USER MOD reduce.3.24.130724 H: found=0, std=0, add=713, rem=0, adj=23 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 167:sc= -0.0579 (180deg=-0.464) USER MOD Single : A 1 MET N :NH3+ -109:sc= 0.122 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -3.25! C(o=-3.3!,f=-6.3!) USER MOD Single : A 13 LYS NZ :NH3+ 166:sc= -0.0481 (180deg=-0.301) USER MOD Single : A 16 SER OG : rot 90:sc= -0.263 USER MOD Single : A 17 TYR OH : rot 30:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 MET CE :methyl -169:sc= -3.01! (180deg=-3.33) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 34 MET CE :methyl 157:sc= -0.309 (180deg=-0.668) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN :FLIP amide:sc= -0.146 F(o=-2.3!,f=-0.15) USER MOD Single : B 101 MET CE :methyl -164:sc= -0.201 (180deg=-0.787) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 105 ASN : amide:sc= -3.72! C(o=-3.7!,f=-5.5!) USER MOD Single : B 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 116 SER OG : rot 100:sc= -0.347 USER MOD Single : B 117 TYR OH : rot 30:sc= 0 USER MOD Single : B 122 LYS NZ :NH3+ -134:sc= -0.571 (180deg=-2.3!) USER MOD Single : B 123 MET CE :methyl -178:sc= -0.969 (180deg=-1.02) 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 155:sc= -0.352 (180deg=-0.737) USER MOD Single : B 137 TYR OH : rot 180:sc= 0 USER MOD Single : B 141 ASN :FLIP amide:sc= -0.112 F(o=-2.4!,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.013 13.529 11.690 1.00 0.00 N ATOM 2 CA MET A 1 -2.812 12.179 11.118 1.00 0.00 C ATOM 3 C MET A 1 -2.768 11.143 12.227 1.00 0.00 C ATOM 4 O MET A 1 -2.589 11.489 13.405 1.00 0.00 O ATOM 5 CB MET A 1 -1.504 12.122 10.313 1.00 0.00 C ATOM 6 CG MET A 1 -0.222 12.295 11.127 1.00 0.00 C ATOM 7 SD MET A 1 1.236 11.775 10.208 1.00 0.00 S ATOM 8 CE MET A 1 1.028 12.688 8.674 1.00 0.00 C ATOM 0 H1 MET A 1 -3.972 13.862 11.465 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.893 13.490 12.722 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.315 14.185 11.285 1.00 0.00 H new ATOM 0 HA MET A 1 -3.647 11.963 10.452 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.458 11.164 9.795 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.535 12.897 9.547 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.114 13.340 11.416 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.296 11.716 12.047 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.955 12.654 8.102 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.224 12.240 8.090 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.779 13.725 8.899 1.00 0.00 H new ATOM 18 N GLY A 2 -2.929 9.871 11.867 1.00 0.00 N ATOM 19 CA GLY A 2 -2.947 8.806 12.840 1.00 0.00 C ATOM 20 C GLY A 2 -2.175 7.574 12.385 1.00 0.00 C ATOM 21 O GLY A 2 -1.672 7.541 11.265 1.00 0.00 O ATOM 0 H GLY A 2 -3.048 9.563 10.902 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -2.523 9.169 13.776 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -3.980 8.526 13.045 1.00 0.00 H new ATOM 25 N SER A 3 -2.120 6.583 13.250 1.00 0.00 N ATOM 26 CA SER A 3 -1.366 5.367 13.006 1.00 0.00 C ATOM 27 C SER A 3 -2.298 4.149 12.987 1.00 0.00 C ATOM 28 O SER A 3 -3.268 4.089 13.757 1.00 0.00 O ATOM 29 CB SER A 3 -0.279 5.199 14.062 1.00 0.00 C ATOM 30 OG SER A 3 -0.760 5.447 15.380 1.00 0.00 O ATOM 0 H SER A 3 -2.600 6.597 14.150 1.00 0.00 H new ATOM 0 HA SER A 3 -0.889 5.444 12.029 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.122 4.187 14.009 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.544 5.880 13.844 1.00 0.00 H new ATOM 0 HG SER A 3 -0.030 5.326 16.023 1.00 0.00 H new ATOM 36 N ILE A 4 -1.996 3.207 12.104 1.00 0.00 N ATOM 37 CA ILE A 4 -2.780 1.983 11.948 1.00 0.00 C ATOM 38 C ILE A 4 -1.863 0.786 11.951 1.00 0.00 C ATOM 39 O ILE A 4 -0.638 0.924 11.792 1.00 0.00 O ATOM 40 CB ILE A 4 -3.605 2.027 10.619 1.00 0.00 C ATOM 41 CG1 ILE A 4 -2.697 1.958 9.369 1.00 0.00 C ATOM 42 CG2 ILE A 4 -4.474 3.284 10.573 1.00 0.00 C ATOM 43 CD1 ILE A 4 -2.494 0.562 8.834 1.00 0.00 C ATOM 0 H ILE A 4 -1.198 3.268 11.472 1.00 0.00 H new ATOM 0 HA ILE A 4 -3.476 1.902 12.783 1.00 0.00 H new ATOM 0 HB ILE A 4 -4.247 1.146 10.606 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -3.130 2.578 8.584 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -1.725 2.387 9.614 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -5.042 3.300 9.643 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.162 3.282 11.418 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.838 4.168 10.625 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -1.846 0.599 7.958 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -2.031 -0.058 9.602 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.458 0.136 8.555 1.00 0.00 H new ATOM 55 N ASN A 5 -2.416 -0.415 12.137 1.00 0.00 N ATOM 56 CA ASN A 5 -1.623 -1.623 12.183 1.00 0.00 C ATOM 57 C ASN A 5 -1.707 -2.365 10.847 1.00 0.00 C ATOM 58 O ASN A 5 -2.797 -2.569 10.304 1.00 0.00 O ATOM 59 CB ASN A 5 -2.114 -2.546 13.302 1.00 0.00 C ATOM 60 CG ASN A 5 -1.230 -3.753 13.479 1.00 0.00 C ATOM 61 OD1 ASN A 5 -0.267 -3.721 14.239 1.00 0.00 O ATOM 62 ND2 ASN A 5 -1.558 -4.843 12.798 1.00 0.00 N ATOM 0 H ASN A 5 -3.417 -0.566 12.258 1.00 0.00 H new ATOM 0 HA ASN A 5 -0.588 -1.341 12.378 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -2.155 -1.988 14.238 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -3.130 -2.872 13.081 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -1.002 -5.693 12.897 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -2.366 -4.832 12.175 1.00 0.00 H new ATOM 69 N LEU A 6 -0.555 -2.739 10.348 1.00 0.00 N ATOM 70 CA LEU A 6 -0.419 -3.505 9.114 1.00 0.00 C ATOM 71 C LEU A 6 0.150 -4.871 9.509 1.00 0.00 C ATOM 72 O LEU A 6 0.855 -4.951 10.512 1.00 0.00 O ATOM 73 CB LEU A 6 0.513 -2.717 8.178 1.00 0.00 C ATOM 74 CG LEU A 6 0.732 -3.259 6.759 1.00 0.00 C ATOM 75 CD1 LEU A 6 1.877 -4.253 6.725 1.00 0.00 C ATOM 76 CD2 LEU A 6 -0.552 -3.889 6.207 1.00 0.00 C ATOM 0 H LEU A 6 0.338 -2.520 10.790 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.360 -3.660 8.587 1.00 0.00 H new ATOM 0 HB2 LEU A 6 0.121 -1.703 8.092 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.487 -2.642 8.661 1.00 0.00 H new ATOM 0 HG LEU A 6 0.998 -2.417 6.119 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.010 -4.621 5.707 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.793 -3.764 7.056 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.652 -5.090 7.387 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -0.369 -4.265 5.200 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -0.860 -4.712 6.852 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.341 -3.138 6.176 1.00 0.00 H new ATOM 88 N ARG A 7 -0.161 -5.942 8.782 1.00 0.00 N ATOM 89 CA ARG A 7 0.347 -7.277 9.137 1.00 0.00 C ATOM 90 C ARG A 7 0.801 -7.976 7.875 1.00 0.00 C ATOM 91 O ARG A 7 -0.006 -8.157 6.955 1.00 0.00 O ATOM 92 CB ARG A 7 -0.721 -8.115 9.854 1.00 0.00 C ATOM 93 CG ARG A 7 -1.207 -7.518 11.170 1.00 0.00 C ATOM 94 CD ARG A 7 -1.855 -8.567 12.072 1.00 0.00 C ATOM 95 NE ARG A 7 -2.462 -7.971 13.275 1.00 0.00 N ATOM 96 CZ ARG A 7 -2.658 -8.615 14.411 1.00 0.00 C ATOM 97 NH1 ARG A 7 -2.361 -9.898 14.547 1.00 0.00 N ATOM 98 NH2 ARG A 7 -3.191 -7.957 15.436 1.00 0.00 N ATOM 0 H ARG A 7 -0.754 -5.919 7.953 1.00 0.00 H new ATOM 0 HA ARG A 7 1.185 -7.163 9.825 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -1.575 -8.241 9.188 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -0.318 -9.109 10.046 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -0.367 -7.061 11.692 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -1.925 -6.724 10.964 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -2.619 -9.104 11.510 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -1.105 -9.299 12.371 1.00 0.00 H new ATOM 0 HE ARG A 7 -2.751 -6.994 13.227 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -1.969 -10.417 13.761 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -2.524 -10.368 15.438 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -3.440 -6.973 15.336 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -3.351 -8.436 16.322 1.00 0.00 H new ATOM 112 N ILE A 8 2.065 -8.375 7.816 1.00 0.00 N ATOM 113 CA ILE A 8 2.618 -9.051 6.620 1.00 0.00 C ATOM 114 C ILE A 8 3.658 -10.060 7.039 1.00 0.00 C ATOM 115 O ILE A 8 4.065 -10.117 8.208 1.00 0.00 O ATOM 116 CB ILE A 8 3.273 -8.084 5.602 1.00 0.00 C ATOM 117 CG1 ILE A 8 4.558 -7.414 6.167 1.00 0.00 C ATOM 118 CG2 ILE A 8 2.288 -7.050 5.084 1.00 0.00 C ATOM 119 CD1 ILE A 8 4.377 -6.650 7.469 1.00 0.00 C ATOM 0 H ILE A 8 2.736 -8.249 8.574 1.00 0.00 H new ATOM 0 HA ILE A 8 1.769 -9.524 6.128 1.00 0.00 H new ATOM 0 HB ILE A 8 3.580 -8.694 4.752 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.312 -8.186 6.320 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.951 -6.729 5.415 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.790 -6.393 4.373 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.458 -7.554 4.589 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.908 -6.460 5.918 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.332 -6.223 7.776 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.651 -5.850 7.324 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.018 -7.329 8.242 1.00 0.00 H new ATOM 131 N ASP A 9 4.106 -10.849 6.085 1.00 0.00 N ATOM 132 CA ASP A 9 5.171 -11.799 6.328 1.00 0.00 C ATOM 133 C ASP A 9 6.452 -11.038 6.655 1.00 0.00 C ATOM 134 O ASP A 9 6.822 -10.077 5.961 1.00 0.00 O ATOM 135 CB ASP A 9 5.387 -12.708 5.107 1.00 0.00 C ATOM 136 CG ASP A 9 6.140 -13.976 5.467 1.00 0.00 C ATOM 137 OD1 ASP A 9 7.159 -13.899 6.182 1.00 0.00 O ATOM 138 OD2 ASP A 9 5.682 -15.070 5.074 1.00 0.00 O ATOM 0 H ASP A 9 3.747 -10.851 5.130 1.00 0.00 H new ATOM 0 HA ASP A 9 4.896 -12.434 7.170 1.00 0.00 H new ATOM 0 HB2 ASP A 9 4.421 -12.970 4.675 1.00 0.00 H new ATOM 0 HB3 ASP A 9 5.940 -12.163 4.343 1.00 0.00 H new ATOM 143 N ASP A 10 7.154 -11.464 7.710 1.00 0.00 N ATOM 144 CA ASP A 10 8.349 -10.773 8.171 1.00 0.00 C ATOM 145 C ASP A 10 9.419 -10.786 7.084 1.00 0.00 C ATOM 146 O ASP A 10 10.213 -9.845 6.960 1.00 0.00 O ATOM 147 CB ASP A 10 8.875 -11.401 9.460 1.00 0.00 C ATOM 148 CG ASP A 10 9.945 -10.570 10.148 1.00 0.00 C ATOM 149 OD1 ASP A 10 11.145 -10.730 