USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 785 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 30 GLN : amide:sc= 0.484 K(o=3.5,f=-4.5!) USER MOD Set 1.2: A 31 GLN : amide:sc= 2.03 K(o=3.5,f=-2.3) USER MOD Set 1.3: A 53 LYS NZ :NH3+ 178:sc= 1.02 (180deg=0) USER MOD Single : A 1 SER N :NH3+ -95:sc= 0.0227 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00807 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc=0.000443 USER MOD Single : A 10 ASN : amide:sc= 0.115 K(o=0.12,f=-5.3!) USER MOD Single : A 11 HIS : no HD1:sc= 0.992 K(o=0.99,f=-4.5!) USER MOD Single : A 20 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot -73:sc= 0.799 USER MOD Single : A 26 ASN : amide:sc=-0.00831 K(o=-0.0083,f=-0.89) USER MOD Single : A 27 SER OG : rot -130:sc= 0.0715 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 180:sc= -0.0967 (180deg=-0.0967) USER MOD Single : A 38 SER OG : rot 72:sc= 1.23 USER MOD Single : A 39 THR OG1 : rot -90:sc= 1.24 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 67:sc= 1.22 USER MOD Single : A 54 GLN : amide:sc= -0.0389 X(o=-0.039,f=-0.039) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0.00305 USER MOD Single : A 56 SER OG : rot 180:sc= 0.181 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0.154 USER MOD Single : A 63 LYS NZ :NH3+ -179:sc= 0.896 (180deg=0.895) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -170:sc= 0.632 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl 177:sc= 0 (180deg=-0.00819) USER MOD Single : A 81 TYR OH : rot 180:sc= 0.598 USER MOD Single : A 83 SER OG : rot 180:sc= 0.0144 USER MOD Single : A 85 SER OG : rot 180:sc= 0.329 USER MOD Single : A 86 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 87 GLN : amide:sc= 0.969 K(o=0.97,f=0) USER MOD Single : A 90 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= -0.0415 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0128 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 7.913 -17.625 -0.685 1.00 0.00 N ATOM 2 CA SER A 1 8.640 -16.692 -1.590 1.00 0.00 C ATOM 3 C SER A 1 9.110 -15.430 -0.856 1.00 0.00 C ATOM 4 O SER A 1 8.475 -15.000 0.107 1.00 0.00 O ATOM 5 CB SER A 1 7.784 -16.315 -2.809 1.00 0.00 C ATOM 6 OG SER A 1 7.367 -17.501 -3.474 1.00 0.00 O ATOM 0 H1 SER A 1 8.574 -18.339 -0.318 1.00 0.00 H new ATOM 0 H2 SER A 1 7.505 -17.091 0.109 1.00 0.00 H new ATOM 0 H3 SER A 1 7.151 -18.098 -1.213 1.00 0.00 H new ATOM 0 HA SER A 1 9.526 -17.222 -1.941 1.00 0.00 H new ATOM 0 HB2 SER A 1 6.916 -15.737 -2.493 1.00 0.00 H new ATOM 0 HB3 SER A 1 8.357 -15.685 -3.489 1.00 0.00 H new ATOM 0 HG SER A 1 6.819 -17.265 -4.251 1.00 0.00 H new ATOM 14 N VAL A 2 10.219 -14.817 -1.303 1.00 0.00 N ATOM 15 CA VAL A 2 10.846 -13.640 -0.642 1.00 0.00 C ATOM 16 C VAL A 2 10.342 -12.279 -1.152 1.00 0.00 C ATOM 17 O VAL A 2 10.606 -11.252 -0.525 1.00 0.00 O ATOM 18 CB VAL A 2 12.388 -13.704 -0.703 1.00 0.00 C ATOM 19 CG1 VAL A 2 12.923 -14.943 0.026 1.00 0.00 C ATOM 20 CG2 VAL A 2 12.944 -13.699 -2.135 1.00 0.00 C ATOM 0 H VAL A 2 10.716 -15.121 -2.140 1.00 0.00 H new ATOM 0 HA VAL A 2 10.528 -13.707 0.398 1.00 0.00 H new ATOM 0 HB VAL A 2 12.730 -12.796 -0.206 1.00 0.00 H new ATOM 0 HG11 VAL A 2 14.011 -14.959 -0.035 1.00 0.00 H new ATOM 0 HG12 VAL A 2 12.618 -14.909 1.072 1.00 0.00 H new ATOM 0 HG13 VAL A 2 12.520 -15.842 -0.440 1.00 0.00 H new ATOM 0 HG21 VAL A 2 14.033 -13.746 -2.103 1.00 0.00 H new ATOM 0 HG22 VAL A 2 12.560 -14.563 -2.678 1.00 0.00 H new ATOM 0 HG23 VAL A 2 12.635 -12.785 -2.642 1.00 0.00 H new ATOM 30 N SER A 3 9.619 -12.251 -2.278 1.00 0.00 N ATOM 31 CA SER A 3 9.125 -11.022 -2.923 1.00 0.00 C ATOM 32 C SER A 3 8.053 -10.290 -2.098 1.00 0.00 C ATOM 33 O SER A 3 7.263 -10.914 -1.383 1.00 0.00 O ATOM 34 CB SER A 3 8.562 -11.342 -4.318 1.00 0.00 C ATOM 35 OG SER A 3 9.535 -12.015 -5.104 1.00 0.00 O ATOM 0 H SER A 3 9.354 -13.099 -2.779 1.00 0.00 H new ATOM 0 HA SER A 3 9.983 -10.354 -3.002 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.670 -11.962 -4.224 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.259 -10.420 -4.815 1.00 0.00 H new ATOM 0 HG SER A 3 9.161 -12.213 -5.988 1.00 0.00 H new ATOM 41 N ILE A 4 7.996 -8.960 -2.232 1.00 0.00 N ATOM 42 CA ILE A 4 6.999 -8.102 -1.571 1.00 0.00 C ATOM 43 C ILE A 4 5.639 -8.253 -2.286 1.00 0.00 C ATOM 44 O ILE A 4 5.573 -8.276 -3.517 1.00 0.00 O ATOM 45 CB ILE A 4 7.501 -6.633 -1.497 1.00 0.00 C ATOM 46 CG1 ILE A 4 8.595 -6.413 -0.421 1.00 0.00 C ATOM 47 CG2 ILE A 4 6.367 -5.644 -1.168 1.00 0.00 C ATOM 48 CD1 ILE A 4 9.917 -7.167 -0.619 1.00 0.00 C ATOM 0 H ILE A 4 8.652 -8.438 -2.813 1.00 0.00 H new ATOM 0 HA ILE A 4 6.856 -8.418 -0.538 1.00 0.00 H new ATOM 0 HB ILE A 4 7.909 -6.447 -2.490 1.00 0.00 H new ATOM 0 HG12 ILE A 4 8.815 -5.347 -0.373 1.00 0.00 H new ATOM 0 HG13 ILE A 4 8.183 -6.698 0.547 1.00 0.00 H new ATOM 0 HG21 ILE A 4 6.768 -4.631 -1.127 1.00 0.00 H new ATOM 0 HG22 ILE A 4 5.600 -5.700 -1.940 1.00 0.00 H new ATOM 0 HG23 ILE A 4 5.930 -5.900 -0.203 1.00 0.00 H new ATOM 0 HD11 ILE A 4 10.597 -6.929 0.199 1.00 0.00 H new ATOM 0 HD12 ILE A 4 9.726 -8.240 -0.631 1.00 0.00 H new ATOM 0 HD13 ILE A 4 10.368 -6.868 -1.565 1.00 0.00 H new ATOM 60 N LEU A 5 4.550 -8.362 -1.512 1.00 0.00 N ATOM 61 CA LEU A 5 3.203 -8.639 -2.034 1.00 0.00 C ATOM 62 C LEU A 5 2.552 -7.423 -2.730 1.00 0.00 C ATOM 63 O LEU A 5 1.818 -7.591 -3.708 1.00 0.00 O ATOM 64 CB LEU A 5 2.344 -9.161 -0.863 1.00 0.00 C ATOM 65 CG LEU A 5 0.916 -9.608 -1.236 1.00 0.00 C ATOM 66 CD1 LEU A 5 0.901 -10.765 -2.236 1.00 0.00 C ATOM 67 CD2 LEU A 5 0.179 -10.058 0.027 1.00 0.00 C ATOM 0 H LEU A 5 4.579 -8.260 -0.498 1.00 0.00 H new ATOM 0 HA LEU A 5 3.277 -9.392 -2.818 1.00 0.00 H new ATOM 0 HB2 LEU A 5 2.861 -10.003 -0.403 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.275 -8.378 -0.108 1.00 0.00 H new ATOM 0 HG LEU A 5 0.427 -8.752 -1.701 