USER MOD reduce.3.24.130724 H: found=0, std=0, add=1230, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1226 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 134 CYS SG : rot 180:sc= -0.37 USER MOD Set 1.2: A 141 THR OG1 : rot -67:sc= 0.87 USER MOD Set 2.1: A 105 GLN : amide:sc= -5.2! C(o=-13!,f=-20!) USER MOD Set 2.2: A 107 ASN :FLIP amide:sc= -8.05! C(o=-15!,f=-13!) USER MOD Set 3.1: A 8 GLN : amide:sc= -1.36! C(o=-7.6!,f=-12!) USER MOD Set 3.2: A 27 GLN : amide:sc= -1.54 X(o=-7.6,f=-7.1) USER MOD Set 3.3: A 62 HIS : no HD1:sc= -4.71! C(o=-7.6!,f=-8.3!) USER MOD Single : A 1 GLY N :NH3+ -123:sc= -0.403 (180deg=-1.92!) USER MOD Single : A 5 SER OG : rot 180:sc= -0.231 USER MOD Single : A 6 MET CE :methyl -156:sc= -0.0985 (180deg=-0.799) USER MOD Single : A 9 SER OG : rot -120:sc= 0.203 USER MOD Single : A 13 GLN : amide:sc= -0.0729 X(o=-0.073,f=-0.18) USER MOD Single : A 15 THR OG1 : rot 147:sc= 0.124 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 CYS SG : rot 164:sc= 0.172 USER MOD Single : A 31 CYS SG : rot 180:sc= -0.249 USER MOD Single : A 32 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.194) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN :FLIP amide:sc= -0.231 F(o=-5.2!,f=-0.23) USER MOD Single : A 38 SER OG : rot -120:sc= -0.375 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 53 GLN :FLIP amide:sc= -0.445 F(o=-1.1,f=-0.45) USER MOD Single : A 55 HIS : no HE2:sc= -0.557 K(o=-0.56,f=-8.6!) USER MOD Single : A 60 TYR OH : rot 105:sc= 0.00105 USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.0464 USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0.0275 USER MOD Single : A 73 SER OG : rot 180:sc=-0.00101 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot -120:sc= 1.14 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot -160:sc= -0.533 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN :FLIP amide:sc= -2.34! C(o=-5.4!,f=-2.3!) USER MOD Single : A 121 SER OG : rot 180:sc= -0.017 USER MOD Single : A 122 HIS : no HD1:sc= -5.98! C(o=-6!,f=-6.2!) USER MOD Single : A 123 THR OG1 : rot 153:sc= 0.666 USER MOD Single : A 125 THR OG1 : rot 180:sc=0.000927 USER MOD Single : A 128 GLN :FLIP amide:sc= -0.205 F(o=-0.82,f=-0.2) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 152 HIS :FLIP no HE2:sc= -0.858 F(o=-2.4!,f=-0.86) USER MOD Single : A 153 THR OG1 : rot 8:sc= 0.204 USER MOD Single : A 154 CYS SG : rot 180:sc= 0.147 USER MOD Single : A 161 SER OG : rot -3:sc= 0.563! USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.389 22.111 -8.370 1.00 1.00 N ATOM 2 CA GLY A 1 -8.498 22.692 -7.003 1.00 1.00 C ATOM 3 C GLY A 1 -9.940 22.587 -6.515 1.00 1.00 C ATOM 4 O GLY A 1 -10.257 21.757 -5.663 1.00 1.00 O ATOM 0 H1 GLY A 1 -7.678 21.352 -8.369 1.00 1.00 H new ATOM 0 H2 GLY A 1 -9.310 21.722 -8.656 1.00 1.00 H new ATOM 0 H3 GLY A 1 -8.103 22.853 -9.041 1.00 1.00 H new ATOM 0 HA2 GLY A 1 -7.833 22.165 -6.319 1.00 1.00 H new ATOM 0 HA3 GLY A 1 -8.182 23.735 -7.014 1.00 1.00 H new ATOM 10 N PRO A 2 -10.810 23.408 -7.040 1.00 1.00 N ATOM 11 CA PRO A 2 -12.252 23.413 -6.654 1.00 1.00 C ATOM 12 C PRO A 2 -12.967 22.143 -7.111 1.00 1.00 C ATOM 13 O PRO A 2 -14.044 21.812 -6.613 1.00 1.00 O ATOM 14 CB PRO A 2 -12.814 24.664 -7.352 1.00 1.00 C ATOM 15 CG PRO A 2 -11.899 24.902 -8.511 1.00 1.00 C ATOM 16 CD PRO A 2 -10.515 24.423 -8.066 1.00 1.00 C ATOM 0 HA PRO A 2 -12.394 23.436 -5.574 1.00 1.00 H new ATOM 0 HB2 PRO A 2 -13.839 24.504 -7.685 1.00 1.00 H new ATOM 0 HB3 PRO A 2 -12.828 25.520 -6.677 1.00 1.00 H new ATOM 0 HG2 PRO A 2 -12.236 24.355 -9.392 1.00 1.00 H new ATOM 0 HG3 PRO A 2 -11.878 25.958 -8.780 1.00 1.00 H new ATOM 0 HD2 PRO A 2 -9.951 24.000 -8.897 1.00 1.00 H new ATOM 0 HD3 PRO A 2 -9.919 25.241 -7.661 1.00 1.00 H new ATOM 24 N LEU A 3 -12.367 21.438 -8.065 1.00 1.00 N ATOM 25 CA LEU A 3 -12.961 20.212 -8.582 1.00 1.00 C ATOM 26 C LEU A 3 -13.071 19.170 -7.472 1.00 1.00 C ATOM 27 O LEU A 3 -14.074 18.464 -7.370 1.00 1.00 O ATOM 28 CB LEU A 3 -12.101 19.666 -9.733 1.00 1.00 C ATOM 29 CG LEU A 3 -12.415 20.419 -11.039 1.00 1.00 C ATOM 30 CD1 LEU A 3 -13.822 20.055 -11.562 1.00 1.00 C ATOM 31 CD2 LEU A 3 -12.327 21.930 -10.789 1.00 1.00 C ATOM 0 H LEU A 3 -11.477 21.693 -8.493 1.00 1.00 H new ATOM 0 HA LEU A 3 -13.962 20.432 -8.954 1.00 1.00 H new ATOM 0 HB2 LEU A 3 -11.044 19.773 -9.489 1.00 1.00 H new ATOM 0 HB3 LEU A 3 -12.291 18.601 -9.865 1.00 1.00 H new ATOM 0 HG LEU A 3 -11.685 20.127 -11.794 1.00 1.00 H new ATOM 0 HD11 LEU A 3 -14.019 20.600 -12.485 1.00 1.00 H new ATOM 0 HD12 LEU A 3 -13.872 18.983 -11.755 1.00 1.00 H new ATOM 0 HD13 LEU A 3 -14.569 20.324 -10.815 1.00 1.00 H new ATOM 0 HD21 LEU A 3 -12.549 22.465 -11.712 1.00 1.00 H new ATOM 0 HD22 LEU A 3 -13.048 22.215 -10.022 1.00 1.00 H new ATOM 0 HD23 LEU A 3 -11.322 22.185 -10.454 1.00 1.00 H new ATOM 43 N GLY A 4 -12.037 19.082 -6.645 1.00 1.00 N ATOM 44 CA GLY A 4 -12.035 18.128 -5.544 1.00 1.00 C ATOM 45 C GLY A 4 -12.295 16.713 -6.044 1.00 1.00 C ATOM 46 O GLY A 4 -13.436 16.339 -6.320 1.00 1.00 O ATOM 0 H GLY A 4 -11.196 19.654 -6.715 1.00 1.00 H new ATOM 0 HA2 GLY A 4 -11.075 18.164 -5.029 1.00 1.00 H new ATOM 0 HA3 GLY A 4 -12.798 18.406 -4.817 1.00 1.00 H new ATOM 50 N SER A 5 -11.229 15.926 -6.150 1.00 1.00 N ATOM 51 CA SER A 5 -11.344 14.545 -6.607 1.00 1.00 C ATOM 52 C SER A 5 -11.772 13.642 -5.454 1.00 1.00 C ATOM 53 O SER A 5 -11.810 14.072 -4.302 1.00 1.00 O ATOM 54 CB SER A 5 -10.001 14.071 -7.158 1.00 1.00 C ATOM 55 OG SER A 5 -8.979 14.353 -6.211 1.00 1.00 O ATOM 0 H SER A 5 -10.278 16.220 -5.926 1.00 1.00 H new ATOM 0 HA SER A 5 -12.097 14.496 -7.394 1.00 1.00 H new ATOM 0 HB2 SER A 5 -10.037 13.001 -7.364 1.00 1.00 H new ATOM 0 HB3 SER A 5 -9.786 14.571 -8.102 1.00 1.00 H new ATOM 0 HG SER A 5 -8.116 14.048 -6.561 1.00 1.00 H new ATOM 61 N MET A 6 -12.101 12.390 -5.772 1.00 1.00 N ATOM 62 CA MET A 6 -12.534 11.431 -4.753 1.00 1.00 C ATOM 63 C MET A 6 -11.903 10.058 -4.995 1.00 1.00 C ATOM 64 O MET A 6 -12.521 9.026 -4.741 1.00 1.00 O ATOM 65 CB MET A 6 -14.057 11.312 -4.776 1.00 1.00 C ATOM 66 CG MET A 6 -14.681 12.650 -4.362 1.00 1.00 C ATOM 67 SD MET A 6 -16.487 12.497 -4.327 1.00 1.00 S ATOM 68 CE MET A 6 -16.762 12.353 -6.113 1.00 1.00 C ATOM 0 H MET A 6 -12.077 12.017 -6.721 1.00 1.00 H new ATOM 0 HA MET A 6 -12.209 11.791 -3.777 1.00 1.00 H new ATOM 0 HB2 MET A 6 -14.396 11.034 -5.774 1.00 1.00 H new ATOM 0 HB3 MET A 6 -14.381 10.522 -4.098 1.00 1.00 H new ATOM 0 HG2 MET A 6 -14.312 12.946 -3.380 1.00 1.00 H new ATOM 0 HG3 MET A 6 -14.386 13.432 -5.062 1.00 1.00 H new ATOM 0 HE1 MET A 6 -17.777 12.670 -6.352 1.00 1.00 H new ATOM 0 HE2 MET A 6 -16.050 12.986 -6.643 1.00 1.00 H new ATOM 0 HE3 MET A 6 -16.624 11.316 -6.420 1.00 1.00 H new ATOM 78 N ASP A 7 -10.665 10.061 -5.486 1.00 1.00 N ATOM 79 CA ASP A 7 -9.952 8.812 -5.758 1.00 1.00 C ATOM 80 C ASP A 7 -9.366 8.231 -4.480 1.00 1.00 C ATOM 81 O ASP A 7 -9.835 8.516 -3.378 1.00 1.00 O ATOM 82 CB ASP A 7 -8.834 9.043 -6.780 1.00 1.00 C ATOM 83 CG ASP A 7 -7.740 9.912 -6.174 1.00 1.00 C ATOM 84 OD1 ASP A 7 -7.924 10.373 -5.061 1.00 1.00 O ATOM 85 OD2 ASP A 7 -6.732 10.101 -6.834 1.00 1.00 O ATOM 0 H ASP A 7 -10.137 10.907 -5.703 1.00 1.00 H new ATOM 0 HA ASP A 7 -10.669 8.101 -6.168 1.00 1.00 H new ATOM 0 HB2 ASP A 7 -8.416 8.087 -7.096 1.00 1.00 H new ATOM 0 HB3 ASP A 7 -9.239 9.523 -7.671 1.00 1.00 H new ATOM 90 N GLN A 8 -8.321 7.427 -4.641 1.00 1.00 N ATOM 91 CA GLN A 8 -7.651 6.809 -3.501 1.00 1.00 C ATOM 92 C GLN A 8 -6.555 7.723 -2.978 1.00 1.00 C ATOM 93 O GLN A 8 -6.317 7.797 -1.776 1.00 1.00 O ATOM 94 CB GLN A 8 -7.032 5.467 -3.916 1.00 1.00 C ATOM 95 CG GLN A 8 -8.124 4.407 -4.052 1.00 1.00 C ATOM 96 CD GLN A 8 -8.952 4.665 -5.301 1.00 1.00 C ATOM 97 OE1 GLN A 8 -8.560 5.459 -6.157 1.00 1.00 O ATOM 98 NE2 GLN A 8 -10.081 4.035 -5.460 1.00 1.00 N ATOM 0 H GLN A 8 -7.919 7.188 -5.548 1.00 1.00 H new ATOM 0 HA GLN A 8 -8.389 6.642 -2.716 1.00 1.00 H new ATOM 0 HB2 GLN A 8 -6.502 5.579 -4.862 1.00 1.00 H new ATOM 0 HB3 GLN A 8 -6.298 5.151 -3.175 1.00 1.00 H new ATOM 0 HG2 GLN A 8 -7.674 3.415 -4.103 1.00 1.00 H new ATOM 0 HG3 GLN A 8 -8.766 4.421 -3.171 1.00 1.00 H new ATOM 0 HE21 GLN A 8 -10.403 3.378 -4.749 1.00 1.00 H new ATOM 0 HE22 GLN A 8 -10.643 4.199 -6.295 1.00 1.00 H new ATOM 107 N SER A 9 -5.880 8.400 -3.895 1.00 1.00 N ATOM 108 CA SER A 9 -4.780 9.290 -3.507 1.00 1.00 C ATOM 109 C SER A 9 -5.222 10.276 -2.431 1.00 1.00 C ATOM 110 O SER A 9 -4.572 10.400 -1.392 1.00 1.00 O ATOM 111 CB SER A 9 -4.265 10.075 -4.713 1.00 1.00 C ATOM 112 OG SER A 9 -5.288 10.941 -5.184 1.00 1.00 O ATOM 0 H SER A 9 -6.065 8.357 -4.897 1.00 1.00 H new ATOM 0 HA SER A 9 -3.982 8.661 -3.112 1.00 1.00 H new ATOM 0 HB2 SER A 9 -3.383 10.653 -4.435 1.00 1.00 H new ATOM 0 HB3 SER A 9 -3.961 9.390 -5.504 1.00 1.00 H new ATOM 0 HG SER A 9 -5.507 10.714 -6.112 1.00 1.00 H new ATOM 118 N VAL A 10 -6.323 10.974 -2.674 1.00 1.00 N ATOM 119 CA VAL A 10 -6.820 11.938 -1.703 1.00 1.00 C ATOM 120 C VAL A 10 -7.208 11.223 -0.412 1.00 1.00 C ATOM 121 O VAL A 10 -6.860 11.658 0.686 1.00 1.00 O ATOM 122 CB VAL A 10 -8.034 12.669 -2.280 1.00 1.00 C ATOM 123 CG1 VAL A 10 -8.656 13.567 -1.210 1.00 1.00 C ATOM 124 CG2 VAL A 10 -7.593 13.525 -3.472 1.00 1.00 C ATOM 0 H VAL A 10 -6.882 10.893 -3.523 1.00 1.00 H new ATOM 0 HA VAL A 10 -6.036 12.663 -1.483 1.00 1.00 H new ATOM 0 HB VAL A 10 -8.773 11.937 -2.607 1.00 1.00 H new ATOM 0 HG11 VAL A 10 -9.520 14.085 -1.627 1.00 1.00 H new ATOM 0 HG12 VAL A 10 -8.972 12.958 -0.363 1.00 1.00 H new ATOM 0 HG13 VAL A 10 -7.920 14.299 -0.877 1.00 1.00 H new ATOM 0 HG21 VAL A 10 -8.457 14.047 -3.885 1.00 1.00 H new ATOM 0 HG22 VAL A 10 -6.852 14.254 -3.142 1.00 1.00 H new ATOM 0 HG23 VAL A 10 -7.156 12.884 -4.238 1.00 1.00 H new ATOM 134 N ALA A 11 -7.953 10.133 -0.564 1.00 1.00 N ATOM 135 CA ALA A 11 -8.422 9.359 0.579 1.00 1.00 C ATOM 136 C ALA A 11 -7.338 9.248 1.643 1.00 1.00 C ATOM 137 O ALA A 11 -7.598 9.461 2.824 1.00 1.00 O ATOM 138 CB ALA A 11 -8.845 7.953 0.134 1.00 1.00 C ATOM 0 H ALA A 11 -8.245 9.765 -1.469 1.00 1.00 H new ATOM 0 HA ALA A 11 -9.281 9.878 1.004 1.00 1.00 H new ATOM 0 HB1 ALA A 11 -9.193 7.387 0.998 1.00 1.00 H new ATOM 0 HB2 ALA A 11 -9.650 8.030 -0.597 1.00 1.00 H new ATOM 0 HB3 ALA A 11 -7.994 7.442 -0.316 1.00 1.00 H new ATOM 144 N ILE A 12 -6.124 8.916 1.224 1.00 1.00 N ATOM 145 CA ILE A 12 -5.023 8.779 2.164 1.00 1.00 C ATOM 146 C ILE A 12 -4.704 10.112 2.825 1.00 1.00 C ATOM 147 O ILE A 12 -4.490 10.186 4.030 1.00 1.00 O ATOM 148 CB ILE A 12 -3.783 8.250 1.437 1.00 1.00 C ATOM 149 CG1 ILE A 12 -4.140 6.961 0.685 1.00 1.00 C ATOM 150 CG2 ILE A 12 -2.665 7.975 2.443 1.00 1.00 C ATOM 151 CD1 ILE A 12 -4.770 5.935 1.636 1.00 1.00 C ATOM 0 H ILE A 12 -5.880 8.739 0.250 1.00 1.00 H new ATOM 0 HA ILE A 12 -5.319 8.073 2.940 1.00 1.00 H new ATOM 0 HB ILE A 12 -3.438 8.999 0.724 1.00 1.00 H new ATOM 0 HG12 ILE A 12 -4.833 7.187 -0.125 1.00 1.00 H new ATOM 0 HG13 ILE A 12 -3.244 6.540 0.230 1.00 1.00 H new ATOM 0 HG21 ILE A 12 -1.787 7.599 1.918 1.00 1.00 H new ATOM 0 HG22 ILE A 12 -2.409 8.898 2.964 1.00 1.00 H new ATOM 0 HG23 ILE A 12 -3.001 7.232 3.166 1.00 1.00 H new ATOM 0 HD11 ILE A 12 -5.016 5.029 1.083 1.00 1.00 H new ATOM 0 HD12 ILE A 12 -4.064 5.695 2.431 1.00 1.00 H new ATOM 0 HD13 ILE A 12 -5.678 6.352 2.071 1.00 1.00 H new ATOM 163 N GLN A 13 -4.648 11.151 2.011 1.00 1.00 N ATOM 164 CA GLN A 13 -4.325 12.480 2.515 1.00 1.00 C ATOM 165 C GLN A 13 -5.109 12.773 3.794 1.00 1.00 C ATOM 166 O GLN A 13 -4.529 13.172 4.805 1.00 1.00 O ATOM 167 CB GLN A 13 -4.616 13.555 1.439 1.00 1.00 C ATOM 168 CG GLN A 13 -3.339 14.350 1.130 1.00 1.00 C ATOM 169 CD GLN A 13 -2.929 15.155 2.360 1.00 1.00 C ATOM 170 OE1 GLN A 13 -3.735 15.921 2.891 1.00 1.00 O ATOM 171 NE2 GLN A 13 -1.725 15.029 2.856 1.00 1.00 N ATOM 0 H GLN A 13 -4.820 11.105 1.007 1.00 1.00 H new ATOM 0 HA GLN A 13 -3.261 12.510 2.750 1.00 1.00 H new ATOM 0 HB2 GLN A 13 -4.987 13.081 0.531 1.00 1.00 H new ATOM 0 HB3 GLN A 13 -5.398 14.229 1.789 1.00 1.00 H new ATOM 0 HG2 GLN A 13 -2.536 13.671 0.843 1.00 1.00 H new ATOM 0 HG3 GLN A 13 -3.509 15.018 0.286 1.00 1.00 H new ATOM 0 HE21 GLN A 13 -1.057 14.395 2.418 1.00 1.00 H new ATOM 0 HE22 GLN A 13 -1.455 15.564 3.681 1.00 1.00 H new ATOM 180 N GLU A 14 -6.420 12.580 3.748 1.00 1.00 N ATOM 181 CA GLU A 14 -7.246 12.841 4.912 1.00 1.00 C ATOM 182 C GLU A 14 -6.809 11.964 6.085 1.00 1.00 C ATOM 183 O GLU A 14 -6.709 12.430 7.222 1.00 1.00 O ATOM 184 CB GLU A 14 -8.706 12.548 4.558 1.00 1.00 C ATOM 185 CG GLU A 14 -9.184 13.519 3.473 1.00 1.00 C ATOM 186 CD GLU A 14 -9.284 14.934 4.035 1.00 1.00 C ATOM 187 OE1 GLU A 14 -9.169 15.083 5.239 1.00 1.00 O ATOM 188 OE2 GLU A 14 -9.485 15.848 3.250 1.00 1.00 O ATOM 0 H GLU A 14 -6.927 12.248 2.927 1.00 1.00 H new ATOM 0 HA GLU A 14 -7.137 13.885 5.206 1.00 1.00 H new ATOM 0 HB2 GLU A 14 -8.805 11.520 4.208 1.00 1.00 H new ATOM 0 HB3 GLU A 14 -9.331 12.644 5.446 1.00 1.00 H new ATOM 0 HG2 GLU A 14 -8.492 13.503 2.631 1.00 1.00 H new ATOM 0 HG3 GLU A 14 -10.155 13.202 3.094 1.00 1.00 H new ATOM 195 N THR A 15 -6.553 10.692 5.797 1.00 1.00 N ATOM 196 CA THR A 15 -6.130 9.744 6.825 1.00 1.00 C ATOM 197 C THR A 15 -4.681 9.965 7.244 1.00 1.00 C ATOM 198 O THR A 15 -4.317 9.702 8.389 1.00 1.00 O ATOM 199 CB THR A 15 -6.280 8.312 6.321 1.00 1.00 C ATOM 200 OG1 THR A 15 -5.407 8.110 5.222 1.00 1.00 O ATOM 201 CG2 THR A 15 -7.724 8.058 5.885 1.00 1.00 C ATOM 0 H THR A 15 -6.631 10.293 4.862 1.00 1.00 H new ATOM 0 HA THR A 15 -6.772 9.909 7.691 1.00 1.00 H new ATOM 0 HB THR A 15 -6.027 7.619 7.123 1.00 1.00 H new ATOM 0 HG1 THR A 15 -5.085 7.184 5.226 1.00 1.00 H new ATOM 0 HG21 THR A 15 -7.821 7.033 5.527 1.00 1.00 H new ATOM 0 HG22 THR A 15 -8.392 8.211 6.732 1.00 1.00 H new ATOM 0 HG23 THR A 15 -7.989 8.749 5.085 1.00 1.00 H new ATOM 209 N LEU A 16 -3.849 10.408 6.310 1.00 1.00 N ATOM 210 CA LEU A 16 -2.435 10.615 6.604 1.00 1.00 C ATOM 211 C LEU A 16 -2.268 11.628 7.737 1.00 1.00 C ATOM 212 O LEU A 16 -2.916 11.526 8.778 1.00 1.00 O ATOM 213 CB LEU A 16 -1.701 11.100 5.340 1.00 1.00 C ATOM 214 CG LEU A 16 -0.182 10.856 5.462 1.00 1.00 C ATOM 215 CD1 LEU A 16 0.151 9.358 5.329 1.00 1.00 C ATOM 216 CD2 LEU A 16 0.540 11.633 4.353 1.00 1.00 C ATOM 0 H LEU A 16 -4.123 10.629 5.353 1.00 1.00 H new ATOM 0 HA LEU A 16 -2.000 9.668 6.923 1.00 1.00 H new ATOM 0 HB2 LEU A 16 -2.089 10.578 4.466 1.00 1.00 H new ATOM 0 HB3 LEU A 16 -1.892 12.162 5.188 1.00 1.00 H new ATOM 0 HG LEU A 16 0.147 11.197 6.444 1.00 1.00 H new ATOM 0 HD11 LEU A 16 1.228 9.215 5.419 1.00 1.00 H new ATOM 0 HD12 LEU A 16 -0.356 8.801 6.117 1.00 1.00 H new ATOM 0 HD13 LEU A 16 -0.183 8.996 4.357 1.00 1.00 H new ATOM 0 HD21 LEU A 16 1.614 11.466 4.432 1.00 1.00 H new ATOM 0 HD22 LEU A 16 0.190 11.288 3.380 1.00 1.00 H new ATOM 0 HD23 LEU A 16 0.330 12.697 4.458 1.00 1.00 H new ATOM 228 N VAL A 17 -1.410 12.610 7.524 1.00 1.00 N ATOM 229 CA VAL A 17 -1.175 13.642 8.516 1.00 1.00 C ATOM 230 C VAL A 17 -0.257 14.704 7.926 1.00 1.00 C ATOM 231 O VAL A 17 0.525 14.421 7.018 1.00 1.00 O ATOM 232 CB VAL A 17 -0.567 13.043 9.793 1.00 1.00 C ATOM 233 CG1 VAL A 17 0.728 12.301 9.461 1.00 1.00 C ATOM 234 CG2 VAL A 17 -0.272 14.163 10.792 1.00 1.00 C ATOM 0 H VAL A 17 -0.863 12.714 6.669 1.00 1.00 H new ATOM 0 HA VAL A 17 -2.125 14.101 8.789 1.00 1.00 H new ATOM 0 HB VAL A 17 -1.277 12.341 10.229 1.00 1.00 H new ATOM 0 HG11 VAL A 17 1.151 11.880 10.373 1.00 1.00 H new ATOM 0 HG12 VAL A 17 0.516 11.498 8.755 1.00 1.00 H new ATOM 0 HG13 VAL A 17 1.442 12.995 9.017 1.00 1.00 H new ATOM 0 HG21 VAL A 17 0.159 13.738 11.698 1.00 1.00 H new ATOM 0 HG22 VAL A 17 0.433 14.868 10.351 1.00 1.00 H new ATOM 0 HG23 VAL A 17 -1.198 14.682 11.040 1.00 1.00 H new ATOM 244 N GLU A 18 -0.367 15.921 8.429 1.00 1.00 N ATOM 245 CA GLU A 18 0.446 17.022 7.927 1.00 1.00 C ATOM 246 C GLU A 18 1.934 16.679 7.961 1.00 1.00 C ATOM 247 O GLU A 18 2.325 15.569 8.325 1.00 1.00 O ATOM 248 CB GLU A 18 0.199 18.260 8.784 1.00 1.00 C ATOM 249 CG GLU A 18 -1.234 18.751 8.575 1.00 1.00 C ATOM 250 CD GLU A 18 -1.535 19.890 9.541 1.00 1.00 C ATOM 251 OE1 GLU A 18 -0.644 20.254 10.290 1.00 1.00 O ATOM 252 OE2 GLU A 18 -2.654 20.378 9.523 1.00 1.00 O ATOM 0 H GLU A 18 -1.007 16.174 9.181 1.00 1.00 H new ATOM 0 HA GLU A 18 0.162 17.210 6.892 1.00 1.00 H new ATOM 0 HB2 GLU A 18 0.364 18.026 9.836 1.00 1.00 H new ATOM 0 HB3 GLU A 18 0.906 19.046 8.518 1.00 1.00 H new ATOM 0 HG2 GLU A 18 -1.366 19.089 7.547 1.00 1.00 H new ATOM 0 HG3 GLU A 18 -1.936 17.932 8.734 1.00 1.00 H new ATOM 259 N GLY A 19 2.752 17.662 7.596 1.00 1.00 N ATOM 260 CA GLY A 19 4.202 17.497 7.602 1.00 1.00 C ATOM 261 C GLY A 19 4.659 16.388 6.663 1.00 1.00 C ATOM 262 O GLY A 19 5.860 16.176 6.494 1.00 1.00 O ATOM 0 H GLY A 19 2.435 18.582 7.292 1.00 1.00 H new ATOM 0 HA2 GLY A 19 4.674 18.435 7.310 1.00 1.00 H new ATOM 0 HA3 GLY A 19 4.536 17.274 8.615 1.00 1.00 H new ATOM 266 N GLU A 20 3.707 15.674 6.052 1.00 1.00 N ATOM 267 CA GLU A 20 4.044 14.582 5.131 1.00 1.00 C ATOM 268 C GLU A 20 3.611 14.903 3.706 1.00 1.00 C ATOM 269 O GLU A 20 3.158 16.010 3.413 1.00 1.00 O ATOM 270 CB GLU A 20 3.396 13.273 5.591 1.00 1.00 C ATOM 271 CG GLU A 20 4.137 12.742 6.821 1.00 1.00 C ATOM 272 CD GLU A 20 3.508 11.435 7.289 1.00 1.00 C ATOM 273 OE1 GLU A 20 2.293 11.378 7.364 1.00 1.00 O ATOM 274 OE2 GLU A 20 4.253 10.510 7.571 1.00 1.00 O ATOM 0 H GLU A 20 2.707 15.830 6.176 1.00 1.00 H new ATOM 0 HA GLU A 20 5.128 14.466 5.140 1.00 1.00 H new ATOM 0 HB2 GLU A 20 2.345 13.439 5.830 1.00 1.00 H new ATOM 0 HB3 GLU A 20 3.428 12.537 4.788 1.00 1.00 H new ATOM 0 