 -2.850 4.675 3.975 1.00 0.00 C ATOM 543 CD2 LEU A 35 -3.553 2.794 2.481 1.00 0.00 C ATOM 0 H LEU A 35 -1.032 4.442 0.342 1.00 0.00 H new ATOM 0 HA LEU A 35 -3.708 3.626 0.050 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -2.483 5.945 1.568 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.150 5.428 1.727 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.678 3.807 2.426 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.550 3.941 4.723 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.206 5.551 4.047 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -3.885 4.970 4.150 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.243 2.091 3.254 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.608 3.035 2.612 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.403 2.343 1.500 1.00 0.00 H new ATOM 555 N GLU A 36 -2.837 6.358 -1.481 1.00 0.00 N ATOM 556 CA GLU A 36 -3.258 7.331 -2.478 1.00 0.00 C ATOM 557 C GLU A 36 -3.728 6.629 -3.744 1.00 0.00 C ATOM 558 O GLU A 36 -4.817 6.933 -4.259 1.00 0.00 O ATOM 559 CB GLU A 36 -2.122 8.312 -2.795 1.00 0.00 C ATOM 560 CG GLU A 36 -1.537 8.945 -1.562 1.00 0.00 C ATOM 561 CD GLU A 36 -0.801 10.242 -1.852 1.00 0.00 C ATOM 562 OE1 GLU A 36 0.401 10.203 -2.121 1.00 0.00 O ATOM 563 OE2 GLU A 36 -1.453 11.319 -1.814 1.00 0.00 O ATOM 0 H GLU A 36 -1.835 6.357 -1.291 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.093 7.899 -2.069 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.335 7.787 -3.336 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.497 9.093 -3.456 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.336 9.139 -0.846 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -0.851 8.242 -1.090 1.00 0.00 H new ATOM 570 N TYR A 37 -2.929 5.688 -4.267 1.00 0.00 N ATOM 571 CA TYR A 37 -3.255 5.066 -5.553 1.00 0.00 C ATOM 572 C TYR A 37 -4.477 4.168 -5.444 1.00 0.00 C ATOM 573 O TYR A 37 -5.226 4.025 -6.400 1.00 0.00 O ATOM 574 CB TYR A 37 -2.053 4.291 -6.156 1.00 0.00 C ATOM 575 CG TYR A 37 -1.873 2.840 -5.712 1.00 0.00 C ATOM 576 CD1 TYR A 37 -2.752 1.843 -6.123 1.00 0.00 C ATOM 577 CD2 TYR A 37 -0.813 2.462 -4.897 1.00 0.00 C ATOM 578 CE1 TYR A 37 -2.591 0.530 -5.732 1.00 0.00 C ATOM 579 CE2 TYR A 37 -0.645 1.145 -4.510 1.00 0.00 C ATOM 580 CZ TYR A 37 -1.533 0.187 -4.931 1.00 0.00 C ATOM 581 OH TYR A 37 -1.359 -1.121 -4.522 1.00 0.00 O ATOM 0 H TYR A 37 -2.072 5.349 -3.830 1.00 0.00 H new ATOM 0 HA TYR A 37 -3.491 5.880 -6.239 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -2.151 4.304 -7.241 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -1.141 4.836 -5.912 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -3.581 2.104 -6.764 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -0.109 3.209 -4.560 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.294 -0.223 -6.055 1.00 0.00 H new ATOM 0 HE2 TYR A 37 0.185 0.870 -3.876 1.00 0.00 H new ATOM 0 HH TYR A 37 -0.558 -1.184 -3.961 1.00 0.00 H new ATOM 591 N ILE A 38 -4.682 3.550 -4.278 1.00 0.00 N ATOM 592 CA ILE A 38 -5.871 2.691 -4.095 1.00 0.00 C ATOM 593 C ILE A 38 -7.126 3.551 -3.994 1.00 0.00 C ATOM 594 O ILE A 38 -8.154 3.215 -4.585 1.00 0.00 O ATOM 595 CB ILE A 38 -5.743 1.753 -2.851 1.00 0.00 C ATOM 596 CG1 ILE A 38 -7.097 1.091 -2.501 1.00 0.00 C ATOM 597 CG2 ILE A 38 -5.177 2.493 -1.650 1.00 0.00 C ATOM 598 CD1 ILE A 38 -7.700 0.250 -3.600 1.00 0.00 C ATOM 0 H ILE A 38 -4.067 3.619 -3.467 1.00 0.00 H new ATOM 0 HA ILE A 38 -5.946 2.045 -4.970 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.041 0.962 -3.116 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -6.961 0.465 -1.619 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -7.807 1.873 -2.231 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.102 1.810 -0.804 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -4.187 2.879 -1.894 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -5.835 3.322 -1.390 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.646 -0.171 -3.259 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -7.875 0.871 -4.479 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.015 -0.558 -3.857 1.00 0.00 H new ATOM 610 N ALA A 39 -7.054 4.639 -3.253 1.00 0.00 N ATOM 611 CA ALA A 39 -8.192 5.559 -3.125 1.00 0.00 C ATOM 612 C ALA A 39 -8.568 6.155 -4.483 1.00 0.00 C ATOM 613 O ALA A 39 -9.750 6.353 -4.792 1.00 0.00 O ATOM 614 CB ALA A 39 -7.848 6.668 -2.152 1.00 0.00 C ATOM 0 H ALA A 39 -6.225 4.917 -2.727 1.00 0.00 H new ATOM 0 HA ALA A 39 -9.048 4.998 -2.749 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -8.695 7.348 -2.061 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -7.620 6.238 -1.176 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.980 7.217 -2.518 1.00 0.00 H new ATOM 620 N ASP A 40 -7.544 6.429 -5.289 1.00 0.00 N ATOM 621 CA ASP A 40 -7.727 7.042 -6.601 1.00 0.00 C ATOM 622 C ASP A 40 -8.269 6.050 -7.650 1.00 0.00 C ATOM 623 O ASP A 40 -9.273 6.325 -8.316 1.00 0.00 O ATOM 624 CB ASP A 40 -6.388 7.622 -7.097 1.00 0.00 C ATOM 625 CG ASP A 40 -6.519 8.423 -8.383 1.00 0.00 C ATOM 626 OD1 ASP A 40 -6.878 9.611 -8.311 1.00 0.00 O ATOM 627 OD2 ASP A 40 -6.254 7.863 -9.470 1.00 0.00 O ATOM 0 H ASP A 40 -6.571 6.234 -5.053 1.00 0.00 H new ATOM 0 HA ASP A 40 -8.467 7.833 -6.482 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -5.967 8.261 -6.321 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -5.683 6.806 -7.256 1.00 0.00 H new ATOM 632 N ASN A 41 -7.619 4.894 -7.768 1.00 0.00 N ATOM 633 CA ASN A 41 -7.928 3.930 -8.830 1.00 0.00 C ATOM 634 C ASN A 41 -9.003 2.941 -8.403 1.00 0.00 C ATOM 635 O ASN A 41 -9.796 2.479 -9.236 1.00 0.00 O ATOM 636 CB ASN A 41 -6.659 3.159 -9.244 1.00 0.00 C ATOM 637 CG ASN A 41 -5.634 4.041 -9.949 1.00 0.00 C ATOM 638 OD1 ASN A 41 -5.690 4.228 -11.164 1.00 0.00 O ATOM 639 ND2 ASN A 41 -4.683 4.581 -9.194 1.00 0.00 N ATOM 0 H ASN A 41 -6.872 4.598 -7.140 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.306 4.499 -9.679 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -6.203 2.717 -8.358 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -6.938 2.337 -9.903 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -3.969 5.172 -9.619 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -4.668 4.404 -8.190 