USER MOD reduce.3.24.130724 H: found=0, std=0, add=867, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 868 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 115 GLN : amide:sc= 0.335 K(o=-0.0021,f=-1.2) USER MOD Set 1.2: A 119 ASN : amide:sc= -0.337 X(o=-0.0021,f=0.46) USER MOD Set 2.1: A 60 LYS NZ :NH3+ 151:sc= 0.00424 (180deg=0) USER MOD Set 2.2: A 62 THR OG1 : rot 180:sc= 0.00476 USER MOD Set 3.1: A 45 THR OG1 : rot 176:sc= 0.302 USER MOD Set 3.2: A 56 GLN : amide:sc= -0.358 K(o=-0.056,f=-0.79) USER MOD Set 4.1: A 34 SER OG : rot 67:sc= 1.55 USER MOD Set 4.2: A 39 SER OG : rot 96:sc= 0.397 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.0387 K(o=-0.039,f=-0.91) USER MOD Single : A 17 ASN : amide:sc= -0.0203 X(o=-0.02,f=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 82:sc= -0.294 USER MOD Single : A 51 ASN : amide:sc= -0.759 K(o=-0.76,f=0.96) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 122:sc= -0.225 USER MOD Single : A 64 SER OG : rot 180:sc= -0.116 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 150:sc= 0 USER MOD Single : A 74 TYR OH : rot 30:sc= -0.155 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -0.0179 K(o=-0.018,f=-0.92) USER MOD Single : A 81 ASN : amide:sc= 0.018 K(o=0.018,f=-0.92) USER MOD Single : A 85 ASN : amide:sc= -1.2 K(o=-1.2,f=-2.5!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 156:sc= -0.0819 (180deg=-0.431) USER MOD Single : A 97 GLN : amide:sc= -0.0961 X(o=-0.096,f=-0.085) USER MOD Single : A 101 ASN : amide:sc= -0.677 X(o=-0.68,f=-0.27) USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 MET CE :methyl 138:sc= -0.47 (180deg=-2.5) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.0199 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= -0.0401 X(o=-0.04,f=0) USER MOD ----------------------------------------------------------------- ATOM 97 N ASP A 10 1.627 21.485 -6.256 1.00 0.00 N ATOM 98 CA ASP A 10 2.554 20.787 -7.140 1.00 0.00 C ATOM 99 C ASP A 10 2.528 19.284 -6.877 1.00 0.00 C ATOM 100 O ASP A 10 3.355 18.761 -6.130 1.00 0.00 O ATOM 101 CB ASP A 10 3.973 21.326 -6.954 1.00 0.00 C ATOM 102 CG ASP A 10 4.102 22.776 -7.377 1.00 0.00 C ATOM 103 OD1 ASP A 10 3.605 23.655 -6.641 1.00 0.00 O ATOM 104 OD2 ASP A 10 4.700 23.032 -8.442 1.00 0.00 O ATOM 0 HA ASP A 10 2.239 20.963 -8.169 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.261 21.229 -5.907 1.00 0.00 H new ATOM 0 HB3 ASP A 10 4.668 20.718 -7.533 1.00 0.00 H new ATOM 109 N TYR A 11 1.574 18.597 -7.495 1.00 0.00 N ATOM 110 CA TYR A 11 1.439 17.155 -7.325 1.00 0.00 C ATOM 111 C TYR A 11 2.692 16.430 -7.806 1.00 0.00 C ATOM 112 O TYR A 11 3.274 15.625 -7.081 1.00 0.00 O ATOM 113 CB TYR A 11 0.215 16.644 -8.088 1.00 0.00 C ATOM 114 CG TYR A 11 -1.057 17.395 -7.765 1.00 0.00 C ATOM 115 CD1 TYR A 11 -1.355 17.767 -6.460 1.00 0.00 C ATOM 116 CD2 TYR A 11 -1.960 17.732 -8.766 1.00 0.00 C ATOM 117 CE1 TYR A 11 -2.517 18.453 -6.161 1.00 0.00 C ATOM 118 CE2 TYR A 11 -3.123 18.419 -8.476 1.00 0.00 C ATOM 119 CZ TYR A 11 -3.397 18.777 -7.172 1.00 0.00 C ATOM 120 OH TYR A 11 -4.555 19.460 -6.879 1.00 0.00 O ATOM 0 H TYR A 11 0.883 19.015 -8.118 1.00 0.00 H new ATOM 0 HA TYR A 11 1.309 16.950 -6.262 1.00 0.00 H new ATOM 0 HB2 TYR A 11 0.408 16.717 -9.158 1.00 0.00 H new ATOM 0 HB3 TYR A 11 0.071 15.588 -7.861 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -0.667 17.516 -5.666 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -1.749 17.452 -9.788 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -2.735 18.734 -5.141 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -3.814 18.674 -9.266 1.00 0.00 H new ATOM 0 HH TYR A 11 -5.063 19.611 -7.703 1.00 0.00 H new ATOM 130 N GLY A 12 3.101 16.723 -9.037 1.00 0.00 N ATOM 131 CA GLY A 12 4.283 16.091 -9.595 1.00 0.00 C ATOM 132 C GLY A 12 5.390 15.927 -8.573 1.00 0.00 C ATOM 133 O GLY A 12 6.220 15.025 -8.688 1.00 0.00 O ATOM 0 H GLY A 12 2.636 17.386 -9.657 1.00 0.00 H new ATOM 0 HA2 GLY A 12 4.014 15.113 -9.995 1.00 0.00 H new ATOM 0 HA3 GLY A 12 4.650 16.687 -10.431 1.00 0.00 H new ATOM 137 N GLU A 13 5.404 16.801 -7.572 1.00 0.00 N ATOM 138 CA GLU A 13 6.420 16.749 -6.527 1.00 0.00 C ATOM 139 C GLU A 13 6.086 15.675 -5.496 1.00 0.00 C ATOM 140 O GLU A 13 6.829 14.708 -5.330 1.00 0.00 O ATOM 141 CB GLU A 13 6.546 18.110 -5.839 1.00 0.00 C ATOM 142 CG GLU A 13 7.538 19.043 -6.513 1.00 0.00 C ATOM 143 CD GLU A 13 7.637 20.388 -5.820 1.00 0.00 C ATOM 144 OE1 GLU A 13 6.799 21.268 -6.109 1.00 0.00 O ATOM 145 OE2 GLU A 13 8.553 20.561 -4.989 1.00 0.00 O ATOM 0 H GLU A 13 4.724 17.553 -7.462 1.00 0.00 H new ATOM 0 HA GLU A 13 7.372 16.496 -6.994 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.567 18.589 -5.817 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.849 17.957 -4.803 1.00 0.00 H new ATOM 0 HG2 GLU A 13 8.521 18.573 -6.528 1.00 0.00 H new ATOM 0 HG3 GLU A 13 7.242 19.194 -7.551 1.00 0.00 H new ATOM 152 N GLU A 14 4.963 15.852 -4.807 1.00 0.00 N ATOM 153 CA GLU A 14 4.531 14.899 -3.792 1.00 0.00 C ATOM 154 C GLU A 14 4.878 13.471 -4.204 1.00 0.00 C ATOM 155 O GLU A 14 5.423 12.702 -3.413 1.00 0.00 O ATOM 156 CB GLU A 14 3.025 15.022 -3.553 1.00 0.00 C ATOM 157 CG GLU A 14 2.600 16.384 -3.032 1.00 0.00 C ATOM 158 CD GLU A 14 2.967 16.592 -1.576 1.00 0.00 C ATOM 159 OE1 GLU A 14 4.176 16.629 -1.267 1.00 0.00 O ATOM 160 OE2 GLU A 14 2.043 16.719 -0.744 1.00 0.00 O ATOM 0 H GLU A 14 4.336 16.647 -4.933 1.00 0.00 H new ATOM 0 HA GLU A 14 5.058 15.129 -2.866 1.00 0.00 H new ATOM 0 HB2 GLU A 14 2.500 14.820 -4.487 1.00 0.00 H new ATOM 0 HB3 GLU A 14 2.715 14.257 -2.841 1.00 0.00 H new ATOM 0 HG2 GLU A 14 3.068 17.162 -3.635 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.522 16.494 -3.150 1.00 0.00 H new ATOM 167 N GLN A 15 4.556 13.126 -5.446 1.00 0.00 N ATOM 168 CA GLN A 15 4.832 11.790 -5.963 1.00 0.00 C ATOM 169 C GLN A 15 6.320 11.469 -5.875 1.00 0.00 C ATOM 170 O GLN A 15 6.706 10.380 -5.448 1.00 0.00 O ATOM 171 CB GLN A 15 4.358 11.673 -7.413 1.00 0.00 C ATOM 172 CG GLN A 15 2.860 11.873 -7.581 1.00 0.00 C ATOM 173 CD GLN A 15 2.455 12.056 -9.030 1.00 0.00 C ATOM 174 OE1 GLN A 15 3.275 11.916 -9.939 1.00 0.00 O ATOM 175 NE2 GLN A 15 1.184 12.369 -9.255 1.00 0.00 N ATOM 0 H GLN A 15 4.104 13.752 -6.113 1.00 0.00 H new ATOM 0 HA GLN A 15 4.287 11.071 -5.351 1.00 0.00 H new ATOM 0 HB2 GLN A 15 4.885 12.410 -8.019 1.00 0.00 H new ATOM 0 HB3 GLN A 15 4.630 10.690 -7.797 1.00 0.00 H new ATOM 0 HG2 GLN A 15 2.334 11.013 -7.166 1.00 0.00 H new ATOM 0 HG3 GLN A 15 2.547 12.745 -7.007 1.00 0.00 H new ATOM 0 HE21 GLN A 15 0.539 12.475 -8.472 1.00 0.00 H new ATOM 0 HE22 GLN A 15 0.853 12.503 -10.211 1.00 0.00 H new ATOM 184 N ARG A 16 7.151 12.423 -6.281 1.00 0.00 N ATOM 185 CA ARG A 16 8.597 12.241 -6.249 1.00 0.00 C ATOM 186 C ARG A 16 9.122 12.302 -4.817 1.00 0.00 C ATOM 187 O ARG A 16 9.729 11.351 -4.327 1.00 0.00 O ATOM 188 CB ARG A 16 9.286 13.308 -7.101 1.00 0.00 C ATOM 189 CG ARG A 16 9.015 13.167 -8.590 1.00 0.00 C ATOM 190 CD ARG A 16 10.102 13.832 -9.420 1.00 0.00 C ATOM 191 NE ARG A 16 11.259 12.960 -9.605 1.00 0.00 N ATOM 192 CZ ARG A 16 11.330 12.021 -10.542 1.00 0.00 C ATOM 193 NH1 ARG A 16 10.315 11.833 -11.375 1.00 0.00 N ATOM 194 NH2 ARG A 16 12.417 11.268 -10.648 1.00 0.00 N ATOM 0 H ARG A 16 6.848 13.330 -6.636 1.00 0.00 H new ATOM 0 HA ARG A 16 8.822 11.257 -6.659 1.00 0.00 H new ATOM 0 HB2 ARG A 16 8.955 14.293 -6.772 1.00 0.00 H new ATOM 0 HB3 ARG A 16 10.361 13.259 -6.930 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.952 12.111 -8.851 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.049 13.613 -8.829 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.697 14.108 -10.393 1.00 0.00 H new ATOM 0 HD3 ARG A 16 10.417 14.754 -8.932 1.00 0.00 H new ATOM 0 HE ARG A 16 12.057 13.079 -8.980 1.00 0.00 H new ATOM 0 HH11 ARG A 16 9.478 12.410 -11.297 1.00 0.00 H new ATOM 0 HH12 ARG A 16 10.372 11.111 -12.094 1.00 0.00 H new ATOM 0 HH21 ARG A 16 13.200 11.410 -10.010 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.470 10.547 -11.368 1.00 0.00 H new ATOM 208 N ASN A 17 8.882 13.428 -4.152 1.00 0.00 N ATOM 209 CA ASN A 17 9.331 13.613 -2.777 1.00 0.00 C ATOM 210 C ASN A 17 9.027 12.379 -1.934 1.00 0.00 C ATOM 211 O ASN A 17 9.858 11.936 -1.142 1.00 0.00 O ATOM 212 CB ASN A 17 8.661 14.843 -2.161 1.00 0.00 C ATOM 213 CG ASN A 17 9.372 16.132 -2.524 1.00 0.00 C ATOM 214 OD1 ASN A 17 10.169 16.655 -1.744 1.00 0.00 O ATOM 215 ND2 ASN A 17 9.087 16.651 -3.712 1.00 0.00 N ATOM 0 H ASN A 17 8.380 14.225 -4.543 1.00 0.00 H new ATOM 0 HA ASN A 17 10.410 13.764 -2.791 1.00 0.00 H new ATOM 0 HB2 ASN A 17 7.625 14.896 -2.497 1.00 0.00 H new ATOM 0 HB3 ASN A 17 8.639 14.736 -1.076 1.00 0.00 H new ATOM 0 HD21 ASN A 17 9.535 17.517 -4.011 1.00 0.00 H new ATOM 0 HD22 ASN A 17 8.420 16.183 -4.326 1.00 0.00 H new ATOM 222 N GLU A 18 7.830 11.827 -2.112 1.00 0.00 N ATOM 223 CA GLU A 18 7.417 10.644 -1.367 1.00 0.00 C ATOM 224 C GLU A 18 8.237 9.426 -1.783 1.00 0.00 C ATOM 225 O GLU A 18 8.837 8.751 -0.944 1.00 0.00 O ATOM 226 CB GLU A 18 5.928 10.369 -1.588 1.00 0.00 C ATOM 227 CG GLU A 18 5.339 9.378 -0.599 1.00 0.00 C ATOM 228 CD GLU A 18 5.992 9.458 0.767 1.00 0.00 C ATOM 229 OE1 GLU A 18 5.563 10.300 1.582 1.00 0.00 O ATOM 230 OE2 GLU A 18 6.934 8.677 1.019 1.00 0.00 O ATOM 0 H GLU A 18 7.131 12.180 -2.765 1.00 0.00 H new ATOM 0 HA GLU A 18 7.591 10.834 -0.308 1.00 0.00 H new ATOM 0 HB2 GLU A 18 5.379 11.308 -1.519 1.00 0.00 H new ATOM 0 HB3 GLU A 18 5.783 9.989 -2.600 1.00 0.00 H new ATOM 0 HG2 GLU A 18 4.270 9.564 -0.498 1.00 0.00 H new ATOM 0 HG3 GLU A 18 5.451 8.368 -0.992 1.00 0.00 H new ATOM 237 N LEU A 19 8.258 9.149 -3.082 1.00 0.00 N ATOM 238 CA LEU A 19 9.004 8.012 -3.610 1.00 0.00 C ATOM 239 C LEU A 19 10.340 7.856 -2.891 1.00 0.00 C ATOM 240 O LEU A 19 10.633 6.801 -2.330 1.00 0.00 O ATOM 241 CB LEU A 19 9.237 8.183 -5.112 1.00 0.00 C ATOM 242 CG LEU A 19 8.149 7.621 -6.029 1.00 0.00 C ATOM 243 CD1 LEU A 19 8.485 7.896 -7.486 1.00 0.00 C ATOM 244 CD2 LEU A 19 7.972 6.128 -5.792 1.00 0.00 C ATOM 0 H LEU A 19 7.767 9.696 -3.789 1.00 0.00 H new ATOM 0 HA LEU A 19 8.414 7.111 -3.440 1.00 0.00 H new ATOM 0 HB2 LEU A 19 9.348 9.247 -5.323 1.00 0.00 H new ATOM 0 HB3 LEU A 19 10.183 7.706 -5.369 1.00 0.00 H new ATOM 0 HG LEU A 19 7.209 8.120 -5.795 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.700 7.489 -8.123 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.561 8.972 -7.645 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.436 7.425 -7.735 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.194 5.744 -6.452 1.00 0.00 H new ATOM 0 HD22 LEU A 19 8.910 5.613 -5.999 1.00 0.00 H new ATOM 0 HD23 LEU A 19 7.685 5.956 -4.755 1.00 0.00 H new ATOM 256 N GLU A 20 11.144 8.914 -2.912 1.00 0.00 N ATOM 257 CA GLU A 20 12.449 8.893 -2.260 1.00 0.00 C ATOM 258 C GLU A 20 12.330 8.402 -0.820 1.00 0.00 C ATOM 259 O GLU A 20 12.910 7.381 -0.452 1.00 0.00 O ATOM 260 CB GLU A 20 13.077 10.288 -2.284 1.00 0.00 C ATOM 261 CG GLU A 20 14.497 10.325 -1.744 1.00 0.00 C ATOM 262 CD GLU A 20 15.046 11.735 -1.642 1.00 0.00 C ATOM 263 OE1 GLU A 20 15.338 12.336 -2.697 1.00 0.00 O ATOM 264 OE2 GLU A 20 15.183 12.238 -0.507 1.00 0.00 O ATOM 0 H GLU A 20 10.916 9.795 -3.372 1.00 0.00 H new ATOM 0 HA GLU A 20 13.090 8.203 -2.809 1.00 0.00 H new ATOM 0 HB2 GLU A 20 13.077 10.660 -3.309 1.00 0.00 H new ATOM 0 HB3 GLU A 20 12.457 10.967 -1.699 1.00 0.00 H new ATOM 0 HG2 GLU A 20 14.519 9.858 -0.759 1.00 0.00 H new ATOM 0 HG3 GLU A 20 15.144 9.733 -2.392 1.00 0.00 H new ATOM 271 N ALA A 21 11.575 9.137 -0.011 1.00 0.00 N ATOM 272 CA ALA A 21 11.379 8.776 1.388 1.00 0.00 C ATOM 273 C ALA A 21 11.184 7.271 1.544 1.00 0.00 C ATOM 274 O ALA A 21 11.895 6.619 2.310 1.00 0.00 O ATOM 275 CB ALA A 21 10.188 9.527 1.965 1.00 0.00 C ATOM 0 H ALA A 21 11.089 9.986 -0.300 1.00 0.00 H new ATOM 0 HA ALA A 21 12.275 9.059 1.940 1.00 0.00 H new ATOM 0 HB1 ALA A 21 10.053 9.248 3.010 1.00 0.00 H new ATOM 0 HB2 ALA A 21 10.366 10.600 1.896 1.00 0.00 H new ATOM 0 HB3 ALA A 21 9.290 9.272 1.403 1.00 0.00 H new ATOM 281 N LEU A 22 10.217 6.726 0.815 1.00 0.00 N ATOM 282 CA LEU A 22 9.928 5.297 0.873 1.00 0.00 C ATOM 283 C LEU A 22 11.183 4.476 0.595 1.00 0.00 C ATOM 284 O LEU A 22 11.365 3.395 1.153 1.00 0.00 O ATOM 285 CB LEU A 22 8.835 4.936 -0.134 1.00 0.00 C ATOM 286 CG LEU A 22 7.528 5.721 -0.016 1.00 0.00 C ATOM 287 CD1 LEU A 22 6.575 5.343 -1.139 1.00 0.00 C ATOM 288 CD2 LEU A 22 6.881 5.477 1.340 1.00 0.00 C ATOM 0 H LEU A 22 9.620 7.251 0.177 1.00 0.00 H new ATOM 0 HA LEU A 22 9.578 5.063 1.878 1.00 0.00 H new ATOM 0 HB2 LEU A 22 9.233 5.080 -1.139 1.00 0.00 H new ATOM 0 HB3 LEU A 22 8.609 3.875 -0.030 1.00 0.00 H new ATOM 0 HG LEU A 22 7.755 6.784 -0.103 1.00 0.00 H new ATOM 0 HD11 LEU A 22 5.651 5.912 -1.039 1.00 0.00 H new ATOM 0 HD12 LEU A 22 7.037 5.569 -2.100 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.353 4.277 -1.085 1.00 0.00 H new ATOM 0 HD21 LEU A 22 5.952 6.043 1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 22 6.667 4.414 1.455 1.00 0.00 H new ATOM 0 HD23 LEU A 22 7.560 5.798 2.130 1.00 0.00 H new ATOM 300 N GLU A 23 12.046 4.999 -0.271 1.00 0.00 N ATOM 301 CA GLU A 23 13.285 4.314 -0.622 1.00 0.00 C ATOM 302 C GLU A 23 14.153 4.091 0.614 1.00 0.00 C ATOM 303 