USER MOD reduce.3.24.130724 H: found=0, std=0, add=821, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 823 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: B 138 GLN : amide:sc= 0.246 X(o=-0.14,f=-0.56) USER MOD Set 1.2: B 142 GLN : amide:sc= -0.391 X(o=-0.14,f=-0.56) USER MOD Set 2.1: A 38 GLN : amide:sc= 0.0635 X(o=-0.99,f=-0.66) USER MOD Set 2.2: A 42 GLN : amide:sc= -1.05 X(o=-0.99,f=-0.66) USER MOD Set 3.1: A 37 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: B 125 MET CE :methyl -175:sc= 0 (180deg=-0.0108) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot -39:sc= 0.329 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0228 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 171:sc=-0.00679 (180deg=-0.235) USER MOD Single : A 28 GLN : amide:sc= -0.353 X(o=-0.35,f=-0.4) USER MOD Single : A 35 GLN : amide:sc= -0.197 X(o=-0.2,f=-0.2) USER MOD Single : A 36 LYS NZ :NH3+ 177:sc= -0.0292 (180deg=-0.0383) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 104 TYR OH : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ -133:sc= 0.325 (180deg=-0.035) USER MOD Single : B 109 SER OG : rot -36:sc= 0.265 USER MOD Single : B 111 THR OG1 : rot 180:sc= 0.117 USER MOD Single : B 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 117 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00166) USER MOD Single : B 126 MET CE :methyl 169:sc= 0 (180deg=-0.144) USER MOD Single : B 128 GLN : amide:sc= 0.165 X(o=0.17,f=-0.24) USER MOD Single : B 135 GLN : amide:sc= -0.209 X(o=-0.21,f=-0.21) USER MOD Single : B 136 LYS NZ :NH3+ -175:sc= 1.29 (180deg=1.15) USER MOD Single : B 137 TYR OH : rot 144:sc= 0.0091 USER MOD Single : B 139 SER OG : rot 180:sc= 0 USER MOD Single : B 140 LYS NZ :NH3+ -122:sc= 0.7 (180deg=0) USER MOD Single : B 151 LYS NZ :NH3+ -142:sc= 1.24 (180deg=0.71) USER MOD ----------------------------------------------------------------- ATOM 31 N TYR A 4 -20.497 -4.559 6.941 1.00 0.00 N ATOM 32 CA TYR A 4 -21.117 -3.670 5.973 1.00 0.00 C ATOM 33 C TYR A 4 -22.111 -4.389 5.054 1.00 0.00 C ATOM 34 O TYR A 4 -22.733 -3.730 4.230 1.00 0.00 O ATOM 35 CB TYR A 4 -20.048 -2.921 5.172 1.00 0.00 C ATOM 36 CG TYR A 4 -19.114 -2.030 5.972 1.00 0.00 C ATOM 37 CD1 TYR A 4 -17.972 -2.553 6.610 1.00 0.00 C ATOM 38 CD2 TYR A 4 -19.356 -0.645 6.009 1.00 0.00 C ATOM 39 CE1 TYR A 4 -17.091 -1.700 7.297 1.00 0.00 C ATOM 40 CE2 TYR A 4 -18.482 0.215 6.691 1.00 0.00 C ATOM 41 CZ TYR A 4 -17.342 -0.311 7.334 1.00 0.00 C ATOM 42 OH TYR A 4 -16.479 0.524 7.969 1.00 0.00 O ATOM 0 HA TYR A 4 -21.703 -2.942 6.534 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -19.446 -3.654 4.635 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -20.548 -2.308 4.422 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -17.773 -3.614 6.571 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -20.223 -0.240 5.508 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -16.224 -2.106 7.796 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -18.681 1.276 6.724 1.00 0.00 H new ATOM 0 HH TYR A 4 -16.803 1.446 7.897 1.00 0.00 H new ATOM 52 N GLU A 5 -22.341 -5.698 5.188 1.00 0.00 N ATOM 53 CA GLU A 5 -23.291 -6.466 4.361 1.00 0.00 C ATOM 54 C GLU A 5 -24.685 -5.811 4.282 1.00 0.00 C ATOM 55 O GLU A 5 -25.347 -5.887 3.244 1.00 0.00 O ATOM 56 CB GLU A 5 -23.357 -7.908 4.889 1.00 0.00 C ATOM 57 CG GLU A 5 -23.830 -8.001 6.361 1.00 0.00 C ATOM 58 CD GLU A 5 -23.111 -9.051 7.214 1.00 0.00 C ATOM 59 OE1 GLU A 5 -22.057 -9.591 6.802 1.00 0.00 O ATOM 60 OE2 GLU A 5 -23.525 -9.257 8.372 1.00 0.00 O ATOM 0 H GLU A 5 -21.866 -6.270 5.886 1.00 0.00 H new ATOM 0 HA GLU A 5 -22.926 -6.475 3.334 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -24.033 -8.487 4.260 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -22.371 -8.365 4.802 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -23.700 -7.025 6.829 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -24.898 -8.219 6.369 1.00 0.00 H new ATOM 67 N PHE A 6 -25.090 -5.103 5.344 1.00 0.00 N ATOM 68 CA PHE A 6 -26.351 -4.378 5.492 1.00 0.00 C ATOM 69 C PHE A 6 -26.518 -3.287 4.424 1.00 0.00 C ATOM 70 O PHE A 6 -27.621 -2.766 4.251 1.00 0.00 O ATOM 71 CB PHE A 6 -26.428 -3.767 6.903 1.00 0.00 C ATOM 72 CG PHE A 6 -26.939 -4.719 7.968 1.00 0.00 C ATOM 73 CD1 PHE A 6 -26.131 -5.772 8.441 1.00 0.00 C ATOM 74 CD2 PHE A 6 -28.251 -4.572 8.462 1.00 0.00 C ATOM 75 CE1 PHE A 6 -26.641 -6.689 9.378 1.00 0.00 C ATOM 76 CE2 PHE A 6 -28.751 -5.475 9.417 1.00 0.00 C ATOM 77 CZ PHE A 6 -27.950 -6.536 9.866 1.00 0.00 C ATOM 0 H PHE A 6 -24.505 -5.018 6.175 1.00 0.00 H new ATOM 0 HA PHE A 6 -27.167 -5.087 5.353 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -25.436 -3.418 7.190 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -27.077 -2.892 6.873 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -25.117 -5.875 8.083 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -28.873 -3.764 8.106 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -26.028 -7.509 9.722 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -29.751 -5.352 9.805 1.00 0.00 H new ATOM 0 HZ PHE A 6 -28.341 -7.237 10.589 1.00 0.00 H new ATOM 87 N LEU A 7 -25.452 -2.955 3.681 1.00 0.00 N ATOM 88 CA LEU A 7 -25.440 -1.962 2.611 1.00 0.00 C ATOM 89 C LEU A 7 -26.530 -2.265 1.591 1.00 0.00 C ATOM 90 O LEU A 7 -26.961 -1.351 0.897 1.00 0.00 O ATOM 91 CB LEU A 7 -24.076 -1.937 1.899 1.00 0.00 C ATOM 92 CG LEU A 7 -23.007 -1.129 2.650 1.00 0.00 C ATOM 93 CD1 LEU A 7 -21.621 -1.549 2.157 1.00 0.00 C ATOM 94 CD2 LEU A 7 -23.162 0.377 2.425 1.00 0.00 C ATOM 0 H LEU A 7 -24.541 -3.392 3.819 1.00 0.00 H new ATOM 0 HA LEU A 7 -25.624 -0.987 3.062 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -23.723 -2.960 1.771 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -24.204 -1.517 0.901 1.00 0.00 H new ATOM 0 HG LEU A 7 -23.128 -1.333 3.714 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -20.858 -0.979 2.687 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -21.475 -2.613 2.345 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -21.541 -1.355 1.087 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -22.385 0.909 2.975 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -23.070 0.597 1.362 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -24.142 0.699 2.778 1.00 0.00 H new ATOM 106 N LYS A 8 -26.986 -3.522 1.489 1.00 0.00 N ATOM 107 CA LYS A 8 -28.052 -3.882 0.555 1.00 0.00 C ATOM 108 C LYS A 8 -29.311 -3.046 0.805 1.00 0.00 C ATOM 109 O LYS A 8 -30.053 -2.795 -0.142 1.00 0.00 O ATOM 110 CB LYS A 8 -28.404 -5.376 0.679 1.00 0.00 C ATOM 111 CG LYS A 8 -27.379 -6.359 0.094 1.00 0.00 C ATOM 112 CD LYS A 8 -26.964 -5.983 -1.334 1.00 0.00 C ATOM 113 CE LYS A 8 -26.354 -7.138 -2.127 1.00 0.00 C ATOM 114 NZ LYS A 8 -27.342 -8.141 -2.563 1.00 0.00 N ATOM 0 H LYS A 8 -26.631 -4.302 2.043 1.00 0.00 H new ATOM 0 HA LYS A 8 -27.685 -3.679 -0.451 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -28.541 -5.610 1.735 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -29.362 -5.545 0.188 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -26.496 -6.383 0.733 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -27.801 -7.364 0.095 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -27.837 -5.609 -1.869 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -26.244 -5.166 -1.289 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -25.845 -6.737 -3.003 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -25.597 -7.628 -1.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -26.861 -8.894 -3.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -27.812 -8.550 -1.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -28.052 -7.687 -3.173 1.00 0.00 H new ATOM 128 N SER A 9 -29.548 -2.617 2.045 1.00 0.00 N ATOM 129 CA SER A 9 -30.698 -1.822 2.437 1.00 0.00 C ATOM 130 C SER A 9 -30.339 -0.340 2.615 1.00 0.00 C ATOM 131 O SER A 9 -31.209 0.426 3.031 1.00 0.00 O ATOM 132 CB SER A 9 -31.251 -2.417 3.740 1.00 0.00 C ATOM 133 OG SER A 9 -32.536 -1.909 4.029 1.00 0.00 O ATOM 0 H SER A 9 -28.922 -2.823 2.824 1.00 0.00 H new ATOM 0 HA SER A 9 -31.452 -1.856 1.650 1.00 0.00 H new ATOM 0 HB2 SER A 9 -31.297 -3.503 3.656 1.00 0.00 H new ATOM 0 HB3 SER A 9 -30.574 -2.189 4.563 1.00 0.00 H new ATOM 0 HG SER A 9 -32.568 -0.955 3.808 1.00 0.00 H new ATOM 139 N TRP A 10 -29.086 0.074 2.394 1.00 0.00 N ATOM 140 CA TRP A 10 -28.695 1.469 2.556 1.00 0.00 C ATOM 141 C TRP A 10 -29.158 2.302 1.361 1.00 0.00 C ATOM 142 O TRP A 10 -29.527 1.776 0.303 1.00 0.00 O ATOM 143 CB TRP A 10 -27.160 1.593 2.688 1.00 0.00 C ATOM 144 CG TRP A 10 -26.539 1.475 4.055 1.00 0.00 C ATOM 145 CD1 TRP A 10 -25.345 2.029 4.370 1.00 0.00 C ATOM 146 CD2 TRP A 10 -27.001 0.822 5.288 1.00 0.00 C ATOM 147 NE1 TRP A 10 -25.014 1.732 5.672 1.00 0.00 N ATOM 148 CE2 TRP A 10 -25.995 0.990 6.288 1.00 0.00 C ATOM 149 CE3 TRP A 10 -28.152 0.106 5.689 1.00 0.00 C ATOM 150 CZ2 TRP A 10 -26.109 0.459 7.581 1.00 0.00 C ATOM 151 CZ3 TRP A 10 -28.281 -0.431 6.984 1.00 0.00 C ATOM 152 CH2 TRP A 10 -27.259 -0.264 7.932 1.00 0.00 C ATOM 0 H TRP A 10 -28.328 -0.543 2.102 1.00 0.00 H new ATOM 0 HA TRP A 10 -29.169 1.842 3.464 1.00 0.00 H new ATOM 0 HB2 TRP A 10 -26.711 0.828 2.054 1.00 0.00 H new ATOM 0 HB3 TRP A 10 -26.870 2.559 2.276 1.00 0.00 H new ATOM 0 HD1 TRP A 10 -24.740 2.619 3.697 1.00 0.00 H new ATOM 0 HE1 TRP A 10 -24.148 2.026 6.125 1.00 0.00 H new ATOM 0 HE3 TRP A 10 -28.956 -0.033 4.981 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 -25.318 0.606 8.301 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 -29.174 -0.976 7.251 1.00 0.00 H new ATOM 0 HH2 TRP A 10 -27.357 -0.687 8.921 1.00 0.00 H new ATOM 163 N THR A 11 -29.158 3.622 1.538 1.00 0.00 N ATOM 164 CA THR A 11 -29.515 4.542 0.480 1.00 0.00 C ATOM 165 C THR A 11 -28.361 4.492 -0.527 1.00 0.00 C ATOM 166 O THR A 11 -27.221 4.146 -0.184 1.00 0.00 O ATOM 167 CB THR A 11 -29.704 5.964 1.050 1.00 0.00 C ATOM 168 OG1 THR A 11 -28.655 6.302 1.935 1.00 0.00 O ATOM 169 CG2 THR A 11 -31.032 6.085 1.793 1.00 0.00 C ATOM 0 H THR A 11 -28.910 4.074 2.418 1.00 0.00 H new ATOM 0 HA THR A 11 -30.457 4.271 0.004 1.00 0.00 H new ATOM 0 HB THR A 11 -29.698 6.650 0.203 1.00 0.00 H new ATOM 0 HG1 THR A 11 -28.798 7.208 2.281 1.00 0.00 H new ATOM 0 HG21 THR A 11 -31.139 7.097 2.184 1.00 0.00 H new ATOM 0 HG22 THR A 11 -31.853 5.872 1.108 1.00 0.00 H new ATOM 0 HG23 THR A 11 -31.054 5.373 2.618 1.00 0.00 H new ATOM 177 N VAL A 12 -28.647 4.841 -1.781 1.00 0.00 N ATOM 178 CA VAL A 12 -27.615 4.856 -2.804 1.00 0.00 C ATOM 179 C VAL A 12 -26.543 5.876 -2.405 1.00 0.00 C ATOM 180 O VAL A 12 -25.366 5.663 -2.660 1.00 0.00 O ATOM 181 CB VAL A 12 -28.247 5.129 -4.185 1.00 0.00 C ATOM 182 CG1 VAL A 12 -28.959 6.488 -4.291 1.00 0.00 C ATOM 183 CG2 VAL A 12 -27.195 4.984 -5.282 1.00 0.00 C ATOM 0 H VAL A 12 -29.575 5.113 -2.105 1.00 0.00 H new ATOM 0 HA VAL A 12 -27.125 3.886 -2.885 1.00 0.00 H new ATOM 0 HB VAL A 12 -29.027 4.379 -4.317 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -29.376 6.603 -5.291 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -29.762 6.536 -3.555 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -28.244 7.289 -4.101 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -27.652 5.179 -6.252 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -26.389 5.698 -5.110 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -26.792 3.972 -5.268 1.00 0.00 H new ATOM 193 N GLU A 13 -26.926 6.955 -1.716 1.00 0.00 N ATOM 194 CA GLU A 13 -25.980 7.974 -1.305 1.00 0.00 C ATOM 195 C GLU A 13 -25.034 7.413 -0.246 1.00 0.00 C ATOM 196 O GLU A 13 -23.827 7.432 -0.450 1.00 0.00 O ATOM 197 CB GLU A 13 -26.719 9.222 -0.797 1.00 0.00 C ATOM 198 CG GLU A 13 -27.705 9.758 -1.848 1.00 0.00 C ATOM 199 CD GLU A 13 -28.233 11.159 -1.541 1.00 0.00 C ATOM 200 OE1 GLU A 13 -28.081 11.659 -0.404 1.00 0.00 O ATOM 201 OE2 GLU A 13 -28.736 11.804 -2.489 1.00 0.00 O ATOM 0 H GLU A 13 -27.889 