1.00 0.00 H new ATOM 646 N GLU A 42 -9.014 2.582 -7.113 1.00 0.00 N ATOM 647 CA GLU A 42 -9.961 1.600 -6.587 1.00 0.00 C ATOM 648 C GLU A 42 -9.871 0.269 -7.349 1.00 0.00 C ATOM 649 O GLU A 42 -10.893 -0.346 -7.689 1.00 0.00 O ATOM 650 CB GLU A 42 -11.393 2.160 -6.686 1.00 0.00 C ATOM 651 CG GLU A 42 -11.574 3.518 -6.008 1.00 0.00 C ATOM 652 CD GLU A 42 -12.952 4.103 -6.232 1.00 0.00 C ATOM 653 OE1 GLU A 42 -13.918 3.641 -5.614 1.00 0.00 O ATOM 654 OE2 GLU A 42 -13.083 5.031 -7.067 1.00 0.00 O ATOM 0 H GLU A 42 -8.374 2.961 -6.415 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.708 1.409 -5.544 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.666 2.250 -7.737 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.084 1.446 -6.238 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.399 3.411 -4.938 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.823 4.212 -6.387 1.00 0.00 H new ATOM 661 N ARG A 43 -8.641 -0.212 -7.599 1.00 0.00 N ATOM 662 CA ARG A 43 -8.455 -1.426 -8.404 1.00 0.00 C ATOM 663 C ARG A 43 -7.313 -2.298 -7.884 1.00 0.00 C ATOM 664 O ARG A 43 -7.446 -3.522 -7.860 1.00 0.00 O ATOM 665 CB ARG A 43 -8.192 -1.066 -9.873 1.00 0.00 C ATOM 666 CG ARG A 43 -6.897 -0.290 -10.122 1.00 0.00 C ATOM 667 CD ARG A 43 -6.715 0.060 -11.579 1.00 0.00 C ATOM 668 NE ARG A 43 -7.773 0.932 -12.102 1.00 0.00 N ATOM 669 CZ ARG A 43 -7.571 1.924 -12.967 1.00 0.00 C ATOM 670 NH1 ARG A 43 -6.345 2.205 -13.389 1.00 0.00 N ATOM 671 NH2 ARG A 43 -8.594 2.636 -13.397 1.00 0.00 N ATOM 0 H ARG A 43 -7.777 0.213 -7.262 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.379 -1.998 -8.324 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -8.167 -1.985 -10.459 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.030 -0.475 -10.243 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -6.903 0.624 -9.528 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -6.048 -0.884 -9.784 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -5.751 0.551 -11.710 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -6.687 -0.858 -12.166 1.00 0.00 H new ATOM 0 HE ARG A 43 -8.727 0.767 -11.781 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -5.552 1.660 -13.051 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -6.196 2.966 -14.052 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -9.536 2.426 -13.067 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -8.443 3.397 -14.060 1.00 0.00 H new ATOM 685 N LEU A 44 -6.189 -1.690 -7.477 1.00 0.00 N ATOM 686 CA LEU A 44 -4.998 -2.427 -7.006 1.00 0.00 C ATOM 687 C LEU A 44 -4.372 -3.246 -8.153 1.00 0.00 C ATOM 688 O LEU A 44 -5.063 -3.687 -9.069 1.00 0.00 O ATOM 689 CB LEU A 44 -5.329 -3.371 -5.828 1.00 0.00 C ATOM 690 CG LEU A 44 -5.750 -2.683 -4.521 1.00 0.00 C ATOM 691 CD1 LEU A 44 -6.147 -3.719 -3.481 1.00 0.00 C ATOM 692 CD2 LEU A 44 -4.635 -1.790 -3.984 1.00 0.00 C ATOM 0 H LEU A 44 -6.076 -0.676 -7.463 1.00 0.00 H new ATOM 0 HA LEU A 44 -4.285 -1.680 -6.657 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -6.130 -4.042 -6.138 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.455 -3.990 -5.626 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.613 -2.052 -4.735 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.443 -3.216 -2.561 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.983 -4.310 -3.856 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.300 -4.375 -3.280 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.962 -1.316 -3.058 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.748 -2.393 -3.789 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.397 -1.022 -4.720 1.00 0.00 H new ATOM 812 N MET B 101 4.960 -14.069 10.795 1.00 0.00 N ATOM 813 CA MET B 101 4.345 -12.754 10.460 1.00 0.00 C ATOM 814 C MET B 101 4.555 -11.770 11.597 1.00 0.00 C ATOM 815 O MET B 101 4.677 -12.152 12.770 1.00 0.00 O ATOM 816 CB MET B 101 2.852 -12.922 10.182 1.00 0.00 C ATOM 817 CG MET B 101 2.549 -13.736 8.950 1.00 0.00 C ATOM 818 SD MET B 101 0.803 -13.796 8.547 1.00 0.00 S ATOM 819 CE MET B 101 0.508 -12.064 8.190 1.00 0.00 C ATOM 0 HA MET B 101 4.827 -12.364 9.564 1.00 0.00 H new ATOM 0 HB2 MET B 101 2.383 -13.397 11.044 1.00 0.00 H new ATOM 0 HB3 MET B 101 2.399 -11.936 10.075 1.00 0.00 H new ATOM 0 HG2 MET B 101 3.095 -13.318 8.104 1.00 0.00 H new ATOM 0 HG3 MET B 101 2.916 -14.752 9.096 1.00 0.00 H new ATOM 0 HE1 MET B 101 -0.489 -11.944 7.767 1.00 0.00 H new ATOM 0 HE2 MET B 101 0.584 -11.485 9.110 1.00 0.00 H new ATOM 0 HE3 MET B 101 1.250 -11.708 7.475 1.00 0.00 H new ATOM 829 N GLY B 102 4.580 -10.483 11.244 1.00 0.00 N ATOM 830 CA GLY B 102 4.713 -9.440 12.235 1.00 0.00 C ATOM 831 C GLY B 102 3.871 -8.227 11.893 1.00 0.00 C ATOM 832 O GLY B 102 3.345 -8.114 10.773 1.00 0.00 O ATOM 0 H GLY B 102 4.510 -10.150 10.282 1.00 0.00 H new ATOM 0 HA2 GLY B 102 4.416 -9.825 13.210 1.00 0.00 H new ATOM 0 HA3 GLY B 102 5.759 -9.145 12.314 1.00 0.00 H new ATOM 836 N SER B 103 3.746 -7.309 12.842 1.00 0.00 N ATOM 837 CA SER B 103 2.950 -6.106 12.664 1.00 0.00 C ATOM 838 C SER B 103 3.822 -4.855 12.707 1.00 0.00 C ATOM 839 O SER B 103 4.786 -4.780 13.479 1.00 0.00 O ATOM 840 CB SER B 103 1.848 -6.039 13.724 1.00 0.00 C ATOM 841 OG SER B 103 2.383 -6.262 15.018 1.00 0.00 O ATOM 0 H SER B 103 4.194 -7.379 13.756 1.00 0.00 H new ATOM 0 HA SER B 103 2.484 -6.148 11.680 1.00 0.00 H new ATOM 0 HB2 SER B 103 1.362 -5.064 13.689 1.00 0.00 H new ATOM 0 HB3 SER B 103 1.083 -6.785 13.508 1.00 0.00 H new ATOM 0 HG SER B 103 1.664 -6.214 15.682 1.00 0.00 H new ATOM 847 N ILE B 104 3.483 -3.892 11.869 1.00 0.00 N ATOM 848 CA ILE B 104 4.219 -2.632 11.780 1.00 0.00 C ATOM 849 C ILE B 104 3.238 -1.460 11.876 1.00 0.00 C ATOM 850 O ILE B 104 2.026 -1.648 11.722 1.00 0.00 O ATOM 851 CB ILE B 104 5.056 -2.531 10.469 1.00 0.00 C ATOM 852 CG1 ILE B 104 4.151 -2.378 9.220 1.00 0.00 C ATOM 853 CG2 ILE B 104 5.955 -3.745 10.330 1.00 0.00 C ATOM 854 CD1 ILE B 104 3.910 -0.949 8.778 1.00 0.00 C ATOM 0 H ILE B 104 2.691 -3.956 11.229 1.00 0.00 H new ATOM 0 HA ILE B 104 4.923 -2.595 12.612 1.00 0.00 H new ATOM 0 HB ILE B 104 5.673 -1.635 10.535 1.00 0.00 H new ATOM 0 HG12 ILE B 104 4.601 -2.928 8.393 1.00 0.00 H new ATOM 0 HG13 ILE B 104 3.189 -2.846 9.427 1.00 0.00 H new ATOM 