USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1032 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 107 TYR OH : rot -15:sc= -3.44! USER MOD Set 1.2: A 111 CYS SG : rot 63:sc= 0.0816 USER MOD Single : A 9 GLN :FLIP amide:sc= -7.66! C(o=-9.1!,f=-7.7!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.187 X(o=-0.19,f=-0.33) USER MOD Single : A 15 GLN :FLIP amide:sc= -0.475 F(o=-3.1!,f=-0.48) USER MOD Single : A 17 TYR OH : rot 150:sc= 0.585! USER MOD Single : A 20 ASN :FLIP amide:sc= -3.46 F(o=-7.7!,f=-3.5) USER MOD Single : A 24 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.141) USER MOD Single : A 26 LYS NZ :NH3+ -154:sc= 1.2 (180deg=0.857) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 149:sc= -0.701 (180deg=-3.6!) USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 50:sc= 0.597 USER MOD Single : A 44 ASN : amide:sc= -0.258 X(o=-0.26,f=0) USER MOD Single : A 49 MET CE :methyl 169:sc= -0.6 (180deg=-0.814) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -60:sc= 1.21 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc=-0.00947 USER MOD Single : A 61 ASN : amide:sc= -0.0347 K(o=-0.035,f=-1.9!) USER MOD Single : A 74 ASN : amide:sc= -3.39! C(o=-3.4!,f=-9.6!) USER MOD Single : A 75 LYS NZ :NH3+ 161:sc= -0.157 (180deg=-0.474) USER MOD Single : A 76 LYS NZ :NH3+ -139:sc= -0.244 (180deg=-1.07) USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 HIS : no HD1:sc= -0.0273 X(o=-0.027,f=-0.017) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc=-0.00933 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 105:sc= 1.23 USER MOD Single : A 100 THR OG1 : rot 81:sc= 0.59 USER MOD Single : A 101 GLN : amide:sc= -5.59! C(o=-5.6!,f=-7.3!) USER MOD Single : A 102 TYR OH : rot 74:sc= -0.46! USER MOD Single : A 103 MET CE :methyl 157:sc= -0.678 (180deg=-1.74!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 109:sc= 0.842 USER MOD Single : A 113 LYS NZ :NH3+ -159:sc= -0.177 (180deg=-1.39) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= -0.714 K(o=-0.71,f=-1.2) USER MOD Single : A 117 SER OG : rot 82:sc= -1.54! USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.783 USER MOD Single : A 123 GLN : amide:sc= -0.127 X(o=-0.13,f=-0.14) USER MOD Single : A 129 ASN :FLIP amide:sc= -7.75! C(o=-10!,f=-7.8!) USER MOD ----------------------------------------------------------------- ATOM 93 N GLN A 9 -15.141 -2.704 -7.963 1.00 0.00 N ATOM 94 CA GLN A 9 -13.811 -2.253 -8.453 1.00 0.00 C ATOM 95 C GLN A 9 -13.981 -1.006 -9.325 1.00 0.00 C ATOM 96 O GLN A 9 -13.178 -0.099 -9.289 1.00 0.00 O ATOM 97 CB GLN A 9 -13.160 -3.370 -9.273 1.00 0.00 C ATOM 98 CG GLN A 9 -12.420 -4.324 -8.333 1.00 0.00 C ATOM 99 CD GLN A 9 -11.139 -3.650 -7.849 1.00 0.00 C ATOM 100 OE1 GLN A 9 -11.058 -3.256 -6.610 1.00 0.00 O flip ATOM 101 NE2 GLN A 9 -10.207 -3.469 -8.608 1.00 0.00 N flip ATOM 0 HA GLN A 9 -13.174 -2.013 -7.601 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -13.919 -3.913 -9.836 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -12.466 -2.946 -9.999 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -13.053 -4.583 -7.484 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -12.184 -5.254 -8.850 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -10.272 -3.778 -9.578 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -9.360 -3.008 -8.275 1.00 0.00 H new ATOM 110 N PHE A 10 -15.020 -0.952 -10.112 1.00 0.00 N ATOM 111 CA PHE A 10 -15.225 0.238 -10.989 1.00 0.00 C ATOM 112 C PHE A 10 -15.174 1.513 -10.146 1.00 0.00 C ATOM 113 O PHE A 10 -14.471 2.450 -10.465 1.00 0.00 O ATOM 114 CB PHE A 10 -16.589 0.133 -11.675 1.00 0.00 C ATOM 115 CG PHE A 10 -16.740 1.253 -12.677 1.00 0.00 C ATOM 116 CD1 PHE A 10 -16.219 1.112 -13.969 1.00 0.00 C ATOM 117 CD2 PHE A 10 -17.404 2.431 -12.315 1.00 0.00 C ATOM 118 CE1 PHE A 10 -16.361 2.149 -14.898 1.00 0.00 C ATOM 119 CE2 PHE A 10 -17.546 3.469 -13.245 1.00 0.00 C ATOM 120 CZ PHE A 10 -17.024 3.327 -14.537 1.00 0.00 C ATOM 0 H PHE A 10 -15.734 -1.677 -10.187 1.00 0.00 H new ATOM 0 HA PHE A 10 -14.438 0.273 -11.743 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -16.682 -0.831 -12.175 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -17.386 0.186 -10.933 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -15.707 0.203 -14.249 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -17.807 2.540 -11.319 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -15.959 2.040 -15.894 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -18.058 4.378 -12.966 1.00 0.00 H new ATOM 0 HZ PHE A 10 -17.133 4.127 -15.255 1.00 0.00 H new ATOM 130 N LYS A 11 -15.907 1.555 -9.067 1.00 0.00 N ATOM 131 CA LYS A 11 -15.885 2.769 -8.208 1.00 0.00 C ATOM 132 C LYS A 11 -14.474 2.976 -7.661 1.00 0.00 C ATOM 133 O LYS A 11 -13.970 4.077 -7.604 1.00 0.00 O ATOM 134 CB LYS A 11 -16.847 2.570 -7.040 1.00 0.00 C ATOM 135 CG LYS A 11 -18.255 2.323 -7.575 1.00 0.00 C ATOM 136 CD LYS A 11 -19.234 2.278 -6.404 1.00 0.00 C ATOM 137 CE LYS A 11 -18.885 1.103 -5.488 1.00 0.00 C ATOM 138 NZ LYS A 11 -20.110 0.648 -4.770 1.00 0.00 N ATOM 0 H LYS A 11 -16.517 0.804 -8.745 1.00 0.00 H new ATOM 0 HA LYS A 11 -16.184 3.639 -8.793 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -16.525 1.726 -6.430 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -16.840 3.449 -6.396 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -18.537 3.113 -8.271 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -18.288 1.385 -8.129 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -19.191 3.213 -5.845 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -20.254 2.174 -6.774 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -18.469 0.283 -6.074 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -18.121 1.402 -4.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -19.871 -0.151 -4.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -20.489 1.431 -4.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -20.826 0.346 -5.462 1.00 0.00 H new ATOM 152 N GLN A 12 -13.842 1.914 -7.248 1.00 0.00 N ATOM 153 CA GLN A 12 -12.466 2.026 -6.684 1.00 0.00 C ATOM 154 C GLN A 12 -11.478 2.494 -7.752 1.00 0.00 C ATOM 155 O GLN A 12 -10.722 3.421 -7.537 1.00 0.00 O ATOM 156 CB GLN A 12 -12.029 0.654 -6.167 1.00 0.00 C ATOM 157 CG GLN A 12 -12.827 0.294 -4.918 1.00 0.00 C ATOM 158 CD GLN A 12 -12.402 1.201 -3.764 1.00 0.00 C ATOM 159 OE1 GLN A 12 -13.056 2.183 -3.474 1.00 0.00 O ATOM 160 NE2 GLN A 12 -11.322 0.913 -3.089 1.00 0.00 N ATOM 0 H GLN A 12 -14.220 0.967 -7.276 1.00 0.00 H new ATOM 0 HA GLN A 12 -12.476 2.755 -5.874 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.183 -0.101 -6.938 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -10.963 0.664 -5.938 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -13.894 0.407 -5.110 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -12.659 -0.750 -4.655 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.773 0.089 -3.333 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.027 1.512 -2.318 1.00 0.00 H new ATOM 169 N VAL A 13 -11.467 1.879 -8.902 1.00 0.00 N ATOM 170 CA VAL A 13 -10.514 2.325 -9.948 1.00 0.00 C ATOM 171 C VAL A 13 -10.982 3.672 -10.492 1.00 0.00 C ATOM 172 O VAL A 13 -10.189 4.540 -10.777 1.00 0.00 O ATOM 173 CB VAL A 13 -10.428 1.278 -11.063 1.00 0.00 C ATOM 174 CG1 VAL A 13 -10.253 -0.116 -10.452 1.00 0.00 C ATOM 175 CG2 VAL A 13 -11.701 1.314 -11.911 1.00 0.00 C ATOM 0 H VAL A 13 -12.070 1.097 -9.158 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.516 2.438 -9.524 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.570 1.503 -11.697 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -10.192 -0.857 -11.249 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.337 -0.142 -9.861 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -11.105 -0.342 -9.810 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -11.633 0.567 -12.702 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -12.564 1.098 -11.281 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -11.815 2.303 -12.355 1.00 0.00 H new ATOM 185 N ARG A 14 -12.265 3.882 -10.602 1.00 0.00 N ATOM 186 CA ARG A 14 -12.733 5.207 -11.092 1.00 0.00 C ATOM 187 C ARG A 14 -12.107 6.274 -10.200 1.00 0.00 C ATOM 188 O ARG A 14 -11.646 7.297 -10.663 1.00 0.00 O ATOM 189 CB ARG A 14 -14.263 5.281 -11.014 1.00 0.00 C ATOM 190 CG ARG A 14 -14.766 6.614 -11.588 1.00 0.00 C ATOM 191 CD ARG A 14 -14.810 6.545 -13.121 1.00 0.00 C ATOM 192 NE ARG A 14 -15.188 7.886 -13.681 1.00 0.00 N ATOM 193 CZ ARG A 14 -16.295 8.489 -13.333 1.00 0.00 C ATOM 194 NH1 ARG A 14 -17.194 7.868 -12.621 1.00 0.00 N ATOM 195 NH2 ARG A 14 -16.527 9.704 -13.749 1.00 0.00 N ATOM 0 H ARG A 14 -12.997 3.207 -10.378 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.440 5.360 -12.131 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -14.702 4.451 -11.568 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -14.586 5.179 -9.978 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -15.759 6.835 -11.198 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -14.111 7.426 -11.271 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -13.838 6.240 -13.508 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -15.531 5.792 -13.440 1.00 0.00 H new ATOM 0 HE ARG A 14 -14.565 8.338 -14.350 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -17.037 6.903 -12.330 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -18.054 8.347 -12.355 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -15.847 10.178 -14.343 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -17.389 10.179 -13.481 1.00 0.00 H new ATOM 209 N GLN A 15 -12.056 6.027 -8.921 1.00 0.00 N ATOM 210 CA GLN A 15 -11.424 7.010 -8.007 1.00 0.00 C ATOM 211 C GLN A 15 -9.977 7.222 -8.450 1.00 0.00 C ATOM 212 O GLN A 15 -9.422 8.286 -8.297 1.00 0.00 O ATOM 213 CB GLN A 15 -11.443 6.476 -6.568 1.00 0.00 C ATOM 214 CG GLN A 15 -12.864 6.535 -6.009 1.00 0.00 C ATOM 215 CD GLN A 15 -13.222 7.987 -5.694 1.00 0.00 C ATOM 216 OE1 GLN A 15 -12.354 8.928 -5.945 1.00 0.00 O flip ATOM 217 NE2 GLN A 15 -14.302 8.268 -5.212 1.00 0.00 N flip ATOM 0 H GLN A 15 -12.424 5.188 -8.473 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.973 7.951 -8.041 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -11.077 5.449 -6.547 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -10.772 7.066 -5.943 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -13.569 6.123 -6.731 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -12.938 5.926 -5.108 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -14.980 7.532 -5.016 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -14.530 9.240 -5.004 1.00 0.00 H new ATOM 226 N LEU A 16 -9.365 6.207 -9.001 1.00 0.00 N ATOM 227 CA LEU A 16 -7.951 6.350 -9.453 1.00 0.00 C ATOM 228 C LEU A 16 -7.850 7.215 -10.719 1.00 0.00 C ATOM 229 O LEU A 16 -6.913 7.974 -10.870 1.00 0.00 O ATOM 230 CB LEU A 16 -7.336 4.967 -9.726 1.00 0.00 C ATOM 231 CG LEU A 16 -6.673 4.422 -8.459 1.00 0.00 C ATOM 232 CD1 LEU A 16 -6.405 2.933 -8.635 1.00 0.00 C ATOM 233 CD2 LEU A 16 -5.340 5.134 -8.206 1.00 0.00 C ATOM 0 H LEU A 16 -9.781 5.289 -9.157 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.399 6.845 -8.654 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.109 4.278 -10.065 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.600 5.040 -10.527 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.339 4.592 -7.613 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -5.933 2.539 -7.735 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.347 2.412 -8.808 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -5.744 2.781 -9.488 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -4.881 4.735 -7.301 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -4.674 4.971 -9.053 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.516 6.203 -8.083 1.00 0.00 H new ATOM 245 N TYR A 17 -8.778 7.117 -11.639 1.00 0.00 N ATOM 246 CA TYR A 17 -8.663 7.950 -12.871 1.00 0.00 C ATOM 247 C TYR A 17 -9.085 9.389 -12.571 1.00 0.00 C ATOM 248 O TYR A 17 -8.589 10.324 -13.167 1.00 0.00 O ATOM 249 CB TYR A 17 -9.565 7.391 -13.981 1.00 0.00 C ATOM 250 CG TYR A 17 -9.112 6.004 -14.384 1.00 0.00 C ATOM 251 CD1 TYR A 17 -9.639 4.892 -13.727 1.00 0.00 C ATOM 252 CD2 TYR A 17 -8.180 5.828 -15.416 1.00 0.00 C ATOM 253 CE1 TYR A 17 -9.239 3.603 -14.092 1.00 0.00 C ATOM 254 CE2 TYR A 17 -7.781 4.538 -15.783 1.00 0.00 C ATOM 255 CZ TYR A 17 -8.310 3.425 -15.119 1.00 0.00 C ATOM 256 OH TYR A 17 -7.914 2.153 -15.474 1.00 0.00 O ATOM 0 H TYR A 17 -9.595 6.508 -11.591 1.00 0.00 H new ATOM 0 HA TYR A 17 -7.625 7.930 -13.201 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -10.598 7.356 -13.635 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -9.540 8.054 -14.846 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -10.359 5.027 -12.933 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -7.770 6.687 -15.927 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -9.649 2.745 -13.580 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -7.064 4.401 -16.579 1.00 0.00 H new ATOM 0 HH TYR A 17 -7.686 2.135 -16.427 1.00 0.00 H new ATOM 266 N GLU A 18 -10.026 9.577 -11.684 1.00 0.00 N ATOM 267 CA GLU A 18 -10.513 10.956 -11.387 1.00 0.00 C ATOM 268 C GLU A 18 -9.450 11.774 -10.657 1.00 0.00 C ATOM 269 O GLU A 18 -9.432 12.985 -10.742 1.00 0.00 O ATOM 270 CB GLU A 18 -11.771 10.863 -10.517 1.00 0.00 C ATOM 271 CG GLU A 18 -12.989 10.428 -11.356 1.00 0.00 C ATOM 272 CD GLU A 18 -12.550 9.639 -12.597 1.00 0.00 C ATOM 273 OE1 GLU A 18 -12.432 8.429 -12.497 1.00 0.00 O ATOM 274 OE2 GLU A 18 -12.343 10.260 -13.625 1.00 0.00 O ATOM 0 H GLU A 18 -10.479 8.834 -11.152 1.00 0.00 H new ATOM 0 HA GLU A 18 -10.737 11.456 -12.329 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -11.607 10.150 -9.709 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -11.970 11.829 -10.054 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -13.654 9.815 -10.747 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -13.557 11.307 -11.662 1.00 0.00 H new ATOM 281 N ILE A 19 -8.590 11.127 -9.923 1.00 0.00 N ATOM 282 CA ILE A 19 -7.544 11.860 -9.164 1.00 0.00 C ATOM 283 C ILE A 19 -7.064 13.075 -9.965 1.00 0.00 C ATOM 284 O ILE A 19 -6.808 14.128 -9.415 1.00 0.00 O ATOM 285 CB ILE A 19 -6.402 10.895 -8.881 1.00 0.00 C ATOM 286 CG1 ILE A 19 -6.785 10.036 -7.677 1.00 0.00 C ATOM 287 CG2 ILE A 19 -5.121 11.656 -8.573 1.00 0.00 C ATOM 288 CD1 ILE A 19 -5.936 8.776 -7.649 1.00 0.00 C ATOM 0 H ILE A 19 -8.568 10.113 -9.816 1.00 0.00 H new ATOM 0 HA ILE A 19 -7.944 12.232 -8.221 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.228 10.271 -9.758 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.643 10.601 -6.756 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.841 9.772 -7.729 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.316 10.948 -8.373 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.853 12.278 -9.427 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.274 12.287 -7.698 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.215 8.169 -6.788 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.100 8.206 -8.564 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.883 