USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 846 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 Set 1.1: A 66 MET CE :methyl -149:sc= -3.09! (180deg=-7.28!) USER MOD Set 1.2: A 90 MET CE :methyl 164:sc= -2.54 (180deg=-3.37!) USER MOD Single : A 2 SER OG : rot 13:sc= 0.701 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot -77:sc= 1.22 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc= -0.0636 K(o=-0.064,f=-1.2) USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=-0.048) USER MOD Single : A 30 TYR OH : rot 180:sc= -0.67 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot -160:sc= -1.32 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 46 MET CE :methyl 153:sc= -1.59 (180deg=-3.01!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= -0.15 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc=-0.00662 USER MOD Single : A 71 MET CE :methyl 138:sc= -2.08 (180deg=-7.3!) USER MOD Single : A 76 THR OG1 : rot -72:sc= 0.333 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl -164:sc= -0.0985 (180deg=-0.877) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.434 X(o=-0.43,f=-0.51) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N SER A 2 0.768 -2.154 -1.420 1.00 0.00 N ATOM 19 CA SER A 2 0.262 -3.251 -2.236 1.00 0.00 C ATOM 20 C SER A 2 -1.210 -3.518 -1.934 1.00 0.00 C ATOM 21 O SER A 2 -1.636 -3.480 -0.779 1.00 0.00 O ATOM 22 CB SER A 2 1.083 -4.519 -1.989 1.00 0.00 C ATOM 23 OG SER A 2 2.342 -4.207 -1.418 1.00 0.00 O ATOM 0 HA SER A 2 0.354 -2.965 -3.284 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.535 -5.188 -1.325 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.228 -5.051 -2.929 1.00 0.00 H new ATOM 0 HG SER A 2 2.341 -3.276 -1.113 1.00 0.00 H new ATOM 29 N LEU A 3 -1.981 -3.789 -2.981 1.00 0.00 N ATOM 30 CA LEU A 3 -3.406 -4.063 -2.831 1.00 0.00 C ATOM 31 C LEU A 3 -3.705 -5.540 -3.067 1.00 0.00 C ATOM 32 O LEU A 3 -3.131 -6.166 -3.959 1.00 0.00 O ATOM 33 CB LEU A 3 -4.216 -3.206 -3.804 1.00 0.00 C ATOM 34 CG LEU A 3 -4.359 -1.728 -3.438 1.00 0.00 C ATOM 35 CD1 LEU A 3 -4.218 -0.855 -4.676 1.00 0.00 C ATOM 36 CD2 LEU A 3 -5.694 -1.474 -2.753 1.00 0.00 C ATOM 0 H LEU A 3 -1.644 -3.825 -3.943 1.00 0.00 H new ATOM 0 HA LEU A 3 -3.693 -3.812 -1.810 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -3.752 -3.273 -4.788 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -5.214 -3.636 -3.892 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.561 -1.468 -2.742 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.323 0.193 -4.396 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -3.237 -1.015 -5.124 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -4.993 -1.117 -5.396 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.778 -0.417 -2.500 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.506 -1.752 -3.425 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -5.755 -2.071 -1.843 1.00 0.00 H new ATOM 48 N LYS A 4 -4.608 -6.092 -2.263 1.00 0.00 N ATOM 49 CA LYS A 4 -4.986 -7.495 -2.386 1.00 0.00 C ATOM 50 C LYS A 4 -5.595 -7.776 -3.756 1.00 0.00 C ATOM 51 O LYS A 4 -5.384 -8.844 -4.332 1.00 0.00 O ATOM 52 CB LYS A 4 -5.982 -7.874 -1.287 1.00 0.00 C ATOM 53 CG LYS A 4 -5.486 -8.980 -0.372 1.00 0.00 C ATOM 54 CD LYS A 4 -6.577 -9.454 0.572 1.00 0.00 C ATOM 55 CE LYS A 4 -6.381 -8.898 1.975 1.00 0.00 C ATOM 56 NZ LYS A 4 -5.308 -9.621 2.712 1.00 0.00 N ATOM 0 H LYS A 4 -5.092 -5.589 -1.519 1.00 0.00 H new ATOM 0 HA LYS A 4 -4.085 -8.099 -2.277 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.203 -6.990 -0.688 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -6.918 -8.188 -1.749 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -5.133 -9.819 -0.972 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -4.634 -8.621 0.206 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -7.550 -9.145 0.190 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -6.580 -10.543 0.608 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -6.130 -7.839 1.914 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -7.316 -8.973 2.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -5.205 -9.213 3.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -5.559 -10.627 2.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -4.410 -9.528 2.196 1.00 0.00 H new ATOM 70 N SER A 5 -6.348 -6.811 -4.274 1.00 0.00 N ATOM 71 CA SER A 5 -6.988 -6.957 -5.576 1.00 0.00 C ATOM 72 C SER A 5 -5.946 -7.116 -6.679 1.00 0.00 C ATOM 73 O SER A 5 -6.247 -7.609 -7.766 1.00 0.00 O ATOM 74 CB SER A 5 -7.877 -5.747 -5.869 1.00 0.00 C ATOM 75 OG SER A 5 -7.111 -4.557 -5.943 1.00 0.00 O ATOM 0 H SER A 5 -6.530 -5.920 -3.812 1.00 0.00 H new ATOM 0 HA SER A 5 -7.605 -7.855 -5.551 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.407 -5.901 -6.809 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.632 -5.649 -5.089 1.00 0.00 H new ATOM 0 HG SER A 5 -6.871 -4.266 -5.039 1.00 0.00 H new ATOM 81 N ASP A 6 -4.720 -6.694 -6.391 1.00 0.00 N ATOM 82 CA ASP A 6 -3.632 -6.789 -7.357 1.00 0.00 C ATOM 83 C ASP A 6 -3.470 -8.223 -7.853 1.00 0.00 C ATOM 84 O ASP A 6 -3.275 -8.458 -9.045 1.00 0.00 O ATOM 85 CB ASP A 6 -2.323 -6.302 -6.733 1.00 0.00 C ATOM 86 CG ASP A 6 -1.345 -5.784 -7.769 1.00 0.00 C ATOM 87 OD1 ASP A 6 -0.574 -6.600 -8.316 1.00 0.00 O ATOM 88 OD2 ASP A 6 -1.350 -4.563 -8.033 1.00 0.00 O ATOM 0 H ASP A 6 -4.455 -6.283 -5.496 1.00 0.00 H new ATOM 0 HA ASP A 6 -3.878 -6.154 -8.208 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -2.539 -5.512 -6.014 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.862 -7.120 -6.179 1.00 0.00 H new ATOM 93 N GLU A 7 -3.551 -9.176 -6.930 1.00 0.00 N ATOM 94 CA GLU A 7 -3.411 -10.586 -7.275 1.00 0.00 C ATOM 95 C GLU A 7 -4.517 -11.024 -8.231 1.00 0.00 C ATOM 96 O GLU A 7 -4.252 -11.642 -9.262 1.00 0.00 O ATOM 97 CB GLU A 7 -3.443 -11.448 -6.012 1.00 0.00 C ATOM 98 CG GLU A 7 -2.615 -10.885 -4.869 1.00 0.00 C ATOM 99 CD GLU A 7 -2.257 -11.934 -3.835 1.00 0.00 C ATOM 100 OE1 GLU A 7 -3.042 -12.121 -2.882 1.00 0.00 O ATOM 101 OE2 GLU A 7 -1.191 -12.569 -3.979 1.00 0.00 O ATOM 0 H GLU A 7 -3.713 -8.998 -5.939 1.00 0.00 H new ATOM 0 HA GLU A 7 -2.450 -10.719 -7.773 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -4.476 -11.556 -5.682 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -3.080 -12.447 -6.255 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -1.700 -10.448 -5.269 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -3.169 -10.079 -4.387 1.00 0.00 H new ATOM 108 N VAL A 8 -5.757 -10.700 -7.880 1.00 0.00 N ATOM 109 CA VAL A 8 -6.904 -11.059 -8.706 1.00 0.00 C ATOM 110 C VAL A 8 -6.788 -10.454 -10.101 1.00 0.00 C ATOM 111 O VAL A 8 -6.910 -11.155 -11.105 1.00 0.00 O ATOM 112 CB VAL A 8 -8.225 -10.594 -8.065 1.00 0.00 C ATOM 113 CG1 VAL A 8 -9.408 -10.983 -8.938 1.00 0.00 C ATOM 114 CG2 VAL A 8 -8.371 -11.174 -6.666 1.00 0.00 C ATOM 0 H VAL A 8 -5.993 -10.189 -7.029 1.00 0.00 H new ATOM 0 HA VAL A 8 -6.910 -12.146 -8.784 1.00 0.00 H new ATOM 0 HB VAL A 8 -8.206 -9.507 -7.983 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.333 -10.646 -8.469 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.307 -10.515 -9.917 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.434 -12.066 -9.054 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.310 -10.835 -6.228 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.368 -12.263 -6.721 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.540 -10.840 -6.045 1.00 0.00 H new ATOM 124 N PHE A 9 -6.551 -9.147 -10.155 1.00 0.00 N ATOM 125 CA PHE A 9 -6.418 -8.446 -11.426 1.00 0.00 C ATOM 126 C PHE A 9 -5.264 -9.018 -12.245 1.00 0.00 C ATOM 127 O PHE A 9 -5.333 -9.087 -13.471 1.00 0.00 O ATOM 128 CB PHE A 9 -6.198 -6.951 -11.188 1.00 0.00 C ATOM 129 CG PHE A 9 -7.466 -6.146 -11.224 1.00 0.00 C ATOM 130 CD1 PHE A 9 -8.566 -6.527 -10.473 1.00 0.00 C ATOM 131 CD2 PHE A 9 -7.557 -5.007 -12.008 1.00 0.00 C ATOM 132 CE1 PHE A 9 -9.733 -5.788 -10.505 1.00 0.00 C ATOM 133 CE2 PHE A 9 -8.722 -4.264 -12.044 1.00 0.00 C ATOM 134 CZ PHE A 9 -9.811 -4.654 -11.290 1.00 0.00 C ATOM 0 H PHE A 9 -6.447 -8.552 -9.333 1.00 0.00 H new ATOM 0 HA PHE A 9 -7.342 -8.585 -11.987 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -5.716 -6.812 -10.220 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -5.512 -6.568 -11.943 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -8.511 -7.411 -9.856 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -6.707 -4.696 -12.598 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -10.584 -6.097 -9.916 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -8.780 -3.380 -12.661 1.00 0.00 H new ATOM 0 HZ PHE A 9 -10.722 -4.074 -11.314 1.00 0.00 H new ATOM 144 N ALA A 10 -4.203 -9.425 -11.556 1.00 0.00 N ATOM 145 CA ALA A 10 -3.034 -9.992 -12.217 1.00 0.00 C ATOM 146 C ALA A 10 -3.383 -11.297 -12.925 1.00 0.00 C ATOM 147 O ALA A 10 -2.999 -11.514 -14.075 1.00 0.00 O ATOM 148 CB ALA A 10 -1.916 -10.217 -11.211 1.00 0.00 C ATOM 0 H ALA A 10 -4.129 -9.373 -10.540 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.692 -9.281 -12.969 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -1.050 -10.641 -11.719 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.640 -9.266 -10.755 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.256 -10.906 -10.437 1.00 0.00 H new ATOM 154 N LYS A 11 -4.111 -12.165 -12.230 1.00 0.00 N ATOM 155 CA LYS A 11 -4.512 -13.449 -12.791 1.00 0.00 C ATOM 156 C LYS A 11 -5.370 -13.255 -14.038 1.00 0.00 C ATOM 157 O LYS A 11 -5.325 -14.063 -14.966 1.00 0.00 O ATOM 158 CB LYS A 11 -5.283 -14.265 -11.751 1.00 0.00 C ATOM 159 CG LYS A 11 -4.635 -14.266 -10.377 1.00 0.00 C ATOM 160 CD LYS A 11 -4.600 -15.662 -9.778 1.00 0.00 C ATOM 161 CE LYS A 11 -4.134 -15.636 -8.331 1.00 0.00 C ATOM 162 NZ LYS A 11 -5.273 -15.762 -7.379 1.00 0.00 N ATOM 0 H LYS A 11 -4.435 -12.002 -11.277 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.609 -13.991 -13.073 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.294 -13.867 -11.666 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -5.373 -15.293 -12.102 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.620 -13.876 -10.452 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -5.185 -13.598 -9.714 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.593 -16.108 -9.834 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.933 -16.294 -10.365 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -3.428 -16.449 -8.162 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -3.601 -14.705 -8.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -4.914 -15.740 -6.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.934 -14.972 -7.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -5.767 -16.662 -7.546 1.00 0.00 H new ATOM 176 N ILE A 12 -6.149 -12.178 -14.052 1.00 0.00 N ATOM 177 CA ILE A 12 -7.014 -11.877 -15.186 1.00 0.00 C ATOM 178 C ILE A 12 -6.196 -11.584 -16.439 1.00 0.00 C ATOM 179 O ILE A 12 -6.390 -12.211 -17.480 1.00 0.00 O ATOM 180 CB ILE A 12 -7.930 -10.675 -14.891 1.00 0.00 C ATOM 181 CG1 ILE A 12 -8.850 -10.985 -13.708 1.00 0.00 C ATOM 182 CG2 ILE A 12 -8.746 -10.316 -16.124 1.00 0.00 C ATOM 183 CD1 ILE A 12 -9.771 -12.160 -13.950 1.00 0.00 C ATOM 0 H ILE A 12 -6.199 -11.500 -13.291 1.00 0.00 H new ATOM 0 HA ILE A 12 -7.630 -12.760 -15.356 1.00 0.00 H new ATOM 0 HB ILE A 12 -7.308 -9.819 -14.629 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -8.240 -11.187 -12.827 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -9.450 -10.103 -13.484 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -9.389 -9.465 -15.900 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -8.074 -10.058 -16.943 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -9.361 -11.168 -16.414 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -10.394 -12.322 -13.070 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -10.407 -11.953 -14.811 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -9.178 -13.054 -14.144 1.00 0.00 H new ATOM 195 N ALA A 13 -5.280 -10.627 -16.330 1.00 0.00 N ATOM 196 CA ALA A 13 -4.430 -10.252 -17.453 1.00 0.00 C ATOM 197 C ALA A 13 -3.812 -11.483 -18.108 1.00 0.00 C ATOM 198 O ALA A 13 -3.895 -11.660 -19.324 1.00 0.00 O ATOM 199 CB ALA A 13 -3.341 -9.293 -16.994 1.00 0.00 C ATOM 0 H ALA A 13 -5.108 -10.098 -15.475 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.051 -9.750 -18.195 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -2.714 -9.021 -17.843 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -3.798 -8.395 -16.579 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -2.730 -9.775 -16.231 1.00 0.00 H new ATOM 205 N LYS A 14 -3.191 -12.331 -17.295 1.00 0.00 N ATOM 206 CA LYS A 14 -2.558 -13.546 -17.794 1.00 0.00 C ATOM 207 C LYS A 14 -3.583 -14.460 -18.458 1.00 0.00 C ATOM 208 O LYS A 14 -3.259 -15.202 -19.385 1.00 0.00 O ATOM 209 CB LYS A 14 -1.860 -14.288 -16.652 1.00 0.00 C ATOM 210 CG LYS A 14 -0.649 -13.556 -16.101 1.00 0.00 C ATOM 211 CD LYS A 14 0.312 -14.509 -15.411 1.00 0.00 C ATOM 212 CE LYS A 14 1.425 -13.758 -14.697 1.00 0.00 C ATOM 213 NZ LYS A 14 2.446 -14.683 -14.132 1.00 0.00 N ATOM 0 H LYS A 14 -3.113 -12.199 -16.287 1.00 0.00 H new ATOM 0 HA LYS A 14 -1.816 -13.260 -18.540 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -2.574 -14.450 -15.845 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -1.550 -15.272 -17.005 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -0.133 -13.042 -16.912 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -0.975 -12.792 -15.395 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.234 -15.121 -14.693 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.743 -15.188 -16.146 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.904 -13.071 -15.394 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.999 -13.154 -13.