USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1236 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 144 HIS : no HD1:sc= -0.58 X(o=-0.75,f=-0.31) USER MOD Set 1.2: A 148 CYS SG : rot 86:sc= -0.165 USER MOD Set 2.1: A 86 ASN : amide:sc= -5.05! C(o=-5.1!,f=-16!) USER MOD Set 2.2: A 95 THR OG1 : rot 180:sc=-0.00626 USER MOD Set 3.1: A 49 HIS : no HE2:sc= 1.01 K(o=2.3,f=-7.9!) USER MOD Set 3.2: A 94 LYS NZ :NH3+ -167:sc= 1.3 (180deg=0) USER MOD Set 4.1: A 42 HIS : no HD1:sc= 0.213 K(o=0.14,f=-1.8!) USER MOD Set 4.2: A 44 THR OG1 : rot 170:sc= -0.0637 USER MOD Set 4.3: A 47 LYS NZ :NH3+ -125:sc=-0.00765 (180deg=-1.28!) USER MOD Set 5.1: A 26 ASN :FLIP amide:sc= -1.25! C(o=-3.7!,f=-1.8!) USER MOD Set 5.2: A 27 ASN : amide:sc= -0.522 K(o=-1.8,f=-3.7) USER MOD Set 6.1: A 19 CYS SG : rot -30:sc= -3.47! USER MOD Set 6.2: A 23 LYS NZ :NH3+ -128:sc= -0.435! (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -173:sc= -12! (180deg=-13.6!) USER MOD Single : A 5 SER OG : rot 180:sc= -0.079 USER MOD Single : A 6 MET CE :methyl -160:sc= -0.716 (180deg=-1.81!) USER MOD Single : A 11 CYS SG : rot 30:sc= -0.974 USER MOD Single : A 35 GLN :FLIP amide:sc= -0.809 F(o=-2.1!,f=-0.81) USER MOD Single : A 37 SER OG : rot -127:sc= 0.818 USER MOD Single : A 41 HIS : no HD1:sc= -0.664 X(o=-0.66,f=-0.71) USER MOD Single : A 59 THR OG1 : rot 71:sc= -3.4! USER MOD Single : A 64 THR OG1 : rot 87:sc= -5.78! USER MOD Single : A 65 GLN : amide:sc= -2.57! C(o=-2.6!,f=-6.6!) USER MOD Single : A 74 GLN : amide:sc= -2.7 K(o=-2.7,f=-4.8!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= 0 X(o=0,f=-0.041) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 172:sc= -0.807 USER MOD Single : A 104 LYS NZ :NH3+ 139:sc= 0.809 (180deg=-0.286) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= -0.0473 USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=-0.0059) USER MOD Single : A 116 HIS :FLIP no HD1:sc= -2.5 F(o=-3.8,f=-2.5) USER MOD Single : A 117 GLN :FLIP amide:sc= 0 F(o=-2.3!,f=0) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 180:sc= -3.18 USER MOD Single : A 129 GLN : amide:sc= -8.18! C(o=-8.2!,f=-11!) USER MOD Single : A 132 GLN :FLIP amide:sc= -9.14! C(o=-17!,f=-9.1!) USER MOD Single : A 134 LYS NZ :NH3+ -163:sc= -0.0028 (180deg=-0.352) USER MOD Single : A 136 MET CE :methyl -155:sc= -1.19 (180deg=-2.55) USER MOD Single : A 137 LYS NZ :NH3+ -171:sc= -5.42! (180deg=-5.65!) USER MOD Single : A 141 GLN :FLIP amide:sc= -1.13 F(o=-5!,f=-1.1) USER MOD Single : A 145 GLN : amide:sc= -0.101 X(o=-0.1,f=-0.3) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.142 -19.117 0.981 1.00 0.00 N ATOM 2 CA GLY A 1 4.343 -19.119 0.170 1.00 0.00 C ATOM 3 C GLY A 1 4.437 -17.830 -0.635 1.00 0.00 C ATOM 4 O GLY A 1 5.489 -17.517 -1.190 1.00 0.00 O ATOM 0 H1 GLY A 1 3.148 -19.943 1.612 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.109 -18.247 1.550 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.306 -19.159 0.364 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.221 -19.223 0.808 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.335 -19.977 -0.503 1.00 0.00 H new ATOM 8 N PRO A 2 3.333 -17.082 -0.698 1.00 0.00 N ATOM 9 CA PRO A 2 3.235 -15.831 -1.419 1.00 0.00 C ATOM 10 C PRO A 2 4.010 -14.752 -0.677 1.00 0.00 C ATOM 11 O PRO A 2 4.523 -13.820 -1.292 1.00 0.00 O ATOM 12 CB PRO A 2 1.742 -15.512 -1.448 1.00 0.00 C ATOM 13 CG PRO A 2 1.235 -16.151 -0.155 1.00 0.00 C ATOM 14 CD PRO A 2 2.083 -17.416 -0.052 1.00 0.00 C ATOM 0 HA PRO A 2 3.652 -15.887 -2.425 1.00 0.00 H new ATOM 0 HB2 PRO A 2 1.558 -14.438 -1.468 1.00 0.00 H new ATOM 0 HB3 PRO A 2 1.255 -15.935 -2.327 1.00 0.00 H new ATOM 0 HG2 PRO A 2 1.379 -15.496 0.704 1.00 0.00 H new ATOM 0 HG3 PRO A 2 0.171 -16.380 -0.207 1.00 0.00 H new ATOM 0 HD2 PRO A 2 2.240 -17.702 0.988 1.00 0.00 H new ATOM 0 HD3 PRO A 2 1.597 -18.258 -0.544 1.00 0.00 H new ATOM 22 N LEU A 3 4.115 -14.837 0.613 1.00 0.00 N ATOM 23 CA LEU A 3 4.861 -13.810 1.386 1.00 0.00 C ATOM 24 C LEU A 3 6.347 -14.170 1.382 1.00 0.00 C ATOM 25 O LEU A 3 6.716 -15.326 1.490 1.00 0.00 O ATOM 26 CB LEU A 3 4.349 -13.789 2.828 1.00 0.00 C ATOM 27 CG LEU A 3 2.838 -13.550 2.837 1.00 0.00 C ATOM 28 CD1 LEU A 3 2.356 -13.451 4.287 1.00 0.00 C ATOM 29 CD2 LEU A 3 2.521 -12.243 2.106 1.00 0.00 C ATOM 0 H LEU A 3 3.710 -15.585 1.176 1.00 0.00 H new ATOM 0 HA LEU A 3 4.715 -12.828 0.935 1.00 0.00 H new ATOM 0 HB2 LEU A 3 4.580 -14.734 3.320 1.00 0.00 H new ATOM 0 HB3 LEU A 3 4.854 -13.005 3.392 1.00 0.00 H new ATOM 0 HG LEU A 3 2.333 -14.376 2.335 1.00 0.00 H new ATOM 0 HD11 LEU A 3 1.280 -13.281 4.302 1.00 0.00 H new ATOM 0 HD12 LEU A 3 2.584 -14.380 4.810 1.00 0.00 H new ATOM 0 HD13 LEU A 3 2.861 -12.622 4.783 1.00 0.00 H new ATOM 0 HD21 LEU A 3 1.444 -12.074 2.113 1.00 0.00 H new ATOM 0 HD22 LEU A 3 3.022 -11.415 2.608 1.00 0.00 H new ATOM 0 HD23 LEU A 3 2.871 -12.308 1.076 1.00 0.00 H new ATOM 41 N GLY A 4 7.205 -13.200 1.259 1.00 0.00 N ATOM 42 CA GLY A 4 8.664 -13.500 1.247 1.00 0.00 C ATOM 43 C GLY A 4 9.455 -12.218 0.980 1.00 0.00 C ATOM 44 O GLY A 4 9.022 -11.129 1.304 1.00 0.00 O ATOM 0 H GLY A 4 6.962 -12.214 1.166 1.00 0.00 H new ATOM 0 HA2 GLY A 4 8.964 -13.931 2.202 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.886 -14.241 0.479 1.00 0.00 H new ATOM 48 N SER A 5 10.614 -12.341 0.394 1.00 0.00 N ATOM 49 CA SER A 5 11.435 -11.130 0.103 1.00 0.00 C ATOM 50 C SER A 5 11.722 -10.384 1.405 1.00 0.00 C ATOM 51 O SER A 5 11.345 -10.819 2.475 1.00 0.00 O ATOM 52 CB SER A 5 10.676 -10.214 -0.856 1.00 0.00 C ATOM 53 OG SER A 5 11.549 -9.193 -1.321 1.00 0.00 O ATOM 0 H SER A 5 11.029 -13.227 0.104 1.00 0.00 H new ATOM 0 HA SER A 5 12.376 -11.432 -0.357 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.290 -10.789 -1.697 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.817 -9.772 -0.351 1.00 0.00 H new ATOM 0 HG SER A 5 11.065 -8.605 -1.938 1.00 0.00 H new ATOM 59 N MET A 6 12.386 -9.264 1.321 1.00 0.00 N ATOM 60 CA MET A 6 12.700 -8.493 2.554 1.00 0.00 C ATOM 61 C MET A 6 11.419 -7.901 3.131 1.00 0.00 C ATOM 62 O MET A 6 10.639 -7.277 2.441 1.00 0.00 O ATOM 63 CB MET A 6 13.671 -7.360 2.225 1.00 0.00 C ATOM 64 CG MET A 6 14.996 -7.588 2.959 1.00 0.00 C ATOM 65 SD MET A 6 14.694 -7.704 4.744 1.00 0.00 S ATOM 66 CE MET A 6 13.935 -6.075 4.960 1.00 0.00 C ATOM 0 H MET A 6 12.724 -8.851 0.452 1.00 0.00 H new ATOM 0 HA MET A 6 13.156 -9.163 3.283 1.00 0.00 H new ATOM 0 HB2 MET A 6 13.843 -7.316 1.150 1.00 0.00 H new ATOM 0 HB3 MET A 6 13.241 -6.402 2.519 1.00 0.00 H new ATOM 0 HG2 MET A 6 15.469 -8.502 2.600 1.00 0.00 H new ATOM 0 HG3 MET A 6 15.685 -6.769 2.749 1.00 0.00 H new ATOM 0 HE1 MET A 6 13.990 -5.784 6.009 1.00 0.00 H new ATOM 0 HE2 MET A 6 14.466 -5.343 4.352 1.00 0.00 H new ATOM 0 HE3 MET A 6 12.891 -6.116 4.649 1.00 0.00 H new ATOM 76 N ALA A 7 11.209 -8.085 4.398 1.00 0.00 N ATOM 77 CA ALA A 7 9.987 -7.537 5.044 1.00 0.00 C ATOM 78 C ALA A 7 8.745 -7.983 4.283 1.00 0.00 C ATOM 79 O ALA A 7 8.813 -8.462 3.167 1.00 0.00 O ATOM 80 CB ALA A 7 10.049 -6.010 5.064 1.00 0.00 C ATOM 0 H ALA A 7 11.835 -8.595 5.021 1.00 0.00 H new ATOM 0 HA ALA A 7 9.935 -7.912 6.066 1.00 0.00 H new ATOM 0 HB1 ALA A 7 9.151 -5.616 5.539 1.00 0.00 H new ATOM 0 HB2 ALA A 7 10.927 -5.689 5.625 1.00 0.00 H new ATOM 0 HB3 ALA A 7 10.114 -5.635 4.043 1.00 0.00 H new ATOM 86 N LEU A 8 7.608 -7.847 4.900 1.00 0.00 N ATOM 87 CA LEU A 8 6.345 -8.281 4.246 1.00 0.00 C ATOM 88 C LEU A 8 5.621 -7.079 3.638 1.00 0.00 C ATOM 89 O LEU A 8 5.531 -6.024 4.238 1.00 0.00 O ATOM 90 CB LEU A 8 5.439 -8.931 5.292 1.00 0.00 C ATOM 91 CG LEU A 8 6.260 -9.864 6.187 1.00 0.00 C ATOM 92 CD1 LEU A 8 7.169 -9.037 7.089 1.00 0.00 C ATOM 93 CD2 LEU A 8 5.321 -10.681 7.068 1.00 0.00 C ATOM 0 H LEU A 8 7.498 -7.452 5.834 1.00 0.00 H new ATOM 0 HA LEU A 8 6.581 -8.992 3.454 1.00 0.00 H new ATOM 0 HB2 LEU A 8 4.958 -8.162 5.897 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.645 -9.492 4.799 1.00 0.00 H new ATOM 0 HG LEU A 8 6.857 -10.525 5.559 1.00 0.00 H new ATOM 0 HD11 LEU A 8 7.753 -9.702 7.725 1.00 0.00 H new ATOM 0 HD12 LEU A 8 7.842 -8.438 6.476 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.563 -8.379 7.711 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.905 -11.345 7.705 1.00 0.00 H new ATOM 0 HD22 LEU A 8 4.729 -10.009 7.690 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.656 -11.273 6.440 1.00 0.00 H new ATOM 105 N ARG A 9 5.089 -7.236 2.457 1.00 0.00 N ATOM 106 CA ARG A 9 4.350 -6.116 1.810 1.00 0.00 C ATOM 107 C ARG A 9 2.927 -6.084 2.369 1.00 0.00 C ATOM 108 O ARG A 9 2.274 -7.104 2.478 1.00 0.00 O ATOM 109 CB ARG A 9 4.284 -6.348 0.300 1.00 0.00 C ATOM 110 CG ARG A 9 3.893 -5.043 -0.398 1.00 0.00 C ATOM 111 CD ARG A 9 3.656 -5.305 -1.885 1.00 0.00 C ATOM 112 NE ARG A 9 4.910 -5.817 -2.509 1.00 0.00 N ATOM 113 CZ ARG A 9 5.073 -7.099 -2.706 1.00 0.00 C ATOM 114 NH1 ARG A 9 4.144 -7.945 -2.352 1.00 0.00 N ATOM 115 NH2 ARG A 9 6.172 -7.534 -3.259 1.00 0.00 N ATOM 0 H ARG A 9 5.135 -8.096 1.910 1.00 0.00 H new ATOM 0 HA ARG A 9 4.860 -5.174 2.010 1.00 0.00 H new ATOM 0 HB2 ARG A 9 5.249 -6.695 -0.068 1.00 0.00 H new ATOM 0 HB3 ARG A 9 3.557 -7.127 0.072 1.00 0.00 H new ATOM 0 HG2 ARG A 9 2.992 -4.632 0.057 1.00 0.00 H new ATOM 0 HG3 ARG A 9 4.681 -4.301 -0.271 1.00 0.00 H new ATOM 0 HD2 ARG A 9 2.852 -6.030 -2.013 1.00 0.00 H new ATOM 0 HD3 ARG A 9 3.340 -4.387 -2.380 1.00 0.00 H new ATOM 0 HE ARG A 9 5.644 -5.164 -2.783 1.00 0.00 H new ATOM 0 HH11 ARG A 9 3.285 -7.607 -1.919 1.00 0.00 H new ATOM 0 HH12 ARG A 9 4.277 -8.944 -2.509 1.00 0.00 H new ATOM 0 HH21 ARG A 9 6.899 -6.875 -3.536 1.00 0.00 H new ATOM 0 HH22 ARG A 9 6.304 -8.533 -3.415 1.00 0.00 H new ATOM 129 N ALA A 10 2.436 -4.933 2.727 1.00 0.00 N ATOM 130 CA ALA A 10 1.053 -4.868 3.276 1.00 0.00 C ATOM 131 C ALA A 10 0.390 -3.564 2.853 1.00 0.00 C ATOM 132 O ALA A 10 1.044 -2.592 2.542 1.00 0.00 O ATOM 133 CB ALA A 10 1.102 -4.925 4.801 1.00 0.00 C ATOM 0 H ALA A 10 2.926 -4.041 2.665 1.00 0.00 H new ATOM 0 HA ALA A 10 0.481 -5.713 2.892 1.00 0.00 H new ATOM 0 HB1 ALA A 10 0.089 -4.877 5.200 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.572 -5.857 5.115 1.00 0.00 H new ATOM 0 HB3 ALA A 10 1.680 -4.082 5.178 1.00 0.00 H new ATOM 139 N CYS A 11 -0.911 -3.534 2.851 1.00 0.00 N ATOM 140 CA CYS A 11 -1.610 -2.285 2.457 1.00 0.00 C ATOM 141 C CYS A 11 -2.935 -2.175 3.212 1.00 0.00 C ATOM 142 O CYS A 11 -3.784 -3.040 3.125 1.00 0.00 O ATOM 143 CB CYS A 11 -1.880 -2.316 0.956 1.00 0.00 C ATOM 144 SG CYS A 11 -0.534 -1.472 0.085 1.00 0.00 S ATOM 0 H CYS A 11 -1.516 -4.315 3.103 1.00 0.00 H new ATOM 0 HA CYS A 11 -0.986 -1.425 2.702 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -1.961 -3.347 0.611 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -2.831 -1.831 0.736 1.00 0.00 H new ATOM 0 HG CYS A 11 0.568 -1.597 0.764 1.00 0.00 H new ATOM 150 N GLY A 12 -3.120 -1.108 3.934 1.00 0.00 N ATOM 151 CA GLY A 12 -4.393 -0.919 4.685 1.00 0.00 C ATOM 152 C GLY A 12 -5.046 0.370 4.197 1.00 0.00 C ATOM 153 O GLY A 12 -4.494 1.069 3.371 1.00 0.00 O ATOM 0 H GLY A 12 -2.441 -0.354 4.038 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -5.059 -1.767 4.525 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -4.198 -0.865 5.756 1.00 0.00 H new ATOM 157 N LEU A 13 -6.214 0.698 4.679 1.00 0.00 N ATOM 158 CA LEU A 13 -6.865 1.949 4.196 1.00 0.00 C ATOM 159 C LEU A 13 -7.215 2.877 5.351 1.00 0.00 C ATOM 160 O LEU A 13 -8.060 2.574 6.173 1.00 0.00 O ATOM 161 CB LEU A 13 -8.165 1.600 3.458 1.00 0.00 C ATOM 162 CG LEU A 13 -8.030 1.901 1.961 1.00 0.00 C ATOM 163 CD1 LEU A 13 -9.394 1.764 1.275 1.00 0.00 C ATOM 164 CD2 LEU A 13 -7.520 3.328 1.764 1.00 0.00 C ATOM 0 H LEU A 13 -6.738 0.165 5.373 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.161 2.452 3.534 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.401 0.546 3.603 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.993 2.172 3.877 1.00 0.00 H new ATOM 0 HG LEU A 13 -7.326 1.193 1.524 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -9.290 1.979 0.212 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.766 0.748 1.405 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.098 2.467 1.720 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -7.426 3.537 0.698 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.223 4.031 2.211 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -6.546 3.436 2.242 1.00 0.00 H new ATOM 176 N ILE A 14 -6.632 4.045 5.381 1.00 0.00 N ATOM 177 CA ILE A 14 -7.011 5.013 6.434 1.00 0.00 C ATOM 178 C ILE A 14 -8.265 5.702 5.914 1.00 0.00 C ATOM 179 O ILE A 14 -8.224 6.522 5.020 1.00 0.00 O ATOM 180 CB ILE A 14 -5.885 6.018 6.685 1.00 0.00 C ATOM 181 CG1 ILE A 14 -4.715 5.291 7.354 1.00 0.00 C ATOM 182 CG2 ILE A 14 -6.387 7.135 7.604 1.00 0.00 C ATOM 183 CD1 ILE A 14 -3.507 6.226 7.452 1.00 0.00 C ATOM 0 H ILE A 14 -5.917 4.363 4.726 1.00 0.00 H new ATOM 0 HA ILE A 14 -7.192 4.523 7.391 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.560 6.453 5.740 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -5.006 4.954 8.349 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -4.452 4.402 6.780 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -5.583 7.849 7.781 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -7.227 7.644 7.132 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -6.708 6.708 8.554 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.679 5.702 7.929 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.209 6.541 6.452 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.772 7.102 8.045 1.00 0.00 H new ATOM 195 N ILE A 15 -9.385 5.302 6.425 1.00 0.00 N ATOM 196 CA ILE A 15 -10.684 5.833 5.944 1.00 0.00 C ATOM 197 C ILE A 15 -11.118 7.037 6.762 1.00 0.00 C ATOM 198 O ILE A 15 -10.904 7.102 7.952 1.00 0.00 O ATOM 199 CB ILE A 15 -11.688 4.701 6.099 1.00 0.00 C ATOM 200 CG1 ILE A 15 -11.280 3.560 5.169 1.00 0.00 C ATOM 201 CG2 ILE A 15 -13.103 5.162 5.773 1.00 0.00 C ATOM 202 CD1 ILE A 15 -12.000 2.278 5.576 1.00 0.00 C ATOM 0 H ILE A 15 -9.459 4.613 7.174 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.609 6.165 4.909 1.00 0.00 H new ATOM 0 HB ILE A 15 -11.686 4.365 7.136 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -11.525 3.814 4.138 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -10.201 3.411 5.213 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -13.794 4.328 5.894 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -13.387 5.970 6.448 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -13.141 5.519 4.744 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -11.705 1.468 4.909 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -11.733 2.020 6.601 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -13.077 2.429 5.509 1.00 0.00 H new ATOM 214 N PHE A 16 -11.730 7.998 6.130 1.00 0.00 N ATOM 215 CA PHE A 16 -12.175 9.195 6.880 1.00 0.00 C ATOM 216 C PHE A 16 -13.519 9.691 6.346 1.00 0.00 C ATOM 217 O PHE A 16 -13.655 10.025 5.189 1.00 0.00 O ATOM 218 CB PHE A 16 -11.134 10.304 6.723 1.00 0.00 C ATOM 219 CG PHE A 16 -11.081 10.751 5.280 1.00 0.00 C ATOM 220 CD1 PHE A 16 -11.909 11.790 4.840 1.00 0.00 C ATOM 221 CD2 PHE A 16 -10.199 10.130 4.387 1.00 0.00 C ATOM 222 CE1 PHE A 16 -11.855 12.209 3.504 1.00 0.00 C ATOM 223 CE2 PHE A 16 -10.145 10.550 3.050 1.00 0.00 C ATOM 224 CZ PHE A 16 -10.974 11.589 2.608 1.00 0.00 C ATOM 0 H PHE A 16 -11.939 8.003 5.132 1.00 0.00 H new ATOM 0 HA PHE A 16 -12.287 8.930 7.931 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.387 11.147 7.366 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -10.155 9.944 7.039 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -12.589 12.268 5.529 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -9.561 9.328 4.728 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -12.493 13.011 3.164 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -9.464 10.072 2.361 1.00 0.00 H new ATOM 0 HZ PHE A 16 -10.934 11.912 1.578 1.00 0.00 H new ATOM 234 N ARG A 17 -14.508 9.774 7.193 1.00 0.00 N ATOM 235 CA ARG A 17 -15.831 10.286 6.742 1.00 0.00 C ATOM 236 C ARG A 17 -15.794 11.814 6.741 1.00 0.00 C ATOM 237 O ARG A 17 -15.599 12.436 7.765 1.00 0.00 O ATOM 238 CB ARG A 17 -16.919 9.823 7.709 1.00 0.00 C ATOM 239 CG ARG A 17 -17.223 8.344 7.481 1.00 0.00 C ATOM 240 CD ARG A 17 -18.281 7.878 8.484 1.00 0.00 C ATOM 241 NE ARG A 17 -18.520 6.418 8.313 1.00 0.00 N ATOM 242 CZ ARG A 17 -19.308 5.782 9.134 1.00 0.00 C ATOM 243 NH1 ARG A 17 -19.877 6.418 10.123 1.00 0.00 N ATOM 244 NH2 ARG A 17 -19.521 4.505 8.968 1.00 0.00 N ATOM 0 H ARG A 17 -14.456 9.509 8.177 1.00 0.00 H new ATOM 0 HA ARG A 17 -16.046 9.909 5.742 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -16.595 9.982 8.738 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -17.822 10.415 7.564 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -17.579 8.188 6.463 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -16.314 7.753 7.595 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -17.949 8.086 9.501 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -19.209 8.429 8.332 1.00 0.00 H new ATOM 0 HE ARG A 17 -18.066 5.914 7.551 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -19.705 7.415 10.254 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -20.493 5.918 10.764 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -19.072 4.009 8.198 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -20.137 4.003 9.608 1.00 0.00 H new ATOM 258 N ARG A 18 -15.988 12.426 5.607 1.00 0.00 N ATOM 259 CA ARG A 18 -15.964 13.913 5.565 1.00 0.00 C ATOM 260 C ARG A 18 -17.394 14.446 5.680 1.00 0.00 C ATOM 261 O ARG A 18 -18.310 13.935 5.065 1.00 0.00 O ATOM 262 CB ARG A 18 -15.344 14.388 4.250 1.00 0.00 C ATOM 263 CG ARG A 18 -15.138 15.901 4.307 1.00 0.00 C ATOM 264 CD ARG A 18 -14.402 16.360 3.048 1.00 0.00 C ATOM 265 NE ARG A 18 -15.316 16.239 1.880 1.00 0.00 N ATOM 266 CZ ARG A 18 -16.184 17.182 1.632 1.00 0.00 C ATOM 267 NH1 ARG A 18 -16.239 18.239 2.396 1.00 0.00 N ATOM 268 NH2 ARG A 18 -16.997 17.067 0.617 1.00 0.00 N ATOM 0 H ARG A 18 -16.161 11.965 4.714 1.00 0.00 H new ATOM 0 HA ARG A 18 -15.365 14.287 6.396 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.391 13.886 4.081 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -15.993 14.129 3.414 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -16.100 16.408 4.384 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -14.565 16.168 5.195 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -14.071 17.392 3.161 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -13.510 15.754 2.892 1.00 0.00 H new ATOM 0 HE ARG A 18 -15.264 15.420 1.274 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -15.603 18.329 3.188 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -16.918 18.975 2.201 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -16.953 