USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 750 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 62 TYR OH : rot -17:sc= 0.879 USER MOD Set 1.2: A 87 TYR OH : rot 21:sc= 0.883 USER MOD Single : A 21 SER OG : rot 148:sc= 0.302 USER MOD Single : A 25 ASN : amide:sc= -2.44 K(o=-2.4,f=-8.2!) USER MOD Single : A 26 CYS SG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -141:sc= -0.653 (180deg=-1.45) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ -137:sc=-0.000675 (180deg=-0.201) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -1.46 K(o=-1.5,f=-14!) USER MOD Single : A 60 MET CE :methyl 138:sc= -0.654 (180deg=-3.77!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -81:sc= 0.691 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 130:sc= -0.104 USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.102) USER MOD Single : A 75 THR OG1 : rot -24:sc= -0.198 USER MOD Single : A 88 LYS NZ :NH3+ -113:sc= 1.31 (180deg=-0.813) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -1.48 K(o=-1.5,f=-0.79) USER MOD Single : A 94 HIS : no HD1:sc= -0.19 K(o=-0.19,f=-0.91) USER MOD Single : A 97 GLN : amide:sc= -0.158 X(o=-0.16,f=-0.0042) USER MOD ----------------------------------------------------------------- ATOM 105 N LEU A 11 25.310 -10.154 -1.288 1.00 0.00 N ATOM 106 CA LEU A 11 25.966 -11.212 -2.049 1.00 0.00 C ATOM 107 C LEU A 11 25.204 -12.527 -1.921 1.00 0.00 C ATOM 108 O LEU A 11 24.707 -13.066 -2.910 1.00 0.00 O ATOM 109 CB LEU A 11 27.406 -11.396 -1.568 1.00 0.00 C ATOM 110 CG LEU A 11 28.230 -12.453 -2.305 1.00 0.00 C ATOM 111 CD1 LEU A 11 28.200 -13.773 -1.551 1.00 0.00 C ATOM 112 CD2 LEU A 11 27.716 -12.636 -3.725 1.00 0.00 C ATOM 0 HA LEU A 11 25.975 -10.918 -3.099 1.00 0.00 H new ATOM 0 HB2 LEU A 11 27.921 -10.439 -1.652 1.00 0.00 H new ATOM 0 HB3 LEU A 11 27.384 -11.654 -0.509 1.00 0.00 H new ATOM 0 HG LEU A 11 29.263 -12.110 -2.356 1.00 0.00 H new ATOM 0 HD11 LEU A 11 28.791 -14.513 -2.090 1.00 0.00 H new ATOM 0 HD12 LEU A 11 28.616 -13.632 -0.554 1.00 0.00 H new ATOM 0 HD13 LEU A 11 27.171 -14.121 -1.468 1.00 0.00 H new ATOM 0 HD21 LEU A 11 28.314 -13.392 -4.234 1.00 0.00 H new ATOM 0 HD22 LEU A 11 26.675 -12.956 -3.697 1.00 0.00 H new ATOM 0 HD23 LEU A 11 27.790 -11.691 -4.263 1.00 0.00 H new ATOM 124 N TRP A 12 25.114 -13.037 -0.698 1.00 0.00 N ATOM 125 CA TRP A 12 24.411 -14.288 -0.441 1.00 0.00 C ATOM 126 C TRP A 12 23.070 -14.317 -1.166 1.00 0.00 C ATOM 127 O TRP A 12 22.654 -15.356 -1.678 1.00 0.00 O ATOM 128 CB TRP A 12 24.196 -14.477 1.062 1.00 0.00 C ATOM 129 CG TRP A 12 22.994 -13.753 1.586 1.00 0.00 C ATOM 130 CD1 TRP A 12 22.974 -12.530 2.195 1.00 0.00 C ATOM 131 CD2 TRP A 12 21.636 -14.206 1.549 1.00 0.00 C ATOM 132 NE1 TRP A 12 21.686 -12.197 2.539 1.00 0.00 N ATOM 133 CE2 TRP A 12 20.847 -13.208 2.152 1.00 0.00 C ATOM 134 CE3 TRP A 12 21.011 -15.357 1.062 1.00 0.00 C ATOM 135 CZ2 TRP A 12 19.466 -13.329 2.283 1.00 0.00 C ATOM 136 CZ3 TRP A 12 19.640 -15.476 1.193 1.00 0.00 C ATOM 137 CH2 TRP A 12 18.880 -14.467 1.798 1.00 0.00 C ATOM 0 H TRP A 12 25.519 -12.603 0.131 1.00 0.00 H new ATOM 0 HA TRP A 12 25.025 -15.105 -0.819 1.00 0.00 H new ATOM 0 HB2 TRP A 12 24.092 -15.541 1.276 1.00 0.00 H new ATOM 0 HB3 TRP A 12 25.081 -14.130 1.595 1.00 0.00 H new ATOM 0 HD1 TRP A 12 23.843 -11.915 2.379 1.00 0.00 H new ATOM 0 HE1 TRP A 12 21.401 -11.337 3.007 1.00 0.00 H new ATOM 0 HE3 TRP A 12 21.588 -16.139 0.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 18.878 -12.553 2.751 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 19.146 -16.362 0.822 1.00 0.00 H new ATOM 0 HH2 TRP A 12 17.810 -14.589 1.884 1.00 0.00 H new ATOM 148 N GLU A 13 22.398 -13.171 -1.205 1.00 0.00 N ATOM 149 CA GLU A 13 21.103 -13.068 -1.868 1.00 0.00 C ATOM 150 C GLU A 13 21.264 -13.096 -3.385 1.00 0.00 C ATOM 151 O GLU A 13 20.471 -13.717 -4.094 1.00 0.00 O ATOM 152 CB GLU A 13 20.389 -11.782 -1.444 1.00 0.00 C ATOM 153 CG GLU A 13 19.321 -12.000 -0.386 1.00 0.00 C ATOM 154 CD GLU A 13 18.037 -11.253 -0.691 1.00 0.00 C ATOM 155 OE1 GLU A 13 17.488 -11.445 -1.797 1.00 0.00 O ATOM 156 OE2 GLU A 13 17.581 -10.478 0.174 1.00 0.00 O ATOM 0 H GLU A 13 22.728 -12.302 -0.786 1.00 0.00 H new ATOM 0 HA GLU A 13 20.501 -13.926 -1.568 1.00 0.00 H new ATOM 0 HB2 GLU A 13 21.127 -11.075 -1.064 1.00 0.00 H new ATOM 0 HB3 GLU A 13 19.932 -11.324 -2.321 1.00 0.00 H new ATOM 0 HG2 GLU A 13 19.107 -13.066 -0.306 1.00 0.00 H new ATOM 0 HG3 GLU A 13 19.703 -11.678 0.583 1.00 0.00 H new ATOM 163 N PHE A 14 22.297 -12.420 -3.877 1.00 0.00 N ATOM 164 CA PHE A 14 22.563 -12.366 -5.310 1.00 0.00 C ATOM 165 C PHE A 14 22.715 -13.770 -5.888 1.00 0.00 C ATOM 166 O PHE A 14 21.994 -14.156 -6.809 1.00 0.00 O ATOM 167 CB PHE A 14 23.827 -11.550 -5.585 1.00 0.00 C ATOM 168 CG PHE A 14 24.518 -11.928 -6.864 1.00 0.00 C ATOM 169 CD1 PHE A 14 25.463 -12.941 -6.883 1.00 0.00 C ATOM 170 CD2 PHE A 14 24.223 -11.270 -8.048 1.00 0.00 C ATOM 171 CE1 PHE A 14 26.102 -13.290 -8.058 1.00 0.00 C ATOM 172 CE2 PHE A 14 24.858 -11.616 -9.226 1.00 0.00 C ATOM 173 CZ PHE A 14 25.797 -12.628 -9.231 1.00 0.00 C ATOM 0 H PHE A 14 22.964 -11.902 -3.305 1.00 0.00 H new ATOM 0 HA PHE A 14 21.714 -11.883 -5.794 1.00 0.00 H new ATOM 0 HB2 PHE A 14 23.566 -10.492 -5.621 1.00 0.00 H new ATOM 0 HB3 PHE A 14 24.521 -11.679 -4.754 1.00 0.00 H new ATOM 0 HD1 PHE A 14 25.703 -13.464 -5.969 1.00 0.00 H new ATOM 0 HD2 PHE A 14 23.489 -10.478 -8.050 1.00 0.00 H new ATOM 0 HE1 PHE A 14 26.839 -14.079 -8.059 1.00 0.00 H new ATOM 0 HE2 PHE A 14 24.620 -11.095 -10.142 1.00 0.00 H new ATOM 0 HZ PHE A 14 26.292 -12.902 -10.151 1.00 0.00 H new ATOM 183 N VAL A 15 23.659 -14.530 -5.342 1.00 0.00 N ATOM 184 CA VAL A 15 23.906 -15.891 -5.802 1.00 0.00 C ATOM 185 C VAL A 15 22.672 -16.767 -5.617 1.00 0.00 C ATOM 186 O VAL A 15 22.322 -17.557 -6.493 1.00 0.00 O ATOM 187 CB VAL A 15 25.091 -16.530 -5.054 1.00 0.00 C ATOM 188 CG1 VAL A 15 24.924 -16.369 -3.551 1.00 0.00 C ATOM 189 CG2 VAL A 15 25.230 -17.997 -5.430 1.00 0.00 C ATOM 0 H VAL A 15 24.265 -14.226 -4.580 1.00 0.00 H new ATOM 0 HA VAL A 15 24.147 -15.827 -6.863 1.00 0.00 H new ATOM 0 HB VAL A 15 26.005 -16.015 -5.350 1.00 0.00 H new ATOM 0 HG11 VAL A 15 25.771 -16.827 -3.040 1.00 0.00 H new ATOM 0 HG12 VAL A 15 24.879 -15.309 -3.301 1.00 0.00 H new ATOM 0 HG13 VAL A 15 24.002 -16.856 -3.233 1.00 0.00 H new ATOM 0 HG21 VAL A 15 26.072 -18.432 -4.892 1.00 0.00 H new ATOM 0 HG22 VAL A 15 24.316 -18.529 -5.165 1.00 0.00 H new ATOM 0 HG23 VAL A 15 25.401 -18.083 -6.503 1.00 0.00 H new ATOM 199 N ARG A 16 22.015 -16.619 -4.471 1.00 0.00 N ATOM 200 CA ARG A 16 20.819 -17.397 -4.170 1.00 0.00 C ATOM 201 C ARG A 16 19.724 -17.131 -5.199 1.00 0.00 C ATOM 202 O ARG A 16 19.057 -18.056 -5.664 1.00 0.00 O ATOM 203 CB ARG A 16 20.307 -17.064 -2.768 1.00 0.00 C ATOM 204 CG ARG A 16 18.984 -17.730 -2.428 1.00 0.00 C ATOM 205 CD ARG A 16 17.940 -16.710 -2.001 1.00 0.00 C ATOM 206 NE ARG A 16 17.629 -15.765 -3.070 1.00 0.00 N ATOM 207 CZ ARG A 16 16.599 -14.927 -3.034 1.00 0.00 C ATOM 208 NH1 ARG A 16 15.785 -14.917 -1.987 1.00 0.00 N ATOM 209 NH2 ARG A 16 16.381 -14.097 -4.046 1.00 0.00 N ATOM 0 H ARG A 16 22.291 -15.968 -3.736 1.00 0.00 H new ATOM 0 HA ARG A 16 21.084 -18.453 -4.211 1.00 0.00 H new ATOM 0 HB2 ARG A 16 21.055 -17.367 -2.036 1.00 0.00 H new ATOM 0 HB3 ARG A 16 20.193 -15.984 -2.679 1.00 0.00 H new ATOM 0 HG2 ARG A 16 18.621 -18.283 -3.294 1.00 0.00 H new ATOM 0 HG3 ARG A 16 19.135 -18.454 -1.628 1.00 0.00 H new ATOM 0 HD2 ARG A 16 17.030 -17.228 -1.699 1.00 0.00 H new ATOM 0 HD3 ARG A 16 18.301 -16.165 -1.129 1.00 0.00 H new ATOM 0 HE ARG A 16 18.236 -15.747 -3.889 1.00 0.00 H new ATOM 0 HH11 ARG A 16 15.949 -15.554 -1.207 1.00 0.00 H new ATOM 0 HH12 ARG A 16 14.995 -14.273 -1.962 1.00 0.00 H new ATOM 0 HH21 ARG A 16 17.005 -14.102 -4.853 1.00 0.00 H new ATOM 0 HH22 ARG A 16 15.590 -13.454 -4.017 1.00 0.00 H new ATOM 223 N ASP A 17 19.545 -15.863 -5.550 1.00 0.00 N ATOM 224 CA ASP A 17 18.532 -15.474 -6.525 1.00 0.00 C ATOM 225 C ASP A 17 18.681 -16.278 -7.813 1.00 0.00 C ATOM 226 O ASP A 17 17.716 -16.861 -8.309 1.00 0.00 O ATOM 227 CB ASP A 17 18.632 -13.978 -6.828 1.00 0.00 C ATOM 228 CG ASP A 17 17.407 -13.451 -7.549 1.00 0.00 C ATOM 229 OD1 ASP A 17 16.381 -13.211 -6.880 1.00 0.00 O ATOM 230 OD2 ASP A 17 17.476 -13.277 -8.784 1.00 0.00 O ATOM 0 H ASP A 17 20.088 -15.086 -5.174 1.00 0.00 H new ATOM 0 HA ASP A 17 17.552 -15.685 -6.097 1.00 0.00 H new ATOM 0 HB2 ASP A 17 18.765 -13.429 -5.896 1.00 0.00 H new ATOM 0 HB3 ASP A 17 19.517 -13.792 -7.437 1.00 0.00 H new ATOM 235 N LEU A 18 19.895 -16.303 -8.351 1.00 0.00 N ATOM 236 CA LEU A 18 20.171 -17.034 -9.583 1.00 0.00 C ATOM 237 C LEU A 18 19.515 -18.411 -9.558 1.00 0.00 C ATOM 238 O LEU A 18 18.896 -18.834 -10.536 1.00 0.00 O ATOM 239 CB LEU A 18 21.680 -17.180 -9.786 1.00 0.00 C ATOM 240 CG LEU A 18 22.347 -16.113 -10.654 1.00 0.00 C ATOM 241 CD1 LEU A 18 22.294 -14.757 -9.968 1.00 0.00 C ATOM 242 CD2 LEU A 18 23.786 -16.500 -10.964 1.00 0.00 C ATOM 0 H LEU A 18 20.704 -15.826 -7.954 1.00 0.00 H new ATOM 0 HA LEU A 18 19.752 -16.467 -10.414 1.00 0.00 H new ATOM 0 HB2 LEU A 18 22.160 -17.176 -8.807 1.00 0.00 H new ATOM 0 HB3 LEU A 18 21.874 -18.156 -10.232 1.00 0.00 H new ATOM 0 HG LEU A 18 21.800 -16.043 -11.594 1.00 0.00 H new ATOM 0 HD11 LEU A 18 22.774 -14.010 -10.601 1.00 0.00 H new ATOM 0 HD12 LEU A 18 21.255 -14.475 -9.798 1.00 0.00 H new ATOM 0 HD13 LEU A 18 22.816 -14.812 -9.013 1.00 0.00 H new ATOM 0 HD21 LEU A 18 24.245 -15.729 -11.583 1.00 0.00 H new ATOM 0 HD22 LEU A 18 24.345 -16.599 -10.033 1.00 0.00 H new ATOM 0 HD23 LEU A 18 23.800 -17.450 -11.498 1.00 0.00 H new ATOM 254 N LEU A 19 19.651 -19.105 -8.433 1.00 0.00 N ATOM 255 CA LEU A 19 19.069 -20.434 -8.279 1.00 0.00 C ATOM 256 C LEU A 19 17.553 -20.386 -8.441 1.00 0.00 C ATOM 257 O LEU A 19 16.955 -21.273 -9.051 1.00 0.00 O ATOM 258 CB LEU A 19 19.429 -21.014 -6.910 1.00 0.00 C ATOM 259 CG LEU A 19 20.905 -21.346 -6.689 1.00 0.00 C ATOM 260 CD1 LEU A 19 21.188 -21.562 -5.211 1.00 0.00 C ATOM 261 CD2 LEU A 19 21.301 -22.575 -7.495 1.00 0.00 C ATOM 0 H LEU A 19 20.159 -18.770 -7.615 1.00 0.00 H new ATOM 0 HA LEU A 19 19.479 -21.076 -9.058 1.00 0.00 H new ATOM 0 HB2 LEU A 19 19.118 -20.304 -6.144 1.00 0.00 H new ATOM 0 HB3 LEU A 19 18.846 -21.922 -6.758 1.00 0.00 H new ATOM 0 HG LEU A 19 21.503 -20.502 -7.033 1.00 0.00 H new ATOM 0 HD11 LEU A 19 22.243 -21.797 -5.073 1.00 0.00 H new ATOM 0 HD12 LEU A 19 20.943 -20.656 -4.657 1.00 0.00 H new ATOM 0 HD13 LEU A 19 20.581 -22.388 -4.841 1.00 0.00 H new ATOM 0 HD21 LEU A 19 22.355 -22.797 -7.326 1.00 0.00 H new ATOM 0 HD22 LEU A 19 20.696 -23.426 -7.182 1.00 0.00 H new ATOM 0 HD23 LEU A 19 21.136 -22.383 -8.555 1.00 0.00 H new ATOM 273 N LEU A 20 16.937 -19.345 -7.892 1.00 0.00 N ATOM 274 CA LEU A 20 15.490 -19.180 -7.978 1.00 0.00 C ATOM 275 C LEU A 20 15.107 -18.356 -9.203 1.00 0.00 C ATOM 276 O LEU A 20 13.926 -18.195 -9.511 1.00 0.00 O ATOM 277 CB LEU A 20 14.958 -18.508 -6.711 1.00 0.00 C ATOM 278 CG LEU A 20 15.634 -18.914 -5.401 1.00 0.00 C ATOM 279 CD1 LEU A 20 14.995 -18.194 -4.224 1.00 0.00 C ATOM 280 CD2 LEU A 20 15.562 -20.422 -5.209 1.00 0.00 C ATOM 0 H LEU A 20 17.417 -18.603 -7.383 1.00 0.00 H new ATOM 0 HA LEU A 20 15.042 -20.169 -8.074 1.00 0.00 H new ATOM 0 HB2 LEU A 20 15.056 -17.429 -6.828 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.893 -18.724 -6.629 1.00 0.00 H new ATOM 0 HG LEU A 20 16.683 -18.623 -5.451 1.00 0.00 H new ATOM 0 HD11 LEU A 20 15.490 -18.496 -3.301 1.00 0.00 H new ATOM 0 HD12 LEU A 20 15.099 -17.117 -4.356 1.00 0.00 H new ATOM 0 HD13 LEU A 20 13.937 -18.452 -4.170 1.00 0.00 H new ATOM 0 HD21 LEU A 20 16.048 -20.693 -4.272 1.00 0.00 H new ATOM 0 HD22 LEU A 20 14.519 -20.736 -5.181 1.00 0.00 H new ATOM 0 HD23 LEU A 20 16.068 -20.919 -6.037 1.00 0.00 H new ATOM 292 N SER A 21 16.114 -17.837 -9.899 1.00 0.00 N ATOM 293 CA SER A 21 15.883 -17.028 -11.090 1.00 0.00 C ATOM 294 C SER A 21 16.609 -17.617 -12.296 1.00 0.00 C ATOM 295 O SER A 21 17.706 -17.194 -12.660 1.00 0.00 O ATOM 296 CB SER A 21 16.347 -15.590 -10.854 1.00 0.00 C ATOM 297 OG SER A 21 15.344 -14.831 -10.201 1.00 0.00 O ATOM 0 H SER A 21 17.097 -17.962 -9.659 1.00 0.00 H new ATOM 0 HA SER A 21 14.813 -17.027 -11.296 1.00 0.00 H new ATOM 0 HB2 SER A 21 17.256 -15.592 -10.252 1.00 0.00 H new ATOM 0 HB3 SER A 21 16.597 -15.124 -11.807 1.00 0.00 H new ATOM 0 HG SER A 21 15.765 -14.163 -9.621 1.00 0.00 H new ATOM 303 N PRO A 22 15.983 -18.619 -12.931 1.00 0.00 N ATOM 304 CA PRO A 22 16.550 -19.289 -14.106 1.00 0.00 C ATOM 305 C PRO A 22 16.564 -18.387 -15.335 1.00 0.00 C ATOM 306 O PRO A 22 17.167 -18.723 -16.354 1.00 0.00 O ATOM 307 CB PRO A 22 15.610 -20.477 -14.324 1.00 0.00 C ATOM 308 CG PRO A 22 14.316 -20.053 -13.719 1.00 0.00 C ATOM 309 CD PRO A 22 14.673 -19.175 -12.552 1.00 0.00 C ATOM 0 HA PRO A 22 17.590 -19.575 -13.951 1.00 0.00 H new ATOM 0 HB2 PRO A 22 15.496 -20.702 -15.384 1.00 0.00 H new ATOM 0 HB3 PRO A 22 15.994 -21.378 -13.846 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.706 -19.512 -14.442 1.00 0.00 H new ATOM 0 HG3 PRO A 22 13.735 -20.916 -13.395 1.00 0.00 H new ATOM 0 HD2 PRO A 22 13.933 -18.390 -12.399 1.00 0.00 H new ATOM 0 HD3 PRO A 22 14.731 -19.744 -11.624 1.00 0.00 H new ATOM 317 N GLU A 23 15.897 -17.242 -15.232 1.00 0.00 N ATOM 318 CA GLU A 23 15.834 -16.293 -16.338 1.00 0.00 C ATOM 319 C GLU A 23 17.112 -15.462 -16.414 1.00 0.00 C ATOM 320 O GLU A 23 17.489 -14.983 -17.483 1.00 0.00 O ATOM 321 CB GLU A 23 14.622 -15.373 -16.181 1.00 0.00 C ATOM 322 CG GLU A 23 13.477 -15.708 -17.122 1.00 0.00 C ATOM 323 CD GLU A 23 12.589 -14.514 -17.409 1.00 0.00 C ATOM 324 OE1 GLU A 23 12.400 -13.683 -16.496 1.00 0.00 O ATOM 325 OE2 GLU A 23 12.083 -14.409 -18.546 1.00 0.00 O ATOM 0 H GLU A 23 15.393 -16.949 -14.395 1.00 0.00 H new ATOM 0 HA GLU A 23 15.733 -16.859 -17.264 1.00 0.00 H new ATOM 0 HB2 GLU A 23 14.264 -15.430 -15.153 1.00 0.00 H new ATOM 0 HB3 GLU A 23 14.934 -14.343 -16.354 1.00 0.00 H new ATOM 0 HG2 GLU A 23 13.882 -16.088 -18.060 1.00 0.00 H new ATOM 0 HG3 GLU A 23 12.876 -16.507 -16.687 1.00 0.00 H new ATOM 332 N GLU A 24 17.771 -15.294 -15.272 1.00 0.00 N ATOM 333 CA GLU A 24 19.005 -14.519 -15.210 1.00 0.00 C ATOM 334 C GLU A 24 20.220 -15.437 -15.119 1.00 0.00 C ATOM 335 O GLU A 24 21.210 -15.246 -15.824 1.00 0.00 O ATOM 336 CB GLU A 24 18.977 -13.571 -14.009 1.00 0.00 C ATOM 337 CG GLU A 24 18.570 -12.151 -14.364 1.00 0.00 C ATOM 338 CD GLU A 24 19.702 -11.157 -14.183 1.00 0.00 C ATOM 339 OE1 GLU A 24 20.501 -11.335 -13.240 1.00 0.00 O ATOM 340 OE2 GLU A 24 19.788 -10.203 -14.984 1.00 0.00 O ATOM 0 H GLU A 24 17.472 -15.684 -14.378 1.00 0.00 H new ATOM 0 HA GLU A 24 19.083 -13.933 -16.126 1.00 0.00 H new ATOM 0 HB2 GLU A 24 18.285 -13.963 -13.264 1.00 0.00 H new ATOM 0 HB3 GLU A 24 19.965 -13.552 -13.548 1.00 0.00 H new ATOM 0 HG2 GLU A 24 18.229 -12.123 -15.399 1.00 0.00 H new ATOM 0 HG3 GLU A 24 17.726 -11.852 -13.742 1.00 0.00 H new ATOM 347 N ASN A 25 20.137 -16.435 -14.245 1.00 0.00 N ATOM 348 CA ASN A 25 21.230 -17.383 -14.061 1.00 0.00 C ATOM 349 C ASN A 25 21.467 -18.194 -15.331 1.00 0.00 C ATOM 350 O ASN A 25 20.569 -18.884 -15.815 1.00 0.00 O ATOM 351 CB ASN A 25 20.926 -18.322 -12.892 1.00 0.00 C ATOM 352 CG ASN A 25 22.046 -19.314 -12.641 1.00 0.00 C ATOM 353 OD1 ASN A 25 23.205 -19.052 -12.962 1.00 0.00 O ATOM 354 ND2 ASN A 25 21.703 -20.460 -12.064 1.00 0.00 N ATOM 0 H ASN A 25 19.324 -16.608 -13.653 1.00 0.00 H new ATOM 0 HA ASN A 25 22.135 -16.817 -13.839 1.00 0.00 H new ATOM 0 HB2 ASN A 25 20.757 -17.733 -11.991 1.00 0.00 H new ATOM 0 HB3 ASN A 25 20.003 -18.864 -13.096 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.413 -21.166 -11.870 1.00 0.00 H new ATOM 0 HD22 ASN A 25 20.729 -20.634 -11.815 1.00 0.00 H new ATOM 361 N CYS A 26 22.680 -18.105 -15.865 1.00 0.00 N ATOM 362 CA CYS A 26 23.036 -18.830 -17.080 1.00 0.00 C ATOM 363 C CYS A 26 24.122 -19.863 -16.798 1.00 0.00 C ATOM 364 O CYS A 26 25.310 -19.588 -16.954 1.00 0.00 O ATOM 365 CB CYS A 26 23.509 -17.856 -18.160 1.00 0.00 C ATOM 366 SG CYS A 26 22.884 -18.228 -19.815 1.00 0.00 S ATOM 0 H CYS A 26 23.434 -17.538 -15.476 1.00 0.00 H new ATOM 0 HA CYS A 26 22.148 -19.352 -17.436 1.00 0.00 H new ATOM 0 HB2 CYS A 26 23.200 -16.847 -17.885 1.00 0.00 H new ATOM 0 HB3 CYS A 26 24.599 -17.860 -18.186 1.00 0.00 H new ATOM 0 HG CYS A 26 23.337 -17.348 -20.658 1.00 0.00 H new ATOM 372 N GLY A 27 23.704 -21.054 -16.380 1.00 0.00 N ATOM 373 CA GLY A 27 24.653 -22.110 -16.080 1.00 0.00 C ATOM 374 C GLY A 27 25.779 -21.640 -15.181 1.00 0.00 C ATOM 375 O GLY A 27 26.923 -22.071 -15.330 1.00 0.00 O ATOM 0 H GLY A 27 22.725 -21.306 -16.244 1.00 0.00 H new ATOM 0 HA2 GLY A 27 24.131 -22.938 -15.600 1.00 0.00 H new ATOM 0 HA3 GLY A 27 25.071 -22.493 -17.011 1.00 0.00 H new ATOM 379 N ILE A 28 25.456 -20.753 -14.246 1.00 0.00 N ATOM 380 CA ILE A 28 26.449 -20.224 -13.320 1.00 0.00 C ATOM 381 C ILE A 28 26.485 -21.036 -12.029 1.00 0.00 C ATOM 382 O ILE A 28 27.522 -21.129 -11.370 1.00 0.00 O ATOM 383 CB ILE A 28 26.170 -18.748 -12.977 1.00 0.00 C ATOM 384 CG1 ILE A 28 25.916 -17.945 -14.254 1.00 0.00 C ATOM 385 CG2 ILE A 28 27.334 -18.157 -12.195 1.00 0.00 C ATOM 386 CD1 ILE A 28 25.443 -16.532 -13.995 1.00 0.00 C ATOM 0 H ILE A 28 24.514 -20.386 -14.110 1.00 0.00 H new ATOM 0 HA ILE A 28 27.415 -20.296 -13.819 1.00 0.00 H new ATOM 0 HB ILE A 28 25.277 -18.697 -12.354 1.00 0.00 H new ATOM 0 HG12 ILE A 28 26.834 -17.910 -14.840 1.00 0.00 H new ATOM 0 HG13 ILE A 28 25.171 -18.464 -14.858 1.00 0.00 H new ATOM 0 HG21 ILE A 28 27.122 -17.114 -11.960 1.00 0.00 H new ATOM 0 HG22 ILE A 28 27.472 -18.717 -11.270 1.00 0.00 H new ATOM 0 HG23 ILE A 28 28.243 -18.217 -12.794 1.00 0.00 H new ATOM 0 HD11 ILE A 28 25.283 -16.022 -14.945 1.00 0.00 H new ATOM 0 HD12 ILE A 28 24.508 -16.558 -13.435 1.00 0.00 H new ATOM 0 HD13 ILE A 28 26.197 -15.996 -13.418 1.00 0.00 H new ATOM 398 N LEU A 29 25.347 -21.622 -11.674 1.00 0.00 N ATOM 399 CA LEU A 29 25.248 -22.429 -10.463 1.00 0.00 C ATOM 400 C LEU A 29 24.477 -23.718 -10.729 1.00 0.00 C ATOM 401 O LEU A 29 23.984 -23.940 -11.834 1.00 0.00 O ATOM 402 CB LEU A 29 24.564 -21.632 -9.351 1.00 0.00 C ATOM 403 CG LEU A 29 25.143 -20.246 -9.065 1.00 0.00 C ATOM 404 CD1 LEU A 29 24.034 -19.266 -8.715 1.00 0.00 C ATOM 405 CD2 LEU A 29 26.167 -20.318 -7.941 1.00 0.00 C ATOM 0 H LEU A 29 24.480 -21.554 -12.207 1.00 0.00 H new ATOM 0 HA LEU A 29 26.258 -22.691 -10.146 1.00 0.00 H new ATOM 0 HB2 LEU A 29 23.511 -21.518 -9.608 1.00 0.00 H new ATOM 0 HB3 LEU A 29 24.606 -22.218 -8.433 1.00 0.00 H new ATOM 0 HG LEU A 29 25.644 -19.890 -9.965 1.00 0.00 H new ATOM 0 HD11 LEU A 29 24.465 -18.285 -8.515 1.00 0.00 H new ATOM 0 HD12 LEU A 29 23.337 -19.192 -9.550 1.00 0.00 H new ATOM 0 HD13 LEU A 29 23.504 -19.617 -7.830 1.00 0.00 H new ATOM 0 HD21 LEU A 29 26.569 -19.323 -7.751 1.00 0.00 H new ATOM 0 HD22 LEU A 29 25.689 -20.695 -7.037 1.00 0.00 H new ATOM 0 HD23 LEU A 29 26.977 -20.987 -8.229 1.00 0.00 H new ATOM 417 N GLU A 30 24.376 -24.563 -9.707 1.00 0.00 N ATOM 418 CA GLU A 30 23.663 -25.829 -9.831 1.00 0.00 C ATOM 419 C GLU A 30 23.026 -26.227 -8.503 1.00 0.00 C ATOM 420 O GLU A 30 23.550 -25.917 -7.433 1.00 0.00 O ATOM 421 CB GLU A 30 24.614 -26.931 -10.304 1.00 0.00 C ATOM 422 CG GLU A 30 24.604 -27.138 -11.809 1.00 0.00 C ATOM 423 CD GLU A 30 24.898 -28.573 -12.201 1.00 0.00 C ATOM 424 OE1 GLU A 30 26.041 -29.027 -11.977 1.00 0.00 O ATOM 425 OE2 GLU A 30 23.988 -29.242 -12.732 1.00 0.00 O ATOM 0 H GLU A 30 24.779 -24.394 -8.785 1.00 0.00 H new ATOM 0 HA GLU A 30 22.872 -25.700 -10.569 1.00 0.00 H new ATOM 0 HB2 GLU A 30 25.627 -26.686 -9.986 1.00 0.00 H new ATOM 0 HB3 GLU A 30 24.344 -27.867 -9.815 1.00 0.00 H new ATOM 0 HG2 GLU A 30 23.631 -26.849 -12.206 1.00 0.00 H new ATOM 0 HG3 GLU A 30 25.343 -26.481 -12.268 1.00 0.00 H new ATOM 432 N TRP A 31 21.892 -26.914 -8.580 1.00 0.00 N ATOM 433 CA TRP A 31 21.182 -27.354 -7.384 1.00 0.00 C ATOM 434 C TRP A 31 21.562 -28.785 -7.021 1.00 0.00 C ATOM 435 O TRP A 31 20.999 -29.740 -7.556 1.00 0.00 O ATOM 436 CB TRP A 31 19.671 -27.253 -7.597 1.00 0.00 C ATOM 437 CG TRP A 31 19.092 -25.949 -7.138 1.00 0.00 C ATOM 438 CD1 TRP A 31 18.374 -25.061 -7.887 1.00 0.00 C ATOM 439 CD2 TRP A 31 19.185 -25.386 -5.825 1.00 0.00 C ATOM 440 NE1 TRP A 31 18.014 -23.980 -7.119 1.00 0.00 N ATOM 441 CE2 TRP A 31 18.499 -24.155 -5.850 1.00 0.00 C ATOM 442 CE3 TRP A 31 19.779 -25.801 -4.630 1.00 0.00 C ATOM 443 CZ2 TRP A 31 18.394 -23.339 -4.726 1.00 0.00 C ATOM 444 CZ3 TRP A 31 19.674 -24.990 -3.516 1.00 0.00 C ATOM 445 CH2 TRP A 31 18.985 -23.771 -3.570 1.00 0.00 C ATOM 0 H TRP A 31 21.444 -27.178 -9.458 1.00 0.00 H new ATOM 0 HA TRP A 31 21.470 -26.701 -6.560 1.00 0.00 H new ATOM 0 HB2 TRP A 31 19.451 -27.387 -8.656 1.00 0.00 H new ATOM 0 HB3 TRP A 31 19.181 -28.068 -7.064 1.00 0.00 H new ATOM 0 HD1 TRP A 31 18.126 -25.190 -8.930 1.00 0.00 H new ATOM 0 HE1 TRP A 31 17.473 -23.177 -7.442 1.00 0.00 H new ATOM 0 HE3 TRP A 31 20.311 -26.739 -4.578 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 17.865 -22.398 -4.766 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 20.131 -25.301 -2.588 1.00 0.00 H new ATOM 0 HH2 TRP A 31 18.919 -23.160 -2.682 1.00 0.00 H new ATOM 456 N GLU A 32 22.520 -28.926 -6.110 1.00 0.00 N ATOM 457 CA GLU A 32 22.974 -30.242 -5.677 1.00 0.00 C ATOM 458 C GLU A 32 21.938 -30.906 -4.775 1.00 0.00 C ATOM 459 O GLU A 32 21.736 -32.119 -4.831 1.00 0.00 O ATOM 460 CB GLU A 32 24.310 -30.128 -4.940 1.00 0.00 C ATOM 461 CG GLU A 32 25.518 -30.167 -5.861 1.00 0.00 C ATOM 462 CD GLU A 32 25.967 -31.581 -6.173 1.00 0.00 