USER MOD reduce.3.24.130724 H: found=0, std=0, add=821, rem=0, adj=18 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: A 37 TYR OH : rot 171:sc= 1.15 USER MOD Set 1.2: B 125 MET CE :methyl -139:sc= 0 (180deg=-0.0849) USER MOD Set 2.1: A 40 LYS NZ :NH3+ 174:sc= 0.117 (180deg=0.0862) USER MOD Set 2.2: B 104 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 25 MET CE :methyl 177:sc= 0 (180deg=0) USER MOD Set 3.2: B 137 TYR OH : rot 30:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -147:sc= 1.22 (180deg=-0.15) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.00177 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 26 MET CE :methyl 170:sc= 0 (180deg=-0.112) USER MOD Single : A 28 GLN : amide:sc= -1.19 X(o=-1.2,f=-1.3) USER MOD Single : A 35 GLN : amide:sc= -0.464 X(o=-0.46,f=-0.46) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 GLN : amide:sc= 0.439 K(o=0.44,f=-5.5!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 108 LYS NZ :NH3+ -131:sc= 1.28 (180deg=-0.623) USER MOD Single : B 109 SER OG : rot -38:sc= 0.442 USER MOD Single : B 111 THR OG1 : rot 180:sc= 0.00435 USER MOD Single : B 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 126 MET CE :methyl 175:sc= 0 (180deg=-0.0174) USER MOD Single : B 128 GLN : amide:sc= -0.253 X(o=-0.25,f=-0.17) USER MOD Single : B 135 GLN : amide:sc= -0.22 X(o=-0.22,f=-0.22) USER MOD Single : B 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 138 GLN : amide:sc= 0.0151 K(o=0.015,f=-7.2!) USER MOD Single : B 139 SER OG : rot 180:sc= 0 USER MOD Single : B 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 142 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 151 LYS NZ :NH3+ -112:sc= 2.27 (180deg=-2.65!) USER MOD ----------------------------------------------------------------- ATOM 31 N TYR A 4 -20.225 -5.006 6.759 1.00 0.00 N ATOM 32 CA TYR A 4 -21.094 -3.990 6.176 1.00 0.00 C ATOM 33 C TYR A 4 -22.106 -4.620 5.205 1.00 0.00 C ATOM 34 O TYR A 4 -22.525 -4.001 4.232 1.00 0.00 O ATOM 35 CB TYR A 4 -20.225 -2.905 5.517 1.00 0.00 C ATOM 36 CG TYR A 4 -19.577 -1.914 6.469 1.00 0.00 C ATOM 37 CD1 TYR A 4 -18.548 -2.300 7.351 1.00 0.00 C ATOM 38 CD2 TYR A 4 -20.015 -0.578 6.466 1.00 0.00 C ATOM 39 CE1 TYR A 4 -18.001 -1.373 8.253 1.00 0.00 C ATOM 40 CE2 TYR A 4 -19.453 0.361 7.345 1.00 0.00 C ATOM 41 CZ TYR A 4 -18.454 -0.036 8.255 1.00 0.00 C ATOM 42 OH TYR A 4 -17.903 0.879 9.099 1.00 0.00 O ATOM 0 HA TYR A 4 -21.688 -3.516 6.957 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -19.440 -3.394 4.941 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -20.842 -2.351 4.809 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -18.178 -3.314 7.333 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -20.791 -0.271 5.781 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -17.233 -1.683 8.946 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -19.787 1.388 7.324 1.00 0.00 H new ATOM 0 HH TYR A 4 -18.334 1.749 8.965 1.00 0.00 H new ATOM 52 N GLU A 5 -22.497 -5.876 5.436 1.00 0.00 N ATOM 53 CA GLU A 5 -23.477 -6.592 4.603 1.00 0.00 C ATOM 54 C GLU A 5 -24.757 -5.764 4.453 1.00 0.00 C ATOM 55 O GLU A 5 -25.323 -5.709 3.367 1.00 0.00 O ATOM 56 CB GLU A 5 -23.793 -7.945 5.265 1.00 0.00 C ATOM 57 CG GLU A 5 -22.594 -8.903 5.347 1.00 0.00 C ATOM 58 CD GLU A 5 -22.153 -9.479 3.999 1.00 0.00 C ATOM 59 OE1 GLU A 5 -22.290 -8.806 2.952 1.00 0.00 O ATOM 60 OE2 GLU A 5 -21.581 -10.590 3.983 1.00 0.00 O ATOM 0 H GLU A 5 -22.141 -6.433 6.213 1.00 0.00 H new ATOM 0 HA GLU A 5 -23.062 -6.756 3.609 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -24.169 -7.765 6.272 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -24.594 -8.431 4.708 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -21.753 -8.375 5.796 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -22.847 -9.726 6.015 1.00 0.00 H new ATOM 67 N PHE A 6 -25.124 -5.043 5.511 1.00 0.00 N ATOM 68 CA PHE A 6 -26.269 -4.162 5.670 1.00 0.00 C ATOM 69 C PHE A 6 -26.374 -3.085 4.587 1.00 0.00 C ATOM 70 O PHE A 6 -27.461 -2.536 4.393 1.00 0.00 O ATOM 71 CB PHE A 6 -26.139 -3.491 7.043 1.00 0.00 C ATOM 72 CG PHE A 6 -26.060 -4.483 8.187 1.00 0.00 C ATOM 73 CD1 PHE A 6 -27.245 -4.936 8.790 1.00 0.00 C ATOM 74 CD2 PHE A 6 -24.815 -5.001 8.603 1.00 0.00 C ATOM 75 CE1 PHE A 6 -27.188 -5.913 9.795 1.00 0.00 C ATOM 76 CE2 PHE A 6 -24.765 -6.008 9.582 1.00 0.00 C ATOM 77 CZ PHE A 6 -25.954 -6.462 10.175 1.00 0.00 C ATOM 0 H PHE A 6 -24.565 -5.068 6.364 1.00 0.00 H new ATOM 0 HA PHE A 6 -27.174 -4.764 5.582 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -25.247 -2.865 7.051 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -26.993 -2.832 7.200 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -28.198 -4.533 8.481 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -23.901 -4.624 8.169 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -28.096 -6.243 10.277 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -23.816 -6.431 9.877 1.00 0.00 H new ATOM 0 HZ PHE A 6 -25.919 -7.237 10.927 1.00 0.00 H new ATOM 87 N LEU A 7 -25.274 -2.789 3.878 1.00 0.00 N ATOM 88 CA LEU A 7 -25.225 -1.797 2.807 1.00 0.00 C ATOM 89 C LEU A 7 -26.289 -2.090 1.752 1.00 0.00 C ATOM 90 O LEU A 7 -26.716 -1.165 1.069 1.00 0.00 O ATOM 91 CB LEU A 7 -23.842 -1.774 2.132 1.00 0.00 C ATOM 92 CG LEU A 7 -22.728 -1.084 2.936 1.00 0.00 C ATOM 93 CD1 LEU A 7 -21.375 -1.524 2.369 1.00 0.00 C ATOM 94 CD2 LEU A 7 -22.796 0.443 2.842 1.00 0.00 C ATOM 0 H LEU A 7 -24.377 -3.246 4.041 1.00 0.00 H new ATOM 0 HA LEU A 7 -25.416 -0.823 3.258 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -23.538 -2.801 1.930 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -23.935 -1.273 1.168 1.00 0.00 H new ATOM 0 HG LEU A 7 -22.853 -1.370 3.980 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -20.572 -1.043 2.928 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -21.279 -2.606 2.455 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -21.309 -1.236 1.320 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -21.987 0.880 3.428 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -22.696 0.748 1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -23.754 0.789 3.231 1.00 0.00 H new ATOM 106 N LYS A 8 -26.734 -3.348 1.614 1.00 0.00 N ATOM 107 CA LYS A 8 -27.762 -3.721 0.644 1.00 0.00 C ATOM 108 C LYS A 8 -29.022 -2.867 0.795 1.00 0.00 C ATOM 109 O LYS A 8 -29.667 -2.593 -0.217 1.00 0.00 O ATOM 110 CB LYS A 8 -28.153 -5.196 0.822 1.00 0.00 C ATOM 111 CG LYS A 8 -27.076 -6.223 0.464 1.00 0.00 C ATOM 112 CD LYS A 8 -26.581 -6.102 -0.978 1.00 0.00 C ATOM 113 CE LYS A 8 -25.736 -7.313 -1.366 1.00 0.00 C ATOM 114 NZ LYS A 8 -24.498 -7.464 -0.593 1.00 0.00 N ATOM 0 H LYS A 8 -26.390 -4.129 2.172 1.00 0.00 H new ATOM 0 HA LYS A 8 -27.339 -3.556 -0.347 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -28.444 -5.351 1.861 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -29.034 -5.394 0.211 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -26.231 -6.105 1.142 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -27.473 -7.226 0.622 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -27.432 -6.016 -1.653 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -25.992 -5.192 -1.090 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -26.337 -8.214 -1.244 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -25.482 -7.239 -2.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -23.761 -7.881 -1.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -24.183 -6.532 -0.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -24.671 -8.087 0.222 1.00 0.00 H new ATOM 128 N SER A 9 -29.362 -2.460 2.021 1.00 0.00 N ATOM 129 CA SER A 9 -30.541 -1.653 2.309 1.00 0.00 C ATOM 130 C SER A 9 -30.205 -0.181 2.570 1.00 0.00 C ATOM 131 O SER A 9 -31.109 0.586 2.903 1.00 0.00 O ATOM 132 CB SER A 9 -31.287 -2.262 3.500 1.00 0.00 C ATOM 133 OG SER A 9 -31.534 -3.644 3.303 1.00 0.00 O ATOM 0 H SER A 9 -28.815 -2.688 2.851 1.00 0.00 H new ATOM 0 HA SER A 9 -31.179 -1.664 1.425 1.00 0.00 H new ATOM 0 HB2 SER A 9 -30.702 -2.121 4.409 1.00 0.00 H new ATOM 0 HB3 SER A 9 -32.232 -1.739 3.645 1.00 0.00 H new ATOM 0 HG SER A 9 -32.010 -4.005 4.080 1.00 0.00 H new ATOM 139 N TRP A 10 -28.927 0.210 2.530 1.00 0.00 N ATOM 140 CA TRP A 10 -28.547 1.599 2.745 1.00 0.00 C ATOM 141 C TRP A 10 -28.933 2.375 1.483 1.00 0.00 C ATOM 142 O TRP A 10 -29.122 1.794 0.406 1.00 0.00 O ATOM 143 CB TRP A 10 -27.039 1.716 3.019 1.00 0.00 C ATOM 144 CG TRP A 10 -26.551 1.510 4.432 1.00 0.00 C ATOM 145 CD1 TRP A 10 -25.398 2.048 4.888 1.00 0.00 C ATOM 146 CD2 TRP A 10 -27.155 0.845 5.600 1.00 0.00 C ATOM 147 NE1 TRP A 10 -25.227 1.741 6.216 1.00 0.00 N ATOM 148 CE2 TRP A 10 -26.283 1.027 6.718 1.00 0.00 C ATOM 149 CE3 TRP A 10 -28.351 0.143 5.874 1.00 0.00 C ATOM 150 CZ2 TRP A 10 -26.574 0.564 8.011 1.00 0.00 C ATOM 151 CZ3 TRP A 10 -28.650 -0.348 7.160 1.00 0.00 C ATOM 152 CH2 TRP A 10 -27.768 -0.136 8.232 1.00 0.00 C ATOM 0 H TRP A 10 -28.144 -0.419 2.351 1.00 0.00 H new ATOM 0 HA TRP A 10 -29.060 2.006 3.616 1.00 0.00 H new ATOM 0 HB2 TRP A 10 -26.528 0.994 2.382 1.00 0.00 H new ATOM 0 HB3 TRP A 10 -26.718 2.707 2.698 1.00 0.00 H new ATOM 0 HD1 TRP A 10 -24.711 2.634 4.295 1.00 0.00 H new ATOM 0 HE1 TRP A 10 -24.410 2.013 6.764 1.00 0.00 H new ATOM 0 HE3 TRP A 10 -29.057 -0.022 5.073 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 -25.887 0.745 8.825 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 -29.568 -0.894 7.323 1.00 0.00 H new ATOM 0 HH2 TRP A 10 -28.007 -0.509 9.217 1.00 0.00 H new ATOM 163 N THR A 11 -29.077 3.695 1.604 1.00 0.00 N ATOM 164 CA THR A 11 -29.423 4.503 0.452 1.00 0.00 C ATOM 165 C THR A 11 -28.238 4.525 -0.511 1.00 0.00 C ATOM 166 O THR A 11 -27.084 4.285 -0.129 1.00 0.00 O ATOM 167 CB THR A 11 -29.840 5.921 0.879 1.00 0.00 C ATOM 168 OG1 THR A 11 -28.956 6.473 1.835 1.00 0.00 O ATOM 169 CG2 THR A 11 -31.253 5.897 1.457 1.00 0.00 C ATOM 0 H THR A 11 -28.960 4.213 2.475 1.00 0.00 H new ATOM 0 HA THR A 11 -30.281 4.066 -0.058 1.00 0.00 H new ATOM 0 HB THR A 11 -29.806 6.548 -0.012 1.00 0.00 H new ATOM 0 HG1 THR A 11 -29.257 7.374 2.077 1.00 0.00 H new ATOM 0 HG21 THR A 11 -31.541 6.905 1.757 1.00 0.00 H new ATOM 0 HG22 THR A 11 -31.949 5.531 0.702 1.00 0.00 H new ATOM 0 HG23 THR A 11 -31.280 5.239 2.325 1.00 0.00 H new ATOM 177 N VAL A 12 -28.526 4.842 -1.774 1.00 0.00 N ATOM 178 CA VAL A 12 -27.495 4.920 -2.793 1.00 0.00 C ATOM 179 C VAL A 12 -26.474 6.001 -2.422 1.00 0.00 C ATOM 180 O VAL A 12 -25.298 5.860 -2.748 1.00 0.00 O ATOM 181 CB VAL A 12 -28.140 5.105 -4.178 1.00 0.00 C ATOM 182 CG1 VAL A 12 -28.941 6.408 -4.336 1.00 0.00 C ATOM 183 CG2 VAL A 12 -27.069 4.995 -5.264 1.00 0.00 C ATOM 0 H VAL A 12 -29.467 5.048 -2.109 1.00 0.00 H new ATOM 0 HA VAL A 12 -26.935 3.986 -2.846 1.00 0.00 H new ATOM 0 HB VAL A 12 -28.872 4.304 -4.284 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -29.361 6.457 -5.341 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -29.748 6.430 -3.604 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -28.282 7.262 -4.176 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -27.529 5.126 -6.243 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -26.315 5.767 -5.111 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -26.599 4.013 -5.213 1.00 0.00 H new ATOM 193 N GLU A 13 -26.885 7.056 -1.714 1.00 0.00 N ATOM 194 CA GLU A 13 -25.968 8.108 -1.318 1.00 0.00 C ATOM 195 C GLU A 13 -25.047 7.581 -0.219 1.00 0.00 C ATOM 196 O GLU A 13 -23.831 7.607 -0.371 1.00 0.00 O ATOM 197 CB GLU A 13 -26.719 9.341 -0.795 1.00 0.00 C ATOM 198 CG GLU A 13 -27.815 9.878 -1.723 1.00 0.00 C ATOM 199 CD GLU A 13 -28.335 11.252 -1.270 1.00 0.00 C ATOM 200 OE1 GLU A 13 -28.380 11.512 -0.038 1.00 0.00 O ATOM 201 OE2 GLU A 13 -28.697 12.059 -2.157 1.00 0.00 O ATOM 0 H GLU A 13 -27.847 7.197 -1.407 1.00 0.00 H new ATOM 0 HA GLU A 13 -25.391 8.405 -2.194 