HG2 GLU A 20 5.188 12.583 6.581 1.00 1.00 H new ATOM 0 HG3 GLU A 20 4.101 13.479 7.623 1.00 1.00 H new ATOM 281 N TYR A 21 3.790 13.925 2.822 1.00 1.00 N ATOM 282 CA TYR A 21 3.458 14.092 1.410 1.00 1.00 C ATOM 283 C TYR A 21 2.844 12.829 0.824 1.00 1.00 C ATOM 284 O TYR A 21 3.451 11.758 0.864 1.00 1.00 O ATOM 285 CB TYR A 21 4.741 14.423 0.649 1.00 1.00 C ATOM 286 CG TYR A 21 4.429 14.732 -0.793 1.00 1.00 C ATOM 287 CD1 TYR A 21 4.003 16.013 -1.160 1.00 1.00 C ATOM 288 CD2 TYR A 21 4.574 13.736 -1.764 1.00 1.00 C ATOM 289 CE1 TYR A 21 3.721 16.296 -2.502 1.00 1.00 C ATOM 290 CE2 TYR A 21 4.292 14.019 -3.104 1.00 1.00 C ATOM 291 CZ TYR A 21 3.865 15.300 -3.473 1.00 1.00 C ATOM 292 OH TYR A 21 3.587 15.578 -4.795 1.00 1.00 O ATOM 0 H TYR A 21 4.164 13.006 3.059 1.00 1.00 H new ATOM 0 HA TYR A 21 2.726 14.895 1.317 1.00 1.00 H new ATOM 0 HB2 TYR A 21 5.237 15.276 1.112 1.00 1.00 H new ATOM 0 HB3 TYR A 21 5.433 13.583 0.706 1.00 1.00 H new ATOM 0 HD1 TYR A 21 3.892 16.782 -0.410 1.00 1.00 H new ATOM 0 HD2 TYR A 21 4.904 12.748 -1.479 1.00 1.00 H new ATOM 0 HE1 TYR A 21 3.392 17.284 -2.787 1.00 1.00 H new ATOM 0 HE2 TYR A 21 4.404 13.250 -3.854 1.00 1.00 H new ATOM 0 HH TYR A 21 3.740 14.776 -5.337 1.00 1.00 H new ATOM 302 N CYS A 22 1.664 12.971 0.227 1.00 1.00 N ATOM 303 CA CYS A 22 1.015 11.842 -0.424 1.00 1.00 C ATOM 304 C CYS A 22 1.562 11.770 -1.840 1.00 1.00 C ATOM 305 O CYS A 22 1.777 12.803 -2.473 1.00 1.00 O ATOM 306 CB CYS A 22 -0.512 12.007 -0.430 1.00 1.00 C ATOM 307 SG CYS A 22 -1.243 10.867 -1.633 1.00 1.00 S ATOM 0 H CYS A 22 1.144 13.847 0.181 1.00 1.00 H new ATOM 0 HA CYS A 22 1.223 10.918 0.116 1.00 1.00 H new ATOM 0 HB2 CYS A 22 -0.913 11.809 0.564 1.00 1.00 H new ATOM 0 HB3 CYS A 22 -0.776 13.034 -0.681 1.00 1.00 H new ATOM 0 HG CYS A 22 -2.520 10.763 -1.412 1.00 1.00 H new ATOM 313 N VAL A 23 1.800 10.564 -2.334 1.00 1.00 N ATOM 314 CA VAL A 23 2.349 10.382 -3.681 1.00 1.00 C ATOM 315 C VAL A 23 1.384 9.609 -4.577 1.00 1.00 C ATOM 316 O VAL A 23 0.988 10.090 -5.638 1.00 1.00 O ATOM 317 CB VAL A 23 3.676 9.610 -3.584 1.00 1.00 C ATOM 318 CG1 VAL A 23 3.463 8.270 -2.855 1.00 1.00 C ATOM 319 CG2 VAL A 23 4.222 9.349 -4.995 1.00 1.00 C ATOM 0 H VAL A 23 1.624 9.696 -1.829 1.00 1.00 H new ATOM 0 HA VAL A 23 2.509 11.366 -4.121 1.00 1.00 H new ATOM 0 HB VAL A 23 4.392 10.207 -3.019 1.00 1.00 H new ATOM 0 HG11 VAL A 23 4.410 7.735 -2.794 1.00 1.00 H new ATOM 0 HG12 VAL A 23 3.087 8.459 -1.849 1.00 1.00 H new ATOM 0 HG13 VAL A 23 2.741 7.667 -3.405 1.00 1.00 H new ATOM 0 HG21 VAL A 23 5.162 8.802 -4.926 1.00 1.00 H new ATOM 0 HG22 VAL A 23 3.500 8.760 -5.561 1.00 1.00 H new ATOM 0 HG23 VAL A 23 4.392 10.299 -5.501 1.00 1.00 H new ATOM 329 N ILE A 24 1.031 8.396 -4.156 1.00 1.00 N ATOM 330 CA ILE A 24 0.140 7.557 -4.945 1.00 1.00 C ATOM 331 C ILE A 24 -0.573 6.539 -4.059 1.00 1.00 C ATOM 332 O ILE A 24 -0.033 6.087 -3.049 1.00 1.00 O ATOM 333 CB ILE A 24 0.968 6.854 -6.050 1.00 1.00 C ATOM 334 CG1 ILE A 24 0.051 6.039 -6.986 1.00 1.00 C ATOM 335 CG2 ILE A 24 2.041 5.914 -5.429 1.00 1.00 C ATOM 336 CD1 ILE A 24 -1.021 6.934 -7.612 1.00 1.00 C ATOM 0 H ILE A 24 1.346 7.978 -3.281 1.00 1.00 H new ATOM 0 HA ILE A 24 -0.630 8.174 -5.409 1.00 1.00 H new ATOM 0 HB ILE A 24 1.470 7.630 -6.628 1.00 1.00 H new ATOM 0 HG12 ILE A 24 0.647 5.574 -7.771 1.00 1.00 H new ATOM 0 HG13 ILE A 24 -0.423 5.233 -6.426 1.00 1.00 H new ATOM 0 HG21 ILE A 24 2.608 5.433 -6.226 1.00 1.00 H new ATOM 0 HG22 ILE A 24 2.717 6.497 -4.803 1.00 1.00 H new ATOM 0 HG23 ILE A 24 1.551 5.153 -4.822 1.00 1.00 H new ATOM 0 HD11 ILE A 24 -1.655 6.338 -8.268 1.00 1.00 H new ATOM 0 HD12 ILE A 24 -1.629 7.378 -6.824 1.00 1.00 H new ATOM 0 HD13 ILE A 24 -0.543 7.724 -8.190 1.00 1.00 H new ATOM 348 N ALA A 25 -1.795 6.188 -4.448 1.00 1.00 N ATOM 349 CA ALA A 25 -2.597 5.224 -3.705 1.00 1.00 C ATOM 350 C ALA A 25 -3.277 4.278 -4.676 1.00 1.00 C ATOM 351 O ALA A 25 -3.165 4.430 -5.889 1.00 1.00 O ATOM 352 CB ALA A 25 -3.655 5.949 -2.872 1.00 1.00 C ATOM 0 H ALA A 25 -2.253 6.560 -5.280 1.00 1.00 H new ATOM 0 HA ALA A 25 -1.946 4.660 -3.037 1.00 1.00 H new ATOM 0 HB1 ALA A 25 -4.248 5.219 -2.321 1.00 1.00 H new ATOM 0 HB2 ALA A 25 -3.166 6.623 -2.169 1.00 1.00 H new ATOM 0 HB3 ALA A 25 -4.307 6.523 -3.531 1.00 1.00 H new ATOM 358 N VAL A 26 -3.982 3.310 -4.130 1.00 1.00 N ATOM 359 CA VAL A 26 -4.693 2.339 -4.940 1.00 1.00 C ATOM 360 C VAL A 26 -5.573 1.489 -4.043 1.00 1.00 C ATOM 361 O VAL A 26 -5.495 1.591 -2.824 1.00 1.00 O ATOM 362 CB VAL A 26 -3.688 1.474 -5.704 1.00 1.00 C ATOM 363 CG1 VAL A 26 -2.737 0.819 -4.710 1.00 1.00 C ATOM 364 CG2 VAL A 26 -4.419 0.397 -6.513 1.00 1.00 C ATOM 0 H VAL A 26 -4.079 3.173 -3.124 1.00 1.00 H new ATOM 0 HA VAL A 26 -5.326 2.849 -5.666 1.00 1.00 H new ATOM 0 HB VAL A 26 -3.124 2.102 -6.394 1.00 1.00 H new ATOM 0 HG11 VAL A 26 -2.018 0.201 -5.248 1.00 1.00 H new ATOM 0 HG12 VAL A 26 -2.207 1.590 -4.152 1.00 1.00 H new ATOM 0 HG13 VAL A 26 -3.305 0.197 -4.019 1.00 1.00 H new ATOM 0 HG21 VAL A 26 -3.691 -0.210 -7.051 1.00 1.00 H new ATOM 0 HG22 VAL A 26 -4.993 -0.238 -5.838 1.00 1.00 H new ATOM 0 HG23 VAL A 26 -5.093 0.872 -7.226 1.00 1.00 H new ATOM 374 N GLN A 27 -6.393 0.644 -4.641 1.00 1.00 N ATOM 375 CA GLN A 27 -7.269 -0.227 -3.875 1.00 1.00 C ATOM 376 C GLN A 27 -6.495 -1.464 -3.418 1.00 1.00 C ATOM 377 O GLN A 27 -5.320 -1.622 -3.744 1.00 1.00 O ATOM 378 CB GLN A 27 -8.462 -0.631 -4.758 1.00 1.00 C ATOM 379 CG GLN A 27 -9.678 -1.028 -3.907 1.00 1.00 C ATOM 380 CD GLN A 27 -10.168 0.174 -3.109 1.00 1.00 C ATOM 381 OE1 GLN A 27 -10.138 1.300 -3.603 1.00 1.00 O ATOM 382 NE2 GLN A 27 -10.611 0.001 -1.895 1.00 1.00 N ATOM 0 H GLN A 27 -6.472 0.542 -5.653 1.00 1.00 H new ATOM 0 HA GLN A 27 -7.636 0.294 -2.991 1.00 1.00 H new ATOM 0 HB2 GLN A 27 -8.729 0.198 -5.413 1.00 1.00 H new ATOM 0 HB3 GLN A 27 -8.176 -1.465 -5.399 1.00 1.00 H new ATOM 0 HG2 GLN A 27 -10.477 -1.399 -4.549 1.00 1.00 H new ATOM 0 HG3 GLN A 27 -9.410 -1.840 -3.231 1.00 1.00 H new ATOM 0 HE21 GLN A 27 -10.634 -0.934 -1.489 1.00 1.00 H new ATOM 0 HE22 GLN A 27 -10.934 0.801 -1.351 1.00 1.00 H new ATOM 391 N GLY A 28 -7.158 -2.326 -2.658 1.00 1.00 N ATOM 392 CA GLY A 28 -6.545 -3.539 -2.163 1.00 1.00 C ATOM 393 C GLY A 28 -7.616 -4.496 -1.665 1.00 1.00 C ATOM 394 O GLY A 28 -8.504 -4.111 -0.918 1.00 1.00 O ATOM 0 H GLY A 28 -8.129 -2.200 -2.372 1.00 1.00 H new ATOM 0 HA2 GLY A 28 -5.963 -4.011 -2.954 1.00 1.00 H new ATOM 0 HA3 GLY A 28 -5.852 -3.303 -1.355 1.00 1.00 H new ATOM 398 N VAL A 29 -7.521 -5.752 -2.078 1.00 1.00 N ATOM 399 CA VAL A 29 -8.476 -6.776 -1.654 1.00 1.00 C ATOM 400 C VAL A 29 -7.709 -7.950 -1.080 1.00 1.00 C ATOM 401 O VAL A 29 -6.582 -8.209 -1.461 1.00 1.00 O ATOM 402 CB VAL A 29 -9.327 -7.247 -2.834 1.00 1.00 C ATOM 403 CG1 VAL A 29 -10.508 -8.080 -2.321 1.00 1.00 C ATOM 404 CG2 VAL A 29 -9.855 -6.030 -3.600 1.00 1.00 C ATOM 0 H VAL A 29 -6.793 -6.090 -2.707 1.00 1.00 H new ATOM 0 HA VAL A 29 -9.141 -6.353 -0.901 1.00 1.00 H new ATOM 0 HB VAL A 29 -8.716 -7.859 -3.497 1.00 1.00 H new ATOM 0 HG11 VAL A 29 -11.112 -8.414 -3.165 1.00 1.00 H new ATOM 0 HG12 VAL A 29 -10.133 -8.947 -1.778 1.00 1.00 H new ATOM 0 HG13 VAL A 29 -11.120 -7.472 -1.655 1.00 1.00 H new ATOM 0 HG21 VAL A 29 -10.462 -6.365 -4.441 1.00 1.00 H new ATOM 0 HG22 VAL A 29 -10.464 -5.417 -2.935 1.00 1.00 H new ATOM 0 HG23 VAL A 29 -9.016 -5.441 -3.970 1.00 1.00 H new ATOM 414 N LEU A 30 -8.340 -8.681 -0.193 1.00 1.00 N ATOM 415 CA LEU A 30 -7.716 -9.861 0.399 1.00 1.00 C ATOM 416 C LEU A 30 -8.766 -10.945 0.453 1.00 1.00 C ATOM 417 O LEU A 30 -9.798 -10.771 1.101 1.00 1.00 O ATOM 418 CB LEU A 30 -7.200 -9.546 1.827 1.00 1.00 C ATOM 419 CG LEU A 30 -5.836 -10.219 2.083 1.00 1.00 C ATOM 420 CD1 LEU A 30 -5.878 -11.711 1.669 1.00 1.00 C ATOM 421 CD2 LEU A 30 -4.728 -9.456 1.313 1.00 1.00 C ATOM 0 H LEU A 30 -9.284 -8.488 0.141 1.00 1.00 H new ATOM 0 HA LEU A 30 -6.861 -10.179 -0.198 1.00 1.00 H new ATOM 0 HB2 LEU A 30 -7.107 -8.467 1.954 1.00 1.00 H new ATOM 0 HB3 LEU A 30 -7.925 -9.893 2.564 1.00 1.00 H new ATOM 0 HG LEU A 30 -5.611 -10.179 3.149 1.00 1.00 H new ATOM 0 HD11 LEU A 30 -4.907 -12.168 1.857 1.00 1.00 H new ATOM 0 HD12 LEU A 30 -6.641 -12.228 2.250 1.00 1.00 H new ATOM 0 HD13 LEU A 30 -6.116 -11.788 0.608 1.00 1.00 H new ATOM 0 HD21 LEU A 30 -3.765 -9.932 1.495 1.00 1.00 H new ATOM 0 HD22 LEU A 30 -4.947 -9.476 0.245 1.00 1.00 H new ATOM 0 HD23 LEU A 30 -4.692 -8.422 1.657 1.00 1.00 H new ATOM 433 N CYS A 31 -8.528 -12.062 -0.223 1.00 1.00 N ATOM 434 CA CYS A 31 -9.492 -13.152 -0.231 1.00 1.00 C ATOM 435 C CYS A 31 -8.917 -14.364 0.480 1.00 1.00 C ATOM 436 O CYS A 31 -7.761 -14.730 0.280 1.00 1.00 O ATOM 437 CB CYS A 31 -9.833 -13.518 -1.674 1.00 1.00 C ATOM 438 SG CYS A 31 -10.352 -12.028 -2.559 1.00 1.00 S ATOM 0 H CYS A 31 -7.683 -12.235 -0.768 1.00 1.00 H new ATOM 0 HA CYS A 31 -10.395 -12.833 0.289 1.00 1.00 H new ATOM 0 HB2 CYS A 31 -8.967 -13.963 -2.163 1.00 1.00 H new ATOM 0 HB3 CYS A 31 -10.628 -14.263 -1.695 1.00 1.00 H new ATOM 0 HG CYS A 31 -10.642 -12.333 -3.789 1.00 1.00 H new ATOM 444 N LYS A 32 -9.750 -14.999 1.284 1.00 1.00 N ATOM 445 CA LYS A 32 -9.352 -16.201 2.006 1.00 1.00 C ATOM 446 C LYS A 32 -10.423 -17.244 1.804 1.00 1.00 C ATOM 447 O LYS A 32 -11.577 -16.989 2.120 1.00 1.00 O ATOM 448 CB LYS A 32 -9.219 -15.903 3.494 1.00 1.00 C ATOM 449 CG LYS A 32 -8.174 -14.812 3.680 1.00 1.00 C ATOM 450 CD LYS A 32 -8.098 -14.428 5.150 1.00 1.00 C ATOM 451 CE LYS A 32 -7.242 -13.167 5.291 1.00 1.00 C ATOM 452 NZ LYS A 32 -5.837 -13.465 4.884 1.00 1.00 N ATOM 0 H LYS A 32 -10.711 -14.703 1.456 1.00 1.00 H new ATOM 0 HA LYS A 32 -8.391 -16.554 1.633 1.00 1.00 H new ATOM 0 HB2 LYS A 32 -10.177 -15.582 3.903 1.00 1.00 H new ATOM 0 HB3 LYS A 32 -8.927 -16.803 4.035 1.00 1.00 H new ATOM 0 HG2 LYS A 32 -7.202 -15.162 3.334 1.00 1.00 H new ATOM 0 HG3 LYS A 32 -8.432 -13.940 3.078 1.00 1.00 H new ATOM 0 HD2 LYS A 32 -9.098 -14.250 5.545 1.00 1.00 H new ATOM 0 HD3 LYS A 32 -7.666 -15.243 5.730 1.00 1.00 H new ATOM 0 HE2 LYS A 32 -7.649 -12.368 4.671 1.00 1.00 H new ATOM 0 HE3 LYS A 32 -7.265 -12.813 6.322 1.00 1.00 H new ATOM 0 HZ1 LYS A 32 -5.222 -12.671 5.154 1.00 1.00 H new ATOM 0 HZ2 LYS A 32 -5.514 -14.331 5.361 1.00 1.00 H new ATOM 0 HZ3 LYS A 32 -5.795 -13.601 3.854 1.00 1.00 H new ATOM 466 N GLY A 33 -10.031 -18.402 1.278 1.00 1.00 N ATOM 467 CA GLY A 33 -10.969 -19.499 1.024 1.00 1.00 C ATOM 468 C GLY A 33 -12.332 -18.993 0.579 1.00 1.00 C ATOM 469 O GLY A 33 -12.674 -19.063 -0.601 1.00 1.00 O ATOM 0 H GLY A 33 -9.067 -18.608 1.018 1.00 1.00 H new ATOM 0 HA2 GLY A 33 -10.559 -20.156 0.258 1.00 1.00 H new ATOM 0 HA3 GLY A 33 -11.082 -20.096 1.929 1.00 1.00 H new ATOM 473 N ASP A 34 -13.089 -18.458 1.524 1.00 1.00 N ATOM 474 CA ASP A 34 -14.396 -17.904 1.249 1.00 1.00 C ATOM 475 C ASP A 34 -14.701 -16.832 2.290 1.00 1.00 C ATOM 476 O ASP A 34 -15.286 -17.117 3.337 1.00 1.00 O ATOM 477 CB ASP A 34 -15.452 -19.011 1.297 1.00 1.00 C ATOM 478 CG ASP A 34 -15.394 -19.849 0.022 1.00 1.00 C ATOM 479 OD1 ASP A 34 -14.986 -19.317 -0.998 1.00 1.00 O ATOM 480 OD2 ASP A 34 -15.751 -21.013 0.085 1.00 1.00 O ATOM 0 H ASP A 34 -12.810 -18.398 2.503 1.00 1.00 H new ATOM 0 HA ASP A 34 -14.411 -17.460 0.254 1.00 1.00 H new ATOM 0 HB2 ASP A 34 -15.284 -19.646 2.167 1.00 1.00 H new ATOM 0 HB3 ASP A 34 -16.444 -18.573 1.409 1.00 1.00 H new ATOM 485 N SER A 35 -14.303 -15.596 1.996 1.00 1.00 N ATOM 486 CA SER A 35 -14.534 -14.467 2.893 1.00 1.00 C ATOM 487 C SER A 35 -13.798 -13.247 2.340 1.00 1.00 C ATOM 488 O SER A 35 -12.604 -13.078 2.584 1.00 1.00 O ATOM 489 CB SER A 35 -14.018 -14.786 4.295 1.00 1.00 C ATOM 490 OG SER A 35 -13.782 -13.573 4.995 1.00 1.00 O ATOM 0 H SER A 35 -13.814 -15.350 1.135 1.00 1.00 H new ATOM 0 HA SER A 35 -15.603 -14.266 2.957 1.00 1.00 H new ATOM 0 HB2 SER A 35 -14.745 -15.394 4.833 1.00 1.00 H new ATOM 0 HB3 SER A 35 -13.099 -15.368 4.233 1.00 1.00 H new ATOM 0 HG SER A 35 -13.452 -13.774 5.896 1.00 1.00 H new ATOM 496 N ARG A 36 -14.495 -12.406 1.573 1.00 1.00 N ATOM 497 CA ARG A 36 -13.858 -11.233 0.977 1.00 1.00 C ATOM 498 C ARG A 36 -13.552 -10.168 2.022 1.00 1.00 C ATOM 499 O ARG A 36 -14.346 -9.918 2.930 1.00 1.00 O ATOM 500 CB ARG A 36 -14.776 -10.638 -0.099 1.00 1.00 C ATOM 501 CG ARG A 36 -15.081 -11.687 -1.181 1.00 1.00 C ATOM 502 CD ARG A 36 -13.923 -11.775 -2.183 1.00 1.00 C ATOM 503 NE ARG A 36 -14.279 -12.670 -3.280 1.00 1.00 N ATOM 504 CZ ARG A 36 -15.005 -12.244 -4.309 1.00 1.00 C ATOM 505 NH1 ARG A 36 -15.408 -11.003 -4.352 1.00 1.00 N ATOM 506 NH2 ARG A 36 -15.314 -13.065 -5.273 1.00 1.00 N ATOM 0 H ARG A 36 -15.485 -12.513 1.353 1.00 1.00 H new ATOM 0 HA ARG A 36 -12.916 -11.555 0.533 1.00 1.00 H new ATOM 0 HB2 ARG A 36 -15.705 -10.294 0.356 1.00 1.00 H new ATOM 0 HB3 ARG A 36 -14.301 -9.767 -0.551 1.00 1.00 H new ATOM 0 HG2 ARG A 36 -15.244 -12.660 -0.717 1.00 1.00 H new ATOM 0 HG3 ARG A 36 -16.002 -11.424 -1.702 1.00 1.00 H new ATOM 0 HD2 ARG A 36 -13.692 -10.783 -2.572 1.00 1.00 H new ATOM 0 HD3 ARG A 36 -13.025 -12.138 -1.683 1.00 1.00 H new ATOM 0 HE ARG A 36 -13.965 -13.640 -3.257 1.00 1.00 H new ATOM 0 HH11 ARG A 36 -15.166 -10.362 -3.597 1.00 1.00 H new ATOM 0 HH12 ARG A 36 -15.965 -10.675 -5.141 1.00 1.00 H new ATOM 0 HH21 ARG A 36 -14.999 -14.034 -5.238 1.00 1.00 H new ATOM 0 HH22 ARG A 36 -15.871 -12.738 -6.062 1.00 1.00 H new ATOM 520 N GLN A 37 -12.380 -9.545 1.883 1.00 1.00 N ATOM 521 CA GLN A 37 -11.938 -8.502 2.806 1.00 1.00 C ATOM 522 C GLN A 37 -11.369 -7.323 2.028 1.00 1.00 C ATOM 523 O GLN A 37 -10.305 -7.416 1.419 1.00 1.00 O ATOM 524 CB GLN A 37 -10.877 -9.075 3.741 1.00 1.00 C ATOM 525 CG GLN A 37 -11.534 -10.088 4.678 1.00 1.00 C ATOM 526 CD GLN A 37 -10.468 -10.901 5.395 1.00 1.00 C ATOM 527 OE1 GLN A 37 -10.035 -12.002 4.845 1.00 1.00 O flip ATOM 528 NE2 GLN A 37 -10.013 -10.523 6.474 1.00 1.00 N flip ATOM 0 H GLN A 37 -11.717 -9.748 1.135 1.00 1.00 H new ATOM 0 HA GLN A 37 -12.787 -8.153 3.393 1.00 1.00 H new ATOM 0 HB2 GLN A 37 -10.086 -9.554 3.164 1.00 1.00 H new ATOM 0 HB3 GLN A 37 -10.412 -8.275 4.318 1.00 1.00 H new ATOM 0 HG2 GLN A 37 -12.159 -9.570 5.406 1.00 1.00 H new ATOM 0 HG3 GLN A 37 -12.188 -10.750 4.110 1.00 1.00 H new ATOM 0 HE21 GLN A 37 -10.356 -9.661 6.898 1.00 1.00 H new ATOM 0 HE22 GLN A 37 -9.293 -11.071 6.944 1.00 1.00 H new ATOM 537 N SER A 38 -12.098 -6.217 2.053 1.00 1.00 N ATOM 538 CA SER A 38 -11.673 -5.018 1.343 1.00 1.00 C ATOM 539 C SER A 38 -10.629 -4.257 2.151 1.00 1.00 C ATOM 540 O SER A 38 -10.808 -4.000 3.343 1.00 1.00 O ATOM 541 CB SER A 38 -12.871 -4.117 1.058 1.00 1.00 C ATOM 542 OG SER A 38 -13.978 -4.922 0.669 1.00 1.00 O ATOM 0 H SER A 38 -12.982 -6.124 2.554 1.00 1.00 H new ATOM 0 HA SER A 38 -11.227 -5.322 0.396 1.00 1.00 H new ATOM 0 HB2 SER A 38 -13.123 -3.535 1.944 1.00 1.00 H new ATOM 0 HB3 SER A 38 -12.627 -3.406 0.268 1.00 1.00 H new ATOM 0 HG SER A 38 -14.267 -4.668 -0.232 1.00 1.00 H new ATOM 548 N ARG A 39 -9.536 -3.910 1.482 1.00 1.00 N ATOM 549 CA ARG A 39 -8.431 -3.179 2.103 1.00 1.00 C ATOM 550 C ARG A 39 -8.015 -1.991 1.237 1.00 1.00 C ATOM 551 O ARG A 39 -8.214 -1.983 0.024 1.00 1.00 O ATOM 552 CB ARG A 39 -7.232 -4.109 2.295 1.00 1.00 C ATOM 553 CG ARG A 39 -7.538 -5.136 3.389 1.00 1.00 C ATOM 554 CD ARG A 39 -6.323 -6.048 3.597 1.00 1.00 C ATOM 555 NE ARG A 39 -6.627 -7.059 4.605 1.00 1.00 N ATOM 556 CZ ARG A 39 -5.730 -7.974 4.974 1.00 1.00 C ATOM 557 NH1 ARG A 39 -4.530 -7.969 4.461 1.00 1.00 N ATOM 558 NH2 ARG A 39 -6.053 -8.877 5.862 1.00 1.00 N ATOM 0 H ARG A 39 -9.388 -4.125 0.496 1.00 1.00 H new ATOM 0 HA ARG A 39 -8.768 -2.810 3.072 1.00 1.00 H new ATOM 0 HB2 ARG A 39 -7.003 -4.619 1.359 1.00 1.00 H new ATOM 0 HB3 ARG A 39 -6.350 -3.528 2.566 1.00 1.00 H new ATOM 0 HG2 ARG A 39 -7.786 -4.627 4.320 1.00 1.00 H new ATOM 0 HG3 ARG A 39 -8.408 -5.731 3.110 1.00 1.00 H new ATOM 0 HD2 ARG A 39 -6.053 -6.529 2.657 1.00 1.00 H new ATOM 0 HD3 ARG A 39 -5.463 -5.456 3.911 1.00 1.00 H new ATOM 0 HE ARG A 39 -7.550 -7.066 5.039 1.00 1.00 H new ATOM 0 HH11 ARG A 39 -4.273 -7.262 3.773 1.00 1.00 H new ATOM 0 HH12 ARG A 39 -3.850 -8.672 4.749 1.00 1.00 H new ATOM 0 HH21 ARG A 39 -6.988 -8.880 6.270 1.00 1.00 H new ATOM 0 HH22 ARG A 39 -5.370 -9.579 6.147 1.00 1.00 H new ATOM 572 N LEU A 40 -7.443 -0.985 1.891 1.00 1.00 N ATOM 573 CA LEU A 40 -6.991 0.234 1.205 1.00 1.00 C ATOM 574 C LEU A 40 -5.516 0.500 1.512 1.00 1.00 C ATOM 575 O LEU A 40 -5.105 0.472 2.672 1.00 1.00 O ATOM 576 CB LEU A 40 -7.867 1.424 1.643 1.00 1.00 C ATOM 577 CG LEU A 40 -7.338 2.735 1.050 1.00 1.00 C ATOM 578 CD1 LEU A 40 -7.261 2.629 -0.476 1.00 1.00 C ATOM 579 CD2 LEU A 40 -8.284 3.876 1.440 1.00 1.00 C ATOM 0 H LEU A 40 -7.278 -0.984 2.898 1.00 1.00 H new ATOM 0 HA LEU A 40 -7.091 0.102 0.128 1.00 1.00 H new ATOM 0 HB2 LEU A 40 -8.896 1.263 1.321 1.00 1.00 H new ATOM 0 HB3 LEU A 40 -7.881 1.491 2.731 1.00 1.00 H new ATOM 0 HG LEU A 40 -6.339 2.932 1.439 1.00 1.00 H new ATOM 0 HD11 LEU A 40 -6.884 3.565 -0.887 1.00 1.00 H new ATOM 0 HD12 LEU A 40 -6.589 1.816 -0.751 1.00 1.00 H new ATOM 0 HD13 LEU A 40 -8.255 2.430 -0.878 1.00 1.00 H new ATOM 0 HD21 LEU A 40 -7.916 4.813 1.022 1.00 1.00 H new ATOM 0 HD22 LEU A 40 -9.281 3.672 1.049 1.00 1.00 H new ATOM 0 HD23 LEU A 40 -8.329 3.956 2.526 1.00 1.00 H new ATOM 591 N LEU A 41 -4.711 0.741 0.465 1.00 1.00 N ATOM 592 CA LEU A 41 -3.276 0.992 0.642 1.00 1.00 C ATOM 593 C LEU A 41 -2.946 2.453 0.381 1.00 1.00 C ATOM 594 O LEU A 41 -3.805 3.229 -0.028 1.00 1.00 O ATOM 595 CB LEU A 41 -2.490 0.129 -0.344 1.00 1.00 C ATOM 596 CG LEU A 41 -2.698 -1.365 -0.024 1.00 1.00 C ATOM 597 CD1 LEU A 41 -2.498 -2.199 -1.294 1.00 1.00 C ATOM 598 CD2 LEU A 41 -1.683 -1.821 1.032 1.00 1.00 C ATOM 0 H LEU A 41 -5.028 0.767 -0.504 1.00 1.00 H new ATOM 0 HA LEU A 41 -3.006 0.745 1.669 1.00 1.00 H new ATOM 0 HB2 LEU A 41 -2.815 0.339 -1.363 1.00 1.00 H new ATOM 0 HB3 LEU A 41 -1.430 0.376 -0.291 1.00 1.00 H new ATOM 0 HG LEU A 41 -3.710 -1.504 0.356 1.00 1.00 H new ATOM 0 HD11 LEU A 41 -2.646 -3.254 -1.063 1.00 1.00 H new ATOM 0 HD12 LEU A 41 -3.219 -1.888 -2.050 1.00 1.00 H new ATOM 0 HD13 LEU A 41 -1.487 -2.049 -1.673 1.00 1.00 H new ATOM 0 HD21 LEU A 41 -1.837 -2.877 1.252 1.00 1.00 H new ATOM 0 HD22 LEU A 41 -0.672 -1.673 0.653 1.00 1.00 H new ATOM 0 HD23 LEU A 41 -1.818 -1.237 1.942 1.00 1.00 H new ATOM 610 N GLY A 42 -1.681 2.808 0.583 1.00 1.00 N ATOM 611 CA GLY A 42 -1.241 4.176 0.337 1.00 1.00 C ATOM 612 C GLY A 42 0.247 4.355 0.625 1.00 1.00 C ATOM 613 O GLY A 42 0.695 4.185 1.753 1.00 1.00 O ATOM 0 H GLY A 42 -0.951 2.176 0.912 1.00 1.00 H new ATOM 0 HA2 GLY A 42 -1.445 4.442 -0.700 1.00 1.00 H new ATOM 0 HA3 GLY A 42 -1.816 4.860 0.960 1.00 1.00 H new ATOM 617 N LEU A 43 1.010 4.701 -0.405 1.00 1.00 N ATOM 618 CA LEU A 43 2.450 4.914 -0.251 1.00 1.00 C ATOM 619 C LEU A 43 2.707 6.369 0.127 1.00 1.00 C ATOM 620 O LEU A 43 1.964 7.256 -0.285 1.00 1.00 O ATOM 621 CB LEU A 43 3.170 4.553 -1.553 1.00 1.00 C ATOM 622 CG LEU A 43 4.669 4.876 -1.464 1.00 1.00 C ATOM 623 CD1 LEU A 43 5.321 4.082 -0.319 1.00 1.00 C ATOM 624 CD2 LEU A 43 5.338 4.491 -2.789 1.00 1.00 C ATOM 0 H LEU A 43 0.661 4.840 -1.353 1.00 1.00 H new ATOM 0 HA LEU A 43 2.836 4.273 0.541 1.00 1.00 H new ATOM 0 HB2 LEU A 43 3.035 3.492 -1.765 1.00 1.00 H new ATOM 0 HB3 LEU A 43 2.725 5.102 -2.383 1.00 1.00 H new ATOM 0 HG LEU A 43 4.795 5.941 -1.270 1.00 1.00 H new ATOM 0 HD11 LEU A 43 6.383 4.322 -0.269 1.00 1.00 H new ATOM 0 HD12 LEU A 43 4.844 4.347 0.625 1.00 1.00 H new ATOM 0 HD13 LEU A 43 5.198 3.014 -0.501 1.00 1.00 H new ATOM 0 HD21 LEU A 43 6.403 4.716 -2.738 1.00 1.00 H new ATOM 0 HD22 LEU A 43 5.201 3.425 -2.970 1.00 1.00 H new ATOM 0 HD23 LEU A 43 4.886 5.058 -3.603 1.00 1.00 H new ATOM 636 N VAL A 44 3.738 6.612 0.934 1.00 1.00 N ATOM 637 CA VAL A 44 4.052 7.972 1.365 1.00 1.00 C ATOM 638 C VAL A 44 5.548 8.247 1.305 1.00 1.00 C ATOM 639 O VAL A 44 6.365 7.421 1.716 1.00 1.00 O ATOM 640 CB VAL A 44 3.543 8.181 2.789 1.00 1.00 C ATOM 641 CG1 VAL A 44 4.417 7.400 3.773 1.00 1.00 C ATOM 642 CG2 VAL A 44 3.595 9.671 3.132 1.00 1.00 C ATOM 0 H VAL A 44 4.364 5.894 1.299 1.00 1.00 H new ATOM 0 HA VAL A 44 3.559 8.668 0.686 1.00 1.00 H new ATOM 0 HB VAL A 44 2.516 7.823 2.861 1.00 1.00 H new ATOM 0 HG11 VAL A 44 4.049 7.553 4.787 1.00 1.00 H new ATOM 0 HG12 VAL A 44 4.379 6.338 3.530 1.00 1.00 H new ATOM 0 HG13 VAL A 44 5.446 7.752 3.704 1.00 1.00 H new ATOM 0 HG21 VAL A 44 3.232 9.823 4.148 1.00 1.00 H new ATOM 0 HG22 VAL A 44 4.623 10.026 3.057 1.00 1.00 H new ATOM 0 HG23 VAL A 44 2.967 10.227 2.436 1.00 1.00 H new ATOM 652 N ARG A 45 5.891 9.434 0.817 1.00 1.00 N ATOM 653 CA ARG A 45 7.282 9.861 0.725 1.00 1.00 C ATOM 654 C ARG A 45 7.515 10.985 1.720 1.00 1.00 C ATOM 655 O ARG A 45 6.756 11.953 1.771 1.00 1.00 O ATOM 656 CB ARG A 45 7.591 10.359 -0.686 1.00 1.00 C ATOM 657 CG ARG A 45 9.078 10.707 -0.803 1.00 1.00 C ATOM 658 CD ARG A 45 9.348 11.296 -2.186 1.00 1.00 C ATOM 659 NE ARG A 45 9.132 10.289 -3.216 1.00 1.00 N ATOM 660 CZ ARG A 45 9.269 10.585 -4.504 1.00 1.00 C ATOM 661 NH1 ARG A 45 9.616 11.790 -4.863 1.00 1.00 N ATOM 662 NH2 ARG A 45 9.057 9.670 -5.411 1.00 1.00 N ATOM 0 H ARG A 45 5.219 10.122 0.477 1.00 1.00 H new ATOM 0 HA ARG A 45 7.935 9.018 0.949 1.00 1.00 H new ATOM 0 HB2 ARG A 45 7.329 9.593 -1.416 1.00 1.00 H new ATOM 0 HB3 ARG A 45 6.985 11.236 -0.912 1.00 1.00 H new ATOM 0 HG2 ARG A 45 9.359 11.421 -0.029 1.00 1.00 H new ATOM 0 HG3 ARG A 45 9.686 9.815 -0.649 1.00 1.00 H new ATOM 0 HD2 ARG A 45 8.693 12.150 -2.359 1.00 1.00 H new ATOM 0 HD3 ARG A 45 10.372 11.665 -2.238 1.00 1.00 H new ATOM 0 HE ARG A 45 8.871 9.341 -2.944 1.00 1.00 H new ATOM 0 HH11 ARG A 45 9.782 12.505 -4.155 1.00 1.00 H new ATOM 0 HH12 ARG A 45 9.721 12.017 -5.852 1.00 1.00 H new ATOM 0 HH21 ARG A 45 8.786 8.727 -5.131 1.00 1.00 H new ATOM 0 HH22 ARG A 45 9.162 9.898 -6.400 1.00 1.00 H new ATOM 676 N TYR A 46 8.563 10.845 2.516 1.00 1.00 N ATOM 677 CA TYR A 46 8.906 11.836 3.529 1.00 1.00 C ATOM 678 C TYR A 46 10.355 12.280 3.336 1.00 1.00 C ATOM 679 O TYR A 46 11.243 11.447 3.156 1.00 1.00 O ATOM 680 CB TYR A 46 8.707 11.207 4.906 1.00 1.00 C ATOM 681 CG TYR A 46 9.024 12.209 5.983 1.00 1.00 C ATOM 682 CD1 TYR A 46 8.121 13.239 6.264 1.00 1.00 C ATOM 683 CD2 TYR A 46 10.216 12.105 6.704 1.00 1.00 C ATOM 684 CE1 TYR A 46 8.412 14.168 7.267 1.00 1.00 C ATOM 685 CE2 TYR A 46 10.508 13.032 7.708 1.00 1.00 C ATOM 686 CZ TYR A 46 9.605 14.064 7.990 1.00 1.00 C ATOM 687 OH TYR A 46 9.894 14.978 8.981 1.00 1.00 O ATOM 0 H TYR A 46 9.198 10.047 2.481 1.00 1.00 H new ATOM 0 HA TYR A 46 8.267 12.714 3.440 1.00 1.00 H new ATOM 0 HB2 TYR A 46 7.679 10.861 5.011 1.00 1.00 H new ATOM 0 HB3 TYR A 46 9.349 10.333 5.011 1.00 1.00 H new ATOM 0 HD1 TYR A 46 7.199 13.317 5.706 1.00 1.00 H new ATOM 0 HD2 TYR A 46 10.912 11.308 6.485 1.00 1.00 H new ATOM 0 HE1 TYR A 46 7.716 14.965 7.484 1.00 1.00 H new ATOM 0 HE2 TYR A 46 11.429 12.952 8.266 1.00 1.00 H new ATOM 0 HH TYR A 46 10.760 14.760 9.384 1.00 1.00 H new ATOM 697 N ARG A 47 10.589 13.593 3.353 1.00 1.00 N ATOM 698 CA ARG A 47 11.941 14.122 3.154 1.00 1.00 C ATOM 699 C ARG A 47 12.712 14.217 4.465 1.00 1.00 C ATOM 700 O ARG A 47 12.182 14.666 5.481 1.00 1.00 O ATOM 701 CB ARG A 47 11.880 15.511 2.512 1.00 1.00 C ATOM 702 CG ARG A 47 11.402 15.397 1.065 1.00 1.00 C ATOM 703 CD ARG A 47 11.438 16.781 0.414 1.00 1.00 C ATOM 704 NE ARG A 47 10.405 17.642 0.980 1.00 1.00 N ATOM 705 CZ ARG A 47 9.148 17.591 0.545 1.00 1.00 C ATOM 706 NH1 ARG A 47 8.821 16.773 -0.420 1.00 1.00 N ATOM 707 NH2 ARG A 47 8.242 18.364 1.076 1.00 1.00 N ATOM 0 H ARG A 47 9.871 14.302 3.500 1.00 1.00 H new ATOM 0 HA ARG A 47 12.462 13.427 2.495 1.00 1.00 H new ATOM 0 HB2 ARG A 47 11.204 16.153 3.077 1.00 1.00 H new ATOM 0 HB3 ARG A 47 12.864 15.979 2.543 1.00 1.00 H new ATOM 0 HG2 ARG A 47 12.038 14.705 0.513 1.00 1.00 H new ATOM 0 HG3 ARG A 47 10.390 14.993 1.034 1.00 1.00 H new ATOM 0 HD2 ARG A 47 12.418 17.234 0.563 1.00 1.00 H new ATOM 0 HD3 ARG A 47 11.291 16.687 -0.662 1.00 1.00 H new ATOM 0 HE ARG A 47 10.651 18.296 1.723 1.00 1.00 H new ATOM 0 HH11 ARG A 47 9.529 16.172 -0.841 1.00 1.00 H new ATOM 0 HH12 ARG A 47 7.857 16.735 -0.752 1.00 1.00 H new ATOM 0 HH21 ARG A 47 8.496 19.008 1.825 1.00 1.00 H new ATOM 0 HH22 ARG A 47 7.279 18.325 0.742 1.00 1.00 H new ATOM 721 N LEU A 48 13.987 13.812 4.425 1.00 1.00 N ATOM 722 CA LEU A 48 14.846 13.874 5.607 1.00 1.00 C ATOM 723 C LEU A 48 15.662 15.159 5.602 1.00 1.00 C ATOM 724 O LEU A 48 16.307 15.500 4.611 1.00 1.00 O ATOM 725 CB LEU A 48 15.809 12.680 5.651 1.00 1.00 C ATOM 726 CG LEU A 48 15.041 11.384 5.950 1.00 1.00 C ATOM 727 CD1 LEU A 48 15.963 10.183 5.704 1.00 1.00 C ATOM 728 CD2 LEU A 48 14.555 11.372 7.418 1.00 1.00 C ATOM 0 H LEU A 48 14.442 13.440 3.591 1.00 1.00 H new ATOM 0 HA LEU A 48 14.200 13.847 6.485 1.00 1.00 H new ATOM 0 HB2 LEU A 48 16.330 12.590 4.698 1.00 1.00 H new ATOM 0 HB3 LEU A 48 16.568 12.845 6.415 1.00 1.00 H new ATOM 0 HG LEU A 48 14.172 11.325 5.294 1.00 1.00 H new ATOM 0 HD11 LEU A 48 15.423 9.260 5.915 1.00 1.00 H new ATOM 0 HD12 LEU A 48 16.290 10.182 4.664 1.00 1.00 H new ATOM 0 HD13 LEU A 48 16.832 10.252 6.358 1.00 1.00 H new ATOM 0 HD21 LEU A 48 14.013 10.447 7.614 1.00 1.00 H new ATOM 0 HD22 LEU A 48 15.414 11.438 8.086 1.00 1.00 H new ATOM 0 HD23 LEU A 48 13.896 12.223 7.590 1.00 1.00 H new ATOM 740 N GLU A 49 15.632 15.857 6.725 1.00 1.00 N ATOM 741 CA GLU A 49 16.376 17.101 6.870 1.00 1.00 C ATOM 742 C GLU A 49 17.811 16.926 6.380 1.00 1.00 C ATOM 743 O GLU A 49 18.542 17.901 6.201 1.00 1.00 O ATOM 744 CB GLU A 49 16.386 17.536 8.340 1.00 1.00 C ATOM 745 CG GLU A 49 16.907 16.393 9.223 1.00 1.00 C ATOM 746 CD GLU A 49 15.826 15.334 9.406 1.00 1.00 C ATOM 747 OE1 GLU A 49 14.668 15.708 9.506 1.00 1.00 O ATOM 748 OE2 GLU A 49 16.171 14.163 9.447 1.00 1.00 O ATOM 0 H GLU A 49 15.100 15.584 7.552 1.00 1.00 H new ATOM 0 HA GLU A 49 15.888 17.867 6.268 1.00 1.00 H new ATOM 0 HB2 GLU A 49 17.016 18.417 8.463 1.00 1.00 H new ATOM 0 HB3 GLU A 49 15.380 17.817 8.651 1.00 1.00 H new ATOM 0 HG2 GLU A 49 17.791 15.946 8.768 1.00 1.00 H new ATOM 0 HG3 GLU A 49 17.212 16.784 10.194 1.00 1.00 H new ATOM 755 N ASN A 50 18.210 15.673 6.176 1.00 1.00 N ATOM 756 CA ASN A 50 19.561 15.369 5.719 1.00 1.00 C ATOM 757 C ASN A 50 19.630 15.412 4.196 1.00 1.00 C ATOM 758 O ASN A 50 20.692 15.200 3.613 1.00 1.00 O ATOM 759 CB ASN A 50 19.963 13.974 6.208 1.00 1.00 C ATOM 760 CG ASN A 50 19.981 13.944 7.733 1.00 1.00 C ATOM 761 OD1 ASN A 50 20.412 14.906 8.369 1.00 1.00 O ATOM 762 ND2 ASN A 50 19.528 12.893 8.360 1.00 1.00 N ATOM 0 H ASN A 50 17.618 14.855 6.320 1.00 1.00 H new ATOM 0 HA ASN A 50 20.245 16.114 6.124 1.00 1.00 H new ATOM 0 HB2 ASN A 50 19.262 13.230 5.829 1.00 1.00 H new ATOM 0 HB3 ASN A 50 20.947 13.712 5.819 1.00 1.00 H new ATOM 0 HD21 ASN A 50 19.530 12.867 9.380 1.00 1.00 H new ATOM 0 HD22 ASN A 50 19.172 12.097 7.830 1.00 1.00 H new ATOM 769 N ASP A 51 18.480 15.664 3.564 1.00 1.00 N ATOM 770 CA ASP A 51 18.386 15.714 2.103 1.00 1.00 C ATOM 771 C ASP A 51 18.120 14.310 1.577 1.00 1.00 C ATOM 772 O ASP A 51 17.780 14.117 0.409 1.00 1.00 O ATOM 773 CB ASP A 51 19.682 16.282 1.488 1.00 1.00 C ATOM 774 CG ASP A 51 19.391 16.981 0.162 1.00 1.00 C ATOM 775 OD1 ASP A 51 18.309 16.779 -0.365 1.00 1.00 O ATOM 776 OD2 ASP A 51 20.254 17.707 -0.303 1.00 1.00 O ATOM 0 H ASP A 51 17.597 15.837 4.045 1.00 1.00 H new ATOM 0 HA ASP A 51 17.567 16.374 1.819 1.00 1.00 H new ATOM 0 HB2 ASP A 51 20.141 16.986 2.182 1.00 1.00 H new ATOM 0 HB3 ASP A 51 20.399 15.476 1.330 1.00 1.00 H new ATOM 781 N ALA A 52 18.275 13.335 2.467 1.00 1.00 N ATOM 782 CA ALA A 52 18.054 11.938 2.126 1.00 1.00 C ATOM 783 C ALA A 52 16.566 11.651 1.930 1.00 1.00 C ATOM 784 O ALA A 52 15.705 12.333 2.484 1.00 1.00 O ATOM 785 CB ALA A 52 18.612 11.044 3.239 1.00 1.00 C ATOM 0 H ALA A 52 18.555 13.491 3.435 1.00 1.00 H new ATOM 0 HA ALA A 52 18.569 11.725 1.189 1.00 1.00 H new ATOM 0 HB1 ALA A 52 18.446 9.998 2.983 1.00 1.00 H new ATOM 0 HB2 ALA A 52 19.681 11.225 3.350 1.00 1.00 H new ATOM 0 HB3 ALA A 52 18.106 11.272 4.177 1.00 1.00 H new ATOM 791 N GLN A 53 16.281 10.637 1.125 1.00 1.00 N ATOM 792 CA GLN A 53 14.899 10.240 0.832 1.00 1.00 C ATOM 793 C GLN A 53 14.580 8.881 1.453 1.00 1.00 C ATOM 794 O GLN A 53 15.424 7.985 1.477 1.00 1.00 O ATOM 795 CB GLN A 53 14.706 10.158 -0.681 1.00 1.00 C ATOM 796 CG GLN A 53 15.017 11.519 -1.306 1.00 1.00 C ATOM 797 CD GLN A 53 14.016 12.559 -0.818 1.00 1.00 C ATOM 798 OE1 GLN A 53 14.448 13.642 -0.233 1.00 1.00 O flip ATOM 799 NE2 GLN A 53 12.808 12.378 -0.969 1.00 1.00 N flip ATOM 0 H GLN A 53 16.988 10.068 0.658 1.00 1.00 H new ATOM 0 HA GLN A 53 14.227 10.985 1.258 1.00 1.00 H new ATOM 0 HB2 GLN A 53 15.360 9.394 -1.101 1.00 1.00 H new ATOM 0 HB3 GLN A 53 13.682 9.864 -0.913 1.00 1.00 H new ATOM 0 HG2 GLN A 53 16.029 11.826 -1.043 1.00 1.00 H new ATOM 0 HG3 GLN A 53 14.978 11.447 -2.393 1.00 1.00 H new ATOM 0 HE21 GLN A 53 12.473 11.530 -1.427 1.00 1.00 H new ATOM 0 HE22 GLN A 53 12.142 13.076 -0.636 1.00 1.00 H new ATOM 808 N GLU A 54 13.347 8.730 1.939 1.00 1.00 N ATOM 809 CA GLU A 54 12.909 7.471 2.539 1.00 1.00 C ATOM 810 C GLU A 54 11.415 7.274 2.298 1.00 1.00 C ATOM 811 O GLU A 54 10.664 8.241 2.165 1.00 1.00 O ATOM 812 CB GLU A 54 13.220 7.459 4.038 1.00 1.00 C ATOM 813 CG GLU A 54 12.413 8.541 4.751 1.00 1.00 C ATOM 814 CD GLU A 54 12.889 8.665 6.194 1.00 1.00 C ATOM 815 OE1 GLU A 54 13.686 7.839 6.606 1.00 1.00 O ATOM 816 OE2 GLU A 54 12.443 9.577 6.869 1.00 1.00 O ATOM 0 H GLU A 54 12.637 9.462 1.929 1.00 1.00 H new ATOM 0 HA GLU A 54 13.450 6.648 2.072 1.00 1.00 H new ATOM 0 HB2 GLU A 54 12.983 6.482 4.458 1.00 1.00 H new ATOM 0 HB3 GLU A 54 14.285 7.625 4.197 1.00 1.00 H new ATOM 0 HG2 GLU A 54 12.529 9.495 4.236 1.00 1.00 H new ATOM 0 HG3 GLU A 54 11.352 8.293 4.727 1.00 1.00 H new ATOM 823 N HIS A 55 10.994 6.011 2.226 1.00 1.00 N ATOM 824 CA HIS A 55 9.588 5.675 1.979 1.00 1.00 C ATOM 825 C HIS A 55 9.112 4.602 2.951 1.00 1.00 C ATOM 826 O HIS A 55 9.914 3.831 3.479 1.00 1.00 O ATOM 827 CB HIS A 55 9.426 5.130 0.561 1.00 1.00 C ATOM 828 CG HIS A 55 9.831 6.173 -0.443 1.00 1.00 C ATOM 829 ND1 HIS A 55 11.150 6.354 -0.823 1.00 1.00 N ATOM 830 CD2 HIS A 55 9.101 7.084 -1.165 1.00 1.00 C ATOM 831 CE1 HIS A 55 11.175 7.339 -1.738 1.00 1.00 C ATOM 832 NE2 HIS A 55 9.954 7.819 -1.983 1.00 1.00 N ATOM 0 H HIS A 55 11.606 5.202 2.335 1.00 1.00 H new ATOM 0 HA HIS A 55 8.999 6.582 2.112 1.00 1.00 H new ATOM 0 HB2 HIS A 55 10.037 4.236 0.435 1.00 1.00 H new ATOM 0 HB3 HIS A 55 8.390 4.835 0.393 1.00 1.00 H new ATOM 0 HD1 HIS A 55 11.955 5.835 -0.473 1.00 1.00 H new ATOM 0 HD2 HIS A 55 8.030 7.211 -1.107 1.00 1.00 H new ATOM 0 HE1 HIS A 55 12.074 7.698 -2.217 1.00 1.00 H new ATOM 840 N ALA A 56 7.803 4.558 3.177 1.00 1.00 N ATOM 841 CA ALA A 56 7.202 3.580 4.074 1.00 1.00 C ATOM 842 C ALA A 56 5.797 3.242 3.571 1.00 1.00 C ATOM 843 O ALA A 56 5.073 4.119 3.103 1.00 1.00 O ATOM 844 CB ALA A 56 7.136 4.152 5.498 1.00 1.00 C ATOM 0 H ALA A 56 7.133 5.195 2.746 1.00 1.00 H new ATOM 0 HA ALA A 56 7.807 2.673 4.093 1.00 1.00 H new ATOM 0 HB1 ALA A 56 6.686 3.417 6.165 1.00 1.00 H new ATOM 0 HB2 ALA A 56 8.143 4.386 5.843 1.00 1.00 H new ATOM 0 HB3 ALA A 56 6.532 5.060 5.498 1.00 1.00 H new ATOM 850 N LEU A 57 5.428 1.968 3.649 1.00 1.00 N ATOM 851 CA LEU A 57 4.115 1.529 3.179 1.00 1.00 C ATOM 852 C LEU A 57 3.095 1.682 4.298 1.00 1.00 C ATOM 853 O LEU A 57 3.390 1.421 5.464 1.00 1.00 O ATOM 854 CB LEU A 57 4.193 0.058 2.710 1.00 1.00 C ATOM 855 CG LEU A 57 3.290 -0.188 1.482 1.00 1.00 C ATOM 856 CD1 LEU A 57 1.839 0.218 1.797 1.00 1.00 C ATOM 857 CD2 LEU A 57 3.809 0.608 0.261 1.00 1.00 C ATOM 0 H LEU A 57 6.013 1.224 4.030 1.00 1.00 H new ATOM 0 HA LEU A 57 3.804 2.145 2.336 1.00 1.00 H new ATOM 0 HB2 LEU A 57 5.224 -0.193 2.462 1.00 1.00 H new ATOM 0 HB3 LEU A 57 3.892 -0.602 3.524 1.00 1.00 H new ATOM 0 HG LEU A 57 3.315 -1.251 1.243 1.00 1.00 H new ATOM 0 HD11 LEU A 57 1.213 0.039 0.923 1.00 1.00 H new ATOM 0 HD12 LEU A 57 1.469 -0.373 2.635 1.00 1.00 H new ATOM 0 HD13 LEU A 57 1.806 1.276 2.057 1.00 1.00 H new ATOM 0 HD21 LEU A 57 3.161 0.423 -0.596 1.00 1.00 H new ATOM 0 HD22 LEU A 57 3.808 1.673 0.494 1.00 1.00 H new ATOM 0 HD23 LEU A 57 4.824 0.289 0.024 1.00 1.00 H new ATOM 869 N PHE A 58 1.891 2.105 3.933 1.00 1.00 N ATOM 870 CA PHE A 58 0.818 2.293 4.901 1.00 1.00 C ATOM 871 C PHE A 58 -0.413 1.496 4.488 1.00 1.00 C ATOM 872 O PHE A 58 -0.816 1.504 3.325 1.00 1.00 O ATOM 873 CB PHE A 58 0.467 3.785 4.994 1.00 1.00 C ATOM 874 CG PHE A 58 1.466 4.500 5.879 1.00 1.00 C ATOM 875 CD1 PHE A 58 2.794 4.651 5.465 1.00 1.00 C ATOM 876 CD2 PHE A 58 1.058 5.011 7.116 1.00 1.00 C ATOM 877 CE1 PHE A 58 3.712 5.311 6.290 1.00 1.00 C ATOM 878 CE2 PHE A 58 1.974 5.671 7.938 1.00 1.00 C ATOM 879 CZ PHE A 58 3.301 5.822 7.527 1.00 1.00 C ATOM 0 H PHE A 58 1.633 2.325 2.971 1.00 1.00 H new ATOM 0 HA PHE A 58 1.152 1.937 5.875 1.00 1.00 H new ATOM 0 HB2 PHE A 58 0.468 4.229 3.999 1.00 1.00 H new ATOM 0 HB3 PHE A 58 -0.539 3.906 5.396 1.00 1.00 H new ATOM 0 HD1 PHE A 58 3.110 4.259 4.510 1.00 1.00 H new ATOM 0 HD2 PHE A 58 0.033 4.895 7.436 1.00 1.00 H new ATOM 0 HE1 PHE A 58 4.738 5.426 5.972 1.00 1.00 H new ATOM 0 HE2 PHE A 58 1.657 6.065 8.892 1.00 1.00 H new ATOM 0 HZ PHE A 58 4.009 6.332 8.163 1.00 1.00 H new ATOM 889 N LEU A 59 -1.027 0.843 5.472 1.00 1.00 N ATOM 890 CA LEU A 59 -2.243 0.066 5.245 1.00 1.00 C ATOM 891 C LEU A 59 -3.396 0.764 5.944 1.00 1.00 C ATOM 892 O LEU A 59 -3.307 1.116 7.121 1.00 1.00 O ATOM 893 CB LEU A 59 -2.095 -1.363 5.781 1.00 1.00 C ATOM 894 CG LEU A 59 -3.331 -2.210 5.398 1.00 1.00 C ATOM 895 CD1 LEU A 59 -3.323 -2.539 3.897 1.00 1.00 C ATOM 896 CD2 LEU A 59 -3.328 -3.512 6.206 1.00 1.00 C ATOM 0 H LEU A 59 -0.700 0.837 6.438 1.00 1.00 H new ATOM 0 HA LEU A 59 -2.431 -0.000 4.173 1.00 1.00 H new ATOM 0 HB2 LEU A 59 -1.193 -1.820 5.375 1.00 1.00 H new ATOM 0 HB3 LEU A 59 -1.981 -1.342 6.865 1.00 1.00 H new ATOM 0 HG LEU A 59 -4.229 -1.635 5.623 1.00 1.00 H new ATOM 0 HD11 LEU A 59 -4.202 -3.135 3.651 1.00 1.00 H new ATOM 0 HD12 LEU A 59 -3.340 -1.613 3.322 1.00 1.00 H new ATOM 0 HD13 LEU A 59 -2.422 -3.102 3.653 1.00 1.00 H new ATOM 0 HD21 LEU A 59 -4.199 -4.109 5.937 1.00 1.00 H new ATOM 0 HD22 LEU A 59 -2.420 -4.074 5.987 1.00 1.00 H new ATOM 0 HD23 LEU A 59 -3.363 -3.280 7.270 1.00 1.00 H new ATOM 908 N TYR A 60 -4.464 0.980 5.199 1.00 1.00 N ATOM 909 CA TYR A 60 -5.650 1.657 5.713 1.00 1.00 C ATOM 910 C TYR A 60 -6.859 0.738 5.582 1.00 1.00 C ATOM 911 O TYR A 60 -7.130 0.235 4.496 1.00 1.00 O ATOM 912 CB TYR A 60 -5.903 2.906 4.867 1.00 1.00 C ATOM 913 CG TYR A 60 -4.796 3.919 5.041 1.00 1.00 C ATOM 914 CD1 TYR A 60 -4.885 4.888 6.049 1.00 1.00 C ATOM 915 CD2 TYR A 60 -3.692 3.905 4.180 1.00 1.00 C ATOM 916 CE1 TYR A 60 -3.866 5.839 6.199 1.00 1.00 C ATOM 917 CE2 TYR A 60 -2.676 4.857 4.327 1.00 1.00 C ATOM 918 CZ TYR A 60 -2.761 5.823 5.337 1.00 1.00 C ATOM 919 OH TYR A 60 -1.758 6.762 5.481 1.00 1.00 O ATOM 0 H TYR A 60 -4.538 0.694 4.223 1.00 1.00 H new ATOM 0 HA TYR A 60 -5.496 1.921 6.759 1.00 1.00 H new ATOM 0 HB2 TYR A 60 -5.982 2.627 3.816 1.00 1.00 H new ATOM 0 HB3 TYR A 60 -6.856 3.353 5.150 1.00 1.00 H