C ATOM 463 OE1 GLU A 32 25.098 -32.428 -6.467 1.00 0.00 O ATOM 464 OE2 GLU A 32 27.188 -31.841 -6.125 1.00 0.00 O ATOM 0 H GLU A 32 22.996 -28.145 -5.658 1.00 0.00 H new ATOM 0 HA GLU A 32 23.108 -30.861 -6.564 1.00 0.00 H new ATOM 0 HB2 GLU A 32 24.325 -29.197 -4.374 1.00 0.00 H new ATOM 0 HB3 GLU A 32 24.388 -30.941 -4.218 1.00 0.00 H new ATOM 0 HG2 GLU A 32 25.278 -29.652 -6.791 1.00 0.00 H new ATOM 0 HG3 GLU A 32 26.341 -29.622 -5.398 1.00 0.00 H new ATOM 471 N ASP A 33 21.284 -30.102 -3.944 1.00 0.00 N ATOM 472 CA ASP A 33 20.268 -30.610 -3.030 1.00 0.00 C ATOM 473 C ASP A 33 19.382 -29.478 -2.518 1.00 0.00 C ATOM 474 O ASP A 33 19.735 -28.783 -1.565 1.00 0.00 O ATOM 475 CB ASP A 33 20.926 -31.331 -1.852 1.00 0.00 C ATOM 476 CG ASP A 33 20.546 -32.797 -1.786 1.00 0.00 C ATOM 477 OD1 ASP A 33 19.336 -33.100 -1.855 1.00 0.00 O ATOM 478 OD2 ASP A 33 21.458 -33.642 -1.664 1.00 0.00 O ATOM 0 H ASP A 33 21.439 -29.096 -3.885 1.00 0.00 H new ATOM 0 HA ASP A 33 19.644 -31.317 -3.577 1.00 0.00 H new ATOM 0 HB2 ASP A 33 22.009 -31.243 -1.935 1.00 0.00 H new ATOM 0 HB3 ASP A 33 20.636 -30.841 -0.922 1.00 0.00 H new ATOM 483 N ARG A 34 18.231 -29.298 -3.158 1.00 0.00 N ATOM 484 CA ARG A 34 17.297 -28.249 -2.770 1.00 0.00 C ATOM 485 C ARG A 34 16.859 -28.421 -1.318 1.00 0.00 C ATOM 486 O ARG A 34 16.804 -27.455 -0.558 1.00 0.00 O ATOM 487 CB ARG A 34 16.073 -28.262 -3.687 1.00 0.00 C ATOM 488 CG ARG A 34 15.297 -26.955 -3.686 1.00 0.00 C ATOM 489 CD ARG A 34 15.776 -26.022 -4.787 1.00 0.00 C ATOM 490 NE ARG A 34 15.162 -24.700 -4.690 1.00 0.00 N ATOM 491 CZ ARG A 34 13.906 -24.446 -5.038 1.00 0.00 C ATOM 492 NH1 ARG A 34 13.134 -25.419 -5.503 1.00 0.00 N ATOM 493 NH2 ARG A 34 13.419 -23.217 -4.921 1.00 0.00 N ATOM 0 H ARG A 34 17.923 -29.866 -3.948 1.00 0.00 H new ATOM 0 HA ARG A 34 17.806 -27.290 -2.867 1.00 0.00 H new ATOM 0 HB2 ARG A 34 16.394 -28.483 -4.705 1.00 0.00 H new ATOM 0 HB3 ARG A 34 15.408 -29.070 -3.380 1.00 0.00 H new ATOM 0 HG2 ARG A 34 14.235 -27.161 -3.819 1.00 0.00 H new ATOM 0 HG3 ARG A 34 15.408 -26.465 -2.719 1.00 0.00 H new ATOM 0 HD2 ARG A 34 16.860 -25.923 -4.732 1.00 0.00 H new ATOM 0 HD3 ARG A 34 15.545 -26.459 -5.758 1.00 0.00 H new ATOM 0 HE ARG A 34 15.729 -23.930 -4.336 1.00 0.00 H new ATOM 0 HH11 ARG A 34 13.505 -26.365 -5.594 1.00 0.00 H new ATOM 0 HH12 ARG A 34 12.169 -25.221 -5.770 1.00 0.00 H new ATOM 0 HH21 ARG A 34 14.010 -22.466 -4.563 1.00 0.00 H new ATOM 0 HH22 ARG A 34 12.454 -23.023 -5.189 1.00 0.00 H new ATOM 507 N GLU A 35 16.549 -29.658 -0.941 1.00 0.00 N ATOM 508 CA GLU A 35 16.115 -29.955 0.419 1.00 0.00 C ATOM 509 C GLU A 35 17.131 -29.445 1.437 1.00 0.00 C ATOM 510 O GLU A 35 16.773 -28.757 2.393 1.00 0.00 O ATOM 511 CB GLU A 35 15.913 -31.462 0.595 1.00 0.00 C ATOM 512 CG GLU A 35 14.471 -31.906 0.419 1.00 0.00 C ATOM 513 CD GLU A 35 13.865 -32.446 1.700 1.00 0.00 C ATOM 514 OE1 GLU A 35 14.581 -33.151 2.442 1.00 0.00 O ATOM 515 OE2 GLU A 35 12.678 -32.163 1.961 1.00 0.00 O ATOM 0 H GLU A 35 16.590 -30.469 -1.558 1.00 0.00 H new ATOM 0 HA GLU A 35 15.167 -29.446 0.591 1.00 0.00 H new ATOM 0 HB2 GLU A 35 16.538 -31.991 -0.125 1.00 0.00 H new ATOM 0 HB3 GLU A 35 16.255 -31.753 1.588 1.00 0.00 H new ATOM 0 HG2 GLU A 35 13.876 -31.063 0.067 1.00 0.00 H new ATOM 0 HG3 GLU A 35 14.423 -32.674 -0.353 1.00 0.00 H new ATOM 522 N GLN A 36 18.397 -29.788 1.225 1.00 0.00 N ATOM 523 CA GLN A 36 19.463 -29.366 2.126 1.00 0.00 C ATOM 524 C GLN A 36 19.874 -27.925 1.845 1.00 0.00 C ATOM 525 O GLN A 36 20.424 -27.246 2.710 1.00 0.00 O ATOM 526 CB GLN A 36 20.674 -30.291 1.985 1.00 0.00 C ATOM 527 CG GLN A 36 20.322 -31.768 2.051 1.00 0.00 C ATOM 528 CD GLN A 36 21.395 -32.594 2.733 1.00 0.00 C ATOM 529 OE1 GLN A 36 22.381 -32.989 2.110 1.00 0.00 O ATOM 530 NE2 GLN A 36 21.209 -32.859 4.021 1.00 0.00 N ATOM 0 H GLN A 36 18.710 -30.356 0.438 1.00 0.00 H new ATOM 0 HA GLN A 36 19.086 -29.425 3.147 1.00 0.00 H new ATOM 0 HB2 GLN A 36 21.169 -30.086 1.036 1.00 0.00 H new ATOM 0 HB3 GLN A 36 21.390 -30.061 2.774 1.00 0.00 H new ATOM 0 HG2 GLN A 36 19.380 -31.890 2.586 1.00 0.00 H new ATOM 0 HG3 GLN A 36 20.165 -32.146 1.041 1.00 0.00 H new ATOM 0 HE21 GLN A 36 20.377 -32.512 4.498 1.00 0.00 H new ATOM 0 HE22 GLN A 36 21.898 -33.410 4.533 1.00 0.00 H new ATOM 539 N GLY A 37 19.604 -27.464 0.627 1.00 0.00 N ATOM 540 CA GLY A 37 19.952 -26.106 0.254 1.00 0.00 C ATOM 541 C GLY A 37 21.384 -25.987 -0.230 1.00 0.00 C ATOM 542 O GLY A 37 22.007 -24.933 -0.094 1.00 0.00 O ATOM 0 H GLY A 37 19.150 -28.007 -0.108 1.00 0.00 H new ATOM 0 HA2 GLY A 37 19.277 -25.763 -0.530 1.00 0.00 H new ATOM 0 HA3 GLY A 37 19.805 -25.448 1.111 1.00 0.00 H new ATOM 546 N ILE A 38 21.908 -27.070 -0.794 1.00 0.00 N ATOM 547 CA ILE A 38 23.275 -27.082 -1.299 1.00 0.00 C ATOM 548 C ILE A 38 23.320 -26.704 -2.775 1.00 0.00 C ATOM 549 O ILE A 38 22.521 -27.190 -3.576 1.00 0.00 O ATOM 550 CB ILE A 38 23.931 -28.463 -1.114 1.00 0.00 C ATOM 551 CG1 ILE A 38 23.984 -28.833 0.369 1.00 0.00 C ATOM 552 CG2 ILE A 38 25.328 -28.472 -1.718 1.00 0.00 C ATOM 553 CD1 ILE A 38 24.042 -30.324 0.619 1.00 0.00 C ATOM 0 H ILE A 38 21.407 -27.950 -0.913 1.00 0.00 H new ATOM 0 HA ILE A 38 23.831 -26.344 -0.721 1.00 0.00 H new ATOM 0 HB ILE A 38 23.327 -29.207 -1.633 1.00 0.00 H new ATOM 0 HG12 ILE A 38 24.857 -28.363 0.821 1.00 0.00 H new ATOM 0 HG13 ILE A 38 23.106 -28.423 0.869 1.00 0.00 H new ATOM 0 HG21 ILE A 38 25.778 -29.455 -1.579 1.00 0.00 H new ATOM 0 HG22 ILE A 38 25.265 -28.249 -2.783 1.00 0.00 H new ATOM 0 HG23 ILE A 38 25.942 -27.719 -1.225 1.00 0.00 H new ATOM 0 HD11 ILE A 38 24.078 -30.512 1.692 1.00 0.00 H new ATOM 0 HD12 ILE A 38 23.156 -30.798 0.197 1.00 0.00 H new ATOM 0 HD13 ILE A 38 24.934 -30.737 0.148 1.00 0.00 H new ATOM 565 N PHE A 39 24.260 -25.834 -3.130 1.00 0.00 N ATOM 566 CA PHE A 39 24.410 -25.390 -4.511 1.00 0.00 C ATOM 567 C PHE A 39 25.882 -25.346 -4.911 1.00 0.00 C ATOM 568 O PHE A 39 26.757 -25.123 -4.075 1.00 0.00 O ATOM 569 CB PHE A 39 23.778 -24.010 -4.697 1.00 0.00 C ATOM 570 CG PHE A 39 24.488 -22.919 -3.947 1.00 0.00 C ATOM 571 CD1 PHE A 39 24.284 -22.750 -2.587 1.00 0.00 C ATOM 572 CD2 PHE A 39 25.359 -22.064 -4.601 1.00 0.00 C ATOM 573 CE1 PHE A 39 24.936 -21.747 -1.894 1.00 0.00 C ATOM 574 CE2 PHE A 39 26.014 -21.059 -3.914 1.00 0.00 C ATOM 575 CZ PHE A 39 25.803 -20.901 -2.559 1.00 0.00 C ATOM 0 H PHE A 39 24.930 -25.422 -2.480 1.00 0.00 H new ATOM 0 HA PHE A 39 23.898 -26.106 -5.154 1.00 0.00 H new ATOM 0 HB2 PHE A 39 23.769 -23.764 -5.759 1.00 0.00 H new ATOM 0 HB3 PHE A 39 22.739 -24.048 -4.370 1.00 0.00 H new ATOM 0 HD1 PHE A 39 23.608 -23.409 -2.062 1.00 0.00 H new ATOM 0 HD2 PHE A 39 25.529 -22.184 -5.661 1.00 0.00 H new ATOM 0 HE1 PHE A 39 24.768 -21.625 -0.834 1.00 0.00 H new ATOM 0 HE2 PHE A 39 26.690 -20.398 -4.437 1.00 0.00 H new ATOM 0 HZ PHE A 39 26.315 -20.118 -2.020 1.00 0.00 H new ATOM 585 N ARG A 40 26.146 -25.562 -6.196 1.00 0.00 N ATOM 586 CA ARG A 40 27.511 -25.549 -6.707 1.00 0.00 C ATOM 587 C ARG A 40 27.734 -24.354 -7.631 1.00 0.00 C ATOM 588 O ARG A 40 26.818 -23.912 -8.324 1.00 0.00 O ATOM 589 CB ARG A 40 27.810 -26.848 -7.456 1.00 0.00 C ATOM 590 CG ARG A 40 29.119 -26.820 -8.228 1.00 0.00 C ATOM 591 CD ARG A 40 29.124 -27.839 -9.356 1.00 0.00 C ATOM 592 NE ARG A 40 30.234 -27.627 -10.281 1.00 0.00 N ATOM 593 CZ ARG A 40 30.388 -28.306 -11.412 1.00 0.00 C ATOM 594 NH1 ARG A 40 29.508 -29.236 -11.756 1.00 0.00 N ATOM 595 NH2 ARG A 40 31.425 -28.056 -12.202 1.00 0.00 N ATOM 0 H ARG A 40 25.433 -25.748 -6.901 1.00 0.00 H new ATOM 0 HA ARG A 40 28.189 -25.462 -5.858 1.00 0.00 H new ATOM 0 HB2 ARG A 40 27.837 -27.671 -6.742 1.00 0.00 H new ATOM 0 HB3 ARG A 40 26.994 -27.054 -8.149 1.00 0.00 H new ATOM 0 HG2 ARG A 40 29.280 -25.823 -8.637 1.00 0.00 H new ATOM 0 HG3 ARG A 40 29.947 -27.023 -7.549 1.00 0.00 H new ATOM 0 HD2 ARG A 40 29.188 -28.843 -8.937 1.00 0.00 H new ATOM 0 HD3 ARG A 40 28.182 -27.781 -9.901 1.00 0.00 H new ATOM 0 HE ARG A 40 30.929 -26.919 -10.046 1.00 0.00 H new ATOM 0 HH11 ARG A 40 28.710 -29.432 -11.151 1.00 0.00 H new ATOM 0 HH12 ARG A 40 29.629 -29.756 -12.625 1.00 0.00 H new ATOM 0 HH21 ARG A 40 32.105 -27.342 -11.941 1.00 0.00 H new ATOM 0 HH22 ARG A 40 31.542 -28.578 -13.070 1.00 0.00 H new ATOM 609 N VAL A 41 28.958 -23.836 -7.634 1.00 0.00 N ATOM 610 CA VAL A 41 29.302 -22.694 -8.472 1.00 0.00 C ATOM 611 C VAL A 41 29.905 -23.146 -9.797 1.00 0.00 C ATOM 612 O VAL A 41 31.125 -23.166 -9.962 1.00 0.00 O ATOM 613 CB VAL A 41 30.296 -21.756 -7.762 1.00 0.00 C ATOM 614 CG1 VAL A 41 30.763 -20.658 -8.706 1.00 0.00 C ATOM 615 CG2 VAL A 41 29.667 -21.162 -6.510 1.00 0.00 C ATOM 0 H VAL A 41 29.728 -24.189 -7.065 1.00 0.00 H new ATOM 0 HA VAL A 41 28.376 -22.152 -8.664 1.00 0.00 H new ATOM 0 HB VAL A 41 31.167 -22.339 -7.462 1.00 0.00 H new ATOM 0 HG11 VAL A 41 31.465 -20.005 -8.186 1.00 0.00 H new ATOM 0 HG12 VAL A 41 31.255 -21.106 -9.570 1.00 0.00 H new ATOM 0 HG13 VAL A 41 29.904 -20.075 -9.039 1.00 0.00 H new ATOM 0 HG21 VAL A 41 30.383 -20.502 -6.021 1.00 0.00 H new ATOM 0 HG22 VAL A 41 28.778 -20.594 -6.784 1.00 0.00 H new ATOM 0 HG23 VAL A 41 29.388 -21.964 -5.827 1.00 0.00 H new ATOM 625 N VAL A 42 29.042 -23.508 -10.741 1.00 0.00 N ATOM 626 CA VAL A 42 29.489 -23.959 -12.054 1.00 0.00 C ATOM 627 C VAL A 42 30.511 -22.996 -12.646 1.00 0.00 C ATOM 628 O VAL A 42 31.574 -23.410 -13.110 1.00 0.00 O ATOM 629 CB VAL A 42 28.306 -24.101 -13.031 1.00 0.00 C ATOM 630 CG1 VAL A 42 28.797 -24.533 -14.404 1.00 0.00 C ATOM 631 CG2 VAL A 42 27.282 -25.085 -12.487 1.00 0.00 C ATOM 0 H VAL A 42 28.029 -23.498 -10.621 1.00 0.00 H new ATOM 0 HA VAL A 42 29.953 -24.935 -11.913 1.00 0.00 H new ATOM 0 HB VAL A 42 27.823 -23.129 -13.134 1.00 0.00 H new ATOM 0 HG11 VAL A 42 27.948 -24.628 -15.081 1.00 0.00 H new ATOM 0 HG12 VAL A 42 29.490 -23.787 -14.794 1.00 0.00 H new ATOM 0 HG13 VAL A 42 29.306 -25.494 -14.323 1.00 0.00 H new ATOM 0 HG21 VAL A 42 26.453 -25.173 -13.189 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.750 -26.060 -12.353 1.00 0.00 H new ATOM 0 HG23 VAL A 42 26.908 -24.728 -11.528 1.00 0.00 H new ATOM 641 N LYS A 43 30.183 -21.709 -12.629 1.00 0.00 N ATOM 642 CA LYS A 43 31.073 -20.685 -13.163 1.00 0.00 C ATOM 643 C LYS A 43 31.524 -19.729 -12.063 1.00 0.00 C ATOM 644 O LYS A 43 30.743 -18.907 -11.583 1.00 0.00 O ATOM 645 CB LYS A 43 30.374 -19.903 -14.278 1.00 0.00 C ATOM 646 CG LYS A 43 30.073 -20.739 -15.510 1.00 0.00 C ATOM 647 CD LYS A 43 29.226 -19.972 -16.510 1.00 0.00 C ATOM 648 CE LYS A 43 28.999 -20.776 -17.781 1.00 0.00 C ATOM 649 NZ LYS A 43 29.984 -20.427 -18.842 1.00 0.00 N ATOM 0 H LYS A 43 29.306 -21.350 -12.251 1.00 0.00 H new ATOM 0 HA LYS A 43 31.953 -21.181 -13.572 1.00 0.00 H new ATOM 0 HB2 LYS A 43 29.442 -19.491 -13.892 1.00 0.00 H new ATOM 0 HB3 LYS A 43 31.000 -19.059 -14.566 1.00 0.00 H new ATOM 0 HG2 LYS A 43 31.007 -21.044 -15.981 1.00 0.00 H new ATOM 0 HG3 LYS A 43 29.553 -21.650 -15.214 1.00 0.00 H new ATOM 0 HD2 LYS A 43 28.265 -19.723 -16.059 1.00 0.00 H new ATOM 0 HD3 LYS A 43 29.716 -19.030 -16.757 1.00 0.00 H new ATOM 0 HE2 LYS A 43 29.070 -21.840 -17.555 1.00 0.00 H new ATOM 0 HE3 LYS A 43 27.989 -20.595 -18.