O GLU A 23 14.999 3.198 0.638 1.00 0.00 O ATOM 304 CB GLU A 23 14.062 5.120 -1.665 1.00 0.00 C ATOM 305 CG GLU A 23 14.956 4.268 -2.550 1.00 0.00 C ATOM 306 CD GLU A 23 15.485 5.029 -3.750 1.00 0.00 C ATOM 307 OE1 GLU A 23 14.663 5.578 -4.513 1.00 0.00 O ATOM 308 OE2 GLU A 23 16.720 5.074 -3.926 1.00 0.00 O ATOM 0 H GLU A 23 11.910 5.894 -0.742 1.00 0.00 H new ATOM 0 HA GLU A 23 13.026 3.343 -1.043 1.00 0.00 H new ATOM 0 HB2 GLU A 23 13.355 5.663 -2.292 1.00 0.00 H new ATOM 0 HB3 GLU A 23 14.673 5.865 -1.155 1.00 0.00 H new ATOM 0 HG2 GLU A 23 15.795 3.896 -1.962 1.00 0.00 H new ATOM 0 HG3 GLU A 23 14.397 3.398 -2.894 1.00 0.00 H new ATOM 315 N SER A 24 13.935 4.911 1.638 1.00 0.00 N ATOM 316 CA SER A 24 14.699 4.807 2.875 1.00 0.00 C ATOM 317 C SER A 24 14.081 3.773 3.811 1.00 0.00 C ATOM 318 O SER A 24 14.715 2.775 4.157 1.00 0.00 O ATOM 319 CB SER A 24 14.767 6.167 3.573 1.00 0.00 C ATOM 320 OG SER A 24 15.369 6.055 4.851 1.00 0.00 O ATOM 0 H SER A 24 13.236 5.654 1.635 1.00 0.00 H new ATOM 0 HA SER A 24 15.709 4.485 2.623 1.00 0.00 H new ATOM 0 HB2 SER A 24 15.336 6.866 2.960 1.00 0.00 H new ATOM 0 HB3 SER A 24 13.762 6.577 3.675 1.00 0.00 H new ATOM 0 HG SER A 24 15.402 6.938 5.275 1.00 0.00 H new ATOM 326 N ILE A 25 12.839 4.019 4.216 1.00 0.00 N ATOM 327 CA ILE A 25 12.134 3.109 5.111 1.00 0.00 C ATOM 328 C ILE A 25 11.983 1.728 4.482 1.00 0.00 C ATOM 329 O ILE A 25 11.989 0.713 5.180 1.00 0.00 O ATOM 330 CB ILE A 25 10.739 3.649 5.478 1.00 0.00 C ATOM 331 CG1 ILE A 25 10.865 4.851 6.416 1.00 0.00 C ATOM 332 CG2 ILE A 25 9.900 2.554 6.119 1.00 0.00 C ATOM 333 CD1 ILE A 25 9.726 5.838 6.289 1.00 0.00 C ATOM 0 H ILE A 25 12.301 4.840 3.939 1.00 0.00 H new ATOM 0 HA ILE A 25 12.734 3.029 6.018 1.00 0.00 H new ATOM 0 HB ILE A 25 10.239 3.975 4.566 1.00 0.00 H new ATOM 0 HG12 ILE A 25 10.914 4.495 7.445 1.00 0.00 H new ATOM 0 HG13 ILE A 25 11.805 5.364 6.212 1.00 0.00 H new ATOM 0 HG21 ILE A 25 8.917 2.950 6.373 1.00 0.00 H new ATOM 0 HG22 ILE A 25 9.788 1.725 5.420 1.00 0.00 H new ATOM 0 HG23 ILE A 25 10.393 2.200 7.024 1.00 0.00 H new ATOM 0 HD11 ILE A 25 9.881 6.664 6.983 1.00 0.00 H new ATOM 0 HD12 ILE A 25 9.690 6.223 5.270 1.00 0.00 H new ATOM 0 HD13 ILE A 25 8.785 5.340 6.523 1.00 0.00 H new ATOM 345 N TYR A 26 11.850 1.696 3.161 1.00 0.00 N ATOM 346 CA TYR A 26 11.697 0.439 2.438 1.00 0.00 C ATOM 347 C TYR A 26 12.851 0.227 1.464 1.00 0.00 C ATOM 348 O TYR A 26 12.740 0.481 0.264 1.00 0.00 O ATOM 349 CB TYR A 26 10.367 0.420 1.682 1.00 0.00 C ATOM 350 CG TYR A 26 9.173 0.748 2.550 1.00 0.00 C ATOM 351 CD1 TYR A 26 8.729 -0.141 3.521 1.00 0.00 C ATOM 352 CD2 TYR A 26 8.488 1.948 2.399 1.00 0.00 C ATOM 353 CE1 TYR A 26 7.638 0.154 4.315 1.00 0.00 C ATOM 354 CE2 TYR A 26 7.397 2.253 3.189 1.00 0.00 C ATOM 355 CZ TYR A 26 6.975 1.352 4.145 1.00 0.00 C ATOM 356 OH TYR A 26 5.889 1.651 4.935 1.00 0.00 O ATOM 0 H TYR A 26 11.845 2.526 2.569 1.00 0.00 H new ATOM 0 HA TYR A 26 11.706 -0.373 3.166 1.00 0.00 H new ATOM 0 HB2 TYR A 26 10.415 1.134 0.860 1.00 0.00 H new ATOM 0 HB3 TYR A 26 10.224 -0.566 1.239 1.00 0.00 H new ATOM 0 HD1 TYR A 26 9.246 -1.079 3.657 1.00 0.00 H new ATOM 0 HD2 TYR A 26 8.815 2.655 1.650 1.00 0.00 H new ATOM 0 HE1 TYR A 26 7.306 -0.549 5.065 1.00 0.00 H new ATOM 0 HE2 TYR A 26 6.877 3.191 3.059 1.00 0.00 H new ATOM 0 HH TYR A 26 5.538 2.532 4.688 1.00 0.00 H new ATOM 366 N PRO A 27 13.988 -0.250 1.991 1.00 0.00 N ATOM 367 CA PRO A 27 15.186 -0.509 1.186 1.00 0.00 C ATOM 368 C PRO A 27 15.008 -1.696 0.247 1.00 0.00 C ATOM 369 O PRO A 27 15.502 -1.687 -0.881 1.00 0.00 O ATOM 370 CB PRO A 27 16.259 -0.813 2.235 1.00 0.00 C ATOM 371 CG PRO A 27 15.502 -1.313 3.417 1.00 0.00 C ATOM 372 CD PRO A 27 14.192 -0.575 3.413 1.00 0.00 C ATOM 0 HA PRO A 27 15.431 0.332 0.537 1.00 0.00 H new ATOM 0 HB2 PRO A 27 16.966 -1.559 1.873 1.00 0.00 H new ATOM 0 HB3 PRO A 27 16.835 0.079 2.482 1.00 0.00 H new ATOM 0 HG2 PRO A 27 15.344 -2.389 3.352 1.00 0.00 H new ATOM 0 HG3 PRO A 27 16.052 -1.127 4.340 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.383 -1.191 3.805 1.00 0.00 H new ATOM 0 HD3 PRO A 27 14.235 0.324 4.028 1.00 0.00 H new ATOM 380 N ASP A 28 14.301 -2.717 0.718 1.00 0.00 N ATOM 381 CA ASP A 28 14.056 -3.912 -0.081 1.00 0.00 C ATOM 382 C ASP A 28 12.561 -4.130 -0.289 1.00 0.00 C ATOM 383 O ASP A 28 12.135 -4.637 -1.327 1.00 0.00 O ATOM 384 CB ASP A 28 14.674 -5.138 0.593 1.00 0.00 C ATOM 385 CG ASP A 28 16.123 -5.346 0.199 1.00 0.00 C ATOM 386 OD1 ASP A 28 16.388 -5.550 -1.004 1.00 0.00 O ATOM 387 OD2 ASP A 28 16.993 -5.304 1.094 1.00 0.00 O ATOM 0 H ASP A 28 13.887 -2.741 1.650 1.00 0.00 H new ATOM 0 HA ASP A 28 14.523 -3.769 -1.056 1.00 0.00 H new ATOM 0 HB2 ASP A 28 14.607 -5.026 1.675 1.00 0.00 H new ATOM 0 HB3 ASP A 28 14.097 -6.024 0.328 1.00 0.00 H new ATOM 392 N SER A 29 11.768 -3.745 0.706 1.00 0.00 N ATOM 393 CA SER A 29 10.320 -3.903 0.635 1.00 0.00 C ATOM 394 C SER A 29 9.745 -3.116 -0.539 1.00 0.00 C ATOM 395 O SER A 29 8.815 -3.567 -1.208 1.00 0.00 O ATOM 396 CB SER A 29 9.670 -3.441 1.940 1.00 0.00 C ATOM 397 OG SER A 29 9.762 -4.443 2.938 1.00 0.00 O ATOM 0 H SER A 29 12.104 -3.321 1.571 1.00 0.00 H new ATOM 0 HA SER A 29 10.102 -4.960 0.484 1.00 0.00 H new ATOM 0 HB2 SER A 29 10.156 -2.530 2.289 1.00 0.00 H new ATOM 0 HB3 SER A 29 8.623 -3.196 1.762 1.00 0.00 H new ATOM 0 HG SER A 29 9.341 -4.123 3.763 1.00 0.00 H new ATOM 403 N PHE A 30 10.305 -1.936 -0.783 1.00 0.00 N ATOM 404 CA PHE A 30 9.848 -1.084 -1.875 1.00 0.00 C ATOM 405 C PHE A 30 10.642 -1.360 -3.149 1.00 0.00 C ATOM 406 O PHE A 30 11.814 -0.998 -3.255 1.00 0.00 O ATOM 407 CB PHE A 30 9.980 0.391 -1.489 1.00 0.00 C ATOM 408 CG PHE A 30 9.969 1.323 -2.667 1.00 0.00 C ATOM 409 CD1 PHE A 30 11.146 1.646 -3.322 1.00 0.00 C ATOM 410 CD2 PHE A 30 8.781 1.875 -3.119 1.00 0.00 C ATOM 411 CE1 PHE A 30 11.139 2.503 -4.407 1.00 0.00 C ATOM 412 CE2 PHE A 30 8.768 2.732 -4.203 1.00 0.00 C ATOM 413 CZ PHE A 30 9.949 3.047 -4.847 1.00 0.00 C ATOM 0 H PHE A 30 11.076 -1.548 -0.239 1.00 0.00 H new ATOM 0 HA PHE A 30 8.799 -1.311 -2.065 1.00 0.00 H new ATOM 0 HB2 PHE A 30 9.163 0.657 -0.818 1.00 0.00 H new ATOM 0 HB3 PHE A 30 10.907 0.531 -0.934 1.00 0.00 H new ATOM 0 HD1 PHE A 30 12.080 1.224 -2.981 1.00 0.00 H new ATOM 0 HD2 PHE A 30 7.855 1.633 -2.619 1.00 0.00 H new ATOM 0 HE1 PHE A 30 12.063 2.747 -4.910 1.00 0.00 H new ATOM 0 HE2 PHE A 30 7.836 3.155 -4.546 1.00 0.00 H new ATOM 0 HZ PHE A 30 9.941 3.718 -5.693 1.00 0.00 H new ATOM 423 N THR A 31 9.994 -2.005 -4.114 1.00 0.00 N ATOM 424 CA THR A 31 10.638 -2.332 -5.380 1.00 0.00 C ATOM 425 C THR A 31 9.867 -1.746 -6.557 1.00 0.00 C ATOM 426 O THR A 31 8.660 -1.950 -6.685 1.00 0.00 O ATOM 427 CB THR A 31 10.762 -3.856 -5.570 1.00 0.00 C ATOM 428 OG1 THR A 31 11.649 -4.401 -4.588 1.00 0.00 O ATOM 429 CG2 THR A 31 11.274 -4.187 -6.964 1.00 0.00 C ATOM 0 H THR A 31 9.024 -2.311 -4.043 1.00 0.00 H new ATOM 0 HA THR A 31 11.636 -1.894 -5.349 1.00 0.00 H new ATOM 0 HB THR A 31 9.773 -4.297 -5.449 1.00 0.00 H new ATOM 0 HG1 THR A 31 11.721 -5.370 -4.714 1.00 0.00 H new ATOM 0 HG21 THR A 31 11.354 -5.268 -7.075 1.00 0.00 H new ATOM 0 HG22 THR A 31 10.581 -3.796 -7.709 1.00 0.00 H new ATOM 0 HG23 THR A 31 12.255 -3.734 -7.108 1.00 0.00 H new ATOM 437 N VAL A 32 10.571 -1.015 -7.416 1.00 0.00 N ATOM 438 CA VAL A 32 9.953 -0.400 -8.584 1.00 0.00 C ATOM 439 C VAL A 32 9.788 -1.410 -9.714 1.00 0.00 C ATOM 440 O VAL A 32 10.613 -2.308 -9.884 1.00 0.00 O ATOM 441 CB VAL A 32 10.781 0.794 -9.094 1.00 0.00 C ATOM 442 CG1 VAL A 32 10.066 1.488 -10.243 1.00 0.00 C ATOM 443 CG2 VAL A 32 11.060 1.771 -7.962 1.00 0.00 C ATOM 0 H VAL A 32 11.571 -0.834 -7.324 1.00 0.00 H new ATOM 0 HA VAL A 32 8.971 -0.044 -8.272 1.00 0.00 H new ATOM 0 HB VAL A 32 11.735 0.420 -9.464 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.666 2.329 -10.590 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.922 0.782 -11.061 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.096 1.851 -9.902 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.646 2.608 -8.340 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.117 2.141 -7.560 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.617 1.265 -7.174 1.00 0.00 H new ATOM 453 N LEU A 33 8.717 -1.257 -10.485 1.00 0.00 N ATOM 454 CA LEU A 33 8.443 -2.155 -11.601 1.00 0.00 C ATOM 455 C LEU A 33 8.624 -1.438 -12.935 1.00 0.00 C ATOM 456 O LEU A 33 9.268 -1.956 -13.847 1.00 0.00 O ATOM 457 CB LEU A 33 7.021 -2.711 -11.497 1.00 0.00 C ATOM 458 CG LEU A 33 6.770 -3.703 -10.361 1.00 0.00 C ATOM 459 CD1 LEU A 33 5.316 -4.147 -10.352 1.00 0.00 C ATOM 460 CD2 LEU A 33 7.696 -4.904 -10.487 1.00 0.00 C ATOM 0 H LEU A 33 8.024 -0.519 -10.358 1.00 0.00 H new ATOM 0 HA LEU A 33 9.154 -2.980 -11.554 1.00 0.00 H new ATOM 0 HB2 LEU A 33 6.333 -1.874 -11.380 1.00 0.00 H new ATOM 0 HB3 LEU A 33 6.773 -3.199 -12.440 1.00 0.00 H new ATOM 0 HG LEU A 33 6.982 -3.204 -9.415 1.00 0.00 H new ATOM 0 HD11 LEU A 33 5.156 -4.853 -9.537 1.00 0.00 H new ATOM 0 HD12 LEU A 33 4.671 -3.279 -10.212 1.00 0.00 H new ATOM 0 HD13 LEU A 33 5.077 -4.628 -11.300 1.00 0.00 H new ATOM 0 HD21 LEU A 33 7.503 -5.599 -9.670 1.00 0.00 H new ATOM 0 HD22 LEU A 33 7.516 -5.404 -11.439 1.00 0.00 H new ATOM 0 HD23 LEU A 33 8.733 -4.570 -10.442 1.00 0.00 H new ATOM 472 N SER A 34 8.054 -0.242 -13.040 1.00 0.00 N ATOM 473 CA SER A 34 8.151 0.547 -14.263 1.00 0.00 C ATOM 474 C SER A 34 8.411 2.016 -13.943 1.00 0.00 C ATOM 475 O SER A 34 7.668 2.636 -13.183 1.00 0.00 O ATOM 476 CB SER A 34 6.868 0.411 -15.085 1.00 0.00 C ATOM 477 OG SER A 34 5.742 0.860 -14.351 1.00 0.00 O ATOM 0 H SER A 34 7.520 0.202 -12.293 1.00 0.00 H new ATOM 0 HA SER A 34 8.990 0.167 -14.846 1.00 0.00 H new ATOM 0 HB2 SER A 34 6.959 0.987 -16.006 1.00 0.00 H new ATOM 0 HB3 SER A 34 6.726 -0.630 -15.374 1.00 0.00 H new ATOM 0 HG SER A 34 5.806 1.828 -14.213 1.00 0.00 H new ATOM 483 N GLU A 35 9.471 2.564 -14.529 1.00 0.00 N ATOM 484 CA GLU A 35 9.829 3.960 -14.305 1.00 0.00 C ATOM 485 C GLU A 35 8.788 4.893 -14.917 1.00 0.00 C ATOM 486 O GLU A 35 8.659 6.047 -14.510 1.00 0.00 O ATOM 487 CB GLU A 35 11.208 4.256 -14.899 1.00 0.00 C ATOM 488 CG GLU A 35 12.358 3.927 -13.963 1.00 0.00 C ATOM 489 CD GLU A 35 12.639 5.038 -12.970 1.00 0.00 C ATOM 490 OE1 GLU A 35 12.415 6.216 -13.319 1.00 0.00 O ATOM 491 OE2 GLU A 35 13.083 4.730 -11.845 1.00 0.00 O ATOM 0 H GLU A 35 10.096 2.064 -15.161 1.00 0.00 H new ATOM 0 HA GLU A 35 9.859 4.134 -13.229 1.00 0.00 H new ATOM 0 HB2 GLU A 35 11.327 3.687 -15.821 1.00 0.00 H new ATOM 0 HB3 GLU A 35 11.260 5.311 -15.167 1.00 0.00 H new ATOM 0 HG2 GLU A 35 12.129 3.010 -13.421 1.00 0.00 H new ATOM 0 HG3 GLU A 35 13.256 3.734 -14.550 1.00 0.00 H new ATOM 498 N ASN A 36 8.049 4.385 -15.897 1.00 0.00 N ATOM 499 CA ASN A 36 7.020 5.173 -16.566 1.00 0.00 C ATOM 500 C ASN A 36 5.968 4.268 -17.200 1.00 0.00 C ATOM 501 O ASN A 36 6.214 3.596 -18.202 1.00 0.00 O ATOM 502 CB ASN A 36 7.649 6.069 -17.635 1.00 0.00 C ATOM 503 CG ASN A 36 6.609 6.760 -18.495 1.00 0.00 C ATOM 504 OD1 ASN A 36 5.798 7.542 -18.000 1.00 0.00 O ATOM 505 ND2 ASN A 36 6.628 6.473 -19.792 1.00 0.00 N ATOM 0 H ASN A 36 8.143 3.431 -16.246 1.00 0.00 H new ATOM 0 HA ASN A 36 6.533 5.798 -15.818 1.00 0.00 H new ATOM 0 HB2 ASN A 36 8.275 6.820 -17.153 1.00 0.00 H new ATOM 0 HB3 ASN A 36 8.301 5.469 -18.270 1.00 0.00 H new ATOM 0 HD21 ASN A 36 5.952 6.907 -20.420 1.00 0.00 H new ATOM 0 HD22 ASN A 36 7.319 5.818 -20.159 1.00 0.00 H new ATOM 512 N PRO A 37 4.767 4.250 -16.604 1.00 0.00 N ATOM 513 CA PRO A 37 4.463 5.045 -15.411 1.00 0.00 C ATOM 514 C PRO A 37 5.194 4.536 -14.173 1.00 0.00 C ATOM 515 O PRO A 37 5.569 3.367 -14.081 1.00 0.00 O ATOM 516 CB PRO A 37 2.951 4.875 -15.247 1.00 0.00 C ATOM 517 CG PRO A 37 2.642 3.575 -15.907 1.00 0.00 C ATOM 518 CD PRO A 37 3.613 3.450 -17.049 1.00 0.00 C ATOM 0 HA PRO A 37 4.780 6.082 -15.521 1.00 0.00 H new ATOM 0 HB2 PRO A 37 2.666 4.863 -14.195 1.00 0.00 H new ATOM 0 HB3 PRO A 37 2.407 5.696 -15.715 1.00 0.00 H new ATOM 0 HG2 PRO A 37 2.753 2.746 -15.208 1.00 0.00 H new ATOM 0 HG3 PRO A 37 1.613 3.554 -16.266 1.00 0.00 H new ATOM 0 HD2 PRO A 37 3.890 2.411 -17.229 1.00 0.00 H new ATOM 0 HD3 PRO A 37 3.192 3.834 -17.978 1.00 0.00 H new ATOM 526 N PRO A 38 5.401 5.432 -13.197 1.00 0.00 N ATOM 527 CA PRO A 38 6.087 5.095 -11.946 1.00 0.00 C ATOM 528 C PRO A 38 5.257 4.174 -11.059 1.00 0.00 C ATOM 529 O PRO A 38 4.410 4.632 -10.293 1.00 0.00 O ATOM 530 CB PRO A 38 6.282 6.455 -11.271 1.00 0.00 C ATOM 531 CG PRO A 38 5.197 7.312 -11.826 1.00 0.00 C ATOM 532 CD PRO A 38 4.980 6.842 -13.238 1.00 0.00 C ATOM 0 HA PRO A 38 7.017 4.555 -12.124 1.00 0.00 H new ATOM 0 HB2 PRO A 38 6.207 6.373 -10.187 1.00 0.00 H new ATOM 0 HB3 PRO A 38 7.266 6.869 -11.492 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.284 7.216 -11.238 1.00 0.00 H new ATOM 0 HG3 PRO A 38 5.481 8.364 -11.804 1.00 0.00 H new ATOM 0 HD2 PRO A 38 3.937 6.941 -13.539 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.573 7.418 -13.949 1.00 0.00 H new ATOM 540 N SER A 39 5.506 2.873 -11.167 1.00 0.00 N ATOM 541 CA SER A 39 4.779 1.887 -10.377 1.00 0.00 C ATOM 542 C SER A 39 5.739 1.050 -9.536 1.00 0.00 C ATOM 543 O SER A 39 6.861 0.764 -9.953 1.00 0.00 O ATOM 544 CB SER A 39 3.957 0.976 -11.290 1.00 0.00 C ATOM 545 OG SER