16.241 0.020 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -17.676 17.803 0.422 1.00 0.00 H new ATOM 282 N CYS A 19 -17.595 15.462 6.469 1.00 0.00 N ATOM 283 CA CYS A 19 -18.966 16.027 6.629 1.00 0.00 C ATOM 284 C CYS A 19 -19.138 17.225 5.689 1.00 0.00 C ATOM 285 O CYS A 19 -18.232 18.014 5.504 1.00 0.00 O ATOM 286 CB CYS A 19 -19.157 16.482 8.076 1.00 0.00 C ATOM 287 SG CYS A 19 -20.374 15.420 8.887 1.00 0.00 S ATOM 0 H CYS A 19 -16.868 15.928 7.012 1.00 0.00 H new ATOM 0 HA CYS A 19 -19.707 15.266 6.384 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -18.208 16.439 8.610 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -19.490 17.520 8.101 1.00 0.00 H new ATOM 0 HG CYS A 19 -21.228 14.989 8.007 1.00 0.00 H new ATOM 293 N LEU A 20 -20.293 17.370 5.095 1.00 0.00 N ATOM 294 CA LEU A 20 -20.516 18.517 4.169 1.00 0.00 C ATOM 295 C LEU A 20 -20.177 19.824 4.891 1.00 0.00 C ATOM 296 O LEU A 20 -19.547 20.704 4.338 1.00 0.00 O ATOM 297 CB LEU A 20 -21.986 18.536 3.736 1.00 0.00 C ATOM 298 CG LEU A 20 -22.195 19.627 2.682 1.00 0.00 C ATOM 299 CD1 LEU A 20 -21.546 19.199 1.361 1.00 0.00 C ATOM 300 CD2 LEU A 20 -23.695 19.844 2.464 1.00 0.00 C ATOM 0 H LEU A 20 -21.090 16.744 5.211 1.00 0.00 H new ATOM 0 HA LEU A 20 -19.879 18.412 3.291 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -22.269 17.565 3.330 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -22.627 18.721 4.598 1.00 0.00 H new ATOM 0 HG LEU A 20 -21.737 20.554 3.027 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -21.696 19.977 0.613 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -20.478 19.044 1.514 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -22.002 18.271 1.016 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -23.845 20.620 1.714 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -24.151 18.915 2.121 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -24.158 20.151 3.402 1.00 0.00 H new ATOM 312 N ILE A 21 -20.574 19.945 6.129 1.00 0.00 N ATOM 313 CA ILE A 21 -20.257 21.183 6.898 1.00 0.00 C ATOM 314 C ILE A 21 -20.047 20.805 8.369 1.00 0.00 C ATOM 315 O ILE A 21 -20.391 19.719 8.788 1.00 0.00 O ATOM 316 CB ILE A 21 -21.407 22.186 6.783 1.00 0.00 C ATOM 317 CG1 ILE A 21 -22.656 21.481 6.251 1.00 0.00 C ATOM 318 CG2 ILE A 21 -21.013 23.314 5.826 1.00 0.00 C ATOM 319 CD1 ILE A 21 -23.168 20.492 7.299 1.00 0.00 C ATOM 0 H ILE A 21 -21.104 19.240 6.641 1.00 0.00 H new ATOM 0 HA ILE A 21 -19.354 21.643 6.496 1.00 0.00 H new ATOM 0 HB ILE A 21 -21.618 22.602 7.768 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -23.429 22.214 6.018 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -22.424 20.957 5.324 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -21.834 24.027 5.746 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -20.127 23.822 6.207 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -20.797 22.898 4.842 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -24.058 19.989 6.921 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -22.395 19.753 7.510 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -23.416 21.028 8.215 1.00 0.00 H new ATOM 331 N PRO A 22 -19.476 21.685 9.147 1.00 0.00 N ATOM 332 CA PRO A 22 -19.208 21.422 10.593 1.00 0.00 C ATOM 333 C PRO A 22 -20.486 21.232 11.413 1.00 0.00 C ATOM 334 O PRO A 22 -21.518 21.801 11.124 1.00 0.00 O ATOM 335 CB PRO A 22 -18.462 22.666 11.079 1.00 0.00 C ATOM 336 CG PRO A 22 -18.037 23.400 9.851 1.00 0.00 C ATOM 337 CD PRO A 22 -19.021 23.019 8.747 1.00 0.00 C ATOM 0 HA PRO A 22 -18.645 20.497 10.715 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -19.105 23.288 11.702 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -17.600 22.391 11.687 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -18.045 24.477 10.022 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -17.019 23.129 9.572 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -19.849 23.725 8.685 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -18.541 23.004 7.768 1.00 0.00 H new ATOM 345 N LYS A 23 -20.409 20.448 12.453 1.00 0.00 N ATOM 346 CA LYS A 23 -21.598 20.228 13.320 1.00 0.00 C ATOM 347 C LYS A 23 -21.347 20.922 14.659 1.00 0.00 C ATOM 348 O LYS A 23 -21.802 22.021 14.900 1.00 0.00 O ATOM 349 CB LYS A 23 -21.787 18.726 13.540 1.00 0.00 C ATOM 350 CG LYS A 23 -21.530 17.986 12.223 1.00 0.00 C ATOM 351 CD LYS A 23 -22.492 18.484 11.139 1.00 0.00 C ATOM 352 CE LYS A 23 -22.083 17.897 9.790 1.00 0.00 C ATOM 353 NZ LYS A 23 -22.703 16.554 9.620 1.00 0.00 N ATOM 0 H LYS A 23 -19.568 19.948 12.740 1.00 0.00 H new ATOM 0 HA LYS A 23 -22.495 20.634 12.853 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -21.102 18.370 14.310 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -22.798 18.523 13.894 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -20.499 18.143 11.905 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -21.659 16.914 12.369 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -23.514 18.191 11.381 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -22.475 19.573 11.094 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -22.399 18.559 8.984 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -20.998 17.818 9.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -21.969 15.862 9.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -23.159 16.267 10.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -23.415 16.594 8.863 1.00 0.00 H new ATOM 367 N VAL A 24 -20.594 20.297 15.521 1.00 0.00 N ATOM 368 CA VAL A 24 -20.276 20.925 16.833 1.00 0.00 C ATOM 369 C VAL A 24 -18.932 21.637 16.695 1.00 0.00 C ATOM 370 O VAL A 24 -18.311 22.025 17.665 1.00 0.00 O ATOM 371 CB VAL A 24 -20.176 19.850 17.917 1.00 0.00 C ATOM 372 CG1 VAL A 24 -20.954 20.299 19.155 1.00 0.00 C ATOM 373 CG2 VAL A 24 -20.761 18.537 17.391 1.00 0.00 C ATOM 0 H VAL A 24 -20.184 19.375 15.372 1.00 0.00 H new ATOM 0 HA VAL A 24 -21.059 21.629 17.114 1.00 0.00 H new ATOM 0 HB VAL A 24 -19.130 19.699 18.183 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -20.883 19.533 19.927 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -20.534 21.232 19.530 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -22.001 20.452 18.891 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -20.689 17.771 18.164 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -21.807 18.686 17.124 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -20.204 18.217 16.511 1.00 0.00 H new ATOM 383 N ASP A 25 -18.477 21.788 15.482 1.00 0.00 N ATOM 384 CA ASP A 25 -17.172 22.453 15.245 1.00 0.00 C ATOM 385 C ASP A 25 -16.071 21.686 15.970 1.00 0.00 C ATOM 386 O ASP A 25 -15.234 22.258 16.638 1.00 0.00 O ATOM 387 CB ASP A 25 -17.218 23.895 15.744 1.00 0.00 C ATOM 388 CG ASP A 25 -18.266 24.671 14.943 1.00 0.00 C ATOM 389 OD1 ASP A 25 -18.662 24.184 13.898 1.00 0.00 O ATOM 390 OD2 ASP A 25 -18.655 25.738 15.388 1.00 0.00 O ATOM 0 H ASP A 25 -18.960 21.475 14.640 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.963 22.460 14.175 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -17.464 23.917 16.806 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -16.239 24.362 15.634 1.00 0.00 H new ATOM 396 N ASN A 26 -16.055 20.391 15.825 1.00 0.00 N ATOM 397 CA ASN A 26 -14.998 19.584 16.484 1.00 0.00 C ATOM 398 C ASN A 26 -14.858 18.247 15.769 1.00 0.00 C ATOM 399 O ASN A 26 -15.790 17.475 15.671 1.00 0.00 O ATOM 400 CB ASN A 26 -15.338 19.331 17.951 1.00 0.00 C ATOM 401 CG ASN A 26 -16.116 18.021 18.077 1.00 0.00 C ATOM 402 OD1 ASN A 26 -17.399 18.017 17.869 1.00 0.00 O flip ATOM 403 ND2 ASN A 26 -15.544 16.987 18.363 1.00 0.00 N flip ATOM 0 H ASN A 26 -16.730 19.858 15.277 1.00 0.00 H new ATOM 0 HA ASN A 26 -14.062 20.139 16.432 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -14.424 19.282 18.544 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -15.930 20.157 18.346 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -14.537 16.989 18.526 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -16.071 16.117 18.440 1.00 0.00 H new ATOM 410 N ASN A 27 -13.690 17.982 15.274 1.00 0.00 N ATOM 411 CA ASN A 27 -13.443 16.700 14.565 1.00 0.00 C ATOM 412 C ASN A 27 -14.335 16.603 13.333 1.00 0.00 C ATOM 413 O ASN A 27 -15.007 15.616 13.116 1.00 0.00 O ATOM 414 CB ASN A 27 -13.725 15.525 15.499 1.00 0.00 C ATOM 415 CG ASN A 27 -12.841 15.638 16.743 1.00 0.00 C ATOM 416 OD1 ASN A 27 -13.302 15.446 17.848 1.00 0.00 O ATOM 417 ND2 ASN A 27 -11.580 15.945 16.605 1.00 0.00 N ATOM 0 H ASN A 27 -12.884 18.605 15.330 1.00 0.00 H new ATOM 0 HA ASN A 27 -12.399 16.667 14.252 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -14.776 15.519 15.786 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -13.530 14.584 14.985 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -10.981 16.024 17.427 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -11.193 16.106 15.675 1.00 0.00 H new ATOM 424 N ALA A 28 -14.346 17.615 12.511 1.00 0.00 N ATOM 425 CA ALA A 28 -15.191 17.564 11.288 1.00 0.00 C ATOM 426 C ALA A 28 -14.944 16.237 10.576 1.00 0.00 C ATOM 427 O ALA A 28 -15.802 15.717 9.890 1.00 0.00 O ATOM 428 CB ALA A 28 -14.791 18.706 10.348 1.00 0.00 C ATOM 0 H ALA A 28 -13.808 18.473 12.634 1.00 0.00 H new ATOM 0 HA ALA A 28 -16.242 17.659 11.561 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -15.408 18.672 9.450 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -14.937 19.661 10.853 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -13.742 18.599 10.071 1.00 0.00 H new ATOM 434 N ILE A 29 -13.768 15.692 10.725 1.00 0.00 N ATOM 435 CA ILE A 29 -13.448 14.410 10.047 1.00 0.00 C ATOM 436 C ILE A 29 -13.222 13.294 11.069 1.00 0.00 C ATOM 437 O ILE A 29 -12.565 13.471 12.076 1.00 0.00 O ATOM 438 CB ILE A 29 -12.192 14.604 9.197 1.00 0.00 C ATOM 439 CG1 ILE A 29 -12.533 15.512 8.016 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.705 13.253 8.681 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.304 16.336 7.626 1.00 0.00 C ATOM 0 H ILE A 29 -13.014 16.083 11.290 1.00 0.00 H new ATOM 0 HA ILE A 29 -14.287 14.120 9.414 1.00 0.00 H new ATOM 0 HB ILE A 29 -11.405 15.058 9.799 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -12.865 14.913 7.168 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.358 16.174 8.280 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.810 13.396 8.076 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.473 12.603 9.525 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -12.484 12.793 8.073 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.551 16.982 6.784 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -10.992 16.947 8.473 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -10.492 15.666 7.343 1.00 0.00 H new ATOM 453 N GLU A 30 -13.759 12.137 10.791 1.00 0.00 N ATOM 454 CA GLU A 30 -13.588 10.972 11.703 1.00 0.00 C ATOM 455 C GLU A 30 -12.948 9.838 10.900 1.00 0.00 C ATOM 456 O GLU A 30 -13.000 9.837 9.687 1.00 0.00 O ATOM 457 CB GLU A 30 -14.956 10.530 12.223 1.00 0.00 C ATOM 458 CG GLU A 30 -15.583 11.661 13.039 1.00 0.00 C ATOM 459 CD GLU A 30 -16.909 11.185 13.632 1.00 0.00 C ATOM 460 OE1 GLU A 30 -17.378 10.136 13.222 1.00 0.00 O ATOM 461 OE2 GLU A 30 -17.432 11.876 14.489 1.00 0.00 O ATOM 0 H GLU A 30 -14.317 11.948 9.958 1.00 0.00 H new ATOM 0 HA GLU A 30 -12.958 11.236 12.552 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -15.606 10.266 11.389 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.851 9.637 12.840 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -14.905 11.968 13.836 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -15.747 12.533 12.406 1.00 0.00 H new ATOM 469 N PHE A 31 -12.337 8.885 11.549 1.00 0.00 N ATOM 470 CA PHE A 31 -11.681 7.778 10.789 1.00 0.00 C ATOM 471 C PHE A 31 -12.288 6.420 11.163 1.00 0.00 C ATOM 472 O PHE A 31 -12.777 6.223 12.257 1.00 0.00 O ATOM 473 CB PHE A 31 -10.186 7.765 11.114 1.00 0.00 C ATOM 474 CG PHE A 31 -9.562 9.083 10.708 1.00 0.00 C ATOM 475 CD1 PHE A 31 -9.179 9.294 9.381 1.00 0.00 C ATOM 476 CD2 PHE A 31 -9.361 10.085 11.663 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.596 10.510 9.005 1.00 0.00 C ATOM 478 CE2 PHE A 31 -8.777 11.304 11.286 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.395 11.514 9.955 1.00 0.00 C ATOM 0 H PHE A 31 -12.263 8.823 12.564 1.00 0.00 H new ATOM 0 HA PHE A 31 -11.838 7.947 9.724 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.038 7.595 12.180 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -9.697 6.944 10.589 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -9.333 8.519 8.645 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -9.655 9.921 12.689 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -8.301 10.672 7.979 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -8.622 12.080 12.022 1.00 0.00 H new ATOM 0 HZ PHE A 31 -7.945 12.452 9.663 1.00 0.00 H new ATOM 489 N LEU A 32 -12.241 5.469 10.261 1.00 0.00 N ATOM 490 CA LEU A 32 -12.796 4.117 10.574 1.00 0.00 C ATOM 491 C LEU A 32 -11.747 3.320 11.350 1.00 0.00 C ATOM 492 O LEU A 32 -10.617 3.187 10.926 1.00 0.00 O ATOM 493 CB LEU A 32 -13.146 3.367 9.279 1.00 0.00 C ATOM 494 CG LEU A 32 -13.532 1.923 9.621 1.00 0.00 C ATOM 495 CD1 LEU A 32 -14.728 1.930 10.570 1.00 0.00 C ATOM 496 CD2 LEU A 32 -13.905 1.168 8.342 1.00 0.00 C ATOM 0 H LEU A 32 -11.844 5.571 9.327 1.00 0.00 H new ATOM 0 HA LEU A 32 -13.702 4.231 11.169 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -13.970 3.865 8.768 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.295 3.377 8.598 1.00 0.00 H new ATOM 0 HG LEU A 32 -12.686 1.428 10.098 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.004 0.904 10.815 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.464 2.463 11.484 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.570 2.428 10.090 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.178 0.143 8.591 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.749 1.662 7.861 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.053 1.161 7.662 1.00 0.00 H new ATOM 508 N LEU A 33 -12.116 2.796 12.487 1.00 0.00 N ATOM 509 CA LEU A 33 -11.145 2.006 13.299 1.00 0.00 C ATOM 510 C LEU A 33 -11.744 0.640 13.635 1.00 0.00 C ATOM 511 O LEU A 33 -12.886 0.535 14.028 1.00 0.00 O ATOM 512 CB LEU A 33 -10.830 2.763 14.592 1.00 0.00 C ATOM 513 CG LEU A 33 -9.687 3.746 14.340 1.00 0.00 C ATOM 514 CD1 LEU A 33 -9.645 4.789 15.459 1.00 0.00 C ATOM 515 CD2 LEU A 33 -8.363 2.980 14.316 1.00 0.00 C ATOM 0 H LEU A 33 -13.049 2.881 12.890 1.00 0.00 H new ATOM 0 HA LEU A 33 -10.227 1.863 12.729 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -11.715 3.298 14.938 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -10.554 2.061 15.379 1.00 0.00 H new ATOM 0 HG LEU A 33 -9.844 4.247 13.385 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.829 5.487 15.275 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.589 5.333 15.485 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.487 4.290 16.415 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -7.543 3.676 14.137 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -8.213 2.482 15.274 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -8.388 2.236 13.520 1.00 0.00 H new ATOM 527 N LEU A 34 -10.978 -0.410 13.479 1.00 0.00 N ATOM 528 CA LEU A 34 -11.502 -1.772 13.782 1.00 0.00 C ATOM 529 C LEU A 34 -10.858 -2.304 15.069 1.00 0.00 C ATOM 530 O LEU A 34 -9.694 -2.074 15.335 1.00 0.00 O ATOM 531 CB LEU A 34 -11.173 -2.703 12.614 1.00 0.00 C ATOM 532 CG LEU A 34 -11.735 -2.103 11.326 1.00 0.00 C ATOM 533 CD1 LEU A 34 -11.422 -3.021 10.144 1.00 0.00 C ATOM 534 CD2 LEU A 34 -13.250 -1.956 11.462 1.00 0.00 C ATOM 0 H LEU A 34 -10.011 -0.381 13.154 1.00 0.00 H new ATOM 0 HA LEU A 34 -12.582 -1.726 13.922 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -10.094 -2.834 12.529 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -11.601 -3.690 12.787 1.00 0.00 H new ATOM 0 HG LEU A 34 -11.280 -1.128 11.153 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.826 -2.587 9.229 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -10.342 -3.133 10.047 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -11.875 -3.998 10.312 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -13.658 -1.528 10.546 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -13.696 -2.935 11.635 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.478 -1.300 12.302 1.00 0.00 H new ATOM 546 N GLN A 35 -11.609 -3.010 15.870 1.00 0.00 N ATOM 547 CA GLN A 35 -11.046 -3.555 17.140 1.00 0.00 C ATOM 548 C GLN A 35 -10.667 -5.024 16.964 1.00 0.00 C ATOM 549 O GLN A 35 -11.477 -5.838 16.570 1.00 0.00 O ATOM 550 CB GLN A 35 -12.095 -3.454 18.246 1.00 0.00 C ATOM 551 CG GLN A 35 -11.477 -3.903 19.572 1.00 0.00 C ATOM 552 CD GLN A 35 -12.541 -3.850 20.673 1.00 0.00 C ATOM 553 OE1 GLN A 35 -13.718 -3.363 20.399 1.00 0.00 O flip ATOM 554 NE2 GLN A 35 -12.298 -4.259 21.792 1.00 0.00 N flip ATOM 0 H GLN A 35 -12.590 -3.234 15.700 1.00 0.00 H new ATOM 0 HA GLN A 35 -10.159 -2.978 17.403 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -12.456 -2.429 18.328 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.956 -4.076 18.004 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -11.085 -4.916 19.479 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -10.637 -3.258 19.831 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -11.377 -4.640 22.007 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -13.016 -4.221 22.516 1.00 0.00 H new ATOM 563 N ALA A 36 -9.448 -5.373 17.269 1.00 0.00 N ATOM 564 CA ALA A 36 -9.031 -6.794 17.135 1.00 0.00 C ATOM 565 C ALA A 36 -9.800 -7.629 18.162 1.00 0.00 C ATOM 566 O ALA A 36 -9.996 -7.217 19.287 1.00 0.00 O ATOM 567 CB ALA A 36 -7.529 -6.919 17.402 1.00 0.00 C ATOM 0 H ALA A 36 -8.725 -4.736 17.604 1.00 0.00 H new ATOM 0 HA ALA A 36 -9.245 -7.148 16.127 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.227 -7.962 17.303 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -6.980 -6.312 16.682 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -7.309 -6.572 18.412 1.00 0.00 H new ATOM 573 N SER A 37 -10.234 -8.801 17.790 1.00 0.00 N ATOM 574 CA SER A 37 -10.987 -9.652 18.758 1.00 0.00 C ATOM 575 C SER A 37 -9.996 -10.362 19.674 1.00 0.00 C ATOM 576 O SER A 37 -10.372 -11.074 20.583 1.00 0.00 O ATOM 577 CB SER A 37 -11.805 -10.693 17.995 1.00 0.00 C ATOM 578 OG SER A 37 -10.933 -11.712 17.521 1.00 0.00 O ATOM 0 H SER A 37 -10.102 -9.206 16.863 1.00 0.00 H new ATOM 0 HA SER A 37 -11.657 -9.028 19.350 1.00 0.00 H new ATOM 0 HB2 SER A 37 -12.567 -11.122 18.645 1.00 0.00 H new ATOM 0 HB3 SER A 37 -12.325 -10.224 17.160 1.00 0.00 H new ATOM 0 HG SER A 37 -11.061 -11.830 16.557 1.00 0.00 H new ATOM 584 N ASP A 38 -8.731 -10.168 19.445 1.00 0.00 N ATOM 585 CA ASP A 38 -7.708 -10.828 20.298 1.00 0.00 C ATOM 586 C ASP A 38 -6.532 -9.883 20.512 1.00 0.00 C ATOM 