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 29.795 -20.996 -19.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 29.899 -19.417 -19.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 30.946 -20.623 -18.500 1.00 0.00 H new ATOM 663 N SER A 44 32.789 -19.841 -11.670 1.00 0.00 N ATOM 664 CA SER A 44 33.343 -18.987 -10.625 1.00 0.00 C ATOM 665 C SER A 44 33.656 -17.597 -11.168 1.00 0.00 C ATOM 666 O SER A 44 33.698 -16.621 -10.419 1.00 0.00 O ATOM 667 CB SER A 44 34.610 -19.616 -10.042 1.00 0.00 C ATOM 668 OG SER A 44 35.668 -19.600 -10.984 1.00 0.00 O ATOM 0 H SER A 44 33.449 -20.514 -12.059 1.00 0.00 H new ATOM 0 HA SER A 44 32.597 -18.890 -9.836 1.00 0.00 H new ATOM 0 HB2 SER A 44 34.909 -19.074 -9.145 1.00 0.00 H new ATOM 0 HB3 SER A 44 34.404 -20.643 -9.740 1.00 0.00 H new ATOM 0 HG SER A 44 36.466 -20.006 -10.586 1.00 0.00 H new ATOM 674 N GLU A 45 33.875 -17.515 -12.477 1.00 0.00 N ATOM 675 CA GLU A 45 34.185 -16.244 -13.121 1.00 0.00 C ATOM 676 C GLU A 45 32.914 -15.440 -13.379 1.00 0.00 C ATOM 677 O GLU A 45 32.853 -14.246 -13.090 1.00 0.00 O ATOM 678 CB GLU A 45 34.927 -16.482 -14.438 1.00 0.00 C ATOM 679 CG GLU A 45 34.173 -17.377 -15.408 1.00 0.00 C ATOM 680 CD GLU A 45 34.941 -17.621 -16.693 1.00 0.00 C ATOM 681 OE1 GLU A 45 36.099 -18.082 -16.613 1.00 0.00 O ATOM 682 OE2 GLU A 45 34.385 -17.351 -17.778 1.00 0.00 O ATOM 0 H GLU A 45 33.843 -18.313 -13.111 1.00 0.00 H new ATOM 0 HA GLU A 45 34.825 -15.673 -12.449 1.00 0.00 H new ATOM 0 HB2 GLU A 45 35.118 -15.521 -14.916 1.00 0.00 H new ATOM 0 HB3 GLU A 45 35.897 -16.930 -14.223 1.00 0.00 H new ATOM 0 HG2 GLU A 45 33.963 -18.333 -14.927 1.00 0.00 H new ATOM 0 HG3 GLU A 45 33.211 -16.922 -15.645 1.00 0.00 H new ATOM 689 N ALA A 46 31.901 -16.105 -13.925 1.00 0.00 N ATOM 690 CA ALA A 46 30.631 -15.454 -14.221 1.00 0.00 C ATOM 691 C ALA A 46 29.933 -15.005 -12.942 1.00 0.00 C ATOM 692 O ALA A 46 29.345 -13.924 -12.890 1.00 0.00 O ATOM 693 CB ALA A 46 29.731 -16.390 -15.015 1.00 0.00 C ATOM 0 H ALA A 46 31.935 -17.094 -14.171 1.00 0.00 H new ATOM 0 HA ALA A 46 30.836 -14.568 -14.822 1.00 0.00 H new ATOM 0 HB1 ALA A 46 28.786 -15.891 -15.229 1.00 0.00 H new ATOM 0 HB2 ALA A 46 30.220 -16.658 -15.951 1.00 0.00 H new ATOM 0 HB3 ALA A 46 29.541 -17.292 -14.434 1.00 0.00 H new ATOM 699 N LEU A 47 30.001 -15.841 -11.911 1.00 0.00 N ATOM 700 CA LEU A 47 29.375 -15.530 -10.631 1.00 0.00 C ATOM 701 C LEU A 47 29.878 -14.196 -10.089 1.00 0.00 C ATOM 702 O LEU A 47 29.089 -13.307 -9.770 1.00 0.00 O ATOM 703 CB LEU A 47 29.656 -16.643 -9.620 1.00 0.00 C ATOM 704 CG LEU A 47 29.057 -16.451 -8.226 1.00 0.00 C ATOM 705 CD1 LEU A 47 27.550 -16.653 -8.260 1.00 0.00 C ATOM 706 CD2 LEU A 47 29.702 -17.404 -7.232 1.00 0.00 C ATOM 0 H LEU A 47 30.483 -16.739 -11.937 1.00 0.00 H new ATOM 0 HA LEU A 47 28.299 -15.454 -10.789 1.00 0.00 H new ATOM 0 HB2 LEU A 47 29.280 -17.581 -10.029 1.00 0.00 H new ATOM 0 HB3 LEU A 47 30.736 -16.749 -9.518 1.00 0.00 H new ATOM 0 HG LEU A 47 29.259 -15.430 -7.903 1.00 0.00 H new ATOM 0 HD11 LEU A 47 27.141 -16.512 -7.259 1.00 0.00 H new ATOM 0 HD12 LEU A 47 27.101 -15.929 -8.940 1.00 0.00 H new ATOM 0 HD13 LEU A 47 27.326 -17.662 -8.605 1.00 0.00 H new ATOM 0 HD21 LEU A 47 29.263 -17.253 -6.246 1.00 0.00 H new ATOM 0 HD22 LEU A 47 29.532 -18.432 -7.551 1.00 0.00 H new ATOM 0 HD23 LEU A 47 30.774 -17.211 -7.186 1.00 0.00 H new ATOM 718 N ALA A 48 31.196 -14.063 -9.989 1.00 0.00 N ATOM 719 CA ALA A 48 31.805 -12.836 -9.489 1.00 0.00 C ATOM 720 C ALA A 48 31.543 -11.669 -10.435 1.00 0.00 C ATOM 721 O ALA A 48 31.205 -10.568 -10.001 1.00 0.00 O ATOM 722 CB ALA A 48 33.300 -13.032 -9.291 1.00 0.00 C ATOM 0 H ALA A 48 31.863 -14.790 -10.248 1.00 0.00 H new ATOM 0 HA ALA A 48 31.350 -12.599 -8.527 1.00 0.00 H new ATOM 0 HB1 ALA A 48 33.742 -12.108 -8.917 1.00 0.00 H new ATOM 0 HB2 ALA A 48 33.470 -13.832 -8.571 1.00 0.00 H new ATOM 0 HB3 ALA A 48 33.762 -13.296 -10.243 1.00 0.00 H new ATOM 728 N LYS A 49 31.701 -11.917 -11.731 1.00 0.00 N ATOM 729 CA LYS A 49 31.482 -10.887 -12.740 1.00 0.00 C ATOM 730 C LYS A 49 30.087 -10.284 -12.607 1.00 0.00 C ATOM 731 O LYS A 49 29.923 -9.065 -12.624 1.00 0.00 O ATOM 732 CB LYS A 49 31.666 -11.470 -14.142 1.00 0.00 C ATOM 733 CG LYS A 49 32.817 -10.849 -14.913 1.00 0.00 C ATOM 734 CD LYS A 49 33.822 -11.898 -15.358 1.00 0.00 C ATOM 735 CE LYS A 49 34.792 -11.340 -16.388 1.00 0.00 C ATOM 736 NZ LYS A 49 34.821 -12.166 -17.627 1.00 0.00 N ATOM 0 H LYS A 49 31.980 -12.823 -12.107 1.00 0.00 H new ATOM 0 HA LYS A 49 32.217 -10.097 -12.583 1.00 0.00 H new ATOM 0 HB2 LYS A 49 31.832 -12.544 -14.061 1.00 0.00 H new ATOM 0 HB3 LYS A 49 30.745 -11.332 -14.708 1.00 0.00 H new ATOM 0 HG2 LYS A 49 32.429 -10.322 -15.785 1.00 0.00 H new ATOM 0 HG3 LYS A 49 33.316 -10.108 -14.289 1.00 0.00 H new ATOM 0 HD2 LYS A 49 34.377 -12.261 -14.493 1.00 0.00 H new ATOM 0 HD3 LYS A 49 33.294 -12.753 -15.780 1.00 0.00 H new ATOM 0 HE2 LYS A 49 34.507 -10.318 -16.639 1.00 0.00 H new ATOM 0 HE3 LYS A 49 35.793 -11.295 -15.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 35.494 -11.753 -18.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 35.117 -13.135 -17.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 33.872 -12.188 -18.052 1.00 0.00 H new ATOM 750 N MET A 50 29.085 -11.147 -12.474 1.00 0.00 N ATOM 751 CA MET A 50 27.704 -10.699 -12.336 1.00 0.00 C ATOM 752 C MET A 50 27.492 -9.993 -11.001 1.00 0.00 C ATOM 753 O MET A 50 26.751 -9.014 -10.917 1.00 0.00 O ATOM 754 CB MET A 50 26.745 -11.885 -12.456 1.00 0.00 C ATOM 755 CG MET A 50 26.326 -12.186 -13.886 1.00 0.00 C ATOM 756 SD MET A 50 24.554 -11.985 -14.148 1.00 0.00 S ATOM 757 CE MET A 50 23.900 -13.096 -12.903 1.00 0.00 C ATOM 0 H MET A 50 29.203 -12.160 -12.459 1.00 0.00 H new ATOM 0 HA MET A 50 27.497 -9.991 -13.139 1.00 0.00 H new ATOM 0 HB2 MET A 50 27.219 -12.770 -12.031 1.00 0.00 H new ATOM 0 HB3 MET A 50 25.855 -11.684 -11.860 1.00 0.00 H new ATOM 0 HG2 MET A 50 26.867 -11.527 -14.565 1.00 0.00 H new ATOM 0 HG3 MET A 50 26.613 -13.207 -14.137 1.00 0.00 H new ATOM 0 HE1 MET A 50 23.032 -13.620 -13.303 1.00 0.00 H new ATOM 0 HE2 MET A 50 24.665 -13.821 -12.624 1.00 0.00 H new ATOM 0 HE3 MET A 50 23.604 -12.524 -12.024 1.00 0.00 H new ATOM 767 N TRP A 51 28.148 -10.495 -9.961 1.00 0.00 N ATOM 768 CA TRP A 51 28.031 -9.912 -8.629 1.00 0.00 C ATOM 769 C TRP A 51 28.583 -8.490 -8.608 1.00 0.00 C ATOM 770 O TRP A 51 27.932 -7.569 -8.116 1.00 0.00 O ATOM 771 CB TRP A 51 28.770 -10.775 -7.605 1.00 0.00 C ATOM 772 CG TRP A 51 28.824 -10.160 -6.239 1.00 0.00 C ATOM 773 CD1 TRP A 51 29.932 -9.996 -5.458 1.00 0.00 C ATOM 774 CD2 TRP A 51 27.723 -9.630 -5.494 1.00 0.00 C ATOM 775 NE1 TRP A 51 29.585 -9.396 -4.271 1.00 0.00 N ATOM 776 CE2 TRP A 51 28.236 -9.161 -4.269 1.00 0.00 C ATOM 777 CE3 TRP A 51 26.353 -9.505 -5.743 1.00 0.00 C ATOM 778 CZ2 TRP A 51 27.426 -8.577 -3.298 1.00 0.00 C ATOM 779 CZ3 TRP A 51 25.551 -8.926 -4.778 1.00 0.00 C ATOM 780 CH2 TRP A 51 26.089 -8.467 -3.568 1.00 0.00 C ATOM 0 H TRP A 51 28.766 -11.304 -10.014 1.00 0.00 H new ATOM 0 HA TRP A 51 26.974 -9.876 -8.366 1.00 0.00 H new ATOM 0 HB2 TRP A 51 28.281 -11.747 -7.539 1.00 0.00 H new ATOM 0 HB3 TRP A 51 29.786 -10.953 -7.956 1.00 0.00 H new ATOM 0 HD1 TRP A 51 30.933 -10.294 -5.732 1.00 0.00 H new ATOM 0 HE1 TRP A 51 30.228 -9.163 -3.514 1.00 0.00 H new ATOM 0 HE3 TRP A 51 25.929 -9.855 -6.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 27.839 -8.223 -2.365 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 24.491 -8.825 -4.959 1.00 0.00 H new ATOM 0 HH2 TRP A 51 25.436 -8.018 -2.835 1.00 0.00 H new ATOM 791 N GLY A 52 29.787 -8.319 -9.144 1.00 0.00 N ATOM 792 CA GLY A 52 30.405 -7.006 -9.176 1.00 0.00 C ATOM 793 C GLY A 52 29.489 -5.948 -9.758 1.00 0.00 C ATOM 794 O GLY A 52 29.364 -4.855 -9.206 1.00 0.00 O ATOM 0 H GLY A 52 30.346 -9.066 -9.557 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.691 -6.718 -8.164 1.00 0.00 H new ATOM 0 HA3 GLY A 52 31.321 -7.053 -9.765 1.00 0.00 H new ATOM 798 N GLN A 53 28.849 -6.273 -10.877 1.00 0.00 N ATOM 799 CA GLN A 53 27.942 -5.340 -11.535 1.00 0.00 C ATOM 800 C GLN A 53 26.915 -4.792 -10.550 1.00 0.00 C ATOM 801 O GLN A 53 26.489 -3.642 -10.657 1.00 0.00 O ATOM 802 CB GLN A 53 27.231 -6.026 -12.703 1.00 0.00 C ATOM 803 CG GLN A 53 28.156 -6.374 -13.858 1.00 0.00 C ATOM 804 CD GLN A 53 27.515 -6.135 -15.211 1.00 0.00 C ATOM 805 OE1 GLN A 53 26.571 -6.826 -15.594 1.00 0.00 O ATOM 806 NE2 GLN A 53 28.026 -5.153 -15.943 1.00 0.00 N ATOM 0 H GLN A 53 28.942 -7.174 -11.346 1.00 0.00 H new ATOM 0 HA GLN A 53 28.532 -4.507 -11.917 1.00 0.00 H new ATOM 0 HB2 GLN A 53 26.754 -6.938 -12.343 1.00 0.00 H new ATOM 0 HB3 GLN A 53 26.437 -5.374 -13.068 1.00 0.00 H new ATOM 0 HG2 GLN A 53 29.066 -5.779 -13.781 1.00 0.00 H new ATOM 0 HG3 GLN A 53 28.451 -7.420 -13.780 1.00 0.00 H new ATOM 0 HE21 GLN A 53 28.809 -4.605 -15.586 1.00 0.00 H new ATOM 0 HE22 GLN A 53 27.636 -4.946 -16.862 1.00 0.00 H new ATOM 815 N ARG A 54 26.520 -5.624 -9.591 1.00 0.00 N ATOM 816 CA ARG A 54 25.542 -5.223 -8.587 1.00 0.00 C ATOM 817 C ARG A 54 26.150 -4.231 -7.600 1.00 0.00 C ATOM 818 O ARG A 54 25.477 -3.313 -7.131 1.00 0.00 O ATOM 819 CB ARG A 54 25.017 -6.449 -7.837 1.00 0.00 C ATOM 820 CG ARG A 54 24.833 -7.671 -8.722 1.00 0.00 C ATOM 821 CD ARG A 54 24.000 -7.348 -9.952 1.00 0.00 C ATOM 822 NE ARG A 54 22.570 -7.508 -9.703 1.00 0.00 N ATOM 823 CZ ARG A 54 21.627 -7.099 -10.544 1.00 0.00 C ATOM 824 NH1 ARG A 54 21.961 -6.508 -11.683 1.00 0.00 N ATOM 825 NH2 ARG A 54 20.347 -7.280 -10.247 1.00 0.00 N ATOM 0 H ARG A 54 26.862 -6.579 -9.489 1.00 0.00 H new ATOM 0 HA ARG A 54 24.712 -4.736 -9.099 1.00 0.00 H new ATOM 0 HB2 ARG A 54 25.708 -6.695 -7.031 1.00 0.00 H new ATOM 0 HB3 ARG A 54 24.063 -6.200 -7.373 1.00 0.00 H new ATOM 0 HG2 ARG A 54 25.808 -8.048 -9.030 1.00 0.00 H new ATOM 0 HG3 ARG A 54 24.350 -8.465 -8.152 1.00 0.00 H new ATOM 0 HD2 ARG A 54 24.201 -6.324 -10.267 1.00 0.00 H new ATOM 0 HD3 ARG A 54 24.300 -7.998 -10.774 1.00 0.00 H new ATOM 0 HE ARG A 54 22.279 -7.959 -8.835 1.00 0.00 H new ATOM 0 HH11 ARG A 54 22.944 -6.367 -11.915 1.00 0.00 H new ATOM 0 HH12 ARG A 54 21.235 -6.195 -12.327 1.00 0.00 H new ATOM 0 HH21 ARG A 54 20.086 -7.734 -9.372 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.624 -6.965 -10.894 1.00 0.00 H new ATOM 839 N LYS A 55 27.427 -4.424 -7.287 1.00 0.00 N ATOM 840 CA LYS A 55 28.128 -3.547 -6.357 1.00 0.00 C ATOM 841 C LYS A 55 28.955 -2.508 -7.106 1.00 0.00 C ATOM 842 O LYS A 55 29.763 -1.794 -6.510 1.00 0.00 O ATOM 843 CB LYS A 55 29.033 -4.367 -5.435 1.00 0.00 C ATOM 844 CG LYS A 55 28.273 -5.312 -4.520 1.00 0.00 C ATOM 845 CD LYS A 55 28.430 -4.921 -3.060 1.00 0.00 C ATOM 846 CE LYS A 55 27.363 -3.923 -2.633 1.00 0.00 C ATOM 847 NZ LYS A 55 27.774 -2.519 -2.912 1.00 0.00 N ATOM 0 H LYS A 55 27.998 -5.181 -7.664 1.00 0.00 H new ATOM 0 HA LYS A 55 27.383 -3.026 -5.756 1.00 0.00 H new ATOM 0 HB2 LYS A 55 29.729 -4.945 -6.043 1.00 0.00 H new ATOM 0 HB3 LYS A 55 29.630 -3.687 -4.827 1.00 0.00 H new ATOM 0 HG2 LYS A 55 27.216 -5.307 -4.787 1.00 0.00 H new ATOM 0 HG3 LYS A 55 28.634 -6.330 -4.666 1.00 0.00 H new ATOM 0 HD2 LYS A 55 28.368 -5.812 -2.435 1.00 0.00 H new ATOM 0 HD3 LYS A 55 29.418 -4.489 -2.902 1.00 0.00 H new ATOM 0 HE2 LYS A 55 26.432 -4.140 -3.157 1.00 0.00 H new ATOM 0 HE3 LYS A 55 27.163 -4.038 -1.