0 HG21 ILE B 104 6.535 -3.665 9.411 1.00 0.00 H new ATOM 0 HG22 ILE B 104 6.632 -3.796 11.183 1.00 0.00 H new ATOM 0 HG23 ILE B 104 5.345 -4.648 10.296 1.00 0.00 H new ATOM 0 HD11 ILE B 104 3.267 -0.944 7.898 1.00 0.00 H new ATOM 0 HD12 ILE B 104 3.428 -0.395 9.584 1.00 0.00 H new ATOM 0 HD13 ILE B 104 4.862 -0.478 8.534 1.00 0.00 H new ATOM 866 N ASN B 105 3.754 -0.276 12.134 1.00 0.00 N ATOM 867 CA ASN B 105 2.936 0.928 12.288 1.00 0.00 C ATOM 868 C ASN B 105 2.987 1.784 11.030 1.00 0.00 C ATOM 869 O ASN B 105 4.060 2.090 10.505 1.00 0.00 O ATOM 870 CB ASN B 105 3.436 1.738 13.504 1.00 0.00 C ATOM 871 CG ASN B 105 3.028 3.211 13.473 1.00 0.00 C ATOM 872 OD1 ASN B 105 1.834 3.514 13.003 1.00 0.00 O flip ATOM 873 ND2 ASN B 105 3.783 4.077 13.891 1.00 0.00 N flip ATOM 0 H ASN B 105 4.755 -0.112 12.245 1.00 0.00 H new ATOM 0 HA ASN B 105 1.900 0.629 12.451 1.00 0.00 H new ATOM 0 HB2 ASN B 105 3.050 1.283 14.416 1.00 0.00 H new ATOM 0 HB3 ASN B 105 4.523 1.672 13.551 1.00 0.00 H new ATOM 0 HD21 ASN B 105 4.703 3.822 14.251 1.00 0.00 H new ATOM 0 HD22 ASN B 105 3.493 5.055 13.880 1.00 0.00 H new ATOM 880 N LEU B 106 1.806 2.149 10.550 1.00 0.00 N ATOM 881 CA LEU B 106 1.658 3.025 9.379 1.00 0.00 C ATOM 882 C LEU B 106 1.071 4.358 9.884 1.00 0.00 C ATOM 883 O LEU B 106 0.232 4.353 10.779 1.00 0.00 O ATOM 884 CB LEU B 106 0.728 2.341 8.351 1.00 0.00 C ATOM 885 CG LEU B 106 0.961 2.651 6.855 1.00 0.00 C ATOM 886 CD1 LEU B 106 -0.123 2.001 5.997 1.00 0.00 C ATOM 887 CD2 LEU B 106 1.044 4.148 6.582 1.00 0.00 C ATOM 0 H LEU B 106 0.919 1.850 10.956 1.00 0.00 H new ATOM 0 HA LEU B 106 2.610 3.213 8.883 1.00 0.00 H new ATOM 0 HB2 LEU B 106 0.813 1.263 8.487 1.00 0.00 H new ATOM 0 HB3 LEU B 106 -0.299 2.614 8.594 1.00 0.00 H new ATOM 0 HG LEU B 106 1.926 2.224 6.583 1.00 0.00 H new ATOM 0 HD11 LEU B 106 0.058 2.230 4.947 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -0.102 0.921 6.141 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -1.099 2.387 6.290 1.00 0.00 H new ATOM 0 HD21 LEU B 106 1.208 4.315 5.518 1.00 0.00 H new ATOM 0 HD22 LEU B 106 0.112 4.625 6.885 1.00 0.00 H new ATOM 0 HD23 LEU B 106 1.871 4.576 7.148 1.00 0.00 H new ATOM 899 N ARG B 107 1.488 5.489 9.325 1.00 0.00 N ATOM 900 CA ARG B 107 1.070 6.791 9.808 1.00 0.00 C ATOM 901 C ARG B 107 0.748 7.709 8.627 1.00 0.00 C ATOM 902 O ARG B 107 1.640 8.074 7.862 1.00 0.00 O ATOM 903 CB ARG B 107 2.156 7.420 10.683 1.00 0.00 C ATOM 904 CG ARG B 107 2.394 6.651 11.982 1.00 0.00 C ATOM 905 CD ARG B 107 3.045 7.519 13.025 1.00 0.00 C ATOM 906 NE ARG B 107 4.251 8.161 12.509 1.00 0.00 N ATOM 907 CZ ARG B 107 4.632 9.408 12.795 1.00 0.00 C ATOM 908 NH1 ARG B 107 3.947 10.121 13.687 1.00 0.00 N ATOM 909 NH2 ARG B 107 5.703 9.916 12.210 1.00 0.00 N ATOM 0 H ARG B 107 2.123 5.524 8.527 1.00 0.00 H new ATOM 0 HA ARG B 107 0.174 6.662 10.415 1.00 0.00 H new ATOM 0 HB2 ARG B 107 3.088 7.467 10.119 1.00 0.00 H new ATOM 0 HB3 ARG B 107 1.875 8.446 10.921 1.00 0.00 H new ATOM 0 HG2 ARG B 107 1.445 6.274 12.362 1.00 0.00 H new ATOM 0 HG3 ARG B 107 3.025 5.785 11.783 1.00 0.00 H new ATOM 0 HD2 ARG B 107 2.340 8.281 13.358 1.00 0.00 H new ATOM 0 HD3 ARG B 107 3.297 6.915 13.897 1.00 0.00 H new ATOM 0 HE ARG B 107 4.846 7.617 11.884 1.00 0.00 H new ATOM 0 HH11 ARG B 107 3.134 9.714 14.149 1.00 0.00 H new ATOM 0 HH12 ARG B 107 4.235 11.074 13.908 1.00 0.00 H new ATOM 0 HH21 ARG B 107 6.234 9.356 11.543 1.00 0.00 H new ATOM 0 HH22 ARG B 107 5.998 10.868 12.425 1.00 0.00 H new ATOM 923 N ILE B 108 -0.531 8.055 8.457 1.00 0.00 N ATOM 924 CA ILE B 108 -0.951 8.937 7.364 1.00 0.00 C ATOM 925 C ILE B 108 -2.045 9.876 7.835 1.00 0.00 C ATOM 926 O ILE B 108 -2.553 9.747 8.954 1.00 0.00 O ATOM 927 CB ILE B 108 -1.489 8.165 6.118 1.00 0.00 C ATOM 928 CG1 ILE B 108 -2.887 7.550 6.392 1.00 0.00 C ATOM 929 CG2 ILE B 108 -0.512 7.094 5.678 1.00 0.00 C ATOM 930 CD1 ILE B 108 -2.957 6.605 7.575 1.00 0.00 C ATOM 0 H ILE B 108 -1.291 7.739 9.059 1.00 0.00 H new ATOM 0 HA ILE B 108 -0.056 9.485 7.068 1.00 0.00 H new ATOM 0 HB ILE B 108 -1.594 8.886 5.308 1.00 0.00 H new ATOM 0 HG12 ILE B 108 -3.597 8.361 6.553 1.00 0.00 H new ATOM 0 HG13 ILE B 108 -3.211 7.014 5.500 1.00 0.00 H new ATOM 0 HG21 ILE B 108 -0.912 6.572 4.809 1.00 0.00 H new ATOM 0 HG22 ILE B 108 0.441 7.555 5.418 1.00 0.00 H new ATOM 0 HG23 ILE B 108 -0.361 6.383 6.490 1.00 0.00 H new ATOM 0 HD11 ILE B 108 -3.975 6.230 7.681 1.00 0.00 H new ATOM 0 HD12 ILE B 108 -2.277 5.768 7.413 1.00 0.00 H new ATOM 0 HD13 ILE B 108 -2.669 7.136 8.482 1.00 0.00 H new ATOM 942 N ASP B 109 -2.420 10.823 6.992 1.00 0.00 N ATOM 943 CA ASP B 109 -3.526 11.718 7.300 1.00 0.00 C ATOM 944 C ASP B 109 -4.829 10.911 7.337 1.00 0.00 C ATOM 945 O ASP B 109 -5.071 10.075 6.449 1.00 0.00 O ATOM 946 CB ASP B 109 -3.640 12.828 6.244 1.00 0.00 C ATOM 947 CG ASP B 109 -4.353 14.053 6.794 1.00 0.00 C ATOM 948 OD1 ASP B 109 -5.538 13.940 7.155 1.00 0.00 O ATOM 949 OD2 ASP B 109 -3.738 15.146 6.864 1.00 0.00 O ATOM 0 H ASP B 109 -1.976 10.993 6.089 1.00 0.00 H new ATOM 0 HA ASP B 109 -3.344 12.182 8.269 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -2.644 13.109 5.902 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -4.181 12.451 5.376 1.00 0.00 H new ATOM 954 N ASP B 110 -5.654 11.162 8.341 1.00 0.00 N ATOM 955 CA ASP B 110 -6.906 10.432 8.518 1.00 0.00 C ATOM 956 C ASP B 110 -7.790 10.575 7.284 1.00 0.00 C ATOM 957 O ASP B 110 -8.560 9.665 6.940 1.00 0.00 O ATOM 958 CB ASP B 110 -7.642 10.921 9.762 1.00 0.00 C ATOM 959 CG ASP B 110 -6.829 10.709 11.037 1.00 0.00 C ATOM 960 OD1 ASP B 110 -6.844 9.587 11.576 1.00 0.00 O ATOM 961 OD2 ASP B 110 -6.179 11.670 11.497 1.00 0.00 O ATOM 0 H ASP B 110 -5.480 11.871 9.053 1.00 0.00 H new ATOM 0 HA ASP B 110 -6.670 9.376 8.651 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -7.872 11.981 9.652 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -8.593 10.396 9.849 1.00 0.00 H new ATOM 966 N GLU B 111 -7.669 11.711 6.595 1.00 0.00 N ATOM 967 CA GLU B 111 -8.466 11.986 5.406 1.00 0.00 C ATOM 968 C GLU B 111 -8.109 11.017 4.286 1.00 0.00 C ATOM 969 O GLU B 111 -8.985 10.623 3.512 1.00 0.00 O ATOM 970 CB GLU B 111 -8.259 13.416 4.905 1.00 0.00 C ATOM 971 CG GLU B 111 -6.881 13.718 4.325 1.00 