9.832 1.00 0.00 O ATOM 150 OD2 ASP A 10 9.595 -9.744 11.018 1.00 0.00 O ATOM 0 H ASP A 10 6.909 -12.288 8.259 1.00 0.00 H new ATOM 0 HA ASP A 10 8.089 -9.737 8.386 1.00 0.00 H new ATOM 0 HB2 ASP A 10 8.043 -11.549 10.148 1.00 0.00 H new ATOM 0 HB3 ASP A 10 9.281 -12.387 9.235 1.00 0.00 H new ATOM 155 N GLU A 11 9.419 -11.851 6.280 1.00 0.00 N ATOM 156 CA GLU A 11 10.386 -11.993 5.205 1.00 0.00 C ATOM 157 C GLU A 11 10.103 -11.004 4.076 1.00 0.00 C ATOM 158 O GLU A 11 11.024 -10.535 3.418 1.00 0.00 O ATOM 159 CB GLU A 11 10.401 -13.409 4.647 1.00 0.00 C ATOM 160 CG GLU A 11 9.177 -13.753 3.786 1.00 0.00 C ATOM 161 CD GLU A 11 9.328 -15.069 3.061 1.00 0.00 C ATOM 162 OE1 GLU A 11 9.346 -16.126 3.726 1.00 0.00 O ATOM 163 OE2 GLU A 11 9.445 -15.065 1.821 1.00 0.00 O ATOM 0 H GLU A 11 8.758 -12.624 6.358 1.00 0.00 H new ATOM 0 HA GLU A 11 11.366 -11.777 5.631 1.00 0.00 H new ATOM 0 HB2 GLU A 11 11.302 -13.544 4.049 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.460 -14.115 5.476 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.291 -13.791 4.420 1.00 0.00 H new ATOM 0 HG3 GLU A 11 9.014 -12.958 3.058 1.00 0.00 H new ATOM 170 N LEU A 12 8.828 -10.685 3.878 1.00 0.00 N ATOM 171 CA LEU A 12 8.429 -9.833 2.753 1.00 0.00 C ATOM 172 C LEU A 12 8.704 -8.358 3.075 1.00 0.00 C ATOM 173 O LEU A 12 9.219 -7.623 2.230 1.00 0.00 O ATOM 174 CB LEU A 12 6.921 -10.023 2.486 1.00 0.00 C ATOM 175 CG LEU A 12 6.374 -9.217 1.293 1.00 0.00 C ATOM 176 CD1 LEU A 12 6.968 -9.698 -0.015 1.00 0.00 C ATOM 177 CD2 LEU A 12 4.846 -9.305 1.247 1.00 0.00 C ATOM 0 H LEU A 12 8.059 -10.997 4.471 1.00 0.00 H new ATOM 0 HA LEU A 12 9.005 -10.115 1.872 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.727 -11.081 2.312 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.368 -9.741 3.382 1.00 0.00 H new ATOM 0 HG LEU A 12 6.665 -8.176 1.431 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.562 -9.109 -0.837 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.052 -9.583 0.013 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.719 -10.749 -0.163 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.474 -8.731 0.399 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.545 -10.347 1.140 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.430 -8.900 2.170 1.00 0.00 H new ATOM 189 N LYS A 13 8.362 -7.956 4.283 1.00 0.00 N ATOM 190 CA LYS A 13 8.593 -6.585 4.735 1.00 0.00 C ATOM 191 C LYS A 13 10.063 -6.254 4.603 1.00 0.00 C ATOM 192 O LYS A 13 10.412 -5.179 4.136 1.00 0.00 O ATOM 193 CB LYS A 13 8.131 -6.395 6.179 1.00 0.00 C ATOM 194 CG LYS A 13 9.132 -6.863 7.222 1.00 0.00 C ATOM 195 CD LYS A 13 8.668 -6.535 8.614 1.00 0.00 C ATOM 196 CE LYS A 13 9.692 -6.883 9.676 1.00 0.00 C ATOM 197 NZ LYS A 13 10.968 -6.170 9.475 1.00 0.00 N ATOM 0 H LYS A 13 7.920 -8.558 4.978 1.00 0.00 H new ATOM 0 HA LYS A 13 8.011 -5.908 4.110 1.00 0.00 H new ATOM 0 HB2 LYS A 13 7.919 -5.339 6.344 1.00 0.00 H new ATOM 0 HB3 LYS A 13 7.195 -6.935 6.323 1.00 0.00 H new ATOM 0 HG2 LYS A 13 9.279 -7.939 7.130 1.00 0.00 H new ATOM 0 HG3 LYS A 13 10.098 -6.392 7.038 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.438 -5.471 8.673 1.00 0.00 H new ATOM 0 HD3 LYS A 13 7.743 -7.073 8.819 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.291 -6.637 10.659 1.00 0.00 H new ATOM 0 HE3 LYS A 13 9.873 -7.958 9.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 11.548 -6.247 10.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 11.479 -6.592 8.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 10.778 -5.167 9.274 1.00 0.00 H new ATOM 211 N ALA A 14 10.907 -7.163 5.061 1.00 0.00 N ATOM 212 CA ALA A 14 12.357 -7.054 4.899 1.00 0.00 C ATOM 213 C ALA A 14 12.740 -6.587 3.485 1.00 0.00 C ATOM 214 O ALA A 14 13.473 -5.599 3.329 1.00 0.00 O ATOM 215 CB ALA A 14 13.029 -8.392 5.203 1.00 0.00 C ATOM 0 H ALA A 14 10.610 -8.003 5.558 1.00 0.00 H new ATOM 0 HA ALA A 14 12.708 -6.303 5.607 1.00 0.00 H new ATOM 0 HB1 ALA A 14 14.107 -8.294 5.078 1.00 0.00 H new ATOM 0 HB2 ALA A 14 12.808 -8.685 6.229 1.00 0.00 H new ATOM 0 HB3 ALA A 14 12.652 -9.152 4.519 1.00 0.00 H new ATOM 221 N ARG A 15 12.251 -7.302 2.457 1.00 0.00 N ATOM 222 CA ARG A 15 12.585 -6.988 1.059 1.00 0.00 C ATOM 223 C ARG A 15 12.078 -5.622 0.640 1.00 0.00 C ATOM 224 O ARG A 15 12.838 -4.789 0.107 1.00 0.00 O ATOM 225 CB ARG A 15 12.014 -8.057 0.107 1.00 0.00 C ATOM 226 CG ARG A 15 12.849 -9.323 -0.047 1.00 0.00 C ATOM 227 CD ARG A 15 12.894 -10.135 1.239 1.00 0.00 C ATOM 228 NE ARG A 15 13.685 -11.354 1.112 1.00 0.00 N ATOM 229 CZ ARG A 15 13.256 -12.586 1.431 1.00 0.00 C ATOM 230 NH1 ARG A 15 12.009 -12.781 1.822 1.00 0.00 N ATOM 231 NH2 ARG A 15 14.097 -13.613 1.357 1.00 0.00 N ATOM 0 H ARG A 15 11.625 -8.099 2.569 1.00 0.00 H new ATOM 0 HA ARG A 15 13.673 -6.981 0.993 1.00 0.00 H new ATOM 0 HB2 ARG A 15 11.023 -8.339 0.461 1.00 0.00 H new ATOM 0 HB3 ARG A 15 11.885 -7.608 -0.878 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.435 -9.935 -0.848 1.00 0.00 H new ATOM 0 HG3 ARG A 15 13.863 -9.055 -0.342 1.00 0.00 H new ATOM 0 HD2 ARG A 15 13.309 -9.520 2.037 1.00 0.00 H new ATOM 0 HD3 ARG A 15 11.878 -10.396 1.534 1.00 0.00 H new ATOM 0 HE ARG A 15 14.636 -11.264 0.754 1.00 0.00 H new ATOM 0 HH11 ARG A 15 11.365 -11.993 1.883 1.00 0.00 H new ATOM 0 HH12 ARG A 15 11.691 -13.720 2.063 1.00 0.00 H new ATOM 0 HH21 ARG A 15 15.061 -13.462 1.060 1.00 0.00 H new ATOM 0 HH22 ARG A 15 13.778 -14.552 1.598 1.00 0.00 H new ATOM 245 N SER A 16 10.792 -5.358 0.867 1.00 0.00 N ATOM 246 CA SER A 16 10.166 -4.102 0.465 1.00 0.00 C ATOM 247 C SER A 16 10.892 -2.908 1.068 1.00 0.00 C ATOM 248 O SER A 16 11.322 -1.991 0.363 1.00 0.00 O ATOM 249 CB SER A 16 8.690 -4.110 0.868 1.00 0.00 C ATOM 250 OG SER A 16 8.536 -4.550 2.203 1.00 0.00 O ATOM 0 H SER A 16 10.158 -6.007 1.333 1.00 0.00 H new ATOM 0 HA SER A 16 10.234 -4.008 -0.619 1.00 0.00 H new ATOM 0 HB2 SER A 16 8.274 -3.108 0.760 1.00 0.00 H new ATOM 0 HB3 SER A 16 8.129 -4.762 0.198 1.00 0.00 H new ATOM 0 HG SER A 16 8.578 -3.780 2.808 1.00 0.00 H new ATOM 256 N TYR A 17 11.009 -2.950 2.393 1.00 0.00 N ATOM 257 CA TYR A 17 11.710 -1.917 3.153 1.00 0.00 C ATOM 258 C TYR A 17 13.115 -1.696 2.617 1.00 0.00 C ATOM 259 O TYR A 17 13.523 -0.566 2.386 1.00 0.00 O ATOM 260 CB TYR A 17 11.775 -2.292 4.634 1.00 0.00 C ATOM 261 CG TYR A 17 10.418 -2.324 5.318 1.00 0.00 C ATOM 262 CD1 TYR A 17 9.279 -1.853 4.679 1.00 0.00 C ATOM 263 CD2 TYR A 17 10.282 -2.820 6.603 1.00 0.00 C ATOM 264 CE1 TYR A 17 8.044 -1.871 5.306 1.00 0.00 C ATOM 265 CE2 TYR A 17 9.052 -2.850 7.234 1.00 0.00 C ATOM 266 CZ TYR A 17 7.941 -2.366 6.585 1.00 0.00 C ATOM 267 OH TYR A 17 6.714 -2.393 7.214 1.00 0.00 O ATOM 0 H TYR A 17 10.622 -3.698 2.969 1.00 0.00 H new ATOM 0 HA TYR A 17 11.149 -0.989 3.043 1.00 0.00 H new ATOM 0 HB2 TYR A 17 12.244 -3.271 4.731 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.416 -1.579 5.152 1.00 0.00 H new ATOM 0 HD1 TYR A 17 9.357 -1.465 3.674 1.00 0.00 H new ATOM 0 HD2 TYR A 17 11.153 -3.191 7.123 1.00 0.00 H new ATOM 0 HE1 TYR A 17 7.169 -1.499 4.794 1.00 0.00 H new ATOM 0 HE2 TYR A 17 8.964 -3.252 8.233 1.00 0.00 H new ATOM 0 HH TYR A 17 6.006 -2.498 6.545 1.00 0.00 H new ATOM 277 N ALA A 18 13.822 -2.794 2.379 1.00 0.00 N ATOM 278 CA ALA A 18 15.207 -2.737 1.915 1.00 0.00 C ATOM 279 C ALA A 18 15.309 -1.959 0.600 1.00 0.00 C ATOM 280 O ALA A 18 16.236 -1.159 0.416 1.00 0.00 O ATOM 281 CB ALA A 18 15.777 -4.146 1.753 1.00 0.00 C ATOM 0 H ALA A 18 13.459 -3.740 2.500 1.00 0.00 H new ATOM 0 HA ALA A 18 15.797 -2.212 2.666 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.809 -4.084 1.407 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.747 -4.663 2.712 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.183 -4.697 1.024 1.00 0.00 H new ATOM 287 N ALA A 19 14.360 -2.214 -0.283 1.00 0.00 N ATOM 288 CA ALA A 19 14.347 -1.557 -1.602 1.00 0.00 C ATOM 289 C ALA A 19 14.089 -0.043 -1.490 1.00 0.00 C ATOM 290 O ALA A 19 14.816 0.762 -2.066 1.00 0.00 O ATOM 291 CB ALA A 19 13.291 -2.215 -2.484 1.00 0.00 C ATOM 0 H ALA A 19 13.590 -2.863 -0.124 1.00 0.00 H new ATOM 0 HA ALA A 19 15.332 -1.680 -2.053 1.00 0.00 H new ATOM 0 HB1 ALA A 19 13.279 -1.731 -3.460 1.00 0.00 H new ATOM 0 HB2 ALA A 19 13.526 -3.272 -2.606 1.00 0.00 H new ATOM 0 HB3 ALA A 19 12.312 -2.113 -2.017 1.00 0.00 H new ATOM 297 N LEU A 20 13.076 0.320 -0.716 1.00 0.00 N ATOM 298 CA LEU A 20 12.611 1.700 -0.651 1.00 0.00 C ATOM 299 C LEU A 20 13.561 2.584 0.144 1.00 0.00 C ATOM 300 O LEU A 20 13.781 3.733 -0.219 1.00 0.00 O ATOM 301 CB LEU A 20 11.159 1.777 -0.116 1.00 0.00 C ATOM 302 CG LEU A 20 10.885 1.092 1.237 1.00 0.00 C ATOM 303 CD1 LEU A 20 11.276 1.990 2.401 1.00 0.00 C ATOM 304 CD2 LEU A 20 9.403 0.681 1.346 1.00 0.00 C ATOM 0 H LEU A 20 12.557 -0.326 -0.121 1.00 0.00 H new ATOM 0 HA LEU A 20 12.603 2.091 -1.669 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.884 2.828 -0.028 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.497 1.336 -0.861 1.00 0.00 H new ATOM 0 HG LEU A 20 11.500 0.194 1.286 1.00 0.00 H new ATOM 0 HD11 LEU A 20 11.070 1.478 3.341 1.00 0.00 H new ATOM 0 HD12 LEU A 20 12.339 2.223 2.340 1.00 0.00 H new ATOM 0 HD13 LEU A 20 10.699 2.914 2.358 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.229 0.199 2.308 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.773 1.567 1.265 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.158 -0.014 0.543 1.00 0.00 H new ATOM 316 N GLU A 21 14.150 2.048 1.215 1.00 0.00 N ATOM 317 CA GLU A 21 15.066 2.818 2.044 1.00 0.00 C ATOM 318 C GLU A 21 16.295 3.185 1.224 1.00 0.00 C ATOM 319 O GLU A 21 16.854 4.274 1.338 1.00 0.00 O ATOM 320 CB GLU A 21 15.482 2.038 3.300 1.00 0.00 C ATOM 321 CG GLU A 21 16.144 0.699 3.003 1.00 0.00 C ATOM 322 CD GLU A 21 16.688 0.000 4.242 1.00 0.00 C ATOM 323 OE1 GLU A 21 15.876 -0.521 5.043 1.00 0.00 O ATOM 324 OE2 GLU A 21 17.914 -0.035 4.401 1.00 0.00 O ATOM 0 H GLU A 21 14.007 1.087 1.524 1.00 0.00 H new ATOM 0 HA GLU A 21 14.556 3.723 2.374 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.169 2.650 3.885 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.601 1.867 3.918 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.420 0.046 2.516 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.959 0.855 2.297 1.00 0.00 H new ATOM 331 N LYS A 22 16.713 2.223 0.410 1.00 0.00 N ATOM 332 CA LYS A 22 17.782 2.411 -0.568 1.00 0.00 C ATOM 333 C LYS A 22 17.443 3.551 -1.516 1.00 0.00 C ATOM 334 O LYS A 22 18.303 4.383 -1.826 1.00 0.00 O ATOM 335 CB LYS A 22 17.957 1.073 -1.314 1.00 0.00 C ATOM 336 CG LYS A 22 18.899 1.132 -2.509 1.00 0.00 C ATOM 337 CD LYS A 22 18.974 -0.250 -3.145 1.00 0.00 C ATOM 338 CE LYS A 22 19.832 -0.259 -4.387 1.00 0.00 C ATOM 339 NZ LYS A 22 19.991 -1.635 -4.941 1.00 0.00 N ATOM 0 H LYS A 22 16.318 1.283 0.409 1.00 0.00 H new ATOM 0 HA LYS A 22 18.718 2.686 -0.081 1.00 0.00 H new ATOM 0 HB2 LYS A 22 18.328 0.326 -0.612 1.00 0.00 H new ATOM 0 HB3 LYS A 22 16.980 0.732 -1.655 1.00 0.00 H new ATOM 0 HG2 LYS A 22 18.542 1.862 -3.235 1.00 0.00 H new ATOM 0 HG3 LYS A 22 19.890 1.456 -2.192 1.00 0.00 H new ATOM 0 HD2 LYS A 22 19.376 -0.960 -2.422 1.00 0.00 H new ATOM 0 HD3 LYS A 22 17.969 -0.587 -3.397 1.00 0.00 H new ATOM 0 HE2 LYS A 22 19.385 0.387 -5.142 1.00 0.00 H new ATOM 0 HE3 LYS A 22 20.813 0.155 -4.