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 27.528 -1.917 -2.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 28.801 -2.483 -3.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 27.280 -2.175 -3.760 1.00 0.00 H new ATOM 861 N LYS A 56 28.749 -2.427 -8.416 1.00 0.00 N ATOM 862 CA LYS A 56 29.474 -1.473 -9.248 1.00 0.00 C ATOM 863 C LYS A 56 30.980 -1.631 -9.070 1.00 0.00 C ATOM 864 O LYS A 56 31.736 -0.672 -9.220 1.00 0.00 O ATOM 865 CB LYS A 56 29.056 -0.042 -8.901 1.00 0.00 C ATOM 866 CG LYS A 56 27.615 0.275 -9.263 1.00 0.00 C ATOM 867 CD LYS A 56 27.520 0.993 -10.599 1.00 0.00 C ATOM 868 CE LYS A 56 27.128 2.452 -10.420 1.00 0.00 C ATOM 869 NZ LYS A 56 25.650 2.631 -10.406 1.00 0.00 N ATOM 0 H LYS A 56 28.085 -3.011 -8.925 1.00 0.00 H new ATOM 0 HA LYS A 56 29.226 -1.675 -10.290 1.00 0.00 H new ATOM 0 HB2 LYS A 56 29.198 0.120 -7.832 1.00 0.00 H new ATOM 0 HB3 LYS A 56 29.714 0.656 -9.419 1.00 0.00 H new ATOM 0 HG2 LYS A 56 27.038 -0.649 -9.304 1.00 0.00 H new ATOM 0 HG3 LYS A 56 27.171 0.894 -8.484 1.00 0.00 H new ATOM 0 HD2 LYS A 56 28.478 0.933 -11.115 1.00 0.00 H new ATOM 0 HD3 LYS A 56 26.786 0.493 -11.231 1.00 0.00 H new ATOM 0 HE2 LYS A 56 27.548 2.829 -9.488 1.00 0.00 H new ATOM 0 HE3 LYS A 56 27.558 3.045 -11.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 25.423 3.638 -10.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 25.251 2.294 -11.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 25.242 2.085 -9.620 1.00 0.00 H new ATOM 883 N ASN A 57 31.410 -2.848 -8.752 1.00 0.00 N ATOM 884 CA ASN A 57 32.827 -3.131 -8.555 1.00 0.00 C ATOM 885 C ASN A 57 33.443 -3.729 -9.816 1.00 0.00 C ATOM 886 O ASN A 57 33.546 -4.949 -9.950 1.00 0.00 O ATOM 887 CB ASN A 57 33.018 -4.088 -7.377 1.00 0.00 C ATOM 888 CG ASN A 57 34.480 -4.390 -7.108 1.00 0.00 C ATOM 889 OD1 ASN A 57 35.343 -4.130 -7.947 1.00 0.00 O ATOM 890 ND2 ASN A 57 34.764 -4.943 -5.934 1.00 0.00 N ATOM 0 H ASN A 57 30.797 -3.654 -8.625 1.00 0.00 H new ATOM 0 HA ASN A 57 33.333 -2.191 -8.336 1.00 0.00 H new ATOM 0 HB2 ASN A 57 32.569 -3.654 -6.484 1.00 0.00 H new ATOM 0 HB3 ASN A 57 32.489 -5.019 -7.579 1.00 0.00 H new ATOM 0 HD21 ASN A 57 35.730 -5.170 -5.697 1.00 0.00 H new ATOM 0 HD22 ASN A 57 34.016 -5.141 -5.269 1.00 0.00 H new ATOM 897 N ASP A 58 33.849 -2.863 -10.737 1.00 0.00 N ATOM 898 CA ASP A 58 34.456 -3.305 -11.987 1.00 0.00 C ATOM 899 C ASP A 58 35.628 -4.245 -11.720 1.00 0.00 C ATOM 900 O ASP A 58 36.059 -4.983 -12.606 1.00 0.00 O ATOM 901 CB ASP A 58 34.928 -2.101 -12.804 1.00 0.00 C ATOM 902 CG ASP A 58 33.776 -1.331 -13.418 1.00 0.00 C ATOM 903 OD1 ASP A 58 32.988 -0.733 -12.656 1.00 0.00 O ATOM 904 OD2 ASP A 58 33.664 -1.324 -14.662 1.00 0.00 O ATOM 0 H ASP A 58 33.769 -1.851 -10.642 1.00 0.00 H new ATOM 0 HA ASP A 58 33.701 -3.847 -12.556 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.506 -1.435 -12.163 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.596 -2.442 -13.595 1.00 0.00 H new ATOM 909 N ARG A 59 36.139 -4.211 -10.493 1.00 0.00 N ATOM 910 CA ARG A 59 37.262 -5.058 -10.110 1.00 0.00 C ATOM 911 C ARG A 59 36.787 -6.249 -9.283 1.00 0.00 C ATOM 912 O ARG A 59 37.509 -6.744 -8.418 1.00 0.00 O ATOM 913 CB ARG A 59 38.290 -4.250 -9.316 1.00 0.00 C ATOM 914 CG ARG A 59 39.021 -3.209 -10.149 1.00 0.00 C ATOM 915 CD ARG A 59 40.499 -3.539 -10.281 1.00 0.00 C ATOM 916 NE ARG A 59 41.234 -2.488 -10.980 1.00 0.00 N ATOM 917 CZ ARG A 59 42.542 -2.532 -11.206 1.00 0.00 C ATOM 918 NH1 ARG A 59 43.256 -3.568 -10.790 1.00 0.00 N ATOM 919 NH2 ARG A 59 43.139 -1.536 -11.849 1.00 0.00 N ATOM 0 H ARG A 59 35.793 -3.606 -9.748 1.00 0.00 H new ATOM 0 HA ARG A 59 37.729 -5.433 -11.021 1.00 0.00 H new ATOM 0 HB2 ARG A 59 37.787 -3.752 -8.487 1.00 0.00 H new ATOM 0 HB3 ARG A 59 39.020 -4.933 -8.881 1.00 0.00 H new ATOM 0 HG2 ARG A 59 38.570 -3.152 -11.140 1.00 0.00 H new ATOM 0 HG3 ARG A 59 38.906 -2.227 -9.689 1.00 0.00 H new ATOM 0 HD2 ARG A 59 40.928 -3.684 -9.290 1.00 0.00 H new ATOM 0 HD3 ARG A 59 40.614 -4.480 -10.818 1.00 0.00 H new ATOM 0 HE ARG A 59 40.714 -1.676 -11.313 1.00 0.00 H new ATOM 0 HH11 ARG A 59 42.801 -4.335 -10.295 1.00 0.00 H new ATOM 0 HH12 ARG A 59 44.260 -3.599 -10.965 1.00 0.00 H new ATOM 0 HH21 ARG A 59 42.593 -0.736 -12.170 1.00 0.00 H new ATOM 0 HH22 ARG A 59 44.144 -1.570 -12.022 1.00 0.00 H new ATOM 933 N MET A 60 35.569 -6.704 -9.556 1.00 0.00 N ATOM 934 CA MET A 60 34.998 -7.838 -8.838 1.00 0.00 C ATOM 935 C MET A 60 35.505 -9.157 -9.412 1.00 0.00 C ATOM 936 O MET A 60 35.505 -9.358 -10.627 1.00 0.00 O ATOM 937 CB MET A 60 33.470 -7.794 -8.903 1.00 0.00 C ATOM 938 CG MET A 60 32.797 -8.945 -8.174 1.00 0.00 C ATOM 939 SD MET A 60 33.442 -9.183 -6.507 1.00 0.00 S ATOM 940 CE MET A 60 32.465 -7.992 -5.593 1.00 0.00 C ATOM 0 H MET A 60 34.958 -6.305 -10.269 1.00 0.00 H new ATOM 0 HA MET A 60 35.312 -7.771 -7.796 1.00 0.00 H new ATOM 0 HB2 MET A 60 33.123 -6.853 -8.477 1.00 0.00 H new ATOM 0 HB3 MET A 60 33.159 -7.805 -9.948 1.00 0.00 H new ATOM 0 HG2 MET A 60 31.724 -8.759 -8.121 1.00 0.00 H new ATOM 0 HG3 MET A 60 32.934 -9.862 -8.747 1.00 0.00 H new ATOM 0 HE1 MET A 60 32.147 -8.431 -4.647 1.00 0.00 H new ATOM 0 HE2 MET A 60 33.065 -7.103 -5.397 1.00 0.00 H new ATOM 0 HE3 MET A 60 31.588 -7.716 -6.178 1.00 0.00 H new ATOM 950 N THR A 61 35.938 -10.054 -8.532 1.00 0.00 N ATOM 951 CA THR A 61 36.449 -11.353 -8.952 1.00 0.00 C ATOM 952 C THR A 61 36.194 -12.414 -7.888 1.00 0.00 C ATOM 953 O THR A 61 36.223 -12.127 -6.691 1.00 0.00 O ATOM 954 CB THR A 61 37.959 -11.293 -9.249 1.00 0.00 C ATOM 955 OG1 THR A 61 38.386 -12.514 -9.862 1.00 0.00 O ATOM 956 CG2 THR A 61 38.753 -11.055 -7.974 1.00 0.00 C ATOM 0 H THR A 61 35.945 -9.905 -7.523 1.00 0.00 H new ATOM 0 HA THR A 61 35.917 -11.622 -9.865 1.00 0.00 H new ATOM 0 HB THR A 61 38.140 -10.462 -9.931 1.00 0.00 H new ATOM 0 HG1 THR A 61 39.347 -12.467 -10.049 1.00 0.00 H new ATOM 0 HG21 THR A 61 39.817 -11.017 -8.210 1.00 0.00 H new ATOM 0 HG22 THR A 61 38.446 -10.110 -7.525 1.00 0.00 H new ATOM 0 HG23 THR A 61 38.566 -11.868 -7.272 1.00 0.00 H new ATOM 964 N TYR A 62 35.944 -13.641 -8.331 1.00 0.00 N ATOM 965 CA TYR A 62 35.683 -14.746 -7.416 1.00 0.00 C ATOM 966 C TYR A 62 36.606 -14.679 -6.203 1.00 0.00 C ATOM 967 O TYR A 62 36.176 -14.894 -5.070 1.00 0.00 O ATOM 968 CB TYR A 62 35.862 -16.084 -8.134 1.00 0.00 C ATOM 969 CG TYR A 62 35.301 -17.262 -7.370 1.00 0.00 C ATOM 970 CD1 TYR A 62 33.960 -17.305 -7.008 1.00 0.00 C ATOM 971 CD2 TYR A 62 36.111 -18.332 -7.011 1.00 0.00 C ATOM 972 CE1 TYR A 62 33.443 -18.379 -6.309 1.00 0.00 C ATOM 973 CE2 TYR A 62 35.603 -19.410 -6.313 1.00 0.00 C ATOM 974 CZ TYR A 62 34.268 -19.429 -5.964 1.00 0.00 C ATOM 975 OH TYR A 62 33.757 -20.501 -5.269 1.00 0.00 O ATOM 0 H TYR A 62 35.917 -13.896 -9.318 1.00 0.00 H new ATOM 0 HA TYR A 62 34.653 -14.662 -7.071 1.00 0.00 H new ATOM 0 HB2 TYR A 62 35.378 -16.031 -9.109 1.00 0.00 H new ATOM 0 HB3 TYR A 62 36.924 -16.251 -8.314 1.00 0.00 H new ATOM 0 HD1 TYR A 62 33.311 -16.485 -7.278 1.00 0.00 H new ATOM 0 HD2 TYR A 62 37.156 -18.321 -7.282 1.00 0.00 H new ATOM 0 HE1 TYR A 62 32.399 -18.396 -6.034 1.00 0.00 H new ATOM 0 HE2 TYR A 62 36.247 -20.234 -6.042 1.00 0.00 H new ATOM 0 HH TYR A 62 32.898 -20.252 -4.869 1.00 0.00 H new ATOM 985 N GLU A 63 37.877 -14.379 -6.451 1.00 0.00 N ATOM 986 CA GLU A 63 38.862 -14.284 -5.380 1.00 0.00 C ATOM 987 C GLU A 63 38.360 -13.379 -4.258 1.00 0.00 C ATOM 988 O GLU A 63 38.509 -13.694 -3.077 1.00 0.00 O ATOM 989 CB GLU A 63 40.190 -13.753 -5.924 1.00 0.00 C ATOM 990 CG GLU A 63 41.390 -14.599 -5.534 1.00 0.00 C ATOM 991 CD GLU A 63 42.700 -14.016 -6.025 1.00 0.00 C ATOM 992 OE1 GLU A 63 43.068 -14.282 -7.189 1.00 0.00 O ATOM 993 OE2 GLU A 63 43.357 -13.293 -5.247 1.00 0.00 O ATOM 0 H GLU A 63 38.249 -14.198 -7.383 1.00 0.00 H new ATOM 0 HA GLU A 63 39.018 -15.284 -4.974 1.00 0.00 H new ATOM 0 HB2 GLU A 63 40.132 -13.699 -7.011 1.00 0.00 H new ATOM 0 HB3 GLU A 63 40.340 -12.736 -5.562 1.00 0.00 H new ATOM 0 HG2 GLU A 63 41.424 -14.696 -4.449 1.00 0.00 H new ATOM 0 HG3 GLU A 63 41.269 -15.603 -5.940 1.00 0.00 H new ATOM 1000 N LYS A 64 37.766 -12.253 -4.636 1.00 0.00 N ATOM 1001 CA LYS A 64 37.240 -11.301 -3.665 1.00 0.00 C ATOM 1002 C LYS A 64 35.840 -11.703 -3.211 1.00 0.00 C ATOM 1003 O LYS A 64 35.522 -11.648 -2.023 1.00 0.00 O ATOM 1004 CB LYS A 64 37.210 -9.893 -4.264 1.00 0.00 C ATOM 1005 CG LYS A 64 38.582 -9.363 -4.640 1.00 0.00 C ATOM 1006 CD LYS A 64 38.497 -7.966 -5.232 1.00 0.00 C ATOM 1007 CE LYS A 64 39.668 -7.681 -6.160 1.00 0.00 C ATOM 1008 NZ LYS A 64 40.398 -6.443 -5.768 1.00 0.00 N ATOM 0 H LYS A 64 37.637 -11.977 -5.609 1.00 0.00 H new ATOM 0 HA LYS A 64 37.899 -11.305 -2.797 1.00 0.00 H new ATOM 0 HB2 LYS A 64 36.576 -9.898 -5.151 1.00 0.00 H new ATOM 0 HB3 LYS A 64 36.751 -9.212 -3.547 1.00 0.00 H new ATOM 0 HG2 LYS A 64 39.221 -9.347 -3.757 1.00 0.00 H new ATOM 0 HG3 LYS A 64 39.049 -10.036 -5.359 1.00 0.00 H new ATOM 0 HD2 LYS A 64 37.562 -7.859 -5.781 1.00 0.00 H new ATOM 0 HD3 LYS A 64 38.481 -7.230 -4.428 1.00 0.00 H new ATOM 0 HE2 LYS A 64 40.355 -8.527 -6.148 1.00 0.00 H new ATOM 0 HE3 LYS A 64 39.305 -7.580 -7.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 41.189 -6.284 -6.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 39.749 -5.631 -5.