9.048 -7.575 1.00 0.00 H new ATOM 300 N ASN A 20 -6.944 12.944 -11.255 1.00 0.00 N ATOM 301 CA ASN A 20 -6.487 14.103 -12.076 1.00 0.00 C ATOM 302 C ASN A 20 -6.576 13.763 -13.561 1.00 0.00 C ATOM 303 O ASN A 20 -6.778 12.627 -13.943 1.00 0.00 O ATOM 304 CB ASN A 20 -5.039 14.452 -11.723 1.00 0.00 C ATOM 305 CG ASN A 20 -4.201 13.176 -11.649 1.00 0.00 C ATOM 306 OD1 ASN A 20 -4.689 12.060 -12.110 1.00 0.00 O flip ATOM 307 ND2 ASN A 20 -3.086 13.198 -11.165 1.00 0.00 N flip ATOM 0 H ASN A 20 -7.141 12.090 -11.777 1.00 0.00 H new ATOM 0 HA ASN A 20 -7.130 14.957 -11.863 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -4.625 15.127 -12.472 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -5.004 14.976 -10.768 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -2.704 14.072 -10.804 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -2.533 12.342 -11.120 1.00 0.00 H new ATOM 314 N ASP A 21 -6.436 14.752 -14.399 1.00 0.00 N ATOM 315 CA ASP A 21 -6.524 14.510 -15.864 1.00 0.00 C ATOM 316 C ASP A 21 -5.137 14.207 -16.429 1.00 0.00 C ATOM 317 O ASP A 21 -4.538 15.023 -17.102 1.00 0.00 O ATOM 318 CB ASP A 21 -7.093 15.753 -16.551 1.00 0.00 C ATOM 319 CG ASP A 21 -8.550 15.945 -16.130 1.00 0.00 C ATOM 320 OD1 ASP A 21 -9.099 15.032 -15.537 1.00 0.00 O ATOM 321 OD2 ASP A 21 -9.093 17.003 -16.408 1.00 0.00 O ATOM 0 H ASP A 21 -6.264 15.721 -14.130 1.00 0.00 H new ATOM 0 HA ASP A 21 -7.177 13.657 -16.046 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.507 16.631 -16.281 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -7.027 15.646 -17.634 1.00 0.00 H new ATOM 326 N ASP A 22 -4.629 13.031 -16.178 1.00 0.00 N ATOM 327 CA ASP A 22 -3.288 12.662 -16.716 1.00 0.00 C ATOM 328 C ASP A 22 -3.478 11.618 -17.829 1.00 0.00 C ATOM 329 O ASP A 22 -4.234 10.680 -17.669 1.00 0.00 O ATOM 330 CB ASP A 22 -2.433 12.063 -15.598 1.00 0.00 C ATOM 331 CG ASP A 22 -1.844 13.189 -14.745 1.00 0.00 C ATOM 332 OD1 ASP A 22 -1.314 14.125 -15.320 1.00 0.00 O ATOM 333 OD2 ASP A 22 -1.933 13.094 -13.532 1.00 0.00 O ATOM 0 H ASP A 22 -5.086 12.308 -15.622 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.789 13.547 -17.112 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -3.038 11.401 -14.978 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -1.632 11.458 -16.023 1.00 0.00 H new ATOM 338 N PRO A 23 -2.814 11.770 -18.953 1.00 0.00 N ATOM 339 CA PRO A 23 -2.945 10.810 -20.086 1.00 0.00 C ATOM 340 C PRO A 23 -2.230 9.484 -19.810 1.00 0.00 C ATOM 341 O PRO A 23 -2.835 8.430 -19.801 1.00 0.00 O ATOM 342 CB PRO A 23 -2.287 11.540 -21.259 1.00 0.00 C ATOM 343 CG PRO A 23 -1.306 12.475 -20.638 1.00 0.00 C ATOM 344 CD PRO A 23 -1.871 12.858 -19.271 1.00 0.00 C ATOM 0 HA PRO A 23 -3.985 10.540 -20.269 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -1.792 10.839 -21.931 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -3.026 12.081 -21.851 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -0.330 12.000 -20.534 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -1.166 13.359 -21.260 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -1.083 12.934 -18.521 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -2.374 13.824 -19.304 1.00 0.00 H new ATOM 352 N LYS A 24 -0.947 9.529 -19.586 1.00 0.00 N ATOM 353 CA LYS A 24 -0.192 8.274 -19.311 1.00 0.00 C ATOM 354 C LYS A 24 -0.779 7.581 -18.082 1.00 0.00 C ATOM 355 O LYS A 24 -0.801 6.370 -17.994 1.00 0.00 O ATOM 356 CB LYS A 24 1.279 8.611 -19.049 1.00 0.00 C ATOM 357 CG LYS A 24 1.867 9.380 -20.239 1.00 0.00 C ATOM 358 CD LYS A 24 2.029 8.449 -21.445 1.00 0.00 C ATOM 359 CE LYS A 24 2.843 9.160 -22.526 1.00 0.00 C ATOM 360 NZ LYS A 24 2.053 10.302 -23.067 1.00 0.00 N ATOM 0 H LYS A 24 -0.387 10.382 -19.581 1.00 0.00 H new ATOM 0 HA LYS A 24 -0.268 7.611 -20.173 1.00 0.00 H new ATOM 0 HB2 LYS A 24 1.367 9.209 -18.142 1.00 0.00 H new ATOM 0 HB3 LYS A 24 1.846 7.695 -18.883 1.00 0.00 H new ATOM 0 HG2 LYS A 24 1.215 10.214 -20.500 1.00 0.00 H new ATOM 0 HG3 LYS A 24 2.833 9.804 -19.965 1.00 0.00 H new ATOM 0 HD2 LYS A 24 2.529 7.528 -21.144 1.00 0.00 H new ATOM 0 HD3 LYS A 24 1.051 8.168 -21.836 1.00 0.00 H new ATOM 0 HE2 LYS A 24 3.785 9.519 -22.111 1.00 0.00 H new ATOM 0 HE3 LYS A 24 3.092 8.464 -23.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 2.517 10.671 -23.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 1.094 9.978 -23.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 1.996 11.055 -22.352 1.00 0.00 H new ATOM 374 N ARG A 25 -1.249 8.334 -17.124 1.00 0.00 N ATOM 375 CA ARG A 25 -1.822 7.699 -15.905 1.00 0.00 C ATOM 376 C ARG A 25 -2.956 6.757 -16.309 1.00 0.00 C ATOM 377 O ARG A 25 -3.083 5.668 -15.788 1.00 0.00 O ATOM 378 CB ARG A 25 -2.374 8.772 -14.970 1.00 0.00 C ATOM 379 CG ARG A 25 -2.710 8.136 -13.621 1.00 0.00 C ATOM 380 CD ARG A 25 -3.704 9.022 -12.863 1.00 0.00 C ATOM 381 NE ARG A 25 -3.486 8.914 -11.382 1.00 0.00 N ATOM 382 CZ ARG A 25 -3.236 7.765 -10.800 1.00 0.00 C ATOM 383 NH1 ARG A 25 -3.281 6.649 -11.467 1.00 0.00 N ATOM 384 NH2 ARG A 25 -2.978 7.735 -9.523 1.00 0.00 N ATOM 0 H ARG A 25 -1.261 9.354 -17.133 1.00 0.00 H new ATOM 0 HA ARG A 25 -1.039 7.140 -15.393 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.642 9.569 -14.838 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -3.265 9.226 -15.404 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -3.135 7.144 -13.772 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.801 8.007 -13.033 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -3.589 10.059 -13.178 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -4.724 8.726 -13.108 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.534 9.758 -10.812 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -3.514 6.657 -12.460 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -3.083 5.766 -10.997 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -2.971 8.601 -8.984 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -2.783 6.846 -9.063 1.00 0.00 H new ATOM 398 N LYS A 26 -3.790 7.162 -17.227 1.00 0.00 N ATOM 399 CA LYS A 26 -4.908 6.271 -17.641 1.00 0.00 C ATOM 400 C LYS A 26 -4.321 4.987 -18.224 1.00 0.00 C ATOM 401 O LYS A 26 -4.631 3.894 -17.793 1.00 0.00 O ATOM 402 CB LYS A 26 -5.753 6.977 -18.705 1.00 0.00 C ATOM 403 CG LYS A 26 -6.960 6.107 -19.062 1.00 0.00 C ATOM 404 CD LYS A 26 -7.764 6.783 -20.176 1.00 0.00 C ATOM 405 CE LYS A 26 -9.048 5.990 -20.432 1.00 0.00 C ATOM 406 NZ LYS A 26 -8.711 4.692 -21.082 1.00 0.00 N ATOM 0 H LYS A 26 -3.746 8.063 -17.704 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.536 6.035 -16.782 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -6.087 7.946 -18.334 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -5.152 7.166 -19.595 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.628 5.121 -19.386 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.588 5.959 -18.184 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -8.007 7.807 -19.894 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.169 6.836 -21.088 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -9.572 5.813 -19.493 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -9.721 6.564 -21.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -9.524 4.362 -21.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -7.890 4.820 -21.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.483 3.987 -20.352 1.00 0.00 H new ATOM 420 N GLU A 27 -3.463 5.117 -19.195 1.00 0.00 N ATOM 421 CA GLU A 27 -2.838 3.910 -19.802 1.00 0.00 C ATOM 422 C GLU A 27 -2.223 3.063 -18.688 1.00 0.00 C ATOM 423 O GLU A 27 -2.259 1.849 -18.722 1.00 0.00 O ATOM 424 CB GLU A 27 -1.748 4.336 -20.788 1.00 0.00 C ATOM 425 CG GLU A 27 -1.203 3.103 -21.512 1.00 0.00 C ATOM 426 CD GLU A 27 -0.050 3.516 -22.428 1.00 0.00 C ATOM 427 OE1 GLU A 27 0.270 4.693 -22.451 1.00 0.00 O ATOM 428 OE2 GLU A 27 0.494 2.648 -23.090 1.00 0.00 O ATOM 0 H GLU A 27 -3.167 6.007 -19.595 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.591 3.330 -20.336 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -2.153 5.045 -21.510 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -0.943 4.845 -20.258 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -0.859 2.365 -20.787 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -1.994 2.632 -22.096 1.00 0.00 H new ATOM 435 N PHE A 28 -1.661 3.701 -17.697 1.00 0.00 N ATOM 436 CA PHE A 28 -1.043 2.949 -16.571 1.00 0.00 C ATOM 437 C PHE A 28 -2.110 2.129 -15.847 1.00 0.00 C ATOM 438 O PHE A 28 -2.057 0.916 -15.803 1.00 0.00 O ATOM 439 CB PHE A 28 -0.458 3.950 -15.585 1.00 0.00 C ATOM 440 CG PHE A 28 0.325 3.217 -14.539 1.00 0.00 C ATOM 441 CD1 PHE A 28 1.668 2.930 -14.775 1.00 0.00 C ATOM 442 CD2 PHE A 28 -0.277 2.839 -13.330 1.00 0.00 C ATOM 443 CE1 PHE A 28 2.419 2.262 -13.814 1.00 0.00 C ATOM 444 CE2 PHE A 28 0.476 2.166 -12.366 1.00 0.00 C ATOM 445 CZ PHE A 28 1.825 1.875 -12.607 1.00 0.00 C ATOM 0 H PHE A 28 -1.604 4.716 -17.620 1.00 0.00 H new ATOM 0 HA PHE A 28 -0.270 2.285 -16.958 1.00 0.00 H new ATOM 0 HB2 PHE A 28 0.185 4.658 -16.107 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -1.256 4.528 -15.119 1.00 0.00 H new ATOM 0 HD1 PHE A 28 2.127 3.227 -15.707 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.316 3.067 -13.146 1.00 0.00 H new ATOM 0 HE1 PHE A 28 3.460 2.042 -13.999 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.018 1.870 -11.434 1.00 0.00 H new ATOM 0 HZ PHE A 28 2.406 1.352 -11.862 1.00 0.00 H new ATOM 455 N LEU A 29 -3.075 2.793 -15.276 1.00 0.00 N ATOM 456 CA LEU A 29 -4.155 2.078 -14.545 1.00 0.00 C ATOM 457 C LEU A 29 -4.799 1.045 -15.461 1.00 0.00 C ATOM 458 O LEU A 29 -5.020 -0.088 -15.084 1.00 0.00 O ATOM 459 CB LEU A 29 -5.221 3.096 -14.149 1.00 0.00 C ATOM 460 CG LEU A 29 -4.617 4.170 -13.251 1.00 0.00 C ATOM 461 CD1 LEU A 29 -5.655 5.270 -13.020 1.00 0.00 C ATOM 462 CD2 LEU A 29 -4.228 3.551 -11.907 1.00 0.00 C ATOM 0 H LEU A 29 -3.162 3.809 -15.285 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.739 1.583 -13.667 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -5.645 3.555 -15.042 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -6.038 2.595 -13.630 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.731 4.591 -13.727 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -5.230 6.042 -12.378 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -5.939 5.709 -13.976 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.536 4.844 -12.540 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.796 4.318 -11.264 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -5.114 3.134 -11.429 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.496 2.759 -12.069 1.00 0.00 H new ATOM 474 N ASP A 30 -5.106 1.435 -16.663 1.00 0.00 N ATOM 475 CA ASP A 30 -5.748 0.476 -17.610 1.00 0.00 C ATOM 476 C ASP A 30 -4.817 -0.708 -17.866 1.00 0.00 C ATOM 477 O ASP A 30 -5.216 -1.852 -17.779 1.00 0.00 O ATOM 478 CB ASP A 30 -6.035 1.174 -18.941 1.00 0.00 C ATOM 479 CG ASP A 30 -7.175 2.178 -18.768 1.00 0.00 C ATOM 480 OD1 ASP A 30 -7.847 2.112 -17.755 1.00 0.00 O ATOM 481 OD2 ASP A 30 -7.363 2.990 -19.659 1.00 0.00 O ATOM 0 H ASP A 30 -4.943 2.371 -17.033 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.680 0.122 -17.169 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -5.139 1.685 -19.294 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -6.300 0.436 -19.698 1.00 0.00 H new ATOM 486 N ASP A 31 -3.581 -0.447 -18.187 1.00 0.00 N ATOM 487 CA ASP A 31 -2.632 -1.562 -18.454 1.00 0.00 C ATOM 488 C ASP A 31 -2.376 -2.356 -17.172 1.00 0.00 C ATOM 489 O ASP A 31 -2.336 -3.570 -17.180 1.00 0.00 O ATOM 490 CB ASP A 31 -1.310 -0.989 -18.968 1.00 0.00 C ATOM 491 CG ASP A 31 -0.407 -2.130 -19.438 1.00 0.00 C ATOM 492 OD1 ASP A 31 -0.874 -3.256 -19.466 1.00 0.00 O ATOM 493 OD2 ASP A 31 0.737 -1.857 -19.763 1.00 0.00 O ATOM 0 H ASP A 31 -3.187 0.490 -18.276 1.00 0.00 H new ATOM 0 HA ASP A 31 -3.065 -2.226 -19.202 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -1.496 -0.297 -19.789 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.816 -0.422 -18.179 1.00 0.00 H new ATOM 498 N LEU A 32 -2.179 -1.681 -16.072 1.00 0.00 N ATOM 499 CA LEU A 32 -1.898 -2.405 -14.800 1.00 0.00 C ATOM 500 C LEU A 32 -3.003 -3.414 -14.507 1.00 0.00 C ATOM 501 O LEU A 32 -2.738 -4.575 -14.271 1.00 0.00 O ATOM 502 CB LEU A 32 -1.787 -1.399 -13.648 1.00 0.00 C ATOM 503 CG LEU A 32 -1.477 -2.131 -12.338 1.00 0.00 C ATOM 504 CD1 LEU A 32 -0.090 -2.767 -12.409 1.00 0.00 C ATOM 505 CD2 LEU A 32 -1.491 -1.135 -11.186 1.00 0.00 C ATOM 0 H LEU A 32 -2.200 -0.664 -15.999 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.955 -2.943 -14.901 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.002 -0.673 -13.863 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.719 -0.842 -13.551 1.00 0.00 H new ATOM 0 HG LEU A 32 -2.230 -2.904 -12.181 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.121 -3.285 -11.473 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.058 -3.479 -13.233 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.658 -1.991 -12.571 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.271 -1.654 -10.253 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.738 -0.367 -11.360 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.475 -0.670 -11.119 1.00 0.00 H new ATOM 517 N PHE A 33 -4.235 -3.003 -14.518 1.00 0.00 N ATOM 518 CA PHE A 33 -5.313 -3.983 -14.233 1.00 0.00 C ATOM 519 C PHE A 33 -5.293 -5.063 -15.312 1.00 0.00 C ATOM 520 O PHE A 33 -5.623 -6.205 -15.070 1.00 0.00 O ATOM 521 CB PHE A 33 -6.685 -3.305 -14.258 1.00 0.00 C ATOM 522 CG PHE A 33 -6.792 -2.234 -13.189 1.00 0.00 C ATOM 523 CD1 PHE A 33 -6.591 -2.552 -11.835 1.00 0.00 C ATOM 524 CD2 PHE A 33 -7.105 -0.916 -13.554 1.00 0.00 C ATOM 525 CE1 PHE A 33 -6.702 -1.552 -10.856 1.00 0.00 C ATOM 526 CE2 PHE A 33 -7.218 0.078 -12.574 1.00 0.00 C ATOM 527 CZ PHE A 33 -7.018 -0.237 -11.228 1.00 0.00 C ATOM 0 H PHE A 33 -4.540 -2.048 -14.708 1.00 0.00 H new ATOM 0 HA PHE A 33 -5.143 -4.410 -13.245 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.855 -2.861 -15.239 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -7.464 -4.052 -14.107 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.351 -3.565 -11.548 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -7.259 -0.667 -14.594 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -6.544 -1.795 -9.816 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -7.460 1.091 -12.860 1.00 0.00 H new ATOM 0 HZ PHE A 33 -7.107 0.531 -10.474 1.00 0.00 H new ATOM 537 N SER A 34 -4.930 -4.702 -16.510 1.00 0.00 N ATOM 538 CA SER A 34 -4.915 -5.697 -17.620 1.00 0.00 C ATOM 539 C SER A 34 -3.830 -6.759 -17.402 1.00 0.00 C ATOM 540 O SER A 34 -4.114 -7.934 -17.281 1.00 0.00 O ATOM 541 CB SER A 34 -4.649 -4.973 -18.940 1.00 0.00 C ATOM 542 OG SER A 34 -4.793 -5.890 -20.016 1.00 0.00 O ATOM 0 H SER A 34 -4.642 -3.759 -16.770 1.00 0.00 H new ATOM 0 HA SER A 34 -5.884 -6.196 -17.646 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.345 -4.143 -19.059 1.00 0.00 H new ATOM 0 HB3 SER A 34 -3.645 -4.550 -18.940 1.00 0.00 H new ATOM 0 HG SER A 34 -4.625 -5.428 -20.864 1.00 0.00 H new ATOM 548 N PHE A 35 -2.590 -6.358 -17.383 1.00 0.00 N ATOM 549 CA PHE A 35 -1.482 -7.347 -17.210 1.00 0.00 C ATOM 550 C PHE A 35 -1.563 -8.039 -15.842 1.00 0.00 C ATOM 551 O PHE A 35 -1.113 -9.156 -15.679 1.00 0.00 O ATOM 552 CB PHE A 35 -0.140 -6.623 -17.417 1.00 0.00 C ATOM 553 CG PHE A 35 0.963 -7.204 -16.558 1.00 0.00 C ATOM 554 CD1 PHE A 35 1.293 -8.563 -16.630 1.00 0.00 C ATOM 555 CD2 PHE A 35 1.696 -6.352 -15.727 1.00 0.00 C ATOM 556 CE1 PHE A 35 2.354 -9.064 -15.864 1.00 0.00 C ATOM 557 CE2 PHE A 35 2.749 -6.852 -14.958 1.00 0.00 C ATOM 558 CZ PHE A 35 3.080 -8.207 -15.026 1.00 0.00 C ATOM 0 H PHE A 35 -2.292 -5.387 -17.480 1.00 0.00 H new ATOM 0 HA PHE A 35 -1.573 -8.138 -17.954 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.147 -6.687 -18.466 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.260 -5.565 -17.184 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.731 -9.223 -17.274 1.00 0.00 H new ATOM 0 HD2 PHE A 35 1.447 -5.302 -15.679 1.00 0.00 H new ATOM 0 HE1 PHE A 35 2.612 -10.111 -15.919 1.00 0.00 H new ATOM 0 HE2 PHE A 35 3.307 -6.191 -14.311 1.00 0.00 H new ATOM 0 HZ PHE A 35 3.895 -8.594 -14.433 1.00 0.00 H new ATOM 568 N MET A 36 -2.123 -7.394 -14.861 1.00 0.00 N ATOM 569 CA MET A 36 -2.217 -8.027 -13.513 1.00 0.00 C ATOM 570 C MET A 36 -3.106 -9.279 -13.552 1.00 0.00 C ATOM 571 O MET A 36 -2.817 -10.269 -12.910 1.00 0.00 O ATOM 572 CB MET A 36 -2.807 -7.014 -12.536 1.00 0.00 C ATOM 573 CG MET A 36 -1.735 -5.990 -12.167 1.00 0.00 C ATOM 574 SD MET A 36 -0.589 -6.711 -10.967 1.00 0.00 S ATOM 575 CE MET A 36 -1.605 -6.436 -9.495 1.00 0.00 C ATOM 0 H MET A 36 -2.520 -6.457 -14.931 1.00 0.00 H new ATOM 0 HA MET A 36 -1.219 -8.329 -13.194 1.00 0.00 H new ATOM 0 HB2 MET A 36 -3.665 -6.514 -12.986 1.00 0.00 H new ATOM 0 HB3 MET A 36 -3.166 -7.521 -11.641 1.00 0.00 H new ATOM 0 HG2 MET A 36 -1.193 -5.679 -13.060 1.00 0.00 H new ATOM 0 HG3 MET A 36 -2.200 -5.097 -11.749 1.00 0.00 H new ATOM 0 HE1 MET A 36 -1.412 -7.224 -8.767 1.00 0.00 H new ATOM 0 HE2 MET A 36 -1.357 -5.469 -9.057 1.00 0.00 H new ATOM 0 HE3 MET A 36 -2.659 -6.448 -9.773 1.00 0.00 H new ATOM 585 N GLN A 37 -4.186 -9.245 -14.282 1.00 0.00 N ATOM 586 CA GLN A 37 -5.086 -10.436 -14.336 1.00 0.00 C ATOM 587 C GLN A 37 -4.347 -11.641 -14.924 1.00 0.00 C ATOM 588 O GLN A 37 -4.560 -12.768 -14.522 1.00 0.00 O ATOM 589 CB GLN A 37 -6.304 -10.121 -15.208 1.00 0.00 C ATOM 590 CG GLN A 37 -7.156 -9.048 -14.529 1.00 0.00 C ATOM 591 CD GLN A 37 -8.354 -8.707 -15.416 1.00 0.00 C ATOM 592 OE1 GLN A 37 -8.359 -9.012 -16.592 1.00 0.00 O ATOM 593 NE2 GLN A 37 -9.376 -8.085 -14.898 1.00 0.00 N ATOM 0 H GLN A 37 -4.486 -8.447 -14.843 1.00 0.00 H new ATOM 0 HA GLN A 37 -5.406 -10.675 -13.322 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -5.981 -9.776 -16.190 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -6.895 -11.023 -15.365 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -7.499 -9.403 -13.557 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -6.558 -8.155 -14.349 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -9.371 -7.830 -13.911 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -10.181 -7.854 -15.480 1.00 0.00 H new ATOM 602 N LYS A 38 -3.493 -11.416 -15.882 1.00 0.00 N ATOM 603 CA LYS A 38 -2.755 -12.551 -16.506 1.00 0.00 C ATOM 604 C LYS A 38 -1.926 -13.309 -15.463 1.00 0.00 C ATOM 605 O LYS A 38 -1.971 -14.520 -15.388 1.00 0.00 O ATOM 606 CB LYS A 38 -1.833 -12.007 -17.594 1.00 0.00 C ATOM 607 CG LYS A 38 -0.977 -13.146 -18.140 1.00 0.00 C ATOM 608 CD LYS A 38 -0.235 -12.675 -19.392 1.00 0.00 C ATOM 609 CE LYS A 38 0.734 -11.551 -19.023 1.00 0.00 C ATOM 610 NZ LYS A 38 1.812 -11.471 -20.049 1.00 0.00 N ATOM 0 H LYS A 38 -3.273 -10.495 -16.261 1.00 0.00 H new ATOM 0 HA LYS A 38 -3.478 -13.244 -16.936 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.421 -11.561 -18.396 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.197 -11.220 -17.189 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -0.264 -13.473 -17.384 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -1.605 -14.004 -18.378 1.00 0.00 H new ATOM 0 HD2 LYS A 38 0.310 -13.507 -19.838 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -0.947 -12.324 -20.139 1.00 0.00 H new ATOM 0 HE2 LYS A 38 0.202 -10.602 -18.964 1.00 0.00 H new ATOM 0 HE3 LYS A 38 1.166 -11.736 -18.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.472 -10.707 -19.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.326 -12.375 -20.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.391 -11.275 -20.980 1.00 0.00 H new ATOM 624 N ARG A 39 -1.148 -12.616 -14.681 1.00 0.00 N ATOM 625 CA ARG A 39 -0.293 -13.307 -13.672 1.00 0.00 C ATOM 626 C ARG A 39 -1.148 -14.015 -12.634 1.00 0.00 C ATOM 627 O ARG A 39 -0.684 -14.895 -11.936 1.00 0.00 O ATOM 628 CB ARG A 39 0.577 -12.283 -12.950 1.00 0.00 C ATOM 629 CG ARG A 39 1.545 -11.658 -13.936 1.00 0.00 C ATOM 630 CD ARG A 39 2.749 -11.083 -13.186 1.00 0.00 C ATOM 631 NE ARG A 39 3.368 -12.144 -12.341 1.00 0.00 N ATOM 632 CZ ARG A 39 4.573 -11.980 -11.867 1.00 0.00 C ATOM 633 NH1 ARG A 39 5.248 -10.903 -12.155 1.00 0.00 N ATOM 634 NH2 ARG A 39 5.105 -12.901 -11.109 1.00 0.00 N ATOM 0 H ARG A 39 -1.066 -11.599 -14.695 1.00 0.00 H new ATOM 0 HA ARG A 39 0.324 -14.037 -14.196 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -0.048 -11.512 -12.499 1.00 0.00 H new ATOM 0 HB3 ARG A 39 1.126 -12.763 -12.140 1.00 0.00 H new ATOM 0 HG2 ARG A 39 1.877 -12.405 -14.657 1.00 0.00 H new ATOM 0 HG3 ARG A 39 1.046 -10.870 -14.500 1.00 0.00 H new ATOM 0 HD2 ARG A 39 3.481 -10.696 -13.895 1.00 0.00 H new ATOM 0 HD3 ARG A 39 2.435 -10.245 -12.563 1.00 0.00 H new ATOM 0 HE ARG A 39 2.850 -12.998 -12.133 1.00 0.00 H new ATOM 0 HH11 ARG A 39 4.835 -10.186 -12.752 1.00 0.00 H new ATOM 0 HH12 ARG A 39 6.190 -10.777 -11.784 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.579 -13.747 -10.888 1.00 0.00 H new ATOM 0 HH22 ARG A 39 6.047 -12.775 -10.738 1.00 0.00 H new ATOM 648 N GLY A 40 -2.381 -13.635 -12.500 1.00 0.00 N ATOM 649 CA GLY A 40 -3.237 -14.285 -11.480 1.00 0.00 C ATOM 650 C GLY A 40 -3.298 -13.375 -10.261 1.00 0.00 C ATOM 651 O GLY A 40 -3.899 -13.709 -9.259 1.00 0.00 O ATOM 0 H GLY A 40 -2.833 -12.905 -13.051 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.238 -14.457 -11.877 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.831 -15.259 -11.207 1.00 0.00 H new ATOM 655 N THR A 41 -2.686 -12.215 -10.342 1.00 0.00 N ATOM 656 CA THR A 41 -2.730 -11.269 -9.184 1.00 0.00 C ATOM 657 C THR A 41 -3.444 -9.989 -9.616 1.00 0.00 C ATOM 658 O THR A 41 -2.815 -9.016 -9.978 1.00 0.00 O ATOM 659 CB THR A 41 -1.302 -10.911 -8.755 1.00 0.00 C ATOM 660 OG1 THR A 41 -0.560 -10.493 -9.892 1.00 0.00 O ATOM 661 CG2 THR A 41 -0.616 -12.121 -8.119 1.00 0.00 C ATOM 0 H THR A 41 -2.163 -11.886 -11.154 1.00 0.00 H new ATOM 0 HA THR A 41 -3.257 -11.738 -8.353 1.00 0.00 H new ATOM 0 HB THR A 41 -1.346 -10.105 -8.022 1.00 0.00 H new ATOM 0 HG1 THR A 41 -1.070 -9.817 -10.385 1.00 0.00 H new ATOM 0 HG21 THR A 41 0.397 -11.850 -7.820 1.00 0.00 H new ATOM 0 HG22 THR A 41 -1.180 -12.440 -7.242 1.00 0.00 H new ATOM 0 HG23 THR A 41 -0.575 -12.937 -8.841 1.00 0.00 H new ATOM 669 N PRO A 42 -4.752 -9.985 -9.566 1.00 0.00 N ATOM 670 CA PRO A 42 -5.580 -8.815 -9.942 1.00 0.00 C ATOM 671 C PRO A 42 -5.919 -7.948 -8.730 1.00 0.00 C ATOM 672 O PRO A 42 -6.028 -8.440 -7.623 1.00 0.00 O ATOM 673 CB PRO A 42 -6.834 -9.487 -10.478 1.00 0.00 C ATOM 674 CG PRO A 42 -7.017 -10.676 -9.590 1.00 0.00 C ATOM 675 CD PRO A 42 -5.609 -11.108 -9.149 1.00 0.00 C ATOM 0 HA PRO A 42 -5.087 -8.143 -10.644 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -7.694 -8.819 -10.433 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -6.714 -9.782 -11.520 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -7.634 -10.425 -8.727 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -7.523 -11.483 -10.120 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -5.559 -11.271 -8.072 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -5.308 -12.040 -9.627 1.00 0.00 H new ATOM 683 N ILE A 43 -6.097 -6.672 -8.914 1.00 0.00 N ATOM 684 CA ILE A 43 -6.437 -5.818 -7.747 1.00 0.00 C ATOM 685 C ILE A 43 -7.945 -5.863 -7.516 1.00 0.00 C ATOM 686 O ILE A 43 -8.700 -5.158 -8.156 1.00 0.00 O ATOM 687 CB ILE A 43 -6.017 -4.371 -8.008 1.00 0.00 C ATOM 688 CG1 ILE A 43 -4.546 -4.330 -8.418 1.00 0.00 C ATOM 689 CG2 ILE A 43 -6.204 -3.556 -6.727 1.00 0.00 C ATOM 690 CD1 ILE A 43 -4.175 -2.918 -8.871 1.00 0.00 C ATOM 0 H ILE A 43 -6.023 -6.189 -9.809 1.00 0.00 H new ATOM 0 HA ILE A 43 -5.909 -6.191 -6.869 1.00 0.00 H new ATOM 0 HB ILE A 43 -6.629 -3.953 -8.807 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -3.917 -4.630 -7.580 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -4.364 -5.040 -9.224 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -5.906 -2.523 -6.906 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -7.252 -3.585 -6.427 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.588 -3.979 -5.934 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.125 -2.894 -9.162 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -4.794 -2.634 -9.722 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -4.341 -2.218 -8.052 1.00 0.00 H new ATOM 702 N ASN A 44 -8.394 -6.675 -6.602 1.00 0.00 N ATOM 703 CA ASN A 44 -9.855 -6.742 -6.333 1.00 0.00 C ATOM 704 C ASN A 44 -10.229 -5.555 -5.452 1.00 0.00 C ATOM 705 O ASN A 44 -11.385 -5.228 -5.272 1.00 0.00 O ATOM 706 CB ASN A 44 -10.171 -8.045 -5.600 1.00 0.00 C ATOM 707 CG ASN A 44 -9.740 -9.234 -6.462 1.00 0.00 C ATOM 708 OD1 ASN A 44 -9.105 -10.151 -5.980 1.00 0.00 O ATOM 709 ND2 ASN A 44 -10.062 -9.258 -7.727 1.00 0.00 N ATOM 0 H ASN A 44 -7.816 -7.292 -6.032 1.00 0.00 H new ATOM 0 HA ASN A 44 -10.419 -6.711 -7.265 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -9.652 -8.070 -4.642 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -11.238 -8.105 -5.387 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -9.781 -10.046 -8.310 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -10.595 -8.489 -8.132 1.00 0.00 H new ATOM 716 N ARG A 45 -9.239 -4.908 -4.908 1.00 0.00 N ATOM 717 CA ARG A 45 -9.480 -3.733 -4.038 1.00 0.00 C ATOM 718 C ARG A 45 -8.192 -2.908 -3.984 1.00 0.00 C ATOM 719 O ARG A 45 -7.147 -3.410 -3.622 1.00 0.00 O ATOM 720 CB ARG A 45 -9.830 -4.230 -2.650 1.00 0.00 C ATOM 721 CG ARG A 45 -8.612 -4.958 -2.075 1.00 0.00 C ATOM 722 CD ARG A 45 -9.037 -5.945 -0.983 1.00 0.00 C ATOM 723 NE ARG A 45 -8.620 -7.322 -1.371 1.00 0.00 N ATOM 724 CZ ARG A 45 -8.583 -8.269 -0.473 1.00 0.00 C ATOM 725 NH1 ARG A 45 -8.904 -8.009 0.764 1.00 0.00 N ATOM 726 NH2 ARG A 45 -8.222 -9.477 -0.813 1.00 0.00 N ATOM 0 H ARG A 45 -8.256 -5.151 -5.034 1.00 0.00 H new ATOM 0 HA ARG A 45 -10.295 -3.120 -4.422 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -10.111 -3.395 -2.008 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -10.688 -4.901 -2.693 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -8.091 -5.490 -2.871 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -7.910 -4.233 -1.664 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -8.582 -5.670 -0.032 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -10.117 -5.906 -0.843 1.00 0.00 H new ATOM 0 HE ARG A 45 -8.364 -7.525 -2.337 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -9.184 -7.065 1.031 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -8.875 -8.749 1.465 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -7.969 -9.681 -1.780 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -8.193 -10.217 -0.112 1.00 0.00 H new ATOM 740 N LEU A 46 -8.239 -1.659 -4.348 1.00 0.00 N ATOM 741 CA LEU A 46 -6.984 -0.850 -4.309 1.00 0.00 C ATOM 742 C LEU A 46 -6.603 -0.576 -2.854 1.00 0.00 C ATOM 743 O LEU A 46 -7.462 -0.383 -2.017 1.00 0.00 O ATOM 744 CB LEU A 46 -7.169 0.516 -4.986 1.00 0.00 C ATOM 745 CG LEU A 46 -8.061 0.426 -6.225 1.00 0.00 C ATOM 746 CD1 LEU A 46 -8.616 1.815 -6.510 1.00 0.00 C ATOM 747 CD2 LEU A 46 -7.254 -0.044 -7.444 1.00 0.00 C ATOM 0 H LEU A 46 -9.074 -1.167 -4.666 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.216 -1.419 -4.832 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.606 1.217 -4.275 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -6.195 0.915 -5.269 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.862 -0.290 -6.041 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.257 1.777 -7.391 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -9.197 2.158 -5.654 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.792 2.506 -6.690 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.909 -0.101 -8.314 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.448 0.663 -7.642 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.831 -1.028 -7.243 1.00 0.00 H new ATOM 759 N PRO A 47 -5.335 -0.498 -2.558 1.00 0.00 N ATOM 760 CA PRO A 47 -4.885 -0.168 -1.188 1.00 0.00 C ATOM 761 C PRO A 47 -5.239 1.288 -0.886 1.00 0.00 C ATOM 762 O PRO A 47 -5.100 2.147 -1.734 1.00 0.00 O ATOM 763 CB PRO A 47 -3.368 -0.379 -1.216 1.00 0.00 C ATOM 764 CG PRO A 47 -2.971 -0.346 -2.659 1.00 0.00 C ATOM 765 CD PRO A 47 -4.209 -0.709 -3.480 1.00 0.00 C ATOM 0 HA PRO A 47 -5.354 -0.779 -0.417 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -2.856 0.401 -0.653 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -3.098 -1.331 -0.759 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -2.604 0.643 -2.934 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -2.162 -1.051 -2.851 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -4.297 -0.079 -4.365 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -4.167 -1.742 -3.826 1.00 0.00 H new ATOM 773 N ILE A 48 -5.718 1.580 0.290 1.00 0.00 N ATOM 774 CA ILE A 48 -6.103 2.988 0.604 1.00 0.00 C ATOM 775 C ILE A 48 -5.071 3.621 1.526 1.00 0.00 C ATOM 776 O ILE A 48 -4.490 2.977 2.375 1.00 0.00 O ATOM 777 CB ILE A 48 -7.486 2.999 1.272 1.00 0.00 C ATOM 778 CG1 ILE A 48 -8.500 2.386 0.298 1.00 0.00 C ATOM 779 CG2 ILE A 48 -7.905 4.436 1.620 1.00 0.00 C ATOM 780 CD1 ILE A 48 -9.926 2.754 0.719 1.00 0.00 C ATOM 0 H ILE A 48 -5.860 0.910 1.046 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.143 3.566 -0.319 1.00 0.00 H new ATOM 0 HB ILE A 48 -7.450 2.421 2.195 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -8.307 2.745 -0.713 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -8.387 1.302 0.278 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -8.887 4.424 2.092 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -7.178 4.871 2.306 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -7.948 5.033 0.709 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -10.637 2.313 0.020 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -10.119 2.373 1.722 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -10.038 3.838 0.715 1.00 0.00 H new ATOM 792 N MET A 49 -4.850 4.894 1.360 1.00 0.00 N ATOM 793 CA MET A 49 -3.869 5.606 2.216 1.00 0.00 C ATOM 794 C MET A 49 -4.391 7.013 2.504 1.00 0.00 C ATOM 795 O MET A 49 -4.675 7.779 1.605 1.00 0.00 O ATOM 796 CB MET A 49 -2.530 5.681 1.489 1.00 0.00 C ATOM 797 CG MET A 49 -1.906 4.285 1.444 1.00 0.00 C ATOM 798 SD MET A 49 -0.182 4.400 0.899 1.00 0.00 S ATOM 799 CE MET A 49 0.511 5.053 2.441 1.00 0.00 C ATOM 0 H MET A 49 -5.313 5.475 0.661 1.00 0.00 H new ATOM 0 HA MET A 49 -3.733 5.073 3.157 1.00 0.00 H new ATOM 0 HB2 MET A 49 -2.672 6.062 0.478 1.00 0.00 H new ATOM 0 HB3 MET A 49 -1.863 6.375 2.000 1.00 0.00 H new ATOM 0 HG2 MET A 49 -1.955 3.823 2.430 1.00 0.00 H new ATOM 0 HG3 MET A 49 -2.470 3.646 0.764 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.599 5.018 2.394 1.00 0.00 H new ATOM 0 HE2 MET A 49 0.187 6.085 2.577 1.00 0.00 H new ATOM 0 HE3 MET A 49 0.164 4.450 3.280 1.00 0.00 H new ATOM 809 N ALA A 50 -4.544 7.347 3.754 1.00 0.00 N ATOM 810 CA ALA A 50 -5.076 8.694 4.101 1.00 0.00 C ATOM 811 C ALA A 50 -6.551 8.749 3.695 1.00 0.00 C ATOM 812 O ALA A 50 -7.035 9.737 3.181 1.00 0.00 O ATOM 813 CB ALA A 50 -4.290 9.767 3.347 1.00 0.00 C ATOM 0 H ALA A 50 -4.324 6.747 4.549 1.00 0.00 H new ATOM 0 HA ALA A 50 -4.976 8.874 5.171 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.681 10.752 3.603 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.238 9.711 3.626 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.390 9.604 2.274 1.00 0.00 H new ATOM 819 N LYS A 51 -7.253 7.673 3.919 1.00 0.00 N ATOM 820 CA LYS A 51 -8.700 7.609 3.557 1.00 0.00 C ATOM 821 C LYS A 51 -8.868 7.875 2.061 1.00 0.00 C ATOM 822 O LYS A 51 -9.912 8.300 1.605 1.00 0.00 O ATOM 823 CB LYS A 51 -9.478 8.651 4.356 1.00 0.00 C ATOM 824 CG LYS A 51 -9.365 8.328 5.843 1.00 0.00 C ATOM 825 CD LYS A 51 -10.197 9.329 6.635 1.00 0.00 C ATOM 826 CE LYS A 51 -10.014 9.078 8.134 1.00 0.00 C ATOM 827 NZ LYS A 51 -10.259 10.343 8.883 1.00 0.00 N ATOM 0 H LYS A 51 -6.882 6.823 4.343 1.00 0.00 H new ATOM 0 HA LYS A 51 -9.086 6.617 3.792 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -9.085 9.648 4.157 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.524 8.654 4.051 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -9.714 7.313 6.035 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -8.323 8.372 6.159 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -9.894 10.346 6.387 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -11.249 9.236 6.366 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -10.704 8.304 8.471 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -9.006 8.715 8.