587 O ASP A 38 -6.519 -8.768 20.023 1.00 0.00 O ATOM 588 CB ASP A 38 -7.218 -12.103 19.616 1.00 0.00 C ATOM 589 CG ASP A 38 -6.591 -11.753 18.268 1.00 0.00 C ATOM 590 OD1 ASP A 38 -6.524 -12.628 17.427 1.00 0.00 O ATOM 591 OD2 ASP A 38 -6.183 -10.614 18.103 1.00 0.00 O ATOM 0 H ASP A 38 -8.359 -9.578 18.701 1.00 0.00 H new ATOM 0 HA ASP A 38 -8.151 -11.079 21.262 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -6.488 -12.608 20.248 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -8.049 -12.794 19.474 1.00 0.00 H new ATOM 597 N GLY A 39 -5.545 -10.318 21.238 1.00 0.00 N ATOM 598 CA GLY A 39 -4.369 -9.443 21.486 1.00 0.00 C ATOM 599 C GLY A 39 -4.749 -8.379 22.515 1.00 0.00 C ATOM 600 O GLY A 39 -5.602 -8.589 23.355 1.00 0.00 O ATOM 0 H GLY A 39 -5.501 -11.241 21.671 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.529 -10.035 21.849 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -4.048 -8.971 20.557 1.00 0.00 H new ATOM 604 N ILE A 40 -4.127 -7.240 22.455 1.00 0.00 N ATOM 605 CA ILE A 40 -4.460 -6.165 23.430 1.00 0.00 C ATOM 606 C ILE A 40 -5.707 -5.412 22.953 1.00 0.00 C ATOM 607 O ILE A 40 -6.132 -4.447 23.559 1.00 0.00 O ATOM 608 CB ILE A 40 -3.275 -5.197 23.552 1.00 0.00 C ATOM 609 CG1 ILE A 40 -3.215 -4.281 22.326 1.00 0.00 C ATOM 610 CG2 ILE A 40 -1.971 -5.994 23.635 1.00 0.00 C ATOM 611 CD1 ILE A 40 -2.045 -3.313 22.490 1.00 0.00 C ATOM 0 H ILE A 40 -3.404 -7.004 21.776 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.661 -6.606 24.407 1.00 0.00 H new ATOM 0 HB ILE A 40 -3.405 -4.595 24.451 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -3.091 -4.873 21.419 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -4.149 -3.729 22.221 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -1.129 -5.307 23.722 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -1.998 -6.646 24.508 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -1.855 -6.597 22.735 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -1.992 -2.655 21.622 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -2.191 -2.715 23.390 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -1.116 -3.876 22.575 1.00 0.00 H new ATOM 623 N HIS A 41 -6.293 -5.848 21.867 1.00 0.00 N ATOM 624 CA HIS A 41 -7.509 -5.165 21.335 1.00 0.00 C ATOM 625 C HIS A 41 -7.115 -3.791 20.797 1.00 0.00 C ATOM 626 O HIS A 41 -7.848 -2.831 20.918 1.00 0.00 O ATOM 627 CB HIS A 41 -8.548 -5.000 22.452 1.00 0.00 C ATOM 628 CG HIS A 41 -8.571 -6.238 23.305 1.00 0.00 C ATOM 629 ND1 HIS A 41 -8.770 -7.503 22.769 1.00 0.00 N ATOM 630 CD2 HIS A 41 -8.425 -6.424 24.656 1.00 0.00 C ATOM 631 CE1 HIS A 41 -8.735 -8.384 23.784 1.00 0.00 C ATOM 632 NE2 HIS A 41 -8.528 -7.777 24.953 1.00 0.00 N ATOM 0 H HIS A 41 -5.979 -6.652 21.324 1.00 0.00 H new ATOM 0 HA HIS A 41 -7.941 -5.766 20.535 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -8.306 -4.130 23.062 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -9.534 -4.824 22.022 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -8.256 -5.639 25.378 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -8.859 -9.450 23.667 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -8.460 -8.214 25.872 1.00 0.00 H new ATOM 641 N HIS A 42 -5.956 -3.693 20.201 1.00 0.00 N ATOM 642 CA HIS A 42 -5.504 -2.383 19.652 1.00 0.00 C ATOM 643 C HIS A 42 -6.440 -1.962 18.515 1.00 0.00 C ATOM 644 O HIS A 42 -7.058 -2.785 17.872 1.00 0.00 O ATOM 645 CB HIS A 42 -4.076 -2.524 19.117 1.00 0.00 C ATOM 646 CG HIS A 42 -4.044 -3.558 18.019 1.00 0.00 C ATOM 647 ND1 HIS A 42 -4.148 -4.921 18.279 1.00 0.00 N ATOM 648 CD2 HIS A 42 -3.914 -3.446 16.657 1.00 0.00 C ATOM 649 CE1 HIS A 42 -4.078 -5.563 17.097 1.00 0.00 C ATOM 650 NE2 HIS A 42 -3.938 -4.711 16.081 1.00 0.00 N ATOM 0 H HIS A 42 -5.303 -4.465 20.071 1.00 0.00 H new ATOM 0 HA HIS A 42 -5.524 -1.627 20.437 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -3.723 -1.565 18.737 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -3.402 -2.815 19.923 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -3.809 -2.517 16.116 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -4.129 -6.636 16.986 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -3.864 -4.939 15.090 1.00 0.00 H new ATOM 659 N TRP A 43 -6.552 -0.685 18.263 1.00 0.00 N ATOM 660 CA TRP A 43 -7.451 -0.219 17.171 1.00 0.00 C ATOM 661 C TRP A 43 -6.611 0.107 15.931 1.00 0.00 C ATOM 662 O TRP A 43 -5.603 0.779 16.014 1.00 0.00 O ATOM 663 CB TRP A 43 -8.194 1.040 17.620 1.00 0.00 C ATOM 664 CG TRP A 43 -9.069 0.731 18.793 1.00 0.00 C ATOM 665 CD1 TRP A 43 -8.666 0.720 20.084 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.490 0.404 18.806 1.00 0.00 C ATOM 667 NE1 TRP A 43 -9.748 0.404 20.889 1.00 0.00 N ATOM 668 CE2 TRP A 43 -10.894 0.202 20.146 1.00 0.00 C ATOM 669 CE3 TRP A 43 -11.458 0.264 17.795 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.209 -0.130 20.473 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -12.783 -0.066 18.120 1.00 0.00 C ATOM 672 CH2 TRP A 43 -13.158 -0.264 19.455 1.00 0.00 C ATOM 0 H TRP A 43 -6.060 0.053 18.766 1.00 0.00 H new ATOM 0 HA TRP A 43 -8.172 -1.002 16.935 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -7.479 1.818 17.885 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.797 1.428 16.799 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -7.664 0.924 20.431 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -9.704 0.330 21.905 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -11.180 0.411 16.762 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -12.492 -0.282 21.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -13.518 -0.168 17.336 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -14.179 -0.520 19.698 1.00 0.00 H new ATOM 683 N THR A 44 -7.019 -0.360 14.783 1.00 0.00 N ATOM 684 CA THR A 44 -6.244 -0.072 13.542 1.00 0.00 C ATOM 685 C THR A 44 -7.154 -0.226 12.325 1.00 0.00 C ATOM 686 O THR A 44 -8.082 -1.008 12.336 1.00 0.00 O ATOM 687 CB THR A 44 -5.083 -1.065 13.417 1.00 0.00 C ATOM 688 OG1 THR A 44 -5.303 -2.159 14.296 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.767 -0.378 13.779 1.00 0.00 C ATOM 0 H THR A 44 -7.855 -0.929 14.650 1.00 0.00 H new ATOM 0 HA THR A 44 -5.857 0.946 13.592 1.00 0.00 H new ATOM 0 HB THR A 44 -5.027 -1.424 12.389 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.654 -2.868 14.105 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.947 -1.091 13.688 1.00 0.00 H new ATOM 0 HG22 THR A 44 -3.596 0.460 13.103 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.817 -0.013 14.805 1.00 0.00 H new ATOM 697 N PRO A 45 -6.879 0.502 11.274 1.00 0.00 N ATOM 698 CA PRO A 45 -7.676 0.430 10.019 1.00 0.00 C ATOM 699 C PRO A 45 -7.503 -0.920 9.315 1.00 0.00 C ATOM 700 O PRO A 45 -6.573 -1.651 9.582 1.00 0.00 O ATOM 701 CB PRO A 45 -7.123 1.562 9.154 1.00 0.00 C ATOM 702 CG PRO A 45 -5.758 1.845 9.687 1.00 0.00 C ATOM 703 CD PRO A 45 -5.781 1.475 11.169 1.00 0.00 C ATOM 0 HA PRO A 45 -8.744 0.527 10.212 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -7.081 1.269 8.105 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.758 2.446 9.213 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -5.006 1.263 9.154 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -5.501 2.896 9.554 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.832 1.043 11.488 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.960 2.348 11.796 1.00 0.00 H new ATOM 711 N PRO A 46 -8.398 -1.242 8.428 1.00 0.00 N ATOM 712 CA PRO A 46 -8.364 -2.524 7.665 1.00 0.00 C ATOM 713 C PRO A 46 -6.961 -2.880 7.146 1.00 0.00 C ATOM 714 O PRO A 46 -6.517 -2.373 6.134 1.00 0.00 O ATOM 715 CB PRO A 46 -9.315 -2.262 6.496 1.00 0.00 C ATOM 716 CG PRO A 46 -10.272 -1.221 6.978 1.00 0.00 C ATOM 717 CD PRO A 46 -9.548 -0.409 8.050 1.00 0.00 C ATOM 0 HA PRO A 46 -8.648 -3.370 8.291 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -8.770 -1.916 5.618 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -9.840 -3.172 6.207 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -10.589 -0.579 6.156 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -11.171 -1.683 7.386 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -9.227 0.559 7.666 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -10.195 -0.214 8.905 1.00 0.00 H new ATOM 725 N LYS A 47 -6.262 -3.759 7.823 1.00 0.00 N ATOM 726 CA LYS A 47 -4.897 -4.151 7.347 1.00 0.00 C ATOM 727 C LYS A 47 -4.975 -5.503 6.630 1.00 0.00 C ATOM 728 O LYS A 47 -5.631 -6.420 7.084 1.00 0.00 O ATOM 729 CB LYS A 47 -3.930 -4.268 8.531 1.00 0.00 C ATOM 730 CG LYS A 47 -3.721 -2.899 9.176 1.00 0.00 C ATOM 731 CD LYS A 47 -2.539 -2.962 10.147 1.00 0.00 C ATOM 732 CE LYS A 47 -2.867 -3.930 11.287 1.00 0.00 C ATOM 733 NZ LYS A 47 -2.177 -3.487 12.531 1.00 0.00 N ATOM 0 H LYS A 47 -6.574 -4.219 8.678 1.00 0.00 H new ATOM 0 HA LYS A 47 -4.532 -3.385 6.663 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.326 -4.968 9.266 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.975 -4.669 8.192 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -3.533 -2.149 8.408 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.624 -2.594 9.706 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.641 -3.291 9.623 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -2.330 -1.970 10.547 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -3.944 -3.965 11.449 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.551 -4.939 11.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -1.598 -4.267 12.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -1.566 -2.673 12.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -2.885 -3.212 13.241 1.00 0.00 H new ATOM 747 N GLY A 48 -4.306 -5.637 5.519 1.00 0.00 N ATOM 748 CA GLY A 48 -4.337 -6.928 4.776 1.00 0.00 C ATOM 749 C GLY A 48 -2.987 -7.160 4.096 1.00 0.00 C ATOM 750 O GLY A 48 -2.093 -6.341 4.178 1.00 0.00 O ATOM 0 H GLY A 48 -3.737 -4.906 5.092 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -4.557 -7.748 5.460 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -5.133 -6.912 4.031 1.00 0.00 H new ATOM 754 N HIS A 49 -2.833 -8.268 3.422 1.00 0.00 N ATOM 755 CA HIS A 49 -1.542 -8.552 2.731 1.00 0.00 C ATOM 756 C HIS A 49 -1.765 -8.514 1.218 1.00 0.00 C ATOM 757 O HIS A 49 -2.755 -9.012 0.716 1.00 0.00 O ATOM 758 CB HIS A 49 -1.035 -9.934 3.150 1.00 0.00 C ATOM 759 CG HIS A 49 -0.736 -9.925 4.625 1.00 0.00 C ATOM 760 ND1 HIS A 49 -1.725 -10.117 5.580 1.00 0.00 N ATOM 761 CD2 HIS A 49 0.431 -9.742 5.324 1.00 0.00 C ATOM 762 CE1 HIS A 49 -1.139 -10.042 6.790 1.00 0.00 C ATOM 763 NE2 HIS A 49 0.170 -9.817 6.689 1.00 0.00 N ATOM 0 H HIS A 49 -3.547 -8.990 3.320 1.00 0.00 H new ATOM 0 HA HIS A 49 -0.800 -7.802 3.006 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -1.783 -10.693 2.923 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -0.138 -10.192 2.587 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -2.715 -10.284 5.398 1.00 0.00 H new ATOM 0 HD2 HIS A 49 1.401 -9.567 4.883 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -1.665 -10.151 7.727 1.00 0.00 H new ATOM 772 N VAL A 50 -0.862 -7.921 0.486 1.00 0.00 N ATOM 773 CA VAL A 50 -1.038 -7.841 -0.989 1.00 0.00 C ATOM 774 C VAL A 50 -0.474 -9.095 -1.652 1.00 0.00 C ATOM 775 O VAL A 50 0.580 -9.587 -1.303 1.00 0.00 O ATOM 776 CB VAL A 50 -0.316 -6.602 -1.539 1.00 0.00 C ATOM 777 CG1 VAL A 50 0.577 -6.000 -0.457 1.00 0.00 C ATOM 778 CG2 VAL A 50 0.536 -6.989 -2.752 1.00 0.00 C ATOM 0 H VAL A 50 -0.011 -7.489 0.847 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.103 -7.765 -1.210 1.00 0.00 H new ATOM 0 HB VAL A 50 -1.059 -5.865 -1.844 1.00 0.00 H new ATOM 0 HG11 VAL A 50 1.087 -5.122 -0.853 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.033 -5.711 0.399 1.00 0.00 H new ATOM 0 HG13 VAL A 50 1.316 -6.737 -0.143 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.045 -6.105 -3.136 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.275 -7.733 -2.455 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.105 -7.405 -3.529 1.00 0.00 H new ATOM 788 N GLU A 51 -1.177 -9.599 -2.619 1.00 0.00 N ATOM 789 CA GLU A 51 -0.715 -10.809 -3.342 1.00 0.00 C ATOM 790 C GLU A 51 0.485 -10.426 -4.226 1.00 0.00 C ATOM 791 O GLU A 51 0.969 -9.314 -4.169 1.00 0.00 O ATOM 792 CB GLU A 51 -1.878 -11.326 -4.197 1.00 0.00 C ATOM 793 CG GLU A 51 -2.198 -12.788 -3.855 1.00 0.00 C ATOM 794 CD GLU A 51 -3.323 -12.837 -2.825 1.00 0.00 C ATOM 795 OE1 GLU A 51 -3.152 -12.266 -1.763 1.00 0.00 O ATOM 796 OE2 GLU A 51 -4.336 -13.453 -3.114 1.00 0.00 O ATOM 0 H GLU A 51 -2.066 -9.219 -2.945 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.403 -11.591 -2.649 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -2.760 -10.708 -4.031 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.624 -11.242 -5.254 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.492 -13.327 -4.756 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.310 -13.283 -3.463 1.00 0.00 H new ATOM 804 N PRO A 52 0.973 -11.342 -5.026 1.00 0.00 N ATOM 805 CA PRO A 52 2.144 -11.090 -5.918 1.00 0.00 C ATOM 806 C PRO A 52 1.774 -10.198 -7.103 1.00 0.00 C ATOM 807 O PRO A 52 2.176 -9.054 -7.187 1.00 0.00 O ATOM 808 CB PRO A 52 2.540 -12.486 -6.401 1.00 0.00 C ATOM 809 CG PRO A 52 1.307 -13.317 -6.289 1.00 0.00 C ATOM 810 CD PRO A 52 0.460 -12.712 -5.176 1.00 0.00 C ATOM 0 HA PRO A 52 2.949 -10.568 -5.400 1.00 0.00 H new ATOM 0 HB2 PRO A 52 2.900 -12.457 -7.429 1.00 0.00 H new ATOM 0 HB3 PRO A 52 3.346 -12.897 -5.792 1.00 0.00 H new ATOM 0 HG2 PRO A 52 0.759 -13.322 -7.231 1.00 0.00 H new ATOM 0 HG3 PRO A 52 1.560 -14.353 -6.062 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -0.598 -12.713 -5.437 1.00 0.00 H new ATOM 0 HD3 PRO A 52 0.560 -13.277 -4.249 1.00 0.00 H new ATOM 818 N GLY A 53 0.998 -10.711 -8.018 1.00 0.00 N ATOM 819 CA GLY A 53 0.590 -9.891 -9.191 1.00 0.00 C ATOM 820 C GLY A 53 -0.584 -8.999 -8.787 1.00 0.00 C ATOM 821 O GLY A 53 -1.320 -8.506 -9.618 1.00 0.00 O ATOM 0 H GLY A 53 0.630 -11.662 -8.003 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.426 -9.281 -9.534 1.00 0.00 H new ATOM 0 HA3 GLY A 53 0.305 -10.537 -10.021 1.00 0.00 H new ATOM 825 N GLU A 54 -0.769 -8.792 -7.509 1.00 0.00 N ATOM 826 CA GLU A 54 -1.898 -7.936 -7.042 1.00 0.00 C ATOM 827 C GLU A 54 -1.430 -6.486 -6.929 1.00 0.00 C ATOM 828 O GLU A 54 -0.270 -6.214 -6.689 1.00 0.00 O ATOM 829 CB GLU A 54 -2.376 -8.407 -5.672 1.00 0.00 C ATOM 830 CG GLU A 54 -3.651 -7.653 -5.299 1.00 0.00 C ATOM 831 CD GLU A 54 -4.043 -7.977 -3.857 1.00 0.00 C ATOM 832 OE1 GLU A 54 -5.092 -7.519 -3.433 1.00 0.00 O ATOM 833 OE2 GLU A 54 -3.287 -8.671 -3.198 1.00 0.00 O ATOM 0 H GLU A 54 -0.185 -9.180 -6.768 1.00 0.00 H new ATOM 0 HA GLU A 54 -2.715 -8.008 -7.760 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -2.566 -9.480 -5.689 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -1.603 -8.231 -4.924 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -3.495 -6.580 -5.411 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.459 -7.930 -5.976 1.00 0.00 H new ATOM 841 N ASP A 55 -2.322 -5.547 -7.100 1.00 0.00 N ATOM 842 CA ASP A 55 -1.918 -4.122 -7.004 1.00 0.00 C ATOM 843 C ASP A 55 -1.707 -3.730 -5.545 1.00 0.00 C ATOM 844 O ASP A 55 -2.112 -4.422 -4.631 1.00 0.00 O ATOM 845 CB ASP A 55 -3.000 -3.216 -7.582 1.00 0.00 C ATOM 846 CG ASP A 55 -2.451 -1.794 -7.699 1.00 0.00 C ATOM 847 OD1 ASP A 55 -1.923 -1.469 -8.747 1.00 0.00 O ATOM 848 OD2 ASP A 55 -2.552 -1.059 -6.728 1.00 0.00 O ATOM 0 H ASP A 55 -3.309 -5.708 -7.301 1.00 0.00 H new ATOM 0 HA ASP A 55 -0.992 -4.002 -7.567 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.312 -3.580 -8.561 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.882 -3.227 -6.941 1.00 0.00 H new ATOM 854 N ASP A 56 -1.079 -2.613 -5.337 1.00 0.00 N ATOM 855 CA ASP A 56 -0.834 -2.134 -3.952 1.00 0.00 C ATOM 856 C ASP A 56 -2.128 -1.561 -3.369 1.00 0.00 C ATOM 857 O ASP A 56 -2.607 -2.004 -2.344 1.00 0.00 O ATOM 858 CB ASP A 56 0.236 -1.044 -3.991 1.00 0.00 C ATOM 859 CG ASP A 56 1.567 -1.657 -4.425 1.00 0.00 C ATOM 860 OD1 ASP A 56 2.444 -0.904 -4.816 1.00 0.00 O ATOM 861 OD2 ASP A 56 1.689 -2.871 -4.362 1.00 0.00 O ATOM 0 H ASP A 56 -0.721 -2.004 -6.073 1.00 0.00 H new ATOM 0 HA ASP A 56 -0.499 -2.962 -3.328 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -0.057 -0.255 -4.684 1.00 0.00 H new ATOM 0 HB3 ASP A 56 0.338 -0.583 -3.008 1.00 0.00 H new ATOM 867 N LEU A 57 -2.699 -0.579 -4.016 1.00 0.00 N ATOM 868 CA LEU A 57 -3.959 0.021 -3.496 1.00 0.00 C ATOM 869 C LEU A 57 -5.075 -1.025 -3.493 1.00 0.00 C ATOM 870 O LEU A 57 -5.816 -1.143 -2.540 1.00 0.00 O ATOM 871 CB LEU A 57 -4.362 1.205 -4.376 1.00 0.00 C ATOM 872 CG LEU A 57 -5.680 1.794 -3.866 1.00 0.00 C ATOM 873 CD1 LEU A 57 -5.518 2.241 -2.414 1.00 0.00 C ATOM 874 CD2 LEU A 57 -6.065 2.996 -4.728 1.00 0.00 C ATOM 0 H LEU A 57 -2.347 -0.168 -4.881 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.796 0.367 -2.475 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.581 1.966 -4.361 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.472 0.882 -5.411 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.461 1.036 -3.924 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -6.458 2.660 -2.055 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.243 1.385 -1.798 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.736 2.998 -2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -7.003 3.417 -4.367 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.282 3.752 -4.669 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -6.185 2.678 -5.764 1.00 0.00 H new ATOM 886 N GLU A 58 -5.203 -1.780 -4.548 1.00 0.00 N ATOM 887 CA GLU A 58 -6.278 -2.807 -4.597 1.00 0.00 C ATOM 888 C GLU A 58 -6.199 -3.674 -3.345 1.00 0.00 C ATOM 889 O GLU A 58 -7.205 -4.010 -2.750 1.00 0.00 O ATOM 890 CB GLU A 58 -6.092 -3.682 -5.837 1.00 0.00 C ATOM 891 CG GLU A 58 -6.517 -2.906 -7.091 1.00 0.00 C ATOM 892 CD GLU A 58 -5.903 -1.501 -7.087 1.00 0.00 C ATOM 893 OE1 GLU A 58 -4.795 -1.359 -6.604 1.00 0.00 O ATOM 894 OE2 GLU A 58 -6.557 -0.592 -7.571 1.00 0.00 O ATOM 0 H GLU A 58 -4.610 -1.730 -5.377 1.00 0.00 H new ATOM 0 HA GLU A 58 -7.251 -2.318 -4.644 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.050 -3.988 -5.924 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.685 -4.592 -5.743 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -6.201 -3.445 -7.984 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.604 -2.834 -7.130 1.00 0.00 H new ATOM 902 N THR A 59 -5.020 -4.023 -2.919 1.00 0.00 N ATOM 903 CA THR A 59 -4.915 -4.843 -1.685 1.00 0.00 C ATOM 904 C THR A 59 -5.574 -4.071 -0.552 1.00 0.00 C ATOM 905 O THR A 59 -6.331 -4.615 0.228 1.00 0.00 O ATOM 906 CB THR A 59 -3.449 -5.109 -1.357 1.00 0.00 C ATOM 907 OG1 THR A 59 -2.870 -5.850 -2.422 1.00 0.00 O ATOM 908 CG2 THR A 59 -3.354 -5.904 -0.051 1.00 0.00 C ATOM 0 H THR