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -0.130 -11.037 -2.462 1.00 0.00 H new ATOM 0 HD12 LEU A 5 1.405 -10.460 -3.153 1.00 0.00 H new ATOM 0 HD13 LEU A 5 1.417 -11.624 -1.807 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -0.831 -10.374 -0.234 1.00 0.00 H new ATOM 0 HD22 LEU A 5 0.714 -10.891 0.483 1.00 0.00 H new ATOM 0 HD23 LEU A 5 0.128 -9.229 0.733 1.00 0.00 H new ATOM 79 N ARG A 6 2.819 -6.205 -2.237 1.00 0.00 N ATOM 80 CA ARG A 6 2.277 -4.940 -2.777 1.00 0.00 C ATOM 81 C ARG A 6 3.015 -4.487 -4.048 1.00 0.00 C ATOM 82 O ARG A 6 4.216 -4.719 -4.195 1.00 0.00 O ATOM 83 CB ARG A 6 2.304 -3.843 -1.698 1.00 0.00 C ATOM 84 CG ARG A 6 1.400 -4.169 -0.497 1.00 0.00 C ATOM 85 CD ARG A 6 1.409 -3.025 0.525 1.00 0.00 C ATOM 86 NE ARG A 6 0.579 -3.349 1.706 1.00 0.00 N ATOM 87 CZ ARG A 6 -0.721 -3.153 1.864 1.00 0.00 C ATOM 88 NH1 ARG A 6 -1.468 -2.633 0.929 1.00 0.00 N ATOM 89 NH2 ARG A 6 -1.302 -3.486 2.981 1.00 0.00 N ATOM 0 H ARG A 6 3.431 -6.064 -1.433 1.00 0.00 H new ATOM 0 HA ARG A 6 1.241 -5.122 -3.065 1.00 0.00 H new ATOM 0 HB2 ARG A 6 3.328 -3.706 -1.350 1.00 0.00 H new ATOM 0 HB3 ARG A 6 1.988 -2.898 -2.139 1.00 0.00 H new ATOM 0 HG2 ARG A 6 0.381 -4.345 -0.842 1.00 0.00 H new ATOM 0 HG3 ARG A 6 1.739 -5.089 -0.021 1.00 0.00 H new ATOM 0 HD2 ARG A 6 2.433 -2.826 0.842 1.00 0.00 H new ATOM 0 HD3 ARG A 6 1.038 -2.114 0.056 1.00 0.00 H new ATOM 0 HE ARG A 6 1.067 -3.775 2.494 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -1.054 -2.361 0.037 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -2.466 -2.498 1.090 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -0.755 -3.899 3.737 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -2.304 -3.334 3.100 1.00 0.00 H new ATOM 103 N SER A 7 2.298 -3.792 -4.936 1.00 0.00 N ATOM 104 CA SER A 7 2.827 -3.295 -6.224 1.00 0.00 C ATOM 105 C SER A 7 3.505 -1.915 -6.138 1.00 0.00 C ATOM 106 O SER A 7 4.156 -1.483 -7.093 1.00 0.00 O ATOM 107 CB SER A 7 1.703 -3.253 -7.270 1.00 0.00 C ATOM 108 OG SER A 7 1.081 -4.526 -7.407 1.00 0.00 O ATOM 0 H SER A 7 1.318 -3.552 -4.785 1.00 0.00 H new ATOM 0 HA SER A 7 3.605 -3.999 -6.519 1.00 0.00 H new ATOM 0 HB2 SER A 7 0.959 -2.511 -6.979 1.00 0.00 H new ATOM 0 HB3 SER A 7 2.109 -2.938 -8.231 1.00 0.00 H new ATOM 0 HG SER A 7 0.368 -4.471 -8.077 1.00 0.00 H new ATOM 114 N SER A 8 3.357 -1.206 -5.011 1.00 0.00 N ATOM 115 CA SER A 8 3.912 0.136 -4.773 1.00 0.00 C ATOM 116 C SER A 8 5.414 0.127 -4.441 1.00 0.00 C ATOM 117 O SER A 8 5.966 -0.871 -3.964 1.00 0.00 O ATOM 118 CB SER A 8 3.108 0.845 -3.673 1.00 0.00 C ATOM 119 OG SER A 8 3.034 0.051 -2.493 1.00 0.00 O ATOM 0 H SER A 8 2.831 -1.561 -4.213 1.00 0.00 H new ATOM 0 HA SER A 8 3.820 0.689 -5.708 1.00 0.00 H new ATOM 0 HB2 SER A 8 3.572 1.803 -3.441 1.00 0.00 H new ATOM 0 HB3 SER A 8 2.102 1.058 -4.035 1.00 0.00 H new ATOM 0 HG SER A 8 2.518 0.528 -1.810 1.00 0.00 H new ATOM 125 N VAL A 9 6.087 1.262 -4.685 1.00 0.00 N ATOM 126 CA VAL A 9 7.513 1.477 -4.371 1.00 0.00 C ATOM 127 C VAL A 9 7.675 2.010 -2.942 1.00 0.00 C ATOM 128 O VAL A 9 6.915 2.881 -2.509 1.00 0.00 O ATOM 129 CB VAL A 9 8.175 2.422 -5.402 1.00 0.00 C ATOM 130 CG1 VAL A 9 9.676 2.622 -5.142 1.00 0.00 C ATOM 131 CG2 VAL A 9 8.031 1.875 -6.829 1.00 0.00 C ATOM 0 H VAL A 9 5.648 2.076 -5.116 1.00 0.00 H new ATOM 0 HA VAL A 9 8.025 0.516 -4.433 1.00 0.00 H new ATOM 0 HB VAL A 9 7.657 3.375 -5.295 1.00 0.00 H new ATOM 0 HG11 VAL A 9 10.089 3.293 -5.895 1.00 0.00 H new ATOM 0 HG12 VAL A 9 9.819 3.055 -4.152 1.00 0.00 H new ATOM 0 HG13 VAL A 9 10.186 1.660 -5.195 1.00 0.00 H new ATOM 0 HG21 VAL A 9 8.506 2.560 -7.531 1.00 0.00 H new ATOM 0 HG22 VAL A 9 8.511 0.899 -6.895 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.974 1.777 -7.076 1.00 0.00 H new ATOM 141 N ASN A 10 8.683 1.522 -2.207 1.00 0.00 N ATOM 142 CA ASN A 10 9.010 1.997 -0.858 1.00 0.00 C ATOM 143 C ASN A 10 9.608 3.418 -0.910 1.00 0.00 C ATOM 144 O ASN A 10 10.648 3.638 -1.528 1.00 0.00 O ATOM 145 CB ASN A 10 9.957 0.965 -0.206 1.00 0.00 C ATOM 146 CG ASN A 10 10.376 1.293 1.222 1.00 0.00 C ATOM 147 OD1 ASN A 10 10.112 2.359 1.759 1.00 0.00 O ATOM 148 ND2 ASN A 10 11.074 0.393 1.874 1.00 0.00 N ATOM 0 H ASN A 10 9.300 0.779 -2.536 1.00 0.00 H new ATOM 0 HA ASN A 10 8.112 2.078 -0.245 1.00 0.00 H new ATOM 0 HB2 ASN A 10 9.468 -0.009 -0.211 1.00 0.00 H new ATOM 0 HB3 ASN A 10 10.853 0.876 -0.821 1.00 0.00 H new ATOM 0 HD21 ASN A 10 11.393 0.585 2.824 1.00 0.00 H new ATOM 0 HD22 ASN A 10 11.297 -0.498 1.431 1.00 0.00 H new ATOM 155 N HIS A 11 8.996 4.388 -0.224 1.00 0.00 N ATOM 156 CA HIS A 11 9.462 5.786 -0.217 1.00 0.00 C ATOM 157 C HIS A 11 10.847 5.972 0.430 1.00 0.00 C ATOM 158 O HIS A 11 11.597 6.863 0.029 1.00 0.00 O ATOM 159 CB HIS A 11 8.381 6.676 0.418 1.00 0.00 C ATOM 160 CG HIS A 11 8.092 6.369 1.869 1.00 0.00 C ATOM 161 ND1 HIS A 11 8.886 6.755 2.951 1.00 0.00 N ATOM 162 CD2 HIS A 11 7.021 5.666 2.334 1.00 0.00 C ATOM 163 CE1 HIS A 11 8.280 6.266 4.047 1.00 0.00 C ATOM 164 NE2 HIS A 11 7.159 5.609 3.704 1.00 0.00 N ATOM 0 H HIS A 11 8.163 4.230 0.343 1.00 0.00 H new ATOM 0 HA HIS A 11 9.612 6.097 -1.251 1.00 0.00 H new ATOM 0 HB2 HIS A 11 8.690 7.718 0.334 1.00 0.00 H new ATOM 0 HB3 HIS A 11 7.459 6.570 -0.154 1.00 0.00 H new ATOM 0 HD2 HIS A 11 6.223 5.238 1.746 1.00 0.00 H new ATOM 0 HE1 HIS A 11 8.642 6.384 5.058 1.00 0.00 H new ATOM 0 HE2 HIS A 11 6.518 5.146 4.349 1.00 0.00 H new ATOM 172 N ARG A 12 11.259 5.072 1.335 1.00 0.00 N ATOM 173 CA ARG A 12 12.636 5.036 1.867 1.00 0.00 C ATOM 174 C ARG A 12 13.643 4.620 0.793 1.00 0.00 C ATOM 175 O ARG A 12 14.746 5.156 0.775 1.00 0.00 O ATOM 176 CB ARG A 12 12.676 4.138 3.125 1.00 0.00 C ATOM 177 CG ARG A 12 13.825 4.481 4.090 1.00 0.00 C ATOM 178 CD ARG A 12 15.199 3.880 3.740 1.00 0.00 C ATOM 179 NE ARG A 12 16.288 4.657 4.365 1.00 0.00 N ATOM 180 CZ ARG A 12 16.789 5.812 3.952 1.00 0.00 