A 39 3.542 1.664 -12.457 1.00 0.00 O ATOM 0 H SER A 39 6.206 2.477 -11.794 1.00 0.00 H new ATOM 0 HA SER A 39 4.106 2.421 -9.706 1.00 0.00 H new ATOM 0 HB2 SER A 39 4.550 0.105 -11.569 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.084 0.608 -10.751 1.00 0.00 H new ATOM 0 HG SER A 39 4.172 1.482 -13.186 1.00 0.00 H new ATOM 551 N PHE A 40 5.288 0.660 -8.348 1.00 0.00 N ATOM 552 CA PHE A 40 6.106 -0.143 -7.446 1.00 0.00 C ATOM 553 C PHE A 40 5.230 -0.983 -6.520 1.00 0.00 C ATOM 554 O PHE A 40 4.056 -0.677 -6.311 1.00 0.00 O ATOM 555 CB PHE A 40 7.025 0.758 -6.618 1.00 0.00 C ATOM 556 CG PHE A 40 6.292 1.831 -5.864 1.00 0.00 C ATOM 557 CD1 PHE A 40 6.019 3.051 -6.460 1.00 0.00 C ATOM 558 CD2 PHE A 40 5.878 1.618 -4.559 1.00 0.00 C ATOM 559 CE1 PHE A 40 5.345 4.041 -5.768 1.00 0.00 C ATOM 560 CE2 PHE A 40 5.203 2.604 -3.863 1.00 0.00 C ATOM 561 CZ PHE A 40 4.937 3.817 -4.468 1.00 0.00 C ATOM 0 H PHE A 40 4.361 0.887 -7.988 1.00 0.00 H new ATOM 0 HA PHE A 40 6.716 -0.815 -8.050 1.00 0.00 H new ATOM 0 HB2 PHE A 40 7.582 0.144 -5.910 1.00 0.00 H new ATOM 0 HB3 PHE A 40 7.756 1.224 -7.279 1.00 0.00 H new ATOM 0 HD1 PHE A 40 6.336 3.231 -7.477 1.00 0.00 H new ATOM 0 HD2 PHE A 40 6.085 0.672 -4.080 1.00 0.00 H new ATOM 0 HE1 PHE A 40 5.138 4.988 -6.244 1.00 0.00 H new ATOM 0 HE2 PHE A 40 4.884 2.426 -2.847 1.00 0.00 H new ATOM 0 HZ PHE A 40 4.411 4.589 -3.925 1.00 0.00 H new ATOM 571 N THR A 41 5.810 -2.044 -5.969 1.00 0.00 N ATOM 572 CA THR A 41 5.084 -2.930 -5.068 1.00 0.00 C ATOM 573 C THR A 41 5.752 -2.990 -3.699 1.00 0.00 C ATOM 574 O THR A 41 6.977 -3.063 -3.599 1.00 0.00 O ATOM 575 CB THR A 41 4.985 -4.356 -5.641 1.00 0.00 C ATOM 576 OG1 THR A 41 6.283 -4.959 -5.680 1.00 0.00 O ATOM 577 CG2 THR A 41 4.386 -4.338 -7.039 1.00 0.00 C ATOM 0 H THR A 41 6.781 -2.311 -6.131 1.00 0.00 H new ATOM 0 HA THR A 41 4.080 -2.519 -4.962 1.00 0.00 H new ATOM 0 HB THR A 41 4.333 -4.940 -4.992 1.00 0.00 H new ATOM 0 HG1 THR A 41 6.211 -5.866 -6.044 1.00 0.00 H new ATOM 0 HG21 THR A 41 4.326 -5.357 -7.422 1.00 0.00 H new ATOM 0 HG22 THR A 41 3.386 -3.905 -7.001 1.00 0.00 H new ATOM 0 HG23 THR A 41 5.016 -3.739 -7.697 1.00 0.00 H new ATOM 585 N ILE A 42 4.940 -2.958 -2.648 1.00 0.00 N ATOM 586 CA ILE A 42 5.454 -3.011 -1.285 1.00 0.00 C ATOM 587 C ILE A 42 5.213 -4.380 -0.659 1.00 0.00 C ATOM 588 O ILE A 42 4.197 -5.025 -0.920 1.00 0.00 O ATOM 589 CB ILE A 42 4.806 -1.932 -0.397 1.00 0.00 C ATOM 590 CG1 ILE A 42 4.849 -0.572 -1.096 1.00 0.00 C ATOM 591 CG2 ILE A 42 5.509 -1.863 0.951 1.00 0.00 C ATOM 592 CD1 ILE A 42 6.245 -0.009 -1.239 1.00 0.00 C ATOM 0 H ILE A 42 3.924 -2.896 -2.714 1.00 0.00 H new ATOM 0 HA ILE A 42 6.526 -2.825 -1.345 1.00 0.00 H new ATOM 0 HB ILE A 42 3.763 -2.200 -0.228 1.00 0.00 H new ATOM 0 HG12 ILE A 42 4.401 -0.667 -2.085 1.00 0.00 H new ATOM 0 HG13 ILE A 42 4.237 0.135 -0.536 1.00 0.00 H new ATOM 0 HG21 ILE A 42 5.040 -1.096 1.567 1.00 0.00 H new ATOM 0 HG22 ILE A 42 5.432 -2.828 1.452 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.560 -1.615 0.801 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.198 0.956 -1.743 1.00 0.00 H new ATOM 0 HD12 ILE A 42 6.689 0.119 -0.252 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.856 -0.695 -1.825 1.00 0.00 H new ATOM 604 N THR A 43 6.154 -4.819 0.172 1.00 0.00 N ATOM 605 CA THR A 43 6.045 -6.112 0.836 1.00 0.00 C ATOM 606 C THR A 43 5.653 -5.946 2.300 1.00 0.00 C ATOM 607 O THR A 43 6.399 -5.368 3.091 1.00 0.00 O ATOM 608 CB THR A 43 7.367 -6.898 0.756 1.00 0.00 C ATOM 609 OG1 THR A 43 7.834 -6.935 -0.597 1.00 0.00 O ATOM 610 CG2 THR A 43 7.184 -8.317 1.273 1.00 0.00 C ATOM 0 H THR A 43 7.000 -4.298 0.401 1.00 0.00 H new ATOM 0 HA THR A 43 5.267 -6.671 0.315 1.00 0.00 H new ATOM 0 HB THR A 43 8.103 -6.392 1.380 1.00 0.00 H new ATOM 0 HG1 THR A 43 8.676 -7.435 -0.639 1.00 0.00 H new ATOM 0 HG21 THR A 43 8.131 -8.853 1.207 1.00 0.00 H new ATOM 0 HG22 THR A 43 6.856 -8.286 2.312 1.00 0.00 H new ATOM 0 HG23 THR A 43 6.434 -8.830 0.671 1.00 0.00 H new ATOM 618 N VAL A 44 4.479 -6.457 2.655 1.00 0.00 N ATOM 619 CA VAL A 44 3.988 -6.367 4.025 1.00 0.00 C ATOM 620 C VAL A 44 3.617 -7.742 4.568 1.00 0.00 C ATOM 621 O VAL A 44 2.639 -8.351 4.131 1.00 0.00 O ATOM 622 CB VAL A 44 2.762 -5.440 4.123 1.00 0.00 C ATOM 623 CG1 VAL A 44 2.386 -5.203 5.578 1.00 0.00 C ATOM 624 CG2 VAL A 44 3.033 -4.123 3.413 1.00 0.00 C ATOM 0 H VAL A 44 3.850 -6.938 2.013 1.00 0.00 H new ATOM 0 HA VAL A 44 4.798 -5.950 4.624 1.00 0.00 H new ATOM 0 HB VAL A 44 1.920 -5.926 3.630 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.518 -4.546 5.627 1.00 0.00 H new ATOM 0 HG12 VAL A 44 2.148 -6.155 6.052 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.223 -4.738 6.099 1.00 0.00 H new ATOM 0 HG21 VAL A 44 2.156 -3.480 3.492 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.888 -3.630 3.875 1.00 0.00 H new ATOM 0 HG23 VAL A 44 3.249 -4.314 2.362 1.00 0.00 H new ATOM 634 N THR A 45 4.403 -8.229 5.523 1.00 0.00 N ATOM 635 CA THR A 45 4.158 -9.533 6.125 1.00 0.00 C ATOM 636 C THR A 45 3.609 -9.391 7.540 1.00 0.00 C ATOM 637 O THR A 45 3.878 -8.403 8.224 1.00 0.00 O ATOM 638 CB THR A 45 5.442 -10.383 6.167 1.00 0.00 C ATOM 639 OG1 THR A 45 6.046 -10.423 4.870 1.00 0.00 O ATOM 640 CG2 THR A 45 5.138 -11.798 6.635 1.00 0.00 C ATOM 0 H THR A 45 5.216 -7.739 5.896 1.00 0.00 H new ATOM 0 HA THR A 45 3.419 -10.035 5.501 1.00 0.00 H new ATOM 0 HB THR A 45 6.133 -9.924 6.874 1.00 0.00 H new ATOM 0 HG1 THR A 45 6.895 -10.910 4.919 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.059 -12.380 6.657 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.706 -11.765 7.635 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.431 -12.264 5.949 1.00 0.00 H new ATOM 648 N SER A 46 2.839 -10.383 7.974 1.00 0.00 N ATOM 649 CA SER A 46 2.250 -10.367 9.308 1.00 0.00 C ATOM 650 C SER A 46 3.149 -11.086 10.308 1.00 0.00 C ATOM 651 O SER A 46 4.101 -11.766 9.925 1.00 0.00 O ATOM 652 CB SER A 46 0.867 -11.021 9.286 1.00 0.00 C ATOM 653 OG SER A 46 0.967 -12.418 9.065 1.00 0.00 O ATOM 0 H SER A 46 2.608 -11.209 7.421 1.00 0.00 H new ATOM 0 HA SER A 46 2.148 -9.328 9.620 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.358 -10.835 10.232 1.00 0.00 H new ATOM 0 HB3 SER A 46 0.259 -10.568 8.502 1.00 0.00 H new ATOM 0 HG SER A 46 1.171 -12.869 9.911 1.00 0.00 H new ATOM 659 N GLU A 47 2.840 -10.931 11.591 1.00 0.00 N ATOM 660 CA GLU A 47 3.621 -11.565 12.647 1.00 0.00 C ATOM 661 C GLU A 47 3.242 -13.036 12.796 1.00 0.00 C ATOM 662 O GLU A 47 2.201 -13.472 12.306 1.00 0.00 O ATOM 663 CB GLU A 47 3.410 -10.836 13.976 1.00 0.00 C ATOM 664 CG GLU A 47 4.131 -9.501 14.058 1.00 0.00 C ATOM 665 CD GLU A 47 4.219 -8.972 15.477 1.00 0.00 C ATOM 666 OE1 GLU A 47 4.254 -9.795 16.415 1.00 0.00 O ATOM 667 OE2 GLU A 47 4.253 -7.736 15.649 1.00 0.00 O ATOM 0 H GLU A 47 2.055 -10.372 11.925 1.00 0.00 H new ATOM 0 HA GLU A 47 4.674 -11.505 12.371 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.343 -10.673 14.126 1.00 0.00 H new ATOM 0 HB3 GLU A 47 3.752 -11.475 14.790 1.00 0.00 H new ATOM 0 HG2 GLU A 47 5.137 -9.610 13.652 1.00 0.00 H new ATOM 0 HG3 GLU A 47 3.612 -8.773 13.434 1.00 0.00 H new ATOM 674 N ALA A 48 4.095 -13.795 13.475 1.00 0.00 N ATOM 675 CA ALA A 48 3.850 -15.215 13.690 1.00 0.00 C ATOM 676 C ALA A 48 2.712 -15.432 14.682 1.00 0.00 C ATOM 677 O ALA A 48 2.583 -14.702 15.663 1.00 0.00 O ATOM 678 CB ALA A 48 5.117 -15.902 14.179 1.00 0.00 C ATOM 0 H ALA A 48 4.962 -13.450 13.886 1.00 0.00 H new ATOM 0 HA ALA A 48 3.556 -15.655 12.737 1.00 0.00 H new ATOM 0 HB1 ALA A 48 4.919 -16.962 14.335 1.00 0.00 H new ATOM 0 HB2 ALA A 48 5.904 -15.786 13.434 1.00 0.00 H new ATOM 0 HB3 ALA A 48 5.436 -15.450 15.118 1.00 0.00 H new ATOM 684 N GLY A 49 1.887 -16.441 14.418 1.00 0.00 N ATOM 685 CA GLY A 49 0.770 -16.735 15.296 1.00 0.00 C ATOM 686 C GLY A 49 0.996 -17.984 16.124 1.00 0.00 C ATOM 687 O GLY A 49 2.064 -18.162 16.710 1.00 0.00 O ATOM 0 H GLY A 49 1.973 -17.060 13.612 1.00 0.00 H new ATOM 0 HA2 GLY A 49 0.602 -15.888 15.961 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -0.134 -16.857 14.700 1.00 0.00 H new ATOM 691 N GLU A 50 -0.011 -18.850 16.174 1.00 0.00 N ATOM 692 CA GLU A 50 0.084 -20.088 16.939 1.00 0.00 C ATOM 693 C GLU A 50 1.173 -20.995 16.375 1.00 0.00 C ATOM 694 O GLU A 50 2.220 -21.184 16.993 1.00 0.00 O ATOM 695 CB GLU A 50 -1.259 -20.821 16.933 1.00 0.00 C ATOM 696 CG GLU A 50 -1.282 -22.056 17.818 1.00 0.00 C ATOM 697 CD GLU A 50 -1.228 -21.717 19.295 1.00 0.00 C ATOM 698 OE1 GLU A 50 -2.300 -21.477 19.889 1.00 0.00 O ATOM 699 OE2 GLU A 50 -0.113 -21.693 19.857 1.00 0.00 O ATOM 0 H GLU A 50 -0.901 -18.717 15.694 1.00 0.00 H new ATOM 0 HA GLU A 50 0.346 -19.831 17.965 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -2.040 -20.135 17.261 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -1.500 -21.112 15.911 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -2.187 -22.628 17.613 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -0.436 -22.696 17.565 1.00 0.00 H new ATOM 706 N ASN A 51 0.919 -21.553 15.196 1.00 0.00 N ATOM 707 CA ASN A 51 1.877 -22.441 14.548 1.00 0.00 C ATOM 708 C ASN A 51 2.817 -21.656 13.639 1.00 0.00 C ATOM 709 O ASN A 51 3.200 -22.128 12.568 1.00 0.00 O ATOM 710 CB ASN A 51 1.144 -23.513 13.739 1.00 0.00 C ATOM 711 CG ASN A 51 -0.033 -24.102 14.492 1.00 0.00 C ATOM 712 OD1 ASN A 51 -1.163 -23.630 14.368 1.00 0.00 O ATOM 713 ND2 ASN A 51 0.228 -25.140 15.279 1.00 0.00 N ATOM 0 H ASN A 51 0.058 -21.406 14.670 1.00 0.00 H new ATOM 0 HA ASN A 51 2.470 -22.924 15.325 1.00 0.00 H new ATOM 0 HB2 ASN A 51 0.793 -23.080 12.802 1.00 0.00 H new ATOM 0 HB3 ASN A 51 1.842 -24.310 13.480 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -0.524 -25.579 15.811 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.180 -25.498 15.351 1.00 0.00 H new ATOM 720 N ASP A 52 3.186 -20.456 14.073 1.00 0.00 N ATOM 721 CA ASP A 52 4.083 -19.606 13.300 1.00 0.00 C ATOM 722 C ASP A 52 3.464 -19.245 11.953 1.00 0.00 C ATOM 723 O ASP A 52 4.148 -19.225 10.931 1.00 0.00 O ATOM 724 CB ASP A 52 5.426 -20.306 13.086 1.00 0.00 C ATOM 725 CG ASP A 52 6.264 -20.350 14.349 1.00 0.00 C ATOM 726 OD1 ASP A 52 6.405 -19.296 15.005 1.00 0.00 O ATOM 727 OD2 ASP A 52 6.777 -21.438 14.683 1.00 0.00 O ATOM 0 H ASP A 52 2.877 -20.050 14.956 1.00 0.00 H new ATOM 0 HA ASP A 52 4.246 -18.687 13.863 1.00 0.00 H new ATOM 0 HB2 ASP A 52 5.250 -21.323 12.734 1.00 0.00 H new ATOM 0 HB3 ASP A 52 5.981 -19.789 12.303 1.00 0.00 H new ATOM 732 N GLU A 53 2.165 -18.961 11.962 1.00 0.00 N ATOM 733 CA GLU A 53 1.454 -18.604 10.740 1.00 0.00 C ATOM 734 C GLU A 53 1.801 -17.183 10.305 1.00 0.00 C ATOM 735 O GLU A 53 1.625 -16.228 11.062 1.00 0.00 O ATOM 736 CB GLU A 53 -0.057 -18.731 10.947 1.00 0.00 C ATOM 737 CG GLU A 53 -0.505 -20.136 11.311 1.00 0.00 C ATOM 738 CD GLU A 53 -0.498 -20.382 12.807 1.00 0.00 C ATOM 739 OE1 GLU A 53 0.133 -19.588 13.536 1.00 0.00 O ATOM 740 OE2 GLU A 53 -1.124 -21.368 13.249 1.00 0.00 O ATOM 0 H GLU A 53 1.585 -18.971 12.801 1.00 0.00 H new ATOM 0 HA GLU A 53 1.765 -19.293 9.954 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -0.366 -18.044 11.735 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -0.568 -18.421 10.035 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.510 -20.305 10.924 1.00 0.00 H new ATOM 0 HG3 GLU A 53 0.150 -20.859 10.825 1.00 0.00 H new ATOM 747 N THR A 54 2.296 -17.050 9.078 1.00 0.00 N ATOM 748 CA THR A 54 2.670 -15.747 8.542 1.00 0.00 C ATOM 749 C THR A 54 2.039 -15.514 7.174 1.00 0.00 C ATOM 750 O THR A 54 2.098 -16.376 6.297 1.00 0.00 O ATOM 751 CB THR A 54 4.200 -15.608 8.419 1.00 0.00 C ATOM 752 OG1 THR A 54 4.729 -16.688 7.641 1.00 0.00 O ATOM 753 CG2 THR A 54 4.854 -15.598 9.792 1.00 0.00 C ATOM 0 H THR A 54 2.447 -17.829 8.437 1.00 0.00 H new ATOM 0 HA THR A 54 2.300 -14.999 9.243 1.00 0.00 H new ATOM 0 HB THR A 54 4.418 -14.662 7.923 1.00 0.00 H new ATOM 0 HG1 THR A 54 5.701 -16.592 7.566 1.00 0.00 H new ATOM 0 HG21 THR A 54 5.934 -15.499 9.680 1.00 0.00 H new ATOM 0 HG22 THR A 54 4.471 -14.758 10.371 1.00 0.00 H new ATOM 0 HG23 THR A 54 4.627 -16.530 10.310 1.00 0.00 H new ATOM 761 N VAL A 55 1.434 -14.344 6.998 1.00 0.00 N ATOM 762 CA VAL A 55 0.793 -13.996 5.736 1.00 0.00 C ATOM 763 C VAL A 55 1.442 -12.767 5.110 1.00 0.00 C ATOM 764 O VAL A 55 1.950 -11.895 5.814 1.00 0.00 O ATOM 765 CB VAL A 55 -0.712 -13.729 5.926 1.00 0.00 C ATOM 766 CG1 VAL A 55 -1.322 -14.754 6.870 1.00 0.00 C ATOM 767 CG2 VAL A 55 -0.941 -12.316 6.440 1.00 0.00 C ATOM 0 H VAL A 55 1.374 -13.620 7.714 1.00 0.00 H new ATOM 0 HA VAL A 55 0.921 -14.849 5.070 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.205 -13.824 4.958 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.386 -14.549 6.992 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -1.190 -15.754 6.456 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -0.828 -14.695 7.840 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -2.010 -12.144 6.569 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.436 -12.191 7.398 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -0.542 -11.599 5.723 1.00 0.00 H new ATOM 777 N GLN A 56 1.420 -12.704 3.782 1.00 0.00 N ATOM 778 CA GLN A 56 2.006 -11.581 3.061 1.00 0.00 C ATOM 779 C GLN A 56 1.122 -11.164 