A 59 -4.136 -3.780 -3.365 1.00 0.00 H new ATOM 0 HA THR A 59 -5.411 -5.804 -1.825 1.00 0.00 H new ATOM 0 HB THR A 59 -2.915 -4.167 -1.235 1.00 0.00 H new ATOM 0 HG1 THR A 59 -2.772 -5.272 -3.207 1.00 0.00 H new ATOM 0 HG21 THR A 59 -2.307 -6.094 0.184 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.809 -5.331 0.757 1.00 0.00 H new ATOM 0 HG23 THR A 59 -3.879 -6.853 -0.164 1.00 0.00 H new ATOM 916 N ALA A 60 -5.323 -2.791 -0.477 1.00 0.00 N ATOM 917 CA ALA A 60 -5.968 -1.976 0.581 1.00 0.00 C ATOM 918 C ALA A 60 -7.475 -1.997 0.333 1.00 0.00 C ATOM 919 O ALA A 60 -8.270 -2.127 1.241 1.00 0.00 O ATOM 920 CB ALA A 60 -5.454 -0.537 0.500 1.00 0.00 C ATOM 0 H ALA A 60 -4.700 -2.280 -1.103 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.739 -2.377 1.568 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.928 0.063 1.277 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.373 -0.528 0.643 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -5.694 -0.119 -0.478 1.00 0.00 H new ATOM 926 N LEU A 61 -7.862 -1.884 -0.909 1.00 0.00 N ATOM 927 CA LEU A 61 -9.309 -1.904 -1.257 1.00 0.00 C ATOM 928 C LEU A 61 -9.923 -3.247 -0.860 1.00 0.00 C ATOM 929 O LEU A 61 -10.923 -3.311 -0.174 1.00 0.00 O ATOM 930 CB LEU A 61 -9.438 -1.751 -2.771 1.00 0.00 C ATOM 931 CG LEU A 61 -8.795 -0.443 -3.213 1.00 0.00 C ATOM 932 CD1 LEU A 61 -8.858 -0.352 -4.738 1.00 0.00 C ATOM 933 CD2 LEU A 61 -9.546 0.738 -2.595 1.00 0.00 C ATOM 0 H LEU A 61 -7.231 -1.778 -1.703 1.00 0.00 H new ATOM 0 HA LEU A 61 -9.822 -1.098 -0.732 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -8.958 -2.591 -3.273 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -10.489 -1.766 -3.059 1.00 0.00 H new ATOM 0 HG LEU A 61 -7.757 -0.413 -2.883 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -8.400 0.581 -5.066 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -8.320 -1.193 -5.175 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -9.899 -0.379 -5.061 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -9.082 1.671 -2.914 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -10.586 0.719 -2.922 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -9.506 0.666 -1.508 1.00 0.00 H new ATOM 945 N ARG A 62 -9.314 -4.320 -1.288 1.00 0.00 N ATOM 946 CA ARG A 62 -9.844 -5.673 -0.958 1.00 0.00 C ATOM 947 C ARG A 62 -9.870 -5.849 0.560 1.00 0.00 C ATOM 948 O ARG A 62 -10.812 -6.377 1.117 1.00 0.00 O ATOM 949 CB ARG A 62 -8.929 -6.735 -1.577 1.00 0.00 C ATOM 950 CG ARG A 62 -9.520 -8.128 -1.340 1.00 0.00 C ATOM 951 CD ARG A 62 -8.523 -9.196 -1.808 1.00 0.00 C ATOM 952 NE ARG A 62 -8.294 -9.060 -3.278 1.00 0.00 N ATOM 953 CZ ARG A 62 -8.786 -9.937 -4.114 1.00 0.00 C ATOM 954 NH1 ARG A 62 -9.482 -10.948 -3.673 1.00 0.00 N ATOM 955 NH2 ARG A 62 -8.579 -9.802 -5.393 1.00 0.00 N ATOM 0 H ARG A 62 -8.467 -4.316 -1.856 1.00 0.00 H new ATOM 0 HA ARG A 62 -10.853 -5.781 -1.355 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.817 -6.554 -2.646 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -7.934 -6.672 -1.137 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.744 -8.264 -0.282 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.461 -8.232 -1.881 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.580 -9.087 -1.272 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -8.907 -10.190 -1.580 1.00 0.00 H new ATOM 0 HE ARG A 62 -7.748 -8.275 -3.633 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.645 -11.057 -2.672 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -9.864 -11.629 -4.329 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -8.034 -9.013 -5.741 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -8.962 -10.485 -6.047 1.00 0.00 H new ATOM 969 N ALA A 63 -8.843 -5.407 1.232 1.00 0.00 N ATOM 970 CA ALA A 63 -8.801 -5.544 2.714 1.00 0.00 C ATOM 971 C ALA A 63 -9.830 -4.605 3.342 1.00 0.00 C ATOM 972 O ALA A 63 -10.468 -4.931 4.324 1.00 0.00 O ATOM 973 CB ALA A 63 -7.403 -5.179 3.214 1.00 0.00 C ATOM 0 H ALA A 63 -8.028 -4.955 0.816 1.00 0.00 H new ATOM 0 HA ALA A 63 -9.032 -6.572 2.994 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.367 -5.278 4.299 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.670 -5.848 2.764 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.174 -4.150 2.936 1.00 0.00 H new ATOM 979 N THR A 64 -9.995 -3.438 2.782 1.00 0.00 N ATOM 980 CA THR A 64 -10.976 -2.473 3.346 1.00 0.00 C ATOM 981 C THR A 64 -12.362 -3.115 3.388 1.00 0.00 C ATOM 982 O THR A 64 -13.046 -3.073 4.388 1.00 0.00 O ATOM 983 CB THR A 64 -11.020 -1.233 2.457 1.00 0.00 C ATOM 984 OG1 THR A 64 -9.706 -0.730 2.288 1.00 0.00 O ATOM 985 CG2 THR A 64 -11.892 -0.166 3.108 1.00 0.00 C ATOM 0 H THR A 64 -9.491 -3.112 1.957 1.00 0.00 H new ATOM 0 HA THR A 64 -10.677 -2.195 4.357 1.00 0.00 H new ATOM 0 HB THR A 64 -11.439 -1.498 1.486 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.276 -1.185 1.534 1.00 0.00 H new ATOM 0 HG21 THR A 64 -11.922 0.718 2.471 1.00 0.00 H new ATOM 0 HG22 THR A 64 -12.903 -0.552 3.239 1.00 0.00 H new ATOM 0 HG23 THR A 64 -11.476 0.101 4.080 1.00 0.00 H new ATOM 993 N GLN A 65 -12.780 -3.716 2.310 1.00 0.00 N ATOM 994 CA GLN A 65 -14.117 -4.369 2.295 1.00 0.00 C ATOM 995 C GLN A 65 -14.015 -5.727 2.979 1.00 0.00 C ATOM 996 O GLN A 65 -14.906 -6.156 3.686 1.00 0.00 O ATOM 997 CB GLN A 65 -14.584 -4.535 0.846 1.00 0.00 C ATOM 998 CG GLN A 65 -15.041 -5.975 0.601 1.00 0.00 C ATOM 999 CD GLN A 65 -15.542 -6.109 -0.839 1.00 0.00 C ATOM 1000 OE1 GLN A 65 -15.878 -5.128 -1.473 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -15.601 -7.293 -1.387 1.00 0.00 N ATOM 0 H GLN A 65 -12.254 -3.783 1.439 1.00 0.00 H new ATOM 0 HA GLN A 65 -14.841 -3.754 2.829 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -15.402 -3.846 0.638 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -13.773 -4.282 0.163 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -14.216 -6.665 0.777 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -15.834 -6.241 1.300 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -15.319 -8.116 -0.855 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -15.929 -7.395 -2.347 1.00 0.00 H new ATOM 1010 N GLU A 66 -12.930 -6.408 2.766 1.00 0.00 N ATOM 1011 CA GLU A 66 -12.747 -7.742 3.390 1.00 0.00 C ATOM 1012 C GLU A 66 -12.770 -7.624 4.917 1.00 0.00 C ATOM 1013 O GLU A 66 -13.320 -8.463 5.602 1.00 0.00 O ATOM 1014 CB GLU A 66 -11.404 -8.319 2.939 1.00 0.00 C ATOM 1015 CG GLU A 66 -11.071 -9.568 3.752 1.00 0.00 C ATOM 1016 CD GLU A 66 -12.235 -10.554 3.673 1.00 0.00 C ATOM 1017 OE1 GLU A 66 -12.944 -10.525 2.679 1.00 0.00 O ATOM 1018 OE2 GLU A 66 -12.401 -11.318 4.608 1.00 0.00 O ATOM 0 H GLU A 66 -12.155 -6.095 2.181 1.00 0.00 H new ATOM 0 HA GLU A 66 -13.559 -8.400 3.081 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -11.443 -8.566 1.878 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -10.619 -7.574 3.064 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -10.162 -10.032 3.370 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -10.879 -9.298 4.791 1.00 0.00 H new ATOM 1026 N GLU A 67 -12.165 -6.599 5.457 1.00 0.00 N ATOM 1027 CA GLU A 67 -12.143 -6.446 6.942 1.00 0.00 C ATOM 1028 C GLU A 67 -13.120 -5.351 7.389 1.00 0.00 C ATOM 1029 O GLU A 67 -13.205 -5.034 8.558 1.00 0.00 O ATOM 1030 CB GLU A 67 -10.732 -6.063 7.392 1.00 0.00 C ATOM 1031 CG GLU A 67 -9.745 -7.169 7.006 1.00 0.00 C ATOM 1032 CD GLU A 67 -10.175 -8.490 7.646 1.00 0.00 C ATOM 1033 OE1 GLU A 67 -10.435 -8.490 8.836 1.00 0.00 O ATOM 1034 OE2 GLU A 67 -10.234 -9.480 6.935 1.00 0.00 O ATOM 0 H GLU A 67 -11.687 -5.864 4.937 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.441 -7.393 7.392 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -10.436 -5.121 6.929 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -10.714 -5.908 8.471 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.708 -7.274 5.922 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -8.740 -6.904 7.335 1.00 0.00 H new ATOM 1042 N ALA A 68 -13.848 -4.759 6.484 1.00 0.00 N ATOM 1043 CA ALA A 68 -14.793 -3.680 6.900 1.00 0.00 C ATOM 1044 C ALA A 68 -16.062 -3.728 6.049 1.00 0.00 C ATOM 1045 O ALA A 68 -17.096 -3.230 6.440 1.00 0.00 O ATOM 1046 CB ALA A 68 -14.123 -2.317 6.718 1.00 0.00 C ATOM 0 H ALA A 68 -13.832 -4.970 5.486 1.00 0.00 H new ATOM 0 HA ALA A 68 -15.057 -3.830 7.947 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -14.812 -1.529 7.022 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -13.224 -2.269 7.332 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -13.855 -2.180 5.670 1.00 0.00 H new ATOM 1052 N GLY A 69 -15.993 -4.306 4.887 1.00 0.00 N ATOM 1053 CA GLY A 69 -17.202 -4.367 4.020 1.00 0.00 C ATOM 1054 C GLY A 69 -17.223 -3.143 3.111 1.00 0.00 C ATOM 1055 O GLY A 69 -18.029 -3.040 2.207 1.00 0.00 O ATOM 0 H GLY A 69 -15.155 -4.739 4.498 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -17.192 -5.279 3.423 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -18.103 -4.397 4.632 1.00 0.00 H new ATOM 1059 N ILE A 70 -16.340 -2.211 3.338 1.00 0.00 N ATOM 1060 CA ILE A 70 -16.317 -1.000 2.481 1.00 0.00 C ATOM 1061 C ILE A 70 -15.197 -1.144 1.446 1.00 0.00 C ATOM 1062 O ILE A 70 -14.061 -1.402 1.782 1.00 0.00 O ATOM 1063 CB ILE A 70 -16.071 0.241 3.337 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -16.936 0.186 4.602 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -16.475 1.467 2.521 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -16.306 1.038 5.712 1.00 0.00 C ATOM 0 H ILE A 70 -15.638 -2.238 4.077 1.00 0.00 H new ATOM 0 HA ILE A 70 -17.277 -0.893 1.975 1.00 0.00 H new ATOM 0 HB ILE A 70 -15.020 0.289 3.623 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -17.940 0.548 4.381 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -17.036 -0.846 4.938 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -16.309 2.368 3.111 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -15.875 1.513 1.612 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -17.530 1.396 2.256 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.929 0.991 6.605 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -15.311 0.657 5.943 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -16.229 2.072 5.377 1.00 0.00 H new ATOM 1078 N GLU A 71 -15.512 -0.985 0.190 1.00 0.00 N ATOM 1079 CA GLU A 71 -14.471 -1.115 -0.867 1.00 0.00 C ATOM 1080 C GLU A 71 -14.363 0.206 -1.627 1.00 0.00 C ATOM 1081 O GLU A 71 -15.120 1.125 -1.397 1.00 0.00 O ATOM 1082 CB GLU A 71 -14.845 -2.258 -1.819 1.00 0.00 C ATOM 1083 CG GLU A 71 -15.307 -1.702 -3.169 1.00 0.00 C ATOM 1084 CD GLU A 71 -15.894 -2.836 -4.011 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -15.902 -3.960 -3.531 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -16.323 -2.565 -5.119 1.00 0.00 O ATOM 0 H GLU A 71 -16.449 -0.770 -0.150 1.00 0.00 H new ATOM 0 HA GLU A 71 -13.506 -1.344 -0.415 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.987 -2.914 -1.964 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -15.637 -2.862 -1.378 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -16.054 -0.923 -3.017 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -14.468 -1.243 -3.692 1.00 0.00 H new ATOM 1094 N ALA A 72 -13.424 0.315 -2.526 1.00 0.00 N ATOM 1095 CA ALA A 72 -13.270 1.585 -3.290 1.00 0.00 C ATOM 1096 C ALA A 72 -14.600 1.952 -3.934 1.00 0.00 C ATOM 1097 O ALA A 72 -14.929 3.112 -4.076 1.00 0.00 O ATOM 1098 CB ALA A 72 -12.197 1.415 -4.363 1.00 0.00 C ATOM 0 H ALA A 72 -12.757 -0.419 -2.764 1.00 0.00 H new ATOM 0 HA ALA A 72 -12.967 2.383 -2.613 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -12.088 2.346 -4.919 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -11.248 1.161 -3.891 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -12.488 0.617 -5.046 1.00 0.00 H new ATOM 1104 N GLY A 73 -15.381 0.982 -4.301 1.00 0.00 N ATOM 1105 CA GLY A 73 -16.699 1.293 -4.900 1.00 0.00 C ATOM 1106 C GLY A 73 -17.582 1.903 -3.813 1.00 0.00 C ATOM 1107 O GLY A 73 -18.670 2.378 -4.071 1.00 0.00 O ATOM 0 H GLY A 73 -15.164 -0.011 -4.212 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -16.585 1.988 -5.732 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -17.158 0.389 -5.301 1.00 0.00 H new ATOM 1111 N GLN A 74 -17.113 1.882 -2.589 1.00 0.00 N ATOM 1112 CA GLN A 74 -17.915 2.454 -1.471 1.00 0.00 C ATOM 1113 C GLN A 74 -17.185 3.648 -0.835 1.00 0.00 C ATOM 1114 O GLN A 74 -17.775 4.399 -0.085 1.00 0.00 O ATOM 1115 CB GLN A 74 -18.159 1.377 -0.415 1.00 0.00 C ATOM 1116 CG GLN A 74 -18.997 0.247 -1.019 1.00 0.00 C ATOM 1117 CD GLN A 74 -19.239 -0.834 0.034 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -18.392 -1.673 0.267 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -20.372 -0.853 0.686 1.00 0.00 N ATOM 0 H GLN A 74 -16.210 1.493 -2.319 1.00 0.00 H new ATOM 0 HA GLN A 74 -18.869 2.803 -1.867 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -17.208 0.985 -0.054 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -18.674 1.806 0.445 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -19.949 0.639 -1.377 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -18.483 -0.179 -1.881 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -21.084 -0.149 0.492 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -20.544 -1.572 1.389 1.00 0.00 H new ATOM 1128 N LEU A 75 -15.923 3.852 -1.133 1.00 0.00 N ATOM 1129 CA LEU A 75 -15.213 5.032 -0.543 1.00 0.00 C ATOM 1130 C LEU A 75 -14.538 5.824 -1.652 1.00 0.00 C ATOM 1131 O LEU A 75 -14.692 5.549 -2.824 1.00 0.00 O ATOM 1132 CB LEU A 75 -14.127 4.638 0.479 1.00 0.00 C ATOM 1133 CG LEU A 75 -13.938 3.122 0.562 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -12.673 2.733 -0.194 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -13.780 2.708 2.024 1.00 0.00 C ATOM 0 H LEU A 75 -15.362 3.263 -1.749 1.00 0.00 H new ATOM 0 HA LEU A 75 -15.971 5.619 -0.025 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -13.182 5.106 0.202 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.398 5.024 1.462 1.00 0.00 H new ATOM 0 HG LEU A 75 -14.805 2.625 0.127 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -12.533 1.653 -0.138 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -12.766 3.033 -1.238 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -11.814 3.234 0.252 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -13.645 1.628 2.084 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -12.910 3.206 2.451 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -14.672 2.994 2.582 1.00 0.00 H new ATOM 1147 N THR A 76 -13.778 6.809 -1.272 1.00 0.00 N ATOM 1148 CA THR A 76 -13.061 7.641 -2.266 1.00 0.00 C ATOM 1149 C THR A 76 -11.596 7.723 -1.843 1.00 0.00 C ATOM 1150 O THR A 76 -11.264 8.317 -0.838 1.00 0.00 O ATOM 1151 CB THR A 76 -13.682 9.041 -2.294 1.00 0.00 C ATOM 1152 OG1 THR A 76 -14.951 8.978 -2.927 1.00 0.00 O ATOM 1153 CG2 THR A 76 -12.771 10.000 -3.058 1.00 0.00 C ATOM 0 H THR A 76 -13.623 7.075 -0.300 1.00 0.00 H new ATOM 0 HA THR A 76 -13.136 7.206 -3.263 1.00 0.00 H new ATOM 0 HB THR A 76 -13.801 9.405 -1.273 1.00 0.00 H new ATOM 0 HG1 THR A 76 -15.352 9.872 -2.945 1.00 0.00 H new ATOM 0 HG21 THR A 76 -13.220 10.993 -3.073 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.799 10.048 -2.566 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.643 9.644 -4.080 1.00 0.00 H new ATOM 1161 N ILE A 77 -10.720 7.126 -2.596 1.00 0.00 N ATOM 1162 CA ILE A 77 -9.283 7.163 -2.226 1.00 0.00 C ATOM 1163 C ILE A 77 -8.717 8.528 -2.611 1.00 0.00 C ATOM 1164 O ILE A 77 -8.889 8.989 -3.723 1.00 0.00 O ATOM 1165 CB ILE A 77 -8.530 6.066 -2.981 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -9.367 4.775 -2.971 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -7.178 5.817 -2.303 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -9.448 4.204 -1.553 1.00 0.00 C ATOM 0 H ILE A 77 -10.937 6.614 -3.451 1.00 0.00 H new ATOM 0 HA ILE A 77 -9.170 6.999 -1.154 1.00 0.00 H new ATOM 0 HB ILE A 77 -8.361 6.377 -4.012 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -10.370 4.981 -3.345 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -8.922 4.040 -3.641 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.640 5.036 -2.840 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -6.591 6.735 -2.314 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.340 5.503 -1.272 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -10.043 3.291 -1.562 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -8.444 3.979 -1.193 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -9.915 4.935 -0.893 1.00 0.00 H new ATOM 1180 N ILE A 78 -8.055 9.186 -1.707 1.00 0.00 N ATOM 1181 CA ILE A 78 -7.498 10.525 -2.036 1.00 0.00 C ATOM 1182 C ILE A 78 -6.111 10.376 -2.654 1.00 0.00 C ATOM 1183 O ILE A 78 -5.335 9.520 -2.280 1.00 0.00 O ATOM 1184 CB ILE A 78 -7.434 11.381 -0.772 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -8.457 12.513 -0.887 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -6.034 11.973 -0.607 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -9.851 11.933 -1.133 1.00 0.00 C ATOM 0 H ILE A 78 -7.875 8.858 -0.758 1.00 0.00 H new ATOM 0 HA ILE A 78 -8.147 11.018 -2.760 1.00 0.00 H new ATOM 0 HB ILE A 78 -7.658 10.762 0.096 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -8.457 13.108 0.026 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -8.183 13.181 -1.703 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -6.000 12.581 0.297 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -5.305 11.167 -0.529 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.797 12.594 -1.471 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -10.574 12.745 -1.214 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -9.847 11.357 -2.058 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -10.127 11.283 -0.302 1.00 0.00 H new ATOM 1199 N GLU A 79 -5.808 11.202 -3.615 1.00 0.00 N ATOM 1200 CA GLU A 79 -4.487 11.123 -4.293 1.00 0.00 C ATOM 1201 C GLU A 79 -3.581 12.257 -3.817 1.00 0.00 C ATOM 1202 O GLU A 79 -4.039 13.312 -3.416 1.00 0.00 O ATOM 1203 CB GLU A 79 -4.688 11.229 -5.801 1.00 0.00 C ATOM 1204 CG GLU A 79 -5.556 10.059 -6.276 1.00 0.00 C ATOM 1205 CD GLU A 79 -5.736 10.143 -7.792 1.00 0.00 C ATOM 1206 OE1 GLU A 79 -6.299 9.220 -8.352 1.00 0.00 O ATOM 1207 OE2 GLU A 79 -5.303 11.128 -8.366 1.00 0.00 O ATOM 0 H GLU A 79 -6.426 11.935 -3.962 1.00 0.00 H new ATOM 0 HA GLU A 79 -4.017 10.170 -4.049 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -5.165 12.177 -6.051 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -3.725 11.213 -6.311 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.089 9.112 -6.006 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -6.527 10.088 -5.781 1.00 0.00 H new ATOM 1215 N GLY A 80 -2.299 12.044 -3.861 1.00 0.00 N ATOM 1216 CA GLY A 80 -1.344 13.098 -3.417 1.00 0.00 C ATOM 1217 C GLY A 80 -0.794 12.730 -2.041 1.00 0.00 C ATOM 1218 O GLY A 80 0.256 13.191 -1.633 1.00 0.00 O ATOM 0 H GLY A 80 -1.866 11.180 -4.187 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -0.529 13.192 -4.134 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.845 14.065 -3.375 1.00 0.00 H new ATOM 1222 N PHE A 81 -1.490 11.894 -1.323 1.00 0.00 N ATOM 1223 CA PHE A 81 -1.008 11.485 0.023 1.00 0.00 C ATOM 1224 C PHE A 81 -0.582 10.017 0.004 1.00 0.00 C ATOM 1225 O PHE A 81 -1.340 9.147 -0.376 1.00 0.00 O ATOM 1226 CB PHE A 81 -2.129 11.653 1.049 1.00 0.00 C ATOM 1227 CG PHE A 81 -1.635 11.191 2.398 1.00 0.00 C ATOM 1228 CD1 PHE A 81 -1.679 9.829 2.732 1.00 0.00 C ATOM 1229 CD2 PHE A 81 -1.126 12.117 3.310 1.00 0.00 C ATOM 1230 CE1 PHE A 81 -1.215 9.401 3.980 1.00 0.00 C ATOM 1231 CE2 PHE A 81 -0.662 11.686 4.556 1.00 0.00 C ATOM 1232 CZ PHE A 81 -0.707 10.330 4.893 1.00 0.00 C ATOM 0 H PHE A 81 -2.374 11.476 -1.612 1.00 0.00 H new ATOM 0 HA PHE A 81 -0.158 12.113 0.292 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -2.440 12.697 1.099 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -3.003 11.074 0.750 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -2.071 9.112 2.026 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -1.091 13.165 3.053 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -1.249 8.353 4.238 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -0.267 12.403 5.261 1.00 0.00 H new ATOM 0 HZ PHE A 81 -0.350 10.000 5.857 1.00 0.00 H new ATOM 1242 N LYS A 82 0.617 9.730 0.437 1.00 0.00 N ATOM 1243 CA LYS A 82 1.069 8.309 0.468 1.00 0.00 C ATOM 1244 C LYS A 82 2.146 8.141 1.535 1.00 0.00 C ATOM 1245 O LYS A 82 3.091 8.901 1.611 1.00 0.00 O ATOM 1246 CB LYS A 82 1.644 7.891 -0.881 1.00 0.00 C ATOM 1247 CG LYS A 82 1.363 6.402 -1.096 1.00 0.00 C ATOM 1248 CD LYS A 82 1.940 5.955 -2.439 1.00 0.00 C ATOM 1249 CE LYS A 82 3.449 5.739 -2.305 1.00 0.00 C ATOM 1250 NZ LYS A 82 4.152 6.494 -3.377 1.00 0.00 N ATOM 0 H LYS A 82 1.298 10.413 0.768 1.00 0.00 H new ATOM 0 HA LYS A 82 0.207 7.681 0.695 1.00 0.00 H new ATOM 0 HB2 LYS A 82 1.195 8.479 -1.681 1.00 0.00 H new ATOM 0 HB3 LYS A 82 2.717 8.081 -0.909 1.00 0.00 H new ATOM 0 HG2 LYS A 82 1.805 5.819 -0.288 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.289 6.218 -1.072 1.00 0.00 H new ATOM 0 HD2 LYS A 82 1.458 5.033 -2.764 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.737 6.707 -3.202 1.00 0.00 H new ATOM 0 HE2 LYS A 82 3.790 6.074 -1.325 1.00 0.00 H new ATOM 0 HE3 LYS A 82 3.684 4.677 -2.