C ATOM 181 NH1 ARG A 12 16.465 6.342 2.808 1.00 0.00 N ATOM 182 NH2 ARG A 12 17.621 6.478 4.696 1.00 0.00 N ATOM 0 H ARG A 12 10.651 4.349 1.720 1.00 0.00 H new ATOM 0 HA ARG A 12 12.937 6.039 2.168 1.00 0.00 H new ATOM 0 HB2 ARG A 12 11.728 4.228 3.656 1.00 0.00 H new ATOM 0 HB3 ARG A 12 12.771 3.097 2.815 1.00 0.00 H new ATOM 0 HG2 ARG A 12 13.925 5.565 4.134 1.00 0.00 H new ATOM 0 HG3 ARG A 12 13.547 4.145 5.089 1.00 0.00 H new ATOM 0 HD2 ARG A 12 15.245 2.845 4.079 1.00 0.00 H new ATOM 0 HD3 ARG A 12 15.330 3.868 2.658 1.00 0.00 H new ATOM 0 HE ARG A 12 16.701 4.260 5.209 1.00 0.00 H new ATOM 0 HH11 ARG A 12 15.804 5.866 2.194 1.00 0.00 H new ATOM 0 HH12 ARG A 12 16.872 7.233 2.525 1.00 0.00 H new ATOM 0 HH21 ARG A 12 17.895 6.113 5.608 1.00 0.00 H new ATOM 0 HH22 ARG A 12 18.000 7.366 4.368 1.00 0.00 H new ATOM 196 N GLU A 13 13.255 3.748 -0.138 1.00 0.00 N ATOM 197 CA GLU A 13 14.083 3.363 -1.294 1.00 0.00 C ATOM 198 C GLU A 13 14.170 4.498 -2.331 1.00 0.00 C ATOM 199 O GLU A 13 15.230 4.722 -2.909 1.00 0.00 O ATOM 200 CB GLU A 13 13.545 2.055 -1.900 1.00 0.00 C ATOM 201 CG GLU A 13 14.498 1.446 -2.935 1.00 0.00 C ATOM 202 CD GLU A 13 13.988 0.074 -3.418 1.00 0.00 C ATOM 203 OE1 GLU A 13 14.310 -0.960 -2.783 1.00 0.00 O ATOM 204 OE2 GLU A 13 13.261 0.018 -4.439 1.00 0.00 O ATOM 0 H GLU A 13 12.348 3.281 -0.115 1.00 0.00 H new ATOM 0 HA GLU A 13 15.104 3.186 -0.957 1.00 0.00 H new ATOM 0 HB2 GLU A 13 13.373 1.333 -1.101 1.00 0.00 H new ATOM 0 HB3 GLU A 13 12.580 2.247 -2.369 1.00 0.00 H new ATOM 0 HG2 GLU A 13 14.596 2.121 -3.785 1.00 0.00 H new ATOM 0 HG3 GLU A 13 15.491 1.336 -2.499 1.00 0.00 H new ATOM 211 N VAL A 14 13.101 5.292 -2.495 1.00 0.00 N ATOM 212 CA VAL A 14 13.145 6.543 -3.291 1.00 0.00 C ATOM 213 C VAL A 14 14.105 7.559 -2.653 1.00 0.00 C ATOM 214 O VAL A 14 14.896 8.185 -3.357 1.00 0.00 O ATOM 215 CB VAL A 14 11.744 7.169 -3.459 1.00 0.00 C ATOM 216 CG1 VAL A 14 11.761 8.399 -4.376 1.00 0.00 C ATOM 217 CG2 VAL A 14 10.740 6.179 -4.065 1.00 0.00 C ATOM 0 H VAL A 14 12.187 5.094 -2.087 1.00 0.00 H new ATOM 0 HA VAL A 14 13.513 6.280 -4.283 1.00 0.00 H new ATOM 0 HB VAL A 14 11.442 7.453 -2.451 1.00 0.00 H new ATOM 0 HG11 VAL A 14 10.752 8.803 -4.462 1.00 0.00 H new ATOM 0 HG12 VAL A 14 12.421 9.158 -3.955 1.00 0.00 H new ATOM 0 HG13 VAL A 14 12.122 8.112 -5.363 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.768 6.662 -4.165 1.00 0.00 H new ATOM 0 HG22 VAL A 14 11.090 5.861 -5.047 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.648 5.310 -3.414 1.00 0.00 H new ATOM 227 N ASP A 15 14.101 7.691 -1.321 1.00 0.00 N ATOM 228 CA ASP A 15 15.096 8.514 -0.619 1.00 0.00 C ATOM 229 C ASP A 15 16.526 7.949 -0.747 1.00 0.00 C ATOM 230 O ASP A 15 17.468 8.715 -0.924 1.00 0.00 O ATOM 231 CB ASP A 15 14.695 8.698 0.848 1.00 0.00 C ATOM 232 CG ASP A 15 15.718 9.586 1.561 1.00 0.00 C ATOM 233 OD1 ASP A 15 15.654 10.827 1.411 1.00 0.00 O ATOM 234 OD2 ASP A 15 16.642 9.046 2.214 1.00 0.00 O ATOM 0 H ASP A 15 13.422 7.240 -0.708 1.00 0.00 H new ATOM 0 HA ASP A 15 15.110 9.492 -1.101 1.00 0.00 H new ATOM 0 HB2 ASP A 15 13.704 9.148 0.909 1.00 0.00 H new ATOM 0 HB3 ASP A 15 14.635 7.728 1.342 1.00 0.00 H new ATOM 239 N GLU A 16 16.707 6.625 -0.734 1.00 0.00 N ATOM 240 CA GLU A 16 18.011 5.995 -1.001 1.00 0.00 C ATOM 241 C GLU A 16 18.489 6.258 -2.438 1.00 0.00 C ATOM 242 O GLU A 16 19.665 6.553 -2.643 1.00 0.00 O ATOM 243 CB GLU A 16 17.943 4.487 -0.710 1.00 0.00 C ATOM 244 CG GLU A 16 19.250 3.770 -1.066 1.00 0.00 C ATOM 245 CD GLU A 16 19.220 2.299 -0.606 1.00 0.00 C ATOM 246 OE1 GLU A 16 19.584 2.017 0.561 1.00 0.00 O ATOM 247 OE2 GLU A 16 18.845 1.412 -1.413 1.00 0.00 O ATOM 0 H GLU A 16 15.959 5.959 -0.539 1.00 0.00 H new ATOM 0 HA GLU A 16 18.744 6.447 -0.333 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.721 4.332 0.346 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.123 4.046 -1.276 1.00 0.00 H new ATOM 0 HG2 GLU A 16 19.411 3.814 -2.143 1.00 0.00 H new ATOM 0 HG3 GLU A 16 20.089 4.284 -0.597 1.00 0.00 H new ATOM 254 N ALA A 17 17.596 6.212 -3.431 1.00 0.00 N ATOM 255 CA ALA A 17 17.935 6.551 -4.811 1.00 0.00 C ATOM 256 C ALA A 17 18.355 8.030 -4.942 1.00 0.00 C ATOM 257 O ALA A 17 19.341 8.339 -5.613 1.00 0.00 O ATOM 258 CB ALA A 17 16.740 6.211 -5.711 1.00 0.00 C ATOM 0 H ALA A 17 16.622 5.939 -3.299 1.00 0.00 H new ATOM 0 HA ALA A 17 18.796 5.963 -5.129 1.00 0.00 H new ATOM 0 HB1 ALA A 17 16.981 6.460 -6.745 1.00 0.00 H new ATOM 0 HB2 ALA A 17 16.519 5.146 -5.636 1.00 0.00 H new ATOM 0 HB3 ALA A 17 15.870 6.785 -5.393 1.00 0.00 H new ATOM 264 N ILE A 18 17.666 8.935 -4.230 1.00 0.00 N ATOM 265 CA ILE A 18 18.080 10.339 -4.076 1.00 0.00 C ATOM 266 C ILE A 18 19.473 10.436 -3.442 1.00 0.00 C ATOM 267 O ILE A 18 20.315 11.160 -3.962 1.00 0.00 O ATOM 268 CB ILE A 18 17.009 11.122 -3.277 1.00 0.00 C ATOM 269 CG1 ILE A 18 15.814 11.416 -4.203 1.00 0.00 C ATOM 270 CG2 ILE A 18 17.533 12.433 -2.653 1.00 0.00 C ATOM 271 CD1 ILE A 18 14.516 11.684 -3.441 1.00 0.00 C ATOM 0 H ILE A 18 16.799 8.712 -3.741 1.00 0.00 H new ATOM 0 HA ILE A 18 18.157 10.799 -5.061 1.00 0.00 H new ATOM 0 HB ILE A 18 16.709 10.493 -2.439 1.00 0.00 H new ATOM 0 HG12 ILE A 18 16.048 12.280 -4.825 1.00 0.00 H new ATOM 0 HG13 ILE A 18 15.666 10.570 -4.875 1.00 0.00 H new ATOM 0 HG21 ILE A 18 16.726 12.925 -2.110 1.00 0.00 H new ATOM 0 HG22 ILE A 18 18.349 12.208 -1.966 1.00 0.00 H new ATOM 0 HG23 ILE A 18 17.894 13.093 -3.442 1.00 0.00 H new ATOM 0 HD11 ILE A 18 13.713 11.884 -4.150 1.00 0.00 H new ATOM 0 HD12 ILE A 18 14.260 10.812 -2.840 1.00 0.00 H new ATOM 0 HD13 ILE A 18 14.648 12.548 -2.789 1.00 0.00 H new ATOM 283 N ASP A 19 19.754 9.689 -2.375 1.00 0.00 N ATOM 284 CA ASP A 19 21.064 9.701 -1.707 1.00 0.00 C ATOM 285 C ASP A 19 22.190 9.145 -2.607 1.00 0.00 C ATOM 286 O ASP A 19 23.296 9.686 -2.640 1.00 0.00 O ATOM 287 CB