1.891 1.00 0.00 C ATOM 780 O GLN A 56 0.321 -11.954 1.391 1.00 0.00 O ATOM 781 CB GLN A 56 3.403 -11.945 2.556 1.00 0.00 C ATOM 782 CG GLN A 56 4.189 -10.756 2.027 1.00 0.00 C ATOM 783 CD GLN A 56 5.469 -11.167 1.327 1.00 0.00 C ATOM 784 OE1 GLN A 56 5.547 -11.161 0.098 1.00 0.00 O ATOM 785 NE2 GLN A 56 6.481 -11.526 2.107 1.00 0.00 N ATOM 0 H GLN A 56 1.003 -13.418 3.184 1.00 0.00 H new ATOM 0 HA GLN A 56 2.084 -10.740 3.751 1.00 0.00 H new ATOM 0 HB2 GLN A 56 3.964 -12.408 3.368 1.00 0.00 H new ATOM 0 HB3 GLN A 56 3.312 -12.690 1.766 1.00 0.00 H new ATOM 0 HG2 GLN A 56 3.565 -10.193 1.333 1.00 0.00 H new ATOM 0 HG3 GLN A 56 4.430 -10.088 2.854 1.00 0.00 H new ATOM 0 HE21 GLN A 56 6.372 -11.516 3.121 1.00 0.00 H new ATOM 0 HE22 GLN A 56 7.368 -11.812 1.692 1.00 0.00 H new ATOM 794 N THR A 57 1.271 -9.916 1.458 1.00 0.00 N ATOM 795 CA THR A 57 0.485 -9.392 0.348 1.00 0.00 C ATOM 796 C THR A 57 1.252 -8.313 -0.408 1.00 0.00 C ATOM 797 O THR A 57 1.677 -7.315 0.174 1.00 0.00 O ATOM 798 CB THR A 57 -0.855 -8.809 0.834 1.00 0.00 C ATOM 799 OG1 THR A 57 -1.450 -8.020 -0.202 1.00 0.00 O ATOM 800 CG2 THR A 57 -0.654 -7.955 2.077 1.00 0.00 C ATOM 0 H THR A 57 1.930 -9.249 1.860 1.00 0.00 H new ATOM 0 HA THR A 57 0.287 -10.229 -0.321 1.00 0.00 H new ATOM 0 HB THR A 57 -1.517 -9.638 1.085 1.00 0.00 H new ATOM 0 HG1 THR A 57 -2.302 -7.654 0.114 1.00 0.00 H new ATOM 0 HG21 THR A 57 -1.614 -7.554 2.402 1.00 0.00 H new ATOM 0 HG22 THR A 57 -0.228 -8.566 2.873 1.00 0.00 H new ATOM 0 HG23 THR A 57 0.024 -7.133 1.848 1.00 0.00 H new ATOM 808 N THR A 58 1.426 -8.519 -1.710 1.00 0.00 N ATOM 809 CA THR A 58 2.142 -7.564 -2.546 1.00 0.00 C ATOM 810 C THR A 58 1.197 -6.510 -3.110 1.00 0.00 C ATOM 811 O THR A 58 0.431 -6.779 -4.036 1.00 0.00 O ATOM 812 CB THR A 58 2.863 -8.267 -3.712 1.00 0.00 C ATOM 813 OG1 THR A 58 3.756 -9.265 -3.205 1.00 0.00 O ATOM 814 CG2 THR A 58 3.639 -7.264 -4.551 1.00 0.00 C ATOM 0 H THR A 58 1.080 -9.339 -2.208 1.00 0.00 H new ATOM 0 HA THR A 58 2.883 -7.081 -1.909 1.00 0.00 H new ATOM 0 HB THR A 58 2.111 -8.740 -4.343 1.00 0.00 H new ATOM 0 HG1 THR A 58 4.209 -9.708 -3.952 1.00 0.00 H new ATOM 0 HG21 THR A 58 4.140 -7.783 -5.368 1.00 0.00 H new ATOM 0 HG22 THR A 58 2.952 -6.522 -4.959 1.00 0.00 H new ATOM 0 HG23 THR A 58 4.382 -6.766 -3.928 1.00 0.00 H new ATOM 822 N LEU A 59 1.254 -5.308 -2.546 1.00 0.00 N ATOM 823 CA LEU A 59 0.402 -4.211 -2.994 1.00 0.00 C ATOM 824 C LEU A 59 1.106 -3.375 -4.058 1.00 0.00 C ATOM 825 O LEU A 59 2.214 -2.883 -3.844 1.00 0.00 O ATOM 826 CB LEU A 59 0.012 -3.326 -1.809 1.00 0.00 C ATOM 827 CG LEU A 59 -0.577 -4.049 -0.597 1.00 0.00 C ATOM 828 CD1 LEU A 59 -0.625 -3.121 0.607 1.00 0.00 C ATOM 829 CD2 LEU A 59 -1.966 -4.582 -0.917 1.00 0.00 C ATOM 0 H LEU A 59 1.881 -5.068 -1.778 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.500 -4.639 -3.432 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.896 -2.777 -1.485 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.713 -2.589 -2.155 1.00 0.00 H new ATOM 0 HG LEU A 59 0.068 -4.894 -0.354 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.047 -3.653 1.460 1.00 0.00 H new ATOM 0 HD12 LEU A 59 0.384 -2.788 0.850 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -1.246 -2.256 0.375 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.370 -5.093 -0.043 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -2.620 -3.753 -1.187 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -1.904 -5.282 -1.750 1.00 0.00 H new ATOM 841 N LYS A 60 0.454 -3.216 -5.205 1.00 0.00 N ATOM 842 CA LYS A 60 1.014 -2.436 -6.302 1.00 0.00 C ATOM 843 C LYS A 60 0.383 -1.048 -6.360 1.00 0.00 C ATOM 844 O LYS A 60 -0.746 -0.888 -6.823 1.00 0.00 O ATOM 845 CB LYS A 60 0.799 -3.162 -7.632 1.00 0.00 C ATOM 846 CG LYS A 60 1.189 -2.336 -8.846 1.00 0.00 C ATOM 847 CD LYS A 60 0.719 -2.985 -10.137 1.00 0.00 C ATOM 848 CE LYS A 60 1.474 -2.442 -11.340 1.00 0.00 C ATOM 849 NZ LYS A 60 0.968 -1.104 -11.754 1.00 0.00 N ATOM 0 H LYS A 60 -0.463 -3.617 -5.399 1.00 0.00 H new ATOM 0 HA LYS A 60 2.084 -2.322 -6.126 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.378 -4.085 -7.630 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.250 -3.444 -7.717 1.00 0.00 H new ATOM 0 HG2 LYS A 60 0.758 -1.338 -8.762 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.272 -2.215 -8.872 1.00 0.00 H new ATOM 0 HD2 LYS A 60 0.859 -4.064 -10.075 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -0.349 -2.809 -10.266 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.535 -2.371 -11.101 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.381 -3.139 -12.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.739 -0.563 -12.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 0.193 -1.222 -12.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 0.619 -0.591 -10.919 1.00 0.00 H new ATOM 863 N PHE A 61 1.121 -0.048 -5.890 1.00 0.00 N ATOM 864 CA PHE A 61 0.634 1.326 -5.889 1.00 0.00 C ATOM 865 C PHE A 61 1.057 2.054 -7.162 1.00 0.00 C ATOM 866 O PHE A 61 2.234 2.061 -7.525 1.00 0.00 O ATOM 867 CB PHE A 61 1.157 2.075 -4.662 1.00 0.00 C ATOM 868 CG PHE A 61 0.743 1.454 -3.359 1.00 0.00 C ATOM 869 CD1 PHE A 61 -0.526 1.670 -2.845 1.00 0.00 C ATOM 870 CD2 PHE A 61 1.622 0.654 -2.647 1.00 0.00 C ATOM 871 CE1 PHE A 61 -0.911 1.100 -1.647 1.00 0.00 C ATOM 872 CE2 PHE A 61 1.242 0.080 -1.448 1.00 0.00 C ATOM 873 CZ PHE A 61 -0.025 0.304 -0.947 1.00 0.00 C ATOM 0 H PHE A 61 2.058 -0.164 -5.505 1.00 0.00 H new ATOM 0 HA PHE A 61 -0.455 1.298 -5.852 1.00 0.00 H new ATOM 0 HB2 PHE A 61 2.245 2.114 -4.707 1.00 0.00 H new ATOM 0 HB3 PHE A 61 0.799 3.104 -4.695 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -1.223 2.292 -3.388 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.615 0.477 -3.033 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -1.903 1.276 -1.258 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.936 -0.543 -0.904 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.323 -0.142 -0.010 1.00 0.00 H new ATOM 883 N THR A 62 0.089 2.667 -7.836 1.00 0.00 N ATOM 884 CA THR A 62 0.360 3.396 -9.069 1.00 0.00 C ATOM 885 C THR A 62 -0.020 4.866 -8.933 1.00 0.00 C ATOM 886 O THR A 62 -1.107 5.194 -8.456 1.00 0.00 O ATOM 887 CB THR A 62 -0.404 2.788 -10.260 1.00 0.00 C ATOM 888 OG1 THR A 62 -0.455 1.363 -10.134 1.00 0.00 O ATOM 889 CG2 THR A 62 0.261 3.162 -11.577 1.00 0.00 C ATOM 0 H THR A 62 -0.890 2.673 -7.549 1.00 0.00 H new ATOM 0 HA THR A 62 1.431 3.316 -9.255 1.00 0.00 H new ATOM 0 HB THR A 62 -1.418 3.189 -10.256 1.00 0.00 H new ATOM 0 HG1 THR A 62 -0.944 0.985 -10.894 1.00 0.00 H new ATOM 0 HG21 THR A 62 -0.296 2.721 -12.404 1.00 0.00 H new ATOM 0 HG22 THR A 62 0.272 4.247 -11.684 1.00 0.00 H new ATOM 0 HG23 THR A 62 1.284 2.786 -11.588 1.00 0.00 H new ATOM 897 N TYR A 63 0.880 5.746 -9.355 1.00 0.00 N ATOM 898 CA TYR A 63 0.639 7.182 -9.279 1.00 0.00 C ATOM 899 C TYR A 63 -0.303 7.636 -10.389 1.00 0.00 C ATOM 900 O TYR A 63 0.114 7.837 -11.530 1.00 0.00 O ATOM 901 CB TYR A 63 1.960 7.948 -9.371 1.00 0.00 C ATOM 902 CG TYR A 63 2.806 7.849 -8.122 1.00 0.00 C ATOM 903 CD1 TYR A 63 2.291 8.200 -6.880 1.00 0.00 C ATOM 904 CD2 TYR A 63 4.121 7.403 -8.183 1.00 0.00 C ATOM 905 CE1 TYR A 63 3.060 8.111 -5.736 1.00 0.00 C ATOM 906 CE2 TYR A 63 4.898 7.310 -7.044 1.00 0.00 C ATOM 907 CZ TYR A 63 4.363 7.666 -5.823 1.00 0.00 C ATOM 908 OH TYR A 63 5.132 7.575 -4.686 1.00 0.00 O ATOM 0 H TYR A 63 1.784 5.491 -9.753 1.00 0.00 H new ATOM 0 HA TYR A 63 0.169 7.395 -8.319 1.00 0.00 H new ATOM 0 HB2 TYR A 63 2.532 7.569 -10.218 1.00 0.00 H new ATOM 0 HB3 TYR A 63 1.748 8.998 -9.574 1.00 0.00 H new ATOM 0 HD1 TYR A 63 1.271 8.549 -6.808 1.00 0.00 H new ATOM 0 HD2 TYR A 63 4.543 7.124 -9.137 1.00 0.00 H new ATOM 0 HE1 TYR A 63 2.644 8.388 -4.779 1.00 0.00 H new ATOM 0 HE2 TYR A 63 5.918 6.961 -7.109 1.00 0.00 H new ATOM 0 HH TYR A 63 5.444 6.653 -4.575 1.00 0.00 H new ATOM 918 N SER A 64 -1.577 7.797 -10.046 1.00 0.00 N ATOM 919 CA SER A 64 -2.582 8.224 -11.013 1.00 0.00 C ATOM 920 C SER A 64 -2.376 9.686 -11.399 1.00 0.00 C ATOM 921 O SER A 64 -1.815 10.468 -10.633 1.00 0.00 O ATOM 922 CB SER A 64 -3.987 8.028 -10.441 1.00 0.00 C ATOM 923 OG SER A 64 -4.364 9.126 -9.629 1.00 0.00 O ATOM 0 H SER A 64 -1.938 7.638 -9.105 1.00 0.00 H new ATOM 0 HA SER A 64 -2.474 7.611 -11.908 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.702 7.912 -11.256 1.00 0.00 H new ATOM 0 HB3 SER A 64 -4.020 7.110 -9.855 1.00 0.00 H new ATOM 0 HG SER A 64 -5.266 8.978 -9.277 1.00 0.00 H new ATOM 929 N GLU A 65 -2.836 10.046 -12.593 1.00 0.00 N ATOM 930 CA GLU A 65 -2.702 11.414 -13.082 1.00 0.00 C ATOM 931 C GLU A 65 -3.235 12.412 -12.058 1.00 0.00 C ATOM 932 O GLU A 65 -2.897 13.595 -12.092 1.00 0.00 O ATOM 933 CB GLU A 65 -3.447 11.580 -14.408 1.00 0.00 C ATOM 934 CG GLU A 65 -4.836 10.964 -14.407 1.00 0.00 C ATOM 935 CD GLU A 65 -5.714 11.503 -15.520 1.00 0.00 C ATOM 936 OE1 GLU A 65 -5.466 12.639 -15.975 1.00 0.00 O ATOM 937 OE2 GLU A 65 -6.649 10.787 -15.937 1.00 0.00 O ATOM 0 H GLU A 65 -3.304 9.411 -13.239 1.00 0.00 H new ATOM 0 HA GLU A 65 -1.642 11.614 -13.241 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.530 12.642 -14.638 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -2.858 11.126 -15.205 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -4.750 9.882 -14.509 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.314 11.157 -13.447 1.00 0.00 H new ATOM 944 N LYS A 66 -4.072 11.926 -11.147 1.00 0.00 N ATOM 945 CA LYS A 66 -4.652 12.773 -10.112 1.00 0.00 C ATOM 946 C LYS A 66 -4.348 12.220 -8.723 1.00 0.00 C ATOM 947 O LYS A 66 -5.040 11.326 -8.235 1.00 0.00 O ATOM 948 CB LYS A 66 -6.166 12.888 -10.307 1.00 0.00 C ATOM 949 CG LYS A 66 -6.565 13.393 -11.683 1.00 0.00 C ATOM 950 CD LYS A 66 -6.546 14.911 -11.747 1.00 0.00 C ATOM 951 CE LYS A 66 -7.829 15.508 -11.189 1.00 0.00 C ATOM 952 NZ LYS A 66 -8.936 15.474 -12.184 1.00 0.00 N ATOM 0 H LYS A 66 -4.364 10.949 -11.105 1.00 0.00 H new ATOM 0 HA LYS A 66 -4.205 13.764 -10.195 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -6.620 11.911 -10.142 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -6.571 13.560 -9.551 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -5.884 12.988 -12.432 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -7.563 13.030 -11.930 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -5.693 15.289 -11.184 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -6.414 15.231 -12.781 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -8.127 14.959 -10.296 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -7.647 16.538 -10.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -9.792 15.890 -11.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -8.663 16.020 -13.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -9.127 14.489 -12.457 1.00 0.00 H new ATOM 966 N TYR A 67 -3.312 12.759 -8.090 1.00 0.00 N ATOM 967 CA TYR A 67 -2.916 12.318 -6.758 1.00 0.00 C ATOM 968 C TYR A 67 -1.876 13.260 -6.159 1.00 0.00 C ATOM 969 O TYR A 67 -1.035 13.823 -6.860 1.00 0.00 O ATOM 970 CB TYR A 67 -2.361 10.894 -6.812 1.00 0.00 C ATOM 971 CG TYR A 67 -1.322 10.608 -5.752 1.00 0.00 C ATOM 972 CD1 TYR A 67 -0.025 11.094 -5.873 1.00 0.00 C ATOM 973 CD2 TYR A 67 -1.636 9.853 -4.629 1.00 0.00 C ATOM 974 CE1 TYR A 67 0.928 10.835 -4.907 1.00 0.00 C ATOM 975 CE2 TYR A 67 -0.690 9.590 -3.657 1.00 0.00 C ATOM 976 CZ TYR A 67 0.590 10.083 -3.801 1.00 0.00 C ATOM 977 OH TYR A 67 1.536 9.822 -2.835 1.00 0.00 O ATOM 0 H TYR A 67 -2.731 13.502 -8.478 1.00 0.00 H new ATOM 0 HA TYR A 67 -3.801 12.331 -6.121 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -3.184 10.188 -6.702 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -1.922 10.721 -7.795 1.00 0.00 H new ATOM 0 HD1 TYR A 67 0.242 11.684 -6.737 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -2.637 9.465 -4.514 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.931 11.219 -5.017 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -0.951 9.002 -2.790 1.00 0.00 H new ATOM 0 HH TYR A 67 1.097 9.729 -1.964 1.00 0.00 H new ATOM 987 N PRO A 68 -1.933 13.434 -4.830 1.00 0.00 N ATOM 988 CA PRO A 68 -2.930 12.769 -3.986 1.00 0.00 C ATOM 989 C PRO A 68 -4.337 13.310 -4.216 1.00 0.00 C ATOM 990 O PRO A 68 -5.323 12.695 -3.809 1.00 0.00 O ATOM 991 CB PRO A 68 -2.460 13.088 -2.565 1.00 0.00 C ATOM 992 CG PRO A 68 -1.682 14.351 -2.697 1.00 0.00 C ATOM 993 CD PRO A 68 -1.028 14.295 -4.050 1.00 0.00 C ATOM 0 HA PRO A 68 -2.998 11.702 -4.198 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -3.305 13.213 -1.887 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -1.844 12.284 -2.162 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -2.333 15.221 -2.614 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -0.936 14.435 -1.906 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -0.935 15.287 -4.493 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -0.023 13.876 -3.994 1.00 0.00 H new ATOM 1001 N ASP A 69 -4.423 14.463 -4.871 1.00 0.00 N ATOM 1002 CA ASP A 69 -5.711 15.085 -5.157 1.00 0.00 C ATOM 1003 C ASP A 69 -6.808 14.033 -5.279 1.00 0.00 C ATOM 1004 O ASP A 69 -7.914 14.213 -4.770 1.00 0.00 O ATOM 1005 CB ASP A 69 -5.629 15.908 -6.444 1.00 0.00 C ATOM 1006 CG ASP A 69 -5.983 15.095 -7.673 1.00 0.00 C