USER MOD reduce.3.24.130724 H: found=0, std=0, add=713, rem=0, adj=25 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 -151:sc= -0.142 (180deg=-1.08) USER MOD Single : A 1 MET N :NH3+ -110:sc= 0.085 (180deg=-0.118) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN :FLIP amide:sc= -1.53 F(o=-5.2!,f=-1.5) USER MOD Single : A 13 LYS NZ :NH3+ -167:sc= 0.93 (180deg=0.794) USER MOD Single : A 16 SER OG : rot -90:sc= -0.784 USER MOD Single : A 17 TYR OH : rot 180:sc=-0.00316 USER MOD Single : A 22 LYS NZ :NH3+ 157:sc= 1.24 (180deg=0.593) USER MOD Single : A 23 MET CE :methyl -108:sc= -1.05 (180deg=-2.79!) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0.00564 USER MOD Single : A 34 MET CE :methyl 168:sc= -0.627 (180deg=-0.76) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -2.23! X(o=-2.2!,f=-2.2) USER MOD Single : B 101 MET CE :methyl 167:sc= -0.0881 (180deg=-0.37) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 105 ASN : amide:sc= -2.42 K(o=-2.4,f=-3.8!) USER MOD Single : B 113 LYS NZ :NH3+ 177:sc= 0.944 (180deg=0.942) USER MOD Single : B 116 SER OG : rot -177:sc= -0.582 USER MOD Single : B 117 TYR OH : rot 180:sc= -0.419 USER MOD Single : B 122 LYS NZ :NH3+ -168:sc= 1.15 (180deg=0.567) USER MOD Single : B 123 MET CE :methyl -167:sc= -5.95! (180deg=-6.62!) USER MOD Single : B 126 THR OG1 : rot 180:sc= 0 USER MOD Single : B 128 SER OG : rot 180:sc= 0 USER MOD Single : B 134 MET CE :methyl 168:sc= -0.0499 (180deg=-0.0693) USER MOD Single : B 137 TYR OH : rot 180:sc= -0.0738 USER MOD Single : B 141 ASN :FLIP amide:sc= -0.224 F(o=-2.7!,f=-0.22) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.754 13.287 11.921 1.00 0.00 N ATOM 2 CA MET A 1 -3.440 11.984 11.295 1.00 0.00 C ATOM 3 C MET A 1 -3.535 10.864 12.336 1.00 0.00 C ATOM 4 O MET A 1 -3.505 11.128 13.536 1.00 0.00 O ATOM 5 CB MET A 1 -2.047 12.003 10.639 1.00 0.00 C ATOM 6 CG MET A 1 -0.892 12.157 11.606 1.00 0.00 C ATOM 7 SD MET A 1 0.644 12.563 10.775 1.00 0.00 S ATOM 8 CE MET A 1 0.742 11.266 9.530 1.00 0.00 C ATOM 0 H1 MET A 1 -4.670 13.630 11.568 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.802 13.174 12.954 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.011 13.975 11.682 1.00 0.00 H new ATOM 0 HA MET A 1 -4.172 11.796 10.509 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.912 11.078 10.078 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.011 12.820 9.919 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.128 12.938 12.329 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.765 11.231 12.167 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.788 11.058 9.303 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.266 10.361 9.909 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.232 11.592 8.624 1.00 0.00 H new ATOM 18 N GLY A 2 -3.643 9.615 11.866 1.00 0.00 N ATOM 19 CA GLY A 2 -3.780 8.498 12.755 1.00 0.00 C ATOM 20 C GLY A 2 -2.878 7.343 12.346 1.00 0.00 C ATOM 21 O GLY A 2 -2.316 7.332 11.233 1.00 0.00 O ATOM 0 H GLY A 2 -3.636 9.372 10.875 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -3.536 8.809 13.771 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -4.818 8.165 12.764 1.00 0.00 H new ATOM 25 N SER A 3 -2.753 6.369 13.229 1.00 0.00 N ATOM 26 CA SER A 3 -1.924 5.212 12.995 1.00 0.00 C ATOM 27 C SER A 3 -2.775 3.955 12.843 1.00 0.00 C ATOM 28 O SER A 3 -3.816 3.800 13.496 1.00 0.00 O ATOM 29 CB SER A 3 -0.898 5.014 14.119 1.00 0.00 C ATOM 30 OG SER A 3 -1.517 5.134 15.404 1.00 0.00 O ATOM 0 H SER A 3 -3.228 6.363 14.132 1.00 0.00 H new ATOM 0 HA SER A 3 -1.382 5.388 12.066 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.435 4.032 14.025 1.00 0.00 H new ATOM 0 HB3 SER A 3 -0.102 5.753 14.024 1.00 0.00 H new ATOM 0 HG SER A 3 -0.845 5.002 16.105 1.00 0.00 H new ATOM 36 N ILE A 4 -2.338 3.073 11.962 1.00 0.00 N ATOM 37 CA ILE A 4 -3.001 1.812 11.706 1.00 0.00 C ATOM 38 C ILE A 4 -2.008 0.668 11.887 1.00 0.00 C ATOM 39 O ILE A 4 -0.797 0.902 11.829 1.00 0.00 O ATOM 40 CB ILE A 4 -3.617 1.776 10.268 1.00 0.00 C ATOM 41 CG1 ILE A 4 -2.517 1.714 9.168 1.00 0.00 C ATOM 42 CG2 ILE A 4 -4.507 2.993 10.037 1.00 0.00 C ATOM 43 CD1 ILE A 4 -2.294 0.323 8.604 1.00 0.00 C ATOM 0 H ILE A 4 -1.501 3.217 11.398 1.00 0.00 H new ATOM 0 HA ILE A 4 -3.818 1.700 12.418 1.00 0.00 H new ATOM 0 HB ILE A 4 -4.217 0.869 10.197 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -2.791 2.386 8.355 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -1.579 2.082 9.584 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.927 2.951 9.032 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.315 2.997 10.768 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.916 3.902 10.146 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -1.514 0.359 7.844 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -1.989 -0.350 9.405 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.219 -0.041 8.157 1.00 0.00 H new ATOM 55 N ASN A 5 -2.513 -0.527 12.094 1.00 0.00 N ATOM 56 CA ASN A 5 -1.678 -1.717 12.228 1.00 0.00 C ATOM 57 C ASN A 5 -1.769 -2.551 10.960 1.00 0.00 C ATOM 58 O ASN A 5 -2.862 -2.900 10.509 1.00 0.00 O ATOM 59 CB ASN A 5 -2.132 -2.552 13.457 1.00 0.00 C ATOM 60 CG ASN A 5 -1.629 -3.996 13.465 1.00 0.00 C ATOM 61 OD1 ASN A 5 -0.474 -4.229 12.859 1.00 0.00 O flip ATOM 62 ND2 ASN A 5 -2.282 -4.888 14.009 1.00 0.00 N flip ATOM 0 H ASN A 5 -3.513 -0.710 12.175 1.00 0.00 H new ATOM 0 HA ASN A 5 -0.642 -1.413 12.379 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -1.788 -2.056 14.364 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -3.221 -2.560 13.492 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -3.167 -4.666 14.465 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -1.937 -5.848 14.003 1.00 0.00 H new ATOM 69 N LEU A 6 -0.619 -2.841 10.389 1.00 0.00 N ATOM 70 CA LEU A 6 -0.504 -3.659 9.199 1.00 0.00 C ATOM 71 C LEU A 6 0.271 -4.910 9.558 1.00 0.00 C ATOM 72 O LEU A 6 1.172 -4.834 10.402 1.00 0.00 O ATOM 73 CB LEU A 6 0.193 -2.827 8.096 1.00 0.00 C ATOM 74 CG LEU A 6 0.410 -3.478 6.716 1.00 0.00 C ATOM 75 CD1 LEU A 6 1.647 -4.386 6.700 1.00 0.00 C ATOM 76 CD2 LEU A 6 -0.825 -4.251 6.268 1.00 0.00 C ATOM 0 H LEU A 6 0.278 -2.509 10.744 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.478 -3.964 8.817 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -0.390 -1.918 7.947 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.168 -2.521 8.476 1.00 0.00 H new ATOM 0 HG LEU A 6 0.584 -2.668 6.008 1.00 0.00 H new ATOM 0 HD11 LEU A 6 1.763 -4.825 5.709 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.533 -3.799 6.943 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.525 -5.180 7.436 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -0.640 -4.698 5.291 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -1.045 -5.037 6.991 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.675 -3.572 6.201 1.00 0.00 H new ATOM 88 N ARG A 7 -0.048 -6.071 8.996 1.00 0.00 N ATOM 89 CA ARG A 7 0.574 -7.324 9.399 1.00 0.00 C ATOM 90 C ARG A 7 0.915 -8.144 8.149 1.00 0.00 C ATOM 91 O ARG A 7 0.016 -8.483 7.386 1.00 0.00 O ATOM 92 CB ARG A 7 -0.322 -8.141 10.310 1.00 0.00 C ATOM 93 CG ARG A 7 -0.531 -7.507 11.675 1.00 0.00 C ATOM 94 CD ARG A 7 -1.358 -8.385 12.592 1.00 0.00 C ATOM 95 NE ARG A 7 -2.733 -8.532 12.105 1.00 0.00 N ATOM 96 CZ ARG A 7 -3.716 -9.098 12.807 1.00 0.00 C ATOM 97 NH1 ARG A 7 -3.496 -9.570 14.014 1.00 0.00 N ATOM 98 NH2 ARG A 7 -4.935 -9.218 12.264 1.00 0.00 N ATOM 0 H ARG A 7 -0.740 -6.169 8.253 1.00 0.00 H new ATOM 0 HA ARG A 7 1.478 -7.082 9.957 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -1.290 -8.277 9.828 1.00 0.00 H new ATOM 0 HB3 ARG A 7 0.112 -9.133 10.440 1.00 0.00 H new ATOM 0 HG2 ARG A 7 0.437 -7.313 12.136 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -1.025 -6.543 11.554 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -0.893 -9.368 12.672 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -1.370 -7.956 13.594 1.00 0.00 H new ATOM 0 HE ARG A 7 -2.951 -8.180 11.173 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -2.565 -9.506 14.425 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -4.257 -10.000 14.540 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -5.108 -8.877 11.318 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -5.690 -9.650 12.796 1.00 0.00 H new ATOM 112 N ILE A 8 2.183 -8.441 7.934 1.00 0.00 N ATOM 113 CA ILE A 8 2.608 -9.248 6.792 1.00 0.00 C ATOM 114 C ILE A 8 3.707 -10.196 7.222 1.00 0.00 C ATOM 115 O ILE A 8 4.246 -10.052 8.322 1.00 0.00 O ATOM 116 CB ILE A 8 3.110 -8.418 5.576 1.00 0.00 C ATOM 117 CG1 ILE A 8 4.445 -7.716 5.860 1.00 0.00 C ATOM 118 CG2 ILE A 8 2.056 -7.418 5.134 1.00 0.00 C ATOM 119 CD1 ILE A 8 4.455 -6.766 7.040 1.00 0.00 C ATOM 0 H ILE A 8 2.946 -8.135 8.537 1.00 0.00 H new ATOM 0 HA ILE A 8 1.720 -9.786 6.460 1.00 0.00 H new ATOM 0 HB ILE A 8 3.287 -9.120 4.761 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.206 -8.478 6.026 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.738 -7.161 4.969 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.429 -6.849 4.282 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.149 -7.949 4.846 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.833 -6.737 5.956 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.448 -6.328 7.146 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.725 -5.974 6.875 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.200 -7.312 7.949 1.00 0.00 H new ATOM 131 N ASP A 9 4.050 -11.151 6.363 1.00 0.00 N ATOM 132 CA ASP A 9 5.142 -12.055 6.661 1.00 0.00 C ATOM 133 C ASP A 9 6.449 -11.268 6.754 1.00 0.00 C ATOM 134 O ASP A 9 6.717 -10.409 5.896 1.00 0.00 O ATOM 135 CB ASP A 9 5.259 -13.158 5.603 1.00 0.00 C ATOM 136 CG ASP A 9 6.094 -14.351 6.061 1.00 0.00 C ATOM 137 OD1 ASP A 9 7.266 -14.148 6.428 1.00 0.00 O ATOM 138 OD2 ASP A 9 5.560 -15.473 6.085 1.00 0.00 O ATOM 0 H ASP A 9 3.591 -11.314 5.467 1.00 0.00 H new ATOM 0 HA ASP A 9 4.938 -12.536 7.618 1.00 0.00 H new ATOM 0 HB2 ASP A 9 4.260 -13.504 5.337 1.00 0.00 H new ATOM 0 HB3 ASP A 9 5.702 -12.739 4.700 1.00 0.00 H new ATOM 143 N ASP A 10 7.254 -11.569 7.756 1.00 0.00 N ATOM 144 CA ASP A 10 8.457 -10.804 8.054 1.00 0.00 C ATOM 145 C ASP A 10 9.433 -10.823 6.873 1.00 0.00 C ATOM 146 O ASP A 10 10.111 -9.833 6.596 1.00 0.00 O