ASP A 19 20.961 8.938 -0.375 1.00 0.00 C ATOM 288 CG ASP A 19 21.802 9.602 0.720 1.00 0.00 C ATOM 289 OD1 ASP A 19 21.325 10.611 1.292 1.00 0.00 O ATOM 290 OD2 ASP A 19 22.907 9.103 1.026 1.00 0.00 O ATOM 0 H ASP A 19 19.081 9.055 -1.945 1.00 0.00 H new ATOM 0 HA ASP A 19 21.338 10.736 -1.502 1.00 0.00 H new ATOM 0 HB2 ASP A 19 19.919 8.895 -0.059 1.00 0.00 H new ATOM 0 HB3 ASP A 19 21.293 7.910 -0.517 1.00 0.00 H new ATOM 295 N ASN A 20 21.895 8.122 -3.415 1.00 0.00 N ATOM 296 CA ASN A 20 22.816 7.578 -4.415 1.00 0.00 C ATOM 297 C ASN A 20 23.113 8.603 -5.532 1.00 0.00 C ATOM 298 O ASN A 20 24.274 8.838 -5.859 1.00 0.00 O ATOM 299 CB ASN A 20 22.218 6.265 -4.956 1.00 0.00 C ATOM 300 CG ASN A 20 23.169 5.475 -5.852 1.00 0.00 C ATOM 301 OD1 ASN A 20 24.369 5.704 -5.918 1.00 0.00 O ATOM 302 ND2 ASN A 20 22.660 4.491 -6.564 1.00 0.00 N ATOM 0 H ASN A 20 20.995 7.642 -3.391 1.00 0.00 H new ATOM 0 HA ASN A 20 23.782 7.364 -3.957 1.00 0.00 H new ATOM 0 HB2 ASN A 20 21.922 5.638 -4.115 1.00 0.00 H new ATOM 0 HB3 ASN A 20 21.312 6.494 -5.517 1.00 0.00 H new ATOM 0 HD21 ASN A 20 23.265 3.929 -7.163 1.00 0.00 H new ATOM 0 HD22 ASN A 20 21.661 4.291 -6.517 1.00 0.00 H new ATOM 309 N ILE A 21 22.083 9.289 -6.052 1.00 0.00 N ATOM 310 CA ILE A 21 22.249 10.400 -7.012 1.00 0.00 C ATOM 311 C ILE A 21 23.065 11.544 -6.396 1.00 0.00 C ATOM 312 O ILE A 21 23.983 12.066 -7.026 1.00 0.00 O ATOM 313 CB ILE A 21 20.860 10.881 -7.511 1.00 0.00 C ATOM 314 CG1 ILE A 21 20.314 9.887 -8.560 1.00 0.00 C ATOM 315 CG2 ILE A 21 20.940 12.297 -8.110 1.00 0.00 C ATOM 316 CD1 ILE A 21 18.813 10.043 -8.836 1.00 0.00 C ATOM 0 H ILE A 21 21.109 9.091 -5.821 1.00 0.00 H new ATOM 0 HA ILE A 21 22.811 10.041 -7.874 1.00 0.00 H new ATOM 0 HB ILE A 21 20.182 10.919 -6.658 1.00 0.00 H new ATOM 0 HG12 ILE A 21 20.862 10.020 -9.493 1.00 0.00 H new ATOM 0 HG13 ILE A 21 20.508 8.870 -8.219 1.00 0.00 H new ATOM 0 HG21 ILE A 21 19.951 12.605 -8.450 1.00 0.00 H new ATOM 0 HG22 ILE A 21 21.296 12.994 -7.351 1.00 0.00 H new ATOM 0 HG23 ILE A 21 21.630 12.297 -8.954 1.00 0.00 H new ATOM 0 HD11 ILE A 21 18.502 9.312 -9.582 1.00 0.00 H new ATOM 0 HD12 ILE A 21 18.255 9.880 -7.914 1.00 0.00 H new ATOM 0 HD13 ILE A 21 18.614 11.048 -9.208 1.00 0.00 H new ATOM 328 N LEU A 22 22.770 11.908 -5.149 1.00 0.00 N ATOM 329 CA LEU A 22 23.444 12.978 -4.415 1.00 0.00 C ATOM 330 C LEU A 22 24.952 12.706 -4.254 1.00 0.00 C ATOM 331 O LEU A 22 25.772 13.604 -4.457 1.00 0.00 O ATOM 332 CB LEU A 22 22.714 13.084 -3.065 1.00 0.00 C ATOM 333 CG LEU A 22 23.242 14.156 -2.112 1.00 0.00 C ATOM 334 CD1 LEU A 22 22.950 15.548 -2.665 1.00 0.00 C ATOM 335 CD2 LEU A 22 22.544 14.014 -0.762 1.00 0.00 C ATOM 0 H LEU A 22 22.035 11.454 -4.606 1.00 0.00 H new ATOM 0 HA LEU A 22 23.395 13.923 -4.956 1.00 0.00 H new ATOM 0 HB2 LEU A 22 21.659 13.281 -3.257 1.00 0.00 H new ATOM 0 HB3 LEU A 22 22.771 12.118 -2.564 1.00 0.00 H new ATOM 0 HG LEU A 22 24.319 14.028 -2.002 1.00 0.00 H new ATOM 0 HD11 LEU A 22 23.332 16.301 -1.975 1.00 0.00 H new ATOM 0 HD12 LEU A 22 23.436 15.664 -3.634 1.00 0.00 H new ATOM 0 HD13 LEU A 22 21.874 15.675 -2.781 1.00 0.00 H new ATOM 0 HD21 LEU A 22 22.917 14.776 -0.078 1.00 0.00 H new ATOM 0 HD22 LEU A 22 21.469 14.138 -0.893 1.00 0.00 H new ATOM 0 HD23 LEU A 22 22.747 13.026 -0.350 1.00 0.00 H new ATOM 347 N ARG A 23 25.320 11.455 -3.952 1.00 0.00 N ATOM 348 CA ARG A 23 26.724 11.009 -3.859 1.00 0.00 C ATOM 349 C ARG A 23 27.397 10.869 -5.231 1.00 0.00 C ATOM 350 O ARG A 23 28.529 11.316 -5.390 1.00 0.00 O ATOM 351 CB ARG A 23 26.782 9.690 -3.074 1.00 0.00 C ATOM 352 CG ARG A 23 26.432 9.884 -1.589 1.00 0.00 C ATOM 353 CD ARG A 23 26.301 8.535 -0.876 1.00 0.00 C ATOM 354 NE ARG A 23 25.592 8.696 0.404 1.00 0.00 N ATOM 355 CZ ARG A 23 26.070 8.806 1.625 1.00 0.00 C ATOM 356 NH1 ARG A 23 27.343 8.764 1.909 1.00 0.00 N ATOM 357 NH2 ARG A 23 25.218 8.979 2.587 1.00 0.00 N ATOM 0 H ARG A 23 24.647 10.712 -3.762 1.00 0.00 H new ATOM 0 HA ARG A 23 27.287 11.778 -3.330 1.00 0.00 H new ATOM 0 HB2 ARG A 23 26.091 8.974 -3.518 1.00 0.00 H new ATOM 0 HB3 ARG A 23 27.781 9.263 -3.158 1.00 0.00 H new ATOM 0 HG2 ARG A 23 27.204 10.482 -1.105 1.00 0.00 H new ATOM 0 HG3 ARG A 23 25.498 10.438 -1.501 1.00 0.00 H new ATOM 0 HD2 ARG A 23 25.762 7.832 -1.511 1.00 0.00 H new ATOM 0 HD3 ARG A 23 27.290 8.112 -0.700 1.00 0.00 H new ATOM 0 HE ARG A 23 24.575 8.727 0.334 1.00 0.00 H new ATOM 0 HH11 ARG A 23 28.028 8.640 1.164 1.00 0.00 H new ATOM 0 HH12 ARG A 23 27.653 8.855 2.876 1.00 0.00 H new ATOM 0 HH21 ARG A 23 24.220 9.025 2.382 1.00 0.00 H new ATOM 0 HH22 ARG A 23 25.546 9.069 3.549 1.00 0.00 H new ATOM 371 N TYR A 24 26.692 10.345 -6.241 1.00 0.00 N ATOM 372 CA TYR A 24 27.187 10.229 -7.625 1.00 0.00 C ATOM 373 C TYR A 24 27.494 11.599 -8.262 1.00 0.00 C ATOM 374 O TYR A 24 28.526 11.772 -8.913 1.00 0.00 O ATOM 375 CB TYR A 24 26.137 9.471 -8.451 1.00 0.00 C ATOM 376 CG TYR A 24 26.409 9.395 -9.944 1.00 0.00 C ATOM 377 CD1 TYR A 24 27.518 8.669 -10.426 1.00 0.00 C ATOM 378 CD2 TYR A 24 25.539 10.033 -10.854 1.00 0.00 C ATOM 379 CE1 TYR A 24 27.759 8.587 -11.811 1.00 0.00 C ATOM 380 CE2 TYR A 24 25.772 9.943 -12.241 1.00 0.00 C ATOM 381 CZ TYR A 24 26.888 9.219 -12.723 1.00 0.00 C ATOM 382 OH TYR A 24 27.123 9.113 -14.062 1.00 0.00 O ATOM 0 H TYR A 24 25.746 9.983 -6.121 1.00 0.00 H new ATOM 0 HA TYR A 24 28.131 9.684 -7.611 1.00 0.00 H new ATOM 0 HB2 TYR A 24 26.058 8.456 -8.062 1.00 0.00 H new ATOM 0 HB3 TYR A 24 25.168 9.947 -8.300 1.00 0.00 H new ATOM 0 HD1 TYR A 24 28.183 8.176 -9.732 1.00 0.00 H new ATOM 0 HD2 TYR A 24 24.692 10.592 -10.486 1.00 0.00 H new ATOM 0 HE1 TYR A 24 28.614 8.038 -12.176 1.00 0.00 H new ATOM 0 HE2 TYR A 24 25.100 10.426 -12.935 1.00 0.00 H new ATOM 0 HH TYR A 24 26.432 9.603 -14.555 1.00 0.00 H new ATOM 392 N THR A 25 26.635 12.595 -8.012 1.00 0.00 N ATOM 393 CA THR A 25 26.856 