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 20.586 -1.600 -5.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 20.441 -2.246 -4.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 19.057 -2.020 -5.187 1.00 0.00 H new ATOM 353 N MET A 23 16.176 3.604 -1.943 1.00 0.00 N ATOM 354 CA MET A 23 15.695 4.685 -2.803 1.00 0.00 C ATOM 355 C MET A 23 15.526 5.980 -2.001 1.00 0.00 C ATOM 356 O MET A 23 15.162 7.024 -2.563 1.00 0.00 O ATOM 357 CB MET A 23 14.355 4.305 -3.457 1.00 0.00 C ATOM 358 CG MET A 23 14.427 3.144 -4.426 1.00 0.00 C ATOM 359 SD MET A 23 12.933 2.980 -5.417 1.00 0.00 S ATOM 360 CE MET A 23 11.666 2.987 -4.159 1.00 0.00 C ATOM 0 H MET A 23 15.467 2.910 -1.706 1.00 0.00 H new ATOM 0 HA MET A 23 16.438 4.846 -3.584 1.00 0.00 H new ATOM 0 HB2 MET A 23 13.640 4.060 -2.671 1.00 0.00 H new ATOM 0 HB3 MET A 23 13.964 5.176 -3.984 1.00 0.00 H new ATOM 0 HG2 MET A 23 15.284 3.278 -5.086 1.00 0.00 H new ATOM 0 HG3 MET A 23 14.594 2.221 -3.871 1.00 0.00 H new ATOM 0 HE1 MET A 23 10.712 2.699 -4.601 1.00 0.00 H new ATOM 0 HE2 MET A 23 11.930 2.280 -3.373 1.00 0.00 H new ATOM 0 HE3 MET A 23 11.581 3.987 -3.734 1.00 0.00 H new ATOM 370 N GLY A 24 15.813 5.901 -0.698 1.00 0.00 N ATOM 371 CA GLY A 24 15.732 7.069 0.166 1.00 0.00 C ATOM 372 C GLY A 24 14.321 7.357 0.638 1.00 0.00 C ATOM 373 O GLY A 24 14.030 8.449 1.133 1.00 0.00 O ATOM 0 H GLY A 24 16.101 5.044 -0.226 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.376 6.919 1.033 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.115 7.938 -0.369 1.00 0.00 H new ATOM 377 N VAL A 25 13.456 6.362 0.492 1.00 0.00 N ATOM 378 CA VAL A 25 12.039 6.487 0.882 1.00 0.00 C ATOM 379 C VAL A 25 11.793 5.785 2.223 1.00 0.00 C ATOM 380 O VAL A 25 12.490 4.842 2.584 1.00 0.00 O ATOM 381 CB VAL A 25 11.125 5.854 -0.208 1.00 0.00 C ATOM 382 CG1 VAL A 25 9.651 6.121 0.106 1.00 0.00 C ATOM 383 CG2 VAL A 25 11.491 6.399 -1.592 1.00 0.00 C ATOM 0 H VAL A 25 13.703 5.451 0.105 1.00 0.00 H new ATOM 0 HA VAL A 25 11.801 7.546 0.982 1.00 0.00 H new ATOM 0 HB VAL A 25 11.283 4.775 -0.210 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.027 5.671 -0.666 1.00 0.00 H new ATOM 0 HG12 VAL A 25 9.401 5.686 1.074 1.00 0.00 H new ATOM 0 HG13 VAL A 25 9.474 7.196 0.135 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.844 5.947 -2.344 1.00 0.00 H new ATOM 0 HG22 VAL A 25 11.360 7.481 -1.603 1.00 0.00 H new ATOM 0 HG23 VAL A 25 12.530 6.157 -1.815 1.00 0.00 H new ATOM 393 N THR A 26 10.802 6.281 2.968 1.00 0.00 N ATOM 394 CA THR A 26 10.389 5.673 4.231 1.00 0.00 C ATOM 395 C THR A 26 9.164 4.764 3.990 1.00 0.00 C ATOM 396 O THR A 26 8.265 5.142 3.224 1.00 0.00 O ATOM 397 CB THR A 26 10.049 6.778 5.260 1.00 0.00 C ATOM 398 OG1 THR A 26 11.250 7.410 5.703 1.00 0.00 O ATOM 399 CG2 THR A 26 9.276 6.247 6.445 1.00 0.00 C ATOM 0 H THR A 26 10.267 7.111 2.713 1.00 0.00 H new ATOM 0 HA THR A 26 11.204 5.068 4.628 1.00 0.00 H new ATOM 0 HB THR A 26 9.408 7.504 4.759 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.031 8.110 6.353 1.00 0.00 H new ATOM 0 HG21 THR A 26 9.063 7.063 7.136 1.00 0.00 H new ATOM 0 HG22 THR A 26 8.339 5.809 6.101 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.867 5.486 6.954 1.00 0.00 H new ATOM 407 N PRO A 27 9.107 3.569 4.613 1.00 0.00 N ATOM 408 CA PRO A 27 7.984 2.639 4.439 1.00 0.00 C ATOM 409 C PRO A 27 6.636 3.304 4.681 1.00 0.00 C ATOM 410 O PRO A 27 5.699 3.137 3.894 1.00 0.00 O ATOM 411 CB PRO A 27 8.255 1.531 5.478 1.00 0.00 C ATOM 412 CG PRO A 27 9.333 2.052 6.372 1.00 0.00 C ATOM 413 CD PRO A 27 10.114 3.029 5.537 1.00 0.00 C ATOM 0 HA PRO A 27 7.925 2.261 3.418 1.00 0.00 H new ATOM 0 HB2 PRO A 27 7.354 1.302 6.047 1.00 0.00 H new ATOM 0 HB3 PRO A 27 8.567 0.608 4.990 1.00 0.00 H new ATOM 0 HG2 PRO A 27 8.912 2.538 7.252 1.00 0.00 H new ATOM 0 HG3 PRO A 27 9.971 1.244 6.729 1.00 0.00 H new ATOM 0 HD2 PRO A 27 10.560 3.813 6.148 1.00 0.00 H new ATOM 0 HD3 PRO A 27 10.928 2.540 5.003 1.00 0.00 H new ATOM 421 N SER A 28 6.546 4.084 5.760 1.00 0.00 N ATOM 422 CA SER A 28 5.318 4.787 6.122 1.00 0.00 C ATOM 423 C SER A 28 4.849 5.684 4.980 1.00 0.00 C ATOM 424 O SER A 28 3.648 5.883 4.772 1.00 0.00 O ATOM 425 CB SER A 28 5.554 5.608 7.393 1.00 0.00 C ATOM 426 OG SER A 28 6.073 4.797 8.442 1.00 0.00 O ATOM 0 H SER A 28 7.320 4.245 6.404 1.00 0.00 H new ATOM 0 HA SER A 28 4.534 4.054 6.312 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.249 6.420 7.180 1.00 0.00 H new ATOM 0 HB3 SER A 28 4.618 6.065 7.713 1.00 0.00 H new ATOM 0 HG SER A 28 6.216 5.347 9.241 1.00 0.00 H new ATOM 432 N GLU A 29 5.816 6.211 4.220 1.00 0.00 N ATOM 433 CA GLU A 29 5.511 7.132 3.127 1.00 0.00 C ATOM 434 C GLU A 29 5.049 6.353 1.892 1.00 0.00 C ATOM 435 O GLU A 29 4.040 6.676 1.288 1.00 0.00 O ATOM 436 CB GLU A 29 6.747 7.974 2.785 1.00 0.00 C ATOM 437 CG GLU A 29 7.292 8.757 3.977 1.00 0.00 C ATOM 438 CD GLU A 29 6.219 9.532 4.729 1.00 0.00 C ATOM 439 OE1 GLU A 29 5.899 10.657 4.309 1.00 0.00 O ATOM 440 OE2 GLU A 29 5.715 9.016 5.752 1.00 0.00 O ATOM 0 H GLU A 29 6.809 6.015 4.343 1.00 0.00 H new ATOM 0 HA GLU A 29 4.708 7.797 3.444 1.00 0.00 H new ATOM 0 HB2 GLU A 29 7.529 7.319 2.401 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.494 8.671 1.986 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.780 8.066 4.664 1.00 0.00 H new ATOM 0 HG3 GLU A 29 8.055 9.452 3.628 1.00 0.00 H new ATOM 447 N ALA A 30 5.802 5.304 1.549 1.00 0.00 N ATOM 448 CA ALA A 30 5.456 4.459 0.413 1.00 0.00 C ATOM 449 C ALA A 30 4.056 3.869 0.564 1.00 0.00 C ATOM 450 O ALA A 30 3.318 3.719 -0.412 1.00 0.00 O ATOM 451 CB ALA A 30 6.477 3.340 0.219 1.00 0.00 C ATOM 0 H ALA A 30 6.650 5.024 2.042 1.00 0.00 H new ATOM 0 HA ALA A 30 5.469 5.095 -0.472 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.189 2.729 -0.636 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.461 3.773 0.041 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.510 2.719 1.114 1.00 0.00 H new ATOM 457 N LEU A 31 3.708 3.516 1.790 1.00 0.00 N ATOM 458 CA LEU A 31 2.378 3.010 2.097 1.00 0.00 C ATOM 459 C LEU A 31 1.345 4.142 2.017 1.00 0.00 C ATOM 460 O LEU A 31 0.208 3.934 1.606 1.00 0.00 O ATOM 461 CB LEU A 31 2.356 2.354 3.486 1.00 0.00 C ATOM 462 CG LEU A 31 3.225 1.093 3.617 1.00 0.00 C ATOM 463 CD1 LEU A 31 3.258 0.557 5.055 1.00 0.00 C ATOM 464 CD2 LEU A 31 2.756 -0.012 2.666 1.00 0.00 C ATOM 0 H LEU A 31 4.332 3.571 2.595 1.00 0.00 H new ATOM 0 HA LEU A 31 2.118 2.252 1.359 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.688 3.085 4.223 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.326 2.096 3.734 1.00 0.00 H new ATOM 0 HG LEU A 31 4.237 1.391 3.343 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.884 -0.334 5.097 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.667 1.319 5.718 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.246 0.305 5.373 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.392 -0.889 2.785 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.725 -0.278 2.898 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.817 0.343 1.637 1.00 0.00 H new ATOM 476 N ARG A 32 1.773 5.344 2.390 1.00 0.00 N ATOM 477 CA ARG A 32 0.900 6.535 2.350 1.00 0.00 C ATOM 478 C ARG A 32 0.457 6.811 0.912 1.00 0.00 C ATOM 479 O ARG A 32 -0.737 7.052 0.670 1.00 0.00 O ATOM 480 CB ARG A 32 1.652 7.739 2.953 1.00 0.00 C ATOM 481 CG ARG A 32 0.773 8.907 3.372 1.00 0.00 C ATOM 482 CD ARG A 32 0.447 9.865 2.217 1.00 0.00 C ATOM 483 NE ARG A 32 -0.272 11.057 2.695 1.00 0.00 N ATOM 484 CZ ARG A 32 -0.706 12.045 1.903 1.00 0.00 C ATOM 485 NH1 ARG A 32 -0.527 11.968 0.587 1.00 0.00 N ATOM 486 NH2 ARG A 32 -1.316 13.098 2.427 1.00 0.00 N ATOM 0 H ARG A 32 2.718 5.530 2.725 1.00 0.00 H new ATOM 0 HA ARG A 32 0.003 6.359 2.944 1.00 0.00 H new ATOM 0 HB2 ARG A 32 2.214 7.398 3.822 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.379 8.095 2.223 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -0.157 8.522 3.789 1.00 0.00 H new ATOM 0 HG3 ARG A 32 1.272 9.462 4.166 1.00 0.00 H new ATOM 0 HD2 ARG A 32 1.370 10.169 1.723 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.158 9.347 1.473 1.00 0.00 H new ATOM 0 HE ARG A 32 -0.451 11.135 3.696 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -0.059 11.157 0.183 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -0.857 12.720 -0.017 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -1.456 13.157 3.436 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -1.646 13.850 1.822 1.00 0.00 H new ATOM 500 N LEU A 33 1.403 6.769 -0.032 1.00 0.00 N ATOM 501 CA LEU A 33 1.075 7.023 -1.432 1.00 0.00 C ATOM 502 C LEU A 33 0.284 5.861 -2.027 1.00 0.00 C ATOM 503 O LEU A 33 -0.445 6.035 -3.000 1.00 0.00 O ATOM 504 CB LEU A 33 2.336 7.307 -2.259 1.00 0.00 C ATOM 505 CG LEU A 33 3.486 6.300 -2.120 1.00 0.00 C ATOM 506 CD1 LEU A 33 3.361 5.139 -3.115 1.00 0.00 C ATOM 507 CD2 LEU A 33 4.800 7.033 -2.283 1.00 0.00 C ATOM 0 H LEU A 33 2.386 6.565 0.147 1.00 0.00 H new ATOM 0 HA LEU A 33 0.448 7.914 -1.468 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.051 7.357 -3.310 1.00 0.00 H new ATOM 0 HB3 LEU A 33 2.710 8.293 -1.983 1.00 0.00 H new ATOM 0 HG LEU A 33 3.442 5.851 -1.128 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.196 4.452 -2.980 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.424 4.610 -2.941 