ATOM 147 CB ASP A 10 9.141 -11.343 9.318 1.00 0.00 C ATOM 148 CG ASP A 10 10.331 -10.505 9.760 1.00 0.00 C ATOM 149 OD1 ASP A 10 10.126 -9.505 10.468 1.00 0.00 O ATOM 150 OD2 ASP A 10 11.468 -10.859 9.415 1.00 0.00 O ATOM 0 H ASP A 10 7.094 -12.352 8.389 1.00 0.00 H new ATOM 0 HA ASP A 10 8.159 -9.771 8.231 1.00 0.00 H new ATOM 0 HB2 ASP A 10 8.413 -11.384 10.128 1.00 0.00 H new ATOM 0 HB3 ASP A 10 9.473 -12.365 9.136 1.00 0.00 H new ATOM 155 N GLU A 11 9.473 -11.945 6.164 1.00 0.00 N ATOM 156 CA GLU A 11 10.419 -12.122 5.059 1.00 0.00 C ATOM 157 C GLU A 11 10.106 -11.140 3.935 1.00 0.00 C ATOM 158 O GLU A 11 11.018 -10.620 3.286 1.00 0.00 O ATOM 159 CB GLU A 11 10.408 -13.553 4.511 1.00 0.00 C ATOM 160 CG GLU A 11 9.094 -13.978 3.839 1.00 0.00 C ATOM 161 CD GLU A 11 9.150 -15.388 3.275 1.00 0.00 C ATOM 162 OE1 GLU A 11 9.700 -15.551 2.170 1.00 0.00 O ATOM 163 OE2 GLU A 11 8.644 -16.336 3.927 1.00 0.00 O ATOM 0 H GLU A 11 8.865 -12.746 6.331 1.00 0.00 H new ATOM 0 HA GLU A 11 11.416 -11.926 5.455 1.00 0.00 H new ATOM 0 HB2 GLU A 11 11.218 -13.656 3.789 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.620 -14.241 5.329 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.283 -13.914 4.564 1.00 0.00 H new ATOM 0 HG3 GLU A 11 8.859 -13.279 3.036 1.00 0.00 H new ATOM 170 N LEU A 12 8.831 -10.860 3.716 1.00 0.00 N ATOM 171 CA LEU A 12 8.406 -9.983 2.633 1.00 0.00 C ATOM 172 C LEU A 12 8.656 -8.547 3.033 1.00 0.00 C ATOM 173 O LEU A 12 9.170 -7.743 2.244 1.00 0.00 O ATOM 174 CB LEU A 12 6.910 -10.202 2.349 1.00 0.00 C ATOM 175 CG LEU A 12 6.331 -9.318 1.222 1.00 0.00 C ATOM 176 CD1 LEU A 12 7.072 -9.556 -0.101 1.00 0.00 C ATOM 177 CD2 LEU A 12 4.825 -9.564 1.055 1.00 0.00 C ATOM 0 H LEU A 12 8.065 -11.231 4.279 1.00 0.00 H new ATOM 0 HA LEU A 12 8.972 -10.209 1.729 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.753 -11.249 2.088 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.349 -10.014 3.264 1.00 0.00 H new ATOM 0 HG LEU A 12 6.476 -8.276 1.505 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.644 -8.921 -0.877 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.127 -9.314 0.025 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.971 -10.602 -0.391 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.439 -8.931 0.256 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.653 -10.611 0.804 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.312 -9.326 1.987 1.00 0.00 H new ATOM 189 N LYS A 13 8.312 -8.241 4.285 1.00 0.00 N ATOM 190 CA LYS A 13 8.546 -6.931 4.867 1.00 0.00 C ATOM 191 C LYS A 13 10.026 -6.539 4.717 1.00 0.00 C ATOM 192 O LYS A 13 10.329 -5.385 4.437 1.00 0.00 O ATOM 193 CB LYS A 13 8.139 -6.944 6.350 1.00 0.00 C ATOM 194 CG LYS A 13 8.441 -5.661 7.139 1.00 0.00 C ATOM 195 CD LYS A 13 9.793 -5.748 7.862 1.00 0.00 C ATOM 196 CE LYS A 13 9.791 -6.876 8.883 1.00 0.00 C ATOM 197 NZ LYS A 13 11.108 -7.068 9.542 1.00 0.00 N ATOM 0 H LYS A 13 7.863 -8.900 4.920 1.00 0.00 H new ATOM 0 HA LYS A 13 7.941 -6.192 4.341 1.00 0.00 H new ATOM 0 HB2 LYS A 13 7.069 -7.142 6.412 1.00 0.00 H new ATOM 0 HB3 LYS A 13 8.646 -7.776 6.839 1.00 0.00 H new ATOM 0 HG2 LYS A 13 8.445 -4.808 6.460 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.649 -5.486 7.867 1.00 0.00 H new ATOM 0 HD2 LYS A 13 10.589 -5.911 7.135 1.00 0.00 H new ATOM 0 HD3 LYS A 13 10.005 -4.802 8.360 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.038 -6.669 9.643 1.00 0.00 H new ATOM 0 HE3 LYS A 13 9.499 -7.803 8.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 11.111 -7.973 10.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 11.859 -7.075 8.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 11.278 -6.291 10.212 1.00 0.00 H new ATOM 211 N ALA A 14 10.910 -7.512 4.883 1.00 0.00 N ATOM 212 CA ALA A 14 12.340 -7.264 4.752 1.00 0.00 C ATOM 213 C ALA A 14 12.685 -6.721 3.360 1.00 0.00 C ATOM 214 O ALA A 14 13.379 -5.715 3.231 1.00 0.00 O ATOM 215 CB ALA A 14 13.143 -8.524 5.053 1.00 0.00 C ATOM 0 H ALA A 14 10.665 -8.476 5.108 1.00 0.00 H new ATOM 0 HA ALA A 14 12.611 -6.504 5.485 1.00 0.00 H new ATOM 0 HB1 ALA A 14 14.207 -8.311 4.948 1.00 0.00 H new ATOM 0 HB2 ALA A 14 12.937 -8.852 6.072 1.00 0.00 H new ATOM 0 HB3 ALA A 14 12.860 -9.311 4.355 1.00 0.00 H new ATOM 221 N ARG A 15 12.199 -7.401 2.328 1.00 0.00 N ATOM 222 CA ARG A 15 12.488 -7.020 0.938 1.00 0.00 C ATOM 223 C ARG A 15 11.900 -5.632 0.616 1.00 0.00 C ATOM 224 O ARG A 15 12.569 -4.764 0.065 1.00 0.00 O ATOM 225 CB ARG A 15 11.936 -8.039 -0.060 1.00 0.00 C ATOM 226 CG ARG A 15 12.835 -9.282 -0.269 1.00 0.00 C ATOM 227 CD ARG A 15 12.997 -10.097 0.987 1.00 0.00 C ATOM 228 NE ARG A 15 13.646 -11.387 0.712 1.00 0.00 N ATOM 229 CZ ARG A 15 13.660 -12.432 1.543 1.00 0.00 C ATOM 230 NH1 ARG A 15 13.066 -12.359 2.723 1.00 0.00 N ATOM 231 NH2 ARG A 15 14.269 -13.544 1.175 1.00 0.00 N ATOM 0 H ARG A 15 11.601 -8.222 2.421 1.00 0.00 H new ATOM 0 HA ARG A 15 13.573 -6.991 0.841 1.00 0.00 H new ATOM 0 HB2 ARG A 15 10.955 -8.369 0.281 1.00 0.00 H new ATOM 0 HB3 ARG A 15 11.790 -7.546 -1.021 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.407 -9.908 -1.051 1.00 0.00 H new ATOM 0 HG3 ARG A 15 13.816 -8.961 -0.619 1.00 0.00 H new ATOM 0 HD2 ARG A 15 13.589 -9.538 1.711 1.00 0.00 H new ATOM 0 HD3 ARG A 15 12.020 -10.269 1.439 1.00 0.00 H new ATOM 0 HE ARG A 15 14.123 -11.492 -0.184 1.00 0.00 H new ATOM 0 HH11 ARG A 15 12.593 -11.500 3.004 1.00 0.00 H new ATOM 0 HH12 ARG A 15 13.081 -13.162 3.352 1.00 0.00 H new ATOM 0 HH21 ARG A 15 14.723 -13.599 0.263 1.00 0.00 H new ATOM 0 HH22 ARG A 15 14.285 -14.348 1.802 1.00 0.00 H new ATOM 245 N SER A 16 10.636 -5.444 0.986 1.00 0.00 N ATOM 246 CA SER A 16 9.924 -4.205 0.708 1.00 0.00 C ATOM 247 C SER A 16 10.639 -3.007 1.340 1.00 0.00 C ATOM 248 O SER A 16 11.012 -2.049 0.651 1.00 0.00 O ATOM 249 CB SER A 16 8.495 -4.293 1.234 1.00 0.00 C ATOM 250 OG SER A 16 7.845 -3.054 1.101 1.00 0.00 O ATOM 0 H SER A 16 10.082 -6.142 1.483 1.00 0.00 H new ATOM 0 HA SER A 16 9.902 -4.061 -0.372 1.00 0.00 H new ATOM 0 HB2 SER A 16 7.946 -5.059 0.686 1.00 0.00 H new ATOM 0 HB3 SER A 16 8.505 -4.595 2.281 1.00 0.00 H new ATOM 0 HG SER A 16 7.987 -2.522 1.911 1.00 0.00 H new ATOM 256 N TYR A 17 10.829 -3.063 2.659 1.00 0.00 N ATOM 257 CA TYR A 17 11.470 -1.971 3.389 1.00 0.00 C ATOM 258 C TYR A 17 12.881 -1.721 2.874 1.00 0.00 C ATOM 259 O TYR A 17 13.292 -0.571 2.736 1.00 0.00 O ATOM 260 CB TYR A 17 11.507 -2.287 4.893 1.00 0.00 C ATOM 261 CG TYR A 17 10.185 -2.011 5.593 1.00 0.00 C ATOM 262 CD1 TYR A 17 9.033 -2.718 5.256 1.00 0.00 C ATOM 263 CD2 TYR A 17 10.084 -1.043 6.580 1.00 0.00 C ATOM 264 CE1 TYR A 17 7.826 -2.475 5.882 1.00 0.00 C ATOM 265 CE2 TYR A 17 8.881 -0.770 7.218 1.00 0.00 C ATOM 266 CZ TYR A 17 7.758 -1.496 6.859 1.00 0.00 C ATOM 267 OH TYR A 17 6.577 -1.229 7.475 1.00 0.00 O ATOM 0 H TYR A 17 10.548 -3.852 3.242 1.00 0.00 H new ATOM 0 HA TYR A 17 10.883 -1.067 3.228 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.773 -3.335 5.032 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.291 -1.694 5.364 1.00 0.00 H new ATOM 0 HD1 TYR A 17 9.085 -3.474 4.487 1.00 0.00 H new ATOM 0 HD2 TYR A 17 10.965 -0.486 6.861 1.00 0.00 H new ATOM 0 HE1 TYR A 17 6.947 -3.041 5.613 1.00 0.00 H new ATOM 0 HE2 TYR A 17 8.823 -0.006 7.979 1.00 0.00 H new ATOM 0 HH TYR A 17 6.706 -0.516 8.135 1.00 0.00 H new ATOM 277 N ALA A 18 13.591 -2.795 2.544 1.00 0.00 N ATOM 278 CA ALA A 18 14.951 -2.683 2.011 1.00 0.00 C ATOM 279 C ALA A 18 14.950 -1.870 0.698 1.00 0.00 C ATOM 280 O ALA A 18 15.852 -1.046 0.462 1.00 0.00 O ATOM 281 CB ALA A 18 15.539 -4.070 1.775 1.00 0.00 C ATOM 0 H ALA A 18 13.251 -3.752 2.635 1.00 0.00 H new ATOM 0 HA ALA A 18 15.569 -2.160 2.741 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.550 -3.974 1.379 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.569 -4.618 2.717 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.919 -4.611 1.060 1.00 0.00 H new ATOM 287 N ALA A 19 13.965 -2.133 -0.148 1.00 0.00 N ATOM 288 CA ALA A 19 13.837 -1.446 -1.428 1.00 0.00 C ATOM 289 C ALA A 19 13.548 0.048 -1.257 1.00 0.00 C ATOM 290 O ALA A 19 14.179 0.887 -1.884 1.00 0.00 O ATOM 291 CB ALA A 19 12.748 -2.105 -2.266 1.00 0.00 C ATOM 0 H ALA A 19 13.236 -2.824 0.030 1.00 0.00 H new ATOM 0 HA ALA A 19 14.794 -1.531 -1.944 1.00 0.00 H new ATOM 0 HB1 ALA A 19 12.659 -1.586 -3.220 1.00 0.00 H new ATOM 0 HB2 ALA A 19 13.007 -3.149 -2.444 1.00 0.00 H new ATOM 0 HB3 ALA A 19 11.798 -2.052 -1.734 1.00 0.00 H new ATOM 297 N LEU A 20 12.609 0.371 -0.377 1.00 0.00 N ATOM 298 CA LEU A 20 12.176 1.764 -0.222 1.00 0.00 C ATOM 299 C LEU A 20 13.238 2.610 0.487 1.00 0.00 C ATOM 300 O LEU A 20 13.460 3.772 0.124 1.00 0.00 O ATOM 301 CB LEU A 20 10.801 1.836 0.471 1.00 0.00 C ATOM 302 CG LEU A 20 10.650 1.053 1.794 1.00 0.00 C ATOM 303 CD1 LEU A 20 11.242 1.821 2.977 1.00 0.00 C ATOM 304 CD2 LEU A 20 9.182 0.713 2.047 1.00 0.00 C ATOM 0 H LEU A 20 12.136 -0.296 0.233 1.00 0.00 H new ATOM 0 HA LEU A 20 12.057 2.196 -1.216 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.573 2.884 0.668 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.048 1.472 -0.228 1.00 0.00 H new ATOM 0 HG LEU A 20 11.212 0.124 1.697 1.00 0.00 H new ATOM 0 HD11 LEU A 20 11.116 1.238 3.889 1.00 0.00 H new ATOM 0 HD12 LEU A 20 12.303 1.997 2.802 1.00 0.00 H new ATOM 0 HD13 LEU A 20 10.729 2.777 3.084 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.092 0.161 2.983 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.601 1.633 2.111 1.00 0.00 H new ATOM 0 HD23 LEU A 20 8.804 0.102 1.228 1.00 0.00 H new ATOM 316 N GLU A 21 13.925 2.006 1.453 1.00 0.00 N ATOM 317 CA GLU A 21 14.935 2.740 2.234 1.00 0.00 C ATOM 318 C GLU A 21 16.172 3.018 1.388 1.00 0.00 C ATOM 319 O GLU A 21 16.923 3.950 1.662 1.00 0.00 O ATOM 320 CB GLU A 21 15.341 1.967 3.485 1.00 0.00 C ATOM 321 CG GLU A 21 15.981 0.622 3.195 1.00 0.00 C ATOM 322 CD GLU A 21 16.744 0.063 4.397 1.00 0.00 C ATOM 323 OE1 GLU A 21 17.957 0.371 4.522 1.00 0.00 O ATOM 324 OE2 GLU A 21 16.171 -0.679 5.216 1.00 0.00 O ATOM 0 H GLU A 21 13.809 1.027 1.716 1.00 0.00 H new ATOM 0 HA GLU A 21 14.485 3.685 2.539 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.038 2.573 4.064 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.459 1.812 4.107 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.209 -0.087 2.898 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.663 0.723 2.351 1.00 0.00 H new ATOM 331 N LYS A 22 16.376 2.224 0.323 1.00 0.00 N ATOM 332 CA LYS A 22 17.536 2.415 -0.559 1.00 0.00 C ATOM 333 C LYS A 22 17.249 3.560 -1.513 1.00 0.00 C ATOM 334 O LYS A 22 18.159 4.312 -1.894 1.00 0.00 O ATOM 335 CB LYS A 22 17.866 1.120 -1.337 1.00 0.00 C ATOM 336 CG LYS A 22 17.003 0.909 -2.575 1.00 0.00 C ATOM 337 CD LYS A 22 17.071 -0.534 -3.095 1.00 0.00 C ATOM 338 CE LYS A 22 18.486 -0.931 -3.491 1.00 0.00 C ATOM 339 NZ LYS A 22 18.541 -2.358 -3.920 1.00 0.00 N ATOM 0 H LYS A 22 15.762 1.455 0.056 1.00 0.00 H new ATOM 0 HA LYS A 22 18.409 2.658 0.047 1.00 0.00 H new ATOM 0 HB2 LYS A 22 18.914 1.144 -1.636 1.00 0.00 H new ATOM 0 HB3 LYS A 22 17.744 0.266 -0.671 1.00 0.00 H new ATOM 0 HG2 LYS A 22 15.968 1.160 -2.341 1.00 0.00 H new ATOM 0 HG3 LYS A 22 17.326 1.591 -3.361 1.00 0.00 H new ATOM 0 HD2 LYS A 22 16.705 -1.214 -2.326 1.00 0.00 H new ATOM 0 HD3 LYS A 22 16.410 -0.641 -3.955 1.00 0.00 H new ATOM 0 HE2 LYS A 22 18.834 -0.290 -4.301 1.00 0.00 H new ATOM 0 HE3 LYS A 22 19.160 -0.774 -2.