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -10.135 10.173 9.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -9.584 11.069 8.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -11.229 10.671 8.703 1.00 0.00 H new ATOM 841 N SER A 52 -7.846 7.621 1.298 1.00 0.00 N ATOM 842 CA SER A 52 -7.928 7.846 -0.174 1.00 0.00 C ATOM 843 C SER A 52 -7.250 6.680 -0.899 1.00 0.00 C ATOM 844 O SER A 52 -6.422 5.990 -0.338 1.00 0.00 O ATOM 845 CB SER A 52 -7.216 9.151 -0.528 1.00 0.00 C ATOM 846 OG SER A 52 -5.820 8.999 -0.307 1.00 0.00 O ATOM 0 H SER A 52 -6.950 7.265 1.630 1.00 0.00 H new ATOM 0 HA SER A 52 -8.972 7.909 -0.480 1.00 0.00 H new ATOM 0 HB2 SER A 52 -7.405 9.411 -1.570 1.00 0.00 H new ATOM 0 HB3 SER A 52 -7.605 9.968 0.080 1.00 0.00 H new ATOM 0 HG SER A 52 -5.660 8.777 0.634 1.00 0.00 H new ATOM 852 N VAL A 53 -7.592 6.446 -2.139 1.00 0.00 N ATOM 853 CA VAL A 53 -6.956 5.319 -2.877 1.00 0.00 C ATOM 854 C VAL A 53 -5.492 5.650 -3.147 1.00 0.00 C ATOM 855 O VAL A 53 -5.119 6.797 -3.294 1.00 0.00 O ATOM 856 CB VAL A 53 -7.691 5.067 -4.200 1.00 0.00 C ATOM 857 CG1 VAL A 53 -9.177 4.837 -3.922 1.00 0.00 C ATOM 858 CG2 VAL A 53 -7.528 6.275 -5.129 1.00 0.00 C ATOM 0 H VAL A 53 -8.279 6.983 -2.668 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.016 4.416 -2.270 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.267 4.186 -4.681 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.700 4.658 -4.862 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -9.296 3.971 -3.270 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.597 5.718 -3.436 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.053 6.087 -6.066 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.945 7.161 -4.650 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.470 6.437 -5.333 1.00 0.00 H new ATOM 868 N LEU A 54 -4.657 4.653 -3.205 1.00 0.00 N ATOM 869 CA LEU A 54 -3.214 4.906 -3.454 1.00 0.00 C ATOM 870 C LEU A 54 -2.972 5.082 -4.952 1.00 0.00 C ATOM 871 O LEU A 54 -3.318 4.239 -5.755 1.00 0.00 O ATOM 872 CB LEU A 54 -2.408 3.714 -2.945 1.00 0.00 C ATOM 873 CG LEU A 54 -0.916 3.978 -3.138 1.00 0.00 C ATOM 874 CD1 LEU A 54 -0.493 5.190 -2.301 1.00 0.00 C ATOM 875 CD2 LEU A 54 -0.131 2.745 -2.690 1.00 0.00 C ATOM 0 H LEU A 54 -4.913 3.672 -3.090 1.00 0.00 H new ATOM 0 HA LEU A 54 -2.905 5.813 -2.934 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.623 3.542 -1.890 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.699 2.811 -3.481 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.712 4.183 -4.189 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.572 5.375 -2.441 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.059 6.066 -2.618 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.691 4.992 -1.248 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.936 2.924 -2.824 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.336 2.546 -1.638 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.432 1.885 -3.288 1.00 0.00 H new ATOM 887 N ASP A 55 -2.393 6.184 -5.328 1.00 0.00 N ATOM 888 CA ASP A 55 -2.132 6.449 -6.769 1.00 0.00 C ATOM 889 C ASP A 55 -1.156 5.407 -7.327 1.00 0.00 C ATOM 890 O ASP A 55 0.045 5.566 -7.237 1.00 0.00 O ATOM 891 CB ASP A 55 -1.505 7.838 -6.898 1.00 0.00 C ATOM 892 CG ASP A 55 -2.459 8.885 -6.319 1.00 0.00 C ATOM 893 OD1 ASP A 55 -3.416 8.491 -5.672 1.00 0.00 O ATOM 894 OD2 ASP A 55 -2.210 10.062 -6.520 1.00 0.00 O ATOM 0 H ASP A 55 -2.086 6.921 -4.693 1.00 0.00 H new ATOM 0 HA ASP A 55 -3.067 6.395 -7.327 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -0.551 7.868 -6.371 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -1.298 8.059 -7.945 1.00 0.00 H new ATOM 899 N LEU A 56 -1.651 4.332 -7.892 1.00 0.00 N ATOM 900 CA LEU A 56 -0.724 3.303 -8.427 1.00 0.00 C ATOM 901 C LEU A 56 0.251 3.959 -9.400 1.00 0.00 C ATOM 902 O LEU A 56 1.346 3.477 -9.613 1.00 0.00 O ATOM 903 CB LEU A 56 -1.528 2.226 -9.153 1.00 0.00 C ATOM 904 CG LEU A 56 -2.642 1.728 -8.238 1.00 0.00 C ATOM 905 CD1 LEU A 56 -3.347 0.542 -8.895 1.00 0.00 C ATOM 906 CD2 LEU A 56 -2.049 1.289 -6.898 1.00 0.00 C ATOM 0 H LEU A 56 -2.645 4.130 -8.002 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.167 2.848 -7.608 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.950 2.629 -10.073 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.877 1.399 -9.437 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.359 2.532 -8.070 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -4.143 0.185 -8.242 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.772 0.854 -9.849 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.629 -0.260 -9.063 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.847 0.934 -6.246 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -1.331 0.486 -7.064 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.546 2.134 -6.428 1.00 0.00 H new ATOM 918 N TYR A 57 -0.138 5.046 -10.007 1.00 0.00 N ATOM 919 CA TYR A 57 0.771 5.709 -10.977 1.00 0.00 C ATOM 920 C TYR A 57 1.852 6.527 -10.267 1.00 0.00 C ATOM 921 O TYR A 57 3.028 6.260 -10.412 1.00 0.00 O ATOM 922 CB TYR A 57 -0.028 6.638 -11.883 1.00 0.00 C ATOM 923 CG TYR A 57 0.906 7.209 -12.915 1.00 0.00 C ATOM 924 CD1 TYR A 57 1.514 6.353 -13.829 1.00 0.00 C ATOM 925 CD2 TYR A 57 1.168 8.579 -12.953 1.00 0.00 C ATOM 926 CE1 TYR A 57 2.389 6.851 -14.789 1.00 0.00 C ATOM 927 CE2 TYR A 57 2.047 9.092 -13.915 1.00 0.00 C ATOM 928 CZ TYR A 57 2.661 8.227 -14.836 1.00 0.00 C ATOM 929 OH TYR A 57 3.528 8.728 -15.785 1.00 0.00 O ATOM 0 H TYR A 57 -1.041 5.500 -9.873 1.00 0.00 H new ATOM 0 HA TYR A 57 1.253 4.926 -11.563 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -0.839 6.093 -12.365 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.484 7.438 -11.300 1.00 0.00 H new ATOM 0 HD1 TYR A 57 1.305 5.294 -13.793 1.00 0.00 H new ATOM 0 HD2 TYR A 57 0.695 9.241 -12.243 1.00 0.00 H new ATOM 0 HE1 TYR A 57 2.857 6.181 -15.495 1.00 0.00 H new ATOM 0 HE2 TYR A 57 2.253 10.152 -13.949 1.00 0.00 H new ATOM 0 HH TYR A 57 3.604 9.699 -15.679 1.00 0.00 H new ATOM 939 N GLU A 58 1.484 7.536 -9.522 1.00 0.00 N ATOM 940 CA GLU A 58 2.524 8.363 -8.850 1.00 0.00 C ATOM 941 C GLU A 58 3.414 7.466 -7.999 1.00 0.00 C ATOM 942 O GLU A 58 4.611 7.659 -7.925 1.00 0.00 O ATOM 943 CB GLU A 58 1.852 9.417 -7.970 1.00 0.00 C ATOM 944 CG GLU A 58 1.038 10.365 -8.853 1.00 0.00 C ATOM 945 CD GLU A 58 0.416 11.464 -7.989 1.00 0.00 C ATOM 946 OE1 GLU A 58 0.471 11.341 -6.777 1.00 0.00 O ATOM 947 OE2 GLU A 58 -0.106 12.410 -8.556 1.00 0.00 O ATOM 0 H GLU A 58 0.519 7.820 -9.352 1.00 0.00 H new ATOM 0 HA GLU A 58 3.134 8.864 -9.602 1.00 0.00 H new ATOM 0 HB2 GLU A 58 1.204 8.937 -7.237 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.604 9.976 -7.413 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.678 10.807 -9.616 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.256 9.812 -9.374 1.00 0.00 H new ATOM 954 N LEU A 59 2.855 6.465 -7.384 1.00 0.00 N ATOM 955 CA LEU A 59 3.702 5.549 -6.581 1.00 0.00 C ATOM 956 C LEU A 59 4.713 4.913 -7.527 1.00 0.00 C ATOM 957 O LEU A 59 5.893 4.845 -7.255 1.00 0.00 O ATOM 958 CB LEU A 59 2.825 4.458 -5.961 1.00 0.00 C ATOM 959 CG LEU A 59 3.692 3.508 -5.130 1.00 0.00 C ATOM 960 CD1 LEU A 59 4.259 4.256 -3.925 1.00 0.00 C ATOM 961 CD2 LEU A 59 2.839 2.329 -4.651 1.00 0.00 C ATOM 0 H LEU A 59 1.859 6.244 -7.402 1.00 0.00 H new ATOM 0 HA LEU A 59 4.209 6.090 -5.782 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.057 4.909 -5.332 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.310 3.903 -6.745 1.00 0.00 H new ATOM 0 HG LEU A 59 4.514 3.136 -5.741 1.00 0.00 H new ATOM 0 HD11 LEU A 59 4.876 3.579 -3.334 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.866 5.093 -4.269 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.440 4.630 -3.311 1.00 0.00 H new ATOM 0 HD21 LEU A 59 3.454 1.651 -4.059 1.00 0.00 H new ATOM 0 HD22 LEU A 59 2.016 2.700 -4.039 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.438 1.796 -5.513 1.00 0.00 H new ATOM 973 N TYR A 60 4.242 4.471 -8.655 1.00 0.00 N ATOM 974 CA TYR A 60 5.132 3.849 -9.665 1.00 0.00 C ATOM 975 C TYR A 60 6.169 4.872 -10.131 1.00 0.00 C ATOM 976 O TYR A 60 7.347 4.740 -9.869 1.00 0.00 O ATOM 977 CB TYR A 60 4.251 3.431 -10.840 1.00 0.00 C ATOM 978 CG TYR A 60 5.044 2.628 -11.827 1.00 0.00 C ATOM 979 CD1 TYR A 60 5.333 1.294 -11.552 1.00 0.00 C ATOM 980 CD2 TYR A 60 5.473 3.211 -13.022 1.00 0.00 C ATOM 981 CE1 TYR A 60 6.055 0.533 -12.470 1.00 0.00 C ATOM 982 CE2 TYR A 60 6.198 2.450 -13.945 1.00 0.00 C ATOM 983 CZ TYR A 60 6.490 1.110 -13.670 1.00 0.00 C ATOM 984 OH TYR A 60 7.202 0.357 -14.579 1.00 0.00 O ATOM 0 H TYR A 60 3.259 4.516 -8.924 1.00 0.00 H new ATOM 0 HA TYR A 60 5.659 2.990 -9.250 1.00 0.00 H new ATOM 0 HB2 TYR A 60 3.406 2.844 -10.479 1.00 0.00 H new ATOM 0 HB3 TYR A 60 3.840 4.315 -11.327 1.00 0.00 H new ATOM 0 HD1 TYR A 60 4.998 0.849 -10.627 1.00 0.00 H new ATOM 0 HD2 TYR A 60 5.246 4.246 -13.232 1.00 0.00 H new ATOM 0 HE1 TYR A 60 6.279 -0.502 -12.256 1.00 0.00 H new ATOM 0 HE2 TYR A 60 6.532 2.897 -14.870 1.00 0.00 H new ATOM 0 HH TYR A 60 7.426 0.909 -15.357 1.00 0.00 H new ATOM 994 N ASN A 61 5.738 5.884 -10.830 1.00 0.00 N ATOM 995 CA ASN A 61 6.697 6.908 -11.329 1.00 0.00 C ATOM 996 C ASN A 61 7.705 7.244 -10.230 1.00 0.00 C ATOM 997 O ASN A 61 8.873 7.447 -10.495 1.00 0.00 O ATOM 998 CB ASN A 61 5.933 8.173 -11.728 1.00 0.00 C ATOM 999 CG ASN A 61 6.874 9.127 -12.467 1.00 0.00 C ATOM 1000 OD1 ASN A 61 7.892 8.713 -12.987 1.00 0.00 O ATOM 1001 ND2 ASN A 61 6.574 10.395 -12.534 1.00 0.00 N ATOM 0 H ASN A 61 4.762 6.046 -11.078 1.00 0.00 H new ATOM 0 HA ASN A 61 7.226 6.516 -12.197 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.087 7.914 -12.365 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.527 8.660 -10.841 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.194 11.041 -13.023 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.720 10.741 -12.097 1.00 0.00 H new ATOM 1008 N LEU A 62 7.279 7.282 -8.999 1.00 0.00 N ATOM 1009 CA LEU A 62 8.243 7.578 -7.907 1.00 0.00 C ATOM 1010 C LEU A 62 9.173 6.381 -7.747 1.00 0.00 C ATOM 1011 O LEU A 62 10.379 6.511 -7.723 1.00 0.00 O ATOM 1012 CB LEU A 62 7.490 7.828 -6.593 1.00 0.00 C ATOM 1013 CG LEU A 62 7.190 9.324 -6.439 1.00 0.00 C ATOM 1014 CD1 LEU A 62 6.085 9.536 -5.387 1.00 0.00 C ATOM 1015 CD2 LEU A 62 8.476 10.068 -6.021 1.00 0.00 C ATOM 0 H LEU A 62 6.315 7.123 -8.705 1.00 0.00 H new ATOM 0 HA LEU A 62 8.818 8.471 -8.153 1.00 0.00 H new ATOM 0 HB2 LEU A 62 6.560 7.259 -6.583 1.00 0.00 H new ATOM 0 HB3 LEU A 62 8.087 7.479 -5.750 1.00 0.00 H new ATOM 0 HG LEU A 62 6.842 9.722 -7.392 1.00 0.00 H new ATOM 0 HD11 LEU A 62 5.879 10.602 -5.285 1.00 0.00 H new ATOM 0 HD12 LEU A 62 5.178 9.020 -5.703 1.00 0.00 H new ATOM 0 HD13 LEU A 62 6.414 9.137 -4.428 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.262 11.131 -5.912 1.00 0.00 H new ATOM 0 HD22 LEU A 62 8.834 9.670 -5.071 1.00 0.00 H new ATOM 0 HD23 LEU A 62 9.241 9.929 -6.784 1.00 0.00 H new ATOM 1027 N VAL A 63 8.611 5.217 -7.629 1.00 0.00 N ATOM 1028 CA VAL A 63 9.447 4.005 -7.461 1.00 0.00 C ATOM 1029 C VAL A 63 10.411 3.862 -8.644 1.00 0.00 C ATOM 1030 O VAL A 63 11.575 3.564 -8.463 1.00 0.00 O ATOM 1031 CB VAL A 63 8.538 2.777 -7.350 1.00 0.00 C ATOM 1032 CG1 VAL A 63 9.381 1.520 -7.497 1.00 0.00 C ATOM 1033 CG2 VAL A 63 7.840 2.767 -5.973 1.00 0.00 C ATOM 0 H VAL A 63 7.604 5.052 -7.642 1.00 0.00 H new ATOM 0 HA VAL A 63 10.039 4.091 -6.550 1.00 0.00 H new ATOM 0 HB VAL A 63 7.783 2.811 -8.135 1.00 0.00 H new ATOM 0 HG11 VAL A 63 8.741 0.641 -7.419 1.00 0.00 H new ATOM 0 HG12 VAL A 63 9.874 1.524 -8.469 1.00 0.00 H new ATOM 0 HG13 VAL A 63 10.133 1.492 -6.708 1.00 0.00 H new ATOM 0 HG21 VAL A 63 7.195 1.892 -5.899 1.00 0.00 H new ATOM 0 HG22 VAL A 63 8.592 2.732 -5.184 1.00 0.00 H new ATOM 0 HG23 VAL A 63 7.240 3.671 -5.862 1.00 0.00 H new ATOM 1043 N ILE A 64 9.963 4.091 -9.851 1.00 0.00 N ATOM 1044 CA ILE A 64 10.903 3.977 -11.004 1.00 0.00 C ATOM 1045 C ILE A 64 11.891 5.144 -10.931 1.00 0.00 C ATOM 1046 O ILE A 64 13.041 5.031 -11.307 1.00 0.00 O ATOM 1047 CB ILE A 64 10.152 4.060 -12.337 1.00 0.00 C ATOM 1048 CG1 ILE A 64 8.908 3.178 -12.307 1.00 0.00 C ATOM 1049 CG2 ILE A 64 11.071 3.563 -13.456 1.00 0.00 C ATOM 1050 CD1 ILE A 64 9.269 1.796 -11.773 1.00 0.00 C ATOM 0 H ILE A 64 9.004 4.348 -10.086 1.00 0.00 H new ATOM 0 HA ILE A 64 11.414 3.016 -10.951 1.00 0.00 H new ATOM 0 HB ILE A 64 9.855 5.095 -12.509 1.00 0.00 H new ATOM 0 HG12 ILE A 64 8.143 3.633 -11.678 1.00 0.00 H new ATOM 0 HG13 ILE A 64 8.487 3.093 -13.309 1.00 0.00 H new ATOM 0 HG21 ILE A 64 10.546 3.618 -14.410 1.00 0.00 H new ATOM 0 HG22 ILE A 64 11.964 4.186 -13.497 1.00 0.00 H new ATOM 0 HG23 ILE A 64 11.358 2.530 -13.259 1.00 0.00 H new ATOM 0 HD11 ILE A 64 8.377 1.169 -11.753 1.00 0.00 H new ATOM 0 HD12 ILE A 64 10.019 1.340 -12.420 1.00 0.00 H new ATOM 0 HD13 ILE A 64 9.669 1.889 -10.763 1.00 0.00 H new ATOM 1062 N ALA A 65 11.424 6.277 -10.480 1.00 0.00 