13.994 -8.432 1.00 0.00 C ATOM 394 C THR A 25 27.806 14.773 -7.507 1.00 0.00 C ATOM 395 O THR A 25 28.199 15.890 -7.846 1.00 0.00 O ATOM 396 CB THR A 25 25.532 14.765 -8.574 1.00 0.00 C ATOM 397 OG1 THR A 25 24.838 14.796 -7.347 1.00 0.00 O ATOM 398 CG2 THR A 25 24.598 14.168 -9.624 1.00 0.00 C ATOM 0 H THR A 25 25.759 12.457 -7.509 1.00 0.00 H new ATOM 0 HA THR A 25 27.338 13.920 -9.407 1.00 0.00 H new ATOM 0 HB THR A 25 25.813 15.769 -8.891 1.00 0.00 H new ATOM 0 HG1 THR A 25 24.457 13.912 -7.164 1.00 0.00 H new ATOM 0 HG21 THR A 25 23.683 14.758 -9.675 1.00 0.00 H new ATOM 0 HG22 THR A 25 25.090 14.178 -10.596 1.00 0.00 H new ATOM 0 HG23 THR A 25 24.353 13.141 -9.352 1.00 0.00 H new ATOM 406 N ASN A 26 28.196 14.187 -6.365 1.00 0.00 N ATOM 407 CA ASN A 26 29.034 14.797 -5.323 1.00 0.00 C ATOM 408 C ASN A 26 28.519 16.182 -4.878 1.00 0.00 C ATOM 409 O ASN A 26 29.275 17.154 -4.782 1.00 0.00 O ATOM 410 CB ASN A 26 30.517 14.741 -5.753 1.00 0.00 C ATOM 411 CG ASN A 26 31.492 15.020 -4.615 1.00 0.00 C ATOM 412 OD1 ASN A 26 31.160 15.005 -3.437 1.00 0.00 O ATOM 413 ND2 ASN A 26 32.748 15.255 -4.929 1.00 0.00 N ATOM 0 H ASN A 26 27.923 13.232 -6.133 1.00 0.00 H new ATOM 0 HA ASN A 26 28.961 14.212 -4.406 1.00 0.00 H new ATOM 0 HB2 ASN A 26 30.729 13.756 -6.169 1.00 0.00 H new ATOM 0 HB3 ASN A 26 30.684 15.466 -6.549 1.00 0.00 H new ATOM 0 HD21 ASN A 26 33.435 15.423 -4.194 1.00 0.00 H new ATOM 0 HD22 ASN A 26 33.035 15.270 -5.908 1.00 0.00 H new ATOM 420 N SER A 27 27.201 16.270 -4.672 1.00 0.00 N ATOM 421 CA SER A 27 26.486 17.538 -4.459 1.00 0.00 C ATOM 422 C SER A 27 25.793 17.632 -3.084 1.00 0.00 C ATOM 423 O SER A 27 25.925 16.748 -2.235 1.00 0.00 O ATOM 424 CB SER A 27 25.498 17.741 -5.618 1.00 0.00 C ATOM 425 OG SER A 27 25.169 19.119 -5.721 1.00 0.00 O ATOM 0 H SER A 27 26.590 15.453 -4.648 1.00 0.00 H new ATOM 0 HA SER A 27 27.218 18.346 -4.450 1.00 0.00 H new ATOM 0 HB2 SER A 27 25.938 17.390 -6.551 1.00 0.00 H new ATOM 0 HB3 SER A 27 24.596 17.152 -5.449 1.00 0.00 H new ATOM 0 HG SER A 27 24.195 19.221 -5.761 1.00 0.00 H new ATOM 431 N THR A 28 25.054 18.725 -2.874 1.00 0.00 N ATOM 432 CA THR A 28 24.161 18.949 -1.719 1.00 0.00 C ATOM 433 C THR A 28 22.701 18.992 -2.183 1.00 0.00 C ATOM 434 O THR A 28 22.400 19.481 -3.273 1.00 0.00 O ATOM 435 CB THR A 28 24.567 20.210 -0.934 1.00 0.00 C ATOM 436 OG1 THR A 28 23.622 20.475 0.080 1.00 0.00 O ATOM 437 CG2 THR A 28 24.656 21.481 -1.781 1.00 0.00 C ATOM 0 H THR A 28 25.057 19.511 -3.524 1.00 0.00 H new ATOM 0 HA THR A 28 24.263 18.113 -1.027 1.00 0.00 H new ATOM 0 HB THR A 28 25.559 19.984 -0.543 1.00 0.00 H new ATOM 0 HG1 THR A 28 23.889 21.277 0.575 1.00 0.00 H new ATOM 0 HG21 THR A 28 24.948 22.320 -1.149 1.00 0.00 H new ATOM 0 HG22 THR A 28 25.399 21.343 -2.567 1.00 0.00 H new ATOM 0 HG23 THR A 28 23.685 21.687 -2.232 1.00 0.00 H new ATOM 445 N GLU A 29 21.756 18.490 -1.385 1.00 0.00 N ATOM 446 CA GLU A 29 20.368 18.334 -1.835 1.00 0.00 C ATOM 447 C GLU A 29 19.655 19.670 -2.107 1.00 0.00 C ATOM 448 O GLU A 29 18.776 19.707 -2.962 1.00 0.00 O ATOM 449 CB GLU A 29 19.565 17.361 -0.951 1.00 0.00 C ATOM 450 CG GLU A 29 19.636 17.610 0.563 1.00 0.00 C ATOM 451 CD GLU A 29 20.757 16.763 1.197 1.00 0.00 C ATOM 452 OE1 GLU A 29 21.920 17.235 1.224 1.00 0.00 O ATOM 453 OE2 GLU A 29 20.468 15.619 1.629 1.00 0.00 O ATOM 0 H GLU A 29 21.924 18.185 -0.426 1.00 0.00 H new ATOM 0 HA GLU A 29 20.422 17.857 -2.814 1.00 0.00 H new ATOM 0 HB2 GLU A 29 18.520 17.402 -1.257 1.00 0.00 H new ATOM 0 HB3 GLU A 29 19.916 16.348 -1.149 1.00 0.00 H new ATOM 0 HG2 GLU A 29 19.818 18.667 0.756 1.00 0.00 H new ATOM 0 HG3 GLU A 29 18.680 17.362 1.024 1.00 0.00 H new ATOM 460 N GLN A 30 20.081 20.792 -1.515 1.00 0.00 N ATOM 461 CA GLN A 30 19.580 22.120 -1.922 1.00 0.00 C ATOM 462 C GLN A 30 19.980 22.495 -3.363 1.00 0.00 C ATOM 463 O GLN A 30 19.185 23.103 -4.083 1.00 0.00 O ATOM 464 CB GLN A 30 19.938 23.195 -0.874 1.00 0.00 C ATOM 465 CG GLN A 30 21.432 23.450 -0.584 1.00 0.00 C ATOM 466 CD GLN A 30 22.145 24.440 -1.513 1.00 0.00 C ATOM 467 OE1 GLN A 30 21.687 24.817 -2.582 1.00 0.00 O ATOM 468 NE2 GLN A 30 23.327 24.885 -1.145 1.00 0.00 N ATOM 0 H GLN A 30 20.765 20.813 -0.759 1.00 0.00 H new ATOM 0 HA GLN A 30 18.492 22.067 -1.948 1.00 0.00 H new ATOM 0 HB2 GLN A 30 19.494 24.137 -1.196 1.00 0.00 H new ATOM 0 HB3 GLN A 30 19.457 22.920 0.065 1.00 0.00 H new ATOM 0 HG2 GLN A 30 21.525 23.814 0.439 1.00 0.00 H new ATOM 0 HG3 GLN A 30 21.958 22.496 -0.632 1.00 0.00 H new ATOM 0 HE21 GLN A 30 23.731 24.586 -0.258 1.00 0.00 H new ATOM 0 HE22 GLN A 30 23.839 25.530 -1.747 1.00 0.00 H new ATOM 477 N GLN A 31 21.150 22.047 -3.841 1.00 0.00 N ATOM 478 CA GLN A 31 21.527 22.177 -5.255 1.00 0.00 C ATOM 479 C GLN A 31 20.745 21.209 -6.144 1.00 0.00 C ATOM 480 O GLN A 31 20.360 21.580 -7.248 1.00 0.00 O ATOM 481 CB GLN A 31 23.047 22.012 -5.442 1.00 0.00 C ATOM 482 CG GLN A 31 23.856 23.228 -4.963 1.00 0.00 C ATOM 483 CD GLN A 31 23.537 24.472 -5.789 1.00 0.00 C ATOM 484 OE1 GLN A 31 24.027 24.647 -6.898 1.00 0.00 O ATOM 485 NE2 GLN A 31 22.670 25.341 -5.316 1.00 0.00 N ATOM 0 H GLN A 31 21.855 21.589 -3.264 1.00 0.00 H new ATOM 0 HA GLN A 31 21.261 23.186 -5.571 1.00 0.00 H new ATOM 0 HB2 GLN A 31 23.379 21.127 -4.899 1.00 0.00 H new ATOM 0 HB3 GLN A 31 23.259 21.836 -6.497 1.00 0.00 H new ATOM 0 HG2 GLN A 31 23.637 23.421 -3.913 1.00 0.00 H new ATOM 0 HG3 GLN A 31 24.921 23.008 -5.031 1.00 0.00 H new ATOM 0 HE21 GLN A 31 22.259 25.200 -4.393 1.00 0.00 H new ATOM 0 HE22 GLN A 31 22.409 26.155 -5.872 1.00 0.00 H new ATOM 494 N PHE A 32 20.429 20.004 -5.659 1.00 0.00 N ATOM 495 CA PHE A 32 19.531 19.079 -6.366 1.00 0.00 C ATOM 496 C PHE A 32 18.101 19.651 -6.469 1.00 0.00 C ATOM 497 O PHE A 32 17.495 19.572 -7.535 1.00 0.00 O ATOM 498 CB PHE A 32 19.623 17.700 -5.683 1.00 0.00 C ATOM 499 CG PHE A 32 19.029 