0.00 C ATOM 972 CD GLU B 111 -6.837 15.075 3.630 1.00 0.00 C ATOM 973 OE1 GLU B 111 -7.133 16.099 4.281 1.00 0.00 O ATOM 974 OE2 GLU B 111 -6.495 15.123 2.426 1.00 0.00 O ATOM 0 H GLU B 111 -7.021 12.458 6.845 1.00 0.00 H new ATOM 0 HA GLU B 111 -9.511 11.860 5.688 1.00 0.00 H new ATOM 0 HB2 GLU B 111 -9.009 13.627 4.142 1.00 0.00 H new ATOM 0 HB3 GLU B 111 -8.444 14.102 5.732 1.00 0.00 H new ATOM 0 HG2 GLU B 111 -6.139 13.696 5.123 1.00 0.00 H new ATOM 0 HG3 GLU B 111 -6.608 12.938 3.614 1.00 0.00 H new ATOM 981 N LEU B 112 -6.858 10.613 4.217 1.00 0.00 N ATOM 982 CA LEU B 112 -6.382 9.742 3.154 1.00 0.00 C ATOM 983 C LEU B 112 -6.717 8.295 3.507 1.00 0.00 C ATOM 984 O LEU B 112 -7.103 7.497 2.650 1.00 0.00 O ATOM 985 CB LEU B 112 -4.871 9.910 2.959 1.00 0.00 C ATOM 986 CG LEU B 112 -4.233 9.043 1.872 1.00 0.00 C ATOM 987 CD1 LEU B 112 -4.803 9.381 0.499 1.00 0.00 C ATOM 988 CD2 LEU B 112 -2.708 9.160 1.894 1.00 0.00 C ATOM 0 H LEU B 112 -6.141 10.876 4.893 1.00 0.00 H new ATOM 0 HA LEU B 112 -6.874 10.010 2.219 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -4.669 10.956 2.727 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -4.376 9.693 3.906 1.00 0.00 H new ATOM 0 HG LEU B 112 -4.481 8.003 2.083 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -4.333 8.751 -0.256 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -5.879 9.206 0.499 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -4.606 10.428 0.271 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -2.284 8.533 1.110 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -2.420 10.197 1.724 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -2.332 8.833 2.864 1.00 0.00 H new ATOM 1000 N LYS B 113 -6.536 7.991 4.788 1.00 0.00 N ATOM 1001 CA LYS B 113 -6.925 6.705 5.345 1.00 0.00 C ATOM 1002 C LYS B 113 -8.345 6.365 4.963 1.00 0.00 C ATOM 1003 O LYS B 113 -8.627 5.290 4.448 1.00 0.00 O ATOM 1004 CB LYS B 113 -6.814 6.742 6.885 1.00 0.00 C ATOM 1005 CG LYS B 113 -7.423 5.520 7.571 1.00 0.00 C ATOM 1006 CD LYS B 113 -8.134 5.900 8.873 1.00 0.00 C ATOM 1007 CE LYS B 113 -7.257 6.770 9.752 1.00 0.00 C ATOM 1008 NZ LYS B 113 -7.860 7.057 11.073 1.00 0.00 N ATOM 0 H LYS B 113 -6.117 8.628 5.465 1.00 0.00 H new ATOM 0 HA LYS B 113 -6.255 5.945 4.943 1.00 0.00 H new ATOM 0 HB2 LYS B 113 -5.763 6.819 7.164 1.00 0.00 H new ATOM 0 HB3 LYS B 113 -7.308 7.640 7.255 1.00 0.00 H new ATOM 0 HG2 LYS B 113 -8.131 5.039 6.896 1.00 0.00 H new ATOM 0 HG3 LYS B 113 -6.639 4.793 7.783 1.00 0.00 H new ATOM 0 HD2 LYS B 113 -9.059 6.429 8.643 1.00 0.00 H new ATOM 0 HD3 LYS B 113 -8.411 4.996 9.415 1.00 0.00 H new ATOM 0 HE2 LYS B 113 -6.296 6.277 9.898 1.00 0.00 H new ATOM 0 HE3 LYS B 113 -7.058 7.711 9.238 1.00 0.00 H new ATOM 0 HZ1 LYS B 113 -7.731 8.063 11.302 1.00 0.00 H new ATOM 0 HZ2 LYS B 113 -8.876 6.835 11.047 1.00 0.00 H new ATOM 0 HZ3 LYS B 113 -7.397 6.474 11.800 1.00 0.00 H new ATOM 1022 N ALA B 114 -9.257 7.311 5.213 1.00 0.00 N ATOM 1023 CA ALA B 114 -10.673 7.090 4.999 1.00 0.00 C ATOM 1024 C ALA B 114 -10.953 6.667 3.541 1.00 0.00 C ATOM 1025 O ALA B 114 -11.621 5.664 3.288 1.00 0.00 O ATOM 1026 CB ALA B 114 -11.461 8.343 5.354 1.00 0.00 C ATOM 0 H ALA B 114 -9.027 8.240 5.566 1.00 0.00 H new ATOM 0 HA ALA B 114 -10.995 6.278 5.651 1.00 0.00 H new ATOM 0 HB1 ALA B 114 -12.523 8.164 5.189 1.00 0.00 H new ATOM 0 HB2 ALA B 114 -11.294 8.593 6.402 1.00 0.00 H new ATOM 0 HB3 ALA B 114 -11.131 9.171 4.726 1.00 0.00 H new ATOM 1032 N ARG B 115 -10.415 7.446 2.596 1.00 0.00 N ATOM 1033 CA ARG B 115 -10.660 7.196 1.183 1.00 0.00 C ATOM 1034 C ARG B 115 -10.081 5.854 0.720 1.00 0.00 C ATOM 1035 O ARG B 115 -10.751 5.063 0.053 1.00 0.00 O ATOM 1036 CB ARG B 115 -10.074 8.321 0.310 1.00 0.00 C ATOM 1037 CG ARG B 115 -10.939 9.586 0.224 1.00 0.00 C ATOM 1038 CD ARG B 115 -11.070 10.298 1.559 1.00 0.00 C ATOM 1039 NE ARG B 115 -11.810 11.556 1.437 1.00 0.00 N ATOM 1040 CZ ARG B 115 -11.278 12.758 1.585 1.00 0.00 C ATOM 1041 NH1 ARG B 115 -9.974 12.900 1.802 1.00 0.00 N ATOM 1042 NH2 ARG B 115 -12.051 13.840 1.495 1.00 0.00 N ATOM 0 H ARG B 115 -9.813 8.247 2.788 1.00 0.00 H new ATOM 0 HA ARG B 115 -11.743 7.164 1.064 1.00 0.00 H new ATOM 0 HB2 ARG B 115 -9.094 8.594 0.703 1.00 0.00 H new ATOM 0 HB3 ARG B 115 -9.917 7.936 -0.698 1.00 0.00 H new ATOM 0 HG2 ARG B 115 -10.505 10.269 -0.506 1.00 0.00 H new ATOM 0 HG3 ARG B 115 -11.931 9.319 -0.140 1.00 0.00 H new ATOM 0 HD2 ARG B 115 -11.577 9.646 2.270 1.00 0.00 H new ATOM 0 HD3 ARG B 115 -10.077 10.498 1.962 1.00 0.00 H new ATOM 0 HE ARG B 115 -12.806 11.501 1.223 1.00 0.00 H new ATOM 0 HH11 ARG B 115 -9.373 12.077 1.856 1.00 0.00 H new ATOM 0 HH12 ARG B 115 -9.574 13.832 1.915 1.00 0.00 H new ATOM 0 HH21 ARG B 115 -13.050 13.740 1.313 1.00 0.00 H new ATOM 0 HH22 ARG B 115 -11.644 14.768 1.609 1.00 0.00 H new ATOM 1056 N SER B 116 -8.819 5.603 1.074 1.00 0.00 N ATOM 1057 CA SER B 116 -8.123 4.386 0.653 1.00 0.00 C ATOM 1058 C SER B 116 -8.843 3.146 1.178 1.00 0.00 C ATOM 1059 O SER B 116 -9.172 2.231 0.413 1.00 0.00 O ATOM 1060 CB SER B 116 -6.685 4.420 1.167 1.00 0.00 C ATOM 1061 OG SER B 116 -6.622 4.707 2.559 1.00 0.00 O ATOM 0 H SER B 116 -8.257 6.228 1.652 1.00 0.00 H new ATOM 0 HA SER B 116 -8.117 4.339 -0.436 1.00 0.00 H new ATOM 0 HB2 SER B 116 -6.208 3.459 0.973 1.00 0.00 H new ATOM 0 HB3 SER B 116 -6.121 5.173 0.616 1.00 0.00 H new ATOM 0 HG SER B 116 -6.713 5.673 2.698 1.00 0.00 H new ATOM 1067 N TYR B 117 -9.098 3.144 2.482 1.00 0.00 N ATOM 1068 CA TYR B 117 -9.828 2.060 3.126 1.00 0.00 C ATOM 1069 C TYR B 117 -11.196 1.858 2.490 1.00 0.00 C ATOM 1070 O TYR B 117 -11.641 0.721 2.316 1.00 0.00 O ATOM 1071 CB TYR B 117 -9.955 2.325 4.635 1.00 0.00 C ATOM 1072 CG TYR B 117 -8.681 2.044 5.405 1.00 0.00 C ATOM 1073 CD1 TYR B 117 -7.504 1.670 4.745 1.00 0.00 C ATOM 1074 CD2 TYR B 117 -8.643 2.139 6.794 1.00 0.00 C ATOM 1075 CE1 TYR B 117 -6.350 1.393 5.435 1.00 0.00 C ATOM 1076 CE2 TYR B 117 -7.486 1.870 7.498 1.00 0.00 C ATOM 1077 CZ TYR B 117 -6.348 1.494 6.811 1.00 0.00 C ATOM 1078 OH TYR B 117 -5.191 1.204 7.505 1.00 0.00 O ATOM 0 H TYR B 117 -8.807 3.887 3.117 1.00 0.00 H new ATOM 0 HA TYR B 117 -9.263 1.139 2.983 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -10.243 3.365 4.791 