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 5.178 6.349 -3.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 3.833 6.154 -4.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 3.937 7.507 -3.286 1.00 0.00 H new ATOM 1264 N ARG A 83 2.010 7.144 2.357 1.00 0.00 N ATOM 1265 CA ARG A 83 3.018 6.897 3.422 1.00 0.00 C ATOM 1266 C ARG A 83 2.851 5.462 3.924 1.00 0.00 C ATOM 1267 O ARG A 83 1.742 4.987 4.082 1.00 0.00 O ATOM 1268 CB ARG A 83 2.787 7.884 4.570 1.00 0.00 C ATOM 1269 CG ARG A 83 3.723 7.552 5.735 1.00 0.00 C ATOM 1270 CD ARG A 83 3.471 8.527 6.887 1.00 0.00 C ATOM 1271 NE ARG A 83 4.415 8.234 8.007 1.00 0.00 N ATOM 1272 CZ ARG A 83 4.132 8.626 9.218 1.00 0.00 C ATOM 1273 NH1 ARG A 83 3.030 9.283 9.452 1.00 0.00 N ATOM 1274 NH2 ARG A 83 4.951 8.354 10.197 1.00 0.00 N ATOM 0 H ARG A 83 1.235 6.481 2.337 1.00 0.00 H new ATOM 0 HA ARG A 83 4.027 7.034 3.033 1.00 0.00 H new ATOM 0 HB2 ARG A 83 2.965 8.903 4.227 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.749 7.836 4.900 1.00 0.00 H new ATOM 0 HG2 ARG A 83 3.556 6.528 6.069 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.762 7.617 5.411 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.605 9.553 6.544 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.441 8.438 7.233 1.00 0.00 H new ATOM 0 HE ARG A 83 5.281 7.727 7.824 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.388 9.491 8.687 1.00 0.00 H new ATOM 0 HH12 ARG A 83 2.810 9.589 10.400 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.810 7.836 10.014 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.732 8.660 11.145 1.00 0.00 H new ATOM 1288 N GLU A 84 3.923 4.763 4.184 1.00 0.00 N ATOM 1289 CA GLU A 84 3.773 3.366 4.676 1.00 0.00 C ATOM 1290 C GLU A 84 4.406 3.218 6.051 1.00 0.00 C ATOM 1291 O GLU A 84 5.467 3.744 6.315 1.00 0.00 O ATOM 1292 CB GLU A 84 4.441 2.381 3.713 1.00 0.00 C ATOM 1293 CG GLU A 84 5.872 2.823 3.392 1.00 0.00 C ATOM 1294 CD GLU A 84 5.846 4.110 2.567 1.00 0.00 C ATOM 1295 OE1 GLU A 84 4.791 4.444 2.056 1.00 0.00 O ATOM 1296 OE2 GLU A 84 6.887 4.739 2.455 1.00 0.00 O ATOM 0 H GLU A 84 4.882 5.094 4.079 1.00 0.00 H new ATOM 0 HA GLU A 84 2.707 3.145 4.738 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.453 1.385 4.155 1.00 0.00 H new ATOM 0 HB3 GLU A 84 3.861 2.314 2.793 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.428 2.984 4.316 1.00 0.00 H new ATOM 0 HG3 GLU A 84 6.390 2.038 2.841 1.00 0.00 H new ATOM 1304 N LEU A 85 3.775 2.482 6.925 1.00 0.00 N ATOM 1305 CA LEU A 85 4.367 2.285 8.269 1.00 0.00 C ATOM 1306 C LEU A 85 5.084 0.938 8.268 1.00 0.00 C ATOM 1307 O LEU A 85 4.476 -0.101 8.093 1.00 0.00 O ATOM 1308 CB LEU A 85 3.268 2.291 9.339 1.00 0.00 C ATOM 1309 CG LEU A 85 2.310 3.468 9.101 1.00 0.00 C ATOM 1310 CD1 LEU A 85 1.468 3.708 10.355 1.00 0.00 C ATOM 1311 CD2 LEU A 85 3.096 4.739 8.778 1.00 0.00 C ATOM 0 H LEU A 85 2.883 2.014 6.764 1.00 0.00 H new ATOM 0 HA LEU A 85 5.065 3.091 8.496 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.717 1.351 9.311 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.714 2.369 10.330 1.00 0.00 H new ATOM 0 HG LEU A 85 1.663 3.223 8.259 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.789 4.544 10.183 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.890 2.812 10.582 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.123 3.940 11.195 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.402 5.563 8.612 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.755 4.981 9.612 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.692 4.580 7.879 1.00 0.00 H new ATOM 1323 N ASN A 86 6.376 0.944 8.445 1.00 0.00 N ATOM 1324 CA ASN A 86 7.128 -0.339 8.428 1.00 0.00 C ATOM 1325 C ASN A 86 7.753 -0.592 9.796 1.00 0.00 C ATOM 1326 O ASN A 86 8.542 0.191 10.287 1.00 0.00 O ATOM 1327 CB ASN A 86 8.237 -0.256 7.376 1.00 0.00 C ATOM 1328 CG ASN A 86 7.653 0.251 6.058 1.00 0.00 C ATOM 1329 OD1 ASN A 86 6.487 0.579 5.987 1.00 0.00 O ATOM 1330 ND2 ASN A 86 8.418 0.327 5.004 1.00 0.00 N ATOM 0 H ASN A 86 6.941 1.779 8.600 1.00 0.00 H new ATOM 0 HA ASN A 86 6.446 -1.154 8.188 1.00 0.00 H new ATOM 0 HB2 ASN A 86 9.027 0.413 7.717 1.00 0.00 H new ATOM 0 HB3 ASN A 86 8.690 -1.237 7.232 1.00 0.00 H new ATOM 0 HD21 ASN A 86 8.036 0.662 4.120 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.398 0.051 5.064 1.00 0.00 H new ATOM 1337 N TYR A 87 7.416 -1.686 10.408 1.00 0.00 N ATOM 1338 CA TYR A 87 7.998 -2.009 11.734 1.00 0.00 C ATOM 1339 C TYR A 87 7.945 -3.513 11.952 1.00 0.00 C ATOM 1340 O TYR A 87 7.140 -4.209 11.364 1.00 0.00 O ATOM 1341 CB TYR A 87 7.206 -1.306 12.836 1.00 0.00 C ATOM 1342 CG TYR A 87 5.731 -1.535 12.619 1.00 0.00 C ATOM 1343 CD1 TYR A 87 5.137 -2.732 13.033 1.00 0.00 C ATOM 1344 CD2 TYR A 87 4.958 -0.545 12.004 1.00 0.00 C ATOM 1345 CE1 TYR A 87 3.770 -2.941 12.828 1.00 0.00 C ATOM 1346 CE2 TYR A 87 3.589 -0.754 11.799 1.00 0.00 C ATOM 1347 CZ TYR A 87 2.993 -1.952 12.213 1.00 0.00 C ATOM 1348 OH TYR A 87 1.643 -2.160 12.014 1.00 0.00 O ATOM 0 H TYR A 87 6.758 -2.375 10.045 1.00 0.00 H new ATOM 0 HA TYR A 87 9.033 -1.668 11.766 1.00 0.00 H new ATOM 0 HB2 TYR A 87 7.504 -1.687 13.813 1.00 0.00 H new ATOM 0 HB3 TYR A 87 7.424 -0.238 12.830 1.00 0.00 H new ATOM 0 HD1 TYR A 87 5.734 -3.494 13.511 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.417 0.380 11.687 1.00 0.00 H new ATOM 0 HE1 TYR A 87 3.313 -3.867 13.145 1.00 0.00 H new ATOM 0 HE2 TYR A 87 2.992 0.009 11.321 1.00 0.00 H new ATOM 0 HH TYR A 87 1.252 -1.375 11.576 1.00 0.00 H new ATOM 1358 N VAL A 88 8.786 -4.018 12.801 1.00 0.00 N ATOM 1359 CA VAL A 88 8.779 -5.474 13.070 1.00 0.00 C ATOM 1360 C VAL A 88 8.279 -5.706 14.490 1.00 0.00 C ATOM 1361 O VAL A 88 8.983 -5.472 15.453 1.00 0.00 O ATOM 1362 CB VAL A 88 10.192 -6.027 12.919 1.00 0.00 C ATOM 1363 CG1 VAL A 88 11.102 -5.412 13.981 1.00 0.00 C ATOM 1364 CG2 VAL A 88 10.158 -7.539 13.100 1.00 0.00 C ATOM 0 H VAL A 88 9.481 -3.483 13.322 1.00 0.00 H new ATOM 0 HA VAL A 88 8.124 -5.983 12.363 1.00 0.00 H new ATOM 0 HB VAL A 88 10.575 -5.780 11.929 1.00 0.00 H new ATOM 0 HG11 VAL A 88 12.111 -5.809 13.870 1.00 0.00 H new ATOM 0 HG12 VAL A 88 11.123 -4.329 13.859 1.00 0.00 H new ATOM 0 HG13 VAL A 88 10.722 -5.658 14.973 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.166 -7.941 12.993 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.775 -7.778 14.092 1.00 0.00 H new ATOM 0 HG23 VAL A 88 9.509 -7.981 12.344 1.00 0.00 H new ATOM 1374 N ALA A 89 7.065 -6.154 14.633 1.00 0.00 N ATOM 1375 CA ALA A 89 6.522 -6.387 15.998 1.00 0.00 C ATOM 1376 C ALA A 89 7.048 -7.712 16.555 1.00 0.00 C ATOM 1377 O ALA A 89 8.045 -7.749 17.248 1.00 0.00 O ATOM 1378 CB ALA A 89 4.993 -6.422 15.939 1.00 0.00 C ATOM 0 H ALA A 89 6.427 -6.368 13.867 1.00 0.00 H new ATOM 0 HA ALA A 89 6.843 -5.577 16.653 1.00 0.00 H new ATOM 0 HB1 ALA A 89 4.594 -6.593 16.939 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.622 -5.471 15.558 1.00 0.00 H new ATOM 0 HB3 ALA A 89 4.673 -7.228 15.278 1.00 0.00 H new ATOM 1384 N ARG A 90 6.383 -8.798 16.271 1.00 0.00 N ATOM 1385 CA ARG A 90 6.849 -10.111 16.806 1.00 0.00 C ATOM 1386 C ARG A 90 8.299 -10.367 16.384 1.00 0.00 C ATOM 1387 O ARG A 90 9.160 -10.614 17.208 1.00 0.00 O ATOM 1388 CB ARG A 90 5.944 -11.229 16.274 1.00 0.00 C ATOM 1389 CG ARG A 90 6.129 -11.373 14.762 1.00 0.00 C ATOM 1390 CD ARG A 90 4.978 -12.205 14.190 1.00 0.00 C ATOM 1391 NE ARG A 90 5.227 -12.480 12.747 1.00 0.00 N ATOM 1392 CZ ARG A 90 4.271 -12.971 12.009 1.00 0.00 C ATOM 1393 NH1 ARG A 90 3.097 -13.196 12.530 1.00 0.00 N ATOM 1394 NH2 ARG A 90 4.484 -13.230 10.747 1.00 0.00 N ATOM 0 H ARG A 90 5.542 -8.835 15.695 1.00 0.00 H new ATOM 0 HA ARG A 90 6.800 -10.093 17.895 1.00 0.00 H new ATOM 0 HB2 ARG A 90 6.184 -12.170 16.770 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.902 -11.005 16.502 1.00 0.00 H new ATOM 0 HG2 ARG A 90 6.152 -10.390 14.291 1.00 0.00 H new ATOM 0 HG3 ARG A 90 7.083 -11.853 14.545 1.00 0.00 H new ATOM 0 HD2 ARG A 90 4.886 -13.143 14.738 1.00 0.00 H new ATOM 0 HD3 ARG A 90 4.035 -11.671 14.311 1.00 0.00 H new ATOM 0 HE ARG A 90 6.141 -12.285 12.338 1.00 0.00 H new ATOM 0 HH11 ARG A 90 2.927 -12.988 13.514 1.00 0.00 H new ATOM 0 HH12 ARG A 90 2.348 -13.580 11.954 1.00 0.00 H new ATOM 0 HH21 ARG A 90 5.400 -13.048 10.337 1.00 0.00 H new ATOM 0 HH22 ARG A 90 3.734 -13.614 10.172 1.00 0.00 H new ATOM 1408 N ASN A 91 8.582 -10.306 15.115 1.00 0.00 N ATOM 1409 CA ASN A 91 9.978 -10.544 14.649 1.00 0.00 C ATOM 1410 C ASN A 91 10.014 -10.445 13.121 1.00 0.00 C ATOM 1411 O ASN A 91 10.918 -10.935 12.474 1.00 0.00 O ATOM 1412 CB ASN A 91 10.438 -11.943 15.073 1.00 0.00 C ATOM 1413 CG ASN A 91 11.958 -11.950 15.242 1.00 0.00 C ATOM 1414 OD1 ASN A 91 12.484 -11.333 16.149 1.00 0.00 O ATOM 1415 ND2 ASN A 91 12.693 -12.625 14.403 1.00 0.00 N ATOM 0 H ASN A 91 7.907 -10.101 14.378 1.00 0.00 H new ATOM 0 HA ASN A 91 10.640 -9.799 15.091 1.00 0.00 H new ATOM 0 HB2 ASN A 91 9.956 -12.228 16.008 1.00 0.00 H new ATOM 0 HB3 ASN A 91 10.141 -12.678 14.324 1.00 0.00 H new ATOM 0 HD21 ASN A 91 13.708 -12.635 14.508 1.00 0.00 H new ATOM 0 HD22 ASN A 91 12.253 -13.143 13.642 1.00 0.00 H new ATOM 1422 N LYS A 92 9.032 -9.813 12.545 1.00 0.00 N ATOM 1423 CA LYS A 92 9.001 -9.671 11.067 1.00 0.00 C ATOM 1424 C LYS A 92 8.515 -8.259 10.705 1.00 0.00 C ATOM 1425 O LYS A 92 7.483 -7.816 11.167 1.00 0.00 O ATOM 1426 CB LYS A 92 8.043 -10.714 10.489 1.00 0.00 C ATOM 1427 CG LYS A 92 8.718 -11.442 9.323 1.00 0.00 C ATOM 1428 CD LYS A 92 9.855 -12.329 9.848 1.00 0.00 C ATOM 1429 CE LYS A 92 9.989 -13.559 8.949 1.00 0.00 C ATOM 1430 NZ LYS A 92 11.414 -13.999 8.905 1.00 0.00 N ATOM 0 H LYS A 92 8.247 -9.387 13.038 1.00 0.00 H new ATOM 0 HA LYS A 92 9.998 -9.824 10.654 1.00 0.00 H new ATOM 0 HB2 LYS A 92 7.759 -11.429 11.261 1.00 0.00 H new ATOM 0 HB3 LYS A 92 7.127 -10.232 10.148 1.00 0.00 H new ATOM 0 HG2 LYS A 92 7.987 -12.050 8.791 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.110 -10.718 8.609 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.791 -11.771 9.862 1.00 0.00 H new ATOM 0 HD3 LYS A 92 9.650 -12.634 10.874 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.361 -14.366 9.326 1.00 0.00 H new ATOM 0 HE3 LYS A 92 9.639 -13.326 7.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 11.500 -14.835 8.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.003 -13.230 8.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 11.733 -14.239 9.865 1.00 0.00 H new ATOM 1444 N PRO A 93 9.257 -7.556 9.885 1.00 0.00 N ATOM 1445 CA PRO A 93 8.910 -6.168 9.452 1.00 0.00 C ATOM 1446 C PRO A 93 7.867 -6.170 8.355 1.00 0.00 C ATOM 1447 O PRO A 93 8.011 -6.858 7.372 1.00 0.00 O ATOM 1448 CB PRO A 93 10.213 -5.636 8.883 1.00 0.00 C ATOM 1449 CG PRO A 93 10.897 -6.844 8.352 1.00 0.00 C ATOM 1450 CD PRO A 93 10.512 -8.003 9.267 1.00 0.00 C ATOM 0 HA PRO A 93 8.502 -5.580 10.274 1.00 0.00 H new ATOM 0 HB2 PRO A 93 10.035 -4.901 8.098 1.00 0.00 H new ATOM 0 HB3 PRO A 93 10.811 -5.144 9.650 1.00 0.00 H new ATOM 0 HG2 PRO A 93 10.590 -7.043 7.325 1.00 0.00 H new ATOM 0 HG3 PRO A 93 11.978 -6.703 8.340 1.00 0.00 H new ATOM 0 HD2 PRO A 93 10.375 -8.928 8.706 1.00 0.00 H new ATOM 0 HD3 PRO A 93 11.281 -8.195 10.015 1.00 0.00 H new ATOM 1458 N LYS A 94 6.838 -5.405 8.496 1.00 0.00 N ATOM 1459 CA LYS A 94 5.804 -5.391 7.437 1.00 0.00 C ATOM 1460 C LYS A 94 5.569 -3.967 6.946 1.00 0.00 C ATOM 1461 O LYS A 94 5.188 -3.092 7.700 1.00 0.00 O ATOM 1462 CB LYS A 94 4.515 -5.972 8.012 1.00 0.00 C ATOM 1463 CG LYS A 94 3.448 -6.031 6.927 1.00 0.00 C ATOM 1464 CD LYS A 94 2.616 -7.305 7.097 1.00 0.00 C ATOM 1465 CE LYS A 94 1.789 -7.211 8.377 1.00 0.00 C ATOM 1466 NZ LYS A 94 1.553 -8.580 8.918 1.00 0.00 N ATOM 0 H LYS A 94 6.664 -4.791 9.292 1.00 0.00 H new ATOM 0 HA LYS A 94 6.135 -5.990 6.589 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.700 -6.971 8.408 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.168 -5.359 8.844 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.805 -5.153 6.987 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.915 -6.018 5.942 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.960 -7.440 6.237 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.270 -8.176 7.138 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.310 -6.601 9.115 1.00 0.00 H new ATOM 0 HE3 LYS A 94 0.837 -6.720 8.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 0.817 -8.541 9.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 1.242 -9.208 8.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.434 -8.947 9.330 1.00 0.00 H new ATOM 1480 N THR A 95 5.777 -3.736 5.678 1.00 0.00 N ATOM 1481 CA THR A 95 5.544 -2.376 5.130 1.00 0.00 C ATOM 1482 C THR A 95 4.047 -2.199 4.942 1.00 0.00 C ATOM 1483 O THR A 95 3.381 -3.035 4.365 1.00 0.00 O ATOM 1484 CB THR A 95 6.243 -2.210 3.777 1.00 0.00 C ATOM 1485 OG1 THR A 95 7.650 -2.291 3.951 1.00 0.00 O ATOM 1486 CG2 THR A 95 5.880 -0.846 3.181 1.00 0.00 C ATOM 0 H THR A 95 6.097 -4.430 5.002 1.00 0.00 H new ATOM 0 HA THR A 95 5.945 -1.631 5.817 1.00 0.00 H new ATOM 0 HB THR A 95 5.918 -3.002 3.103 1.00 0.00 H new ATOM 0 HG1 THR A 95 8.093 -2.186 3.083 1.00 0.00 H new ATOM 0 HG21 THR A 95 6.376 -0.726 2.218 1.00 0.00 H new ATOM 0 HG22 THR A 95 4.801 -0.785 3.043 1.00 0.00 H new ATOM 0 HG23 THR A 95 6.204 -0.055 3.858 1.00 0.00 H new ATOM 1494 N VAL A 96 3.513 -1.125 5.424 1.00 0.00 N ATOM 1495 CA VAL A 96 2.058 -0.894 5.278 1.00 0.00 C ATOM 1496 C VAL A 96 1.845 0.446 4.587 1.00 0.00 C ATOM 1497 O VAL A 96 2.207 1.472 5.109 1.00 0.00 O ATOM 1498 CB VAL A 96 1.425 -0.859 6.669 1.00 0.00 C ATOM 1499 CG1 VAL A 96 -0.085 -0.664 6.542 1.00 0.00 C ATOM 1500 CG2 VAL A 96 1.711 -2.178 7.390 1.00 0.00 C ATOM 0 H VAL A 96 4.023 -0.391 5.916 1.00 0.00 H new ATOM 0 HA VAL A 96 1.602 -1.689 4.688 1.00 0.00 H new ATOM 0 HB VAL A 96 1.848 -0.032 7.239 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.534 -0.639 7.535 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -0.289 0.276 6.029 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -0.512 -1.489 5.972 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.261 -2.155 8.382 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.288 -3.004 6.818 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.788 -2.315 7.484 1.00 0.00 H new ATOM 1510 N ILE A 97 1.243 0.448 3.427 1.00 0.00 N ATOM 1511 CA ILE A 97 1.003 1.738 2.720 1.00 0.00 C ATOM 1512 C ILE A 97 -0.434 2.174 2.991 1.00 0.00 C ATOM 1513 O ILE A 97 -1.368 1.417 2.807 1.00 0.00 O ATOM 1514 CB ILE A 97 1.225 1.543 1.213 1.00 0.00 C ATOM 1515 CG1 ILE A 97 2.640 0.980 0.974 1.00 0.00 C ATOM 1516 CG2 ILE A 97 1.061 2.881 0.489 1.00 0.00 C ATOM 1517 CD1 ILE A 97 3.597 2.094 0.519 1.00 0.00 C ATOM 0 H ILE A 97 0.909 -0.384 2.941 1.00 0.00 H new ATOM 0 HA ILE A 97 1.692 2.504 3.077 1.00 0.00 H new ATOM 0 HB ILE A 97 0.489 0.840 0.823 1.00 0.00 H new ATOM 0 HG12 ILE A 97 3.015 0.523 1.890 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.602 0.195 0.219 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.219 2.738 -0.580 1.00 0.00 H new ATOM 0 HG22 ILE A 97 0.055 3.266 0.659 1.00 0.00 H new ATOM 0 HG23 ILE A 97 1.791 3.594 0.872 1.00 0.00 H new ATOM 0 HD11 ILE A 97 4.590 1.676 0.356 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.230 2.532 -0.409 1.00 0.00 H new ATOM 0 HD13 ILE A 97 3.650 2.865 1.288 1.00 0.00 H new ATOM 1529 N TYR A 98 -0.624 3.379 3.460 1.00 0.00 N ATOM 1530 CA TYR A 98 -2.006 3.835 3.775 1.00 0.00 C ATOM 1531 C TYR A 98 -2.444 4.967 2.850 1.00 0.00 C ATOM 1532 O TYR A 98 -1.762 5.959 2.689 1.00 0.00 O ATOM 1533 CB TYR A 98 -2.056 4.369 5.205 1.00 0.00 C ATOM 1534 CG TYR A 98 -2.021 3.235 6.201 1.00 0.00 C ATOM 1535 CD1 TYR A 98 -3.100 2.349 6.292 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.917 3.081 7.048 1.00 0.00 C ATOM 1537 CE1 TYR A 98 -3.072 1.308 7.228 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.890 2.040 7.982 1.00 0.00 C ATOM 1539 CZ TYR A 98 -1.967 1.154 8.072 1.00 0.00 C ATOM 1540 OH TYR A 98 -1.939 0.129 8.995 1.00 0.00 O ATOM 0 H TYR A 98 0.113 4.061 3.637 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.669 2.979 3.646 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -1.213 5.038 5.378 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -2.963 4.956 5.347 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -3.954 