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 40.767 -6.549 -4.801 1.00 0.00 H new ATOM 1022 N LEU A 65 35.008 -12.107 -4.165 1.00 0.00 N ATOM 1023 CA LEU A 65 33.642 -12.520 -3.863 1.00 0.00 C ATOM 1024 C LEU A 65 33.624 -13.596 -2.782 1.00 0.00 C ATOM 1025 O LEU A 65 32.724 -13.632 -1.943 1.00 0.00 O ATOM 1026 CB LEU A 65 32.955 -13.040 -5.127 1.00 0.00 C ATOM 1027 CG LEU A 65 31.509 -13.509 -4.961 1.00 0.00 C ATOM 1028 CD1 LEU A 65 30.699 -13.194 -6.209 1.00 0.00 C ATOM 1029 CD2 LEU A 65 31.463 -14.998 -4.654 1.00 0.00 C ATOM 0 H LEU A 65 35.255 -12.157 -5.153 1.00 0.00 H new ATOM 0 HA LEU A 65 33.099 -11.650 -3.493 1.00 0.00 H new ATOM 0 HB2 LEU A 65 32.976 -12.251 -5.878 1.00 0.00 H new ATOM 0 HB3 LEU A 65 33.542 -13.870 -5.520 1.00 0.00 H new ATOM 0 HG LEU A 65 31.067 -12.972 -4.122 1.00 0.00 H new ATOM 0 HD11 LEU A 65 29.673 -13.535 -6.072 1.00 0.00 H new ATOM 0 HD12 LEU A 65 30.704 -12.118 -6.384 1.00 0.00 H new ATOM 0 HD13 LEU A 65 31.139 -13.703 -7.067 1.00 0.00 H new ATOM 0 HD21 LEU A 65 30.426 -15.314 -4.539 1.00 0.00 H new ATOM 0 HD22 LEU A 65 31.923 -15.553 -5.472 1.00 0.00 H new ATOM 0 HD23 LEU A 65 32.007 -15.196 -3.730 1.00 0.00 H new ATOM 1041 N SER A 66 34.626 -14.469 -2.807 1.00 0.00 N ATOM 1042 CA SER A 66 34.724 -15.547 -1.830 1.00 0.00 C ATOM 1043 C SER A 66 34.802 -14.989 -0.412 1.00 0.00 C ATOM 1044 O SER A 66 34.253 -15.569 0.526 1.00 0.00 O ATOM 1045 CB SER A 66 35.952 -16.414 -2.117 1.00 0.00 C ATOM 1046 OG SER A 66 37.138 -15.784 -1.663 1.00 0.00 O ATOM 0 H SER A 66 35.381 -14.451 -3.493 1.00 0.00 H new ATOM 0 HA SER A 66 33.827 -16.161 -1.912 1.00 0.00 H new ATOM 0 HB2 SER A 66 35.840 -17.382 -1.628 1.00 0.00 H new ATOM 0 HB3 SER A 66 36.025 -16.604 -3.188 1.00 0.00 H new ATOM 0 HG SER A 66 37.426 -15.117 -2.321 1.00 0.00 H new ATOM 1052 N ARG A 67 35.488 -13.861 -0.263 1.00 0.00 N ATOM 1053 CA ARG A 67 35.639 -13.224 1.040 1.00 0.00 C ATOM 1054 C ARG A 67 34.318 -13.230 1.804 1.00 0.00 C ATOM 1055 O ARG A 67 34.279 -13.545 2.993 1.00 0.00 O ATOM 1056 CB ARG A 67 36.139 -11.788 0.875 1.00 0.00 C ATOM 1057 CG ARG A 67 35.022 -10.764 0.757 1.00 0.00 C ATOM 1058 CD ARG A 67 35.566 -9.344 0.750 1.00 0.00 C ATOM 1059 NE ARG A 67 34.730 -8.434 1.528 1.00 0.00 N ATOM 1060 CZ ARG A 67 35.128 -7.231 1.927 1.00 0.00 C ATOM 1061 NH1 ARG A 67 36.343 -6.796 1.622 1.00 0.00 N ATOM 1062 NH2 ARG A 67 34.310 -6.460 2.632 1.00 0.00 N ATOM 0 H ARG A 67 35.948 -13.369 -1.029 1.00 0.00 H new ATOM 0 HA ARG A 67 36.372 -13.793 1.612 1.00 0.00 H new ATOM 0 HB2 ARG A 67 36.768 -11.531 1.728 1.00 0.00 H new ATOM 0 HB3 ARG A 67 36.768 -11.731 -0.013 1.00 0.00 H new ATOM 0 HG2 ARG A 67 34.458 -10.943 -0.158 1.00 0.00 H new ATOM 0 HG3 ARG A 67 34.327 -10.884 1.588 1.00 0.00 H new ATOM 0 HD2 ARG A 67 36.578 -9.342 1.154 1.00 0.00 H new ATOM 0 HD3 ARG A 67 35.632 -8.986 -0.277 1.00 0.00 H new ATOM 0 HE ARG A 67 33.789 -8.739 1.779 1.00 0.00 H new ATOM 0 HH11 ARG A 67 36.975 -7.385 1.080 1.00 0.00 H new ATOM 0 HH12 ARG A 67 36.646 -5.872 1.930 1.00 0.00 H new ATOM 0 HH21 ARG A 67 33.374 -6.791 2.868 1.00 0.00 H new ATOM 0 HH22 ARG A 67 34.617 -5.537 2.938 1.00 0.00 H new ATOM 1076 N ALA A 68 33.239 -12.879 1.113 1.00 0.00 N ATOM 1077 CA ALA A 68 31.917 -12.845 1.725 1.00 0.00 C ATOM 1078 C ALA A 68 31.394 -14.254 1.981 1.00 0.00 C ATOM 1079 O ALA A 68 30.692 -14.499 2.963 1.00 0.00 O ATOM 1080 CB ALA A 68 30.947 -12.071 0.845 1.00 0.00 C ATOM 0 H ALA A 68 33.255 -12.614 0.128 1.00 0.00 H new ATOM 0 HA ALA A 68 32.002 -12.337 2.686 1.00 0.00 H new ATOM 0 HB1 ALA A 68 29.964 -12.054 1.315 1.00 0.00 H new ATOM 0 HB2 ALA A 68 31.306 -11.050 0.718 1.00 0.00 H new ATOM 0 HB3 ALA A 68 30.875 -12.554 -0.130 1.00 0.00 H new ATOM 1086 N LEU A 69 31.739 -15.179 1.091 1.00 0.00 N ATOM 1087 CA LEU A 69 31.303 -16.565 1.220 1.00 0.00 C ATOM 1088 C LEU A 69 31.879 -17.202 2.481 1.00 0.00 C ATOM 1089 O LEU A 69 31.212 -17.992 3.150 1.00 0.00 O ATOM 1090 CB LEU A 69 31.726 -17.370 -0.010 1.00 0.00 C ATOM 1091 CG LEU A 69 31.191 -16.873 -1.353 1.00 0.00 C ATOM 1092 CD1 LEU A 69 31.687 -17.758 -2.486 1.00 0.00 C ATOM 1093 CD2 LEU A 69 29.670 -16.826 -1.337 1.00 0.00 C ATOM 0 H LEU A 69 32.319 -14.994 0.273 1.00 0.00 H new ATOM 0 HA LEU A 69 30.216 -16.572 1.295 1.00 0.00 H new ATOM 0 HB2 LEU A 69 32.815 -17.380 -0.056 1.00 0.00 H new ATOM 0 HB3 LEU A 69 31.404 -18.402 0.127 1.00 0.00 H new ATOM 0 HG LEU A 69 31.564 -15.862 -1.519 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.296 -17.389 -3.434 1.00 0.00 H new ATOM 0 HD12 LEU A 69 32.777 -17.740 -2.511 1.00 0.00 H new ATOM 0 HD13 LEU A 69 31.344 -18.780 -2.326 1.00 0.00 H new ATOM 0 HD21 LEU A 69 29.307 -16.470 -2.301 1.00 0.00 H new ATOM 0 HD22 LEU A 69 29.277 -17.825 -1.148 1.00 0.00 H new ATOM 0 HD23 LEU A 69 29.335 -16.149 -0.551 1.00 0.00 H new ATOM 1105 N ARG A 70 33.120 -16.851 2.801 1.00 0.00 N ATOM 1106 CA ARG A 70 33.785 -17.388 3.982 1.00 0.00 C ATOM 1107 C ARG A 70 33.467 -16.546 5.215 1.00 0.00 C ATOM 1108 O ARG A 70 33.628 -17.000 6.348 1.00 0.00 O ATOM 1109 CB ARG A 70 35.298 -17.439 3.763 1.00 0.00 C ATOM 1110 CG ARG A 70 35.710 -18.247 2.544 1.00 0.00 C ATOM 1111 CD ARG A 70 36.636 -19.392 2.921 1.00 0.00 C ATOM 1112 NE ARG A 70 37.701 -19.582 1.939 1.00 0.00 N ATOM 1113 CZ ARG A 70 38.786 -20.314 2.164 1.00 0.00 C ATOM 1114 NH1 ARG A 70 38.950 -20.922 3.331 1.00 0.00 N ATOM 1115 NH2 ARG A 70 39.711 -20.439 1.221 1.00 0.00 N ATOM 0 H ARG A 70 33.685 -16.197 2.259 1.00 0.00 H new ATOM 0 HA ARG A 70 33.415 -18.400 4.148 1.00 0.00 H new ATOM 0 HB2 ARG A 70 35.676 -16.422 3.659 1.00 0.00 H new ATOM 0 HB3 ARG A 70 35.770 -17.866 4.648 1.00 0.00 H new ATOM 0 HG2 ARG A 70 34.822 -18.643 2.052 1.00 0.00 H new ATOM 0 HG3 ARG A 70 36.209 -17.596 1.826 1.00 0.00 H new ATOM 0 HD2 ARG A 70 37.076 -19.195 3.899 1.00 0.00 H new ATOM 0 HD3 ARG A 70 36.057 -20.311 3.011 1.00 0.00 H new ATOM 0 HE ARG A 70 37.606 -19.128 1.031 1.00 0.00 H new ATOM 0 HH11 ARG A 70 38.242 -20.828 4.059 1.00 0.00 H new ATOM 0 HH12 ARG A 70 39.784 -21.484 3.501 1.00 0.00 H new ATOM 0 HH21 ARG A 70 39.589 -19.973 0.322 1.00 0.00 H new ATOM 0 HH22 ARG A 70 40.544 -21.001 1.395 1.00 0.00 H new ATOM 1129 N TYR A 71 33.016 -15.318 4.985 1.00 0.00 N ATOM 1130 CA TYR A 71 32.678 -14.412 6.076 1.00 0.00 C ATOM 1131 C TYR A 71 31.258 -14.665 6.575 1.00 0.00 C ATOM 1132 O TYR A 71 30.882 -14.226 7.662 1.00 0.00 O ATOM 1133 CB TYR A 71 32.819 -12.958 5.622 1.00 0.00 C ATOM 1134 CG TYR A 71 32.362 -11.953 6.656 1.00 0.00 C ATOM 1135 CD1 TYR A 71 31.021 -11.611 6.776 1.00 0.00 C ATOM 1136 CD2 TYR A 71 33.273 -11.347 7.513 1.00 0.00 C ATOM 1137 CE1 TYR A 71 30.600 -10.693 7.719 1.00 0.00 C ATOM 1138 CE2 TYR A 71 32.861 -10.429 8.460 1.00 0.00 C ATOM 1139 CZ TYR A 71 31.524 -10.105 8.558 1.00 0.00 C ATOM 1140 OH TYR A 71 31.108 -9.192 9.500 1.00 0.00 O ATOM 0 H TYR A 71 32.876 -14.927 4.053 1.00 0.00 H new ATOM 0 HA TYR A 71 33.371 -14.599 6.897 1.00 0.00 H new ATOM 0 HB2 TYR A 71 33.863 -12.763 5.375 1.00 0.00 H new ATOM 0 HB3 TYR A 71 32.243 -12.814 4.708 1.00 0.00 H new ATOM 0 HD1 TYR A 71 30.295 -12.070 6.121 1.00 0.00 H new ATOM 0 HD2 TYR A 71 34.321 -11.598 7.437 1.00 0.00 H new ATOM 0 HE1 TYR A 71 29.554 -10.437 7.799 1.00 0.00 H new ATOM 0 HE2 TYR A 71 33.582 -9.968 9.119 1.00 0.00 H new ATOM 0 HH TYR A 71 31.881 -8.873 10.010 1.00 0.00 H new ATOM 1150 N TYR A 72 30.474 -15.376 5.772 1.00 0.00 N ATOM 1151 CA TYR A 72 29.096 -15.687 6.130 1.00 0.00 C ATOM 1152 C TYR A 72 29.040 -16.820 7.150 1.00 0.00 C ATOM 1153 O TYR A 72 28.055 -16.971 7.874 1.00 0.00 O ATOM 1154 CB TYR A 72 28.297 -16.070 4.882 1.00 0.00 C ATOM 1155 CG TYR A 72 27.708 -14.884 4.152 1.00 0.00 C ATOM 1156 CD1 TYR A 72 26.978 -13.918 4.833 1.00 0.00 C ATOM 1157 CD2 TYR A 72 27.881 -14.730 2.783 1.00 0.00 C ATOM 1158 CE1 TYR A 72 26.437 -12.833 4.171 1.00 0.00 C ATOM 1159 CE2 TYR A 72 27.345 -13.648 2.112 1.00 0.00 C ATOM 1160 CZ TYR A 72 26.624 -12.702 2.811 1.00 0.00 C ATOM 1161 OH TYR A 72 26.087 -11.623 2.146 1.00 0.00 O ATOM 0 H TYR A 72 30.770 -15.747 4.869 1.00 0.00 H new ATOM 0 HA TYR A 72 28.654 -14.797 6.578 1.00 0.00 H new ATOM 0 HB2 TYR A 72 28.946 -16.620 4.200 1.00 0.00 H new ATOM 0 HB3 TYR A 72 27.491 -16.745 5.170 1.00 0.00 H new ATOM 0 HD1 TYR A 72 26.831 -14.017 5.898 1.00 0.00 H new ATOM 0 HD2 TYR A 72 28.445 -15.469 2.233 1.00 0.00 H new ATOM 0 HE1 TYR A 72 25.871 -12.092 4.715 1.00 0.00 H new ATOM 0 HE2 TYR A 72 27.489 -13.543 1.047 1.00 0.00 H new ATOM 0 HH TYR A 72 26.779 -11.201 1.595 1.00 0.00 H new ATOM 1171 N TYR A 73 30.104 -17.613 7.203 1.00 0.00 N ATOM 1172 CA TYR A 73 30.177 -18.733 8.133 1.00 0.00 C ATOM 1173 C TYR A 73 30.184 -18.242 9.578 1.00 0.00 C ATOM 1174 O TYR A 73 29.933 -19.008 10.508 1.00 0.00 O ATOM 1175 CB TYR A 73 31.429 -19.569 7.861 1.00 0.00 C ATOM 1176 CG TYR A 73 31.447 -20.203 6.488 1.00 0.00 C ATOM 1177 CD1 TYR A 73 30.296 -20.759 5.944 1.00 0.00 C ATOM 1178 CD2 TYR A 73 32.615 -20.247 5.737 1.00 0.00 C ATOM 1179 CE1 TYR A 73 30.308 -21.340 4.690 1.00 0.00 C ATOM 1180 CE2 TYR A 73 32.635 -20.824 4.482 1.00 0.00 C ATOM 1181 CZ TYR A 73 31.479 -21.370 3.963 1.00 0.00 C ATOM 1182 OH TYR A 73 31.496 -21.947 2.714 1.00 0.00 O ATOM 0 H TYR A 73 30.928 -17.501 6.613 1.00 0.00 H new ATOM 0 HA TYR A 73 29.294 -19.354 7.983 1.00 0.00 H new ATOM 0 HB2 TYR A 73 32.309 -18.936 7.971 1.00 0.00 H new ATOM 0 HB3 TYR A 73 31.503 -20.353 8.615 1.00 0.00 H new ATOM 0 HD1 TYR A 73 29.377 -20.737 6.510 1.00 0.00 H new ATOM 0 HD2 TYR A 73 33.522 -19.823 6.141 1.00 0.00 H new ATOM 0 HE1 TYR A 73 29.405 -21.768 4.282 1.00 0.00 H new ATOM 0 HE2 TYR A 73 33.551 -20.848 3.910 1.00 0.00 H new ATOM 0 HH TYR A 73 32.398 -21.884 2.337 1.00 0.00 H new ATOM 1192 N LYS A 74 30.474 -16.958 9.758 1.00 0.00 N ATOM 1193 CA LYS A 74 30.512 -16.361 11.088 1.00 0.00 C ATOM 1194 C LYS A 74 29.106 -16.032 11.577 1.00 0.00 C ATOM 1195 O LYS A 74 28.783 -16.227 12.750 1.00 0.00 O ATOM 1196 CB LYS A 74 31.369 -15.093 11.075 1.00 0.00 C ATOM 1197 CG LYS A 74 32.631 -15.220 10.240 1.00 0.00 C ATOM 1198 CD LYS A 74 33.836 -14.637 10.958 1.00 0.00 C ATOM 1199 CE LYS A 74 35.132 -15.278 10.484 1.00 0.00 C ATOM 1200 NZ LYS A 74 35.289 -16.663 11.007 1.00 0.00 N ATOM 0 H LYS A 74 30.686 -16.310 8.999 1.00 0.00 H new ATOM 0 HA LYS A 74 30.955 -17.085 11.772 1.00 0.00 H new ATOM 0 HB2 LYS A 74 30.772 -14.265 10.692 1.00 0.00 H new ATOM 0 HB3 LYS A 74 31.645 -14.841 12.099 1.00 0.00 H new ATOM 0 HG2 LYS A 74 32.814 -16.270 10.014 1.00 0.00 H new ATOM 0 HG3 LYS A 74 32.491 -14.708 9.288 1.00 0.00 H new ATOM 0 HD2 LYS A 74 33.877 -13.561 10.787 1.00 0.00 H new ATOM 0 HD3 LYS A 74 33.727 -14.785 12.032 1.00 0.00 H new ATOM 0 HE2 LYS A 74 35.150 -15.297 9.394 1.00 0.00 H new ATOM 0 HE3 LYS A 74 35.977 -14.670 10.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 36.278 -16.965 10.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 35.029 -16.685 12.