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -27.168 9.092 0.166 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -25.997 10.137 -0.613 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -27.424 9.955 -2.738 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -28.643 9.170 -1.753 1.00 0.00 H new ATOM 208 N ASP A 14 -25.621 7.046 0.862 1.00 0.00 N ATOM 209 CA ASP A 14 -24.892 6.527 2.023 1.00 0.00 C ATOM 210 C ASP A 14 -23.840 5.498 1.612 1.00 0.00 C ATOM 211 O ASP A 14 -22.674 5.566 2.022 1.00 0.00 O ATOM 212 CB ASP A 14 -25.903 5.970 3.035 1.00 0.00 C ATOM 213 CG ASP A 14 -25.327 5.660 4.416 1.00 0.00 C ATOM 214 OD1 ASP A 14 -24.113 5.806 4.663 1.00 0.00 O ATOM 215 OD2 ASP A 14 -26.125 5.276 5.298 1.00 0.00 O ATOM 0 H ASP A 14 -26.633 6.959 0.957 1.00 0.00 H new ATOM 0 HA ASP A 14 -24.338 7.336 2.499 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -26.715 6.689 3.149 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -26.339 5.059 2.626 1.00 0.00 H new ATOM 220 N LEU A 15 -24.222 4.532 0.772 1.00 0.00 N ATOM 221 CA LEU A 15 -23.267 3.528 0.323 1.00 0.00 C ATOM 222 C LEU A 15 -22.215 4.188 -0.585 1.00 0.00 C ATOM 223 O LEU A 15 -21.024 3.906 -0.431 1.00 0.00 O ATOM 224 CB LEU A 15 -23.986 2.312 -0.303 1.00 0.00 C ATOM 225 CG LEU A 15 -24.399 2.497 -1.772 1.00 0.00 C ATOM 226 CD1 LEU A 15 -23.231 2.200 -2.718 1.00 0.00 C ATOM 227 CD2 LEU A 15 -25.587 1.613 -2.138 1.00 0.00 C ATOM 0 H LEU A 15 -25.165 4.428 0.399 1.00 0.00 H new ATOM 0 HA LEU A 15 -22.725 3.117 1.175 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -23.332 1.443 -0.230 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -24.876 2.091 0.286 1.00 0.00 H new ATOM 0 HG LEU A 15 -24.693 3.540 -1.887 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.554 2.339 -3.750 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -22.406 2.878 -2.501 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -22.901 1.171 -2.577 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -25.850 1.771 -3.184 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -25.323 0.567 -1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -26.438 1.868 -1.507 1.00 0.00 H new ATOM 239 N GLN A 16 -22.612 5.071 -1.513 1.00 0.00 N ATOM 240 CA GLN A 16 -21.683 5.730 -2.425 1.00 0.00 C ATOM 241 C GLN A 16 -20.661 6.553 -1.634 1.00 0.00 C ATOM 242 O GLN A 16 -19.484 6.572 -1.994 1.00 0.00 O ATOM 243 CB GLN A 16 -22.441 6.566 -3.456 1.00 0.00 C ATOM 244 CG GLN A 16 -21.510 7.153 -4.520 1.00 0.00 C ATOM 245 CD GLN A 16 -22.349 7.733 -5.644 1.00 0.00 C ATOM 246 OE1 GLN A 16 -22.763 8.886 -5.581 1.00 0.00 O ATOM 247 NE2 GLN A 16 -22.671 6.945 -6.652 1.00 0.00 N ATOM 0 H GLN A 16 -23.586 5.344 -1.647 1.00 0.00 H new ATOM 0 HA GLN A 16 -21.128 4.975 -2.982 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -23.197 5.947 -3.939 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -22.967 7.375 -2.950 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -20.879 7.927 -4.083 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -20.845 6.380 -4.906 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -22.316 5.989 -6.686 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -23.275 7.292 -7.398 1.00 0.00 H new ATOM 256 N LYS A 17 -21.060 7.175 -0.516 1.00 0.00 N ATOM 257 CA LYS A 17 -20.158 7.960 0.326 1.00 0.00 C ATOM 258 C LYS A 17 -19.004 7.074 0.788 1.00 0.00 C ATOM 259 O LYS A 17 -17.902 7.590 0.993 1.00 0.00 O ATOM 260 CB LYS A 17 -20.891 8.588 1.529 1.00 0.00 C ATOM 261 CG LYS A 17 -21.307 10.047 1.286 1.00 0.00 C ATOM 262 CD LYS A 17 -22.533 10.182 0.374 1.00 0.00 C ATOM 263 CE LYS A 17 -22.860 11.630 0.021 1.00 0.00 C ATOM 264 NZ LYS A 17 -23.432 12.409 1.136 1.00 0.00 N ATOM 0 H LYS A 17 -22.020 7.146 -0.173 1.00 0.00 H new ATOM 0 HA LYS A 17 -19.766 8.788 -0.265 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -21.778 7.996 1.756 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -20.245 8.542 2.405 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -21.521 10.521 2.244 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -20.471 10.587 0.842 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -22.359 9.621 -0.544 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -23.395 9.730 0.865 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -21.951 12.123 -0.323 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -23.563 11.640 -0.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -23.626 13.380 0.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -24.318 11.964 1.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -22.756 12.433 1.926 1.00 0.00 H new ATOM 278 N ARG A 18 -19.229 5.774 1.025 1.00 0.00 N ATOM 279 CA ARG A 18 -18.163 4.856 1.424 1.00 0.00 C ATOM 280 C ARG A 18 -17.321 4.538 0.195 1.00 0.00 C ATOM 281 O ARG A 18 -16.106 4.579 0.305 1.00 0.00 O ATOM 282 CB ARG A 18 -18.711 3.551 2.025 1.00 0.00 C ATOM 283 CG ARG A 18 -19.110 3.642 3.502 1.00 0.00 C ATOM 284 CD ARG A 18 -17.906 3.558 4.454 1.00 0.00 C ATOM 285 NE ARG A 18 -17.363 4.885 4.797 1.00 0.00 N ATOM 286 CZ ARG A 18 -16.304 5.145 5.574 1.00 0.00 C ATOM 287 NH1 ARG A 18 -15.558 4.171 6.095 1.00 0.00 N ATOM 288 NH2 ARG A 18 -16.013 6.413 5.833 1.00 0.00 N ATOM 0 H ARG A 18 -20.147 5.336 0.945 1.00 0.00 H new ATOM 0 HA ARG A 18 -17.565 5.338 2.197 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -19.580 3.238 1.447 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -17.957 2.772 1.914 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -19.637 4.580 3.673 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -19.807 2.837 3.735 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -18.205 3.044 5.368 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -17.123 2.957 3.992 1.00 0.00 H new ATOM 0 HE ARG A 18 -17.846 5.691 4.400 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -15.788 3.196 5.905 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -14.757 4.401 6.683 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -16.590 7.158 5.443 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -15.212 6.643 6.422 1.00 0.00 H new ATOM 302 N LEU A 19 -17.941 4.244 -0.959 1.00 0.00 N ATOM 303 CA LEU A 19 -17.230 3.919 -2.201 1.00 0.00 C ATOM 304 C LEU A 19 -16.216 5.009 -2.533 1.00 0.00 C ATOM 305 O LEU A 19 -15.033 4.721 -2.745 1.00 0.00 O ATOM 306 CB LEU A 19 -18.219 3.718 -3.362 1.00 0.00 C ATOM 307 CG LEU A 19 -17.560 3.060 -4.594 1.00 0.00 C ATOM 308 CD1 LEU A 19 -18.543 2.098 -5.268 1.00 0.00 C ATOM 309 CD2 LEU A 19 -17.085 4.096 -5.619 1.00 0.00 C ATOM 0 H LEU A 19 -18.956 4.226 -1.055 1.00 0.00 H new ATOM 0 HA LEU A 19 -16.692 2.982 -2.054 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -19.050 3.098 -3.024 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -18.637 4.683 -3.650 1.00 0.00 H new ATOM 0 HG LEU A 19 -16.687 2.515 -4.236 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -18.067 1.640 -6.135 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -18.834 1.321 -4.561 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -19.428 2.647 -5.588 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -16.629 3.586 -6.467 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -17.936 4.683 -5.964 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -16.352 4.757 -5.156 1.00 0.00 H new ATOM 321 N LEU A 20 -16.669 6.259 -2.545 1.00 0.00 N ATOM 322 CA LEU A 20 -15.852 7.423 -2.819 1.00 0.00 C ATOM 323 C LEU A 20 -14.748 7.500 -1.775 1.00 0.00 C ATOM 324 O LEU A 20 -13.591 7.676 -2.121 1.00 0.00 O ATOM 325 CB LEU A 20 -16.736 8.684 -2.771 1.00 0.00 C ATOM 326 CG LEU A 20 -15.944 9.996 -2.580 1.00 0.00 C ATOM 327 CD1 LEU A 20 -15.043 10.336 -3.770 1.00 0.00 C ATOM 328 CD2 LEU A 20 -16.918 11.148 -2.360 1.00 0.00 C ATOM 0 H LEU A 20 -17.645 6.490 -2.358 1.00 0.00 H new ATOM 0 HA LEU A 20 -15.402 7.352 -3.809 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -17.310 8.749 -3.695 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -17.453 8.582 -1.957 1.00 0.00 H new ATOM 0 HG LEU A 20 -15.299 9.849 -1.714 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -14.515 11.269 -3.572 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -14.320 9.534 -3.920 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -15.652 10.447 -4.667 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -16.361 12.075 -2.225 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -17.573 11.241 -3.226 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -17.518 10.953 -1.471 1.00 0.00 H new ATOM 340 N ALA A 21 -15.094 7.372 -0.494 1.00 0.00 N ATOM 341 CA ALA A 21 -14.137 7.457 0.596 1.00 0.00 C ATOM 342 C ALA A 21 -13.109 6.324 0.636 1.00 0.00 C ATOM 343 O ALA A 21 -12.120 6.467 1.358 1.00 0.00 O ATOM 344 CB ALA A 21 -14.887 7.542 1.926 1.00 0.00 C ATOM 0 H ALA A 21 -16.053 7.206 -0.187 1.00 0.00 H new ATOM 0 HA ALA A 21 -13.556 8.362 0.419 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -14.170 7.606 2.745 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -15.522 8.428 1.930 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -15.504 6.653 2.053 1.00 0.00 H new ATOM 350 N LEU A 22 -13.329 5.212 -0.067 1.00 0.00 N ATOM 351 CA LEU A 22 -12.423 4.063 -0.113 1.00 0.00 C ATOM 352 C LEU A 22 -11.264 4.343 -1.067 1.00 0.00 C ATOM 353 O LEU A 22 -10.120 4.005 -0.759 1.00 0.00 O ATOM 354 CB LEU A 22 -13.168 2.788 -0.576 1.00 0.00 C ATOM 355 CG LEU A 22 -13.395 1.675 0.469 1.00 0.00 C ATOM 356 CD1 LEU A 22 -12.140 1.285 1.257 1.00 0.00 C ATOM 357 CD2 LEU A 22 -14.508 2.037 1.455 1.00 0.00 C ATOM 0 H LEU A 22 -14.166 5.082 -0.636 1.00 0.00 H new ATOM 0 HA LEU A 22 -12.038 3.900 0.894 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -14.141 3.089 -0.963 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -12.613 2.358 -1.410 1.00 0.00 H new ATOM 0 HG LEU A 22 -13.689 0.809 -0.124 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -12.387 0.498 1.969 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -11.375 0.925 0.569 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -11.763 2.155 1.795 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -14.635 1.227 2.173 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -14.242 2.952 1.984 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -15.440 2.190 0.911 1.00 0.00 H new ATOM 369 N ASP A 23 -11.555 4.964 -2.210 1.00 0.00 N ATOM 370 CA ASP A 23 -10.572 5.301 -3.241 1.00 0.00 C ATOM 371 C ASP A 23 -9.356 6.065 -2.686 1.00 0.00 C ATOM 372 O ASP A 23 -8.231 5.580 -2.853 1.00 0.00 O ATOM 373 CB ASP A 23 -11.250 6.025 -4.424 1.00 0.00 C ATOM 374 CG ASP A 23 -11.695 5.090 -5.555 1.00 0.00 C ATOM 375 OD1 ASP A 23 -11.447 3.862 -5.524 1.00 0.00 O ATOM 376 OD2 ASP A 23 -12.348 5.553 -6.517 1.00 0.00 O ATOM 0 H ASP A 23 -12.503 5.254 -2.451 1.00 0.00 H new ATOM 0 HA ASP A 23 -10.163 4.365 -3.621 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -12.119 6.570 -4.054 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -10.559 6.764 -4.828 1.00 0.00 H new ATOM 381 N PRO A 24 -9.504 7.208 -1.985 1.00 0.00 N ATOM 382 CA PRO A 24 -8.367 7.936 -1.451 1.00 0.00 C ATOM 383 C PRO A 24 -7.717 7.220 -0.259 1.00 0.00 C ATOM 384 O PRO A 24 -6.601 7.591 0.094 1.00 0.00 O ATOM 385 CB PRO A 24 -8.894 9.325 -1.081 1.00 0.00 C ATOM 386 CG PRO A 24 -10.339 9.036 -0.708 1.00 0.00 C ATOM 387 CD PRO A 24 -10.723 7.931 -1.685 1.00 0.00 C ATOM 0 HA PRO A 24 -7.568 8.005 -2.189 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -8.340 9.762 -0.251 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -8.821 10.023 -1.915 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.432 8.711 0.328 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -10.971 9.917 -0.824 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -11.470 7.268 -1.248 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -11.160 8.349 -2.592 1.00 0.00 H new ATOM 395 N MET A 25 -8.370 6.241 0.389 1.00 0.00 N ATOM 396 CA MET A 25 -7.772 5.518 1.518 1.00 0.00 C ATOM 397 C MET