N ATOM 1063 CA ALA A 65 12.300 7.480 -10.412 1.00 0.00 C ATOM 1064 C ALA A 65 13.552 7.192 -9.580 1.00 0.00 C ATOM 1065 O ALA A 65 14.565 7.839 -9.747 1.00 0.00 O ATOM 1066 CB ALA A 65 11.528 8.640 -9.780 1.00 0.00 C ATOM 0 H ALA A 65 10.468 6.421 -10.154 1.00 0.00 H new ATOM 0 HA ALA A 65 12.605 7.744 -11.425 1.00 0.00 H new ATOM 0 HB1 ALA A 65 12.169 9.520 -9.731 1.00 0.00 H new ATOM 0 HB2 ALA A 65 10.650 8.865 -10.385 1.00 0.00 H new ATOM 0 HB3 ALA A 65 11.214 8.363 -8.774 1.00 0.00 H new ATOM 1072 N ARG A 66 13.511 6.238 -8.688 1.00 0.00 N ATOM 1073 CA ARG A 66 14.723 5.945 -7.868 1.00 0.00 C ATOM 1074 C ARG A 66 15.531 4.821 -8.529 1.00 0.00 C ATOM 1075 O ARG A 66 16.551 4.391 -8.028 1.00 0.00 O ATOM 1076 CB ARG A 66 14.288 5.535 -6.458 1.00 0.00 C ATOM 1077 CG ARG A 66 14.196 6.777 -5.565 1.00 0.00 C ATOM 1078 CD ARG A 66 13.028 7.660 -5.995 1.00 0.00 C ATOM 1079 NE ARG A 66 13.121 8.956 -5.272 1.00 0.00 N ATOM 1080 CZ ARG A 66 12.441 9.988 -5.693 1.00 0.00 C ATOM 1081 NH1 ARG A 66 11.647 9.872 -6.722 1.00 0.00 N ATOM 1082 NH2 ARG A 66 12.554 11.137 -5.085 1.00 0.00 N ATOM 0 H ARG A 66 12.698 5.653 -8.493 1.00 0.00 H new ATOM 0 HA ARG A 66 15.352 6.833 -7.802 1.00 0.00 H new ATOM 0 HB2 ARG A 66 13.322 5.031 -6.497 1.00 0.00 H new ATOM 0 HB3 ARG A 66 15.001 4.826 -6.039 1.00 0.00 H new ATOM 0 HG2 ARG A 66 14.068 6.476 -4.525 1.00 0.00 H new ATOM 0 HG3 ARG A 66 15.126 7.342 -5.621 1.00 0.00 H new ATOM 0 HD2 ARG A 66 13.055 7.825 -7.072 1.00 0.00 H new ATOM 0 HD3 ARG A 66 12.081 7.169 -5.772 1.00 0.00 H new ATOM 0 HE ARG A 66 13.716 9.039 -4.448 1.00 0.00 H new ATOM 0 HH11 ARG A 66 11.557 8.974 -7.198 1.00 0.00 H new ATOM 0 HH12 ARG A 66 11.116 10.679 -7.050 1.00 0.00 H new ATOM 0 HH21 ARG A 66 13.174 11.229 -4.280 1.00 0.00 H new ATOM 0 HH22 ARG A 66 12.022 11.943 -5.414 1.00 0.00 H new ATOM 1096 N GLY A 67 15.096 4.383 -9.674 1.00 0.00 N ATOM 1097 CA GLY A 67 15.845 3.327 -10.414 1.00 0.00 C ATOM 1098 C GLY A 67 15.505 1.915 -9.915 1.00 0.00 C ATOM 1099 O GLY A 67 16.214 0.974 -10.215 1.00 0.00 O ATOM 0 H GLY A 67 14.248 4.712 -10.135 1.00 0.00 H new ATOM 0 HA2 GLY A 67 15.616 3.399 -11.477 1.00 0.00 H new ATOM 0 HA3 GLY A 67 16.916 3.500 -10.306 1.00 0.00 H new ATOM 1103 N GLY A 68 14.431 1.733 -9.185 1.00 0.00 N ATOM 1104 CA GLY A 68 14.083 0.348 -8.723 1.00 0.00 C ATOM 1105 C GLY A 68 13.661 0.339 -7.253 1.00 0.00 C ATOM 1106 O GLY A 68 14.278 0.957 -6.407 1.00 0.00 O ATOM 0 H GLY A 68 13.788 2.469 -8.892 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.275 -0.050 -9.337 1.00 0.00 H new ATOM 0 HA3 GLY A 68 14.941 -0.309 -8.861 1.00 0.00 H new ATOM 1110 N LEU A 69 12.595 -0.358 -6.953 1.00 0.00 N ATOM 1111 CA LEU A 69 12.086 -0.425 -5.553 1.00 0.00 C ATOM 1112 C LEU A 69 13.199 -0.848 -4.587 1.00 0.00 C ATOM 1113 O LEU A 69 13.297 -0.339 -3.488 1.00 0.00 O ATOM 1114 CB LEU A 69 10.956 -1.459 -5.494 1.00 0.00 C ATOM 1115 CG LEU A 69 10.236 -1.361 -4.145 1.00 0.00 C ATOM 1116 CD1 LEU A 69 9.319 -0.126 -4.130 1.00 0.00 C ATOM 1117 CD2 LEU A 69 9.404 -2.631 -3.917 1.00 0.00 C ATOM 0 H LEU A 69 12.049 -0.891 -7.630 1.00 0.00 H new ATOM 0 HA LEU A 69 11.727 0.561 -5.259 1.00 0.00 H new ATOM 0 HB2 LEU A 69 10.250 -1.288 -6.307 1.00 0.00 H new ATOM 0 HB3 LEU A 69 11.361 -2.462 -5.629 1.00 0.00 H new ATOM 0 HG LEU A 69 10.973 -1.264 -3.348 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.810 -0.062 -3.168 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.916 0.773 -4.285 1.00 0.00 H new ATOM 0 HD13 LEU A 69 8.580 -0.212 -4.926 1.00 0.00 H new ATOM 0 HD21 LEU A 69 8.891 -2.563 -2.958 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.669 -2.732 -4.715 1.00 0.00 H new ATOM 0 HD23 LEU A 69 10.061 -3.501 -3.916 1.00 0.00 H new ATOM 1129 N VAL A 70 14.028 -1.780 -4.970 1.00 0.00 N ATOM 1130 CA VAL A 70 15.109 -2.222 -4.044 1.00 0.00 C ATOM 1131 C VAL A 70 15.964 -1.012 -3.648 1.00 0.00 C ATOM 1132 O VAL A 70 16.321 -0.845 -2.499 1.00 0.00 O ATOM 1133 CB VAL A 70 15.972 -3.295 -4.731 1.00 0.00 C ATOM 1134 CG1 VAL A 70 17.085 -3.779 -3.780 1.00 0.00 C ATOM 1135 CG2 VAL A 70 15.078 -4.482 -5.121 1.00 0.00 C ATOM 0 H VAL A 70 14.005 -2.251 -5.875 1.00 0.00 H new ATOM 0 HA VAL A 70 14.672 -2.654 -3.144 1.00 0.00 H new ATOM 0 HB VAL A 70 16.435 -2.867 -5.620 1.00 0.00 H new ATOM 0 HG11 VAL A 70 17.687 -4.538 -4.280 1.00 0.00 H new ATOM 0 HG12 VAL A 70 17.719 -2.937 -3.504 1.00 0.00 H new ATOM 0 HG13 VAL A 70 16.637 -4.205 -2.882 1.00 0.00 H new ATOM 0 HG21 VAL A 70 15.682 -5.247 -5.609 1.00 0.00 H new ATOM 0 HG22 VAL A 70 14.617 -4.899 -4.226 1.00 0.00 H new ATOM 0 HG23 VAL A 70 14.301 -4.143 -5.805 1.00 0.00 H new ATOM 1145 N ASP A 71 16.294 -0.163 -4.583 1.00 0.00 N ATOM 1146 CA ASP A 71 17.121 1.031 -4.239 1.00 0.00 C ATOM 1147 C ASP A 71 16.409 1.854 -3.157 1.00 0.00 C ATOM 1148 O ASP A 71 17.024 2.352 -2.235 1.00 0.00 O ATOM 1149 CB ASP A 71 17.312 1.891 -5.492 1.00 0.00 C ATOM 1150 CG ASP A 71 18.153 1.123 -6.514 1.00 0.00 C ATOM 1151 OD1 ASP A 71 18.915 0.265 -6.098 1.00 0.00 O ATOM 1152 OD2 ASP A 71 18.023 1.409 -7.692 1.00 0.00 O ATOM 0 H ASP A 71 16.029 -0.243 -5.565 1.00 0.00 H new ATOM 0 HA ASP A 71 18.092 0.707 -3.866 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.343 2.147 -5.921 1.00 0.00 H new ATOM 0 HB3 ASP A 71 17.803 2.828 -5.231 1.00 0.00 H new ATOM 1157 N VAL A 72 15.116 1.990 -3.263 1.00 0.00 N ATOM 1158 CA VAL A 72 14.346 2.768 -2.247 1.00 0.00 C ATOM 1159 C VAL A 72 14.421 2.083 -0.891 1.00 0.00 C ATOM 1160 O VAL A 72 14.584 2.724 0.115 1.00 0.00 O ATOM 1161 CB VAL A 72 12.882 2.852 -2.688 1.00 0.00 C ATOM 1162 CG1 VAL A 72 12.045 3.524 -1.596 1.00 0.00 C ATOM 1163 CG2 VAL A 72 12.770 3.649 -3.997 1.00 0.00 C ATOM 0 H VAL A 72 14.554 1.593 -4.016 1.00 0.00 H new ATOM 0 HA VAL A 72 14.773 3.768 -2.163 1.00 0.00 H new ATOM 0 HB VAL A 72 12.506 1.843 -2.855 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.005 3.580 -1.917 1.00 0.00 H new ATOM 0 HG12 VAL A 72 12.110 2.941 -0.677 1.00 0.00 H new ATOM 0 HG13 VAL A 72 12.423 4.530 -1.415 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.725 3.703 -4.302 1.00 0.00 H new ATOM 0 HG22 VAL A 72 13.156 4.657 -3.843 1.00 0.00 H new ATOM 0 HG23 VAL A 72 13.350 3.153 -4.775 1.00 0.00 H new ATOM 1173 N ILE A 73 14.282 0.795 -0.844 1.00 0.00 N ATOM 1174 CA ILE A 73 14.329 0.107 0.473 1.00 0.00 C ATOM 1175 C ILE A 73 15.731 0.224 1.084 1.00 0.00 C ATOM 1176 O ILE A 73 15.895 0.684 2.197 1.00 0.00 O ATOM 1177 CB ILE A 73 13.966 -1.364 0.279 1.00 0.00 C ATOM 1178 CG1 ILE A 73 12.610 -1.450 -0.425 1.00 0.00 C ATOM 1179 CG2 ILE A 73 13.875 -2.057 1.642 1.00 0.00 C ATOM 1180 CD1 ILE A 73 12.280 -2.910 -0.728 1.00 0.00 C ATOM 0 H ILE A 73 14.139 0.189 -1.652 1.00 0.00 H new ATOM 0 HA ILE A 73 13.617 0.575 1.152 1.00 0.00 H new ATOM 0 HB ILE A 73 14.731 -1.855 -0.323 1.00 0.00 H new ATOM 0 HG12 ILE A 73 11.834 -1.015 0.205 1.00 0.00 H new ATOM 0 HG13 ILE A 73 12.632 -0.872 -1.349 1.00 0.00 H new ATOM 0 HG21 ILE A 73 13.616 -3.106 1.500 1.00 0.00 H new ATOM 0 HG22 ILE A 73 14.836 -1.986 2.151 1.00 0.00 H new ATOM 0 HG23 ILE A 73 13.108 -1.572 2.246 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.314 -2.968 -1.229 1.00 0.00 H new ATOM 0 HD12 ILE A 73 13.050 -3.330 -1.375 1.00 0.00 H new ATOM 0 HD13 ILE A 73 12.240 -3.475 0.203 1.00 0.00 H new ATOM 1192 N ASN A 74 16.741 -0.196 0.371 1.00 0.00 N ATOM 1193 CA ASN A 74 18.123 -0.120 0.910 1.00 0.00 C ATOM 1194 C ASN A 74 18.469 1.318 1.274 1.00 0.00 C ATOM 1195 O ASN A 74 19.061 1.581 2.302 1.00 0.00 O ATOM 1196 CB ASN A 74 19.104 -0.622 -0.152 1.00 0.00 C ATOM 1197 CG ASN A 74 18.850 -2.104 -0.424 1.00 0.00 C ATOM 1198 OD1 ASN A 74 18.318 -2.806 0.413 1.00 0.00 O ATOM 1199 ND2 ASN A 74 19.206 -2.615 -1.571 1.00 0.00 N ATOM 0 H ASN A 74 16.664 -0.590 -0.567 1.00 0.00 H new ATOM 0 HA ASN A 74 18.191 -0.738 1.805 1.00 0.00 H new ATOM 0 HB2 ASN A 74 18.986 -0.048 -1.071 1.00 0.00 H new ATOM 0 HB3 ASN A 74 20.129 -0.475 0.187 1.00 0.00 H new ATOM 0 HD21 ASN A 74 19.037 -3.602 -1.764 1.00 0.00 H new ATOM 0 HD22 ASN A 74 19.653 -2.027 -2.275 1.00 0.00 H new ATOM 1206 N LYS A 75 18.106 2.257 0.444 1.00 0.00 N ATOM 1207 CA LYS A 75 18.419 3.673 0.754 1.00 0.00 C ATOM 1208 C LYS A 75 17.246 4.339 1.478 1.00 0.00 C ATOM 1209 O LYS A 75 17.345 5.458 1.941 1.00 0.00 O ATOM 1210 CB LYS A 75 18.702 4.403 -0.548 1.00 0.00 C ATOM 1211 CG LYS A 75 19.894 3.732 -1.245 1.00 0.00 C ATOM 1212 CD LYS A 75 19.791 3.940 -2.752 1.00 0.00 C ATOM 1213 CE LYS A 75 20.052 5.410 -3.080 1.00 0.00 C ATOM 1214 NZ LYS A 75 19.698 5.677 -4.502 1.00 0.00 N ATOM 0 H LYS A 75 17.608 2.102 -0.432 1.00 0.00 H new ATOM 0 HA LYS A 75 19.290 3.716 1.407 1.00 0.00 H new ATOM 0 HB2 LYS A 75 17.824 4.377 -1.194 1.00 0.00 H new ATOM 0 HB3 LYS A 75 18.922 5.452 -0.352 1.00 0.00 H new ATOM 0 HG2 LYS A 75 20.829 4.152 -0.873 1.00 0.00 H new ATOM 0 HG3 LYS A 75 19.909 2.667 -1.015 1.00 0.00 H new ATOM 0 HD2 LYS A 75 20.513 3.307 -3.268 1.00 0.00 H new ATOM 0 HD3 LYS A 75 18.802 3.647 -3.104 1.00 0.00 H new ATOM 0 HE2 LYS A 75 19.463 6.050 -2.422 1.00 0.00 H new ATOM 0 HE3 LYS A 75 21.100 5.651 -2.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 19.564 6.699 -4.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 20.465 5.341 -5.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 18.818 5.177 -4.740 1.00 0.00 H new ATOM 1228 N LYS A 76 16.128 3.674 1.543 1.00 0.00 N ATOM 1229 CA LYS A 76 14.928 4.272 2.198 1.00 0.00 C ATOM 1230 C LYS A 76 14.556 5.577 1.504 1.00 0.00 C ATOM 1231 O LYS A 76 14.520 6.626 2.116 1.00 0.00 O ATOM 1232 CB LYS A 76 15.179 4.550 3.685 1.00 0.00 C ATOM 1233 CG LYS A 76 14.925 3.290 4.522 1.00 0.00 C ATOM 1234 CD LYS A 76 14.645 3.697 5.971 1.00 0.00 C ATOM 1235 CE LYS A 76 15.940 4.179 6.629 1.00 0.00 C ATOM 1236 NZ LYS A 76 16.947 3.081 6.605 1.00 0.00 N ATOM 0 H LYS A 76 15.991 2.735 1.169 1.00 0.00 H new ATOM 0 HA LYS A 76 14.112 3.554 2.113 1.00 0.00 H new ATOM 0 HB2 LYS A 76 16.205 4.887 3.829 1.00 0.00 H new ATOM 0 HB3 LYS A 76 14.528 5.356 4.025 1.00 0.00 H new ATOM 0 HG2 LYS A 76 14.079 2.735 4.118 1.00 0.00 H new ATOM 0 HG3 LYS A 76 15.791 2.629 4.478 1.00 0.00 H new ATOM 0 HD2 LYS A 76 13.895 4.488 5.999 1.00 0.00 H new ATOM 0 HD3 LYS A 76 14.237 2.851 6.524 1.00 0.00 H new ATOM 0 HE2 LYS A 76 16.325 5.052 6.102 1.00 0.00 H new ATOM 0 HE3 LYS A 76 15.746 4.487 7.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 17.456 3.057 7.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 16.465 2.172 6.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 17.623 3.247 5.832 1.00 0.00 H new ATOM 1250 N LEU A 77 14.255 5.525 0.241 1.00 0.00 N ATOM 1251 CA LEU A 77 13.862 6.769 -0.464 1.00 0.00 C ATOM 1252 C LEU A 77 12.345 6.911 -0.368 1.00 0.00 C ATOM 1253 O LEU A 77 11.736 7.701 -1.062 1.00 0.00 O ATOM 1254 CB LEU A 77 14.320 6.698 -1.924 1.00 0.00 C ATOM 1255 CG LEU A 77 15.858 6.630 -1.953 1.00 0.00 C ATOM 1256 CD1 LEU A 77 16.365 5.986 -3.254 1.00 0.00 C ATOM 1257 CD2 LEU A 77 16.432 8.048 -1.838 1.00 0.00 C ATOM 0 H LEU A 77 14.264 4.680 -0.330 1.00 0.00 H new ATOM 0 HA LEU A 77 14.334 7.639 -0.008 1.00 0.00 H new ATOM 0 HB2 LEU A 77 13.893 5.822 -2.412 1.00 0.00 H new ATOM 0 HB3 LEU A 77 13.969 7.572 -2.473 1.00 0.00 H new ATOM 0 HG LEU A 77 16.187 6.017 -1.114 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.454 5.953 -3.243 1.00 0.00 H new ATOM 0 HD12 LEU A 77 15.972 4.973 -3.336 1.00 0.00 H new ATOM 0 HD13 LEU A 77 16.028 6.575 -4.107 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.521 8.003 -1.858 1.00 0.00 H new ATOM 0 HD22 LEU A 77 16.078 8.652 -2.673 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.105 8.498 -0.901 1.00 0.00 H new ATOM 1269 N TRP A 78 11.732 6.158 0.515 1.00 0.00 N ATOM 1270 CA TRP A 78 10.257 6.266 0.681 1.00 0.00 C ATOM 1271 C TRP A 78 9.924 7.682 1.119 1.00 0.00 C ATOM 1272 O TRP A 78 8.973 8.270 0.658 1.00 0.00 O ATOM 1273 CB TRP A 78 9.756 5.300 1.755 1.00 0.00 C ATOM 1274 CG TRP A 78 9.931 3.892 1.297 1.00 0.00 C ATOM 1275 CD1 TRP A 78 10.870 3.039 1.758 1.00 0.00 C ATOM 1276 CD2 TRP A 78 9.161 3.157 0.305 1.00 0.00 C ATOM 1277 NE1 TRP A 78 10.722 1.823 1.122 1.00 0.00 N ATOM 1278 CE2 TRP A 78 9.682 1.845 0.215 1.00 0.00 C ATOM 1279 CE3 TRP A 78 8.068 3.495 -0.518 1.00 0.00 C ATOM 1280 CZ2 TRP A 78 9.141 0.902 -0.655 1.00 0.00 C ATOM 1281 CZ3 TRP A 78 7.527 2.545 -1.394 1.00 0.00 C ATOM 1282 CH2 TRP A 78 8.060 1.257 -1.462 1.00 0.00 C ATOM 0 H TRP A 78 12.191 5.479 1.122 1.00 0.00 H new ATOM 0 HA TRP A 78 9.778 6.020 -0.267 1.00 0.00 H new ATOM 0 HB2 TRP A 78 10.304 5.460 2.684 1.00 0.00 H new ATOM 0 HB3 TRP A 78 8.705 5.494 1.968 1.00 0.00 H new ATOM 0 HD1 TRP A 78 11.616 3.270 2.504 1.00 0.00 H new ATOM 0 HE1 TRP A 78 11.309 1.008 1.300 1.00 0.00 H new ATOM 0 HE3 TRP A 78 7.647 4.488 -0.473 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 9.554 -0.095 -0.705 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 6.690 2.812 -2.022 1.00 0.00 H new ATOM 0 HH2 TRP A 78 7.634 0.533 -2.141 1.00 0.00 H new ATOM 1293 N GLN A 79 10.701 8.255 2.000 1.00 0.00 N ATOM 1294 CA GLN A 79 10.393 9.640 2.437 1.00 0.00 C ATOM 1295 C GLN A 79 10.118 10.492 1.202 1.00 0.00 C ATOM 1296 O GLN A 79 9.213 11.301 1.185 1.00 0.00 O ATOM 1297 CB GLN A 79 11.595 10.193 3.199 1.00 0.00 C ATOM 1298 CG GLN A 79 11.834 9.320 4.428 1.00 0.00 C ATOM 1299 CD GLN A 79 13.110 9.761 5.139 1.00 0.00 C ATOM 1300 OE1 GLN A 79 13.718 10.749 4.778 1.00 0.00 O ATOM 1301 NE2 GLN A 79 13.548 9.051 6.138 1.00 0.00 N ATOM 0 H GLN A 79 11.523 7.828 2.428 1.00 0.00 H new ATOM 0 HA GLN A 79 9.518 9.653 3.087 1.00 0.00 H new ATOM 0 HB2 GLN A 79 12.478 10.198 2.561 1.00 0.00 H new ATOM 0 HB3 GLN A 79 11.412 11.225 3.498 1.00 0.00 H new ATOM 0 HG2 GLN A 79 10.985 9.393 5.108 1.00 0.00 H new ATOM 0 HG3 GLN A 79 11.916 8.274 4.132 1.00 0.00 H new ATOM 0 HE21 GLN A 79 13.035 8.222 6.438 1.00 0.00 H new ATOM 0 HE22 GLN A 79 14.404 9.323 6.621 1.00 0.00 H new ATOM 1310 N GLU A 80 10.869 10.297 0.153 1.00 0.00 N ATOM 1311 CA GLU A 80 10.613 11.079 -1.084 1.00 0.00 C ATOM 1312 C GLU A 80 9.278 10.620 -1.670 1.00 0.00 C ATOM 1313 O GLU A 80 8.469 11.417 -2.102 1.00 0.00 O ATOM 1314 CB GLU A 80 11.736 10.833 -2.092 1.00 0.00 C ATOM 1315 CG GLU A 80 13.034 11.451 -1.573 1.00 0.00 C ATOM 1316 CD GLU A 80 12.872 12.969 -1.464 1.00 0.00 C ATOM 1317 OE1 GLU A 80 11.949 13.491 -2.069 1.00 0.00 O ATOM 1318 OE2 GLU A 80 13.673 13.583 -0.779 1.00 0.00 O ATOM 0 H GLU A 80 11.643 9.635 0.101 1.00 0.00 H new ATOM 0 HA GLU A 80 10.577 12.145 -0.857 1.00 0.00 H new ATOM 0 HB2 GLU A 80 11.869 9.763 -2.250 1.00 0.00 H new ATOM 0 HB3 GLU A 80 11.474 11.268 -3.057 1.00 0.00 H new ATOM 0 HG2 GLU A 80 13.285 11.031 -0.599 1.00 0.00 H new ATOM 0 HG3 GLU A 80 13.858 11.210 -2.245 1.00 0.00 H new ATOM 1325 N ILE A 81 9.036 9.337 -1.662 1.00 0.00 N ATOM 1326 CA ILE A 81 7.745 8.814 -2.190 1.00 0.00 C ATOM 1327 C ILE A 81 6.623 9.229 -1.233 1.00 0.00 C ATOM 1328 O ILE A 81 5.632 9.805 -1.626 1.00 0.00 O ATOM 1329 CB ILE A 81 7.800 7.286 -2.252 1.00 0.00 C ATOM 1330 CG1 ILE A 81 9.056 6.857 -3.019 1.00 0.00 C ATOM 1331 CG2 ILE A 81 6.544 6.751 -2.953 1.00 0.00 C ATOM 1332 CD1 ILE A 81 8.905 5.414 -3.512 1.00 0.00 C ATOM 0 H ILE A 81 9.679 8.627 -1.311 1.00 0.00 H new ATOM 0 HA ILE A 81 7.564 9.214 -3.188 1.00 0.00 H new ATOM 0 HB ILE A 81 7.839 6.878 -1.242 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.220 7.524 -3.866 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.931 6.940 -2.374 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.587 5.663 -2.995 1.00 0.00 H new ATOM 0 HG22 ILE A 81 5.658 7.058 -2.397 1.00 0.00 H new ATOM 0 HG23 ILE A 81 6.494 7.152 -3.965 1.00 0.00 H new ATOM 0 HD11 ILE A 81 9.803 5.119 -4.056 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.763 4.751 -2.659 1.00 0.00 H new ATOM 0 HD13 ILE A 81 8.041 5.344 -4.173 1.00 0.00 H new ATOM 1344 N ILE A 82 6.785 8.927 0.029 1.00 0.00 N ATOM 1345 CA ILE A 82 5.749 9.281 1.037 1.00 0.00 C ATOM 1346 C ILE A 82 5.444 10.778 0.950 1.00 0.00 C ATOM 1347 O ILE A 82 4.312 11.184 0.778 1.00 0.00 O ATOM 1348 CB ILE A 82 6.292 8.955 2.436 1.00 0.00 C ATOM 1349 CG1 ILE A 82 6.695 7.479 2.503 1.00 0.00 C ATOM 1350 CG2 ILE A 82 5.211 9.223 3.490 1.00 0.00 C ATOM 1351 CD1 ILE A 82 7.624 7.252 3.702 1.00 0.00 C ATOM 0 H ILE A 82 7.601 8.445 0.406 1.00 0.00 H new ATOM 0 HA ILE A 82 4.837 8.715 0.847 1.00 0.00 H new ATOM 0 HB ILE A 82 7.160 9.584 2.632 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.807 6.853 2.595 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.197 7.187 1.581 1.00 0.00 H new ATOM 0 HG21 ILE A 82 5.602 8.990 4.480 1.00 0.00 H new ATOM 0 HG22 ILE A 82 4.919 10.273 3.453 1.00 0.00 H new ATOM 0 HG23 ILE A 82 4.342 8.597 3.287 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.909 6.201 3.747 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.518 7.866 3.591 1.00 0.00 H new ATOM 0 HD13 ILE A 82 7.106 7.527 4.621 1.00 0.00 H new ATOM 1363 N LYS A 83 6.449 11.601 1.070 1.00 0.00 N ATOM 1364 CA LYS A 83 6.226 13.071 0.995 1.00 0.00 C ATOM 1365 C LYS A 83 5.819 13.464 -0.429 1.00 0.00 C ATOM 1366 O LYS A 83 4.936 14.274 -0.631 1.00 0.00 O ATOM 1367 CB LYS A 83 7.520 13.792 1.377 1.00 0.00 C ATOM 1368 CG LYS A 83 7.898 13.430 2.815 1.00 0.00 C ATOM 1369 CD LYS A 83 9.156 14.199 3.225 1.00 0.00 C ATOM 1370 CE LYS A 83 9.633 13.717 4.599 1.00 0.00 C ATOM 1371 NZ LYS A 83 11.104 13.924 4.712 1.00 0.00 N ATOM 0 H LYS A 83 7.418 11.317 1.217 1.00 0.00 H new ATOM 0 HA LYS A 83 5.429 13.355 1.682 1.00 0.00 H new ATOM 0 HB2 LYS A 83 8.322 13.508 0.696 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.390 14.870 1.284 1.00 0.00 H new ATOM 0 HG2 LYS A 83 7.076 13.671 3.489 1.00 0.00 H new ATOM 0 HG3 LYS A 83 8.073 12.357 2.897 1.00 0.00 H new ATOM 0 HD2 LYS A 83 9.942 14.051 2.484 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.946 15.268 3.257 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.116 14.263 5.388 1.00 0.00 H new ATOM 0 HE3 LYS A 83 9.392 12.662 4.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 11.430 13.597 5.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.589 13.384 3.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 11.322 14.935 4.604 1.00 0.00 H new ATOM 1385 N GLY A 84 6.463 12.902 -1.418 1.00 0.00 N ATOM 1386 CA GLY A 84 6.120 13.250 -2.828 1.00 0.00 C ATOM 1387 C GLY A 84 4.614 13.110 -3.032 1.00 0.00 C ATOM 1388 O GLY A 84 4.010 13.820 -3.811 1.00 0.00 O ATOM 0 H GLY A 84 7.211 12.217 -1.310 1.00 0.00 H new ATOM 0 HA2 GLY A 84 6.435 14.270 -3.050 1.00 0.00 H new ATOM 0 HA3 GLY A 84 6.654 12.595 -3.516 1.00 0.00 H new ATOM 1392 N LEU A 85 4.004 12.203 -2.327 1.00 0.00 N ATOM 1393 CA LEU A 85 2.536 12.012 -2.460 1.00 0.00 C ATOM 1394 C LEU A 85 1.824 12.892 -1.434 1.00 0.00 C ATOM 1395 O LEU A 85 0.615 13.012 -1.434 1.00 0.00 O ATOM 1396 CB LEU A 85 2.211 10.547 -2.202 1.00 0.00 C ATOM 1397 CG LEU A 85 2.970 9.681 -3.214 1.00 0.00 C ATOM 1398 CD1 LEU A 85 2.821 8.203 -2.849 1.00 0.00 C ATOM 1399 CD2 LEU A 85 2.405 9.916 -4.619 1.00 0.00 C ATOM 0 H LEU A 85 4.462 11.582 -1.660 1.00 0.00 H new ATOM 0 HA LEU A 85 2.205 12.289 -3.461 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.493 10.272 -1.186 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.138 10.378 -2.292 1.00 0.00 H new ATOM 0 HG LEU A 85 4.025 9.953 -3.194 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.363 7.593 -3.572 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.228 8.031 -1.852 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.766 7.930 -2.862 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.946 9.299 -5.337 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.348 9.649 -4.636 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.518 10.967 -4.886 1.00 0.00 H new ATOM 1411 N HIS A 86 2.577 13.505 -0.561 1.00 0.00 N ATOM 1412 CA HIS A 86 1.979 14.391 0.479 1.00 0.00 C ATOM 1413 C HIS A 86 1.065 13.580 1.399 1.00 0.00 C ATOM 1414 O HIS A 86 0.002 14.026 1.780 1.00 0.00 O ATOM 1415 CB HIS A 86 1.178 15.512 -0.186 1.00 0.00 C ATOM 1416 CG HIS A 86 2.016 16.167 -1.250 1.00 0.00 C ATOM 1417 ND1 HIS A 86 2.999 17.098 -0.946 1.00 0.00 N ATOM 1418 CD2 HIS A 86 2.031 16.040 -2.616 1.00 0.00 C ATOM 1419 CE1 HIS A 86 3.559 17.489 -2.106 1.00 0.00 C ATOM 1420 NE2 HIS A 86 3.006 16.875 -3.155 1.00 0.00 N ATOM 0 H HIS A 86 3.593 13.429 -0.524 1.00 0.00 H new ATOM 0 HA HIS A 86 2.783 14.828 1.071 1.00 0.00 H new ATOM 0 HB2 HIS A 86 0.265 15.110 -0.624 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.877 16.249 0.559 1.00 0.00 H new ATOM 0 HD2 HIS A 86 1.384 15.390 -3.187 1.00 0.00 H new ATOM 0 HE1 HIS A 86 4.358 18.211 -2.179 1.00 0.00 H new ATOM 0 HE2 HIS A 86 3.246 16.992 -4.139 1.00 0.00 H new ATOM 1428 N LEU A 87 1.485 12.406 1.787 1.00 0.00 N ATOM 1429 CA LEU A 87 0.649 11.596 2.714 1.00 0.00 C ATOM 1430 C LEU A 87 0.704 12.249 4.103 1.00 0.00 C ATOM 1431 O LEU A 87 1.756 12.670 4.541 1.00 0.00 O ATOM 1432 CB LEU A 87 1.193 10.165 2.787 1.00 0.00 C ATOM 1433 CG LEU A 87 0.757 9.389 1.539 1.00 0.00 C ATOM 1434 CD1 LEU A 87 1.753 8.261 1.264 1.00 0.00 C ATOM 1435 CD2 LEU A 87 -0.635 8.791 1.767 1.00 0.00 C ATOM 0 H LEU A 87 2.366 11.976 1.503 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.381 11.557 2.358 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.281 10.181 2.857 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.823 9.669 3.684 1.00 0.00 H new ATOM 0 HG LEU A 87 0.728 10.066 0.685 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.442 7.710 0.377 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.745 8.683 1.100 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.783 7.585 2.119 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.944 8.240 0.879 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.605 8.115 2.622 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.348 9.592 1.963 1.00 0.00 H new ATOM 1447 N PRO A 88 -0.403 12.344 4.797 1.00 0.00 N ATOM 1448 CA PRO A 88 -0.433 12.969 6.152 1.00 0.00 C ATOM 1449 C PRO A 88 0.342 12.147 7.188 1.00 0.00 C ATOM 1450 O PRO A 88 0.313 10.933 7.181 1.00 0.00 O ATOM 1451 CB PRO A 88 -1.923 13.027 6.507 1.00 0.00 C ATOM 1452 CG PRO A 88 -2.581 11.998 5.649 1.00 0.00 C ATOM 1453 CD PRO A 88 -1.735 11.873 4.383 1.00 0.00 C ATOM 0 HA PRO A 88 0.044 13.949 6.152 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -2.082 12.816 7.564 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -2.333 14.018 6.315 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -2.642 11.042 6.169 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -3.601 12.293 5.405 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -1.701 10.844 4.026 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -2.138 12.479 3.572 1.00 0.00 H new ATOM 1461 N SER A 89 1.038 12.802 8.078 1.00 0.00 N ATOM 1462 CA SER A 89 1.820 12.069 9.116 1.00 0.00 C ATOM 1463 C SER A 89 0.899 11.126 9.897 1.00 0.00 C ATOM 1464 O SER A 89 1.317 10.463 10.825 1.00 0.00 O ATOM 1465 CB SER A 89 2.454 13.073 10.079 1.00 0.00 C ATOM 1466 OG SER A 89 3.533 13.732 9.429 1.00 0.00 O ATOM 0 H SER A 89 1.099 13.819 8.131 1.00 0.00 H new ATOM 0 HA SER A 89 2.600 11.484 8.629 1.00 0.00 H new ATOM 0 HB2 SER A 89 1.711 13.801 10.404 1.00 0.00 H new ATOM 0 HB3 SER A 89 2.811 12.561 10.973 1.00 0.00 H new ATOM 0 HG SER A 89 3.940 14.378 10.044 1.00 0.00 H new ATOM 1472 N SER A 90 -0.357 11.080 9.548 1.00 0.00 N ATOM 1473 CA SER A 90 -1.301 10.201 10.294 1.00 0.00 C ATOM 1474 C SER A 90 -0.924 8.732 10.077 1.00 0.00 C ATOM 1475 O SER A 90 -1.206 7.889 10.904 1.00 0.00 O ATOM 1476 CB SER A 90 -2.723 10.440 9.791 1.00 0.00 C ATOM 1477 OG SER A 90 -2.836 9.962 8.457 1.00 0.00 O ATOM 0 H SER A 90 -0.770 11.611 8.781 1.00 0.00 H new ATOM 0 HA SER A 90 -1.245 10.434 11.357 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.439 9.929 10.434 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.961 11.503 9.830 1.00 0.00 H new ATOM 0 HG SER A 90 -3.748 10.112 8.132 1.00 0.00 H new ATOM 1483 N ILE A 91 -0.274 8.417 8.987 1.00 0.00 N ATOM 1484 CA ILE A 91 0.131 6.997 8.757 1.00 0.00 C ATOM 1485 C ILE A 91 1.608 6.831 9.115 1.00 0.00 C ATOM 1486 O ILE A 91 2.486 7.220 8.369 1.00 0.00 O ATOM 1487 CB ILE A 91 -0.083 6.621 7.287 1.00 0.00 C ATOM 1488 CG1 ILE A 91 -1.567 6.793 6.934 1.00 0.00 C ATOM 1489 CG2 ILE A 91 0.338 5.165 7.068 1.00 0.00 C ATOM 1490 CD1 ILE A 91 -1.801 6.501 5.445 1.00 0.00 C ATOM 0 H ILE A 91 -0.008 9.073 8.253 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.477 6.344 9.383 1.00 0.00 H new ATOM 0 HB ILE A 91 0.519 7.268 6.648 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -2.172 6.121 7.542 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.887 7.809 7.167 1.00 0.00 H new ATOM 0 HG21 ILE A 91 0.186 4.896 6.023 1.00 0.00 H new ATOM 0 HG22 ILE A 91 1.391 5.048 7.324 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -0.264 4.513 7.701 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -2.858 6.627 5.211 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -1.211 7.191 4.842 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -1.500 5.477 5.223 1.00 0.00 H new ATOM 1502 N THR A 92 1.893 6.248 10.249 1.00 0.00 N ATOM 1503 CA THR A 92 3.316 6.051 10.646 1.00 0.00 C ATOM 1504 C THR A 92 3.898 4.878 9.860 1.00 0.00 C ATOM 1505 O THR A 92 5.094 4.769 9.673 1.00 0.00 O ATOM 1506 CB THR A 92 3.392 5.752 12.146 1.00 0.00 C ATOM 1507 OG1 THR A 92 2.699 4.544 12.421 1.00 0.00 O ATOM 1508 CG2 THR A 92 2.757 6.900 12.935 1.00 0.00 C ATOM 0 H THR A 92 1.203 5.901 10.915 1.00 0.00 H new ATOM 0 HA THR A 92 3.886 6.955 10.430 1.00 0.00 H new ATOM 0 HB THR A 92 4.436 5.649 12.442 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.748 4.350 13.380 1.00 0.00 H new ATOM 0 HG21 THR A 92 2.813 6.683 14.002 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.292 7.826 12.724 1.00 0.00 H new ATOM 0 HG23 THR A 92 1.713 7.009 12.642 1.00 0.00 H new ATOM 1516 N SER A 93 3.054 3.999 9.396 1.00 0.00 N ATOM 1517 CA SER A 93 3.537 2.827 8.614 1.00 0.00 C ATOM 1518 C SER A 93 3.335 3.103 7.125 1.00 0.00 C ATOM 1519 O SER A 93 2.959 2.231 6.368 1.00 0.00 O ATOM 1520 CB SER A 93 2.740 1.585 9.015 1.00 0.00 C ATOM 1521 OG SER A 93 3.098 1.203 10.337 1.00 0.00 O ATOM 0 H SER A 93 2.043 4.043 9.526 1.00 0.00 H new ATOM 0 HA SER A 93 4.595 2.659 8.817 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.671 1.792 8.961 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.943 0.769 8.321 1.00 0.00 H new ATOM 0 HG SER A 93 2.587 0.408 10.597 1.00 0.00 H new ATOM 1527 N ALA A 94 3.575 4.312 6.700 1.00 0.00 N ATOM 1528 CA ALA A 94 3.389 4.642 5.259 1.00 0.00 C ATOM 1529 C ALA A 94 4.389 3.841 4.424 1.00 0.00 C ATOM 1530 O ALA A 94 4.016 3.018 3.611 1.00 0.00 O ATOM 1531 CB ALA A 94 3.628 6.138 5.047 1.00 0.00 C ATOM 0 H ALA A 94 3.891 5.084 7.286 1.00 0.00 H new ATOM 0 HA ALA A 94 2.374 4.389 4.952 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.493 6.382 3.993 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.918 6.708 5.646 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.644 6.391 5.350 1.00 0.00 H new ATOM 1537 N ALA A 95 5.659 4.082 4.609 1.00 0.00 N ATOM 1538 CA ALA A 95 6.683 3.340 3.814 1.00 0.00 C ATOM 1539 C ALA A 95 6.342 1.842 3.804 1.00 0.00 C ATOM 1540 O ALA A 95 6.282 1.224 2.760 1.00 0.00 O ATOM 1541 CB ALA A 95 8.067 3.556 4.445 1.00 0.00 C ATOM 0 H ALA A 95 6.032 4.759 5.274 1.00 0.00 H new ATOM 0 HA ALA A 95 6.690 3.710 2.789 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.818 3.016 3.868 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.305 4.620 4.445 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.061 3.185 5.470 1.00 0.00 H new ATOM 1547 N LEU A 96 6.120 1.248 4.946 1.00 0.00 N ATOM 1548 CA LEU A 96 5.788 -0.205 4.959 1.00 0.00 C ATOM 1549 C LEU A 96 4.527 -0.431 4.131 1.00 0.00 C ATOM 1550 O LEU A 96 4.450 -1.355 3.343 1.00 0.00 O ATOM 1551 CB LEU A 96 5.529 -0.661 6.397 1.00 0.00 C ATOM 1552 CG LEU A 96 5.200 -2.166 6.434 1.00 0.00 C ATOM 1553 CD1 LEU A 96 6.478 -2.986 6.608 1.00 0.00 C ATOM 1554 CD2 LEU A 96 4.274 -2.442 7.610 1.00 0.00 C ATOM 0 H LEU A 96 6.154 1.700 5.860 1.00 0.00 H new ATOM 0 HA LEU A 96 6.619 -0.773 4.542 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.406 -0.459 7.012 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.703 -0.091 6.822 1.00 0.00 H new ATOM 0 HG LEU A 96 4.720 -2.447 5.497 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.229 -4.047 6.632 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.152 -2.790 5.774 1.00 0.00 H new ATOM 0 HD13 LEU A 96 6.965 -2.706 7.542 1.00 0.00 H new ATOM 0 HD21 LEU A 96 4.036 -3.505 7.644 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.767 -2.151 8.537 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.355 -1.868 7.492 1.00 0.00 H new ATOM 1566 N THR A 97 3.539 0.407 4.282 1.00 0.00 N ATOM 1567 CA THR A 97 2.302 0.234 3.483 1.00 0.00 C ATOM 1568 C THR A 97 2.660 0.345 2.006 1.00 0.00 C ATOM 1569 O THR A 97 2.175 -0.398 1.177 1.00 0.00 O ATOM 1570 CB THR A 97 1.308 1.336 3.865 1.00 0.00 C ATOM 1571 OG1 THR A 97 0.939 1.186 5.229 1.00 0.00 O ATOM 1572 CG2 THR A 97 0.064 1.252 2.980 1.00 0.00 C ATOM 0 H THR A 97 3.538 1.201 4.923 1.00 0.00 H new ATOM 0 HA THR A 97 1.851 -0.739 3.677 1.00 0.00 H new ATOM 0 HB THR A 97 1.778 2.309 3.719 1.00 0.00 H new ATOM 0 HG1 THR A 97 1.396 1.865 5.768 1.00 0.00 H new ATOM 0 HG21 THR A 97 -0.636 2.040 3.260 1.00 0.00 H new ATOM 0 HG22 THR A 97 0.351 1.376 1.936 1.00 0.00 H new ATOM 0 HG23 THR A 97 -0.412 0.280 3.112 1.00 0.00 H new ATOM 1580 N LEU A 98 3.511 1.270 1.674 1.00 0.00 N ATOM 1581 CA LEU A 98 3.913 1.442 0.265 1.00 0.00 C ATOM 1582 C LEU A 98 4.784 0.259 -0.176 1.00 0.00 C ATOM 1583 O LEU A 98 4.616 -0.280 -1.250 1.00 0.00 O ATOM 1584 CB LEU A 98 4.716 2.735 0.164 1.00 0.00 C ATOM 1585 CG LEU A 98 3.840 3.931 0.552 1.00 0.00 C ATOM 1586 CD1 LEU A 98 4.715 5.042 1.137 1.00 0.00 C ATOM 1587 CD2 LEU A 98 3.146 4.466 -0.698 1.00 0.00 C ATOM 0 H LEU A 98 3.947 1.919 2.329 1.00 0.00 H new ATOM 0 HA LEU A 98 3.034 1.485 -0.378 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.586 2.684 0.819 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.089 2.862 -0.852 1.00 0.00 H new ATOM 0 HG LEU A 98 3.103 3.614 1.290 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.089 5.891 1.412 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.232 4.670 2.022 1.00 0.00 H new ATOM 0 HD13 LEU A 98 5.448 5.357 0.394 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.520 5.318 -0.431 