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -10.758 1.708 5.038 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -7.504 1.598 3.667 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -9.535 2.428 7.330 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -5.455 1.100 4.907 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -7.471 1.953 8.575 1.00 0.00 H new ATOM 0 HH TYR B 117 -4.413 1.415 6.947 1.00 0.00 H new ATOM 1088 N ALA B 118 -11.844 2.960 2.124 1.00 0.00 N ATOM 1089 CA ALA B 118 -13.153 2.899 1.475 1.00 0.00 C ATOM 1090 C ALA B 118 -13.065 2.125 0.151 1.00 0.00 C ATOM 1091 O ALA B 118 -13.897 1.253 -0.137 1.00 0.00 O ATOM 1092 CB ALA B 118 -13.697 4.298 1.246 1.00 0.00 C ATOM 0 H ALA B 118 -11.486 3.905 2.265 1.00 0.00 H new ATOM 0 HA ALA B 118 -13.840 2.368 2.133 1.00 0.00 H new ATOM 0 HB1 ALA B 118 -14.672 4.235 0.762 1.00 0.00 H new ATOM 0 HB2 ALA B 118 -13.799 4.810 2.203 1.00 0.00 H new ATOM 0 HB3 ALA B 118 -13.011 4.855 0.608 1.00 0.00 H new ATOM 1098 N ALA B 119 -12.038 2.432 -0.629 1.00 0.00 N ATOM 1099 CA ALA B 119 -11.818 1.818 -1.931 1.00 0.00 C ATOM 1100 C ALA B 119 -11.577 0.307 -1.824 1.00 0.00 C ATOM 1101 O ALA B 119 -12.134 -0.494 -2.599 1.00 0.00 O ATOM 1102 CB ALA B 119 -10.664 2.486 -2.648 1.00 0.00 C ATOM 0 H ALA B 119 -11.329 3.119 -0.374 1.00 0.00 H new ATOM 0 HA ALA B 119 -12.729 1.963 -2.512 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -10.516 2.013 -3.619 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -10.887 3.543 -2.790 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -9.757 2.383 -2.052 1.00 0.00 H new ATOM 1108 N LEU B 120 -10.753 -0.091 -0.866 1.00 0.00 N ATOM 1109 CA LEU B 120 -10.361 -1.493 -0.738 1.00 0.00 C ATOM 1110 C LEU B 120 -11.492 -2.334 -0.126 1.00 0.00 C ATOM 1111 O LEU B 120 -11.666 -3.494 -0.507 1.00 0.00 O ATOM 1112 CB LEU B 120 -9.046 -1.613 0.060 1.00 0.00 C ATOM 1113 CG LEU B 120 -8.975 -0.919 1.433 1.00 0.00 C ATOM 1114 CD1 LEU B 120 -9.661 -1.723 2.520 1.00 0.00 C ATOM 1115 CD2 LEU B 120 -7.526 -0.638 1.811 1.00 0.00 C ATOM 0 H LEU B 120 -10.343 0.530 -0.168 1.00 0.00 H new ATOM 0 HA LEU B 120 -10.178 -1.895 -1.734 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -8.840 -2.673 0.209 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -8.241 -1.216 -0.558 1.00 0.00 H new ATOM 0 HG LEU B 120 -9.512 0.026 1.346 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -9.584 -1.192 3.469 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -10.712 -1.858 2.264 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -9.181 -2.698 2.609 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -7.492 -0.147 2.784 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -6.974 -1.577 1.859 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -7.074 0.011 1.061 1.00 0.00 H new ATOM 1127 N GLU B 121 -12.266 -1.755 0.792 1.00 0.00 N ATOM 1128 CA GLU B 121 -13.404 -2.473 1.381 1.00 0.00 C ATOM 1129 C GLU B 121 -14.526 -2.558 0.356 1.00 0.00 C ATOM 1130 O GLU B 121 -15.376 -3.454 0.423 1.00 0.00 O ATOM 1131 CB GLU B 121 -13.916 -1.788 2.657 1.00 0.00 C ATOM 1132 CG GLU B 121 -14.435 -0.369 2.444 1.00 0.00 C ATOM 1133 CD GLU B 121 -15.291 0.133 3.593 1.00 0.00 C ATOM 1134 OE1 GLU B 121 -14.726 0.516 4.640 1.00 0.00 O ATOM 1135 OE2 GLU B 121 -16.532 0.129 3.466 1.00 0.00 O ATOM 0 H GLU B 121 -12.132 -0.806 1.142 1.00 0.00 H new ATOM 0 HA GLU B 121 -13.068 -3.472 1.658 1.00 0.00 H new ATOM 0 HB2 GLU B 121 -14.715 -2.394 3.085 1.00 0.00 H new ATOM 0 HB3 GLU B 121 -13.109 -1.761 3.389 1.00 0.00 H new ATOM 0 HG2 GLU B 121 -13.588 0.304 2.309 1.00 0.00 H new ATOM 0 HG3 GLU B 121 -15.018 -0.337 1.524 1.00 0.00 H new ATOM 1142 N LYS B 122 -14.521 -1.631 -0.587 1.00 0.00 N ATOM 1143 CA LYS B 122 -15.465 -1.631 -1.698 1.00 0.00 C ATOM 1144 C LYS B 122 -15.227 -2.889 -2.555 1.00 0.00 C ATOM 1145 O LYS B 122 -16.157 -3.620 -2.893 1.00 0.00 O ATOM 1146 CB LYS B 122 -15.221 -0.369 -2.517 1.00 0.00 C ATOM 1147 CG LYS B 122 -16.078 -0.221 -3.762 1.00 0.00 C ATOM 1148 CD LYS B 122 -15.583 0.952 -4.615 1.00 0.00 C ATOM 1149 CE LYS B 122 -16.445 1.155 -5.854 1.00 0.00 C ATOM 1150 NZ LYS B 122 -15.901 2.251 -6.701 1.00 0.00 N ATOM 0 H LYS B 122 -13.861 -0.854 -0.606 1.00 0.00 H new ATOM 0 HA LYS B 122 -16.495 -1.643 -1.343 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -15.389 0.497 -1.877 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -14.173 -0.347 -2.814 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -16.046 -1.142 -4.345 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -17.118 -0.059 -3.478 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -15.587 1.863 -4.017 1.00 0.00 H new ATOM 0 HD3 LYS B 122 -14.551 0.772 -4.916 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -16.486 0.230 -6.430 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -17.467 1.391 -5.557 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -16.680 2.716 -7.210 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -15.417 2.947 -6.099 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -15.226 1.857 -7.387 1.00 0.00 H new ATOM 1164 N MET B 123 -13.954 -3.106 -2.863 1.00 0.00 N ATOM 1165 CA MET B 123 -13.491 -4.280 -3.618 1.00 0.00 C ATOM 1166 C MET B 123 -13.572 -5.538 -2.742 1.00 0.00 C ATOM 1167 O MET B 123 -13.516 -6.668 -3.240 1.00 0.00 O ATOM 1168 CB MET B 123 -12.069 -4.035 -4.101 1.00 0.00 C ATOM 1169 CG MET B 123 -11.897 -2.751 -4.896 1.00 0.00 C ATOM 1170 SD MET B 123 -10.222 -2.089 -4.849 1.00 0.00 S ATOM 1171 CE MET B 123 -9.279 -3.499 -5.405 1.00 0.00 C ATOM 0 H MET B 123 -13.202 -2.471 -2.597 1.00 0.00 H new ATOM 0 HA MET B 123 -14.132 -4.438 -4.485 1.00 0.00 H new ATOM 0 HB2 MET B 123 -11.403 -4.008 -3.238 1.00 0.00 H new ATOM 0 HB3 MET B 123 -11.756 -4.877 -4.719 1.00 0.00 H new ATOM 0 HG2 MET B 123 -12.176 -2.936 -5.933 1.00 0.00 H new ATOM 0 HG3 MET B 123 -12.586 -2.000 -4.510 1.00 0.00 H new ATOM 0 HE1 MET B 123 -8.229 -3.221 -5.496 1.00 0.00 H new ATOM 0 HE2 MET B 123 -9.379 -4.310 -4.684 1.00 0.00 H new ATOM 0 HE3 MET B 123 -9.653 -3.827 -6.375 1.00 0.00 H new ATOM 1181 N GLY B 124 -13.681 -5.332 -1.430 1.00 0.00 N ATOM 1182 CA GLY B 124 -13.839 -6.438 -0.486 1.00 0.00 C ATOM 1183 C GLY B 124 -12.516 -6.995 0.013 1.00 0.00 C