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 19.368 -2.505 -4.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 18.618 -2.970 -3.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 17.675 -2.596 -4.445 1.00 0.00 H new ATOM 353 N MET A 23 15.985 3.667 -1.899 1.00 0.00 N ATOM 354 CA MET A 23 15.506 4.754 -2.753 1.00 0.00 C ATOM 355 C MET A 23 15.356 6.048 -1.951 1.00 0.00 C ATOM 356 O MET A 23 15.088 7.110 -2.525 1.00 0.00 O ATOM 357 CB MET A 23 14.164 4.366 -3.367 1.00 0.00 C ATOM 358 CG MET A 23 14.262 3.187 -4.335 1.00 0.00 C ATOM 359 SD MET A 23 12.842 2.083 -4.217 1.00 0.00 S ATOM 360 CE MET A 23 11.498 3.218 -4.533 1.00 0.00 C ATOM 0 H MET A 23 15.259 3.003 -1.630 1.00 0.00 H new ATOM 0 HA MET A 23 16.236 4.924 -3.545 1.00 0.00 H new ATOM 0 HB2 MET A 23 13.466 4.115 -2.569 1.00 0.00 H new ATOM 0 HB3 MET A 23 13.750 5.226 -3.893 1.00 0.00 H new ATOM 0 HG2 MET A 23 14.343 3.563 -5.355 1.00 0.00 H new ATOM 0 HG3 MET A 23 15.173 2.626 -4.129 1.00 0.00 H new ATOM 0 HE1 MET A 23 10.950 3.399 -3.608 1.00 0.00 H new ATOM 0 HE2 MET A 23 11.898 4.160 -4.908 1.00 0.00 H new ATOM 0 HE3 MET A 23 10.825 2.788 -5.275 1.00 0.00 H new ATOM 370 N GLY A 24 15.519 5.934 -0.631 1.00 0.00 N ATOM 371 CA GLY A 24 15.444 7.094 0.234 1.00 0.00 C ATOM 372 C GLY A 24 14.027 7.486 0.569 1.00 0.00 C ATOM 373 O GLY A 24 13.780 8.580 1.081 1.00 0.00 O ATOM 0 H GLY A 24 15.702 5.054 -0.149 1.00 0.00 H new ATOM 0 HA2 GLY A 24 15.986 6.888 1.157 1.00 0.00 H new ATOM 0 HA3 GLY A 24 15.943 7.934 -0.249 1.00 0.00 H new ATOM 377 N VAL A 25 13.074 6.597 0.275 1.00 0.00 N ATOM 378 CA VAL A 25 11.670 6.857 0.572 1.00 0.00 C ATOM 379 C VAL A 25 11.255 6.198 1.883 1.00 0.00 C ATOM 380 O VAL A 25 11.467 4.997 2.085 1.00 0.00 O ATOM 381 CB VAL A 25 10.737 6.376 -0.588 1.00 0.00 C ATOM 382 CG1 VAL A 25 11.039 4.957 -1.029 1.00 0.00 C ATOM 383 CG2 VAL A 25 9.260 6.517 -0.209 1.00 0.00 C ATOM 0 H VAL A 25 13.252 5.695 -0.167 1.00 0.00 H new ATOM 0 HA VAL A 25 11.559 7.937 0.672 1.00 0.00 H new ATOM 0 HB VAL A 25 10.942 7.028 -1.437 1.00 0.00 H new ATOM 0 HG11 VAL A 25 10.362 4.675 -1.836 1.00 0.00 H new ATOM 0 HG12 VAL A 25 12.069 4.897 -1.381 1.00 0.00 H new ATOM 0 HG13 VAL A 25 10.903 4.278 -0.187 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.638 6.175 -1.036 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.052 5.914 0.675 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.037 7.563 0.004 1.00 0.00 H new ATOM 393 N THR A 26 10.694 7.003 2.786 1.00 0.00 N ATOM 394 CA THR A 26 10.222 6.501 4.071 1.00 0.00 C ATOM 395 C THR A 26 9.083 5.482 3.882 1.00 0.00 C ATOM 396 O THR A 26 8.194 5.715 3.053 1.00 0.00 O ATOM 397 CB THR A 26 9.730 7.698 4.921 1.00 0.00 C ATOM 398 OG1 THR A 26 10.821 8.600 5.161 1.00 0.00 O ATOM 399 CG2 THR A 26 9.156 7.234 6.245 1.00 0.00 C ATOM 0 H THR A 26 10.557 8.004 2.649 1.00 0.00 H new ATOM 0 HA THR A 26 11.041 5.992 4.579 1.00 0.00 H new ATOM 0 HB THR A 26 8.942 8.207 4.366 1.00 0.00 H new ATOM 0 HG1 THR A 26 10.507 9.358 5.698 1.00 0.00 H new ATOM 0 HG21 THR A 26 8.819 8.098 6.818 1.00 0.00 H new ATOM 0 HG22 THR A 26 8.312 6.568 6.063 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.923 6.702 6.807 1.00 0.00 H new ATOM 407 N PRO A 27 9.096 4.362 4.631 1.00 0.00 N ATOM 408 CA PRO A 27 8.031 3.349 4.542 1.00 0.00 C ATOM 409 C PRO A 27 6.646 3.972 4.704 1.00 0.00 C ATOM 410 O PRO A 27 5.747 3.697 3.925 1.00 0.00 O ATOM 411 CB PRO A 27 8.348 2.382 5.701 1.00 0.00 C ATOM 412 CG PRO A 27 9.367 3.075 6.544 1.00 0.00 C ATOM 413 CD PRO A 27 10.127 3.984 5.619 1.00 0.00 C ATOM 0 HA PRO A 27 8.008 2.853 3.572 1.00 0.00 H new ATOM 0 HB2 PRO A 27 7.451 2.157 6.278 1.00 0.00 H new ATOM 0 HB3 PRO A 27 8.732 1.434 5.325 1.00 0.00 H new ATOM 0 HG2 PRO A 27 8.890 3.643 7.343 1.00 0.00 H new ATOM 0 HG3 PRO A 27 10.034 2.356 7.018 1.00 0.00 H new ATOM 0 HD2 PRO A 27 10.528 4.853 6.141 1.00 0.00 H new ATOM 0 HD3 PRO A 27 10.971 3.476 5.152 1.00 0.00 H new ATOM 421 N SER A 28 6.510 4.818 5.720 1.00 0.00 N ATOM 422 CA SER A 28 5.248 5.500 5.986 1.00 0.00 C ATOM 423 C SER A 28 4.763 6.233 4.745 1.00 0.00 C ATOM 424 O SER A 28 3.549 6.351 4.510 1.00 0.00 O ATOM 425 CB SER A 28 5.442 6.494 7.138 1.00 0.00 C ATOM 426 OG SER A 28 6.115 5.884 8.231 1.00 0.00 O ATOM 0 H SER A 28 7.259 5.048 6.373 1.00 0.00 H new ATOM 0 HA SER A 28 4.497 4.760 6.262 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.014 7.354 6.789 1.00 0.00 H new ATOM 0 HB3 SER A 28 4.473 6.868 7.467 1.00 0.00 H new ATOM 0 HG SER A 28 6.228 6.538 8.952 1.00 0.00 H new ATOM 432 N GLU A 29 5.705 6.720 3.926 1.00 0.00 N ATOM 433 CA GLU A 29 5.372 7.498 2.745 1.00 0.00 C ATOM 434 C GLU A 29 4.945 6.586 1.594 1.00 0.00 C ATOM 435 O GLU A 29 3.975 6.874 0.905 1.00 0.00 O ATOM 436 CB GLU A 29 6.569 8.360 2.328 1.00 0.00 C ATOM 437 CG GLU A 29 6.895 9.458 3.354 1.00 0.00 C ATOM 438 CD GLU A 29 5.707 10.368 3.640 1.00 0.00 C ATOM 439 OE1 GLU A 29 5.311 11.130 2.738 1.00 0.00 O ATOM 440 OE2 GLU A 29 5.174 10.325 4.773 1.00 0.00 O ATOM 0 H GLU A 29 6.706 6.583 4.069 1.00 0.00 H new ATOM 0 HA GLU A 29 4.534 8.151 2.988 1.00 0.00 H new ATOM 0 HB2 GLU A 29 7.442 7.722 2.195 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.361 8.821 1.362 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.224 8.994 4.284 1.00 0.00 H new ATOM 0 HG3 GLU A 29 7.727 10.058 2.985 1.00 0.00 H new ATOM 447 N ALA A 30 5.694 5.496 1.367 1.00 0.00 N ATOM 448 CA ALA A 30 5.362 4.546 0.305 1.00 0.00 C ATOM 449 C ALA A 30 3.959 3.988 0.489 1.00 0.00 C ATOM 450 O ALA A 30 3.219 3.802 -0.496 1.00 0.00 O ATOM 451 CB ALA A 30 6.380 3.421 0.256 1.00 0.00 C ATOM 0 H ALA A 30 6.528 5.255 1.903 1.00 0.00 H new ATOM 0 HA ALA A 30 5.391 5.081 -0.644 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.115 2.725 -0.540 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.370 3.834 0.063 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.387 2.895 1.210 1.00 0.00 H new ATOM 457 N LEU A 31 3.592 3.703 1.732 1.00 0.00 N ATOM 458 CA LEU A 31 2.249 3.213 2.032 1.00 0.00 C ATOM 459 C LEU A 31 1.222 4.330 1.846 1.00 0.00 C ATOM 460 O LEU A 31 0.101 4.099 1.400 1.00 0.00 O ATOM 461 CB LEU A 31 2.165 2.622 3.451 1.00 0.00 C ATOM 462 CG LEU A 31 2.752 1.199 3.633 1.00 0.00 C ATOM 463 CD1 LEU A 31 2.018 0.190 2.738 1.00 0.00 C ATOM 464 CD2 LEU A 31 4.254 1.162 3.398 1.00 0.00 C ATOM 0 H LEU A 31 4.200 3.801 2.545 1.00 0.00 H new ATOM 0 HA LEU A 31 2.022 2.409 1.332 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.681 3.296 4.134 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.118 2.602 3.753 1.00 0.00 H new ATOM 0 HG LEU A 31 2.593 0.911 4.672 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.446 -0.802 2.881 1.00 0.00 H new ATOM 0 HD12 LEU A 31 0.961 0.171 3.002 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.126 0.484 1.694 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.619 0.144 3.537 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.471 1.490 2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.750 1.825 4.107 1.00 0.00 H new ATOM 476 N ARG A 32 1.625 5.567 2.184 1.00 0.00 N ATOM 477 CA ARG A 32 0.762 6.737 2.044 1.00 0.00 C ATOM 478 C ARG A 32 0.334 6.918 0.585 1.00 0.00 C ATOM 479 O ARG A 32 -0.844 7.067 0.304 1.00 0.00 O ATOM 480 CB ARG A 32 1.474 7.997 2.591 1.00 0.00 C ATOM 481 CG ARG A 32 0.591 9.240 2.725 1.00 0.00 C ATOM 482 CD ARG A 32 0.398 9.988 1.413 1.00 0.00 C ATOM 483 NE ARG A 32 -0.377 11.219 1.613 1.00 0.00 N ATOM 484 CZ ARG A 32 -0.379 12.243 0.746 1.00 0.00 C ATOM 485 NH1 ARG A 32 0.260 12.176 -0.409 1.00 0.00 N ATOM 486 NH2 ARG A 32 -1.072 13.349 1.037 1.00 0.00 N ATOM 0 H ARG A 32 2.551 5.776 2.558 1.00 0.00 H new ATOM 0 HA ARG A 32 -0.142 6.583 2.634 1.00 0.00 H new ATOM 0 HB2 ARG A 32 1.893 7.762 3.569 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.311 8.235 1.935 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -0.384 8.944 3.113 1.00 0.00 H new ATOM 0 HG3 ARG A 32 1.034 9.914 3.458 1.00 0.00 H new ATOM 0 HD2 ARG A 32 1.370 10.233 0.984 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.114 9.345 0.697 1.00 0.00 H new ATOM 0 HE ARG A 32 -0.945 11.300 2.457 1.00 0.00 H new ATOM 0 HH11 ARG A 32 0.772 11.330 -0.660 1.00 0.00 H new ATOM 0 HH12 ARG A 32 0.241 12.970 -1.049 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -1.593 13.409 1.912 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -1.080 14.133 0.384 1.00 0.00 H new ATOM 500 N LEU A 33 1.297 6.866 -0.343 1.00 0.00 N ATOM 501 CA LEU A 33 1.004 7.064 -1.760 1.00 0.00 C ATOM 502 C LEU A 33 0.248 5.871 -2.330 1.00 0.00 C ATOM 503 O LEU A 33 -0.446 5.994 -3.337 1.00 0.00 O ATOM 504 CB LEU A 33 2.280 7.364 -2.556 1.00 0.00 C ATOM 505 CG LEU A 33 3.466 6.415 -2.332 1.00 0.00 C ATOM 506 CD1 LEU A 33 3.543 5.367 -3.435 1.00 0.00 C ATOM 507 CD2 LEU A 33 4.730 7.227 -2.229 1.00 0.00 C ATOM 0 H LEU A 33 2.280 6.689 -0.136 1.00 0.00 H new ATOM 0 HA LEU A 33 0.357 7.936 -1.853 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.031 7.354 -3.617 1.00 0.00 H new ATOM 0 HB3 LEU A 33 2.603 8.377 -2.314 1.00 0.00 H new ATOM 0 HG LEU A 33 3.329 5.869 -1.399 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.392 4.708 -3.252 