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.373 5.529 -4.133 1.00 0.00 H new ATOM 0 HD21 LEU A 33 5.625 6.327 -2.186 1.00 0.00 H new ATOM 0 HD22 LEU A 33 4.836 7.501 -3.267 1.00 0.00 H new ATOM 0 HD23 LEU A 33 4.887 7.800 -1.513 1.00 0.00 H new ATOM 519 N MET A 34 0.441 4.681 -1.428 1.00 0.00 N ATOM 520 CA MET A 34 -0.325 3.516 -1.843 1.00 0.00 C ATOM 521 C MET A 34 -1.809 3.734 -1.569 1.00 0.00 C ATOM 522 O MET A 34 -2.659 3.463 -2.427 1.00 0.00 O ATOM 523 CB MET A 34 0.166 2.237 -1.151 1.00 0.00 C ATOM 524 CG MET A 34 -0.805 1.058 -1.256 1.00 0.00 C ATOM 525 SD MET A 34 -2.244 1.226 -0.190 1.00 0.00 S ATOM 526 CE MET A 34 -3.197 -0.201 -0.704 1.00 0.00 C ATOM 0 H MET A 34 1.089 4.511 -0.659 1.00 0.00 H new ATOM 0 HA MET A 34 -0.177 3.387 -2.915 1.00 0.00 H new ATOM 0 HB2 MET A 34 1.122 1.946 -1.585 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.346 2.453 -0.098 1.00 0.00 H new ATOM 0 HG2 MET A 34 -1.136 0.960 -2.290 1.00 0.00 H new ATOM 0 HG3 MET A 34 -0.278 0.138 -1.002 1.00 0.00 H new ATOM 0 HE1 MET A 34 -3.885 -0.485 0.092 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.763 0.044 -1.603 1.00 0.00 H new ATOM 0 HE3 MET A 34 -2.523 -1.032 -0.914 1.00 0.00 H new ATOM 536 N LEU A 35 -2.103 4.259 -0.373 1.00 0.00 N ATOM 537 CA LEU A 35 -3.478 4.501 0.018 1.00 0.00 C ATOM 538 C LEU A 35 -4.124 5.514 -0.930 1.00 0.00 C ATOM 539 O LEU A 35 -5.332 5.514 -1.142 1.00 0.00 O ATOM 540 CB LEU A 35 -3.544 5.001 1.474 1.00 0.00 C ATOM 541 CG LEU A 35 -3.090 3.998 2.546 1.00 0.00 C ATOM 542 CD1 LEU A 35 -3.286 4.569 3.947 1.00 0.00 C ATOM 543 CD2 LEU A 35 -3.841 2.681 2.397 1.00 0.00 C ATOM 0 H LEU A 35 -1.408 4.519 0.327 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.031 3.564 -0.046 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -2.930 5.898 1.559 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.571 5.296 1.691 1.00 0.00 H new ATOM 0 HG LEU A 35 -2.026 3.809 2.403 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.957 3.839 4.687 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.700 5.482 4.053 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -4.341 4.794 4.104 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.507 1.983 3.164 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.911 2.858 2.508 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.644 2.259 1.412 1.00 0.00 H new ATOM 555 N GLU A 36 -3.282 6.349 -1.533 1.00 0.00 N ATOM 556 CA GLU A 36 -3.744 7.326 -2.500 1.00 0.00 C ATOM 557 C GLU A 36 -4.191 6.640 -3.790 1.00 0.00 C ATOM 558 O GLU A 36 -5.269 6.952 -4.304 1.00 0.00 O ATOM 559 CB GLU A 36 -2.643 8.360 -2.775 1.00 0.00 C ATOM 560 CG GLU A 36 -2.068 8.950 -1.498 1.00 0.00 C ATOM 561 CD GLU A 36 -1.158 10.151 -1.728 1.00 0.00 C ATOM 562 OE1 GLU A 36 -1.662 11.177 -2.244 1.00 0.00 O ATOM 563 OE2 GLU A 36 0.047 10.085 -1.409 1.00 0.00 O ATOM 0 H GLU A 36 -2.276 6.364 -1.365 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.607 7.848 -2.086 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.843 7.891 -3.347 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.048 9.162 -3.392 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.889 9.248 -0.845 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.507 8.177 -0.972 1.00 0.00 H new ATOM 570 N TYR A 37 -3.411 5.689 -4.300 1.00 0.00 N ATOM 571 CA TYR A 37 -3.716 5.086 -5.603 1.00 0.00 C ATOM 572 C TYR A 37 -4.857 4.103 -5.500 1.00 0.00 C ATOM 573 O TYR A 37 -5.537 3.839 -6.474 1.00 0.00 O ATOM 574 CB TYR A 37 -2.472 4.412 -6.235 1.00 0.00 C ATOM 575 CG TYR A 37 -2.202 2.966 -5.824 1.00 0.00 C ATOM 576 CD1 TYR A 37 -3.003 1.926 -6.281 1.00 0.00 C ATOM 577 CD2 TYR A 37 -1.137 2.646 -4.998 1.00 0.00 C ATOM 578 CE1 TYR A 37 -2.747 0.617 -5.927 1.00 0.00 C ATOM 579 CE2 TYR A 37 -0.877 1.343 -4.631 1.00 0.00 C ATOM 580 CZ TYR A 37 -1.687 0.329 -5.105 1.00 0.00 C ATOM 581 OH TYR A 37 -1.429 -0.974 -4.749 1.00 0.00 O ATOM 0 H TYR A 37 -2.576 5.322 -3.843 1.00 0.00 H new ATOM 0 HA TYR A 37 -4.022 5.898 -6.262 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -2.579 4.445 -7.319 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -1.595 5.008 -5.983 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -3.841 2.146 -6.925 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -0.496 3.435 -4.633 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.379 -0.178 -6.296 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -0.047 1.117 -3.978 1.00 0.00 H new ATOM 0 HH TYR A 37 -0.643 -1.004 -4.164 1.00 0.00 H new ATOM 591 N ILE A 38 -5.077 3.503 -4.330 1.00 0.00 N ATOM 592 CA ILE A 38 -6.234 2.628 -4.148 1.00 0.00 C ATOM 593 C ILE A 38 -7.509 3.463 -4.052 1.00 0.00 C ATOM 594 O ILE A 38 -8.529 3.116 -4.664 1.00 0.00 O ATOM 595 CB ILE A 38 -6.085 1.669 -2.926 1.00 0.00 C ATOM 596 CG1 ILE A 38 -7.436 1.002 -2.559 1.00 0.00 C ATOM 597 CG2 ILE A 38 -5.503 2.391 -1.718 1.00 0.00 C ATOM 598 CD1 ILE A 38 -8.058 0.159 -3.652 1.00 0.00 C ATOM 0 H ILE A 38 -4.481 3.604 -3.508 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.297 1.983 -5.025 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.388 0.884 -3.220 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.286 0.375 -1.680 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -8.143 1.782 -2.277 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.413 1.693 -0.886 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -4.518 2.785 -1.969 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -6.161 3.212 -1.433 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.998 -0.262 -3.296 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -8.247 0.780 -4.527 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.377 -0.649 -3.921 1.00 0.00 H new ATOM 610 N ALA A 39 -7.430 4.575 -3.340 1.00 0.00 N ATOM 611 CA ALA A 39 -8.582 5.474 -3.208 1.00 0.00 C ATOM 612 C ALA A 39 -8.972 6.067 -4.568 1.00 0.00 C ATOM 613 O ALA A 39 -10.154 6.251 -4.863 1.00 0.00 O ATOM 614 CB ALA A 39 -8.267 6.590 -2.229 1.00 0.00 C ATOM 0 H ALA A 39 -6.592 4.882 -2.846 1.00 0.00 H new ATOM 0 HA ALA A 39 -9.424 4.894 -2.830 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.130 7.250 -2.140 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -8.034 6.163 -1.253 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.410 7.159 -2.590 1.00 0.00 H new ATOM 620 N ASP A 40 -7.954 6.362 -5.374 1.00 0.00 N ATOM 621 CA ASP A 40 -8.162 7.035 -6.658 1.00 0.00 C ATOM 622 C ASP A 40 -8.495 6.042 -7.775 1.00 0.00 C ATOM 623 O ASP A 40 -9.455 6.219 -8.514 1.00 0.00 O ATOM 624 CB ASP A 40 -6.905 7.836 -7.026 1.00 0.00 C ATOM 625 CG ASP A 40 -7.115 8.705 -8.265 1.00 0.00 C ATOM 626 OD1 ASP A 40 -7.624 9.839 -8.126 1.00 0.00 O ATOM 627 OD2 ASP A 40 -6.774 8.262 -9.384 1.00 0.00 O ATOM 0 H ASP A 40 -6.979 6.147 -5.163 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.014 7.707 -6.552 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -6.620 8.468 -6.185 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -6.077 7.149 -7.203 1.00 0.00 H new ATOM 632 N ASN A 41 -7.687 4.995 -7.882 1.00 0.00 N ATOM 633 CA ASN A 41 -7.830 4.015 -8.970 1.00 0.00 C ATOM 634 C ASN A 41 -8.939 3.007 -8.671 1.00 0.00 C ATOM 635 O ASN A 41 -9.635 2.573 -9.592 1.00 0.00 O ATOM 636 CB ASN A 41 -6.510 3.259 -9.198 1.00 0.00 C ATOM 637 CG ASN A 41 -5.375 4.130 -9.754 1.00 0.00 C ATOM 638 OD1 ASN A 41 -5.246 5.366 -9.272 1.00 0.00 O flip ATOM 639 ND2 ASN A 41 -4.595 3.669 -10.598 1.00 0.00 N flip ATOM 0 H ASN A 41 -6.925 4.796 -7.234 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.093 4.570 -9.871 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -6.187 2.821 -8.254 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -6.691 2.434 -9.887 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -4.723 2.719 -10.945 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -3.824 4.240 -10.946 1.00 0.00 H new ATOM 646 N GLU A 42 -9.082 2.645 -7.397 1.00 0.00 N ATOM 647 CA GLU A 42 -10.067 1.649 -6.961 1.00 0.00 C ATOM 648 C GLU A 42 -9.984 0.370 -7.803 1.00 0.00 C ATOM 649 O GLU A 42 -10.991 -0.094 -8.353 1.00 0.00 O ATOM 650 CB GLU A 42 -11.494 2.226 -7.059 1.00 0.00 C ATOM 651 CG GLU A 42 -11.717 3.474 -6.209 1.00 0.00 C ATOM 652 CD GLU A 42 -13.175 3.924 -6.197 1.00 0.00 C ATOM 653 OE1 GLU A 42 -13.964 3.380 -5.388 1.00 0.00 O ATOM 654 OE2 GLU A 42 -13.534 4.810 -7.013 1.00 0.00 O ATOM 0 H GLU A 42 -8.521 3.031 -6.638 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.840 1.400 -5.925 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.708 2.465 -8.101 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.207 1.459 -6.755 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.394 3.275 -5.187 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -11.094 4.284 -6.589 1.00 0.00 H new ATOM 661 N ARG A 43 -8.772 -0.183 -7.911 1.00 0.00 N ATOM 662 CA ARG A 43 -8.561 -1.436 -8.661 1.00 0.00 C ATOM 663 C ARG A 43 -7.482 -2.324 -8.042 1.00 0.00 C ATOM 664 O ARG A 43 -7.670 -3.533 -7.898 1.00 0.00 O ATOM 665 CB ARG A 43 -8.206 -1.161 -10.131 1.00 0.00 C ATOM 666 CG ARG A 43 -6.978 -0.278 -10.336 1.00 0.00 C ATOM 667 CD ARG A 43 -6.361 -0.503 -11.706 1.00 0.00 C ATOM 668 NE ARG A 43 -5.845 -1.864 -11.857 1.00 0.00 N ATOM 669 CZ ARG A 43 -4.864 -2.238 -12.705 1.00 0.00 C ATOM 670 NH1 ARG A 43 -4.356 -1.343 -13.546 1.00 0.00 N ATOM 671 NH2 ARG A 43 -4.439 -3.487 -12.719 1.00 0.00 N ATOM 0 H ARG A 43 -7.927 0.208 -7.495 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.510 -1.970 -8.610 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -8.040 -2.113 -10.635 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.061 -0.689 -10.615 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -7.258 0.770 -10.228 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -6.240 -0.492 -9.563 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -7.108 -0.311 -12.476 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -5.552 0.211 -11.861 1.00 0.00 H new ATOM 0 HE ARG A 43 -6.261 -2.590 -11.273 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -4.708 -0.386 -13.546 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -3.614 -1.613 -14.192 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -4.852 -4.173 -12.088 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -3.697 -3.766 -13.361 1.00 0.00 H new ATOM 685 N LEU A 44 -6.352 -1.717 -7.686 1.00 0.00 N ATOM 686 CA LEU A 44 -5.147 -2.445 -7.248 1.00 0.00 C ATOM 687 C LEU A 44 -4.546 -3.264 -8.414 1.00 0.00 C ATOM 688 O LEU A 44 -5.259 -3.634 -9.358 1.00 0.00 O ATOM 689 CB LEU A 44 -5.448 -3.381 -6.054 1.00 0.00 C ATOM 690 CG LEU A 44 -5.848 -2.681 -4.742 1.00 0.00 C ATOM 691 CD1 LEU A 44 -6.199 -3.708 -3.682 1.00 0.00 C ATOM 692 CD2 LEU A 44 -4.732 -1.763 -4.252 1.00 0.00 C ATOM 0 H LEU A 44 -6.238 -0.703 -7.691 1.00 0.00 H new ATOM 0 HA LEU A 44 -4.422 -1.699 -6.923 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -6.251 -4.060 -6.342 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.566 -3.993 -5.864 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.728 -2.067 -4.936 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.480 -3.198 -2.760 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.034 -4.318 -4.028 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.336 -4.347 -3.495 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -5.039 -1.280 -3.324 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.830 -2.349 -4.075 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.529 -1.003 -5.006 1.00 0.00 H new ATOM 812 N MET B 101 4.330 -14.241 10.621 1.00 0.00 N ATOM 813 CA MET B 101 4.130 -12.848 10.157 1.00 0.00 C ATOM 814 C MET B 101 4.053 -11.901 11.336 1.00 0.00 C ATOM 815 O MET B 101 3.841 -12.331 12.478 1.00 0.00 O ATOM 816 CB MET B 101 2.851 -12.750 9.314 1.00 0.00 C ATOM 817 CG MET B 101 1.575 -12.979 10.093 1.00 0.00 C ATOM 818 SD MET B 101 0.136 -13.094 9.005 1.00 0.00 S ATOM 819 CE MET B 101 0.304 -11.613 8.011 1.00 0.00 C ATOM 0 HA MET B 101 4.982 -12.563 9.540 1.00 0.00 H new ATOM 0 HB2 MET B 101 2.809 -11.764 8.852 1.00 0.00 H new ATOM 0 HB3 MET B 101 2.906 -13.479 8.506 1.00 0.00 H new ATOM 0 HG2 MET B 101 1.664 -13.896 10.676 1.00 0.00 H new ATOM 0 HG3 MET B 101 1.431 -12.164 10.802 1.00 0.00 H new ATOM 0 HE1 MET B 101 -0.639 -11.405 7.506 1.00 0.00 H new ATOM 0 HE2 MET B 101 0.566 -10.772 8.653 1.00 0.00 H new ATOM 0 HE3 MET B 101 1.088 -11.760 7.268 1.00 0.00 H new ATOM 829 N GLY B 102 4.222 -10.613 11.087 1.00 0.00 N ATOM 830 CA GLY B 102 4.213 -9.626 12.151 1.00 0.00 C ATOM 831 C GLY B 102 3.447 -8.379 11.773 1.00 0.00 C ATOM 832 O GLY B 102 2.971 -8.253 10.649 1.00 0.00 O ATOM 0 H GLY B 102 4.367 -10.227 10.154 1.00 0.00 H new ATOM 0 HA2 GLY B 102 3.770 -10.064 13.046 1.00 0.00 H new ATOM 0 HA3 GLY B 102 5.239 -9.357 12.402 1.00 0.00 H new ATOM 836 N SER B 103 3.358 -7.454 12.718 1.00 0.00 N ATOM 837 CA SER B 103 2.627 -6.215 12.551 1.00 0.00 C ATOM 838 C SER B 103 3.542 -5.017 12.658 1.00 0.00 C ATOM 839 O SER B 103 4.499 -5.010 13.444 1.00 0.00 O ATOM 840 CB SER B 103 1.495 -6.128 13.589 1.00 0.00 C ATOM 841 OG SER B 103 1.968 -6.491 14.887 1.00 0.00 O ATOM 0 H SER B 103 3.799 -7.548 13.633 1.00 0.00 H new ATOM 0 HA SER B 103 2.192 -6.208 11.551 1.00 0.00 H new ATOM 0 HB2 SER B 103 1.095 -5.114 13.613 1.00 0.00 H new ATOM 0 HB3 SER B 103 0.677 -6.787 13.298 1.00 0.00 H new ATOM 0 HG SER B 103 1.233 -6.427 15.532 1.00 0.00 H new ATOM 847 N ILE B 104 3.269 -4.003 11.837 1.00 0.00 N ATOM 848 CA ILE B 104 4.060 -2.765 11.802 1.00 0.00 C ATOM 849 C ILE B 104 3.121 -1.569 11.897 1.00 0.00 C ATOM 850 O ILE B 104 1.919 -1.695 11.687 1.00 0.00 O ATOM 851 CB ILE B 104 4.915 -2.683 10.504 1.00 0.00 C ATOM 852 CG1 ILE B 104 4.035 -2.535 9.232 1.00 0.00 C ATOM 853 CG2 ILE B 104 5.802 -3.919 10.392 1.00 0.00 C ATOM 854 CD1 ILE B 104 3.826 -1.099 8.770 1.00 0.00 C ATOM 0 H ILE B 104 2.493 -4.013 11.175 1.00 0.00 H new ATOM 0 HA ILE B 104 4.746 -2.760 12.649 1.00 0.00 H new ATOM 0 HB ILE B 104 5.536 -1.790 10.572 1.00 0.00 H new ATOM 0 HG12 ILE B 104 4.494 -3.101 8.421 1.00 0.00 H new ATOM 0 HG13 ILE B 104 3.062 -2.986 9.425 1.00 0.00 H new ATOM 0 HG21 ILE B 104 6.399 -3.857 9.482 1.00 0.00 H new ATOM 0 HG22 ILE B 104 6.463 -3.972 11.257 1.00 0.00 H new ATOM 0 HG23 ILE B 104 5.178 -4.812 10.357 1.00 0.00 H new ATOM 0 HD11 ILE B 104 3.201 -1.091 7.877 1.00 0.00 H new ATOM 0 HD12 ILE B 104 3.337 -0.530 9.561 1.00 0.00 H new ATOM 0 HD13 ILE B 104 4.791 -0.646 8.541 1.00 0.00 H new ATOM 866 N ASN B 105 3.692 -0.386 12.191 1.00 0.00 N ATOM 867 CA ASN B 105 2.902 0.820 12.320 1.00 0.00 C ATOM 868 C ASN B 105 3.010 1.652 11.042 1.00 0.00 C ATOM 869 O ASN B 105 4.108 1.909 10.536 1.00 0.00 O ATOM 870 CB ASN B 105 3.356 1.666 13.511 1.00 0.00 C ATOM 871 CG ASN B 105 2.423 2.841 13.777 1.00 0.00 C ATOM 872 OD1 ASN B 105 1.612 2.801 14.692 1.00 0.00 O ATOM 873 ND2 ASN B 105 2.513 3.866 12.946 1.00 0.00 N ATOM 0 H ASN B 105 4.693 -0.255 12.340 1.00 0.00 H new ATOM 0 HA ASN B 105 1.867 0.521 12.486 1.00 0.00 H new ATOM 0 HB2 ASN B 105 3.408 1.038 14.400 1.00 0.00 H new ATOM 0 HB3 ASN B 105 4.363 2.040 13.325 1.00 0.00 H new ATOM 0 HD21 ASN B 105 1.890 4.667 13.054 1.00 0.00 H new ATOM 0 HD22 ASN B 105 3.205 3.856 12.197 1.00 0.00 H new ATOM 880 N LEU B 106 1.865 2.075 10.552 1.00 0.00 N ATOM 881 CA LEU B 106 1.767 2.950 9.385 1.00 0.00 C ATOM 882 C LEU B 106 1.193 4.282 9.879 1.00 0.00 C ATOM 883 O LEU B 106 0.453 4.288 10.856 1.00 0.00 O ATOM 884 CB LEU B 106 0.828 2.273 8.359 1.00 0.00 C ATOM 885 CG LEU B 106 1.062 2.576 6.867 1.00 0.00 C ATOM 886 CD1 LEU B 106 -0.154 2.131 6.071 1.00 0.00 C ATOM 887 CD2 LEU B 106 1.373 4.039 6.590 1.00 0.00 C ATOM 0 H LEU B 106 0.961 1.823 10.951 1.00 0.00 H new ATOM 0 HA LEU B 106 2.729 3.126 8.904 1.00 0.00 H new ATOM 0 HB2 LEU B 106 0.901 1.194 8.498 1.00 0.00 H new ATOM 0 HB3 LEU B 106 -0.196 2.557 8.603 1.00 0.00 H new ATOM 0 HG LEU B 106 1.945 2.018 6.556 1.00 0.00 H new ATOM 0 HD11 LEU B 106 0.006 2.343 5.014 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -0.306 1.060 6.207 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -1.035 2.670 6.420 1.00 0.00 H new ATOM 0 HD21 LEU B 106 1.527 4.182 5.520 1.00 0.00 H new ATOM 0 HD22 LEU B 106 0.539 4.658 6.923 1.00 0.00 H new ATOM 0 HD23 LEU B 106 2.276 4.327 7.128 1.00 0.00 H new ATOM 899 N ARG B 107 1.520 5.413 9.250 1.00 0.00 N ATOM 900 CA ARG B 107 1.003 6.703 9.682 1.00 0.00 C ATOM 901 C ARG B 107 0.570 7.502 8.474 1.00 0.00 C ATOM 902 O ARG B 107 1.388 7.765 7.584 1.00 0.00 O ATOM 903 CB ARG B 107 2.040 7.504 10.470 1.00 0.00 C ATOM 904 CG ARG B 107 2.423 6.895 11.800 1.00 0.00 C ATOM 905 CD ARG B 107 3.031 7.936 12.718 1.00 0.00 C ATOM 906 NE ARG B 107 4.184 8.611 12.099 1.00 0.00 N ATOM 907 CZ ARG B 107 4.197 9.884 11.750 1.00 0.00 C ATOM 908 NH1 ARG B 107 3.142 10.668 11.952 1.00 0.00 N ATOM 909 NH2 ARG B 107 5.288 10.400 11.181 1.00 0.00 N ATOM 0 H ARG B 107 2.140 5.456 8.441 1.00 0.00 H new ATOM 0 HA ARG B 107 0.155 6.515 10.341 1.00 0.00 H new ATOM 0 HB2 ARG B 107 2.938 7.610 9.861 1.00 0.00 H new ATOM 0 HB3 ARG B 107 1.651 8.508 10.643 1.00 0.00 H new ATOM 0 HG2 ARG B 107 1.542 6.459 12.272 1.00 0.00 H new ATOM 0 HG3 ARG B 107 3.134 6.084 11.642 1.00 0.00 H new ATOM 0 HD2 ARG B 107 2.274 8.676 12.978 1.00 0.00 H new ATOM 0 HD3 ARG B 107 3.345 7.461 13.647 1.00 0.00 H new ATOM 0 HE ARG B 107 5.026 8.060 11.929 1.00 0.00 H new ATOM 0 HH11 ARG B 107 2.300 10.288 12.385 1.00 0.00 H new ATOM 0 HH12 ARG B 107 3.175 11.649 11.674 1.00 0.00 H new ATOM 0 HH21 ARG B 107 6.105 9.812 11.018 1.00 0.00 H new ATOM 0 HH22 ARG B 107 5.305 11.383 10.909 1.00 0.00 H new ATOM 923 N ILE B 108 -0.696 7.894 8.412 1.00 0.00 N ATOM 924 CA ILE B 108 -1.209 8.672 7.270 1.00 0.00 C ATOM 925 C ILE B 108 -2.266 9.661 7.742 1.00 0.00 C ATOM 926 O ILE B 108 -2.703 9.609 8.900 1.00 0.00 O ATOM 927 CB ILE B 108 -1.847 7.789 6.153 1.00 0.00 C ATOM 928 CG1 ILE B 108 -3.235 7.244 6.574 1.00 0.00 C ATOM 929 CG2 ILE B 108 -0.914 6.646 5.774 1.00 0.00 C ATOM 930 CD1 ILE B 108 -3.214 6.353 7.814 1.00 0.00 C ATOM 0 H ILE B 108 -1.391 7.692 9.131 1.00 0.00 H new ATOM 0 HA ILE B 108 -0.343 9.181 6.847 1.00 0.00 H new ATOM 0 HB ILE B 108 -1.996 8.423 5.279 1.00 0.00 H new ATOM 0 HG12 ILE B 108 -3.902 8.086 6.758 1.00 0.00 H new ATOM 0 HG13 ILE B 108 -3.657 6.679 5.743 1.00 0.00 H new ATOM 0 HG21 ILE B 108 -1.377 6.042 4.994 1.00 0.00 H new ATOM 0 HG22 ILE B 108 0.029 7.052 5.407 1.00 0.00 H new ATOM 0 HG23 ILE B 108 -0.725 6.025 6.650 1.00 0.00 H new ATOM 0 HD11 ILE B 108 -4.226 6.016 8.037 1.00 0.00 H new ATOM 0 HD12 ILE B 108 -2.576 5.489 7.630 1.00 0.00 H new ATOM 0 HD13 ILE B 108 -2.825 6.918 8.661 1.00 0.00 H new ATOM 942 N ASP B 109 -2.675 10.546 6.834 1.00 0.00 N ATOM 943 CA ASP B 109 -3.778 11.450 7.114 1.00 0.00 C ATOM 944 C ASP B 109 -5.063 10.661 7.336 1.00 0.00 C ATOM 945 O ASP B 109 -5.406 9.775 6.538 1.00 0.00 O ATOM 946 CB ASP B 109 -3.969 12.397 5.936 1.00 0.00 C ATOM 947 CG ASP B 109 -2.757 13.240 5.609 1.00 0.00 C ATOM 948 OD1 ASP B 109 -1.730 12.664 5.195 1.00 0.00 O ATOM 949 OD2 ASP B 109 -2.838 14.479 5.731 1.00 0.00 O ATOM 0 H ASP B 109 -2.261 10.652 5.908 1.00 0.00 H new ATOM 0 HA ASP B 109 -3.548 12.019 8.015 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -4.238 11.813 5.056 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -4.809 13.058 6.149 1.00 0.00 H new ATOM 954 N ASP B 110 -5.774 10.966 8.412 1.00 0.00 N ATOM 955 CA ASP B 110 -6.997 10.259 8.772 1.00 0.00 C ATOM 956 C ASP B 110 -8.034 10.371 7.674 1.00 0.00 C ATOM 957 O ASP B 110 -8.835 9.459 7.474 1.00 0.00 O ATOM 958 CB ASP B 110 -7.561 10.804 10.093 1.00 0.00 C ATOM 959 CG ASP B 110 -6.775 10.315 11.301 1.00 0.00 C ATOM 960 OD1 ASP B 110 -7.089 9.220 11.826 1.00 0.00 O ATOM 961 OD2 ASP B 110 -5.827 11.002 11.716 1.00 0.00 O ATOM 0 H ASP B 110 -5.520 11.711 9.061 1.00 0.00 H new ATOM 0 HA ASP B 110 -6.751 9.205 8.901 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -7.547 11.894 10.070 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -8.603 10.501 10.193 1.00 0.00 H new ATOM 966 N GLU B 111 -8.015 11.499 6.969 1.00 0.00 N ATOM 967 CA GLU B 111 -8.953 11.737 5.872 1.00 0.00 C ATOM 968 C GLU B 111 -8.643 10.836 4.688 1.00 0.00 C ATOM 969 O GLU B 111 -9.540 10.412 3.970 1.00 0.00 O ATOM 970 CB GLU B 111 -8.916 13.199 5.426 1.00 0.00 C ATOM 971 CG GLU B 111 -7.534 13.686 4.990 1.00 0.00 C ATOM 972 CD GLU B 111 -7.532 15.118 4.528 1.00 0.00 C ATOM 973 OE1 GLU B 111 -7.891 15.378 3.360 1.00 0.00 O ATOM 974 OE2 GLU B 111 -7.180 16.013 5.327 1.00 0.00 O ATOM 0 H GLU B 111 -7.361 12.264 7.137 1.00 0.00 H new ATOM 0 HA GLU B 111 -9.952 11.506 6.241 1.00 0.00 H new ATOM 0 HB2 GLU B 