2.468 5.641 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.085 3.767 6.980 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -3.904 0.623 7.298 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -0.037 1.921 8.634 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.052 0.086 9.409 1.00 0.00 H new ATOM 1550 N TRP A 99 -3.616 4.842 2.296 1.00 0.00 N ATOM 1551 CA TRP A 99 -4.168 5.921 1.435 1.00 0.00 C ATOM 1552 C TRP A 99 -5.365 6.509 2.172 1.00 0.00 C ATOM 1553 O TRP A 99 -6.118 5.793 2.801 1.00 0.00 O ATOM 1554 CB TRP A 99 -4.638 5.347 0.096 1.00 0.00 C ATOM 1555 CG TRP A 99 -3.480 5.216 -0.836 1.00 0.00 C ATOM 1556 CD1 TRP A 99 -3.003 6.203 -1.626 1.00 0.00 C ATOM 1557 CD2 TRP A 99 -2.659 4.046 -1.099 1.00 0.00 C ATOM 1558 NE1 TRP A 99 -1.934 5.715 -2.354 1.00 0.00 N ATOM 1559 CE2 TRP A 99 -1.681 4.388 -2.063 1.00 0.00 C ATOM 1560 CE3 TRP A 99 -2.663 2.736 -0.591 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 -0.747 3.457 -2.517 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 -1.724 1.796 -1.042 1.00 0.00 C ATOM 1563 CH2 TRP A 99 -0.766 2.158 -2.002 1.00 0.00 C ATOM 0 H TRP A 99 -4.221 4.028 2.405 1.00 0.00 H new ATOM 0 HA TRP A 99 -3.407 6.675 1.236 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -5.103 4.373 0.251 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -5.396 5.996 -0.342 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -3.393 7.209 -1.680 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -1.398 6.267 -3.024 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -3.394 2.451 0.151 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -0.015 3.738 -3.260 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -1.738 0.790 -0.649 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -0.043 1.432 -2.343 1.00 0.00 H new ATOM 1574 N LEU A 100 -5.568 7.792 2.110 1.00 0.00 N ATOM 1575 CA LEU A 100 -6.737 8.359 2.826 1.00 0.00 C ATOM 1576 C LEU A 100 -7.986 8.004 2.030 1.00 0.00 C ATOM 1577 O LEU A 100 -8.008 8.113 0.821 1.00 0.00 O ATOM 1578 CB LEU A 100 -6.595 9.877 2.934 1.00 0.00 C ATOM 1579 CG LEU A 100 -5.112 10.251 2.887 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -4.947 11.733 3.225 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -4.334 9.410 3.903 1.00 0.00 C ATOM 0 H LEU A 100 -4.987 8.461 1.605 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.803 7.951 3.835 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.130 10.363 2.118 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.042 10.230 3.863 1.00 0.00 H new ATOM 0 HG LEU A 100 -4.726 10.059 1.886 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.890 11.998 3.191 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -5.496 12.335 2.500 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.337 11.924 4.225 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.278 9.679 3.866 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.722 9.598 4.904 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.447 8.353 3.663 1.00 0.00 H new ATOM 1593 N ALA A 101 -9.020 7.563 2.690 1.00 0.00 N ATOM 1594 CA ALA A 101 -10.252 7.180 1.950 1.00 0.00 C ATOM 1595 C ALA A 101 -11.481 7.746 2.652 1.00 0.00 C ATOM 1596 O ALA A 101 -11.496 7.950 3.847 1.00 0.00 O ATOM 1597 CB ALA A 101 -10.359 5.656 1.900 1.00 0.00 C ATOM 0 H ALA A 101 -9.065 7.452 3.703 1.00 0.00 H new ATOM 0 HA ALA A 101 -10.200 7.583 0.938 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.261 5.372 1.358 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -9.486 5.246 1.391 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -10.406 5.261 2.915 1.00 0.00 H new ATOM 1603 N GLU A 102 -12.524 7.986 1.908 1.00 0.00 N ATOM 1604 CA GLU A 102 -13.774 8.523 2.511 1.00 0.00 C ATOM 1605 C GLU A 102 -14.932 7.609 2.128 1.00 0.00 C ATOM 1606 O GLU A 102 -15.199 7.404 0.963 1.00 0.00 O ATOM 1607 CB GLU A 102 -14.045 9.927 1.966 1.00 0.00 C ATOM 1608 CG GLU A 102 -15.325 10.485 2.593 1.00 0.00 C ATOM 1609 CD GLU A 102 -15.695 11.809 1.919 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -14.951 12.240 1.055 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -16.722 12.364 2.279 1.00 0.00 O ATOM 0 H GLU A 102 -12.564 7.832 0.901 1.00 0.00 H new ATOM 0 HA GLU A 102 -13.670 8.569 3.595 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -13.203 10.583 2.189 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -14.145 9.894 0.881 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -16.139 9.769 2.480 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -15.181 10.638 3.663 1.00 0.00 H new ATOM 1619 N VAL A 103 -15.634 7.065 3.082 1.00 0.00 N ATOM 1620 CA VAL A 103 -16.768 6.175 2.728 1.00 0.00 C ATOM 1621 C VAL A 103 -17.946 7.034 2.271 1.00 0.00 C ATOM 1622 O VAL A 103 -18.287 8.028 2.880 1.00 0.00 O ATOM 1623 CB VAL A 103 -17.137 5.287 3.919 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -15.878 4.592 4.410 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -17.696 6.123 5.061 1.00 0.00 C ATOM 0 H VAL A 103 -15.473 7.197 4.080 1.00 0.00 H new ATOM 0 HA VAL A 103 -16.485 5.512 1.910 1.00 0.00 H new ATOM 0 HB VAL A 103 -17.890 4.566 3.602 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -16.122 3.954 5.260 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -15.462 3.983 3.607 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -15.146 5.339 4.716 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -17.952 5.472 5.897 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -16.948 6.848 5.381 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -18.589 6.648 4.724 1.00 0.00 H new ATOM 1635 N LYS A 104 -18.537 6.667 1.173 1.00 0.00 N ATOM 1636 CA LYS A 104 -19.663 7.462 0.609 1.00 0.00 C ATOM 1637 C LYS A 104 -20.797 7.613 1.621 1.00 0.00 C ATOM 1638 O LYS A 104 -21.378 8.672 1.750 1.00 0.00 O ATOM 1639 CB LYS A 104 -20.205 6.719 -0.604 1.00 0.00 C ATOM 1640 CG LYS A 104 -19.105 6.566 -1.655 1.00 0.00 C ATOM 1641 CD LYS A 104 -19.599 5.620 -2.746 1.00 0.00 C ATOM 1642 CE LYS A 104 -18.436 5.231 -3.656 1.00 0.00 C ATOM 1643 NZ LYS A 104 -18.961 4.917 -5.016 1.00 0.00 N ATOM 0 H LYS A 104 -18.286 5.839 0.633 1.00 0.00 H new ATOM 0 HA LYS A 104 -19.295 8.454 0.346 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -20.574 5.738 -0.305 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -21.050 7.262 -1.026 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -18.853 7.537 -2.082 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -18.197 6.174 -1.197 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -20.036 4.728 -2.297 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -20.385 6.101 -3.329 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -17.714 6.045 -3.711 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -17.912 4.367 -3.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -18.323 5.315 -5.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -19.018 3.886 -5.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -19.908 5.332 -5.127 1.00 0.00 H new ATOM 1657 N ASP A 105 -21.141 6.568 2.319 1.00 0.00 N ATOM 1658 CA ASP A 105 -22.271 6.685 3.282 1.00 0.00 C ATOM 1659 C ASP A 105 -21.765 6.864 4.707 1.00 0.00 C ATOM 1660 O ASP A 105 -20.846 6.206 5.144 1.00 0.00 O ATOM 1661 CB ASP A 105 -23.134 5.428 3.226 1.00 0.00 C ATOM 1662 CG ASP A 105 -24.607 5.833 3.134 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -25.358 5.132 2.478 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -24.956 6.847 3.721 1.00 0.00 O ATOM 0 H ASP A 105 -20.697 5.651 2.267 1.00 0.00 H new ATOM 0 HA ASP A 105 -22.857 7.560 3.000 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.857 4.820 2.365 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -22.967 4.818 4.114 1.00 0.00 H new ATOM 1670 N TYR A 106 -22.393 7.736 5.440 1.00 0.00 N ATOM 1671 CA TYR A 106 -21.999 7.945 6.855 1.00 0.00 C ATOM 1672 C TYR A 106 -22.376 6.683 7.627 1.00 0.00 C ATOM 1673 O TYR A 106 -21.650 6.213 8.478 1.00 0.00 O ATOM 1674 CB TYR A 106 -22.753 9.151 7.414 1.00 0.00 C ATOM 1675 CG TYR A 106 -22.258 9.447 8.808 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -21.049 10.127 8.991 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -23.008 9.038 9.916 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -20.590 10.402 10.284 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -22.549 9.312 11.212 1.00 0.00 C ATOM 1680 CZ TYR A 106 -21.340 9.996 11.393 1.00 0.00 C ATOM 1681 OH TYR A 106 -20.888 10.269 12.668 1.00 0.00 O ATOM 0 H TYR A 106 -23.167 8.316 5.117 1.00 0.00 H new ATOM 0 HA TYR A 106 -20.929 8.135 6.943 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -22.603 10.018 6.771 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -23.824 8.949 7.431 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -20.470 10.440 8.134 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -23.940 8.511 9.773 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.657 10.927 10.426 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -23.126 8.997 12.069 1.00 0.00 H new ATOM 0 HH TYR A 106 -21.527 9.920 13.323 1.00 0.00 H new ATOM 1691 N ASP A 107 -23.508 6.121 7.305 1.00 0.00 N ATOM 1692 CA ASP A 107 -23.958 4.871 7.975 1.00 0.00 C ATOM 1693 C ASP A 107 -23.552 3.691 7.097 1.00 0.00 C ATOM 1694 O ASP A 107 -24.116 2.618 7.175 1.00 0.00 O ATOM 1695 CB ASP A 107 -25.478 4.889 8.150 1.00 0.00 C ATOM 1696 CG ASP A 107 -25.869 5.988 9.140 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -27.004 6.431 9.084 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -25.030 6.364 9.942 1.00 0.00 O ATOM 0 H ASP A 107 -24.148 6.480 6.597 1.00 0.00 H new ATOM 0 HA ASP A 107 -23.499 4.786 8.960 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -25.963 5.062 7.189 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -25.824 3.921 8.511 1.00 0.00 H new ATOM 1704 N VAL A 108 -22.571 3.894 6.259 1.00 0.00 N ATOM 1705 CA VAL A 108 -22.104 2.804 5.364 1.00 0.00 C ATOM 1706 C VAL A 108 -21.996 1.519 6.180 1.00 0.00 C ATOM 1707 O VAL A 108 -21.724 1.544 7.362 1.00 0.00 O ATOM 1708 CB VAL A 108 -20.739 3.194 4.801 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -19.839 3.627 5.953 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -20.089 2.014 4.070 1.00 0.00 C ATOM 0 H VAL A 108 -22.071 4.777 6.158 1.00 0.00 H new ATOM 0 HA VAL A 108 -22.801 2.647 4.541 1.00 0.00 H new ATOM 0 HB VAL A 108 -20.872 4.009 4.089 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -18.860 3.908 5.564 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -20.286 4.480 6.463 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -19.726 2.802 6.657 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -19.118 2.318 3.679 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -19.956 1.184 4.764 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -20.730 1.699 3.246 1.00 0.00 H new ATOM 1720 N GLU A 109 -22.230 0.400 5.568 1.00 0.00 N ATOM 1721 CA GLU A 109 -22.169 -0.874 6.322 1.00 0.00 C ATOM 1722 C GLU A 109 -20.739 -1.176 6.749 1.00 0.00 C ATOM 1723 O GLU A 109 -19.780 -0.868 6.069 1.00 0.00 O ATOM 1724 CB GLU A 109 -22.700 -2.022 5.464 1.00 0.00 C ATOM 1725 CG GLU A 109 -21.549 -2.945 5.057 1.00 0.00 C ATOM 1726 CD GLU A 109 -22.037 -3.920 3.986 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -23.239 -4.047 3.832 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -21.198 -4.518 3.332 1.00 0.00 O ATOM 0 H GLU A 109 -22.461 0.312 4.578 1.00 0.00 H new ATOM 0 HA GLU A 109 -22.790 -0.773 7.212 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -23.450 -2.585 6.019 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -23.192 -1.626 4.575 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -20.714 -2.357 4.676 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -21.183 -3.494 5.925 1.00 0.00 H new ATOM 1736 N ILE A 110 -20.612 -1.798 7.875 1.00 0.00 N ATOM 1737 CA ILE A 110 -19.277 -2.173 8.394 1.00 0.00 C ATOM 1738 C ILE A 110 -19.232 -3.685 8.588 1.00 0.00 C ATOM 1739 O ILE A 110 -19.890 -4.238 9.448 1.00 0.00 O ATOM 1740 CB ILE A 110 -19.037 -1.455 9.721 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -18.879 0.049 9.474 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -17.775 -2.001 10.376 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -17.731 0.292 8.492 1.00 0.00 C ATOM 0 H ILE A 110 -21.393 -2.069 8.472 1.00 0.00 H new ATOM 0 HA ILE A 110 -18.497 -1.881 7.691 1.00 0.00 H new ATOM 0 HB ILE A 110 -19.889 -1.623 10.380 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -19.806 0.461 9.074 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -18.681 0.563 10.415 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -17.605 -1.488 11.323 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -17.893 -3.069 10.558 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -16.923 -1.837 9.716 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -17.621 1.362 8.318 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -16.805 -0.105 8.909 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -17.948 -0.208 7.548 1.00 0.00 H new ATOM 1755 N ARG A 111 -18.452 -4.361 7.792 1.00 0.00 N ATOM 1756 CA ARG A 111 -18.356 -5.840 7.923 1.00 0.00 C ATOM 1757 C ARG A 111 -17.037 -6.189 8.583 1.00 0.00 C ATOM 1758 O ARG A 111 -15.974 -6.019 8.019 1.00 0.00 O ATOM 1759 CB ARG A 111 -18.434 -6.482 6.544 1.00 0.00 C ATOM 1760 CG ARG A 111 -19.860 -6.321 6.029 1.00 0.00 C ATOM 1761 CD ARG A 111 -19.948 -6.790 4.584 1.00 0.00 C ATOM 1762 NE ARG A 111 -21.361 -6.664 4.120 1.00 0.00 N ATOM 1763 CZ ARG A 111 -21.693 -7.063 2.926 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -20.791 -7.557 2.130 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -22.931 -6.951 2.524 1.00 0.00 N ATOM 0 H ARG A 111 -17.876 -3.952 7.056 1.00 0.00 H new ATOM 0 HA ARG A 111 -19.179 -6.213 8.532 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -17.727 -6.008 5.863 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -18.166 -7.537 6.599 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -20.547 -6.897 6.649 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -20.165 -5.277 6.100 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -19.289 -6.193 3.953 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -19.615 -7.825 4.503 1.00 0.00 H new ATOM 0 HE ARG A 111 -22.067 -6.265 4.739 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -19.822 -7.632 2.441 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -21.052 -7.869 1.195 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -23.635 -6.552 3.145 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -23.194 -7.263 1.589 1.00 0.00 H new ATOM 1779 N LEU A 112 -17.103 -6.667 9.783 1.00 0.00 N ATOM 1780 CA LEU A 112 -15.864 -7.021 10.507 1.00 0.00 C ATOM 1781 C LEU A 112 -15.623 -8.523 10.401 1.00 0.00 C ATOM 1782 O LEU A 112 -16.542 -9.318 10.420 1.00 0.00 O ATOM 1783 CB LEU A 112 -16.015 -6.635 11.973 1.00 0.00 C ATOM 1784 CG LEU A 112 -16.577 -5.216 12.074 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -16.422 -4.719 13.511 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -15.819 -4.285 11.121 1.00 0.00 C ATOM 0 H LEU A 112 -17.968 -6.829 10.298 1.00 0.00 H new ATOM 0 HA LEU A 112 -15.020 -6.488 10.070 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -16.679 -7.337 12.478 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -15.050 -6.691 12.476 1.00 0.00 H new ATOM 0 HG LEU A 112 -17.631 -5.221 11.798 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -16.820 -3.708 13.591 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -16.968 -5.379 14.185 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -15.366 -4.716 13.783 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -16.225 -3.276 11.198 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -14.762 -4.273 11.388 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -15.930 -4.643 10.098 1.00 0.00 H new ATOM 1798 N SER A 113 -14.390 -8.913 10.305 1.00 0.00 N ATOM 1799 CA SER A 113 -14.067 -10.361 10.213 1.00 0.00 C ATOM 1800 C SER A 113 -13.632 -10.844 11.594 1.00 0.00 C ATOM 1801 O SER A 113 -13.319 -10.052 12.462 1.00 0.00 O ATOM 1802 CB SER A 113 -12.934 -10.569 9.210 1.00 0.00 C ATOM 1803 OG SER A 113 -12.644 -11.956 9.108 1.00 0.00 O ATOM 0 H SER A 113 -13.584 -8.288 10.286 1.00 0.00 H new ATOM 0 HA SER A 113 -14.939 -10.923 9.879 1.00 0.00 H new ATOM 0 HB2 SER A 113 -13.219 -10.173 8.235 1.00 0.00 H new ATOM 0 HB3 SER A 113 -12.046 -10.023 9.529 1.00 0.00 H new ATOM 0 HG SER A 113 -11.918 -12.092 8.464 1.00 0.00 H new ATOM 1809 N HIS A 114 -13.608 -12.128 11.815 1.00 0.00 N ATOM 1810 CA HIS A 114 -13.194 -12.630 13.151 1.00 0.00 C ATOM 1811 C HIS A 114 -11.955 -11.859 13.602 1.00 0.00 C ATOM 1812 O HIS A 114 -11.718 -11.679 14.780 1.00 0.00 O ATOM 1813 CB HIS A 114 -12.867 -14.122 13.066 1.00 0.00 C ATOM 1814 CG HIS A 114 -12.552 -14.641 14.440 1.00 0.00 C ATOM 1815 ND1 HIS A 114 -11.251 -14.842 14.876 1.00 0.00 N ATOM 1816 CD2 HIS A 114 -13.360 -14.996 15.494 1.00 0.00 C ATOM 1817 CE1 HIS A 114 -11.312 -15.300 16.138 1.00 0.00 C ATOM 1818 NE2 HIS A 114 -12.570 -15.409 16.561 1.00 0.00 N ATOM 0 H HIS A 114 -13.855 -12.846 11.134 1.00 0.00 H new ATOM 0 HA HIS A 114 -14.004 -12.486 13.866 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -13.711 -14.667 12.644 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -12.019 -14.283 12.401 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -14.439 -14.960 15.493 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -10.447 -15.549 16.735 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -12.888 -15.729 17.476 1.00 0.00 H new ATOM 1827 N GLU A 115 -11.171 -11.395 12.673 1.00 0.00 N ATOM 1828 CA GLU A 115 -9.951 -10.624 13.040 1.00 0.00 C ATOM 1829 C GLU A 115 -10.350 -9.340 13.773 1.00 0.00 C ATOM 1830 O GLU A 115 -9.636 -8.864 14.630 1.00 0.00 O ATOM 1831 CB GLU A 115 -9.175 -10.263 11.772 1.00 0.00 C ATOM 1832 CG GLU A 115 -8.597 -11.533 11.144 1.00 0.00 C ATOM 1833 CD GLU A 115 -7.751 -11.161 9.923 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -7.092 -12.044 9.395 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -7.778 -10.004 9.540 1.00 0.00 O ATOM 0 H GLU A 115 -11.322 -11.516 11.672 1.00 0.00 H new ATOM 0 HA GLU A 115 -9.325 -11.233 13.692 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -9.832 -9.761 11.062 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.372 -9.566 12.011 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -7.987 -12.067 11.873 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -9.403 -12.205 10.850 1.00 0.00 H new ATOM 1843 N HIS A 116 -11.481 -8.773 13.444 1.00 0.00 N ATOM 1844 CA HIS A 116 -11.902 -7.519 14.134 1.00 0.00 C ATOM 1845 C HIS A 116 -13.183 -7.769 14.936 1.00 0.00 C ATOM 1846 O HIS A 116 -14.168 -8.265 14.425 1.00 0.00 O ATOM 1847 CB HIS A 116 -12.144 -6.423 13.096 1.00 0.00 