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.624 4.781 -3.445 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.669 5.861 -4.398 1.00 0.00 H new ATOM 0 HD21 LEU A 33 5.578 6.561 -2.070 1.00 0.00 H new ATOM 0 HD22 LEU A 33 4.878 7.789 -3.151 1.00 0.00 H new ATOM 0 HD23 LEU A 33 4.650 7.920 -1.391 1.00 0.00 H new ATOM 519 N MET A 34 0.391 4.734 -1.679 1.00 0.00 N ATOM 520 CA MET A 34 -0.382 3.554 -2.027 1.00 0.00 C ATOM 521 C MET A 34 -1.855 3.798 -1.710 1.00 0.00 C ATOM 522 O MET A 34 -2.727 3.511 -2.525 1.00 0.00 O ATOM 523 CB MET A 34 0.118 2.303 -1.281 1.00 0.00 C ATOM 524 CG MET A 34 -0.862 1.120 -1.321 1.00 0.00 C ATOM 525 SD MET A 34 -2.258 1.329 -0.201 1.00 0.00 S ATOM 526 CE MET A 34 -3.223 -0.123 -0.591 1.00 0.00 C ATOM 0 H MET A 34 1.038 4.600 -0.902 1.00 0.00 H new ATOM 0 HA MET A 34 -0.258 3.371 -3.094 1.00 0.00 H new ATOM 0 HB2 MET A 34 1.068 1.990 -1.714 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.313 2.566 -0.241 1.00 0.00 H new ATOM 0 HG2 MET A 34 -1.234 0.997 -2.338 1.00 0.00 H new ATOM 0 HG3 MET A 34 -0.330 0.205 -1.063 1.00 0.00 H new ATOM 0 HE1 MET A 34 -4.004 -0.253 0.158 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.679 -0.003 -1.574 1.00 0.00 H new ATOM 0 HE3 MET A 34 -2.575 -1.000 -0.596 1.00 0.00 H new ATOM 536 N LEU A 35 -2.099 4.393 -0.535 1.00 0.00 N ATOM 537 CA LEU A 35 -3.460 4.676 -0.099 1.00 0.00 C ATOM 538 C LEU A 35 -4.123 5.651 -1.060 1.00 0.00 C ATOM 539 O LEU A 35 -5.347 5.632 -1.237 1.00 0.00 O ATOM 540 CB LEU A 35 -3.460 5.224 1.344 1.00 0.00 C ATOM 541 CG LEU A 35 -3.000 4.235 2.422 1.00 0.00 C ATOM 542 CD1 LEU A 35 -3.053 4.865 3.810 1.00 0.00 C ATOM 543 CD2 LEU A 35 -3.831 2.948 2.377 1.00 0.00 C ATOM 0 H LEU A 35 -1.374 4.683 0.121 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.035 3.750 -0.103 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -2.815 6.102 1.381 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.468 5.558 1.588 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.962 3.977 2.212 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.721 4.139 4.552 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.400 5.738 3.839 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -4.076 5.169 4.033 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.484 2.264 3.151 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.881 3.187 2.547 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.720 2.477 1.400 1.00 0.00 H new ATOM 555 N GLU A 36 -3.294 6.486 -1.685 1.00 0.00 N ATOM 556 CA GLU A 36 -3.775 7.413 -2.691 1.00 0.00 C ATOM 557 C GLU A 36 -4.290 6.647 -3.933 1.00 0.00 C ATOM 558 O GLU A 36 -5.406 6.916 -4.408 1.00 0.00 O ATOM 559 CB GLU A 36 -2.670 8.379 -3.104 1.00 0.00 C ATOM 560 CG GLU A 36 -1.970 9.065 -1.931 1.00 0.00 C ATOM 561 CD GLU A 36 -1.061 10.209 -2.371 1.00 0.00 C ATOM 562 OE1 GLU A 36 -1.582 11.209 -2.920 1.00 0.00 O ATOM 563 OE2 GLU A 36 0.170 10.126 -2.174 1.00 0.00 O ATOM 0 H GLU A 36 -2.291 6.535 -1.509 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.598 7.982 -2.259 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.928 7.836 -3.689 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.094 9.142 -3.757 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.721 9.449 -1.240 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.381 8.329 -1.385 1.00 0.00 H new ATOM 570 N TYR A 37 -3.506 5.690 -4.456 1.00 0.00 N ATOM 571 CA TYR A 37 -3.883 5.016 -5.699 1.00 0.00 C ATOM 572 C TYR A 37 -5.059 4.071 -5.487 1.00 0.00 C ATOM 573 O TYR A 37 -5.873 3.892 -6.377 1.00 0.00 O ATOM 574 CB TYR A 37 -2.692 4.261 -6.329 1.00 0.00 C ATOM 575 CG TYR A 37 -2.484 2.804 -5.912 1.00 0.00 C ATOM 576 CD1 TYR A 37 -3.348 1.808 -6.366 1.00 0.00 C ATOM 577 CD2 TYR A 37 -1.441 2.424 -5.086 1.00 0.00 C ATOM 578 CE1 TYR A 37 -3.172 0.495 -5.988 1.00 0.00 C ATOM 579 CE2 TYR A 37 -1.258 1.110 -4.711 1.00 0.00 C ATOM 580 CZ TYR A 37 -2.131 0.142 -5.168 1.00 0.00 C ATOM 581 OH TYR A 37 -1.959 -1.171 -4.793 1.00 0.00 O ATOM 0 H TYR A 37 -2.627 5.374 -4.045 1.00 0.00 H new ATOM 0 HA TYR A 37 -4.191 5.795 -6.396 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -2.811 4.288 -7.412 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -1.781 4.812 -6.094 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -4.165 2.069 -7.022 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -0.753 3.175 -4.726 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.858 -0.261 -6.340 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -0.437 0.839 -4.064 1.00 0.00 H new ATOM 0 HH TYR A 37 -1.173 -1.245 -4.212 1.00 0.00 H new ATOM 591 N ILE A 38 -5.175 3.445 -4.319 1.00 0.00 N ATOM 592 CA ILE A 38 -6.307 2.558 -4.056 1.00 0.00 C ATOM 593 C ILE A 38 -7.600 3.388 -3.965 1.00 0.00 C ATOM 594 O ILE A 38 -8.632 2.996 -4.489 1.00 0.00 O ATOM 595 CB ILE A 38 -6.130 1.692 -2.767 1.00 0.00 C ATOM 596 CG1 ILE A 38 -7.452 1.043 -2.318 1.00 0.00 C ATOM 597 CG2 ILE A 38 -5.533 2.522 -1.635 1.00 0.00 C ATOM 598 CD1 ILE A 38 -8.056 0.099 -3.342 1.00 0.00 C ATOM 0 H ILE A 38 -4.511 3.532 -3.550 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.363 1.857 -4.889 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.439 0.887 -3.016 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.280 0.495 -1.391 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -8.173 1.829 -2.094 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.419 1.899 -0.748 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -4.558 2.903 -1.939 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -6.195 3.358 -1.408 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.984 -0.317 -2.951 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -8.263 0.645 -4.263 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.355 -0.710 -3.549 1.00 0.00 H new ATOM 610 N ALA A 39 -7.507 4.543 -3.309 1.00 0.00 N ATOM 611 CA ALA A 39 -8.660 5.430 -3.143 1.00 0.00 C ATOM 612 C ALA A 39 -9.135 6.007 -4.489 1.00 0.00 C ATOM 613 O ALA A 39 -10.335 6.155 -4.724 1.00 0.00 O ATOM 614 CB ALA A 39 -8.293 6.576 -2.192 1.00 0.00 C ATOM 0 H ALA A 39 -6.646 4.888 -2.883 1.00 0.00 H new ATOM 0 HA ALA A 39 -9.477 4.843 -2.725 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.152 7.236 -2.069 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -8.008 6.167 -1.223 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.458 7.141 -2.608 1.00 0.00 H new ATOM 620 N ASP A 40 -8.186 6.323 -5.353 1.00 0.00 N ATOM 621 CA ASP A 40 -8.497 6.927 -6.653 1.00 0.00 C ATOM 622 C ASP A 40 -8.903 5.883 -7.682 1.00 0.00 C ATOM 623 O ASP A 40 -9.823 6.099 -8.480 1.00 0.00 O ATOM 624 CB ASP A 40 -7.279 7.725 -7.174 1.00 0.00 C ATOM 625 CG ASP A 40 -7.504 8.270 -8.568 1.00 0.00 C ATOM 626 OD1 ASP A 40 -8.277 9.237 -8.725 1.00 0.00 O ATOM 627 OD2 ASP A 40 -6.887 7.752 -9.523 1.00 0.00 O ATOM 0 H ASP A 40 -7.191 6.174 -5.185 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.343 7.599 -6.506 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -7.070 8.550 -6.493 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -6.399 7.081 -7.175 1.00 0.00 H new ATOM 632 N ASN A 41 -8.243 4.733 -7.663 1.00 0.00 N ATOM 633 CA ASN A 41 -8.437 3.709 -8.699 1.00 0.00 C ATOM 634 C ASN A 41 -9.561 2.756 -8.326 1.00 0.00 C ATOM 635 O ASN A 41 -10.312 2.310 -9.190 1.00 0.00 O ATOM 636 CB ASN A 41 -7.143 2.894 -8.914 1.00 0.00 C ATOM 637 CG ASN A 41 -5.967 3.690 -9.486 1.00 0.00 C ATOM 638 OD1 ASN A 41 -5.239 3.197 -10.331 1.00 0.00 O ATOM 639 ND2 ASN A 41 -5.742 4.899 -8.991 1.00 0.00 N ATOM 0 H ASN A 41 -7.566 4.479 -6.944 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.699 4.229 -9.620 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -6.841 2.462 -7.960 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -7.361 2.063 -9.585 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -4.943 5.443 -9.316 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -6.368 5.286 -8.285 1.00 0.00 H new ATOM 646 N GLU A 42 -9.674 2.469 -7.023 1.00 0.00 N ATOM 647 CA GLU A 42 -10.698 1.555 -6.503 1.00 0.00 C ATOM 648 C GLU A 42 -10.704 0.231 -7.278 1.00 0.00 C ATOM 649 O GLU A 42 -11.773 -0.264 -7.662 1.00 0.00 O ATOM 650 CB GLU A 42 -12.066 2.234 -6.587 1.00 0.00 C ATOM 651 CG GLU A 42 -12.126 3.596 -5.890 1.00 0.00 C ATOM 652 CD GLU A 42 -13.480 4.273 -6.017 1.00 0.00 C ATOM 653 OE1 GLU A 42 -13.805 4.785 -7.110 1.00 0.00 O ATOM 654 OE2 GLU A 42 -14.238 4.285 -5.018 1.00 0.00 O ATOM 0 H GLU A 42 -9.064 2.860 -6.305 1.00 0.00 H new ATOM 0 HA GLU A 42 -10.470 1.323 -5.463 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.334 2.361 -7.636 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.815 1.577 -6.144 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.889 3.467 -4.834 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -11.360 4.247 -6.312 1.00 0.00 H new ATOM 661 N ARG A 43 -9.529 -0.363 -7.467 1.00 0.00 N ATOM 662 CA ARG A 43 -9.422 -1.609 -8.249 1.00 0.00 C ATOM 663 C ARG A 43 -8.243 -2.487 -7.798 1.00 0.00 C ATOM 664 O ARG A 43 -8.378 -3.707 -7.719 1.00 0.00 O ATOM 665 CB ARG A 43 -9.293 -1.295 -9.734 1.00 0.00 C ATOM 666 CG ARG A 43 -8.108 -0.422 -10.066 1.00 0.00 C ATOM 667 CD ARG A 43 -7.983 -0.144 -11.555 1.00 0.00 C ATOM 668 NE ARG A 43 -6.891 0.794 -11.834 1.00 0.00 N ATOM 669 CZ ARG A 43 -5.915 0.577 -12.698 1.00 0.00 C ATOM 670 NH1 ARG A 43 -5.878 -0.546 -13.414 1.00 0.00 N ATOM 671 NH2 ARG A 43 -4.960 1.479 -12.874 1.00 0.00 N ATOM 0 H ARG A 43 -8.644 -0.014 -7.099 1.00 0.00 H new ATOM 0 HA ARG A 43 -10.338 -2.173 -8.071 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -9.212 -2.230 -10.289 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -10.204 -0.801 -10.073 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -8.197 0.523 -9.530 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -7.196 -0.904 -9.713 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -7.807 -1.079 -12.088 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -8.921 0.265 -11.930 1.00 0.00 H new ATOM 0 HE ARG A 43 -6.884 1.678 -11.324 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -6.608 -1.249 -13.298 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -5.120 -0.703 -14.078 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -4.975 2.348 -12.341 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -4.210 1.304 -13.543 1.00 0.00 H new ATOM 685 