new ATOM 0 HD1 TYR A 60 -5.739 4.902 6.710 1.00 1.00 H new ATOM 0 HD2 TYR A 60 -3.624 3.159 3.402 1.00 1.00 H new ATOM 0 HE1 TYR A 60 -3.932 6.584 6.978 1.00 1.00 H new ATOM 0 HE2 TYR A 60 -1.826 4.846 3.661 1.00 1.00 H new ATOM 0 HH TYR A 60 -0.976 6.344 5.899 1.00 1.00 H new ATOM 929 N THR A 61 -7.611 0.523 6.662 1.00 1.00 N ATOM 930 CA THR A 61 -8.795 -0.326 6.548 1.00 1.00 C ATOM 931 C THR A 61 -9.927 0.506 5.985 1.00 1.00 C ATOM 932 O THR A 61 -9.894 1.726 6.053 1.00 1.00 O ATOM 933 CB THR A 61 -9.217 -0.904 7.898 1.00 1.00 C ATOM 934 OG1 THR A 61 -10.327 -1.773 7.698 1.00 1.00 O ATOM 935 CG2 THR A 61 -9.617 0.223 8.848 1.00 1.00 C ATOM 0 H THR A 61 -7.432 0.907 7.590 1.00 1.00 H new ATOM 0 HA THR A 61 -8.557 -1.163 5.892 1.00 1.00 H new ATOM 0 HB THR A 61 -8.384 -1.455 8.335 1.00 1.00 H new ATOM 0 HG1 THR A 61 -10.605 -2.151 8.558 1.00 1.00 H new ATOM 0 HG21 THR A 61 -9.916 -0.199 9.807 1.00 1.00 H new ATOM 0 HG22 THR A 61 -8.770 0.893 8.995 1.00 1.00 H new ATOM 0 HG23 THR A 61 -10.451 0.780 8.421 1.00 1.00 H new ATOM 943 N HIS A 62 -10.934 -0.140 5.443 1.00 1.00 N ATOM 944 CA HIS A 62 -12.057 0.599 4.896 1.00 1.00 C ATOM 945 C HIS A 62 -13.208 -0.342 4.576 1.00 1.00 C ATOM 946 O HIS A 62 -13.018 -1.551 4.459 1.00 1.00 O ATOM 947 CB HIS A 62 -11.613 1.377 3.648 1.00 1.00 C ATOM 948 CG HIS A 62 -11.562 0.472 2.451 1.00 1.00 C ATOM 949 ND1 HIS A 62 -12.533 0.491 1.462 1.00 1.00 N ATOM 950 CD2 HIS A 62 -10.660 -0.484 2.076 1.00 1.00 C ATOM 951 CE1 HIS A 62 -12.192 -0.432 0.546 1.00 1.00 C ATOM 952 NE2 HIS A 62 -11.057 -1.058 0.872 1.00 1.00 N ATOM 0 H HIS A 62 -11.003 -1.155 5.368 1.00 1.00 H new ATOM 0 HA HIS A 62 -12.409 1.314 5.639 1.00 1.00 H new ATOM 0 HB2 HIS A 62 -12.304 2.199 3.460 1.00 1.00 H new ATOM 0 HB3 HIS A 62 -10.631 1.819 3.819 1.00 1.00 H new ATOM 0 HD2 HIS A 62 -9.773 -0.753 2.630 1.00 1.00 H new ATOM 0 HE1 HIS A 62 -12.765 -0.642 -0.345 1.00 1.00 H new ATOM 0 HE2 HIS A 62 -10.584 -1.797 0.351 1.00 1.00 H new ATOM 960 N ARG A 63 -14.399 0.215 4.435 1.00 1.00 N ATOM 961 CA ARG A 63 -15.557 -0.598 4.121 1.00 1.00 C ATOM 962 C ARG A 63 -15.510 -1.038 2.669 1.00 1.00 C ATOM 963 O ARG A 63 -14.859 -0.407 1.835 1.00 1.00 O ATOM 964 CB ARG A 63 -16.849 0.174 4.388 1.00 1.00 C ATOM 965 CG ARG A 63 -17.020 0.366 5.897 1.00 1.00 C ATOM 966 CD ARG A 63 -18.308 1.141 6.182 1.00 1.00 C ATOM 967 NE ARG A 63 -18.455 1.349 7.619 1.00 1.00 N ATOM 968 CZ ARG A 63 -19.612 1.725 8.154 1.00 1.00 C ATOM 969 NH1 ARG A 63 -20.655 1.919 7.394 1.00 1.00 N ATOM 970 NH2 ARG A 63 -19.705 1.901 9.445 1.00 1.00 N ATOM 0 H ARG A 63 -14.586 1.213 4.532 1.00 1.00 H new ATOM 0 HA ARG A 63 -15.540 -1.479 4.763 1.00 1.00 H new ATOM 0 HB2 ARG A 63 -16.818 1.142 3.888 1.00 1.00 H new ATOM 0 HB3 ARG A 63 -17.702 -0.369 3.980 1.00 1.00 H new ATOM 0 HG2 ARG A 63 -17.051 -0.603 6.394 1.00 1.00 H new ATOM 0 HG3 ARG A 63 -16.164 0.905 6.303 1.00 1.00 H new ATOM 0 HD2 ARG A 63 -18.286 2.101 5.667 1.00 1.00 H new ATOM 0 HD3 ARG A 63 -19.166 0.592 5.796 1.00 1.00 H new ATOM 0 HE ARG A 63 -17.650 1.202 8.228 1.00 1.00 H new ATOM 0 HH11 ARG A 63 -20.584 1.782 6.386 1.00 1.00 H new ATOM 0 HH12 ARG A 63 -21.541 2.208 7.808 1.00 1.00 H new ATOM 0 HH21 ARG A 63 -18.891 1.750 10.040 1.00 1.00 H new ATOM 0 HH22 ARG A 63 -20.592 2.190 9.858 1.00 1.00 H new ATOM 984 N ARG A 64 -16.202 -2.125 2.376 1.00 1.00 N ATOM 985 CA ARG A 64 -16.242 -2.652 1.023 1.00 1.00 C ATOM 986 C ARG A 64 -16.768 -1.601 0.055 1.00 1.00 C ATOM 987 O ARG A 64 -16.877 -1.855 -1.145 1.00 1.00 O ATOM 988 CB ARG A 64 -17.147 -3.888 0.990 1.00 1.00 C ATOM 989 CG ARG A 64 -18.574 -3.484 1.376 1.00 1.00 C ATOM 990 CD ARG A 64 -19.456 -4.728 1.471 1.00 1.00 C ATOM 991 NE ARG A 64 -19.658 -5.307 0.149 1.00 1.00 N ATOM 992 CZ ARG A 64 -20.361 -6.424 -0.011 1.00 1.00 C ATOM 993 NH1 ARG A 64 -20.880 -7.023 1.025 1.00 1.00 N ATOM 994 NH2 ARG A 64 -20.532 -6.920 -1.206 1.00 1.00 N ATOM 0 H ARG A 64 -16.743 -2.659 3.056 1.00 1.00 H new ATOM 0 HA ARG A 64 -15.232 -2.926 0.718 1.00 1.00 H new ATOM 0 HB2 ARG A 64 -17.139 -4.331 -0.006 1.00 1.00 H new ATOM 0 HB3 ARG A 64 -16.773 -4.645 1.679 1.00 1.00 H new ATOM 0 HG2 ARG A 64 -18.567 -2.958 2.331 1.00 1.00 H new ATOM 0 HG3 ARG A 64 -18.980 -2.795 0.635 1.00 1.00 H new ATOM 0 HD2 ARG A 64 -18.992 -5.462 2.130 1.00 1.00 H new ATOM 0 HD3 ARG A 64 -20.418 -4.467 1.912 1.00 1.00 H new ATOM 0 HE ARG A 64 -19.253 -4.848 -0.667 1.00 1.00 H new ATOM 0 HH11 ARG A 64 -20.747 -6.634 1.959 1.00 1.00 H new ATOM 0 HH12 ARG A 64 -21.419 -7.880 0.901 1.00 1.00 H new ATOM 0 HH21 ARG A 64 -20.126 -6.451 -2.016 1.00 1.00 H new ATOM 0 HH22 ARG A 64 -21.071 -7.777 -1.330 1.00 1.00 H new ATOM 1008 N MET A 65 -17.101 -0.418 0.574 1.00 1.00 N ATOM 1009 CA MET A 65 -17.624 0.655 -0.263 1.00 1.00 C ATOM 1010 C MET A 65 -17.328 2.016 0.369 1.00 1.00 C ATOM 1011 O MET A 65 -18.106 2.957 0.221 1.00 1.00 O ATOM 1012 CB MET A 65 -19.139 0.490 -0.418 1.00 1.00 C ATOM 1013 CG MET A 65 -19.775 0.233 0.954 1.00 1.00 C ATOM 1014 SD MET A 65 -21.556 -0.031 0.756 1.00 1.00 S ATOM 1015 CE MET A 65 -21.952 -0.293 2.504 1.00 1.00 C ATOM 0 H MET A 65 -17.018 -0.183 1.563 1.00 1.00 H new ATOM 0 HA MET A 65 -17.143 0.604 -1.240 1.00 1.00 H new ATOM 0 HB2 MET A 65 -19.568 1.386 -0.866 1.00 1.00 H new ATOM 0 HB3 MET A 65 -19.357 -0.339 -1.092 1.00 1.00 H new ATOM 0 HG2 MET A 65 -19.317 -0.639 1.421 1.00 1.00 H new ATOM 0 HG3 MET A 65 -19.594 1.081 1.615 1.00 1.00 H new ATOM 0 HE1 MET A 65 -23.021 -0.477 2.611 1.00 1.00 H new ATOM 0 HE2 MET A 65 -21.396 -1.153 2.878 1.00 1.00 H new ATOM 0 HE3 MET A 65 -21.677 0.593 3.076 1.00 1.00 H new ATOM 1025 N ALA A 66 -16.201 2.117 1.078 1.00 1.00 N ATOM 1026 CA ALA A 66 -15.833 3.370 1.723 1.00 1.00 C ATOM 1027 C ALA A 66 -15.630 4.470 0.686 1.00 1.00 C ATOM 1028 O ALA A 66 -16.286 5.503 0.762 1.00 1.00 O ATOM 1029 CB ALA A 66 -14.552 3.186 2.535 1.00 1.00 C ATOM 0 H ALA A 66 -15.538 1.354 1.216 1.00 1.00 H new ATOM 0 HA ALA A 66 -16.644 3.663 2.390 1.00 1.00 H new ATOM 0 HB1 ALA A 66 -14.286 4.129 3.013 1.00 1.00 H new ATOM 0 HB2 ALA A 66 -14.711 2.424 3.298 1.00 1.00 H new ATOM 0 HB3 ALA A 66 -13.744 2.874 1.874 1.00 1.00 H new ATOM 1035 N ILE A 67 -14.733 4.205 -0.279 1.00 1.00 N ATOM 1036 CA ILE A 67 -14.411 5.135 -1.366 1.00 1.00 C ATOM 1037 C ILE A 67 -14.179 6.551 -0.843 1.00 1.00 C ATOM 1038 O ILE A 67 -13.101 7.126 -0.989 1.00 1.00 O ATOM 1039 CB ILE A 67 -15.560 5.151 -2.396 1.00 1.00 C ATOM 1040 CG1 ILE A 67 -15.725 3.755 -3.008 1.00 1.00 C ATOM 1041 CG2 ILE A 67 -15.241 6.153 -3.511 1.00 1.00 C ATOM 1042 CD1 ILE A 67 -17.013 3.701 -3.838 1.00 1.00 C ATOM 0 H ILE A 67 -14.209 3.331 -0.324 1.00 1.00 H new ATOM 0 HA ILE A 67 -13.490 4.791 -1.838 1.00 1.00 H new ATOM 0 HB ILE A 67 -16.483 5.443 -1.895 1.00 1.00 H new ATOM 0 HG12 ILE A 67 -14.866 3.520 -3.637 1.00 1.00 H new ATOM 0 HG13 ILE A 67 -15.758 3.004 -2.219 1.00 1.00 H new ATOM 0 HG21 ILE A 67 -16.055 6.161 -4.236 1.00 1.00 H new ATOM 0 HG22 ILE A 67 -15.126 7.149 -3.083 1.00 1.00 H new ATOM 0 HG23 ILE A 67 -14.315 5.862 -4.008 1.00 1.00 H new ATOM 0 HD11 ILE A 67 -17.126 2.707 -4.271 1.00 1.00 H new ATOM 0 HD12 ILE A 67 -17.868 3.917 -3.197 1.00 1.00 H new ATOM 0 HD13 ILE A 67 -16.962 4.441 -4.637 1.00 1.00 H new ATOM 1054 N THR A 68 -15.234 7.095 -0.284 1.00 1.00 N ATOM 1055 CA THR A 68 -15.243 8.452 0.221 1.00 1.00 C ATOM 1056 C THR A 68 -13.950 8.851 0.942 1.00 1.00 C ATOM 1057 O THR A 68 -13.459 9.959 0.736 1.00 1.00 O ATOM 1058 CB THR A 68 -16.442 8.650 1.152 1.00 1.00 C ATOM 1059 OG1 THR A 68 -17.611 8.140 0.526 1.00 1.00 O ATOM 1060 CG2 THR A 68 -16.619 10.140 1.444 1.00 1.00 C ATOM 0 H THR A 68 -16.121 6.605 -0.165 1.00 1.00 H new ATOM 0 HA THR A 68 -15.322 9.105 -0.648 1.00 1.00 H new ATOM 0 HB THR A 68 -16.272 8.119 2.089 1.00 1.00 H new ATOM 0 HG1 THR A 68 -18.381 8.264 1.120 1.00 1.00 H new ATOM 0 HG21 THR A 68 -17.473 10.282 2.107 1.00 1.00 H new ATOM 0 HG22 THR A 68 -15.719 10.526 1.923 1.00 1.00 H new ATOM 0 HG23 THR A 68 -16.792 10.676 0.511 1.00 1.00 H new ATOM 1068 N GLY A 69 -13.420 7.998 1.821 1.00 1.00 N ATOM 1069 CA GLY A 69 -12.212 8.357 2.578 1.00 1.00 C ATOM 1070 C GLY A 69 -12.628 8.786 3.978 1.00 1.00 C ATOM 1071 O GLY A 69 -11.798 8.985 4.865 1.00 1.00 O ATOM 0 H GLY A 69 -13.796 7.072 2.026 1.00 1.00 H new ATOM 0 HA2 GLY A 69 -11.531 7.508 2.629 1.00 1.00 H new ATOM 0 HA3 GLY A 69 -11.678 9.165 2.078 1.00 1.00 H new ATOM 1075 N ASP A 70 -13.940 8.941 4.141 1.00 1.00 N ATOM 1076 CA ASP A 70 -14.515 9.361 5.410 1.00 1.00 C ATOM 1077 C ASP A 70 -14.484 8.251 6.460 1.00 1.00 C ATOM 1078 O ASP A 70 -14.324 8.543 7.644 1.00 1.00 O ATOM 1079 CB ASP A 70 -15.960 9.820 5.203 1.00 1.00 C ATOM 1080 CG ASP A 70 -16.804 8.674 4.654 1.00 1.00 C ATOM 1081 OD1 ASP A 70 -16.238 7.636 4.356 1.00 1.00 O ATOM 1082 OD2 ASP A 70 -18.005 8.848 4.547 1.00 1.00 O ATOM 0 H ASP A 70 -14.626 8.780 3.403 1.00 1.00 H new ATOM 0 HA ASP A 70 -13.905 10.185 5.779 1.00 1.00 H new ATOM 0 HB2 ASP A 70 -16.377 10.168 6.148 1.00 1.00 H new ATOM 0 HB3 ASP A 70 -15.986 10.663 4.513 1.00 1.00 H new ATOM 1087 N ASP A 71 -14.699 6.985 6.065 1.00 1.00 N ATOM 1088 CA ASP A 71 -14.737 5.892 7.062 1.00 1.00 C ATOM 1089 C ASP A 71 -13.501 4.999 7.020 1.00 1.00 C ATOM 1090 O ASP A 71 -13.595 3.785 7.208 1.00 1.00 O ATOM 1091 CB ASP A 71 -15.983 5.045 6.821 1.00 1.00 C ATOM 1092 CG ASP A 71 -17.226 5.886 7.057 1.00 1.00 C ATOM 1093 OD1 ASP A 71 -17.421 6.323 8.180 1.00 1.00 O ATOM 1094 OD2 ASP A 71 -17.958 6.089 6.104 1.00 1.00 O ATOM 0 H ASP A 71 -14.845 6.695 5.098 1.00 1.00 H new ATOM 0 HA ASP A 71 -14.759 6.354 8.049 1.00 1.00 H new ATOM 0 HB2 ASP A 71 -15.981 4.659 5.801 1.00 1.00 H new ATOM 0 HB3 ASP A 71 -15.983 4.183 7.488 1.00 1.00 H new ATOM 1099 N VAL A 72 -12.341 5.603 6.801 1.00 1.00 N ATOM 1100 CA VAL A 72 -11.087 4.853 6.776 1.00 1.00 C ATOM 1101 C VAL A 72 -9.961 5.658 7.405 1.00 1.00 C ATOM 1102 O VAL A 72 -9.846 6.858 7.170 1.00 1.00 O ATOM 1103 CB VAL A 72 -10.733 4.494 5.325 1.00 1.00 C ATOM 1104 CG1 VAL A 72 -11.030 5.694 4.424 1.00 1.00 C ATOM 1105 CG2 VAL A 72 -9.236 4.126 5.204 1.00 1.00 C ATOM 0 H VAL A 72 -12.239 6.605 6.639 1.00 1.00 H new ATOM 0 HA VAL A 72 -11.215 3.939 7.356 1.00 1.00 H new ATOM 0 HB VAL A 72 -11.331 3.635 5.020 1.00 1.00 H new ATOM 0 HG11 VAL A 72 -10.781 5.445 3.393 1.00 1.00 H new ATOM 0 HG12 VAL A 72 -12.088 5.946 4.491 1.00 1.00 H new ATOM 0 HG13 VAL A 72 -10.433 6.547 4.746 1.00 1.00 H new ATOM 0 HG21 VAL A 72 -9.006 3.875 4.169 1.00 1.00 H new ATOM 0 HG22 VAL A 72 -8.626 4.974 5.516 1.00 1.00 H new ATOM 0 HG23 VAL A 72 -9.019 3.269 5.842 1.00 1.00 H new ATOM 1115 N SER A 73 -9.131 4.994 8.220 1.00 1.00 N ATOM 1116 CA SER A 73 -8.010 5.644 8.883 1.00 1.00 C ATOM 1117 C SER A 73 -6.891 4.608 9.050 1.00 1.00 C ATOM 1118 O SER A 73 -7.117 3.416 8.848 1.00 1.00 O ATOM 1119 CB SER A 73 -8.441 6.181 10.248 1.00 1.00 C ATOM 1120 OG SER A 73 -9.470 7.146 10.068 1.00 1.00 O ATOM 0 H SER A 73 -9.222 4.001 8.432 1.00 1.00 H new ATOM 0 HA SER A 73 -7.658 6.486 8.287 1.00 1.00 H new ATOM 0 HB2 SER A 73 -8.797 5.365 10.877 1.00 1.00 H new ATOM 0 HB3 SER A 73 -7.590 6.630 10.760 1.00 1.00 H new ATOM 0 HG SER A 73 -9.751 7.492 10.941 1.00 1.00 H new ATOM 1126 N LEU A 74 -5.682 5.064 9.346 1.00 1.00 N ATOM 1127 CA LEU A 74 -4.532 4.158 9.442 1.00 1.00 C ATOM 1128 C LEU A 74 -4.832 2.863 10.214 1.00 1.00 C ATOM 1129 O LEU A 74 -5.395 2.879 11.309 1.00 1.00 O ATOM 1130 CB LEU A 74 -3.350 4.890 10.110 1.00 1.00 C ATOM 1131 CG LEU A 74 -2.029 4.478 9.448 1.00 1.00 C ATOM 1132 CD1 LEU A 74 -0.872 5.273 10.075 1.00 1.00 C ATOM 1133 CD2 LEU A 74 -1.804 2.961 9.625 1.00 1.00 C ATOM 0 H LEU A 74 -5.467 6.045 9.523 1.00 1.00 H new ATOM 0 HA LEU A 74 -4.283 3.865 8.422 1.00 1.00 H new ATOM 0 HB2 LEU A 74 -3.486 5.968 10.026 1.00 1.00 H new ATOM 0 HB3 LEU A 74 -3.321 4.654 11.174 1.00 1.00 H new ATOM 0 HG LEU A 74 -2.070 4.698 8.381 1.00 1.00 H new ATOM 0 HD11 LEU A 74 0.067 4.981 9.605 1.00 1.00 H new ATOM 0 HD12 LEU A 74 -1.038 6.339 9.922 1.00 1.00 H new ATOM 0 HD13 LEU A 74 -0.824 5.063 11.144 1.00 1.00 H new ATOM 0 HD21 LEU A 74 -0.864 2.675 9.153 1.00 1.00 H new ATOM 0 HD22 LEU A 74 -1.764 2.721 10.687 1.00 1.00 H new ATOM 0 HD23 LEU A 74 -2.625 2.415 9.160 1.00 1.00 H new ATOM 1145 N ASP A 75 -4.414 1.742 9.610 1.00 1.00 N ATOM 1146 CA ASP A 75 -4.590 0.412 10.196 1.00 1.00 C ATOM 1147 C ASP A 75 -3.258 -0.120 10.743 1.00 1.00 C ATOM 1148 O ASP A 75 -3.146 -0.425 11.930 1.00 1.00 O ATOM 1149 CB ASP A 75 -5.116 -0.548 9.129 1.00 1.00 C ATOM 1150 CG ASP A 75 -5.450 -1.898 9.754 1.00 1.00 C ATOM 1151 OD1 ASP A 75 -5.487 -1.973 10.971 1.00 1.00 O ATOM 1152 OD2 ASP A 75 -5.663 -2.836 9.005 1.00 1.00 O ATOM 0 H ASP A 75 -3.946 1.735 8.704 1.00 1.00 H new ATOM 0 HA ASP A 75 -5.303 0.485 11.017 1.00 1.00 H new ATOM 0 HB2 ASP A 75 -6.004 -0.128 8.657 1.00 1.00 H new ATOM 0 HB3 ASP A 75 -4.369 -0.677 8.345 1.00 1.00 H new ATOM 1157 N GLN A 76 -2.247 -0.229 9.870 1.00 1.00 N ATOM 1158 CA GLN A 76 -0.931 -0.725 10.287 1.00 1.00 C ATOM 1159 C GLN A 76 0.142 -0.352 9.258 1.00 1.00 C ATOM 1160 O GLN A 76 0.007 -0.637 8.068 1.00 1.00 O ATOM 1161 CB GLN A 76 -0.954 -2.250 10.457 1.00 1.00 C ATOM 1162 CG GLN A 76 0.326 -2.697 11.177 1.00 1.00 C ATOM 1163 CD GLN A 76 0.511 -4.205 11.052 1.00 1.00 C ATOM 1164 OE1 GLN A 76 -0.113 -4.972 11.786 1.00 1.00 O ATOM 1165 NE2 GLN A 76 1.335 -4.679 10.158 1.00 1.00 N ATOM 0 H GLN A 76 -2.314 0.017 8.882 1.00 1.00 H new ATOM 0 HA GLN A 76 -0.691 -0.259 11.243 1.00 1.00 H new ATOM 0 HB2 GLN A 76 -1.831 -2.551 11.029 1.00 1.00 H new ATOM 0 HB3 GLN A 76 -1.026 -2.735 9.484 1.00 1.00 H new ATOM 0 HG2 GLN A 76 1.188 -2.183 10.752 1.00 1.00 H new ATOM 0 HG3 GLN A 76 0.275 -2.417 12.229 1.00 1.00 H new ATOM 0 HE21 GLN A 76 1.851 -4.042 9.551 1.00 1.00 H new ATOM 0 HE22 GLN A 76 1.463 -5.687 10.066 1.00 1.00 H new ATOM 1174 N ILE A 77 1.206 0.281 9.740 1.00 1.00 N ATOM 1175 CA ILE A 77 2.317 0.700 8.886 1.00 1.00 C ATOM 1176 C ILE A 77 3.246 -0.480 8.627 1.00 1.00 C ATOM 1177 O ILE A 77 3.654 -1.177 9.554 1.00 1.00 O ATOM 1178 CB ILE A 77 3.104 1.827 9.584 1.00 1.00 C ATOM 1179 CG1 ILE A 77 2.138 2.962 9.939 1.00 1.00 C ATOM 1180 CG2 ILE A 77 4.216 2.375 8.660 1.00 1.00 C ATOM 1181 CD1 ILE A 77 2.892 4.088 10.663 1.00 1.00 C ATOM 0 H ILE A 77 1.325 0.518 10.725 1.00 1.00 H new ATOM 0 HA ILE A 77 1.922 1.061 7.936 1.00 1.00 H new ATOM 0 HB ILE A 77 3.568 1.426 10.485 1.00 1.00 H new ATOM 0 HG12 ILE A 77 1.671 3.350 9.033 1.00 1.00 H new ATOM 0 HG13 ILE A 77 1.337 2.583 10.574 1.00 1.00 H new ATOM 0 HG21 ILE A 77 4.758 3.169 9.174 1.00 1.00 H new ATOM 0 HG22 ILE A 77 4.906 1.571 8.405 1.00 1.00 H new ATOM 0 HG23 ILE A 77 3.769 2.772 7.749 1.00 1.00 H new ATOM 0 HD11 ILE A 77 2.197 4.890 10.911 1.00 1.00 H new ATOM 0 HD12 ILE A 77 3.338 3.698 11.578 1.00 1.00 H new ATOM 0 HD13 ILE A 77 3.677 4.476 10.014 1.00 1.00 H new ATOM 1193 N VAL A 78 3.589 -0.677 7.358 1.00 1.00 N ATOM 1194 CA VAL A 78 4.500 -1.752 6.955 1.00 1.00 C ATOM 1195 C VAL A 78 5.730 -1.118 6.302 1.00 1.00 C ATOM 1196 O VAL A 78 5.723 -0.860 5.097 1.00 1.00 O ATOM 1197 CB VAL A 78 3.814 -2.695 5.966 1.00 1.00 C ATOM 1198 CG1 VAL A 78 4.836 -3.718 5.447 1.00 1.00 C ATOM 1199 CG2 VAL A 78 2.678 -3.428 6.680 1.00 1.00 C ATOM 0 H VAL A 78 3.250 -0.105 6.585 1.00 1.00 H new ATOM 0 HA VAL A 78 4.792 -2.334 7.830 1.00 1.00 H new ATOM 0 HB VAL A 78 3.414 -2.124 5.128 1.00 1.00 H new ATOM 0 HG11 VAL A 78 4.350 -4.392 4.742 1.00 1.00 H new ATOM 0 HG12 VAL A 78 5.652 -3.196 4.947 1.00 1.00 H new ATOM 0 HG13 VAL A 78 5.232 -4.293 6.284 1.00 1.00 H new ATOM 0 HG21 VAL A 78 2.184 -4.103 5.981 1.00 1.00 H new ATOM 0 HG22 VAL A 78 3.083 -4.002 7.514 1.00 1.00 H new ATOM 0 HG23 VAL A 78 1.956 -2.703 7.056 1.00 1.00 H new ATOM 1209 N PRO A 79 6.761 -0.808 7.062 1.00 1.00 N ATOM 1210 CA PRO A 79 7.973 -0.128 6.514 1.00 1.00 C ATOM 1211 C PRO A 79 8.823 -1.026 5.630 1.00 1.00 C ATOM 1212 O PRO A 79 8.896 -2.239 5.832 1.00 1.00 O ATOM 1213 CB PRO A 79 8.733 0.312 7.770 1.00 1.00 C ATOM 1214 CG PRO A 79 8.356 -0.687 8.809 1.00 1.00 C ATOM 1215 CD PRO A 79 6.906 -1.075 8.511 1.00 1.00 C ATOM 0 HA PRO A 79 7.707 0.699 5.855 1.00 1.00 H new ATOM 0 HB2 PRO A 79 9.810 0.319 7.599 1.00 1.00 H new ATOM 0 HB3 PRO A 79 8.451 1.321 8.070 1.00 1.00 H new ATOM 0 HG2 PRO A 79 9.010 -1.558 8.769 1.00 1.00 H new ATOM 0 HG3 PRO A 79 8.450 -0.264 9.809 1.00 1.00 H new ATOM 0 HD2 PRO A 79 6.715 -2.122 8.746 1.00 1.00 H new ATOM 0 HD3 PRO A 79 6.204 -0.484 9.099 1.00 1.00 H new ATOM 1223 N LEU A 80 9.451 -0.410 4.637 1.00 1.00 N ATOM 1224 CA LEU A 80 10.285 -1.140 3.705 1.00 1.00 C ATOM 1225 C LEU A 80 11.538 -1.673 4.383 1.00 1.00 C ATOM 1226 O LEU A 80 12.293 -0.939 5.023 1.00 1.00 O ATOM 1227 CB LEU A 80 10.672 -0.219 2.545 1.00 1.00 C ATOM 1228 CG LEU A 80 9.435 0.102 1.696 1.00 1.00 C ATOM 1229 CD1 LEU A 80 9.797 1.179 0.670 1.00 1.00 C ATOM 1230 CD2 LEU A 80 8.928 -1.166 0.968 1.00 1.00 C ATOM 0 H LEU A 80 9.396 0.593 4.460 1.00 1.00 H new ATOM 0 HA LEU A 80 9.719 -1.993 3.330 1.00 1.00 H new ATOM 0 HB2 LEU A 80 11.108 0.703 2.931 1.00 1.00 H new ATOM 0 HB3 LEU A 80 11.433 -0.697 1.928 1.00 1.00 H new ATOM 0 HG LEU A 80 8.640 0.463 2.349 1.00 1.00 H new ATOM 0 HD11 LEU A 80 8.922 1.412 0.063 1.00 1.00 H new ATOM 0 HD12 LEU A 80 10.129 2.079 1.188 1.00 1.00 H new ATOM 0 HD13 LEU A 80 10.598 0.814 0.027 1.00 1.00 H new ATOM 0 HD21 LEU A 80 8.050 -0.917 0.372 1.00 1.00 H new ATOM 0 HD22 LEU A 80 9.713 -1.550 0.316 1.00 1.00 H new ATOM 0 HD23 LEU A 80 8.663 -1.926 1.703 1.00 1.00 H new ATOM 1242 N SER A 81 11.734 -2.974 4.226 1.00 1.00 N ATOM 1243 CA SER A 81 12.881 -3.672 4.804 1.00 1.00 C ATOM 1244 C SER A 81 