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 34.669 -17.307 10.475 1.00 0.00 H new ATOM 1214 N THR A 75 28.270 -15.532 10.672 1.00 0.00 N ATOM 1215 CA THR A 75 26.898 -15.177 11.012 1.00 0.00 C ATOM 1216 C THR A 75 25.966 -16.373 10.859 1.00 0.00 C ATOM 1217 O THR A 75 24.922 -16.445 11.505 1.00 0.00 O ATOM 1218 CB THR A 75 26.382 -14.023 10.131 1.00 0.00 C ATOM 1219 OG1 THR A 75 26.247 -14.465 8.775 1.00 0.00 O ATOM 1220 CG2 THR A 75 27.327 -12.833 10.190 1.00 0.00 C ATOM 0 H THR A 75 28.520 -15.364 9.697 1.00 0.00 H new ATOM 0 HA THR A 75 26.904 -14.856 12.054 1.00 0.00 H new ATOM 0 HB THR A 75 25.408 -13.712 10.510 1.00 0.00 H new ATOM 0 HG1 THR A 75 26.843 -15.227 8.618 1.00 0.00 H new ATOM 0 HG21 THR A 75 26.942 -12.031 9.560 1.00 0.00 H new ATOM 0 HG22 THR A 75 27.405 -12.481 11.219 1.00 0.00 H new ATOM 0 HG23 THR A 75 28.312 -13.133 9.833 1.00 0.00 H new ATOM 1228 N GLY A 76 26.352 -17.313 10.001 1.00 0.00 N ATOM 1229 CA GLY A 76 25.539 -18.494 9.780 1.00 0.00 C ATOM 1230 C GLY A 76 24.894 -18.506 8.408 1.00 0.00 C ATOM 1231 O GLY A 76 24.459 -19.554 7.929 1.00 0.00 O ATOM 0 H GLY A 76 27.213 -17.277 9.455 1.00 0.00 H new ATOM 0 HA2 GLY A 76 26.158 -19.384 9.895 1.00 0.00 H new ATOM 0 HA3 GLY A 76 24.763 -18.545 10.543 1.00 0.00 H new ATOM 1235 N ILE A 77 24.830 -17.339 7.776 1.00 0.00 N ATOM 1236 CA ILE A 77 24.232 -17.220 6.452 1.00 0.00 C ATOM 1237 C ILE A 77 24.602 -18.410 5.573 1.00 0.00 C ATOM 1238 O ILE A 77 23.742 -19.006 4.923 1.00 0.00 O ATOM 1239 CB ILE A 77 24.673 -15.921 5.751 1.00 0.00 C ATOM 1240 CG1 ILE A 77 24.094 -14.704 6.474 1.00 0.00 C ATOM 1241 CG2 ILE A 77 24.239 -15.934 4.293 1.00 0.00 C ATOM 1242 CD1 ILE A 77 22.628 -14.468 6.182 1.00 0.00 C ATOM 0 H ILE A 77 25.185 -16.463 8.159 1.00 0.00 H new ATOM 0 HA ILE A 77 23.151 -17.198 6.594 1.00 0.00 H new ATOM 0 HB ILE A 77 25.761 -15.857 5.786 1.00 0.00 H new ATOM 0 HG12 ILE A 77 24.226 -14.833 7.548 1.00 0.00 H new ATOM 0 HG13 ILE A 77 24.660 -13.818 6.187 1.00 0.00 H new ATOM 0 HG21 ILE A 77 24.557 -15.010 3.810 1.00 0.00 H new ATOM 0 HG22 ILE A 77 24.695 -16.784 3.785 1.00 0.00 H new ATOM 0 HG23 ILE A 77 23.154 -16.017 4.237 1.00 0.00 H new ATOM 0 HD11 ILE A 77 22.285 -13.589 6.728 1.00 0.00 H new ATOM 0 HD12 ILE A 77 22.491 -14.307 5.113 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.050 -15.338 6.495 1.00 0.00 H new ATOM 1254 N LEU A 78 25.885 -18.752 5.559 1.00 0.00 N ATOM 1255 CA LEU A 78 26.370 -19.873 4.761 1.00 0.00 C ATOM 1256 C LEU A 78 26.843 -21.014 5.656 1.00 0.00 C ATOM 1257 O LEU A 78 26.971 -20.852 6.869 1.00 0.00 O ATOM 1258 CB LEU A 78 27.511 -19.419 3.848 1.00 0.00 C ATOM 1259 CG LEU A 78 27.111 -18.995 2.435 1.00 0.00 C ATOM 1260 CD1 LEU A 78 28.326 -18.507 1.660 1.00 0.00 C ATOM 1261 CD2 LEU A 78 26.437 -20.146 1.703 1.00 0.00 C ATOM 0 H LEU A 78 26.609 -18.269 6.091 1.00 0.00 H new ATOM 0 HA LEU A 78 25.544 -20.235 4.148 1.00 0.00 H new ATOM 0 HB2 LEU A 78 28.021 -18.583 4.326 1.00 0.00 H new ATOM 0 HB3 LEU A 78 28.233 -20.232 3.771 1.00 0.00 H new ATOM 0 HG LEU A 78 26.399 -18.173 2.511 1.00 0.00 H new ATOM 0 HD11 LEU A 78 28.022 -18.209 0.656 1.00 0.00 H new ATOM 0 HD12 LEU A 78 28.766 -17.653 2.174 1.00 0.00 H new ATOM 0 HD13 LEU A 78 29.061 -19.309 1.594 1.00 0.00 H new ATOM 0 HD21 LEU A 78 26.159 -19.826 0.699 1.00 0.00 H new ATOM 0 HD22 LEU A 78 27.125 -20.989 1.638 1.00 0.00 H new ATOM 0 HD23 LEU A 78 25.543 -20.450 2.247 1.00 0.00 H new ATOM 1273 N GLU A 79 27.102 -22.168 5.048 1.00 0.00 N ATOM 1274 CA GLU A 79 27.562 -23.335 5.791 1.00 0.00 C ATOM 1275 C GLU A 79 28.791 -23.951 5.128 1.00 0.00 C ATOM 1276 O GLU A 79 28.712 -24.480 4.019 1.00 0.00 O ATOM 1277 CB GLU A 79 26.446 -24.377 5.889 1.00 0.00 C ATOM 1278 CG GLU A 79 25.589 -24.234 7.136 1.00 0.00 C ATOM 1279 CD GLU A 79 25.016 -25.558 7.605 1.00 0.00 C ATOM 1280 OE1 GLU A 79 25.747 -26.317 8.275 1.00 0.00 O ATOM 1281 OE2 GLU A 79 23.837 -25.834 7.301 1.00 0.00 O ATOM 0 H GLU A 79 27.001 -22.319 4.044 1.00 0.00 H new ATOM 0 HA GLU A 79 27.836 -23.011 6.795 1.00 0.00 H new ATOM 0 HB2 GLU A 79 25.808 -24.298 5.009 1.00 0.00 H new ATOM 0 HB3 GLU A 79 26.888 -25.373 5.874 1.00 0.00 H new ATOM 0 HG2 GLU A 79 26.188 -23.798 7.936 1.00 0.00 H new ATOM 0 HG3 GLU A 79 24.773 -23.540 6.934 1.00 0.00 H new ATOM 1288 N ARG A 80 29.926 -23.879 5.816 1.00 0.00 N ATOM 1289 CA ARG A 80 31.172 -24.427 5.295 1.00 0.00 C ATOM 1290 C ARG A 80 30.977 -25.865 4.823 1.00 0.00 C ATOM 1291 O ARG A 80 30.455 -26.705 5.556 1.00 0.00 O ATOM 1292 CB ARG A 80 32.264 -24.374 6.364 1.00 0.00 C ATOM 1293 CG ARG A 80 33.642 -24.048 5.811 1.00 0.00 C ATOM 1294 CD ARG A 80 34.645 -23.796 6.927 1.00 0.00 C ATOM 1295 NE ARG A 80 36.023 -23.855 6.447 1.00 0.00 N ATOM 1296 CZ ARG A 80 37.082 -23.800 7.247 1.00 0.00 C ATOM 1297 NH1 ARG A 80 36.922 -23.685 8.558 1.00 0.00 N ATOM 1298 NH2 ARG A 80 38.305 -23.859 6.735 1.00 0.00 N ATOM 0 H ARG A 80 30.008 -23.446 6.736 1.00 0.00 H new ATOM 0 HA ARG A 80 31.478 -23.821 4.443 1.00 0.00 H new ATOM 0 HB2 ARG A 80 31.995 -23.626 7.110 1.00 0.00 H new ATOM 0 HB3 ARG A 80 32.306 -25.335 6.877 1.00 0.00 H new ATOM 0 HG2 ARG A 80 33.989 -24.872 5.187 1.00 0.00 H new ATOM 0 HG3 ARG A 80 33.580 -23.168 5.171 1.00 0.00 H new ATOM 0 HD2 ARG A 80 34.457 -22.818 7.370 1.00 0.00 H new ATOM 0 HD3 ARG A 80 34.504 -24.535 7.715 1.00 0.00 H new ATOM 0 HE ARG A 80 36.181 -23.943 5.443 1.00 0.00 H new ATOM 0 HH11 ARG A 80 35.984 -23.639 8.955 1.00 0.00 H new ATOM 0 HH12 ARG A 80 37.737 -23.643 9.170 1.00 0.00 H new ATOM 0 HH21 ARG A 80 38.432 -23.947 5.727 1.00 0.00 H new ATOM 0 HH22 ARG A 80 39.118 -23.817 7.350 1.00 0.00 H new ATOM 1312 N VAL A 81 31.400 -26.142 3.594 1.00 0.00 N ATOM 1313 CA VAL A 81 31.273 -27.478 3.024 1.00 0.00 C ATOM 1314 C VAL A 81 32.642 -28.093 2.755 1.00 0.00 C ATOM 1315 O VAL A 81 33.620 -27.381 2.524 1.00 0.00 O ATOM 1316 CB VAL A 81 30.467 -27.454 1.712 1.00 0.00 C ATOM 1317 CG1 VAL A 81 30.324 -28.859 1.147 1.00 0.00 C ATOM 1318 CG2 VAL A 81 29.103 -26.819 1.937 1.00 0.00 C ATOM 0 H VAL A 81 31.834 -25.459 2.973 1.00 0.00 H new ATOM 0 HA VAL A 81 30.742 -28.086 3.757 1.00 0.00 H new ATOM 0 HB VAL A 81 31.008 -26.850 0.984 1.00 0.00 H new ATOM 0 HG11 VAL A 81 29.752 -28.822 0.220 1.00 0.00 H new ATOM 0 HG12 VAL A 81 31.312 -29.273 0.947 1.00 0.00 H new ATOM 0 HG13 VAL A 81 29.805 -29.490 1.869 1.00 0.00 H new ATOM 0 HG21 VAL A 81 28.547 -26.810 1.000 1.00 0.00 H new ATOM 0 HG22 VAL A 81 28.552 -27.395 2.681 1.00 0.00 H new ATOM 0 HG23 VAL A 81 29.232 -25.797 2.292 1.00 0.00 H new ATOM 1328 N ASP A 82 32.705 -29.420 2.787 1.00 0.00 N ATOM 1329 CA ASP A 82 33.954 -30.132 2.545 1.00 0.00 C ATOM 1330 C ASP A 82 34.091 -30.504 1.072 1.00 0.00 C ATOM 1331 O ASP A 82 34.645 -31.550 0.735 1.00 0.00 O ATOM 1332 CB ASP A 82 34.023 -31.392 3.410 1.00 0.00 C ATOM 1333 CG ASP A 82 34.897 -31.206 4.635 1.00 0.00 C ATOM 1334 OD1 ASP A 82 34.767 -30.159 5.303 1.00 0.00 O ATOM 1335 OD2 ASP A 82 35.712 -32.107 4.925 1.00 0.00 O ATOM 0 H ASP A 82 31.906 -30.024 2.978 1.00 0.00 H new ATOM 0 HA ASP A 82 34.778 -29.471 2.812 1.00 0.00 H new ATOM 0 HB2 ASP A 82 33.017 -31.669 3.724 1.00 0.00 H new ATOM 0 HB3 ASP A 82 34.410 -32.218 2.813 1.00 0.00 H new ATOM 1340 N ARG A 83 33.583 -29.640 0.199 1.00 0.00 N ATOM 1341 CA ARG A 83 33.647 -29.878 -1.238 1.00 0.00 C ATOM 1342 C ARG A 83 34.213 -28.663 -1.966 1.00 0.00 C ATOM 1343 O ARG A 83 34.336 -27.583 -1.388 1.00 0.00 O ATOM 1344 CB ARG A 83 32.257 -30.211 -1.783 1.00 0.00 C ATOM 1345 CG ARG A 83 31.795 -31.621 -1.453 1.00 0.00 C ATOM 1346 CD ARG A 83 30.628 -31.610 -0.478 1.00 0.00 C ATOM 1347 NE ARG A 83 29.676 -32.684 -0.751 1.00 0.00 N ATOM 1348 CZ ARG A 83 28.663 -32.990 0.052 1.00 0.00 C ATOM 1349 NH1 ARG A 83 28.471 -32.307 1.172 1.00 0.00 N ATOM 1350 NH2 ARG A 83 27.840 -33.981 -0.265 1.00 0.00 N ATOM 0 H ARG A 83 33.122 -28.769 0.462 1.00 0.00 H new ATOM 0 HA ARG A 83 34.311 -30.725 -1.412 1.00 0.00 H new ATOM 0 HB2 ARG A 83 31.538 -29.498 -1.380 1.00 0.00 H new ATOM 0 HB3 ARG A 83 32.260 -30.083 -2.865 1.00 0.00 H new ATOM 0 HG2 ARG A 83 31.500 -32.132 -2.369 1.00 0.00 H new ATOM 0 HG3 ARG A 83 32.623 -32.186 -1.025 1.00 0.00 H new ATOM 0 HD2 ARG A 83 31.005 -31.710 0.540 1.00 0.00 H new ATOM 0 HD3 ARG A 83 30.117 -30.649 -0.536 1.00 0.00 H new ATOM 0 HE ARG A 83 29.796 -33.229 -1.605 1.00 0.00 H new ATOM 0 HH11 ARG A 83 29.102 -31.544 1.419 1.00 0.00 H new ATOM 0 HH12 ARG A 83 27.692 -32.544 1.787 1.00 0.00 H new ATOM 0 HH21 ARG A 83 27.985 -34.509 -1.126 1.00 0.00 H new ATOM 0 HH22 ARG A 83 27.062 -34.215 0.352 1.00 0.00 H new ATOM 1364 N ARG A 84 34.557 -28.848 -3.236 1.00 0.00 N ATOM 1365 CA ARG A 84 35.112 -27.768 -4.043 1.00 0.00 C ATOM 1366 C ARG A 84 34.010 -27.035 -4.803 1.00 0.00 C ATOM 1367 O ARG A 84 33.114 -27.659 -5.372 1.00 0.00 O ATOM 1368 CB ARG A 84 36.147 -28.317 -5.027 1.00 0.00 C ATOM 1369 CG ARG A 84 36.922 -27.235 -5.762 1.00 0.00 C ATOM 1370 CD ARG A 84 38.113 -27.814 -6.509 1.00 0.00 C ATOM 1371 NE ARG A 84 38.833 -26.793 -7.265 1.00 0.00 N ATOM 1372 CZ ARG A 84 39.874 -27.056 -8.048 1.00 0.00 C ATOM 1373 NH1 ARG A 84 40.314 -28.300 -8.176 1.00 0.00 N ATOM 1374 NH2 ARG A 84 40.477 -26.073 -8.704 1.00 0.00 N ATOM 0 H ARG A 84 34.461 -29.736 -3.729 1.00 0.00 H new ATOM 0 HA ARG A 84 35.599 -27.061 -3.372 1.00 0.00 H new ATOM 0 HB2 ARG A 84 36.849 -28.951 -4.486 1.00 0.00 H new ATOM 0 HB3 ARG A 84 35.642 -28.950 -5.757 1.00 0.00 H new ATOM 0 HG2 ARG A 84 36.262 -26.727 -6.465 1.00 0.00 H new ATOM 0 HG3 ARG A 84 37.267 -26.485 -5.050 1.00 0.00 H new ATOM 0 HD2 ARG A 84 38.792 -28.286 -5.799 1.00 0.00 H new ATOM 0 HD3 ARG A 84 37.770 -28.594 -7.189 1.00 0.00 H new ATOM 0 HE ARG A 84 38.520 -25.825 -7.188 1.00 0.00 H new ATOM 0 HH11 ARG A 84 39.853 -29.058 -7.673 1.00 0.00 H new ATOM 0 HH12 ARG A 84 41.113 -28.499 -8.778 1.00 0.00 H new ATOM 0 HH21 ARG A 84 40.142 -25.115 -8.608 1.00 0.00 H new ATOM 0 HH22 ARG A 84 41.276 -26.276 -9.305 1.00 0.00 H new ATOM 1388 N LEU A 85 34.083 -25.709 -4.808 1.00 0.00 N ATOM 1389 CA LEU A 85 33.091 -24.891 -5.497 1.00 0.00 C ATOM 1390 C LEU A 85 31.676 -25.327 -5.132 1.00 0.00 C ATOM 1391 O LEU A 85 30.741 -25.157 -5.915 1.00 0.00 O ATOM 1392 CB LEU A 85 33.290 -24.981 -7.011 1.00 0.00 C ATOM 1393 CG LEU A 85 34.165 -23.895 -7.639 1.00 0.00 C ATOM 1394 CD1 LEU A 85 35.481 -23.769 -6.888 1.00 0.00 C ATOM 1395 CD2 LEU A 85 34.414 -24.195 -9.110 1.00 0.00 C ATOM 0 H LEU A 85 34.819 -25.177 -4.343 1.00 0.00 H new ATOM 0 HA LEU A 85 33.225 -23.857 -5.179 1.00 0.00 H new ATOM 0 HB2 LEU A 85 33.728 -25.952 -7.243 1.00 0.00 H new ATOM 0 HB3 LEU A 85 32.311 -24.952 -7.488 1.00 0.00 H new ATOM 0 HG LEU A 85 33.638 -22.944 -7.567 1.00 0.00 H new ATOM 0 HD11 LEU A 85 36.090 -22.992 -7.349 1.00 0.00 H new ATOM 0 HD12 LEU A 85 35.283 -23.506 -5.849 1.00 0.00 H new ATOM 0 HD13 LEU A 85 36.014 -24.719 -6.927 1.00 0.00 H new ATOM 0 HD21 LEU A 85 35.038 -23.412 -9.540 1.00 0.00 H new ATOM 0 HD22 LEU A 85 34.920 -25.156 -9.205 1.00 0.00 H new ATOM 0 HD23 LEU A 85 33.462 -24.233 -9.640 1.00 0.00 H new ATOM 1407 N VAL A 86 31.525 -25.889 -3.937 1.00 0.00 N ATOM 1408 CA VAL A 86 30.223 -26.347 -3.466 1.00 0.00 C ATOM 1409 C VAL A 86 29.865 -25.705 -2.131 1.00 0.00 C ATOM 1410 O VAL A 86 30.401 -26.078 -1.087 1.00 0.00 O ATOM 1411 CB VAL A 86 30.189 -27.879 -3.312 1.00 0.00 C ATOM 1412 CG1 VAL A 86 28.987 -28.306 -2.484 1.00 0.00 C ATOM 1413 CG2 VAL A 86 30.173 -28.551 -4.677 1.00 0.00 C ATOM 0 H VAL A 86 32.288 -26.038 -3.277 1.00 