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.896 4.780 -1.424 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.526 3.683 -1.133 1.00 0.00 H new ATOM 1599 N ARG A 99 5.717 -0.143 0.647 1.00 0.00 N ATOM 1600 CA ARG A 99 6.615 -1.285 0.287 1.00 0.00 C ATOM 1601 C ARG A 99 5.834 -2.590 0.218 1.00 0.00 C ATOM 1602 O ARG A 99 5.890 -3.305 -0.759 1.00 0.00 O ATOM 1603 CB ARG A 99 7.691 -1.413 1.365 1.00 0.00 C ATOM 1604 CG ARG A 99 8.718 -2.490 0.973 1.00 0.00 C ATOM 1605 CD ARG A 99 9.192 -3.210 2.230 1.00 0.00 C ATOM 1606 NE ARG A 99 9.236 -2.227 3.355 1.00 0.00 N ATOM 1607 CZ ARG A 99 9.933 -1.132 3.263 1.00 0.00 C ATOM 1608 NH1 ARG A 99 10.744 -0.958 2.259 1.00 0.00 N ATOM 1609 NH2 ARG A 99 9.852 -0.226 4.199 1.00 0.00 N ATOM 0 H ARG A 99 5.898 0.273 1.561 1.00 0.00 H new ATOM 0 HA ARG A 99 7.059 -1.092 -0.690 1.00 0.00 H new ATOM 0 HB2 ARG A 99 8.193 -0.455 1.502 1.00 0.00 H new ATOM 0 HB3 ARG A 99 7.230 -1.671 2.319 1.00 0.00 H new ATOM 0 HG2 ARG A 99 8.270 -3.201 0.279 1.00 0.00 H new ATOM 0 HG3 ARG A 99 9.564 -2.033 0.460 1.00 0.00 H new ATOM 0 HD2 ARG A 99 8.518 -4.032 2.472 1.00 0.00 H new ATOM 0 HD3 ARG A 99 10.179 -3.644 2.068 1.00 0.00 H new ATOM 0 HE ARG A 99 8.711 -2.418 4.209 1.00 0.00 H new ATOM 0 HH11 ARG A 99 10.833 -1.680 1.544 1.00 0.00 H new ATOM 0 HH12 ARG A 99 11.290 -0.099 2.187 1.00 0.00 H new ATOM 0 HH21 ARG A 99 9.242 -0.376 5.003 1.00 0.00 H new ATOM 0 HH22 ARG A 99 10.398 0.632 4.127 1.00 0.00 H new ATOM 1623 N THR A 100 5.119 -2.921 1.249 1.00 0.00 N ATOM 1624 CA THR A 100 4.365 -4.196 1.230 1.00 0.00 C ATOM 1625 C THR A 100 3.462 -4.232 -0.004 1.00 0.00 C ATOM 1626 O THR A 100 3.443 -5.191 -0.747 1.00 0.00 O ATOM 1627 CB THR A 100 3.519 -4.289 2.503 1.00 0.00 C ATOM 1628 OG1 THR A 100 4.340 -4.012 3.628 1.00 0.00 O ATOM 1629 CG2 THR A 100 2.926 -5.691 2.647 1.00 0.00 C ATOM 0 H THR A 100 5.024 -2.367 2.100 1.00 0.00 H new ATOM 0 HA THR A 100 5.054 -5.040 1.189 1.00 0.00 H new ATOM 0 HB THR A 100 2.706 -3.565 2.443 1.00 0.00 H new ATOM 0 HG1 THR A 100 4.445 -3.043 3.726 1.00 0.00 H new ATOM 0 HG21 THR A 100 2.327 -5.741 3.557 1.00 0.00 H new ATOM 0 HG22 THR A 100 2.296 -5.910 1.785 1.00 0.00 H new ATOM 0 HG23 THR A 100 3.732 -6.423 2.702 1.00 0.00 H new ATOM 1637 N GLN A 101 2.704 -3.198 -0.221 1.00 0.00 N ATOM 1638 CA GLN A 101 1.795 -3.170 -1.398 1.00 0.00 C ATOM 1639 C GLN A 101 2.578 -3.190 -2.718 1.00 0.00 C ATOM 1640 O GLN A 101 2.219 -3.889 -3.642 1.00 0.00 O ATOM 1641 CB GLN A 101 0.946 -1.909 -1.330 1.00 0.00 C ATOM 1642 CG GLN A 101 0.079 -1.969 -0.073 1.00 0.00 C ATOM 1643 CD GLN A 101 -0.711 -0.672 0.073 1.00 0.00 C ATOM 1644 OE1 GLN A 101 -0.582 0.229 -0.732 1.00 0.00 O ATOM 1645 NE2 GLN A 101 -1.525 -0.536 1.082 1.00 0.00 N ATOM 0 H GLN A 101 2.674 -2.366 0.369 1.00 0.00 H new ATOM 0 HA GLN A 101 1.166 -4.060 -1.371 1.00 0.00 H new ATOM 0 HB2 GLN A 101 1.583 -1.025 -1.307 1.00 0.00 H new ATOM 0 HB3 GLN A 101 0.319 -1.827 -2.218 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -0.604 -2.817 -0.131 1.00 0.00 H new ATOM 0 HG3 GLN A 101 0.706 -2.124 0.805 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.632 -1.293 1.757 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -2.055 0.328 1.197 1.00 0.00 H new ATOM 1654 N TYR A 102 3.634 -2.424 -2.837 1.00 0.00 N ATOM 1655 CA TYR A 102 4.383 -2.424 -4.121 1.00 0.00 C ATOM 1656 C TYR A 102 4.858 -3.841 -4.424 1.00 0.00 C ATOM 1657 O TYR A 102 4.819 -4.300 -5.548 1.00 0.00 O ATOM 1658 CB TYR A 102 5.591 -1.487 -4.029 1.00 0.00 C ATOM 1659 CG TYR A 102 5.917 -0.962 -5.406 1.00 0.00 C ATOM 1660 CD1 TYR A 102 6.560 -1.782 -6.340 1.00 0.00 C ATOM 1661 CD2 TYR A 102 5.562 0.347 -5.749 1.00 0.00 C ATOM 1662 CE1 TYR A 102 6.849 -1.290 -7.620 1.00 0.00 C ATOM 1663 CE2 TYR A 102 5.849 0.838 -7.026 1.00 0.00 C ATOM 1664 CZ TYR A 102 6.493 0.021 -7.962 1.00 0.00 C ATOM 1665 OH TYR A 102 6.776 0.506 -9.223 1.00 0.00 O ATOM 0 H TYR A 102 4.002 -1.809 -2.111 1.00 0.00 H new ATOM 0 HA TYR A 102 3.727 -2.075 -4.919 1.00 0.00 H new ATOM 0 HB2 TYR A 102 5.374 -0.660 -3.353 1.00 0.00 H new ATOM 0 HB3 TYR A 102 6.449 -2.019 -3.617 1.00 0.00 H new ATOM 0 HD1 TYR A 102 6.833 -2.793 -6.075 1.00 0.00 H new ATOM 0 HD2 TYR A 102 5.066 0.979 -5.027 1.00 0.00 H new ATOM 0 HE1 TYR A 102 7.346 -1.921 -8.342 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.574 1.848 -7.290 1.00 0.00 H new ATOM 0 HH TYR A 102 6.158 0.110 -9.872 1.00 0.00 H new ATOM 1675 N MET A 103 5.323 -4.529 -3.423 1.00 0.00 N ATOM 1676 CA MET A 103 5.823 -5.908 -3.625 1.00 0.00 C ATOM 1677 C MET A 103 4.804 -6.768 -4.379 1.00 0.00 C ATOM 1678 O MET A 103 5.111 -7.382 -5.380 1.00 0.00 O ATOM 1679 CB MET A 103 6.062 -6.527 -2.251 1.00 0.00 C ATOM 1680 CG MET A 103 7.363 -6.007 -1.658 1.00 0.00 C ATOM 1681 SD MET A 103 7.697 -6.892 -0.117 1.00 0.00 S ATOM 1682 CE MET A 103 8.088 -8.501 -0.854 1.00 0.00 C ATOM 0 H MET A 103 5.377 -4.188 -2.463 1.00 0.00 H new ATOM 0 HA MET A 103 6.739 -5.869 -4.215 1.00 0.00 H new ATOM 0 HB2 MET A 103 5.231 -6.289 -1.587 1.00 0.00 H new ATOM 0 HB3 MET A 103 6.101 -7.613 -2.335 1.00 0.00 H new ATOM 0 HG2 MET A 103 8.183 -6.152 -2.362 1.00 0.00 H new ATOM 0 HG3 MET A 103 7.290 -4.936 -1.470 1.00 0.00 H new ATOM 0 HE1 MET A 103 8.703 -9.078 -0.163 1.00 0.00 H new ATOM 0 HE2 MET A 103 7.164 -9.043 -1.056 1.00 0.00 H new ATOM 0 HE3 MET A 103 8.632 -8.351 -1.786 1.00 0.00 H new ATOM 1692 N LYS A 104 3.613 -6.874 -3.869 1.00 0.00 N ATOM 1693 CA LYS A 104 2.600 -7.760 -4.522 1.00 0.00 C ATOM 1694 C LYS A 104 2.039 -7.176 -5.828 1.00 0.00 C ATOM 1695 O LYS A 104 2.004 -7.835 -6.848 1.00 0.00 O ATOM 1696 CB LYS A 104 1.420 -7.966 -3.572 1.00 0.00 C ATOM 1697 CG LYS A 104 1.926 -8.250 -2.159 1.00 0.00 C ATOM 1698 CD LYS A 104 0.736 -8.576 -1.255 1.00 0.00 C ATOM 1699 CE LYS A 104 1.186 -8.600 0.209 1.00 0.00 C ATOM 1700 NZ LYS A 104 0.373 -9.597 0.961 1.00 0.00 N ATOM 0 H LYS A 104 3.292 -6.389 -3.031 1.00 0.00 H new ATOM 0 HA LYS A 104 3.112 -8.694 -4.754 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.787 -7.079 -3.568 1.00 0.00 H new ATOM 0 HB3 LYS A 104 0.804 -8.795 -3.919 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.628 -9.084 -2.172 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.466 -7.385 -1.772 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -0.050 -7.833 -1.391 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.312 -9.542 -1.530 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.244 -8.856 0.272 1.00 0.00 H new ATOM 0 HE3 LYS A 104 1.070 -7.611 0.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 0.678 -9.614 1.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -0.632 -9.334 0.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 0.505 -10.540 0.542 1.00 0.00 H new ATOM 1714 N TYR A 105 1.498 -5.990 -5.773 1.00 0.00 N ATOM 1715 CA TYR A 105 0.816 -5.413 -6.973 1.00 0.00 C ATOM 1716 C TYR A 105 1.741 -4.709 -7.984 1.00 0.00 C ATOM 1717 O TYR A 105 1.579 -4.892 -9.174 1.00 0.00 O ATOM 1718 CB TYR A 105 -0.231 -4.421 -6.469 1.00 0.00 C ATOM 1719 CG TYR A 105 -1.095 -5.113 -5.440 1.00 0.00 C ATOM 1720 CD1 TYR A 105 -2.159 -5.923 -5.849 1.00 0.00 C ATOM 1721 CD2 TYR A 105 -0.821 -4.956 -4.076 1.00 0.00 C ATOM 1722 CE1 TYR A 105 -2.954 -6.571 -4.895 1.00 0.00 C ATOM 1723 CE2 TYR A 105 -1.612 -5.606 -3.121 1.00 0.00 C ATOM 1724 CZ TYR A 105 -2.680 -6.412 -3.529 1.00 0.00 C ATOM 1725 OH TYR A 105 -3.463 -7.052 -2.589 1.00 0.00 O ATOM 0 H TYR A 105 1.497 -5.391 -4.947 1.00 0.00 H new ATOM 0 HA TYR A 105 0.386 -6.249 -7.525 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.254 -3.549 -6.031 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -0.842 -4.063 -7.297 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -2.368 -6.049 -6.901 1.00 0.00 H new ATOM 0 HD2 TYR A 105 0.002 -4.332 -3.760 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -3.778 -7.193 -5.212 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -1.398 -5.485 -2.069 1.00 0.00 H new ATOM 0 HH TYR A 105 -3.137 -6.837 -1.690 1.00 0.00 H new ATOM 1735 N LEU A 106 2.649 -3.864 -7.565 1.00 0.00 N ATOM 1736 CA LEU A 106 3.488 -3.131 -8.579 1.00 0.00 C ATOM 1737 C LEU A 106 4.856 -3.780 -8.812 1.00 0.00 C ATOM 1738 O LEU A 106 5.592 -3.351 -9.679 1.00 0.00 O ATOM 1739 CB LEU A 106 3.690 -1.680 -8.132 1.00 0.00 C ATOM 1740 CG LEU A 106 2.363 -0.913 -8.234 1.00 0.00 C ATOM 1741 CD1 LEU A 106 1.557 -1.079 -6.936 1.00 0.00 C ATOM 1742 CD2 LEU A 106 2.653 0.574 -8.472 1.00 0.00 C ATOM 0 H LEU A 106 2.848 -3.649 -6.588 1.00 0.00 H new ATOM 0 HA LEU A 106 2.945 -3.174 -9.523 1.00 0.00 H new ATOM 0 HB2 LEU A 106 4.057 -1.654 -7.106 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.446 -1.201 -8.754 1.00 0.00 H new ATOM 0 HG LEU A 106 1.782 -1.312 -9.065 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.618 -0.532 -7.018 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.348 -2.136 -6.770 1.00 0.00 H new ATOM 0 HD13 LEU A 106 2.133 -0.688 -6.097 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.713 1.121 -8.545 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.239 0.968 -7.641 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.214 0.691 -9.399 1.00 0.00 H new ATOM 1754 N TYR A 107 5.222 -4.799 -8.092 1.00 0.00 N ATOM 1755 CA TYR A 107 6.557 -5.406 -8.366 1.00 0.00 C ATOM 1756 C TYR A 107 6.580 -5.967 -9.792 1.00 0.00 C ATOM 1757 O TYR A 107 7.585 -5.888 -10.470 1.00 0.00 O ATOM 1758 CB TYR A 107 6.883 -6.510 -7.357 1.00 0.00 C ATOM 1759 CG TYR A 107 8.332 -6.913 -7.509 1.00 0.00 C ATOM 1760 CD1 TYR A 107 9.350 -5.988 -7.243 1.00 0.00 C ATOM 1761 CD2 TYR A 107 8.658 -8.211 -7.919 1.00 0.00 C ATOM 1762 CE1 TYR A 107 10.691 -6.362 -7.386 1.00 0.00 C ATOM 1763 CE2 TYR A 107 9.999 -8.586 -8.062 1.00 0.00 C ATOM 1764 CZ TYR A 107 11.015 -7.661 -7.794 1.00 0.00 C ATOM 1765 OH TYR A 107 12.336 -8.028 -7.936 1.00 0.00 O ATOM 0 H TYR A 107 4.676 -5.230 -7.346 1.00 0.00 H new ATOM 0 HA TYR A 107 7.317 -4.631 -8.266 1.00 0.00 H new ATOM 0 HB2 TYR A 107 6.696 -6.158 -6.342 1.00 0.00 H new ATOM 0 HB3 TYR A 107 6.235 -7.371 -7.520 1.00 0.00 H new ATOM 0 HD1 TYR A 107 9.100 -4.986 -6.927 1.00 0.00 H new ATOM 0 HD2 TYR A 107 7.874 -8.924 -8.125 1.00 0.00 H new ATOM 0 HE1 TYR A 107 11.476 -5.648 -7.182 1.00 0.00 H new ATOM 0 HE2 TYR A 107 10.250 -9.588 -8.379 1.00 0.00 H new ATOM 0 HH TYR A 107 12.899 -7.226 -7.952 1.00 0.00 H new ATOM 1775 N PRO A 108 5.485 -6.523 -10.262 1.00 0.00 N ATOM 1776 CA PRO A 108 5.410 -7.087 -11.641 1.00 0.00 C ATOM 1777 C PRO A 108 5.536 -5.992 -12.709 1.00 0.00 C ATOM 1778 O PRO A 108 6.353 -6.073 -13.599 1.00 0.00 O ATOM 1779 CB PRO A 108 4.024 -7.757 -11.703 1.00 0.00 C ATOM 1780 CG PRO A 108 3.543 -7.837 -10.292 1.00 0.00 C ATOM 1781 CD PRO A 108 4.204 -6.679 -9.555 1.00 0.00 C ATOM 0 HA PRO A 108 6.224 -7.784 -11.841 1.00 0.00 H new ATOM 0 HB2 PRO A 108 3.337 -7.176 -12.317 1.00 0.00 H new ATOM 0 HB3 PRO A 108 4.090 -8.749 -12.150 1.00 0.00 H new ATOM 0 HG2 PRO A 108 2.457 -7.760 -10.245 1.00 0.00 H new ATOM 0 HG3 PRO A 108 3.814 -8.792 -9.841 1.00 0.00 H new ATOM 0 HD2 PRO A 108 3.602 -5.772 -9.606 1.00 0.00 H new ATOM 0 HD3 PRO A 108 4.351 -6.904 -8.499 1.00 0.00 H new ATOM 1789 N TYR A 109 4.731 -4.969 -12.619 1.00 0.00 N ATOM 1790 CA TYR A 109 4.792 -3.867 -13.624 1.00 0.00 C ATOM 1791 C TYR A 109 6.202 -3.261 -13.635 1.00 0.00 C ATOM 1792 O TYR A 109 6.797 -3.076 -14.677 1.00 0.00 O ATOM 1793 CB TYR A 109 3.763 -2.787 -13.237 1.00 0.00 C ATOM 1794 CG TYR A 109 3.179 -2.142 -14.478 1.00 0.00 C ATOM 1795 CD1 TYR A 109 3.845 -1.086 -15.108 1.00 0.00 C ATOM 1796 CD2 TYR A 109 1.966 -2.612 -14.998 1.00 0.00 C ATOM 1797 CE1 TYR A 109 3.296 -0.497 -16.257 1.00 0.00 C ATOM 1798 CE2 TYR A 109 1.417 -2.028 -16.147 1.00 0.00 C ATOM 1799 CZ TYR A 109 2.081 -0.969 -16.776 1.00 0.00 C ATOM 1800 OH TYR A 109 1.543 -0.390 -17.907 1.00 0.00 O ATOM 0 H TYR A 109 4.029 -4.847 -11.889 1.00 0.00 H new ATOM 0 HA TYR A 109 4.564 -4.254 -14.617 1.00 0.00 H new ATOM 0 HB2 TYR A 109 2.966 -3.232 -12.642 1.00 0.00 H new ATOM 0 HB3 TYR A 109 4.239 -2.029 -12.615 1.00 0.00 H new ATOM 0 HD1 TYR A 109 4.782 -0.724 -14.710 1.00 0.00 H new ATOM 0 HD2 TYR A 109 1.452 -3.428 -14.511 1.00 0.00 H new ATOM 0 HE1 TYR A 109 3.809 0.320 -16.742 1.00 0.00 H new ATOM 0 HE2 TYR A 109 0.483 -2.394 -16.547 1.00 0.00 H new ATOM 0 HH TYR A 109 1.616 -1.013 -18.660 1.00 0.00 H new ATOM 1810 N GLU A 110 6.739 -2.946 -12.485 1.00 0.00 N ATOM 1811 CA GLU A 110 8.108 -2.347 -12.434 1.00 0.00 C ATOM 1812 C GLU A 110 9.155 -3.372 -12.878 1.00 0.00 C ATOM 1813 O GLU A 110 10.024 -3.080 -13.672 1.00 0.00 O ATOM 1814 CB GLU A 110 8.424 -1.917 -10.996 1.00 0.00 C ATOM 1815 CG GLU A 110 9.863 -1.397 -10.922 1.00 0.00 C ATOM 1816 CD GLU A 110 10.814 -2.560 -10.629 1.00 0.00 C ATOM 1817 OE1 GLU A 110 10.555 -3.287 -9.683 1.00 0.00 O ATOM 1818 OE2 GLU A 110 11.779 -2.709 -11.359 1.00 0.00 O ATOM 0 H GLU A 110 6.290 -3.077 -11.579 1.00 0.00 H new ATOM 0 HA GLU A 110 8.136 -1.486 -13.102 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.729 -1.141 -10.676 1.00 0.00 H new ATOM 0 HB3 GLU A 110 8.295 -2.760 -10.317 1.00 0.00 H new ATOM 0 HG2 GLU A 110 10.136 -0.918 -11.862 1.00 0.00 H new ATOM 0 HG3 GLU A 110 9.947 -0.640 -10.143 1.00 0.00 H new ATOM 1825 N CYS A 111 9.095 -4.565 -12.358 1.00 0.00 N ATOM 1826 CA CYS A 111 10.107 -5.592 -12.738 1.00 0.00 C ATOM 1827 C CYS A 111 9.843 -6.115 -14.151 1.00 0.00 C ATOM 1828 O CYS A 111 10.751 -6.259 -14.947 1.00 0.00 O ATOM 1829 CB CYS A 111 10.046 -6.758 -11.747 1.00 0.00 C ATOM 1830 SG CYS A 111 11.650 -7.593 -11.696 1.00 0.00 S ATOM 0 H CYS A 111 8.391 -4.874 -11.688 1.00 0.00 H new ATOM 0 HA CYS A 111 11.095 -5.132 -12.714 1.00 0.00 H new ATOM 0 HB2 CYS A 111 9.783 -6.392 -10.755 1.00 0.00 H new ATOM 0 HB3 CYS A 111 9.268 -7.461 -12.044 1.00 0.00 H new ATOM 0 HG CYS A 111 12.556 -6.767 -11.263 1.00 0.00 H new ATOM 1836 N GLU A 112 8.622 -6.439 -14.464 1.00 0.00 N ATOM 1837 CA GLU A 112 8.322 -6.996 -15.811 1.00 0.00 C ATOM 1838 C GLU A 112 8.547 -5.949 -16.910 1.00 0.00 C ATOM 1839 O GLU A 112 9.219 -6.203 -17.891 1.00 0.00 O ATOM 1840 CB GLU A 112 6.854 -7.435 -15.837 1.00 0.00 C ATOM 1841 CG GLU A 112 6.571 -8.198 -17.132 1.00 0.00 C ATOM 1842 CD GLU A 112 5.078 -8.521 -17.219 1.00 0.00 C ATOM 1843 OE1 GLU A 112 4.289 -7.592 -17.187 1.00 0.00 O ATOM 1844 OE2 GLU A 112 4.751 -9.692 -17.312 1.00 0.00 O ATOM 0 H GLU A 112 7.817 -6.342 -13.845 1.00 0.00 H new ATOM 0 HA GLU A 112 8.988 -7.838 -15.999 1.00 0.00 H new ATOM 0 HB2 GLU A 112 6.637 -8.067 -14.976 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.202 -6.564 -15.766 1.00 0.00 H new ATOM 0 HG2 GLU A 112 6.875 -7.601 -17.992 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.155 -9.118 -17.159 1.00 0.00 H new ATOM 1851 N LYS A 113 7.969 -4.791 -16.772 1.00 0.00 N ATOM 1852 CA LYS A 113 8.126 -3.748 -17.829 1.00 0.00 C ATOM 1853 C LYS A 113 9.518 -3.105 -17.795 1.00 0.00 C ATOM 1854 O LYS A 113 10.026 -2.684 -18.815 1.00 0.00 O ATOM 1855 CB LYS A 113 7.067 -2.661 -17.629 1.00 0.00 C ATOM 1856 CG LYS A 113 5.671 -3.293 -17.573 1.00 0.00 C ATOM 1857 CD LYS A 113 5.329 -3.930 -18.923 1.00 0.00 C ATOM 1858 CE LYS A 113 3.822 -4.182 -19.000 1.00 0.00 C ATOM 1859 NZ LYS A 113 3.305 -4.524 -17.645 1.00 0.00 N ATOM 0 H LYS A 113 7.394 -4.518 -15.975 1.00 0.00 H new ATOM 0 HA LYS A 113 8.002 -4.233 -18.797 1.00 0.00 H new ATOM 0 HB2 LYS A 113 7.265 -2.114 -16.707 1.00 0.00 H new ATOM 0 HB3 LYS A 113 7.116 -1.939 -18.444 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.636 -4.047 -16.787 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.930 -2.535 -17.321 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.641 -3.275 -19.736 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.872 -4.867 -19.043 1.00 0.00 H new ATOM 0 HE2 LYS A 113 3.314 -3.297 -19.382 1.00 0.00 H new ATOM 0 HE3 LYS A 113 3.614 -4.994 -19.