C ATOM 1848 CG HIS A 116 -10.842 -6.084 12.425 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -9.763 -5.337 12.837 1.00 0.00 N flip ATOM 1850 CD2 HIS A 116 -10.516 -6.550 11.159 1.00 0.00 C flip ATOM 1851 CE1 HIS A 116 -8.791 -5.340 11.843 1.00 0.00 C flip ATOM 1852 NE2 HIS A 116 -9.293 -6.081 10.854 1.00 0.00 N flip ATOM 0 H HIS A 116 -12.126 -9.120 12.734 1.00 0.00 H new ATOM 0 HA HIS A 116 -11.114 -7.202 14.817 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -12.871 -6.759 12.357 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -12.562 -5.537 13.575 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -11.133 -7.176 10.532 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -7.831 -4.846 11.867 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -8.809 -6.269 9.976 1.00 0.00 H new ATOM 1861 N GLN A 117 -13.166 -7.429 16.196 1.00 0.00 N ATOM 1862 CA GLN A 117 -14.365 -7.641 17.056 1.00 0.00 C ATOM 1863 C GLN A 117 -15.368 -6.497 16.894 1.00 0.00 C ATOM 1864 O GLN A 117 -16.565 -6.710 16.888 1.00 0.00 O ATOM 1865 CB GLN A 117 -13.909 -7.717 18.515 1.00 0.00 C ATOM 1866 CG GLN A 117 -15.100 -7.542 19.461 1.00 0.00 C ATOM 1867 CD GLN A 117 -14.602 -7.568 20.906 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -13.345 -7.829 21.143 1.00 0.00 O flip ATOM 1869 NE2 GLN A 117 -15.365 -7.349 21.828 1.00 0.00 N flip ATOM 0 H GLN A 117 -12.366 -7.010 16.670 1.00 0.00 H new ATOM 0 HA GLN A 117 -14.857 -8.567 16.758 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -13.427 -8.677 18.702 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -13.166 -6.944 18.710 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -15.608 -6.600 19.256 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -15.828 -8.338 19.300 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -16.347 -7.145 21.640 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -15.023 -7.369 22.789 1.00 0.00 H new ATOM 1878 N ALA A 118 -14.902 -5.283 16.791 1.00 0.00 N ATOM 1879 CA ALA A 118 -15.855 -4.145 16.662 1.00 0.00 C ATOM 1880 C ALA A 118 -15.145 -2.927 16.066 1.00 0.00 C ATOM 1881 O ALA A 118 -13.937 -2.893 15.946 1.00 0.00 O ATOM 1882 CB ALA A 118 -16.392 -3.793 18.051 1.00 0.00 C ATOM 0 H ALA A 118 -13.914 -5.031 16.790 1.00 0.00 H new ATOM 0 HA ALA A 118 -16.675 -4.430 16.003 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -17.091 -2.961 17.971 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -16.904 -4.658 18.473 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -15.564 -3.509 18.700 1.00 0.00 H new ATOM 1888 N TYR A 119 -15.894 -1.920 15.693 1.00 0.00 N ATOM 1889 CA TYR A 119 -15.271 -0.697 15.111 1.00 0.00 C ATOM 1890 C TYR A 119 -15.885 0.554 15.735 1.00 0.00 C ATOM 1891 O TYR A 119 -16.975 0.524 16.268 1.00 0.00 O ATOM 1892 CB TYR A 119 -15.515 -0.671 13.605 1.00 0.00 C ATOM 1893 CG TYR A 119 -16.968 -0.370 13.330 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -17.903 -1.409 13.313 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -17.382 0.943 13.083 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -19.249 -1.140 13.052 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -18.731 1.214 12.818 1.00 0.00 C ATOM 1898 CZ TYR A 119 -19.664 0.170 12.804 1.00 0.00 C ATOM 1899 OH TYR A 119 -20.991 0.435 12.542 1.00 0.00 O ATOM 0 H TYR A 119 -16.911 -1.894 15.767 1.00 0.00 H new ATOM 0 HA TYR A 119 -14.201 -0.714 15.316 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -14.883 0.084 13.137 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -15.243 -1.631 13.166 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -17.584 -2.423 13.502 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -16.662 1.748 13.097 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -19.969 -1.945 13.042 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -19.051 2.227 12.625 1.00 0.00 H new ATOM 0 HH TYR A 119 -21.109 1.396 12.393 1.00 0.00 H new ATOM 1909 N ARG A 120 -15.192 1.657 15.663 1.00 0.00 N ATOM 1910 CA ARG A 120 -15.736 2.916 16.239 1.00 0.00 C ATOM 1911 C ARG A 120 -15.441 4.078 15.295 1.00 0.00 C ATOM 1912 O ARG A 120 -14.451 4.087 14.594 1.00 0.00 O ATOM 1913 CB ARG A 120 -15.056 3.228 17.574 1.00 0.00 C ATOM 1914 CG ARG A 120 -15.377 2.146 18.602 1.00 0.00 C ATOM 1915 CD ARG A 120 -14.691 2.494 19.921 1.00 0.00 C ATOM 1916 NE ARG A 120 -15.490 3.526 20.640 1.00 0.00 N ATOM 1917 CZ ARG A 120 -14.933 4.259 21.565 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -13.672 4.100 21.856 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -15.641 5.151 22.201 1.00 0.00 N ATOM 0 H ARG A 120 -14.272 1.739 15.230 1.00 0.00 H new ATOM 0 HA ARG A 120 -16.809 2.789 16.382 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -13.977 3.295 17.433 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.391 4.198 17.942 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -16.455 2.072 18.746 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -15.036 1.174 18.245 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.591 1.601 20.538 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -13.684 2.865 19.732 1.00 0.00 H new ATOM 0 HE ARG A 120 -16.474 3.660 20.409 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -13.118 3.401 21.360 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -13.239 4.674 22.579 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -16.628 5.275 21.975 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -15.208 5.725 22.924 1.00 0.00 H new ATOM 1933 N TRP A 121 -16.269 5.081 15.311 1.00 0.00 N ATOM 1934 CA TRP A 121 -16.008 6.270 14.459 1.00 0.00 C ATOM 1935 C TRP A 121 -15.641 7.415 15.396 1.00 0.00 C ATOM 1936 O TRP A 121 -16.476 7.932 16.112 1.00 0.00 O ATOM 1937 CB TRP A 121 -17.260 6.628 13.656 1.00 0.00 C ATOM 1938 CG TRP A 121 -17.373 5.723 12.469 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -18.172 4.636 12.392 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -16.682 5.817 11.191 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -18.017 4.054 11.143 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -17.109 4.749 10.367 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -15.737 6.720 10.672 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -16.614 4.584 9.070 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -15.236 6.553 9.374 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -15.676 5.491 8.573 1.00 0.00 C ATOM 0 H TRP A 121 -17.116 5.129 15.878 1.00 0.00 H new ATOM 0 HA TRP A 121 -15.203 6.072 13.751 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -18.146 6.533 14.284 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -17.210 7.667 13.330 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -18.824 4.279 13.175 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -18.512 3.217 10.835 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -15.396 7.547 11.277 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -16.954 3.762 8.458 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -14.505 7.248 8.988 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -15.290 5.374 7.571 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.391 7.790 15.429 1.00 0.00 N ATOM 1958 CA LEU A 122 -13.968 8.876 16.356 1.00 0.00 C ATOM 1959 C LEU A 122 -13.211 9.954 15.589 1.00 0.00 C ATOM 1960 O LEU A 122 -12.921 9.818 14.417 1.00 0.00 O ATOM 1961 CB LEU A 122 -13.045 8.312 17.443 1.00 0.00 C ATOM 1962 CG LEU A 122 -13.415 6.858 17.766 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -12.308 5.924 17.273 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -13.575 6.694 19.282 1.00 0.00 C ATOM 0 H LEU A 122 -13.647 7.392 14.856 1.00 0.00 H new ATOM 0 HA LEU A 122 -14.861 9.303 16.813 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.008 8.364 17.110 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -13.121 8.921 18.344 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.352 6.607 17.269 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.573 4.892 17.504 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.190 6.036 16.195 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.371 6.177 17.769 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -13.838 5.661 19.511 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -12.637 6.948 19.776 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -14.364 7.356 19.638 1.00 0.00 H new ATOM 1976 N GLY A 123 -12.876 11.023 16.254 1.00 0.00 N ATOM 1977 CA GLY A 123 -12.125 12.113 15.582 1.00 0.00 C ATOM 1978 C GLY A 123 -10.633 11.789 15.619 1.00 0.00 C ATOM 1979 O GLY A 123 -10.224 10.760 16.118 1.00 0.00 O ATOM 0 H GLY A 123 -13.092 11.187 17.237 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -12.461 12.221 14.551 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -12.316 13.064 16.080 1.00 0.00 H new ATOM 1983 N LEU A 124 -9.819 12.661 15.096 1.00 0.00 N ATOM 1984 CA LEU A 124 -8.352 12.413 15.102 1.00 0.00 C ATOM 1985 C LEU A 124 -7.867 12.237 16.541 1.00 0.00 C ATOM 1986 O LEU A 124 -7.025 11.411 16.824 1.00 0.00 O ATOM 1987 CB LEU A 124 -7.642 13.613 14.468 1.00 0.00 C ATOM 1988 CG LEU A 124 -6.125 13.440 14.557 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -5.724 12.054 14.056 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -5.445 14.500 13.688 1.00 0.00 C ATOM 0 H LEU A 124 -10.108 13.538 14.663 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.130 11.509 14.535 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -7.943 13.713 13.425 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -7.941 14.530 14.975 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.815 13.551 15.596 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -4.642 11.942 14.124 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -6.207 11.292 14.668 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -6.037 11.938 13.018 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.363 14.381 13.748 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -5.766 14.383 12.653 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -5.721 15.493 14.043 1.00 0.00 H new ATOM 2002 N GLU A 125 -8.380 13.023 17.448 1.00 0.00 N ATOM 2003 CA GLU A 125 -7.939 12.927 18.874 1.00 0.00 C ATOM 2004 C GLU A 125 -8.169 11.517 19.421 1.00 0.00 C ATOM 2005 O GLU A 125 -7.261 10.880 19.918 1.00 0.00 O ATOM 2006 CB GLU A 125 -8.739 13.932 19.708 1.00 0.00 C ATOM 2007 CG GLU A 125 -10.226 13.551 19.716 1.00 0.00 C ATOM 2008 CD GLU A 125 -11.034 14.680 20.358 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -10.424 15.619 20.842 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -12.250 14.585 20.352 1.00 0.00 O ATOM 0 H GLU A 125 -9.090 13.732 17.264 1.00 0.00 H new ATOM 0 HA GLU A 125 -6.873 13.149 18.930 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -8.357 13.955 20.728 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -8.615 14.935 19.299 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -10.573 13.373 18.698 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -10.373 12.623 20.269 1.00 0.00 H new ATOM 2018 N GLU A 126 -9.370 11.031 19.345 1.00 0.00 N ATOM 2019 CA GLU A 126 -9.651 9.669 19.869 1.00 0.00 C ATOM 2020 C GLU A 126 -8.988 8.641 18.965 1.00 0.00 C ATOM 2021 O GLU A 126 -8.310 7.744 19.412 1.00 0.00 O ATOM 2022 CB GLU A 126 -11.155 9.444 19.877 1.00 0.00 C ATOM 2023 CG GLU A 126 -11.706 9.595 21.292 1.00 0.00 C ATOM 2024 CD GLU A 126 -11.072 10.803 21.985 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -11.627 11.884 21.876 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -10.044 10.626 22.616 1.00 0.00 O ATOM 0 H GLU A 126 -10.172 11.517 18.943 1.00 0.00 H new ATOM 0 HA GLU A 126 -9.260 9.569 20.881 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -11.640 10.159 19.212 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -11.383 8.449 19.495 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -12.789 9.715 21.257 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -11.504 8.691 21.866 1.00 0.00 H new ATOM 2034 N ALA A 127 -9.157 8.777 17.687 1.00 0.00 N ATOM 2035 CA ALA A 127 -8.512 7.809 16.779 1.00 0.00 C ATOM 2036 C ALA A 127 -7.039 7.753 17.162 1.00 0.00 C ATOM 2037 O ALA A 127 -6.416 6.709 17.158 1.00 0.00 O ATOM 2038 CB ALA A 127 -8.666 8.296 15.340 1.00 0.00 C ATOM 0 H ALA A 127 -9.708 9.508 17.238 1.00 0.00 H new ATOM 0 HA ALA A 127 -8.964 6.820 16.859 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -8.192 7.586 14.663 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.725 8.379 15.095 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -8.191 9.271 15.233 1.00 0.00 H new ATOM 2044 N CYS A 128 -6.490 8.879 17.522 1.00 0.00 N ATOM 2045 CA CYS A 128 -5.068 8.922 17.944 1.00 0.00 C ATOM 2046 C CYS A 128 -4.948 8.304 19.337 1.00 0.00 C ATOM 2047 O CYS A 128 -3.996 7.615 19.646 1.00 0.00 O ATOM 2048 CB CYS A 128 -4.597 10.373 17.979 1.00 0.00 C ATOM 2049 SG CYS A 128 -3.872 10.804 16.380 1.00 0.00 S ATOM 0 H CYS A 128 -6.972 9.778 17.541 1.00 0.00 H new ATOM 0 HA CYS A 128 -4.451 8.362 17.241 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -5.435 11.034 18.202 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -3.863 10.510 18.773 1.00 0.00 H new ATOM 0 HG CYS A 128 -3.471 12.040 16.404 1.00 0.00 H new ATOM 2055 N GLN A 129 -5.916 8.542 20.182 1.00 0.00 N ATOM 2056 CA GLN A 129 -5.864 7.960 21.553 1.00 0.00 C ATOM 2057 C GLN A 129 -5.956 6.439 21.445 1.00 0.00 C ATOM 2058 O GLN A 129 -5.157 5.717 22.006 1.00 0.00 O ATOM 2059 CB GLN A 129 -7.028 8.518 22.392 1.00 0.00 C ATOM 2060 CG GLN A 129 -8.263 7.611 22.300 1.00 0.00 C ATOM 2061 CD GLN A 129 -8.086 6.393 23.209 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -7.007 6.141 23.708 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -9.114 5.627 23.452 1.00 0.00 N ATOM 0 H GLN A 129 -6.738 9.113 19.982 1.00 0.00 H new ATOM 0 HA GLN A 129 -4.928 8.227 22.043 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.718 8.610 23.433 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.282 9.520 22.045 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.155 8.166 22.591 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.411 7.288 21.270 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.019 5.840 23.032 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -9.013 4.815 24.062 1.00 0.00 H new ATOM 2072 N LEU A 130 -6.916 5.948 20.712 1.00 0.00 N ATOM 2073 CA LEU A 130 -7.056 4.474 20.546 1.00 0.00 C ATOM 2074 C LEU A 130 -5.840 3.947 19.794 1.00 0.00 C ATOM 2075 O LEU A 130 -5.249 2.953 20.164 1.00 0.00 O ATOM 2076 CB LEU A 130 -8.316 4.179 19.729 1.00 0.00 C ATOM 2077 CG LEU A 130 -9.564 4.529 20.535 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -10.619 5.097 19.592 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -10.121 3.265 21.191 1.00 0.00 C ATOM 0 H LEU A 130 -7.613 6.506 20.219 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.129 3.994 21.522 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -8.300 4.754 18.803 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -8.338 3.126 19.450 1.00 0.00 H new ATOM 0 HG LEU A 130 -9.309 5.260 21.302 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -11.515 5.350 20.159 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -10.230 5.993 19.108 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -10.867 4.354 18.834 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -11.012 3.516 21.766 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -10.379 2.539 20.420 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -9.369 2.838 21.855 1.00 0.00 H new ATOM 2091 N ALA A 131 -5.454 4.618 18.742 1.00 0.00 N ATOM 2092 CA ALA A 131 -4.270 4.167 17.969 1.00 0.00 C ATOM 2093 C ALA A 131 -3.016 4.608 18.715 1.00 0.00 C ATOM 2094 O ALA A 131 -2.158 5.280 18.183 1.00 0.00 O ATOM 2095 CB ALA A 131 -4.300 4.785 16.569 1.00 0.00 C ATOM 0 H ALA A 131 -5.910 5.459 18.388 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.276 3.082 17.865 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -3.429 4.451 16.005 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.208 4.473 16.053 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.285 5.872 16.651 1.00 0.00 H new ATOM 2101 N GLN A 132 -2.932 4.235 19.960 1.00 0.00 N ATOM 2102 CA GLN A 132 -1.771 4.616 20.811 1.00 0.00 C ATOM 2103 C GLN A 132 -0.481 4.610 19.996 1.00 0.00 C ATOM 2104 O GLN A 132 0.405 5.412 20.215 1.00 0.00 O ATOM 2105 CB GLN A 132 -1.637 3.589 21.936 1.00 0.00 C ATOM 2106 CG GLN A 132 -1.806 2.177 21.362 1.00 0.00 C ATOM 2107 CD GLN A 132 -0.504 1.389 21.531 1.00 0.00 C ATOM 2108 OE1 GLN A 132 0.507 1.636 20.740 1.00 0.00 O flip ATOM 2109 NE2 GLN A 132 -0.405 0.536 22.391 1.00 0.00 N flip ATOM 0 H GLN A 132 -3.636 3.669 20.434 1.00 0.00 H new ATOM 0 HA GLN A 132 -1.936 5.617 21.209 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -0.663 3.684 22.415 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -2.389 3.774 22.703 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -2.622 1.663 21.871 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -2.074 2.233 20.307 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -1.192 0.341 23.009 1.00 0.00 H new ATOM 0 HE22 GLN A 132 0.466 0.015 22.494 1.00 0.00 H new ATOM 2118 N PHE A 133 -0.357 3.702 19.081 1.00 0.00 N ATOM 2119 CA PHE A 133 0.889 3.630 18.277 1.00 0.00 C ATOM 2120 C PHE A 133 1.115 4.952 17.550 1.00 0.00 C ATOM 2121 O PHE A 133 0.280 5.419 16.804 1.00 0.00 O ATOM 2122 CB PHE A 133 0.756 2.485 17.275 1.00 0.00 C ATOM 2123 CG PHE A 133 0.499 1.212 18.047 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -0.788 0.943 18.528 1.00 0.00 C ATOM 2125 CD2 PHE A 133 1.544 0.323 18.307 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -1.029 -0.223 19.265 1.00 0.00 C ATOM 2127 CE2 PHE A 133 1.304 -0.842 19.048 1.00 0.00 C ATOM 2128 CZ PHE A 133 0.018 -1.113 19.528 1.00 0.00 C ATOM 0 H PHE A 133 -1.064 3.004 18.852 1.00 0.00 H new ATOM 0 HA PHE A 133 1.745 3.448 18.927 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -0.061 2.680 16.580 1.00 0.00 H new ATOM 0 HB3 PHE A 133 1.665 2.392 16.680 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -1.594 1.634 18.331 1.00 0.00 H new ATOM 0 HD2 PHE A 133 2.537 0.533 17.937 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.023 -0.435 19.630 1.00 0.00 H new ATOM 0 HE2 PHE A 133 2.112 -1.531 19.249 1.00 0.00 H new ATOM 0 HZ PHE A 133 -0.166 -2.009 20.102 1.00 0.00 H new ATOM 2138 N LYS A 134 2.248 5.558 17.779 1.00 0.00 N ATOM 2139 CA LYS A 134 2.565 6.860 17.127 1.00 0.00 C ATOM 2140 C LYS A 134 2.435 6.743 15.609 1.00 0.00 C ATOM 2141 O LYS A 134 2.016 7.664 14.935 1.00 0.00 O ATOM 2142 CB LYS A 134 4.005 7.246 17.472 1.00 0.00 C ATOM 2143 CG LYS A 134 4.340 8.584 16.818 1.00 0.00 C ATOM 2144 CD LYS A 134 5.801 8.935 17.083 1.00 0.00 C ATOM 2145 CE LYS A 134 6.088 10.328 16.526 1.00 0.00 C ATOM 2146 NZ LYS A 134 5.963 10.302 15.043 1.00 0.00 N ATOM 0 H LYS A 134 2.976 5.202 18.398 1.00 0.00 H new ATOM 0 HA LYS A 134 1.867 7.617 17.485 1.00 0.00 H new ATOM 0 HB2 LYS A 134 4.126 7.316 18.553 1.00 0.00 H new ATOM 0 HB3 LYS A 134 4.693 6.476 17.124 1.00 0.00 H new ATOM 0 HG2 LYS A 134 4.158 8.531 15.745 1.00 0.00 H new ATOM 0 HG3 LYS A 134 3.691 9.365 17.213 1.00 0.00 H new ATOM 0 HD2 LYS A 134 6.006 8.908 18.153 1.00 0.00 H new ATOM 0 HD3 LYS A 134 6.456 8.200 16.614 1.00 0.00 H new ATOM 0 HE2 LYS A 134 5.391 11.051 16.948 1.00 0.00 H new ATOM 0 HE3 LYS A 134 7.090 10.647 16.