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.187 -14.132 -13.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.994 -15.323 -13.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.871 -15.242 -14.899 1.00 0.00 H new ATOM 227 N ARG A 15 -4.821 -14.400 -17.977 1.00 0.00 N ATOM 228 CA ARG A 15 -5.893 -15.223 -18.524 1.00 0.00 C ATOM 229 C ARG A 15 -6.395 -14.652 -19.847 1.00 0.00 C ATOM 230 O ARG A 15 -6.789 -15.396 -20.747 1.00 0.00 O ATOM 231 CB ARG A 15 -7.050 -15.320 -17.527 1.00 0.00 C ATOM 232 CG ARG A 15 -7.594 -16.729 -17.361 1.00 0.00 C ATOM 233 CD ARG A 15 -6.562 -17.656 -16.739 1.00 0.00 C ATOM 234 NE ARG A 15 -6.929 -18.050 -15.381 1.00 0.00 N ATOM 235 CZ ARG A 15 -6.426 -19.114 -14.764 1.00 0.00 C ATOM 236 NH1 ARG A 15 -5.540 -19.885 -15.379 1.00 0.00 N ATOM 237 NH2 ARG A 15 -6.809 -19.407 -13.528 1.00 0.00 N ATOM 0 H ARG A 15 -5.106 -13.791 -17.210 1.00 0.00 H new ATOM 0 HA ARG A 15 -5.494 -16.221 -18.706 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -6.715 -14.953 -16.557 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -7.857 -14.664 -17.855 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -8.486 -16.704 -16.735 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -7.897 -17.120 -18.332 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.454 -18.546 -17.358 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -5.592 -17.160 -16.723 1.00 0.00 H new ATOM 0 HE ARG A 15 -7.608 -17.478 -14.879 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -5.242 -19.662 -16.329 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -5.156 -20.701 -14.902 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -7.490 -18.816 -13.051 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -6.423 -20.224 -13.055 1.00 0.00 H new ATOM 251 N LEU A 16 -6.380 -13.328 -19.958 1.00 0.00 N ATOM 252 CA LEU A 16 -6.833 -12.657 -21.171 1.00 0.00 C ATOM 253 C LEU A 16 -5.899 -12.954 -22.340 1.00 0.00 C ATOM 254 O LEU A 16 -6.240 -12.708 -23.497 1.00 0.00 O ATOM 255 CB LEU A 16 -6.917 -11.147 -20.941 1.00 0.00 C ATOM 256 CG LEU A 16 -7.895 -10.686 -19.860 1.00 0.00 C ATOM 257 CD1 LEU A 16 -8.200 -9.204 -20.012 1.00 0.00 C ATOM 258 CD2 LEU A 16 -9.177 -11.504 -19.917 1.00 0.00 C ATOM 0 H LEU A 16 -6.059 -12.698 -19.223 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.825 -13.037 -21.418 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.923 -10.783 -20.682 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.195 -10.671 -21.881 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.430 -10.842 -18.887 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.898 -8.894 -19.234 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.277 -8.631 -19.921 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.644 -9.022 -20.991 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.861 -11.162 -19.141 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.645 -11.380 -20.894 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -8.944 -12.557 -19.758 1.00 0.00 H new ATOM 270 N GLU A 17 -4.721 -13.486 -22.029 1.00 0.00 N ATOM 271 CA GLU A 17 -3.739 -13.817 -23.055 1.00 0.00 C ATOM 272 C GLU A 17 -4.104 -15.122 -23.757 1.00 0.00 C ATOM 273 O GLU A 17 -3.592 -15.424 -24.834 1.00 0.00 O ATOM 274 CB GLU A 17 -2.343 -13.931 -22.438 1.00 0.00 C ATOM 275 CG GLU A 17 -1.708 -12.588 -22.117 1.00 0.00 C ATOM 276 CD GLU A 17 -0.213 -12.575 -22.370 1.00 0.00 C ATOM 277 OE1 GLU A 17 0.419 -13.646 -22.252 1.00 0.00 O ATOM 278 OE2 GLU A 17 0.325 -11.493 -22.685 1.00 0.00 O ATOM 0 H GLU A 17 -4.424 -13.697 -21.076 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.738 -13.015 -23.793 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.406 -14.521 -21.524 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -1.695 -14.475 -23.125 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.182 -11.813 -22.720 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.898 -12.341 -21.073 1.00 0.00 H new ATOM 285 N SER A 18 -4.994 -15.891 -23.137 1.00 0.00 N ATOM 286 CA SER A 18 -5.425 -17.166 -23.699 1.00 0.00 C ATOM 287 C SER A 18 -6.670 -16.985 -24.563 1.00 0.00 C ATOM 288 O SER A 18 -7.109 -17.915 -25.240 1.00 0.00 O ATOM 289 CB SER A 18 -5.708 -18.171 -22.581 1.00 0.00 C ATOM 290 OG SER A 18 -5.160 -19.441 -22.887 1.00 0.00 O ATOM 0 H SER A 18 -5.430 -15.653 -22.246 1.00 0.00 H new ATOM 0 HA SER A 18 -4.620 -17.549 -24.327 1.00 0.00 H new ATOM 0 HB2 SER A 18 -5.287 -17.806 -21.644 1.00 0.00 H new ATOM 0 HB3 SER A 18 -6.784 -18.262 -22.433 1.00 0.00 H new ATOM 0 HG SER A 18 -5.353 -20.065 -22.156 1.00 0.00 H new ATOM 296 N ILE A 19 -7.233 -15.782 -24.534 1.00 0.00 N ATOM 297 CA ILE A 19 -8.426 -15.478 -25.314 1.00 0.00 C ATOM 298 C ILE A 19 -8.196 -15.747 -26.797 1.00 0.00 C ATOM 299 O ILE A 19 -7.107 -15.509 -27.320 1.00 0.00 O ATOM 300 CB ILE A 19 -8.860 -14.011 -25.131 1.00 0.00 C ATOM 301 CG1 ILE A 19 -9.067 -13.699 -23.648 1.00 0.00 C ATOM 302 CG2 ILE A 19 -10.131 -13.733 -25.920 1.00 0.00 C ATOM 303 CD1 ILE A 19 -9.363 -12.242 -23.373 1.00 0.00 C ATOM 0 H ILE A 19 -6.882 -15.002 -23.979 1.00 0.00 H new ATOM 0 HA ILE A 19 -9.218 -16.131 -24.947 1.00 0.00 H new ATOM 0 HB ILE A 19 -8.071 -13.363 -25.512 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -9.889 -14.306 -23.269 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.174 -13.990 -23.096 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -10.425 -12.693 -25.781 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -9.951 -13.921 -26.978 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -10.929 -14.386 -25.567 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -9.498 -12.094 -22.302 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -8.531 -11.630 -23.722 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -10.273 -11.950 -23.897 1.00 0.00 H new ATOM 315 N ASP A 20 -9.228 -16.243 -27.470 1.00 0.00 N ATOM 316 CA ASP A 20 -9.140 -16.542 -28.895 1.00 0.00 C ATOM 317 C ASP A 20 -10.140 -15.706 -29.688 1.00 0.00 C ATOM 318 O ASP A 20 -11.182 -15.292 -29.180 1.00 0.00 O ATOM 319 CB ASP A 20 -9.392 -18.030 -29.142 1.00 0.00 C ATOM 320 CG ASP A 20 -8.203 -18.720 -29.781 1.00 0.00 C ATOM 321 OD1 ASP A 20 -7.057 -18.400 -29.402 1.00 0.00 O ATOM 322 OD2 ASP A 20 -8.418 -19.579 -30.662 1.00 0.00 O ATOM 0 H ASP A 20 -10.136 -16.447 -27.052 1.00 0.00 H new ATOM 0 HA ASP A 20 -8.135 -16.291 -29.233 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -9.626 -18.518 -28.196 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -10.264 -18.146 -29.785 1.00 0.00 H new ATOM 327 N PRO A 21 -9.816 -15.450 -30.964 1.00 0.00 N ATOM 328 CA PRO A 21 -10.672 -14.660 -31.855 1.00 0.00 C ATOM 329 C PRO A 21 -11.956 -15.395 -32.226 1.00 0.00 C ATOM 330 O PRO A 21 -12.965 -14.772 -32.555 1.00 0.00 O ATOM 331 CB PRO A 21 -9.798 -14.452 -33.094 1.00 0.00 C ATOM 332 CG PRO A 21 -8.847 -15.600 -33.084 1.00 0.00 C ATOM 333 CD PRO A 21 -8.590 -15.911 -31.636 1.00 0.00 C ATOM 0 HA PRO A 21 -11.000 -13.732 -31.388 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -10.397 -14.442 -34.004 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -9.270 -13.500 -33.050 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -9.270 -16.462 -33.599 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -7.921 -15.344 -33.599 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.422 -16.976 -31.478 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -7.708 -15.390 -31.264 1.00 0.00 H new ATOM 341 N ALA A 22 -11.911 -16.722 -32.169 1.00 0.00 N ATOM 342 CA ALA A 22 -13.071 -17.540 -32.496 1.00 0.00 C ATOM 343 C ALA A 22 -14.248 -17.216 -31.582 1.00 0.00 C ATOM 344 O ALA A 22 -15.339 -16.893 -32.049 1.00 0.00 O ATOM 345 CB ALA A 22 -12.719 -19.017 -32.403 1.00 0.00 C ATOM 0 H ALA A 22 -11.083 -17.253 -31.899 1.00 0.00 H new ATOM 0 HA ALA A 22 -13.367 -17.312 -33.520 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -13.595 -19.616 -32.650 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -11.915 -19.244 -33.103 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -12.394 -19.250 -31.389 1.00 0.00 H new ATOM 351 N ASN A 23 -14.018 -17.305 -30.276 1.00 0.00 N ATOM 352 CA ASN A 23 -15.060 -17.022 -29.295 1.00 0.00 C ATOM 353 C ASN A 23 -14.904 -15.615 -28.727 1.00 0.00 C ATOM 354 O ASN A 23 -13.915 -15.308 -28.062 1.00 0.00 O ATOM 355 CB ASN A 23 -15.015 -18.049 -28.162 1.00 0.00 C ATOM 356 CG ASN A 23 -16.059 -19.136 -28.325 1.00 0.00 C ATOM 357 OD1 ASN A 23 -17.181 -19.013 -27.834 1.00 0.00 O ATOM 358 ND2 ASN A 23 -15.693 -20.209 -29.017 1.00 0.00 N ATOM 0 H ASN A 23 -13.120 -17.571 -29.872 1.00 0.00 H new ATOM 0 HA ASN A 23 -16.025 -17.087 -29.798 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -14.025 -18.503 -28.126 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -15.168 -17.542 -27.209 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -16.353 -20.974 -29.159 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -14.752 -20.268 -29.406 1.00 0.00 H new ATOM 365 N ARG A 24 -15.889 -14.763 -28.995 1.00 0.00 N ATOM 366 CA ARG A 24 -15.862 -13.388 -28.512 1.00 0.00 C ATOM 367 C ARG A 24 -17.215 -12.713 -28.716 1.00 0.00 C ATOM 368 O ARG A 24 -17.403 -11.953 -29.665 1.00 0.00 O ATOM 369 CB ARG A 24 -14.770 -12.593 -29.231 1.00 0.00 C ATOM 370 CG ARG A 24 -13.485 -12.462 -28.431 1.00 0.00 C ATOM 371 CD ARG A 24 -12.719 -11.204 -28.809 1.00 0.00 C ATOM 372 NE ARG A 24 -11.917 -11.393 -30.015 1.00 0.00 N ATOM 373 CZ ARG A 24 -10.981 -10.540 -30.416 1.00 0.00 C ATOM 374 NH1 ARG A 24 -10.730 -9.446 -29.710 1.00 0.00 N ATOM 375 NH2 ARG A 24 -10.293 -10.781 -31.525 1.00 0.00 N ATOM 0 H ARG A 24 -16.715 -15.001 -29.544 1.00 0.00 H new ATOM 0 HA ARG A 24 -15.643 -13.409 -27.444 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -14.548 -13.076 -30.183 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -15.149 -11.597 -29.460 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -13.718 -12.441 -27.367 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -12.858 -13.337 -28.603 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -13.421 -10.385 -28.965 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -12.069 -10.913 -27.983 1.00 0.00 H new ATOM 0 HE ARG A 24 -12.085 -12.225 -30.580 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -11.256 -9.258 -28.857 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -10.011 -8.793 -30.020 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -10.483 -11.622 -32.070 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -9.575 -10.125 -31.832 1.00 0.00 H new ATOM 389 N GLN A 25 -18.153 -12.997 -27.818 1.00 0.00 N ATOM 390 CA GLN A 25 -19.489 -12.418 -27.901 1.00 0.00 C ATOM 391 C GLN A 25 -19.423 -10.895 -27.910 1.00 0.00 C ATOM 392 O GLN A 25 -19.933 -10.246 -28.823 1.00 0.00 O ATOM 393 CB GLN A 25 -20.349 -12.897 -26.730 1.00 0.00 C ATOM 394 CG GLN A 25 -21.212 -14.104 -27.062 1.00 0.00 C ATOM 395 CD GLN A 25 -22.661 -13.735 -27.309 1.00 0.00 C ATOM 396 OE1 GLN A 25 -22.983 -12.575 -27.568 1.00 0.00 O ATOM 397 NE2 GLN A 25 -23.545 -14.723 -27.231 1.00 0.00 N ATOM 0 H GLN A 25 -18.013 -13.624 -27.026 1.00 0.00 H new ATOM 0 HA GLN A 25 -19.943 -12.749 -28.835 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -19.699 -13.145 -25.891 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -20.992 -12.080 -26.404 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -20.812 -14.600 -27.946 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -21.158 -14.821 -26.243 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -23.234 -15.670 -27.014 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -24.535 -14.535 -27.388 1.00 0.00 H new ATOM 406 N VAL A 26 -18.792 -10.329 -26.886 1.00 0.00 N ATOM 407 CA VAL A 26 -18.658 -8.881 -26.775 1.00 0.00 C ATOM 408 C VAL A 26 -17.529 -8.505 -25.823 1.00 0.00 C ATOM 409 O VAL A 26 -17.328 -9.152 -24.796 1.00 0.00 O ATOM 410 CB VAL A 26 -19.966 -8.233 -26.284 1.00 0.00 C ATOM 411 CG1 VAL A 26 -20.150 -8.464 -24.792 1.00 0.00 C ATOM 412 CG2 VAL A 26 -19.977 -6.746 -26.607 1.00 0.00 C ATOM 0 H VAL A 26 -18.365 -10.851 -26.121 1.00 0.00 H new ATOM 0 HA VAL A 26 -18.428 -8.507 -27.773 1.00 0.00 H new ATOM 0 HB VAL A 26 -20.801 -8.701 -26.805 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -21.079 -7.999 -24.464 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -20.190 -9.535 -24.592 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -19.313 -8.024 -24.250 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -20.908 -6.304 -26.253 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -19.135 -6.260 -26.114 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -19.896 -6.607 -27.685 1.00 0.00 H new ATOM 422 N GLU A 27 -16.794 -7.453 -26.172 1.00 0.00 N ATOM 423 CA GLU A 27 -15.684 -6.991 -25.347 1.00 0.00 C ATOM 424 C GLU A 27 -15.399 -5.512 -25.598 1.00 0.00 C ATOM 425 O GLU A 27 -15.094 -5.109 -26.721 1.00 0.00 O ATOM 426 CB GLU A 27 -14.429 -7.818 -25.632 1.00 0.00 C ATOM 427 CG GLU A 27 -14.435 -9.183 -24.965 1.00 0.00 C ATOM 428 CD GLU A 27 -14.745 -9.106 -23.482 1.00 0.00 C ATOM 429 OE1 GLU A 27 -14.214 -8.194 -22.813 1.00 0.00 O ATOM 430 OE2 GLU A 27 -15.516 -9.956 -22.991 1.00 0.00 O ATOM 0 H GLU A 27 -16.947 -6.906 -27.019 1.00 0.00 H new ATOM 0 HA GLU A 27 -15.964 -7.118 -24.301 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -14.328 -7.950 -26.709 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.554 -7.262 -25.295 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -15.173 -9.819 -25.454 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.463 -9.656 -25.105 1.00 0.00 H new ATOM 437 N HIS A 28 -15.501 -4.709 -24.544 1.00 0.00 N ATOM 438 CA HIS A 28 -15.255 -3.275 -24.648 1.00 0.00 C ATOM 439 C HIS A 28 -14.355 -2.795 -23.514 1.00 0.00 C ATOM 440 O HIS A 28 -14.115 -3.519 -22.548 1.00 0.00 O ATOM 441 CB HIS A 28 -16.576 -2.507 -24.627 1.00 0.00 C ATOM 442 CG HIS A 28 -17.208 -2.363 -25.977 1.00 0.00 C ATOM 443 ND1 HIS A 28 -16.656 -1.608 -26.990 1.00 0.00 N ATOM 444 CD2 HIS A 28 -18.351 -2.886 -26.480 1.00 0.00 C ATOM 445 CE1 HIS A 28 -17.433 -1.670 -28.056 1.00 0.00 C ATOM 446 NE2 HIS A 28 -18.468 -2.440 -27.773 1.00 0.00 N ATOM 0 H HIS A 28 -15.752 -5.027 -23.608 1.00 0.00 H new ATOM 0 HA HIS A 28 -14.749 -3.086 -25.595 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -17.273 -3.017 -23.962 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -16.403 -1.516 -24.208 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -19.042 -3.533 -25.961 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.253 -1.175 -28.999 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -19.230 -2.667 -28.412 1.00 0.00 H new ATOM 454 N VAL A 29 -13.858 -1.568 -23.639 1.00 0.00 N ATOM 455 CA VAL A 29 -12.984 -0.991 -22.625 1.00 0.00 C ATOM 456 C VAL A 29 -13.709 -0.848 -21.291 1.00 0.00 C ATOM 457 O VAL A 29 -14.842 -0.367 -21.237 1.00 0.00 O ATOM 458 CB VAL A 29 -12.455 0.389 -23.059 1.00 0.00 C ATOM 459 CG1 VAL A 29 -11.394 0.885 -22.088 1.00 0.00 C ATOM 460 CG2 VAL A 29 -11.904 0.326 -24.476 1.00 0.00 C ATOM 0 H VAL A 29 -14.046 -0.955 -24.432 1.00 0.00 H new ATOM 0 HA VAL A 29 -12.143 -1.674 -22.507 1.00 0.00 H new ATOM 0 HB VAL A 29 -13.284 1.097 -23.046 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.033 1.861 -22.411 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.825 0.970 -21.090 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -10.563 0.180 -22.065 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -11.534 1.309 -24.767 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -11.088 -0.395 -24.517 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.695 0.019 -25.160 1.00 0.00 H new ATOM 470 N TYR A 30 -13.049 -1.267 -20.217 1.00 0.00 N ATOM 471 CA TYR A 30 -13.632 -1.188 -18.883 1.00 0.00 C ATOM 472 C TYR A 30 -12.643 -0.580 -17.893 1.00 0.00 C ATOM 473 O TYR A 30 -11.461 -0.923 -17.886 1.00 0.00 O ATOM 474 CB TYR A 30 -14.059 -2.577 -18.407 1.00 0.00 C ATOM 475 CG TYR A 30 -15.404 -3.013 -18.942 1.00 0.00 C ATOM 476 CD1 TYR A 30 -16.584 -2.530 -18.388 1.00 0.00 C ATOM 477 CD2 TYR A 30 -15.496 -3.909 -20.000 1.00 0.00 C ATOM 478 CE1 TYR A 30 -17.815 -2.926 -18.873 1.00 0.00 C ATOM 479 CE2 TYR A 30 -16.723 -4.310 -20.492 1.00 0.00 C ATOM 480 CZ TYR A 30 -17.880 -3.816 -19.925 1.00 0.00 C ATOM 481 OH TYR A 30 -19.104 -4.214 -20.412 1.00 0.00 O ATOM 0 H TYR A 30 -12.110 -1.665 -20.244 1.00 0.00 H new ATOM 0 HA TYR A 30 -14.510 -0.544 -18.935 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -13.304 -3.303 -18.709 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -14.091 -2.585 -17.317 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -16.537 -1.833 -17.564 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -14.593 -4.299 -20.445 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -18.722 -2.541 -18.431 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -16.776 -5.006 -21.316 1.00 0.00 H new ATOM 0 HH TYR A 30 -18.973 -4.842 -21.153 1.00 0.00 H new ATOM 491 N LYS A 31 -13.137 0.326 -17.055 1.00 0.00 N ATOM 492 CA LYS A 31 -12.300 0.982 -16.057 1.00 0.00 C ATOM 493 C LYS A 31 -12.642 0.492 -14.653 1.00 0.00 C ATOM 494 O LYS A 31 -13.813 0.364 -14.298 1.00 0.00 O ATOM 495 CB LYS A 31 -12.474 2.501 -16.135 1.00 0.00 C ATOM 496 CG LYS A 31 -11.346 3.205 -16.868 1.00 0.00 C ATOM 497 CD LYS A 31 -10.711 4.286 -16.009 1.00 0.00 C ATOM 498 CE LYS A 31 -11.649 5.468 -15.817 1.00 0.00 C ATOM 499 NZ LYS A 31 -11.229 6.330 -14.678 1.00 0.00 N ATOM 0 H LYS A 31 -14.113 0.623 -17.047 1.00 0.00 H new ATOM 0 HA LYS A 31 -11.261 0.730 -16.268 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -13.416 2.725 -16.635 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -12.546 2.903 -15.124 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -10.588 2.477 -17.157 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.729 3.648 -17.787 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -10.444 3.870 -15.037 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -9.786 4.626 -16.475 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -11.677 6.062 -16.731 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -12.661 5.104 -15.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -11.893 7.124 -14.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -11.227 5.770 -13.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -10.273 6.699 -14.856 1.00 0.00 H new ATOM 513 N PHE A 32 -11.611 0.220 -13.860 1.00 0.00 N ATOM 514 CA PHE A 32 -11.802 -0.255 -12.494 1.00 0.00 C ATOM 515 C PHE A 32 -11.218 0.732 -11.488 1.00 0.00 C ATOM 516 O PHE A 32 -10.119 1.252 -11.679 1.00 0.00 O ATOM 517 CB PHE A 32 -11.152 -1.629 -12.315 1.00 0.00 C ATOM 518 CG PHE A 32 -11.621 -2.649 -13.312 1.00 0.00 C ATOM 519 CD1 PHE A 32 -12.869 -3.239 -13.184 1.00 0.00 C ATOM 520 CD2 PHE A 32 -10.816 -3.018 -14.377 1.00 0.00 C ATOM 521 CE1 PHE A 32 -13.302 -4.179 -14.100 1.00 0.00 C ATOM 522 CE2 PHE A 32 -11.244 -3.957 -15.296 1.00 0.00 C ATOM 523 CZ PHE A 32 -12.490 -4.537 -15.158 1.00 0.00 C ATOM 0 H PHE A 32 -10.635 0.320 -14.139 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.873 -0.340 -12.311 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.070 -1.524 -12.397 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.362 -1.993 -11.309 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.509 -2.961 -12.360 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -9.842 -2.566 -14.491 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -14.275 -4.634 -13.988 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -10.605 -4.237 -16.121 1.00 0.00 H new ATOM 0 HZ PHE A 32 -12.829 -5.269 -15.876 1.00 0.00 H new ATOM 533 N ARG A 33 -11.962 0.985 -10.416 1.00 0.00 N ATOM 534 CA ARG A 33 -11.520 1.911 -9.381 1.00 0.00 C ATOM 535 C ARG A 33 -11.283 1.179 -8.063 1.00 0.00 C ATOM 536 O ARG A 33 -12.209 0.611 -7.482 1.00 0.00 O ATOM 537 CB ARG A 33 -12.555 3.019 -9.182 1.00 0.00 C ATOM 538 CG ARG A 33 -12.177 4.332 -9.847 1.00 0.00 C ATOM 539 CD ARG A 33 -12.853 5.515 -9.171 1.00 0.00 C ATOM 540 NE ARG A 33 -13.949 6.051 -9.973 1.00 0.00 N ATOM 541 CZ ARG A 33 -13.775 6.887 -10.991 1.00 0.00 C ATOM 542 NH1 ARG A 33 -12.554 7.279 -11.329 1.00 0.00 N ATOM 543 NH2 ARG A 33 -14.822 7.332 -11.673 1.00 0.00 N ATOM 0 H ARG A 33 -12.873 0.562 -10.242 1.00 0.00 H new ATOM 0 HA ARG A 33 -10.579 2.356 -9.704 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -13.514 2.684 -9.577 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.692 3.189 -8.114 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.095 4.461 -9.811 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.460 4.303 -10.899 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -13.233 5.207 -8.197 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -12.117 6.299 -8.992 1.00 0.00 H new ATOM 0 HE ARG A 33 -14.901 5.768 -9.739 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -11.746 6.939 -10.807 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -12.423 7.921 -12.111 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -15.763 7.033 -11.416 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -14.687 7.974 -12.454 1.00 0.00 H new ATOM 557 N ILE A 34 -10.039 1.197 -7.598 1.00 0.00 N ATOM 558 CA ILE A 34 -9.681 0.536 -6.349 1.00 0.00 C ATOM 559 C ILE A 34 -9.639 1.530 -5.193 1.00 0.00 C ATOM 560 O ILE A 34 -8.877 2.498 -5.218 1.00 0.00 O ATOM 561 CB ILE A 34 -8.315 -0.168 -6.455 1.00 0.00 C ATOM 562 CG1 ILE A 34 -8.292 -1.101 -7.667 1.00 0.00 C ATOM 563 CG2 ILE A 34 -8.017 -0.940 -5.179 1.00 0.00 C ATOM 564 CD1 ILE A 34 -9.280 -2.242 -7.571 1.00 0.00 C ATOM 0 H ILE A 34 -9.262 1.662 -8.067 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.451 -0.211 -6.156 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.541 0.588 -6.587 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.505 -0.522 -8.565 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.288 -1.509 -7.782 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.049 -1.432 -5.269 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -7.997 -0.252 -4.334 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.791 -1.690 -5.018 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.208 -2.862 -8.465 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -9.055 -2.845 -6.692 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -10.291 -1.842 -7.487 1.00 0.00 H new ATOM 576 N THR A 35 -10.462 1.285 -4.178 1.00 0.00 N ATOM 577 CA THR A 35 -10.519 2.157 -3.012 1.00 0.00 C ATOM 578 C THR A 35 -9.981 1.453 -1.772 1.00 0.00 C ATOM 579 O THR A 35 -10.142 0.243 -1.615 1.00 0.00 O ATOM 580 CB THR A 35 -11.958 2.632 -2.735 1.00 0.00 C ATOM 581 OG1 THR A 35 -12.735 1.554 -2.202 1.00 0.00 O ATOM 582 CG2 THR A 35 -12.610 3.153 -4.007 1.00 0.00 C ATOM 0 H THR A 35 -11.099 0.489 -4.140 1.00 0.00 H new ATOM 0 HA THR A 35 -9.895 3.023 -3.234 1.00 0.00 H new ATOM 0 HB THR A 35 -11.916 3.443 -2.008 1.00 0.00 H new ATOM 0 HG1 THR A 35 -13.688 1.747 -2.323 1.00 0.00 H new ATOM 0 HG21 THR A 35 -13.625 3.483 -3.787 1.00 0.00 H new ATOM 0 HG22 THR A 35 -12.032 3.992 -4.395 1.00 0.00 H new ATOM 0 HG23 THR A 35 -12.640 2.358 -4.752 1.00 0.00 H new ATOM 590 N GLN A 36 -9.342 2.218 -0.893 1.00 0.00 N ATOM 591 CA GLN A 36 -8.780 1.666 0.334 1.00 0.00 C ATOM 592 C GLN A 36 -9.737 1.859 1.506 1.00 0.00 C ATOM 593 O GLN A 36 -9.817 2.942 2.084 1.00 0.00 O ATOM 594 CB GLN A 36 -7.435 2.324 0.646 1.00 0.00 C ATOM 595 CG GLN A 36 -6.366 1.341 1.096 1.00 0.00 C ATOM 596 CD GLN A 36 -4.982 1.959 1.132 1.00 0.00 C ATOM 597 OE1 GLN A 36 -4.682 2.788 1.992 1.00 0.00 O ATOM 598 NE2 GLN A 36 -4.130 1.557 0.196 1.00 0.00 N ATOM 0 H GLN A 36 -9.201 3.222 -1.008 1.00 0.00 H new ATOM 0 HA GLN A 36 -8.627 0.597 0.184 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -7.083 2.850 -0.241 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.579 3.073 1.424 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -6.618 0.965 2.088 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -6.360 0.484 0.423 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -4.422 0.868 -0.497 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -3.184 1.937 0.170 1.00 0.00 H new ATOM 607 N GLY A 37 -10.463 0.800 1.852 1.00 0.00 N ATOM 608 CA GLY A 37 -11.405 0.874 2.953 1.00 0.00 C ATOM 609 C GLY A 37 -12.701 1.557 2.562 1.00 0.00 C ATOM 610 O GLY A 37 -13.767 1.225 3.079 1.00 0.00 O ATOM 0 H GLY A 37 -10.415 -0.108 1.389 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -11.622 -0.133 3.310 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -10.949 1.415 3.782 1.00 0.00 H new ATOM 614 N GLY A 38 -12.609 2.517 1.646 1.00 0.00 N ATOM 615 CA GLY A 38 -13.790 3.235 1.204 1.00 0.00 C ATOM 616 C GLY A 38 -13.448 4.475 0.402 1.00 0.00 C ATOM 617 O GLY A 38 -14.333 5.134 -0.145 1.00 0.00 O ATOM 0 H GLY A 38 -11.738 2.810 1.203 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -14.408 2.573 0.598 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -14.384 3.520 2.072 1.00 0.00 H new ATOM 621 N LYS A 39 -12.161 4.797 0.334 1.00 0.00 N ATOM 622 CA LYS A 39 -11.703 5.967 -0.406 1.00 0.00 C ATOM 623 C LYS A 39 -10.808 5.558 -1.571 1.00 0.00 C ATOM 624 O LYS A 39 -9.818 4.849 -1.388 1.00 0.00 O ATOM 625 CB LYS A 39 -10.946 6.919 0.523 1.00 0.00 C ATOM 626 CG LYS A 39 -10.948 8.362 0.048 1.00 0.00 C ATOM 627 CD LYS A 39 -12.078 9.156 0.682 1.00 0.00 C ATOM 628 CE LYS A 39 -11.669 10.597 0.942 1.00 0.00 C ATOM 629 NZ LYS A 39 -12.621 11.563 0.327 1.00 0.00 N ATOM 0 H LYS A 39 -11.416 4.264 0.783 1.00 0.00 H new ATOM 0 HA LYS A 39 -12.578 6.479 -0.806 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -11.390 6.872 1.517 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -9.915 6.578 0.617 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.993 8.828 0.292 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -11.047 8.389 -1.037 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -12.950 9.136 0.028 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -12.373 8.686 1.620 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -11.618 10.772 2.017 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -10.669 10.768 0.