16.479 -6.374 1.00 0.00 C ATOM 500 CD1 PHE A 32 18.516 16.513 -7.688 1.00 0.00 C ATOM 501 CD2 PHE A 32 19.030 15.256 -5.674 1.00 0.00 C ATOM 502 CE1 PHE A 32 17.966 15.356 -8.269 1.00 0.00 C ATOM 503 CE2 PHE A 32 18.482 14.099 -6.257 1.00 0.00 C ATOM 504 CZ PHE A 32 17.936 14.151 -7.549 1.00 0.00 C ATOM 0 H PHE A 32 20.784 19.643 -4.774 1.00 0.00 H new ATOM 0 HA PHE A 32 19.841 18.952 -7.403 1.00 0.00 H new ATOM 0 HB2 PHE A 32 20.678 17.493 -5.505 1.00 0.00 H new ATOM 0 HB3 PHE A 32 19.146 17.787 -4.707 1.00 0.00 H new ATOM 0 HD1 PHE A 32 18.546 17.434 -8.252 1.00 0.00 H new ATOM 0 HD2 PHE A 32 19.455 15.207 -4.682 1.00 0.00 H new ATOM 0 HE1 PHE A 32 17.566 15.395 -9.271 1.00 0.00 H new ATOM 0 HE2 PHE A 32 18.481 13.168 -5.709 1.00 0.00 H new ATOM 0 HZ PHE A 32 17.495 13.268 -7.987 1.00 0.00 H new ATOM 514 N LEU A 33 17.598 20.345 -5.438 1.00 0.00 N ATOM 515 CA LEU A 33 16.330 21.099 -5.491 1.00 0.00 C ATOM 516 C LEU A 33 16.383 22.224 -6.523 1.00 0.00 C ATOM 517 O LEU A 33 15.498 22.315 -7.368 1.00 0.00 O ATOM 518 CB LEU A 33 15.979 21.565 -4.057 1.00 0.00 C ATOM 519 CG LEU A 33 14.635 22.284 -3.785 1.00 0.00 C ATOM 520 CD1 LEU A 33 14.603 23.731 -4.278 1.00 0.00 C ATOM 521 CD2 LEU A 33 13.453 21.534 -4.390 1.00 0.00 C ATOM 0 H LEU A 33 18.063 20.401 -4.532 1.00 0.00 H new ATOM 0 HA LEU A 33 15.519 20.459 -5.839 1.00 0.00 H new ATOM 0 HB2 LEU A 33 16.013 20.686 -3.413 1.00 0.00 H new ATOM 0 HB3 LEU A 33 16.776 22.232 -3.728 1.00 0.00 H new ATOM 0 HG LEU A 33 14.548 22.296 -2.699 1.00 0.00 H new ATOM 0 HD11 LEU A 33 13.631 24.171 -4.053 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.384 24.303 -3.778 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.771 23.752 -5.355 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.531 22.074 -4.175 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.585 21.457 -5.469 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.397 20.534 -3.959 1.00 0.00 H new ATOM 533 N GLU A 34 17.445 23.026 -6.519 1.00 0.00 N ATOM 534 CA GLU A 34 17.628 24.110 -7.496 1.00 0.00 C ATOM 535 C GLU A 34 17.746 23.584 -8.937 1.00 0.00 C ATOM 536 O GLU A 34 17.138 24.145 -9.850 1.00 0.00 O ATOM 537 CB GLU A 34 18.840 24.961 -7.070 1.00 0.00 C ATOM 538 CG GLU A 34 19.030 26.216 -7.929 1.00 0.00 C ATOM 539 CD GLU A 34 20.027 27.191 -7.271 1.00 0.00 C ATOM 540 OE1 GLU A 34 21.244 26.888 -7.212 1.00 0.00 O ATOM 541 OE2 GLU A 34 19.597 28.275 -6.803 1.00 0.00 O ATOM 0 H GLU A 34 18.204 22.948 -5.842 1.00 0.00 H new ATOM 0 HA GLU A 34 16.740 24.743 -7.501 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.719 25.257 -6.028 1.00 0.00 H new ATOM 0 HB3 GLU A 34 19.741 24.351 -7.126 1.00 0.00 H new ATOM 0 HG2 GLU A 34 19.392 25.933 -8.918 1.00 0.00 H new ATOM 0 HG3 GLU A 34 18.070 26.713 -8.071 1.00 0.00 H new ATOM 548 N ALA A 35 18.442 22.465 -9.143 1.00 0.00 N ATOM 549 CA ALA A 35 18.559 21.808 -10.448 1.00 0.00 C ATOM 550 C ALA A 35 17.222 21.216 -10.917 1.00 0.00 C ATOM 551 O ALA A 35 16.833 21.407 -12.067 1.00 0.00 O ATOM 552 CB ALA A 35 19.664 20.743 -10.365 1.00 0.00 C ATOM 0 H ALA A 35 18.947 21.983 -8.400 1.00 0.00 H new ATOM 0 HA ALA A 35 18.831 22.549 -11.199 1.00 0.00 H new ATOM 0 HB1 ALA A 35 19.763 20.245 -11.330 1.00 0.00 H new ATOM 0 HB2 ALA A 35 20.609 21.219 -10.104 1.00 0.00 H new ATOM 0 HB3 ALA A 35 19.405 20.008 -9.602 1.00 0.00 H new ATOM 558 N MET A 36 16.471 20.548 -10.035 1.00 0.00 N ATOM 559 CA MET A 36 15.136 20.013 -10.350 1.00 0.00 C ATOM 560 C MET A 36 14.132 21.133 -10.638 1.00 0.00 C ATOM 561 O MET A 36 13.386 21.044 -11.608 1.00 0.00 O ATOM 562 CB MET A 36 14.650 19.111 -9.198 1.00 0.00 C ATOM 563 CG MET A 36 15.432 17.792 -9.135 1.00 0.00 C ATOM 564 SD MET A 36 14.988 16.569 -10.405 1.00 0.00 S ATOM 565 CE MET A 36 13.580 15.765 -9.603 1.00 0.00 C ATOM 0 H MET A 36 16.770 20.361 -9.078 1.00 0.00 H new ATOM 0 HA MET A 36 15.211 19.415 -11.258 1.00 0.00 H new ATOM 0 HB2 MET A 36 14.756 19.642 -8.252 1.00 0.00 H new ATOM 0 HB3 MET A 36 13.589 18.898 -9.327 1.00 0.00 H new ATOM 0 HG2 MET A 36 16.496 18.014 -9.223 1.00 0.00 H new ATOM 0 HG3 MET A 36 15.280 17.344 -8.153 1.00 0.00 H new ATOM 0 HE1 MET A 36 13.188 14.984 -10.254 1.00 0.00 H new ATOM 0 HE2 MET A 36 13.902 15.323 -8.660 1.00 0.00 H new ATOM 0 HE3 MET A 36 12.801 16.503 -9.411 1.00 0.00 H new ATOM 575 N GLU A 37 14.146 22.226 -9.874 1.00 0.00 N ATOM 576 CA GLU A 37 13.234 23.360 -10.095 1.00 0.00 C ATOM 577 C GLU A 37 13.601 24.156 -11.366 1.00 0.00 C ATOM 578 O GLU A 37 12.712 24.662 -12.056 1.00 0.00 O ATOM 579 CB GLU A 37 13.207 24.223 -8.822 1.00 0.00 C ATOM 580 CG GLU A 37 12.061 25.241 -8.821 1.00 0.00 C ATOM 581 CD GLU A 37 11.811 25.794 -7.405 1.00 0.00 C ATOM 582 OE1 GLU A 37 11.130 25.099 -6.607 1.00 0.00 O ATOM 583 OE2 GLU A 37 12.280 26.913 -7.085 1.00 0.00 O ATOM 0 H GLU A 37 14.784 22.355 -9.088 1.00 0.00 H new ATOM 0 HA GLU A 37 12.225 22.992 -10.281 1.00 0.00 H new ATOM 0 HB2 GLU A 37 13.112 23.575 -7.951 1.00 0.00 H new ATOM 0 HB3 GLU A 37 14.156 24.750 -8.725 1.00 0.00 H new ATOM 0 HG2 GLU A 37 12.299 26.061 -9.498 1.00 0.00 H new ATOM 0 HG3 GLU A 37 11.152 24.771 -9.197 1.00 0.00 H new ATOM 590 N SER A 38 14.888 24.190 -11.740 1.00 0.00 N ATOM 591 CA SER A 38 15.353 24.773 -13.015 1.00 0.00 C ATOM 592 C SER A 38 15.028 23.912 -14.250 1.00 0.00 C ATOM 593 O SER A 38 14.942 24.445 -15.358 1.00 0.00 O ATOM 594 CB SER A 38 16.871 25.016 -12.981 1.00 0.00 C ATOM 595 OG SER A 38 17.229 25.885 -11.920 1.00 0.00 O ATOM 0 H SER A 38 15.642 23.813 -11.166 1.00 0.00 H new ATOM 0 HA SER A 38 14.808 25.712 -13.113 1.00 0.00 H new ATOM 0 HB2 SER A 38 17.391 24.065 -12.867 1.00 0.00 H new ATOM 0 HB3 SER A 38 17.194 25.444 -13.930 1.00 0.00 H new ATOM 0 HG SER A 38 17.130 25.416 -11.065 1.00 0.00 H new ATOM 601 N THR A 39 14.850 22.594 -14.075 1.00 0.00 N ATOM 602 CA THR A 39 14.655 21.623 -15.181 1.00 0.00 C ATOM 