ATOM 1184 O GLY B 124 -12.474 -8.085 0.592 1.00 0.00 O ATOM 0 H GLY B 124 -13.663 -4.409 -0.996 1.00 0.00 H new ATOM 0 HA2 GLY B 124 -14.427 -6.098 0.367 1.00 0.00 H new ATOM 0 HA3 GLY B 124 -14.405 -7.237 -0.965 1.00 0.00 H new ATOM 1188 N VAL B 125 -11.434 -6.268 -0.210 1.00 0.00 N ATOM 1189 CA VAL B 125 -10.116 -6.690 0.226 1.00 0.00 C ATOM 1190 C VAL B 125 -9.787 -6.062 1.576 1.00 0.00 C ATOM 1191 O VAL B 125 -10.251 -4.963 1.878 1.00 0.00 O ATOM 1192 CB VAL B 125 -9.017 -6.328 -0.814 1.00 0.00 C ATOM 1193 CG1 VAL B 125 -8.867 -4.824 -0.998 1.00 0.00 C ATOM 1194 CG2 VAL B 125 -7.669 -6.960 -0.444 1.00 0.00 C ATOM 0 H VAL B 125 -11.445 -5.372 -0.697 1.00 0.00 H new ATOM 0 HA VAL B 125 -10.132 -7.776 0.323 1.00 0.00 H new ATOM 0 HB VAL B 125 -9.344 -6.743 -1.767 1.00 0.00 H new ATOM 0 HG11 VAL B 125 -8.088 -4.623 -1.734 1.00 0.00 H new ATOM 0 HG12 VAL B 125 -9.811 -4.404 -1.345 1.00 0.00 H new ATOM 0 HG13 VAL B 125 -8.595 -4.366 -0.047 1.00 0.00 H new ATOM 0 HG21 VAL B 125 -6.923 -6.688 -1.190 1.00 0.00 H new ATOM 0 HG22 VAL B 125 -7.353 -6.597 0.534 1.00 0.00 H new ATOM 0 HG23 VAL B 125 -7.772 -8.045 -0.413 1.00 0.00 H new ATOM 1204 N THR B 126 -9.023 -6.780 2.404 1.00 0.00 N ATOM 1205 CA THR B 126 -8.604 -6.274 3.690 1.00 0.00 C ATOM 1206 C THR B 126 -7.496 -5.230 3.530 1.00 0.00 C ATOM 1207 O THR B 126 -6.616 -5.375 2.681 1.00 0.00 O ATOM 1208 CB THR B 126 -8.094 -7.440 4.548 1.00 0.00 C ATOM 1209 OG1 THR B 126 -9.098 -8.467 4.639 1.00 0.00 O ATOM 1210 CG2 THR B 126 -7.685 -6.987 5.930 1.00 0.00 C ATOM 0 H THR B 126 -8.686 -7.719 2.193 1.00 0.00 H new ATOM 0 HA THR B 126 -9.456 -5.798 4.175 1.00 0.00 H new ATOM 0 HB THR B 126 -7.208 -7.844 4.059 1.00 0.00 H new ATOM 0 HG1 THR B 126 -8.965 -9.119 3.920 1.00 0.00 H new ATOM 0 HG21 THR B 126 -7.330 -7.843 6.504 1.00 0.00 H new ATOM 0 HG22 THR B 126 -6.887 -6.249 5.850 1.00 0.00 H new ATOM 0 HG23 THR B 126 -8.542 -6.542 6.435 1.00 0.00 H new ATOM 1218 N PRO B 127 -7.520 -4.125 4.332 1.00 0.00 N ATOM 1219 CA PRO B 127 -6.451 -3.119 4.310 1.00 0.00 C ATOM 1220 C PRO B 127 -5.065 -3.756 4.380 1.00 0.00 C ATOM 1221 O PRO B 127 -4.215 -3.510 3.517 1.00 0.00 O ATOM 1222 CB PRO B 127 -6.721 -2.277 5.574 1.00 0.00 C ATOM 1223 CG PRO B 127 -8.160 -2.463 5.879 1.00 0.00 C ATOM 1224 CD PRO B 127 -8.577 -3.793 5.290 1.00 0.00 C ATOM 0 HA PRO B 127 -6.456 -2.536 3.389 1.00 0.00 H new ATOM 0 HB2 PRO B 127 -6.098 -2.608 6.405 1.00 0.00 H new ATOM 0 HB3 PRO B 127 -6.490 -1.226 5.401 1.00 0.00 H new ATOM 0 HG2 PRO B 127 -8.329 -2.450 6.956 1.00 0.00 H new ATOM 0 HG3 PRO B 127 -8.751 -1.652 5.453 1.00 0.00 H new ATOM 0 HD2 PRO B 127 -8.666 -4.557 6.062 1.00 0.00 H new ATOM 0 HD3 PRO B 127 -9.548 -3.722 4.799 1.00 0.00 H new ATOM 1232 N SER B 128 -4.874 -4.610 5.379 1.00 0.00 N ATOM 1233 CA SER B 128 -3.616 -5.314 5.592 1.00 0.00 C ATOM 1234 C SER B 128 -3.228 -6.125 4.348 1.00 0.00 C ATOM 1235 O SER B 128 -2.042 -6.324 4.085 1.00 0.00 O ATOM 1236 CB SER B 128 -3.714 -6.221 6.823 1.00 0.00 C ATOM 1237 OG SER B 128 -2.450 -6.767 7.147 1.00 0.00 O ATOM 0 H SER B 128 -5.592 -4.834 6.068 1.00 0.00 H new ATOM 0 HA SER B 128 -2.834 -4.575 5.770 1.00 0.00 H new ATOM 0 HB2 SER B 128 -4.097 -5.652 7.670 1.00 0.00 H new ATOM 0 HB3 SER B 128 -4.424 -7.025 6.632 1.00 0.00 H new ATOM 0 HG SER B 128 -2.304 -7.585 6.627 1.00 0.00 H new ATOM 1243 N GLU B 129 -4.211 -6.572 3.580 1.00 0.00 N ATOM 1244 CA GLU B 129 -3.958 -7.353 2.377 1.00 0.00 C ATOM 1245 C GLU B 129 -3.505 -6.438 1.236 1.00 0.00 C ATOM 1246 O GLU B 129 -2.522 -6.734 0.538 1.00 0.00 O ATOM 1247 CB GLU B 129 -5.186 -8.166 1.960 1.00 0.00 C ATOM 1248 CG GLU B 129 -5.565 -9.272 2.927 1.00 0.00 C ATOM 1249 CD GLU B 129 -6.703 -10.136 2.416 1.00 0.00 C ATOM 1250 OE1 GLU B 129 -7.849 -9.629 2.349 1.00 0.00 O ATOM 1251 OE2 GLU B 129 -6.469 -11.315 2.080 1.00 0.00 O ATOM 0 H GLU B 129 -5.199 -6.406 3.771 1.00 0.00 H new ATOM 0 HA GLU B 129 -3.160 -8.060 2.602 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -6.034 -7.490 1.850 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -5.000 -8.605 0.980 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -4.694 -9.900 3.113 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -5.850 -8.831 3.882 1.00 0.00 H new ATOM 1258 N ALA B 130 -4.207 -5.339 1.038 1.00 0.00 N ATOM 1259 CA ALA B 130 -3.841 -4.351 0.019 1.00 0.00 C ATOM 1260 C ALA B 130 -2.441 -3.810 0.277 1.00 0.00 C ATOM 1261 O ALA B 130 -1.644 -3.594 -0.647 1.00 0.00 O ATOM 1262 CB ALA B 130 -4.861 -3.209 -0.031 1.00 0.00 C ATOM 0 H ALA B 130 -5.043 -5.099 1.571 1.00 0.00 H new ATOM 0 HA ALA B 130 -3.845 -4.848 -0.951 1.00 0.00 H new ATOM 0 HB1 ALA B 130 -4.565 -2.490 -0.795 1.00 0.00 H new ATOM 0 HB2 ALA B 130 -5.845 -3.611 -0.272 1.00 0.00 H new ATOM 0 HB3 ALA B 130 -4.899 -2.713 0.939 1.00 0.00 H new ATOM 1268 N LEU B 131 -2.131 -3.595 1.549 1.00 0.00 N ATOM 1269 CA LEU B 131 -0.821 -3.124 1.960 1.00 0.00 C ATOM 1270 C LEU B 131 0.228 -4.221 1.751 1.00 0.00 C ATOM 1271 O LEU B 131 1.387 -3.931 1.458 1.00 0.00 O ATOM 1272 CB LEU B 131 -0.866 -2.683 3.430 1.00 0.00 C ATOM 1273 CG LEU B 131 -1.751 -1.451 3.693 1.00 0.00 C ATOM 1274 CD1 LEU B 131 -1.861 -1.168 5.191 1.00 0.00 C ATOM 1275 CD2 LEU B 131 -1.215 -0.231 2.936 1.00 0.00 C ATOM 0 H LEU B 131 -2.781 -3.743 2.321 1.00 0.00 H new ATOM 0 HA LEU B 131 -0.540 -2.267 1.348 1.00 0.00 H new ATOM 0 HB2 LEU B 131 -1.229 -3.513 4.036 1.00 0.00 H new ATOM 0 HB3 LEU B 131 0.149 -2.465 3.763 1.00 0.00 H new ATOM 0 HG LEU B 131 -2.754 -1.664 3.322 1.00 0.00 H new ATOM 0 HD11 LEU B 131 -2.491 -0.293 5.351 1.00 0.00 H new ATOM 0 HD12 LEU B 131 -2.302 -2.029 5.693 1.00 0.00 H new ATOM 0 HD13 LEU B 131 -0.868 -0.979 5.600 1.00 0.00 H new ATOM 0 HD21 LEU B 131 -1.854 0.630 3.134 1.00 0.00 H new ATOM 0 HD22 LEU B 131 -0.200 -0.014 3.268 1.00 0.00 H new ATOM 0 HD23 LEU B 131 -1.210 -0.440 1.866 1.00 0.00 H new ATOM 1287 N ARG B 132 -0.193 -5.474 1.878 1.00 0.00 N ATOM 1288 CA ARG B 132 0.682 -6.622 1.648 1.00 0.00 C ATOM 1289 C ARG B 132 1.162 -6.647 0.200 1.00 0.00 C ATOM 1290 O ARG B 132 2.365 -6.716 -0.067 1.00 0.00 O ATOM 1291 CB ARG B 132 -0.030 -7.954 1.970 1.00 0.00 C ATOM 1292 CG ARG B 132 0.798 -9.185 1.577 1.00 0.00 C ATOM 1293 CD ARG B 132 -0.011 -10.478 1.651 1.00 