N LEU A 44 -7.084 -1.849 -7.504 1.00 0.00 N ATOM 686 CA LEU A 44 -5.846 -2.563 -7.157 1.00 0.00 C ATOM 687 C LEU A 44 -5.271 -3.282 -8.385 1.00 0.00 C ATOM 688 O LEU A 44 -6.021 -3.767 -9.228 1.00 0.00 O ATOM 689 CB LEU A 44 -6.057 -3.580 -6.014 1.00 0.00 C ATOM 690 CG LEU A 44 -6.349 -2.976 -4.629 1.00 0.00 C ATOM 691 CD1 LEU A 44 -6.604 -4.081 -3.603 1.00 0.00 C ATOM 692 CD2 LEU A 44 -5.190 -2.090 -4.185 1.00 0.00 C ATOM 0 H LEU A 44 -6.988 -0.834 -7.502 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.138 -1.811 -6.810 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -6.883 -4.237 -6.285 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -5.166 -4.203 -5.938 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.248 -2.363 -4.700 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.809 -3.634 -2.630 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.461 -4.677 -3.916 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.724 -4.720 -3.531 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -5.409 -1.669 -3.204 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -4.278 -2.685 -4.129 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.053 -1.282 -4.904 1.00 0.00 H new ATOM 812 N MET B 101 4.838 -13.880 11.054 1.00 0.00 N ATOM 813 CA MET B 101 4.553 -12.532 10.509 1.00 0.00 C ATOM 814 C MET B 101 4.623 -11.495 11.631 1.00 0.00 C ATOM 815 O MET B 101 4.585 -11.844 12.815 1.00 0.00 O ATOM 816 CB MET B 101 3.171 -12.496 9.817 1.00 0.00 C ATOM 817 CG MET B 101 1.990 -12.646 10.753 1.00 0.00 C ATOM 818 SD MET B 101 0.407 -12.234 9.950 1.00 0.00 S ATOM 819 CE MET B 101 0.488 -13.245 8.466 1.00 0.00 C ATOM 0 HA MET B 101 5.306 -12.293 9.758 1.00 0.00 H new ATOM 0 HB2 MET B 101 3.074 -11.553 9.279 1.00 0.00 H new ATOM 0 HB3 MET B 101 3.131 -13.292 9.074 1.00 0.00 H new ATOM 0 HG2 MET B 101 1.951 -13.671 11.122 1.00 0.00 H new ATOM 0 HG3 MET B 101 2.133 -12.001 11.620 1.00 0.00 H new ATOM 0 HE1 MET B 101 -0.494 -13.279 7.995 1.00 0.00 H new ATOM 0 HE2 MET B 101 1.209 -12.814 7.771 1.00 0.00 H new ATOM 0 HE3 MET B 101 0.799 -14.256 8.731 1.00 0.00 H new ATOM 829 N GLY B 102 4.735 -10.238 11.247 1.00 0.00 N ATOM 830 CA GLY B 102 4.852 -9.163 12.208 1.00 0.00 C ATOM 831 C GLY B 102 3.977 -7.984 11.865 1.00 0.00 C ATOM 832 O GLY B 102 3.446 -7.898 10.765 1.00 0.00 O ATOM 0 H GLY B 102 4.747 -9.937 10.272 1.00 0.00 H new ATOM 0 HA2 GLY B 102 4.585 -9.534 13.198 1.00 0.00 H new ATOM 0 HA3 GLY B 102 5.891 -8.837 12.259 1.00 0.00 H new ATOM 836 N SER B 103 3.831 -7.086 12.817 1.00 0.00 N ATOM 837 CA SER B 103 3.008 -5.896 12.638 1.00 0.00 C ATOM 838 C SER B 103 3.868 -4.639 12.598 1.00 0.00 C ATOM 839 O SER B 103 4.892 -4.542 13.281 1.00 0.00 O ATOM 840 CB SER B 103 1.971 -5.805 13.766 1.00 0.00 C ATOM 841 OG SER B 103 2.577 -5.973 15.045 1.00 0.00 O ATOM 0 H SER B 103 4.274 -7.154 13.733 1.00 0.00 H new ATOM 0 HA SER B 103 2.487 -5.974 11.684 1.00 0.00 H new ATOM 0 HB2 SER B 103 1.469 -4.838 13.724 1.00 0.00 H new ATOM 0 HB3 SER B 103 1.206 -6.568 13.621 1.00 0.00 H new ATOM 0 HG SER B 103 1.892 -5.908 15.743 1.00 0.00 H new ATOM 847 N ILE B 104 3.440 -3.700 11.760 1.00 0.00 N ATOM 848 CA ILE B 104 4.125 -2.416 11.617 1.00 0.00 C ATOM 849 C ILE B 104 3.136 -1.297 11.855 1.00 0.00 C ATOM 850 O ILE B 104 1.922 -1.512 11.755 1.00 0.00 O ATOM 851 CB ILE B 104 4.773 -2.271 10.202 1.00 0.00 C ATOM 852 CG1 ILE B 104 3.700 -2.106 9.089 1.00 0.00 C ATOM 853 CG2 ILE B 104 5.655 -3.485 9.902 1.00 0.00 C ATOM 854 CD1 ILE B 104 3.453 -0.661 8.684 1.00 0.00 C ATOM 0 H ILE B 104 2.617 -3.804 11.166 1.00 0.00 H new ATOM 0 HA ILE B 104 4.927 -2.365 12.353 1.00 0.00 H new ATOM 0 HB ILE B 104 5.384 -1.369 10.210 1.00 0.00 H new ATOM 0 HG12 ILE B 104 4.011 -2.672 8.211 1.00 0.00 H new ATOM 0 HG13 ILE B 104 2.762 -2.542 9.434 1.00 0.00 H new ATOM 0 HG21 ILE B 104 6.102 -3.375 8.914 1.00 0.00 H new ATOM 0 HG22 ILE B 104 6.444 -3.556 10.651 1.00 0.00 H new ATOM 0 HG23 ILE B 104 5.049 -4.390 9.927 1.00 0.00 H new ATOM 0 HD11 ILE B 104 2.693 -0.627 7.904 1.00 0.00 H new ATOM 0 HD12 ILE B 104 3.111 -0.094 9.550 1.00 0.00 H new ATOM 0 HD13 ILE B 104 4.379 -0.225 8.308 1.00 0.00 H new ATOM 866 N ASN B 105 3.635 -0.099 12.163 1.00 0.00 N ATOM 867 CA ASN B 105 2.789 1.061 12.360 1.00 0.00 C ATOM 868 C ASN B 105 2.911 1.993 11.159 1.00 0.00 C ATOM 869 O ASN B 105 4.017 2.381 10.759 1.00 0.00 O ATOM 870 CB ASN B 105 3.199 1.810 13.641 1.00 0.00 C ATOM 871 CG ASN B 105 2.246 2.944 13.972 1.00 0.00 C ATOM 872 OD1 ASN B 105 1.299 2.783 14.738 1.00 0.00 O ATOM 873 ND2 ASN B 105 2.490 4.107 13.390 1.00 0.00 N ATOM 0 H ASN B 105 4.631 0.086 12.281 1.00 0.00 H new ATOM 0 HA ASN B 105 1.755 0.731 12.462 1.00 0.00 H new ATOM 0 HB2 ASN B 105 3.231 1.109 14.475 1.00 0.00 H new ATOM 0 HB3 ASN B 105 4.207 2.208 13.520 1.00 0.00 H new ATOM 0 HD21 ASN B 105 1.882 4.906 13.572 1.00 0.00 H new ATOM 0 HD22 ASN B 105 3.286 4.205 12.759 1.00 0.00 H new ATOM 880 N LEU B 106 1.767 2.325 10.588 1.00 0.00 N ATOM 881 CA LEU B 106 1.685 3.220 9.435 1.00 0.00 C ATOM 882 C LEU B 106 0.887 4.459 9.891 1.00 0.00 C ATOM 883 O LEU B 106 -0.023 4.311 10.691 1.00 0.00 O ATOM 884 CB LEU B 106 1.007 2.461 8.281 1.00 0.00 C ATOM 885 CG LEU B 106 0.878 3.183 6.922 1.00 0.00 C ATOM 886 CD1 LEU B 106 -0.313 4.146 6.897 1.00 0.00 C ATOM 887 CD2 LEU B 106 2.174 3.925 6.577 1.00 0.00 C ATOM 0 H LEU B 106 0.861 1.983 10.909 1.00 0.00 H new ATOM 0 HA LEU B 106 2.660 3.547 9.074 1.00 0.00 H new ATOM 0 HB2 LEU B 106 1.560 1.536 8.118 1.00 0.00 H new ATOM 0 HB3 LEU B 106 0.006 2.180 8.607 1.00 0.00 H new ATOM 0 HG LEU B 106 0.698 2.419 6.166 1.00 0.00 H new ATOM 0 HD11 LEU B 106 -0.367 4.633 5.923 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -1.234 3.591 7.077 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -0.187 4.901 7.673 1.00 0.00 H new ATOM 0 HD21 LEU B 106 2.061 4.427 5.616 1.00 0.00 H new ATOM 0 HD22 LEU B 106 2.387 4.664 7.349 1.00 0.00 H new ATOM 0 HD23 LEU B 106 2.997 3.213 6.520 1.00 0.00 H new ATOM 899 N ARG B 107 1.237 5.653 9.402 1.00 0.00 N ATOM 900 CA ARG B 107 0.600 6.876 9.886 1.00 0.00 C ATOM 901 C ARG B 107 0.290 7.772 8.685 1.00 0.00 C ATOM 902 O ARG B 107 1.214 8.178 7.970 1.00 0.00 O ATOM 903 CB ARG B 107 1.473 7.632 10.863 1.00 0.00 C ATOM 904 CG ARG B 107 1.785 6.869 12.139 1.00 0.00 C ATOM 905 CD ARG B 107 2.420 7.765 13.191 1.00 0.00 C ATOM 906 NE ARG B 107 3.575 8.499 12.661 1.00 0.00 N ATOM 907 CZ ARG B 107 4.739 8.628 13.279 1.00 0.00 C ATOM 908 NH1 ARG B 107 4.954 8.010 14.425 1.00 0.00 N ATOM 909 NH2 ARG B 107 5.687 9.368 12.744 1.00 0.00 N ATOM 0 H ARG B 107 1.946 5.796 8.683 1.00 0.00 H new ATOM 0 HA ARG B 107 -0.311 6.597 10.415 1.00 0.00 H new ATOM 0 HB2 ARG B 107 2.410 7.892 10.370 1.00 0.00 H new ATOM 0 HB3 ARG B 107 0.980 8.568 11.124 1.00 0.00 H new ATOM 0 HG2 ARG B 107 0.868 6.435 12.537 1.00 0.00 H new ATOM 0 HG3 ARG B 107 2.457 6.041 11.913 1.00 0.00 H new ATOM 0 HD2 ARG B 107 1.678 8.473 13.560 1.00 0.00 H new ATOM 0 HD3 ARG B 107 2.734 7.160 14.042 1.00 0.00 H new ATOM 0 HE ARG B 107 3.474 8.943 11.748 1.00 0.00 H new ATOM 0 HH11 ARG B 107 4.222 7.431 14.837 1.00 0.00 H new ATOM 0 HH12 ARG B 107 5.852 8.111 14.899 1.00 0.00 H new ATOM 0 HH21 ARG B 107 5.524 9.841 11.855 1.00 0.00 H new ATOM 0 HH22 ARG B 107 6.584 9.469 13.218 1.00 0.00 H new ATOM 923 N ILE B 108 -0.970 8.088 8.469 1.00 0.00 N ATOM 924 CA ILE B 108 -1.365 8.977 7.371 1.00 0.00 C ATOM 925 C ILE B 108 -2.482 9.887 7.846 1.00 0.00 C ATOM 926 O ILE B 108 -3.038 9.677 8.931 1.00 0.00 O ATOM 927 CB ILE B 108 -1.856 8.231 6.099 1.00 0.00 C ATOM 928 CG1 ILE B 108 -3.211 7.516 6.330 1.00 0.00 C ATOM 929 CG2 ILE B 108 -0.792 7.252 5.595 1.00 0.00 C ATOM 930 CD1 ILE B 108 -3.189 6.457 7.408 1.00 0.00 C ATOM 0 H ILE B 108 -1.747 7.747 9.035 1.00 0.00 H new ATOM 0 HA ILE B 108 -0.470 9.533 7.093 1.00 0.00 H new ATOM 0 HB ILE B 108 -2.021 8.982 5.327 1.00 0.00 H new ATOM 0 HG12 ILE B 108 -3.961 8.263 6.589 1.00 0.00 H new ATOM 0 HG13 ILE B 108 -3.528 7.056 5.394 1.00 0.00 H new ATOM 0 HG21 ILE B 108 -1.159 6.742 4.704 1.00 0.00 H new ATOM 0 HG22 ILE B 108 0.119 7.799 5.351 1.00 0.00 H new ATOM 0 HG23 ILE B 108 -0.577 6.517 6.371 1.00 0.00 H new ATOM 0 HD11 ILE B 108 -4.179 6.011 7.500 1.00 0.00 H new ATOM 0 HD12 ILE B 108 -2.466 5.685 7.145 1.00 0.00 H new ATOM 0 HD13 ILE B 108 -2.906 6.911 8.358 1.00 0.00 H new ATOM 942 N ASP B 109 -2.817 10.885 7.043 1.00 0.00 N ATOM 943 CA ASP B 109 -3.913 11.772 7.380 1.00 0.00 C ATOM 944 C ASP B 109 -5.218 10.995 7.377 1.00 0.00 C ATOM 945 O ASP B 109 -5.458 10.188 6.483 1.00 0.00 O ATOM 946 CB ASP B 109 -4.009 12.952 6.410 1.00 0.00 C ATOM 947 CG ASP B 109 -4.859 14.087 6.974 1.00 0.00 C ATOM 948 OD1 ASP B 109 -6.089 13.923 7.094 1.00 0.00 O ATOM 949 OD2 ASP B 109 -4.286 15.146 7.319 1.00 0.00 O ATOM 0 H ASP B 109 -2.349 11.098 6.162 1.00 0.00 H new ATOM 0 HA ASP B 109 -3.723 12.176 8.374 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -3.008 13.323 6.190 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -4.437 12.612 5.467 1.00 0.00 H new ATOM 954 N ASP B 110 -6.035 11.234 8.387 1.00 0.00 N ATOM 955 CA ASP B 110 -7.249 10.454 8.596 1.00 0.00 C ATOM 956 C ASP B 110 -8.202 10.556 7.416 1.00 0.00 C ATOM 957 O ASP B 110 -8.873 9.582 7.064 1.00 0.00 O ATOM 958 CB ASP B 110 -7.951 10.891 9.892 1.00 0.00 C ATOM 959 CG ASP B 110 -9.227 10.100 10.161 1.00 0.00 C ATOM 960 OD1 ASP B 110 -9.126 8.920 10.562 1.00 0.00 O ATOM 961 OD2 ASP B 110 -10.330 10.664 9.990 1.00 0.00 O ATOM 0 H ASP B 110 -5.881 11.966 9.081 1.00 0.00 H new ATOM 0 HA ASP B 110 -6.953 9.409 8.686 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -7.267 10.767 10.731 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -8.191 11.952 9.831 1.00 0.00 H new ATOM 966 N GLU B 111 -8.218 11.731 6.769 1.00 0.00 N ATOM 967 CA GLU B 111 -9.139 11.968 5.656 1.00 0.00 C ATOM 968 C GLU B 111 -8.810 11.078 4.472 1.00 0.00 C ATOM 969 O GLU B 111 -9.703 10.607 3.770 1.00 0.00 O ATOM 970 CB GLU B 111 -9.116 13.437 5.196 1.00 0.00 C ATOM 971 CG GLU B 111 -7.839 13.850 4.482 1.00 0.00 C ATOM 972 CD GLU B 111 -7.987 15.159 3.740 1.00 0.00 C ATOM 973 OE1 GLU B 111 -8.572 15.151 2.625 1.00 0.00 O ATOM 974 OE2 GLU B 111 -7.527 16.204 4.238 1.00 0.00 O ATOM 0 H GLU B 111 -7.612 12.519 6.995 1.00 0.00 H new ATOM 0 HA GLU B 111 -10.136 11.730 6.025 1.00 0.00 H new