13.666 -4.387 3.714 1.00 1.00 C ATOM 1245 O SER A 81 13.170 -4.599 2.613 1.00 1.00 O ATOM 1246 CB SER A 81 12.405 -4.686 5.844 1.00 1.00 C ATOM 1247 OG SER A 81 11.885 -3.993 6.971 1.00 1.00 O ATOM 0 H SER A 81 11.106 -3.578 3.696 1.00 1.00 H new ATOM 0 HA SER A 81 13.529 -2.940 5.286 1.00 1.00 H new ATOM 0 HB2 SER A 81 11.639 -5.332 5.415 1.00 1.00 H new ATOM 0 HB3 SER A 81 13.231 -5.329 6.147 1.00 1.00 H new ATOM 0 HG SER A 81 11.577 -4.640 7.639 1.00 1.00 H new ATOM 1253 N LYS A 82 14.905 -4.727 4.005 1.00 1.00 N ATOM 1254 CA LYS A 82 15.741 -5.391 3.019 1.00 1.00 C ATOM 1255 C LYS A 82 15.087 -6.681 2.530 1.00 1.00 C ATOM 1256 O LYS A 82 15.099 -6.975 1.336 1.00 1.00 O ATOM 1257 CB LYS A 82 17.096 -5.712 3.636 1.00 1.00 C ATOM 1258 CG LYS A 82 18.020 -6.300 2.565 1.00 1.00 C ATOM 1259 CD LYS A 82 19.390 -6.607 3.177 1.00 1.00 C ATOM 1260 CE LYS A 82 19.339 -7.918 3.972 1.00 1.00 C ATOM 1261 NZ LYS A 82 20.724 -8.331 4.332 1.00 1.00 N ATOM 0 H LYS A 82 15.354 -4.558 4.905 1.00 1.00 H new ATOM 0 HA LYS A 82 15.868 -4.723 2.167 1.00 1.00 H new ATOM 0 HB2 LYS A 82 17.539 -4.809 4.057 1.00 1.00 H new ATOM 0 HB3 LYS A 82 16.975 -6.420 4.456 1.00 1.00 H new ATOM 0 HG2 LYS A 82 17.583 -7.210 2.153 1.00 1.00 H new ATOM 0 HG3 LYS A 82 18.129 -5.597 1.739 1.00 1.00 H new ATOM 0 HD2 LYS A 82 20.139 -6.681 2.389 1.00 1.00 H new ATOM 0 HD3 LYS A 82 19.695 -5.790 3.830 1.00 1.00 H new ATOM 0 HE2 LYS A 82 18.741 -7.787 4.874 1.00 1.00 H new ATOM 0 HE3 LYS A 82 18.857 -8.697 3.380 1.00 1.00 H new ATOM 0 HZ1 LYS A 82 20.692 -9.220 4.871 1.00 1.00 H new ATOM 0 HZ2 LYS A 82 21.281 -8.472 3.465 1.00 1.00 H new ATOM 0 HZ3 LYS A 82 21.168 -7.590 4.912 1.00 1.00 H new ATOM 1275 N ASP A 83 14.525 -7.450 3.455 1.00 1.00 N ATOM 1276 CA ASP A 83 13.882 -8.708 3.095 1.00 1.00 C ATOM 1277 C ASP A 83 12.602 -8.448 2.296 1.00 1.00 C ATOM 1278 O ASP A 83 11.885 -9.379 1.928 1.00 1.00 O ATOM 1279 CB ASP A 83 13.562 -9.497 4.367 1.00 1.00 C ATOM 1280 CG ASP A 83 14.848 -10.037 4.989 1.00 1.00 C ATOM 1281 OD1 ASP A 83 15.858 -10.046 4.306 1.00 1.00 O ATOM 1282 OD2 ASP A 83 14.801 -10.436 6.142 1.00 1.00 O ATOM 0 H ASP A 83 14.501 -7.228 4.450 1.00 1.00 H new ATOM 0 HA ASP A 83 14.560 -9.289 2.470 1.00 1.00 H new ATOM 0 HB2 ASP A 83 13.045 -8.856 5.081 1.00 1.00 H new ATOM 0 HB3 ASP A 83 12.888 -10.321 4.133 1.00 1.00 H new ATOM 1287 N PHE A 84 12.346 -7.172 2.004 1.00 1.00 N ATOM 1288 CA PHE A 84 11.176 -6.788 1.216 1.00 1.00 C ATOM 1289 C PHE A 84 11.396 -7.192 -0.236 1.00 1.00 C ATOM 1290 O PHE A 84 12.504 -7.086 -0.758 1.00 1.00 O ATOM 1291 CB PHE A 84 10.945 -5.269 1.312 1.00 1.00 C ATOM 1292 CG PHE A 84 9.587 -4.890 0.744 1.00 1.00 C ATOM 1293 CD1 PHE A 84 9.345 -4.951 -0.637 1.00 1.00 C ATOM 1294 CD2 PHE A 84 8.567 -4.466 1.607 1.00 1.00 C ATOM 1295 CE1 PHE A 84 8.089 -4.593 -1.145 1.00 1.00 C ATOM 1296 CE2 PHE A 84 7.314 -4.108 1.098 1.00 1.00 C ATOM 1297 CZ PHE A 84 7.075 -4.174 -0.278 1.00 1.00 C ATOM 0 H PHE A 84 12.931 -6.391 2.300 1.00 1.00 H new ATOM 0 HA PHE A 84 10.295 -7.297 1.606 1.00 1.00 H new ATOM 0 HB2 PHE A 84 11.009 -4.952 2.353 1.00 1.00 H new ATOM 0 HB3 PHE A 84 11.730 -4.743 0.770 1.00 1.00 H new ATOM 0 HD1 PHE A 84 10.127 -5.274 -1.308 1.00 1.00 H new ATOM 0 HD2 PHE A 84 8.749 -4.415 2.670 1.00 1.00 H new ATOM 0 HE1 PHE A 84 7.904 -4.641 -2.208 1.00 1.00 H new ATOM 0 HE2 PHE A 84 6.532 -3.781 1.767 1.00 1.00 H new ATOM 0 HZ PHE A 84 6.107 -3.901 -0.671 1.00 1.00 H new ATOM 1307 N MET A 85 10.327 -7.628 -0.887 1.00 1.00 N ATOM 1308 CA MET A 85 10.400 -8.018 -2.293 1.00 1.00 C ATOM 1309 C MET A 85 9.000 -8.204 -2.863 1.00 1.00 C ATOM 1310 O MET A 85 8.128 -8.768 -2.203 1.00 1.00 O ATOM 1311 CB MET A 85 11.200 -9.316 -2.458 1.00 1.00 C ATOM 1312 CG MET A 85 11.336 -9.657 -3.950 1.00 1.00 C ATOM 1313 SD MET A 85 12.359 -11.142 -4.142 1.00 1.00 S ATOM 1314 CE MET A 85 12.331 -11.218 -5.952 1.00 1.00 C ATOM 0 H MET A 85 9.401 -7.721 -0.469 1.00 1.00 H new ATOM 0 HA MET A 85 10.908 -7.222 -2.838 1.00 1.00 H new ATOM 0 HB2 MET A 85 12.187 -9.205 -2.009 1.00 1.00 H new ATOM 0 HB3 MET A 85 10.701 -10.131 -1.933 1.00 1.00 H new ATOM 0 HG2 MET A 85 10.351 -9.822 -4.387 1.00 1.00 H new ATOM 0 HG3 MET A 85 11.786 -8.821 -4.485 1.00 1.00 H new ATOM 0 HE1 MET A 85 12.912 -12.076 -6.289 1.00 1.00 H new ATOM 0 HE2 MET A 85 11.302 -11.319 -6.296 1.00 1.00 H new ATOM 0 HE3 MET A 85 12.762 -10.304 -6.361 1.00 1.00 H new ATOM 1324 N LEU A 86 8.787 -7.757 -4.095 1.00 1.00 N ATOM 1325 CA LEU A 86 7.490 -7.917 -4.745 1.00 1.00 C ATOM 1326 C LEU A 86 7.558 -9.115 -5.677 1.00 1.00 C ATOM 1327 O LEU A 86 8.468 -9.207 -6.502 1.00 1.00 O ATOM 1328 CB LEU A 86 7.143 -6.649 -5.538 1.00 1.00 C ATOM 1329 CG LEU A 86 8.203 -6.399 -6.646 1.00 1.00 C ATOM 1330 CD1 LEU A 86 7.686 -6.895 -8.009 1.00 1.00 C ATOM 1331 CD2 LEU A 86 8.517 -4.895 -6.744 1.00 1.00 C ATOM 0 H LEU A 86 9.490 -7.284 -4.662 1.00 1.00 H new ATOM 0 HA LEU A 86 6.715 -8.078 -3.995 1.00 1.00 H new ATOM 0 HB2 LEU A 86 6.155 -6.752 -5.987 1.00 1.00 H new ATOM 0 HB3 LEU A 86 7.100 -5.792 -4.866 1.00 1.00 H new ATOM 0 HG LEU A 86 9.108 -6.948 -6.384 1.00 1.00 H new ATOM 0 HD11 LEU A 86 8.441 -6.712 -8.773 1.00 1.00 H new ATOM 0 HD12 LEU A 86 7.479 -7.964 -7.953 1.00 1.00 H new ATOM 0 HD13 LEU A 86 6.772 -6.361 -8.267 1.00 1.00 H new ATOM 0 HD21 LEU A 86 9.261 -4.729 -7.523 1.00 1.00 H new ATOM 0 HD22 LEU A 86 7.606 -4.348 -6.989 1.00 1.00 H new ATOM 0 HD23 LEU A 86 8.906 -4.542 -5.789 1.00 1.00 H new ATOM 1343 N GLU A 87 6.613 -10.045 -5.542 1.00 1.00 N ATOM 1344 CA GLU A 87 6.599 -11.248 -6.376 1.00 1.00 C ATOM 1345 C GLU A 87 5.329 -11.308 -7.212 1.00 1.00 C ATOM 1346 O GLU A 87 4.362 -10.590 -6.959 1.00 1.00 O ATOM 1347 CB GLU A 87 6.662 -12.496 -5.495 1.00 1.00 C ATOM 1348 CG GLU A 87 8.015 -12.561 -4.785 1.00 1.00 C ATOM 1349 CD GLU A 87 8.053 -13.757 -3.839 1.00 1.00 C ATOM 1350 OE1 GLU A 87 7.071 -14.480 -3.791 1.00 1.00 O ATOM 1351 OE2 GLU A 87 9.062 -13.933 -3.178 1.00 1.00 O ATOM 0 H GLU A 87 5.850 -9.990 -4.867 1.00 1.00 H new ATOM 0 HA GLU A 87 7.466 -11.211 -7.036 1.00 1.00 H new ATOM 0 HB2 GLU A 87 5.856 -12.475 -4.761 1.00 1.00 H new ATOM 0 HB3 GLU A 87 6.517 -13.389 -6.103 1.00 1.00 H new ATOM 0 HG2 GLU A 87 8.816 -12.643 -5.519 1.00 1.00 H new ATOM 0 HG3 GLU A 87 8.186 -11.640 -4.227 1.00 1.00 H new ATOM 1358 N GLU A 88 5.347 -12.194 -8.199 1.00 1.00 N ATOM 1359 CA GLU A 88 4.199 -12.400 -9.081 1.00 1.00 C ATOM 1360 C GLU A 88 3.723 -13.841 -8.971 1.00 1.00 C ATOM 1361 O GLU A 88 4.534 -14.756 -8.813 1.00 1.00 O ATOM 1362 CB GLU A 88 4.581 -12.091 -10.532 1.00 1.00 C ATOM 1363 CG GLU A 88 4.935 -10.607 -10.674 1.00 1.00 C ATOM 1364 CD GLU A 88 3.717 -9.738 -10.371 1.00 1.00 C ATOM 1365 OE1 GLU A 88 2.670 -10.000 -10.942 1.00 1.00 O ATOM 1366 OE2 GLU A 88 3.848 -8.829 -9.570 1.00 1.00 O ATOM 0 H GLU A 88 6.149 -12.787 -8.412 1.00 1.00 H new ATOM 0 HA GLU A 88 3.396 -11.728 -8.779 1.00 1.00 H new ATOM 0 HB2 GLU A 88 5.429 -12.706 -10.833 1.00 1.00 H new ATOM 0 HB3 GLU A 88 3.754 -12.342 -11.196 1.00 1.00 H new ATOM 0 HG2 GLU A 88 5.748 -10.354 -9.994 1.00 1.00 H new ATOM 0 HG3 GLU A 88 5.290 -10.406 -11.685 1.00 1.00 H new ATOM 1373 N VAL A 89 2.408 -14.046 -9.066 1.00 1.00 N ATOM 1374 CA VAL A 89 1.840 -15.400 -8.988 1.00 1.00 C ATOM 1375 C VAL A 89 1.243 -15.801 -10.325 1.00 1.00 C ATOM 1376 O VAL A 89 0.582 -15.007 -10.991 1.00 1.00 O ATOM 1377 CB VAL A 89 0.765 -15.474 -7.910 1.00 1.00 C ATOM 1378 CG1 VAL A 89 -0.256 -14.361 -8.123 1.00 1.00 C ATOM 1379 CG2 VAL A 89 0.058 -16.838 -7.966 1.00 1.00 C ATOM 0 H VAL A 89 1.720 -13.304 -9.196 1.00 1.00 H new ATOM 0 HA VAL A 89 2.646 -16.088 -8.732 1.00 1.00 H new ATOM 0 HB VAL A 89 1.234 -15.353 -6.933 1.00 1.00 H new ATOM 0 HG11 VAL A 89 -1.023 -14.418 -7.350 1.00 1.00 H new ATOM 0 HG12 VAL A 89 0.243 -13.394 -8.068 1.00 1.00 H new ATOM 0 HG13 VAL A 89 -0.720 -14.475 -9.103 1.00 1.00 H new ATOM 0 HG21 VAL A 89 -0.709 -16.882 -7.192 1.00 1.00 H new ATOM 0 HG22 VAL A 89 -0.405 -16.968 -8.944 1.00 1.00 H new ATOM 0 HG23 VAL A 89 0.786 -17.632 -7.801 1.00 1.00 H new ATOM 1389 N SER A 90 1.489 -17.045 -10.698 1.00 1.00 N ATOM 1390 CA SER A 90 0.986 -17.578 -11.961 1.00 1.00 C ATOM 1391 C SER A 90 -0.499 -17.229 -12.145 1.00 1.00 C ATOM 1392 O SER A 90 -1.351 -17.817 -11.481 1.00 1.00 O ATOM 1393 CB SER A 90 1.146 -19.098 -11.989 1.00 1.00 C ATOM 1394 OG SER A 90 0.773 -19.582 -13.274 1.00 1.00 O ATOM 0 H SER A 90 2.034 -17.708 -10.147 1.00 1.00 H new ATOM 0 HA SER A 90 1.562 -17.130 -12.771 1.00 1.00 H new ATOM 0 HB2 SER A 90 2.178 -19.372 -11.769 1.00 1.00 H new ATOM 0 HB3 SER A 90 0.524 -19.556 -11.220 1.00 1.00 H new ATOM 0 HG SER A 90 0.029 -20.213 -13.182 1.00 1.00 H new ATOM 1400 N PRO A 91 -0.841 -16.301 -13.021 1.00 1.00 N ATOM 1401 CA PRO A 91 -2.272 -15.918 -13.248 1.00 1.00 C ATOM 1402 C PRO A 91 -3.171 -17.127 -13.522 1.00 1.00 C ATOM 1403 O PRO A 91 -4.303 -17.186 -13.044 1.00 1.00 O ATOM 1404 CB PRO A 91 -2.211 -14.994 -14.477 1.00 1.00 C ATOM 1405 CG PRO A 91 -0.832 -14.424 -14.467 1.00 1.00 C ATOM 1406 CD PRO A 91 0.071 -15.509 -13.878 1.00 1.00 C ATOM 0 HA PRO A 91 -2.706 -15.444 -12.368 1.00 1.00 H new ATOM 0 HB2 PRO A 91 -2.402 -15.548 -15.396 1.00 1.00 H new ATOM 0 HB3 PRO A 91 -2.963 -14.207 -14.417 1.00 1.00 H new ATOM 0 HG2 PRO A 91 -0.514 -14.156 -15.475 1.00 1.00 H new ATOM 0 HG3 PRO A 91 -0.790 -13.515 -13.868 1.00 1.00 H new ATOM 0 HD2 PRO A 91 0.520 -16.123 -14.659 1.00 1.00 H new ATOM 0 HD3 PRO A 91 0.889 -15.079 -13.301 1.00 1.00 H new ATOM 1414 N ASP A 92 -2.667 -18.067 -14.314 1.00 1.00 N ATOM 1415 CA ASP A 92 -3.443 -19.253 -14.668 1.00 1.00 C ATOM 1416 C ASP A 92 -4.752 -18.831 -15.335 1.00 1.00 C ATOM 1417 O ASP A 92 -5.791 -19.468 -15.153 1.00 1.00 O ATOM 1418 CB ASP A 92 -3.738 -20.098 -13.419 1.00 1.00 C ATOM 1419 CG ASP A 92 -2.457 -20.762 -12.924 1.00 1.00 C ATOM 1420 OD1 ASP A 92 -1.455 -20.662 -13.613 1.00 1.00 O ATOM 1421 OD2 ASP A 92 -2.495 -21.358 -11.859 1.00 1.00 O ATOM 0 H ASP A 92 -1.732 -18.033 -14.721 1.00 1.00 H new ATOM 0 HA ASP A 92 -2.862 -19.858 -15.364 1.00 1.00 H new ATOM 0 HB2 ASP A 92 -4.158 -19.468 -12.634 1.00 1.00 H new ATOM 0 HB3 ASP A 92 -4.485 -20.857 -13.652 1.00 1.00 H new ATOM 1426 N GLY A 93 -4.684 -17.749 -16.112 1.00 1.00 N ATOM 1427 CA GLY A 93 -5.859 -17.231 -16.815 1.00 1.00 C ATOM 1428 C GLY A 93 -6.204 -18.091 -18.031 1.00 1.00 C ATOM 1429 O GLY A 93 -5.510 -18.054 -19.048 1.00 1.00 O ATOM 0 H GLY A 93 -3.829 -17.215 -16.270 1.00 1.00 H new ATOM 0 HA2 GLY A 93 -6.710 -17.203 -16.134 1.00 1.00 H new ATOM 0 HA3 GLY A 93 -5.672 -16.206 -17.134 1.00 1.00 H new ATOM 1433 N GLU A 94 -7.274 -18.872 -17.910 1.00 1.00 N ATOM 1434 CA GLU A 94 -7.705 -19.752 -18.994 1.00 1.00 C ATOM 1435 C GLU A 94 -8.316 -18.950 -20.143 1.00 1.00 C ATOM 1436 O GLU A 94 -7.997 -19.183 -21.309 1.00 1.00 O ATOM 1437 CB GLU A 94 -8.727 -20.782 -18.462 1.00 1.00 C ATOM 1438 CG GLU A 94 -9.522 -20.178 -17.292 1.00 1.00 C ATOM 1439 CD GLU A 94 -8.734 -20.302 -15.989 1.00 1.00 C ATOM 1440 OE1 GLU A 94 -8.133 -21.344 -15.781 1.00 1.00 O ATOM 1441 OE2 GLU A 94 -8.747 -19.356 -15.219 1.00 1.00 O ATOM 0 H GLU A 94 -7.858 -18.914 -17.075 1.00 1.00 H new ATOM 0 HA GLU A 94 -6.830 -20.278 -19.376 1.00 1.00 H new ATOM 0 HB2 GLU A 94 -9.407 -21.077 -19.261 1.00 1.00 H new ATOM 0 HB3 GLU A 94 -8.210 -21.684 -18.134 1.00 1.00 H new ATOM 0 HG2 GLU A 94 -9.738 -19.129 -17.495 1.00 1.00 H new ATOM 0 HG3 GLU A 94 -10.480 -20.688 -17.194 1.00 1.00 H new ATOM 1448 N LEU A 95 -9.190 -18.001 -19.811 1.00 1.00 N ATOM 1449 CA LEU A 95 -9.830 -17.172 -20.830 1.00 1.00 C ATOM 1450 C LEU A 95 -10.040 -15.765 -20.282 1.00 1.00 C ATOM 1451 O LEU A 95 -11.170 -15.329 -20.060 1.00 1.00 O ATOM 1452 CB LEU A 95 -11.184 -17.774 -21.235 1.00 1.00 C ATOM 1453 CG LEU A 95 -11.779 -17.004 -22.429 1.00 1.00 C ATOM 1454 CD1 LEU A 95 -10.927 -17.221 -23.695 1.00 1.00 C ATOM 1455 CD2 LEU A 95 -13.213 -17.492 -22.679 1.00 1.00 C ATOM 0 H LEU A 95 -9.469 -17.788 -18.853 1.00 1.00 H new ATOM 0 HA LEU A 95 -9.186 -17.132 -21.709 1.00 1.00 H new ATOM 0 HB2 LEU A 95 -11.058 -18.824 -21.498 1.00 1.00 H new ATOM 0 HB3 LEU A 95 -11.873 -17.737 -20.391 1.00 1.00 H new ATOM 0 HG LEU A 95 -11.785 -15.939 -22.197 1.00 1.00 H new ATOM 0 HD11 LEU A 95 -11.364 -16.669 -24.527 1.00 1.00 H new ATOM 0 HD12 LEU A 95 -9.912 -16.865 -23.516 1.00 1.00 H new ATOM 0 HD13 LEU A 95 -10.901 -18.283 -23.938 1.00 1.00 H new ATOM 0 HD21 LEU A 95 -13.640 -16.950 -23.523 1.00 1.00 H new ATOM 0 HD22 LEU A 95 -13.201 -18.559 -22.901 1.00 1.00 H new ATOM 0 HD23 LEU A 95 -13.818 -17.313 -21.790 1.00 1.00 H new ATOM 1467 N TYR A 96 -8.942 -15.050 -20.071 1.00 1.00 N ATOM 1468 CA TYR A 96 -9.022 -13.684 -19.558 1.00 1.00 C ATOM 1469 C TYR A 96 -7.659 -12.988 -19.648 1.00 1.00 C ATOM 1470 O TYR A 96 -6.616 -13.639 -19.710 1.00 1.00 O ATOM 1471 CB TYR A 96 -9.503 -13.702 -18.085 1.00 1.00 C ATOM 1472 CG TYR A 96 -10.591 -12.674 -17.865 1.00 1.00 C ATOM 1473 CD1 TYR A 96 -11.934 -13.006 -18.084 1.00 1.00 C ATOM 1474 CD2 TYR A 96 -10.246 -11.390 -17.438 1.00 1.00 C ATOM 1475 CE1 TYR A 96 -12.932 -12.045 -17.874 1.00 1.00 C ATOM 1476 CE2 TYR A 96 -11.240 -10.432 -17.229 1.00 1.00 C ATOM 1477 CZ TYR A 96 -12.583 -10.758 -17.447 1.00 1.00 C ATOM 1478 OH TYR A 96 -13.563 -9.812 -17.235 1.00 1.00 O ATOM 0 H TYR A 96 -7.995 -15.386 -20.244 1.00 1.00 H new ATOM 0 HA TYR A 96 -9.736 -13.129 -20.167 1.00 1.00 H new ATOM 0 HB2 TYR A 96 -9.877 -14.694 -17.831 1.00 1.00 H new ATOM 0 HB3 TYR A 96 -8.663 -13.498 -17.421 1.00 1.00 H new ATOM 0 HD1 TYR A 96 -12.200 -14.000 -18.414 1.00 1.00 H new ATOM 0 HD2 TYR A 96 -9.210 -11.138 -17.269 1.00 1.00 H new ATOM 0 HE1 TYR A 96 -13.969 -12.297 -18.041 1.00 1.00 H new ATOM 0 HE2 TYR A 96 -10.972 -9.439 -16.899 1.00 1.00 H new ATOM 0 HH TYR A 96 -13.150 -8.974 -16.940 1.00 1.00 H new ATOM 1488 N ILE A 97 -7.685 -11.653 -19.639 1.00 1.00 N ATOM 1489 CA ILE A 97 -6.467 -10.850 -19.700 1.00 1.00 C ATOM 1490 C ILE A 97 -6.468 -9.810 -18.580 1.00 1.00 C ATOM 1491 O ILE A 97 -6.314 -8.619 -18.845 1.00 1.00 O ATOM 1492 CB ILE A 97 -6.390 -10.119 -21.039 1.00 1.00 C ATOM 1493 CG1 ILE A 97 -7.767 -9.521 -21.372 1.00 1.00 C ATOM 1494 CG2 ILE A 97 -5.961 -11.091 -22.133 1.00 1.00 C ATOM 1495 CD1 ILE A 97 -7.603 -8.366 -22.357 1.00 1.00 C ATOM 0 H ILE A 97 -8.544 -11.105 -19.590 1.00 1.00 H new ATOM 0 HA ILE A 97 -5.611 -11.515 -19.589 1.00 1.00 H new ATOM 0 HB ILE A 97 -5.656 -9.316 -20.976 1.00 1.00 H new ATOM 0 HG12 ILE A 97 -8.413 -10.288 -21.800 1.00 1.00 H new ATOM 0 HG13 ILE A 97 -8.251 -9.169 -20.461 1.00 1.00 H new ATOM 0 HG21 ILE A 97 -5.907 -10.565 -23.086 1.00 1.00 H new ATOM 0 HG22 ILE A 97 -4.981 -11.503 -21.890 1.00 1.00 H new ATOM 0 HG23 ILE A 97 -6.687 -11.901 -22.206 1.00 1.00 H new ATOM 0 HD11 ILE A 97 -8.581 -7.945 -22.590 1.00 1.00 H new ATOM 0 HD12 ILE A 97 -6.973 -7.595 -21.913 1.00 1.00 H new ATOM 0 HD13 ILE A 97 -7.138 -8.732 -23.272 1.00 1.00 H new ATOM 1507 N LEU A 98 -6.659 -10.263 -17.344 1.00 1.00 N ATOM 1508 CA LEU A 98 -6.696 -9.356 -16.190 1.00 1.00 C ATOM 1509 C LEU A 98 -7.821 -8.335 -16.375 1.00 1.00 C ATOM 1510 O LEU A 98 -8.833 -8.373 -15.675 1.00 1.00 O ATOM 1511 CB LEU A 98 -5.340 -8.626 -16.040 1.00 1.00 C ATOM 1512 CG LEU A 98 -4.348 -9.479 -15.241 1.00 1.00 C ATOM 1513 CD1 LEU A 98 -4.281 -10.895 -15.821 1.00 1.00 C ATOM 1514 CD2 LEU A 98 -2.962 -8.835 -15.326 1.00 1.00 C ATOM 0 H LEU A 98 -6.790 -11.247 -17.112 1.00 1.00 H new ATOM 0 HA LEU A 98 -6.882 -9.937 -15.287 1.00 1.00 H new ATOM 0 HB2 LEU A 98 -4.928 -8.408 -17.025 1.00 1.00 H new ATOM 0 HB3 LEU A 98 -5.490 -7.670 -15.539 1.00 1.00 H new ATOM 0 HG LEU A 98 -4.676 -9.536 -14.203 1.00 1.00 H new ATOM 0 HD11 LEU A 98 -3.573 -11.491 -15.245 1.00 1.00 H new ATOM 0 HD12 LEU A 98 -5.268 -11.355 -15.772 1.00 1.00 H new ATOM 0 HD13 LEU A 98 -3.954 -10.848 -16.860 1.00 1.00 H new ATOM 0 HD21 LEU A 98 -2.247 -9.433 -14.761 1.00 1.00 H new ATOM 0 HD22 LEU A 98 -2.648 -8.784 -16.369 1.00 1.00 H new ATOM 0 HD23 LEU A 98 -3.002 -7.829 -14.909 1.00 1.00 H new ATOM 1526 N GLY A 99 -7.621 -7.420 -17.310 1.00 1.00 N ATOM 1527 CA GLY A 99 -8.601 -6.374 -17.592 1.00 1.00 C ATOM 1528 C GLY A 99 -8.652 -5.371 -16.448 1.00 1.00 C ATOM 1529 O GLY A 99 -8.377 -4.186 -16.628 1.00 1.00 O ATOM 0 H GLY A 99 -6.784 -7.378 -17.892 1.00 1.00 H new ATOM 0 HA2 GLY A 99 -8.341 -5.864 -18.520 1.00 1.00 H new ATOM 0 HA3 GLY A 99 -9.585 -6.819 -17.738 1.00 1.00 H new ATOM 1533 N SER A 100 -9.001 -5.865 -15.270 1.00 1.00 N ATOM 1534 CA SER A 100 -9.079 -5.026 -14.083 1.00 1.00 C ATOM 1535 C SER A 100 -8.958 -5.898 -12.836 1.00 1.00 C ATOM 1536 O SER A 100 -9.594 -5.645 -11.815 1.00 1.00 O ATOM 1537 CB SER A 100 -10.395 -4.246 -14.073 1.00 1.00 C ATOM 1538 OG SER A 100 -11.487 -5.151 -14.128 1.00 1.00 O ATOM 0 H SER A 100 -9.235 -6.845 -15.110 1.00 1.00 H new ATOM 0 HA SER A 100 -8.259 -4.307 -14.092 1.00 1.00 H new ATOM 0 HB2 SER A 100 -10.461 -3.636 -13.172 1.00 1.00 H new ATOM 0 HB3 SER A 100 -10.432 -3.564 -14.923 1.00 1.00 H new ATOM 0 HG SER A 100 -12.329 -4.649 -14.120 1.00 1.00 H new ATOM 1544 N ASP A 101 -8.117 -6.927 -12.946 1.00 1.00 N ATOM 1545 CA ASP A 101 -7.872 -7.858 -11.847 1.00 1.00 C ATOM 1546 C ASP A 101 -6.429 -8.338 -11.888 1.00 1.00 C ATOM 1547 O ASP A 101 -6.147 -9.423 -12.396 1.00 1.00 O ATOM 1548 CB ASP A 101 -8.789 -9.075 -11.965 1.00 1.00 C ATOM 1549 CG ASP A 101 -10.227 -8.695 -11.620 1.00 1.00 C ATOM 1550 OD1 ASP A 101 -10.412 -7.684 -10.962 1.00 1.00 O ATOM 1551 OD2 ASP A 101 -11.121 -9.430 -12.008 1.00 1.00 O ATOM 0 H ASP A 101 -7.590 -7.137 -13.794 1.00 1.00 H new ATOM 0 HA ASP A 101 -8.070 -7.338 -10.909 1.00 1.00 H new ATOM 0 HB2 ASP A 101 -8.745 -9.474 -12.978 1.00 1.00 H new ATOM 0 HB3 ASP A 101 -8.444 -9.864 -11.296 1.00 1.00 H new ATOM 1556 N VAL A 102 -5.516 -7.536 -11.352 1.00 1.00 N ATOM 1557 CA VAL A 102 -4.102 -7.907 -11.340 1.00 1.00 C ATOM 1558 C VAL A 102 -3.807 -8.773 -10.126 1.00 1.00 C ATOM 1559 O VAL A 102 -4.485 -8.674 -9.114 1.00 1.00 O ATOM 1560 CB VAL A 102 -3.213 -6.639 -11.329 1.00 1.00 C ATOM 1561 CG1 VAL A 102 -2.916 -6.192 -9.887 1.00 1.00 C ATOM 1562 CG2 VAL A 102 -1.882 -6.925 -12.041 1.00 1.00 C ATOM 0 H VAL A 102 -5.724 -6.634 -10.924 1.00 1.00 H new ATOM 0 HA VAL A 102 -3.877 -8.476 -12.242 1.00 1.00 H new ATOM 0 HB VAL A 102 -3.752 -5.846 -11.847 1.00 1.00 H new ATOM 0 HG11 VAL A 102 -2.290 -5.300 -9.904 1.00 1.00 H new ATOM 0 HG12 VAL A 102 -3.852 -5.969 -9.375 1.00 1.00 H new ATOM 0 HG13 VAL A 102 -2.395 -6.990 -9.359 1.00 1.00 H new ATOM 0 HG21 VAL A 102 -1.263 -6.028 -12.029 1.00 1.00 H new ATOM 0 HG22 VAL A 102 -1.361 -7.733 -11.527 1.00 1.00 H new ATOM 0 HG23 VAL A 102 -2.077 -7.217 -13.073 1.00 1.00 H new ATOM 1572 N THR A 103 -2.772 -9.592 -10.226 1.00 1.00 N ATOM 1573 CA THR A 103 -2.378 -10.458 -9.105 1.00 1.00 C ATOM 1574 C THR A 103 -0.952 -10.149 -8.649 1.00 1.00 C ATOM 1575 O THR A 103 0.016 -10.375 -9.377 1.00 1.00 O ATOM 1576 CB THR A 103 -2.494 -11.939 -9.518 1.00 1.00 C ATOM 1577 OG1 THR A 103 -3.438 -12.053 -10.573 1.00 1.00 O ATOM 1578 CG2 THR A 103 -2.975 -12.775 -8.326 1.00 1.00 C ATOM 0 H THR A 103 -2.190 -9.682 -11.059 1.00 1.00 H new ATOM 0 HA THR A 103 -3.051 -10.265 -8.270 1.00 1.00 H new ATOM 0 HB THR A 103 -1.519 -12.301 -9.845 1.00 1.00 H new ATOM 0 HG1 THR A 103 -3.516 -12.992 -10.842 1.00 1.00 H new ATOM 0 HG21 THR A 103 -3.055 -13.821 -8.624 1.00 1.00 H new ATOM 0 HG22 THR A 103 -2.262 -12.685 -7.507 1.00 1.00 H new ATOM 0 HG23 THR A 103 -3.951 -12.415 -7.999 1.00 1.00 H new ATOM 1586 N VAL A 104 -0.841 -9.648 -7.423 1.00 1.00 N ATOM 1587 CA VAL A 104 0.449 -9.317 -6.829 1.00 1.00 C ATOM 1588 C VAL A 104 0.489 -9.841 -5.394 1.00 1.00 C ATOM 1589 O VAL A 104 -0.504 -9.757 -4.671 1.00 1.00 O ATOM 1590 CB VAL A 104 0.658 -7.796 -6.856 1.00 1.00 C ATOM 1591 CG1 VAL A 104 -0.212 -7.122 -5.791 1.00 1.00 C ATOM 1592 CG2 VAL A 104 2.131 -7.476 -6.591 1.00 1.00 C ATOM 0 H VAL A 104 -1.639 -9.461 -6.816 1.00 1.00 H new ATOM 0 HA VAL A 104 1.251 -9.784 -7.400 1.00 1.00 H new ATOM 0 HB VAL A 104 0.372 -7.418 -7.837 1.00 1.00 H new ATOM 0 HG11 VAL A 104 -0.054 -6.044 -5.821 1.00 1.00 H new ATOM 0 HG12 VAL A 104 -1.262 -7.341 -5.987 1.00 1.00 H new ATOM 0 HG13 VAL A 104 0.060 -7.501 -4.806 1.00 1.00 H new ATOM 0 HG21 VAL A 104 2.278 -6.396 -6.610 1.00 1.00 H new ATOM 0 HG22 VAL A 104 2.417 -7.864 -5.613 1.00 1.00 H new ATOM 0 HG23 VAL A 104 2.748 -7.940 -7.360 1.00 1.00 H new ATOM 1602 N GLN A 105 1.630 -10.393 -4.990 1.00 1.00 N ATOM 1603 CA GLN A 105 1.787 -10.942 -3.641 1.00 1.00 C ATOM 1604 C GLN A 105 2.994 -10.314 -2.953 1.00 1.00 C ATOM 1605 O GLN A 105 4.128 -10.517 -3.385 1.00 1.00 O ATOM 1606 CB GLN A 105 1.972 -12.465 -3.741 1.00 1.00 C ATOM 1607 CG GLN A 105 1.630 -13.127 -2.403 1.00 1.00 C ATOM 1608 CD GLN A 105 2.671 -12.760 -1.355 1.00 1.00 C ATOM 1609 OE1 GLN A 105 3.837 -13.133 -1.474 1.00 1.00 O ATOM 1610 NE2 GLN A 105 2.312 -12.034 -0.337 1.00 1.00 N ATOM 0 H GLN A 105 2.461 -10.473 -5.576 1.00 1.00 H new ATOM 0 HA GLN A 105 0.899 -10.717 -3.051 1.00 1.00 H new ATOM 0 HB2 GLN A 105 1.333 -12.866 -4.528 1.00 1.00 H new ATOM 0 HB3 GLN A 105 3.001 -12.697 -4.018 1.00 1.00 H new ATOM 0 HG2 GLN A 105 0.642 -12.807 -2.072 1.00 1.00 H new ATOM 0 HG3 GLN A 105 1.591 -14.210 -2.524 1.00 1.00 H new ATOM 0 HE21 GLN A 105 1.343 -11.728 -0.245 1.00 1.00 H new ATOM 0 HE22 GLN A 105 2.999 -11.770 0.369 1.00 1.00 H new ATOM 1619 N LEU A 106 2.757 -9.535 -1.893 1.00 1.00 N ATOM 1620 CA LEU A 106 3.843 -8.874 -1.180 1.00 1.00 C ATOM 1621 C LEU A 106 4.546 -9.844 -0.239 1.00 1.00 C ATOM 1622 O LEU A 106 3.909 -10.501 0.566 1.00 1.00 O ATOM 1623 CB LEU A 106 3.260 -7.725 -0.352 1.00 1.00 C ATOM 1624 CG LEU A 106 2.394 -6.827 -1.240 1.00 1.00 C ATOM 1625 CD1 LEU A 106 1.720 -5.763 -0.371 1.00 1.00 C ATOM 1626 CD2 LEU A 106 3.268 -6.146 -2.304 1.00 1.00 C ATOM 0 H LEU A 106 1.828 -9.350 -1.515 1.00 1.00 H new ATOM 0 HA LEU A 106 4.565 -8.504 -1.908 1.00 1.00 H new ATOM 0 HB2 LEU A 106 2.663 -8.123 0.469 1.00 1.00 H new ATOM 0 HB3 LEU A 106 4.066 -7.142 0.094 1.00 1.00 H new ATOM 0 HG LEU A 106 1.635 -7.431 -1.738 1.00 1.00 H new ATOM 0 HD11 LEU A 106 1.102 -5.120 -0.997 1.00 1.00 H new ATOM 0 HD12 LEU A 106 1.095 -6.248 0.379 1.00 1.00 H new ATOM 0 HD13 LEU A 106 2.482 -5.162 0.125 1.00 1.00 H new ATOM 0 HD21 LEU A 106 2.646 -5.509 -2.932 1.00 1.00 H new ATOM 0 HD22 LEU A 106 4.031 -5.540 -1.815 1.00 1.00 H new ATOM 0 HD23 LEU A 106 3.748 -6.906 -2.921 1.00 1.00 H new ATOM 1638 N ASN A 107 5.863 -9.935 -0.372 1.00 1.00 N ATOM 1639 CA ASN A 107 6.653 -10.853 0.462 1.00 1.00 C ATOM 1640 C ASN A 107 7.570 -10.118 1.433 1.00 1.00 C ATOM 1641 O ASN A 107 8.786 -10.118 1.256 1.00 1.00 O ATOM 1642 CB ASN A 107 7.496 -11.753 -0.431 1.00 1.00 C ATOM 1643 CG ASN A 107 6.656 -12.240 -1.599 1.00 1.00 C ATOM 1644 OD1 ASN A 107 6.215 -11.376 -2.467 1.00 1.00 O flip ATOM 1645 ND2 ASN A 107 6.391 -13.436 -1.721 1.00 1.00 N flip ATOM 0 H ASN A 107 6.410 -9.393 -1.041 1.00 1.00 H new ATOM 0 HA ASN A 107 5.949 -11.440 1.051 1.00 1.00 H new ATOM 0 HB2 ASN A 107 8.366 -11.208 -0.797 1.00 1.00 H new ATOM 0 HB3 ASN A 107 7.870 -12.602 0.141 1.00 1.00 H new ATOM 0 HD21 ASN A 107 6.740 -14.108 -1.037 1.00 1.00 H new ATOM 0 HD22 ASN A 107 5.823 -13.755 -2.506 1.00 1.00 H new ATOM 1652 N THR A 108 6.999 -9.500 2.463 1.00 1.00 N ATOM 1653 CA THR A 108 7.820 -8.792 3.429 1.00 1.00 C ATOM 1654 C THR A 108 8.567 -9.792 4.311 1.00 1.00 C ATOM 1655 O THR A 108 8.369 -11.003 4.212 1.00 1.00 O ATOM 1656 CB THR A 108 6.941 -7.876 4.306 1.00 1.00 C ATOM 1657 OG1 THR A 108 5.747 -7.570 3.602 1.00 1.00 O ATOM 1658 CG2 THR A 108 7.670 -6.565 4.640 1.00 1.00 C ATOM 0 H THR A 108 5.996 -9.476 2.645 1.00 1.00 H new ATOM 0 HA THR A 108 8.543 -8.179 2.892 1.00 1.00 H new ATOM 0 HB THR A 108 6.718 -8.398 5.237 1.00 1.00 H new ATOM 0 HG1 THR A 108 5.338 -6.766 3.985 1.00 1.00 H new ATOM 0 HG21 THR A 108 7.027 -5.939 5.259 1.00 1.00 H new ATOM 0 HG22 THR A 108 8.590 -6.788 5.181 1.00 1.00 H new ATOM 0 HG23 THR A 108 7.911 -6.037 3.717 1.00 1.00 H new ATOM 1666 N ALA A 109 9.435 -9.259 5.147 1.00 1.00 N ATOM 1667 CA ALA A 109 10.240 -10.081 6.039 1.00 1.00 C ATOM 1668 C ALA A 109 9.390 -11.144 6.736 1.00 1.00 C ATOM 1669 O ALA A 109 9.838 -12.275 6.923 1.00 1.00 O ATOM 1670 CB ALA A 109 10.908 -9.197 7.090 1.00 1.00 C ATOM 0 H ALA A 109 9.604 -8.257 5.230 1.00 1.00 H new ATOM 0 HA ALA A 109 10.997 -10.587 5.440 1.00 1.00 H new ATOM 0 HB1 ALA A 109 11.510 -9.815 7.756 1.00 1.00 H new ATOM 0 HB2 ALA A 109 11.548 -8.466 6.597 1.00 1.00 H new ATOM 0 HB3 ALA A 109 10.143 -8.678 7.668 1.00 1.00 H new ATOM 1676 N GLU A 110 8.167 -10.781 7.128 1.00 1.00 N ATOM 1677 CA GLU A 110 7.270 -11.725 7.803 1.00 1.00 C ATOM 1678 C GLU A 110 5.859 -11.646 7.233 1.00 1.00 C ATOM 1679 O GLU A 110 5.126 -12.635 7.227 1.00 1.00 O ATOM 1680 CB GLU A 110 7.234 -11.408 9.296 1.00 1.00 C ATOM 1681 CG GLU A 110 6.618 -10.024 9.501 1.00 1.00 C ATOM 1682 CD GLU A 110 6.786 -9.586 10.949 1.00 1.00 C ATOM 1683 OE1 GLU A 110 6.771 -10.447 11.813 1.00 1.00 O ATOM 1684 OE2 GLU A 110 6.925 -8.395 11.173 1.00 1.00 O ATOM 0 H GLU A 110 7.776 -9.849 6.992 1.00 1.00 H new ATOM 0 HA GLU A 110 7.648 -12.735 7.642 1.00 1.00 H new ATOM 0 HB2 GLU A 110 6.651 -12.161 9.826 1.00 1.00 H new ATOM 0 HB3 GLU A 110 8.242 -11.436 9.710 1.00 1.00 H new ATOM 0 HG2 GLU A 110 7.095 -9.303 8.837 1.00 1.00 H new ATOM 0 HG3 GLU A 110 5.560 -10.046 9.240 1.00 1.00 H new ATOM 1691 N LEU A 111 5.483 -10.462 6.755 1.00 1.00 N ATOM 1692 CA LEU A 111 4.156 -10.275 6.189 1.00 1.00 C ATOM 1693 C LEU A 111 4.096 -10.918 4.808 1.00 1.00 C ATOM 1694 O LEU A 111 5.079 -10.914 4.067 1.00 1.00 O ATOM 1695 CB LEU A 111 3.808 -8.778 6.100 1.00 1.00 C ATOM 1696 CG LEU A 111 3.958 -8.118 7.480 1.00 1.00 C ATOM 1697 CD1 LEU A 111 3.738 -6.608 7.345 1.00 1.00 C ATOM 1698 CD2 LEU A 111 2.924 -8.700 8.460 1.00 1.00 C ATOM 0 H LEU A 111 6.072 -9.629 6.749 1.00 1.00 H new ATOM 0 HA LEU A 111 3.424 -10.753 6.840 1.00 1.00 H new ATOM 0 HB2 LEU A 111 4.463 -8.287 5.380 1.00 1.00 H new ATOM 0 HB3 LEU A 111 2.787 -8.655 5.738 1.00 1.00 H new ATOM 0 HG LEU A 111 4.960 -8.313 7.863 1.00 1.00 H new ATOM 0 HD11 LEU A 111 3.844 -6.136 8.322 1.00 1.00 H new ATOM 0 HD12 LEU A 111 4.477 -6.193 6.660 1.00 1.00 H new ATOM 0 HD13 LEU A 111 2.737 -6.419 6.957 1.00 1.00 H new ATOM 0 HD21 LEU A 111 3.039 -8.226 9.435 1.00 1.00 H new ATOM 0 HD22 LEU A 111 1.919 -8.513 8.082 1.00 1.00 H new ATOM 0 HD23 LEU A 111 3.081 -9.774 8.559 1.00 1.00 H new ATOM 1710 N LYS A 112 2.936 -11.462 4.470 1.00 1.00 N ATOM 1711 CA LYS A 112 2.744 -12.103 3.176 1.00 1.00 C ATOM 1712 C LYS A 112 1.264 -12.146 2.863 1.00 1.00 C ATOM 1713 O LYS A 112 0.533 -12.990 3.380 1.00 1.00 O ATOM 1714 CB LYS A 112 3.322 -13.517 3.169 1.00 1.00 C ATOM 1715 CG LYS A 112 3.245 -14.075 1.748 1.00 1.00 C ATOM 1716 CD LYS A 112 3.887 -15.459 1.709 1.00 1.00 C ATOM 1717 CE LYS A 112 3.825 -16.012 0.285 1.00 1.00 C ATOM 1718 NZ LYS A 112 4.459 -17.359 0.255 1.00 1.00 N ATOM 0 H LYS A 112 2.113 -11.473 5.073 1.00 1.00 H new ATOM 0 HA LYS A 112 3.270 -11.525 2.416 1.00 1.00 H new ATOM 0 HB2 LYS A 112 4.356 -13.503 3.513 1.00 1.00 H new ATOM 0 HB3 LYS A 112 2.766 -14.155 3.856 1.00 1.00 H new ATOM 0 HG2 LYS A 112 2.206 -14.135 1.426 1.00 1.00 H new ATOM 0 HG3 LYS A 112 3.755 -13.406 1.055 1.00 1.00 H new ATOM 0 HD2 LYS A 112 4.923 -15.400 2.042 1.00 1.00 H new ATOM 0 HD3 LYS A 112 3.369 -16.131 2.394 1.00 1.00 H new ATOM 0 HE2 LYS A 112 2.789 -16.077 -0.048 1.00 1.00 H new ATOM 0 HE3 LYS A 112 4.339 -15.340 -0.402 1.00 1.00 H new ATOM 0 HZ1 LYS A 112 4.419 -17.740 -0.712 1.00 1.00 H new ATOM 0 HZ2 LYS A 112 5.451 -17.282 0.557 1.00 1.00 H new ATOM 0 HZ3 LYS A 112 3.950 -17.997 0.899 1.00 1.00 H new ATOM 1732 N LEU A 113 0.824 -11.216 2.021 1.00 1.00 N ATOM 1733 CA LEU A 113 -0.593 -11.114 1.656 1.00 1.00 C ATOM 1734 C LEU A 113 -0.775 -11.085 0.138 1.00 1.00 C ATOM 1735 O LEU A 113 0.184 -10.930 -0.617 1.00 1.00 O ATOM 1736 CB LEU A 113 -1.178 -9.827 2.280 1.00 1.00 C ATOM 1737 CG LEU A 113 -1.673 -10.062 3.730 1.00 1.00 C ATOM 1738 CD1 LEU A 113 -2.765 -11.156 3.771 1.00 1.00 C ATOM 1739 CD2 LEU A 113 -0.492 -10.435 4.656 1.00 1.00 C ATOM 0 H LEU A 113 1.424 -10.521 1.577 1.00 1.00 H new ATOM 0 HA LEU A 113 -1.118 -11.990 2.037 1.00 1.00 H new ATOM 0 HB2 LEU A 113 -0.419 -9.045 2.278 1.00 1.00 H new ATOM 0 HB3 LEU A 113 -2.006 -9.470 1.667 1.00 1.00 H new ATOM 0 HG LEU A 113 -2.112 -9.132 4.092 1.00 1.00 H new ATOM 0 HD11 LEU A 113 -3.095 -11.302 4.799 1.00 1.00 H new ATOM 0 HD12 LEU A 113 -3.612 -10.848 3.158 1.00 1.00 H new ATOM 0 HD13 LEU A 113 -2.358 -12.091 3.385 1.00 1.00 H new ATOM 0 HD21 LEU A 113 -0.861 -10.596 5.669 1.00 1.00 H new ATOM 0 HD22 LEU A 113 -0.019 -11.347 4.293 1.00 1.00 H new ATOM 0 HD23 LEU A 113 0.237 -9.625 4.660 1.00 1.00 H new ATOM 1751 N VAL A 114 -2.033 -11.224 -0.297 1.00 1.00 N ATOM 1752 CA VAL A 114 -2.371 -11.203 -1.723 1.00 1.00 C ATOM 1753 C VAL A 114 -3.377 -10.087 -2.002 1.00 1.00 C ATOM 1754 O VAL A 114 -4.445 -10.037 -1.394 1.00 1.00 O ATOM 1755 CB VAL A 114 -2.994 -12.548 -2.128 1.00 1.00 C ATOM 1756 CG1 VAL A 114 -3.534 -12.458 -3.561 1.00 1.00 C ATOM 1757 CG2 VAL A 114 -1.941 -13.660 -2.045 1.00 1.00 C ATOM 0 H VAL A 114 -2.835 -11.352 0.321 1.00 1.00 H new ATOM 0 HA VAL A 114 -1.462 -11.029 -2.298 1.00 1.00 H new ATOM 0 HB VAL A 114 -3.812 -12.779 -1.446 1.00 1.00 H new ATOM 0 HG11 VAL A 114 -3.975 -13.414 -3.844 1.00 1.00 H new ATOM 0 HG12 VAL A 114 -4.293 -11.678 -3.615 1.00 1.00 H new ATOM 0 HG13 VAL A 114 -2.718 -12.218 -4.243 1.00 1.00 H new ATOM 0 HG21 VAL A 114 -2.391 -14.610 -2.334 1.00 1.00 H new ATOM 0 HG22 VAL A 114 -1.115 -13.430 -2.718 1.00 1.00 H new ATOM 0 HG23 VAL A 114 -1.567 -13.731 -1.024 1.00 1.00 H new ATOM 1767 N PHE A 115 -3.030 -9.193 -2.927 1.00 1.00 N ATOM 1768 CA PHE A 115 -3.902 -8.070 -3.283 1.00 1.00 C ATOM 1769 C PHE A 115 -4.291 -8.105 -4.761 1.00 1.00 C ATOM 1770 O PHE A 115 -3.451 -8.308 -5.639 1.00 1.00 O ATOM 1771 CB PHE A 115 -3.200 -6.738 -2.988 1.00 1.00 C ATOM 1772 CG PHE A 115 -3.102 -6.512 -1.499 1.00 1.00 C ATOM 1773 CD1 PHE A 115 -1.999 -6.990 -0.786 1.00 1.00 C ATOM 1774 CD2 PHE A 115 -4.115 -5.813 -0.832 1.00 1.00 C ATOM 1775 CE1 PHE A 115 -1.909 -6.772 0.595 1.00 1.00 C ATOM 1776 CE2 PHE A 115 -4.025 -5.595 0.546 1.00 1.00 C ATOM 1777 CZ PHE A 115 -2.923 -6.074 1.261 1.00 1.00 C ATOM 0 H PHE A 115 -2.152 -9.223 -3.445 1.00 1.00 H new ATOM 0 HA PHE A 115 -4.806 -8.160 -2.681 1.00 1.00 H new ATOM 0 HB2 PHE A 115 -2.203 -6.740 -3.428 1.00 1.00 H new ATOM 0 HB3 PHE A 115 -3.751 -5.919 -3.451 1.00 1.00 H new ATOM 0 HD1 PHE A 115 -1.216 -7.528 -1.300 1.00 1.00 H new ATOM 0 HD2 PHE A 115 -4.967 -5.442 -1.382 1.00 1.00 H new ATOM 0 HE1 PHE A 115 -1.057 -7.143 1.146 1.00 1.00 H new ATOM 0 HE2 PHE A 115 -4.808 -5.056 1.059 1.00 1.00 H new ATOM 0 HZ PHE A 115 -2.854 -5.906 2.326 1.00 1.00 H new ATOM 1787 N GLN A 116 -5.580 -7.880 -5.015 1.00 1.00 N ATOM 1788 CA GLN A 116 -6.120 -7.852 -6.376 1.00 1.00 C ATOM 1789 C GLN A 116 -6.439 -6.411 -6.775 1.00 1.00 C ATOM 1790 O GLN A 116 -7.527 -5.905 -6.495 1.00 1.00 O ATOM 1791 CB GLN A 116 -7.397 -8.700 -6.453 1.00 1.00 C ATOM 1792 CG GLN A 116 -7.038 -10.192 -6.497 1.00 1.00 C ATOM 1793 CD GLN A 116 -6.665 -10.608 -7.918 1.00 1.00 C ATOM 1794 OE1 GLN A 116 -6.571 -9.701 -8.851 1.00 1.00 O flip ATOM 1795 NE2 GLN A 116 -6.445 -11.789 -8.182 1.00 1.00 N flip ATOM 0 H GLN A 116 -6.276 -7.713 -4.289 1.00 1.00 H new ATOM 0 HA GLN A 116 -5.377 -8.262 -7.060 1.00 1.00 H new ATOM 0 HB2 GLN A 116 -8.031 -8.496 -5.590 1.00 1.00 H new ATOM 0 HB3 GLN A 116 -7.970 -8.429 -7.340 1.00 1.00 H new ATOM 0 HG2 GLN A 116 -6.206 -10.392 -5.822 1.00 1.00 H new ATOM 0 HG3 GLN A 116 -7.882 -10.786 -6.147 1.00 1.00 H new ATOM 0 HE21 GLN A 116 -6.519 -12.497 -7.452 1.00 1.00 H new ATOM 0 HE22 GLN A 116 -6.189 -12.060 -9.131 1.00 1.00 H new ATOM 1804 N LEU A 117 -5.477 -5.748 -7.420 1.00 1.00 N ATOM 1805 CA LEU A 117 -5.647 -4.355 -7.849 1.00 1.00 C ATOM 1806 C LEU A 117 -6.027 -4.298 -9.341 1.00 1.00 C ATOM 1807 O LEU A 117 -5.681 -5.198 -10.103 1.00 1.00 O ATOM 1808 CB LEU A 117 -4.324 -3.599 -7.611 1.00 1.00 C ATOM 1809 CG LEU A 117 -3.655 -4.116 -6.330 1.00 1.00 C ATOM 1810 CD1 LEU A 117 -2.408 -3.272 -6.034 1.00 1.00 C ATOM 1811 CD2 LEU A 117 -4.639 -4.024 -5.150 1.00 1.00 C ATOM 0 H LEU A 117 -4.571 -6.152 -7.658 1.00 1.00 H new ATOM 0 HA LEU A 117 -6.448 -3.890 -7.274 1.00 1.00 H new ATOM 0 HB2 LEU A 117 -3.657 -3.737 -8.462 1.00 1.00 H new ATOM 0 HB3 LEU A 117 -4.516 -2.529 -7.526 1.00 1.00 H new ATOM 0 HG LEU A 117 -3.366 -5.158 -6.468 1.00 1.00 H new ATOM 0 HD11 LEU A 117 -1.930 -3.636 -5.125 1.00 1.00 H new ATOM 0 HD12 LEU A 117 -1.710 -3.350 -6.867 1.00 1.00 H new ATOM 0 HD13 LEU A 117 -2.698 -2.230 -5.899 1.00 1.00 H new ATOM 0 HD21 LEU A 117 -4.157 -4.393 -4.245 1.00 1.00 H new ATOM 0 HD22 LEU A 117 -4.937 -2.986 -5.005 1.00 1.00 H new ATOM 0 HD23 LEU A 117 -5.521 -4.628 -5.363 1.00 1.00 H new ATOM 1823 N PRO A 118 -6.734 -3.278 -9.780 1.00 1.00 N ATOM 1824 CA PRO A 118 -7.147 -3.156 -11.215 1.00 1.00 C ATOM 1825 C PRO A 118 -5.952 -2.929 -12.146 1.00 1.00 C ATOM 1826 O PRO A 118 -5.074 -2.119 -11.867 1.00 1.00 O ATOM 1827 CB PRO A 118 -8.104 -1.953 -11.215 1.00 1.00 C ATOM 1828 CG PRO A 118 -7.686 -1.138 -10.035 1.00 1.00 C ATOM 1829 CD PRO A 118 -7.216 -2.138 -8.980 1.00 1.00 C ATOM 0 HA PRO A 118 -7.612 -4.067 -11.591 1.00 1.00 H new ATOM 0 HB2 PRO A 118 -8.023 -1.382 -12.140 1.00 1.00 H new ATOM 0 HB3 PRO A 118 -9.142 -2.273 -11.128 1.00 1.00 H new ATOM 0 HG2 PRO A 118 -6.886 -0.447 -10.301 1.00 1.00 H new ATOM 0 HG3 PRO A 118 -8.515 -0.537 -9.662 1.00 1.00 H new ATOM 0 HD2 PRO A 118 -6.425 -1.722 -8.356 1.00 1.00 H new ATOM 0 HD3 PRO A 118 -8.027 -2.430 -8.313 1.00 1.00 H new ATOM 1837 N PHE A 119 -5.923 -3.681 -13.235 1.00 1.00 N ATOM 1838 CA PHE A 119 -4.840 -3.629 -14.215 1.00 1.00 C ATOM 1839 C PHE A 119 -4.451 -2.219 -14.628 1.00 1.00 C ATOM 1840 O PHE A 119 -5.295 -1.338 -14.791 1.00 1.00 O ATOM 1841 CB PHE A 119 -5.282 -4.392 -15.463 1.00 1.00 C ATOM 1842 CG PHE A 119 -4.208 -4.316 -16.528 1.00 1.00 C ATOM 1843 CD1 PHE A 119 -2.972 -4.927 -16.309 1.00 1.00 C ATOM 1844 CD2 PHE A 119 -4.452 -3.634 -17.728 1.00 1.00 C ATOM 1845 CE1 PHE A 119 -1.974 -4.858 -17.287 1.00 1.00 C ATOM 1846 CE2 PHE A 119 -3.454 -3.566 -18.708 1.00 1.00 C ATOM 1847 CZ PHE A 119 -2.214 -4.179 -18.486 1.00 1.00 C ATOM 0 H PHE A 119 -6.655 -4.352 -13.469 1.00 1.00 H new ATOM 0 HA PHE A 119 -3.964 -4.073 -13.742 1.00 1.00 H new ATOM 0 HB2 PHE A 119 -5.481 -5.433 -15.210 1.00 1.00 H new ATOM 0 HB3 PHE A 119 -6.213 -3.973 -15.844 1.00 1.00 H new ATOM 0 HD1 PHE A 119 -2.786 -5.453 -15.384 1.00 1.00 H new ATOM 0 HD2 PHE A 119 -5.408 -3.162 -17.897 1.00 1.00 H new ATOM 0 HE1 PHE A 119 -1.017 -5.329 -17.116 1.00 1.00 H new ATOM 0 HE2 PHE A 119 -3.640 -3.042 -19.634 1.00 1.00 H new ATOM 0 HZ PHE A 119 -1.443 -4.127 -19.241 1.00 1.00 H new ATOM 1857 N GLY A 120 -3.143 -2.044 -14.816 1.00 1.00 N ATOM 1858 CA GLY A 120 -2.578 -0.769 -15.238 1.00 1.00 C ATOM 1859 C GLY A 120 -3.364 0.406 -14.671 1.00 1.00 C ATOM 1860 O GLY A 120 -3.823 0.362 -13.532 1.00 1.00 O ATOM 0 H GLY A 120 -2.451 -2.781 -14.680 1.00 1.00 H new ATOM 0 HA2 GLY A 120 -1.540 -0.704 -14.912 1.00 1.00 H new ATOM 0 HA3 GLY A 