A 25 -6.622 4.701 0.966 1.00 0.00 C ATOM 398 O MET A 25 -5.504 4.770 1.473 1.00 0.00 O ATOM 399 CB MET A 25 -8.758 4.583 2.227 1.00 0.00 C ATOM 400 CG MET A 25 -9.813 5.356 3.003 1.00 0.00 C ATOM 401 SD MET A 25 -9.383 5.777 4.709 1.00 0.00 S ATOM 402 CE MET A 25 -9.656 4.182 5.517 1.00 0.00 C ATOM 0 H MET A 25 -9.312 5.934 0.148 1.00 0.00 H new ATOM 0 HA MET A 25 -7.449 6.246 2.262 1.00 0.00 H new ATOM 0 HB2 MET A 25 -9.245 3.943 1.491 1.00 0.00 H new ATOM 0 HB3 MET A 25 -8.213 3.929 2.908 1.00 0.00 H new ATOM 0 HG2 MET A 25 -10.030 6.279 2.465 1.00 0.00 H new ATOM 0 HG3 MET A 25 -10.732 4.770 3.014 1.00 0.00 H new ATOM 0 HE1 MET A 25 -9.383 4.256 6.570 1.00 0.00 H new ATOM 0 HE2 MET A 25 -10.707 3.907 5.433 1.00 0.00 H new ATOM 0 HE3 MET A 25 -9.042 3.421 5.036 1.00 0.00 H new ATOM 412 N MET A 26 -6.902 3.892 -0.059 1.00 0.00 N ATOM 413 CA MET A 26 -5.862 3.091 -0.677 1.00 0.00 C ATOM 414 C MET A 26 -4.863 4.032 -1.342 1.00 0.00 C ATOM 415 O MET A 26 -3.688 3.724 -1.391 1.00 0.00 O ATOM 416 CB MET A 26 -6.467 2.101 -1.668 1.00 0.00 C ATOM 417 CG MET A 26 -5.414 1.232 -2.364 1.00 0.00 C ATOM 418 SD MET A 26 -6.120 -0.022 -3.464 1.00 0.00 S ATOM 419 CE MET A 26 -6.686 1.051 -4.813 1.00 0.00 C ATOM 0 H MET A 26 -7.829 3.780 -0.469 1.00 0.00 H new ATOM 0 HA MET A 26 -5.340 2.498 0.074 1.00 0.00 H new ATOM 0 HB2 MET A 26 -7.173 1.457 -1.144 1.00 0.00 H new ATOM 0 HB3 MET A 26 -7.033 2.649 -2.421 1.00 0.00 H new ATOM 0 HG2 MET A 26 -4.748 1.875 -2.940 1.00 0.00 H new ATOM 0 HG3 MET A 26 -4.805 0.738 -1.607 1.00 0.00 H new ATOM 0 HE1 MET A 26 -6.989 0.439 -5.662 1.00 0.00 H new ATOM 0 HE2 MET A 26 -7.534 1.646 -4.474 1.00 0.00 H new ATOM 0 HE3 MET A 26 -5.875 1.714 -5.115 1.00 0.00 H new ATOM 429 N GLU A 27 -5.290 5.161 -1.888 1.00 0.00 N ATOM 430 CA GLU A 27 -4.350 6.070 -2.526 1.00 0.00 C ATOM 431 C GLU A 27 -3.339 6.622 -1.516 1.00 0.00 C ATOM 432 O GLU A 27 -2.135 6.528 -1.767 1.00 0.00 O ATOM 433 CB GLU A 27 -5.076 7.172 -3.292 1.00 0.00 C ATOM 434 CG GLU A 27 -4.086 7.894 -4.218 1.00 0.00 C ATOM 435 CD GLU A 27 -4.741 8.794 -5.266 1.00 0.00 C ATOM 436 OE1 GLU A 27 -5.971 8.698 -5.462 1.00 0.00 O ATOM 437 OE2 GLU A 27 -4.011 9.586 -5.912 1.00 0.00 O ATOM 0 H GLU A 27 -6.263 5.466 -1.903 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.779 5.504 -3.262 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -5.892 6.746 -3.876 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -5.521 7.882 -2.594 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -3.412 8.497 -3.609 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.475 7.149 -4.728 1.00 0.00 H new ATOM 444 N GLN A 28 -3.809 7.146 -0.383 1.00 0.00 N ATOM 445 CA GLN A 28 -2.968 7.720 0.654 1.00 0.00 C ATOM 446 C GLN A 28 -2.094 6.665 1.327 1.00 0.00 C ATOM 447 O GLN A 28 -0.883 6.854 1.423 1.00 0.00 O ATOM 448 CB GLN A 28 -3.857 8.445 1.681 1.00 0.00 C ATOM 449 CG GLN A 28 -3.087 9.133 2.823 1.00 0.00 C ATOM 450 CD GLN A 28 -2.622 8.175 3.929 1.00 0.00 C ATOM 451 OE1 GLN A 28 -3.414 7.399 4.461 1.00 0.00 O ATOM 452 NE2 GLN A 28 -1.349 8.188 4.292 1.00 0.00 N ATOM 0 H GLN A 28 -4.804 7.181 -0.162 1.00 0.00 H new ATOM 0 HA GLN A 28 -2.288 8.437 0.194 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -4.454 9.194 1.161 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.553 7.725 2.112 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -2.217 9.640 2.407 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -3.722 9.901 3.265 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -0.698 8.834 3.846 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -1.019 7.552 5.018 1.00 0.00 H new ATOM 461 N GLU A 29 -2.678 5.555 1.793 1.00 0.00 N ATOM 462 CA GLU A 29 -1.905 4.522 2.466 1.00 0.00 C ATOM 463 C GLU A 29 -0.777 4.029 1.568 1.00 0.00 C ATOM 464 O GLU A 29 0.347 3.837 2.031 1.00 0.00 O ATOM 465 CB GLU A 29 -2.813 3.355 2.877 1.00 0.00 C ATOM 466 CG GLU A 29 -3.785 3.691 4.019 1.00 0.00 C ATOM 467 CD GLU A 29 -3.129 3.817 5.399 1.00 0.00 C ATOM 468 OE1 GLU A 29 -1.889 3.717 5.538 1.00 0.00 O ATOM 469 OE2 GLU A 29 -3.877 3.991 6.391 1.00 0.00 O ATOM 0 H GLU A 29 -3.675 5.356 1.714 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.466 4.952 3.366 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -3.387 3.031 2.009 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.191 2.513 3.179 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -4.290 4.628 3.785 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -4.552 2.918 4.065 1.00 0.00 H new ATOM 476 N ILE A 30 -1.056 3.871 0.274 1.00 0.00 N ATOM 477 CA ILE A 30 -0.096 3.388 -0.688 1.00 0.00 C ATOM 478 C ILE A 30 0.924 4.462 -0.973 1.00 0.00 C ATOM 479 O ILE A 30 2.093 4.113 -0.962 1.00 0.00 O ATOM 480 CB ILE A 30 -0.819 2.894 -1.951 1.00 0.00 C ATOM 481 CG1 ILE A 30 -1.612 1.588 -1.713 1.00 0.00 C ATOM 482 CG2 ILE A 30 0.131 2.636 -3.125 1.00 0.00 C ATOM 483 CD1 ILE A 30 -2.177 1.305 -0.319 1.00 0.00 C ATOM 0 H ILE A 30 -1.969 4.081 -0.129 1.00 0.00 H new ATOM 0 HA ILE A 30 0.446 2.533 -0.283 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.500 3.709 -2.198 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -2.446 1.578 -2.414 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -0.961 0.755 -1.979 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.440 2.289 -3.986 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.651 3.559 -3.382 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.860 1.876 -2.843 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -2.703 0.351 -0.327 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -1.361 1.264 0.403 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -2.869 2.099 -0.039 1.00 0.00 H new ATOM 495 N GLU A 31 0.551 5.719 -1.242 1.00 0.00 N ATOM 496 CA GLU A 31 1.560 6.738 -1.523 1.00 0.00 C ATOM 497 C GLU A 31 2.555 6.799 -0.371 1.00 0.00 C ATOM 498 O GLU A 31 3.742 6.998 -0.617 1.00 0.00 O ATOM 499 CB GLU A 31 0.953 8.114 -1.843 1.00 0.00 C ATOM 500 CG GLU A 31 0.768 9.071 -0.652 1.00 0.00 C ATOM 501 CD GLU A 31 0.224 10.418 -1.108 1.00 0.00 C ATOM 502 OE1 GLU A 31 1.003 11.220 -1.665 1.00 0.00 O ATOM 503 OE2 GLU A 31 -0.994 10.673 -0.969 1.00 0.00 O ATOM 0 H GLU A 31 -0.415 6.046 -1.270 1.00 0.00 H new ATOM 0 HA GLU A 31 2.089 6.447 -2.430 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.588 8.605 -2.581 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.019 7.959 -2.311 1.00 0.00 H new ATOM 0 HG2 GLU A 31 0.086 8.627 0.073 1.00 0.00 H new ATOM 0 HG3 GLU A 31 1.722 9.214 -0.145 1.00 0.00 H new ATOM 510 N GLU A 32 2.076 6.584 0.856 1.00 0.00 N ATOM 511 CA GLU A 32 2.902 6.586 2.037 1.00 0.00 C ATOM 512 C GLU A 32 3.848 5.385 1.944 1.00 0.00 C ATOM 513 O GLU A 32 5.038 5.547 2.198 1.00 0.00 O ATOM 514 CB GLU A 32 2.029 6.573 3.300 1.00 0.00 C ATOM 515 CG GLU A 32 2.863 7.002 4.508 1.00 0.00 C ATOM 516 CD GLU A 32 2.190 6.696 5.842 1.00 0.00 C ATOM 517 OE1 GLU A 32 2.434 5.579 6.366 1.00 0.00 O ATOM 518 OE2 GLU A 32 1.515 7.581 6.413 1.00 0.00 O ATOM 0 H GLU A 32 1.090 6.403 1.046 1.00 0.00 H new ATOM 0 HA GLU A 32 3.501 7.494 2.103 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.181 7.246 3.174 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.623 5.575 3.463 1.00 0.00 H new ATOM 0 HG2 GLU A 32 3.829 6.498 4.472 1.00 0.00 H new ATOM 0 HG3 GLU A 32 3.059 8.072 4.444 1.00 0.00 H new ATOM 525 N ILE A 33 3.377 4.179 1.576 1.00 0.00 N ATOM 526 CA ILE A 33 4.261 3.023 1.460 1.00 0.00 C ATOM 527 C ILE A 33 5.297 3.283 0.374 1.00 0.00 C ATOM 528 O ILE A 33 6.489 3.065 0.598 1.00 0.00 O ATOM 529 CB ILE A 33 3.476 1.717 1.216 1.00 0.00 C ATOM 530 CG1 ILE A 33 2.569 1.361 2.406 1.00 0.00 C ATOM 531 CG2 ILE A 33 4.490 0.583 1.023 1.00 0.00 C ATOM 532 CD1 ILE A 33 1.691 0.141 2.129 1.00 0.00 C ATOM 0 H ILE A 33 2.399 3.989 1.358 1.00 0.00 H new ATOM 0 HA ILE A 33 4.781 2.884 2.408 1.00 0.00 H new ATOM 0 HB ILE A 33 2.844 1.853 0.338 1.00 0.00 H new ATOM 0 HG12 ILE A 33 3.186 1.169 3.284 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.934 2.215 2.643 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.960 -0.353 0.848 1.00 0.00 H new ATOM 0 HG22 ILE A 33 5.126 0.805 0.166 1.00 0.00 H new ATOM 0 HG23 ILE A 33 5.106 0.490 1.917 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.071 -0.067 3.001 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.052 0.340 1.269 1.00 0.00 H new ATOM 0 HD13 ILE A 33 2.323 -0.722 1.919 1.00 0.00 H new ATOM 544 N ARG A 34 4.850 3.733 -0.797 1.00 0.00 N ATOM 545 CA ARG A 34 5.706 4.026 -1.924 1.00 0.00 C ATOM 546 C ARG A 34 6.768 4.996 -1.479 1.00 0.00 C ATOM 547 O ARG A 34 7.935 4.739 -1.724 1.00 0.00 O ATOM 548 CB ARG A 34 4.878 4.590 -3.078 1.00 0.00 C ATOM 549 CG ARG A 34 3.870 3.547 -3.563 1.00 0.00 C ATOM 550 CD ARG A 34 3.358 3.848 -4.955 1.00 0.00 C ATOM 551 NE ARG A 34 2.519 5.054 -5.053 1.00 0.00 N ATOM 552 CZ ARG A 34 1.358 5.138 -5.719 1.00 0.00 C ATOM 553 NH1 ARG A 34 0.717 4.071 -6.188 1.00 0.00 N ATOM 554 NH2 ARG A 34 0.828 6.332 -5.939 1.00 0.00 N ATOM 0 H ARG A 34 3.862 3.904 -0.983 1.00 0.00 H new ATOM 0 HA ARG A 34 6.187 3.116 -2.283 1.00 0.00 H new ATOM 0 HB2 ARG A 34 4.354 5.489 -2.754 1.00 0.00 H new ATOM 0 HB3 ARG A 34 5.534 4.881 -3.898 1.00 0.00 H new ATOM 0 HG2 ARG A 34 4.337 2.562 -3.555 1.00 0.00 H new ATOM 0 HG3 ARG A 34 3.030 3.507 -2.870 1.00 0.00 H new ATOM 0 HD2 ARG A 34 4.210 3.959 -5.625 1.00 0.00 H new ATOM 0 HD3 ARG A 34 2.784 2.992 -5.309 1.00 0.00 H new ATOM 0 HE ARG A 34 2.847 5.894 -4.576 1.00 0.00 H new ATOM 0 HH11 ARG A 34 1.107 3.139 -6.047 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -0.164 4.185 -6.689 1.00 0.00 H new ATOM 0 HH21 ARG A 34 1.302 7.170 -5.603 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -0.054 6.413 -6.444 1.00 0.00 H new ATOM 568 N GLN A 35 6.404 6.072 -0.787 1.00 0.00 N ATOM 569 CA GLN A 35 7.379 7.035 -0.322 1.00 0.00 C ATOM 570 C GLN A 35 8.349 6.428 0.668 1.00 0.00 C ATOM 571 O GLN A 35 9.554 6.532 0.449 1.00 0.00 O ATOM 572 CB GLN A 35 6.686 8.225 0.342 1.00 0.00 C ATOM 573 CG GLN A 35 6.224 9.208 -0.719 1.00 0.00 C ATOM 574 CD GLN A 35 7.409 9.784 -1.499 1.00 0.00 C ATOM 575 OE1 GLN A 35 8.348 10.338 -0.927 1.00 0.00 O ATOM 576 NE2 GLN A 35 7.452 9.574 -2.806 1.00 0.00 N ATOM 0 H GLN A 35 5.439 6.293 -0.539 1.00 0.00 H new ATOM 0 HA GLN A 35 7.935 7.365 -1.200 1.00 0.00 H new ATOM 0 HB2 GLN A 35 5.834 7.881 0.928 1.00 0.00 H new ATOM 0 HB3 GLN A 35 7.370 8.717 1.033 1.00 0.00 H new ATOM 0 HG2 GLN A 35 5.541 8.709 -1.407 1.00 0.00 H new ATOM 0 HG3 GLN A 35 5.667 10.019 -0.249 1.00 0.00 H new ATOM 0 HE21 GLN A 35 6.671 9.115 -3.275 1.00 0.00 H new ATOM 0 HE22 GLN A 35 8.266 9.872 -3.344 1.00 0.00 H new ATOM 585 N LYS A 36 7.851 5.775 1.717 1.00 0.00 N ATOM 586 CA LYS A 36 8.686 5.182 2.748 1.00 0.00 C ATOM 587 C LYS A 36 9.708 4.247 2.113 1.00 0.00 C ATOM 588 O LYS A 36 10.920 4.456 2.229 1.00 0.00 O ATOM 589 CB LYS A 36 7.773 4.588 3.853 1.00 0.00 C ATOM 590 CG LYS A 36 7.642 3.061 3.963 1.00 0.00 C ATOM 591 CD LYS A 36 6.698 2.648 5.100 1.00 0.00 C ATOM 592 CE LYS A 36 5.222 2.856 4.749 1.00 0.00 C ATOM 593 NZ LYS A 36 4.303 2.648 5.881 1.00 0.00 N ATOM 0 H LYS A 36 6.851 5.645 1.872 1.00 0.00 H new ATOM 0 HA LYS A 36 9.302 5.918 3.266 1.00 0.00 H new ATOM 0 HB2 LYS A 36 8.133 4.958 4.813 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.772 4.996 3.709 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.272 2.660 3.020 1.00 0.00 H new ATOM 0 HG3 LYS A 36 8.626 2.623 4.131 1.00 0.00 H new ATOM 0 HD2 LYS A 36 6.865 1.598 5.342 1.00 0.00 H new ATOM 0 HD3 LYS A 36 6.939 3.223 5.994 1.00 0.00 H new ATOM 0 HE2 LYS A 36 5.089 3.868 4.367 1.00 0.00 H new ATOM 0 HE3 LYS A 36 4.951 2.173 3.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 3.324 2.806 5.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 4.401 1.674 6.