7.138 -1.435 1.00 0.00 H new ATOM 0 HA GLU A 13 -25.383 8.274 -2.166 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -27.258 8.980 0.119 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -25.996 9.998 -0.546 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -27.213 9.770 -2.821 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -28.548 9.071 -1.925 1.00 0.00 H new ATOM 208 N ASP A 14 -25.555 6.842 0.842 1.00 0.00 N ATOM 209 CA ASP A 14 -24.746 6.301 1.944 1.00 0.00 C ATOM 210 C ASP A 14 -23.725 5.282 1.477 1.00 0.00 C ATOM 211 O ASP A 14 -22.587 5.258 1.964 1.00 0.00 O ATOM 212 CB ASP A 14 -25.625 5.638 3.008 1.00 0.00 C ATOM 213 CG ASP A 14 -26.271 6.617 3.979 1.00 0.00 C ATOM 214 OD1 ASP A 14 -26.228 7.848 3.756 1.00 0.00 O ATOM 215 OD2 ASP A 14 -26.887 6.120 4.950 1.00 0.00 O ATOM 0 H ASP A 14 -26.559 6.740 0.987 1.00 0.00 H new ATOM 0 HA ASP A 14 -24.221 7.158 2.366 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -26.408 5.065 2.511 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -25.020 4.928 3.573 1.00 0.00 H new ATOM 220 N LEU A 15 -24.137 4.385 0.582 1.00 0.00 N ATOM 221 CA LEU A 15 -23.214 3.387 0.073 1.00 0.00 C ATOM 222 C LEU A 15 -22.195 4.088 -0.841 1.00 0.00 C ATOM 223 O LEU A 15 -20.999 3.828 -0.719 1.00 0.00 O ATOM 224 CB LEU A 15 -23.978 2.192 -0.544 1.00 0.00 C ATOM 225 CG LEU A 15 -24.452 2.389 -1.987 1.00 0.00 C ATOM 226 CD1 LEU A 15 -23.321 2.118 -2.973 1.00 0.00 C ATOM 227 CD2 LEU A 15 -25.651 1.511 -2.343 1.00 0.00 C ATOM 0 H LEU A 15 -25.083 4.333 0.205 1.00 0.00 H new ATOM 0 HA LEU A 15 -22.633 2.926 0.872 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -23.334 1.313 -0.508 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -24.846 1.977 0.079 1.00 0.00 H new ATOM 0 HG LEU A 15 -24.767 3.430 -2.061 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.683 2.265 -3.991 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -22.497 2.804 -2.779 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -22.974 1.091 -2.856 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -25.942 1.694 -3.377 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -25.382 0.462 -2.222 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -26.486 1.750 -1.684 1.00 0.00 H new ATOM 239 N GLN A 16 -22.632 4.999 -1.718 1.00 0.00 N ATOM 240 CA GLN A 16 -21.769 5.716 -2.650 1.00 0.00 C ATOM 241 C GLN A 16 -20.708 6.531 -1.906 1.00 0.00 C ATOM 242 O GLN A 16 -19.557 6.582 -2.337 1.00 0.00 O ATOM 243 CB GLN A 16 -22.640 6.570 -3.569 1.00 0.00 C ATOM 244 CG GLN A 16 -21.885 7.313 -4.669 1.00 0.00 C ATOM 245 CD GLN A 16 -22.906 7.769 -5.704 1.00 0.00 C ATOM 246 OE1 GLN A 16 -23.505 8.834 -5.563 1.00 0.00 O ATOM 247 NE2 GLN A 16 -23.175 6.955 -6.710 1.00 0.00 N ATOM 0 H GLN A 16 -23.615 5.260 -1.797 1.00 0.00 H new ATOM 0 HA GLN A 16 -21.216 5.008 -3.267 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -23.389 5.929 -4.033 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -23.176 7.299 -2.962 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -21.351 8.169 -4.256 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -21.140 6.663 -5.127 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -22.665 6.077 -6.806 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -23.893 7.205 -7.390 1.00 0.00 H new ATOM 256 N LYS A 17 -21.059 7.151 -0.770 1.00 0.00 N ATOM 257 CA LYS A 17 -20.097 7.927 0.015 1.00 0.00 C ATOM 258 C LYS A 17 -18.956 7.008 0.442 1.00 0.00 C ATOM 259 O LYS A 17 -17.796 7.403 0.385 1.00 0.00 O ATOM 260 CB LYS A 17 -20.724 8.600 1.242 1.00 0.00 C ATOM 261 CG LYS A 17 -21.053 10.081 0.990 1.00 0.00 C ATOM 262 CD LYS A 17 -22.260 10.256 0.066 1.00 0.00 C ATOM 263 CE LYS A 17 -21.999 10.361 -1.439 1.00 0.00 C ATOM 264 NZ LYS A 17 -21.782 11.757 -1.867 1.00 0.00 N ATOM 0 H LYS A 17 -22.000 7.128 -0.378 1.00 0.00 H new ATOM 0 HA LYS A 17 -19.727 8.734 -0.618 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -21.635 8.070 1.519 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -20.040 8.521 2.087 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -21.252 10.574 1.942 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -20.186 10.574 0.550 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -22.933 9.414 0.231 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -22.792 11.155 0.377 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -21.126 9.763 -1.698 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -22.845 9.942 -1.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -21.609 11.783 -2.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -22.625 12.324 -1.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -20.959 12.149 -1.367 1.00 0.00 H new ATOM 278 N ARG A 18 -19.274 5.781 0.866 1.00 0.00 N ATOM 279 CA ARG A 18 -18.246 4.837 1.280 1.00 0.00 C ATOM 280 C ARG A 18 -17.357 4.499 0.092 1.00 0.00 C ATOM 281 O ARG A 18 -16.149 4.446 0.287 1.00 0.00 O ATOM 282 CB ARG A 18 -18.848 3.575 1.895 1.00 0.00 C ATOM 283 CG ARG A 18 -19.532 3.840 3.238 1.00 0.00 C ATOM 284 CD ARG A 18 -20.446 2.655 3.564 1.00 0.00 C ATOM 285 NE ARG A 18 -20.997 2.702 4.927 1.00 0.00 N ATOM 286 CZ ARG A 18 -21.826 3.612 5.446 1.00 0.00 C ATOM 287 NH1 ARG A 18 -22.324 4.595 4.698 1.00 0.00 N ATOM 288 NH2 ARG A 18 -22.132 3.531 6.734 1.00 0.00 N ATOM 0 H ARG A 18 -20.228 5.426 0.929 1.00 0.00 H new ATOM 0 HA ARG A 18 -17.641 5.306 2.056 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -19.572 3.148 1.201 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -18.062 2.832 2.033 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -18.787 3.970 4.023 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -20.111 4.763 3.192 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -21.268 2.631 2.848 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -19.886 1.728 3.438 1.00 0.00 H new ATOM 0 HE ARG A 18 -20.711 1.948 5.552 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -22.074 4.662 3.711 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -22.956 5.281 5.112 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -21.736 2.785 7.306 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -22.763 4.215 7.152 1.00 0.00 H new ATOM 302 N LEU A 19 -17.907 4.277 -1.112 1.00 0.00 N ATOM 303 CA LEU A 19 -17.101 3.958 -2.290 1.00 0.00 C ATOM 304 C LEU A 19 -16.108 5.085 -2.566 1.00 0.00 C ATOM 305 O LEU A 19 -14.909 4.828 -2.669 1.00 0.00 O ATOM 306 CB LEU A 19 -17.989 3.739 -3.542 1.00 0.00 C ATOM 307 CG LEU A 19 -17.202 3.768 -4.872 1.00 0.00 C ATOM 308 CD1 LEU A 19 -16.223 2.598 -4.988 1.00 0.00 C ATOM 309 CD2 LEU A 19 -18.115 3.847 -6.092 1.00 0.00 C ATOM 0 H LEU A 19 -18.911 4.314 -1.291 1.00 0.00 H new ATOM 0 HA LEU A 19 -16.563 3.033 -2.082 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -18.499 2.780 -3.452 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -18.760 4.509 -3.569 1.00 0.00 H new ATOM 0 HG LEU A 19 -16.615 4.686 -4.853 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -15.693 2.660 -5.938 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -15.505 2.641 -4.169 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -16.772 1.658 -4.940 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -17.510 3.865 -6.999 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -18.773 2.978 -6.111 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -18.716 4.755 -6.039 1.00 0.00 H new ATOM 321 N LEU A 20 -16.592 6.328 -2.647 1.00 0.00 N ATOM 322 CA LEU A 20 -15.721 7.458 -2.946 1.00 0.00 C ATOM 323 C LEU A 20 -14.673 7.655 -1.857 1.00 0.00 C ATOM 324 O LEU A 20 -13.533 7.961 -2.185 1.00 0.00 O ATOM 325 CB LEU A 20 -16.516 8.731 -3.300 1.00 0.00 C ATOM 326 CG LEU A 20 -16.855 9.655 -2.118 1.00 0.00 C ATOM 327 CD1 LEU A 20 -15.792 10.738 -1.892 1.00 0.00 C ATOM 328 CD2 LEU A 20 -18.217 10.324 -2.337 1.00 0.00 C ATOM 0 H LEU A 20 -17.573 6.571 -2.511 1.00 0.00 H new ATOM 0 HA LEU A 20 -15.162 7.222 -3.852 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -15.945 9.302 -4.032 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -17.447 8.434 -3.784 1.00 0.00 H new ATOM 0 HG LEU A 20 -16.884 9.025 -1.229 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -16.082 11.361 -1.046 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -14.831 10.267 -1.683 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -15.707 11.356 -2.786 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -18.443 10.975 -1.492 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -18.189 10.915 -3.253 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -18.989 9.559 -2.422 1.00 0.00 H new ATOM 340 N ALA A 21 -15.026 7.463 -0.584 1.00 0.00 N ATOM 341 CA ALA A 21 -14.106 7.608 0.536 1.00 0.00 C ATOM 342 C ALA A 21 -13.069 6.487 0.508 1.00 0.00 C ATOM 343 O ALA A 21 -11.951 6.661 0.987 1.00 0.00 O ATOM 344 CB ALA A 21 -14.881 7.594 1.857 1.00 0.00 C ATOM 0 H ALA A 21 -15.971 7.200 -0.303 1.00 0.00 H new ATOM 0 HA ALA A 21 -13.587 8.562 0.451 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -14.185 7.703 2.689 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -15.593 8.419 1.870 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -15.417 6.650 1.954 1.00 0.00 H new ATOM 350 N LEU A 22 -13.424 5.329 -0.050 1.00 0.00 N ATOM 351 CA LEU A 22 -12.539 4.185 -0.161 1.00 0.00 C ATOM 352 C LEU A 22 -11.355 4.504 -1.061 1.00 0.00 C ATOM 353 O LEU A 22 -10.310 3.879 -0.895 1.00 0.00 O ATOM 354 CB LEU A 22 -13.302 2.932 -0.643 1.00 0.00 C ATOM 355 CG LEU A 22 -13.311 1.790 0.381 1.00 0.00 C ATOM 356 CD1 LEU A 22 -11.902 1.287 0.659 1.00 0.00 C ATOM 357 CD2 LEU A 22 -13.978 2.204 1.703 1.00 0.00 C ATOM 0 H LEU A 22 -14.351 5.164 -0.442 1.00 0.00 H new ATOM 0 HA LEU A 22 -12.148 3.961 0.832 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -14.330 3.209 -0.875 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -12.851 2.576 -1.569 1.00 0.00 H new ATOM 0 HG LEU A 22 -13.898 0.985 -0.061 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -11.942 0.478 1.388 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -11.458 0.920 -0.266 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -11.296 2.102 1.054 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -13.961 1.364 2.398 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -13.436 3.044 2.137 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -15.010 2.498 1.513 1.00 0.00 H new ATOM 369 N ASP A 23 -11.518 5.406 -2.032 1.00 0.00 N ATOM 370 CA ASP A 23 -10.434 5.778 -2.939 1.00 0.00 C ATOM 371 C ASP A 23 -9.265 6.388 -2.156 1.00 0.00 C ATOM 372 O ASP A 23 -8.211 5.752 -2.136 1.00 0.00 O ATOM 373 CB ASP A 23 -10.929 6.683 -4.069 1.00 0.00 C ATOM 374 CG ASP A 23 -11.743 5.944 -5.131 1.00 0.00 C ATOM 375 OD1 ASP A 23 -11.385 4.803 -5.525 1.00 0.00 O ATOM 376 OD2 ASP A 23 -12.788 6.494 -5.551 1.00 0.00 O ATOM 0 H ASP A 23 -12.396 5.894 -2.209 1.00 0.00 H new ATOM 0 HA ASP A 23 -10.062 4.875 -3.422 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -11.539 7.480 -3.644 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -10.071 7.158 -4.545 1.00 0.00 H new ATOM 381 N PRO A 24 -9.396 7.533 -1.448 1.00 0.00 N ATOM 382 CA PRO A 24 -8.284 8.092 -0.698 1.00 0.00 C ATOM 383 C PRO A 24 -7.882 7.168 0.450 1.00 0.00 C ATOM 384 O PRO A 24 -6.735 7.230 0.872 1.00 0.00 O ATOM 385 CB PRO A 24 -8.722 9.476 -0.215 1.00 0.00 C ATOM 386 CG PRO A 24 -10.237 9.353 -0.156 1.00 0.00 C ATOM 387 CD PRO A 24 -10.536 8.422 -1.331 1.00 0.00 C ATOM 0 HA PRO A 24 -7.394 8.188 -1.320 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -8.298 9.716 0.760 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -8.407 10.262 -0.902 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.574 8.933 0.792 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -10.728 10.320 -0.268 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -11.452 7.858 -1.156 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -10.682 8.990 -2.250 1.00 0.00 H new ATOM 395 N MET A 25 -8.767 