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 6.426 11.142 14.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 6.418 9.444 14.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 4.957 10.302 14.779 1.00 0.00 H new ATOM 2160 N GLU A 135 2.806 5.624 15.065 1.00 0.00 N ATOM 2161 CA GLU A 135 2.727 5.450 13.590 1.00 0.00 C ATOM 2162 C GLU A 135 1.318 5.759 13.120 1.00 0.00 C ATOM 2163 O GLU A 135 1.108 6.464 12.153 1.00 0.00 O ATOM 2164 CB GLU A 135 3.024 3.993 13.250 1.00 0.00 C ATOM 2165 CG GLU A 135 4.178 3.495 14.114 1.00 0.00 C ATOM 2166 CD GLU A 135 4.414 2.012 13.831 1.00 0.00 C ATOM 2167 OE1 GLU A 135 5.354 1.464 14.382 1.00 0.00 O ATOM 2168 OE2 GLU A 135 3.647 1.447 13.070 1.00 0.00 O ATOM 0 H GLU A 135 3.162 4.818 15.578 1.00 0.00 H new ATOM 0 HA GLU A 135 3.442 6.116 13.108 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.138 3.381 13.419 1.00 0.00 H new ATOM 0 HB3 GLU A 135 3.279 3.899 12.194 1.00 0.00 H new ATOM 0 HG2 GLU A 135 5.081 4.067 13.900 1.00 0.00 H new ATOM 0 HG3 GLU A 135 3.949 3.644 15.169 1.00 0.00 H new ATOM 2176 N MET A 136 0.349 5.216 13.789 1.00 0.00 N ATOM 2177 CA MET A 136 -1.051 5.450 13.381 1.00 0.00 C ATOM 2178 C MET A 136 -1.483 6.841 13.821 1.00 0.00 C ATOM 2179 O MET A 136 -2.056 7.589 13.052 1.00 0.00 O ATOM 2180 CB MET A 136 -1.918 4.382 14.024 1.00 0.00 C ATOM 2181 CG MET A 136 -1.328 3.009 13.691 1.00 0.00 C ATOM 2182 SD MET A 136 -1.034 2.889 11.908 1.00 0.00 S ATOM 2183 CE MET A 136 -2.657 3.455 11.337 1.00 0.00 C ATOM 0 H MET A 136 0.469 4.617 14.606 1.00 0.00 H new ATOM 0 HA MET A 136 -1.153 5.393 12.297 1.00 0.00 H new ATOM 0 HB2 MET A 136 -1.957 4.525 15.104 1.00 0.00 H new ATOM 0 HB3 MET A 136 -2.942 4.453 13.656 1.00 0.00 H new ATOM 0 HG2 MET A 136 -0.395 2.862 14.234 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.010 2.222 14.011 1.00 0.00 H new ATOM 0 HE1 MET A 136 -2.853 3.054 10.342 1.00 0.00 H new ATOM 0 HE2 MET A 136 -3.427 3.108 12.026 1.00 0.00 H new ATOM 0 HE3 MET A 136 -2.670 4.544 11.298 1.00 0.00 H new ATOM 2193 N LYS A 137 -1.191 7.219 15.031 1.00 0.00 N ATOM 2194 CA LYS A 137 -1.573 8.585 15.454 1.00 0.00 C ATOM 2195 C LYS A 137 -0.959 9.545 14.445 1.00 0.00 C ATOM 2196 O LYS A 137 -1.544 10.548 14.091 1.00 0.00 O ATOM 2197 CB LYS A 137 -1.036 8.874 16.859 1.00 0.00 C ATOM 2198 CG LYS A 137 -1.935 8.195 17.892 1.00 0.00 C ATOM 2199 CD LYS A 137 -1.094 7.442 18.922 1.00 0.00 C ATOM 2200 CE LYS A 137 -0.323 8.416 19.816 1.00 0.00 C ATOM 2201 NZ LYS A 137 -0.118 9.706 19.106 1.00 0.00 N ATOM 0 H LYS A 137 -0.714 6.652 15.732 1.00 0.00 H new ATOM 0 HA LYS A 137 -2.657 8.696 15.488 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -0.014 8.508 16.953 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -1.007 9.949 17.036 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -2.551 8.942 18.393 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -2.614 7.504 17.393 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -1.740 6.813 19.535 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -0.395 6.779 18.412 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -0.872 8.585 20.742 1.00 0.00 H new ATOM 0 HE3 LYS A 137 0.640 7.986 20.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 0.533 10.304 19.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 0.287 9.524 18.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -1.031 10.193 19.001 1.00 0.00 H new ATOM 2215 N ALA A 138 0.208 9.211 13.949 1.00 0.00 N ATOM 2216 CA ALA A 138 0.866 10.070 12.926 1.00 0.00 C ATOM 2217 C ALA A 138 0.143 9.876 11.593 1.00 0.00 C ATOM 2218 O ALA A 138 -0.188 10.826 10.910 1.00 0.00 O ATOM 2219 CB ALA A 138 2.330 9.668 12.766 1.00 0.00 C ATOM 0 H ALA A 138 0.732 8.376 14.212 1.00 0.00 H new ATOM 0 HA ALA A 138 0.818 11.113 13.239 1.00 0.00 H new ATOM 0 HB1 ALA A 138 2.802 10.302 12.016 1.00 0.00 H new ATOM 0 HB2 ALA A 138 2.846 9.787 13.719 1.00 0.00 H new ATOM 0 HB3 ALA A 138 2.389 8.627 12.450 1.00 0.00 H new ATOM 2225 N ALA A 139 -0.117 8.645 11.226 1.00 0.00 N ATOM 2226 CA ALA A 139 -0.831 8.384 9.947 1.00 0.00 C ATOM 2227 C ALA A 139 -2.175 9.091 10.011 1.00 0.00 C ATOM 2228 O ALA A 139 -2.564 9.811 9.112 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.072 6.884 9.788 1.00 0.00 C ATOM 0 H ALA A 139 0.136 7.813 11.759 1.00 0.00 H new ATOM 0 HA ALA A 139 -0.238 8.744 9.106 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.595 6.697 8.850 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.116 6.361 9.781 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -1.677 6.523 10.619 1.00 0.00 H new ATOM 2235 N LEU A 140 -2.869 8.901 11.090 1.00 0.00 N ATOM 2236 CA LEU A 140 -4.174 9.570 11.267 1.00 0.00 C ATOM 2237 C LEU A 140 -3.907 11.073 11.342 1.00 0.00 C ATOM 2238 O LEU A 140 -4.729 11.889 10.981 1.00 0.00 O ATOM 2239 CB LEU A 140 -4.811 9.077 12.572 1.00 0.00 C ATOM 2240 CG LEU A 140 -4.902 7.544 12.555 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -4.868 7.011 13.987 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -6.217 7.099 11.896 1.00 0.00 C ATOM 0 H LEU A 140 -2.582 8.303 11.865 1.00 0.00 H new ATOM 0 HA LEU A 140 -4.853 9.349 10.443 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -4.218 9.407 13.425 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -5.805 9.509 12.689 1.00 0.00 H new ATOM 0 HG LEU A 140 -4.057 7.151 11.989 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -4.933 5.923 13.972 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -3.936 7.312 14.465 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -5.711 7.417 14.546 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.271 6.010 11.890 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -7.060 7.500 12.459 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.255 7.470 10.872 1.00 0.00 H new ATOM 2254 N GLN A 141 -2.746 11.431 11.825 1.00 0.00 N ATOM 2255 CA GLN A 141 -2.379 12.868 11.953 1.00 0.00 C ATOM 2256 C GLN A 141 -2.005 13.462 10.591 1.00 0.00 C ATOM 2257 O GLN A 141 -2.516 14.491 10.196 1.00 0.00 O ATOM 2258 CB GLN A 141 -1.171 12.975 12.881 1.00 0.00 C ATOM 2259 CG GLN A 141 -1.617 13.484 14.248 1.00 0.00 C ATOM 2260 CD GLN A 141 -1.906 14.981 14.147 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -1.888 15.554 12.976 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -2.152 15.634 15.140 1.00 0.00 N flip ATOM 0 H GLN A 141 -2.029 10.778 12.140 1.00 0.00 H new ATOM 0 HA GLN A 141 -3.232 13.417 12.350 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -0.691 12.002 12.983 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -0.431 13.652 12.454 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -2.508 12.949 14.577 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.841 13.299 14.991 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -2.166 15.184 16.056 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -2.345 16.632 15.059 1.00 0.00 H new ATOM 2271 N GLU A 142 -1.111 12.836 9.876 1.00 0.00 N ATOM 2272 CA GLU A 142 -0.708 13.394 8.556 1.00 0.00 C ATOM 2273 C GLU A 142 -1.883 13.315 7.576 1.00 0.00 C ATOM 2274 O GLU A 142 -2.113 14.222 6.799 1.00 0.00 O ATOM 2275 CB GLU A 142 0.486 12.609 8.008 1.00 0.00 C ATOM 2276 CG GLU A 142 1.674 12.760 8.963 1.00 0.00 C ATOM 2277 CD GLU A 142 2.897 12.057 8.369 1.00 0.00 C ATOM 2278 OE1 GLU A 142 2.742 11.394 7.357 1.00 0.00 O ATOM 2279 OE2 GLU A 142 3.968 12.194 8.936 1.00 0.00 O ATOM 0 H GLU A 142 -0.646 11.969 10.146 1.00 0.00 H new ATOM 0 HA GLU A 142 -0.422 14.438 8.679 1.00 0.00 H new ATOM 0 HB2 GLU A 142 0.224 11.557 7.899 1.00 0.00 H new ATOM 0 HB3 GLU A 142 0.753 12.976 7.017 1.00 0.00 H new ATOM 0 HG2 GLU A 142 1.891 13.816 9.126 1.00 0.00 H new ATOM 0 HG3 GLU A 142 1.430 12.331 9.935 1.00 0.00 H new ATOM 2287 N GLY A 143 -2.636 12.248 7.607 1.00 0.00 N ATOM 2288 CA GLY A 143 -3.795 12.142 6.673 1.00 0.00 C ATOM 2289 C GLY A 143 -4.713 13.345 6.885 1.00 0.00 C ATOM 2290 O GLY A 143 -5.082 14.028 5.953 1.00 0.00 O ATOM 0 H GLY A 143 -2.501 11.453 8.231 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.446 12.112 5.641 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.340 11.215 6.853 1.00 0.00 H new ATOM 2294 N HIS A 144 -5.068 13.621 8.108 1.00 0.00 N ATOM 2295 CA HIS A 144 -5.946 14.794 8.379 1.00 0.00 C ATOM 2296 C HIS A 144 -5.235 16.063 7.906 1.00 0.00 C ATOM 2297 O HIS A 144 -5.829 16.940 7.315 1.00 0.00 O ATOM 2298 CB HIS A 144 -6.206 14.899 9.885 1.00 0.00 C ATOM 2299 CG HIS A 144 -7.327 15.868 10.142 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -7.105 17.219 10.370 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -8.688 15.695 10.226 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -8.298 17.800 10.580 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -9.294 16.915 10.503 1.00 0.00 N ATOM 0 H HIS A 144 -4.789 13.087 8.931 1.00 0.00 H new ATOM 0 HA HIS A 144 -6.893 14.675 7.852 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -6.460 13.919 10.289 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -5.302 15.230 10.397 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -9.206 14.756 10.097 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -8.434 18.852 10.785 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -10.291 17.096 10.622 1.00 0.00 H new ATOM 2312 N GLN A 145 -3.963 16.163 8.184 1.00 0.00 N ATOM 2313 CA GLN A 145 -3.186 17.372 7.778 1.00 0.00 C ATOM 2314 C GLN A 145 -3.240 17.574 6.257 1.00 0.00 C ATOM 2315 O GLN A 145 -3.417 18.676 5.780 1.00 0.00 O ATOM 2316 CB GLN A 145 -1.725 17.183 8.201 1.00 0.00 C ATOM 2317 CG GLN A 145 -0.947 18.481 7.965 1.00 0.00 C ATOM 2318 CD GLN A 145 -1.348 19.520 9.012 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -1.320 19.246 10.195 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -1.718 20.710 8.623 1.00 0.00 N ATOM 0 H GLN A 145 -3.423 15.453 8.679 1.00 0.00 H new ATOM 0 HA GLN A 145 -3.620 18.247 8.262 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -1.674 16.904 9.253 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -1.274 16.369 7.633 1.00 0.00 H new ATOM 0 HG2 GLN A 145 0.125 18.289 8.021 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -1.151 18.862 6.964 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -1.741 20.938 7.629 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -1.984 21.412 9.313 1.00 0.00 H new ATOM 2329 N PHE A 146 -3.070 16.531 5.493 1.00 0.00 N ATOM 2330 CA PHE A 146 -3.092 16.689 4.005 1.00 0.00 C ATOM 2331 C PHE A 146 -4.507 16.989 3.503 1.00 0.00 C ATOM 2332 O PHE A 146 -4.720 17.919 2.750 1.00 0.00 O ATOM 2333 CB PHE A 146 -2.583 15.405 3.353 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.636 15.545 1.850 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.825 15.264 1.171 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.503 15.957 1.137 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -3.889 15.392 -0.221 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.564 16.084 -0.259 1.00 0.00 C ATOM 2339 CZ PHE A 146 -2.757 15.801 -0.938 1.00 0.00 C ATOM 0 H PHE A 146 -2.917 15.580 5.828 1.00 0.00 H new ATOM 0 HA PHE A 146 -2.448 17.527 3.737 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -1.561 15.203 3.674 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.191 14.558 3.671 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.698 14.947 1.723 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -0.584 16.176 1.661 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.810 15.176 -0.742 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.691 16.400 -0.811 1.00 0.00 H new ATOM 0 HZ PHE A 146 -2.804 15.898 -2.013 1.00 0.00 H new ATOM 2349 N LEU A 147 -5.477 16.207 3.895 1.00 0.00 N ATOM 2350 CA LEU A 147 -6.865 16.454 3.410 1.00 0.00 C ATOM 2351 C LEU A 147 -7.250 17.907 3.672 1.00 0.00 C ATOM 2352 O LEU A 147 -7.867 18.550 2.848 1.00 0.00 O ATOM 2353 CB LEU A 147 -7.838 15.529 4.138 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.495 14.074 3.809 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.492 13.148 4.495 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -7.574 13.858 2.300 1.00 0.00 C ATOM 0 H LEU A 147 -5.369 15.413 4.526 1.00 0.00 H new ATOM 0 HA LEU A 147 -6.911 16.255 2.339 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -7.779 15.694 5.214 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -8.862 15.750 3.837 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.486 13.856 4.160 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -8.247 12.112 4.260 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.444 13.297 5.574 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -9.499 13.372 4.142 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -7.329 12.822 2.068 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -8.583 14.079 1.953 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.866 14.519 1.800 1.00 0.00 H new ATOM 2368 N CYS A 148 -6.875 18.436 4.799 1.00 0.00 N ATOM 2369 CA CYS A 148 -7.204 19.859 5.090 1.00 0.00 C ATOM 2370 C CYS A 148 -6.417 20.749 4.125 1.00 0.00 C ATOM 2371 O CYS A 148 -6.676 21.930 3.998 1.00 0.00 O ATOM 2372 CB CYS A 148 -6.811 20.200 6.526 1.00 0.00 C ATOM 2373 SG CYS A 148 -7.900 19.328 7.681 1.00 0.00 S ATOM 0 H CYS A 148 -6.357 17.949 5.530 1.00 0.00 H new ATOM 0 HA CYS A 148 -8.275 20.022 4.967 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -5.774 19.918 6.706 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -6.881 21.276 6.687 1.00 0.00 H new ATOM 0 HG CYS A 148 -7.437 18.132 7.895 1.00 0.00 H new ATOM 2379 N SER A 149 -5.442 20.190 3.456 1.00 0.00 N ATOM 2380 CA SER A 149 -4.613 20.994 2.511 1.00 0.00 C ATOM 2381 C SER A 149 -5.236 20.997 1.116 1.00 0.00 C ATOM 2382 O SER A 149 -4.847 21.763 0.258 1.00 0.00 O ATOM 2383 CB SER A 149 -3.220 20.376 2.418 1.00 0.00 C ATOM 2384 OG SER A 149 -2.242 21.396 2.556 1.00 0.00 O ATOM 0 H SER A 149 -5.184 19.206 3.525 1.00 0.00 H new ATOM 0 HA SER A 149 -4.558 22.018 2.881 1.00 0.00 H new ATOM 0 HB2 SER A 149 -3.091 19.625 3.197 1.00 0.00 H new ATOM 0 HB3 SER A 149 -3.099 19.867 1.462 1.00 0.00 H new ATOM 0 HG SER A 149 -1.347 21.001 2.498 1.00 0.00 H new ATOM 2390 N ILE A 150 -6.183 20.137 0.868 1.00 0.00 N ATOM 2391 CA ILE A 150 -6.792 20.095 -0.486 1.00 0.00 C ATOM 2392 C ILE A 150 -7.804 21.227 -0.633 1.00 0.00 C ATOM 2393 O ILE A 150 -7.501 22.386 -0.427 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.503 18.753 -0.698 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.767 17.642 0.049 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -7.520 18.418 -2.192 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -7.600 16.363 -0.021 1.00 0.00 C ATOM 0 H ILE A 150 -6.558 19.467 1.539 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.004 20.210 -1.230 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.522 18.830 -0.318 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.785 17.477 -0.394 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.604 17.930 1.088 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -8.025 17.464 -2.345 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -8.050 19.201 -2.734 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.497 18.350 -2.561 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -7.084 15.563 0.509 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -8.572 16.536 0.441 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -7.739 16.076 -1.063 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.005 20.891 -1.001 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.060 21.922 -1.181 1.00 0.00 C ATOM 2411 C GLU A 151 -10.656 22.301 0.177 1.00 0.00 C ATOM 2412 O GLU A 151 -11.500 23.165 0.265 1.00 0.00 O ATOM 2413 CB GLU A 151 -11.151 21.350 -2.087 1.00 0.00 C ATOM 2414 CG GLU A 151 -11.914 20.251 -1.342 1.00 0.00 C ATOM 2415 CD GLU A 151 -12.885 19.571 -2.307 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -13.020 20.057 -3.419 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -13.475 18.575 -1.924 1.00 0.00 O ATOM 0 H GLU A 151 -9.305 19.934 -1.187 1.00 0.00 H new ATOM 0 HA GLU A 151 -9.632 22.816 -1.634 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -11.837 22.141 -2.391 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -10.707 20.946 -2.997 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -11.216 19.520 -0.934 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -12.458 20.677 -0.499 1.00 0.00 H new ATOM 2425 N ALA A 152 -10.218 21.654 1.231 1.00 0.00 N ATOM 2426 CA ALA A 152 -10.742 21.962 2.596 1.00 0.00 C ATOM 2427 C ALA A 152 -11.917 22.937 2.515 1.00 0.00 C ATOM 2428 O ALA A 152 -13.061 22.559 2.668 1.00 0.00 O ATOM 2429 CB ALA A 152 -9.624 22.581 3.430 1.00 0.00 C ATOM 0 H ALA A 152 -9.512 20.918 1.201 1.00 0.00 H new ATOM 0 HA ALA A 152 -11.089 21.038 3.059 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -9.998 22.809 4.428 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -8.794 21.878 3.505 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -9.280 23.499 2.953 1.00 0.00 H new ATOM 2435 N LEU A 153 -11.644 24.194 2.274 1.00 0.00 N ATOM 2436 CA LEU A 153 -12.746 25.194 2.177 1.00 0.00 C ATOM 2437 C LEU A 153 -13.863 24.631 1.292 1.00 0.00 C ATOM 2438 O LEU A 153 -13.770 23.509 0.801 1.00 0.00 O ATOM 2439 CB LEU A 153 -12.205 26.490 1.562 1.00 0.00 C ATOM 2440 CG LEU A 153 -13.301 27.557 1.550 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -13.559 28.058 2.974 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -12.851 28.732 0.681 1.00 0.00 C ATOM 0 H LEU A 153 -10.705 24.570 2.140 1.00 0.00 H new ATOM 0 HA LEU A 153 -13.141 25.404 3.171 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -11.347 26.844 2.134 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -11.856 26.303 0.546 1.00 0.00 H new ATOM 0 HG LEU A 153 -14.217 27.124 1.148 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -14.341 28.817 2.956 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -13.877 27.225 3.601 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -12.644 28.489 3.380 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -13.629 29.495 0.670 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -11.933 29.156 1.089 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -12.669 28.384 -0.336 1.00 0.00 H new TER 2454 LEU A 153