0.00 C ATOM 1294 NE ARG B 132 -0.393 -10.821 3.018 1.00 0.00 N ATOM 1295 CZ ARG B 132 0.178 -11.792 3.751 1.00 0.00 C ATOM 1296 NH1 ARG B 132 1.247 -12.430 3.291 1.00 0.00 N ATOM 1297 NH2 ARG B 132 -0.300 -12.079 4.948 1.00 0.00 N ATOM 0 H ARG B 132 -1.146 -5.724 2.142 1.00 0.00 H new ATOM 0 HA ARG B 132 1.536 -6.515 2.317 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -0.248 -7.995 3.037 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -0.986 -7.984 1.448 1.00 0.00 H new ATOM 0 HG2 ARG B 132 1.179 -9.055 0.564 1.00 0.00 H new ATOM 0 HG3 ARG B 132 1.663 -9.263 2.235 1.00 0.00 H new ATOM 0 HD2 ARG B 132 -0.909 -10.377 1.041 1.00 0.00 H new ATOM 0 HD3 ARG B 132 0.574 -11.293 1.225 1.00 0.00 H new ATOM 0 HE ARG B 132 -1.147 -10.285 3.447 1.00 0.00 H new ATOM 0 HH11 ARG B 132 1.636 -12.183 2.381 1.00 0.00 H new ATOM 0 HH12 ARG B 132 1.680 -13.167 3.848 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -1.101 -11.564 5.314 1.00 0.00 H new ATOM 0 HH22 ARG B 132 0.132 -12.816 5.506 1.00 0.00 H new ATOM 1311 N LEU B 133 0.217 -6.561 -0.747 1.00 0.00 N ATOM 1312 CA LEU B 133 0.557 -6.640 -2.167 1.00 0.00 C ATOM 1313 C LEU B 133 1.385 -5.428 -2.573 1.00 0.00 C ATOM 1314 O LEU B 133 2.143 -5.484 -3.524 1.00 0.00 O ATOM 1315 CB LEU B 133 -0.693 -6.758 -3.035 1.00 0.00 C ATOM 1316 CG LEU B 133 -1.775 -5.706 -2.836 1.00 0.00 C ATOM 1317 CD1 LEU B 133 -1.669 -4.559 -3.862 1.00 0.00 C ATOM 1318 CD2 LEU B 133 -3.139 -6.385 -2.885 1.00 0.00 C ATOM 0 H LEU B 133 -0.777 -6.438 -0.555 1.00 0.00 H new ATOM 0 HA LEU B 133 1.149 -7.541 -2.325 1.00 0.00 H new ATOM 0 HB2 LEU B 133 -0.383 -6.732 -4.080 1.00 0.00 H new ATOM 0 HB3 LEU B 133 -1.137 -7.738 -2.858 1.00 0.00 H new ATOM 0 HG LEU B 133 -1.639 -5.242 -1.859 1.00 0.00 H new ATOM 0 HD11 LEU B 133 -2.462 -3.833 -3.680 1.00 0.00 H new ATOM 0 HD12 LEU B 133 -0.700 -4.070 -3.762 1.00 0.00 H new ATOM 0 HD13 LEU B 133 -1.770 -4.962 -4.870 1.00 0.00 H new ATOM 0 HD21 LEU B 133 -3.922 -5.640 -2.743 1.00 0.00 H new ATOM 0 HD22 LEU B 133 -3.270 -6.869 -3.853 1.00 0.00 H new ATOM 0 HD23 LEU B 133 -3.202 -7.132 -2.094 1.00 0.00 H new ATOM 1330 N MET B 134 1.237 -4.355 -1.816 1.00 0.00 N ATOM 1331 CA MET B 134 2.049 -3.168 -2.017 1.00 0.00 C ATOM 1332 C MET B 134 3.516 -3.501 -1.700 1.00 0.00 C ATOM 1333 O MET B 134 4.423 -3.196 -2.482 1.00 0.00 O ATOM 1334 CB MET B 134 1.607 -1.996 -1.157 1.00 0.00 C ATOM 1335 CG MET B 134 2.546 -0.804 -1.266 1.00 0.00 C ATOM 1336 SD MET B 134 2.733 0.098 0.286 1.00 0.00 S ATOM 1337 CE MET B 134 4.438 0.622 0.132 1.00 0.00 C ATOM 0 H MET B 134 0.561 -4.281 -1.056 1.00 0.00 H new ATOM 0 HA MET B 134 1.930 -2.868 -3.058 1.00 0.00 H new ATOM 0 HB2 MET B 134 0.603 -1.691 -1.453 1.00 0.00 H new ATOM 0 HB3 MET B 134 1.550 -2.315 -0.116 1.00 0.00 H new ATOM 0 HG2 MET B 134 3.525 -1.150 -1.598 1.00 0.00 H new ATOM 0 HG3 MET B 134 2.172 -0.124 -2.031 1.00 0.00 H new ATOM 0 HE1 MET B 134 4.766 1.073 1.069 1.00 0.00 H new ATOM 0 HE2 MET B 134 5.065 -0.241 -0.095 1.00 0.00 H new ATOM 0 HE3 MET B 134 4.523 1.353 -0.672 1.00 0.00 H new ATOM 1347 N LEU B 135 3.706 -4.147 -0.553 1.00 0.00 N ATOM 1348 CA LEU B 135 5.043 -4.511 -0.101 1.00 0.00 C ATOM 1349 C LEU B 135 5.682 -5.444 -1.116 1.00 0.00 C ATOM 1350 O LEU B 135 6.901 -5.470 -1.282 1.00 0.00 O ATOM 1351 CB LEU B 135 4.999 -5.154 1.286 1.00 0.00 C ATOM 1352 CG LEU B 135 4.504 -4.237 2.425 1.00 0.00 C ATOM 1353 CD1 LEU B 135 4.553 -4.959 3.764 1.00 0.00 C ATOM 1354 CD2 LEU B 135 5.329 -2.956 2.477 1.00 0.00 C ATOM 0 H LEU B 135 2.954 -4.428 0.077 1.00 0.00 H new ATOM 0 HA LEU B 135 5.648 -3.608 -0.019 1.00 0.00 H new ATOM 0 HB2 LEU B 135 4.353 -6.031 1.241 1.00 0.00 H new ATOM 0 HB3 LEU B 135 5.999 -5.508 1.536 1.00 0.00 H new ATOM 0 HG LEU B 135 3.467 -3.972 2.221 1.00 0.00 H new ATOM 0 HD11 LEU B 135 4.199 -4.292 4.550 1.00 0.00 H new ATOM 0 HD12 LEU B 135 3.916 -5.843 3.724 1.00 0.00 H new ATOM 0 HD13 LEU B 135 5.579 -5.260 3.978 1.00 0.00 H new ATOM 0 HD21 LEU B 135 4.966 -2.322 3.286 1.00 0.00 H new ATOM 0 HD22 LEU B 135 6.376 -3.204 2.653 1.00 0.00 H new ATOM 0 HD23 LEU B 135 5.236 -2.425 1.530 1.00 0.00 H new ATOM 1366 N GLU B 136 4.845 -6.215 -1.796 1.00 0.00 N ATOM 1367 CA GLU B 136 5.317 -7.098 -2.854 1.00 0.00 C ATOM 1368 C GLU B 136 5.848 -6.290 -4.044 1.00 0.00 C ATOM 1369 O GLU B 136 6.958 -6.554 -4.511 1.00 0.00 O ATOM 1370 CB GLU B 136 4.196 -8.035 -3.309 1.00 0.00 C ATOM 1371 CG GLU B 136 3.534 -8.802 -2.186 1.00 0.00 C ATOM 1372 CD GLU B 136 2.787 -10.047 -2.671 1.00 0.00 C ATOM 1373 OE1 GLU B 136 3.475 -11.004 -3.096 1.00 0.00 O ATOM 1374 OE2 GLU B 136 1.547 -10.084 -2.620 1.00 0.00 O ATOM 0 H GLU B 136 3.838 -6.247 -1.635 1.00 0.00 H new ATOM 0 HA GLU B 136 6.135 -7.698 -2.454 1.00 0.00 H new ATOM 0 HB2 GLU B 136 3.438 -7.450 -3.830 1.00 0.00 H new ATOM 0 HB3 GLU B 136 4.602 -8.745 -4.029 1.00 0.00 H new ATOM 0 HG2 GLU B 136 4.291 -9.099 -1.461 1.00 0.00 H new ATOM 0 HG3 GLU B 136 2.836 -8.145 -1.667 1.00 0.00 H new ATOM 1381 N TYR B 137 5.080 -5.312 -4.526 1.00 0.00 N ATOM 1382 CA TYR B 137 5.481 -4.598 -5.733 1.00 0.00 C ATOM 1383 C TYR B 137 6.696 -3.703 -5.489 1.00 0.00 C ATOM 1384 O TYR B 137 7.473 -3.474 -6.402 1.00 0.00 O ATOM 1385 CB TYR B 137 4.294 -3.765 -6.323 1.00 0.00 C ATOM 1386 CG TYR B 137 4.099 -2.356 -5.763 1.00 0.00 C ATOM 1387 CD1 TYR B 137 5.031 -1.347 -6.002 1.00 0.00 C ATOM 1388 CD2 TYR B 137 2.983 -2.032 -5.011 1.00 0.00 C ATOM 1389 CE1 TYR B 137 4.854 -0.076 -5.515 1.00 0.00 C ATOM 1390 CE2 TYR B 137 2.809 -0.755 -4.520 1.00 0.00 C ATOM 1391 CZ TYR B 137 3.744 0.217 -4.780 1.00 0.00 C ATOM 1392 OH TYR B 137 3.578 1.491 -4.269 1.00 0.00 O ATOM 0 H TYR B 137 4.201 -5.004 -4.111 1.00 0.00 H new ATOM 0 HA TYR B 137 5.767 -5.352 -6.466 1.00 0.00 H new ATOM 0 HB2 TYR B 137 4.436 -3.686 -7.401 1.00 0.00 H new ATOM 0 HB3 TYR B 137 3.373 -4.325 -6.163 1.00 0.00 H new ATOM 0 HD1 TYR B 137 5.913 -1.571 -6.584 1.00 0.00 H new ATOM 0 HD2 TYR B 137 2.240 -2.788 -4.806 1.00 0.00 H new ATOM 0 HE1 TYR B 137 5.591 0.688 -5.713 1.00 0.00 H new ATOM 0 HE2 TYR B 137 1.936 -0.519 -3.930 1.00 0.00 H new ATOM 0 HH TYR B 137 2.736 1.536 -3.770 1.00 0.00 H new ATOM 1402 N ILE B 138 6.852 -3.197 -4.274 1.00 0.00 N ATOM 1403 CA ILE B 138 8.010 -2.362 -3.969 1.00 0.00 C ATOM 