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 4.534 3.316 6.643 1.00 0.00 H new ATOM 607 N TYR A 37 9.245 3.252 1.366 1.00 0.00 N ATOM 608 CA TYR A 37 10.118 2.288 0.730 1.00 0.00 C ATOM 609 C TYR A 37 10.963 2.884 -0.393 1.00 0.00 C ATOM 610 O TYR A 37 12.107 2.454 -0.543 1.00 0.00 O ATOM 611 CB TYR A 37 9.308 1.038 0.365 1.00 0.00 C ATOM 612 CG TYR A 37 8.868 0.213 1.578 1.00 0.00 C ATOM 613 CD1 TYR A 37 9.705 0.018 2.697 1.00 0.00 C ATOM 614 CD2 TYR A 37 7.586 -0.354 1.599 1.00 0.00 C ATOM 615 CE1 TYR A 37 9.242 -0.680 3.826 1.00 0.00 C ATOM 616 CE2 TYR A 37 7.118 -1.082 2.712 1.00 0.00 C ATOM 617 CZ TYR A 37 7.941 -1.229 3.848 1.00 0.00 C ATOM 618 OH TYR A 37 7.518 -1.882 4.970 1.00 0.00 O ATOM 0 H TYR A 37 8.253 3.095 1.187 1.00 0.00 H new ATOM 0 HA TYR A 37 10.883 1.969 1.438 1.00 0.00 H new ATOM 0 HB2 TYR A 37 8.425 1.340 -0.198 1.00 0.00 H new ATOM 0 HB3 TYR A 37 9.906 0.408 -0.294 1.00 0.00 H new ATOM 0 HD1 TYR A 37 10.712 0.409 2.686 1.00 0.00 H new ATOM 0 HD2 TYR A 37 6.941 -0.230 0.742 1.00 0.00 H new ATOM 0 HE1 TYR A 37 9.887 -0.797 4.684 1.00 0.00 H new ATOM 0 HE2 TYR A 37 6.133 -1.525 2.695 1.00 0.00 H new ATOM 0 HH TYR A 37 6.561 -2.080 4.892 1.00 0.00 H new ATOM 628 N GLN A 38 10.499 3.892 -1.132 1.00 0.00 N ATOM 629 CA GLN A 38 11.292 4.515 -2.187 1.00 0.00 C ATOM 630 C GLN A 38 12.455 5.251 -1.525 1.00 0.00 C ATOM 631 O GLN A 38 13.592 5.133 -1.981 1.00 0.00 O ATOM 632 CB GLN A 38 10.441 5.495 -3.017 1.00 0.00 C ATOM 633 CG GLN A 38 11.222 6.242 -4.103 1.00 0.00 C ATOM 634 CD GLN A 38 11.726 5.350 -5.232 1.00 0.00 C ATOM 635 OE1 GLN A 38 11.526 4.135 -5.269 1.00 0.00 O ATOM 636 NE2 GLN A 38 12.482 5.944 -6.138 1.00 0.00 N ATOM 0 H GLN A 38 9.570 4.296 -1.016 1.00 0.00 H new ATOM 0 HA GLN A 38 11.662 3.750 -2.870 1.00 0.00 H new ATOM 0 HB2 GLN A 38 9.626 4.944 -3.486 1.00 0.00 H new ATOM 0 HB3 GLN A 38 9.988 6.224 -2.345 1.00 0.00 H new ATOM 0 HG2 GLN A 38 10.584 7.019 -4.525 1.00 0.00 H new ATOM 0 HG3 GLN A 38 12.073 6.744 -3.643 1.00 0.00 H new ATOM 0 HE21 GLN A 38 12.637 6.951 -6.092 1.00 0.00 H new ATOM 0 HE22 GLN A 38 12.911 5.396 -6.883 1.00 0.00 H new ATOM 645 N SER A 39 12.180 5.977 -0.439 1.00 0.00 N ATOM 646 CA SER A 39 13.155 6.728 0.333 1.00 0.00 C ATOM 647 C SER A 39 14.225 5.774 0.852 1.00 0.00 C ATOM 648 O SER A 39 15.398 6.126 0.872 1.00 0.00 O ATOM 649 CB SER A 39 12.413 7.454 1.466 1.00 0.00 C ATOM 650 OG SER A 39 13.135 8.578 1.889 1.00 0.00 O ATOM 0 H SER A 39 11.235 6.057 -0.065 1.00 0.00 H new ATOM 0 HA SER A 39 13.660 7.477 -0.277 1.00 0.00 H new ATOM 0 HB2 SER A 39 11.424 7.758 1.123 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.264 6.774 2.305 1.00 0.00 H new ATOM 0 HG SER A 39 12.647 9.028 2.609 1.00 0.00 H new ATOM 656 N LYS A 40 13.835 4.558 1.247 1.00 0.00 N ATOM 657 CA LYS A 40 14.742 3.527 1.744 1.00 0.00 C ATOM 658 C LYS A 40 15.517 2.911 0.577 1.00 0.00 C ATOM 659 O LYS A 40 16.686 2.569 0.733 1.00 0.00 O ATOM 660 CB LYS A 40 13.941 2.500 2.567 1.00 0.00 C ATOM 661 CG LYS A 40 13.407 3.168 3.851 1.00 0.00 C ATOM 662 CD LYS A 40 12.130 2.553 4.434 1.00 0.00 C ATOM 663 CE LYS A 40 12.291 1.173 5.056 1.00 0.00 C ATOM 664 NZ LYS A 40 13.171 1.180 6.236 1.00 0.00 N ATOM 0 H LYS A 40 12.860 4.260 1.229 1.00 0.00 H new ATOM 0 HA LYS A 40 15.489 3.954 2.413 1.00 0.00 H new ATOM 0 HB2 LYS A 40 13.112 2.112 1.975 1.00 0.00 H new ATOM 0 HB3 LYS A 40 14.575 1.651 2.823 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.187 3.129 4.611 1.00 0.00 H new ATOM 0 HG3 LYS A 40 13.219 4.221 3.640 1.00 0.00 H new ATOM 0 HD2 LYS A 40 11.735 3.230 5.192 1.00 0.00 H new ATOM 0 HD3 LYS A 40 11.384 2.490 3.642 1.00 0.00 H new ATOM 0 HE2 LYS A 40 11.311 0.791 5.341 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.695 0.488 4.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.165 0.239 6.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 14.140 1.420 5.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.830 1.886 6.919 1.00 0.00 H new ATOM 678 N ARG A 41 14.902 2.767 -0.604 1.00 0.00 N ATOM 679 CA ARG A 41 15.544 2.209 -1.796 1.00 0.00 C ATOM 680 C ARG A 41 16.588 3.174 -2.344 1.00 0.00 C ATOM 681 O ARG A 41 17.647 2.721 -2.756 1.00 0.00 O ATOM 682 CB ARG A 41 14.500 1.922 -2.899 1.00 0.00 C ATOM 683 CG ARG A 41 15.105 1.197 -4.126 1.00 0.00 C ATOM 684 CD ARG A 41 14.367 1.455 -5.449 1.00 0.00 C ATOM 685 NE ARG A 41 13.520 0.321 -5.844 1.00 0.00 N ATOM 686 CZ ARG A 41 12.219 0.330 -6.134 1.00 0.00 C ATOM 687 NH1 ARG A 41 11.501 1.451 -6.105 1.00 0.00 N ATOM 688 NH2 ARG A 41 11.622 -0.805 -6.458 1.00 0.00 N ATOM 0 H ARG A 41 13.931 3.039 -0.758 1.00 0.00 H new ATOM 0 HA ARG A 41 16.027 1.276 -1.504 1.00 0.00 H new ATOM 0 HB2 ARG A 41 13.697 1.313 -2.483 1.00 0.00 H new ATOM 0 HB3 ARG A 41 14.053 2.862 -3.223 1.00 0.00 H new ATOM 0 HG2 ARG A 41 16.144 1.506 -4.238 1.00 0.00 H new ATOM 0 HG3 ARG A 41 15.111 0.125 -3.931 1.00 0.00 H new ATOM 0 HD2 ARG A 41 13.751 2.349 -5.351 1.00 0.00 H new ATOM 0 HD3 ARG A 41 15.095 1.654 -6.236 1.00 0.00 H new ATOM 0 HE ARG A 41 13.985 -0.585 -5.904 1.00 0.00 H new ATOM 0 HH11 ARG A 41 11.945 2.335 -5.856 1.00 0.00 H new ATOM 0 HH12 ARG A 41 10.507 1.426 -6.332 1.00 0.00 H new ATOM 0 HH21 ARG A 41 12.157 -1.673 -6.484 1.00 0.00 H new ATOM 0 HH22 ARG A 41 10.627 -0.812 -6.682 1.00 0.00 H new ATOM 702 N GLN A 42 16.319 4.477 -2.334 1.00 0.00 N ATOM 703 CA GLN A 42 17.209 5.497 -2.871 1.00 0.00 C ATOM 704 C GLN A 42 18.666 5.360 -2.390 1.00 0.00 C ATOM 705 O GLN A 42 19.517 5.190 -3.254 1.00 0.00 O ATOM 706 CB GLN A 42 16.561 6.895 -2.794 1.00 0.00 C ATOM 707 CG GLN A 42 16.766 7.702 -4.086 1.00 0.00 C ATOM 708 CD GLN A 42 18.183 8.214 -4.323 1.00 0.00 C ATOM 709 OE1 GLN A 42 18.503 9.328 -3.925 1.00 0.00 O ATOM 710 NE2 GLN A 42 19.015 7.477 -5.044 1.00 0.00 N ATOM 0 H GLN A 42 15.458 4.859 -1.944 1.00 0.00 H new ATOM 0 HA GLN A 42 17.334 5.326 -3.940 1.00 0.00 H new ATOM 0 HB2 GLN A 42 15.494 6.789 -2.600 1.00 0.00 H new ATOM 0 HB3 GLN A 42 16.985 7.444 -1.953 1.00 0.00 H new ATOM 0 HG2 GLN A 42 16.477 7.079 -4.932 1.00 0.00 H new ATOM 0 HG3 GLN A 42 16.088 8.555 -4.072 1.00 0.00 H new ATOM 0 HE21 GLN A 42 18.729 6.552 -5.366 1.00 0.00 H new ATOM 0 HE22 GLN A 42 19.941 7.834 -5.277 1.00 0.00 H new ATOM 719 N PRO A 43 19.006 5.340 -1.092 1.00 0.00 N ATOM 720 CA PRO A 43 20.393 5.186 -0.664 1.00 0.00 C ATOM 721 C PRO A 43 20.955 3.818 -1.083 1.00 0.00 C ATOM 722 O PRO A 43 22.155 3.709 -1.321 1.00 0.00 O ATOM 723 CB PRO A 43 20.391 5.379 0.853 1.00 0.00 C ATOM 724 CG PRO A 43 18.954 5.058 1.253 1.00 0.00 C ATOM 725 CD PRO A 43 18.148 5.525 0.051 1.00 0.00 C ATOM 0 HA PRO A 43 21.045 5.919 -1.139 1.00 0.00 H new ATOM 0 HB2 PRO A 43 21.102 4.714 1.343 1.00 0.00 H new ATOM 0 HB3 PRO A 43 20.666 6.397 1.128 1.00 0.00 H new ATOM 0 HG2 PRO A 43 18.816 3.993 1.441 1.00 0.00 H new ATOM 0 HG3 PRO A 43 18.662 5.583 2.163 1.00 0.00 H new ATOM 0 HD2 PRO A 43 17.229 4.948 -0.052 1.00 0.00 H new ATOM 0 HD3 PRO A 43 17.858 6.570 0.157 1.00 0.00 H new ATOM 733 N ILE A 44 20.117 2.775 -1.179 1.00 0.00 N ATOM 734 CA ILE A 44 20.543 1.442 -1.591 1.00 0.00 C ATOM 735 C ILE A 44 20.969 1.497 -3.066 1.00 0.00 C ATOM 736 O ILE A 44 22.065 1.049 -3.399 1.00 0.00 O ATOM 737 CB ILE A 44 19.445 0.370 -1.325 1.00 0.00 C ATOM 738 CG1 ILE A 44 18.998 0.240 0.152 1.00 0.00 C ATOM 739 CG2 ILE A 44 20.015 -0.992 -1.734 1.00 0.00 C ATOM 740 CD1 ILE A 44 17.681 -0.515 0.388 1.00 0.00 C ATOM 0 H ILE A 44 19.121 2.840 -0.970 1.00 0.00 H new ATOM 0 HA ILE A 44 21.397 1.132 -0.989 1.00 0.00 H new ATOM 0 HB ILE A 44 18.572 0.685 -1.896 1.00 0.00 H new ATOM 0 HG12 ILE A 44 19.788 -0.264 0.708 1.00 0.00 H new ATOM 0 HG13 ILE A 44 18.901 1.241 0.572 1.00 0.00 H new ATOM 0 HG21 ILE A 44 19.268 -1.766 -1.559 1.00 0.00 H new ATOM 0 HG22 ILE A 44 20.278 -0.974 -2.792 1.00 0.00 H new ATOM 0 HG23 ILE A 44 20.905 -1.206 -1.142 1.00 0.00 H new ATOM 0 HD11 ILE A 44 17.465 -0.546 1.456 1.00 0.00 H new ATOM 0 HD12 ILE A 44 16.870 -0.004 -0.131 1.00 0.00 H new ATOM 0 HD13 ILE A 44 17.771 -1.532 0.007 1.00 0.00 H new ATOM 752 N LEU A 45 20.107 2.005 -3.952 1.00 0.00 N ATOM 753 CA LEU A 45 20.420 2.104 -5.377 1.00 0.00 C ATOM 754 C LEU A 45 21.608 3.023 -5.584 1.00 0.00 C ATOM 755 O LEU A 45 22.483 2.744 -6.393 1.00 0.00 O ATOM 756 CB LEU A 45 19.200 2.484 -6.234 1.00 0.00 C ATOM 757 CG LEU A 45 18.853 3.973 -6.384 1.00 0.00 C ATOM 758 CD1 LEU A 45 19.627 4.715 -7.483 1.00 0.00 C ATOM 759 CD2 LEU A 45 17.356 4.125 -6.670 1.00 0.00 C ATOM 0 H LEU A 45 19.182 2.355 -3.703 1.00 0.00 H new ATOM 0 HA LEU A 45 20.702 1.113 -5.732 1.00 0.00 H new ATOM 0 HB2 LEU A 45 19.355 2.076 -7.233 1.00 0.00 H new ATOM 0 HB3 LEU A 45 18.329 1.980 -5.815 1.00 0.00 H new ATOM 0 HG LEU A 45 19.144 4.428 -5.437 1.00 0.00 H new ATOM 0 HD11 LEU A 45 19.311 5.758 -7.510 1.00 0.00 H new ATOM 0 HD12 LEU A 45 20.695 4.664 -7.273 1.00 0.00 H new ATOM 0 HD13 LEU A 45 19.425 4.250 -8.448 1.00 0.00 H new ATOM 0 HD21 LEU A 45 17.111 5.182 -6.776 1.00 0.00 H new ATOM 0 HD22 LEU A 45 17.107 3.600 -7.592 1.00 0.00 H new ATOM 0 HD23 LEU A 45 16.783 3.701 -5.845 1.00 0.00 H new ATOM 771 N ASP A 46 21.659 4.106 -4.822 1.00 0.00 N ATOM 772 CA ASP A 46 22.745 5.060 -4.917 1.00 0.00 C ATOM 773 C ASP A 46 24.071 4.383 -4.571 1.00 0.00 C ATOM 774 O ASP A 46 25.065 4.561 -5.269 1.00 0.00 O ATOM 775 CB ASP A 46 22.457 6.209 -3.960 1.00 0.00 C ATOM 776 CG ASP A 46 23.621 7.177 -3.975 1.00 0.00 C ATOM 777 OD1 ASP A 46 23.671 7.991 -4.926 1.00 0.00 O ATOM 778 OD2 ASP A 46 24.447 7.093 -3.044 1.00 0.00 O ATOM 0 H ASP A 46 20.952 4.344 -4.126 1.00 0.00 H new ATOM 0 HA ASP A 46 22.824 5.443 -5.934 1.00 0.00 H new ATOM 0 HB2 ASP A 46 21.540 6.720 -4.253 1.00 0.00 H new ATOM 0 HB3 ASP A 46 22.300 5.827 -2.951 1.00 0.00 H new ATOM 783 N ALA A 47 24.065 3.559 -3.520 1.00 0.00 N ATOM 784 CA ALA A 47 25.239 2.850 -3.050 1.00 0.00 C ATOM 785 C ALA A 47 25.791 1.887 -4.101 1.00 0.00 C ATOM 786 O ALA A 47 26.989 1.908 -4.334 1.00 0.00 O ATOM 787 CB ALA A 47 24.925 2.134 -1.734 1.00 0.00 C ATOM 0 H ALA A 47 23.228 3.369 -2.969 1.00 0.00 H new ATOM 0 HA ALA A 47 26.025 3.582 -2.867 1.00 0.00 H new ATOM 0 HB1 ALA A 47 25.812 1.604 -1.388 1.00 0.00 H new ATOM 0 HB2 ALA A 47 24.624 2.866 -0.984 1.00 0.00 H new ATOM 0 HB3 ALA A 47 24.115 1.422 -1.892 1.00 0.00 H new ATOM 793 N ILE A 48 24.980 1.044 -4.745 1.00 0.00 N ATOM 794 CA ILE A 48 25.484 0.108 -5.764 1.00 0.00 C ATOM 795 C ILE A 48 26.018 0.831 -7.000 1.00 0.00 C ATOM 796 O ILE A 48 26.931 0.335 -7.662 1.00 0.00 O ATOM 797 CB ILE A 48 24.426 -0.945 -6.132 1.00 0.00 C ATOM 798 CG1 ILE A 48 24.995 -2.084 -6.994 1.00 0.00 C ATOM 799 CG2 ILE A 48 23.179 -0.305 -6.736 1.00 0.00 C ATOM 800 CD1 ILE A 48 24.068 -3.311 -7.034 1.00 0.00 C ATOM 0 H ILE A 48 23.975 0.987 -4.583 1.00 0.00 H new ATOM 0 HA ILE A 48 26.330 -0.418 -5.322 1.00 0.00 H new ATOM 0 HB ILE A 48 24.113 -1.417 -5.201 1.00 0.00 H new ATOM 0 HG12 ILE A 48 25.157 -1.721 -8.009 1.00 0.00 H new ATOM 0 HG13 ILE A 48 25.968 -2.380 -6.603 1.00 0.00 H new ATOM 0 HG21 ILE A 48 22.455 -1.081 -6.983 1.00 0.00 H new ATOM 0 HG22 ILE A 48 22.739 0.386 -6.016 1.00 0.00 H new ATOM 0 HG23 ILE A 48 23.451 0.238 -7.641 1.00 0.00 H new ATOM 0 HD11 ILE A 48 24.517 -4.086 -7.656 1.00 0.00 H new ATOM 0 HD12 ILE A 48 23.927 -3.694 -6.023 1.00 0.00 H new ATOM 0 HD13 ILE A 48 23.103 -3.024 -7.451 1.00 0.00 H new ATOM 812 N GLU A 49 25.412 1.962 -7.350 1.00 0.00 N ATOM 813 CA GLU A 49 25.830 2.741 -8.501 1.00 0.00 C ATOM 814 C GLU A 49 27.098 3.545 -8.184 1.00 0.00 C ATOM 815 O GLU A 49 27.830 3.931 -9.097 1.00 0.00 O ATOM 816 CB GLU A 49 24.709 3.715 -8.872 1.00 0.00 C ATOM 817 CG GLU A 49 23.449 3.044 -9.456 1.00 0.00 C ATOM 818 CD GLU A 49 23.689 2.224 -10.724 1.00 0.00 C ATOM 819 OE1 GLU A 49 24.593 2.536 -11.523 1.00 0.00 O ATOM 820 OE2 GLU A 49 22.932 1.253 -10.973 1.00 0.00 O ATOM 0 H GLU A 49 24.621 2.359 -6.843 1.00 0.00 H new ATOM 0 HA GLU A 49 26.042 2.061 -9.326 1.00 0.00 H new ATOM 0 HB2 GLU A 49 24.426 4.280 -7.984 1.00 0.00 H new ATOM 0 HB3 GLU A 49 25.093 4.433 -9.597 1.00 0.00 H new ATOM 0 HG2 GLU A 49 23.015 2.394 -8.696 1.00 0.00 H new ATOM 0 HG3 GLU A 49 22.711 3.816 -9.674 1.00 0.00 H new ATOM 827 N ALA A 50 27.372 3.832 -6.909 1.00 0.00 N ATOM 828 CA ALA A 50 28.528 4.606 -6.478 1.00 0.00 C ATOM 829 C ALA A 50 29.727 3.746 -6.082 1.00 0.00 C ATOM 830 O ALA A 50 30.816 4.006 -6.589 1.00 0.00 O ATOM 831 CB ALA A 50 28.127 5.506 -5.295 1.00 0.00 C ATOM 0 H ALA A 50 26.782 3.525 -6.136 1.00 0.00 H new ATOM 0 HA ALA A 50 28.843 5.202 -7.334 1.00 0.00 H new ATOM 0 HB1 ALA A 50 28.991 6.086 -4.970 1.00 0.00 H new ATOM 0 HB2 ALA A 50 27.331 6.183 -5.606 1.00 0.00 H new ATOM 0 HB3 ALA A 50 27.775 4.887 -4.470 1.00 0.00 H new ATOM 890 N TYR B 104 20.454 3.629 6.856 1.00 0.00 N ATOM 891 CA TYR B 104 20.696 3.222 5.492 1.00 0.00 C ATOM 892 C TYR B 104 21.704 4.160 4.839 1.00 0.00 C ATOM 893 O TYR B 104 21.983 4.068 3.653 1.00 0.00 O ATOM 894 CB TYR B 104 19.376 3.011 4.745 1.00 0.00 C ATOM 895 CG TYR B 104 18.376 2.106 5.457 1.00 0.00 C ATOM 896 CD1 TYR B 104 18.567 0.712 5.461 1.00 0.00 C ATOM 897 CD2 TYR B 104 17.297 2.651 6.180 1.00 0.00 C ATOM 898 CE1 TYR B 104 17.739 -0.124 6.230 1.00 0.00 C ATOM 899 CE2 TYR B 104 16.469 1.825 6.963 1.00 0.00 C ATOM 900 CZ TYR B 104 16.703 0.431 7.012 1.00 0.00 C ATOM 901 OH TYR B 104 15.926 -0.388 7.779 1.00 0.00 O ATOM 0 HA TYR B 104 21.171 2.242 5.455 1.00 0.00 H new ATOM 0 HB2 TYR B 104 18.910 3.982 4.577 1.00 0.00 H new ATOM 0 HB3 TYR B 104 19.593 2.588 3.764 1.00 0.00 H new ATOM 0 HD1 TYR B 104 19.358 0.280 4.867 1.00 0.00 H new ATOM 0 HD2 TYR B 104 17.103 3.712 6.133 1.00 0.00 H new ATOM 0 HE1 TYR B 104 17.896 -1.193 6.223 1.00 0.00 H new ATOM 0 HE2 TYR B 104 15.655 2.256 7.527 1.00 0.00 H new ATOM 0 HH TYR B 104 15.259 0.148 8.258 1.00 0.00 H new ATOM 911 N GLU B 105 22.331 5.001 5.657 1.00 0.00 N ATOM 912 CA GLU B 105 23.292 5.989 5.234 1.00 0.00 C ATOM 913 C GLU B 105 24.684 5.382 5.035 1.00 0.00 C ATOM 914 O GLU B 105 25.455 5.789 4.169 1.00 0.00 O ATOM 915 CB GLU B 105 23.290 7.155 6.245 1.00 0.00 C ATOM 916 CG GLU B 105 21.851 7.507 6.668 1.00 0.00 C ATOM 917 CD GLU B 105 21.668 8.847 7.361 1.00 0.00 C ATOM 918 OE1 GLU B 105 22.363 9.137 8.359 1.00 0.00 O ATOM 919 OE2 GLU B 105 20.684 9.537 6.992 1.00 0.00 O ATOM 0 H GLU B 105 22.172 5.005 6.664 1.00 0.00 H new ATOM 0 HA GLU B 105 23.004 6.378 4.257 1.00 0.00 H new ATOM 0 HB2 GLU B 105 23.876 6.883 7.123 1.00 0.00 H new ATOM 0 HB3 GLU B 105 23.768 8.028 5.801 1.00 0.00 H new ATOM 0 HG2 GLU B 105 21.218 7.490 5.780 1.00 0.00 H new ATOM 0 HG3 GLU B 105 21.487 6.724 7.333 1.00 0.00 H new ATOM 926 N PHE B 106 25.002 4.365 5.834 1.00 0.00 N ATOM 927 CA PHE B 106 26.264 3.641 5.821 1.00 0.00 C ATOM 928 C PHE B 106 26.354 2.697 4.624 1.00 0.00 C ATOM 929 O PHE B 106 27.404 2.104 4.389 1.00 0.00 O ATOM 930 CB PHE B 106 26.408 2.854 7.126 1.00 0.00 C ATOM 931 CG PHE B 106 26.312 3.681 8.393 1.00 0.00 C ATOM 932 CD1 PHE B 106 27.330 4.603 8.697 1.00 0.00 C ATOM 933 CD2 PHE B 106 25.255 3.485 9.303 1.00 0.00 C ATOM 934 CE1 PHE B 106 27.309 5.304 9.914 1.00 0.00 C ATOM 935 CE2 PHE B 106 25.235 4.188 10.522 1.00 0.00 C ATOM 936 CZ PHE B 106 26.265 5.094 10.831 1.00 0.00 C ATOM 0 H PHE B 106 24.355 4.010 6.538 1.00 0.00 H new ATOM 0 HA PHE B 106 27.076 4.363 5.733 1.00 0.00 H new ATOM 0 HB2 PHE B 106 25.637 2.084 7.154 1.00 0.00 H new ATOM 0 HB3 PHE B 106 27.370 2.341 7.118 1.00 0.00 H new ATOM 0 HD1 PHE B 106 28.131 4.772 7.992 1.00 0.00 H new ATOM 0 HD2 PHE B 106 24.459 2.795 9.065 1.00 0.00 H new ATOM 0 HE1 PHE B 106 28.097 6.006 10.145 1.00 0.00 H new ATOM 0 HE2 PHE B 106 24.427 4.031 11.221 1.00 0.00 H new ATOM 0 HZ PHE B 106 26.254 5.627 11.770 1.00 0.00 H new ATOM 946 N LEU B 107 25.267 2.552 3.853 1.00 0.00 N ATOM 947 CA LEU B 107 25.228 1.690 2.679 1.00 0.00 C ATOM 948 C LEU B 107 26.330 2.051 1.694 1.00 0.00 C ATOM 949 O LEU B 107 26.765 1.173 0.957 1.00 0.00 O ATOM 950 CB LEU B 107 23.868 1.769 1.980 1.00 0.00 C ATOM 951 CG LEU B 107 22.737 1.091 2.767 1.00 0.00 C ATOM 952 CD1 LEU B 107 21.433 1.317 2.021 1.00 0.00 C ATOM 953 CD2 LEU B 107 22.944 -0.421 2.901 1.00 0.00 C ATOM 0 H LEU B 107 24.388 3.036 4.034 1.00 0.00 H new ATOM 0 HA LEU B 107 25.387 0.669 3.025 1.00 0.00 H new ATOM 0 HB2 LEU B 107 23.611 2.816 1.819 1.00 0.00 H new ATOM 0 HB3 LEU B 107 23.946 1.305 0.997 1.00 0.00 H new ATOM 0 HG LEU B 107 22.723 1.524 3.767 1.00 0.00 H new ATOM 0 HD11 LEU B 107 20.616 0.842 2.564 1.00 0.00 H new ATOM 0 HD12 LEU B 107 21.241 2.387 1.939 1.00 0.00 H new ATOM 0 HD13 LEU B 107 21.505 0.884 1.023 1.00 0.00 H new ATOM 0 HD21 LEU B 107 22.117 -0.853 3.465 1.00 0.00 H new ATOM 0 HD22 LEU B 107 22.981 -0.872 1.910 1.00 0.00 H new ATOM 0 HD23 LEU B 107 23.881 -0.615 3.424 1.00 0.00 H new ATOM 965 N LYS B 108 26.804 3.304 1.699 1.00 0.00 N ATOM 966 CA LYS B 108 27.886 3.723 0.798 1.00 0.00 C ATOM 967 C LYS B 108 29.186 2.949 1.062 1.00 0.00 C ATOM 968 O LYS B 108 30.081 2.976 0.223 1.00 0.00 O ATOM 969 CB LYS B 108 28.135 5.235 0.908 1.00 0.00 C ATOM 970 CG LYS B 108 27.034 6.029 0.198 1.00 0.00 C ATOM 971 CD LYS B 108 27.373 7.523 0.129 1.00 0.00 C ATOM 972 CE LYS B 108 26.394 8.271 -0.782 1.00 0.00 C ATOM 973 NZ LYS B 108 26.778 8.162 -2.202 1.00 0.00 N ATOM 0 H LYS B 108 26.458 4.041 2.313 1.00 0.00 H new ATOM 0 HA LYS B 108 27.564 3.492 -0.217 1.00 0.00 H new ATOM 0 HB2 LYS B 108 28.177 5.524 1.958 1.00 0.00 H new ATOM 0 HB3 LYS B 108 29.103 5.480 0.471 1.00 0.00 H new ATOM 0 HG2 LYS B 108 26.896 5.639 -0.811 1.00 0.00 H new ATOM 0 HG3 LYS B 108 26.089 5.893 0.724 1.00 0.00 H new ATOM 0 HD2 LYS B 108 27.343 7.952 1.130 1.00 0.00 H new ATOM 0 HD3 LYS B 108 28.390 7.651 -0.242 1.00 0.00 H new ATOM 0 HE2 LYS B 108 25.390 7.870 -0.645 1.00 0.00 H new ATOM 0 HE3 LYS B 108 26.359 9.322 -0.494 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 26.769 9.106 -2.638 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 27.733 7.757 -2.273 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 26.103 7.545 -2.698 1.00 0.00 H new ATOM 987 N SER B 109 29.297 2.268 2.203 1.00 0.00 N ATOM 988 CA SER B 109 30.448 1.479 2.602 1.00 0.00 C ATOM 989 C SER B 109 30.086 -0.010 2.727 1.00 0.00 C ATOM 990 O SER B 109 30.910 -0.775 3.232 1.00 0.00 O ATOM 991 CB SER B 109 30.982 2.058 3.921 1.00 0.00 C ATOM 992 OG SER B 109 32.227 1.492 4.268 1.00 0.00 O ATOM 0 H SER B 109 28.552 2.255 2.899 1.00 0.00 H new ATOM 0 HA SER B 109 31.227 1.534 1.841 1.00 0.00 H new ATOM 0 HB2 SER B 109 31.086 3.139 3.829 1.00 0.00 H new ATOM 0 HB3 SER B 109 30.262 1.873 4.718 1.00 0.00 H new ATOM 0 HG SER B 109 32.231 0.541 4.032 1.00 0.00 H new ATOM 998 N TRP B 110 28.856 -0.427 2.400 1.00 0.00 N ATOM 999 CA TRP B 110 28.457 -1.827 2.487 1.00 0.00 C ATOM 1000 C TRP B 110 28.848 -2.536 1.192 1.00 0.00 C ATOM 1001 O TRP B 110 28.995 -1.917 0.138 1.00 0.00 O ATOM 1002 CB TRP B 110 26.937 -1.963 2.690 1.00 0.00 C ATOM 1003 CG TRP B 110 26.381 -1.982 4.089 1.00 0.00 C ATOM 1004 CD1 TRP B 110 25.218 -2.593 4.409 1.00 0.00 C ATOM 1005 CD2 TRP B 110 26.865 -1.388 5.343 1.00 0.00 C ATOM 1006 NE1 TRP B 110 24.929 -2.395 5.740 1.00 0.00 N ATOM 1007 CE2 TRP B 110 25.901 -1.651 6.364 1.00 0.00 C ATOM 1008 CE3 TRP B 110 28.000 -0.650 5.744 1.00 0.00 C ATOM 1009 CZ2 TRP B 110 26.033 -1.180 7.678 1.00 0.00 C ATOM 1010 CZ3 TRP B 110 28.145 -0.165 7.056 1.00 0.00 C ATOM 1011 CH2 TRP B 110 27.152 -0.411 8.020 1.00 0.00 C ATOM 0 H TRP B 110 28.118 0.196 2.071 1.00 0.00 H new ATOM 0 HA TRP B 110 28.962 -2.276 3.342 1.00 0.00 H new ATOM 0 HB2 TRP B 110 26.460 -1.139 2.159 1.00 0.00 H new ATOM 0 HB3 TRP B 110 26.622 -2.884 2.199 1.00 0.00 H new ATOM 0 HD1 TRP B 110 24.605 -3.155 3.720 1.00 0.00 H new ATOM 0 HE1 TRP B 110 24.096 -2.756 6.206 1.00 0.00 H new ATOM 0 HE3 TRP B 110 28.779 -0.452 5.023 1.00 0.00 H new ATOM 0 HZ2 TRP B 110 25.280 -1.408 8.418 1.00 0.00 H new ATOM 0 HZ3 TRP B 110 29.025 0.400 7.325 1.00 0.00 H new ATOM 0 HH2 TRP B 110 27.251 -0.010 9.018 1.00 0.00 H new ATOM 1022 N THR B 111 29.016 -3.855 1.263 1.00 0.00 N ATOM 1023 CA THR B 111 29.350 -4.627 0.075 1.00 0.00 C ATOM 1024 C THR B 111 28.123 -4.661 -0.838 1.00 0.00 C ATOM 1025 O THR B 111 26.988 -4.585 -0.351 1.00 0.00 O ATOM 1026 CB THR B 111 29.738 -6.072 0.449 1.00 0.00 C ATOM 1027 OG1 THR B 111 28.853 -6.652 1.394 1.00 0.00 O ATOM 1028 CG2 THR B 111 31.156 -6.158 1.002 1.00 0.00 C ATOM 0 H THR B 111 28.927 -4.402 2.119 1.00 0.00 H new ATOM 0 HA THR B 111 30.198 -4.161 -0.427 1.00 0.00 H new ATOM 0 HB THR B 111 29.673 -6.632 -0.484 1.00 0.00 H new ATOM 0 HG1 THR B 111 29.142 -7.566 1.595 1.00 0.00 H new ATOM 0 HG21 THR B 111 31.387 -7.194 1.252 1.00 0.00 H new ATOM 0 HG22 THR B 111 31.861 -5.800 0.252 1.00 0.00 H new ATOM 0 HG23 THR B 111 31.235 -5.542 1.898 1.00 0.00 H new ATOM 1036 N VAL B 112 28.329 -4.870 -2.145 1.00 0.00 N ATOM 1037 CA VAL B 112 27.214 -4.964 -3.078 1.00 0.00 C ATOM 1038 C VAL B 112 26.246 -6.057 -2.640 1.00 0.00 C ATOM 1039 O VAL B 112 25.048 -5.865 -2.786 1.00 0.00 O ATOM 1040 CB VAL B 112 27.704 -5.247 -4.503 1.00 0.00 C ATOM 1041 CG1 VAL B 112 26.558 -5.373 -5.515 1.00 0.00 C ATOM 1042 CG2 VAL B 112 28.614 -4.105 -4.926 1.00 0.00 C ATOM 0 H VAL B 112 29.250 -4.975 -2.571 1.00 0.00 H new ATOM 0 HA VAL B 112 26.698 -4.004 -3.076 1.00 0.00 H new ATOM 0 HB VAL B 112 28.228 -6.203 -4.493 1.00 0.00 H new ATOM 0 HG11 VAL B 112 26.967 -5.573 -6.505 1.00 0.00 H new ATOM 0 HG12 VAL B 112 25.902 -6.192 -5.221 1.00 0.00 H new ATOM 0 HG13 VAL B 112 25.990 -4.443 -5.539 1.00 0.00 H new ATOM 0 HG21 VAL B 112 28.976 -4.284 -5.938 1.00 0.00 H new ATOM 0 HG22 VAL B 112 28.058 -3.168 -4.900 1.00 0.00 H new ATOM 0 HG23 VAL B 112 29.462 -4.043 -4.243 1.00 0.00 H new ATOM 1052 N GLU B 113 26.708 -7.174 -2.078 1.00 0.00 N ATOM 1053 CA GLU B 113 25.769 -8.206 -1.675 1.00 0.00 C ATOM 1054 C GLU B 113 24.950 -7.725 -0.478 1.00 0.00 C ATOM 1055 O GLU B 113 23.730 -7.873 -0.482 1.00 0.00 O ATOM 1056 CB GLU B 113 26.485 -9.530 -1.384 1.00 0.00 C ATOM 1057 CG GLU B 113 26.930 -10.247 -2.666 1.00 0.00 C ATOM 1058 CD GLU B 113 28.244 -9.699 -3.223 1.00 0.00 C ATOM 1059 OE1 GLU B 113 29.310 -10.221 -2.824 1.00 0.00 O ATOM 1060 OE2 GLU B 113 28.207 -8.785 -4.079 1.00 0.00 O ATOM 0 H GLU B 113 27.691 -7.379 -1.899 1.00 0.00 H new ATOM 0 HA GLU B 113 25.084 -8.398 -2.501 1.00 0.00 H new ATOM 0 HB2 GLU B 113 27.356 -9.339 -0.757 1.00 0.00 H new ATOM 0 HB3 GLU B 113 25.821 -10.183 -0.818 1.00 0.00 H new ATOM 0 HG2 GLU B 113 27.043 -11.312 -2.461 1.00 0.00 H new ATOM 0 HG3 GLU B 113 26.151 -10.148 -3.422 1.00 0.00 H new ATOM 1067 N ASP B 114 25.587 -7.117 0.527 1.00 0.00 N ATOM 1068 CA ASP B 114 24.875 -6.644 1.718 1.00 0.00 C ATOM 1069 C ASP B 114 23.827 -5.608 1.351 1.00 0.00 C ATOM 1070 O ASP B 114 22.717 -5.647 1.888 1.00 0.00 O ATOM 1071 CB ASP B 114 25.823 -6.058 2.774 1.00 0.00 C ATOM 1072 CG ASP B 114 26.418 -7.101 3.720 1.00 0.00 C ATOM 1073 OD1 ASP B 114 26.353 -8.318 3.441 1.00 0.00 O ATOM 1074 OD2 ASP B 114 26.953 -6.695 4.773 1.00 0.00 O ATOM 0 H ASP B 114 26.592 -6.941 0.540 1.00 0.00 H new ATOM 0 HA ASP B 114 24.388 -7.518 2.150 1.00 0.00 H new ATOM 0 HB2 ASP B 114 26.635 -5.535 2.269 1.00 0.00 H new ATOM 0 HB3 ASP B 114 25.282 -5.316 3.361 1.00 0.00 H new ATOM 1079 N LEU B 115 24.160 -4.667 0.464 1.00 0.00 N ATOM 1080 CA LEU B 115 23.214 -3.642 0.046 1.00 0.00 C ATOM 1081 C LEU B 115 22.171 -4.260 -0.894 1.00 0.00 C ATOM 1082 O LEU B 115 20.985 -3.971 -0.741 1.00 0.00 O ATOM 1083 CB LEU B 115 23.938 -2.404 -0.532 1.00 0.00 C ATOM 1084 CG LEU B 115 24.358 -2.527 -2.008 1.00 0.00 C ATOM 1085 CD1 LEU B 115 23.209 -2.196 -2.966 1.00 0.00 C ATOM 1086 CD2 LEU B 115 25.559 -1.643 -2.337 1.00 0.00 C ATOM 0 H LEU B 115 25.078 -4.598 0.025 1.00 0.00 H new ATOM 0 HA LEU B 115 22.672 -3.263 0.912 1.00 0.00 H new ATOM 0 HB2 LEU B 115 23.285 -1.538 -0.427 1.00 0.00 H new ATOM 0 HB3 LEU B 115 24.827 -2.208 0.068 1.00 0.00 H new ATOM 0 HG LEU B 115 24.640 -3.570 -2.149 1.00 0.00 H new ATOM 0 HD11 LEU B 115 23.553 -2.297 -3.995 1.00 0.00 H new ATOM 0 HD12 LEU B 115 22.381 -2.883 -2.792 1.00 0.00 H new ATOM 0 HD13 LEU B 115 22.875 -1.173 -2.794 1.00 0.00 H new ATOM 0 HD21 LEU B 115 25.821 -1.761 -3.388 1.00 0.00 H new ATOM 0 HD22 LEU B 115 25.308 -0.601 -2.141 1.00 0.00 H new ATOM 0 HD23 LEU B 115 26.407 -1.935 -1.717 1.00 0.00 H new ATOM 1098 N GLN B 116 22.562 -5.129 -1.836 1.00 0.00 N ATOM 1099 CA GLN B 116 21.643 -5.752 -2.783 1.00 0.00 C ATOM 1100 C GLN B 116 20.596 -6.564 -2.031 1.00 0.00 C ATOM 1101 O GLN B 116 19.432 -6.532 -2.418 1.00 0.00 O ATOM 1102 CB GLN B 116 22.368 -6.596 -3.837 1.00 0.00 C ATOM 1103 CG GLN B 116 21.379 -7.147 -4.874 1.00 0.00 C ATOM 1104 CD GLN B 116 22.095 -7.740 -6.077 1.00 0.00 C ATOM 1105 OE1 GLN B 116 22.179 -8.957 -6.216 1.00 0.00 O ATOM 1106 NE2 GLN B 116 22.606 -6.888 -6.948 1.00 0.00 N ATOM 0 H GLN B 116 23.533 -5.418 -1.959 1.00 0.00 H new ATOM 0 HA GLN B 116 21.140 -4.957 -3.334 1.00 0.00 H new ATOM 0 HB2 GLN B 116 23.124 -5.990 -4.336 1.00 0.00 H new ATOM 0 HB3 GLN B 116 22.890 -7.421 -3.352 1.00 0.00 H new ATOM 0 HG2 GLN B 116 20.754 -7.910 -4.410 1.00 0.00 H new ATOM 0 HG3 GLN B 116 20.715 -6.348 -5.204 1.00 0.00 H new ATOM 0 HE21 GLN B 116 22.513 -5.884 -6.794 1.00 0.00 H new ATOM 0 HE22 GLN B 116 23.093 -7.234 -7.775 1.00 0.00 H new ATOM 1115 N LYS B 117 20.959 -7.262 -0.945 1.00 0.00 N ATOM 1116 CA LYS B 117 19.967 -8.022 -0.180 1.00 0.00 C ATOM 1117 C LYS B 117 18.890 -7.052 0.308 1.00 0.00 C ATOM 1118 O LYS B 117 17.726 -7.428 0.377 1.00 0.00 O ATOM 1119 CB LYS B 117 20.614 -8.833 0.963 1.00 0.00 C ATOM 1120 CG LYS B 117 20.897 -10.295 0.566 1.00 0.00 C ATOM 1121 CD LYS B 117 21.924 -10.448 -0.564 1.00 0.00 C ATOM 1122 CE LYS B 117 22.090 -11.890 -1.044 1.00 0.00 C ATOM 1123 NZ LYS B 117 22.800 -12.746 -0.074 1.00 0.00 N ATOM 0 H LYS B 117 21.912 -7.315 -0.584 1.00 0.00 H new ATOM 0 HA LYS B 117 19.500 -8.770 -0.821 1.00 0.00 H new ATOM 0 HB2 LYS B 117 21.547 -8.354 1.260 1.00 0.00 H new ATOM 0 HB3 LYS B 117 19.956 -8.817 1.832 1.00 0.00 H new ATOM 0 HG2 LYS B 117 21.253 -10.836 1.443 1.00 0.00 H new ATOM 0 HG3 LYS B 117 19.962 -10.765 0.260 1.00 0.00 H new ATOM 0 HD2 LYS B 117 21.622 -9.825 -1.406 1.00 0.00 H new ATOM 0 HD3 LYS B 117 22.889 -10.074 -0.221 1.00 0.00 H new ATOM 0 HE2 LYS B 117 21.106 -12.316 -1.243 1.00 0.00 H new ATOM 0 HE3 LYS B 117 22.635 -11.892 -1.988 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 22.881 -13.710 -0.456 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 23.750 -12.361 0.098 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 22.269 -12.771 0.820 1.00 0.00 H new ATOM 1137 N ARG B 118 19.236 -5.799 0.638 1.00 0.00 N ATOM 1138 CA ARG B 118 18.259 -4.807 1.075 1.00 0.00 C ATOM 1139 C ARG B 118 17.368 -4.449 -0.101 1.00 0.00 C ATOM 1140 O ARG B 118 16.157 -4.442 0.061 1.00 0.00 O ATOM 1141 CB ARG B 118 18.902 -3.493 1.573 1.00 0.00 C ATOM 1142 CG ARG B 118 20.019 -3.585 2.613 1.00 0.00 C ATOM 1143 CD ARG B 118 19.468 -3.759 4.020 1.00 0.00 C ATOM 1144 NE ARG B 118 18.761 -5.041 4.169 1.00 0.00 N ATOM 1145 CZ ARG B 118 17.682 -5.249 4.927 1.00 0.00 C ATOM 1146 NH1 ARG B 118 17.396 -4.419 5.919 1.00 0.00 N ATOM 1147 NH2 ARG B 118 16.894 -6.281 4.664 1.00 0.00 N ATOM 0 H ARG B 118 20.195 -5.453 0.608 1.00 0.00 H new ATOM 0 HA ARG B 118 17.710 -5.255 1.903 1.00 0.00 H new ATOM 0 HB2 ARG B 118 19.298 -2.966 0.705 1.00 0.00 H new ATOM 0 HB3 ARG B 118 18.109 -2.871 1.989 1.00 0.00 H new ATOM 0 HG2 ARG B 118 20.672 -4.424 2.372 1.00 0.00 H new ATOM 0 HG3 ARG B 118 20.630 -2.683 2.571 1.00 0.00 H new ATOM 0 HD2 ARG B 118 20.284 -3.707 4.740 1.00 0.00 H new ATOM 0 HD3 ARG B 118 18.788 -2.939 4.249 1.00 0.00 H new ATOM 0 HE ARG B 118 19.127 -5.839 3.649 1.00 0.00 H new ATOM 0 HH11 ARG B 118 18.001 -3.619 6.105 1.00 0.00 H new ATOM 0 HH12 ARG B 118 16.571 -4.580 6.497 1.00 0.00 H new ATOM 0 HH21 ARG B 118 17.115 -6.907 3.889 1.00 0.00 H new ATOM 0 HH22 ARG B 118 16.067 -6.450 5.236 1.00 0.00 H new ATOM 1161 N LEU B 119 17.965 -4.127 -1.253 1.00 0.00 N ATOM 1162 CA LEU B 119 17.264 -3.729 -2.473 1.00 0.00 C ATOM 1163 C LEU B 119 16.244 -4.778 -2.869 1.00 0.00 C ATOM 1164 O LEU B 119 15.069 -4.471 -3.044 1.00 0.00 O ATOM 1165 CB LEU B 119 18.264 -3.569 -3.637 1.00 0.00 C ATOM 1166 CG LEU B 119 17.595 -3.060 -4.930 1.00 0.00 C ATOM 1167 CD1 LEU B 119 17.498 -1.535 -4.915 1.00 0.00 C ATOM 1168 CD2 LEU B 119 18.379 -3.560 -6.140 1.00 0.00 C ATOM 0 H LEU B 119 18.979 -4.137 -1.363 1.00 0.00 H new ATOM 0 HA LEU B 119 16.763 -2.782 -2.273 1.00 0.00 H new ATOM 0 HB2 LEU B 119 19.051 -2.875 -3.342 1.00 0.00 H new ATOM 0 HB3 LEU B 119 18.743 -4.528 -3.834 1.00 0.00 H new ATOM 0 HG LEU B 119 16.579 -3.451 -4.994 1.00 0.00 H new ATOM 0 HD11 LEU B 119 17.024 -1.192 -5.834 1.00 0.00 H new ATOM 0 HD12 LEU B 119 16.903 -1.217 -4.059 1.00 0.00 H new ATOM 0 HD13 LEU B 119 18.498 -1.108 -4.841 1.00 0.00 H new ATOM 0 HD21 LEU B 119 17.906 -3.200 -7.054 1.00 0.00 H new ATOM 0 HD22 LEU B 119 19.402 -3.187 -6.090 1.00 0.00 H new ATOM 0 HD23 LEU B 119 18.389 -4.650 -6.142 1.00 0.00 H new ATOM 1180 N LEU B 120 16.707 -6.020 -2.956 1.00 0.00 N ATOM 1181 CA LEU B 120 15.892 -7.136 -3.332 1.00 0.00 C ATOM 1182 C LEU B 120 14.789 -7.329 -2.304 1.00 0.00 C ATOM 1183 O LEU B 120 13.641 -7.471 -2.695 1.00 0.00 O ATOM 1184 CB LEU B 120 16.770 -8.389 -3.452 1.00 0.00 C ATOM 1185 CG LEU B 120 15.937 -9.680 -3.506 1.00 0.00 C ATOM 1186 CD1 LEU B 120 15.048 -9.773 -4.753 1.00 0.00 C ATOM 1187 CD2 LEU B 120 16.885 -10.878 -3.478 1.00 0.00 C ATOM 0 H LEU B 120 17.677 -6.269 -2.761 1.00 0.00 H new ATOM 0 HA LEU B 120 15.425 -6.951 -4.299 1.00 0.00 H new ATOM 0 HB2 LEU B 120 17.383 -8.316 -4.351 1.00 0.00 H new ATOM 0 HB3 LEU B 120 17.453 -8.435 -2.604 1.00 0.00 H new ATOM 0 HG LEU B 120 15.273 -9.674 -2.641 1.00 0.00 H new ATOM 0 HD11 LEU B 120 14.486 -10.707 -4.731 1.00 0.00 H new ATOM 0 HD12 LEU B 120 14.354 -8.933 -4.769 1.00 0.00 H new ATOM 0 HD13 LEU B 120 15.671 -9.746 -5.647 1.00 0.00 H new ATOM 0 HD21 LEU B 120 16.306 -11.801 -3.516 1.00 0.00 H new ATOM 0 HD22 LEU B 120 17.553 -10.833 -4.338 1.00 0.00 H new ATOM 0 HD23 LEU B 120 17.473 -10.856 -2.560 1.00 0.00 H new ATOM 1199 N ALA B 121 15.119 -7.352 -1.007 1.00 0.00 N ATOM 1200 CA ALA B 121 14.131 -7.561 0.052 1.00 0.00 C ATOM 1201 C ALA B 121 13.065 -6.467 0.085 1.00 0.00 C ATOM 1202 O ALA B 121 11.945 -6.719 0.525 1.00 0.00 O ATOM 1203 CB ALA B 121 14.830 -7.647 1.414 1.00 0.00 C ATOM 0 H ALA B 121 16.072 -7.227 -0.666 1.00 0.00 H new ATOM 0 HA ALA B 121 13.624 -8.501 -0.166 1.00 0.00 H new ATOM 0 HB1 ALA B 121 14.086 -7.803 2.195 1.00 0.00 H new ATOM 0 HB2 ALA B 121 15.532 -8.480 1.410 1.00 0.00 H new ATOM 0 HB3 ALA B 121 15.369 -6.719 1.606 1.00 0.00 H new ATOM 1209 N LEU B 122 13.410 -5.268 -0.380 1.00 0.00 N ATOM 1210 CA LEU B 122 12.555 -4.083 -0.432 1.00 0.00 C ATOM 1211 C LEU B 122 11.395 -4.268 -1.410 1.00 0.00 C ATOM 1212 O LEU B 122 10.326 -3.677 -1.237 1.00 0.00 O ATOM 1213 CB LEU B 122 13.395 -2.861 -0.878 1.00 0.00 C ATOM 1214 CG LEU B 122 13.370 -1.623 0.027 1.00 0.00 C ATOM 1215 CD1 LEU B 122 11.950 -1.137 0.281 1.00 0.00 C ATOM 1216 CD2 LEU B 122 14.091 -1.863 1.358 1.00 0.00 C ATOM 0 H LEU B 122 14.343 -5.087 -0.750 1.00 0.00 H new ATOM 0 HA LEU B 122 12.144 -3.924 0.565 1.00 0.00 H new ATOM 0 HB2 LEU B 122 14.431 -3.183 -0.981 1.00 0.00 H new ATOM 0 HB3 LEU B 122 13.055 -2.561 -1.869 1.00 0.00 H new ATOM 0 HG LEU B 122 13.909 -0.844 -0.511 1.00 0.00 H new ATOM 0 HD11 LEU B 122 11.976 -0.259 0.926 1.00 0.00 H new ATOM 0 HD12 LEU B 122 11.479 -0.877 -0.667 1.00 0.00 H new ATOM 0 HD13 LEU B 122 11.376 -1.927 0.766 1.00 0.00 H new ATOM 0 HD21 LEU B 122 14.047 -0.958 1.964 1.00 0.00 H new ATOM 0 HD22 LEU B 122 13.607 -2.681 1.891 1.00 0.00 H new ATOM 0 HD23 LEU B 122 15.133 -2.120 1.166 1.00 0.00 H new ATOM 1228 N ASP B 123 11.603 -5.056 -2.462 1.00 0.00 N ATOM 1229 CA ASP B 123 10.602 -5.315 -3.491 1.00 0.00 C ATOM 1230 C ASP B 123 9.431 -6.166 -2.989 1.00 0.00 C ATOM 1231 O ASP B 123 8.306 -5.666 -3.081 1.00 0.00 O ATOM 1232 CB ASP B 123 11.271 -5.819 -4.780 1.00 0.00 C ATOM 1233 CG ASP B 123 11.585 -4.683 -5.768 1.00 0.00 C ATOM 1234 OD1 ASP B 123 11.398 -3.480 -5.449 1.00 0.00 O ATOM 1235 OD2 ASP B 123 11.979 -4.997 -6.912 1.00 0.00 O ATOM 0 H ASP B 123 12.486 -5.540 -2.625 1.00 0.00 H new ATOM 0 HA ASP B 123 10.124 -4.371 -3.751 1.00 0.00 H new ATOM 0 HB2 ASP B 123 12.194 -6.340 -4.526 1.00 0.00 H new ATOM 0 HB3 ASP B 123 10.618 -6.546 -5.263 1.00 0.00 H new ATOM 1240 N PRO B 124 9.603 -7.392 -2.453 1.00 0.00 N ATOM 1241 CA PRO B 124 8.485 -8.178 -1.955 1.00 0.00 C ATOM 1242 C PRO B 124 7.880 -7.523 -0.705 1.00 0.00 C ATOM 1243 O PRO B 124 6.725 -7.809 -0.399 1.00 0.00 O ATOM 1244 CB PRO B 124 9.027 -9.582 -1.677 1.00 0.00 C ATOM 1245 CG PRO B 124 10.503 -9.336 -1.389 1.00 0.00 C ATOM 1246 CD PRO B 124 10.832 -8.133 -2.272 1.00 0.00 C ATOM 0 HA PRO B 124 7.674 -8.233 -2.682 1.00 0.00 H new ATOM 0 HB2 PRO B 124 8.524 -10.047 -0.829 1.00 0.00 H new ATOM 0 HB3 PRO B 124 8.889 -10.243 -2.532 1.00 0.00 H new ATOM 0 HG2 PRO B 124 10.678 -9.122 -0.335 1.00 0.00 H new ATOM 0 HG3 PRO B 124 11.113 -10.202 -1.644 1.00 0.00 H new ATOM 0 HD2 PRO B 124 11.593 -7.509 -1.805 1.00 0.00 H new ATOM 0 HD3 PRO B 124 11.232 -8.458 -3.233 1.00 0.00 H new ATOM 1254 N MET B 125 8.624 -6.665 0.016 1.00 0.00 N ATOM 1255 CA MET B 125 8.114 -5.978 1.202 1.00 0.00 C ATOM 1256 C MET B 125 6.988 -5.055 0.749 1.00 0.00 C ATOM 1257 O MET B 125 5.859 -5.177 1.212 1.00 0.00 O ATOM 1258 CB MET B 125 9.207 -5.119 1.863 1.00 0.00 C ATOM 1259 CG MET B 125 10.219 -5.909 2.694 1.00 0.00 C ATOM 1260 SD MET B 125 9.880 -5.992 4.469 1.00 0.00 S ATOM 1261 CE MET B 125 10.299 -4.293 4.934 1.00 0.00 C ATOM 0 H MET B 125 9.591 -6.433 -0.211 1.00 0.00 H new ATOM 0 HA MET B 125 7.772 -6.718 1.926 1.00 0.00 H new ATOM 0 HB2 MET B 125 9.742 -4.573 1.086 1.00 0.00 H new ATOM 0 HB3 MET B 125 8.730 -4.377 2.504 1.00 0.00 H new ATOM 0 HG2 MET B 125 10.267 -6.926 2.304 1.00 0.00 H new ATOM 0 HG3 MET B 125 11.204 -5.465 2.551 1.00 0.00 H new ATOM 0 HE1 MET B 125 10.843 -4.298 5.878 1.00 0.00 H new ATOM 0 HE2 MET B 125 10.922 -3.847 4.159 1.00 0.00 H new ATOM 0 HE3 MET B 125 9.385 -3.710 5.045 1.00 0.00 H new ATOM 1271 N MET B 126 7.286 -4.144 -0.185 1.00 0.00 N ATOM 1272 CA MET B 126 6.288 -3.214 -0.688 1.00 0.00 C ATOM 1273 C MET B 126 5.196 -3.984 -1.423 1.00 0.00 C ATOM 1274 O MET B 126 4.028 -3.659 -1.265 1.00 0.00 O ATOM 1275 CB MET B 126 6.968 -2.150 -1.557 1.00 0.00 C ATOM 1276 CG MET B 126 5.987 -1.142 -2.158 1.00 0.00 C ATOM 1277 SD MET B 126 6.712 0.281 -3.020 1.00 0.00 S ATOM 1278 CE MET B 126 7.474 -0.563 -4.428 1.00 0.00 C ATOM 0 H MET B 126 8.211 -4.037 -0.602 1.00 0.00 H new ATOM 0 HA MET B 126 5.804 -2.687 0.134 1.00 0.00 H new ATOM 0 HB2 MET B 126 7.704 -1.616 -0.956 1.00 0.00 H new ATOM 0 HB3 MET B 126 7.512 -2.642 -2.363 1.00 0.00 H new ATOM 0 HG2 MET B 126 5.340 -1.671 -2.858 1.00 0.00 H new ATOM 0 HG3 MET B 126 5.350 -0.767 -1.357 1.00 0.00 H new ATOM 0 HE1 MET B 126 7.891 0.176 -5.112 1.00 0.00 H new ATOM 0 HE2 MET B 126 8.269 -1.218 -4.072 1.00 0.00 H new ATOM 0 HE3 MET B 126 6.721 -1.155 -4.948 1.00 0.00 H new ATOM 1288 N GLU B 127 5.548 -5.009 -2.200 1.00 0.00 N ATOM 1289 CA GLU B 127 4.575 -5.802 -2.934 1.00 0.00 C ATOM 1290 C GLU B 127 3.538 -6.409 -1.986 1.00 0.00 C ATOM 1291 O GLU B 127 2.343 -6.247 -2.232 1.00 0.00 O ATOM 1292 CB GLU B 127 5.300 -6.870 -3.757 1.00 0.00 C ATOM 1293 CG GLU B 127 4.380 -7.590 -4.748 1.00 0.00 C ATOM 1294 CD GLU B 127 5.181 -8.369 -5.803 1.00 0.00 C ATOM 1295 OE1 GLU B 127 6.252 -8.932 -5.477 1.00 0.00 O ATOM 1296 OE2 GLU B 127 4.807 -8.331 -6.997 1.00 0.00 O ATOM 0 H GLU B 127 6.514 -5.308 -2.335 1.00 0.00 H new ATOM 0 HA GLU B 127 4.029 -5.158 -3.623 1.00 0.00 H new ATOM 0 HB2 GLU B 127 6.120 -6.405 -4.304 1.00 0.00 H new ATOM 0 HB3 GLU B 127 5.742 -7.603 -3.082 1.00 0.00 H new ATOM 0 HG2 GLU B 127 3.727 -8.275 -4.207 1.00 0.00 H new ATOM 0 HG3 GLU B 127 3.737 -6.862 -5.243 1.00 0.00 H