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -12.307 12.534 0.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -12.651 11.413 -0.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -13.570 11.417 0.726 1.00 0.00 H new ATOM 643 N VAL A 40 -11.161 6.010 -2.770 1.00 0.00 N ATOM 644 CA VAL A 40 -10.388 5.693 -3.965 1.00 0.00 C ATOM 645 C VAL A 40 -8.903 5.957 -3.745 1.00 0.00 C ATOM 646 O VAL A 40 -8.520 6.976 -3.170 1.00 0.00 O ATOM 647 CB VAL A 40 -10.869 6.511 -5.178 1.00 0.00 C ATOM 648 CG1 VAL A 40 -10.466 7.971 -5.032 1.00 0.00 C ATOM 649 CG2 VAL A 40 -10.317 5.924 -6.469 1.00 0.00 C ATOM 0 H VAL A 40 -11.978 6.597 -2.940 1.00 0.00 H new ATOM 0 HA VAL A 40 -10.540 4.633 -4.168 1.00 0.00 H new ATOM 0 HB VAL A 40 -11.957 6.462 -5.219 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -10.814 8.533 -5.898 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -10.914 8.383 -4.128 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.381 8.044 -4.965 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -10.667 6.514 -7.316 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.228 5.941 -6.440 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -10.661 4.895 -6.577 1.00 0.00 H new ATOM 659 N VAL A 41 -8.068 5.031 -4.206 1.00 0.00 N ATOM 660 CA VAL A 41 -6.623 5.163 -4.062 1.00 0.00 C ATOM 661 C VAL A 41 -5.926 5.089 -5.415 1.00 0.00 C ATOM 662 O VAL A 41 -4.813 5.588 -5.581 1.00 0.00 O ATOM 663 CB VAL A 41 -6.049 4.071 -3.140 1.00 0.00 C ATOM 664 CG1 VAL A 41 -6.458 2.690 -3.629 1.00 0.00 C ATOM 665 CG2 VAL A 41 -4.535 4.188 -3.055 1.00 0.00 C ATOM 0 H VAL A 41 -8.368 4.181 -4.683 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.438 6.140 -3.615 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.459 4.212 -2.140 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.043 1.931 -2.965 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -7.545 2.613 -3.634 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.079 2.535 -4.639 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.146 3.409 -2.399 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.105 4.073 -4.050 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.268 5.166 -2.655 1.00 0.00 H new ATOM 675 N LYS A 42 -6.588 4.463 -6.382 1.00 0.00 N ATOM 676 CA LYS A 42 -6.034 4.324 -7.724 1.00 0.00 C ATOM 677 C LYS A 42 -7.109 3.884 -8.713 1.00 0.00 C ATOM 678 O LYS A 42 -8.202 3.482 -8.318 1.00 0.00 O ATOM 679 CB LYS A 42 -4.885 3.314 -7.721 1.00 0.00 C ATOM 680 CG LYS A 42 -3.842 3.576 -8.794 1.00 0.00 C ATOM 681 CD LYS A 42 -2.608 2.711 -8.596 1.00 0.00 C ATOM 682 CE LYS A 42 -1.732 3.240 -7.471 1.00 0.00 C ATOM 683 NZ LYS A 42 -0.376 3.619 -7.956 1.00 0.00 N ATOM 0 H LYS A 42 -7.510 4.043 -6.261 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.654 5.297 -8.036 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -4.401 3.330 -6.744 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -5.292 2.312 -7.859 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -4.272 3.379 -9.776 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.557 4.628 -8.776 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -2.911 1.688 -8.372 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.033 2.678 -9.521 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -2.210 4.107 -7.015 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.641 2.481 -6.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.191 3.975 -7.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.091 2.786 -8.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.461 4.361 -8.679 1.00 0.00 H new ATOM 697 N ASN A 43 -6.789 3.963 -10.001 1.00 0.00 N ATOM 698 CA ASN A 43 -7.727 3.572 -11.046 1.00 0.00 C ATOM 699 C ASN A 43 -7.021 2.780 -12.143 1.00 0.00 C ATOM 700 O ASN A 43 -6.020 3.230 -12.701 1.00 0.00 O ATOM 701 CB ASN A 43 -8.398 4.808 -11.647 1.00 0.00 C ATOM 702 CG ASN A 43 -7.430 5.962 -11.826 1.00 0.00 C ATOM 703 OD1 ASN A 43 -6.738 6.055 -12.840 1.00 0.00 O ATOM 704 ND2 ASN A 43 -7.377 6.848 -10.838 1.00 0.00 N ATOM 0 H ASN A 43 -5.888 4.294 -10.345 1.00 0.00 H new ATOM 0 HA ASN A 43 -8.489 2.936 -10.595 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -8.833 4.549 -12.612 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -9.219 5.122 -11.002 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -6.744 7.645 -10.902 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -7.969 6.731 -10.016 1.00 0.00 H new ATOM 711 N TRP A 44 -7.549 1.600 -12.446 1.00 0.00 N ATOM 712 CA TRP A 44 -6.969 0.745 -13.476 1.00 0.00 C ATOM 713 C TRP A 44 -7.838 0.737 -14.729 1.00 0.00 C ATOM 714 O TRP A 44 -9.058 0.887 -14.651 1.00 0.00 O ATOM 715 CB TRP A 44 -6.800 -0.681 -12.949 1.00 0.00 C ATOM 716 CG TRP A 44 -5.676 -0.821 -11.967 1.00 0.00 C ATOM 717 CD1 TRP A 44 -5.725 -0.575 -10.625 1.00 0.00 C ATOM 718 CD2 TRP A 44 -4.337 -1.240 -12.252 1.00 0.00 C ATOM 719 NE1 TRP A 44 -4.496 -0.814 -10.058 1.00 0.00 N ATOM 720 CE2 TRP A 44 -3.628 -1.225 -11.035 1.00 0.00 C ATOM 721 CE3 TRP A 44 -3.668 -1.629 -13.416 1.00 0.00 C ATOM 722 CZ2 TRP A 44 -2.285 -1.581 -10.952 1.00 0.00 C ATOM 723 CZ3 TRP A 44 -2.335 -1.982 -13.332 1.00 0.00 C ATOM 724 CH2 TRP A 44 -1.655 -1.957 -12.107 1.00 0.00 C ATOM 0 H TRP A 44 -8.377 1.213 -11.994 1.00 0.00 H new ATOM 0 HA TRP A 44 -5.990 1.146 -13.737 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -7.729 -0.998 -12.475 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -6.625 -1.353 -13.789 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.601 -0.242 -10.088 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -4.267 -0.703 -9.070 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -4.184 -1.653 -14.364 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -1.759 -1.561 -10.009 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -1.808 -2.282 -14.226 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -0.613 -2.240 -12.074 1.00 0.00 H new ATOM 735 N VAL A 45 -7.203 0.561 -15.883 1.00 0.00 N ATOM 736 CA VAL A 45 -7.919 0.532 -17.153 1.00 0.00 C ATOM 737 C VAL A 45 -7.751 -0.814 -17.849 1.00 0.00 C ATOM 738 O VAL A 45 -6.682 -1.422 -17.794 1.00 0.00 O ATOM 739 CB VAL A 45 -7.435 1.650 -18.096 1.00 0.00 C ATOM 740 CG1 VAL A 45 -8.167 1.580 -19.427 1.00 0.00 C ATOM 741 CG2 VAL A 45 -7.621 3.013 -17.446 1.00 0.00 C ATOM 0 H VAL A 45 -6.194 0.436 -15.965 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.973 0.690 -16.925 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.371 1.506 -18.286 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.812 2.377 -20.080 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -7.977 0.615 -19.896 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -9.238 1.698 -19.260 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.274 3.791 -18.126 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.677 3.169 -17.224 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -7.046 3.057 -16.521 1.00 0.00 H new ATOM 751 N MET A 46 -8.812 -1.272 -18.504 1.00 0.00 N ATOM 752 CA MET A 46 -8.781 -2.546 -19.212 1.00 0.00 C ATOM 753 C MET A 46 -8.540 -2.333 -20.703 1.00 0.00 C ATOM 754 O MET A 46 -9.424 -1.870 -21.425 1.00 0.00 O ATOM 755 CB MET A 46 -10.092 -3.305 -18.999 1.00 0.00 C ATOM 756 CG MET A 46 -9.989 -4.792 -19.300 1.00 0.00 C ATOM 757 SD MET A 46 -11.297 -5.370 -20.399 1.00 0.00 S ATOM 758 CE MET A 46 -12.562 -5.820 -19.213 1.00 0.00 C ATOM 0 H MET A 46 -9.704 -0.780 -18.559 1.00 0.00 H new ATOM 0 HA MET A 46 -7.958 -3.137 -18.809 1.00 0.00 H new ATOM 0 HB2 MET A 46 -10.415 -3.173 -17.966 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.863 -2.867 -19.633 1.00 0.00 H new ATOM 0 HG2 MET A 46 -9.020 -5.001 -19.753 1.00 0.00 H new ATOM 0 HG3 MET A 46 -10.031 -5.352 -18.366 1.00 0.00 H new ATOM 0 HE1 MET A 46 -13.544 -5.733 -19.678 1.00 0.00 H new ATOM 0 HE2 MET A 46 -12.405 -6.848 -18.886 1.00 0.00 H new ATOM 0 HE3 MET A 46 -12.508 -5.153 -18.353 1.00 0.00 H new ATOM 768 N ASP A 47 -7.339 -2.673 -21.159 1.00 0.00 N ATOM 769 CA ASP A 47 -6.983 -2.520 -22.564 1.00 0.00 C ATOM 770 C ASP A 47 -7.707 -3.551 -23.424 1.00 0.00 C ATOM 771 O ASP A 47 -7.396 -4.742 -23.379 1.00 0.00 O ATOM 772 CB ASP A 47 -5.471 -2.657 -22.747 1.00 0.00 C ATOM 773 CG ASP A 47 -4.916 -1.660 -23.746 1.00 0.00 C ATOM 774 OD1 ASP A 47 -5.614 -1.362 -24.737 1.00 0.00 O ATOM 775 OD2 ASP A 47 -3.782 -1.179 -23.537 1.00 0.00 O ATOM 0 H ASP A 47 -6.596 -3.057 -20.575 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.291 -1.525 -22.885 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -4.977 -2.517 -21.785 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -5.238 -3.668 -23.080 1.00 0.00 H new ATOM 780 N LEU A 48 -8.675 -3.086 -24.207 1.00 0.00 N ATOM 781 CA LEU A 48 -9.445 -3.969 -25.077 1.00 0.00 C ATOM 782 C LEU A 48 -8.707 -4.220 -26.388 1.00 0.00 C ATOM 783 O LEU A 48 -8.902 -5.248 -27.036 1.00 0.00 O ATOM 784 CB LEU A 48 -10.821 -3.363 -25.361 1.00 0.00 C ATOM 785 CG LEU A 48 -11.986 -4.351 -25.433 1.00 0.00 C ATOM 786 CD1 LEU A 48 -11.785 -5.331 -26.578 1.00 0.00 C ATOM 787 CD2 LEU A 48 -12.138 -5.093 -24.114 1.00 0.00 C ATOM 0 H LEU A 48 -8.945 -2.104 -24.257 1.00 0.00 H new ATOM 0 HA LEU A 48 -9.573 -4.923 -24.565 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -11.040 -2.629 -24.585 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -10.770 -2.822 -26.306 1.00 0.00 H new ATOM 0 HG LEU A 48 -12.902 -3.790 -25.619 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -12.624 -6.026 -26.613 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -11.727 -4.784 -27.519 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -10.860 -5.886 -26.423 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -12.972 -5.792 -24.184 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -11.222 -5.642 -23.898 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -12.330 -4.378 -23.314 1.00 0.00 H new ATOM 799 N LYS A 49 -7.856 -3.274 -26.773 1.00 0.00 N ATOM 800 CA LYS A 49 -7.085 -3.393 -28.005 1.00 0.00 C ATOM 801 C LYS A 49 -5.934 -4.380 -27.833 1.00 0.00 C ATOM 802 O LYS A 49 -5.639 -5.166 -28.733 1.00 0.00 O ATOM 803 CB LYS A 49 -6.540 -2.026 -28.423 1.00 0.00 C ATOM 804 CG LYS A 49 -7.142 -1.500 -29.715 1.00 0.00 C ATOM 805 CD LYS A 49 -8.231 -0.475 -29.445 1.00 0.00 C ATOM 806 CE LYS A 49 -8.425 0.457 -30.631 1.00 0.00 C ATOM 807 NZ LYS A 49 -9.276 -0.159 -31.687 1.00 0.00 N ATOM 0 H LYS A 49 -7.683 -2.416 -26.249 1.00 0.00 H new ATOM 0 HA LYS A 49 -7.748 -3.767 -28.785 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -6.731 -1.309 -27.625 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -5.458 -2.095 -28.538 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -6.359 -1.049 -30.325 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -7.556 -2.329 -30.289 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -9.168 -0.987 -29.226 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.972 0.108 -28.561 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -8.883 1.386 -30.292 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -7.454 0.716 -31.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -9.384 0.507 -32.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -8.827 -1.032 -32.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -10.212 -0.383 -31.292 1.00 0.00 H new ATOM 821 N ASN A 50 -5.290 -4.335 -26.672 1.00 0.00 N ATOM 822 CA ASN A 50 -4.172 -5.226 -26.383 1.00 0.00 C ATOM 823 C ASN A 50 -4.626 -6.411 -25.537 1.00 0.00 C ATOM 824 O ASN A 50 -3.907 -7.400 -25.396 1.00 0.00 O ATOM 825 CB ASN A 50 -3.060 -4.465 -25.659 1.00 0.00 C ATOM 826 CG ASN A 50 -1.891 -4.143 -26.570 1.00 0.00 C ATOM 827 OD1 ASN A 50 -0.771 -4.603 -26.349 1.00 0.00 O ATOM 828 ND2 ASN A 50 -2.148 -3.348 -27.603 1.00 0.00 N ATOM 0 H ASN A 50 -5.523 -3.691 -25.916 1.00 0.00 H new ATOM 0 HA ASN A 50 -3.787 -5.604 -27.330 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -3.464 -3.539 -25.250 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -2.707 -5.059 -24.816 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -1.402 -3.096 -28.251 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -3.092 -2.989 -27.748 1.00 0.00 H new ATOM 835 N VAL A 51 -5.827 -6.305 -24.975 1.00 0.00 N ATOM 836 CA VAL A 51 -6.379 -7.368 -24.144 1.00 0.00 C ATOM 837 C VAL A 51 -5.549 -7.565 -22.880 1.00 0.00 C ATOM 838 O VAL A 51 -5.362 -8.690 -22.415 1.00 0.00 O ATOM 839 CB VAL A 51 -6.449 -8.702 -24.912 1.00 0.00 C ATOM 840 CG1 VAL A 51 -7.412 -9.661 -24.229 1.00 0.00 C ATOM 841 CG2 VAL A 51 -6.857 -8.462 -26.357 1.00 0.00 C ATOM 0 H VAL A 51 -6.436 -5.493 -25.081 1.00 0.00 H new ATOM 0 HA VAL A 51 -7.388 -7.062 -23.868 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.458 -9.157 -24.909 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.449 -10.598 -24.785 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -7.071 -9.856 -23.212 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.407 -9.218 -24.199 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.902 -9.414 -26.885 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.837 -7.986 -26.384 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.125 -7.814 -26.839 1.00 0.00 H new ATOM 851 N LYS A 52 -5.053 -6.464 -22.327 1.00 0.00 N ATOM 852 CA LYS A 52 -4.243 -6.513 -21.116 1.00 0.00 C ATOM 853 C LYS A 52 -4.670 -5.428 -20.132 1.00 0.00 C ATOM 854 O LYS A 52 -5.361 -4.478 -20.501 1.00 0.00 O ATOM 855 CB LYS A 52 -2.761 -6.349 -21.460 1.00 0.00 C ATOM 856 CG LYS A 52 -1.826 -6.754 -20.334 1.00 0.00 C ATOM 857 CD LYS A 52 -0.629 -7.531 -20.854 1.00 0.00 C ATOM 858 CE LYS A 52 0.682 -6.891 -20.424 1.00 0.00 C ATOM 859 NZ LYS A 52 1.027 -5.714 -21.268 1.00 0.00 N ATOM 0 H LYS A 52 -5.198 -5.525 -22.699 1.00 0.00 H new ATOM 0 HA LYS A 52 -4.395 -7.485 -20.647 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -2.533 -6.947 -22.343 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -2.571 -5.308 -21.722 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.482 -5.864 -19.808 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -2.369 -7.362 -19.610 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.672 -8.556 -20.486 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -0.671 -7.580 -21.942 1.00 0.00 H new ATOM 0 HE2 LYS A 52 0.610 -6.582 -19.381 1.00 0.00 H new ATOM 0 HE3 LYS A 52 1.483 -7.628 -20.