0.00 H new ATOM 0 HA VAL A 86 29.492 -26.049 -4.217 1.00 0.00 H new ATOM 0 HB VAL A 86 31.091 -28.194 -2.788 1.00 0.00 H new ATOM 0 HG11 VAL A 86 28.980 -29.392 -2.386 1.00 0.00 H new ATOM 0 HG12 VAL A 86 29.047 -27.853 -1.495 1.00 0.00 H new ATOM 0 HG13 VAL A 86 28.071 -27.980 -2.977 1.00 0.00 H new ATOM 0 HG21 VAL A 86 30.149 -29.633 -4.549 1.00 0.00 H new ATOM 0 HG22 VAL A 86 29.290 -28.231 -5.230 1.00 0.00 H new ATOM 0 HG23 VAL A 86 31.069 -28.271 -5.231 1.00 0.00 H new ATOM 1423 N TYR A 87 28.955 -24.738 -2.171 1.00 0.00 N ATOM 1424 CA TYR A 87 28.526 -24.042 -0.964 1.00 0.00 C ATOM 1425 C TYR A 87 27.092 -24.417 -0.599 1.00 0.00 C ATOM 1426 O TYR A 87 26.385 -25.051 -1.383 1.00 0.00 O ATOM 1427 CB TYR A 87 28.636 -22.528 -1.156 1.00 0.00 C ATOM 1428 CG TYR A 87 30.033 -22.061 -1.497 1.00 0.00 C ATOM 1429 CD1 TYR A 87 30.548 -22.224 -2.777 1.00 0.00 C ATOM 1430 CD2 TYR A 87 30.837 -21.456 -0.539 1.00 0.00 C ATOM 1431 CE1 TYR A 87 31.824 -21.799 -3.093 1.00 0.00 C ATOM 1432 CE2 TYR A 87 32.114 -21.027 -0.846 1.00 0.00 C ATOM 1433 CZ TYR A 87 32.603 -21.201 -2.124 1.00 0.00 C ATOM 1434 OH TYR A 87 33.874 -20.775 -2.434 1.00 0.00 O ATOM 0 H TYR A 87 28.500 -24.418 -3.026 1.00 0.00 H new ATOM 0 HA TYR A 87 29.181 -24.346 -0.148 1.00 0.00 H new ATOM 0 HB2 TYR A 87 27.955 -22.220 -1.950 1.00 0.00 H new ATOM 0 HB3 TYR A 87 28.308 -22.030 -0.244 1.00 0.00 H new ATOM 0 HD1 TYR A 87 29.940 -22.691 -3.538 1.00 0.00 H new ATOM 0 HD2 TYR A 87 30.457 -21.319 0.463 1.00 0.00 H new ATOM 0 HE1 TYR A 87 32.209 -21.934 -4.093 1.00 0.00 H new ATOM 0 HE2 TYR A 87 32.726 -20.558 -0.090 1.00 0.00 H new ATOM 0 HH TYR A 87 33.954 -20.662 -3.404 1.00 0.00 H new ATOM 1444 N LYS A 88 26.670 -24.019 0.596 1.00 0.00 N ATOM 1445 CA LYS A 88 25.321 -24.310 1.067 1.00 0.00 C ATOM 1446 C LYS A 88 24.827 -23.219 2.010 1.00 0.00 C ATOM 1447 O LYS A 88 25.576 -22.729 2.856 1.00 0.00 O ATOM 1448 CB LYS A 88 25.287 -25.666 1.776 1.00 0.00 C ATOM 1449 CG LYS A 88 23.971 -25.953 2.478 1.00 0.00 C ATOM 1450 CD LYS A 88 24.177 -26.798 3.724 1.00 0.00 C ATOM 1451 CE LYS A 88 22.879 -27.452 4.174 1.00 0.00 C ATOM 1452 NZ LYS A 88 21.924 -26.459 4.738 1.00 0.00 N ATOM 0 H LYS A 88 27.243 -23.494 1.257 1.00 0.00 H new ATOM 0 HA LYS A 88 24.660 -24.343 0.201 1.00 0.00 H new ATOM 0 HB2 LYS A 88 25.479 -26.453 1.046 1.00 0.00 H new ATOM 0 HB3 LYS A 88 26.095 -25.705 2.507 1.00 0.00 H new ATOM 0 HG2 LYS A 88 23.490 -25.013 2.750 1.00 0.00 H new ATOM 0 HG3 LYS A 88 23.298 -26.470 1.794 1.00 0.00 H new ATOM 0 HD2 LYS A 88 24.923 -27.567 3.524 1.00 0.00 H new ATOM 0 HD3 LYS A 88 24.569 -26.174 4.527 1.00 0.00 H new ATOM 0 HE2 LYS A 88 22.416 -27.961 3.328 1.00 0.00 H new ATOM 0 HE3 LYS A 88 23.097 -28.213 4.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 21.798 -26.637 5.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 22.299 -25.499 4.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 21.007 -26.546 4.255 1.00 0.00 H new ATOM 1466 N PHE A 89 23.561 -22.842 1.861 1.00 0.00 N ATOM 1467 CA PHE A 89 22.967 -21.808 2.700 1.00 0.00 C ATOM 1468 C PHE A 89 22.596 -22.367 4.071 1.00 0.00 C ATOM 1469 O PHE A 89 21.992 -23.434 4.176 1.00 0.00 O ATOM 1470 CB PHE A 89 21.726 -21.223 2.023 1.00 0.00 C ATOM 1471 CG PHE A 89 22.015 -20.570 0.702 1.00 0.00 C ATOM 1472 CD1 PHE A 89 22.513 -19.278 0.647 1.00 0.00 C ATOM 1473 CD2 PHE A 89 21.791 -21.249 -0.485 1.00 0.00 C ATOM 1474 CE1 PHE A 89 22.780 -18.675 -0.568 1.00 0.00 C ATOM 1475 CE2 PHE A 89 22.056 -20.651 -1.703 1.00 0.00 C ATOM 1476 CZ PHE A 89 22.552 -19.363 -1.744 1.00 0.00 C ATOM 0 H PHE A 89 22.927 -23.237 1.167 1.00 0.00 H new ATOM 0 HA PHE A 89 23.705 -21.017 2.837 1.00 0.00 H new ATOM 0 HB2 PHE A 89 20.995 -22.017 1.874 1.00 0.00 H new ATOM 0 HB3 PHE A 89 21.270 -20.491 2.689 1.00 0.00 H new ATOM 0 HD1 PHE A 89 22.695 -18.736 1.563 1.00 0.00 H new ATOM 0 HD2 PHE A 89 21.405 -22.257 -0.458 1.00 0.00 H new ATOM 0 HE1 PHE A 89 23.166 -17.667 -0.598 1.00 0.00 H new ATOM 0 HE2 PHE A 89 21.875 -21.190 -2.621 1.00 0.00 H new ATOM 0 HZ PHE A 89 22.761 -18.894 -2.694 1.00 0.00 H new ATOM 1486 N GLY A 90 22.964 -21.638 5.120 1.00 0.00 N ATOM 1487 CA GLY A 90 22.663 -22.076 6.471 1.00 0.00 C ATOM 1488 C GLY A 90 21.245 -21.737 6.888 1.00 0.00 C ATOM 1489 O GLY A 90 20.337 -21.701 6.057 1.00 0.00 O ATOM 0 H GLY A 90 23.465 -20.752 5.059 1.00 0.00 H new ATOM 0 HA2 GLY A 90 22.812 -23.153 6.542 1.00 0.00 H new ATOM 0 HA3 GLY A 90 23.363 -21.611 7.165 1.00 0.00 H new ATOM 1493 N LYS A 91 21.054 -21.489 8.179 1.00 0.00 N ATOM 1494 CA LYS A 91 19.737 -21.152 8.707 1.00 0.00 C ATOM 1495 C LYS A 91 19.535 -19.640 8.741 1.00 0.00 C ATOM 1496 O LYS A 91 18.406 -19.155 8.705 1.00 0.00 O ATOM 1497 CB LYS A 91 19.564 -21.732 10.112 1.00 0.00 C ATOM 1498 CG LYS A 91 20.446 -21.069 11.156 1.00 0.00 C ATOM 1499 CD LYS A 91 19.685 -20.012 11.939 1.00 0.00 C ATOM 1500 CE LYS A 91 19.503 -20.418 13.393 1.00 0.00 C ATOM 1501 NZ LYS A 91 18.115 -20.167 13.869 1.00 0.00 N ATOM 0 H LYS A 91 21.795 -21.515 8.880 1.00 0.00 H new ATOM 0 HA LYS A 91 18.987 -21.587 8.047 1.00 0.00 H new ATOM 0 HB2 LYS A 91 18.521 -21.631 10.412 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.786 -22.799 10.086 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.831 -21.824 11.841 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.308 -20.612 10.669 1.00 0.00 H new ATOM 0 HD2 LYS A 91 20.222 -19.064 11.889 1.00 0.00 H new ATOM 0 HD3 LYS A 91 18.709 -19.850 11.481 1.00 0.00 H new ATOM 0 HE2 LYS A 91 19.740 -21.476 13.507 1.00 0.00 H new ATOM 0 HE3 LYS A 91 20.206 -19.864 14.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 18.032 -20.457 14.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 17.897 -19.154 13.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 17.446 -20.715 13.292 1.00 0.00 H new ATOM 1515 N ASN A 92 20.639 -18.902 8.809 1.00 0.00 N ATOM 1516 CA ASN A 92 20.582 -17.445 8.846 1.00 0.00 C ATOM 1517 C ASN A 92 19.937 -16.893 7.579 1.00 0.00 C ATOM 1518 O ASN A 92 19.318 -15.830 7.599 1.00 0.00 O ATOM 1519 CB ASN A 92 21.988 -16.864 9.011 1.00 0.00 C ATOM 1520 CG ASN A 92 22.251 -16.378 10.424 1.00 0.00 C ATOM 1521 OD1 ASN A 92 22.250 -15.176 10.689 1.00 0.00 O ATOM 1522 ND2 ASN A 92 22.477 -17.313 11.339 1.00 0.00 N ATOM 0 H ASN A 92 21.582 -19.289 8.840 1.00 0.00 H new ATOM 0 HA ASN A 92 19.972 -17.151 9.700 1.00 0.00 H new ATOM 0 HB2 ASN A 92 22.725 -17.623 8.748 1.00 0.00 H new ATOM 0 HB3 ASN A 92 22.120 -16.036 8.314 1.00 0.00 H new ATOM 0 HD21 ASN A 92 22.659 -17.046 12.306 1.00 0.00 H new ATOM 0 HD22 ASN A 92 22.468 -18.298 11.075 1.00 0.00 H new ATOM 1529 N ALA A 93 20.086 -17.624 6.479 1.00 0.00 N ATOM 1530 CA ALA A 93 19.516 -17.209 5.203 1.00 0.00 C ATOM 1531 C ALA A 93 18.048 -17.609 5.102 1.00 0.00 C ATOM 1532 O ALA A 93 17.584 -18.493 5.823 1.00 0.00 O ATOM 1533 CB ALA A 93 20.309 -17.807 4.051 1.00 0.00 C ATOM 0 H ALA A 93 20.597 -18.506 6.446 1.00 0.00 H new ATOM 0 HA ALA A 93 19.574 -16.122 5.143 1.00 0.00 H new ATOM 0 HB1 ALA A 93 19.872 -17.489 3.105 1.00 0.00 H new ATOM 0 HB2 ALA A 93 21.343 -17.467 4.106 1.00 0.00 H new ATOM 0 HB3 ALA A 93 20.281 -18.895 4.116 1.00 0.00 H new ATOM 1539 N HIS A 94 17.321 -16.953 4.203 1.00 0.00 N ATOM 1540 CA HIS A 94 15.905 -17.242 4.007 1.00 0.00 C ATOM 1541 C HIS A 94 15.502 -17.025 2.552 1.00 0.00 C ATOM 1542 O HIS A 94 16.273 -16.489 1.757 1.00 0.00 O ATOM 1543 CB HIS A 94 15.053 -16.360 4.921 1.00 0.00 C ATOM 1544 CG HIS A 94 15.297 -14.894 4.737 1.00 0.00 C ATOM 1545 ND1 HIS A 94 14.863 -14.192 3.632 1.00 0.00 N ATOM 1546 CD2 HIS A 94 15.932 -13.996 5.526 1.00 0.00 C ATOM 1547 CE1 HIS A 94 15.223 -12.926 3.749 1.00 0.00 C ATOM 1548 NE2 HIS A 94 15.873 -12.781 4.889 1.00 0.00 N ATOM 0 H HIS A 94 17.689 -16.218 3.599 1.00 0.00 H new ATOM 0 HA HIS A 94 15.734 -18.288 4.260 1.00 0.00 H new ATOM 0 HB2 HIS A 94 14.000 -16.570 4.736 1.00 0.00 H new ATOM 0 HB3 HIS A 94 15.254 -16.626 5.959 1.00 0.00 H new ATOM 0 HD2 HIS A 94 16.398 -14.198 6.479 1.00 0.00 H new ATOM 0 HE1 HIS A 94 15.020 -12.143 3.034 1.00 0.00 H new ATOM 0 HE2 HIS A 94 16.267 -11.908 5.240 1.00 0.00 H new ATOM 1556 N GLY A 95 14.288 -17.446 2.209 1.00 0.00 N ATOM 1557 CA GLY A 95 13.805 -17.290 0.850 1.00 0.00 C ATOM 1558 C GLY A 95 13.898 -18.575 0.050 1.00 0.00 C ATOM 1559 O GLY A 95 12.962 -18.940 -0.661 1.00 0.00 O ATOM 0 H GLY A 95 13.631 -17.892 2.849 1.00 0.00 H new ATOM 0 HA2 GLY A 95 12.768 -16.954 0.873 1.00 0.00 H new ATOM 0 HA3 GLY A 95 14.382 -16.512 0.350 1.00 0.00 H new ATOM 1563 N TRP A 96 15.030 -19.260 0.165 1.00 0.00 N ATOM 1564 CA TRP A 96 15.242 -20.511 -0.555 1.00 0.00 C ATOM 1565 C TRP A 96 14.573 -21.675 0.167 1.00 0.00 C ATOM 1566 O TRP A 96 13.966 -22.540 -0.463 1.00 0.00 O ATOM 1567 CB TRP A 96 16.739 -20.785 -0.713 1.00 0.00 C ATOM 1568 CG TRP A 96 17.408 -21.185 0.568 1.00 0.00 C ATOM 1569 CD1 TRP A 96 18.006 -20.356 1.473 1.00 0.00 C ATOM 1570 CD2 TRP A 96 17.547 -22.513 1.083 1.00 0.00 C ATOM 1571 NE1 TRP A 96 18.510 -21.089 2.520 1.00 0.00 N ATOM 1572 CE2 TRP A 96 18.241 -22.415 2.305 1.00 0.00 C ATOM 1573 CE3 TRP A 96 17.153 -23.775 0.632 1.00 0.00 C ATOM 1574 CZ2 TRP A 96 18.547 -23.532 3.078 1.00 0.00 C ATOM 1575 CZ3 TRP A 96 17.458 -24.883 1.400 1.00 0.00 C ATOM 1576 CH2 TRP A 96 18.149 -24.755 2.613 1.00 0.00 C ATOM 0 H TRP A 96 15.815 -18.971 0.749 1.00 0.00 H new ATOM 0 HA TRP A 96 14.791 -20.414 -1.543 1.00 0.00 H new ATOM 0 HB2 TRP A 96 16.881 -21.575 -1.451 1.00 0.00 H new ATOM 0 HB3 TRP A 96 17.225 -19.892 -1.105 1.00 0.00 H new ATOM 0 HD1 TRP A 96 18.073 -19.282 1.380 1.00 0.00 H new ATOM 0 HE1 TRP A 96 19.004 -20.708 3.327 1.00 0.00 H new ATOM 0 HE3 TRP A 96 16.619 -23.883 -0.301 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 19.080 -23.436 4.012 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 17.159 -25.864 1.060 1.00 0.00 H new ATOM 0 HH2 TRP A 96 18.371 -25.639 3.192 1.00 0.00 H new ATOM 1587 N GLN A 97 14.689 -21.689 1.491 1.00 0.00 N ATOM 1588 CA GLN A 97 14.095 -22.749 2.298 1.00 0.00 C ATOM 1589 C GLN A 97 12.615 -22.918 1.970 1.00 0.00 C ATOM 1590 O GLN A 97 11.960 -21.981 1.514 1.00 0.00 O ATOM 1591 CB GLN A 97 14.268 -22.443 3.787 1.00 0.00 C ATOM 1592 CG GLN A 97 15.313 -23.311 4.469 1.00 0.00 C ATOM 1593 CD GLN A 97 15.752 -22.752 5.808 1.00 0.00 C ATOM 1594 OE1 GLN A 97 15.655 -23.424 6.836 1.00 0.00 O ATOM 1595 NE2 GLN A 97 16.238 -21.516 5.804 1.00 0.00 N ATOM 0 H GLN A 97 15.188 -20.979 2.027 1.00 0.00 H new ATOM 0 HA GLN A 97 14.609 -23.681 2.064 1.00 0.00 H new ATOM 0 HB2 GLN A 97 14.545 -21.395 3.904 1.00 0.00 H new ATOM 0 HB3 GLN A 97 13.311 -22.578 4.291 1.00 0.00 H new ATOM 0 HG2 GLN A 97 14.910 -24.313 4.613 1.00 0.00 H new ATOM 0 HG3 GLN A 97 16.181 -23.407 3.817 1.00 0.00 H new ATOM 0 HE21 GLN A 97 16.300 -20.995 4.929 1.00 0.00 H new ATOM 0 HE22 GLN A 97 16.549 -21.087 6.676 1.00 0.00 H new