ATOM 1007 OD1 ASP A 69 -7.189 14.882 -7.918 1.00 0.00 O ATOM 1008 OD2 ASP A 69 -5.053 14.672 -8.392 1.00 0.00 O ATOM 0 H ASP A 69 -3.617 14.985 -5.214 1.00 0.00 H new ATOM 0 HA ASP A 69 -5.959 15.747 -4.327 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -6.303 16.762 -6.370 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -4.620 16.307 -6.554 1.00 0.00 H new ATOM 1013 N GLU A 70 -6.495 12.934 -5.959 1.00 0.00 N ATOM 1014 CA GLU A 70 -7.455 11.854 -6.150 1.00 0.00 C ATOM 1015 C GLU A 70 -6.853 10.512 -5.744 1.00 0.00 C ATOM 1016 O GLU A 70 -5.665 10.265 -5.949 1.00 0.00 O ATOM 1017 CB GLU A 70 -7.912 11.800 -7.609 1.00 0.00 C ATOM 1018 CG GLU A 70 -9.137 12.653 -7.896 1.00 0.00 C ATOM 1019 CD GLU A 70 -10.413 12.045 -7.347 1.00 0.00 C ATOM 1020 OE1 GLU A 70 -10.395 10.848 -6.991 1.00 0.00 O ATOM 1021 OE2 GLU A 70 -11.429 12.767 -7.273 1.00 0.00 O ATOM 0 H GLU A 70 -5.584 12.769 -6.387 1.00 0.00 H new ATOM 0 HA GLU A 70 -8.317 12.053 -5.514 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -7.093 12.128 -8.250 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -8.130 10.766 -7.875 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -8.995 13.643 -7.463 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -9.237 12.788 -8.973 1.00 0.00 H new ATOM 1028 N ALA A 71 -7.682 9.649 -5.166 1.00 0.00 N ATOM 1029 CA ALA A 71 -7.233 8.332 -4.732 1.00 0.00 C ATOM 1030 C ALA A 71 -6.521 7.596 -5.861 1.00 0.00 C ATOM 1031 O ALA A 71 -7.050 7.435 -6.961 1.00 0.00 O ATOM 1032 CB ALA A 71 -8.411 7.513 -4.225 1.00 0.00 C ATOM 0 H ALA A 71 -8.668 9.838 -4.987 1.00 0.00 H new ATOM 0 HA ALA A 71 -6.522 8.468 -3.917 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -8.061 6.532 -3.904 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -8.875 8.026 -3.383 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.142 7.394 -5.025 1.00 0.00 H new ATOM 1038 N PRO A 72 -5.290 7.137 -5.586 1.00 0.00 N ATOM 1039 CA PRO A 72 -4.479 6.410 -6.567 1.00 0.00 C ATOM 1040 C PRO A 72 -5.036 5.022 -6.866 1.00 0.00 C ATOM 1041 O PRO A 72 -6.175 4.710 -6.514 1.00 0.00 O ATOM 1042 CB PRO A 72 -3.112 6.302 -5.887 1.00 0.00 C ATOM 1043 CG PRO A 72 -3.407 6.383 -4.429 1.00 0.00 C ATOM 1044 CD PRO A 72 -4.597 7.293 -4.297 1.00 0.00 C ATOM 0 HA PRO A 72 -4.452 6.919 -7.531 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -2.617 5.364 -6.139 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -2.448 7.107 -6.202 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -3.623 5.396 -4.019 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.552 6.776 -3.879 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -5.234 7.003 -3.461 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.296 8.326 -4.125 1.00 0.00 H new ATOM 1052 N LEU A 73 -4.228 4.192 -7.515 1.00 0.00 N ATOM 1053 CA LEU A 73 -4.640 2.836 -7.860 1.00 0.00 C ATOM 1054 C LEU A 73 -3.953 1.813 -6.962 1.00 0.00 C ATOM 1055 O LEU A 73 -2.745 1.882 -6.735 1.00 0.00 O ATOM 1056 CB LEU A 73 -4.318 2.542 -9.327 1.00 0.00 C ATOM 1057 CG LEU A 73 -5.250 3.177 -10.359 1.00 0.00 C ATOM 1058 CD1 LEU A 73 -6.589 2.456 -10.383 1.00 0.00 C ATOM 1059 CD2 LEU A 73 -5.444 4.657 -10.064 1.00 0.00 C ATOM 0 H LEU A 73 -3.283 4.434 -7.813 1.00 0.00 H new ATOM 0 HA LEU A 73 -5.717 2.760 -7.708 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -3.301 2.879 -9.529 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -4.331 1.462 -9.472 1.00 0.00 H new ATOM 0 HG LEU A 73 -4.791 3.081 -11.343 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -7.240 2.922 -11.123 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -6.434 1.409 -10.643 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -7.054 2.520 -9.399 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -6.110 5.092 -10.809 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -5.881 4.776 -9.073 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -4.480 5.164 -10.099 1.00 0.00 H new ATOM 1071 N TYR A 74 -4.730 0.862 -6.455 1.00 0.00 N ATOM 1072 CA TYR A 74 -4.197 -0.176 -5.581 1.00 0.00 C ATOM 1073 C TYR A 74 -4.679 -1.556 -6.017 1.00 0.00 C ATOM 1074 O TYR A 74 -5.877 -1.782 -6.184 1.00 0.00 O ATOM 1075 CB TYR A 74 -4.610 0.086 -4.132 1.00 0.00 C ATOM 1076 CG TYR A 74 -6.107 0.166 -3.934 1.00 0.00 C ATOM 1077 CD1 TYR A 74 -6.855 -0.974 -3.669 1.00 0.00 C ATOM 1078 CD2 TYR A 74 -6.774 1.383 -4.012 1.00 0.00 C ATOM 1079 CE1 TYR A 74 -8.223 -0.905 -3.488 1.00 0.00 C ATOM 1080 CE2 TYR A 74 -8.141 1.462 -3.831 1.00 0.00 C ATOM 1081 CZ TYR A 74 -8.861 0.315 -3.570 1.00 0.00 C ATOM 1082 OH TYR A 74 -10.223 0.387 -3.389 1.00 0.00 O ATOM 0 H TYR A 74 -5.731 0.789 -6.634 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.110 -0.152 -5.652 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -4.210 -0.707 -3.500 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -4.157 1.019 -3.797 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -6.359 -1.931 -3.603 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -6.213 2.283 -4.218 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -8.790 -1.801 -3.283 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -8.643 2.416 -3.893 1.00 0.00 H new ATOM 0 HH TYR A 74 -10.510 -0.324 -2.779 1.00 0.00 H new ATOM 1092 N GLU A 75 -3.736 -2.475 -6.200 1.00 0.00 N ATOM 1093 CA GLU A 75 -4.064 -3.833 -6.617 1.00 0.00 C ATOM 1094 C GLU A 75 -3.140 -4.846 -5.947 1.00 0.00 C ATOM 1095 O GLU A 75 -1.963 -4.569 -5.715 1.00 0.00 O ATOM 1096 CB GLU A 75 -3.963 -3.962 -8.138 1.00 0.00 C ATOM 1097 CG GLU A 75 -3.888 -5.399 -8.624 1.00 0.00 C ATOM 1098 CD GLU A 75 -4.211 -5.534 -10.099 1.00 0.00 C ATOM 1099 OE1 GLU A 75 -5.333 -5.160 -10.498 1.00 0.00 O ATOM 1100 OE2 GLU A 75 -3.340 -6.014 -10.855 1.00 0.00 O ATOM 0 H GLU A 75 -2.739 -2.304 -6.066 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.088 -4.042 -6.309 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -4.827 -3.478 -8.593 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -3.079 -3.425 -8.482 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.888 -5.790 -8.438 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -4.582 -6.010 -8.047 1.00 0.00 H new ATOM 1107 N ILE A 76 -3.681 -6.020 -5.640 1.00 0.00 N ATOM 1108 CA ILE A 76 -2.906 -7.074 -4.999 1.00 0.00 C ATOM 1109 C ILE A 76 -2.359 -8.058 -6.027 1.00 0.00 C ATOM 1110 O ILE A 76 -3.094 -8.890 -6.559 1.00 0.00 O ATOM 1111 CB ILE A 76 -3.749 -7.844 -3.966 1.00 0.00 C ATOM 1112 CG1 ILE A 76 -4.347 -6.878 -2.941 1.00 0.00 C ATOM 1113 CG2 ILE A 76 -2.903 -8.902 -3.274 1.00 0.00 C ATOM 1114 CD1 ILE A 76 -5.407 -7.508 -2.064 1.00 0.00 C ATOM 0 H ILE A 76 -4.654 -6.265 -5.825 1.00 0.00 H new ATOM 0 HA ILE A 76 -2.075 -6.587 -4.488 1.00 0.00 H new ATOM 0 HB ILE A 76 -4.566 -8.344 -4.486 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -3.548 -6.490 -2.309 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -4.780 -6.026 -3.466 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -3.513 -9.438 -2.547 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -2.521 -9.604 -4.015 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -2.067 -8.423 -2.764 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -5.786 -6.766 -1.362 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -6.225 -7.871 -2.686 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -4.974 -8.342 -1.512 1.00 0.00 H new ATOM 1126 N PHE A 77 -1.062 -7.959 -6.302 1.00 0.00 N ATOM 1127 CA PHE A 77 -0.416 -8.841 -7.267 1.00 0.00 C ATOM 1128 C PHE A 77 -0.503 -10.296 -6.817 1.00 0.00 C ATOM 1129 O PHE A 77 -0.748 -11.193 -7.625 1.00 0.00 O ATOM 1130 CB PHE A 77 1.049 -8.440 -7.454 1.00 0.00 C ATOM 1131 CG PHE A 77 1.641 -8.918 -8.749 1.00 0.00 C ATOM 1132 CD1 PHE A 77 1.496 -8.173 -9.909 1.00 0.00 C ATOM 1133 CD2 PHE A 77 2.341 -10.112 -8.808 1.00 0.00 C ATOM 1134 CE1 PHE A 77 2.039 -8.610 -11.102 1.00 0.00 C ATOM 1135 CE2 PHE A 77 2.886 -10.555 -9.998 1.00 0.00 C ATOM 1136 CZ PHE A 77 2.736 -9.802 -11.147 1.00 0.00 C ATOM 0 H PHE A 77 -0.438 -7.277 -5.870 1.00 0.00 H new ATOM 0 HA PHE A 77 -0.938 -8.742 -8.219 1.00 0.00 H new ATOM 0 HB2 PHE A 77 1.129 -7.354 -7.406 1.00 0.00 H new ATOM 0 HB3 PHE A 77 1.635 -8.840 -6.626 1.00 0.00 H new ATOM 0 HD1 PHE A 77 0.952 -7.240 -9.880 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.462 -10.704 -7.913 1.00 0.00 H new ATOM 0 HE1 PHE A 77 1.919 -8.020 -11.999 1.00 0.00 H new ATOM 0 HE2 PHE A 77 3.428 -11.488 -10.030 1.00 0.00 H new ATOM 0 HZ PHE A 77 3.163 -10.145 -12.078 1.00 0.00 H new ATOM 1146 N SER A 78 -0.302 -10.522 -5.523 1.00 0.00 N ATOM 1147 CA SER A 78 -0.354 -11.869 -4.966 1.00 0.00 C ATOM 1148 C SER A 78 -0.480 -11.823 -3.446 1.00 0.00 C ATOM 1149 O SER A 78 -0.095 -10.842 -2.810 1.00 0.00 O ATOM 1150 CB SER A 78 0.897 -12.656 -5.361 1.00 0.00 C ATOM 1151 OG SER A 78 0.643 -14.050 -5.364 1.00 0.00 O ATOM 0 H SER A 78 -0.102 -9.791 -4.841 1.00 0.00 H new ATOM 0 HA SER A 78 -1.233 -12.370 -5.372 1.00 0.00 H new ATOM 0 HB2 SER A 78 1.231 -12.342 -6.350 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.706 -12.432 -4.666 1.00 0.00 H new ATOM 0 HG SER A 78 1.458 -14.530 -5.621 1.00 0.00 H new ATOM 1157 N GLN A 79 -1.024 -12.891 -2.871 1.00 0.00 N ATOM 1158 CA GLN A 79 -1.203 -12.973 -1.426 1.00 0.00 C ATOM 1159 C GLN A 79 -1.076 -14.414 -0.943 1.00 0.00 C ATOM 1160 O GLN A 79 -1.145 -15.352 -1.736 1.00 0.00 O ATOM 1161 CB GLN A 79 -2.566 -12.406 -1.027 1.00 0.00 C ATOM 1162 CG GLN A 79 -3.737 -13.270 -1.468 1.00 0.00 C ATOM 1163 CD GLN A 79 -4.235 -12.914 -2.854 1.00 0.00 C ATOM 1164 OE1 GLN A 79 -4.547 -11.756 -3.136 1.00 0.00 O ATOM 1165 NE2 GLN A 79 -4.313 -13.910 -3.729 1.00 0.00 N ATOM 0 H GLN A 79 -1.348 -13.711 -3.383 1.00 0.00 H new ATOM 0 HA GLN A 79 -0.419 -12.381 -0.953 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -2.599 -12.290 0.056 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -2.677 -11.411 -1.458 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -3.437 -14.318 -1.452 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -4.553 -13.161 -0.754 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -4.044 -14.854 -3.452 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -4.642 -13.731 -4.678 1.00 0.00 H new ATOM 1174 N GLU A 80 -0.891 -14.581 0.363 1.00 0.00 N ATOM 1175 CA GLU A 80 -0.754 -15.908 0.951 1.00 0.00 C ATOM 1176 C GLU A 80 -1.581 -16.026 2.228 1.00 0.00 C ATOM 1177 O GLU A 80 -1.592 -15.118 3.058 1.00 0.00 O ATOM 1178 CB GLU A 80 0.716 -16.207 1.253 1.00 0.00 C ATOM 1179 CG GLU A 80 1.545 -16.498 0.013 1.00 0.00 C ATOM 1180 CD GLU A 80 1.700 -15.285 -0.884 1.00 0.00 C ATOM 1181 OE1 GLU A 80 1.785 -14.160 -0.349 1.00 0.00 O ATOM 1182 OE2 GLU A 80 1.735 -15.461 -2.119 1.00 0.00 O ATOM 0 H GLU A 80 -0.833 -13.814 1.033 1.00 0.00 H new ATOM 0 HA GLU A 80 -1.125 -16.636 0.230 1.00 0.00 H new ATOM 0 HB2 GLU A 80 1.150 -15.357 1.779 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.773 -17.062 1.927 1.00 0.00 H new ATOM 0 HG2 GLU A 80 2.531 -16.850 0.315 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.077 -17.305 -0.551 1.00 0.00 H new ATOM 1189 N ASN A 81 -2.272 -17.151 2.376 1.00 0.00 N ATOM 1190 CA ASN A 81 -3.103 -17.388 3.551 1.00 0.00 C ATOM 1191 C ASN A 81 -4.200 -16.333 3.663 1.00 0.00 C ATOM 1192 O ASN A 81 -4.475 -15.819 4.748 1.00 0.00 O ATOM 1193 CB ASN A 81 -2.246 -17.383 4.818 1.00 0.00 C ATOM 1194 CG ASN A 81 -1.280 -18.552 4.867 1.00 0.00 C ATOM 1195 OD1 ASN A 81 -1.566 -19.630 4.344 1.00 0.00 O ATOM 1196 ND2 ASN A 81 -0.130 -18.343 5.496 1.00 0.00 N ATOM 0 H ASN A 81 -2.273 -17.913 1.698 1.00 0.00 H new ATOM 0 HA ASN A 81 -3.572 -18.366 3.441 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.686 -16.450 4.871 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -2.895 -17.415 5.693 1.00 0.00 H new ATOM 0 HD21 ASN A 81 0.559 -19.092 5.561 1.00 0.00 H new ATOM 0 HD22 ASN A 81 0.064 -17.433 5.915 1.00 0.00 H new ATOM 1203 N LEU A 82 -4.825 -16.016 2.534 1.00 0.00 N ATOM 1204 CA LEU A 82 -5.894 -15.023 2.504 1.00 0.00 C ATOM 1205 C LEU A 82 -6.937 -15.378 1.450 1.00 0.00 C ATOM 1206 O LEU A 82 -6.632 -15.445 0.260 1.00 0.00 O ATOM 1207 CB LEU A 82 -5.318 -13.634 2.222 1.00 0.00 C ATOM 1208 CG LEU A 82 -4.384 -13.065 3.290 1.00 0.00 C ATOM 1209 CD1 LEU A 82 -3.508 -11.969 2.703 1.00 0.00 C ATOM 1210 CD2 LEU A 82 -5.183 -12.537 4.472 1.00 0.00 C ATOM 0 H LEU A 82 -4.610 -16.432 1.628 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.379 -15.017 3.480 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.776 -13.672 1.277 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.147 -12.940 2.086 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.737 -13.868 3.645 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -2.850 -11.576 3.477 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.908 -12.379 1.890 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -4.138 -11.166 2.320 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -4.501 -12.136 5.222 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.855 -11.748 4.134 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.766 -13.348 4.908 1.00 0.00 H new ATOM 1222 N GLU A 83 -8.170 -15.601 1.896 1.00 0.00 N ATOM 1223 CA GLU A 83 -9.258 -15.947 0.989 1.00 0.00 C ATOM 1224 C GLU A 83 -9.879 -14.693 0.380 1.00 0.00 C ATOM 1225 O GLU A 83 -9.594 -13.575 