new ATOM 1303 N GLN B 128 3.983 -7.080 -0.918 1.00 0.00 N ATOM 1304 CA GLN B 128 3.109 -7.710 0.059 1.00 0.00 C ATOM 1305 C GLN B 128 2.250 -6.672 0.776 1.00 0.00 C ATOM 1306 O GLN B 128 1.044 -6.871 0.931 1.00 0.00 O ATOM 1307 CB GLN B 128 3.936 -8.534 1.060 1.00 0.00 C ATOM 1308 CG GLN B 128 3.059 -9.296 2.069 1.00 0.00 C ATOM 1309 CD GLN B 128 2.858 -8.552 3.391 1.00 0.00 C ATOM 1310 OE1 GLN B 128 3.693 -8.635 4.287 1.00 0.00 O ATOM 1311 NE2 GLN B 128 1.756 -7.837 3.553 1.00 0.00 N ATOM 0 H GLN B 128 4.975 -7.198 -0.711 1.00 0.00 H new ATOM 0 HA GLN B 128 2.435 -8.386 -0.467 1.00 0.00 H new ATOM 0 HB2 GLN B 128 4.556 -9.245 0.514 1.00 0.00 H new ATOM 0 HB3 GLN B 128 4.611 -7.871 1.600 1.00 0.00 H new ATOM 0 HG2 GLN B 128 2.085 -9.489 1.619 1.00 0.00 H new ATOM 0 HG3 GLN B 128 3.513 -10.266 2.273 1.00 0.00 H new ATOM 0 HE21 GLN B 128 1.071 -7.777 2.799 1.00 0.00 H new ATOM 0 HE22 GLN B 128 1.591 -7.346 4.432 1.00 0.00 H new ATOM 1320 N GLU B 129 2.858 -5.582 1.243 1.00 0.00 N ATOM 1321 CA GLU B 129 2.128 -4.535 1.953 1.00 0.00 C ATOM 1322 C GLU B 129 1.061 -3.916 1.035 1.00 0.00 C ATOM 1323 O GLU B 129 -0.052 -3.637 1.480 1.00 0.00 O ATOM 1324 CB GLU B 129 3.095 -3.471 2.501 1.00 0.00 C ATOM 1325 CG GLU B 129 4.115 -4.011 3.528 1.00 0.00 C ATOM 1326 CD GLU B 129 3.969 -3.380 4.912 1.00 0.00 C ATOM 1327 OE1 GLU B 129 2.904 -3.532 5.549 1.00 0.00 O ATOM 1328 OE2 GLU B 129 4.940 -2.718 5.369 1.00 0.00 O ATOM 0 H GLU B 129 3.857 -5.402 1.141 1.00 0.00 H new ATOM 0 HA GLU B 129 1.617 -4.979 2.808 1.00 0.00 H new ATOM 0 HB2 GLU B 129 3.637 -3.025 1.667 1.00 0.00 H new ATOM 0 HB3 GLU B 129 2.515 -2.674 2.966 1.00 0.00 H new ATOM 0 HG2 GLU B 129 3.997 -5.091 3.614 1.00 0.00 H new ATOM 0 HG3 GLU B 129 5.124 -3.829 3.158 1.00 0.00 H new ATOM 1335 N ILE B 130 1.355 -3.716 -0.256 1.00 0.00 N ATOM 1336 CA ILE B 130 0.400 -3.136 -1.172 1.00 0.00 C ATOM 1337 C ILE B 130 -0.703 -4.151 -1.421 1.00 0.00 C ATOM 1338 O ILE B 130 -1.854 -3.767 -1.242 1.00 0.00 O ATOM 1339 CB ILE B 130 1.074 -2.624 -2.479 1.00 0.00 C ATOM 1340 CG1 ILE B 130 1.454 -1.127 -2.362 1.00 0.00 C ATOM 1341 CG2 ILE B 130 0.186 -2.786 -3.732 1.00 0.00 C ATOM 1342 CD1 ILE B 130 2.509 -0.820 -1.321 1.00 0.00 C ATOM 0 H ILE B 130 2.253 -3.952 -0.678 1.00 0.00 H new ATOM 0 HA ILE B 130 -0.043 -2.245 -0.728 1.00 0.00 H new ATOM 0 HB ILE B 130 1.962 -3.244 -2.600 1.00 0.00 H new ATOM 0 HG12 ILE B 130 1.809 -0.780 -3.332 1.00 0.00 H new ATOM 0 HG13 ILE B 130 0.556 -0.556 -2.128 1.00 0.00 H new ATOM 0 HG21 ILE B 130 0.718 -2.409 -4.606 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -0.050 -3.840 -3.877 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -0.738 -2.223 -3.599 1.00 0.00 H new ATOM 0 HD11 ILE B 130 2.710 0.251 -1.311 1.00 0.00 H new ATOM 0 HD12 ILE B 130 2.153 -1.131 -0.339 1.00 0.00 H new ATOM 0 HD13 ILE B 130 3.425 -1.359 -1.562 1.00 0.00 H new ATOM 1354 N GLU B 131 -0.419 -5.390 -1.843 1.00 0.00 N ATOM 1355 CA GLU B 131 -1.469 -6.367 -2.131 1.00 0.00 C ATOM 1356 C GLU B 131 -2.398 -6.589 -0.952 1.00 0.00 C ATOM 1357 O GLU B 131 -3.609 -6.673 -1.172 1.00 0.00 O ATOM 1358 CB GLU B 131 -0.926 -7.663 -2.731 1.00 0.00 C ATOM 1359 CG GLU B 131 -0.183 -8.559 -1.747 1.00 0.00 C ATOM 1360 CD GLU B 131 0.499 -9.712 -2.468 1.00 0.00 C ATOM 1361 OE1 GLU B 131 1.480 -9.454 -3.201 1.00 0.00 O ATOM 1362 OE2 GLU B 131 0.089 -10.879 -2.280 1.00 0.00 O ATOM 0 H GLU B 131 0.529 -5.736 -1.991 1.00 0.00 H new ATOM 0 HA GLU B 131 -2.089 -5.928 -2.913 1.00 0.00 H new ATOM 0 HB2 GLU B 131 -1.756 -8.226 -3.158 1.00 0.00 H new ATOM 0 HB3 GLU B 131 -0.254 -7.414 -3.552 1.00 0.00 H new ATOM 0 HG2 GLU B 131 0.560 -7.973 -1.206 1.00 0.00 H new ATOM 0 HG3 GLU B 131 -0.881 -8.950 -1.007 1.00 0.00 H new ATOM 1369 N GLU B 132 -1.859 -6.609 0.269 1.00 0.00 N ATOM 1370 CA GLU B 132 -2.666 -6.782 1.459 1.00 0.00 C ATOM 1371 C GLU B 132 -3.661 -5.621 1.487 1.00 0.00 C ATOM 1372 O GLU B 132 -4.858 -5.851 1.650 1.00 0.00 O ATOM 1373 CB GLU B 132 -1.780 -6.852 2.715 1.00 0.00 C ATOM 1374 CG GLU B 132 -2.576 -7.104 4.006 1.00 0.00 C ATOM 1375 CD GLU B 132 -3.199 -8.503 4.065 1.00 0.00 C ATOM 1376 OE1 GLU B 132 -4.343 -8.690 3.579 1.00 0.00 O ATOM 1377 OE2 GLU B 132 -2.573 -9.426 4.640 1.00 0.00 O ATOM 0 H GLU B 132 -0.861 -6.506 0.450 1.00 0.00 H new ATOM 0 HA GLU B 132 -3.212 -7.725 1.444 1.00 0.00 H new ATOM 0 HB2 GLU B 132 -1.044 -7.646 2.589 1.00 0.00 H new ATOM 0 HB3 GLU B 132 -1.227 -5.918 2.814 1.00 0.00 H new ATOM 0 HG2 GLU B 132 -1.917 -6.970 4.864 1.00 0.00 H new ATOM 0 HG3 GLU B 132 -3.366 -6.357 4.090 1.00 0.00 H new ATOM 1384 N ILE B 133 -3.216 -4.376 1.266 1.00 0.00 N ATOM 1385 CA ILE B 133 -4.123 -3.240 1.272 1.00 0.00 C ATOM 1386 C ILE B 133 -5.123 -3.326 0.119 1.00 0.00 C ATOM 1387 O ILE B 133 -6.308 -3.063 0.344 1.00 0.00 O ATOM 1388 CB ILE B 133 -3.356 -1.907 1.297 1.00 0.00 C ATOM 1389 CG1 ILE B 133 -2.592 -1.751 2.632 1.00 0.00 C ATOM 1390 CG2 ILE B 133 -4.375 -0.761 1.200 1.00 0.00 C ATOM 1391 CD1 ILE B 133 -1.790 -0.451 2.725 1.00 0.00 C ATOM 0 H ILE B 133 -2.241 -4.140 1.083 1.00 0.00 H new ATOM 0 HA ILE B 133 -4.704 -3.276 2.193 1.00 0.00 H new ATOM 0 HB ILE B 133 -2.649 -1.886 0.467 1.00 0.00 H new ATOM 0 HG12 ILE B 133 -3.304 -1.790 3.456 1.00 0.00 H new ATOM 0 HG13 ILE B 133 -1.915 -2.596 2.756 1.00 0.00 H new ATOM 0 HG21 ILE B 133 -3.851 0.194 1.216 1.00 0.00 H new ATOM 0 HG22 ILE B 133 -4.936 -0.851 0.270 1.00 0.00 H new ATOM 0 HG23 ILE B 133 -5.062 -0.812 2.045 1.00 0.00 H new ATOM 0 HD11 ILE B 133 -1.279 -0.407 3.687 1.00 0.00 H new ATOM 0 HD12 ILE B 133 -1.054 -0.419 1.921 1.00 0.00 H new ATOM 0 HD13 ILE B 133 -2.465 0.400 2.633 1.00 0.00 H new ATOM 1403 N ARG B 134 -4.696 -3.675 -1.103 1.00 0.00 N ATOM 1404 CA ARG B 134 -5.605 -3.767 -2.237 1.00 0.00 C ATOM 1405 C ARG B 134 -6.729 -4.715 -1.890 1.00 0.00 C ATOM 1406 O ARG B 134 -7.896 -4.373 -2.085 1.00 0.00 O ATOM 1407 CB ARG B 134 -4.881 -4.239 -3.501 1.00 0.00 C ATOM 1408 CG ARG B 134 -3.736 -3.301 -3.870 1.00 0.00 C ATOM 1409 CD ARG B 134 -3.203 -3.541 -5.271 1.00 0.00 C ATOM 1410 NE ARG B 134 -2.219 -4.628 -5.343 1.00 0.00 N ATOM 1411 CZ ARG B 134 -1.771 -5.188 -6.470 1.00 0.00 C ATOM 1412 NH1 ARG B 134 -2.306 -4.916 -7.656 1.00 0.00 N ATOM 1413 NH2 ARG B 134 -0.753 -6.028 -6.418 1.00 0.00 N ATOM 0 H ARG B 134 -3.725 -3.897 -1.324 1.00 0.00 H new ATOM 0 HA ARG B 134 -6.006 -2.775 -2.445 1.00 0.00 H new ATOM 0 HB2 ARG B 134 -4.493 -5.246 -3.345 1.00 0.00 H new ATOM 0 HB3 ARG B 134 -5.589 -4.295 -4.328 1.00 0.00 H new ATOM 0 HG2 ARG B 134 -4.078 -2.269 -3.789 1.00 0.00 H new ATOM 0 HG3 ARG B 134 -2.925 -3.426 -3.152 1.00 0.00 H new ATOM 0 HD2 ARG B 134 -4.037 -3.771 -5.934 1.00 0.00 H new ATOM 0 HD3 ARG B 134 -2.746 -2.623 -5.640 1.00 0.00 H new ATOM 0 HE ARG B 134 -1.848 -4.984 -4.462 1.00 0.00 H new ATOM 0 HH11 ARG B 134 -3.085 -4.261 -7.726 1.00 0.00 H new ATOM 0 HH12 ARG B 134 -1.938 -5.363 -8.496 1.00 0.00 H new ATOM 0 HH21 ARG B 134 -0.316 -6.244 -5.522 1.00 0.00 H new ATOM 0 HH22 ARG B 134 -0.404 -6.460 -7.274 1.00 0.00 H new ATOM 1427 N GLN B 135 -6.395 -5.884 -1.350 1.00 0.00 N ATOM 1428 CA GLN B 135 -7.418 -6.845 -0.973 1.00 0.00 C ATOM 1429 C GLN B 135 -8.259 -6.354 0.192 1.00 0.00 C ATOM 1430 O GLN B 135 -9.482 -6.407 0.097 1.00 0.00 O ATOM 1431 CB GLN B 135 -6.817 -8.183 -0.605 1.00 0.00 C ATOM 1432 CG GLN B 135 -6.386 -8.934 -1.851 1.00 0.00 C ATOM 1433 CD GLN B 135 -7.538 -9.331 -2.784 1.00 0.00 C ATOM 1434 OE1 GLN B 135 -8.341 -10.230 -2.518 1.00 0.00 O ATOM 1435 NE2 GLN B 135 -7.654 -8.678 -3.931 1.00 0.00 N ATOM 0 H GLN B 135 -5.437 -6.183 -1.167 1.00 0.00 H new ATOM 0 HA GLN B 135 -8.056 -6.961 -1.849 1.00 0.00 H new ATOM 0 HB2 GLN B 135 -5.960 -8.035 0.052 1.00 0.00 H new ATOM 0 HB3 GLN B 135 -7.545 -8.775 -0.050 1.00 0.00 H new ATOM 0 HG2 GLN B 135 -5.681 -8.316 -2.407 1.00 0.00 H new ATOM 0 HG3 GLN B 135 -5.851 -9.835 -1.550 1.00 0.00 H new ATOM 0 HE21 GLN B 135 -6.997 -7.933 -4.162 1.00 0.00 H new ATOM 0 HE22 GLN B 135 -8.401 -8.920 -4.582 1.00 0.00 H new ATOM 1444 N LYS B 136 -7.652 -5.845 1.264 1.00 0.00 N ATOM 1445 CA LYS B 136 -8.400 -5.364 2.434 1.00 0.00 C ATOM 1446 C LYS B 136 -9.445 -4.339 2.008 1.00 0.00 C ATOM 1447 O LYS B 136 -10.618 -4.436 2.372 1.00 0.00 O ATOM 1448 CB LYS B 136 -7.438 -4.905 3.549 1.00 0.00 C ATOM 1449 CG LYS B 136 -7.280 -3.392 3.787 1.00 0.00 C ATOM 1450 CD LYS B 136 -6.100 -3.045 4.708 1.00 0.00 C ATOM 1451 CE LYS B 136 -5.960 -3.900 5.967 1.00 0.00 C ATOM 1452 NZ LYS B 136 -7.128 -3.855 6.863 1.00 0.00 N ATOM 0 H LYS B 136 -6.640 -5.753 1.350 1.00 0.00 H new ATOM 0 HA LYS B 136 -8.968 -6.180 2.882 1.00 0.00 H new ATOM 0 HB2 LYS B 136 -7.769 -5.358 4.484 1.00 0.00 H new ATOM 0 HB3 LYS B 136 -6.452 -5.314 3.329 1.00 0.00 H new ATOM 0 HG2 LYS B 136 -7.144 -2.892 2.828 1.00 0.00 H new ATOM 0 HG3 LYS B 136 -8.200 -3.001 4.222 1.00 0.00 H new ATOM 0 HD2 LYS B 136 -5.178 -3.128 4.132 1.00 0.00 H new ATOM 0 HD3 LYS B 136 -6.195 -2.002 5.010 1.00 0.00 H new ATOM 0 HE2 LYS B 136 -5.783 -4.934 5.672 1.00 0.00 H new ATOM 0 HE3 LYS B 136 -5.080 -3.571 6.520 1.00 0.00 H new ATOM 0 HZ1 LYS B 136 -6.954 -4.460 7.691 1.00 0.00 H new ATOM 0 HZ2 LYS B 136 -7.288 -2.876 7.176 1.00 0.00 H new ATOM 0 HZ3 LYS B 136 -7.969 -4.197 6.355 1.00 0.00 H new ATOM 1466 N TYR B 137 -9.045 -3.365 1.190 1.00 0.00 N ATOM 1467 CA TYR B 137 -9.965 -2.354 0.709 1.00 0.00 C ATOM 1468 C TYR B 137 -10.914 -2.944 -0.336 1.00 0.00 C ATOM 1469 O TYR B 137 -12.031 -2.443 -0.455 1.00 0.00 O ATOM 1470 CB TYR B 137 -9.216 -1.083 0.299 1.00 0.00 C ATOM 1471 CG TYR B 137 -8.631 -0.268 1.451 1.00 0.00 C ATOM 1472 CD1 TYR B 137 -9.357 0.012 2.627 1.00 0.00 C ATOM 1473 CD2 TYR B 137 -7.348 0.270 1.317 1.00 0.00 C ATOM 1474 CE1 TYR B 137 -8.790 0.779 3.662 1.00 0.00 C ATOM 1475 CE2 TYR B 137 -6.783 1.083 2.318 1.00 0.00 C ATOM 1476 CZ TYR B 137 -7.492 1.316 3.512 1.00 0.00 C ATOM 1477 OH TYR B 137 -6.935 2.051 4.515 1.00 0.00 O ATOM 0 H TYR B 137 -8.089 -3.261 0.851 1.00 0.00 H new ATOM 0 HA TYR B 137 -10.621 -2.024 1.515 1.00 0.00 H new ATOM 0 HB2 TYR B 137 -8.406 -1.360 -0.376 1.00 0.00 H new ATOM 0 HB3 TYR B 137 -9.897 -0.446 -0.265 1.00 0.00 H new ATOM 0 HD1 TYR B 137 -10.362 -0.367 2.735 1.00 0.00 H new ATOM 0 HD2 TYR B 137 -6.777 0.057 0.425 1.00 0.00 H new ATOM 0 HE1 TYR B 137 -9.347 0.957 4.570 1.00 0.00 H new ATOM 0 HE2 TYR B 137 -5.809 1.526 2.171 1.00 0.00 H new ATOM 0 HH TYR B 137 -7.282 1.743 5.378 1.00 0.00 H new ATOM 1487 N GLN B 138 -10.551 -4.003 -1.068 1.00 0.00 N ATOM 1488 CA GLN B 138 -11.460 -4.621 -2.035 1.00 0.00 C ATOM 1489 C GLN B 138 -12.554 -5.339 -1.254 1.00 0.00 C ATOM 1490 O GLN B 138 -13.719 -5.206 -1.604 1.00 0.00 O ATOM 1491 CB GLN B 138 -10.762 -5.605 -2.995 1.00 0.00 C ATOM 1492 CG GLN B 138 -11.665 -6.009 -4.178 1.00 0.00 C ATOM 1493 CD GLN B 138 -12.068 -4.836 -5.079 1.00 0.00 C ATOM 1494 OE1 GLN B 138 -11.523 -3.734 -4.996 1.00 0.00 O ATOM 1495 NE2 GLN B 138 -13.057 -5.024 -5.933 1.00 0.00 N ATOM 0 H GLN B 138 -9.635 -4.448 -1.008 1.00 0.00 H new ATOM 0 HA GLN B 138 -11.868 -3.832 -2.667 1.00 0.00 H new ATOM 0 HB2 GLN B 138 -9.848 -5.150 -3.377 1.00 0.00 H new ATOM 0 HB3 GLN B 138 -10.467 -6.498 -2.445 1.00 0.00 H new ATOM 0 HG2 GLN B 138 -11.147 -6.756 -4.780 1.00 0.00 H new ATOM 0 HG3 GLN B 138 -12.567 -6.483 -3.789 1.00 0.00 H new ATOM 0 HE21 GLN B 138 -13.506 -5.937 -6.000 1.00 0.00 H new ATOM 0 HE22 GLN B 138 -13.372 -4.256 -6.526 1.00 0.00 H new ATOM 1504 N SER B 139 -12.213 -6.031 -0.160 1.00 0.00 N ATOM 1505 CA SER B 139 -13.148 -6.753 0.698 1.00 0.00 C ATOM 1506 C SER B 139 -14.256 -5.792 1.144 1.00 0.00 C ATOM 1507 O SER B 139 -15.411 -6.196 1.258 1.00 0.00 O ATOM 1508 CB SER B 139 -12.375 -7.362 1.880 1.00 0.00 C ATOM 1509 OG SER B 139 -13.138 -8.353 2.546 1.00 0.00 O ATOM 0 H SER B 139 -11.247 -6.103 0.159 1.00 0.00 H new ATOM 0 HA SER B 139 -13.624 -7.575 0.163 1.00 0.00 H new ATOM 0 HB2 SER B 139 -11.444 -7.800 1.520 1.00 0.00 H new ATOM 0 HB3 SER B 139 -12.106 -6.575 2.584 