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.927 -5.306 -20.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 1.120 -6.013 -22.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.275 -5.000 -21.191 1.00 0.00 H new ATOM 873 N LEU A 53 -4.254 -5.576 -18.879 1.00 0.00 N ATOM 874 CA LEU A 53 -4.591 -4.607 -17.842 1.00 0.00 C ATOM 875 C LEU A 53 -3.362 -3.808 -17.421 1.00 0.00 C ATOM 876 O LEU A 53 -2.298 -4.374 -17.169 1.00 0.00 O ATOM 877 CB LEU A 53 -5.191 -5.319 -16.628 1.00 0.00 C ATOM 878 CG LEU A 53 -6.697 -5.146 -16.424 1.00 0.00 C ATOM 879 CD1 LEU A 53 -7.466 -5.750 -17.589 1.00 0.00 C ATOM 880 CD2 LEU A 53 -7.134 -5.776 -15.110 1.00 0.00 C ATOM 0 H LEU A 53 -3.683 -6.357 -18.557 1.00 0.00 H new ATOM 0 HA LEU A 53 -5.327 -3.915 -18.252 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.976 -6.384 -16.714 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.680 -4.962 -15.734 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.918 -4.079 -16.383 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -8.536 -5.618 -17.427 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -7.175 -5.252 -18.514 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.239 -6.814 -17.662 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -8.208 -5.643 -14.982 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.899 -6.840 -15.121 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -6.608 -5.297 -14.284 1.00 0.00 H new ATOM 892 N VAL A 54 -3.516 -2.490 -17.345 1.00 0.00 N ATOM 893 CA VAL A 54 -2.420 -1.614 -16.952 1.00 0.00 C ATOM 894 C VAL A 54 -2.938 -0.378 -16.225 1.00 0.00 C ATOM 895 O VAL A 54 -4.145 -0.161 -16.134 1.00 0.00 O ATOM 896 CB VAL A 54 -1.591 -1.169 -18.172 1.00 0.00 C ATOM 897 CG1 VAL A 54 -1.062 -2.378 -18.928 1.00 0.00 C ATOM 898 CG2 VAL A 54 -2.423 -0.281 -19.085 1.00 0.00 C ATOM 0 H VAL A 54 -4.390 -2.006 -17.551 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.783 -2.187 -16.279 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.738 -0.590 -17.819 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.479 -2.044 -19.786 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.429 -2.971 -18.268 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.898 -2.986 -19.272 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -1.822 0.024 -19.942 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.296 -0.833 -19.432 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.747 0.603 -18.536 1.00 0.00 H new ATOM 908 N GLU A 55 -2.015 0.430 -15.710 1.00 0.00 N ATOM 909 CA GLU A 55 -2.380 1.644 -14.991 1.00 0.00 C ATOM 910 C GLU A 55 -2.379 2.851 -15.925 1.00 0.00 C ATOM 911 O GLU A 55 -1.322 3.346 -16.316 1.00 0.00 O ATOM 912 CB GLU A 55 -1.415 1.885 -13.828 1.00 0.00 C ATOM 913 CG GLU A 55 0.043 1.660 -14.192 1.00 0.00 C ATOM 914 CD GLU A 55 0.960 2.716 -13.606 1.00 0.00 C ATOM 915 OE1 GLU A 55 0.865 2.974 -12.388 1.00 0.00 O ATOM 916 OE2 GLU A 55 1.773 3.284 -14.365 1.00 0.00 O ATOM 0 H GLU A 55 -1.011 0.265 -15.778 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.387 1.512 -14.596 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.538 2.907 -13.470 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.681 1.224 -13.003 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.354 0.677 -13.839 1.00 0.00 H new ATOM 0 HG3 GLU A 55 0.146 1.656 -15.277 1.00 0.00 H new ATOM 923 N SER A 56 -3.572 3.319 -16.279 1.00 0.00 N ATOM 924 CA SER A 56 -3.710 4.464 -17.171 1.00 0.00 C ATOM 925 C SER A 56 -4.923 5.307 -16.789 1.00 0.00 C ATOM 926 O SER A 56 -5.822 4.840 -16.091 1.00 0.00 O ATOM 927 CB SER A 56 -3.837 3.996 -18.622 1.00 0.00 C ATOM 928 OG SER A 56 -4.117 5.083 -19.486 1.00 0.00 O ATOM 0 H SER A 56 -4.457 2.923 -15.962 1.00 0.00 H new ATOM 0 HA SER A 56 -2.816 5.079 -17.073 1.00 0.00 H new ATOM 0 HB2 SER A 56 -2.912 3.509 -18.933 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.630 3.252 -18.699 1.00 0.00 H new ATOM 0 HG SER A 56 -4.192 4.758 -20.407 1.00 0.00 H new ATOM 934 N ASP A 57 -4.939 6.552 -17.252 1.00 0.00 N ATOM 935 CA ASP A 57 -6.041 7.462 -16.960 1.00 0.00 C ATOM 936 C ASP A 57 -7.001 7.549 -18.143 1.00 0.00 C ATOM 937 O ASP A 57 -7.742 8.522 -18.283 1.00 0.00 O ATOM 938 CB ASP A 57 -5.505 8.853 -16.618 1.00 0.00 C ATOM 939 CG ASP A 57 -6.069 9.386 -15.316 1.00 0.00 C ATOM 940 OD1 ASP A 57 -7.284 9.668 -15.267 1.00 0.00 O ATOM 941 OD2 ASP A 57 -5.294 9.522 -14.345 1.00 0.00 O ATOM 0 H ASP A 57 -4.202 6.954 -17.831 1.00 0.00 H new ATOM 0 HA ASP A 57 -6.586 7.070 -16.101 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -4.418 8.814 -16.551 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -5.750 9.542 -17.426 1.00 0.00 H new ATOM 946 N ASP A 58 -6.980 6.527 -18.992 1.00 0.00 N ATOM 947 CA ASP A 58 -7.848 6.488 -20.163 1.00 0.00 C ATOM 948 C ASP A 58 -9.298 6.239 -19.757 1.00 0.00 C ATOM 949 O ASP A 58 -9.567 5.597 -18.742 1.00 0.00 O ATOM 950 CB ASP A 58 -7.383 5.401 -21.133 1.00 0.00 C ATOM 951 CG ASP A 58 -8.299 5.266 -22.333 1.00 0.00 C ATOM 952 OD1 ASP A 58 -8.650 6.305 -22.931 1.00 0.00 O ATOM 953 OD2 ASP A 58 -8.666 4.122 -22.675 1.00 0.00 O ATOM 0 H ASP A 58 -6.371 5.715 -18.891 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.790 7.456 -20.660 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -6.373 5.630 -21.474 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.333 4.447 -20.608 1.00 0.00 H new ATOM 958 N ALA A 59 -10.227 6.753 -20.556 1.00 0.00 N ATOM 959 CA ALA A 59 -11.649 6.585 -20.280 1.00 0.00 C ATOM 960 C ALA A 59 -12.175 5.287 -20.882 1.00 0.00 C ATOM 961 O ALA A 59 -11.740 4.868 -21.955 1.00 0.00 O ATOM 962 CB ALA A 59 -12.434 7.774 -20.816 1.00 0.00 C ATOM 0 H ALA A 59 -10.021 7.289 -21.399 1.00 0.00 H new ATOM 0 HA ALA A 59 -11.781 6.533 -19.199 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -13.494 7.636 -20.603 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -12.084 8.688 -20.336 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -12.287 7.851 -21.893 1.00 0.00 H new ATOM 968 N ALA A 60 -13.113 4.654 -20.185 1.00 0.00 N ATOM 969 CA ALA A 60 -13.699 3.404 -20.652 1.00 0.00 C ATOM 970 C ALA A 60 -15.201 3.550 -20.871 1.00 0.00 C ATOM 971 O ALA A 60 -15.800 4.551 -20.478 1.00 0.00 O ATOM 972 CB ALA A 60 -13.415 2.285 -19.660 1.00 0.00 C ATOM 0 H ALA A 60 -13.483 4.987 -19.295 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.241 3.152 -21.609 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.858 1.357 -20.021 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.338 2.156 -19.556 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -13.845 2.540 -18.691 1.00 0.00 H new ATOM 978 N GLU A 61 -15.803 2.546 -21.502 1.00 0.00 N ATOM 979 CA GLU A 61 -17.235 2.566 -21.774 1.00 0.00 C ATOM 980 C GLU A 61 -18.036 2.567 -20.475 1.00 0.00 C ATOM 981 O GLU A 61 -19.229 2.871 -20.470 1.00 0.00 O ATOM 982 CB GLU A 61 -17.631 1.359 -22.629 1.00 0.00 C ATOM 983 CG GLU A 61 -16.891 1.283 -23.953 1.00 0.00 C ATOM 984 CD GLU A 61 -16.768 2.633 -24.632 1.00 0.00 C ATOM 985 OE1 GLU A 61 -17.814 3.263 -24.894 1.00 0.00 O ATOM 986 OE2 GLU A 61 -15.626 3.060 -24.900 1.00 0.00 O ATOM 0 H GLU A 61 -15.322 1.710 -21.834 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.462 3.481 -22.321 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -17.442 0.446 -22.064 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.703 1.398 -22.823 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -15.895 0.873 -23.785 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.412 0.593 -24.617 1.00 0.00 H new ATOM 993 N ALA A 62 -17.371 2.226 -19.377 1.00 0.00 N ATOM 994 CA ALA A 62 -18.020 2.189 -18.072 1.00 0.00 C ATOM 995 C ALA A 62 -16.992 2.238 -16.946 1.00 0.00 C ATOM 996 O ALA A 62 -15.811 1.960 -17.157 1.00 0.00 O ATOM 997 CB ALA A 62 -18.884 0.943 -17.946 1.00 0.00 C ATOM 0 H ALA A 62 -16.383 1.971 -19.365 1.00 0.00 H new ATOM 0 HA ALA A 62 -18.657 3.069 -17.986 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -19.362 0.929 -16.967 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.649 0.950 -18.723 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.261 0.056 -18.058 1.00 0.00 H new ATOM 1003 N THR A 63 -17.448 2.594 -15.749 1.00 0.00 N ATOM 1004 CA THR A 63 -16.567 2.680 -14.591 1.00 0.00 C ATOM 1005 C THR A 63 -17.044 1.765 -13.469 1.00 0.00 C ATOM 1006 O THR A 63 -18.180 1.873 -13.005 1.00 0.00 O ATOM 1007 CB THR A 63 -16.480 4.123 -14.059 1.00 0.00 C ATOM 1008 OG1 THR A 63 -16.600 5.053 -15.141 1.00 0.00 O ATOM 1009 CG2 THR A 63 -15.164 4.352 -13.331 1.00 0.00 C ATOM 0 H THR A 63 -18.422 2.827 -15.556 1.00 0.00 H new ATOM 0 HA THR A 63 -15.578 2.361 -14.921 1.00 0.00 H new ATOM 0 HB THR A 63 -17.299 4.277 -13.356 1.00 0.00 H new ATOM 0 HG1 THR A 63 -16.545 5.968 -14.794 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.125 5.378 -12.964 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.089 3.663 -12.490 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.334 4.180 -14.017 1.00 0.00 H new ATOM 1017 N LEU A 64 -16.169 0.864 -13.035 1.00 0.00 N ATOM 1018 CA LEU A 64 -16.500 -0.071 -11.965 1.00 0.00 C ATOM 1019 C LEU A 64 -15.685 0.227 -10.710 1.00 0.00 C ATOM 1020 O LEU A 64 -14.479 -0.016 -10.667 1.00 0.00 O ATOM 1021 CB LEU A 64 -16.247 -1.509 -12.422 1.00 0.00 C ATOM 1022 CG LEU A 64 -17.451 -2.248 -13.007 1.00 0.00 C ATOM 1023 CD1 LEU A 64 -17.329 -2.352 -14.519 1.00 0.00 C ATOM 1024 CD2 LEU A 64 -17.582 -3.630 -12.384 1.00 0.00 C ATOM 0 H LEU A 64 -15.225 0.761 -13.408 1.00 0.00 H new ATOM 0 HA LEU A 64 -17.557 0.047 -11.726 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -15.454 -1.497 -13.170 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -15.874 -2.079 -11.571 1.00 0.00 H new ATOM 0 HG LEU A 64 -18.351 -1.680 -12.774 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -18.194 -2.881 -14.918 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -17.284 -1.352 -14.950 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -16.421 -2.898 -14.774 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -18.444 -4.142 -12.812 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -16.680 -4.207 -12.586 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -17.716 -3.532 -11.307 1.00 0.00 H new ATOM 1036 N THR A 65 -16.353 0.754 -9.689 1.00 0.00 N ATOM 1037 CA THR A 65 -15.692 1.084 -8.433 1.00 0.00 C ATOM 1038 C THR A 65 -15.980 0.033 -7.367 1.00 0.00 C ATOM 1039 O THR A 65 -17.135 -0.215 -7.022 1.00 0.00 O ATOM 1040 CB THR A 65 -16.136 2.464 -7.910 1.00 0.00 C ATOM 1041 OG1 THR A 65 -15.831 3.475 -8.876 1.00 0.00 O ATOM 1042 CG2 THR A 65 -15.449 2.790 -6.592 1.00 0.00 C ATOM 0 H THR A 65 -17.352 0.961 -9.707 1.00 0.00 H new ATOM 0 HA THR A 65 -14.621 1.108 -8.636 1.00 0.00 H new ATOM 0 HB THR A 65 -17.213 2.436 -7.743 1.00 0.00 H new ATOM 0 HG1 THR A 65 -16.118 4.349 -8.537 1.00 0.00 H new ATOM 0 HG21 THR A 65 -15.778 3.769 -6.243 1.00 0.00 H new ATOM 0 HG22 THR A 65 -15.707 2.034 -5.850 1.00 0.00 H new ATOM 0 HG23 THR A 65 -14.369 2.801 -6.738 1.00 0.00 H new ATOM 1050 N MET A 66 -14.922 -0.582 -6.848 1.00 0.00 N ATOM 1051 CA MET A 66 -15.062 -1.606 -5.820 1.00 0.00 C ATOM 1052 C MET A 66 -13.864 -1.597 -4.876 1.00 0.00 C ATOM 1053 O MET A 66 -12.716 -1.552 -5.317 1.00 0.00 O ATOM 1054 CB MET A 66 -15.209 -2.987 -6.462 1.00 0.00 C ATOM 1055 CG MET A 66 -16.479 -3.143 -7.283 1.00 0.00 C ATOM 1056 SD MET A 66 -16.224 -2.780 -9.031 1.00 0.00 S ATOM 1057 CE MET A 66 -16.087 -4.435 -9.704 1.00 0.00 C ATOM 0 H MET A 66 -13.959 -0.389 -7.123 1.00 0.00 H new ATOM 0 HA MET A 66 -15.959 -1.384 -5.242 1.00 0.00 H new ATOM 0 HB2 MET A 66 -14.347 -3.175 -7.102 1.00 0.00 H new ATOM 0 HB3 MET A 66 -15.196 -3.746 -5.680 1.00 0.00 H new ATOM 0 HG2 MET A 66 -16.852 -4.162 -7.178 1.00 0.00 H new ATOM 0 HG3 MET A 66 -17.247 -2.480 -6.886 1.00 0.00 H new ATOM 0 HE1 MET A 66 -15.422 -4.423 -10.568 1.00 0.00 H new ATOM 0 HE2 MET A 66 -15.683 -5.104 -8.944 1.00 0.00 H new ATOM 0 HE3 MET A 66 -17.073 -4.786 -10.010 1.00 0.00 H new ATOM 1067 N GLU A 67 -14.140 -1.638 -3.576 1.00 0.00 N ATOM 1068 CA GLU A 67 -13.083 -1.632 -2.571 1.00 0.00 C ATOM 1069 C GLU A 67 -12.083 -2.756 -2.828 1.00 0.00 C ATOM 1070 O GLU A 67 -12.376 -3.711 -3.547 1.00 0.00 O ATOM 1071 CB GLU A 67 -13.681 -1.777 -1.170 1.00 0.00 C ATOM 1072 CG GLU A 67 -13.604 -0.505 -0.341 1.00 0.00 C ATOM 1073 CD GLU A 67 -14.048 -0.716 1.093 1.00 0.00 C ATOM 1074 OE1 GLU A 67 -13.280 -1.325 1.868 1.00 0.00 O ATOM 1075 OE2 GLU A 67 -15.162 -0.273 1.441 1.00 0.00 O ATOM 0 H GLU A 67 -15.085 -1.676 -3.195 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.558 -0.679 -2.637 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -14.724 -2.080 -1.259 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -13.160 -2.576 -0.643 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -12.580 -0.132 -0.349 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -14.227 0.262 -0.801 1.00 0.00 H new ATOM 1082 N ASP A 68 -10.900 -2.633 -2.235 1.00 0.00 N ATOM 1083 CA ASP A 68 -9.855 -3.637 -2.398 1.00 0.00 C ATOM 1084 C ASP A 68 -10.263 -4.956 -1.747 1.00 0.00 C ATOM 1085 O ASP A 68 -10.230 -6.009 -2.383 1.00 0.00 O ATOM 1086 CB ASP A 68 -8.541 -3.140 -1.793 1.00 0.00 C ATOM 1087 CG ASP A 68 -7.358 -3.999 -2.194 1.00 0.00 C ATOM 1088 OD1 ASP A 68 -7.297 -4.415 -3.370 1.00 0.00 O ATOM 1089 OD2 ASP A 68 -6.493 -4.255 -1.331 1.00 0.00 O ATOM 0 H ASP A 68 -10.641 -1.848 -1.637 1.00 0.00 H new ATOM 0 HA ASP A 68 -9.712 -3.808 -3.465 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -8.364 -2.112 -2.110 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.626 -3.128 -0.706 1.00 0.00 H new ATOM 1094 N ASP A 69 -10.644 -4.889 -0.477 1.00 0.00 N ATOM 1095 CA ASP A 69 -11.057 -6.077 0.261 1.00 0.00 C ATOM 1096 C ASP A 69 -12.327 -6.674 -0.338 1.00 0.00 C ATOM 1097 O ASP A 69 -12.552 -7.882 -0.263 1.00 0.00 O ATOM 1098 CB ASP A 69 -11.285 -5.735 1.734 1.00 0.00 C ATOM 1099 CG ASP A 69 -10.314 -6.452 2.652 1.00 0.00 C ATOM 1100 OD1 ASP A 69 -10.340 -7.700 2.684 1.00 0.00 O ATOM 1101 OD2 ASP A 69 -9.529 -5.765 3.338 1.00 0.00 O ATOM 0 H ASP A 69 -10.676 -4.025 0.064 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.259 -6.816 0.187 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -11.185 -4.659 1.874 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -12.305 -5.999 2.012 1.00 0.00 H new ATOM 1106 N ILE A 70 -13.154 -5.819 -0.931 1.00 0.00 N ATOM 1107 CA ILE A 70 -14.401 -6.262 -1.543 1.00 0.00 C ATOM 1108 C ILE A 70 -14.152 -6.873 -2.918 1.00 0.00 C ATOM 1109 O ILE A 70 -14.596 -7.984 -3.204 1.00 0.00 O ATOM 1110 CB ILE A 70 -15.403 -5.101 -1.682 1.00 0.00 C ATOM 1111 CG1 ILE A 70 -15.419 -4.256 -0.407 1.00 0.00 C ATOM 1112 CG2 ILE A 70 -16.794 -5.637 -1.986 1.00 0.00 C ATOM 1113 CD1 ILE A 70 -15.958 -4.992 0.799 1.00 0.00 C ATOM 0 H ILE A 70 -12.983 -4.816 -1.001 1.00 0.00 H new ATOM 0 HA ILE A 70 -14.825 -7.019 -0.884 1.00 0.00 H new ATOM 0 HB ILE A 70 -15.089 -4.467 -2.511 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -14.405 -3.917 -0.193 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -16.023 -3.365 -0.579 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -17.492 -4.805 -2.082 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -16.771 -6.200 -2.919 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -17.117 -6.290 -1.176 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -15.940 -4.332 1.666 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -16.983 -5.307 0.605 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -15.340 -5.868 0.997 1.00 0.00 H new ATOM 1125 N MET A 71 -13.437 -6.139 -3.764 1.00 0.00 N ATOM 1126 CA MET A 71 -13.127 -6.609 -5.109 1.00 0.00 C ATOM 1127 C MET A 71 -12.477 -7.989 -5.066 1.00 0.00 C ATOM 1128 O MET A 71 -12.618 -8.782 -5.997 1.00 0.00 O ATOM 1129 CB MET A 71 -12.201 -5.619 -5.818 1.00 0.00 C ATOM 1130 CG MET A 71 -11.916 -5.983 -7.266 1.00 0.00 C ATOM 1131 SD MET A 71 -13.038 -5.171 -8.421 1.00 0.00 S ATOM 1132 CE MET A 71 -12.002 -3.838 -9.019 1.00 0.00 C ATOM 0 H MET A 71 -13.062 -5.217 -3.542 1.00 0.00 H new ATOM 0 HA MET A 71 -14.062 -6.683 -5.665 1.00 0.00 H new ATOM 0 HB2 MET A 71 -12.649 -4.626 -5.783 1.00 0.00 H new ATOM 0 HB3 MET A 71 -11.258 -5.562 -5.274 1.00 0.00 H new ATOM 0 HG2 MET A 71 -10.889 -5.709 -7.510 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.995 -7.063 -7.387 1.00 0.00 H new ATOM 0 HE1 MET A 71 -12.132 -3.731 -10.096 1.00 0.00 H new ATOM 0 HE2 MET A 71 -12.285 -2.908 -8.526 1.00 0.00 H new ATOM 0 HE3 MET A 71 -10.958 -4.062 -8.800 1.00 0.00 H new ATOM 1142 N PHE A 72 -11.764 -8.268 -3.979 1.00 0.00 N ATOM 1143 CA PHE A 72 -11.092 -9.552 -3.816 1.00 0.00 C ATOM 1144 C PHE A 72 -12.101 -10.695 -3.788 1.00 0.00 C ATOM 1145 O PHE A 72 -11.926 -11.709 -4.464 1.00 0.00 O ATOM 1146 CB PHE A 72 -10.263 -9.557 -2.530 1.00 0.00 C ATOM 1147 CG PHE A 72 -9.148 -10.564 -2.539 1.00 0.00 C ATOM 1148 CD1 PHE A 72 -7.990 -10.328 -3.262 1.00 0.00 C ATOM 1149 CD2 PHE A 72 -9.259 -11.746 -1.824 1.00 0.00 C ATOM 1150 CE1 PHE A 72 -6.962 -11.253 -3.272 1.00 0.00 C ATOM 1151 CE2 PHE A 72 -8.235 -12.673 -1.830 1.00 0.00 C ATOM 1152 CZ PHE A 72 -7.085 -12.427 -2.556 1.00 0.00 C ATOM 0 H PHE A 72 -11.637 -7.623 -3.199 1.00 0.00 H new ATOM 0 HA PHE A 72 -10.429 -9.698 -4.669 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -9.843 -8.563 -2.374 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.920 -9.762 -1.685 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -7.889 -9.411 -3.824 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -10.156 -11.944 -1.256 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -6.064 -11.057 -3.839 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -8.333 -13.590 -1.268 1.00 0.00 H new ATOM 0 HZ PHE A 72 -6.284 -13.152 -2.563 1.00 0.00 H new ATOM 1162 N ALA A 73 -13.158 -10.524 -3.001 1.00 0.00 N ATOM 1163 CA ALA A 73 -14.197 -11.541 -2.885 1.00 0.00 C ATOM 1164 C ALA A 73 -14.835 -11.830 -4.240 1.00 0.00 C ATOM 1165 O ALA A 73 -14.967 -12.987 -4.640 1.00 0.00 O ATOM 1166 CB ALA A 73 -15.255 -11.102 -1.884 1.00 0.00 C ATOM 0 H ALA A 73 -13.318 -9.691 -2.434 1.00 0.00 H new ATOM 0 HA ALA A 73 -13.734 -12.460 -2.527 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -16.024 -11.870 -1.807 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -14.793 -10.952 -0.908 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -15.707 -10.168 -2.218 1.00 0.00 H new ATOM 1172 N ILE A 74 -15.231 -10.772 -4.940 1.00 0.00 N ATOM 1173 CA ILE A 74 -15.855 -10.913 -6.249 1.00 0.00 C ATOM 1174 C ILE A 74 -14.831 -11.314 -7.306 1.00 0.00 C ATOM 1175 O ILE A 74 -15.188 -11.803 -8.377 1.00 0.00 O ATOM 1176 CB ILE A 74 -16.544 -9.608 -6.688 1.00 0.00 C ATOM 1177 CG1 ILE A 74 -17.621 -9.209 -5.677 1.00 0.00 C ATOM 1178 CG2 ILE A 74 -17.147 -9.768 -8.076 1.00 0.00 C ATOM 1179 CD1 ILE A 74 -17.098 -8.356 -4.542 1.00 0.00 C ATOM 0 H ILE A 74 -15.131 -9.808 -4.622 1.00 0.00 H new ATOM 0 HA ILE A 74 -16.606 -11.698 -6.157 1.00 0.00 H new ATOM 0 HB ILE A 74 -15.797 -8.816 -6.727 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -18.411 -8.665 -6.195 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -18.073 -10.111 -5.264 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -17.630 -8.837 -8.372 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -16.359 -10.011 -8.789 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -17.884 -10.571 -8.062 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -17.916 -8.111 -3.864 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -16.329 -8.905 -3.999 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -16.672 -7.437 -4.944 1.00 0.00 H new ATOM 1191 N GLY A 75 -13.555 -11.106 -6.995 1.00 0.00 N ATOM 1192 CA GLY A 75 -12.499 -11.453 -7.928 1.00 0.00 C ATOM 1193 C GLY A 75 -12.109 -12.916 -7.844 1.00 0.00 C ATOM 1194 O GLY A 75 -11.761 -13.533 -8.851 1.00 0.00 O ATOM 0 H GLY A 75 -13.234 -10.704 -6.114 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -12.825 -11.225 -8.943 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.624 -10.835 -7.728 1.00 0.00 H new ATOM 1198 N THR A 76 -12.165 -13.473 -6.638 1.00 0.00 N ATOM 1199 CA THR A 76 -11.812 -14.872 -6.426 1.00 0.00 C ATOM 1200 C THR A 76 -13.049 -15.762 -6.459 1.00 0.00 C ATOM 1201 O THR A 76 -13.029 -16.888 -5.965 1.00 0.00 O ATOM 1202 CB THR A 76 -11.087 -15.070 -5.081 1.00 0.00 C ATOM 1203 OG1 THR A 76 -11.953 -14.706 -4.000 1.00 0.00 O ATOM 1204 CG2 THR A 76 -9.817 -14.235 -5.023 1.00 0.00 C ATOM 0 H THR A 76 -12.451 -12.977 -5.794 1.00 0.00 H new ATOM 0 HA THR A 76 -11.142 -15.156 -7.237 1.00 0.00 H new ATOM 0 HB THR A 76 -10.816 -16.122 -4.991 1.00 0.00 H new ATOM 0 HG1 THR A 76 -12.055 -13.732 -3.977 1.00 0.00 H new ATOM 0 HG21 THR A 76 -9.322 -14.391 -4.064 1.00 0.00 H new ATOM 0 HG22 THR A 76 -9.148 -14.534 -5.830 1.00 0.00 H new ATOM 0 HG23 THR A 76 -10.070 -13.180 -5.133 1.00 0.00 H new ATOM 1212 N GLY A 77 -14.126 -15.249 -7.047 1.00 0.00 N ATOM 1213 CA GLY A 77 -15.357 -16.012 -7.134 1.00 0.00 C ATOM 1214 C GLY A 77 -15.937 -16.336 -5.772 1.00 0.00 C ATOM 1215 O GLY A 77 -16.665 -17.316 -5.617 1.00 0.00 O ATOM 0 H GLY A 77 -14.167 -14.319 -7.464 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -16.089 -15.449 -7.713 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -15.168 -16.939 -7.675 1.00 0.00 H new ATOM 1219 N ALA A 78 -15.612 -15.513 -4.781 1.00 0.00 N ATOM 1220 CA ALA A 78 -16.105 -15.717 -3.425 1.00 0.00 C ATOM 1221 C ALA A 78 -17.519 -15.168 -3.267 1.00 0.00 C ATOM 1222 O ALA A 78 -18.487 -15.927 -3.203 1.00 0.00 O ATOM 1223 CB ALA A 78 -15.168 -15.065 -2.418 1.00 0.00 C ATOM 0 H ALA A 78 -15.009 -14.698 -4.892 1.00 0.00 H new ATOM 0 HA ALA A 78 -16.136 -16.790 -3.234 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -15.549 -15.226 -1.409 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -14.175 -15.507 -2.506 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -15.108 -13.995 -2.617 1.00 0.00 H new ATOM 1229 N LEU A 79 -17.632 -13.846 -3.203 1.00 0.00 N ATOM 1230 CA LEU A 79 -18.928 -13.195 -3.052 1.00 0.00 C ATOM 1231 C LEU A 79 -19.463 -12.725 -4.401 1.00 0.00 C ATOM 1232 O LEU A 79 -18.714 -12.292 -5.277 1.00 0.00 O ATOM 1233 CB LEU A 79 -18.816 -12.008 -2.094 1.00 0.00 C ATOM 1234 CG LEU A 79 -19.043 -12.316 -0.613 1.00 0.00 C ATOM 1235 CD1 LEU A 79 -18.474 -11.206 0.257 1.00 0.00 C ATOM 1236 CD2 LEU A 79 -20.525 -12.511 -0.330 1.00 0.00 C ATOM 0 H LEU A 79 -16.841 -13.204 -3.253 1.00 0.00 H new ATOM 0 HA LEU A 79 -19.626 -13.923 -2.639 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -17.824 -11.569 -2.205 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -19.536 -11.250 -2.401 1.00 0.00 H new ATOM 0 HG LEU A 79 -18.522 -13.242 -0.371 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -18.645 -11.443 1.307 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -17.403 -11.114 0.075 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -18.965 -10.264 0.013 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -20.668 -12.729 0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -21.068 -11.602 -0.589 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -20.903 -13.342 -0.926 1.00 0.00 H new ATOM 1248 N PRO A 80 -20.790 -12.810 -4.574 1.00 0.00 N ATOM 1249 CA PRO A 80 -21.455 -12.396 -5.813 1.00 0.00 C ATOM 1250 C PRO A 80 -21.428 -10.884 -6.008 1.00 0.00 C ATOM 1251 O PRO A 80 -21.821 -10.127 -5.121 1.00 0.00 O ATOM 1252 CB PRO A 80 -22.893 -12.885 -5.624 1.00 0.00 C ATOM 1253 CG PRO A 80 -23.083 -12.944 -4.148 1.00 0.00 C ATOM 1254 CD PRO A 80 -21.744 -13.317 -3.573 1.00 0.00 C ATOM 0 HA PRO A 80 -20.964 -12.805 -6.696 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -23.607 -12.204 -6.088 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -23.042 -13.863 -6.082 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -23.421 -11.983 -3.759 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -23.841 -13.680 -3.881 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -21.584 -12.859 -2.597 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -21.651 -14.395 -3.438 1.00 0.00 H new ATOM 1262 N ALA A 81 -20.962 -10.451 -7.175 1.00 0.00 N ATOM 1263 CA ALA A 81 -20.886 -9.029 -7.487 1.00 0.00 C ATOM 1264 C ALA A 81 -22.258 -8.371 -7.385 1.00 0.00 C ATOM 1265 O ALA A 81 -22.366 -7.172 -7.125 1.00 0.00 O ATOM 1266 CB ALA A 81 -20.302 -8.824 -8.877 1.00 0.00 C ATOM 0 H ALA A 81 -20.631 -11.065 -7.920 1.00 0.00 H new ATOM 0 HA ALA A 81 -20.230 -8.556 -6.756 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -20.251 -7.758 -9.097 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -19.300 -9.251 -8.917 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -20.936 -9.316 -9.614 1.00 0.00 H new ATOM 1272 N LYS A 82 -23.306 -9.162 -7.593 1.00 0.00 N ATOM 1273 CA LYS A 82 -24.672 -8.657 -7.524 1.00 0.00 C ATOM 1274 C LYS A 82 -25.007 -8.184 -6.113 1.00 0.00 C ATOM 1275 O LYS A 82 -25.425 -7.043 -5.915 1.00 0.00 O ATOM 1276 CB LYS A 82 -25.660 -9.741 -7.958 1.00 0.00 C ATOM 1277 CG LYS A 82 -26.997 -9.193 -8.428 1.00 0.00 C ATOM 1278 CD LYS A 82 -27.654 -10.117 -9.439 1.00 0.00 C ATOM 1279 CE LYS A 82 -29.039 -10.548 -8.983 1.00 0.00 C ATOM 1280 NZ LYS A 82 -28.982 -11.720 -8.065 1.00 0.00 N ATOM 0 H LYS A 82 -23.235 -10.156 -7.811 1.00 0.00 H new ATOM 0 HA LYS A 82 -24.753 -7.807 -8.202 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -25.214 -10.326 -8.762 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -25.829 -10.422 -7.124 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -27.658 -9.060 -7.572 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -26.851 -8.209 -8.874 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -27.728 -9.611 -10.402 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -27.029 -10.997 -9.589 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -29.531 -9.716 -8.479 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -29.646 -10.798 -9.