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 2.401 -5.030 -17.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 3.993 -5.130 -17.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 3.160 -3.651 -17.098 1.00 0.00 H new ATOM 1873 N LYS A 114 10.125 -2.981 -16.640 1.00 0.00 N ATOM 1874 CA LYS A 114 11.461 -2.310 -16.569 1.00 0.00 C ATOM 1875 C LYS A 114 12.554 -3.274 -16.075 1.00 0.00 C ATOM 1876 O LYS A 114 13.706 -3.148 -16.443 1.00 0.00 O ATOM 1877 CB LYS A 114 11.343 -1.126 -15.614 1.00 0.00 C ATOM 1878 CG LYS A 114 12.529 -0.186 -15.803 1.00 0.00 C ATOM 1879 CD LYS A 114 12.312 0.706 -17.032 1.00 0.00 C ATOM 1880 CE LYS A 114 13.273 1.893 -16.965 1.00 0.00 C ATOM 1881 NZ LYS A 114 13.250 2.626 -18.263 1.00 0.00 N ATOM 0 H LYS A 114 9.756 -3.313 -15.749 1.00 0.00 H new ATOM 0 HA LYS A 114 11.749 -1.979 -17.567 1.00 0.00 H new ATOM 0 HB2 LYS A 114 10.411 -0.591 -15.798 1.00 0.00 H new ATOM 0 HB3 LYS A 114 11.309 -1.481 -14.584 1.00 0.00 H new ATOM 0 HG2 LYS A 114 12.657 0.432 -14.915 1.00 0.00 H new ATOM 0 HG3 LYS A 114 13.445 -0.765 -15.923 1.00 0.00 H new ATOM 0 HD2 LYS A 114 12.482 0.136 -17.945 1.00 0.00 H new ATOM 0 HD3 LYS A 114 11.281 1.058 -17.064 1.00 0.00 H new ATOM 0 HE2 LYS A 114 12.986 2.561 -16.153 1.00 0.00 H new ATOM 0 HE3 LYS A 114 14.283 1.545 -16.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 13.904 3.433 -18.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 13.543 1.986 -19.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 12.287 2.971 -18.450 1.00 0.00 H new ATOM 1895 N ASN A 115 12.216 -4.238 -15.263 1.00 0.00 N ATOM 1896 CA ASN A 115 13.256 -5.201 -14.777 1.00 0.00 C ATOM 1897 C ASN A 115 14.424 -4.446 -14.122 1.00 0.00 C ATOM 1898 O ASN A 115 15.578 -4.740 -14.368 1.00 0.00 O ATOM 1899 CB ASN A 115 13.782 -6.010 -15.964 1.00 0.00 C ATOM 1900 CG ASN A 115 14.694 -7.129 -15.460 1.00 0.00 C ATOM 1901 OD1 ASN A 115 15.901 -7.038 -15.563 1.00 0.00 O ATOM 1902 ND2 ASN A 115 14.166 -8.189 -14.913 1.00 0.00 N ATOM 0 H ASN A 115 11.272 -4.404 -14.914 1.00 0.00 H new ATOM 0 HA ASN A 115 12.807 -5.864 -14.038 1.00 0.00 H new ATOM 0 HB2 ASN A 115 12.949 -6.432 -16.527 1.00 0.00 H new ATOM 0 HB3 ASN A 115 14.330 -5.360 -16.646 1.00 0.00 H new ATOM 0 HD21 ASN A 115 14.766 -8.940 -14.572 1.00 0.00 H new ATOM 0 HD22 ASN A 115 13.153 -8.267 -14.826 1.00 0.00 H new ATOM 1909 N LEU A 116 14.139 -3.477 -13.296 1.00 0.00 N ATOM 1910 CA LEU A 116 15.233 -2.704 -12.630 1.00 0.00 C ATOM 1911 C LEU A 116 15.999 -3.582 -11.648 1.00 0.00 C ATOM 1912 O LEU A 116 17.158 -3.344 -11.368 1.00 0.00 O ATOM 1913 CB LEU A 116 14.629 -1.535 -11.866 1.00 0.00 C ATOM 1914 CG LEU A 116 13.938 -0.617 -12.857 1.00 0.00 C ATOM 1915 CD1 LEU A 116 13.095 0.404 -12.097 1.00 0.00 C ATOM 1916 CD2 LEU A 116 14.990 0.111 -13.712 1.00 0.00 C ATOM 0 H LEU A 116 13.193 -3.184 -13.051 1.00 0.00 H new ATOM 0 HA LEU A 116 15.919 -2.348 -13.399 1.00 0.00 H new ATOM 0 HB2 LEU A 116 13.917 -1.895 -11.123 1.00 0.00 H new ATOM 0 HB3 LEU A 116 15.406 -0.993 -11.326 1.00 0.00 H new ATOM 0 HG LEU A 116 13.294 -1.206 -13.510 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.597 1.065 -12.806 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.347 -0.115 -11.498 1.00 0.00 H new ATOM 0 HD13 LEU A 116 13.738 0.992 -11.443 1.00 0.00 H new ATOM 0 HD21 LEU A 116 14.489 0.769 -14.422 1.00 0.00 H new ATOM 0 HD22 LEU A 116 15.639 0.701 -13.065 1.00 0.00 H new ATOM 0 HD23 LEU A 116 15.588 -0.621 -14.255 1.00 0.00 H new ATOM 1928 N SER A 117 15.364 -4.569 -11.092 1.00 0.00 N ATOM 1929 CA SER A 117 16.085 -5.417 -10.096 1.00 0.00 C ATOM 1930 C SER A 117 15.492 -6.829 -10.035 1.00 0.00 C ATOM 1931 O SER A 117 14.719 -7.234 -10.880 1.00 0.00 O ATOM 1932 CB SER A 117 15.974 -4.753 -8.719 1.00 0.00 C ATOM 1933 OG SER A 117 16.224 -5.713 -7.702 1.00 0.00 O ATOM 0 H SER A 117 14.394 -4.827 -11.276 1.00 0.00 H new ATOM 0 HA SER A 117 17.129 -5.505 -10.397 1.00 0.00 H new ATOM 0 HB2 SER A 117 16.688 -3.933 -8.642 1.00 0.00 H new ATOM 0 HB3 SER A 117 14.980 -4.324 -8.591 1.00 0.00 H new ATOM 0 HG SER A 117 17.191 -5.816 -7.580 1.00 0.00 H new ATOM 1939 N THR A 118 15.879 -7.585 -9.038 1.00 0.00 N ATOM 1940 CA THR A 118 15.380 -8.987 -8.899 1.00 0.00 C ATOM 1941 C THR A 118 14.701 -9.156 -7.537 1.00 0.00 C ATOM 1942 O THR A 118 15.038 -8.477 -6.587 1.00 0.00 O ATOM 1943 CB THR A 118 16.577 -9.945 -8.986 1.00 0.00 C ATOM 1944 OG1 THR A 118 17.443 -9.708 -7.888 1.00 0.00 O ATOM 1945 CG2 THR A 118 17.334 -9.704 -10.292 1.00 0.00 C ATOM 0 H THR A 118 16.526 -7.287 -8.308 1.00 0.00 H new ATOM 0 HA THR A 118 14.663 -9.205 -9.691 1.00 0.00 H new ATOM 0 HB THR A 118 16.223 -10.975 -8.960 1.00 0.00 H new ATOM 0 HG1 THR A 118 18.208 -10.318 -7.937 1.00 0.00 H new ATOM 0 HG21 THR A 118 18.183 -10.385 -10.351 1.00 0.00 H new ATOM 0 HG22 THR A 118 16.668 -9.880 -11.137 1.00 0.00 H new ATOM 0 HG23 THR A 118 17.692 -8.675 -10.321 1.00 0.00 H new ATOM 1953 N PRO A 119 13.757 -10.062 -7.427 1.00 0.00 N ATOM 1954 CA PRO A 119 13.046 -10.311 -6.141 1.00 0.00 C ATOM 1955 C PRO A 119 14.019 -10.627 -4.995 1.00 0.00 C ATOM 1956 O PRO A 119 13.809 -10.221 -3.869 1.00 0.00 O ATOM 1957 CB PRO A 119 12.130 -11.514 -6.434 1.00 0.00 C ATOM 1958 CG PRO A 119 12.590 -12.078 -7.742 1.00 0.00 C ATOM 1959 CD PRO A 119 13.259 -10.936 -8.499 1.00 0.00 C ATOM 0 HA PRO A 119 12.493 -9.432 -5.812 1.00 0.00 H new ATOM 0 HB2 PRO A 119 12.201 -12.259 -5.642 1.00 0.00 H new ATOM 0 HB3 PRO A 119 11.086 -11.205 -6.489 1.00 0.00 H new ATOM 0 HG2 PRO A 119 13.288 -12.900 -7.585 1.00 0.00 H new ATOM 0 HG3 PRO A 119 11.749 -12.478 -8.308 1.00 0.00 H new ATOM 0 HD2 PRO A 119 14.069 -11.295 -9.134 1.00 0.00 H new ATOM 0 HD3 PRO A 119 12.553 -10.415 -9.147 1.00 0.00 H new ATOM 1967 N ALA A 120 15.086 -11.338 -5.267 1.00 0.00 N ATOM 1968 CA ALA A 120 16.061 -11.656 -4.180 1.00 0.00 C ATOM 1969 C ALA A 120 16.669 -10.362 -3.657 1.00 0.00 C ATOM 1970 O ALA A 120 16.897 -10.212 -2.474 1.00 0.00 O ATOM 1971 CB ALA A 120 17.165 -12.564 -4.726 1.00 0.00 C ATOM 0 H ALA A 120 15.322 -11.709 -6.187 1.00 0.00 H new ATOM 0 HA ALA A 120 15.547 -12.171 -3.368 1.00 0.00 H new ATOM 0 HB1 ALA A 120 17.874 -12.794 -3.930 1.00 0.00 H new ATOM 0 HB2 ALA A 120 16.725 -13.489 -5.098 1.00 0.00 H new ATOM 0 HB3 ALA A 120 17.684 -12.057 -5.539 1.00 0.00 H new ATOM 1977 N GLU A 121 16.901 -9.406 -4.512 1.00 0.00 N ATOM 1978 CA GLU A 121 17.451 -8.123 -4.012 1.00 0.00 C ATOM 1979 C GLU A 121 16.375 -7.503 -3.132 1.00 0.00 C ATOM 1980 O GLU A 121 16.634 -7.029 -2.044 1.00 0.00 O ATOM 1981 CB GLU A 121 17.770 -7.198 -5.188 1.00 0.00 C ATOM 1982 CG GLU A 121 18.976 -7.745 -5.952 1.00 0.00 C ATOM 1983 CD GLU A 121 19.291 -6.829 -7.136 1.00 0.00 C ATOM 1984 OE1 GLU A 121 18.489 -5.954 -7.413 1.00 0.00 O ATOM 1985 OE2 GLU A 121 20.328 -7.021 -7.748 1.00 0.00 O ATOM 0 H GLU A 121 16.736 -9.457 -5.517 1.00 0.00 H new ATOM 0 HA GLU A 121 18.373 -8.279 -3.452 1.00 0.00 H new ATOM 0 HB2 GLU A 121 16.908 -7.125 -5.851 1.00 0.00 H new ATOM 0 HB3 GLU A 121 17.981 -6.191 -4.827 1.00 0.00 H new ATOM 0 HG2 GLU A 121 19.839 -7.811 -5.290 1.00 0.00 H new ATOM 0 HG3 GLU A 121 18.768 -8.755 -6.306 1.00 0.00 H new ATOM 1992 N LEU A 122 15.156 -7.530 -3.596 1.00 0.00 N ATOM 1993 CA LEU A 122 14.024 -6.980 -2.808 1.00 0.00 C ATOM 1994 C LEU A 122 13.859 -7.791 -1.517 1.00 0.00 C ATOM 1995 O LEU A 122 13.837 -7.247 -0.431 1.00 0.00 O ATOM 1996 CB LEU A 122 12.772 -7.098 -3.682 1.00 0.00 C ATOM 1997 CG LEU A 122 11.511 -6.751 -2.892 1.00 0.00 C ATOM 1998 CD1 LEU A 122 11.654 -5.353 -2.289 1.00 0.00 C ATOM 1999 CD2 LEU A 122 10.288 -6.798 -3.836 1.00 0.00 C ATOM 0 H LEU A 122 14.895 -7.917 -4.503 1.00 0.00 H new ATOM 0 HA LEU A 122 14.197 -5.940 -2.532 1.00 0.00 H new ATOM 0 HB2 LEU A 122 12.861 -6.432 -4.541 1.00 0.00 H new ATOM 0 HB3 LEU A 122 12.692 -8.113 -4.072 1.00 0.00 H new ATOM 0 HG LEU A 122 11.371 -7.472 -2.087 1.00 0.00 H new ATOM 0 HD11 LEU A 122 10.754 -5.106 -1.726 1.00 0.00 H new ATOM 0 HD12 LEU A 122 12.517 -5.330 -1.623 1.00 0.00 H new ATOM 0 HD13 LEU A 122 11.793 -4.625 -3.088 1.00 0.00 H new ATOM 0 HD21 LEU A 122 9.386 -6.551 -3.276 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.423 -6.077 -4.643 1.00 0.00 H new ATOM 0 HD23 LEU A 122 10.191 -7.799 -4.256 1.00 0.00 H new ATOM 2011 N GLN A 123 13.774 -9.091 -1.626 1.00 0.00 N ATOM 2012 CA GLN A 123 13.650 -9.945 -0.409 1.00 0.00 C ATOM 2013 C GLN A 123 14.845 -9.701 0.515 1.00 0.00 C ATOM 2014 O GLN A 123 14.692 -9.471 1.698 1.00 0.00 O ATOM 2015 CB GLN A 123 13.624 -11.415 -0.832 1.00 0.00 C ATOM 2016 CG GLN A 123 13.366 -12.298 0.388 1.00 0.00 C ATOM 2017 CD GLN A 123 11.915 -12.133 0.841 1.00 0.00 C ATOM 2018 OE1 GLN A 123 10.998 -12.383 0.084 1.00 0.00 O ATOM 2019 NE2 GLN A 123 11.666 -11.719 2.053 1.00 0.00 N ATOM 0 H GLN A 123 13.785 -9.600 -2.510 1.00 0.00 H new ATOM 0 HA GLN A 123 12.731 -9.696 0.121 1.00 0.00 H new ATOM 0 HB2 GLN A 123 12.847 -11.575 -1.579 1.00 0.00 H new ATOM 0 HB3 GLN A 123 14.572 -11.687 -1.296 1.00 0.00 H new ATOM 0 HG2 GLN A 123 13.565 -13.341 0.143 1.00 0.00 H new ATOM 0 HG3 GLN A 123 14.044 -12.025 1.197 1.00 0.00 H new ATOM 0 HE21 GLN A 123 12.436 -11.509 2.688 1.00 0.00 H new ATOM 0 HE22 GLN A 123 10.702 -11.605 2.365 1.00 0.00 H new ATOM 2028 N ALA A 124 16.035 -9.761 -0.018 1.00 0.00 N ATOM 2029 CA ALA A 124 17.245 -9.542 0.835 1.00 0.00 C ATOM 2030 C ALA A 124 17.218 -8.134 1.441 1.00 0.00 C ATOM 2031 O ALA A 124 17.542 -7.942 2.597 1.00 0.00 O ATOM 2032 CB ALA A 124 18.505 -9.702 -0.020 1.00 0.00 C ATOM 0 H ALA A 124 16.225 -9.951 -1.002 1.00 0.00 H new ATOM 0 HA ALA A 124 17.249 -10.276 1.641 1.00 0.00 H new ATOM 0 HB1 ALA A 124 19.388 -9.543 0.599 1.00 0.00 H new ATOM 0 HB2 ALA A 124 18.534 -10.707 -0.441 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.492 -8.970 -0.828 1.00 0.00 H new ATOM 2038 N ALA A 125 16.835 -7.152 0.676 1.00 0.00 N ATOM 2039 CA ALA A 125 16.787 -5.759 1.212 1.00 0.00 C ATOM 2040 C ALA A 125 15.681 -5.681 2.242 1.00 0.00 C ATOM 2041 O ALA A 125 15.772 -4.978 3.229 1.00 0.00 O ATOM 2042 CB ALA A 125 16.492 -4.784 0.077 1.00 0.00 C ATOM 0 H ALA A 125 16.552 -7.251 -0.299 1.00 0.00 H new ATOM 0 HA ALA A 125 17.744 -5.500 1.665 1.00 0.00 H new ATOM 0 HB1 ALA A 125 16.457 -3.768 0.470 1.00 0.00 H new ATOM 0 HB2 ALA A 125 17.276 -4.855 -0.677 1.00 0.00 H new ATOM 0 HB3 ALA A 125 15.531 -5.031 -0.375 1.00 0.00 H new ATOM 2048 N ILE A 126 14.646 -6.422 2.024 1.00 0.00 N ATOM 2049 CA ILE A 126 13.533 -6.432 2.983 1.00 0.00 C ATOM 2050 C ILE A 126 14.050 -6.983 4.306 1.00 0.00 C ATOM 2051 O ILE A 126 13.875 -6.389 5.349 1.00 0.00 O ATOM 2052 CB ILE A 126 12.424 -7.299 2.400 1.00 0.00 C ATOM 2053 CG1 ILE A 126 11.541 -6.412 1.525 1.00 0.00 C ATOM 2054 CG2 ILE A 126 11.587 -7.928 3.516 1.00 0.00 C ATOM 2055 CD1 ILE A 126 10.625 -7.268 0.672 1.00 0.00 C ATOM 0 H ILE A 126 14.525 -7.027 1.212 1.00 0.00 H new ATOM 0 HA ILE A 126 13.134 -5.434 3.163 1.00 0.00 H new ATOM 0 HB ILE A 126 12.858 -8.107 1.811 1.00 0.00 H new ATOM 0 HG12 ILE A 126 10.949 -5.744 2.151 1.00 0.00 H new ATOM 0 HG13 ILE A 126 12.162 -5.783 0.887 1.00 0.00 H new ATOM 0 HG21 ILE A 126 10.801 -8.543 3.078 1.00 0.00 H new ATOM 0 HG22 ILE A 126 12.226 -8.549 4.144 1.00 0.00 H new ATOM 0 HG23 ILE A 126 11.137 -7.141 4.121 1.00 0.00 H new ATOM 0 HD11 ILE A 126 10.000 -6.626 0.052 1.00 0.00 H new ATOM 0 HD12 ILE A 126 11.224 -7.917 0.033 1.00 0.00 H new ATOM 0 HD13 ILE A 126 9.992 -7.878 1.317 1.00 0.00 H new ATOM 2067 N ASP A 127 14.716 -8.098 4.265 1.00 0.00 N ATOM 2068 CA ASP A 127 15.274 -8.662 5.523 1.00 0.00 C ATOM 2069 C ASP A 127 16.283 -7.662 6.092 1.00 0.00 C ATOM 2070 O ASP A 127 16.394 -7.480 7.288 1.00 0.00 O ATOM 2071 CB ASP A 127 15.975 -9.989 5.227 1.00 0.00 C ATOM 2072 CG ASP A 127 16.392 -10.650 6.541 1.00 0.00 C ATOM 2073 OD1 ASP A 127 15.561 -11.313 7.139 1.00 0.00 O ATOM 2074 OD2 ASP A 127 17.537 -10.484 6.929 1.00 0.00 O ATOM 0 H ASP A 127 14.898 -8.642 3.421 1.00 0.00 H new ATOM 0 HA ASP A 127 14.474 -8.840 6.242 1.00 0.00 H new ATOM 0 HB2 ASP A 127 15.308 -10.649 4.671 1.00 0.00 H new ATOM 0 HB3 ASP A 127 16.850 -9.818 4.600 1.00 0.00 H new ATOM 2079 N GLY A 128 17.019 -7.012 5.229 1.00 0.00 N ATOM 2080 CA GLY A 128 18.029 -6.017 5.690 1.00 0.00 C ATOM 2081 C GLY A 128 17.349 -4.890 6.477 1.00 0.00 C ATOM 2082 O GLY A 128 17.921 -4.333 7.393 1.00 0.00 O ATOM 0 H GLY A 128 16.962 -7.129 4.217 1.00 0.00 H new ATOM 0 HA2 GLY A 128 18.773 -6.509 6.316 1.00 0.00 H new ATOM 0 HA3 GLY A 128 18.558 -5.602 4.832 1.00 0.00 H new ATOM 2086 N ASN A 129 16.140 -4.539 6.125 1.00 0.00 N ATOM 2087 CA ASN A 129 15.458 -3.431 6.869 1.00 0.00 C ATOM 2088 C ASN A 129 14.618 -3.998 8.017 1.00 0.00 C ATOM 2089 O ASN A 129 14.421 -3.349 9.025 1.00 0.00 O ATOM 2090 CB ASN A 129 14.565 -2.622 5.918 1.00 0.00 C ATOM 2091 CG ASN A 129 13.331 -3.433 5.511 1.00 0.00 C ATOM 2092 OD1 ASN A 129 12.568 -3.967 6.427 1.00 0.00 O flip ATOM 2093 ND2 ASN A 129 13.041 -3.557 4.342 1.00 0.00 N flip ATOM 0 H ASN A 129 15.601 -4.961 5.369 1.00 0.00 H new ATOM 0 HA ASN A 129 16.221 -2.772 7.283 1.00 0.00 H new ATOM 0 HB2 ASN A 129 14.254 -1.696 6.403 1.00 0.00 H new ATOM 0 HB3 ASN A 129 15.131 -2.342 5.030 1.00 0.00 H new ATOM 0 HD21 ASN A 129 13.633 -3.142 3.623 1.00 0.00 H new ATOM 0 HD22 ASN A 129 12.204 -4.076 4.076 1.00 0.00 H new ATOM 2100 N ARG A 130 14.118 -5.195 7.878 1.00 0.00 N ATOM 2101 CA ARG A 130 13.287 -5.782 8.973 1.00 0.00 C ATOM 2102 C ARG A 130 14.119 -5.901 10.249 1.00 0.00 C ATOM 2103 O ARG A 130 15.289 -6.228 10.218 1.00 0.00 O ATOM 2104 CB ARG A 130 12.806 -7.172 8.560 1.00 0.00 C ATOM 2105 CG ARG A 130 11.665 -7.038 7.541 1.00 0.00 C ATOM 2106 CD ARG A 130 11.142 -8.431 7.133 1.00 0.00 C ATOM 2107 NE ARG A 130 9.673 -8.569 7.425 1.00 0.00 N ATOM 2108 CZ ARG A 130 9.156 -8.232 8.581 1.00 0.00 C ATOM 2109 NH1 ARG A 130 9.907 -7.785 9.544 1.00 0.00 N ATOM 2110 NH2 ARG A 130 7.872 -8.361 8.773 1.00 0.00 N ATOM 0 H ARG A 130 14.246 -5.791 7.060 1.00 0.00 H new ATOM 0 HA ARG A 130 12.430 -5.133 9.156 1.00 0.00 H new ATOM 0 HB2 ARG A 130 13.630 -7.740 8.127 1.00 0.00 H new ATOM 0 HB3 ARG A 130 12.463 -7.725 9.435 1.00 0.00 H new ATOM 0 HG2 ARG A 130 10.854 -6.449 7.969 1.00 0.00 H new ATOM 0 HG3 ARG A 130 12.017 -6.502 6.660 1.00 0.00 H new ATOM 0 HD2 ARG A 130 11.321 -8.592 6.070 1.00 0.00 H new ATOM 0 HD3 ARG A 130 11.696 -9.201 7.669 1.00 0.00 H new ATOM 0 HE ARG A 130 9.059 -8.937 6.699 1.00 0.00 H new ATOM 0 HH11 ARG A 130 10.913 -7.693 9.405 1.00 0.00 H new ATOM 0 HH12 ARG A 130 9.490 -7.527 10.438 1.00 0.00 H new ATOM 0 HH21 ARG A 130 7.278 -8.722 8.026 1.00 0.00 H new ATOM 0 HH22 ARG A 130 7.462 -8.101 9.670 1.00 0.00 H new