6.319 0.991 1.00 0.00 N ATOM 396 CA MET A 25 -8.379 5.404 2.071 1.00 0.00 C ATOM 397 C MET A 25 -7.321 4.436 1.528 1.00 0.00 C ATOM 398 O MET A 25 -6.381 4.093 2.232 1.00 0.00 O ATOM 399 CB MET A 25 -9.592 4.639 2.612 1.00 0.00 C ATOM 400 CG MET A 25 -10.552 5.547 3.392 1.00 0.00 C ATOM 401 SD MET A 25 -10.211 5.776 5.157 1.00 0.00 S ATOM 402 CE MET A 25 -10.774 4.194 5.826 1.00 0.00 C ATOM 0 H MET A 25 -9.743 6.247 0.703 1.00 0.00 H new ATOM 0 HA MET A 25 -7.966 5.976 2.902 1.00 0.00 H new ATOM 0 HB2 MET A 25 -10.126 4.176 1.782 1.00 0.00 H new ATOM 0 HB3 MET A 25 -9.250 3.832 3.261 1.00 0.00 H new ATOM 0 HG2 MET A 25 -10.553 6.528 2.917 1.00 0.00 H new ATOM 0 HG3 MET A 25 -11.559 5.143 3.291 1.00 0.00 H new ATOM 0 HE1 MET A 25 -10.628 4.183 6.906 1.00 0.00 H new ATOM 0 HE2 MET A 25 -11.832 4.060 5.601 1.00 0.00 H new ATOM 0 HE3 MET A 25 -10.202 3.384 5.374 1.00 0.00 H new ATOM 412 N MET A 26 -7.487 3.969 0.288 1.00 0.00 N ATOM 413 CA MET A 26 -6.557 3.063 -0.368 1.00 0.00 C ATOM 414 C MET A 26 -5.305 3.790 -0.816 1.00 0.00 C ATOM 415 O MET A 26 -4.190 3.370 -0.516 1.00 0.00 O ATOM 416 CB MET A 26 -7.216 2.471 -1.616 1.00 0.00 C ATOM 417 CG MET A 26 -8.265 1.459 -1.202 1.00 0.00 C ATOM 418 SD MET A 26 -9.494 1.015 -2.464 1.00 0.00 S ATOM 419 CE MET A 26 -8.416 0.783 -3.900 1.00 0.00 C ATOM 0 H MET A 26 -8.287 4.218 -0.294 1.00 0.00 H new ATOM 0 HA MET A 26 -6.292 2.286 0.349 1.00 0.00 H new ATOM 0 HB2 MET A 26 -7.674 3.263 -2.209 1.00 0.00 H new ATOM 0 HB3 MET A 26 -6.465 1.995 -2.246 1.00 0.00 H new ATOM 0 HG2 MET A 26 -7.756 0.549 -0.884 1.00 0.00 H new ATOM 0 HG3 MET A 26 -8.793 1.849 -0.332 1.00 0.00 H new ATOM 0 HE1 MET A 26 -8.990 0.353 -4.720 1.00 0.00 H new ATOM 0 HE2 MET A 26 -8.008 1.746 -4.208 1.00 0.00 H new ATOM 0 HE3 MET A 26 -7.599 0.111 -3.637 1.00 0.00 H new ATOM 429 N GLU A 27 -5.517 4.848 -1.590 1.00 0.00 N ATOM 430 CA GLU A 27 -4.471 5.662 -2.159 1.00 0.00 C ATOM 431 C GLU A 27 -3.552 6.242 -1.099 1.00 0.00 C ATOM 432 O GLU A 27 -2.353 6.285 -1.348 1.00 0.00 O ATOM 433 CB GLU A 27 -5.097 6.745 -3.038 1.00 0.00 C ATOM 434 CG GLU A 27 -4.020 7.528 -3.793 1.00 0.00 C ATOM 435 CD GLU A 27 -4.562 8.077 -5.108 1.00 0.00 C ATOM 436 OE1 GLU A 27 -5.381 9.024 -5.081 1.00 0.00 O ATOM 437 OE2 GLU A 27 -4.159 7.558 -6.179 1.00 0.00 O ATOM 0 H GLU A 27 -6.453 5.165 -1.841 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.836 5.031 -2.780 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -5.786 6.288 -3.749 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -5.682 7.427 -2.421 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -3.661 8.349 -3.173 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.166 6.880 -3.990 1.00 0.00 H new ATOM 444 N GLN A 28 -4.080 6.646 0.059 1.00 0.00 N ATOM 445 CA GLN A 28 -3.256 7.220 1.117 1.00 0.00 C ATOM 446 C GLN A 28 -2.280 6.174 1.632 1.00 0.00 C ATOM 447 O GLN A 28 -1.093 6.449 1.785 1.00 0.00 O ATOM 448 CB GLN A 28 -4.126 7.760 2.264 1.00 0.00 C ATOM 449 CG GLN A 28 -3.334 8.203 3.509 1.00 0.00 C ATOM 450 CD GLN A 28 -3.189 7.089 4.554 1.00 0.00 C ATOM 451 OE1 GLN A 28 -4.187 6.595 5.069 1.00 0.00 O ATOM 452 NE2 GLN A 28 -1.982 6.684 4.921 1.00 0.00 N ATOM 0 H GLN A 28 -5.073 6.585 0.284 1.00 0.00 H new ATOM 0 HA GLN A 28 -2.695 8.058 0.704 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -4.705 8.607 1.897 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.839 6.989 2.557 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -2.343 8.537 3.202 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -3.832 9.059 3.965 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -1.153 7.096 4.492 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -1.881 5.960 5.633 1.00 0.00 H new ATOM 461 N GLU A 29 -2.789 4.976 1.915 1.00 0.00 N ATOM 462 CA GLU A 29 -1.968 3.900 2.435 1.00 0.00 C ATOM 463 C GLU A 29 -0.901 3.525 1.405 1.00 0.00 C ATOM 464 O GLU A 29 0.263 3.350 1.753 1.00 0.00 O ATOM 465 CB GLU A 29 -2.873 2.721 2.809 1.00 0.00 C ATOM 466 CG GLU A 29 -3.900 3.070 3.900 1.00 0.00 C ATOM 467 CD GLU A 29 -3.565 2.430 5.238 1.00 0.00 C ATOM 468 OE1 GLU A 29 -2.686 2.946 5.964 1.00 0.00 O ATOM 469 OE2 GLU A 29 -4.180 1.385 5.557 1.00 0.00 O ATOM 0 H GLU A 29 -3.771 4.732 1.790 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.442 4.212 3.337 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -3.400 2.379 1.918 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.255 1.891 3.152 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -3.945 4.152 4.019 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -4.890 2.743 3.581 1.00 0.00 H new ATOM 476 N ILE A 30 -1.274 3.412 0.127 1.00 0.00 N ATOM 477 CA ILE A 30 -0.331 3.060 -0.914 1.00 0.00 C ATOM 478 C ILE A 30 0.702 4.166 -1.077 1.00 0.00 C ATOM 479 O ILE A 30 1.887 3.855 -1.008 1.00 0.00 O ATOM 480 CB ILE A 30 -1.095 2.751 -2.230 1.00 0.00 C ATOM 481 CG1 ILE A 30 -1.546 1.271 -2.230 1.00 0.00 C ATOM 482 CG2 ILE A 30 -0.258 3.006 -3.501 1.00 0.00 C ATOM 483 CD1 ILE A 30 -2.949 1.002 -2.762 1.00 0.00 C ATOM 0 H ILE A 30 -2.228 3.562 -0.202 1.00 0.00 H new ATOM 0 HA ILE A 30 0.213 2.157 -0.638 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.947 3.430 -2.257 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.837 0.695 -2.824 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -1.487 0.893 -1.209 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.854 2.769 -4.383 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.041 4.054 -3.536 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.631 2.375 -3.484 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -3.157 -0.067 -2.715 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -3.677 1.541 -2.156 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.017 1.339 -3.796 1.00 0.00 H new ATOM 495 N GLU A 31 0.297 5.421 -1.298 1.00 0.00 N ATOM 496 CA GLU A 31 1.245 6.510 -1.511 1.00 0.00 C ATOM 497 C GLU A 31 2.233 6.650 -0.364 1.00 0.00 C ATOM 498 O GLU A 31 3.423 6.833 -0.624 1.00 0.00 O ATOM 499 CB GLU A 31 0.579 7.848 -1.903 1.00 0.00 C ATOM 500 CG GLU A 31 -0.010 8.674 -0.748 1.00 0.00 C ATOM 501 CD GLU A 31 -0.419 10.088 -1.167 1.00 0.00 C ATOM 502 OE1 GLU A 31 -0.942 10.286 -2.292 1.00 0.00 O ATOM 503 OE2 GLU A 31 -0.179 11.033 -0.382 1.00 0.00 O ATOM 0 H GLU A 31 -0.682 5.704 -1.333 1.00 0.00 H new ATOM 0 HA GLU A 31 1.828 6.223 -2.386 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.317 8.460 -2.421 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.218 7.639 -2.616 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.880 8.155 -0.345 1.00 0.00 H new ATOM 0 HG3 GLU A 31 0.723 8.738 0.056 1.00 0.00 H new ATOM 510 N GLU A 32 1.755 6.514 0.873 1.00 0.00 N ATOM 511 CA GLU A 32 2.595 6.619 2.046 1.00 0.00 C ATOM 512 C GLU A 32 3.633 5.503 1.982 1.00 0.00 C ATOM 513 O GLU A 32 4.821 5.765 2.147 1.00 0.00 O ATOM 514 CB GLU A 32 1.737 6.565 3.312 1.00 0.00 C ATOM 515 CG GLU A 32 2.558 6.903 4.560 1.00 0.00 C ATOM 516 CD GLU A 32 1.705 6.738 5.814 1.00 0.00 C ATOM 517 OE1 GLU A 32 0.715 7.483 5.985 1.00 0.00 O ATOM 518 OE2 GLU A 32 1.996 5.812 6.610 1.00 0.00 O ATOM 0 H GLU A 32 0.774 6.328 1.080 1.00 0.00 H new ATOM 0 HA GLU A 32 3.119 7.574 2.075 1.00 0.00 H new ATOM 0 HB2 GLU A 32 0.907 7.265 3.220 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.305 5.570 3.418 1.00 0.00 H new ATOM 0 HG2 GLU A 32 3.431 6.252 4.617 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.927 7.926 4.495 1.00 0.00 H new ATOM 525 N ILE A 33 3.222 4.264 1.692 1.00 0.00 N ATOM 526 CA ILE A 33 4.151 3.148 1.602 1.00 0.00 C ATOM 527 C ILE A 33 5.157 3.367 0.471 1.00 0.00 C ATOM 528 O ILE A 33 6.352 3.143 0.675 1.00 0.00 O ATOM 529 CB ILE A 33 3.398 1.812 1.452 1.00 0.00 C ATOM 530 CG1 ILE A 33 2.677 1.473 2.770 1.00 0.00 C ATOM 531 CG2 ILE A 33 4.396 0.686 1.127 1.00 0.00 C ATOM 532 CD1 ILE A 33 1.942 0.144 2.669 1.00 0.00 C ATOM 0 H ILE A 33 2.249 4.015 1.516 1.00 0.00 H new ATOM 0 HA ILE A 33 4.715 3.096 2.533 1.00 0.00 H new ATOM 0 HB ILE A 33 2.671 1.904 0.645 1.00 0.00 H new ATOM 0 HG12 ILE A 33 3.401 1.430 3.583 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.970 2.265 3.015 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.859 -0.257 1.022 1.00 0.00 H new ATOM 0 HG22 ILE A 33 4.913 0.915 0.195 1.00 0.00 H new ATOM 0 HG23 ILE A 33 5.124 0.601 1.934 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.443 -0.068 3.614 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.201 0.198 1.871 1.00 0.00 H new ATOM 0 HD13 ILE A 33 2.655 -0.650 2.449 1.00 0.00 H new ATOM 544 N ARG A 34 4.707 3.757 -0.727 1.00 0.00 N ATOM 545 CA ARG A 34 5.609 3.972 -1.858 1.00 0.00 C ATOM 546 C ARG A 34 6.655 4.996 -1.448 1.00 0.00 C ATOM 547 O ARG A 34 7.843 4.781 -1.681 1.00 0.00 O ATOM 548 CB ARG A 34 4.858 4.391 -3.133 1.00 0.00 C ATOM 549 CG ARG A 34 3.741 3.408 -3.530 1.00 0.00 C ATOM 550 CD ARG A 34 3.470 3.353 -5.029 1.00 0.00 C ATOM 551 NE ARG A 34 4.540 2.656 -5.762 1.00 0.00 N ATOM 552 CZ ARG A 34 4.458 1.518 -6.461 1.00 0.00 C ATOM 553 NH1 ARG A 34 3.308 0.881 -6.648 1.00 0.00 N ATOM 554 NH2 ARG A 34 5.549 0.998 -7.005 1.00 0.00 N ATOM 0 H ARG A 34 3.724 3.929 -0.936 1.00 0.00 H new ATOM 0 HA ARG A 34 6.100 3.032 -2.110 1.00 0.00 H new ATOM 0 HB2 ARG A 34 4.426 5.381 -2.984 1.00 0.00 H new ATOM 0 HB3 ARG A 34 5.569 4.474 -3.955 1.00 0.00 H new ATOM 0 HG2 ARG A 34 4.008 2.410 -3.182 1.00 0.00 H new ATOM 0 HG3 ARG A 34 2.823 3.690 -3.015 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.521 2.847 -5.207 1.00 0.00 H new ATOM 0 HD3 ARG A 34 3.368 4.367 -5.416 1.00 0.00 H new ATOM 0 HE ARG A 34 5.460 3.096 -5.733 1.00 0.00 H new ATOM 0 HH11 ARG A 34 2.446 1.257 -6.252 1.00 0.00 H new ATOM 0 HH12 ARG A 34 3.286 0.015 -7.187 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.448 1.465 -6.890 1.00 0.00 H new ATOM 0 HH22 ARG A 34 5.489 0.131 -7.538 1.00 0.00 H new ATOM 568 N GLN A 35 6.226 6.083 -0.809 1.00 0.00 N ATOM 569 CA GLN A 35 7.125 7.130 -0.344 1.00 0.00 C ATOM 570 C GLN A 35 8.100 6.615 0.717 1.00 0.00 C ATOM 571 O GLN A 35 9.310 6.828 0.593 1.00 0.00 O ATOM 572 CB GLN A 35 6.315 8.295 0.239 1.00 0.00 C ATOM 573 CG GLN A 35 5.779 9.203 -0.864 1.00 0.00 C ATOM 574 CD GLN A 35 6.917 9.934 -1.574 1.00 0.00 C ATOM 575 OE1 GLN A 35 7.712 10.640 -0.958 1.00 0.00 O ATOM 576 NE2 GLN A 35 7.083 9.742 -2.870 1.00 0.00 N ATOM 0 H GLN A 35 5.243 6.260 -0.600 1.00 0.00 H new ATOM 0 HA GLN A 35 7.704 7.467 -1.203 1.00 0.00 H new ATOM 0 HB2 GLN A 35 5.485 7.905 0.828 1.00 0.00 H new ATOM 0 HB3 GLN A 35 6.942 8.874 0.917 1.00 0.00 H new ATOM 0 HG2 GLN A 35 5.216 8.611 -1.586 1.00 0.00 H new ATOM 0 HG3 GLN A 35 5.086 9.929 -0.438 1.00 0.00 H new ATOM 0 HE21 GLN A 35 6.427 9.157 -3.387 1.00 0.00 H new ATOM 0 HE22 GLN A 35 7.868 10.179 -3.354 1.00 0.00 H new ATOM 585 N LYS A 36 7.588 5.957 1.758 1.00 0.00 N ATOM 586 CA LYS A 36 8.375 5.422 2.869 1.00 0.00 C ATOM 587 C LYS A 36 9.450 4.469 2.377 1.00 0.00 C ATOM 588 O LYS A 36 10.622 4.629 2.724 1.00 0.00 O ATOM 589 CB LYS A 36 7.451 4.835 3.965 1.00 0.00 C ATOM 590 CG LYS A 36 7.259 3.310 4.043 1.00 0.00 C ATOM 591 CD LYS A 36 6.145 2.980 5.042 1.00 0.00 C ATOM 592 CE LYS A 36 5.778 1.496 4.989 1.00 0.00 C ATOM 593 NZ LYS A 36 4.670 1.184 5.913 1.00 0.00 N ATOM 0 H LYS A 36 6.589 5.777 1.854 1.00 0.00 H new ATOM 0 HA LYS A 36 8.918 6.237 3.347 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.833 5.168 4.930 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.466 5.284 3.840 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.007 2.915 3.059 1.00 0.00 H new ATOM 0 HG3 LYS A 36 8.189 2.832 4.350 1.00 0.00 H new ATOM 0 HD2 LYS A 36 6.467 3.242 6.050 1.00 0.00 H new ATOM 0 HD3 LYS A 36 5.264 3.583 4.822 1.00 0.00 H new ATOM 0 HE2 LYS A 36 5.493 1.226 3.972 1.00 0.00 H new ATOM 0 HE3 LYS A 36 6.650 0.894 5.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.410 0.182 5.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 4.970 1.372 6.