ATOM 0 HB2 GLU B 111 -9.962 13.610 4.531 1.00 0.00 H new ATOM 0 HB3 GLU B 111 -9.256 14.080 6.065 1.00 0.00 H new ATOM 0 HG2 GLU B 111 -7.032 13.938 5.210 1.00 0.00 H new ATOM 0 HG3 GLU B 111 -7.551 13.068 3.779 1.00 0.00 H new ATOM 981 N LEU B 112 -7.524 10.801 4.280 1.00 0.00 N ATOM 982 CA LEU B 112 -7.070 10.011 3.153 1.00 0.00 C ATOM 983 C LEU B 112 -7.346 8.543 3.432 1.00 0.00 C ATOM 984 O LEU B 112 -7.841 7.791 2.580 1.00 0.00 O ATOM 985 CB LEU B 112 -5.583 10.242 2.912 1.00 0.00 C ATOM 986 CG LEU B 112 -4.966 9.442 1.744 1.00 0.00 C ATOM 987 CD1 LEU B 112 -5.650 9.789 0.418 1.00 0.00 C ATOM 988 CD2 LEU B 112 -3.455 9.683 1.661 1.00 0.00 C ATOM 0 H LEU B 112 -6.777 11.117 4.898 1.00 0.00 H new ATOM 0 HA LEU B 112 -7.608 10.312 2.254 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -5.424 11.304 2.726 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -5.042 9.994 3.825 1.00 0.00 H new ATOM 0 HG LEU B 112 -5.131 8.382 1.936 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -5.196 9.212 -0.388 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -6.711 9.550 0.483 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -5.530 10.853 0.214 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -3.040 9.110 0.832 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -3.264 10.744 1.501 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -2.984 9.366 2.592 1.00 0.00 H new ATOM 1000 N LYS B 113 -7.022 8.155 4.664 1.00 0.00 N ATOM 1001 CA LYS B 113 -7.277 6.808 5.160 1.00 0.00 C ATOM 1002 C LYS B 113 -8.733 6.435 4.939 1.00 0.00 C ATOM 1003 O LYS B 113 -9.042 5.297 4.593 1.00 0.00 O ATOM 1004 CB LYS B 113 -6.890 6.730 6.646 1.00 0.00 C ATOM 1005 CG LYS B 113 -7.078 5.334 7.279 1.00 0.00 C ATOM 1006 CD LYS B 113 -8.519 5.078 7.726 1.00 0.00 C ATOM 1007 CE LYS B 113 -9.047 6.189 8.637 1.00 0.00 C ATOM 1008 NZ LYS B 113 -8.193 6.385 9.835 1.00 0.00 N ATOM 0 H LYS B 113 -6.575 8.768 5.346 1.00 0.00 H new ATOM 0 HA LYS B 113 -6.669 6.090 4.610 1.00 0.00 H new ATOM 0 HB2 LYS B 113 -5.847 7.028 6.754 1.00 0.00 H new ATOM 0 HB3 LYS B 113 -7.487 7.452 7.203 1.00 0.00 H new ATOM 0 HG2 LYS B 113 -6.784 4.570 6.559 1.00 0.00 H new ATOM 0 HG3 LYS B 113 -6.413 5.236 8.137 1.00 0.00 H new ATOM 0 HD2 LYS B 113 -9.160 4.994 6.849 1.00 0.00 H new ATOM 0 HD3 LYS B 113 -8.571 4.124 8.251 1.00 0.00 H new ATOM 0 HE2 LYS B 113 -9.102 7.122 8.075 1.00 0.00 H new ATOM 0 HE3 LYS B 113 -10.062 5.947 8.952 1.00 0.00 H new ATOM 0 HZ1 LYS B 113 -8.560 7.180 10.396 1.00 0.00 H new ATOM 0 HZ2 LYS B 113 -8.201 5.520 10.413 1.00 0.00 H new ATOM 0 HZ3 LYS B 113 -7.219 6.592 9.537 1.00 0.00 H new ATOM 1022 N ALA B 114 -9.637 7.384 5.152 1.00 0.00 N ATOM 1023 CA ALA B 114 -11.065 7.143 4.984 1.00 0.00 C ATOM 1024 C ALA B 114 -11.387 6.711 3.553 1.00 0.00 C ATOM 1025 O ALA B 114 -12.078 5.712 3.333 1.00 0.00 O ATOM 1026 CB ALA B 114 -11.847 8.399 5.360 1.00 0.00 C ATOM 0 H ALA B 114 -9.404 8.333 5.443 1.00 0.00 H new ATOM 0 HA ALA B 114 -11.361 6.329 5.646 1.00 0.00 H new ATOM 0 HB1 ALA B 114 -12.914 8.215 5.233 1.00 0.00 H new ATOM 0 HB2 ALA B 114 -11.644 8.656 6.400 1.00 0.00 H new ATOM 0 HB3 ALA B 114 -11.542 9.224 4.716 1.00 0.00 H new ATOM 1032 N ARG B 115 -10.862 7.459 2.580 1.00 0.00 N ATOM 1033 CA ARG B 115 -11.127 7.164 1.170 1.00 0.00 C ATOM 1034 C ARG B 115 -10.541 5.817 0.769 1.00 0.00 C ATOM 1035 O ARG B 115 -11.202 4.984 0.145 1.00 0.00 O ATOM 1036 CB ARG B 115 -10.582 8.271 0.241 1.00 0.00 C ATOM 1037 CG ARG B 115 -11.425 9.539 0.202 1.00 0.00 C ATOM 1038 CD ARG B 115 -11.408 10.287 1.527 1.00 0.00 C ATOM 1039 NE ARG B 115 -12.170 11.540 1.498 1.00 0.00 N ATOM 1040 CZ ARG B 115 -11.649 12.732 1.750 1.00 0.00 C ATOM 1041 NH1 ARG B 115 -10.359 12.871 2.027 1.00 0.00 N ATOM 1042 NH2 ARG B 115 -12.440 13.803 1.772 1.00 0.00 N ATOM 0 H ARG B 115 -10.257 8.265 2.739 1.00 0.00 H new ATOM 0 HA ARG B 115 -12.210 7.124 1.055 1.00 0.00 H new ATOM 0 HB2 ARG B 115 -9.573 8.531 0.561 1.00 0.00 H new ATOM 0 HB3 ARG B 115 -10.503 7.872 -0.770 1.00 0.00 H new ATOM 0 HG2 ARG B 115 -11.055 10.194 -0.587 1.00 0.00 H new ATOM 0 HG3 ARG B 115 -12.453 9.281 -0.054 1.00 0.00 H new ATOM 0 HD2 ARG B 115 -11.814 9.641 2.306 1.00 0.00 H new ATOM 0 HD3 ARG B 115 -10.375 10.505 1.800 1.00 0.00 H new ATOM 0 HE ARG B 115 -13.163 11.491 1.270 1.00 0.00 H new ATOM 0 HH11 ARG B 115 -9.751 12.052 2.048 1.00 0.00 H new ATOM 0 HH12 ARG B 115 -9.975 13.796 2.218 1.00 0.00 H new ATOM 0 HH21 ARG B 115 -13.440 13.702 1.596 1.00 0.00 H new ATOM 0 HH22 ARG B 115 -12.046 14.724 1.965 1.00 0.00 H new ATOM 1056 N SER B 116 -9.275 5.592 1.140 1.00 0.00 N ATOM 1057 CA SER B 116 -8.568 4.370 0.786 1.00 0.00 C ATOM 1058 C SER B 116 -9.291 3.126 1.316 1.00 0.00 C ATOM 1059 O SER B 116 -9.652 2.235 0.546 1.00 0.00 O ATOM 1060 CB SER B 116 -7.141 4.430 1.340 1.00 0.00 C ATOM 1061 OG SER B 116 -7.135 4.720 2.717 1.00 0.00 O ATOM 0 H SER B 116 -8.722 6.250 1.689 1.00 0.00 H new ATOM 0 HA SER B 116 -8.539 4.293 -0.301 1.00 0.00 H new ATOM 0 HB2 SER B 116 -6.641 3.477 1.165 1.00 0.00 H new ATOM 0 HB3 SER B 116 -6.573 5.191 0.804 1.00 0.00 H new ATOM 0 HG SER B 116 -6.210 4.798 3.031 1.00 0.00 H new ATOM 1067 N TYR B 117 -9.497 3.096 2.629 1.00 0.00 N ATOM 1068 CA TYR B 117 -10.171 1.972 3.274 1.00 0.00 C ATOM 1069 C TYR B 117 -11.554 1.760 2.701 1.00 0.00 C ATOM 1070 O TYR B 117 -11.973 0.622 2.496 1.00 0.00 O ATOM 1071 CB TYR B 117 -10.229 2.172 4.781 1.00 0.00 C ATOM 1072 CG TYR B 117 -8.922 1.903 5.492 1.00 0.00 C ATOM 1073 CD1 TYR B 117 -7.737 2.467 5.027 1.00 0.00 C ATOM 1074 CD2 TYR B 117 -8.859 1.102 6.625 1.00 0.00 C ATOM 1075 CE1 TYR B 117 -6.540 2.243 5.686 1.00 0.00 C ATOM 1076 CE2 TYR B 117 -7.662 0.875 7.278 1.00 0.00 C ATOM 1077 CZ TYR B 117 -6.512 1.452 6.808 1.00 0.00 C ATOM 1078 OH TYR B 117 -5.324 1.235 7.469 1.00 0.00 O ATOM 0 H TYR B 117 -9.207 3.836 3.268 1.00 0.00 H new ATOM 0 HA TYR B 117 -9.590 1.072 3.073 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -10.539 3.196 4.989 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -10.996 1.517 5.194 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -7.752 3.086 4.142 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -9.763 0.648 7.003 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -5.629 2.690 5.318 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -7.634 0.245 8.155 1.00 0.00 H new ATOM 0 HH TYR B 117 -5.481 0.654 8.242 1.00 0.00 H new ATOM 1088 N ALA B 118 -12.262 2.851 2.435 1.00 0.00 N ATOM 1089 CA ALA B 118 -13.612 2.789 1.865 1.00 0.00 C ATOM 1090 C ALA B 118 -13.587 2.078 0.509 1.00 0.00 C ATOM 1091 O ALA B 118 -14.468 1.262 0.185 1.00 0.00 O ATOM 1092 CB ALA B 118 -14.204 4.178 1.727 1.00 0.00 C ATOM 0 H ALA B 118 -11.925 3.798 2.605 1.00 0.00 H new ATOM 0 HA ALA B 118 -14.244 2.218 2.545 1.00 0.00 H new ATOM 0 HB1 ALA B 118 -15.205 4.106 1.302 1.00 0.00 H new ATOM 0 HB2 ALA B 118 -14.259 4.649 2.708 1.00 0.00 H new ATOM 0 HB3 ALA B 118 -13.574 4.779 1.071 1.00 0.00 H new ATOM 1098 N ALA B 119 -12.578 2.387 -0.293 1.00 0.00 N ATOM 1099 CA ALA B 119 -12.425 1.788 -1.621 1.00 0.00 C ATOM 1100 C ALA B 119 -12.139 0.277 -1.533 1.00 0.00 C ATOM 1101 O ALA B 119 -12.752 -0.513 -2.253 1.00 0.00 O ATOM 1102 CB ALA B 119 -11.317 2.496 -2.391 1.00 0.00 C ATOM 0 H ALA B 119 -11.846 3.054 -0.049 1.00 0.00 H new ATOM 0 HA ALA B 119 -13.367 1.913 -2.155 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -11.212 2.043 -3.377 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -11.568 3.551 -2.502 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -10.378 2.402 -1.846 1.00 0.00 H new ATOM 1108 N LEU B 120 -11.212 -0.110 -0.686 1.00 0.00 N ATOM 1109 CA LEU B 120 -10.793 -1.516 -0.624 1.00 0.00 C ATOM 1110 C LEU B 120 -11.874 -2.395 0.018 1.00 0.00 C ATOM 1111 O LEU B 120 -12.098 -3.533 -0.430 1.00 0.00 O ATOM 1112 CB LEU B 120 -9.423 -1.645 0.086 1.00 0.00 C ATOM 1113 CG LEU B 120 -9.319 -1.090 1.521 1.00 0.00 C ATOM 1114 CD1 LEU B 120 -9.848 -2.095 2.533 1.00 0.00 C ATOM 1115 CD2 LEU B 120 -7.884 -0.698 1.851 1.00 0.00 C ATOM 0 H LEU B 120 -10.732 0.510 -0.034 1.00 0.00 H new ATOM 0 HA LEU B 120 -10.665 -1.883 -1.642 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -9.154 -2.701 0.112 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -8.676 -1.140 -0.527 1.00 0.00 H new ATOM 0 HG LEU B 120 -9.937 -0.194 1.578 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -9.763 -1.679 3.537 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -10.894 -2.312 2.317 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -9.266 -3.015 2.471 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -7.838 -0.310 2.868 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -7.239 -1.573 1.767 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -7.547 0.069 1.154 1.00 0.00 H new ATOM 1127 N GLU B 121 -12.579 -1.870 1.002 1.00 0.00 N ATOM 1128 CA GLU B 121 -13.613 -2.638 1.701 1.00 0.00 C ATOM 1129 C GLU B 121 -14.839 -2.851 0.814 1.00 0.00 C ATOM 1130 O GLU B 121 -15.592 -3.800 1.007 1.00 0.00 O ATOM 1131 CB GLU B 121 -14.027 -1.953 3.024 1.00 0.00 C ATOM 1132 CG GLU B 121 -14.666 -0.571 2.868 1.00 0.00 C ATOM 1133 CD GLU B 121 -16.172 -0.593 2.972 1.00 0.00 C ATOM 1134 OE1 GLU B 121 -16.697 -0.508 4.103 1.00 0.00 O ATOM 1135 OE2 GLU B 121 -16.851 -0.697 1.934 1.00 0.00 O ATOM 0 H GLU B 121 -12.461 -0.915 1.341 1.00 0.00 H new ATOM 0 HA GLU B 121 -13.184 -3.612 1.938 1.00 0.00 H new ATOM 0 HB2 GLU B 121 -14.728 -2.603 3.548 1.00 0.00 H new ATOM 0 HB3 GLU B 121 -13.145 -1.859 3.658 1.00 0.00 H new ATOM 0 HG2 GLU B 121 -14.266 0.095 3.633 1.00 0.00 H new ATOM 0 HG3 GLU B 121 -14.382 -0.154 1.902 1.00 0.00 H new ATOM 1142 N LYS B 122 -15.017 -1.988 -0.190 1.00 0.00 N ATOM 1143 CA LYS B 122 -16.157 -2.120 -1.097 1.00 0.00 C ATOM 1144 C LYS B 122 -15.839 -3.197 -2.137 1.00 0.00 C ATOM 1145 O LYS B 122 -16.729 -3.934 -2.578 1.00 0.00 O ATOM 1146 CB LYS B 122 -16.458 -0.784 -1.797 1.00 0.00 C ATOM 1147 CG LYS B 122 -15.655 -0.514 -3.061 1.00 0.00 C ATOM 1148 CD LYS B 122 -16.100 0.776 -3.724 1.00 0.00 C ATOM 1149 CE LYS B 122 -15.407 1.012 -5.062 1.00 0.00 C ATOM 1150 NZ LYS B 122 -15.903 2.239 -5.737 1.00 0.00 N ATOM 0 H LYS B 122 -14.397 -1.204 -0.392 1.00 0.00 H new ATOM 0 HA LYS B 122 -17.039 -2.404 -0.523 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -17.518 -0.755 -2.048 