603 C THR A 39 13.238 21.029 -15.264 1.00 0.00 C ATOM 604 O THR A 39 12.980 20.150 -16.090 1.00 0.00 O ATOM 605 CB THR A 39 15.697 20.496 -15.129 1.00 0.00 C ATOM 606 OG1 THR A 39 15.630 19.827 -13.896 1.00 0.00 O ATOM 607 CG2 THR A 39 17.127 21.002 -15.300 1.00 0.00 C ATOM 0 H THR A 39 14.836 22.159 -13.152 1.00 0.00 H new ATOM 0 HA THR A 39 14.794 22.207 -16.090 1.00 0.00 H new ATOM 0 HB THR A 39 15.459 19.829 -15.958 1.00 0.00 H new ATOM 0 HG1 THR A 39 16.230 20.262 -13.255 1.00 0.00 H new ATOM 0 HG21 THR A 39 17.819 20.161 -15.254 1.00 0.00 H new ATOM 0 HG22 THR A 39 17.224 21.500 -16.265 1.00 0.00 H new ATOM 0 HG23 THR A 39 17.361 21.708 -14.503 1.00 0.00 H new ATOM 615 N GLY A 40 12.307 21.489 -14.424 1.00 0.00 N ATOM 616 CA GLY A 40 10.911 21.020 -14.422 1.00 0.00 C ATOM 617 C GLY A 40 10.726 19.628 -13.806 1.00 0.00 C ATOM 618 O GLY A 40 9.784 18.914 -14.150 1.00 0.00 O ATOM 0 H GLY A 40 12.498 22.202 -13.720 1.00 0.00 H new ATOM 0 HA2 GLY A 40 10.298 21.735 -13.872 1.00 0.00 H new ATOM 0 HA3 GLY A 40 10.541 21.005 -15.447 1.00 0.00 H new ATOM 622 N GLY A 41 11.643 19.223 -12.919 1.00 0.00 N ATOM 623 CA GLY A 41 11.602 17.939 -12.211 1.00 0.00 C ATOM 624 C GLY A 41 12.094 16.725 -13.001 1.00 0.00 C ATOM 625 O GLY A 41 11.931 15.602 -12.532 1.00 0.00 O ATOM 0 H GLY A 41 12.452 19.792 -12.668 1.00 0.00 H new ATOM 0 HA2 GLY A 41 12.202 18.026 -11.305 1.00 0.00 H new ATOM 0 HA3 GLY A 41 10.575 17.752 -11.897 1.00 0.00 H new ATOM 629 N ARG A 42 12.700 16.917 -14.181 1.00 0.00 N ATOM 630 CA ARG A 42 13.295 15.825 -14.980 1.00 0.00 C ATOM 631 C ARG A 42 14.601 15.355 -14.343 1.00 0.00 C ATOM 632 O ARG A 42 15.628 16.007 -14.520 1.00 0.00 O ATOM 633 CB ARG A 42 13.547 16.335 -16.420 1.00 0.00 C ATOM 634 CG ARG A 42 12.318 16.276 -17.336 1.00 0.00 C ATOM 635 CD ARG A 42 11.981 14.832 -17.734 1.00 0.00 C ATOM 636 NE ARG A 42 11.122 14.795 -18.933 1.00 0.00 N ATOM 637 CZ ARG A 42 9.807 14.899 -19.019 1.00 0.00 C ATOM 638 NH1 ARG A 42 9.050 15.122 -17.981 1.00 0.00 N ATOM 639 NH2 ARG A 42 9.232 14.773 -20.180 1.00 0.00 N ATOM 0 H ARG A 42 12.794 17.836 -14.614 1.00 0.00 H new ATOM 0 HA ARG A 42 12.610 14.978 -15.011 1.00 0.00 H new ATOM 0 HB2 ARG A 42 13.900 17.365 -16.371 1.00 0.00 H new ATOM 0 HB3 ARG A 42 14.347 15.745 -16.867 1.00 0.00 H new ATOM 0 HG2 ARG A 42 11.463 16.724 -16.829 1.00 0.00 H new ATOM 0 HG3 ARG A 42 12.502 16.868 -18.233 1.00 0.00 H new ATOM 0 HD2 ARG A 42 12.902 14.281 -17.926 1.00 0.00 H new ATOM 0 HD3 ARG A 42 11.477 14.332 -16.907 1.00 0.00 H new ATOM 0 HE ARG A 42 11.611 14.672 -19.820 1.00 0.00 H new ATOM 0 HH11 ARG A 42 9.469 15.223 -17.057 1.00 0.00 H new ATOM 0 HH12 ARG A 42 8.039 15.195 -18.093 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.795 14.596 -21.012 1.00 0.00 H new ATOM 0 HH22 ARG A 42 8.218 14.851 -20.258 1.00 0.00 H new ATOM 653 N VAL A 43 14.606 14.200 -13.670 1.00 0.00 N ATOM 654 CA VAL A 43 15.793 13.731 -12.916 1.00 0.00 C ATOM 655 C VAL A 43 17.027 13.578 -13.811 1.00 0.00 C ATOM 656 O VAL A 43 18.104 14.008 -13.417 1.00 0.00 O ATOM 657 CB VAL A 43 15.482 12.467 -12.080 1.00 0.00 C ATOM 658 CG1 VAL A 43 15.233 11.204 -12.912 1.00 0.00 C ATOM 659 CG2 VAL A 43 16.603 12.166 -11.078 1.00 0.00 C ATOM 0 H VAL A 43 13.807 13.567 -13.627 1.00 0.00 H new ATOM 0 HA VAL A 43 16.048 14.511 -12.199 1.00 0.00 H new ATOM 0 HB VAL A 43 14.555 12.712 -11.562 1.00 0.00 H new ATOM 0 HG11 VAL A 43 15.023 10.366 -12.247 1.00 0.00 H new ATOM 0 HG12 VAL A 43 14.381 11.366 -13.573 1.00 0.00 H new ATOM 0 HG13 VAL A 43 16.118 10.981 -13.508 1.00 0.00 H new ATOM 0 HG21 VAL A 43 16.351 11.272 -10.508 1.00 0.00 H new ATOM 0 HG22 VAL A 43 17.537 12.003 -11.615 1.00 0.00 H new ATOM 0 HG23 VAL A 43 16.719 13.009 -10.397 1.00 0.00 H new ATOM 669 N ARG A 44 16.869 13.105 -15.058 1.00 0.00 N ATOM 670 CA ARG A 44 17.985 12.972 -16.024 1.00 0.00 C ATOM 671 C ARG A 44 18.652 14.312 -16.376 1.00 0.00 C ATOM 672 O ARG A 44 19.873 14.428 -16.356 1.00 0.00 O ATOM 673 CB ARG A 44 17.522 12.153 -17.252 1.00 0.00 C ATOM 674 CG ARG A 44 16.471 12.816 -18.169 1.00 0.00 C ATOM 675 CD ARG A 44 15.914 11.839 -19.219 1.00 0.00 C ATOM 676 NE ARG A 44 16.965 11.318 -20.119 1.00 0.00 N ATOM 677 CZ ARG A 44 17.363 11.807 -21.285 1.00 0.00 C ATOM 678 NH1 ARG A 44 16.840 12.884 -21.805 1.00 0.00 N ATOM 679 NH2 ARG A 44 18.312 11.216 -21.950 1.00 0.00 N ATOM 0 H ARG A 44 15.968 12.803 -15.430 1.00 0.00 H new ATOM 0 HA ARG A 44 18.787 12.412 -15.543 1.00 0.00 H new ATOM 0 HB2 ARG A 44 18.399 11.917 -17.854 1.00 0.00 H new ATOM 0 HB3 ARG A 44 17.115 11.206 -16.896 1.00 0.00 H new ATOM 0 HG2 ARG A 44 15.651 13.199 -17.561 1.00 0.00 H new ATOM 0 HG3 ARG A 44 16.920 13.671 -18.674 1.00 0.00 H new ATOM 0 HD2 ARG A 44 15.427 11.005 -18.713 1.00 0.00 H new ATOM 0 HD3 ARG A 44 15.150 12.343 -19.811 1.00 0.00 H new ATOM 0 HE ARG A 44 17.445 10.475 -19.802 1.00 0.00 H new ATOM 0 HH11 ARG A 44 16.098 13.380 -21.311 1.00 0.00 H new ATOM 0 HH12 ARG A 44 17.173 13.229 -22.705 1.00 0.00 H new ATOM 0 HH21 ARG A 44 18.751 10.375 -21.574 1.00 0.00 H new ATOM 0 HH22 ARG A 44 18.617 11.593 -22.847 1.00 0.00 H new ATOM 693 N ILE A 45 17.840 15.352 -16.587 1.00 0.00 N ATOM 694 CA ILE A 45 18.334 16.705 -16.913 1.00 0.00 C ATOM 695 C ILE A 45 18.906 17.373 -15.653 1.00 0.00 C ATOM 696 O ILE A 45 19.929 18.043 -15.722 1.00 0.00 O ATOM 697 CB ILE A 45 17.241 17.566 -17.601 1.00 0.00 C ATOM 698 CG1 ILE A 45 16.572 16.815 -18.781 1.00 0.00 C ATOM 699 CG2 ILE A 45 17.856 18.880 -18.121 1.00 0.00 C ATOM 700 CD1 ILE A 45 15.474 17.608 -19.505 1.00 0.00 C ATOM 0 H ILE A 45 16.823 15.286 -16.538 1.00 0.00 H new ATOM 0 HA ILE A 45 19.143 16.616 -17.638 1.00 0.00 H new ATOM 0 HB ILE A 45 16.476 17.778 -16.854 1.00 0.00 H new ATOM 0 HG12 ILE A 45 17.341 16.543 -19.504 1.00 0.00 H new ATOM 0 HG13 ILE A 45 16.143 15.886 -18.406 1.00 0.00 H new ATOM 0 HG21 ILE A 45 17.082 