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 3.848 1.778 5.683 1.00 0.00 H new ATOM 607 N TYR A 37 9.075 3.480 1.567 1.00 0.00 N ATOM 608 CA TYR A 37 10.027 2.517 1.060 1.00 0.00 C ATOM 609 C TYR A 37 10.964 3.155 0.047 1.00 0.00 C ATOM 610 O TYR A 37 12.156 2.865 0.131 1.00 0.00 O ATOM 611 CB TYR A 37 9.318 1.255 0.567 1.00 0.00 C ATOM 612 CG TYR A 37 8.840 0.333 1.688 1.00 0.00 C ATOM 613 CD1 TYR A 37 9.673 -0.025 2.770 1.00 0.00 C ATOM 614 CD2 TYR A 37 7.550 -0.209 1.625 1.00 0.00 C ATOM 615 CE1 TYR A 37 9.225 -0.921 3.758 1.00 0.00 C ATOM 616 CE2 TYR A 37 7.088 -1.110 2.603 1.00 0.00 C ATOM 617 CZ TYR A 37 7.930 -1.479 3.672 1.00 0.00 C ATOM 618 OH TYR A 37 7.523 -2.384 4.602 1.00 0.00 O ATOM 0 H TYR A 37 8.116 3.332 1.253 1.00 0.00 H new ATOM 0 HA TYR A 37 10.672 2.185 1.874 1.00 0.00 H new ATOM 0 HB2 TYR A 37 8.461 1.546 -0.041 1.00 0.00 H new ATOM 0 HB3 TYR A 37 9.995 0.700 -0.082 1.00 0.00 H new ATOM 0 HD1 TYR A 37 10.666 0.394 2.840 1.00 0.00 H new ATOM 0 HD2 TYR A 37 6.897 0.070 0.811 1.00 0.00 H new ATOM 0 HE1 TYR A 37 9.872 -1.182 4.583 1.00 0.00 H new ATOM 0 HE2 TYR A 37 6.090 -1.518 2.535 1.00 0.00 H new ATOM 0 HH TYR A 37 6.608 -2.670 4.401 1.00 0.00 H new ATOM 628 N GLN A 38 10.510 4.077 -0.813 1.00 0.00 N ATOM 629 CA GLN A 38 11.408 4.712 -1.774 1.00 0.00 C ATOM 630 C GLN A 38 12.511 5.452 -1.018 1.00 0.00 C ATOM 631 O GLN A 38 13.667 5.357 -1.414 1.00 0.00 O ATOM 632 CB GLN A 38 10.655 5.637 -2.741 1.00 0.00 C ATOM 633 CG GLN A 38 11.581 6.389 -3.715 1.00 0.00 C ATOM 634 CD GLN A 38 12.545 5.498 -4.505 1.00 0.00 C ATOM 635 OE1 GLN A 38 12.228 4.384 -4.911 1.00 0.00 O ATOM 636 NE2 GLN A 38 13.750 5.972 -4.768 1.00 0.00 N ATOM 0 H GLN A 38 9.541 4.393 -0.860 1.00 0.00 H new ATOM 0 HA GLN A 38 11.863 3.939 -2.394 1.00 0.00 H new ATOM 0 HB2 GLN A 38 9.940 5.047 -3.314 1.00 0.00 H new ATOM 0 HB3 GLN A 38 10.080 6.362 -2.165 1.00 0.00 H new ATOM 0 HG2 GLN A 38 10.966 6.948 -4.420 1.00 0.00 H new ATOM 0 HG3 GLN A 38 12.163 7.118 -3.151 1.00 0.00 H new ATOM 0 HE21 GLN A 38 14.018 6.897 -4.433 1.00 0.00 H new ATOM 0 HE22 GLN A 38 14.412 5.413 -5.306 1.00 0.00 H new ATOM 645 N SER A 39 12.202 6.126 0.094 1.00 0.00 N ATOM 646 CA SER A 39 13.202 6.840 0.888 1.00 0.00 C ATOM 647 C SER A 39 14.287 5.858 1.354 1.00 0.00 C ATOM 648 O SER A 39 15.460 6.224 1.417 1.00 0.00 O ATOM 649 CB SER A 39 12.477 7.547 2.033 1.00 0.00 C ATOM 650 OG SER A 39 13.266 8.534 2.670 1.00 0.00 O ATOM 0 H SER A 39 11.255 6.191 0.467 1.00 0.00 H new ATOM 0 HA SER A 39 13.719 7.602 0.304 1.00 0.00 H new ATOM 0 HB2 SER A 39 11.569 8.011 1.648 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.168 6.806 2.771 1.00 0.00 H new ATOM 0 HG SER A 39 12.749 8.951 3.391 1.00 0.00 H new ATOM 656 N LYS A 40 13.915 4.617 1.704 1.00 0.00 N ATOM 657 CA LYS A 40 14.856 3.571 2.114 1.00 0.00 C ATOM 658 C LYS A 40 15.584 3.005 0.890 1.00 0.00 C ATOM 659 O LYS A 40 16.741 2.617 0.993 1.00 0.00 O ATOM 660 CB LYS A 40 14.147 2.427 2.862 1.00 0.00 C ATOM 661 CG LYS A 40 13.398 2.905 4.112 1.00 0.00 C ATOM 662 CD LYS A 40 12.694 1.756 4.852 1.00 0.00 C ATOM 663 CE LYS A 40 11.427 2.279 5.534 1.00 0.00 C ATOM 664 NZ LYS A 40 10.772 1.292 6.419 1.00 0.00 N ATOM 0 H LYS A 40 12.942 4.312 1.709 1.00 0.00 H new ATOM 0 HA LYS A 40 15.575 4.028 2.794 1.00 0.00 H new ATOM 0 HB2 LYS A 40 13.443 1.940 2.187 1.00 0.00 H new ATOM 0 HB3 LYS A 40 14.883 1.677 3.151 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.100 3.392 4.788 1.00 0.00 H new ATOM 0 HG3 LYS A 40 12.660 3.654 3.825 1.00 0.00 H new ATOM 0 HD2 LYS A 40 12.439 0.961 4.151 1.00 0.00 H new ATOM 0 HD3 LYS A 40 13.365 1.323 5.594 1.00 0.00 H new ATOM 0 HE2 LYS A 40 11.679 3.164 6.118 1.00 0.00 H new ATOM 0 HE3 LYS A 40 10.717 2.593 4.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 9.923 1.717 6.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 10.500 0.455 5.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 11.432 1.009 7.171 1.00 0.00 H new ATOM 678 N ARG A 41 14.930 2.919 -0.273 1.00 0.00 N ATOM 679 CA ARG A 41 15.491 2.386 -1.517 1.00 0.00 C ATOM 680 C ARG A 41 16.490 3.334 -2.158 1.00 0.00 C ATOM 681 O ARG A 41 17.470 2.893 -2.746 1.00 0.00 O ATOM 682 CB ARG A 41 14.343 2.112 -2.503 1.00 0.00 C ATOM 683 CG ARG A 41 14.704 1.064 -3.561 1.00 0.00 C ATOM 684 CD ARG A 41 15.166 1.643 -4.904 1.00 0.00 C ATOM 685 NE ARG A 41 14.748 0.791 -6.031 1.00 0.00 N ATOM 686 CZ ARG A 41 14.490 1.217 -7.274 1.00 0.00 C ATOM 687 NH1 ARG A 41 14.878 2.420 -7.683 1.00 0.00 N ATOM 688 NH2 ARG A 41 13.822 0.436 -8.106 1.00 0.00 N ATOM 0 H ARG A 41 13.964 3.229 -0.377 1.00 0.00 H new ATOM 0 HA ARG A 41 16.026 1.468 -1.274 1.00 0.00 H new ATOM 0 HB2 ARG A 41 13.467 1.775 -1.949 1.00 0.00 H new ATOM 0 HB3 ARG A 41 14.067 3.042 -2.999 1.00 0.00 H new ATOM 0 HG2 ARG A 41 15.493 0.425 -3.165 1.00 0.00 H new ATOM 0 HG3 ARG A 41 13.836 0.428 -3.734 1.00 0.00 H new ATOM 0 HD2 ARG A 41 14.754 2.644 -5.031 1.00 0.00 H new ATOM 0 HD3 ARG A 41 16.251 1.742 -4.905 1.00 0.00 H new ATOM 0 HE ARG A 41 14.647 -0.208 -5.849 1.00 0.00 H new ATOM 0 HH11 ARG A 41 15.382 3.037 -7.046 1.00 0.00 H new ATOM 0 HH12 ARG A 41 14.672 2.726 -8.634 1.00 0.00 H new ATOM 0 HH21 ARG A 41 13.507 -0.484 -7.799 1.00 0.00 H new ATOM 0 HH22 ARG A 41 13.622 0.754 -9.054 1.00 0.00 H new ATOM 702 N GLN A 42 16.259 4.630 -2.029 1.00 0.00 N ATOM 703 CA GLN A 42 17.103 5.672 -2.579 1.00 0.00 C ATOM 704 C GLN A 42 18.580 5.511 -2.177 1.00 0.00 C ATOM 705 O GLN A 42 19.407 5.404 -3.074 1.00 0.00 O ATOM 706 CB GLN A 42 16.529 7.065 -2.254 1.00 0.00 C ATOM 707 CG GLN A 42 17.150 8.138 -3.158 1.00 0.00 C ATOM 708 CD GLN A 42 16.899 7.855 -4.638 1.00 0.00 C ATOM 709 OE1 GLN A 42 15.786 8.035 -5.128 1.00 0.00 O ATOM 710 NE2 GLN A 42 17.883 7.330 -5.353 1.00 0.00 N ATOM 0 H GLN A 42 15.453 4.995 -1.522 1.00 0.00 H new ATOM 0 HA GLN A 42 17.097 5.570 -3.664 1.00 0.00 H new ATOM 0 HB2 GLN A 42 15.447 7.056 -2.384 1.00 0.00 H new ATOM 0 HB3 GLN A 42 16.722 7.308 -1.209 1.00 0.00 H new ATOM 0 HG2 GLN A 42 16.736 9.113 -2.900 1.00 0.00 H new ATOM 0 HG3 GLN A 42 18.223 8.189 -2.976 1.00 0.00 H new ATOM 0 HE21 GLN A 42 18.800 7.188 -4.931 1.00 0.00 H new ATOM 0 HE22 GLN A 42 17.723 7.068 -6.326 1.00 0.00 H new ATOM 719 N PRO A 43 18.959 5.452 -0.888 1.00 0.00 N ATOM 720 CA PRO A 43 20.355 5.281 -0.492 1.00 0.00 C ATOM 721 C PRO A 43 20.890 3.910 -0.894 1.00 0.00 C ATOM 722 O PRO A 43 22.104 3.728 -0.930 1.00 0.00 O ATOM 723 CB PRO A 43 20.370 5.396 1.035 1.00 0.00 C ATOM 724 CG PRO A 43 18.961 4.975 1.421 1.00 0.00 C ATOM 725 CD PRO A 43 18.132 5.562 0.294 1.00 0.00 C ATOM 0 HA PRO A 43 20.983 6.026 -0.980 1.00 0.00 H new ATOM 0 HB2 PRO A 43 21.122 4.746 1.482 1.00 0.00 H new ATOM 0 HB3 PRO A 43 20.592 6.412 1.362 1.00 0.00 H new ATOM 0 HG2 PRO A 43 18.861 3.891 1.478 1.00 0.00 H new ATOM 0 HG3 PRO A 43 18.668 5.374 2.392 1.00 0.00 H new ATOM 0 HD2 PRO A 43 17.196 5.018 0.170 1.00 0.00 H new ATOM 0 HD3 PRO A 43 17.873 6.601 0.497 1.00 0.00 H new ATOM 733 N ILE A 44 20.002 2.937 -1.128 1.00 0.00 N ATOM 734 CA ILE A 44 20.398 1.601 -1.508 1.00 0.00 C ATOM 735 C ILE A 44 20.906 1.636 -2.946 1.00 0.00 C ATOM 736 O ILE A 44 22.016 1.171 -3.210 1.00 0.00 O ATOM 737 CB ILE A 44 19.267 0.573 -1.287 1.00 0.00 C ATOM 738 CG1 ILE A 44 18.955 0.386 0.211 1.00 0.00 C ATOM 739 CG2 ILE A 44 19.641 -0.771 -1.909 1.00 0.00 C ATOM 740 CD1 ILE A 44 17.774 -0.556 0.483 1.00 0.00 C ATOM 0 H ILE A 44 18.993 3.066 -1.056 1.00 0.00 H new ATOM 0 HA ILE A 44 21.208 1.261 -0.863 1.00 0.00 H new ATOM 0 HB ILE A 44 18.372 0.961 -1.774 1.00 0.00 H new ATOM 0 HG12 ILE A 44 19.841 -0.003 0.712 1.00 0.00 H new ATOM 0 HG13 ILE A 44 18.741 1.359 0.653 1.00 0.00 H new ATOM 0 HG21 ILE A 44 18.834 -1.485 -1.745 1.00 0.00 H new ATOM 0 HG22 ILE A 44 19.801 -0.644 -2.980 1.00 0.00 H new ATOM 0 HG23 ILE A 44 20.555 -1.144 -1.447 1.00 0.00 H new ATOM 0 HD11 ILE A 44 17.614 -0.638 1.558 1.00 0.00 H new ATOM 0 HD12 ILE A 44 16.875 -0.158 0.012 1.00 0.00 H new ATOM 0 HD13 ILE A 44 17.993 -1.542 0.072 1.00 0.00 H new ATOM 752 N LEU A 45 20.087 2.172 -3.855 1.00 0.00 N ATOM 753 CA LEU A 45 20.419 2.272 -5.271 1.00 0.00 C ATOM 754 C LEU A 45 21.626 3.173 -5.442 1.00 0.00 C ATOM 755 O LEU A 45 22.557 2.831 -6.159 1.00 0.00 O ATOM 756 CB LEU A 45 19.211 2.683 -6.140 1.00 0.00 C ATOM 757 CG LEU A 45 18.834 4.165 -6.237 1.00 0.00 C ATOM 758 CD1 LEU A 45 19.602 4.910 -7.338 1.00 0.00 C ATOM 759 CD2 LEU A 45 17.326 4.259 -6.512 1.00 0.00 C ATOM 0 H LEU A 45 19.169 2.550 -3.623 1.00 0.00 H new ATOM 0 HA LEU A 45 20.686 1.282 -5.640 1.00 0.00 H new ATOM 0 HB2 LEU A 45 19.397 2.324 -7.152 1.00 0.00 H new ATOM 0 HB3 LEU A 45 18.339 2.146 -5.766 1.00 0.00 H new ATOM 0 HG LEU A 45 19.101 4.641 -5.294 1.00 0.00 H new ATOM 0 HD11 LEU A 45 19.290 5.954 -7.356 1.00 0.00 H new ATOM 0 HD12 LEU A 45 20.672 4.854 -7.137 1.00 0.00 H new ATOM 0 HD13 LEU A 45 19.390 4.451 -8.304 1.00 0.00 H new ATOM 0 HD21 LEU A 45 17.034 5.307 -6.585 1.00 0.00 H new ATOM 0 HD22 LEU A 45 17.095 3.752 -7.449 1.00 0.00 H new ATOM 0 HD23 LEU A 45 16.777 3.786 -5.698 1.00 0.00 H new ATOM 771 N ASP A 46 21.655 4.285 -4.710 1.00 0.00 N ATOM 772 CA ASP A 46 22.742 5.249 -4.789 1.00 0.00 C ATOM 773 C ASP A 46 24.100 4.616 -4.496 1.00 0.00 C ATOM 774 O ASP A 46 25.103 5.007 -5.085 1.00 0.00 O ATOM 775 CB ASP A 46 22.427 6.372 -3.806 1.00 0.00 C ATOM 776 CG ASP A 46 23.312 7.585 -4.010 1.00 0.00 C ATOM 777 OD1 ASP A 46 24.438 7.622 -3.489 1.00 0.00 O ATOM 778 OD2 ASP A 46 22.803 8.570 -4.595 1.00 0.00 O ATOM 0 H ASP A 46 20.924 4.540 -4.046 1.00 0.00 H new ATOM 0 HA ASP A 46 22.815 5.638 -5.805 1.00 0.00 H new ATOM 0 HB2 ASP A 46 21.383 6.665 -3.916 1.00 0.00 H new ATOM 0 HB3 ASP A 46 22.549 6.004 -2.787 1.00 0.00 H new ATOM 783 N ALA A 47 24.115 3.621 -3.607 1.00 0.00 N ATOM 784 CA ALA A 47 25.304 2.896 -3.206 1.00 0.00 C ATOM 785 C ALA A 47 25.760 1.872 -4.256 1.00 0.00 C ATOM 786 O ALA A 47 26.954 1.834 -4.530 1.00 0.00 O ATOM 787 CB ALA A 47 25.011 2.215 -1.876 1.00 0.00 C ATOM 0 H ALA A 47 23.271 3.294 -3.137 1.00 0.00 H new ATOM 0 HA ALA A 47 26.128 3.602 -3.106 1.00 0.00 H new ATOM 0 HB1 ALA A 47 25.891 1.661 -1.550 1.00 0.00 H new ATOM 0 HB2 ALA A 47 24.759 2.968 -1.129 1.00 0.00 H new ATOM 0 HB3 ALA A 47 24.173 1.528 -1.996 1.00 0.00 H new ATOM 793 N ILE A 48 24.886 1.014 -4.811 1.00 0.00 N ATOM 794 CA ILE A 48 25.330 0.035 -5.827 1.00 0.00 C ATOM 795 C ILE A 48 25.823 0.763 -7.075 1.00 0.00 C ATOM 796 O ILE A 48 26.763 0.312 -7.727 1.00 0.00 O ATOM 797 CB ILE A 48 24.251 -1.022 -6.178 1.00 0.00 C ATOM 798 CG1 ILE A 48 24.776 -2.084 -7.165 1.00 0.00 C ATOM 799 CG2 ILE A 48 22.951 -0.397 -6.693 1.00 0.00 C ATOM 800 CD1 ILE A 48 24.006 -3.408 -7.067 1.00 0.00 C ATOM 0 H ILE A 48 23.893 0.975 -4.583 1.00 0.00 H new ATOM 0 HA ILE A 48 26.156 -0.526 -5.389 1.00 0.00 H new ATOM 0 HB ILE A 48 24.016 -1.524 -5.239 1.00 0.00 H new ATOM 0 HG12 ILE A 48 24.702 -1.699 -8.182 1.00 0.00 H new ATOM 0 HG13 ILE A 48 25.833 -2.266 -6.969 1.00 0.00 H new ATOM 0 HG21 ILE A 48 22.234 -1.185 -6.922 1.00 0.00 H new ATOM 0 HG22 ILE A 48 22.536 0.260 -5.929 1.00 0.00 H new ATOM 0 HG23 ILE A 48 23.157 0.179 -7.595 1.00 0.00 H new ATOM 0 HD11 ILE A 48 24.415 -4.121 -7.783 1.00 0.00 H new ATOM 0 HD12 ILE A 48 24.102 -3.811 -6.059 1.00 0.00 H new ATOM 0 HD13 ILE A 48 22.953 -3.234 -7.290 1.00 0.00 H new ATOM 812 N GLU A 49 25.197 1.896 -7.383 1.00 0.00 N ATOM 813 CA GLU A 49 25.522 2.717 -8.532 1.00 0.00 C ATOM 814 C GLU A 49 26.837 3.485 -8.331 1.00 0.00 C ATOM 815 O GLU A 49 27.311 4.121 -9.273 1.00 0.00 O ATOM 816 CB GLU A 49 24.343 3.642 -8.874 1.00 0.00 C ATOM 817 CG GLU A 49 23.040 2.906 -9.251 1.00 0.00 C ATOM 818 CD GLU A 49 23.080 2.183 -10.597 1.00 0.00 C ATOM 819 OE1 GLU A 49 23.955 1.323 -10.827 1.00 0.00 O ATOM 820 OE2 GLU A 49 22.203 2.461 -11.452 1.00 0.00 O ATOM 0 H GLU A 49 24.432 2.272 -6.823 1.00 0.00 H new ATOM 0 HA GLU A 49 25.687 2.063 -9.388 1.00 0.00 H new ATOM 0 HB2 GLU A 49 24.146 4.289 -8.019 1.00 0.00 H new ATOM 0 HB3 GLU A 49 