1.00 0.00 H new ATOM 0 HG SER B 139 -12.618 -8.721 3.291 1.00 0.00 H new ATOM 1515 N LYS B 140 -13.895 -4.534 1.426 1.00 0.00 N ATOM 1516 CA LYS B 140 -14.797 -3.456 1.821 1.00 0.00 C ATOM 1517 C LYS B 140 -15.564 -2.931 0.604 1.00 0.00 C ATOM 1518 O LYS B 140 -16.766 -2.707 0.683 1.00 0.00 O ATOM 1519 CB LYS B 140 -13.995 -2.334 2.490 1.00 0.00 C ATOM 1520 CG LYS B 140 -13.401 -2.790 3.833 1.00 0.00 C ATOM 1521 CD LYS B 140 -12.199 -1.924 4.204 1.00 0.00 C ATOM 1522 CE LYS B 140 -11.519 -2.344 5.505 1.00 0.00 C ATOM 1523 NZ LYS B 140 -12.361 -2.108 6.689 1.00 0.00 N ATOM 0 H LYS B 140 -12.922 -4.231 1.382 1.00 0.00 H new ATOM 0 HA LYS B 140 -15.525 -3.839 2.536 1.00 0.00 H new ATOM 0 HB2 LYS B 140 -13.192 -2.013 1.826 1.00 0.00 H new ATOM 0 HB3 LYS B 140 -14.640 -1.470 2.651 1.00 0.00 H new ATOM 0 HG2 LYS B 140 -14.159 -2.726 4.614 1.00 0.00 H new ATOM 0 HG3 LYS B 140 -13.098 -3.835 3.768 1.00 0.00 H new ATOM 0 HD2 LYS B 140 -11.470 -1.963 3.394 1.00 0.00 H new ATOM 0 HD3 LYS B 140 -12.523 -0.887 4.292 1.00 0.00 H new ATOM 0 HE2 LYS B 140 -11.264 -3.402 5.451 1.00 0.00 H new ATOM 0 HE3 LYS B 140 -10.583 -1.795 5.615 1.00 0.00 H new ATOM 0 HZ1 LYS B 140 -11.851 -2.411 7.543 1.00 0.00 H new ATOM 0 HZ2 LYS B 140 -12.584 -1.095 6.760 1.00 0.00 H new ATOM 0 HZ3 LYS B 140 -13.243 -2.652 6.602 1.00 0.00 H new ATOM 1537 N ARG B 141 -14.893 -2.714 -0.534 1.00 0.00 N ATOM 1538 CA ARG B 141 -15.500 -2.208 -1.768 1.00 0.00 C ATOM 1539 C ARG B 141 -16.567 -3.142 -2.314 1.00 0.00 C ATOM 1540 O ARG B 141 -17.611 -2.668 -2.748 1.00 0.00 O ATOM 1541 CB ARG B 141 -14.421 -1.983 -2.841 1.00 0.00 C ATOM 1542 CG ARG B 141 -14.960 -1.188 -4.044 1.00 0.00 C ATOM 1543 CD ARG B 141 -13.908 -1.040 -5.149 1.00 0.00 C ATOM 1544 NE ARG B 141 -12.919 0.002 -4.832 1.00 0.00 N ATOM 1545 CZ ARG B 141 -11.636 0.035 -5.203 1.00 0.00 C ATOM 1546 NH1 ARG B 141 -11.031 -1.053 -5.664 1.00 0.00 N ATOM 1547 NH2 ARG B 141 -10.956 1.171 -5.138 1.00 0.00 N ATOM 0 H ARG B 141 -13.892 -2.889 -0.623 1.00 0.00 H new ATOM 0 HA ARG B 141 -15.981 -1.262 -1.518 1.00 0.00 H new ATOM 0 HB2 ARG B 141 -13.579 -1.449 -2.402 1.00 0.00 H new ATOM 0 HB3 ARG B 141 -14.044 -2.947 -3.183 1.00 0.00 H new ATOM 0 HG2 ARG B 141 -15.840 -1.690 -4.446 1.00 0.00 H new ATOM 0 HG3 ARG B 141 -15.280 -0.200 -3.712 1.00 0.00 H new ATOM 0 HD2 ARG B 141 -13.398 -1.992 -5.294 1.00 0.00 H new ATOM 0 HD3 ARG B 141 -14.402 -0.797 -6.090 1.00 0.00 H new ATOM 0 HE ARG B 141 -13.249 0.785 -4.267 1.00 0.00 H new ATOM 0 HH11 ARG B 141 -11.546 -1.930 -5.739 1.00 0.00 H new ATOM 0 HH12 ARG B 141 -10.051 -1.012 -5.943 1.00 0.00 H new ATOM 0 HH21 ARG B 141 -11.412 2.020 -4.805 1.00 0.00 H new ATOM 0 HH22 ARG B 141 -9.976 1.196 -5.421 1.00 0.00 H new ATOM 1561 N GLN B 142 -16.320 -4.446 -2.296 1.00 0.00 N ATOM 1562 CA GLN B 142 -17.217 -5.469 -2.803 1.00 0.00 C ATOM 1563 C GLN B 142 -18.664 -5.322 -2.313 1.00 0.00 C ATOM 1564 O GLN B 142 -19.525 -5.112 -3.158 1.00 0.00 O ATOM 1565 CB GLN B 142 -16.584 -6.860 -2.626 1.00 0.00 C ATOM 1566 CG GLN B 142 -16.522 -7.601 -3.965 1.00 0.00 C ATOM 1567 CD GLN B 142 -17.846 -8.281 -4.278 1.00 0.00 C ATOM 1568 OE1 GLN B 142 -18.037 -9.431 -3.891 1.00 0.00 O ATOM 1569 NE2 GLN B 142 -18.780 -7.601 -4.931 1.00 0.00 N ATOM 0 H GLN B 142 -15.457 -4.831 -1.913 1.00 0.00 H new ATOM 0 HA GLN B 142 -17.335 -5.327 -3.877 1.00 0.00 H new ATOM 0 HB2 GLN B 142 -15.580 -6.758 -2.214 1.00 0.00 H new ATOM 0 HB3 GLN B 142 -17.165 -7.441 -1.910 1.00 0.00 H new ATOM 0 HG2 GLN B 142 -16.273 -6.899 -4.761 1.00 0.00 H new ATOM 0 HG3 GLN B 142 -15.726 -8.345 -3.936 1.00 0.00 H new ATOM 0 HE21 GLN B 142 -18.594 -6.647 -5.241 1.00 0.00 H new ATOM 0 HE22 GLN B 142 -19.684 -8.032 -5.123 1.00 0.00 H new ATOM 1578 N PRO B 143 -18.985 -5.348 -1.009 1.00 0.00 N ATOM 1579 CA PRO B 143 -20.363 -5.193 -0.551 1.00 0.00 C ATOM 1580 C PRO B 143 -20.929 -3.809 -0.903 1.00 0.00 C ATOM 1581 O PRO B 143 -22.145 -3.648 -0.891 1.00 0.00 O ATOM 1582 CB PRO B 143 -20.329 -5.434 0.963 1.00 0.00 C ATOM 1583 CG PRO B 143 -18.902 -5.033 1.311 1.00 0.00 C ATOM 1584 CD PRO B 143 -18.117 -5.573 0.122 1.00 0.00 C ATOM 0 HA PRO B 143 -21.027 -5.902 -1.045 1.00 0.00 H new ATOM 0 HB2 PRO B 143 -21.064 -4.826 1.490 1.00 0.00 H new ATOM 0 HB3 PRO B 143 -20.535 -6.474 1.216 1.00 0.00 H new ATOM 0 HG2 PRO B 143 -18.796 -3.953 1.412 1.00 0.00 H new ATOM 0 HG3 PRO B 143 -18.573 -5.475 2.251 1.00 0.00 H new ATOM 0 HD2 PRO B 143 -17.166 -5.053 0.004 1.00 0.00 H new ATOM 0 HD3 PRO B 143 -17.888 -6.632 0.244 1.00 0.00 H new ATOM 1592 N ILE B 144 -20.089 -2.793 -1.136 1.00 0.00 N ATOM 1593 CA ILE B 144 -20.539 -1.457 -1.506 1.00 0.00 C ATOM 1594 C ILE B 144 -20.992 -1.514 -2.976 1.00 0.00 C ATOM 1595 O ILE B 144 -22.102 -1.089 -3.289 1.00 0.00 O ATOM 1596 CB ILE B 144 -19.448 -0.391 -1.227 1.00 0.00 C ATOM 1597 CG1 ILE B 144 -18.999 -0.339 0.253 1.00 0.00 C ATOM 1598 CG2 ILE B 144 -20.016 0.989 -1.572 1.00 0.00 C ATOM 1599 CD1 ILE B 144 -17.667 0.386 0.478 1.00 0.00 C ATOM 0 H ILE B 144 -19.075 -2.881 -1.071 1.00 0.00 H new ATOM 0 HA ILE B 144 -21.384 -1.144 -0.893 1.00 0.00 H new ATOM 0 HB ILE B 144 -18.584 -0.663 -1.834 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -19.773 0.156 0.839 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -18.915 -1.358 0.632 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -19.261 1.751 -1.381 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -20.299 1.013 -2.624 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -20.894 1.186 -0.956 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -17.424 0.379 1.540 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -16.878 -0.121 -0.078 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -17.751 1.416 0.132 1.00 0.00 H new ATOM 1611 N LEU B 145 -20.150 -2.035 -3.879 1.00 0.00 N ATOM 1612 CA LEU B 145 -20.466 -2.149 -5.305 1.00 0.00 C ATOM 1613 C LEU B 145 -21.692 -3.048 -5.497 1.00 0.00 C ATOM 1614 O LEU B 145 -22.592 -2.724 -6.266 1.00 0.00 O ATOM 1615 CB LEU B 145 -19.225 -2.560 -6.131 1.00 0.00 C ATOM 1616 CG LEU B 145 -18.973 -4.061 -6.350 1.00 0.00 C ATOM 1617 CD1 LEU B 145 -19.730 -4.640 -7.549 1.00 0.00 C ATOM 1618 CD2 LEU B 145 -17.474 -4.322 -6.539 1.00 0.00 C ATOM 0 H LEU B 145 -19.225 -2.391 -3.637 1.00 0.00 H new ATOM 0 HA LEU B 145 -20.741 -1.172 -5.701 1.00 0.00 H new ATOM 0 HB2 LEU B 145 -19.303 -2.087 -7.110 1.00 0.00 H new ATOM 0 HB3 LEU B 145 -18.345 -2.140 -5.644 1.00 0.00 H new ATOM 0 HG LEU B 145 -19.347 -4.561 -5.457 1.00 0.00 H new ATOM 0 HD11 LEU B 145 -19.505 -5.702 -7.643 1.00 0.00 H new ATOM 0 HD12 LEU B 145 -20.802 -4.508 -7.401 1.00 0.00 H new ATOM 0 HD13 LEU B 145 -19.423 -4.122 -8.458 1.00 0.00 H new ATOM 0 HD21 LEU B 145 -17.307 -5.388 -6.693 1.00 0.00 H new ATOM 0 HD22 LEU B 145 -17.115 -3.769 -7.407 1.00 0.00 H new ATOM 0 HD23 LEU B 145 -16.933 -3.995 -5.651 1.00 0.00 H new ATOM 1630 N ASP B 146 -21.743 -4.149 -4.753 1.00 0.00 N ATOM 1631 CA ASP B 146 -22.824 -5.130 -4.779 1.00 0.00 C ATOM 1632 C ASP B 146 -24.119 -4.495 -4.257 1.00 0.00 C ATOM 1633 O ASP B 146 -25.210 -4.913 -4.618 1.00 0.00 O ATOM 1634 CB ASP B 146 -22.357 -6.331 -3.951 1.00 0.00 C ATOM 1635 CG ASP B 146 -23.296 -7.534 -3.897 1.00 0.00 C ATOM 1636 OD1 ASP B 146 -24.036 -7.846 -4.852 1.00 0.00 O ATOM 1637 OD2 ASP B 146 -23.231 -8.220 -2.856 1.00 0.00 O ATOM 0 H ASP B 146 -21.006 -4.392 -4.091 1.00 0.00 H new ATOM 0 HA ASP B 146 -23.050 -5.469 -5.790 1.00 0.00 H new ATOM 0 HB2 ASP B 146 -21.398 -6.665 -4.347 1.00 0.00 H new ATOM 0 HB3 ASP B 146 -22.179 -5.992 -2.930 1.00 0.00 H new ATOM 1642 N ALA B 147 -24.021 -3.476 -3.391 1.00 0.00 N ATOM 1643 CA ALA B 147 -25.179 -2.788 -2.843 1.00 0.00 C ATOM 1644 C ALA B 147 -25.756 -1.754 -3.814 1.00 0.00 C ATOM 1645 O ALA B 147 -26.981 -1.686 -3.901 1.00 0.00 O ATOM 1646 CB ALA B 147 -24.845 -2.139 -1.502 1.00 0.00 C ATOM 0 H ALA B 147 -23.130 -3.111 -3.055 1.00 0.00 H new ATOM 0 HA ALA B 147 -25.948 -3.544 -2.683 1.00 0.00 H new ATOM 0 HB1 ALA B 147 -25.728 -1.631 -1.114 1.00 0.00 H new ATOM 0 HB2 ALA B 147 -24.528 -2.906 -0.796 1.00 0.00 H new ATOM 0 HB3 ALA B 147 -24.041 -1.416 -1.638 1.00 0.00 H new ATOM 1652 N ILE B 148 -24.942 -0.935 -4.502 1.00 0.00 N ATOM 1653 CA ILE B 148 -25.458 0.065 -5.455 1.00 0.00 C ATOM 1654 C ILE B 148 -26.113 -0.612 -6.652 1.00 0.00 C ATOM 1655 O ILE B 148 -27.145 -0.156 -7.131 1.00 0.00 O ATOM 1656 CB ILE B 148 -24.385 1.081 -5.907 1.00 0.00 C ATOM 1657 CG1 ILE B 148 -24.955 2.202 -6.799 1.00 0.00 C ATOM 1658 CG2 ILE B 148 -23.158 0.435 -6.551 1.00 0.00 C ATOM 1659 CD1 ILE B 148 -24.087 3.473 -6.757 1.00 0.00 C ATOM 0 H ILE B 148 -23.926 -0.945 -4.417 1.00 0.00 H new ATOM 0 HA ILE B 148 -26.216 0.639 -4.922 1.00 0.00 H new ATOM 0 HB ILE B 148 -24.043 1.543 -4.981 1.00 0.00 H new ATOM 0 HG12 ILE B 148 -25.026 1.846 -7.827 1.00 0.00 H new ATOM 0 HG13 ILE B 148 -25.967 2.444 -6.474 1.00 0.00 H new ATOM 0 HG21 ILE B 148 -22.449 1.210 -6.842 1.00 0.00 H new ATOM 0 HG22 ILE B 148 -22.685 -0.239 -5.837 1.00 0.00 H new ATOM 0 HG23 ILE B 148 -23.464 -0.127 -7.433 1.00 0.00 H new ATOM 0 HD11 ILE B 148 -24.527 4.235 -7.400 1.00 0.00 H new ATOM 0 HD12 ILE B 148 -24.037 3.846 -5.734 1.00 0.00 H new ATOM 0 HD13 ILE B 148 -23.082 3.239 -7.107 1.00 0.00 H new ATOM 1671 N GLU B 149 -25.530 -1.717 -7.110 1.00 0.00 N ATOM 1672 CA GLU B 149 -26.028 -2.470 -8.246 1.00 0.00 C ATOM 1673 C GLU B 149 -27.339 -3.186 -7.887 1.00 0.00 C ATOM 1674 O GLU B 149 -28.015 -3.701 -8.776 1.00 0.00 O ATOM 1675 CB GLU B 149 -24.927 -3.399 -8.795 1.00 0.00 C ATOM 1676 CG GLU B 149 -23.887 -2.546 -9.545 1.00 0.00 C ATOM 1677 CD GLU B 149 -22.684 -3.309 -10.096 1.00 0.00 C ATOM 1678 OE1 GLU B 149 -22.860 -4.394 -10.698 1.00 0.00 O ATOM 1679 OE2 GLU B 149 -21.563 -2.738 -10.047 1.00 0.00 O ATOM 0 H GLU B 149 -24.688 -2.115 -6.694 1.00 0.00 H new ATOM 0 HA GLU B 149 -26.280 -1.792 -9.061 1.00 0.00 H new ATOM 0 HB2 GLU B 149 -24.451 -3.944 -7.979 1.00 0.00 H new ATOM 0 HB3 GLU B 149 -25.360 -4.142 -9.465 1.00 0.00 H new ATOM 0 HG2 GLU B 149 -24.385 -2.042 -10.373 1.00 0.00 H new ATOM 0 HG3 GLU B 149 -23.525 -1.770 -8.871 1.00 0.00 H new ATOM 1686 N ALA B 150 -27.667 -3.248 -6.590 1.00 0.00 N ATOM 1687 CA ALA B 150 -28.855 -3.854 -6.016 1.00 0.00 C ATOM 1688 C ALA B 150 -29.882 -2.795 -5.569 1.00 0.00 C ATOM 1689 O ALA B 150 -30.692 -3.084 -4.683 1.00 0.00 O ATOM 1690 CB ALA B 150 -28.433 -4.754 -4.844 1.00 0.00 C ATOM 0 H ALA B 150 -27.062 -2.846 -5.873 1.00 0.00 H new ATOM 0 HA ALA B 150 -29.350 -4.456 -6.778 1.00 0.00 H new ATOM 0 HB1 ALA B 150 -29.317 -5.216 -4.403 1.00 0.00 H new ATOM 0 HB2 ALA B 150 -27.760 -5.531 -5.206 1.00 0.00 H new ATOM 0 HB3 ALA B 150 -27.923 -4.154 -4.090 1.00 0.00 H new ATOM 1696 N LYS B 151 -29.762 -1.525 -5.977 1.00 0.00 N ATOM 1697 CA LYS B 151 -30.730 -0.480 -5.609 1.00 0.00 C ATOM 1698 C LYS B 151 -31.882 -0.482 -6.599 1.00 0.00 C ATOM 1699 O LYS B 151 -32.960 -0.038 -6.157 1.00 0.00 O ATOM 1700 CB LYS B 151 -30.088 0.913 -5.576 1.00 0.00 C ATOM 1701 CG LYS B 151 -28.949 1.046 -4.561 1.00 0.00 C ATOM 1702 CD LYS B 151 -29.344 1.163 -3.081 1.00 0.00 C ATOM 1703 CE LYS B 151 -30.105 0.001 -2.422 1.00 0.00 C ATOM 1704 NZ LYS B 151 -29.538 -1.334 -2.713 1.00 0.00 N ATOM 0 H LYS B 151 -28.999 -1.193 -6.567 1.00 0.00 H new ATOM 0 HA LYS B 151 -31.092 -0.704 -4.606 1.00 0.00 H new ATOM 0 HB2 LYS B 151 -29.706 1.150 -6.569 1.00 0.00 H new ATOM 0 HB3 LYS B 151 -30.856 1.651 -5.345 1.00 0.00 H new ATOM 0 HG2 LYS B 151 -28.295 0.180 -4.670 1.00 0.00 H new ATOM 0 HG3 LYS B 151 -28.361 1.925 -4.825 1.00 0.00 H new ATOM 0 HD2 LYS B 151 -28.431 1.326 -2.508 1.00 0.00 H new ATOM 0 HD3 LYS B 151 -29.954 2.060 -2.972 1.00 0.00 H new ATOM 0 HE2 LYS B 151 -30.114 0.153 -1.343 1.00 0.00 H new ATOM 0 HE3 LYS B 151 -31.142 0.024 -2.756 1.00 0.00 H new ATOM 0 HZ1 LYS B 151 -30.200 -1.870 -3.310 1.00 0.00 H new ATOM 0 HZ2 LYS B 151 -28.632 -1.225 -3.212 1.00 0.00 H new ATOM 0 HZ3 LYS B 151 -29.383 -1.847 -1.822 1.00 0.00 H new