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -16.275 0.026 -1.091 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -14.595 -0.454 -2.816 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -15.775 -1.345 -3.757 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -17.179 0.749 -3.877 1.00 0.00 H new ATOM 0 HD3 LYS B 122 -15.893 1.614 -3.058 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -14.332 1.095 -4.904 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -15.568 0.151 -5.711 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -15.563 2.256 -6.720 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -16.943 2.243 -5.730 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -15.550 3.078 -5.234 1.00 0.00 H new ATOM 1164 N MET B 123 -14.567 -3.285 -2.497 1.00 0.00 N ATOM 1165 CA MET B 123 -14.067 -4.311 -3.414 1.00 0.00 C ATOM 1166 C MET B 123 -13.950 -5.646 -2.706 1.00 0.00 C ATOM 1167 O MET B 123 -13.665 -6.678 -3.344 1.00 0.00 O ATOM 1168 CB MET B 123 -12.695 -3.905 -3.984 1.00 0.00 C ATOM 1169 CG MET B 123 -12.690 -2.601 -4.768 1.00 0.00 C ATOM 1170 SD MET B 123 -11.120 -2.305 -5.570 1.00 0.00 S ATOM 1171 CE MET B 123 -9.995 -2.570 -4.208 1.00 0.00 C ATOM 0 H MET B 123 -13.846 -2.646 -2.162 1.00 0.00 H new ATOM 0 HA MET B 123 -14.778 -4.406 -4.235 1.00 0.00 H new ATOM 0 HB2 MET B 123 -11.986 -3.820 -3.161 1.00 0.00 H new ATOM 0 HB3 MET B 123 -12.336 -4.704 -4.633 1.00 0.00 H new ATOM 0 HG2 MET B 123 -13.481 -2.626 -5.518 1.00 0.00 H new ATOM 0 HG3 MET B 123 -12.915 -1.773 -4.095 1.00 0.00 H new ATOM 0 HE1 MET B 123 -9.005 -2.203 -4.477 1.00 0.00 H new ATOM 0 HE2 MET B 123 -10.354 -2.034 -3.330 1.00 0.00 H new ATOM 0 HE3 MET B 123 -9.939 -3.635 -3.985 1.00 0.00 H new ATOM 1181 N GLY B 124 -14.122 -5.620 -1.394 1.00 0.00 N ATOM 1182 CA GLY B 124 -14.078 -6.835 -0.597 1.00 0.00 C ATOM 1183 C GLY B 124 -12.657 -7.258 -0.259 1.00 0.00 C ATOM 1184 O GLY B 124 -12.432 -8.395 0.172 1.00 0.00 O ATOM 0 H GLY B 124 -14.294 -4.769 -0.858 1.00 0.00 H new ATOM 0 HA2 GLY B 124 -14.637 -6.681 0.326 1.00 0.00 H new ATOM 0 HA3 GLY B 124 -14.574 -7.640 -1.140 1.00 0.00 H new ATOM 1188 N VAL B 125 -11.713 -6.351 -0.452 1.00 0.00 N ATOM 1189 CA VAL B 125 -10.298 -6.616 -0.168 1.00 0.00 C ATOM 1190 C VAL B 125 -9.931 -6.068 1.212 1.00 0.00 C ATOM 1191 O VAL B 125 -10.147 -4.890 1.482 1.00 0.00 O ATOM 1192 CB VAL B 125 -9.372 -5.974 -1.229 1.00 0.00 C ATOM 1193 CG1 VAL B 125 -7.921 -6.353 -0.988 1.00 0.00 C ATOM 1194 CG2 VAL B 125 -9.847 -6.328 -2.654 1.00 0.00 C ATOM 0 H VAL B 125 -11.897 -5.413 -0.808 1.00 0.00 H new ATOM 0 HA VAL B 125 -10.155 -7.696 -0.194 1.00 0.00 H new ATOM 0 HB VAL B 125 -9.432 -4.890 -1.133 1.00 0.00 H new ATOM 0 HG11 VAL B 125 -7.293 -5.888 -1.748 1.00 0.00 H new ATOM 0 HG12 VAL B 125 -7.614 -6.007 -0.001 1.00 0.00 H new ATOM 0 HG13 VAL B 125 -7.814 -7.436 -1.042 1.00 0.00 H new ATOM 0 HG21 VAL B 125 -9.182 -5.867 -3.384 1.00 0.00 H new ATOM 0 HG22 VAL B 125 -9.833 -7.410 -2.784 1.00 0.00 H new ATOM 0 HG23 VAL B 125 -10.861 -5.958 -2.802 1.00 0.00 H new ATOM 1204 N THR B 126 -9.374 -6.933 2.060 1.00 0.00 N ATOM 1205 CA THR B 126 -8.935 -6.540 3.380 1.00 0.00 C ATOM 1206 C THR B 126 -7.792 -5.520 3.283 1.00 0.00 C ATOM 1207 O THR B 126 -6.881 -5.666 2.461 1.00 0.00 O ATOM 1208 CB THR B 126 -8.467 -7.793 4.154 1.00 0.00 C ATOM 1209 OG1 THR B 126 -9.547 -8.736 4.230 1.00 0.00 O ATOM 1210 CG2 THR B 126 -8.010 -7.430 5.555 1.00 0.00 C ATOM 0 H THR B 126 -9.219 -7.918 1.844 1.00 0.00 H new ATOM 0 HA THR B 126 -9.765 -6.073 3.911 1.00 0.00 H new ATOM 0 HB THR B 126 -7.623 -8.233 3.622 1.00 0.00 H new ATOM 0 HG1 THR B 126 -9.252 -9.532 4.719 1.00 0.00 H new ATOM 0 HG21 THR B 126 -7.686 -8.331 6.077 1.00 0.00 H new ATOM 0 HG22 THR B 126 -7.180 -6.726 5.496 1.00 0.00 H new ATOM 0 HG23 THR B 126 -8.836 -6.972 6.100 1.00 0.00 H new ATOM 1218 N PRO B 127 -7.814 -4.446 4.119 1.00 0.00 N ATOM 1219 CA PRO B 127 -6.762 -3.430 4.125 1.00 0.00 C ATOM 1220 C PRO B 127 -5.375 -4.053 4.283 1.00 0.00 C ATOM 1221 O PRO B 127 -4.435 -3.714 3.548 1.00 0.00 O ATOM 1222 CB PRO B 127 -7.094 -2.540 5.353 1.00 0.00 C ATOM 1223 CG PRO B 127 -8.152 -3.277 6.105 1.00 0.00 C ATOM 1224 CD PRO B 127 -8.868 -4.148 5.099 1.00 0.00 C ATOM 0 HA PRO B 127 -6.735 -2.873 3.188 1.00 0.00 H new ATOM 0 HB2 PRO B 127 -6.211 -2.380 5.972 1.00 0.00 H new ATOM 0 HB3 PRO B 127 -7.447 -1.557 5.041 1.00 0.00 H new ATOM 0 HG2 PRO B 127 -7.713 -3.882 6.899 1.00 0.00 H new ATOM 0 HG3 PRO B 127 -8.845 -2.583 6.580 1.00 0.00 H new ATOM 0 HD2 PRO B 127 -9.263 -5.055 5.557 1.00 0.00 H new ATOM 0 HD3 PRO B 127 -9.711 -3.629 4.642 1.00 0.00 H new ATOM 1232 N SER B 128 -5.267 -4.981 5.227 1.00 0.00 N ATOM 1233 CA SER B 128 -4.012 -5.687 5.464 1.00 0.00 C ATOM 1234 C SER B 128 -3.491 -6.333 4.191 1.00 0.00 C ATOM 1235 O SER B 128 -2.276 -6.438 3.979 1.00 0.00 O ATOM 1236 CB SER B 128 -4.247 -6.747 6.566 1.00 0.00 C ATOM 1237 OG SER B 128 -4.842 -6.194 7.725 1.00 0.00 O ATOM 0 H SER B 128 -6.032 -5.262 5.840 1.00 0.00 H new ATOM 0 HA SER B 128 -3.253 -4.976 5.790 1.00 0.00 H new ATOM 0 HB2 SER B 128 -4.886 -7.539 6.175 1.00 0.00 H new ATOM 0 HB3 SER B 128 -3.296 -7.207 6.833 1.00 0.00 H new ATOM 0 HG SER B 128 -4.973 -6.899 8.393 1.00 0.00 H new ATOM 1243 N GLU B 129 -4.417 -6.769 3.328 1.00 0.00 N ATOM 1244 CA GLU B 129 -4.055 -7.435 2.100 1.00 0.00 C ATOM 1245 C GLU B 129 -3.614 -6.458 1.023 1.00 0.00 C ATOM 1246 O GLU B 129 -2.619 -6.691 0.351 1.00 0.00 O ATOM 1247 CB GLU B 129 -5.235 -8.288 1.608 1.00 0.00 C ATOM 1248 CG GLU B 129 -5.542 -9.448 2.546 1.00 0.00 C ATOM 1249 CD GLU B 129 -4.437 -10.491 2.560 1.00 0.00 C ATOM 1250 OE1 GLU B 129 -4.414 -11.356 1.658 1.00 0.00 O ATOM 1251 OE2 GLU B 129 -3.568 -10.447 3.474 1.00 0.00 O ATOM 0 H GLU B 129 -5.422 -6.666 3.471 1.00 0.00 H new ATOM 0 HA GLU B 129 -3.201 -8.079 2.309 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -6.120 -7.659 1.511 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -5.010 -8.677 0.615 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -5.689 -9.066 3.556 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -6.478 -9.918 2.244 1.00 0.00 H new ATOM 1258 N ALA B 130 -4.352 -5.359 0.854 1.00 0.00 N ATOM 1259 CA ALA B 130 -3.996 -4.328 -0.133 1.00 0.00 C ATOM 1260 C ALA B 130 -2.593 -3.777 0.114 1.00 0.00 C ATOM 1261 O ALA B 130 -1.840 -3.524 -0.833 1.00 0.00 O ATOM 1262 CB ALA B 130 -5.019 -3.206 -0.124 1.00 0.00 C ATOM 0 H ALA B 130 -5.199 -5.157 1.385 1.00 0.00 H new ATOM 0 HA ALA B 130 -3.999 -4.796 -1.117 1.00 0.00 H new ATOM 0 HB1 ALA B 130 -4.739 -2.453 -0.860 1.00 0.00 H new ATOM 0 HB2 ALA B 130 -6.002 -3.608 -0.371 1.00 0.00 H new ATOM 0 HB3 ALA B 130 -5.052 -2.751 0.866 1.00 0.00 H new ATOM 1268 N LEU B 131 -2.241 -3.613 1.385 1.00 0.00 N ATOM 1269 CA LEU B 131 -0.916 -3.136 1.736 1.00 0.00 C ATOM 1270 C LEU B 131 0.120 -4.229 1.515 1.00 0.00 C ATOM 1271 O LEU B 131 1.257 -3.970 1.130 1.00 0.00 O ATOM 1272 CB LEU B 131 -0.895 -2.646 3.199 1.00 0.00 C ATOM 1273 CG LEU B 131 -1.852 -1.471 3.527 1.00 0.00 C ATOM 1274 CD1 LEU B 131 -1.688 -1.023 4.980 1.00 0.00 C ATOM 1275 CD2 LEU B 131 -1.631 -0.307 2.578 1.00 0.00 C ATOM 0 H LEU B 131 -2.851 -3.802 2.180 1.00 0.00 H new ATOM 0 HA LEU B 131 -0.664 -2.296 1.089 1.00 0.00 H new ATOM 0 HB2 LEU B 131 -1.144 -3.486 3.848 1.00 0.00 H new ATOM 0 HB3 LEU B 131 0.122 -2.342 3.447 1.00 0.00 H new ATOM 0 HG LEU B 131 -2.874 -1.826 3.394 1.00 0.00 H new ATOM 0 HD11 LEU B 131 -2.370 -0.198 5.186 1.00 0.00 H new ATOM 0 HD12 LEU B 131 -1.915 -1.856 5.645 1.00 0.00 H new ATOM 0 HD13 LEU B 131 -0.662 -0.695 5.146 1.00 0.00 H new ATOM 0 HD21 LEU B 131 -2.315 0.503 2.830 1.00 0.00 H new ATOM 0 HD22 LEU B 131 -0.603 0.045 2.667 1.00 0.00 H new ATOM 0 HD23 LEU B 131 -1.816 -0.632 1.554 1.00 0.00 H new ATOM 1287 N ARG B 132 -0.286 -5.484 1.757 1.00 0.00 N ATOM 1288 CA ARG B 132 0.575 -6.647 1.552 1.00 0.00 C ATOM 1289 C ARG B 132 1.031 -6.728 0.101 1.00 0.00 C ATOM 1290 O ARG B 132 2.221 -6.873 -0.171 1.00 0.00 O ATOM 1291 CB ARG B 132 -0.144 -7.942 1.990 1.00 0.00 C ATOM 1292 CG ARG B 132 0.631 -9.239 1.706 1.00 0.00 C ATOM 1293 CD ARG B 132 0.239 -9.868 0.370 1.00 0.00 C ATOM 1294 NE ARG B 132 -1.177 -10.211 0.306 1.00 0.00 N ATOM 1295 CZ ARG B 132 -1.897 -10.268 -0.817 1.00 0.00 C ATOM 1296 NH1 ARG B 132 -1.318 -10.048 -1.987 1.00 0.00 N ATOM 1297 NH2 ARG B 132 -3.183 -10.558 -0.746 1.00 0.00 N ATOM 0 H ARG B 132 -1.218 -5.716 2.099 1.00 0.00 H new ATOM 0 HA ARG B 132 1.463 -6.534 2.174 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -0.347 -7.884 3.059 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -1.108 -7.994 1.485 1.00 0.00 H new ATOM 0 HG2 ARG B 132 1.700 -9.028 1.706 1.00 0.00 H new ATOM 0 HG3 ARG B 132 0.447 -9.953 2.509 1.00 0.00 H new ATOM 0 HD2 ARG B 132 0.478 -9.176 -0.437 1.00 0.00 H new ATOM 0 HD3 ARG B 132 0.834 -10.766 0.207 1.00 0.00 H new ATOM 0 HE ARG B 132 -1.652 -10.423 1.183 1.00 0.00 H new ATOM 0 HH11 ARG B 132 -0.321 -9.835 -2.031 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -1.868 -10.092 -2.845 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -3.616 -10.736 0.160 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -3.743 -10.604 -1.597 1.00 0.00 H new ATOM 1311 N LEU B 133 0.077 -6.619 -0.834 1.00 0.00 N ATOM 1312 CA LEU B 133 0.400 -6.718 -2.258 1.00 0.00 C ATOM 1313 C LEU B 133 1.168 -5.484 -2.729 1.00 0.00 C ATOM 1314 O LEU B 133 1.894 -5.531 -3.731 1.00 0.00 O ATOM 1315 CB LEU B 133 -0.853 -6.952 -3.104 1.00 0.00 C ATOM 1316 CG LEU B 133 -2.017 -5.979 -2.866 1.00 0.00 C ATOM 1317 CD1 LEU B 133 -2.050 -4.852 -3.901 1.00 0.00 C ATOM 1318 CD2 LEU B 133 -3.325 -6.746 -2.842 1.00 0.00 C ATOM 0 H LEU B 133 -0.911 -6.464 -0.631 1.00 0.00 H new ATOM 0 HA LEU B 133 1.045 -7.586 -2.392 1.00 0.00 H new ATOM 0 HB2 LEU B 133 -0.572 -6.901 -4.156 1.00 0.00 H new ATOM 0 HB3 LEU B 133 -1.209 -7.965 -2.918 1.00 0.00 H new ATOM 0 HG LEU B 133 -1.867 -5.501 -1.898 1.00 0.00 H new ATOM 0 HD11 LEU B 133 -2.890 -4.190 -3.691 1.00 0.00 H new ATOM 0 HD12 LEU B 133 -1.120 -4.285 -3.852 1.00 0.00 H new ATOM 0 HD13 LEU B 133 -2.163 -5.277 -4.898 1.00 0.00 H new ATOM 0 HD21 LEU B 133 -4.150 -6.054 -2.673 1.00 0.00 H new ATOM 0 HD22 LEU B 133 -3.467 -7.253 -3.796 1.00 0.00 H new ATOM 0 HD23 LEU B 133 -3.300 -7.483 -2.039 1.00 0.00 H new ATOM 1330 N MET B 134 1.004 -4.376 -2.012 1.00 0.00 