111 -9.614 13.333 4.599 1.00 0.00 H new ATOM 0 HB3 GLU B 111 -9.268 13.826 6.245 1.00 0.00 H new ATOM 0 HG2 GLU B 111 -6.838 13.578 5.822 1.00 0.00 H new ATOM 0 HG3 GLU B 111 -7.169 13.050 4.184 1.00 0.00 H new ATOM 981 N LEU B 112 -7.358 10.522 4.491 1.00 0.00 N ATOM 982 CA LEU B 112 -6.929 9.782 3.316 1.00 0.00 C ATOM 983 C LEU B 112 -7.201 8.286 3.507 1.00 0.00 C ATOM 984 O LEU B 112 -7.705 7.627 2.591 1.00 0.00 O ATOM 985 CB LEU B 112 -5.413 9.987 3.100 1.00 0.00 C ATOM 986 CG LEU B 112 -4.799 9.245 1.903 1.00 0.00 C ATOM 987 CD1 LEU B 112 -5.365 9.765 0.587 1.00 0.00 C ATOM 988 CD2 LEU B 112 -3.276 9.358 1.922 1.00 0.00 C ATOM 0 H LEU B 112 -6.605 10.771 5.132 1.00 0.00 H new ATOM 0 HA LEU B 112 -7.483 10.146 2.451 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -5.224 11.053 2.977 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -4.891 9.673 4.004 1.00 0.00 H new ATOM 0 HG LEU B 112 -5.064 8.191 1.987 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -4.913 9.222 -0.243 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -6.445 9.618 0.572 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -5.142 10.828 0.490 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -2.861 8.826 1.066 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -2.988 10.408 1.871 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -2.890 8.921 2.843 1.00 0.00 H new ATOM 1000 N LYS B 113 -6.888 7.794 4.690 1.00 0.00 N ATOM 1001 CA LYS B 113 -7.136 6.392 5.014 1.00 0.00 C ATOM 1002 C LYS B 113 -8.601 6.056 4.813 1.00 0.00 C ATOM 1003 O LYS B 113 -8.940 5.045 4.234 1.00 0.00 O ATOM 1004 CB LYS B 113 -6.718 6.083 6.450 1.00 0.00 C ATOM 1005 CG LYS B 113 -7.671 6.632 7.497 1.00 0.00 C ATOM 1006 CD LYS B 113 -7.368 6.102 8.878 1.00 0.00 C ATOM 1007 CE LYS B 113 -8.338 6.661 9.919 1.00 0.00 C ATOM 1008 NZ LYS B 113 -8.127 6.053 11.256 1.00 0.00 N ATOM 0 H LYS B 113 -6.464 8.336 5.443 1.00 0.00 H new ATOM 0 HA LYS B 113 -6.537 5.777 4.342 1.00 0.00 H new ATOM 0 HB2 LYS B 113 -6.642 5.003 6.572 1.00 0.00 H new ATOM 0 HB3 LYS B 113 -5.724 6.494 6.626 1.00 0.00 H new ATOM 0 HG2 LYS B 113 -7.610 7.720 7.506 1.00 0.00 H new ATOM 0 HG3 LYS B 113 -8.694 6.372 7.226 1.00 0.00 H new ATOM 0 HD2 LYS B 113 -7.427 5.014 8.872 1.00 0.00 H new ATOM 0 HD3 LYS B 113 -6.347 6.364 9.153 1.00 0.00 H new ATOM 0 HE2 LYS B 113 -8.213 7.742 9.988 1.00 0.00 H new ATOM 0 HE3 LYS B 113 -9.363 6.479 9.595 1.00 0.00 H new ATOM 0 HZ1 LYS B 113 -8.804 6.459 11.933 1.00 0.00 H new ATOM 0 HZ2 LYS B 113 -8.271 5.025 11.196 1.00 0.00 H new ATOM 0 HZ3 LYS B 113 -7.157 6.249 11.577 1.00 0.00 H new ATOM 1022 N ALA B 114 -9.465 6.933 5.325 1.00 0.00 N ATOM 1023 CA ALA B 114 -10.908 6.828 5.102 1.00 0.00 C ATOM 1024 C ALA B 114 -11.246 6.482 3.660 1.00 0.00 C ATOM 1025 O ALA B 114 -11.967 5.518 3.406 1.00 0.00 O ATOM 1026 CB ALA B 114 -11.579 8.136 5.515 1.00 0.00 C ATOM 0 H ALA B 114 -9.189 7.729 5.900 1.00 0.00 H new ATOM 0 HA ALA B 114 -11.286 6.010 5.715 1.00 0.00 H new ATOM 0 HB1 ALA B 114 -12.654 8.061 5.350 1.00 0.00 H new ATOM 0 HB2 ALA B 114 -11.386 8.326 6.571 1.00 0.00 H new ATOM 0 HB3 ALA B 114 -11.177 8.955 4.919 1.00 0.00 H new ATOM 1032 N ARG B 115 -10.725 7.269 2.710 1.00 0.00 N ATOM 1033 CA ARG B 115 -11.021 7.083 1.285 1.00 0.00 C ATOM 1034 C ARG B 115 -10.509 5.741 0.770 1.00 0.00 C ATOM 1035 O ARG B 115 -11.253 4.966 0.153 1.00 0.00 O ATOM 1036 CB ARG B 115 -10.424 8.219 0.428 1.00 0.00 C ATOM 1037 CG ARG B 115 -11.308 9.472 0.408 1.00 0.00 C ATOM 1038 CD ARG B 115 -11.562 10.030 1.782 1.00 0.00 C ATOM 1039 NE ARG B 115 -12.436 11.222 1.762 1.00 0.00 N ATOM 1040 CZ ARG B 115 -12.093 12.409 2.246 1.00 0.00 C ATOM 1041 NH1 ARG B 115 -10.900 12.588 2.798 1.00 0.00 N ATOM 1042 NH2 ARG B 115 -12.949 13.416 2.205 1.00 0.00 N ATOM 0 H ARG B 115 -10.093 8.045 2.905 1.00 0.00 H new ATOM 0 HA ARG B 115 -12.107 7.102 1.193 1.00 0.00 H new ATOM 0 HB2 ARG B 115 -9.439 8.481 0.814 1.00 0.00 H new ATOM 0 HB3 ARG B 115 -10.282 7.863 -0.592 1.00 0.00 H new ATOM 0 HG2 ARG B 115 -10.833 10.236 -0.207 1.00 0.00 H new ATOM 0 HG3 ARG B 115 -12.261 9.231 -0.063 1.00 0.00 H new ATOM 0 HD2 ARG B 115 -12.019 9.260 2.403 1.00 0.00 H new ATOM 0 HD3 ARG B 115 -10.610 10.290 2.245 1.00 0.00 H new ATOM 0 HE ARG B 115 -13.364 11.126 1.349 1.00 0.00 H new ATOM 0 HH11 ARG B 115 -10.241 11.811 2.852 1.00 0.00 H new ATOM 0 HH12 ARG B 115 -10.641 13.503 3.168 1.00 0.00 H new ATOM 0 HH21 ARG B 115 -13.876 13.281 1.801 1.00 0.00 H new ATOM 0 HH22 ARG B 115 -12.683 14.327 2.578 1.00 0.00 H new ATOM 1056 N SER B 116 -9.230 5.475 1.010 1.00 0.00 N ATOM 1057 CA SER B 116 -8.584 4.258 0.514 1.00 0.00 C ATOM 1058 C SER B 116 -9.315 3.013 1.007 1.00 0.00 C ATOM 1059 O SER B 116 -9.728 2.158 0.214 1.00 0.00 O ATOM 1060 CB SER B 116 -7.125 4.248 0.970 1.00 0.00 C ATOM 1061 OG SER B 116 -7.029 4.526 2.363 1.00 0.00 O ATOM 0 H SER B 116 -8.615 6.086 1.547 1.00 0.00 H new ATOM 0 HA SER B 116 -8.623 4.248 -0.575 1.00 0.00 H new ATOM 0 HB2 SER B 116 -6.679 3.276 0.757 1.00 0.00 H new ATOM 0 HB3 SER B 116 -6.558 4.989 0.407 1.00 0.00 H new ATOM 0 HG SER B 116 -6.912 3.688 2.857 1.00 0.00 H new ATOM 1067 N TYR B 117 -9.480 2.926 2.325 1.00 0.00 N ATOM 1068 CA TYR B 117 -10.190 1.849 2.979 1.00 0.00 C ATOM 1069 C TYR B 117 -11.583 1.679 2.381 1.00 0.00 C ATOM 1070 O TYR B 117 -11.981 0.563 2.052 1.00 0.00 O ATOM 1071 CB TYR B 117 -10.321 2.109 4.484 1.00 0.00 C ATOM 1072 CG TYR B 117 -9.015 2.085 5.248 1.00 0.00 C ATOM 1073 CD1 TYR B 117 -7.823 1.673 4.659 1.00 0.00 C ATOM 1074 CD2 TYR B 117 -8.975 2.483 6.575 1.00 0.00 C ATOM 1075 CE1 TYR B 117 -6.647 1.658 5.377 1.00 0.00 C ATOM 1076 CE2 TYR B 117 -7.799 2.465 7.299 1.00 0.00 C ATOM 1077 CZ TYR B 117 -6.637 2.043 6.683 1.00 0.00 C ATOM 1078 OH TYR B 117 -5.453 2.011 7.388 1.00 0.00 O ATOM 0 H TYR B 117 -9.113 3.621 2.975 1.00 0.00 H new ATOM 0 HA TYR B 117 -9.613 0.937 2.823 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -10.794 3.080 4.631 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -10.989 1.361 4.911 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -7.820 1.361 3.625 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -9.884 2.815 7.054 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -5.730 1.340 4.902 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -7.788 2.777 8.333 1.00 0.00 H new ATOM 0 HH TYR B 117 -4.704 2.167 6.776 1.00 0.00 H new ATOM 1088 N ALA B 118 -12.295 2.794 2.220 1.00 0.00 N ATOM 1089 CA ALA B 118 -13.668 2.765 1.718 1.00 0.00 C ATOM 1090 C ALA B 118 -13.732 2.105 0.349 1.00 0.00 C ATOM 1091 O ALA B 118 -14.633 1.317 0.063 1.00 0.00 O ATOM 1092 CB ALA B 118 -14.231 4.183 1.662 1.00 0.00 C ATOM 0 H ALA B 118 -11.944 3.728 2.430 1.00 0.00 H new ATOM 0 HA ALA B 118 -14.276 2.172 2.401 1.00 0.00 H new ATOM 0 HB1 ALA B 118 -15.254 4.154 1.287 1.00 0.00 H new ATOM 0 HB2 ALA B 118 -14.223 4.617 2.662 1.00 0.00 H new ATOM 0 HB3 ALA B 118 -13.618 4.792 0.997 1.00 0.00 H new ATOM 1098 N ALA B 119 -12.768 2.419 -0.499 1.00 0.00 N ATOM 1099 CA ALA B 119 -12.701 1.883 -1.861 1.00 0.00 C ATOM 1100 C ALA B 119 -12.450 0.383 -1.860 1.00 0.00 C ATOM 1101 O ALA B 119 -13.160 -0.374 -2.530 1.00 0.00 O ATOM 1102 CB ALA B 119 -11.624 2.611 -2.641 1.00 0.00 C ATOM 0 H ALA B 119 -12.004 3.054 -0.268 1.00 0.00 H new ATOM 0 HA ALA B 119 -13.665 2.046 -2.344 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -11.575 2.211 -3.654 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -11.860 3.674 -2.681 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -10.661 2.471 -2.149 1.00 0.00 H new ATOM 1108 N LEU B 120 -11.458 -0.044 -1.092 1.00 0.00 N ATOM 1109 CA LEU B 120 -10.989 -1.435 -1.149 1.00 0.00 C ATOM 1110 C LEU B 120 -11.960 -2.380 -0.435 1.00 0.00 C ATOM 1111 O LEU B 120 -12.170 -3.501 -0.896 1.00 0.00 O ATOM 1112 CB LEU B 120 -9.548 -1.551 -0.589 1.00 0.00 C ATOM 1113 CG LEU B 120 -9.306 -0.944 0.814 1.00 0.00 C ATOM 1114 CD1 LEU B 120 -9.742 -1.892 1.923 1.00 0.00 C ATOM 1115 CD2 LEU B 120 -7.836 -0.536 0.972 1.00 0.00 C ATOM 0 H LEU B 120 -10.960 0.543 -0.423 1.00 0.00 H new ATOM 0 HA LEU B 120 -10.960 -1.743 -2.194 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -9.278 -2.606 -0.556 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -8.868 -1.070 -1.292 1.00 0.00 H new ATOM 0 HG LEU B 120 -9.922 -0.049 0.904 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -9.555 -1.429 2.892 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -10.806 -2.106 1.822 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -9.177 -2.821 1.850 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -7.681 -0.111 1.964 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -7.200 -1.413 0.850 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -7.581 0.206 0.215 1.00 0.00 H new ATOM 1127 N GLU B 121 -12.582 -1.932 0.650 1.00 0.00 N ATOM 1128 CA GLU B 121 -13.510 -2.776 1.393 1.00 0.00 C ATOM 1129 C GLU B 121 -14.724 -3.060 0.527 1.00 0.00 C ATOM 1130 O GLU B 121 -15.285 -4.149 0.538 1.00 0.00 O ATOM 1131 CB GLU B 121 -13.939 -2.115 2.705 1.00 0.00 C ATOM 1132 CG GLU B 121 -14.598 -0.740 2.545 1.00 0.00 C ATOM 1133 CD GLU B 121 -15.109 -0.185 3.854 1.00 0.00 C ATOM 1134 OE1 GLU B 121 -16.230 -0.540 4.261 1.00 0.00 O ATOM 1135 OE2 GLU B 121 -14.382 0.591 4.509 1.00 0.00 O ATOM 0 H GLU B 121 -12.461 -0.994 1.033 1.00 0.00 H new ATOM 0 HA GLU B 121 -13.007 -3.710 1.646 1.00 0.00 H new ATOM 0 HB2 GLU B 121 -14.634 -2.778 3.220 1.00 0.00 H new ATOM 0 HB3 GLU B 121 -13.064 -2.011 3.346 1.00 0.00 H new ATOM 0 HG2 GLU B 121 -13.878 -0.044 2.116 1.00 0.00 H new ATOM 0 HG3 GLU B 121 -15.425 -0.818 1.840 1.00 0.00 H new ATOM 1142 N LYS B 122 -15.106 -2.050 -0.238 1.00 0.00 N ATOM 1143 CA LYS B 122 -16.147 -2.155 -1.234 1.00 0.00 C ATOM 1144 C LYS B 122 -15.794 -3.217 -2.275 1.00 0.00 C ATOM 1145 O LYS B 122 -16.644 -4.014 -2.676 1.00 0.00 O ATOM 1146 CB LYS B 122 -16.307 -0.788 -1.904 1.00 0.00 C ATOM 1147 CG LYS B 122 -17.418 -0.728 -2.936 1.00 0.00 C ATOM 1148 CD LYS B 122 -17.525 0.666 -3.534 1.00 0.00 C ATOM 1149 CE LYS B 122 -16.594 0.856 -4.728 1.00 0.00 C ATOM 1150 NZ LYS B 122 -15.143 0.891 -4.355 1.00 0.00 N ATOM 0 H LYS B 122 -14.691 -1.120 -0.179 1.00 0.00 H new ATOM 0 HA LYS B 122 -17.082 -2.454 -0.760 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -16.499 -0.039 -1.135 