24.633 4.288 -9.703 1.00 0.00 H new ATOM 0 HG2 GLU A 49 22.810 2.180 -8.471 1.00 0.00 H new ATOM 0 HG3 GLU A 49 22.223 3.627 -9.266 1.00 0.00 H new ATOM 827 N ALA A 50 27.367 3.528 -7.101 1.00 0.00 N ATOM 828 CA ALA A 50 28.613 4.201 -6.744 1.00 0.00 C ATOM 829 C ALA A 50 29.834 3.267 -6.812 1.00 0.00 C ATOM 830 O ALA A 50 30.938 3.697 -6.469 1.00 0.00 O ATOM 831 CB ALA A 50 28.487 4.791 -5.333 1.00 0.00 C ATOM 0 H ALA A 50 26.920 3.078 -6.302 1.00 0.00 H new ATOM 0 HA ALA A 50 28.777 4.993 -7.475 1.00 0.00 H new ATOM 0 HB1 ALA A 50 29.416 5.294 -5.065 1.00 0.00 H new ATOM 0 HB2 ALA A 50 27.667 5.508 -5.310 1.00 0.00 H new ATOM 0 HB3 ALA A 50 28.289 3.991 -4.620 1.00 0.00 H new ATOM 890 N TYR B 104 20.820 4.144 7.457 1.00 0.00 N ATOM 891 CA TYR B 104 21.603 3.228 6.636 1.00 0.00 C ATOM 892 C TYR B 104 22.470 4.068 5.680 1.00 0.00 C ATOM 893 O TYR B 104 22.689 3.719 4.527 1.00 0.00 O ATOM 894 CB TYR B 104 20.671 2.244 5.905 1.00 0.00 C ATOM 895 CG TYR B 104 19.833 1.330 6.788 1.00 0.00 C ATOM 896 CD1 TYR B 104 18.713 1.837 7.474 1.00 0.00 C ATOM 897 CD2 TYR B 104 20.172 -0.031 6.919 1.00 0.00 C ATOM 898 CE1 TYR B 104 17.994 1.025 8.365 1.00 0.00 C ATOM 899 CE2 TYR B 104 19.467 -0.850 7.818 1.00 0.00 C ATOM 900 CZ TYR B 104 18.401 -0.310 8.574 1.00 0.00 C ATOM 901 OH TYR B 104 17.721 -1.084 9.465 1.00 0.00 O ATOM 0 HA TYR B 104 22.267 2.615 7.246 1.00 0.00 H new ATOM 0 HB2 TYR B 104 19.997 2.818 5.269 1.00 0.00 H new ATOM 0 HB3 TYR B 104 21.278 1.622 5.247 1.00 0.00 H new ATOM 0 HD1 TYR B 104 18.404 2.859 7.313 1.00 0.00 H new ATOM 0 HD2 TYR B 104 20.975 -0.446 6.328 1.00 0.00 H new ATOM 0 HE1 TYR B 104 17.135 1.419 8.887 1.00 0.00 H new ATOM 0 HE2 TYR B 104 19.739 -1.889 7.931 1.00 0.00 H new ATOM 0 HH TYR B 104 18.122 -1.978 9.495 1.00 0.00 H new ATOM 911 N GLU B 105 22.918 5.235 6.135 1.00 0.00 N ATOM 912 CA GLU B 105 23.734 6.192 5.391 1.00 0.00 C ATOM 913 C GLU B 105 25.137 5.684 5.069 1.00 0.00 C ATOM 914 O GLU B 105 25.799 6.258 4.211 1.00 0.00 O ATOM 915 CB GLU B 105 23.725 7.548 6.123 1.00 0.00 C ATOM 916 CG GLU B 105 22.309 8.152 6.081 1.00 0.00 C ATOM 917 CD GLU B 105 22.146 9.468 6.850 1.00 0.00 C ATOM 918 OE1 GLU B 105 22.776 9.699 7.908 1.00 0.00 O ATOM 919 OE2 GLU B 105 21.336 10.299 6.390 1.00 0.00 O ATOM 0 H GLU B 105 22.711 5.556 7.081 1.00 0.00 H new ATOM 0 HA GLU B 105 23.283 6.329 4.408 1.00 0.00 H new ATOM 0 HB2 GLU B 105 24.044 7.416 7.157 1.00 0.00 H new ATOM 0 HB3 GLU B 105 24.435 8.229 5.655 1.00 0.00 H new ATOM 0 HG2 GLU B 105 22.032 8.319 5.040 1.00 0.00 H new ATOM 0 HG3 GLU B 105 21.607 7.423 6.485 1.00 0.00 H new ATOM 926 N PHE B 106 25.642 4.695 5.804 1.00 0.00 N ATOM 927 CA PHE B 106 26.964 4.104 5.604 1.00 0.00 C ATOM 928 C PHE B 106 26.918 3.044 4.489 1.00 0.00 C ATOM 929 O PHE B 106 27.932 2.421 4.169 1.00 0.00 O ATOM 930 CB PHE B 106 27.475 3.513 6.929 1.00 0.00 C ATOM 931 CG PHE B 106 28.040 4.500 7.945 1.00 0.00 C ATOM 932 CD1 PHE B 106 27.435 5.749 8.198 1.00 0.00 C ATOM 933 CD2 PHE B 106 29.217 4.161 8.643 1.00 0.00 C ATOM 934 CE1 PHE B 106 28.013 6.647 9.109 1.00 0.00 C ATOM 935 CE2 PHE B 106 29.786 5.057 9.566 1.00 0.00 C ATOM 936 CZ PHE B 106 29.186 6.305 9.799 1.00 0.00 C ATOM 0 H PHE B 106 25.129 4.271 6.577 1.00 0.00 H new ATOM 0 HA PHE B 106 27.662 4.879 5.287 1.00 0.00 H new ATOM 0 HB2 PHE B 106 26.654 2.972 7.400 1.00 0.00 H new ATOM 0 HB3 PHE B 106 28.249 2.781 6.699 1.00 0.00 H new ATOM 0 HD1 PHE B 106 26.521 6.016 7.688 1.00 0.00 H new ATOM 0 HD2 PHE B 106 29.686 3.204 8.467 1.00 0.00 H new ATOM 0 HE1 PHE B 106 27.551 7.608 9.280 1.00 0.00 H new ATOM 0 HE2 PHE B 106 30.686 4.785 10.097 1.00 0.00 H new ATOM 0 HZ PHE B 106 29.624 6.996 10.504 1.00 0.00 H new ATOM 946 N LEU B 107 25.748 2.834 3.866 1.00 0.00 N ATOM 947 CA LEU B 107 25.542 1.868 2.790 1.00 0.00 C ATOM 948 C LEU B 107 26.500 2.090 1.638 1.00 0.00 C ATOM 949 O LEU B 107 26.750 1.155 0.881 1.00 0.00 O ATOM 950 CB LEU B 107 24.112 1.963 2.243 1.00 0.00 C ATOM 951 CG LEU B 107 23.125 1.053 2.974 1.00 0.00 C ATOM 952 CD1 LEU B 107 21.719 1.288 2.411 1.00 0.00 C ATOM 953 CD2 LEU B 107 23.529 -0.417 2.869 1.00 0.00 C ATOM 0 H LEU B 107 24.901 3.348 4.107 1.00 0.00 H new ATOM 0 HA LEU B 107 25.722 0.883 3.221 1.00 0.00 H new ATOM 0 HB2 LEU B 107 23.769 2.995 2.319 1.00 0.00 H new ATOM 0 HB3 LEU B 107 24.117 1.706 1.184 1.00 0.00 H new ATOM 0 HG LEU B 107 23.133 1.301 4.035 1.00 0.00 H new ATOM 0 HD11 LEU B 107 21.008 0.643 2.927 1.00 0.00 H new ATOM 0 HD12 LEU B 107 21.437 2.330 2.560 1.00 0.00 H new ATOM 0 HD13 LEU B 107 21.711 1.058 1.346 1.00 0.00 H new ATOM 0 HD21 LEU B 107 22.803 -1.033 3.401 1.00 0.00 H new ATOM 0 HD22 LEU B 107 23.556 -0.713 1.820 1.00 0.00 H new ATOM 0 HD23 LEU B 107 24.516 -0.556 3.311 1.00 0.00 H new ATOM 965 N LYS B 108 27.030 3.304 1.500 1.00 0.00 N ATOM 966 CA LYS B 108 27.983 3.618 0.442 1.00 0.00 C ATOM 967 C LYS B 108 29.187 2.664 0.484 1.00 0.00 C ATOM 968 O LYS B 108 29.727 2.316 -0.566 1.00 0.00 O ATOM 969 CB LYS B 108 28.459 5.068 0.614 1.00 0.00 C ATOM 970 CG LYS B 108 27.372 6.151 0.531 1.00 0.00 C ATOM 971 CD LYS B 108 26.466 6.039 -0.702 1.00 0.00 C ATOM 972 CE LYS B 108 25.452 7.183 -0.750 1.00 0.00 C ATOM 973 NZ LYS B 108 26.028 8.459 -1.221 1.00 0.00 N ATOM 0 H LYS B 108 26.812 4.090 2.113 1.00 0.00 H new ATOM 0 HA LYS B 108 27.492 3.497 -0.524 1.00 0.00 H new ATOM 0 HB2 LYS B 108 28.955 5.154 1.581 1.00 0.00 H new ATOM 0 HB3 LYS B 108 29.209 5.276 -0.149 1.00 0.00 H new ATOM 0 HG2 LYS B 108 26.754 6.100 1.428 1.00 0.00 H new ATOM 0 HG3 LYS B 108 27.850 7.131 0.529 1.00 0.00 H new ATOM 0 HD2 LYS B 108 27.075 6.051 -1.606 1.00 0.00 H new ATOM 0 HD3 LYS B 108 25.940 5.084 -0.685 1.00 0.00 H new ATOM 0 HE2 LYS B 108 24.628 6.901 -1.406 1.00 0.00 H new ATOM 0 HE3 LYS B 108 25.032 7.328 0.245 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 25.733 9.228 -0.587 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 27.066 8.391 -1.223 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 25.692 8.657 -2.185 1.00 0.00 H new ATOM 987 N SER B 109 29.598 2.210 1.673 1.00 0.00 N ATOM 988 CA SER B 109 30.734 1.313 1.830 1.00 0.00 C ATOM 989 C SER B 109 30.326 -0.158 1.960 1.00 0.00 C ATOM 990 O SER B 109 31.221 -1.005 2.018 1.00 0.00 O ATOM 991 CB SER B 109 31.548 1.768 3.046 1.00 0.00 C ATOM 992 OG SER B 109 32.835 1.181 3.034 1.00 0.00 O ATOM 0 H SER B 109 29.146 2.459 2.553 1.00 0.00 H new ATOM 0 HA SER B 109 31.339 1.368 0.925 1.00 0.00 H new ATOM 0 HB2 SER B 109 31.638 2.854 3.044 1.00 0.00 H new ATOM 0 HB3 SER B 109 31.026 1.493 3.963 1.00 0.00 H new ATOM 0 HG SER B 109 32.774 0.267 2.687 1.00 0.00 H new ATOM 998 N TRP B 110 29.032 -0.487 2.052 1.00 0.00 N ATOM 999 CA TRP B 110 28.586 -1.872 2.185 1.00 0.00 C ATOM 1000 C TRP B 110 28.943 -2.641 0.917 1.00 0.00 C ATOM 1001 O TRP B 110 28.981 -2.065 -0.174 1.00 0.00 O ATOM 1002 CB TRP B 110 27.078 -1.931 2.446 1.00 0.00 C ATOM 1003 CG TRP B 110 26.637 -1.979 3.881 1.00 0.00 C ATOM 1004 CD1 TRP B 110 25.618 -2.748 4.319 1.00 0.00 C ATOM 1005 CD2 TRP B 110 27.169 -1.315 5.073 1.00 0.00 C ATOM 1006 NE1 TRP B 110 25.479 -2.611 5.683 1.00 0.00 N ATOM 1007 CE2 TRP B 110 26.401 -1.733 6.201 1.00 0.00 C ATOM 1008 CE3 TRP B 110 28.236 -0.432 5.341 1.00 0.00 C ATOM 1009 CZ2 TRP B 110 26.664 -1.289 7.505 1.00 0.00 C ATOM 1010 CZ3 TRP B 110 28.512 0.024 6.642 1.00 0.00 C ATOM 1011 CH2 TRP B 110 27.724 -0.396 7.725 1.00 0.00 C ATOM 0 H TRP B 110 28.274 0.195 2.036 1.00 0.00 H new ATOM 0 HA TRP B 110 29.090 -2.331 3.036 1.00 0.00 H new ATOM 0 HB2 TRP B 110 26.619 -1.060 1.979 1.00 0.00 H new ATOM 0 HB3 TRP B 110 26.680 -2.811 1.940 1.00 0.00 H new ATOM 0 HD1 TRP B 110 25.003 -3.377 3.693 1.00 0.00 H new ATOM 0 HE1 TRP B 110 24.778 -3.101 6.240 1.00 0.00 H new ATOM 0 HE3 TRP B 110 28.858 -0.097 4.524 1.00 0.00 H new ATOM 0 HZ2 TRP B 110 26.057 -1.631 8.331 1.00 0.00 H new ATOM 0 HZ3 TRP B 110 29.336 0.702 6.809 1.00 0.00 H new ATOM 0 HH2 TRP B 110 27.932 -0.034 8.721 1.00 0.00 H new ATOM 1022 N THR B 111 29.236 -3.934 1.039 1.00 0.00 N ATOM 1023 CA THR B 111 29.583 -4.765 -0.106 1.00 0.00 C ATOM 1024 C THR B 111 28.396 -4.789 -1.079 1.00 0.00 C ATOM 1025 O THR B 111 27.252 -4.688 -0.637 1.00 0.00 O ATOM 1026 CB THR B 111 29.919 -6.188 0.409 1.00 0.00 C ATOM 1027 OG1 THR B 111 29.667 -6.370 1.800 1.00 0.00 O ATOM 1028 CG2 THR B 111 31.404 -6.469 0.201 1.00 0.00 C ATOM 0 H THR B 111 29.239 -4.431 1.930 1.00 0.00 H new ATOM 0 HA THR B 111 30.450 -4.369 -0.634 1.00 0.00 H new ATOM 0 HB THR B 111 29.274 -6.862 -0.155 1.00 0.00 H new ATOM 0 HG1 THR B 111 29.898 -7.287 2.057 1.00 0.00 H new ATOM 0 HG21 THR B 111 31.639 -7.470 0.563 1.00 0.00 H new ATOM 0 HG22 THR B 111 31.642 -6.402 -0.861 1.00 0.00 H new ATOM 0 HG23 THR B 111 31.994 -5.736 0.751 1.00 0.00 H new ATOM 1036 N VAL B 112 28.637 -5.004 -2.376 1.00 0.00 N ATOM 1037 CA VAL B 112 27.571 -5.051 -3.376 1.00 0.00 C ATOM 1038 C VAL B 112 26.555 -6.157 -3.063 1.00 0.00 C ATOM 1039 O VAL B 112 25.355 -5.935 -3.193 1.00 0.00 O ATOM 1040 CB VAL B 112 28.170 -5.129 -4.801 1.00 0.00 C ATOM 1041 CG1 VAL B 112 29.032 -6.371 -5.068 1.00 0.00 C ATOM 1042 CG2 VAL B 112 27.079 -5.025 -5.871 1.00 0.00 C ATOM 0 H VAL B 112 29.571 -5.149 -2.759 1.00 0.00 H new ATOM 0 HA VAL B 112 27.001 -4.123 -3.335 1.00 0.00 H new ATOM 0 HB VAL B 112 28.839 -4.270 -4.861 1.00 0.00 H new ATOM 0 HG11 VAL B 112 29.408 -6.340 -6.090 1.00 0.00 H new ATOM 0 HG12 VAL B 112 29.871 -6.388 -4.373 1.00 0.00 H new ATOM 0 HG13 VAL B 112 28.429 -7.269 -4.931 1.00 0.00 H new ATOM 0 HG21 VAL B 112 27.533 -5.083 -6.860 1.00 0.00 H new ATOM 0 HG22 VAL B 112 26.370 -5.844 -5.748 1.00 0.00 H new ATOM 0 HG23 VAL B 112 26.557 -4.074 -5.767 1.00 0.00 H new ATOM 1052 N GLU B 113 26.998 -7.310 -2.566 1.00 0.00 N ATOM 1053 CA GLU B 113 26.115 -8.425 -2.255 1.00 0.00 C ATOM 1054 C GLU B 113 25.158 -8.061 -1.128 1.00 0.00 C ATOM 1055 O GLU B 113 23.940 -8.153 -1.285 1.00 0.00 O ATOM 1056 CB GLU B 113 26.884 -9.703 -1.865 1.00 0.00 C ATOM 1057 CG GLU B 113 28.241 -9.917 -2.545 1.00 0.00 C ATOM 1058 CD GLU B 113 29.327 -9.118 -1.811 1.00 0.00 C ATOM 1059 OE1 GLU B 113 29.727 -9.563 -0.708 1.00 0.00 O ATOM 1060 OE2 GLU B 113 29.677 -8.010 -2.275 1.00 0.00 O ATOM 0 H GLU B 113 27.981 -7.495 -2.368 1.00 0.00 H new ATOM 0 HA GLU B 113 25.557 -8.631 -3.168 1.00 0.00 H new ATOM 0 HB2 GLU B 113 27.041 -9.692 -0.786 1.00 0.00 H new ATOM 0 HB3 GLU B 113 26.252 -10.563 -2.086 1.00 0.00 H new ATOM 0 HG2 GLU B 113 28.494 -10.977 -2.544 1.00 0.00 H new ATOM 0 HG3 GLU B 113 28.188 -9.603 -3.587 1.00 0.00 H new ATOM 1067 N ASP B 114 25.729 -7.608 -0.014 1.00 0.00 N ATOM 1068 CA ASP B 114 25.034 -7.210 1.204 1.00 0.00 C ATOM 1069 C ASP B 114 24.061 -6.085 0.929 1.00 0.00 C ATOM 1070 O ASP B 114 22.903 -6.125 1.345 1.00 0.00 O ATOM 1071 CB ASP B 114 26.049 -6.727 2.248 1.00 0.00 C ATOM 1072 CG ASP B 114 26.493 -7.860 3.154 1.00 0.00 C ATOM 1073 OD1 ASP B 114 27.337 -8.680 2.743 1.00 0.00 O ATOM 1074 OD2 ASP B 114 25.974 -7.951 4.291 1.00 0.00 O ATOM 0 H ASP B 114 26.741 -7.504 0.066 1.00 0.00 H new ATOM 0 HA ASP B 114 24.488 -8.077 1.576 1.00 0.00 H new ATOM 0 HB2 ASP B 114 26.917 -6.301 1.744 1.00 0.00 H new ATOM 0 HB3 ASP B 114 25.606 -5.932 2.848 1.00 0.00 H new ATOM 1079 N LEU B 115 24.539 -5.060 0.231 1.00 0.00 N ATOM 1080 CA LEU B 115 23.721 -3.915 -0.100 1.00 0.00 C ATOM 1081 C LEU B 115 22.559 -4.376 -0.986 1.00 0.00 C ATOM 1082 O LEU B 115 21.415 -3.967 -0.756 1.00 0.00 O ATOM 1083 CB LEU B 115 24.606 -2.795 -0.679 1.00 0.00 C ATOM 1084 CG LEU B 115 24.615 -2.639 -2.213 1.00 0.00 C ATOM 1085 CD1 LEU B 115 23.323 -2.039 -2.792 1.00 0.00 C ATOM 1086 CD2 LEU B 115 25.811 -1.798 -2.648 1.00 0.00 C ATOM 0 H LEU B 115 25.497 -5.006 -0.115 1.00 0.00 H new ATOM 0 HA LEU B 115 23.257 -3.471 0.781 1.00 0.00 H new ATOM 0 HB2 LEU B 115 24.285 -1.849 -0.243 1.00 0.00 H new ATOM 0 HB3 LEU B 115 25.631 -2.967 -0.349 1.00 0.00 H new ATOM 0 HG LEU B 115 24.690 -3.650 -2.614 1.00 0.00 H new ATOM 0 HD11 LEU B 115 23.411 -1.963 -3.876 1.00 0.00 H new ATOM 0 HD12 LEU B 115 22.479 -2.681 -2.541 1.00 0.00 H new ATOM 0 HD13 LEU B 115 23.162 -1.047 -2.371 1.00 0.00 H new ATOM 0 HD21 LEU B 115 25.807 -1.694 -3.733 1.00 0.00 H new ATOM 0 HD22 LEU B 115 25.748 -0.811 -2.189 1.00 0.00 H new ATOM 0 HD23 LEU B 115 26.733 -2.287 -2.333 1.00 0.00 H new ATOM 1098 N GLN B 116 22.833 -5.246 -1.965 1.00 0.00 N ATOM 1099 CA GLN B 116 21.822 -5.768 -2.868 1.00 0.00 C ATOM 1100 C GLN B 116 20.774 -6.575 -2.088 1.00 0.00 C ATOM 1101 O GLN B 116 19.606 -6.557 -2.466 1.00 0.00 O ATOM 1102 CB GLN B 116 22.493 -6.542 -4.006 1.00 0.00 C ATOM 1103 CG GLN B 116 21.481 -7.004 -5.046 1.00 0.00 C ATOM 1104 CD GLN B 116 22.184 -7.688 -6.212 1.00 0.00 C ATOM 1105 OE1 GLN B 116 22.337 -8.907 -6.204 1.00 0.00 O ATOM 1106 NE2 GLN B 116 22.660 -6.966 -7.211 1.00 0.00 N ATOM 0 H GLN B 116 23.770 -5.605 -2.147 1.00 0.00 H new ATOM 0 HA GLN B 116 21.273 -4.952 -3.338 1.00 0.00 H new ATOM 0 HB2 GLN B 116 23.243 -5.911 -4.483 1.00 0.00 H new ATOM 0 HB3 GLN B 116 23.017 -7.407 -3.599 1.00 0.00 H new ATOM 0 HG2 GLN B 116 20.770 -7.692 -4.589 1.00 0.00 H new ATOM 0 HG3 GLN B 116 20.909 -6.150 -5.409 1.00 0.00 H new ATOM 0 HE21 GLN B 116 22.532 -5.954 -7.215 1.00 0.00 H new ATOM 0 HE22 GLN B 116 23.156 -7.421 -7.978 1.00 0.00 H new ATOM 1115 N LYS B 117 21.132 -7.244 -0.985 1.00 0.00 N ATOM 1116 CA LYS B 117 20.144 -7.984 -0.187 1.00 0.00 C ATOM 1117 C LYS B 117 19.073 -7.006 0.292 1.00 0.00 C ATOM 1118 O LYS B 117 17.890 -7.309 0.175 1.00 0.00 O ATOM 1119 CB LYS B 117 20.757 -8.781 0.984 1.00 0.00 C ATOM 1120 CG LYS B 117 21.011 -10.257 0.636 1.00 0.00 C ATOM 1121 CD LYS B 117 22.180 -10.422 -0.339 1.00 0.00 C ATOM 1122 CE LYS B 117 22.469 -11.878 -0.698 1.00 0.00 C ATOM 1123 NZ LYS B 117 21.391 -12.499 -1.494 1.00 0.00 N ATOM 0 H LYS B 117 22.086 -7.289 -0.627 1.00 0.00 H new ATOM 0 HA LYS B 117 19.698 -8.744 -0.828 1.00 0.00 H new ATOM 0 HB2 LYS B 117 21.697 -8.316 1.280 1.00 0.00 H new ATOM 0 HB3 LYS B 117 20.089 -8.725 1.844 1.00 0.00 H new ATOM 0 HG2 LYS B 117 21.219 -10.814 1.549 1.00 0.00 H new ATOM 0 HG3 LYS B 117 20.110 -10.687 0.198 1.00 0.00 H new ATOM 0 HD2 LYS B 117 21.964 -9.867 -1.252 1.00 0.00 H new ATOM 0 HD3 LYS B 117 23.074 -9.979 0.099 1.00 0.00 H new ATOM 0 HE2 LYS B 117 23.403 -11.930 -1.257 1.00 0.00 H new ATOM 0 HE3 LYS B 117 22.613 -12.451 0.218 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 21.649 -13.480 -1.722 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 20.507 -12.492 -0.946 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 21.257 -11.963 -2.375 1.00 0.00 H new ATOM 1137 N ARG B 118 19.435 -5.816 0.789 1.00 0.00 N ATOM 1138 CA ARG B 118 18.399 -4.873 1.222 1.00 0.00 C ATOM 1139 C ARG B 118 17.573 -4.433 0.020 1.00 0.00 C ATOM 1140 O ARG B 118 16.363 -4.275 0.163 1.00 0.00 O ATOM 1141 CB ARG B 118 18.948 -3.626 1.922 1.00 0.00 C ATOM 1142 CG ARG B 118 19.643 -3.869 3.264 1.00 0.00 C ATOM 1143 CD ARG B 118 19.088 -2.916 4.334 1.00 0.00 C ATOM 1144 NE ARG B 118 19.309 -1.490 4.021 1.00 0.00 N ATOM 1145 CZ ARG B 118 18.394 -0.507 4.073 1.00 0.00 C ATOM 1146 NH1 ARG B 118 17.114 -0.771 4.325 1.00 0.00 N ATOM 1147 NH2 ARG B 118 18.737 0.758 3.857 1.00 0.00 N ATOM 0 H ARG B 118 20.396 -5.493 0.898 1.00 0.00 H new ATOM 0 HA ARG B 118 17.791 -5.408 1.952 1.00 0.00 H new ATOM 0 HB2 ARG B 118 19.655 -3.137 1.251 1.00 0.00 H new ATOM 0 HB3 ARG B 118 18.125 -2.929 2.081 1.00 0.00 H new ATOM 0 HG2 ARG B 118 19.494 -4.903 3.576 1.00 0.00 H new ATOM 0 HG3 ARG B 118 20.717 -3.720 3.157 1.00 0.00 H new ATOM 0 HD2 ARG B 118 18.019 -3.094 4.449 1.00 0.00 H new ATOM 0 HD3 ARG B 118 19.554 -3.146 5.292 1.00 0.00 H new ATOM 0 HE ARG B 118 20.252 -1.224 3.736 1.00 0.00 H new ATOM 0 HH11 ARG B 118 16.813 -1.733 4.483 1.00 0.00 H new ATOM 0 HH12 ARG B 118 16.434 -0.012 4.360 1.00 0.00 H new ATOM 0 HH21 ARG B 118 19.707 0.995 3.648 1.00 0.00 H new ATOM 0 HH22 ARG B 118 18.031 1.492 3.900 1.00 0.00 H new ATOM 1161 N LEU B 119 18.194 -4.215 -1.146 1.00 0.00 N ATOM 1162 CA LEU B 119 17.484 -3.788 -2.352 1.00 0.00 C ATOM 1163 C LEU B 119 16.418 -4.795 -2.738 1.00 0.00 C ATOM 1164 O LEU B 119 15.255 -4.421 -2.878 1.00 0.00 O ATOM 1165 CB LEU B 119 18.472 -3.654 -3.528 1.00 0.00 C ATOM 1166 CG LEU B 119 17.843 -3.478 -4.925 1.00 0.00 C ATOM 1167 CD1 LEU B 119 16.928 -2.255 -5.013 1.00 0.00 C ATOM 1168 CD2 LEU B 119 18.986 -3.399 -5.937 1.00 0.00 C ATOM 0 H LEU B 119 19.199 -4.330 -1.277 1.00 0.00 H new ATOM 0 HA LEU B 119 17.016 -2.827 -2.138 1.00 0.00 H new ATOM 0 HB2 LEU B 119 19.122 -2.801 -3.334 1.00 0.00 H new ATOM 0 HB3 LEU B 119 19.106 -4.540 -3.546 1.00 0.00 H new ATOM 0 HG LEU B 119 17.198 -4.330 -5.140 1.00 0.00 H new ATOM 0 HD11 LEU B 119 16.514 -2.182 -6.019 1.00 0.00 H new ATOM 0 HD12 LEU B 119 16.116 -2.355 -4.293 1.00 0.00 H new ATOM 0 HD13 LEU B 119 17.501 -1.355 -4.790 1.00 0.00 H new ATOM 0 HD21 LEU B 119 18.576 -3.274 -6.939 1.00 0.00 H new ATOM 0 HD22 LEU B 119 19.626 -2.549 -5.698 1.00 0.00 H new ATOM 0 HD23 LEU B 119 19.572 -4.317 -5.896 1.00 0.00 H new ATOM 1180 N LEU B 120 16.802 -6.065 -2.855 1.00 0.00 N ATOM 1181 CA LEU B 120 15.860 -7.093 -3.250 1.00 0.00 C ATOM 1182 C LEU B 120 14.813 -7.304 -2.165 1.00 0.00 C ATOM 1183 O LEU B 120 13.673 -7.591 -2.507 1.00 0.00 O ATOM 1184 CB LEU B 120 16.574 -8.393 -3.665 1.00 0.00 C ATOM 1185 CG LEU B 120 16.950 -9.337 -2.505 1.00 0.00 C ATOM 1186 CD1 LEU B 120 15.851 -10.361 -2.186 1.00 0.00 C ATOM 1187 CD2 LEU B 120 18.234 -10.100 -2.832 1.00 0.00 C ATOM 0 H LEU B 120 17.751 -6.398 -2.682 1.00 0.00 H new ATOM 0 HA LEU B 120 15.330 -6.753 -4.140 1.00 0.00 H new ATOM 0 HB2 LEU B 120 15.932 -8.935 -4.359 1.00 0.00 H new ATOM 0 HB3 LEU B 120 17.482 -8.132 -4.208 1.00 0.00 H new ATOM 0 HG LEU B 120 17.088 -8.699 -1.632 1.00 0.00 H new ATOM 0 HD11 LEU B 120 16.174 -10.997 -1.361 1.00 0.00 H new ATOM 0 HD12 LEU B 120 14.937 -9.838 -1.904 1.00 0.00 H new ATOM 0 HD13 LEU B 120 15.661 -10.976 -3.065 1.00 0.00 H new ATOM 0 HD21 LEU B 120 18.485 -10.762 -2.003 1.00 0.00 H new ATOM 0 HD22 LEU B 120 18.086 -10.691 -3.736 1.00 0.00 H new ATOM 0 HD23 LEU B 120 19.048 -9.392 -2.991 1.00 0.00 H new ATOM 1199 N ALA B 121 15.168 -7.144 -0.882 1.00 0.00 N ATOM 1200 CA ALA B 121 14.261 -7.303 0.248 1.00 0.00 C ATOM 1201 C ALA B 121 13.194 -6.214 0.229 1.00 0.00 C ATOM 1202 O ALA B 121 12.042 -6.474 0.571 1.00 0.00 O ATOM 1203 CB ALA B 121 15.036 -7.235 1.567 1.00 0.00 C ATOM 0 H ALA B 121 16.117 -6.895 -0.602 1.00 0.00 H new ATOM 0 HA ALA B 121 13.780 -8.278 0.165 1.00 0.00 H new ATOM 0 HB1 ALA B 121 14.345 -7.355 2.402 1.00 0.00 H new ATOM 0 HB2 ALA B 121 15.779 -8.032 1.594 1.00 0.00 H new ATOM 0 HB3 ALA B 121 15.536 -6.270 1.646 1.00 0.00 H new ATOM 1209 N LEU B 122 13.574 -4.996 -0.169 1.00 0.00 N ATOM 1210 CA LEU B 122 12.694 -3.842 -0.270 1.00 0.00 C ATOM 1211 C LEU B 122 11.563 -4.124 -1.262 1.00 0.00 C ATOM 1212 O LEU B 122 10.518 -3.476 -1.166 1.00 0.00 O ATOM 1213 CB LEU B 122 13.478 -2.574 -0.685 1.00 0.00 C ATOM 1214 CG LEU B 122 13.609 -1.448 0.351 1.00 0.00 C ATOM 1215 CD1 LEU B 122 12.249 -0.894 0.772 1.00 0.00 C ATOM 1216 CD2 LEU B 122 14.400 -1.881 1.582 1.00 0.00 C ATOM 0 H LEU B 122 14.535 -4.786 -0.437 1.00 0.00 H new ATOM 0 HA LEU B 122 12.261 -3.658 0.713 1.00 0.00 H new ATOM 0 HB2 LEU B 122 14.482 -2.881 -0.977 1.00 0.00 H new ATOM 0 HB3 LEU B 122 13.001 -2.160 -1.573 1.00 0.00 H new ATOM 0 HG LEU B 122 14.165 -0.652 -0.145 1.00 0.00 H new ATOM 0 HD11 LEU B 122 12.391 -0.100 1.505 1.00 0.00 H new ATOM 0 HD12 LEU B 122 11.733 -0.494 -0.101 1.00 0.00 H new ATOM 0 HD13 LEU B 122 11.651 -1.692 1.212 1.00 0.00 H new ATOM 0 HD21 LEU B 122 14.464 -1.050 2.284 1.00 0.00 H new ATOM 0 HD22 LEU B 122 13.897 -2.722 2.060 1.00 0.00 H new ATOM 0 HD23 LEU B 122 15.404 -2.181 1.282 1.00 0.00 H new ATOM 1228 N ASP B 123 11.778 -4.987 -2.266 1.00 0.00 N ATOM 1229 CA ASP B 123 10.758 -5.308 -3.265 1.00 0.00 C ATOM 1230 C ASP B 123 9.521 -5.961 -2.616 1.00 0.00 C ATOM 1231 O ASP B 123 8.479 -5.297 -2.595 1.00 0.00 O ATOM 1232 CB ASP B 123 11.349 -6.086 -4.461 1.00 0.00 C ATOM 1233 CG ASP B 123 12.344 -5.263 -5.289 1.00 0.00 C ATOM 1234 OD1 ASP B 123 12.041 -4.098 -5.654 1.00 0.00 O ATOM 1235 OD2 ASP B 123 13.486 -5.712 -5.505 1.00 0.00 O ATOM 0 H ASP B 123 12.661 -5.478 -2.405 1.00 0.00 H new ATOM 0 HA ASP B 123 10.393 -4.377 -3.698 1.00 0.00 H new ATOM 0 HB2 ASP B 123 11.848 -6.982 -4.092 1.00 0.00 H new ATOM 0 HB3 ASP B 123 10.536 -6.417 -5.107 1.00 0.00 H new ATOM 1240 N PRO B 124 9.595 -7.152 -1.978 1.00 0.00 N ATOM 1241 CA PRO B 124 8.433 -7.783 -1.364 1.00 0.00 C ATOM 1242 C PRO B 124 7.938 -7.025 -0.131 1.00 0.00 C ATOM 1243 O PRO B 124 6.789 -7.203 0.269 1.00 0.00 O ATOM 1244 CB PRO B 124 8.829 -9.224 -1.042 1.00 0.00 C ATOM 1245 CG PRO B 124 10.334 -9.123 -0.862 1.00 0.00 C ATOM 1246 CD PRO B 124 10.718 -8.063 -1.889 1.00 0.00 C ATOM 0 HA PRO B 124 7.587 -7.767 -2.052 1.00 0.00 H new ATOM 0 HB2 PRO B 124 8.337 -9.588 -0.140 1.00 0.00 H new ATOM 0 HB3 PRO B 124 8.562 -9.907 -1.848 1.00 0.00 H new ATOM 0 HG2 PRO B 124 10.602 -8.823 0.151 1.00 0.00 H new ATOM 0 HG3 PRO B 124 10.831 -10.074 -1.055 1.00 0.00 H new ATOM 0 HD2 PRO B 124 11.622 -7.536 -1.583 1.00 0.00 H new ATOM 0 HD3 PRO B 124 10.926 -8.518 -2.857 1.00 0.00 H new ATOM 1254 N MET B 125 8.775 -6.185 0.493 1.00 0.00 N ATOM 1255 CA MET B 125 8.364 -5.407 1.661 1.00 0.00 C ATOM 1256 C MET B 125 7.233 -4.466 1.240 1.00 0.00 C ATOM 1257 O MET B 125 6.301 -4.253 2.005 1.00 0.00 O ATOM 1258 CB MET B 125 9.548 -4.615 2.234 1.00 0.00 C ATOM 1259 CG MET B 125 10.569 -5.513 2.941 1.00 0.00 C ATOM 1260 SD MET B 125 10.310 -5.811 4.707 1.00 0.00 S ATOM 1261 CE MET B 125 10.784 -4.207 5.393 1.00 0.00 C ATOM 0 H MET B 125 9.741 -6.029 0.205 1.00 0.00 H new ATOM 0 HA MET B 125 8.013 -6.077 2.446 1.00 0.00 H new ATOM 0 HB2 MET B 125 10.043 -4.073 1.428 1.00 0.00 H new ATOM 0 HB3 MET B 125 9.176 -3.870 2.937 1.00 0.00 H new ATOM 0 HG2 MET B 125 10.583 -6.477 2.432 1.00 0.00 H new ATOM 0 HG3 MET B 125 11.557 -5.071 2.813 1.00 0.00 H new ATOM 0 HE1 MET B 125 10.764 -4.257 6.482 1.00 0.00 H new ATOM 0 HE2 MET B 125 11.790 -3.952 5.060 1.00 0.00 H new ATOM 0 HE3 MET B 125 10.084 -3.444 5.052 1.00 0.00 H new ATOM 1271 N MET B 126 7.363 -3.810 0.084 1.00 0.00 N ATOM 1272 CA MET B 126 6.335 -2.918 -0.436 1.00 0.00 C ATOM 1273 C MET B 126 5.179 -3.732 -1.020 1.00 0.00 C ATOM 1274 O MET B 126 4.017 -3.452 -0.742 1.00 0.00 O ATOM 1275 CB MET B 126 6.962 -1.971 -1.468 1.00 0.00 C ATOM 1276 CG MET B 126 5.945 -1.078 -2.190 1.00 0.00 C ATOM 1277 SD MET B 126 6.630 0.081 -3.404 1.00 0.00 S ATOM 1278 CE MET B 126 7.191 -1.101 -4.660 1.00 0.00 C ATOM 0 H MET B 126 8.186 -3.885 -0.514 1.00 0.00 H new ATOM 0 HA MET B 126 5.922 -2.310 0.368 1.00 0.00 H new ATOM 0 HB2 MET B 126 7.696 -1.339 -0.968 1.00 0.00 H new ATOM 0 HB3 MET B 126 7.502 -2.562 -2.208 1.00 0.00 H new ATOM 0 HG2 MET B 126 5.223 -1.719 -2.696 1.00 0.00 H new ATOM 0 HG3 MET B 126 5.396 -0.507 -1.441 1.00 0.00 H new ATOM 0 HE1 MET B 126 7.463 -0.564 -5.569 1.00 0.00 H new ATOM 0 HE2 MET B 126 8.058 -1.645 -4.286 1.00 0.00 H new ATOM 0 HE3 MET B 126 6.389 -1.805 -4.881 1.00 0.00 H new ATOM 1288 N GLU B 127 5.495 -4.738 -1.837 1.00 0.00 N ATOM 1289 CA GLU B 127 4.532 -5.596 -2.519 1.00 0.00 C ATOM 1290 C GLU B 127 3.502 -6.249 -1.601 1.00 0.00 C ATOM 1291 O GLU B 127 2.311 -6.141 -1.889 1.00 0.00 O ATOM 1292 CB GLU B 127 5.321 -6.646 -3.293 1.00 0.00 C ATOM 1293 CG GLU B 127 4.487 -7.490 -4.253 1.00 0.00 C ATOM 1294 CD GLU B 127 5.452 -8.205 -5.192 1.00 0.00 C ATOM 1295 OE1 GLU B 127 6.154 -9.147 -4.750 1.00 0.00 O ATOM 1296 OE2 GLU B 127 5.659 -7.688 -6.317 1.00 0.00 O ATOM 0 H GLU B 127 6.462 -4.984 -2.048 1.00 0.00 H new ATOM 0 HA GLU B 127 3.936 -4.970 -3.184 1.00 0.00 H new ATOM 0 HB2 GLU B 127 6.107 -6.146 -3.859 1.00 0.00 H new ATOM 0 HB3 GLU B 127 5.813 -7.309 -2.581 1.00 0.00 H new ATOM 0 HG2 GLU B 127 3.882 -8.211 -3.703 1.00 0.00 H new ATOM 0 HG3 GLU B 127 