0.810 1.00 0.00 O ATOM 1226 CB GLU A 83 -10.330 -16.753 1.728 1.00 0.00 C ATOM 1227 CG GLU A 83 -11.064 -15.956 2.793 1.00 0.00 C ATOM 1228 CD GLU A 83 -11.650 -16.836 3.880 1.00 0.00 C ATOM 1229 OE1 GLU A 83 -10.872 -17.352 4.709 1.00 0.00 O ATOM 1230 OE2 GLU A 83 -12.886 -17.009 3.901 1.00 0.00 O ATOM 0 H GLU A 83 -8.440 -15.548 2.878 1.00 0.00 H new ATOM 0 HA GLU A 83 -8.846 -16.555 0.184 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.053 -17.129 1.004 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -9.864 -17.622 2.193 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -10.377 -15.239 3.242 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -11.864 -15.382 2.325 1.00 0.00 H new ATOM 1237 N ASP A 84 -10.727 -14.888 -0.623 1.00 0.00 N ATOM 1238 CA ASP A 84 -11.389 -13.774 -1.292 1.00 0.00 C ATOM 1239 C ASP A 84 -12.023 -12.829 -0.276 1.00 0.00 C ATOM 1240 O ASP A 84 -11.995 -11.611 -0.445 1.00 0.00 O ATOM 1241 CB ASP A 84 -12.455 -14.292 -2.259 1.00 0.00 C ATOM 1242 CG ASP A 84 -13.782 -14.548 -1.574 1.00 0.00 C ATOM 1243 OD1 ASP A 84 -13.959 -15.652 -1.018 1.00 0.00 O ATOM 1244 OD2 ASP A 84 -14.645 -13.646 -1.594 1.00 0.00 O ATOM 0 H ASP A 84 -10.973 -15.807 -0.991 1.00 0.00 H new ATOM 0 HA ASP A 84 -10.636 -13.222 -1.855 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -12.597 -13.567 -3.061 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -12.104 -15.215 -2.722 1.00 0.00 H new ATOM 1249 N ASN A 85 -12.594 -13.400 0.780 1.00 0.00 N ATOM 1250 CA ASN A 85 -13.236 -12.608 1.823 1.00 0.00 C ATOM 1251 C ASN A 85 -12.228 -11.690 2.507 1.00 0.00 C ATOM 1252 O ASN A 85 -12.490 -10.504 2.708 1.00 0.00 O ATOM 1253 CB ASN A 85 -13.891 -13.526 2.858 1.00 0.00 C ATOM 1254 CG ASN A 85 -14.547 -12.751 3.984 1.00 0.00 C ATOM 1255 OD1 ASN A 85 -14.431 -11.527 4.061 1.00 0.00 O ATOM 1256 ND2 ASN A 85 -15.240 -13.462 4.866 1.00 0.00 N ATOM 0 H ASN A 85 -12.625 -14.408 0.936 1.00 0.00 H new ATOM 0 HA ASN A 85 -14.004 -11.991 1.356 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -14.638 -14.149 2.366 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -13.139 -14.197 3.272 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -15.703 -12.996 5.646 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -15.310 -14.474 4.763 1.00 0.00 H new ATOM 1263 N ASP A 86 -11.075 -12.246 2.862 1.00 0.00 N ATOM 1264 CA ASP A 86 -10.026 -11.477 3.522 1.00 0.00 C ATOM 1265 C ASP A 86 -9.406 -10.467 2.561 1.00 0.00 C ATOM 1266 O ASP A 86 -9.380 -9.268 2.836 1.00 0.00 O ATOM 1267 CB ASP A 86 -8.945 -12.411 4.067 1.00 0.00 C ATOM 1268 CG ASP A 86 -9.474 -13.347 5.136 1.00 0.00 C ATOM 1269 OD1 ASP A 86 -10.453 -12.976 5.817 1.00 0.00 O ATOM 1270 OD2 ASP A 86 -8.909 -14.450 5.293 1.00 0.00 O ATOM 0 H ASP A 86 -10.843 -13.227 2.704 1.00 0.00 H new ATOM 0 HA ASP A 86 -10.477 -10.933 4.352 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.529 -12.998 3.248 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.130 -11.817 4.480 1.00 0.00 H new ATOM 1275 N VAL A 87 -8.906 -10.962 1.433 1.00 0.00 N ATOM 1276 CA VAL A 87 -8.286 -10.103 0.431 1.00 0.00 C ATOM 1277 C VAL A 87 -9.152 -8.883 0.140 1.00 0.00 C ATOM 1278 O VAL A 87 -8.660 -7.756 0.095 1.00 0.00 O ATOM 1279 CB VAL A 87 -8.034 -10.866 -0.884 1.00 0.00 C ATOM 1280 CG1 VAL A 87 -7.437 -9.940 -1.933 1.00 0.00 C ATOM 1281 CG2 VAL A 87 -7.127 -12.063 -0.639 1.00 0.00 C ATOM 0 H VAL A 87 -8.918 -11.953 1.190 1.00 0.00 H new ATOM 0 HA VAL A 87 -7.331 -9.776 0.842 1.00 0.00 H new ATOM 0 HB VAL A 87 -8.989 -11.233 -1.260 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -7.266 -10.496 -2.855 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -8.126 -9.118 -2.128 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -6.490 -9.541 -1.569 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -6.959 -12.591 -1.578 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -6.172 -11.720 -0.240 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -7.599 -12.737 0.076 1.00 0.00 H new ATOM 1291 N SER A 88 -10.446 -9.117 -0.057 1.00 0.00 N ATOM 1292 CA SER A 88 -11.382 -8.037 -0.348 1.00 0.00 C ATOM 1293 C SER A 88 -11.384 -7.003 0.775 1.00 0.00 C ATOM 1294 O SER A 88 -11.049 -5.838 0.562 1.00 0.00 O ATOM 1295 CB SER A 88 -12.792 -8.595 -0.545 1.00 0.00 C ATOM 1296 OG SER A 88 -13.693 -7.576 -0.942 1.00 0.00 O ATOM 0 H SER A 88 -10.870 -10.044 -0.020 1.00 0.00 H new ATOM 0 HA SER A 88 -11.061 -7.549 -1.268 1.00 0.00 H new ATOM 0 HB2 SER A 88 -12.773 -9.382 -1.299 1.00 0.00 H new ATOM 0 HB3 SER A 88 -13.139 -9.051 0.382 1.00 0.00 H new ATOM 0 HG SER A 88 -14.587 -7.959 -1.063 1.00 0.00 H new ATOM 1302 N ASP A 89 -11.765 -7.439 1.971 1.00 0.00 N ATOM 1303 CA ASP A 89 -11.810 -6.554 3.128 1.00 0.00 C ATOM 1304 C ASP A 89 -10.594 -5.633 3.157 1.00 0.00 C ATOM 1305 O ASP A 89 -10.683 -4.484 3.590 1.00 0.00 O ATOM 1306 CB ASP A 89 -11.877 -7.371 4.420 1.00 0.00 C ATOM 1307 CG ASP A 89 -13.273 -7.887 4.706 1.00 0.00 C ATOM 1308 OD1 ASP A 89 -13.794 -8.673 3.887 1.00 0.00 O ATOM 1309 OD2 ASP A 89 -13.845 -7.505 5.749 1.00 0.00 O ATOM 0 H ASP A 89 -12.047 -8.400 2.164 1.00 0.00 H new ATOM 0 HA ASP A 89 -12.707 -5.939 3.049 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -11.189 -8.213 4.350 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -11.543 -6.754 5.254 1.00 0.00 H new ATOM 1314 N ILE A 90 -9.459 -6.146 2.693 1.00 0.00 N ATOM 1315 CA ILE A 90 -8.226 -5.370 2.665 1.00 0.00 C ATOM 1316 C ILE A 90 -8.287 -4.279 1.602 1.00 0.00 C ATOM 1317 O ILE A 90 -7.782 -3.173 1.801 1.00 0.00 O ATOM 1318 CB ILE A 90 -7.003 -6.266 2.396 1.00 0.00 C ATOM 1319 CG1 ILE A 90 -6.878 -7.336 3.482 1.00 0.00 C ATOM 1320 CG2 ILE A 90 -5.736 -5.426 2.324 1.00 0.00 C ATOM 1321 CD1 ILE A 90 -5.809 -8.368 3.195 1.00 0.00 C ATOM 0 H ILE A 90 -9.368 -7.095 2.332 1.00 0.00 H new ATOM 0 HA ILE A 90 -8.120 -4.910 3.648 1.00 0.00 H new ATOM 0 HB ILE A 90 -7.141 -6.764 1.436 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -6.658 -6.852 4.434 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -7.837 -7.841 3.595 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.880 -6.074 2.133 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.827 -4.698 1.517 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.592 -4.903 3.270 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -5.777 -9.094 4.007 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -6.038 -8.879 2.260 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -4.840 -7.875 3.111 1.00 0.00 H new ATOM 1333 N LEU A 91 -8.908 -4.596 0.471 1.00 0.00 N ATOM 1334 CA LEU A 91 -9.038 -3.642 -0.625 1.00 0.00 C ATOM 1335 C LEU A 91 -9.925 -2.468 -0.223 1.00 0.00 C ATOM 1336 O LEU A 91 -9.469 -1.327 -0.153 1.00 0.00 O ATOM 1337 CB LEU A 91 -9.614 -4.332 -1.862 1.00 0.00 C ATOM 1338 CG LEU A 91 -8.747 -5.427 -2.485 1.00 0.00 C ATOM 1339 CD1 LEU A 91 -9.604 -6.396 -3.284 1.00 0.00 C ATOM 1340 CD2 LEU A 91 -7.668 -4.815 -3.367 1.00 0.00 C ATOM 0 H LEU A 91 -9.330 -5.507 0.289 1.00 0.00 H new ATOM 0 HA LEU A 91 -8.045 -3.259 -0.860 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -10.577 -4.767 -1.595 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -9.806 -3.573 -2.620 1.00 0.00 H new ATOM 0 HG LEU A 91 -8.261 -5.981 -1.682 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -8.970 -7.168 -3.720 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -10.339 -6.859 -2.626 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -10.118 -5.856 -4.080 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -7.060 -5.608 -3.802 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -8.135 -4.237 -4.164 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -7.035 -4.161 -2.767 1.00 0.00 H new ATOM 1352 N LYS A 92 -11.195 -2.757 0.042 1.00 0.00 N ATOM 1353 CA LYS A 92 -12.147 -1.727 0.440 1.00 0.00 C ATOM 1354 C LYS A 92 -11.552 -0.822 1.514 1.00 0.00 C ATOM 1355 O LYS A 92 -11.756 0.393 1.499 1.00 0.00 O ATOM 1356 CB LYS A 92 -13.437 -2.368 0.957 1.00 0.00 C ATOM 1357 CG LYS A 92 -13.338 -2.867 2.388 1.00 0.00 C ATOM 1358 CD LYS A 92 -14.663 -3.428 2.876 1.00 0.00 C ATOM 1359 CE LYS A 92 -14.814 -3.270 4.381 1.00 0.00 C ATOM 1360 NZ LYS A 92 -14.948 -1.841 4.778 1.00 0.00 N ATOM 0 H LYS A 92 -11.589 -3.696 -0.012 1.00 0.00 H new ATOM 0 HA LYS A 92 -12.375 -1.121 -0.437 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -14.246 -1.641 0.890 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -13.704 -3.202 0.308 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -12.570 -3.637 2.453 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -13.026 -2.050 3.038 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -15.483 -2.918 2.371 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -14.733 -4.483 2.611 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -15.690 -3.824 4.718 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -13.949 -3.706 4.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -15.439 -1.779 5.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -14.003 -1.414 4.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -15.496 -1.330 4.056 1.00 0.00 H new ATOM 1374 N LEU A 93 -10.814 -1.419 2.443 1.00 0.00 N ATOM 1375 CA LEU A 93 -10.187 -0.667 3.524 1.00 0.00 C ATOM 1376 C LEU A 93 -9.258 0.410 2.970 1.00 0.00 C ATOM 1377 O LEU A 93 -9.125 1.488 3.551 1.00 0.00 O ATOM 1378 CB LEU A 93 -9.405 -1.608 4.441 1.00 0.00 C ATOM 1379 CG LEU A 93 -8.416 -0.944 5.400 1.00 0.00 C ATOM 1380 CD1 LEU A 93 -9.136 -0.430 6.637 1.00 0.00 C ATOM 1381 CD2 LEU A 93 -7.313 -1.918 5.788 1.00 0.00 C ATOM 0 H LEU A 93 -10.635 -2.423 2.469 1.00 0.00 H new ATOM 0 HA LEU A 93 -10.975 -0.181 4.100 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -10.118 -2.185 5.029 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.857 -2.316 3.819 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.960 -0.095 4.891 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -8.417 0.039 7.308 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -9.888 0.302 6.342 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.620 -1.262 7.148 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -6.619 -1.428 6.471 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -7.751 -2.787 6.278 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -6.778 -2.237 4.893 1.00 0.00 H new ATOM 1393 N LEU A 94 -8.621 0.111 1.844 1.00 0.00 N ATOM 1394 CA LEU A 94 -7.706 1.054 1.210 1.00 0.00 C ATOM 1395 C LEU A 94 -8.472 2.201 0.558 1.00 0.00 C ATOM 1396 O LEU A 94 -7.962 3.316 0.444 1.00 0.00 O ATOM 1397 CB LEU A 94 -6.849 0.339 0.164 1.00 0.00 C ATOM 1398 CG LEU A 94 -5.750 -0.574 0.708 1.00 0.00 C ATOM 1399 CD1 LEU A 94 -5.476 -1.715 -0.261 1.00 0.00 C ATOM 1400 CD2 LEU A 94 -4.479 0.220 0.972 1.00 0.00 C ATOM 0 H LEU A 94 -8.721 -0.776 1.351 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.057 1.467 1.982 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.506 -0.255 -0.471 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.386 1.092 -0.474 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.092 -0.999 1.652 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -4.691 -2.355 0.143 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.385 -2.300 -0.400 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.155 -1.309 -1.220 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.708 -0.446 1.359 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.134 0.674 0.043 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.684 1.002 1.704 1.00 0.00 H new ATOM 1412 N ALA A 95 -9.699 1.921 0.134 1.00 0.00 N ATOM 1413 CA ALA A 95 -10.537 2.930 -0.502 1.00 0.00 C ATOM 1414 C ALA A 95 -10.840 4.076 0.457 1.00 0.00 C ATOM 1415 O ALA A 95 -10.418 5.212 0.236 1.00 0.00 O ATOM 1416 CB ALA A 95 -11.830 2.303 -1.004 1.00 0.00 C ATOM 0 H ALA A 95 -10.136 1.003 0.219 1.00 0.00 H new ATOM 0 HA ALA A 95 -9.990 3.337 -1.352 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -12.446 3.068 -1.477 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -11.599 1.524 -1.730 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.373 1.867 -0.165 1.00 0.00 H new ATOM 1422 N LEU A 96 -11.574 3.772 1.522 1.00 0.00 N ATOM 1423 CA LEU A 96 -11.934 4.777 2.515 1.00 0.00 C ATOM 1424 C LEU A 96 -10.711 5.579 2.947 1.00 0.00 C ATOM 1425 O LEU A 96 -10.652 6.792 2.752 1.00 0.00 O ATOM 1426 CB LEU A 96 -12.578 4.112 3.733 1.00 0.00 C ATOM 1427 CG LEU A 96 -14.078 3.834 3.631 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -14.461 2.644 4.498 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -14.877 5.065 4.030 1.00 0.00 C ATOM 0 H LEU A 96 -11.931 2.837 1.720 1.00 0.00 H new ATOM 0 HA LEU A 96 -12.651 5.460 2.060 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -12.066 3.168 3.920 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -12.405 4.746 4.602 1.00 0.00 H new ATOM 0 HG LEU A 96 -14.313 3.593 2.594 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -15.532 2.461 4.413 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -13.915 1.761 4.166 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -14.211 2.856 5.538 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -15.942 4.849 3.951 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -14.637 5.337 5.058 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -14.625 