N ATOM 1331 CA MET B 134 1.795 -3.178 -2.245 1.00 0.00 C ATOM 1332 C MET B 134 3.266 -3.475 -1.923 1.00 0.00 C ATOM 1333 O MET B 134 4.155 -3.140 -2.692 1.00 0.00 O ATOM 1334 CB MET B 134 1.296 -1.982 -1.422 1.00 0.00 C ATOM 1335 CG MET B 134 2.277 -0.814 -1.330 1.00 0.00 C ATOM 1336 SD MET B 134 3.635 -1.109 -0.175 1.00 0.00 S ATOM 1337 CE MET B 134 4.624 0.361 -0.399 1.00 0.00 C ATOM 0 H MET B 134 0.323 -4.286 -1.258 1.00 0.00 H new ATOM 0 HA MET B 134 1.691 -2.902 -3.294 1.00 0.00 H new ATOM 0 HB2 MET B 134 0.364 -1.622 -1.858 1.00 0.00 H new ATOM 0 HB3 MET B 134 1.065 -2.324 -0.413 1.00 0.00 H new ATOM 0 HG2 MET B 134 2.688 -0.615 -2.320 1.00 0.00 H new ATOM 0 HG3 MET B 134 1.737 0.082 -1.023 1.00 0.00 H new ATOM 0 HE1 MET B 134 5.372 0.420 0.392 1.00 0.00 H new ATOM 0 HE2 MET B 134 5.123 0.320 -1.367 1.00 0.00 H new ATOM 0 HE3 MET B 134 3.982 1.241 -0.358 1.00 0.00 H new ATOM 1347 N LEU B 135 3.482 -4.133 -0.792 1.00 0.00 N ATOM 1348 CA LEU B 135 4.827 -4.438 -0.339 1.00 0.00 C ATOM 1349 C LEU B 135 5.513 -5.352 -1.361 1.00 0.00 C ATOM 1350 O LEU B 135 6.742 -5.326 -1.499 1.00 0.00 O ATOM 1351 CB LEU B 135 4.807 -5.089 1.042 1.00 0.00 C ATOM 1352 CG LEU B 135 4.227 -4.249 2.184 1.00 0.00 C ATOM 1353 CD1 LEU B 135 4.295 -5.002 3.502 1.00 0.00 C ATOM 1354 CD2 LEU B 135 4.966 -2.904 2.289 1.00 0.00 C ATOM 0 H LEU B 135 2.742 -4.465 -0.174 1.00 0.00 H new ATOM 0 HA LEU B 135 5.390 -3.509 -0.254 1.00 0.00 H new ATOM 0 HB2 LEU B 135 4.235 -6.015 0.975 1.00 0.00 H new ATOM 0 HB3 LEU B 135 5.829 -5.363 1.305 1.00 0.00 H new ATOM 0 HG LEU B 135 3.178 -4.052 1.963 1.00 0.00 H new ATOM 0 HD11 LEU B 135 3.877 -4.384 4.296 1.00 0.00 H new ATOM 0 HD12 LEU B 135 3.723 -5.926 3.423 1.00 0.00 H new ATOM 0 HD13 LEU B 135 5.334 -5.237 3.734 1.00 0.00 H new ATOM 0 HD21 LEU B 135 4.542 -2.319 3.105 1.00 0.00 H new ATOM 0 HD22 LEU B 135 6.023 -3.084 2.483 1.00 0.00 H new ATOM 0 HD23 LEU B 135 4.857 -2.355 1.354 1.00 0.00 H new ATOM 1366 N GLU B 136 4.707 -6.142 -2.060 1.00 0.00 N ATOM 1367 CA GLU B 136 5.208 -6.996 -3.117 1.00 0.00 C ATOM 1368 C GLU B 136 5.743 -6.169 -4.288 1.00 0.00 C ATOM 1369 O GLU B 136 6.870 -6.407 -4.762 1.00 0.00 O ATOM 1370 CB GLU B 136 4.103 -7.955 -3.594 1.00 0.00 C ATOM 1371 CG GLU B 136 3.404 -8.702 -2.452 1.00 0.00 C ATOM 1372 CD GLU B 136 2.588 -9.916 -2.920 1.00 0.00 C ATOM 1373 OE1 GLU B 136 3.203 -10.965 -3.204 1.00 0.00 O ATOM 1374 OE2 GLU B 136 1.345 -9.815 -2.999 1.00 0.00 O ATOM 0 H GLU B 136 3.700 -6.205 -1.909 1.00 0.00 H new ATOM 0 HA GLU B 136 6.035 -7.583 -2.717 1.00 0.00 H new ATOM 0 HB2 GLU B 136 3.360 -7.389 -4.155 1.00 0.00 H new ATOM 0 HB3 GLU B 136 4.536 -8.682 -4.281 1.00 0.00 H new ATOM 0 HG2 GLU B 136 4.154 -9.034 -1.734 1.00 0.00 H new ATOM 0 HG3 GLU B 136 2.744 -8.011 -1.928 1.00 0.00 H new ATOM 1381 N TYR B 137 4.976 -5.161 -4.745 1.00 0.00 N ATOM 1382 CA TYR B 137 5.387 -4.395 -5.934 1.00 0.00 C ATOM 1383 C TYR B 137 6.566 -3.466 -5.637 1.00 0.00 C ATOM 1384 O TYR B 137 7.398 -3.242 -6.500 1.00 0.00 O ATOM 1385 CB TYR B 137 4.194 -3.599 -6.531 1.00 0.00 C ATOM 1386 CG TYR B 137 4.103 -2.121 -6.156 1.00 0.00 C ATOM 1387 CD1 TYR B 137 4.864 -1.154 -6.835 1.00 0.00 C ATOM 1388 CD2 TYR B 137 3.268 -1.688 -5.142 1.00 0.00 C ATOM 1389 CE1 TYR B 137 4.772 0.184 -6.492 1.00 0.00 C ATOM 1390 CE2 TYR B 137 3.172 -0.355 -4.804 1.00 0.00 C ATOM 1391 CZ TYR B 137 3.927 0.578 -5.483 1.00 0.00 C ATOM 1392 OH TYR B 137 3.834 1.915 -5.153 1.00 0.00 O ATOM 0 H TYR B 137 4.095 -4.865 -4.324 1.00 0.00 H new ATOM 0 HA TYR B 137 5.720 -5.118 -6.678 1.00 0.00 H new ATOM 0 HB2 TYR B 137 4.245 -3.673 -7.617 1.00 0.00 H new ATOM 0 HB3 TYR B 137 3.270 -4.087 -6.221 1.00 0.00 H new ATOM 0 HD1 TYR B 137 5.527 -1.458 -7.632 1.00 0.00 H new ATOM 0 HD2 TYR B 137 2.676 -2.412 -4.602 1.00 0.00 H new ATOM 0 HE1 TYR B 137 5.365 0.918 -7.018 1.00 0.00 H new ATOM 0 HE2 TYR B 137 2.509 -0.043 -4.011 1.00 0.00 H new ATOM 0 HH TYR B 137 3.193 2.027 -4.421 1.00 0.00 H new ATOM 1402 N ILE B 138 6.640 -2.923 -4.418 1.00 0.00 N ATOM 1403 CA ILE B 138 7.783 -2.073 -4.078 1.00 0.00 C ATOM 1404 C ILE B 138 9.057 -2.913 -4.019 1.00 0.00 C ATOM 1405 O ILE B 138 10.106 -2.497 -4.492 1.00 0.00 O ATOM 1406 CB ILE B 138 7.572 -1.289 -2.739 1.00 0.00 C ATOM 1407 CG1 ILE B 138 8.893 -0.646 -2.252 1.00 0.00 C ATOM 1408 CG2 ILE B 138 6.981 -2.184 -1.659 1.00 0.00 C ATOM 1409 CD1 ILE B 138 9.488 0.362 -3.212 1.00 0.00 C ATOM 0 H ILE B 138 5.951 -3.049 -3.677 1.00 0.00 H new ATOM 0 HA ILE B 138 7.879 -1.324 -4.864 1.00 0.00 H new ATOM 0 HB ILE B 138 6.859 -0.489 -2.940 1.00 0.00 H new ATOM 0 HG12 ILE B 138 8.713 -0.156 -1.295 1.00 0.00 H new ATOM 0 HG13 ILE B 138 9.623 -1.435 -2.074 1.00 0.00 H new ATOM 0 HG21 ILE B 138 6.847 -1.609 -0.743 1.00 0.00 H new ATOM 0 HG22 ILE B 138 6.016 -2.567 -1.991 1.00 0.00 H new ATOM 0 HG23 ILE B 138 7.656 -3.018 -1.468 1.00 0.00 H new ATOM 0 HD11 ILE B 138 10.411 0.763 -2.793 1.00 0.00 H new ATOM 0 HD12 ILE B 138 9.703 -0.125 -4.163 1.00 0.00 H new ATOM 0 HD13 ILE B 138 8.779 1.174 -3.372 1.00 0.00 H new ATOM 1421 N ALA B 139 8.951 -4.107 -3.465 1.00 0.00 N ATOM 1422 CA ALA B 139 10.099 -5.007 -3.327 1.00 0.00 C ATOM 1423 C ALA B 139 10.595 -5.481 -4.687 1.00 0.00 C ATOM 1424 O ALA B 139 11.807 -5.628 -4.904 1.00 0.00 O ATOM 1425 CB ALA B 139 9.708 -6.199 -2.457 1.00 0.00 C ATOM 0 H ALA B 139 8.077 -4.485 -3.098 1.00 0.00 H new ATOM 0 HA ALA B 139 10.914 -4.462 -2.851 1.00 0.00 H new ATOM 0 HB1 ALA B 139 10.561 -6.869 -2.354 1.00 0.00 H new ATOM 0 HB2 ALA B 139 9.402 -5.846 -1.472 1.00 0.00 H new ATOM 0 HB3 ALA B 139 8.881 -6.734 -2.923 1.00 0.00 H new ATOM 1431 N ASP B 140 9.673 -5.733 -5.607 1.00 0.00 N ATOM 1432 CA ASP B 140 10.018 -6.251 -6.924 1.00 0.00 C ATOM 1433 C ASP B 140 10.448 -5.131 -7.880 1.00 0.00 C ATOM 1434 O ASP B 140 11.381 -5.303 -8.661 1.00 0.00 O ATOM 1435 CB ASP B 140 8.824 -7.021 -7.530 1.00 0.00 C ATOM 1436 CG ASP B 140 9.129 -7.626 -8.890 1.00 0.00 C ATOM 1437 OD1 ASP B 140 9.826 -8.662 -8.945 1.00 0.00 O ATOM 1438 OD2 ASP B 140 8.688 -7.079 -9.908 1.00 0.00 O ATOM 0 H ASP B 140 8.674 -5.586 -5.464 1.00 0.00 H new ATOM 0 HA ASP B 140 10.861 -6.930 -6.795 1.00 0.00 H new ATOM 0 HB2 ASP B 140 8.527 -7.815 -6.845 1.00 0.00 H new ATOM 0 HB3 ASP B 140 7.974 -6.345 -7.623 1.00 0.00 H new ATOM 1443 N ASN B 141 9.791 -3.994 -7.784 1.00 0.00 N ATOM 1444 CA ASN B 141 10.002 -2.897 -8.738 1.00 0.00 C ATOM 1445 C ASN B 141 11.142 -1.980 -8.278 1.00 0.00 C ATOM 1446 O ASN B 141 11.900 -1.479 -9.105 1.00 0.00 O ATOM 1447 CB ASN B 141 8.711 -2.076 -8.928 1.00 0.00 C ATOM 1448 CG ASN B 141 7.539 -2.824 -9.532 1.00 0.00 C ATOM 1449 OD1 ASN B 141 7.292 -4.058 -9.099 1.00 0.00 O flip ATOM 1450 ND2 ASN B 141 6.815 -2.285 -10.372 1.00 0.00 N flip ATOM 0 H ASN B 141 9.103 -3.794 -7.058 1.00 0.00 H new ATOM 0 HA ASN B 141 10.277 -3.341 -9.695 1.00 0.00 H new ATOM 0 HB2 ASN B 141 8.406 -1.683 -7.958 1.00 0.00 H new ATOM 0 HB3 ASN B 141 8.937 -1.219 -9.563 1.00 0.00 H new ATOM 0 HD21 ASN B 141 7.021 -1.338 -10.691 1.00 0.00 H new ATOM 0 HD22 ASN B 141 6.010 -2.786 -10.748 1.00 0.00 H new ATOM 1457 N GLU B 142 11.233 -1.761 -6.954 1.00 0.00 N ATOM 1458 CA GLU B 142 12.259 -0.887 -6.370 1.00 0.00 C ATOM 1459 C GLU B 142 12.272 0.494 -7.026 1.00 0.00 C ATOM 1460 O GLU B 142 13.328 1.130 -7.123 1.00 0.00 O ATOM 1461 CB GLU B 142 13.654 -1.527 -6.498 1.00 0.00 C ATOM 1462 CG GLU B 142 13.816 -2.814 -5.692 1.00 0.00 C ATOM 1463 CD GLU B 142 15.220 -3.383 -5.808 1.00 0.00 C ATOM 1464 OE1 GLU B 142 15.506 -4.101 -6.792 1.00 0.00 O ATOM 1465 OE2 GLU B 142 16.063 -3.117 -4.923 1.00 0.00 O ATOM 0 H GLU B 142 10.605 -2.180 -6.269 1.00 0.00 H new ATOM 0 HA GLU B 142 12.009 -0.763 -5.316 1.00 0.00 H new ATOM 0 HB2 GLU B 142 13.851 -1.740 -7.549 1.00 0.00 H new ATOM 0 HB3 GLU B 142 14.405 -0.808 -6.172 1.00 0.00 H new ATOM 0 HG2 GLU B 142 13.590 -2.617 -4.644 1.00 0.00 H new ATOM 0 HG3 GLU B 142 13.095 -3.553 -6.040 1.00 0.00 H new ATOM 1472 N ARG B 143 11.105 0.999 -7.466 1.00 0.00 N ATOM 1473 CA ARG B 143 11.038 2.287 -8.139 1.00 0.00 C ATOM 1474 C ARG B 143 9.836 3.135 -7.689 1.00 0.00 C ATOM 1475 O ARG B 143 9.961 4.350 -7.549 1.00 0.00 O ATOM 1476 CB ARG B 143 10.982 2.106 -9.669 1.00 0.00 C ATOM 1477 CG ARG B 143 9.897 1.141 -10.132 1.00 0.00 C ATOM 1478 CD ARG B 143 9.706 1.186 -11.649 1.00 0.00 C ATOM 1479 NE ARG B 143 9.110 2.454 -12.078 1.00 0.00 N ATOM 1480 CZ ARG B 143 8.183 2.546 -13.039 1.00 0.00 C ATOM 1481 NH1 ARG B 143 7.765 1.454 -13.677 1.00 0.00 N ATOM 1482 NH2 ARG B 143 7.671 3.726 -13.327 1.00 0.00 N ATOM 0 H ARG B 143 10.206 0.529 -7.363 1.00 0.00 H new ATOM 0 HA ARG B 143 11.947 2.819 -7.859 1.00 0.00 H new ATOM 0 HB2 ARG B 143 10.815 3.077 -10.135 1.00 0.00 H new ATOM 0 HB3 ARG B 143 11.950 1.746 -10.019 1.00 0.00 H new ATOM 0 HG2 ARG B 143 10.159 0.127 -9.829 1.00 0.00 H new ATOM 0 HG3 ARG B 143 8.956 1.388 -9.640 1.00 0.00 H new ATOM 0 HD2 ARG B 143 10.669 1.050 -12.142 1.00 0.00 H new ATOM 0 HD3 ARG B 143 9.068 0.359 -11.961 1.00 0.00 H new ATOM 0 HE ARG B 143 9.418 3.312 -11.620 1.00 0.00 H new ATOM 0 HH11 ARG B 143 8.152 0.542 -13.434 1.00 0.00 H new ATOM 0 HH12 ARG B 143 7.058 1.530 -14.409 1.00 0.00 H new ATOM 0 HH21 ARG B 143 7.982 4.554 -12.820 1.00 0.00 H new ATOM 0 HH22 ARG B 143 6.964 3.811 -14.057 1.00 0.00 H new ATOM 1496 N LEU B 144 8.683 2.490 -7.460 1.00 0.00 N ATOM 1497 CA LEU B 144 7.458 3.200 -7.065 1.00 0.00 C ATOM 1498 C LEU B 144 6.971 4.109 -8.199 1.00 0.00 C ATOM 1499 O LEU B 144 7.712 4.410 -9.126 1.00 0.00 O ATOM 1500 CB LEU B 144 7.684 4.056 -5.793 1.00 0.00 C ATOM 1501 CG LEU B 144 7.904 3.300 -4.485 1.00 0.00 C ATOM 1502 CD1 LEU B 144 8.133 4.258 -3.328 1.00 0.00 C ATOM 1503 CD2 LEU B 144 6.721 2.387 -4.185 1.00 0.00 C ATOM 0 H LEU B 144 8.573 1.479 -7.541 1.00 0.00 H new ATOM 0 HA LEU B 144 6.703 2.444 -6.851 1.00 0.00 H new ATOM 0 HB2 LEU B 144 8.549 4.697 -5.964 1.00 0.00 H new ATOM 0 HB3 LEU B 144 6.822 4.711 -5.666 1.00 0.00 H new ATOM 0 HG LEU B 144 8.798 2.688 -4.603 1.00 0.00 H new ATOM 0 HD11 LEU B 144 8.287 3.690 -2.410 1.00 0.00 H new ATOM 0 HD12 LEU B 144 9.014 4.868 -3.529 1.00 0.00 H new ATOM 0 HD13 LEU B 144 7.263 4.905 -3.213 1.00 0.00 H new ATOM 0 HD21 LEU B 144 6.898 1.858 -3.249 1.00 0.00 H new ATOM 0 HD22 LEU B 144 5.813 2.984 -4.098 1.00 0.00 H new ATOM 0 HD23 LEU B 144 6.604 1.665 -4.993 1.00 0.00 H new