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -15.366 -0.518 -2.383 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -17.226 -1.454 -3.726 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -18.366 -1.004 -2.473 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -18.554 0.848 -3.845 1.00 0.00 H new ATOM 0 HD3 LYS B 122 -17.288 1.406 -2.770 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -16.759 0.047 -5.439 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -16.853 1.785 -5.236 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -14.679 1.684 -4.842 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -15.052 1.015 -3.326 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -14.690 -0.002 -4.638 1.00 0.00 H new ATOM 1164 N MET B 123 -14.527 -3.225 -2.674 1.00 0.00 N ATOM 1165 CA MET B 123 -14.001 -4.241 -3.601 1.00 0.00 C ATOM 1166 C MET B 123 -13.857 -5.595 -2.904 1.00 0.00 C ATOM 1167 O MET B 123 -13.474 -6.590 -3.528 1.00 0.00 O ATOM 1168 CB MET B 123 -12.650 -3.804 -4.157 1.00 0.00 C ATOM 1169 CG MET B 123 -12.683 -2.412 -4.807 1.00 0.00 C ATOM 1170 SD MET B 123 -11.038 -1.712 -5.033 1.00 0.00 S ATOM 1171 CE MET B 123 -10.198 -3.042 -5.890 1.00 0.00 C ATOM 0 H MET B 123 -13.836 -2.538 -2.372 1.00 0.00 H new ATOM 0 HA MET B 123 -14.711 -4.345 -4.422 1.00 0.00 H new ATOM 0 HB2 MET B 123 -11.916 -3.804 -3.351 1.00 0.00 H new ATOM 0 HB3 MET B 123 -12.315 -4.534 -4.894 1.00 0.00 H new ATOM 0 HG2 MET B 123 -13.181 -2.479 -5.774 1.00 0.00 H new ATOM 0 HG3 MET B 123 -13.278 -1.740 -4.188 1.00 0.00 H new ATOM 0 HE1 MET B 123 -9.159 -2.764 -6.064 1.00 0.00 H new ATOM 0 HE2 MET B 123 -10.235 -3.946 -5.283 1.00 0.00 H new ATOM 0 HE3 MET B 123 -10.689 -3.226 -6.846 1.00 0.00 H new ATOM 1181 N GLY B 124 -14.195 -5.612 -1.621 1.00 0.00 N ATOM 1182 CA GLY B 124 -14.134 -6.854 -0.840 1.00 0.00 C ATOM 1183 C GLY B 124 -12.723 -7.183 -0.365 1.00 0.00 C ATOM 1184 O GLY B 124 -12.438 -8.310 0.044 1.00 0.00 O ATOM 0 H GLY B 124 -14.511 -4.795 -1.099 1.00 0.00 H new ATOM 0 HA2 GLY B 124 -14.793 -6.767 0.024 1.00 0.00 H new ATOM 0 HA3 GLY B 124 -14.510 -7.678 -1.446 1.00 0.00 H new ATOM 1188 N VAL B 125 -11.854 -6.174 -0.397 1.00 0.00 N ATOM 1189 CA VAL B 125 -10.461 -6.334 0.012 1.00 0.00 C ATOM 1190 C VAL B 125 -10.245 -5.749 1.411 1.00 0.00 C ATOM 1191 O VAL B 125 -10.954 -4.842 1.835 1.00 0.00 O ATOM 1192 CB VAL B 125 -9.506 -5.625 -0.999 1.00 0.00 C ATOM 1193 CG1 VAL B 125 -8.040 -5.877 -0.636 1.00 0.00 C ATOM 1194 CG2 VAL B 125 -9.807 -6.069 -2.422 1.00 0.00 C ATOM 0 H VAL B 125 -12.093 -5.231 -0.704 1.00 0.00 H new ATOM 0 HA VAL B 125 -10.234 -7.400 0.028 1.00 0.00 H new ATOM 0 HB VAL B 125 -9.680 -4.551 -0.939 1.00 0.00 H new ATOM 0 HG11 VAL B 125 -7.395 -5.373 -1.356 1.00 0.00 H new ATOM 0 HG12 VAL B 125 -7.841 -5.490 0.363 1.00 0.00 H new ATOM 0 HG13 VAL B 125 -7.839 -6.948 -0.657 1.00 0.00 H new ATOM 0 HG21 VAL B 125 -9.131 -5.564 -3.112 1.00 0.00 H new ATOM 0 HG22 VAL B 125 -9.669 -7.147 -2.504 1.00 0.00 H new ATOM 0 HG23 VAL B 125 -10.837 -5.815 -2.672 1.00 0.00 H new ATOM 1204 N THR B 126 -9.279 -6.295 2.155 1.00 0.00 N ATOM 1205 CA THR B 126 -8.901 -5.786 3.451 1.00 0.00 C ATOM 1206 C THR B 126 -7.663 -4.886 3.330 1.00 0.00 C ATOM 1207 O THR B 126 -6.738 -5.205 2.568 1.00 0.00 O ATOM 1208 CB THR B 126 -8.595 -6.983 4.391 1.00 0.00 C ATOM 1209 OG1 THR B 126 -9.788 -7.748 4.614 1.00 0.00 O ATOM 1210 CG2 THR B 126 -8.013 -6.528 5.717 1.00 0.00 C ATOM 0 H THR B 126 -8.740 -7.110 1.861 1.00 0.00 H new ATOM 0 HA THR B 126 -9.719 -5.193 3.861 1.00 0.00 H new ATOM 0 HB THR B 126 -7.847 -7.606 3.900 1.00 0.00 H new ATOM 0 HG1 THR B 126 -9.587 -8.502 5.206 1.00 0.00 H new ATOM 0 HG21 THR B 126 -7.814 -7.397 6.344 1.00 0.00 H new ATOM 0 HG22 THR B 126 -7.083 -5.987 5.540 1.00 0.00 H new ATOM 0 HG23 THR B 126 -8.724 -5.872 6.220 1.00 0.00 H new ATOM 1218 N PRO B 127 -7.628 -3.738 4.052 1.00 0.00 N ATOM 1219 CA PRO B 127 -6.502 -2.795 3.976 1.00 0.00 C ATOM 1220 C PRO B 127 -5.165 -3.479 4.211 1.00 0.00 C ATOM 1221 O PRO B 127 -4.203 -3.245 3.481 1.00 0.00 O ATOM 1222 CB PRO B 127 -6.795 -1.767 5.096 1.00 0.00 C ATOM 1223 CG PRO B 127 -7.905 -2.361 5.899 1.00 0.00 C ATOM 1224 CD PRO B 127 -8.678 -3.260 4.966 1.00 0.00 C ATOM 0 HA PRO B 127 -6.422 -2.341 2.988 1.00 0.00 H new ATOM 0 HB2 PRO B 127 -5.913 -1.595 5.712 1.00 0.00 H new ATOM 0 HB3 PRO B 127 -7.085 -0.803 4.678 1.00 0.00 H new ATOM 0 HG2 PRO B 127 -7.512 -2.926 6.745 1.00 0.00 H new ATOM 0 HG3 PRO B 127 -8.548 -1.581 6.307 1.00 0.00 H new ATOM 0 HD2 PRO B 127 -9.159 -4.081 5.498 1.00 0.00 H new ATOM 0 HD3 PRO B 127 -9.463 -2.719 4.437 1.00 0.00 H new ATOM 1232 N SER B 128 -5.107 -4.339 5.223 1.00 0.00 N ATOM 1233 CA SER B 128 -3.891 -5.078 5.566 1.00 0.00 C ATOM 1234 C SER B 128 -3.397 -5.883 4.358 1.00 0.00 C ATOM 1235 O SER B 128 -2.187 -6.063 4.168 1.00 0.00 O ATOM 1236 CB SER B 128 -4.155 -6.006 6.751 1.00 0.00 C ATOM 1237 OG SER B 128 -4.825 -5.328 7.805 1.00 0.00 O ATOM 0 H SER B 128 -5.900 -4.545 5.830 1.00 0.00 H new ATOM 0 HA SER B 128 -3.116 -4.365 5.846 1.00 0.00 H new ATOM 0 HB2 SER B 128 -4.756 -6.854 6.423 1.00 0.00 H new ATOM 0 HB3 SER B 128 -3.210 -6.407 7.118 1.00 0.00 H new ATOM 0 HG SER B 128 -4.981 -5.949 8.547 1.00 0.00 H new ATOM 1243 N GLU B 129 -4.336 -6.356 3.544 1.00 0.00 N ATOM 1244 CA GLU B 129 -4.000 -7.170 2.375 1.00 0.00 C ATOM 1245 C GLU B 129 -3.498 -6.282 1.241 1.00 0.00 C ATOM 1246 O GLU B 129 -2.465 -6.583 0.631 1.00 0.00 O ATOM 1247 CB GLU B 129 -5.213 -7.956 1.895 1.00 0.00 C ATOM 1248 CG GLU B 129 -5.845 -8.851 2.956 1.00 0.00 C ATOM 1249 CD GLU B 129 -7.064 -9.586 2.430 1.00 0.00 C ATOM 1250 OE1 GLU B 129 -7.947 -8.947 1.820 1.00 0.00 O ATOM 1251 OE2 GLU B 129 -7.126 -10.833 2.570 1.00 0.00 O ATOM 0 H GLU B 129 -5.335 -6.191 3.670 1.00 0.00 H new ATOM 0 HA GLU B 129 -3.217 -7.869 2.667 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -5.965 -7.255 1.534 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -4.918 -8.573 1.046 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -5.108 -9.575 3.305 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -6.130 -8.246 3.817 1.00 0.00 H new ATOM 1258 N ALA B 130 -4.234 -5.228 0.952 1.00 0.00 N ATOM 1259 CA ALA B 130 -3.865 -4.276 -0.116 1.00 0.00 C ATOM 1260 C ALA B 130 -2.467 -3.705 0.132 1.00 0.00 C ATOM 1261 O ALA B 130 -1.698 -3.481 -0.800 1.00 0.00 O ATOM 1262 CB ALA B 130 -4.892 -3.166 -0.219 1.00 0.00 C ATOM 0 H ALA B 130 -5.100 -4.994 1.437 1.00 0.00 H new ATOM 0 HA ALA B 130 -3.849 -4.812 -1.065 1.00 0.00 H new ATOM 0 HB1 ALA B 130 -4.603 -2.475 -1.011 1.00 0.00 H new ATOM 0 HB2 ALA B 130 -5.868 -3.593 -0.449 1.00 0.00 H new ATOM 0 HB3 ALA B 130 -4.945 -2.630 0.729 1.00 0.00 H new ATOM 1268 N LEU B 131 -2.153 -3.450 1.401 1.00 0.00 N ATOM 1269 CA LEU B 131 -0.832 -2.982 1.771 1.00 0.00 C ATOM 1270 C LEU B 131 0.195 -4.103 1.638 1.00 0.00 C ATOM 1271 O LEU B 131 1.348 -3.850 1.266 1.00 0.00 O ATOM 1272 CB LEU B 131 -0.849 -2.444 3.202 1.00 0.00 C ATOM 1273 CG LEU B 131 -1.720 -1.185 3.422 1.00 0.00 C ATOM 1274 CD1 LEU B 131 -1.740 -0.772 4.893 1.00 0.00 C ATOM 1275 CD2 LEU B 131 -1.204 -0.030 2.559 1.00 0.00 C ATOM 0 H LEU B 131 -2.798 -3.561 2.183 1.00 0.00 H new ATOM 0 HA LEU B 131 -0.547 -2.177 1.094 1.00 0.00 H new ATOM 0 HB2 LEU B 131 -1.204 -3.233 3.865 1.00 0.00 H new ATOM 0 HB3 LEU B 131 0.174 -2.215 3.499 1.00 0.00 H new ATOM 0 HG LEU B 131 -2.741 -1.427 3.126 1.00 0.00 H new ATOM 0 HD11 LEU B 131 -2.361 0.116 5.013 1.00 0.00 H new ATOM 0 HD12 LEU B 131 -2.149 -1.585 5.494 1.00 0.00 H new ATOM 0 HD13 LEU B 131 -0.725 -0.552 5.223 1.00 0.00 H new ATOM 0 HD21 LEU B 131 -1.825 0.851 2.722 1.00 0.00 H new ATOM 0 HD22 LEU B 131 -0.173 0.196 2.832 1.00 0.00 H new ATOM 0 HD23 LEU B 131 -1.246 -0.314 1.508 1.00 0.00 H new ATOM 1287 N ARG B 132 -0.244 -5.334 1.892 1.00 0.00 N ATOM 1288 CA ARG B 132 0.627 -6.502 1.770 1.00 0.00 C ATOM 1289 C ARG B 132 1.129 -6.661 0.343 1.00 0.00 C ATOM 1290 O ARG B 132 2.324 -6.852 0.104 1.00 0.00 O ATOM 1291 CB ARG B 132 -0.131 -7.766 2.246 1.00 0.00 C ATOM 1292 CG ARG B 132 0.678 -9.074 2.142 1.00 0.00 C ATOM 1293 CD ARG B 132 0.530 -9.762 0.797 1.00 0.00 C ATOM 1294 NE ARG B 132 -0.831 -10.251 0.567 1.00 0.00 N ATOM 1295 CZ ARG B 132 -1.262 -10.787 -0.584 1.00 0.00 C ATOM 1296 NH1 ARG B 132 -0.462 -10.831 -1.637 1.00 0.00 N ATOM 1297 NH2 ARG B 132 -2.497 -11.248 -0.671 1.00 0.00 N ATOM 0 H ARG B 132 -1.198 -5.549 2.184 1.00 0.00 H new ATOM 0 HA ARG B 132 1.502 -6.361 2.404 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -0.435 -7.623 3.283 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -1.043 -7.870 1.658 1.00 0.00 H new ATOM 0 HG2 ARG B 132 1.732 -8.857 2.318 1.00 0.00 H new ATOM 0 HG3 ARG B 132 0.357 -9.756 2.929 1.00 0.00 H new ATOM 0 HD2 ARG B 132 0.802 -9.066 0.004 1.00 0.00 H new ATOM 0 HD3 ARG B 132 1.228 -10.597 0.741 1.00 0.00 H new ATOM 0 HE ARG B 132 -1.497 -10.179 1.336 1.00 0.00 H new ATOM 0 HH11 ARG B 132 0.485 -10.457 -1.574 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -0.792 -11.239 -2.512 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -3.119 -11.195 0.136 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -2.829 -11.656 -1.545 1.00 0.00 H new ATOM 1311 N LEU B 133 0.209 -6.561 -0.621 1.00 0.00 N ATOM 1312 CA LEU B 133 0.575 -6.692 -2.041 1.00 0.00 C ATOM 1313 C LEU B 133 1.365 -5.473 -2.521 1.00 0.00 C ATOM 1314 O LEU B 133 2.142 -5.564 -3.490 1.00 0.00 O ATOM 1315 CB LEU B 133 -0.664 -6.933 -2.911 1.00 0.00 C ATOM 1316 CG LEU B 133 -1.855 -5.981 -2.679 1.00 0.00 C ATOM 1317 CD1 LEU B 133 -2.005 -4.985 -3.822 1.00 0.00 C ATOM 1318 CD2 LEU B 133 -3.123 -6.799 -2.484 1.00 0.00 C ATOM 0 H LEU B 133 -0.783 -6.392 -0.452 1.00 0.00 H new ATOM 0 HA LEU B 133 1.222 -7.564 -2.141 1.00 0.00 H new ATOM 0 HB2 LEU B 133 -0.367 -6.861 -3.957 1.00 0.00 H new ATOM 0 HB3 LEU B 133 -1.005 -7.955 -2.746 1.00 0.00 H new ATOM 0 HG LEU B 133 -1.669 -5.397 -1.778 1.00 0.00 H new ATOM 0 HD11 LEU B 133 -2.854 -4.330 -3.625 1.00 0.00 H new ATOM 0 HD12 LEU B 133 -1.097 -4.387 -3.905 1.00 0.00 H new ATOM 0 HD13 LEU B 133 -2.171 -5.524 -4.755 1.00 0.00 H new ATOM 0 HD21 LEU B 133 -3.967 -6.129 -2.320 1.00 0.00 H new ATOM 0 HD22 LEU B 133 -3.307 -7.403 -3.373 1.00 0.00 H new ATOM 0 HD23 LEU B 133 -3.005 -7.452 -1.620 1.00 0.00 H new ATOM 1330 N MET B 134 1.191 -4.349 -1.850 1.00 0.00 