1404 C ILE B 138 9.270 -3.216 -3.875 1.00 0.00 C ATOM 1405 O ILE B 138 10.325 -2.841 -4.393 1.00 0.00 O ATOM 1406 CB ILE B 138 7.814 -1.526 -2.661 1.00 0.00 C ATOM 1407 CG1 ILE B 138 9.143 -0.873 -2.211 1.00 0.00 C ATOM 1408 CG2 ILE B 138 7.243 -2.371 -1.550 1.00 0.00 C ATOM 1409 CD1 ILE B 138 9.771 0.041 -3.250 1.00 0.00 C ATOM 0 H ILE B 138 6.208 -3.344 -3.497 1.00 0.00 H new ATOM 0 HA ILE B 138 8.120 -1.651 -4.788 1.00 0.00 H new ATOM 0 HB ILE B 138 7.101 -0.733 -2.887 1.00 0.00 H new ATOM 0 HG12 ILE B 138 8.964 -0.301 -1.301 1.00 0.00 H new ATOM 0 HG13 ILE B 138 9.854 -1.660 -1.958 1.00 0.00 H new ATOM 0 HG21 ILE B 138 7.119 -1.761 -0.656 1.00 0.00 H new ATOM 0 HG22 ILE B 138 6.275 -2.768 -1.856 1.00 0.00 H new ATOM 0 HG23 ILE B 138 7.922 -3.196 -1.335 1.00 0.00 H new ATOM 0 HD11 ILE B 138 10.698 0.457 -2.856 1.00 0.00 H new ATOM 0 HD12 ILE B 138 9.985 -0.529 -4.154 1.00 0.00 H new ATOM 0 HD13 ILE B 138 9.081 0.851 -3.487 1.00 0.00 H new ATOM 1421 N ALA B 139 9.154 -4.369 -3.253 1.00 0.00 N ATOM 1422 CA ALA B 139 10.283 -5.289 -3.131 1.00 0.00 C ATOM 1423 C ALA B 139 10.722 -5.771 -4.511 1.00 0.00 C ATOM 1424 O ALA B 139 11.907 -5.959 -4.775 1.00 0.00 O ATOM 1425 CB ALA B 139 9.896 -6.480 -2.258 1.00 0.00 C ATOM 0 H ALA B 139 8.291 -4.699 -2.821 1.00 0.00 H new ATOM 0 HA ALA B 139 11.115 -4.763 -2.662 1.00 0.00 H new ATOM 0 HB1 ALA B 139 10.744 -7.160 -2.173 1.00 0.00 H new ATOM 0 HB2 ALA B 139 9.613 -6.127 -1.266 1.00 0.00 H new ATOM 0 HB3 ALA B 139 9.054 -7.004 -2.710 1.00 0.00 H new ATOM 1431 N ASP B 140 9.735 -5.987 -5.385 1.00 0.00 N ATOM 1432 CA ASP B 140 9.980 -6.492 -6.722 1.00 0.00 C ATOM 1433 C ASP B 140 10.572 -5.431 -7.658 1.00 0.00 C ATOM 1434 O ASP B 140 11.603 -5.650 -8.290 1.00 0.00 O ATOM 1435 CB ASP B 140 8.659 -7.032 -7.324 1.00 0.00 C ATOM 1436 CG ASP B 140 8.817 -7.502 -8.765 1.00 0.00 C ATOM 1437 OD1 ASP B 140 9.323 -8.629 -8.967 1.00 0.00 O ATOM 1438 OD2 ASP B 140 8.448 -6.744 -9.681 1.00 0.00 O ATOM 0 H ASP B 140 8.751 -5.815 -5.179 1.00 0.00 H new ATOM 0 HA ASP B 140 10.715 -7.292 -6.633 1.00 0.00 H new ATOM 0 HB2 ASP B 140 8.298 -7.860 -6.714 1.00 0.00 H new ATOM 0 HB3 ASP B 140 7.900 -6.251 -7.282 1.00 0.00 H new ATOM 1443 N ASN B 141 9.913 -4.286 -7.735 1.00 0.00 N ATOM 1444 CA ASN B 141 10.269 -3.229 -8.692 1.00 0.00 C ATOM 1445 C ASN B 141 11.346 -2.301 -8.140 1.00 0.00 C ATOM 1446 O ASN B 141 12.162 -1.757 -8.893 1.00 0.00 O ATOM 1447 CB ASN B 141 9.039 -2.424 -9.095 1.00 0.00 C ATOM 1448 CG ASN B 141 8.051 -3.227 -9.934 1.00 0.00 C ATOM 1449 OD1 ASN B 141 8.136 -3.266 -11.162 1.00 0.00 O ATOM 1450 ND2 ASN B 141 7.098 -3.878 -9.272 1.00 0.00 N ATOM 0 H ASN B 141 9.117 -4.055 -7.141 1.00 0.00 H new ATOM 0 HA ASN B 141 10.674 -3.722 -9.576 1.00 0.00 H new ATOM 0 HB2 ASN B 141 8.537 -2.064 -8.197 1.00 0.00 H new ATOM 0 HB3 ASN B 141 9.355 -1.545 -9.657 1.00 0.00 H new ATOM 0 HD21 ASN B 141 6.409 -4.431 -9.782 1.00 0.00 H new ATOM 0 HD22 ASN B 141 7.056 -3.824 -8.254 1.00 0.00 H new ATOM 1457 N GLU B 142 11.328 -2.117 -6.811 1.00 0.00 N ATOM 1458 CA GLU B 142 12.286 -1.239 -6.123 1.00 0.00 C ATOM 1459 C GLU B 142 12.324 0.163 -6.747 1.00 0.00 C ATOM 1460 O GLU B 142 13.401 0.719 -6.969 1.00 0.00 O ATOM 1461 CB GLU B 142 13.678 -1.901 -6.134 1.00 0.00 C ATOM 1462 CG GLU B 142 13.717 -3.284 -5.501 1.00 0.00 C ATOM 1463 CD GLU B 142 15.123 -3.879 -5.483 1.00 0.00 C ATOM 1464 OE1 GLU B 142 15.521 -4.536 -6.474 1.00 0.00 O ATOM 1465 OE2 GLU B 142 15.841 -3.697 -4.473 1.00 0.00 O ATOM 0 H GLU B 142 10.657 -2.567 -6.189 1.00 0.00 H new ATOM 0 HA GLU B 142 11.962 -1.106 -5.091 1.00 0.00 H new ATOM 0 HB2 GLU B 142 14.024 -1.976 -7.165 1.00 0.00 H new ATOM 0 HB3 GLU B 142 14.380 -1.253 -5.608 1.00 0.00 H new ATOM 0 HG2 GLU B 142 13.338 -3.224 -4.481 1.00 0.00 H new ATOM 0 HG3 GLU B 142 13.051 -3.950 -6.050 1.00 0.00 H new ATOM 1472 N ARG B 143 11.146 0.735 -6.993 1.00 0.00 N ATOM 1473 CA ARG B 143 11.057 2.074 -7.584 1.00 0.00 C ATOM 1474 C ARG B 143 9.807 2.846 -7.204 1.00 0.00 C ATOM 1475 O ARG B 143 9.801 4.079 -7.223 1.00 0.00 O ATOM 1476 CB ARG B 143 11.142 1.976 -9.128 1.00 0.00 C ATOM 1477 CG ARG B 143 10.052 1.129 -9.761 1.00 0.00 C ATOM 1478 CD ARG B 143 10.186 1.124 -11.279 1.00 0.00 C ATOM 1479 NE ARG B 143 11.530 0.754 -11.734 1.00 0.00 N ATOM 1480 CZ ARG B 143 11.879 0.603 -13.005 1.00 0.00 C ATOM 1481 NH1 ARG B 143 10.980 0.706 -13.977 1.00 0.00 N ATOM 1482 NH2 ARG B 143 13.150 0.311 -13.305 1.00 0.00 N ATOM 0 H ARG B 143 10.246 0.298 -6.795 1.00 0.00 H new ATOM 0 HA ARG B 143 11.900 2.631 -7.176 1.00 0.00 H new ATOM 0 HB2 ARG B 143 11.095 2.981 -9.547 1.00 0.00 H new ATOM 0 HB3 ARG B 143 12.113 1.562 -9.401 1.00 0.00 H new ATOM 0 HG2 ARG B 143 10.112 0.109 -9.382 1.00 0.00 H new ATOM 0 HG3 ARG B 143 9.073 1.517 -9.479 1.00 0.00 H new ATOM 0 HD2 ARG B 143 9.461 0.427 -11.700 1.00 0.00 H new ATOM 0 HD3 ARG B 143 9.938 2.113 -11.663 1.00 0.00 H new ATOM 0 HE ARG B 143 12.246 0.602 -11.024 1.00 0.00 H new ATOM 0 HH11 ARG B 143 10.005 0.904 -13.751 1.00 0.00 H new ATOM 0 HH12 ARG B 143 11.264 0.587 -14.949 1.00 0.00 H new ATOM 0 HH21 ARG B 143 13.839 0.207 -12.560 1.00 0.00 H new ATOM 0 HH22 ARG B 143 13.430 0.193 -14.279 1.00 0.00 H new ATOM 1496 N LEU B 144 8.717 2.129 -6.885 1.00 0.00 N ATOM 1497 CA LEU B 144 7.431 2.747 -6.587 1.00 0.00 C ATOM 1498 C LEU B 144 6.834 3.425 -7.822 1.00 0.00 C ATOM 1499 O LEU B 144 7.559 3.763 -8.764 1.00 0.00 O ATOM 1500 CB LEU B 144 7.565 3.764 -5.428 1.00 0.00 C ATOM 1501 CG LEU B 144 7.918 3.168 -4.062 1.00 0.00 C ATOM 1502 CD1 LEU B 144 8.161 4.274 -3.044 1.00 0.00 C ATOM 1503 CD2 LEU B 144 6.821 2.227 -3.565 1.00 0.00 C ATOM 0 H LEU B 144 8.710 1.111 -6.829 1.00 0.00 H new ATOM 0 HA LEU B 144 6.751 1.953 -6.278 1.00 0.00 H new ATOM 0 HB2 LEU B 144 8.330 4.493 -5.695 1.00 0.00 H new ATOM 0 HB3 LEU B 144 6.625 4.308 -5.335 1.00 0.00 H new ATOM 0 HG LEU B 144 8.833 2.588 -4.180 1.00 0.00 H new ATOM 0 HD11 LEU B 144 8.411 3.832 -2.079 1.00 0.00 H new ATOM 0 HD12 LEU B 144 8.986 4.903 -3.380 1.00 0.00 H new ATOM 0 HD13 LEU B 144 7.261 4.880 -2.943 1.00 0.00 H new ATOM 0 HD21 LEU B 144 7.103 1.821 -2.593 1.00 0.00 H new ATOM 0 HD22 LEU B 144 5.885 2.777 -3.471 1.00 0.00 H new ATOM 0 HD23 LEU B 144 6.692 1.411 -4.276 1.00 0.00 H new