3.798 -6.861 -4.817 1.00 0.00 H new ATOM 1303 N GLN B 128 3.941 -6.904 -0.521 1.00 0.00 N ATOM 1304 CA GLN B 128 3.059 -7.577 0.429 1.00 0.00 C ATOM 1305 C GLN B 128 2.098 -6.588 1.078 1.00 0.00 C ATOM 1306 O GLN B 128 0.915 -6.874 1.261 1.00 0.00 O ATOM 1307 CB GLN B 128 3.919 -8.283 1.496 1.00 0.00 C ATOM 1308 CG GLN B 128 3.149 -8.909 2.677 1.00 0.00 C ATOM 1309 CD GLN B 128 2.997 -7.963 3.870 1.00 0.00 C ATOM 1310 OE1 GLN B 128 3.920 -7.758 4.660 1.00 0.00 O ATOM 1311 NE2 GLN B 128 1.836 -7.361 4.038 1.00 0.00 N ATOM 0 H GLN B 128 4.930 -6.981 -0.282 1.00 0.00 H new ATOM 0 HA GLN B 128 2.457 -8.315 -0.101 1.00 0.00 H new ATOM 0 HB2 GLN B 128 4.497 -9.068 1.008 1.00 0.00 H new ATOM 0 HB3 GLN B 128 4.633 -7.562 1.894 1.00 0.00 H new ATOM 0 HG2 GLN B 128 2.160 -9.214 2.336 1.00 0.00 H new ATOM 0 HG3 GLN B 128 3.667 -9.812 3.002 1.00 0.00 H new ATOM 0 HE21 GLN B 128 1.073 -7.532 3.383 1.00 0.00 H new ATOM 0 HE22 GLN B 128 1.701 -6.724 4.823 1.00 0.00 H new ATOM 1320 N GLU B 129 2.609 -5.424 1.459 1.00 0.00 N ATOM 1321 CA GLU B 129 1.804 -4.414 2.111 1.00 0.00 C ATOM 1322 C GLU B 129 0.776 -3.833 1.136 1.00 0.00 C ATOM 1323 O GLU B 129 -0.366 -3.608 1.534 1.00 0.00 O ATOM 1324 CB GLU B 129 2.716 -3.350 2.721 1.00 0.00 C ATOM 1325 CG GLU B 129 3.777 -3.901 3.695 1.00 0.00 C ATOM 1326 CD GLU B 129 3.257 -4.150 5.107 1.00 0.00 C ATOM 1327 OE1 GLU B 129 2.312 -4.943 5.307 1.00 0.00 O ATOM 1328 OE2 GLU B 129 3.843 -3.583 6.059 1.00 0.00 O ATOM 0 H GLU B 129 3.585 -5.160 1.324 1.00 0.00 H new ATOM 0 HA GLU B 129 1.234 -4.861 2.926 1.00 0.00 H new ATOM 0 HB2 GLU B 129 3.222 -2.818 1.915 1.00 0.00 H new ATOM 0 HB3 GLU B 129 2.101 -2.621 3.248 1.00 0.00 H new ATOM 0 HG2 GLU B 129 4.172 -4.835 3.295 1.00 0.00 H new ATOM 0 HG3 GLU B 129 4.609 -3.198 3.744 1.00 0.00 H new ATOM 1335 N ILE B 130 1.140 -3.614 -0.135 1.00 0.00 N ATOM 1336 CA ILE B 130 0.227 -3.077 -1.123 1.00 0.00 C ATOM 1337 C ILE B 130 -0.800 -4.141 -1.457 1.00 0.00 C ATOM 1338 O ILE B 130 -1.975 -3.790 -1.518 1.00 0.00 O ATOM 1339 CB ILE B 130 0.967 -2.519 -2.368 1.00 0.00 C ATOM 1340 CG1 ILE B 130 1.290 -1.024 -2.162 1.00 0.00 C ATOM 1341 CG2 ILE B 130 0.117 -2.616 -3.652 1.00 0.00 C ATOM 1342 CD1 ILE B 130 2.424 -0.738 -1.196 1.00 0.00 C ATOM 0 H ILE B 130 2.075 -3.807 -0.495 1.00 0.00 H new ATOM 0 HA ILE B 130 -0.294 -2.213 -0.711 1.00 0.00 H new ATOM 0 HB ILE B 130 1.869 -3.121 -2.482 1.00 0.00 H new ATOM 0 HG12 ILE B 130 1.537 -0.585 -3.129 1.00 0.00 H new ATOM 0 HG13 ILE B 130 0.392 -0.520 -1.804 1.00 0.00 H new ATOM 0 HG21 ILE B 130 0.681 -2.212 -4.493 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -0.129 -3.660 -3.848 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -0.802 -2.044 -3.524 1.00 0.00 H new ATOM 0 HD11 ILE B 130 2.574 0.339 -1.119 1.00 0.00 H new ATOM 0 HD12 ILE B 130 2.176 -1.141 -0.214 1.00 0.00 H new ATOM 0 HD13 ILE B 130 3.339 -1.206 -1.560 1.00 0.00 H new ATOM 1354 N GLU B 131 -0.414 -5.401 -1.704 1.00 0.00 N ATOM 1355 CA GLU B 131 -1.408 -6.419 -2.026 1.00 0.00 C ATOM 1356 C GLU B 131 -2.417 -6.515 -0.889 1.00 0.00 C ATOM 1357 O GLU B 131 -3.612 -6.655 -1.150 1.00 0.00 O ATOM 1358 CB GLU B 131 -0.809 -7.768 -2.443 1.00 0.00 C ATOM 1359 CG GLU B 131 -0.428 -8.755 -1.329 1.00 0.00 C ATOM 1360 CD GLU B 131 -0.029 -10.132 -1.873 1.00 0.00 C ATOM 1361 OE1 GLU B 131 -0.235 -10.387 -3.084 1.00 0.00 O ATOM 1362 OE2 GLU B 131 0.420 -10.979 -1.067 1.00 0.00 O ATOM 0 H GLU B 131 0.552 -5.728 -1.687 1.00 0.00 H new ATOM 0 HA GLU B 131 -1.937 -6.103 -2.925 1.00 0.00 H new ATOM 0 HB2 GLU B 131 -1.524 -8.264 -3.100 1.00 0.00 H new ATOM 0 HB3 GLU B 131 0.084 -7.570 -3.035 1.00 0.00 H new ATOM 0 HG2 GLU B 131 0.399 -8.343 -0.751 1.00 0.00 H new ATOM 0 HG3 GLU B 131 -1.269 -8.868 -0.645 1.00 0.00 H new ATOM 1369 N GLU B 132 -1.949 -6.363 0.353 1.00 0.00 N ATOM 1370 CA GLU B 132 -2.813 -6.393 1.507 1.00 0.00 C ATOM 1371 C GLU B 132 -3.736 -5.174 1.415 1.00 0.00 C ATOM 1372 O GLU B 132 -4.934 -5.347 1.567 1.00 0.00 O ATOM 1373 CB GLU B 132 -2.005 -6.441 2.810 1.00 0.00 C ATOM 1374 CG GLU B 132 -2.937 -6.639 4.012 1.00 0.00 C ATOM 1375 CD GLU B 132 -2.168 -6.591 5.327 1.00 0.00 C ATOM 1376 OE1 GLU B 132 -1.857 -5.471 5.802 1.00 0.00 O ATOM 1377 OE2 GLU B 132 -1.926 -7.651 5.943 1.00 0.00 O ATOM 0 H GLU B 132 -0.964 -6.217 0.573 1.00 0.00 H new ATOM 0 HA GLU B 132 -3.417 -7.300 1.520 1.00 0.00 H new ATOM 0 HB2 GLU B 132 -1.281 -7.254 2.766 1.00 0.00 H new ATOM 0 HB3 GLU B 132 -1.440 -5.517 2.929 1.00 0.00 H new ATOM 0 HG2 GLU B 132 -3.705 -5.866 4.010 1.00 0.00 H new ATOM 0 HG3 GLU B 132 -3.449 -7.597 3.923 1.00 0.00 H new ATOM 1384 N ILE B 133 -3.260 -3.951 1.128 1.00 0.00 N ATOM 1385 CA ILE B 133 -4.128 -2.775 1.030 1.00 0.00 C ATOM 1386 C ILE B 133 -5.202 -3.014 -0.030 1.00 0.00 C ATOM 1387 O ILE B 133 -6.383 -2.725 0.178 1.00 0.00 O ATOM 1388 CB ILE B 133 -3.291 -1.509 0.693 1.00 0.00 C ATOM 1389 CG1 ILE B 133 -2.439 -1.080 1.899 1.00 0.00 C ATOM 1390 CG2 ILE B 133 -4.155 -0.306 0.277 1.00 0.00 C ATOM 1391 CD1 ILE B 133 -1.313 -0.118 1.532 1.00 0.00 C ATOM 0 H ILE B 133 -2.273 -3.755 0.960 1.00 0.00 H new ATOM 0 HA ILE B 133 -4.615 -2.610 1.991 1.00 0.00 H new ATOM 0 HB ILE B 133 -2.661 -1.794 -0.150 1.00 0.00 H new ATOM 0 HG12 ILE B 133 -3.083 -0.608 2.640 1.00 0.00 H new ATOM 0 HG13 ILE B 133 -2.012 -1.967 2.367 1.00 0.00 H new ATOM 0 HG21 ILE B 133 -3.511 0.545 0.055 1.00 0.00 H new ATOM 0 HG22 ILE B 133 -4.734 -0.563 -0.610 1.00 0.00 H new ATOM 0 HG23 ILE B 133 -4.833 -0.046 1.090 1.00 0.00 H new ATOM 0 HD11 ILE B 133 -0.752 0.144 2.429 1.00 0.00 H new ATOM 0 HD12 ILE B 133 -0.647 -0.595 0.813 1.00 0.00 H new ATOM 0 HD13 ILE B 133 -1.735 0.785 1.091 1.00 0.00 H new ATOM 1403 N ARG B 134 -4.798 -3.525 -1.189 1.00 0.00 N ATOM 1404 CA ARG B 134 -5.709 -3.770 -2.287 1.00 0.00 C ATOM 1405 C ARG B 134 -6.754 -4.793 -1.882 1.00 0.00 C ATOM 1406 O ARG B 134 -7.941 -4.521 -2.052 1.00 0.00 O ATOM 1407 CB ARG B 134 -4.913 -4.183 -3.532 1.00 0.00 C ATOM 1408 CG ARG B 134 -3.856 -3.115 -3.896 1.00 0.00 C ATOM 1409 CD ARG B 134 -3.810 -2.771 -5.376 1.00 0.00 C ATOM 1410 NE ARG B 134 -5.095 -2.298 -5.916 1.00 0.00 N ATOM 1411 CZ ARG B 134 -5.568 -1.050 -5.996 1.00 0.00 C ATOM 1412 NH1 ARG B 134 -4.901 -0.016 -5.499 1.00 0.00 N ATOM 1413 NH2 ARG B 134 -6.741 -0.823 -6.567 1.00 0.00 N ATOM 0 H ARG B 134 -3.830 -3.778 -1.387 1.00 0.00 H new ATOM 0 HA ARG B 134 -6.250 -2.858 -2.539 1.00 0.00 H new ATOM 0 HB2 ARG B 134 -4.422 -5.139 -3.353 1.00 0.00 H new ATOM 0 HB3 ARG B 134 -5.593 -4.327 -4.371 1.00 0.00 H new ATOM 0 HG2 ARG B 134 -4.061 -2.207 -3.329 1.00 0.00 H new ATOM 0 HG3 ARG B 134 -2.873 -3.470 -3.585 1.00 0.00 H new ATOM 0 HD2 ARG B 134 -3.054 -2.003 -5.538 1.00 0.00 H new ATOM 0 HD3 ARG B 134 -3.494 -3.652 -5.935 1.00 0.00 H new ATOM 0 HE ARG B 134 -5.711 -3.024 -6.280 1.00 0.00 H new ATOM 0 HH11 ARG B 134 -4.002 -0.162 -5.041 1.00 0.00 H new ATOM 0 HH12 ARG B 134 -5.288 0.925 -5.575 1.00 0.00 H new ATOM 0 HH21 ARG B 134 -7.283 -1.600 -6.945 1.00 0.00 H new ATOM 0 HH22 ARG B 134 -7.103 0.129 -6.628 1.00 0.00 H new ATOM 1427 N GLN B 135 -6.356 -5.914 -1.293 1.00 0.00 N ATOM 1428 CA GLN B 135 -7.309 -6.940 -0.874 1.00 0.00 C ATOM 1429 C GLN B 135 -8.204 -6.465 0.268 1.00 0.00 C ATOM 1430 O GLN B 135 -9.427 -6.579 0.179 1.00 0.00 O ATOM 1431 CB GLN B 135 -6.585 -8.215 -0.446 1.00 0.00 C ATOM 1432 CG GLN B 135 -6.086 -8.995 -1.661 1.00 0.00 C ATOM 1433 CD GLN B 135 -7.219 -9.540 -2.541 1.00 0.00 C ATOM 1434 OE1 GLN B 135 -8.196 -10.135 -2.075 1.00 0.00 O ATOM 1435 NE2 GLN B 135 -7.159 -9.285 -3.836 1.00 0.00 N ATOM 0 H GLN B 135 -5.381 -6.138 -1.094 1.00 0.00 H new ATOM 0 HA GLN B 135 -7.939 -7.148 -1.739 1.00 0.00 H new ATOM 0 HB2 GLN B 135 -5.743 -7.961 0.198 1.00 0.00 H new ATOM 0 HB3 GLN B 135 -7.258 -8.840 0.141 1.00 0.00 H new ATOM 0 HG2 GLN B 135 -5.448 -8.348 -2.262 1.00 0.00 H new ATOM 0 HG3 GLN B 135 -5.468 -9.826 -1.321 1.00 0.00 H new ATOM 0 HE21 GLN B 135 -6.353 -8.794 -4.222 1.00 0.00 H new ATOM 0 HE22 GLN B 135 -7.919 -9.579 -4.449 1.00 0.00 H new ATOM 1444 N LYS B 136 -7.608 -5.900 1.317 1.00 0.00 N ATOM 1445 CA LYS B 136 -8.303 -5.415 2.507 1.00 0.00 C ATOM 1446 C LYS B 136 -9.412 -4.452 2.131 1.00 0.00 C ATOM 1447 O LYS B 136 -10.564 -4.621 2.541 1.00 0.00 O ATOM 1448 CB LYS B 136 -7.298 -4.864 3.549 1.00 0.00 C ATOM 1449 CG LYS B 136 -6.993 -3.356 3.580 1.00 0.00 C ATOM 1450 CD LYS B 136 -5.760 -3.091 4.454 1.00 0.00 C ATOM 1451 CE LYS B 136 -5.410 -1.596 4.509 1.00 0.00 C ATOM 1452 NZ LYS B 136 -4.223 -1.332 5.349 1.00 0.00 N ATOM 0 H LYS B 136 -6.598 -5.763 1.363 1.00 0.00 H new ATOM 0 HA LYS B 136 -8.801 -6.250 3.001 1.00 0.00 H new ATOM 0 HB2 LYS B 136 -7.664 -5.144 4.537 1.00 0.00 H new ATOM 0 HB3 LYS B 136 -6.353 -5.386 3.400 1.00 0.00 H new ATOM 0 HG2 LYS B 136 -6.818 -2.991 2.568 1.00 0.00 H new ATOM 0 HG3 LYS B 136 -7.851 -2.810 3.972 1.00 0.00 H new ATOM 0 HD2 LYS B 136 -5.944 -3.458 5.463 1.00 0.00 H new ATOM 0 HD3 LYS B 136 -4.910 -3.649 4.062 1.00 0.00 H new ATOM 0 HE2 LYS B 136 -5.227 -1.230 3.499 1.00 0.00 H new ATOM 0 HE3 LYS B 136 -6.261 -1.039 4.900 1.00 0.00 H new ATOM 0 HZ1 LYS B 136 -4.074 -0.306 5.426 1.00 0.00 H new ATOM 0 HZ2 LYS B 136 -4.373 -1.733 6.297 1.00 0.00 H new ATOM 0 HZ3 LYS B 136 -3.386 -1.772 4.915 1.00 0.00 H new ATOM 1466 N TYR B 137 -9.085 -3.439 1.337 1.00 0.00 N ATOM 1467 CA TYR B 137 -10.065 -2.469 0.916 1.00 0.00 C ATOM 1468 C TYR B 137 -11.005 -3.036 -0.140 1.00 0.00 C ATOM 1469 O TYR B 137 -12.183 -2.692 -0.089 1.00 0.00 O ATOM 1470 CB TYR B 137 -9.372 -1.185 0.498 1.00 0.00 C ATOM 1471 CG TYR B 137 -8.809 -0.384 1.667 1.00 0.00 C ATOM 1472 CD1 TYR B 137 -9.630 0.045 2.730 1.00 0.00 C ATOM 1473 CD2 TYR B 137 -7.455 -0.018 1.669 1.00 0.00 C ATOM 1474 CE1 TYR B 137 -9.109 0.869 3.741 1.00 0.00 C ATOM 1475 CE2 TYR B 137 -6.930 0.813 2.673 1.00 0.00 C ATOM 1476 CZ TYR B 137 -7.762 1.277 3.710 1.00 0.00 C ATOM 1477 OH TYR B 137 -7.304 2.112 4.681 1.00 0.00 O ATOM 0 H TYR B 137 -8.145 -3.276 0.976 1.00 0.00 H new ATOM 0 HA TYR B 137 -10.711 -2.221 1.758 1.00 0.00 H new ATOM 0 HB2 TYR B 137 -8.561 -1.427 -0.189 1.00 0.00 H new ATOM 0 HB3 TYR B 137 -10.079 -0.563 -0.050 1.00 0.00 H new ATOM 0 HD1 TYR B 137 -10.665 -0.262 2.767 1.00 0.00 H new ATOM 0 HD2 TYR B 137 -6.805 -0.381 0.886 1.00 0.00 H new ATOM 0 HE1 TYR B 137 -9.748 1.193 4.550 1.00 0.00 H new ATOM 0 HE2 TYR B 137 -5.888 1.096 2.649 1.00 0.00 H new ATOM 0 HH TYR B 137 -6.378 1.879 4.903 1.00 0.00 H new ATOM 1487 N GLN B 138 -10.563 -3.920 -1.046 1.00 0.00 N ATOM 1488 CA GLN B 138 -11.462 -4.487 -2.051 1.00 0.00 C ATOM 1489 C GLN B 138 -12.545 -5.289 -1.341 1.00 0.00 C ATOM 1490 O GLN B 138 -13.710 -5.150 -1.688 1.00 0.00 O ATOM 1491 CB GLN B 138 -10.718 -5.359 -3.077 1.00 0.00 C ATOM 1492 CG GLN B 138 -11.627 -6.104 -4.071 1.00 0.00 C ATOM 1493 CD GLN B 138 -12.558 -5.194 -4.883 1.00 0.00 C ATOM 1494 OE1 GLN B 138 -12.233 -4.055 -5.201 1.00 0.00 O ATOM 1495 NE2 GLN B 138 -13.748 -5.643 -5.247 1.00 0.00 N ATOM 0 H GLN B 138 -9.600 -4.252 -1.101 1.00 0.00 H new ATOM 0 HA GLN B 138 -11.911 -3.669 -2.615 1.00 0.00 H new ATOM 0 HB2 GLN B 138 -10.030 -4.727 -3.639 1.00 0.00 H new ATOM 0 HB3 GLN B 138 -10.113 -6.090 -2.541 1.00 0.00 H new ATOM 0 HG2 GLN B 138 -11.002 -6.672 -4.760 1.00 0.00 H new ATOM 0 HG3 GLN B 138 -12.232 -6.825 -3.521 1.00 0.00 H new ATOM 0 HE21 GLN B 138 -14.037 -6.588 -4.992 1.00 0.00 H new ATOM 0 HE22 GLN B 138 -14.377 -5.045 -5.783 1.00 0.00 H new ATOM 1504 N SER B 139 -12.197 -6.087 -0.331 1.00 0.00 N ATOM 1505 CA SER B 139 -13.148 -6.879 0.442 1.00 0.00 C ATOM 1506 C SER B 139 -14.207 -5.939 1.014 1.00 0.00 C ATOM 1507 O SER B 139 -15.393 -6.240 0.944 1.00 0.00 O ATOM 1508 CB SER B 139 -12.353 -7.648 1.507 1.00 0.00 C ATOM 1509 OG SER B 139 -13.179 -8.240 2.481 1.00 0.00 O ATOM 0 H SER B 139 -11.231 -6.201 -0.024 1.00 0.00 H new ATOM 0 HA SER B 139 -13.681 -7.615 -0.160 1.00 0.00 H new ATOM 0 HB2 SER B 139 -11.759 -8.422 1.022 1.00 0.00 H new ATOM 0 HB3 SER B 139 -11.654 -6.968 1.994 1.00 0.00 H new ATOM 0 HG SER B 139 -12.625 -8.718 3.133 1.00 0.00 H new ATOM 1515 N LYS B 140 -13.806 -4.768 1.516 1.00 0.00 N ATOM 1516 CA LYS B 140 -14.743 -3.795 2.065 1.00 0.00 C ATOM 1517 C LYS B 140 -15.518 -3.081 0.939 1.00 0.00 C ATOM 1518 O LYS B 140 -16.671 -2.698 1.139 1.00 0.00 O ATOM 1519 CB LYS B 140 -13.988 -2.842 3.014 1.00 0.00 C ATOM 1520 CG LYS B 140 -13.440 -3.559 4.262 1.00 0.00 C ATOM 1521 CD LYS B 140 -12.660 -2.636 5.211 1.00 0.00 C ATOM 1522 CE LYS B 140 -11.172 -2.528 4.846 1.00 0.00 C ATOM 1523 NZ LYS B 140 -10.470 -1.534 5.688 1.00 0.00 N ATOM 0 H LYS B 140 -12.830 -4.473 1.552 1.00 0.00 H new ATOM 0 HA LYS B 140 -15.506 -4.296 2.661 1.00 0.00 H new ATOM 0 HB2 LYS B 140 -13.162 -2.377 2.475 1.00 0.00 H new ATOM 0 HB3 LYS B 140 -14.657 -2.040 3.325 1.00 0.00 H new ATOM 0 HG2 LYS B 140 -14.271 -4.007 4.807 1.00 0.00 H new ATOM 0 HG3 LYS B 140 -12.789 -4.374 3.946 1.00 0.00 H new ATOM 0 HD2 LYS B 140 -13.107 -1.642 5.193 1.00 0.00 H new ATOM 0 HD3 LYS B 140 -12.753 -3.009 6.231 1.00 0.00 H new ATOM 0 HE2 LYS B 140 -10.698 -3.502 4.962 1.00 0.00 H new ATOM 0 HE3 LYS B 140 -11.074 -2.249 3.797 1.00 0.00 H new ATOM 0 HZ1 LYS B 140 -10.041 -0.806 5.081 1.00 0.00 H new ATOM 0 HZ2 LYS B 140 -11.149 -1.087 6.337 1.00 0.00 H new ATOM 0 HZ3 LYS B 140 -9.726 -2.009 6.238 1.00 0.00 H new ATOM 1537 N ARG B 141 -14.938 -2.878 -0.250 1.00 0.00 N ATOM 1538 CA ARG B 141 -15.554 -2.224 -1.411 1.00 0.00 C ATOM 1539 C ARG B 141 -16.578 -3.131 -2.084 1.00 0.00 C ATOM 1540 O ARG B 141 -17.608 -2.652 -2.539 1.00 0.00 O ATOM 1541 CB ARG B 141 -14.465 -1.826 -2.427 1.00 0.00 C ATOM 1542 CG ARG B 141 -15.017 -0.962 -3.576 1.00 0.00 C ATOM 1543 CD ARG B 141 -13.948 -0.607 -4.615 1.00 0.00 C ATOM 1544 NE ARG B 141 -13.001 0.420 -4.133 1.00 0.00 N ATOM 1545 CZ ARG B 141 -12.661 1.549 -4.777 1.00 0.00 C ATOM 1546 NH1 ARG B 141 -13.145 1.820 -5.980 1.00 0.00 N ATOM 1547 NH2 ARG B 141 -11.830 2.416 -4.213 1.00 0.00 N ATOM 0 H ARG B 141 -13.982 -3.179 -0.438 1.00 0.00 H new ATOM 0 HA ARG B 141 -16.072 -1.332 -1.058 1.00 0.00 H new ATOM 0 HB2 ARG B 141 -13.675 -1.279 -1.912 1.00 0.00 H new ATOM 0 HB3 ARG B 141 -14.011 -2.727 -2.840 1.00 0.00 H new ATOM 0 HG2 ARG B 141 -15.832 -1.495 -4.066 1.00 0.00 H new ATOM 0 HG3 ARG B 141 -15.438 -0.044 -3.165 1.00 0.00 H new ATOM 0 HD2 ARG B 141 -13.395 -1.507 -4.883 1.00 0.00 H new ATOM 0 HD3 ARG B 141 -14.434 -0.249 -5.523 1.00 0.00 H new ATOM 0 HE ARG B 141 -12.564 0.256 -3.226 1.00 0.00 H new ATOM 0 HH11 ARG B 141 -13.786 1.167 -6.431 1.00 0.00 H new ATOM 0 HH12 ARG B 141 -12.877 2.682 -6.455 1.00 0.00 H new ATOM 0 HH21 ARG B 141 -11.447 2.227 -3.287 1.00 0.00 H new ATOM 0 HH22 ARG B 141 -11.574 3.272 -4.705 1.00 0.00 H new ATOM 1561 N GLN B 142 -16.319 -4.428 -2.137 1.00 0.00 N ATOM 1562 CA GLN B 142 -17.164 -5.438 -2.747 1.00 0.00 C ATOM 1563 C GLN B 142 -18.638 -5.312 -2.328 1.00 0.00 C ATOM 1564 O GLN B 142 -19.465 -5.116 -3.210 1.00 0.00 O ATOM 1565 CB GLN B 142 -16.554 -6.834 -2.541 1.00 0.00 C ATOM 1566 CG GLN B 142 -17.212 -7.867 -3.458 1.00 0.00 C ATOM 1567 CD GLN B 142 -16.961 -7.547 -4.928 1.00 0.00 C ATOM 1568 OE1 GLN B 142 -15.834 -7.647 -5.409 1.00 0.00 O ATOM 1569 NE2 GLN B 142 -17.959 -7.057 -5.645 1.00 0.00 N ATOM 0 H GLN B 142 -15.469 -4.823 -1.734 1.00 0.00 H new ATOM 0 HA GLN B 142 -17.191 -5.269 -3.823 1.00 0.00 H new ATOM 0 HB2 GLN B 142 -15.483 -6.798 -2.739 1.00 0.00 H new ATOM 0 HB3 GLN B 142 -16.676 -7.137 -1.501 1.00 0.00 H new ATOM 0 HG2 GLN B 142 -16.823 -8.859 -3.229 1.00 0.00 H new ATOM 0 HG3 GLN B 142 -18.285 -7.893 -3.268 1.00 0.00 H new ATOM 0 HE21 GLN B 142 -18.890 -6.978 -5.236 1.00 0.00 H new ATOM 0 HE22 GLN B 142 -17.797 -6.758 -6.607 1.00 0.00 H new ATOM 1578 N PRO B 143 -19.009 -5.324 -1.037 1.00 0.00 N ATOM 1579 CA PRO B 143 -20.400 -5.192 -0.623 1.00 0.00 C ATOM 1580 C PRO B 143 -21.007 -3.833 -0.998 1.00 0.00 C ATOM 1581 O PRO B 143 -22.232 -3.731 -1.002 1.00 0.00 O ATOM 1582 CB PRO B 143 -20.417 -5.422 0.893 1.00 0.00 C ATOM 1583 CG PRO B 143 -18.987 -5.085 1.301 1.00 0.00 C ATOM 1584 CD PRO B 143 -18.171 -5.550 0.118 1.00 0.00 C ATOM 0 HA PRO B 143 -21.020 -5.922 -1.144 1.00 0.00 H new ATOM 0 HB2 PRO B 143 -21.142 -4.779 1.392 1.00 0.00 H new ATOM 0 HB3 PRO B 143 -20.678 -6.450 1.143 1.00 0.00 H new ATOM 0 HG2 PRO B 143 -18.861 -4.018 1.482 1.00 0.00 H new ATOM 0 HG3 PRO B 143 -18.698 -5.600 2.217 1.00 0.00 H new ATOM 0 HD2 PRO B 143 -17.237 -4.993 0.041 1.00 0.00 H new ATOM 0 HD3 PRO B 143 -17.907 -6.603 0.212 1.00 0.00 H new ATOM 1592 N ILE B 144 -20.200 -2.786 -1.219 1.00 0.00 N ATOM 1593 CA ILE B 144 -20.665 -1.455 -1.608 1.00 0.00 C ATOM 1594 C ILE B 144 -21.074 -1.534 -3.075 1.00 0.00 C ATOM 1595 O ILE B 144 -22.217 -1.213 -3.403 1.00 0.00 O ATOM 1596 CB ILE B 144 -19.576 -0.374 -1.372 1.00 0.00 C ATOM 1597 CG1 ILE B 144 -19.194 -0.263 0.116 1.00 0.00 C ATOM 1598 CG2 ILE B 144 -20.074 1.006 -1.827 1.00 0.00 C ATOM 1599 CD1 ILE B 144 -17.956 0.596 0.367 1.00 0.00 C ATOM 0 H ILE B 144 -19.186 -2.846 -1.129 1.00 0.00 H new ATOM 0 HA ILE B 144 -21.514 -1.155 -0.993 1.00 0.00 H new ATOM 0 HB ILE B 144 -18.705 -0.681 -1.952 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -20.035 0.156 0.668 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -19.019 -1.263 0.513 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -19.296 1.749 -1.653 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -20.314 0.974 -2.890 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -20.966 1.275 -1.262 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -17.747 0.629 1.436 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -17.102 0.166 -0.157 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -18.134 1.607 0.001 1.00 0.00 H new ATOM 1611 N LEU B 145 -20.166 -2.008 -3.932 1.00 0.00 N ATOM 1612 CA LEU B 145 -20.435 -2.125 -5.358 1.00 0.00 C ATOM 1613 C LEU B 145 -21.592 -3.085 -5.568 1.00 0.00 C ATOM 1614 O LEU B 145 -22.498 -2.808 -6.342 1.00 0.00 O ATOM 1615 CB LEU B 145 -19.153 -2.422 -6.161 1.00 0.00 C ATOM 1616 CG LEU B 145 -18.725 -3.873 -6.373 1.00 0.00 C ATOM 1617 CD1 LEU B 145 -19.389 -4.484 -7.613 1.00 0.00 C ATOM 1618 CD2 LEU B 145 -17.197 -3.912 -6.536 1.00 0.00 C ATOM 0 H LEU B 145 -19.234 -2.317 -3.656 1.00 0.00 H new ATOM 0 HA LEU B 145 -20.761 -1.170 -5.769 1.00 0.00 H new ATOM 0 HB2 LEU B 145 -19.270 -1.967 -7.145 1.00 0.00 H new ATOM 0 HB3 LEU B 145 -18.330 -1.906 -5.667 1.00 0.00 H new ATOM 0 HG LEU B 145 -19.038 -4.459 -5.509 1.00 0.00 H new ATOM 0 HD11 LEU B 145 -19.060 -5.516 -7.730 1.00 0.00 H new ATOM 0 HD12 LEU B 145 -20.472 -4.460 -7.495 1.00 0.00 H new ATOM 0 HD13 LEU B 145 -19.107 -3.911 -8.496 1.00 0.00 H new ATOM 0 HD21 LEU B 145 -16.874 -4.942 -6.688 1.00 0.00 H new ATOM 0 HD22 LEU B 145 -16.907 -3.309 -7.397 1.00 0.00 H new ATOM 0 HD23 LEU B 145 -16.725 -3.513 -5.638 1.00 0.00 H new ATOM 1630 N ASP B 146 -21.619 -4.176 -4.811 1.00 0.00 N ATOM 1631 CA ASP B 146 -22.680 -5.163 -4.921 1.00 0.00 C ATOM 1632 C ASP B 146 -24.033 -4.580 -4.484 1.00 0.00 C ATOM 1633 O ASP B 146 -25.085 -5.050 -4.913 1.00 0.00 O ATOM 1634 CB ASP B 146 -22.294 -6.391 -4.101 1.00 0.00 C ATOM 1635 CG ASP B 146 -23.144 -7.572 -4.528 1.00 0.00 C ATOM 1636 OD1 ASP B 146 -22.781 -8.197 -5.543 1.00 0.00 O ATOM 1637 OD2 ASP B 146 -24.162 -7.857 -3.861 1.00 0.00 O ATOM 0 H ASP B 146 -20.912 -4.398 -4.110 1.00 0.00 H new ATOM 0 HA ASP B 146 -22.799 -5.458 -5.964 1.00 0.00 H new ATOM 0 HB2 ASP B 146 -21.238 -6.619 -4.243 1.00 0.00 H new ATOM 0 HB3 ASP B 146 -22.437 -6.192 -3.039 1.00 0.00 H new ATOM 1642 N ALA B 147 -24.026 -3.575 -3.598 1.00 0.00 N ATOM 1643 CA ALA B 147 -25.226 -2.924 -3.095 1.00 0.00 C ATOM 1644 C ALA B 147 -25.796 -1.892 -4.071 1.00 0.00 C ATOM 1645 O ALA B 147 -27.017 -1.840 -4.191 1.00 0.00 O ATOM 1646 CB ALA B 147 -24.961 -2.298 -1.727 1.00 0.00 C ATOM 0 H ALA B 147 -23.166 -3.190 -3.208 1.00 0.00 H new ATOM 0 HA ALA B 147 -25.986 -3.698 -2.988 1.00 0.00 H new ATOM 0 HB1 ALA B 147 -25.869 -1.815 -1.366 1.00 0.00 H new ATOM 0 HB2 ALA B 147 -24.658 -3.074 -1.024 1.00 0.00 H new ATOM 0 HB3 ALA B 147 -24.166 -1.557 -1.814 1.00 0.00 H new ATOM 1652 N ILE B 148 -24.987 -1.060 -4.743 1.00 0.00 N ATOM 1653 CA ILE B 148 -25.546 -0.085 -5.696 1.00 0.00 C ATOM 1654 C ILE B 148 -26.151 -0.801 -6.898 1.00 0.00 C ATOM 1655 O ILE B 148 -27.165 -0.356 -7.421 1.00 0.00 O ATOM 1656 CB ILE B 148 -24.518 0.978 -6.128 1.00 0.00 C ATOM 1657 CG1 ILE B 148 -25.160 2.104 -6.961 1.00 0.00 C ATOM 1658 CG2 ILE B 148 -23.270 0.393 -6.795 1.00 0.00 C ATOM 1659 CD1 ILE B 148 -24.341 3.402 -6.908 1.00 0.00 C ATOM 0 H ILE B 148 -23.971 -1.039 -4.651 1.00 0.00 H new ATOM 0 HA ILE B 148 -26.340 0.455 -5.180 1.00 0.00 H new ATOM 0 HB ILE B 148 -24.161 1.431 -5.203 1.00 0.00 H new ATOM 0 HG12 ILE B 148 -25.256 1.778 -7.997 1.00 0.00 H new ATOM 0 HG13 ILE B 148 -26.168 2.297 -6.593 1.00 0.00 H new ATOM 0 HG21 ILE B 148 -22.593 1.201 -7.072 1.00 0.00 H new ATOM 0 HG22 ILE B 148 -22.768 -0.280 -6.100 1.00 0.00 H new ATOM 0 HG23 ILE B 148 -23.560 -0.159 -7.689 1.00 0.00 H new ATOM 0 HD11 ILE B 148 -24.832 4.167 -7.510 1.00 0.00 H new ATOM 0 HD12 ILE B 148 -24.268 3.744 -5.876 1.00 0.00 H new ATOM 0 HD13 ILE B 148 -23.341 3.218 -7.301 1.00 0.00 H new ATOM 1671 N GLU B 149 -25.561 -1.923 -7.311 1.00 0.00 N ATOM 1672 CA GLU B 149 -26.054 -2.695 -8.442 1.00 0.00 C ATOM 1673 C GLU B 149 -27.414 -3.325 -8.106 1.00 0.00 C ATOM 1674 O GLU B 149 -28.081 -3.874 -8.978 1.00 0.00 O ATOM 1675 CB GLU B 149 -25.019 -3.745 -8.857 1.00 0.00 C ATOM 1676 CG GLU B 149 -23.705 -3.113 -9.346 1.00 0.00 C ATOM 1677 CD GLU B 149 -23.818 -2.220 -10.578 1.00 0.00 C ATOM 1678 OE1 GLU B 149 -24.588 -2.551 -11.508 1.00 0.00 O ATOM 1679 OE2 GLU B 149 -23.024 -1.246 -10.666 1.00 0.00 O ATOM 0 H GLU B 149 -24.731 -2.318 -6.870 1.00 0.00 H new ATOM 0 HA GLU B 149 -26.206 -2.031 -9.293 1.00 0.00 H new ATOM 0 HB2 GLU B 149 -24.811 -4.400 -8.011 1.00 0.00 H new ATOM 0 HB3 GLU B 149 -25.435 -4.369 -9.648 1.00 0.00 H new ATOM 0 HG2 GLU B 149 -23.281 -2.525 -8.532 1.00 0.00 H new ATOM 0 HG3 GLU B 149 -22.997 -3.913 -9.564 1.00 0.00 H new ATOM 1686 N ALA B 150 -27.798 -3.328 -6.825 1.00 0.00 N ATOM 1687 CA ALA B 150 -29.062 -3.849 -6.337 1.00 0.00 C ATOM 1688 C ALA B 150 -30.176 -2.788 -6.423 1.00 0.00 C ATOM 1689 O ALA B 150 -31.249 -3.002 -5.854 1.00 0.00 O ATOM 1690 CB ALA B 150 -28.883 -4.366 -4.907 1.00 0.00 C ATOM 0 H ALA B 150 -27.211 -2.953 -6.080 1.00 0.00 H new ATOM 0 HA ALA B 150 -29.372 -4.680 -6.971 1.00 0.00 H new ATOM 0 HB1 ALA B 150 -29.832 -4.757 -4.540 1.00 0.00 H new ATOM 0 HB2 ALA B 150 -28.135 -5.159 -4.898 1.00 0.00 H new ATOM 0 HB3 ALA B 150 -28.554 -3.550 -4.264 1.00 0.00 H new ATOM 1696 N LYS B 151 -29.927 -1.630 -7.054 1.00 0.00 N ATOM 1697 CA LYS B 151 -30.886 -0.550 -7.223 1.00 0.00 C ATOM 1698 C LYS B 151 -30.953 -0.282 -8.714 1.00 0.00 C ATOM 1699 O LYS B 151 -31.989 -0.605 -9.323 1.00 0.00 O ATOM 1700 CB LYS B 151 -30.472 0.697 -6.421 1.00 0.00 C ATOM 1701 CG LYS B 151 -30.013 0.366 -4.990 1.00 0.00 C ATOM 1702 CD LYS B 151 -30.018 1.593 -4.069 1.00 0.00 C ATOM 1703 CE LYS B 151 -31.151 1.490 -3.036 1.00 0.00 C ATOM 1704 NZ LYS B 151 -30.789 0.625 -1.891 1.00 0.00 N ATOM 0 H LYS B 151 -29.020 -1.422 -7.471 1.00 0.00 H new ATOM 0 HA LYS B 151 -31.869 -0.821 -6.838 1.00 0.00 H new ATOM 0 HB2 LYS B 151 -29.666 1.209 -6.946 1.00 0.00 H new ATOM 0 HB3 LYS B 151 -31.313 1.389 -6.376 1.00 0.00 H new ATOM 0 HG2 LYS B 151 -30.665 -0.400 -4.571 1.00 0.00 H new ATOM 0 HG3 LYS B 151 -29.008 -0.055 -5.023 1.00 0.00 H new ATOM 0 HD2 LYS B 151 -29.059 1.674 -3.558 1.00 0.00 H new ATOM 0 HD3 LYS B 151 -30.141 2.499 -4.662 1.00 0.00 H new ATOM 0 HE2 LYS B 151 -31.399 2.487 -2.671 1.00 0.00 H new ATOM 0 HE3 LYS B 151 -32.045 1.095 -3.519 1.00 0.00 H new ATOM 0 HZ1 LYS B 151 -31.619 0.072 -1.598 1.00 0.00 H new ATOM 0 HZ2 LYS B 151 -30.024 -0.021 -2.172 1.00 0.00 H new ATOM 0 HZ3 LYS B 151 -30.469 1.216 -1.097 1.00 0.00 H new