N ATOM 1331 CA MET B 134 1.976 -3.157 -2.134 1.00 0.00 C ATOM 1332 C MET B 134 3.441 -3.399 -1.828 1.00 0.00 C ATOM 1333 O MET B 134 4.315 -3.070 -2.642 1.00 0.00 O ATOM 1334 CB MET B 134 1.445 -1.952 -1.337 1.00 0.00 C ATOM 1335 CG MET B 134 2.396 -0.764 -1.317 1.00 0.00 C ATOM 1336 SD MET B 134 3.814 -1.020 -0.238 1.00 0.00 S ATOM 1337 CE MET B 134 4.752 0.467 -0.578 1.00 0.00 C ATOM 0 H MET B 134 0.509 -4.235 -1.100 1.00 0.00 H new ATOM 0 HA MET B 134 1.881 -2.930 -3.196 1.00 0.00 H new ATOM 0 HB2 MET B 134 0.493 -1.637 -1.764 1.00 0.00 H new ATOM 0 HB3 MET B 134 1.247 -2.265 -0.312 1.00 0.00 H new ATOM 0 HG2 MET B 134 2.747 -0.569 -2.330 1.00 0.00 H new ATOM 0 HG3 MET B 134 1.854 0.124 -0.991 1.00 0.00 H new ATOM 0 HE1 MET B 134 5.391 0.697 0.275 1.00 0.00 H new ATOM 0 HE2 MET B 134 5.369 0.313 -1.463 1.00 0.00 H new ATOM 0 HE3 MET B 134 4.067 1.297 -0.753 1.00 0.00 H new ATOM 1347 N LEU B 135 3.709 -4.018 -0.676 1.00 0.00 N ATOM 1348 CA LEU B 135 5.079 -4.289 -0.260 1.00 0.00 C ATOM 1349 C LEU B 135 5.752 -5.215 -1.258 1.00 0.00 C ATOM 1350 O LEU B 135 6.977 -5.202 -1.434 1.00 0.00 O ATOM 1351 CB LEU B 135 5.119 -4.903 1.157 1.00 0.00 C ATOM 1352 CG LEU B 135 4.683 -3.967 2.294 1.00 0.00 C ATOM 1353 CD1 LEU B 135 4.844 -4.658 3.651 1.00 0.00 C ATOM 1354 CD2 LEU B 135 5.456 -2.650 2.260 1.00 0.00 C ATOM 0 H LEU B 135 2.996 -4.338 -0.020 1.00 0.00 H new ATOM 0 HA LEU B 135 5.621 -3.344 -0.231 1.00 0.00 H new ATOM 0 HB2 LEU B 135 4.479 -5.785 1.170 1.00 0.00 H new ATOM 0 HB3 LEU B 135 6.135 -5.243 1.359 1.00 0.00 H new ATOM 0 HG LEU B 135 3.628 -3.733 2.148 1.00 0.00 H new ATOM 0 HD11 LEU B 135 4.530 -3.980 4.444 1.00 0.00 H new ATOM 0 HD12 LEU B 135 4.228 -5.557 3.677 1.00 0.00 H new ATOM 0 HD13 LEU B 135 5.889 -4.930 3.799 1.00 0.00 H new ATOM 0 HD21 LEU B 135 5.123 -2.011 3.078 1.00 0.00 H new ATOM 0 HD22 LEU B 135 6.522 -2.851 2.368 1.00 0.00 H new ATOM 0 HD23 LEU B 135 5.276 -2.147 1.310 1.00 0.00 H new ATOM 1366 N GLU B 136 4.930 -5.996 -1.952 1.00 0.00 N ATOM 1367 CA GLU B 136 5.421 -6.890 -2.985 1.00 0.00 C ATOM 1368 C GLU B 136 5.890 -6.116 -4.211 1.00 0.00 C ATOM 1369 O GLU B 136 6.982 -6.379 -4.722 1.00 0.00 O ATOM 1370 CB GLU B 136 4.343 -7.909 -3.378 1.00 0.00 C ATOM 1371 CG GLU B 136 3.724 -8.641 -2.192 1.00 0.00 C ATOM 1372 CD GLU B 136 2.913 -9.875 -2.575 1.00 0.00 C ATOM 1373 OE1 GLU B 136 3.506 -10.973 -2.723 1.00 0.00 O ATOM 1374 OE2 GLU B 136 1.683 -9.759 -2.735 1.00 0.00 O ATOM 0 H GLU B 136 3.920 -6.025 -1.814 1.00 0.00 H new ATOM 0 HA GLU B 136 6.277 -7.427 -2.577 1.00 0.00 H new ATOM 0 HB2 GLU B 136 3.554 -7.395 -3.927 1.00 0.00 H new ATOM 0 HB3 GLU B 136 4.779 -8.641 -4.057 1.00 0.00 H new ATOM 0 HG2 GLU B 136 4.519 -8.940 -1.508 1.00 0.00 H new ATOM 0 HG3 GLU B 136 3.079 -7.950 -1.649 1.00 0.00 H new ATOM 1381 N TYR B 137 5.116 -5.121 -4.676 1.00 0.00 N ATOM 1382 CA TYR B 137 5.471 -4.419 -5.908 1.00 0.00 C ATOM 1383 C TYR B 137 6.611 -3.446 -5.683 1.00 0.00 C ATOM 1384 O TYR B 137 7.303 -3.096 -6.627 1.00 0.00 O ATOM 1385 CB TYR B 137 4.239 -3.690 -6.519 1.00 0.00 C ATOM 1386 CG TYR B 137 4.006 -2.251 -6.038 1.00 0.00 C ATOM 1387 CD1 TYR B 137 4.811 -1.205 -6.452 1.00 0.00 C ATOM 1388 CD2 TYR B 137 2.959 -1.957 -5.172 1.00 0.00 C ATOM 1389 CE1 TYR B 137 4.601 0.090 -6.005 1.00 0.00 C ATOM 1390 CE2 TYR B 137 2.728 -0.664 -4.745 1.00 0.00 C ATOM 1391 CZ TYR B 137 3.551 0.356 -5.154 1.00 0.00 C ATOM 1392 OH TYR B 137 3.324 1.634 -4.720 1.00 0.00 O ATOM 0 H TYR B 137 4.261 -4.795 -4.226 1.00 0.00 H new ATOM 0 HA TYR B 137 5.808 -5.171 -6.622 1.00 0.00 H new ATOM 0 HB2 TYR B 137 4.350 -3.677 -7.603 1.00 0.00 H new ATOM 0 HB3 TYR B 137 3.347 -4.276 -6.297 1.00 0.00 H new ATOM 0 HD1 TYR B 137 5.621 -1.402 -7.139 1.00 0.00 H new ATOM 0 HD2 TYR B 137 2.316 -2.753 -4.827 1.00 0.00 H new ATOM 0 HE1 TYR B 137 5.257 0.887 -6.322 1.00 0.00 H new ATOM 0 HE2 TYR B 137 1.897 -0.455 -4.087 1.00 0.00 H new ATOM 0 HH TYR B 137 2.544 1.644 -4.127 1.00 0.00 H new ATOM 1402 N ILE B 138 6.790 -2.959 -4.465 1.00 0.00 N ATOM 1403 CA ILE B 138 7.930 -2.088 -4.179 1.00 0.00 C ATOM 1404 C ILE B 138 9.216 -2.906 -4.124 1.00 0.00 C ATOM 1405 O ILE B 138 10.247 -2.528 -4.679 1.00 0.00 O ATOM 1406 CB ILE B 138 7.764 -1.245 -2.876 1.00 0.00 C ATOM 1407 CG1 ILE B 138 9.115 -0.661 -2.396 1.00 0.00 C ATOM 1408 CG2 ILE B 138 7.130 -2.068 -1.768 1.00 0.00 C ATOM 1409 CD1 ILE B 138 9.769 0.266 -3.395 1.00 0.00 C ATOM 0 H ILE B 138 6.178 -3.144 -3.671 1.00 0.00 H new ATOM 0 HA ILE B 138 7.981 -1.371 -4.998 1.00 0.00 H new ATOM 0 HB ILE B 138 7.102 -0.414 -3.117 1.00 0.00 H new ATOM 0 HG12 ILE B 138 8.955 -0.120 -1.463 1.00 0.00 H new ATOM 0 HG13 ILE B 138 9.797 -1.482 -2.176 1.00 0.00 H new ATOM 0 HG21 ILE B 138 7.027 -1.455 -0.873 1.00 0.00 H new ATOM 0 HG22 ILE B 138 6.146 -2.412 -2.088 1.00 0.00 H new ATOM 0 HG23 ILE B 138 7.761 -2.929 -1.547 1.00 0.00 H new ATOM 0 HD11 ILE B 138 10.710 0.635 -2.987 1.00 0.00 H new ATOM 0 HD12 ILE B 138 9.962 -0.275 -4.321 1.00 0.00 H new ATOM 0 HD13 ILE B 138 9.107 1.108 -3.598 1.00 0.00 H new ATOM 1421 N ALA B 139 9.128 -4.082 -3.512 1.00 0.00 N ATOM 1422 CA ALA B 139 10.269 -4.994 -3.426 1.00 0.00 C ATOM 1423 C ALA B 139 10.691 -5.472 -4.813 1.00 0.00 C ATOM 1424 O ALA B 139 11.885 -5.611 -5.104 1.00 0.00 O ATOM 1425 CB ALA B 139 9.923 -6.193 -2.539 1.00 0.00 C ATOM 0 H ALA B 139 8.278 -4.429 -3.067 1.00 0.00 H new ATOM 0 HA ALA B 139 11.104 -4.452 -2.982 1.00 0.00 H new ATOM 0 HB1 ALA B 139 10.780 -6.864 -2.483 1.00 0.00 H new ATOM 0 HB2 ALA B 139 9.670 -5.844 -1.538 1.00 0.00 H new ATOM 0 HB3 ALA B 139 9.072 -6.726 -2.963 1.00 0.00 H new ATOM 1431 N ASP B 140 9.708 -5.710 -5.665 1.00 0.00 N ATOM 1432 CA ASP B 140 9.948 -6.279 -7.004 1.00 0.00 C ATOM 1433 C ASP B 140 10.304 -5.190 -8.015 1.00 0.00 C ATOM 1434 O ASP B 140 11.285 -5.317 -8.742 1.00 0.00 O ATOM 1435 CB ASP B 140 8.699 -7.038 -7.463 1.00 0.00 C ATOM 1436 CG ASP B 140 8.905 -7.769 -8.794 1.00 0.00 C ATOM 1437 OD1 ASP B 140 9.356 -8.924 -8.773 1.00 0.00 O ATOM 1438 OD2 ASP B 140 8.617 -7.176 -9.857 1.00 0.00 O ATOM 0 H ASP B 140 8.726 -5.521 -5.462 1.00 0.00 H new ATOM 0 HA ASP B 140 10.794 -6.964 -6.944 1.00 0.00 H new ATOM 0 HB2 ASP B 140 8.416 -7.760 -6.697 1.00 0.00 H new ATOM 0 HB3 ASP B 140 7.870 -6.338 -7.563 1.00 0.00 H new ATOM 1443 N ASN B 141 9.503 -4.140 -8.062 1.00 0.00 N ATOM 1444 CA ASN B 141 9.655 -3.084 -9.049 1.00 0.00 C ATOM 1445 C ASN B 141 10.761 -2.102 -8.651 1.00 0.00 C ATOM 1446 O ASN B 141 11.469 -1.575 -9.507 1.00 0.00 O ATOM 1447 CB ASN B 141 8.345 -2.310 -9.261 1.00 0.00 C ATOM 1448 CG ASN B 141 7.201 -3.127 -9.874 1.00 0.00 C ATOM 1449 OD1 ASN B 141 7.071 -4.395 -9.503 1.00 0.00 O flip ATOM 1450 ND2 ASN B 141 6.405 -2.585 -10.629 1.00 0.00 N flip ATOM 0 H ASN B 141 8.727 -3.995 -7.416 1.00 0.00 H new ATOM 0 HA ASN B 141 9.930 -3.572 -9.984 1.00 0.00 H new ATOM 0 HB2 ASN B 141 8.015 -1.915 -8.300 1.00 0.00 H new ATOM 0 HB3 ASN B 141 8.546 -1.454 -9.906 1.00 0.00 H new ATOM 0 HD21 ASN B 141 6.536 -1.609 -10.893 1.00 0.00 H new ATOM 0 HD22 ASN B 141 5.610 -3.110 -10.994 1.00 0.00 H new ATOM 1457 N GLU B 142 10.891 -1.860 -7.346 1.00 0.00 N ATOM 1458 CA GLU B 142 11.898 -0.935 -6.811 1.00 0.00 C ATOM 1459 C GLU B 142 11.853 0.424 -7.517 1.00 0.00 C ATOM 1460 O GLU B 142 12.882 0.976 -7.894 1.00 0.00 O ATOM 1461 CB GLU B 142 13.301 -1.555 -6.933 1.00 0.00 C ATOM 1462 CG GLU B 142 13.462 -2.878 -6.187 1.00 0.00 C ATOM 1463 CD GLU B 142 14.872 -3.409 -6.270 1.00 0.00 C ATOM 1464 OE1 GLU B 142 15.172 -4.170 -7.228 1.00 0.00 O ATOM 1465 OE2 GLU B 142 15.704 -3.081 -5.383 1.00 0.00 O ATOM 0 H GLU B 142 10.307 -2.295 -6.632 1.00 0.00 H new ATOM 0 HA GLU B 142 11.669 -0.765 -5.759 1.00 0.00 H new ATOM 0 HB2 GLU B 142 13.526 -1.714 -7.987 1.00 0.00 H new ATOM 0 HB3 GLU B 142 14.035 -0.844 -6.554 1.00 0.00 H new ATOM 0 HG2 GLU B 142 13.188 -2.739 -5.141 1.00 0.00 H new ATOM 0 HG3 GLU B 142 12.773 -3.614 -6.602 1.00 0.00 H new ATOM 1472 N ARG B 143 10.644 0.974 -7.674 1.00 0.00 N ATOM 1473 CA ARG B 143 10.466 2.274 -8.345 1.00 0.00 C ATOM 1474 C ARG B 143 9.316 3.082 -7.737 1.00 0.00 C ATOM 1475 O ARG B 143 9.415 4.287 -7.602 1.00 0.00 O ATOM 1476 CB ARG B 143 10.215 2.086 -9.849 1.00 0.00 C ATOM 1477 CG ARG B 143 9.089 1.093 -10.167 1.00 0.00 C ATOM 1478 CD ARG B 143 8.675 1.155 -11.637 1.00 0.00 C ATOM 1479 NE ARG B 143 7.910 2.361 -11.958 1.00 0.00 N ATOM 1480 CZ ARG B 143 7.006 2.455 -12.931 1.00 0.00 C ATOM 1481 NH1 ARG B 143 6.766 1.403 -13.713 1.00 0.00 N ATOM 1482 NH2 ARG B 143 6.319 3.577 -13.078 1.00 0.00 N ATOM 0 H ARG B 143 9.777 0.546 -7.349 1.00 0.00 H new ATOM 0 HA ARG B 143 11.392 2.830 -8.197 1.00 0.00 H new ATOM 0 HB2 ARG B 143 9.971 3.052 -10.291 1.00 0.00 H new ATOM 0 HB3 ARG B 143 11.135 1.742 -10.322 1.00 0.00 H new ATOM 0 HG2 ARG B 143 9.417 0.082 -9.924 1.00 0.00 H new ATOM 0 HG3 ARG B 143 8.226 1.308 -9.537 1.00 0.00 H new ATOM 0 HD2 ARG B 143 9.566 1.118 -12.263 1.00 0.00 H new ATOM 0 HD3 ARG B 143 8.078 0.276 -11.880 1.00 0.00 H new ATOM 0 HE ARG B 143 8.083 3.193 -11.393 1.00 0.00 H new ATOM 0 HH11 ARG B 143 7.274 0.531 -13.565 1.00 0.00 H new ATOM 0 HH12 ARG B 143 6.074 1.470 -14.460 1.00 0.00 H new ATOM 0 HH21 ARG B 143 6.484 4.362 -12.448 1.00 0.00 H new ATOM 0 HH22 ARG B 143 5.625 3.656 -13.821 1.00 0.00 H new ATOM 1496 N LEU B 144 8.222 2.384 -7.384 1.00 0.00 N ATOM 1497 CA LEU B 144 7.000 3.067 -6.901 1.00 0.00 C ATOM 1498 C LEU B 144 6.386 3.934 -8.018 1.00 0.00 C ATOM 1499 O LEU B 144 7.046 4.222 -9.022 1.00 0.00 O ATOM 1500 CB LEU B 144 7.311 3.935 -5.664 1.00 0.00 C ATOM 1501 CG LEU B 144 7.742 3.167 -4.401 1.00 0.00 C ATOM 1502 CD1 LEU B 144 8.130 4.140 -3.302 1.00 0.00 C ATOM 1503 CD2 LEU B 144 6.630 2.236 -3.934 1.00 0.00 C ATOM 0 H LEU B 144 8.154 1.367 -7.421 1.00 0.00 H new ATOM 0 HA LEU B 144 6.277 2.303 -6.615 1.00 0.00 H new ATOM 0 HB2 LEU B 144 8.101 4.639 -5.926 1.00 0.00 H new ATOM 0 HB3 LEU B 144 6.426 4.524 -5.424 1.00 0.00 H new ATOM 0 HG LEU B 144 8.612 2.557 -4.643 1.00 0.00 H new ATOM 0 HD11 LEU B 144 8.433 3.584 -2.414 1.00 0.00 H new ATOM 0 HD12 LEU B 144 8.959 4.761 -3.642 1.00 0.00 H new ATOM 0 HD13 LEU B 144 7.277 4.774 -3.060 1.00 0.00 H new ATOM 0 HD21 LEU B 144 6.954 1.702 -3.040 1.00 0.00 H new ATOM 0 HD22 LEU B 144 5.739 2.820 -3.705 1.00 0.00 H new ATOM 0 HD23 LEU B 144 6.401 1.519 -4.722 1.00 0.00 H new