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -29.946 -11.983 -7.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -28.536 -12.522 -8.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -28.424 -11.474 -7.223 1.00 0.00 H new ATOM 1294 N GLU A 83 -24.819 -9.066 -5.138 1.00 0.00 N ATOM 1295 CA GLU A 83 -25.101 -8.737 -3.745 1.00 0.00 C ATOM 1296 C GLU A 83 -24.260 -7.549 -3.286 1.00 0.00 C ATOM 1297 O GLU A 83 -24.785 -6.570 -2.759 1.00 0.00 O ATOM 1298 CB GLU A 83 -24.830 -9.946 -2.847 1.00 0.00 C ATOM 1299 CG GLU A 83 -25.731 -11.134 -3.138 1.00 0.00 C ATOM 1300 CD GLU A 83 -27.178 -10.874 -2.769 1.00 0.00 C ATOM 1301 OE1 GLU A 83 -27.430 -9.945 -1.973 1.00 0.00 O ATOM 1302 OE2 GLU A 83 -28.059 -11.598 -3.278 1.00 0.00 O ATOM 0 H GLU A 83 -24.473 -10.014 -5.286 1.00 0.00 H new ATOM 0 HA GLU A 83 -26.154 -8.466 -3.668 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -23.790 -10.251 -2.967 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -24.958 -9.650 -1.806 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -25.669 -11.381 -4.198 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -25.370 -12.002 -2.587 1.00 0.00 H new ATOM 1309 N ALA A 84 -22.950 -7.646 -3.490 1.00 0.00 N ATOM 1310 CA ALA A 84 -22.035 -6.580 -3.099 1.00 0.00 C ATOM 1311 C ALA A 84 -22.505 -5.231 -3.632 1.00 0.00 C ATOM 1312 O ALA A 84 -22.511 -4.235 -2.909 1.00 0.00 O ATOM 1313 CB ALA A 84 -20.628 -6.884 -3.591 1.00 0.00 C ATOM 0 H ALA A 84 -22.499 -8.451 -3.924 1.00 0.00 H new ATOM 0 HA ALA A 84 -22.022 -6.527 -2.010 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -19.956 -6.080 -3.292 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -20.286 -7.823 -3.157 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -20.633 -6.967 -4.678 1.00 0.00 H new ATOM 1319 N MET A 85 -22.896 -5.205 -4.902 1.00 0.00 N ATOM 1320 CA MET A 85 -23.367 -3.977 -5.532 1.00 0.00 C ATOM 1321 C MET A 85 -24.730 -3.572 -4.981 1.00 0.00 C ATOM 1322 O MET A 85 -25.059 -2.388 -4.922 1.00 0.00 O ATOM 1323 CB MET A 85 -23.450 -4.156 -7.049 1.00 0.00 C ATOM 1324 CG MET A 85 -22.470 -3.285 -7.818 1.00 0.00 C ATOM 1325 SD MET A 85 -23.289 -1.990 -8.768 1.00 0.00 S ATOM 1326 CE MET A 85 -23.432 -2.783 -10.368 1.00 0.00 C ATOM 0 H MET A 85 -22.896 -6.020 -5.515 1.00 0.00 H new ATOM 0 HA MET A 85 -22.653 -3.185 -5.306 1.00 0.00 H new ATOM 0 HB2 MET A 85 -23.264 -5.202 -7.294 1.00 0.00 H new ATOM 0 HB3 MET A 85 -24.463 -3.927 -7.379 1.00 0.00 H new ATOM 0 HG2 MET A 85 -21.769 -2.829 -7.119 1.00 0.00 H new ATOM 0 HG3 MET A 85 -21.886 -3.911 -8.493 1.00 0.00 H new ATOM 0 HE1 MET A 85 -23.650 -2.033 -11.128 1.00 0.00 H new ATOM 0 HE2 MET A 85 -22.495 -3.283 -10.611 1.00 0.00 H new ATOM 0 HE3 MET A 85 -24.238 -3.516 -10.340 1.00 0.00 H new ATOM 1336 N ALA A 86 -25.520 -4.563 -4.579 1.00 0.00 N ATOM 1337 CA ALA A 86 -26.846 -4.309 -4.032 1.00 0.00 C ATOM 1338 C ALA A 86 -26.760 -3.804 -2.595 1.00 0.00 C ATOM 1339 O ALA A 86 -27.675 -3.143 -2.105 1.00 0.00 O ATOM 1340 CB ALA A 86 -27.695 -5.570 -4.100 1.00 0.00 C ATOM 0 H ALA A 86 -25.264 -5.549 -4.622 1.00 0.00 H new ATOM 0 HA ALA A 86 -27.318 -3.533 -4.635 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -28.683 -5.366 -3.688 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -27.793 -5.887 -5.138 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -27.218 -6.362 -3.523 1.00 0.00 H new ATOM 1346 N GLN A 87 -25.656 -4.121 -1.927 1.00 0.00 N ATOM 1347 CA GLN A 87 -25.452 -3.700 -0.546 1.00 0.00 C ATOM 1348 C GLN A 87 -24.780 -2.332 -0.488 1.00 0.00 C ATOM 1349 O GLN A 87 -24.274 -1.922 0.557 1.00 0.00 O ATOM 1350 CB GLN A 87 -24.605 -4.730 0.204 1.00 0.00 C ATOM 1351 CG GLN A 87 -25.163 -6.142 0.136 1.00 0.00 C ATOM 1352 CD GLN A 87 -25.616 -6.656 1.488 1.00 0.00 C ATOM 1353 OE1 GLN A 87 -26.550 -6.122 2.087 1.00 0.00 O ATOM 1354 NE2 GLN A 87 -24.955 -7.698 1.978 1.00 0.00 N ATOM 0 H GLN A 87 -24.889 -4.668 -2.319 1.00 0.00 H new ATOM 0 HA GLN A 87 -26.428 -3.626 -0.067 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -23.596 -4.727 -0.207 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -24.524 -4.430 1.249 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -26.004 -6.163 -0.557 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -24.402 -6.810 -0.266 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -24.187 -8.110 1.448 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -25.215 -8.087 2.884 1.00 0.00 H new ATOM 1363 N ASP A 88 -24.779 -1.630 -1.616 1.00 0.00 N ATOM 1364 CA ASP A 88 -24.170 -0.308 -1.693 1.00 0.00 C ATOM 1365 C ASP A 88 -22.665 -0.388 -1.462 1.00 0.00 C ATOM 1366 O ASP A 88 -22.000 0.630 -1.268 1.00 0.00 O ATOM 1367 CB ASP A 88 -24.807 0.631 -0.666 1.00 0.00 C ATOM 1368 CG ASP A 88 -24.529 2.091 -0.966 1.00 0.00 C ATOM 1369 OD1 ASP A 88 -24.794 2.524 -2.107 1.00 0.00 O ATOM 1370 OD2 ASP A 88 -24.047 2.801 -0.059 1.00 0.00 O ATOM 0 H ASP A 88 -25.193 -1.955 -2.490 1.00 0.00 H new ATOM 0 HA ASP A 88 -24.345 0.087 -2.694 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -25.884 0.466 -0.646 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -24.429 0.389 0.327 1.00 0.00 H new ATOM 1375 N LYS A 89 -22.132 -1.606 -1.482 1.00 0.00 N ATOM 1376 CA LYS A 89 -20.705 -1.821 -1.275 1.00 0.00 C ATOM 1377 C LYS A 89 -19.939 -1.690 -2.588 1.00 0.00 C ATOM 1378 O LYS A 89 -18.709 -1.646 -2.597 1.00 0.00 O ATOM 1379 CB LYS A 89 -20.460 -3.203 -0.665 1.00 0.00 C ATOM 1380 CG LYS A 89 -21.202 -3.432 0.640 1.00 0.00 C ATOM 1381 CD LYS A 89 -20.897 -4.802 1.222 1.00 0.00 C ATOM 1382 CE LYS A 89 -21.290 -4.884 2.689 1.00 0.00 C ATOM 1383 NZ LYS A 89 -20.113 -5.139 3.565 1.00 0.00 N ATOM 0 H LYS A 89 -22.668 -2.459 -1.640 1.00 0.00 H new ATOM 0 HA LYS A 89 -20.344 -1.057 -0.586 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.761 -3.966 -1.383 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -19.391 -3.331 -0.493 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -20.924 -2.661 1.358 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -22.275 -3.338 0.471 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -21.432 -5.566 0.658 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -19.833 -5.015 1.117 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -21.771 -3.953 2.989 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -22.023 -5.679 2.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -20.422 -5.188 4.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -19.669 -6.040 3.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -19.425 -4.367 3.455 1.00 0.00 H new ATOM 1397 N MET A 90 -20.675 -1.626 -3.693 1.00 0.00 N ATOM 1398 CA MET A 90 -20.063 -1.497 -5.011 1.00 0.00 C ATOM 1399 C MET A 90 -20.988 -0.753 -5.969 1.00 0.00 C ATOM 1400 O MET A 90 -22.207 -0.919 -5.922 1.00 0.00 O ATOM 1401 CB MET A 90 -19.726 -2.877 -5.577 1.00 0.00 C ATOM 1402 CG MET A 90 -18.586 -3.571 -4.850 1.00 0.00 C ATOM 1403 SD MET A 90 -18.389 -5.293 -5.348 1.00 0.00 S ATOM 1404 CE MET A 90 -19.146 -5.264 -6.971 1.00 0.00 C ATOM 0 H MET A 90 -21.694 -1.661 -3.702 1.00 0.00 H new ATOM 0 HA MET A 90 -19.143 -0.922 -4.903 1.00 0.00 H new ATOM 0 HB2 MET A 90 -20.614 -3.507 -5.528 1.00 0.00 H new ATOM 0 HB3 MET A 90 -19.465 -2.775 -6.630 1.00 0.00 H new ATOM 0 HG2 MET A 90 -17.657 -3.033 -5.042 1.00 0.00 H new ATOM 0 HG3 MET A 90 -18.765 -3.526 -3.776 1.00 0.00 H new ATOM 0 HE1 MET A 90 -18.859 -6.159 -7.522 1.00 0.00 H new ATOM 0 HE2 MET A 90 -20.231 -5.235 -6.866 1.00 0.00 H new ATOM 0 HE3 MET A 90 -18.810 -4.380 -7.514 1.00 0.00 H new ATOM 1414 N GLU A 91 -20.401 0.066 -6.835 1.00 0.00 N ATOM 1415 CA GLU A 91 -21.175 0.835 -7.803 1.00 0.00 C ATOM 1416 C GLU A 91 -20.535 0.768 -9.187 1.00 0.00 C ATOM 1417 O GLU A 91 -19.380 0.368 -9.331 1.00 0.00 O ATOM 1418 CB GLU A 91 -21.291 2.293 -7.353 1.00 0.00 C ATOM 1419 CG GLU A 91 -22.288 3.103 -8.164 1.00 0.00 C ATOM 1420 CD GLU A 91 -23.632 2.413 -8.294 1.00 0.00 C ATOM 1421 OE1 GLU A 91 -24.026 1.698 -7.349 1.00 0.00 O ATOM 1422 OE2 GLU A 91 -24.290 2.587 -9.341 1.00 0.00 O ATOM 0 H GLU A 91 -19.393 0.214 -6.887 1.00 0.00 H new ATOM 0 HA GLU A 91 -22.173 0.399 -7.861 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -21.584 2.318 -6.303 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -20.311 2.765 -7.422 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.428 4.076 -7.694 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -21.880 3.285 -9.158 1.00 0.00 H new ATOM 1429 N VAL A 92 -21.296 1.163 -10.203 1.00 0.00 N ATOM 1430 CA VAL A 92 -20.805 1.148 -11.576 1.00 0.00 C ATOM 1431 C VAL A 92 -21.477 2.233 -12.411 1.00 0.00 C ATOM 1432 O VAL A 92 -22.660 2.522 -12.235 1.00 0.00 O ATOM 1433 CB VAL A 92 -21.043 -0.219 -12.243 1.00 0.00 C ATOM 1434 CG1 VAL A 92 -20.375 -0.271 -13.609 1.00 0.00 C ATOM 1435 CG2 VAL A 92 -20.538 -1.342 -11.350 1.00 0.00 C ATOM 0 H VAL A 92 -22.254 1.497 -10.101 1.00 0.00 H new ATOM 0 HA VAL A 92 -19.733 1.339 -11.531 1.00 0.00 H new ATOM 0 HB VAL A 92 -22.115 -0.353 -12.385 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -20.554 -1.245 -14.065 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -20.789 0.510 -14.247 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -19.302 -0.115 -13.496 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -20.714 -2.301 -11.837 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -19.470 -1.215 -11.175 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -21.068 -1.316 -10.398 1.00 0.00 H new ATOM 1445 N ASP A 93 -20.714 2.828 -13.321 1.00 0.00 N ATOM 1446 CA ASP A 93 -21.235 3.880 -14.186 1.00 0.00 C ATOM 1447 C ASP A 93 -21.102 3.492 -15.655 1.00 0.00 C ATOM 1448 O ASP A 93 -20.603 2.415 -15.980 1.00 0.00 O ATOM 1449 CB ASP A 93 -20.500 5.196 -13.924 1.00 0.00 C ATOM 1450 CG ASP A 93 -21.385 6.407 -14.144 1.00 0.00 C ATOM 1451 OD1 ASP A 93 -22.472 6.468 -13.531 1.00 0.00 O ATOM 1452 OD2 ASP A 93 -20.991 7.295 -14.929 1.00 0.00 O ATOM 0 H ASP A 93 -19.732 2.600 -13.479 1.00 0.00 H new ATOM 0 HA ASP A 93 -22.293 4.012 -13.959 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -20.128 5.203 -12.900 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -19.631 5.260 -14.579 1.00 0.00 H new ATOM 1457 N GLY A 94 -21.552 4.377 -16.539 1.00 0.00 N ATOM 1458 CA GLY A 94 -21.475 4.108 -17.963 1.00 0.00 C ATOM 1459 C GLY A 94 -22.690 3.364 -18.479 1.00 0.00 C ATOM 1460 O GLY A 94 -23.822 3.815 -18.305 1.00 0.00 O ATOM 0 H GLY A 94 -21.968 5.275 -16.295 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -21.373 5.050 -18.502 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -20.579 3.523 -18.171 1.00 0.00 H new ATOM 1464 N GLN A 95 -22.456 2.221 -19.117 1.00 0.00 N ATOM 1465 CA GLN A 95 -23.541 1.415 -19.662 1.00 0.00 C ATOM 1466 C GLN A 95 -23.922 0.294 -18.701 1.00 0.00 C ATOM 1467 O GLN A 95 -23.217 -0.709 -18.589 1.00 0.00 O ATOM 1468 CB GLN A 95 -23.138 0.827 -21.016 1.00 0.00 C ATOM 1469 CG GLN A 95 -23.721 1.577 -22.202 1.00 0.00 C ATOM 1470 CD GLN A 95 -25.228 1.724 -22.117 1.00 0.00 C ATOM 1471 OE1 GLN A 95 -25.742 2.808 -21.841 1.00 0.00 O ATOM 1472 NE2 GLN A 95 -25.944 0.632 -22.355 1.00 0.00 N ATOM 0 H GLN A 95 -21.525 1.833 -19.269 1.00 0.00 H new ATOM 0 HA GLN A 95 -24.407 2.062 -19.798 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -22.051 0.829 -21.094 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -23.459 -0.214 -21.061 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -23.266 2.566 -22.261 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -23.462 1.052 -23.122 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -25.476 -0.246 -22.580 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -26.962 0.671 -22.313 1.00 0.00 H new ATOM 1481 N VAL A 96 -25.042 0.471 -18.007 1.00 0.00 N ATOM 1482 CA VAL A 96 -25.518 -0.526 -17.055 1.00 0.00 C ATOM 1483 C VAL A 96 -25.845 -1.841 -17.754 1.00 0.00 C ATOM 1484 O VAL A 96 -25.788 -2.909 -17.145 1.00 0.00 O ATOM 1485 CB VAL A 96 -26.768 -0.032 -16.303 1.00 0.00 C ATOM 1486 CG1 VAL A 96 -27.163 -1.021 -15.216 1.00 0.00 C ATOM 1487 CG2 VAL A 96 -26.524 1.349 -15.715 1.00 0.00 C ATOM 0 H VAL A 96 -25.637 1.296 -18.086 1.00 0.00 H new ATOM 0 HA VAL A 96 -24.713 -0.689 -16.338 1.00 0.00 H new ATOM 0 HB VAL A 96 -27.593 0.040 -17.012 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -28.048 -0.655 -14.695 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -27.381 -1.989 -15.667 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -26.343 -1.128 -14.506 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -27.417 1.683 -15.187 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -25.686 1.305 -15.019 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -26.293 2.050 -16.517 1.00 0.00 H new ATOM 1497 N GLU A 97 -26.187 -1.755 -19.035 1.00 0.00 N ATOM 1498 CA GLU A 97 -26.523 -2.939 -19.817 1.00 0.00 C ATOM 1499 C GLU A 97 -25.271 -3.746 -20.148 1.00 0.00 C ATOM 1500 O GLU A 97 -25.313 -4.975 -20.223 1.00 0.00 O ATOM 1501 CB GLU A 97 -27.241 -2.539 -21.107 1.00 0.00 C ATOM 1502 CG GLU A 97 -28.161 -3.619 -21.652 1.00 0.00 C ATOM 1503 CD GLU A 97 -27.476 -4.509 -22.671 1.00 0.00 C ATOM 1504 OE1 GLU A 97 -26.910 -3.969 -23.644 1.00 0.00 O ATOM 1505 OE2 GLU A 97 -27.507 -5.745 -22.495 1.00 0.00 O ATOM 0 H GLU A 97 -26.239 -0.878 -19.554 1.00 0.00 H new ATOM 0 HA GLU A 97 -27.188 -3.562 -19.218 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -27.823 -1.636 -20.924 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -26.498 -2.291 -21.865 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -28.525 -4.231 -20.827 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -29.032 -3.151 -22.111 1.00 0.00 H new ATOM 1512 N LEU A 98 -24.159 -3.047 -20.344 1.00 0.00 N ATOM 1513 CA LEU A 98 -22.894 -3.698 -20.668 1.00 0.00 C ATOM 1514 C LEU A 98 -22.262 -4.311 -19.422 1.00 0.00 C ATOM 1515 O LEU A 98 -21.931 -5.497 -19.402 1.00 0.00 O ATOM 1516 CB LEU A 98 -21.929 -2.694 -21.301 1.00 0.00 C ATOM 1517 CG LEU A 98 -21.911 -2.652 -22.830 1.00 0.00 C ATOM 1518 CD1 LEU A 98 -21.679 -1.232 -23.323 1.00 0.00 C ATOM 1519 CD2 LEU A 98 -20.844 -3.590 -23.376 1.00 0.00 C ATOM 0 H LEU A 98 -24.107 -2.030 -20.284 1.00 0.00 H new ATOM 0 HA LEU A 98 -23.097 -4.497 -21.381 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -22.179 -1.699 -20.933 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -20.921 -2.919 -20.952 1.00 0.00 H new ATOM 0 HG LEU A 98 -22.882 -2.986 -23.195 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -21.669 -1.222 -24.413 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -22.479 -0.586 -22.961 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -20.722 -0.869 -22.948 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -20.845 -3.548 -24.465 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -19.866 -3.286 -23.002 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -21.055 -4.609 -23.052 1.00 0.00 H new ATOM 1531 N ILE A 99 -22.100 -3.496 -18.385 1.00 0.00 N ATOM 1532 CA ILE A 99 -21.512 -3.959 -17.135 1.00 0.00 C ATOM 1533 C ILE A 99 -22.229 -5.202 -16.617 1.00 0.00 C ATOM 1534 O ILE A 99 -21.635 -6.033 -15.930 1.00 0.00 O ATOM 1535 CB ILE A 99 -21.557 -2.866 -16.052 1.00 0.00 C ATOM 1536 CG1 ILE A 99 -22.999 -2.629 -15.595 1.00 0.00 C ATOM 1537 CG2 ILE A 99 -20.944 -1.576 -16.576 1.00 0.00 C ATOM 1538 CD1 ILE A 99 -23.125 -1.578 -14.515 1.00 0.00 C ATOM 0 H ILE A 99 -22.368 -2.512 -18.386 1.00 0.00 H new ATOM 0 HA ILE A 99 -20.472 -4.205 -17.348 1.00 0.00 H new ATOM 0 HB ILE A 99 -20.974 -3.201 -15.194 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -23.599 -2.329 -16.454 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -23.414 -3.568 -15.228 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -20.983 -0.813 -15.799 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -19.906 -1.754 -16.857 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -21.503 -1.235 -17.448 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -24.173 -1.463 -14.240 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -22.552 -1.885 -13.640 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -22.740 -0.628 -14.885 1.00 0.00 H new ATOM 1550 N PHE A 100 -23.509 -5.323 -16.954 1.00 0.00 N ATOM 1551 CA PHE A 100 -24.307 -6.465 -16.524 1.00 0.00 C ATOM 1552 C PHE A 100 -23.897 -7.729 -17.274 1.00 0.00 C ATOM 1553 O PHE A 100 -23.909 -8.827 -16.716 1.00 0.00 O ATOM 1554 CB PHE A 100 -25.795 -6.186 -16.747 1.00 0.00 C ATOM 1555 CG PHE A 100 -26.671 -7.384 -16.513 1.00 0.00 C ATOM 1556 CD1 PHE A 100 -26.989 -7.786 -15.226 1.00 0.00 C ATOM 1557 CD2 PHE A 100 -27.177 -8.108 -17.581 1.00 0.00 C ATOM 1558 CE1 PHE A 100 -27.794 -8.888 -15.008 1.00 0.00 C ATOM 1559 CE2 PHE A 100 -27.982 -9.211 -17.369 1.00 0.00 C ATOM 1560 CZ PHE A 100 -28.292 -9.601 -16.081 1.00 0.00 C ATOM 0 H PHE A 100 -24.015 -4.645 -17.523 1.00 0.00 H new ATOM 0 HA PHE A 100 -24.129 -6.622 -15.460 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -26.109 -5.381 -16.083 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -25.941 -5.833 -17.768 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -26.603 -7.232 -14.383 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -26.939 -7.807 -18.591 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -28.033 -9.191 -14.000 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -28.368 -9.768 -18.210 1.00 0.00 H new ATOM 0 HZ PHE A 100 -28.922 -10.462 -15.913 1.00 0.00 H new ATOM 1570 N LEU A 101 -23.536 -7.566 -18.542 1.00 0.00 N ATOM 1571 CA LEU A 101 -23.122 -8.693 -19.370 1.00 0.00 C ATOM 1572 C LEU A 101 -21.808 -9.284 -18.869 1.00 0.00 C ATOM 1573 O LEU A 101 -21.396 -10.362 -19.299 1.00 0.00 O ATOM 1574 CB LEU A 101 -22.974 -8.253 -20.828 1.00 0.00 C ATOM 1575 CG LEU A 101 -24.153 -8.570 -21.748 1.00 0.00 C ATOM 1576 CD1 LEU A 101 -24.315 -10.074 -21.909 1.00 0.00 C ATOM 1577 CD2 LEU A 101 -25.433 -7.949 -21.208 1.00 0.00 C ATOM 0 H LEU A 101 -23.522 -6.665 -19.019 1.00 0.00 H new ATOM 0 HA LEU A 101 -23.892 -9.462 -19.305 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -22.804 -7.176 -20.846 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -22.081 -8.724 -21.240 1.00 0.00 H new ATOM 0 HG LEU A 101 -23.950 -8.140 -22.729 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -25.159 -10.281 -22.567 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -23.407 -10.494 -22.341 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -24.496 -10.527 -20.934 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -26.262 -8.185 -21.876 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -25.641 -8.349 -20.216 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -25.314 -6.867 -21.145 1.00 0.00 H new ATOM 1589 N LEU A 102 -21.155 -8.572 -17.958 1.00 0.00 N ATOM 1590 CA LEU A 102 -19.888 -9.026 -17.396 1.00 0.00 C ATOM 1591 C LEU A 102 -20.120 -9.973 -16.223 1.00 0.00 C ATOM 1592 O LEU A 102 -19.367 -10.925 -16.023 1.00 0.00 O ATOM 1593 CB LEU A 102 -19.050 -7.829 -16.941 1.00 0.00 C ATOM 1594 CG LEU A 102 -18.255 -7.113 -18.033 1.00 0.00 C ATOM 1595 CD1 LEU A 102 -17.554 -5.888 -17.467 1.00 0.00 C ATOM 1596 CD2 LEU A 102 -17.246 -8.061 -18.667 1.00 0.00 C ATOM 0 H LEU A 102 -21.482 -7.678 -17.592 1.00 0.00 H new ATOM 0 HA LEU A 102 -19.348 -9.566 -18.174 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -19.714 -7.105 -16.469 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -18.353 -8.169 -16.175 1.00 0.00 H new ATOM 0 HG LEU A 102 -18.950 -6.784 -18.805 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -16.993 -5.391 -18.259 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -18.295 -5.200 -17.061 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -16.870 -6.194 -16.675 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -16.689 -7.534 -19.442 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -16.555 -8.420 -17.904 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -17.771 -8.908 -19.109 1.00 0.00 H new ATOM 1608 N GLU A 103 -21.170 -9.706 -15.452 1.00 0.00 N ATOM 1609 CA GLU A 103 -21.502 -10.536 -14.300 1.00 0.00 C ATOM 1610 C GLU A 103 -21.434 -12.017 -14.659 1.00 0.00 C ATOM 1611 O GLU A 103 -20.678 -12.790 -14.070 1.00 0.00 O ATOM 1612 CB GLU A 103 -22.899 -10.190 -13.780 1.00 0.00 C ATOM 1613 CG GLU A 103 -22.890 -9.229 -12.603 1.00 0.00 C ATOM 1614 CD GLU A 103 -23.278 -7.818 -12.999 1.00 0.00 C ATOM 1615 OE1 GLU A 103 -24.493 -7.533 -13.062 1.00 0.00 O ATOM 1616 OE2 GLU A 103 -22.369 -6.998 -13.245 1.00 0.00 O ATOM 0 H GLU A 103 -21.805 -8.922 -15.604 1.00 0.00 H new ATOM 0 HA GLU A 103 -20.770 -10.336 -13.517 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -23.481 -9.752 -14.591 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -23.405 -11.109 -13.484 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -23.578 -9.590 -11.839 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -21.896 -9.217 -12.156 1.00 0.00 H new ATOM 1623 N PRO A 104 -22.242 -12.424 -15.649 1.00 0.00 N ATOM 1624 CA PRO A 104 -22.293 -13.815 -16.110 1.00 0.00 C ATOM 1625 C PRO A 104 -21.023 -14.228 -16.845 1.00 0.00 C ATOM 1626 O PRO A 104 -20.844 -15.398 -17.186 1.00 0.00 O ATOM 1627 CB PRO A 104 -23.491 -13.830 -17.062 1.00 0.00 C ATOM 1628 CG PRO A 104 -23.612 -12.425 -17.542 1.00 0.00 C ATOM 1629 CD PRO A 104 -23.169 -11.557 -16.396 1.00 0.00 C ATOM 0 HA PRO A 104 -22.382 -14.516 -15.280 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -23.329 -14.519 -17.891 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -24.398 -14.153 -16.551 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -22.990 -12.258 -18.421 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -24.638 -12.198 -17.830 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -22.677 -10.650 -16.746 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -24.012 -11.245 -15.779 1.00 0.00 H new ATOM 1637 N PHE A 105 -20.142 -13.262 -17.085 1.00 0.00 N ATOM 1638 CA PHE A 105 -18.888 -13.526 -17.781 1.00 0.00 C ATOM 1639 C PHE A 105 -17.780 -13.874 -16.791 1.00 0.00 C ATOM 1640 O PHE A 105 -16.741 -14.415 -17.171 1.00 0.00 O ATOM 1641 CB PHE A 105 -18.479 -12.312 -18.617 1.00 0.00 C ATOM 1642 CG PHE A 105 -17.833 -12.675 -19.924 1.00 0.00 C ATOM 1643 CD1 PHE A 105 -16.516 -13.106 -19.965 1.00 0.00 C ATOM 1644 CD2 PHE A 105 -18.541 -12.584 -21.111 1.00 0.00 C ATOM 1645 CE1 PHE A 105 -15.919 -13.440 -21.166 1.00 0.00 C ATOM 1646 CE2 PHE A 105 -17.949 -12.918 -22.314 1.00 0.00 C ATOM 1647 CZ PHE A 105 -16.636 -13.345 -22.342 1.00 0.00 C ATOM 0 H PHE A 105 -20.274 -12.289 -16.808 1.00 0.00 H new ATOM 0 HA PHE A 105 -19.040 -14.379 -18.443 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -19.361 -11.702 -18.814 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -17.789 -11.698 -18.038 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -15.950 -13.182 -19.048 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -19.567 -12.248 -21.096 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -14.892 -13.775 -21.184 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -18.513 -12.845 -23.232 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.171 -13.604 -23.282 1.00 0.00 H new ATOM 1657 N ILE A 106 -18.009 -13.557 -15.521 1.00 0.00 N ATOM 1658 CA ILE A 106 -17.031 -13.836 -14.477 1.00 0.00 C ATOM 1659 C ILE A 106 -16.627 -15.306 -14.480 1.00 0.00 C ATOM 1660 O ILE A 106 -15.459 -15.640 -14.284 1.00 0.00 O ATOM 1661 CB ILE A 106 -17.575 -13.468 -13.083 1.00 0.00 C ATOM 1662 CG1 ILE A 106 -17.963 -11.989 -13.038 1.00 0.00 C ATOM 1663 CG2 ILE A 106 -16.542 -13.783 -12.011 1.00 0.00 C ATOM 1664 CD1 ILE A 106 -18.763 -11.611 -11.810 1.00 0.00 C ATOM 0 H ILE A 106 -18.863 -13.107 -15.191 1.00 0.00 H new ATOM 0 HA ILE A 106 -16.157 -13.221 -14.692 1.00 0.00 H new ATOM 0 HB ILE A 106 -18.466 -14.065 -12.888 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -17.058 -11.383 -13.073 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -18.543 -11.747 -13.928 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -16.941 -13.518 -11.032 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -16.309 -14.848 -12.032 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -15.635 -13.210 -12.201 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -19.003 -10.548 -11.845 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -19.686 -12.191 -11.784 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -18.177 -11.821 -10.915 1.00 0.00 H new ATOM 1676 N ALA A 107 -17.601 -16.182 -14.706 1.00 0.00 N ATOM 1677 CA ALA A 107 -17.346 -17.616 -14.739 1.00 0.00 C ATOM 1678 C ALA A 107 -16.267 -17.959 -15.760 1.00 0.00 C ATOM 1679 O ALA A 107 -15.502 -18.906 -15.575 1.00 0.00 O ATOM 1680 CB ALA A 107 -18.629 -18.373 -15.050 1.00 0.00 C ATOM 0 H ALA A 107 -18.574 -15.923 -14.869 1.00 0.00 H new ATOM 0 HA ALA A 107 -16.987 -17.919 -13.755 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -18.424 -19.443 -15.072 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -19.372 -18.161 -14.281 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -19.012 -18.057 -16.021 1.00 0.00 H new ATOM 1686 N SER A 108 -16.210 -17.183 -16.838 1.00 0.00 N ATOM 1687 CA SER A 108 -15.227 -17.408 -17.890 1.00 0.00 C ATOM 1688 C SER A 108 -13.964 -16.589 -17.638 1.00 0.00 C ATOM 1689 O SER A 108 -12.849 -17.057 -17.874 1.00 0.00 O ATOM 1690 CB SER A 108 -15.818 -17.047 -19.255 1.00 0.00 C ATOM 1691 OG SER A 108 -16.420 -18.175 -19.864 1.00 0.00 O ATOM 0 H SER A 108 -16.833 -16.393 -17.005 1.00 0.00 H new ATOM 0 HA SER A 108 -14.961 -18.465 -17.885 1.00 0.00 H new ATOM 0 HB2 SER A 108 -16.558 -16.255 -19.137 1.00 0.00 H new ATOM 0 HB3 SER A 108 -15.033 -16.656 -19.903 1.00 0.00 H new ATOM 0 HG SER A 108 -16.791 -17.918 -20.734 1.00 0.00 H new