5.893 3.367 1.00 0.00 H new ATOM 1441 N GLN A 97 -9.736 4.891 3.533 1.00 0.00 N ATOM 1442 CA GLN A 97 -8.513 5.540 3.991 1.00 0.00 C ATOM 1443 C GLN A 97 -8.096 6.653 3.036 1.00 0.00 C ATOM 1444 O GLN A 97 -7.973 7.811 3.433 1.00 0.00 O ATOM 1445 CB GLN A 97 -7.385 4.515 4.122 1.00 0.00 C ATOM 1446 CG GLN A 97 -7.562 3.560 5.292 1.00 0.00 C ATOM 1447 CD GLN A 97 -7.455 4.256 6.634 1.00 0.00 C ATOM 1448 OE1 GLN A 97 -6.356 4.519 7.123 1.00 0.00 O ATOM 1449 NE2 GLN A 97 -8.598 4.559 7.238 1.00 0.00 N ATOM 0 H GLN A 97 -9.769 3.886 3.702 1.00 0.00 H new ATOM 0 HA GLN A 97 -8.710 5.980 4.968 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -7.321 3.938 3.199 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -6.438 5.042 4.235 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -8.535 3.074 5.216 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -6.808 2.775 5.233 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -9.487 4.322 6.796 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -8.588 5.028 8.144 1.00 0.00 H new ATOM 1458 N ALA A 98 -7.881 6.294 1.774 1.00 0.00 N ATOM 1459 CA ALA A 98 -7.480 7.262 0.762 1.00 0.00 C ATOM 1460 C ALA A 98 -8.500 8.391 0.647 1.00 0.00 C ATOM 1461 O ALA A 98 -8.154 9.565 0.768 1.00 0.00 O ATOM 1462 CB ALA A 98 -7.297 6.575 -0.583 1.00 0.00 C ATOM 0 H ALA A 98 -7.978 5.339 1.429 1.00 0.00 H new ATOM 0 HA ALA A 98 -6.528 7.697 1.068 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -6.997 7.311 -1.330 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -6.526 5.809 -0.498 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -8.236 6.112 -0.886 1.00 0.00 H new ATOM 1468 N GLU A 99 -9.756 8.025 0.413 1.00 0.00 N ATOM 1469 CA GLU A 99 -10.825 9.008 0.280 1.00 0.00 C ATOM 1470 C GLU A 99 -10.734 10.062 1.380 1.00 0.00 C ATOM 1471 O GLU A 99 -10.991 11.242 1.146 1.00 0.00 O ATOM 1472 CB GLU A 99 -12.190 8.320 0.329 1.00 0.00 C ATOM 1473 CG GLU A 99 -12.514 7.520 -0.921 1.00 0.00 C ATOM 1474 CD GLU A 99 -14.003 7.295 -1.101 1.00 0.00 C ATOM 1475 OE1 GLU A 99 -14.784 8.223 -0.805 1.00 0.00 O ATOM 1476 OE2 GLU A 99 -14.387 6.189 -1.537 1.00 0.00 O ATOM 0 H GLU A 99 -10.058 7.056 0.312 1.00 0.00 H new ATOM 0 HA GLU A 99 -10.711 9.503 -0.684 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -12.222 7.656 1.193 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -12.963 9.074 0.478 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -12.121 8.042 -1.794 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -12.008 6.556 -0.872 1.00 0.00 H new ATOM 1483 N GLU A 100 -10.369 9.625 2.582 1.00 0.00 N ATOM 1484 CA GLU A 100 -10.246 10.530 3.718 1.00 0.00 C ATOM 1485 C GLU A 100 -8.877 11.205 3.731 1.00 0.00 C ATOM 1486 O GLU A 100 -8.744 12.355 4.146 1.00 0.00 O ATOM 1487 CB GLU A 100 -10.465 9.771 5.029 1.00 0.00 C ATOM 1488 CG GLU A 100 -11.898 9.309 5.232 1.00 0.00 C ATOM 1489 CD GLU A 100 -12.845 10.455 5.528 1.00 0.00 C ATOM 1490 OE1 GLU A 100 -12.873 10.916 6.689 1.00 0.00 O ATOM 1491 OE2 GLU A 100 -13.558 10.892 4.601 1.00 0.00 O ATOM 0 H GLU A 100 -10.154 8.651 2.793 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.011 11.301 3.620 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -9.806 8.903 5.051 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.177 10.412 5.863 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -12.237 8.785 4.338 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -11.932 8.593 6.053 1.00 0.00 H new ATOM 1498 N ASN A 101 -7.862 10.479 3.274 1.00 0.00 N ATOM 1499 CA ASN A 101 -6.502 11.006 3.234 1.00 0.00 C ATOM 1500 C ASN A 101 -6.236 11.723 1.914 1.00 0.00 C ATOM 1501 O ASN A 101 -5.085 11.957 1.543 1.00 0.00 O ATOM 1502 CB ASN A 101 -5.489 9.876 3.426 1.00 0.00 C ATOM 1503 CG ASN A 101 -5.488 9.336 4.843 1.00 0.00 C ATOM 1504 OD1 ASN A 101 -5.151 10.047 5.790 1.00 0.00 O ATOM 1505 ND2 ASN A 101 -5.866 8.072 4.995 1.00 0.00 N ATOM 0 H ASN A 101 -7.955 9.525 2.926 1.00 0.00 H new ATOM 0 HA ASN A 101 -6.393 11.724 4.046 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -5.715 9.067 2.732 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -4.492 10.239 3.178 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -5.885 7.654 5.925 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -6.137 7.519 4.182 1.00 0.00 H new ATOM 1512 N LEU A 102 -7.307 12.070 1.209 1.00 0.00 N ATOM 1513 CA LEU A 102 -7.190 12.762 -0.070 1.00 0.00 C ATOM 1514 C LEU A 102 -6.544 14.132 0.109 1.00 0.00 C ATOM 1515 O LEU A 102 -6.723 14.785 1.136 1.00 0.00 O ATOM 1516 CB LEU A 102 -8.568 12.917 -0.717 1.00 0.00 C ATOM 1517 CG LEU A 102 -9.108 11.687 -1.447 1.00 0.00 C ATOM 1518 CD1 LEU A 102 -10.478 11.977 -2.041 1.00 0.00 C ATOM 1519 CD2 LEU A 102 -8.138 11.242 -2.532 1.00 0.00 C ATOM 0 H LEU A 102 -8.266 11.884 1.501 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.554 12.163 -0.722 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.282 13.198 0.058 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.524 13.745 -1.425 1.00 0.00 H new ATOM 0 HG LEU A 102 -9.212 10.877 -0.725 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -10.846 11.090 -2.557 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -11.171 12.247 -1.244 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -10.400 12.802 -2.749 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -8.539 10.365 -3.041 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -8.002 12.049 -3.252 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.177 10.992 -2.081 1.00 0.00 H new ATOM 1531 N GLY A 103 -5.792 14.563 -0.900 1.00 0.00 N ATOM 1532 CA GLY A 103 -5.132 15.853 -0.835 1.00 0.00 C ATOM 1533 C GLY A 103 -3.718 15.755 -0.298 1.00 0.00 C ATOM 1534 O GLY A 103 -2.917 16.674 -0.468 1.00 0.00 O ATOM 0 H GLY A 103 -5.629 14.041 -1.761 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -5.109 16.296 -1.830 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -5.712 16.523 -0.201 1.00 0.00 H new ATOM 1538 N MET A 104 -3.410 14.638 0.353 1.00 0.00 N ATOM 1539 CA MET A 104 -2.082 14.424 0.918 1.00 0.00 C ATOM 1540 C MET A 104 -1.628 12.983 0.706 1.00 0.00 C ATOM 1541 O MET A 104 -2.419 12.048 0.825 1.00 0.00 O ATOM 1542 CB MET A 104 -2.080 14.757 2.411 1.00 0.00 C ATOM 1543 CG MET A 104 -2.618 16.144 2.725 1.00 0.00 C ATOM 1544 SD MET A 104 -4.404 16.156 2.972 1.00 0.00 S ATOM 1545 CE MET A 104 -4.777 17.880 2.662 1.00 0.00 C ATOM 0 H MET A 104 -4.061 13.867 0.502 1.00 0.00 H new ATOM 0 HA MET A 104 -1.384 15.086 0.405 1.00 0.00 H new ATOM 0 HB2 MET A 104 -2.678 14.016 2.941 1.00 0.00 H new ATOM 0 HB3 MET A 104 -1.062 14.676 2.792 1.00 0.00 H new ATOM 0 HG2 MET A 104 -2.129 16.525 3.621 1.00 0.00 H new ATOM 0 HG3 MET A 104 -2.363 16.822 1.910 1.00 0.00 H new ATOM 0 HE1 MET A 104 -5.848 18.047 2.777 1.00 0.00 H new ATOM 0 HE2 MET A 104 -4.235 18.503 3.373 1.00 0.00 H new ATOM 0 HE3 MET A 104 -4.476 18.141 1.647 1.00 0.00 H new ATOM 1555 N VAL A 105 -0.348 12.812 0.391 1.00 0.00 N ATOM 1556 CA VAL A 105 0.212 11.485 0.163 1.00 0.00 C ATOM 1557 C VAL A 105 -0.267 10.497 1.221 1.00 0.00 C ATOM 1558 O VAL A 105 -0.125 10.738 2.419 1.00 0.00 O ATOM 1559 CB VAL A 105 1.752 11.517 0.167 1.00 0.00 C ATOM 1560 CG1 VAL A 105 2.267 12.570 -0.803 1.00 0.00 C ATOM 1561 CG2 VAL A 105 2.276 11.773 1.572 1.00 0.00 C ATOM 0 H VAL A 105 0.321 13.575 0.288 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.135 11.160 -0.818 1.00 0.00 H new ATOM 0 HB VAL A 105 2.119 10.545 -0.161 1.00 0.00 H new ATOM 0 HG11 VAL A 105 3.357 12.578 -0.786 1.00 0.00 H new ATOM 0 HG12 VAL A 105 1.921 12.337 -1.810 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.893 13.550 -0.508 1.00 0.00 H new ATOM 0 HG21 VAL A 105 3.366 11.792 1.556 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.901 12.732 1.931 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.937 10.979 2.237 1.00 0.00 H new ATOM 1571 N MET A 106 -0.834 9.384 0.769 1.00 0.00 N ATOM 1572 CA MET A 106 -1.333 8.357 1.677 1.00 0.00 C ATOM 1573 C MET A 106 -0.675 7.011 1.391 1.00 0.00 C ATOM 1574 O MET A 106 -1.218 5.960 1.732 1.00 0.00 O ATOM 1575 CB MET A 106 -2.853 8.232 1.554 1.00 0.00 C ATOM 1576 CG MET A 106 -3.306 7.597 0.249 1.00 0.00 C ATOM 1577 SD MET A 106 -3.440 8.792 -1.095 1.00 0.00 S ATOM 1578 CE MET A 106 -5.018 9.550 -0.718 1.00 0.00 C ATOM 0 H MET A 106 -0.960 9.170 -0.220 1.00 0.00 H new ATOM 0 HA MET A 106 -1.081 8.654 2.695 1.00 0.00 H new ATOM 0 HB2 MET A 106 -3.229 7.639 2.387 1.00 0.00 H new ATOM 0 HB3 MET A 106 -3.299 9.223 1.641 1.00 0.00 H new ATOM 0 HG2 MET A 106 -2.601 6.815 -0.034 1.00 0.00 H new ATOM 0 HG3 MET A 106 -4.272 7.116 0.400 1.00 0.00 H new ATOM 0 HE1 MET A 106 -4.948 10.628 -0.865 1.00 0.00 H new ATOM 0 HE2 MET A 106 -5.784 9.143 -1.378 1.00 0.00 H new ATOM 0 HE3 MET A 106 -5.283 9.342 0.318 1.00 0.00 H new ATOM 1588 N ILE A 107 0.495 7.052 0.763 1.00 0.00 N ATOM 1589 CA ILE A 107 1.226 5.835 0.432 1.00 0.00 C ATOM 1590 C ILE A 107 1.764 5.158 1.688 1.00 0.00 C ATOM 1591 O ILE A 107 1.685 3.937 1.830 1.00 0.00 O ATOM 1592 CB ILE A 107 2.400 6.125 -0.523 1.00 0.00 C ATOM 1593 CG1 ILE A 107 1.877 6.621 -1.872 1.00 0.00 C ATOM 1594 CG2 ILE A 107 3.254 4.880 -0.705 1.00 0.00 C ATOM 1595 CD1 ILE A 107 1.048 5.596 -2.613 1.00 0.00 C ATOM 0 H ILE A 107 0.957 7.914 0.473 1.00 0.00 H new ATOM 0 HA ILE A 107 0.520 5.169 -0.064 1.00 0.00 H new ATOM 0 HB ILE A 107 3.021 6.907 -0.086 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.276 7.516 -1.712 1.00 0.00 H new ATOM 0 HG13 ILE A 107 2.722 6.912 -2.495 1.00 0.00 H new ATOM 0 HG21 ILE A 107 4.079 5.101 -1.382 1.00 0.00 H new ATOM 0 HG22 ILE A 107 3.651 4.567 0.261 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.645 4.079 -1.124 1.00 0.00 H new ATOM 0 HD11 ILE A 107 0.711 6.017 -3.560 1.00 0.00 H new ATOM 0 HD12 ILE A 107 1.652 4.709 -2.804 1.00 0.00 H new ATOM 0 HD13 ILE A 107 0.183 5.322 -2.009 1.00 0.00 H new ATOM 1607 N PHE A 108 2.308 5.958 2.599 1.00 0.00 N ATOM 1608 CA PHE A 108 2.857 5.436 3.845 1.00 0.00 C ATOM 1609 C PHE A 108 1.746 5.144 4.849 1.00 0.00 C ATOM 1610 O PHE A 108 1.853 4.223 5.660 1.00 0.00 O ATOM 1611 CB PHE A 108 3.852 6.432 4.444 1.00 0.00 C ATOM 1612 CG PHE A 108 4.507 5.941 5.703 1.00 0.00 C ATOM 1613 CD1 PHE A 108 3.801 5.895 6.895 1.00 0.00 C ATOM 1614 CD2 PHE A 108 5.829 5.525 5.696 1.00 0.00 C ATOM 1615 CE1 PHE A 108 4.401 5.443 8.055 1.00 0.00 C ATOM 1616 CE2 PHE A 108 6.433 5.071 6.853 1.00 0.00 C ATOM 1617 CZ PHE A 108 5.719 5.032 8.035 1.00 0.00 C ATOM 0 H PHE A 108 2.380 6.970 2.498 1.00 0.00 H new ATOM 0 HA PHE A 108 3.375 4.503 3.622 1.00 0.00 H new ATOM 0 HB2 PHE A 108 4.623 6.652 3.705 1.00 0.00 H new ATOM 0 HB3 PHE A 108 3.335 7.368 4.654 1.00 0.00 H new ATOM 0 HD1 PHE A 108 2.770 6.216 6.917 1.00 0.00 H new ATOM 0 HD2 PHE A 108 6.394 5.556 4.776 1.00 0.00 H new ATOM 0 HE1 PHE A 108 3.839 5.411 8.977 1.00 0.00 H new ATOM 0 HE2 PHE A 108 7.463 4.747 6.833 1.00 0.00 H new ATOM 0 HZ PHE A 108 6.190 4.681 8.941 1.00 0.00 H new ATOM 1627 N THR A 109 0.679 5.934 4.789 1.00 0.00 N ATOM 1628 CA THR A 109 -0.452 5.762 5.692 1.00 0.00 C ATOM 1629 C THR A 109 -1.214 4.479 5.382 1.00 0.00 C ATOM 1630 O THR A 109 -1.529 3.698 6.281 1.00 0.00 O ATOM 1631 CB THR A 109 -1.423 6.955 5.611 1.00 0.00 C ATOM 1632 OG1 THR A 109 -0.796 8.133 6.128 1.00 0.00 O ATOM 1633 CG2 THR A 109 -2.698 6.669 6.390 1.00 0.00 C ATOM 0 H THR A 109 0.574 6.700 4.124 1.00 0.00 H new ATOM 0 HA THR A 109 -0.044 5.704 6.701 1.00 0.00 H new ATOM 0 HB THR A 109 -1.683 7.113 4.564 1.00 0.00 H new ATOM 0 HG1 THR A 109 -1.419 8.887 6.071 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.368 7.526 6.318 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.189 5.789 5.975 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.452 6.487 7.436 1.00 0.00 H new ATOM 1641 N LEU A 110 -1.506 4.265 4.104 1.00 0.00 N ATOM 1642 CA LEU A 110 -2.231 3.074 3.674 1.00 0.00 C ATOM 1643 C LEU A 110 -1.575 1.810 4.220 1.00 0.00 C ATOM 1644 O LEU A 110 -2.171 1.080 5.012 1.00 0.00 O ATOM 1645 CB LEU A 110 -2.291 3.013 2.147 1.00 0.00 C ATOM 1646 CG LEU A 110 -3.287 3.960 1.476 1.00 0.00 C ATOM 1647 CD1 LEU A 110 -2.961 4.118 -0.001 1.00 0.00 C ATOM 1648 CD2 LEU A 110 -4.710 3.454 1.658 1.00 0.00 C ATOM 0 H LEU A 110 -1.252 4.900 3.347 1.00 0.00 H new ATOM 0 HA LEU A 110 -3.245 3.134 4.069 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -1.297 3.227 1.755 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -2.536 1.992 1.853 1.00 0.00 H new ATOM 0 HG LEU A 110 -3.207 4.937 1.952 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -3.680 4.795 -0.462 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -1.956 4.526 -0.110 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -3.013 3.146 -0.491 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -5.405 4.140 1.174 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -4.805 2.465 1.209 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -4.941 3.393 2.721 1.00 0.00 H new ATOM 1660 N VAL A 111 -0.341 1.558 3.792 1.00 0.00 N ATOM 1661 CA VAL A 111 0.398 0.384 4.240 1.00 0.00 C ATOM 1662 C VAL A 111 0.116 0.084 5.708 1.00 0.00 C ATOM 1663 O VAL A 111 -0.219 -1.045 6.069 1.00 0.00 O ATOM 1664 CB VAL A 111 1.915 0.570 4.048 1.00 0.00 C ATOM 1665 CG1 VAL A 111 2.663 -0.690 4.456 1.00 0.00 C ATOM 