120 -2.574 -0.714 -16.327 1.00 1.00 H new ATOM 1864 N SER A 121 -3.526 1.446 -15.476 1.00 1.00 N ATOM 1865 CA SER A 121 -4.270 2.617 -15.042 1.00 1.00 C ATOM 1866 C SER A 121 -3.637 3.225 -13.791 1.00 1.00 C ATOM 1867 O SER A 121 -2.478 3.641 -13.812 1.00 1.00 O ATOM 1868 CB SER A 121 -5.723 2.221 -14.757 1.00 1.00 C ATOM 1869 OG SER A 121 -6.508 3.393 -14.597 1.00 1.00 O ATOM 0 H SER A 121 -3.156 1.502 -16.425 1.00 1.00 H new ATOM 0 HA SER A 121 -4.245 3.365 -15.835 1.00 1.00 H new ATOM 0 HB2 SER A 121 -6.114 1.617 -15.576 1.00 1.00 H new ATOM 0 HB3 SER A 121 -5.775 1.609 -13.856 1.00 1.00 H new ATOM 0 HG SER A 121 -7.438 3.142 -14.416 1.00 1.00 H new ATOM 1875 N HIS A 122 -4.401 3.277 -12.709 1.00 1.00 N ATOM 1876 CA HIS A 122 -3.911 3.841 -11.458 1.00 1.00 C ATOM 1877 C HIS A 122 -2.993 2.853 -10.738 1.00 1.00 C ATOM 1878 O HIS A 122 -2.357 3.204 -9.744 1.00 1.00 O ATOM 1879 CB HIS A 122 -5.093 4.205 -10.554 1.00 1.00 C ATOM 1880 CG HIS A 122 -4.638 5.138 -9.463 1.00 1.00 C ATOM 1881 ND1 HIS A 122 -4.271 6.452 -9.716 1.00 1.00 N ATOM 1882 CD2 HIS A 122 -4.497 4.963 -8.111 1.00 1.00 C ATOM 1883 CE1 HIS A 122 -3.930 7.011 -8.540 1.00 1.00 C ATOM 1884 NE2 HIS A 122 -4.050 6.146 -7.528 1.00 1.00 N ATOM 0 H HIS A 122 -5.362 2.936 -12.672 1.00 1.00 H new ATOM 0 HA HIS A 122 -3.338 4.740 -11.687 1.00 1.00 H new ATOM 0 HB2 HIS A 122 -5.880 4.677 -11.143 1.00 1.00 H new ATOM 0 HB3 HIS A 122 -5.519 3.302 -10.117 1.00 1.00 H new ATOM 0 HD2 HIS A 122 -4.702 4.046 -7.578 1.00 1.00 H new ATOM 0 HE1 HIS A 122 -3.600 8.033 -8.428 1.00 1.00 H new ATOM 0 HE2 HIS A 122 -3.856 6.316 -6.541 1.00 1.00 H new ATOM 1892 N THR A 123 -2.924 1.617 -11.236 1.00 1.00 N ATOM 1893 CA THR A 123 -2.077 0.599 -10.613 1.00 1.00 C ATOM 1894 C THR A 123 -0.643 0.666 -11.130 1.00 1.00 C ATOM 1895 O THR A 123 0.293 0.402 -10.382 1.00 1.00 O ATOM 1896 CB THR A 123 -2.635 -0.801 -10.885 1.00 1.00 C ATOM 1897 OG1 THR A 123 -3.904 -0.931 -10.267 1.00 1.00 O ATOM 1898 CG2 THR A 123 -1.680 -1.858 -10.320 1.00 1.00 C ATOM 0 H THR A 123 -3.437 1.300 -12.058 1.00 1.00 H new ATOM 0 HA THR A 123 -2.073 0.798 -9.541 1.00 1.00 H new ATOM 0 HB THR A 123 -2.736 -0.946 -11.961 1.00 1.00 H new ATOM 0 HG1 THR A 123 -4.438 -1.593 -10.753 1.00 1.00 H new ATOM 0 HG21 THR A 123 -2.081 -2.852 -10.516 1.00 1.00 H new ATOM 0 HG22 THR A 123 -0.705 -1.760 -10.797 1.00 1.00 H new ATOM 0 HG23 THR A 123 -1.574 -1.715 -9.245 1.00 1.00 H new ATOM 1906 N ARG A 124 -0.473 0.999 -12.407 1.00 1.00 N ATOM 1907 CA ARG A 124 0.861 1.058 -13.002 1.00 1.00 C ATOM 1908 C ARG A 124 1.754 2.041 -12.262 1.00 1.00 C ATOM 1909 O ARG A 124 2.928 1.764 -12.015 1.00 1.00 O ATOM 1910 CB ARG A 124 0.752 1.501 -14.464 1.00 1.00 C ATOM 1911 CG ARG A 124 2.129 1.461 -15.131 1.00 1.00 C ATOM 1912 CD ARG A 124 2.001 1.985 -16.555 1.00 1.00 C ATOM 1913 NE ARG A 124 3.266 1.823 -17.266 1.00 1.00 N ATOM 1914 CZ ARG A 124 3.553 0.700 -17.919 1.00 1.00 C ATOM 1915 NH1 ARG A 124 2.703 -0.291 -17.924 1.00 1.00 N ATOM 1916 NH2 ARG A 124 4.691 0.585 -18.548 1.00 1.00 N ATOM 0 H ARG A 124 -1.234 1.230 -13.045 1.00 1.00 H new ATOM 0 HA ARG A 124 1.301 0.063 -12.934 1.00 1.00 H new ATOM 0 HB2 ARG A 124 0.061 0.849 -14.999 1.00 1.00 H new ATOM 0 HB3 ARG A 124 0.343 2.510 -14.517 1.00 1.00 H new ATOM 0 HG2 ARG A 124 2.839 2.068 -14.568 1.00 1.00 H new ATOM 0 HG3 ARG A 124 2.516 0.442 -15.137 1.00 1.00 H new ATOM 0 HD2 ARG A 124 1.210 1.448 -17.078 1.00 1.00 H new ATOM 0 HD3 ARG A 124 1.716 3.037 -16.539 1.00 1.00 H new ATOM 0 HE ARG A 124 3.943 2.586 -17.262 1.00 1.00 H new ATOM 0 HH11 ARG A 124 1.817 -0.205 -17.427 1.00 1.00 H new ATOM 0 HH12 ARG A 124 2.925 -1.151 -18.425 1.00 1.00 H new ATOM 0 HH21 ARG A 124 5.359 1.356 -18.538 1.00 1.00 H new ATOM 0 HH22 ARG A 124 4.912 -0.276 -19.049 1.00 1.00 H new ATOM 1930 N THR A 125 1.201 3.189 -11.924 1.00 1.00 N ATOM 1931 CA THR A 125 1.963 4.209 -11.230 1.00 1.00 C ATOM 1932 C THR A 125 2.495 3.648 -9.918 1.00 1.00 C ATOM 1933 O THR A 125 3.640 3.892 -9.541 1.00 1.00 O ATOM 1934 CB THR A 125 1.080 5.427 -10.956 1.00 1.00 C ATOM 1935 OG1 THR A 125 0.391 5.788 -12.144 1.00 1.00 O ATOM 1936 CG2 THR A 125 1.952 6.591 -10.498 1.00 1.00 C ATOM 0 H THR A 125 0.231 3.439 -12.117 1.00 1.00 H new ATOM 0 HA THR A 125 2.802 4.515 -11.855 1.00 1.00 H new ATOM 0 HB THR A 125 0.357 5.186 -10.177 1.00 1.00 H new ATOM 0 HG1 THR A 125 -0.177 6.568 -11.969 1.00 1.00 H new ATOM 0 HG21 THR A 125 1.325 7.461 -10.302 1.00 1.00 H new ATOM 0 HG22 THR A 125 2.481 6.313 -9.587 1.00 1.00 H new ATOM 0 HG23 THR A 125 2.674 6.833 -11.277 1.00 1.00 H new ATOM 1944 N PHE A 126 1.642 2.909 -9.224 1.00 1.00 N ATOM 1945 CA PHE A 126 2.021 2.327 -7.946 1.00 1.00 C ATOM 1946 C PHE A 126 3.259 1.451 -8.091 1.00 1.00 C ATOM 1947 O PHE A 126 4.188 1.550 -7.288 1.00 1.00 O ATOM 1948 CB PHE A 126 0.869 1.493 -7.385 1.00 1.00 C ATOM 1949 CG PHE A 126 1.218 1.037 -5.986 1.00 1.00 C ATOM 1950 CD1 PHE A 126 1.175 1.949 -4.922 1.00 1.00 C ATOM 1951 CD2 PHE A 126 1.580 -0.296 -5.748 1.00 1.00 C ATOM 1952 CE1 PHE A 126 1.490 1.527 -3.628 1.00 1.00 C ATOM 1953 CE2 PHE A 126 1.895 -0.715 -4.451 1.00 1.00 C ATOM 1954 CZ PHE A 126 1.849 0.196 -3.390 1.00 1.00 C ATOM 0 H PHE A 126 0.689 2.699 -9.522 1.00 1.00 H new ATOM 0 HA PHE A 126 2.249 3.142 -7.259 1.00 1.00 H new ATOM 0 HB2 PHE A 126 -0.048 2.082 -7.370 1.00 1.00 H new ATOM 0 HB3 PHE A 126 0.683 0.631 -8.025 1.00 1.00 H new ATOM 0 HD1 PHE A 126 0.898 2.977 -5.103 1.00 1.00 H new ATOM 0 HD2 PHE A 126 1.616 -1.000 -6.566 1.00 1.00 H new ATOM 0 HE1 PHE A 126 1.456 2.230 -2.809 1.00 1.00 H new ATOM 0 HE2 PHE A 126 2.174 -1.742 -4.269 1.00 1.00 H new ATOM 0 HZ PHE A 126 2.090 -0.128 -2.388 1.00 1.00 H new ATOM 1964 N LEU A 127 3.261 0.559 -9.079 1.00 1.00 N ATOM 1965 CA LEU A 127 4.387 -0.354 -9.251 1.00 1.00 C ATOM 1966 C LEU A 127 5.697 0.402 -9.375 1.00 1.00 C ATOM 1967 O LEU A 127 6.685 0.046 -8.732 1.00 1.00 O ATOM 1968 CB LEU A 127 4.210 -1.173 -10.532 1.00 1.00 C ATOM 1969 CG LEU A 127 2.817 -1.792 -10.575 1.00 1.00 C ATOM 1970 CD1 LEU A 127 2.679 -2.620 -11.853 1.00 1.00 C ATOM 1971 CD2 LEU A 127 2.600 -2.687 -9.346 1.00 1.00 C ATOM 0 H LEU A 127 2.510 0.450 -9.761 1.00 1.00 H new ATOM 0 HA LEU A 127 4.413 -0.999 -8.373 1.00 1.00 H new ATOM 0 HB2 LEU A 127 4.359 -0.535 -11.403 1.00 1.00 H new ATOM 0 HB3 LEU A 127 4.966 -1.957 -10.578 1.00 1.00 H new ATOM 0 HG LEU A 127 2.067 -1.001 -10.567 1.00 1.00 H new ATOM 0 HD11 LEU A 127 1.685 -3.066 -11.892 1.00 1.00 H new ATOM 0 HD12 LEU A 127 2.822 -1.976 -12.721 1.00 1.00 H new ATOM 0 HD13 LEU A 127 3.432 -3.409 -11.859 1.00 1.00 H new ATOM 0 HD21 LEU A 127 1.602 -3.124 -9.386 1.00 1.00 H new ATOM 0 HD22 LEU A 127 3.345 -3.483 -9.339 1.00 1.00 H new ATOM 0 HD23 LEU A 127 2.698 -2.090 -8.439 1.00 1.00 H new ATOM 1983 N GLN A 128 5.725 1.416 -10.226 1.00 1.00 N ATOM 1984 CA GLN A 128 6.942 2.177 -10.450 1.00 1.00 C ATOM 1985 C GLN A 128 7.431 2.884 -9.186 1.00 1.00 C ATOM 1986 O GLN A 128 8.629 2.902 -8.908 1.00 1.00 O ATOM 1987 CB GLN A 128 6.667 3.199 -11.544 1.00 1.00 C ATOM 1988 CG GLN A 128 6.441 2.456 -12.859 1.00 1.00 C ATOM 1989 CD GLN A 128 5.917 3.415 -13.906 1.00 1.00 C ATOM 1990 OE1 GLN A 128 4.635 3.587 -14.008 1.00 1.00 O flip ATOM 1991 NE2 GLN A 128 6.690 4.027 -14.642 1.00 1.00 N flip ATOM 0 H GLN A 128 4.922 1.729 -10.771 1.00 1.00 H new ATOM 0 HA GLN A 128 7.732 1.487 -10.747 1.00 1.00 H new ATOM 0 HB2 GLN A 128 5.791 3.797 -11.292 1.00 1.00 H new ATOM 0 HB3 GLN A 128 7.507 3.888 -11.638 1.00 1.00 H new ATOM 0 HG2 GLN A 128 7.374 2.007 -13.199 1.00 1.00 H new ATOM 0 HG3 GLN A 128 5.731 1.642 -12.710 1.00 1.00 H new ATOM 0 HE21 GLN A 128 7.696 3.886 -14.555 1.00 1.00 H new ATOM 0 HE22 GLN A 128 6.324 4.676 -15.339 1.00 1.00 H new ATOM 2000 N GLU A 129 6.511 3.484 -8.437 1.00 1.00 N ATOM 2001 CA GLU A 129 6.889 4.207 -7.228 1.00 1.00 C ATOM 2002 C GLU A 129 7.490 3.264 -6.187 1.00 1.00 C ATOM 2003 O GLU A 129 8.445 3.619 -5.495 1.00 1.00 O ATOM 2004 CB GLU A 129 5.664 4.920 -6.632 1.00 1.00 C ATOM 2005 CG GLU A 129 6.127 6.054 -5.709 1.00 1.00 C ATOM 2006 CD GLU A 129 6.736 7.181 -6.533 1.00 1.00 C ATOM 2007 OE1 GLU A 129 6.626 7.126 -7.748 1.00 1.00 O ATOM 2008 OE2 GLU A 129 7.300 8.085 -5.939 1.00 1.00 O ATOM 0 H GLU A 129 5.512 3.485 -8.642 1.00 1.00 H new ATOM 0 HA GLU A 129 7.643 4.946 -7.501 1.00 1.00 H new ATOM 0 HB2 GLU A 129 5.039 5.320 -7.431 1.00 1.00 H new ATOM 0 HB3 GLU A 129 5.053 4.210 -6.074 1.00 1.00 H new ATOM 0 HG2 GLU A 129 5.283 6.430 -5.130 1.00 1.00 H new ATOM 0 HG3 GLU A 129 6.860 5.677 -4.996 1.00 1.00 H new ATOM 2015 N VAL A 130 6.934 2.065 -6.084 1.00 1.00 N ATOM 2016 CA VAL A 130 7.439 1.091 -5.122 1.00 1.00 C ATOM 2017 C VAL A 130 8.885 0.725 -5.463 1.00 1.00 C ATOM 2018 O VAL A 130 9.749 0.665 -4.587 1.00 1.00 O ATOM 2019 CB VAL A 130 6.548 -0.156 -5.140 1.00 1.00 C ATOM 2020 CG1 VAL A 130 7.183 -1.262 -4.295 1.00 1.00 C ATOM 2021 CG2 VAL A 130 5.176 0.199 -4.557 1.00 1.00 C ATOM 0 H VAL A 130 6.145 1.745 -6.645 1.00 1.00 H new ATOM 0 HA VAL A 130 7.419 1.522 -4.121 1.00 1.00 H new ATOM 0 HB VAL A 130 6.438 -0.506 -6.166 1.00 1.00 H new ATOM 0 HG11 VAL A 130 6.544 -2.145 -4.312 1.00 1.00 H new ATOM 0 HG12 VAL A 130 8.162 -1.514 -4.702 1.00 1.00 H new ATOM 0 HG13 VAL A 130 7.296 -0.916 -3.268 1.00 1.00 H new ATOM 0 HG21 VAL A 130 4.537 -0.684 -4.567 1.00 1.00 H new ATOM 0 HG22 VAL A 130 5.296 0.549 -3.532 1.00 1.00 H new ATOM 0 HG23 VAL A 130 4.718 0.985 -5.157 1.00 1.00 H new ATOM 2031 N ALA A 131 9.124 0.459 -6.740 1.00 1.00 N ATOM 2032 CA ALA A 131 10.454 0.070 -7.210 1.00 1.00 C ATOM 2033 C ALA A 131 11.528 1.082 -6.792 1.00 1.00 C ATOM 2034 O ALA A 131 12.610 0.699 -6.349 1.00 1.00 O ATOM 2035 CB ALA A 131 10.449 -0.053 -8.737 1.00 1.00 C ATOM 0 H ALA A 131 8.416 0.505 -7.473 1.00 1.00 H new ATOM 0 HA ALA A 131 10.695 -0.890 -6.753 1.00 1.00 H new ATOM 0 HB1 ALA A 131 11.442 -0.343 -9.082 1.00 1.00 H new ATOM 0 HB2 ALA A 131 9.725 -0.810 -9.039 1.00 1.00 H new ATOM 0 HB3 ALA A 131 10.177 0.906 -9.178 1.00 1.00 H new ATOM 2041 N ARG A 132 11.229 2.368 -6.928 1.00 1.00 N ATOM 2042 CA ARG A 132 12.194 3.402 -6.555 1.00 1.00 C ATOM 2043 C ARG A 132 12.209 3.612 -5.044 1.00 1.00 C ATOM 2044 O ARG A 132 13.169 4.145 -4.485 1.00 1.00 O ATOM 2045 CB ARG A 132 11.844 4.713 -7.257 1.00 1.00 C ATOM 2046 CG ARG A 132 12.068 4.548 -8.761 1.00 1.00 C ATOM 2047 CD ARG A 132 11.684 5.839 -9.482 1.00 1.00 C ATOM 2048 NE ARG A 132 11.855 5.675 -10.922 1.00 1.00 N ATOM 2049 CZ ARG A 132 13.033 5.869 -11.505 1.00 1.00 C ATOM 2050 NH1 ARG A 132 14.066 6.223 -10.787 1.00 1.00 N ATOM 2051 NH2 ARG A 132 13.161 5.704 -12.793 1.00 1.00 N ATOM 0 H ARG A 132 10.341 2.719 -7.288 1.00 1.00 H new ATOM 0 HA ARG A 132 13.186 3.076 -6.867 1.00 1.00 H new ATOM 0 HB2 ARG A 132 10.806 4.981 -7.058 1.00 1.00 H new ATOM 0 HB3 ARG A 132 12.462 5.523 -6.871 1.00 1.00 H new ATOM 0 HG2 ARG A 132 13.112 4.306 -8.959 1.00 1.00 H new ATOM 0 HG3 ARG A 132 11.471 3.718 -9.139 1.00 1.00 H new ATOM 0 HD2 ARG A 132 10.649 6.097 -9.257 1.00 1.00 H new ATOM 0 HD3 ARG A 132 12.303 6.663 -9.125 1.00 1.00 H new ATOM 0 HE ARG A 132 11.054 5.406 -11.493 1.00 1.00 H new ATOM 0 HH11 ARG A 132 13.968 6.350 -9.780 1.00 1.00 H new ATOM 0 HH12 ARG A 132 14.971 6.372 -11.234 1.00 1.00 H new ATOM 0 HH21 ARG A 132 12.356 5.426 -13.354 1.00 1.00 H new ATOM 0 HH22 ARG A 132 14.066 5.853 -13.239 1.00 1.00 H new ATOM 2065 N ALA A 133 11.124 3.210 -4.396 1.00 1.00 N ATOM 2066 CA ALA A 133 10.988 3.372 -2.953 1.00 1.00 C ATOM 2067 C ALA A 133 12.146 2.723 -2.194 1.00 1.00 C ATOM 2068 O ALA A 133 12.384 3.063 -1.036 1.00 1.00 O ATOM 2069 CB ALA A 133 9.668 2.765 -2.485 1.00 1.00 C ATOM 0 H ALA A 133 10.323 2.768 -4.847 1.00 1.00 H new ATOM 0 HA ALA A 133 11.004 4.441 -2.739 1.00 1.00 H new ATOM 0 HB1 ALA A 133 9.573 2.889 -1.406 1.00 1.00 H new ATOM 0 HB2 ALA A 133 8.839 3.268 -2.983 1.00 1.00 H new ATOM 0 HB3 ALA A 133 9.648 1.703 -2.731 1.00 1.00 H new ATOM 2075 N CYS A 134 12.874 1.819 -2.863 1.00 1.00 N ATOM 2076 CA CYS A 134 14.035 1.147 -2.249 1.00 1.00 C ATOM 2077 C CYS A 134 14.349 -0.204 -2.913 1.00 1.00 C ATOM 2078 O CYS A 134 15.422 -0.367 -3.487 1.00 1.00 O ATOM 2079 CB CYS A 134 13.824 0.961 -0.719 1.00 1.00 C ATOM 2080 SG CYS A 134 14.753 -0.466 -0.083 1.00 1.00 S ATOM 0 H CYS A 134 12.684 1.535 -3.824 1.00 1.00 H new ATOM 0 HA CYS A 134 14.895 1.797 -2.411 1.00 1.00 H new ATOM 0 HB2 CYS A 134 14.139 1.864 -0.195 1.00 1.00 H new ATOM 0 HB3 CYS A 134 12.762 0.826 -0.511 1.00 1.00 H new ATOM 0 HG CYS A 134 14.549 -0.582 1.196 1.00 1.00 H new ATOM 2086 N PRO A 135 13.476 -1.179 -2.812 1.00 1.00 N ATOM 2087 CA PRO A 135 13.724 -2.550 -3.379 1.00 1.00 C ATOM 2088 C PRO A 135 14.146 -2.539 -4.850 1.00 1.00 C ATOM 2089 O PRO A 135 15.192 -3.081 -5.212 1.00 1.00 O ATOM 2090 CB PRO A 135 12.369 -3.277 -3.184 1.00 1.00 C ATOM 2091 CG PRO A 135 11.377 -2.190 -2.915 1.00 1.00 C ATOM 2092 CD PRO A 135 12.152 -1.109 -2.177 1.00 1.00 C ATOM 0 HA PRO A 135 14.558 -3.041 -2.878 1.00 1.00 H new ATOM 0 HB2 PRO A 135 12.097 -3.848 -4.072 1.00 1.00 H new ATOM 0 HB3 PRO A 135 12.416 -3.982 -2.354 1.00 1.00 H new ATOM 0 HG2 PRO A 135 10.954 -1.806 -3.843 1.00 1.00 H new ATOM 0 HG3 PRO A 135 10.545 -2.557 -2.314 1.00 1.00 H new ATOM 0 HD2 PRO A 135 11.695 -0.127 -2.298 1.00 1.00 H new ATOM 0 HD3 PRO A 135 12.204 -1.306 -1.106 1.00 1.00 H new ATOM 2100 N GLY A 136 13.317 -1.946 -5.692 1.00 1.00 N ATOM 2101 CA GLY A 136 13.598 -1.898 -7.115 1.00 1.00 C ATOM 2102 C GLY A 136 13.500 -3.293 -7.713 1.00 1.00 C ATOM 2103 O GLY A 136 12.538 -3.613 -8.409 1.00 1.00 O ATOM 0 H GLY A 136 12.446 -1.492 -5.415 1.00 1.00 H new ATOM 0 HA2 GLY A 136 12.893 -1.231 -7.611 1.00 1.00 H new ATOM 0 HA3 GLY A 136 14.595 -1.491 -7.283 1.00 1.00 H new ATOM 2107 N PHE A 137 14.501 -4.118 -7.426 1.00 1.00 N ATOM 2108 CA PHE A 137 14.524 -5.485 -7.930 1.00 1.00 C ATOM 2109 C PHE A 137 15.502 -6.337 -7.125 1.00 1.00 C ATOM 2110 O PHE A 137 15.227 -7.500 -6.825 1.00 1.00 O ATOM 2111 CB PHE A 137 14.939 -5.493 -9.403 1.00 1.00 C ATOM 2112 CG PHE A 137 13.841 -4.892 -10.247 1.00 1.00 C ATOM 2113 CD1 PHE A 137 12.723 -5.662 -10.589 1.00 1.00 C ATOM 2114 CD2 PHE A 137 13.939 -3.567 -10.687 1.00 1.00 C ATOM 2115 CE1 PHE A 137 11.703 -5.108 -11.371 1.00 1.00 C ATOM 2116 CE2 PHE A 137 12.918 -3.011 -11.470 1.00 1.00 C ATOM 2117 CZ PHE A 137 11.800 -3.782 -11.812 1.00 1.00 C ATOM 0 H PHE A 137 15.304 -3.865 -6.850 1.00 1.00 H new ATOM 0 HA PHE A 137 13.523 -5.904 -7.830 1.00 1.00 H new ATOM 0 HB2 PHE A 137 15.861 -4.927 -9.533 1.00 1.00 H new ATOM 0 HB3 PHE A 137 15.142 -6.514 -9.727 1.00 1.00 H new ATOM 0 HD1 PHE A 137 12.648 -6.684 -10.249 1.00 1.00 H new ATOM 0 HD2 PHE A 137 14.801 -2.973 -10.423 1.00 1.00 H new ATOM 0 HE1 PHE A 137 10.841 -5.703 -11.634 1.00 1.00 H new ATOM 0 HE2 PHE A 137 12.993 -1.988 -11.809 1.00 1.00 H new ATOM 0 HZ PHE A 137 11.013 -3.354 -12.415 1.00 1.00 H new ATOM 2127 N ASP A 138 16.654 -5.753 -6.782 1.00 1.00 N ATOM 2128 CA ASP A 138 17.684 -6.471 -6.012 1.00 1.00 C ATOM 2129 C ASP A 138 17.757 -5.911 -4.579 1.00 1.00 C ATOM 2130 O ASP A 138 17.669 -4.698 -4.393 1.00 1.00 O ATOM 2131 CB ASP A 138 19.050 -6.307 -6.699 1.00 1.00 C ATOM 2132 CG ASP A 138 19.148 -7.230 -7.913 1.00 1.00 C ATOM 2133 OD1 ASP A 138 18.365 -7.057 -8.833 1.00 1.00 O ATOM 2134 OD2 ASP A 138 20.008 -8.096 -7.908 1.00 1.00 O ATOM 0 H ASP A 138 16.899 -4.792 -7.021 1.00 1.00 H new ATOM 0 HA ASP A 138 17.423 -7.528 -5.969 1.00 1.00 H new ATOM 0 HB2 ASP A 138 19.186 -5.271 -7.009 1.00 1.00 H new ATOM 0 HB3 ASP A 138 19.849 -6.536 -5.994 1.00 1.00 H new ATOM 2139 N PRO A 139 17.904 -6.747 -3.564 1.00 1.00 N ATOM 2140 CA PRO A 139 17.965 -6.273 -2.142 1.00 1.00 C ATOM 2141 C PRO A 139 19.286 -5.571 -1.812 1.00 1.00 C ATOM 2142 O PRO A 139 19.674 -5.476 -0.649 1.00 1.00 O ATOM 2143 CB PRO A 139 17.796 -7.561 -1.324 1.00 1.00 C ATOM 2144 CG PRO A 139 18.339 -8.643 -2.200 1.00 1.00 C ATOM 2145 CD PRO A 139 18.034 -8.220 -3.643 1.00 1.00 C ATOM 0 HA PRO A 139 17.201 -5.525 -1.928 1.00 1.00 H new ATOM 0 HB2 PRO A 139 18.340 -7.505 -0.381 1.00 1.00 H new ATOM 0 HB3 PRO A 139 16.749 -7.739 -1.078 1.00 1.00 H new ATOM 0 HG2 PRO A 139 19.412 -8.765 -2.049 1.00 1.00 H new ATOM 0 HG3 PRO A 139 17.874 -9.601 -1.969 1.00 1.00 H new ATOM 0 HD2 PRO A 139 18.834 -8.514 -4.323 1.00 1.00 H new ATOM 0 HD3 PRO A 139 17.118 -8.683 -4.009 1.00 1.00 H new ATOM 2153 N GLU A 140 19.967 -5.091 -2.846 1.00 1.00 N ATOM 2154 CA GLU A 140 21.247 -4.404 -2.667 1.00 1.00 C ATOM 2155 C GLU A 140 21.048 -2.893 -2.561 1.00 1.00 C ATOM 2156 O GLU A 140 21.997 -2.151 -2.313 1.00 1.00 O ATOM 2157 CB GLU A 140 22.169 -4.723 -3.845 1.00 1.00 C ATOM 2158 CG GLU A 140 22.557 -6.203 -3.792 1.00 1.00 C ATOM 2159 CD GLU A 140 23.402 -6.564 -5.009 1.00 1.00 C ATOM 2160 OE1 GLU A 140 23.689 -5.675 -5.792 1.00 1.00 O ATOM 2161 OE2 GLU A 140 23.751 -7.727 -5.138 1.00 1.00 O ATOM 0 H GLU A 140 19.658 -5.163 -3.815 1.00 1.00 H new ATOM 0 HA GLU A 140 21.700 -4.755 -1.740 1.00 1.00 H new ATOM 0 HB2 GLU A 140 21.667 -4.499 -4.786 1.00 1.00 H new ATOM 0 HB3 GLU A 140 23.062 -4.099 -3.804 1.00 1.00 H new ATOM 0 HG2 GLU A 140 23.114 -6.409 -2.878 1.00 1.00 H new ATOM 0 HG3 GLU A 140 21.660 -6.822 -3.765 1.00 1.00 H new ATOM 2168 N THR A 141 19.808 -2.453 -2.754 1.00 1.00 N ATOM 2169 CA THR A 141 19.466 -1.031 -2.687 1.00 1.00 C ATOM 2170 C THR A 141 19.936 -0.398 -1.372 1.00 1.00 C ATOM 2171 O THR A 141 19.135 -0.131 -0.476 1.00 1.00 O ATOM 2172 CB THR A 141 17.942 -0.868 -2.818 1.00 1.00 C ATOM 2173 OG1 THR A 141 17.524 0.306 -2.132 1.00 1.00 O ATOM 2174 CG2 THR A 141 17.233 -2.092 -2.212 1.00 1.00 C ATOM 0 H THR A 141 19.017 -3.063 -2.959 1.00 1.00 H new ATOM 0 HA THR A 141 19.974 -0.521 -3.506 1.00 1.00 H new ATOM 0 HB THR A 141 17.683 -0.784 -3.873 1.00 1.00 H new ATOM 0 HG1 THR A 141 17.662 0.189 -1.169 1.00 1.00 H new ATOM 0 HG21 THR A 141 16.154 -1.972 -2.307 1.00 1.00 H new ATOM 0 HG22 THR A 141 17.546 -2.992 -2.741 1.00 1.00 H new ATOM 0 HG23 THR A 141 17.497 -2.180 -1.158 1.00 1.00 H new ATOM 2182 N ARG A 142 21.238 -0.151 -1.269 1.00 1.00 N ATOM 2183 CA ARG A 142 21.809 0.461 -0.072 1.00 1.00 C ATOM 2184 C ARG A 142 21.374 -0.268 1.197 1.00 1.00 C ATOM 2185 O ARG A 142 21.800 -1.392 1.464 1.00 1.00 O ATOM 2186 CB ARG A 142 21.380 1.933 0.017 1.00 1.00 C ATOM 2187 CG ARG A 142 21.912 2.729 -1.187 1.00 1.00 C ATOM 2188 CD ARG A 142 23.344 3.202 -0.914 1.00 1.00 C ATOM 2189 NE ARG A 142 23.353 4.097 0.234 1.00 1.00 N ATOM 2190 CZ ARG A 142 24.489 4.610 0.693 1.00 1.00 C ATOM 2191 NH1 ARG A 142 25.617 4.301 0.122 1.00 1.00 N ATOM 2192 NH2 ARG A 142 24.471 5.418 1.718 1.00 1.00 N ATOM 0 H ARG A 142 21.918 -0.365 -1.999 1.00 1.00 H new ATOM 0 HA ARG A 142 22.894 0.391 -0.151 1.00 1.00 H new ATOM 0 HB2 ARG A 142 20.292 1.998 0.050 1.00 1.00 H new ATOM 0 HB3 ARG A 142 21.754 2.371 0.942 1.00 1.00 H new ATOM 0 HG2 ARG A 142 21.890 2.107 -2.082 1.00 1.00 H new ATOM 0 HG3 ARG A 142 21.268 3.587 -1.379 1.00 1.00 H new ATOM 0 HD2 ARG A 142 23.991 2.345 -0.725 1.00 1.00 H new ATOM 0 HD3 ARG A 142 23.742 3.714 -1.790 1.00 1.00 H new ATOM 0 HE ARG A 142 22.473 4.334 0.693 1.00 1.00 H new ATOM 0 HH11 ARG A 142 25.627 3.666 -0.676 1.00 1.00 H new ATOM 0 HH12 ARG A 142 26.491 4.694 0.473 1.00 1.00 H new ATOM 0 HH21 ARG A 142 23.585 5.655 2.165 1.00 1.00 H new ATOM 0 HH22 ARG A 142 25.343 5.813 2.072 1.00 1.00 H new ATOM 2206 N ASP A 143 20.525 0.390 1.978 1.00 1.00 N ATOM 2207 CA ASP A 143 20.035 -0.176 3.222 1.00 1.00 C ATOM 2208 C ASP A 143 18.670 0.417 3.558 1.00 1.00 C ATOM 2209 O ASP A 143 18.375 1.553 3.189 1.00 1.00 O ATOM 2210 CB ASP A 143 21.030 0.126 4.353 1.00 1.00 C ATOM 2211 CG ASP A 143 21.542 1.559 4.239 1.00 1.00 C ATOM 2212 OD1 ASP A 143 20.961 2.320 3.483 1.00 1.00 O ATOM 2213 OD2 ASP A 143 22.511 1.873 4.912 1.00 1.00 O ATOM 0 H ASP A 143 20.162 1.320 1.767 1.00 1.00 H new ATOM 0 HA ASP A 143 19.935 -1.256 3.112 1.00 1.00 H new ATOM 0 HB2 ASP A 143 20.547 -0.019 5.320 1.00 1.00 H new ATOM 0 HB3 ASP A 143 21.867 -0.571 4.306 1.00 1.00 H new ATOM 2218 N PRO A 144 17.834 -0.317 4.244 1.00 1.00 N ATOM 2219 CA PRO A 144 16.477 0.165 4.627 1.00 1.00 C ATOM 2220 C PRO A 144 16.535 1.286 5.671 1.00 1.00 C ATOM 2221 O PRO A 144 17.532 1.452 6.373 1.00 1.00 O ATOM 2222 CB PRO A 144 15.790 -1.094 5.177 1.00 1.00 C ATOM 2223 CG PRO A 144 16.910 -1.949 5.672 1.00 1.00 C ATOM 2224 CD PRO A 144 18.081 -1.687 4.731 1.00 1.00 C ATOM 0 HA PRO A 144 15.939 0.607 3.788 1.00 1.00 H new ATOM 0 HB2 PRO A 144 15.095 -0.848 5.980 1.00 1.00 H new ATOM 0 HB3 PRO A 144 15.216 -1.602 4.403 1.00 1.00 H new ATOM 0 HG2 PRO A 144 17.170 -1.696 6.700 1.00 1.00 H new ATOM 0 HG3 PRO A 144 16.630 -3.003 5.664 1.00 1.00 H new ATOM 0 HD2 PRO A 144 19.037 -1.762 5.250 1.00 1.00 H new ATOM 0 HD3 PRO A 144 18.106 -2.406 3.912 1.00 1.00 H new ATOM 2232 N GLU A 145 15.439 2.032 5.762 1.00 1.00 N ATOM 2233 CA GLU A 145 15.322 3.131 6.720 1.00 1.00 C ATOM 2234 C GLU A 145 13.867 3.266 7.153 1.00 1.00 C ATOM 2235 O GLU A 145 12.960 3.232 6.323 1.00 1.00 O ATOM 2236 CB GLU A 145 15.811 4.443 6.092 1.00 1.00 C ATOM 2237 CG GLU A 145 15.821 5.551 7.151 1.00 1.00 C ATOM 2238 CD GLU A 145 16.358 6.846 6.547 1.00 1.00 C ATOM 2239 OE1 GLU A 145 16.506 6.897 5.338 1.00 1.00 O ATOM 2240 OE2 GLU A 145 16.616 7.768 7.306 1.00 1.00 O ATOM 0 H GLU A 145 14.612 1.896 5.180 1.00 1.00 H new ATOM 0 HA GLU A 145 15.942 2.917 7.590 1.00 1.00 H new ATOM 0 HB2 GLU A 145 16.812 4.310 5.682 1.00 1.00 H new ATOM 0 HB3 GLU A 145 15.162 4.725 5.263 1.00 1.00 H new ATOM 0 HG2 GLU A 145 14.813 5.709 7.533 1.00 1.00 H new ATOM 0 HG3 GLU A 145 16.439 5.251 7.997 1.00 1.00 H new ATOM 2247 N PHE A 146 13.647 3.395 8.456 1.00 1.00 N ATOM 2248 CA PHE A 146 12.290 3.509 8.979 1.00 1.00 C ATOM 2249 C PHE A 146 12.298 4.079 10.397 1.00 1.00 C ATOM 2250 O PHE A 146 11.265 4.142 11.060 1.00 1.00 O ATOM 2251 CB PHE A 146 11.633 2.130 8.974 1.00 1.00 C ATOM 2252 CG PHE A 146 12.528 1.143 9.682 1.00 1.00 C ATOM 2253 CD1 PHE A 146 12.415 0.959 11.064 1.00 1.00 C ATOM 2254 CD2 PHE A 146 13.473 0.412 8.954 1.00 1.00 C ATOM 2255 CE1 PHE A 146 13.250 0.044 11.718 1.00 1.00 C ATOM 2256 CE2 PHE A 146 14.307 -0.502 9.606 1.00 1.00 C ATOM 2257 CZ PHE A 146 14.198 -0.685 10.988 1.00 1.00 C ATOM 0 H PHE A 146 14.381 3.423 9.163 1.00 1.00 H new ATOM 0 HA PHE A 146 11.723 4.191 8.344 1.00 1.00 H new ATOM 0 HB2 PHE A 146 10.662 2.176 9.468 1.00 1.00 H new ATOM 0 HB3 PHE A 146 11.454 1.805 7.949 1.00 1.00 H new ATOM 0 HD1 PHE A 146 11.685 1.522 11.626 1.00 1.00 H new ATOM 0 HD2 PHE A 146 13.559 0.554 7.887 1.00 1.00 H new ATOM 0 HE1 PHE A 146 13.163 -0.100 12.785 1.00 1.00 H new ATOM 0 HE2 PHE A 146 15.035 -1.066 9.042 1.00 1.00 H new ATOM 0 HZ PHE A 146 14.844 -1.388 11.492 1.00 1.00 H new ATOM 2267 N GLU A 147 13.480 4.462 10.855 1.00 1.00 N ATOM 2268 CA GLU A 147 13.651 5.001 12.202 1.00 1.00 C ATOM 2269 C GLU A 147 12.767 6.227 12.455 1.00 1.00 C ATOM 2270 O GLU A 147 12.568 6.628 13.602 1.00 1.00 O ATOM 2271 CB GLU A 147 15.122 5.376 12.404 1.00 1.00 C ATOM 2272 CG GLU A 147 15.365 5.779 13.860 1.00 1.00 C ATOM 2273 CD GLU A 147 16.857 5.982 14.101 1.00 1.00 C ATOM 2274 OE1 GLU A 147 17.636 5.527 13.280 1.00 1.00 O ATOM 2275 OE2 GLU A 147 17.199 6.586 15.105 1.00 1.00 O ATOM 0 H GLU A 147 14.342 4.410 10.312 1.00 1.00 H new ATOM 0 HA GLU A 147 13.348 4.232 12.913 1.00 1.00 H new ATOM 0 HB2 GLU A 147 15.760 4.533 12.140 1.00 1.00 H new ATOM 0 HB3 GLU A 147 15.390 6.198 11.741 1.00 1.00 H new ATOM 0 HG2 GLU A 147 14.823 6.697 14.088 1.00 1.00 H new ATOM 0 HG3 GLU A 147 14.981 5.008 14.529 1.00 1.00 H new ATOM 2282 N TRP A 148 12.241 6.828 11.390 1.00 1.00 N ATOM 2283 CA TRP A 148 11.394 8.015 11.532 1.00 1.00 C ATOM 2284 C TRP A 148 9.925 7.634 11.727 1.00 1.00 C ATOM 2285 O TRP A 148 9.108 8.473 12.100 1.00 1.00 O ATOM 2286 CB TRP A 148 11.553 8.932 10.314 1.00 1.00 C ATOM 2287 CG TRP A 148 11.241 8.184 9.061 1.00 1.00 C ATOM 2288 CD1 TRP A 148 12.020 7.219 8.518 1.00 1.00 C ATOM 2289 CD2 TRP A 148 10.093 8.329 8.173 1.00 1.00 C ATOM 2290 NE1 TRP A 148 11.420 6.758 7.362 1.00 1.00 N ATOM 2291 CE2 TRP A 148 10.231 7.407 7.108 1.00 1.00 C ATOM 2292 CE3 TRP A 148 8.955 9.157 8.190 1.00 1.00 C ATOM 2293 CZ2 TRP A 148 9.277 7.308 6.096 1.00 1.00 C ATOM 2294 CZ3 TRP A 148 7.991 9.060 7.171 1.00 1.00 C ATOM 2295 CH2 TRP A 148 8.151 8.137 6.125 1.00 1.00 C ATOM 0 H TRP A 148 12.383 6.519 10.428 1.00 1.00 H new ATOM 0 HA TRP A 148 11.718 8.553 12.423 1.00 1.00 H new ATOM 0 HB2 TRP A 148 10.889 9.792 10.408 1.00 1.00 H new ATOM 0 HB3 TRP A 148 12.571 9.319 10.271 1.00 1.00 H new ATOM 0 HD1 TRP A 148 12.957 6.867 8.922 1.00 1.00 H new ATOM 0 HE1 TRP A 148 11.810 6.026 6.768 1.00 1.00 H new ATOM 0 HE3 TRP A 148 8.822 9.870 8.990 1.00 1.00 H new ATOM 0 HZ2 TRP A 148 9.407 6.596 5.295 1.00 1.00 H new ATOM 0 HZ3 TRP A 148 7.121 9.700 7.193 1.00 1.00 H new ATOM 0 HH2 TRP A 148 7.407 8.067 5.345 1.00 1.00 H new ATOM 2306 N LEU A 149 9.591 6.370 11.479 1.00 1.00 N ATOM 2307 CA LEU A 149 8.214 5.911 11.648 1.00 1.00 C ATOM 2308 C LEU A 149 7.807 5.990 13.119 1.00 1.00 C ATOM 2309 O LEU A 149 6.641 6.225 13.436 1.00 1.00 O ATOM 2310 CB LEU A 149 8.054 4.468 11.139 1.00 1.00 C ATOM 2311 CG LEU A 149 7.848 4.452 9.611 1.00 1.00 C ATOM 2312 CD1 LEU A 149 6.462 5.020 9.233 1.00 1.00 C ATOM 2313 CD2 LEU A 149 8.949 5.282 8.939 1.00 1.00 C ATOM 0 H LEU A 149 10.245 5.653 11.164 1.00 1.00 H new ATOM 0 HA LEU A 149 7.564 6.561 11.062 1.00 1.00 H new ATOM 0 HB2 LEU A 149 8.938 3.885 11.399 1.00 1.00 H new ATOM 0 HB3 LEU A 149 7.204 3.995 11.631 1.00 1.00 H new ATOM 0 HG LEU A 149 7.899 3.420 9.265 1.00 1.00 H new ATOM 0 HD11 LEU A 149 6.343 4.997 8.150 1.00 1.00 H new ATOM 0 HD12 LEU A 149 5.682 4.416 9.697 1.00 1.00 H new ATOM 0 HD13 LEU A 149 6.382 6.048 9.585 1.00 1.00 H new ATOM 0 HD21 LEU A 149 8.804 5.271 7.859 1.00 1.00 H new ATOM 0 HD22 LEU A 149 8.903 6.309 9.301 1.00 1.00 H new ATOM 0 HD23 LEU A 149 9.923 4.856 9.179 1.00 1.00 H new ATOM 2325 N SER A 150 8.770 5.783 14.010 1.00 1.00 N ATOM 2326 CA SER A 150 8.502 5.827 15.443 1.00 1.00 C ATOM 2327 C SER A 150 7.730 7.088 15.792 1.00 1.00 C ATOM 2328 O SER A 150 6.813 7.065 16.615 1.00 1.00 O ATOM 2329 CB SER A 150 9.823 5.825 16.205 1.00 1.00 C ATOM 2330 OG SER A 150 10.584 4.687 15.821 1.00 1.00 O ATOM 0 H SER A 150 9.740 5.584 13.767 1.00 1.00 H new ATOM 0 HA SER A 150 7.910 4.955 15.720 1.00 1.00 H new ATOM 0 HB2 SER A 150 10.380 6.738 15.993 1.00 1.00 H new ATOM 0 HB3 SER A 150 9.637 5.807 17.279 1.00 1.00 H new ATOM 0 HG SER A 150 11.435 4.683 16.307 1.00 1.00 H new ATOM 2336 N ARG A 151 8.097 8.183 15.141 1.00 1.00 N ATOM 2337 CA ARG A 151 7.423 9.452 15.369 1.00 1.00 C ATOM 2338 C ARG A 151 5.960 9.296 15.008 1.00 1.00 C ATOM 2339 O ARG A 151 5.075 9.840 15.669 1.00 1.00 O ATOM 2340 CB ARG A 151 8.055 10.542 14.493 1.00 1.00 C ATOM 2341 CG ARG A 151 9.332 11.084 15.140 1.00 1.00 C ATOM 2342 CD ARG A 151 10.441 10.030 15.108 1.00 1.00 C ATOM 2343 NE ARG A 151 11.677 10.605 15.625 1.00 1.00 N ATOM 2344 CZ ARG A 151 12.651 9.840 16.102 1.00 1.00 C ATOM 2345 NH1 ARG A 151 12.526 8.540 16.098 1.00 1.00 N ATOM 2346 NH2 ARG A 151 13.735 10.389 16.576 1.00 1.00 N ATOM 0 H ARG A 151 8.852 8.218 14.456 1.00 1.00 H new ATOM 0 HA ARG A 151 7.521 9.739 16.416 1.00 1.00 H new ATOM 0 HB2 ARG A 151 8.285 10.136 13.508 1.00 1.00 H new ATOM 0 HB3 ARG A 151 7.343 11.354 14.345 1.00 1.00 H new ATOM 0 HG2 ARG A 151 9.660 11.981 14.615 1.00 1.00 H new ATOM 0 HG3 ARG A 151 9.129 11.375 16.171 1.00 1.00 H new ATOM 0 HD2 ARG A 151 10.152 9.165 15.706 1.00 1.00 H new ATOM 0 HD3 ARG A 151 10.591 9.676 14.088 1.00 1.00 H new ATOM 0 HE ARG A 151 11.796 11.618 15.620 1.00 1.00 H new ATOM 0 HH11 ARG A 151 11.678 8.110 15.728 1.00 1.00 H new ATOM 0 HH12 ARG A 151 13.276 7.954 16.465 1.00 1.00 H new ATOM 0 HH21 ARG A 151 13.833 11.404 16.580 1.00 1.00 H new ATOM 0 HH22 ARG A 151 14.485 9.803 16.943 1.00 1.00 H new ATOM 2360 N HIS A 152 5.722 8.533 13.955 1.00 1.00 N ATOM 2361 CA HIS A 152 4.374 8.278 13.497 1.00 1.00 C ATOM 2362 C HIS A 152 3.782 7.119 14.287 1.00 1.00 C ATOM 2363 O HIS A 152 4.491 6.192 14.683 1.00 1.00 O ATOM 2364 CB HIS A 152 4.389 7.948 12.003 1.00 1.00 C ATOM 2365 CG HIS A 152 4.882 9.146 11.231 1.00 1.00 C ATOM 2366 ND1 HIS A 152 6.138 9.517 10.810 1.00 1.00 N flip ATOM 2367 CD2 HIS A 152 4.027 10.145 10.794 1.00 1.00 C flip ATOM 2368 CE1 HIS A 152 6.062 10.725 10.122 1.00 1.00 C flip ATOM 2369 NE2 HIS A 152 4.769 11.061 10.142 1.00 1.00 N flip ATOM 0 H HIS A 152 6.449 8.080 13.402 1.00 1.00 H new ATOM 0 HA HIS A 152 3.761 9.166 13.653 1.00 1.00 H new ATOM 0 HB2 HIS A 152 5.034 7.090 11.815 1.00 1.00 H new ATOM 0 HB3 HIS A 152 3.388 7.673 11.670 1.00 1.00 H new ATOM 0 HD1 HIS A 152 6.994 8.988 10.976 1.00 1.00 H new ATOM 0 HD2 HIS A 152 2.959 10.183 10.948 1.00 1.00 H new ATOM 0 HE1 HIS A 152 6.875 11.273 9.669 1.00 1.00 H new ATOM 2377 N THR A 153 2.480 7.176 14.498 1.00 1.00 N ATOM 2378 CA THR A 153 1.772 6.125 15.224 1.00 1.00 C ATOM 2379 C THR A 153 0.362 5.985 14.668 1.00 1.00 C ATOM 2380 O THR A 153 -0.299 6.979 14.368 1.00 1.00 O ATOM 2381 CB THR A 153 1.723 6.446 16.727 1.00 1.00 C ATOM 2382 OG1 THR A 153 3.005 6.216 17.295 1.00 1.00 O ATOM 2383 CG2 THR A 153 0.690 5.548 17.427 1.00 1.00 C ATOM 0 H THR A 153 1.885 7.940 14.178 1.00 1.00 H new ATOM 0 HA THR A 153 2.305 5.183 15.094 1.00 1.00 H new ATOM 0 HB THR A 153 1.437 7.489 16.861 1.00 1.00 H new ATOM 0 HG1 THR A 153 3.650 6.026 16.582 1.00 1.00 H new ATOM 0 HG21 THR A 153 0.664 5.784 18.491 1.00 1.00 H new ATOM 0 HG22 THR A 153 -0.295 5.720 16.993 1.00 1.00 H new ATOM 0 HG23 THR A 153 0.968 4.502 17.294 1.00 1.00 H new ATOM 2391 N CYS A 154 -0.092 4.745 14.531 1.00 1.00 N ATOM 2392 CA CYS A 154 -1.426 4.479 14.012 1.00 1.00 C ATOM 2393 C CYS A 154 -2.408 4.291 15.159 1.00 1.00 C ATOM 2394 O CYS A 154 -2.054 4.455 16.327 1.00 1.00 O ATOM 2395 CB CYS A 154 -1.390 3.218 13.147 1.00 1.00 C ATOM 2396 SG CYS A 154 -0.567 1.886 14.053 1.00 1.00 S ATOM 0 H CYS A 154 0.443 3.911 14.772 1.00 1.00 H new ATOM 0 HA CYS A 154 -1.752 5.326 13.409 1.00 1.00 H new ATOM 0 HB2 CYS A 154 -2.404 2.918 12.880 1.00 1.00 H new ATOM 0 HB3 CYS A 154 -0.861 3.419 12.215 1.00 1.00 H new ATOM 0 HG CYS A 154 -0.539 0.814 13.318 1.00 1.00 H new ATOM 2402 N ALA A 155 -3.643 3.946 14.819 1.00 1.00 N ATOM 2403 CA ALA A 155 -4.675 3.737 15.826 1.00 1.00 C ATOM 2404 C ALA A 155 -4.176 2.784 16.907 1.00 1.00 C ATOM 2405 O ALA A 155 -3.036 2.324 16.849 1.00 1.00 O ATOM 2406 CB ALA A 155 -5.931 3.161 15.172 1.00 1.00 C ATOM 0 H ALA A 155 -3.954 3.805 13.858 1.00 1.00 H new ATOM 0 HA ALA A 155 -4.914 4.697 16.285 1.00 1.00 H new ATOM 0 HB1 ALA A 155 -6.698 3.007 15.931 1.00 1.00 H new ATOM 0 HB2 ALA A 155 -6.300 3.856 14.418 1.00 1.00 H new ATOM 0 HB3 ALA A 155 -5.691 2.208 14.700 1.00 1.00 H new ATOM 2412 N GLU A 156 -5.035 2.488 17.886 1.00 1.00 N ATOM 2413 CA GLU A 156 -4.669 1.580 18.978 1.00 1.00 C ATOM 2414 C GLU A 156 -3.810 0.423 18.447 1.00 1.00 C ATOM 2415 O GLU A 156 -4.345 -0.519 17.860 1.00 1.00 O ATOM 2416 CB GLU A 156 -5.934 1.011 19.629 1.00 1.00 C ATOM 2417 CG GLU A 156 -6.699 2.137 20.332 1.00 1.00 C ATOM 2418 CD GLU A 156 -8.026 1.611 20.870 1.00 1.00 C ATOM 2419 OE1 GLU A 156 -8.176 0.402 20.947 1.00 1.00 O ATOM 2420 OE2 GLU A 156 -8.875 2.425 21.198 1.00 1.00 O ATOM 0 H GLU A 156 -5.983 2.861 17.946 1.00 1.00 H new ATOM 0 HA GLU A 156 -4.097 2.141 19.717 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -6.566 0.544 18.873 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -5.669 0.234 20.346 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -6.100 2.540 21.149 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -6.879 2.956 19.635 1.00 1.00 H new ATOM 2427 N PRO A 157 -2.503 0.460 18.619 1.00 1.00 N ATOM 2428 CA PRO A 157 -1.608 -0.628 18.120 1.00 1.00 C ATOM 2429 C PRO A 157 -2.034 -2.000 18.614 1.00 1.00 C ATOM 2430 O PRO A 157 -2.667 -2.135 19.661 1.00 1.00 O ATOM 2431 CB PRO A 157 -0.221 -0.247 18.654 1.00 1.00 C ATOM 2432 CG PRO A 157 -0.292 1.225 18.836 1.00 1.00 C ATOM 2433 CD PRO A 157 -1.720 1.520 19.286 1.00 1.00 C ATOM 0 HA PRO A 157 -1.635 -0.707 17.033 1.00 1.00 H new ATOM 0 HB2 PRO A 157 -0.003 -0.754 19.594 1.00 1.00 H new ATOM 0 HB3 PRO A 157 0.566 -0.524 17.952 1.00 1.00 H new ATOM 0 HG2 PRO A 157 0.430 1.562 19.580 1.00 1.00 H new ATOM 0 HG3 PRO A 157 -0.059 1.746 17.907 1.00 1.00 H new ATOM 0 HD2 PRO A 157 -1.819 1.474 20.370 1.00 1.00 H new ATOM 0 HD3 PRO A 157 -2.043 2.515 18.979 1.00 1.00 H new ATOM 2441 N ASP A 158 -1.681 -3.013 17.840 1.00 1.00 N ATOM 2442 CA ASP A 158 -2.029 -4.386 18.183 1.00 1.00 C ATOM 2443 C ASP A 158 -1.347 -4.811 19.480 1.00 1.00 C ATOM 2444 O ASP A 158 -0.218 -4.412 19.762 1.00 1.00 O ATOM 2445 CB ASP A 158 -1.604 -5.323 17.053 1.00 1.00 C ATOM 2446 CG ASP A 158 -2.501 -5.120 15.837 1.00 1.00 C ATOM 2447 OD1 ASP A 158 -3.537 -4.496 15.986 1.00 1.00 O ATOM 2448 OD2 ASP A 158 -2.135 -5.591 14.771 1.00 1.00 O ATOM 0 H ASP A 158 -1.155 -2.913 16.972 1.00 1.00 H new ATOM 0 HA ASP A 158 -3.109 -4.442 18.323 1.00 1.00 H new ATOM 0 HB2 ASP A 158 -0.565 -5.132 16.784 1.00 1.00 H new ATOM 0 HB3 ASP A 158 -1.662 -6.359 17.388 1.00 1.00 H new ATOM 2453 N ALA A 159 -2.051 -5.614 20.269 1.00 1.00 N ATOM 2454 CA ALA A 159 -1.518 -6.081 21.544 1.00 1.00 C ATOM 2455 C ALA A 159 -0.141 -6.712 21.356 1.00 1.00 C ATOM 2456 O ALA A 159 0.805 -6.379 22.071 1.00 1.00 O ATOM 2457 CB ALA A 159 -2.469 -7.113 22.154 1.00 1.00 C ATOM 0 H ALA A 159 -2.987 -5.954 20.050 1.00 1.00 H new ATOM 0 HA ALA A 159 -1.424 -5.225 22.212 1.00 1.00 H new ATOM 0 HB1 ALA A 159 -2.068 -7.460 23.106 1.00 1.00 H new ATOM 0 HB2 ALA A 159 -3.445 -6.657 22.316 1.00 1.00 H new ATOM 0 HB3 ALA A 159 -2.572 -7.959 21.474 1.00 1.00 H new ATOM 2463 N GLU A 160 -0.035 -7.624 20.396 1.00 1.00 N ATOM 2464 CA GLU A 160 1.233 -8.297 20.132 1.00 1.00 C ATOM 2465 C GLU A 160 2.247 -7.322 19.540 1.00 1.00 C ATOM 2466 O GLU A 160 2.676 -7.477 18.398 1.00 1.00 O ATOM 2467 CB GLU A 160 1.011 -9.452 19.156 1.00 1.00 C ATOM 2468 CG GLU A 160 0.078 -10.487 19.789 1.00 1.00 C ATOM 2469 CD GLU A 160 0.754 -11.142 20.989 1.00 1.00 C ATOM 2470 OE1 GLU A 160 1.972 -11.099 21.054 1.00 1.00 O ATOM 2471 OE2 GLU A 160 0.045 -11.672 21.827 1.00 1.00 O ATOM 0 H GLU A 160 -0.804 -7.913 19.792 1.00 1.00 H new ATOM 0 HA GLU A 160 1.623 -8.681 21.075 1.00 1.00 H new ATOM 0 HB2 GLU A 160 0.580 -9.079 18.227 1.00 1.00 H new ATOM 0 HB3 GLU A 160 1.965 -9.915 18.901 1.00 1.00 H new ATOM 0 HG2 GLU A 160 -0.850 -10.008 20.102 1.00 1.00 H new ATOM 0 HG3 GLU A 160 -0.188 -11.246 19.053 1.00 1.00 H new ATOM 2478 N SER A 161 2.629 -6.321 20.326 1.00 1.00 N ATOM 2479 CA SER A 161 3.597 -5.328 19.869 1.00 1.00 C ATOM 2480 C SER A 161 5.016 -5.883 19.957 1.00 1.00 C ATOM 2481 O SER A 161 5.352 -6.439 20.989 1.00 1.00 O ATOM 2482 CB SER A 161 3.489 -4.063 20.717 1.00 1.00 C ATOM 2483 OG SER A 161 4.115 -4.284 21.974 1.00 1.00 O ATOM 2484 OXT SER A 161 5.748 -5.739 18.991 1.00 1.00 O ATOM 0 H SER A 161 2.287 -6.175 21.276 1.00 1.00 H new ATOM 0 HA SER A 161 3.377 -5.086 18.829 1.00 1.00 H new ATOM 0 HB2 SER A 161 3.963 -3.226 20.204 1.00 1.00 H new ATOM 0 HB3 SER A 161 2.442 -3.797 20.861 1.00 1.00 H new ATOM 0 HG SER A 161 4.429 -5.211 22.025 1.00 1.00 H new TER 2490 SER A 161