1666 CG2 VAL A 111 2.228 0.942 2.607 1.00 0.00 C ATOM 0 H VAL A 111 0.167 2.151 3.136 1.00 0.00 H new ATOM 0 HA VAL A 111 0.061 -0.454 3.630 1.00 0.00 H new ATOM 0 HB VAL A 111 2.248 1.386 4.690 1.00 0.00 H new ATOM 0 HG11 VAL A 111 3.733 -0.540 4.314 1.00 0.00 H new ATOM 0 HG12 VAL A 111 2.464 -0.908 5.505 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.329 -1.526 3.842 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.304 1.069 2.490 1.00 0.00 H new ATOM 0 HG22 VAL A 111 1.882 0.150 1.943 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.723 1.874 2.354 1.00 0.00 H new ATOM 1676 N THR A 112 0.252 1.102 6.552 1.00 0.00 N ATOM 1677 CA THR A 112 0.013 0.947 7.981 1.00 0.00 C ATOM 1678 C THR A 112 -1.350 0.317 8.245 1.00 0.00 C ATOM 1679 O THR A 112 -1.457 -0.669 8.973 1.00 0.00 O ATOM 1680 CB THR A 112 0.090 2.301 8.713 1.00 0.00 C ATOM 1681 OG1 THR A 112 1.204 3.058 8.226 1.00 0.00 O ATOM 1682 CG2 THR A 112 0.226 2.097 10.214 1.00 0.00 C ATOM 0 H THR A 112 0.527 2.043 6.270 1.00 0.00 H new ATOM 0 HA THR A 112 0.794 0.290 8.363 1.00 0.00 H new ATOM 0 HB THR A 112 -0.833 2.848 8.519 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.245 3.918 8.695 1.00 0.00 H new ATOM 0 HG21 THR A 112 0.279 3.066 10.710 1.00 0.00 H new ATOM 0 HG22 THR A 112 -0.638 1.546 10.586 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.135 1.533 10.424 1.00 0.00 H new ATOM 1690 N ALA A 113 -2.388 0.892 7.648 1.00 0.00 N ATOM 1691 CA ALA A 113 -3.744 0.384 7.817 1.00 0.00 C ATOM 1692 C ALA A 113 -3.857 -1.053 7.320 1.00 0.00 C ATOM 1693 O ALA A 113 -4.577 -1.867 7.901 1.00 0.00 O ATOM 1694 CB ALA A 113 -4.737 1.276 7.087 1.00 0.00 C ATOM 0 H ALA A 113 -2.316 1.710 7.043 1.00 0.00 H new ATOM 0 HA ALA A 113 -3.979 0.393 8.881 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -5.745 0.885 7.222 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -4.683 2.287 7.491 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -4.495 1.296 6.024 1.00 0.00 H new ATOM 1700 N VAL A 114 -3.143 -1.360 6.242 1.00 0.00 N ATOM 1701 CA VAL A 114 -3.164 -2.700 5.668 1.00 0.00 C ATOM 1702 C VAL A 114 -2.513 -3.710 6.606 1.00 0.00 C ATOM 1703 O VAL A 114 -3.035 -4.806 6.812 1.00 0.00 O ATOM 1704 CB VAL A 114 -2.441 -2.739 4.308 1.00 0.00 C ATOM 1705 CG1 VAL A 114 -2.290 -4.173 3.824 1.00 0.00 C ATOM 1706 CG2 VAL A 114 -3.188 -1.898 3.284 1.00 0.00 C ATOM 0 H VAL A 114 -2.543 -0.699 5.749 1.00 0.00 H new ATOM 0 HA VAL A 114 -4.211 -2.966 5.523 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.444 -2.317 4.434 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -1.777 -4.180 2.862 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -1.709 -4.743 4.549 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -3.276 -4.625 3.713 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -2.664 -1.937 2.329 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.198 -2.289 3.159 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -3.238 -0.865 3.629 1.00 0.00 H new ATOM 1716 N GLN A 115 -1.370 -3.334 7.171 1.00 0.00 N ATOM 1717 CA GLN A 115 -0.647 -4.208 8.087 1.00 0.00 C ATOM 1718 C GLN A 115 -1.532 -4.618 9.260 1.00 0.00 C ATOM 1719 O GLN A 115 -1.527 -5.775 9.678 1.00 0.00 O ATOM 1720 CB GLN A 115 0.613 -3.511 8.604 1.00 0.00 C ATOM 1721 CG GLN A 115 1.353 -4.303 9.669 1.00 0.00 C ATOM 1722 CD GLN A 115 2.263 -5.363 9.081 1.00 0.00 C ATOM 1723 OE1 GLN A 115 3.294 -5.051 8.485 1.00 0.00 O ATOM 1724 NE2 GLN A 115 1.887 -6.625 9.247 1.00 0.00 N ATOM 0 H GLN A 115 -0.925 -2.430 7.010 1.00 0.00 H new ATOM 0 HA GLN A 115 -0.359 -5.106 7.540 1.00 0.00 H new ATOM 0 HB2 GLN A 115 1.286 -3.327 7.767 1.00 0.00 H new ATOM 0 HB3 GLN A 115 0.339 -2.538 9.012 1.00 0.00 H new ATOM 0 HG2 GLN A 115 1.944 -3.620 10.279 1.00 0.00 H new ATOM 0 HG3 GLN A 115 0.629 -4.778 10.332 1.00 0.00 H new ATOM 0 HE21 GLN A 115 1.024 -6.838 9.748 1.00 0.00 H new ATOM 0 HE22 GLN A 115 2.461 -7.381 8.874 1.00 0.00 H new ATOM 1733 N GLU A 116 -2.291 -3.661 9.786 1.00 0.00 N ATOM 1734 CA GLU A 116 -3.180 -3.924 10.911 1.00 0.00 C ATOM 1735 C GLU A 116 -4.252 -4.941 10.531 1.00 0.00 C ATOM 1736 O GLU A 116 -4.729 -5.702 11.373 1.00 0.00 O ATOM 1737 CB GLU A 116 -3.837 -2.626 11.385 1.00 0.00 C ATOM 1738 CG GLU A 116 -2.918 -1.746 12.216 1.00 0.00 C ATOM 1739 CD GLU A 116 -2.617 -2.339 13.579 1.00 0.00 C ATOM 1740 OE1 GLU A 116 -3.577 -2.621 14.327 1.00 0.00 O ATOM 1741 OE2 GLU A 116 -1.424 -2.522 13.897 1.00 0.00 O ATOM 0 H GLU A 116 -2.308 -2.698 9.451 1.00 0.00 H new ATOM 0 HA GLU A 116 -2.583 -4.338 11.724 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.177 -2.063 10.516 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.722 -2.870 11.973 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -1.983 -1.592 11.677 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -3.378 -0.766 12.344 1.00 0.00 H new ATOM 1748 N LYS A 117 -4.629 -4.946 9.257 1.00 0.00 N ATOM 1749 CA LYS A 117 -5.644 -5.868 8.763 1.00 0.00 C ATOM 1750 C LYS A 117 -5.107 -7.295 8.716 1.00 0.00 C ATOM 1751 O LYS A 117 -5.778 -8.237 9.141 1.00 0.00 O ATOM 1752 CB LYS A 117 -6.114 -5.443 7.370 1.00 0.00 C ATOM 1753 CG LYS A 117 -7.502 -5.949 7.015 1.00 0.00 C ATOM 1754 CD LYS A 117 -8.581 -5.203 7.783 1.00 0.00 C ATOM 1755 CE LYS A 117 -9.904 -5.952 7.753 1.00 0.00 C ATOM 1756 NZ LYS A 117 -11.014 -5.138 8.322 1.00 0.00 N ATOM 0 H LYS A 117 -4.246 -4.321 8.547 1.00 0.00 H new ATOM 0 HA LYS A 117 -6.490 -5.839 9.450 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -6.107 -4.355 7.310 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -5.403 -5.808 6.629 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -7.670 -5.833 5.944 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -7.569 -7.015 7.234 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -8.264 -5.064 8.816 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -8.714 -4.210 7.354 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -10.144 -6.225 6.725 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -9.809 -6.881 8.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -11.899 -5.683 8.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -10.797 -4.898 9.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -11.122 -4.264 7.769 1.00 0.00 H new ATOM 1770 N LEU A 118 -3.893 -7.449 8.199 1.00 0.00 N ATOM 1771 CA LEU A 118 -3.265 -8.761 8.098 1.00 0.00 C ATOM 1772 C LEU A 118 -3.077 -9.382 9.478 1.00 0.00 C ATOM 1773 O LEU A 118 -3.315 -10.574 9.671 1.00 0.00 O ATOM 1774 CB LEU A 118 -1.914 -8.649 7.388 1.00 0.00 C ATOM 1775 CG LEU A 118 -1.961 -8.230 5.918 1.00 0.00 C ATOM 1776 CD1 LEU A 118 -0.625 -7.646 5.487 1.00 0.00 C ATOM 1777 CD2 LEU A 118 -2.337 -9.414 5.039 1.00 0.00 C ATOM 0 H LEU A 118 -3.324 -6.681 7.843 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.922 -9.407 7.515 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -1.300 -7.930 7.930 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.410 -9.613 7.454 1.00 0.00 H new ATOM 0 HG LEU A 118 -2.724 -7.460 5.803 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -0.677 -7.353 4.438 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.396 -6.772 6.097 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.158 -8.393 5.617 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.366 -9.098 3.996 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -1.597 -10.205 5.158 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.318 -9.788 5.332 1.00 0.00 H new ATOM 1789 N ASN A 119 -2.650 -8.566 10.436 1.00 0.00 N ATOM 1790 CA ASN A 119 -2.432 -9.035 11.799 1.00 0.00 C ATOM 1791 C ASN A 119 -3.745 -9.473 12.441 1.00 0.00 C ATOM 1792 O ASN A 119 -3.757 -10.312 13.341 1.00 0.00 O ATOM 1793 CB ASN A 119 -1.782 -7.934 12.641 1.00 0.00 C ATOM 1794 CG ASN A 119 -0.268 -7.954 12.550 1.00 0.00 C ATOM 1795 OD1 ASN A 119 0.377 -8.914 12.971 1.00 0.00 O ATOM 1796 ND2 ASN A 119 0.305 -6.891 11.999 1.00 0.00 N ATOM 0 H ASN A 119 -2.448 -7.576 10.293 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.764 -9.895 11.758 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -2.150 -6.963 12.311 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.082 -8.052 13.682 1.00 0.00 H new ATOM 0 HD21 ASN A 119 1.320 -6.847 11.911 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -0.270 -6.118 11.664 1.00 0.00 H new ATOM 1803 N GLU A 120 -4.848 -8.900 11.970 1.00 0.00 N ATOM 1804 CA GLU A 120 -6.166 -9.231 12.498 1.00 0.00 C ATOM 1805 C GLU A 120 -6.637 -10.585 11.973 1.00 0.00 C ATOM 1806 O GLU A 120 -7.188 -11.394 12.720 1.00 0.00 O ATOM 1807 CB GLU A 120 -7.178 -8.147 12.123 1.00 0.00 C ATOM 1808 CG GLU A 120 -7.177 -6.960 13.072 1.00 0.00 C ATOM 1809 CD GLU A 120 -8.508 -6.233 13.098 1.00 0.00 C ATOM 1810 OE1 GLU A 120 -8.911 -5.698 12.043 1.00 0.00 O ATOM 1811 OE2 GLU A 120 -9.146 -6.199 14.171 1.00 0.00 O ATOM 0 H GLU A 120 -4.855 -8.204 11.224 1.00 0.00 H new ATOM 0 HA GLU A 120 -6.091 -9.287 13.584 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -6.964 -7.795 11.114 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -8.176 -8.585 12.103 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.935 -7.304 14.078 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -6.392 -6.264 12.776 1.00 0.00 H new ATOM 1818 N ILE A 121 -6.416 -10.823 10.685 1.00 0.00 N ATOM 1819 CA ILE A 121 -6.818 -12.077 10.060 1.00 0.00 C ATOM 1820 C ILE A 121 -5.951 -13.234 10.545 1.00 0.00 C ATOM 1821 O ILE A 121 -6.461 -14.274 10.964 1.00 0.00 O ATOM 1822 CB ILE A 121 -6.732 -11.995 8.525 1.00 0.00 C ATOM 1823 CG1 ILE A 121 -7.611 -10.856 8.004 1.00 0.00 C ATOM 1824 CG2 ILE A 121 -7.145 -13.319 7.900 1.00 0.00 C ATOM 1825 CD1 ILE A 121 -7.114 -10.253 6.709 1.00 0.00 C ATOM 0 H ILE A 121 -5.961 -10.164 10.054 1.00 0.00 H new ATOM 0 HA ILE A 121 -7.854 -12.255 10.348 1.00 0.00 H new ATOM 0 HB ILE A 121 -5.699 -11.790 8.244 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -8.625 -11.229 7.856 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -7.666 -10.074 8.762 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -7.079 -13.245 6.815 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -6.482 -14.110 8.251 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -8.171 -13.552 8.186 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -7.785 -9.452 6.399 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -6.112 -9.850 6.856 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -7.086 -11.022 5.937 1.00 0.00 H new ATOM 1837 N VAL A 122 -4.636 -13.046 10.487 1.00 0.00 N ATOM 1838 CA VAL A 122 -3.697 -14.073 10.923 1.00 0.00 C ATOM 1839 C VAL A 122 -4.006 -14.533 12.343 1.00 0.00 C ATOM 1840 O VAL A 122 -3.659 -15.648 12.735 1.00 0.00 O ATOM 1841 CB VAL A 122 -2.244 -13.566 10.863 1.00 0.00 C ATOM 1842 CG1 VAL A 122 -1.928 -12.707 12.078 1.00 0.00 C ATOM 1843 CG2 VAL A 122 -1.276 -14.735 10.761 1.00 0.00 C ATOM 0 H VAL A 122 -4.197 -12.192 10.142 1.00 0.00 H new ATOM 0 HA VAL A 122 -3.808 -14.915 10.240 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.129 -12.949 9.972 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.897 -12.358 12.018 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.601 -11.850 12.102 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.059 -13.297 12.985 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -0.254 -14.359 10.720 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.390 -15.379 11.633 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.489 -15.306 9.857 1.00 0.00 H new ATOM 1853 N ASP A 123 -4.660 -13.668 13.110 1.00 0.00 N ATOM 1854 CA ASP A 123 -5.018 -13.986 14.487 1.00 0.00 C ATOM 1855 C ASP A 123 -6.310 -14.795 14.540 1.00 0.00 C ATOM 1856 O ASP A 123 -6.579 -15.488 15.521 1.00 0.00 O ATOM 1857 CB ASP A 123 -5.171 -12.703 15.306 1.00 0.00 C ATOM 1858 CG ASP A 123 -5.478 -12.980 16.764 1.00 0.00 C ATOM 1859 OD1 ASP A 123 -4.670 -13.671 17.421 1.00 0.00 O ATOM 1860 OD2 ASP A 123 -6.526 -12.506 17.250 1.00 0.00 O ATOM 0 H ASP A 123 -4.953 -12.741 12.801 1.00 0.00 H new ATOM 0 HA ASP A 123 -4.216 -14.588 14.915 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -4.253 -12.119 15.236 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -5.969 -12.096 14.879 1.00 0.00 H new ATOM 1865 N GLN A 124 -7.105 -14.701 13.480 1.00 0.00 N ATOM 1866 CA GLN A 124 -8.370 -15.423 13.407 1.00 0.00 C ATOM 1867 C GLN A 124 -8.174 -16.803 12.787 1.00 0.00 C ATOM 1868 O GLN A 124 -9.044 -17.668 12.888 1.00 0.00 O ATOM 1869 CB GLN A 124 -9.391 -14.626 12.594 1.00 0.00 C ATOM 1870 CG GLN A 124 -9.951 -13.422 13.334 1.00 0.00 C ATOM 1871 CD GLN A 124 -11.167 -13.766 14.172 1.00 0.00 C ATOM 1872 OE1 GLN A 124 -11.142 -13.654 15.398 1.00 0.00 O ATOM 1873 NE2 GLN A 124 -12.240 -14.187 13.513 1.00 0.00 N ATOM 0 H GLN A 124 -6.896 -14.132 12.660 1.00 0.00 H new ATOM 0 HA GLN A 124 -8.745 -15.551 14.422 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -8.923 -14.288 11.669 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.213 -15.284 12.313 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -9.177 -13.004 13.978 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -10.218 -12.649 12.613 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -12.216 -14.265 12.496 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -13.088 -14.433 14.023 1.00 0.00 H new