19.478 -18.602 1.00 0.00 H new ATOM 0 HG22 ILE A 45 18.280 19.439 -17.287 1.00 0.00 H new ATOM 0 HG23 ILE A 45 18.641 18.654 -18.842 1.00 0.00 H new ATOM 0 HD11 ILE A 45 15.063 17.005 -20.315 1.00 0.00 H new ATOM 0 HD12 ILE A 45 14.681 17.858 -18.800 1.00 0.00 H new ATOM 0 HD13 ILE A 45 15.898 18.525 -19.915 1.00 0.00 H new ATOM 712 N ALA A 46 18.317 17.130 -14.483 1.00 0.00 N ATOM 713 CA ALA A 46 18.821 17.653 -13.212 1.00 0.00 C ATOM 714 C ALA A 46 20.197 17.063 -12.855 1.00 0.00 C ATOM 715 O ALA A 46 21.115 17.819 -12.546 1.00 0.00 O ATOM 716 CB ALA A 46 17.773 17.396 -12.127 1.00 0.00 C ATOM 0 H ALA A 46 17.474 16.563 -14.389 1.00 0.00 H new ATOM 0 HA ALA A 46 18.981 18.728 -13.298 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.135 17.781 -11.173 1.00 0.00 H new ATOM 0 HB2 ALA A 46 16.844 17.900 -12.392 1.00 0.00 H new ATOM 0 HB3 ALA A 46 17.593 16.324 -12.041 1.00 0.00 H new ATOM 722 N ILE A 47 20.397 15.741 -12.981 1.00 0.00 N ATOM 723 CA ILE A 47 21.727 15.136 -12.753 1.00 0.00 C ATOM 724 C ILE A 47 22.725 15.554 -13.839 1.00 0.00 C ATOM 725 O ILE A 47 23.874 15.837 -13.510 1.00 0.00 O ATOM 726 CB ILE A 47 21.675 13.607 -12.519 1.00 0.00 C ATOM 727 CG1 ILE A 47 21.299 12.801 -13.778 1.00 0.00 C ATOM 728 CG2 ILE A 47 20.746 13.312 -11.332 1.00 0.00 C ATOM 729 CD1 ILE A 47 21.262 11.280 -13.580 1.00 0.00 C ATOM 0 H ILE A 47 19.668 15.075 -13.236 1.00 0.00 H new ATOM 0 HA ILE A 47 22.100 15.541 -11.812 1.00 0.00 H new ATOM 0 HB ILE A 47 22.683 13.269 -12.278 1.00 0.00 H new ATOM 0 HG12 ILE A 47 20.320 13.132 -14.126 1.00 0.00 H new ATOM 0 HG13 ILE A 47 22.013 13.033 -14.568 1.00 0.00 H new ATOM 0 HG21 ILE A 47 20.704 12.236 -11.161 1.00 0.00 H new ATOM 0 HG22 ILE A 47 21.128 13.807 -10.439 1.00 0.00 H new ATOM 0 HG23 ILE A 47 19.745 13.683 -11.552 1.00 0.00 H new ATOM 0 HD11 ILE A 47 20.989 10.797 -14.518 1.00 0.00 H new ATOM 0 HD12 ILE A 47 22.245 10.930 -13.265 1.00 0.00 H new ATOM 0 HD13 ILE A 47 20.526 11.030 -12.816 1.00 0.00 H new ATOM 741 N ALA A 48 22.288 15.727 -15.093 1.00 0.00 N ATOM 742 CA ALA A 48 23.125 16.322 -16.140 1.00 0.00 C ATOM 743 C ALA A 48 23.585 17.752 -15.788 1.00 0.00 C ATOM 744 O ALA A 48 24.771 18.063 -15.915 1.00 0.00 O ATOM 745 CB ALA A 48 22.339 16.277 -17.457 1.00 0.00 C ATOM 0 H ALA A 48 21.355 15.461 -15.407 1.00 0.00 H new ATOM 0 HA ALA A 48 24.045 15.746 -16.238 1.00 0.00 H new ATOM 0 HB1 ALA A 48 22.940 16.714 -18.254 1.00 0.00 H new ATOM 0 HB2 ALA A 48 22.104 15.242 -17.705 1.00 0.00 H new ATOM 0 HB3 ALA A 48 21.414 16.843 -17.348 1.00 0.00 H new ATOM 751 N LYS A 49 22.695 18.611 -15.266 1.00 0.00 N ATOM 752 CA LYS A 49 23.044 19.975 -14.815 1.00 0.00 C ATOM 753 C LYS A 49 23.965 19.979 -13.589 1.00 0.00 C ATOM 754 O LYS A 49 24.929 20.738 -13.564 1.00 0.00 O ATOM 755 CB LYS A 49 21.757 20.790 -14.559 1.00 0.00 C ATOM 756 CG LYS A 49 21.015 21.187 -15.848 1.00 0.00 C ATOM 757 CD LYS A 49 21.732 22.285 -16.649 1.00 0.00 C ATOM 758 CE LYS A 49 20.920 22.622 -17.910 1.00 0.00 C ATOM 759 NZ LYS A 49 21.557 23.707 -18.708 1.00 0.00 N ATOM 0 H LYS A 49 21.709 18.382 -15.143 1.00 0.00 H new ATOM 0 HA LYS A 49 23.612 20.450 -15.615 1.00 0.00 H new ATOM 0 HB2 LYS A 49 21.086 20.206 -13.928 1.00 0.00 H new ATOM 0 HB3 LYS A 49 22.012 21.692 -14.004 1.00 0.00 H new ATOM 0 HG2 LYS A 49 20.898 20.305 -16.478 1.00 0.00 H new ATOM 0 HG3 LYS A 49 20.013 21.530 -15.591 1.00 0.00 H new ATOM 0 HD2 LYS A 49 21.853 23.177 -16.034 1.00 0.00 H new ATOM 0 HD3 LYS A 49 22.732 21.951 -16.927 1.00 0.00 H new ATOM 0 HE2 LYS A 49 20.820 21.729 -18.527 1.00 0.00 H new ATOM 0 HE3 LYS A 49 19.913 22.926 -17.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 20.979 23.904 -19.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.630 24.567 -18.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 22.508 23.408 -19.004 1.00 0.00 H new ATOM 773 N LEU A 50 23.738 19.087 -12.619 1.00 0.00 N ATOM 774 CA LEU A 50 24.628 18.917 -11.455 1.00 0.00 C ATOM 775 C LEU A 50 26.043 18.477 -11.871 1.00 0.00 C ATOM 776 O LEU A 50 27.024 19.030 -11.379 1.00 0.00 O ATOM 777 CB LEU A 50 24.018 17.905 -10.464 1.00 0.00 C ATOM 778 CG LEU A 50 22.770 18.380 -9.698 1.00 0.00 C ATOM 779 CD1 LEU A 50 22.193 17.209 -8.900 1.00 0.00 C ATOM 780 CD2 LEU A 50 23.085 19.509 -8.719 1.00 0.00 C ATOM 0 H LEU A 50 22.933 18.460 -12.614 1.00 0.00 H new ATOM 0 HA LEU A 50 24.721 19.887 -10.966 1.00 0.00 H new ATOM 0 HB2 LEU A 50 23.760 16.999 -11.013 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.783 17.631 -9.738 1.00 0.00 H new ATOM 0 HG LEU A 50 22.060 18.752 -10.436 1.00 0.00 H new ATOM 0 HD11 LEU A 50 21.309 17.540 -8.356 1.00 0.00 H new ATOM 0 HD12 LEU A 50 21.919 16.404 -9.582 1.00 0.00 H new ATOM 0 HD13 LEU A 50 22.940 16.847 -8.193 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.173 19.809 -8.204 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.817 19.164 -7.989 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.490 20.361 -9.265 1.00 0.00 H new ATOM 792 N LEU A 51 26.159 17.538 -12.819 1.00 0.00 N ATOM 793 CA LEU A 51 27.453 17.098 -13.363 1.00 0.00 C ATOM 794 C LEU A 51 28.126 18.176 -14.237 1.00 0.00 C ATOM 795 O LEU A 51 29.349 18.301 -14.210 1.00 0.00 O ATOM 796 CB LEU A 51 27.258 15.787 -14.149 1.00 0.00 C ATOM 797 CG LEU A 51 26.909 14.564 -13.278 1.00 0.00 C ATOM 798 CD1 LEU A 51 26.522 13.388 -14.174 1.00 0.00 C ATOM 799 CD2 LEU A 51 28.072 14.126 -12.385 1.00 0.00 C ATOM 0 H LEU A 51 25.358 17.061 -13.232 1.00 0.00 H new ATOM 0 HA LEU A 51 28.128 16.924 -12.525 1.00 0.00 H new ATOM 0 HB2 LEU A 51 26.465 15.933 -14.882 1.00 0.00 H new ATOM 0 HB3 LEU A 51 28.171 15.572 -14.705 1.00 0.00 H new ATOM 0 HG LEU A 51 26.080 14.861 -12.636 1.00 0.00 H new ATOM 0 HD11 LEU A 51 26.276 12.525 -13.555 1.00 0.00 H new ATOM 0 HD12 LEU A 51 25.656 13.660 -14.778 1.00 0.00 H new ATOM 0 HD13 LEU A 51 27.357 13.139 -14.828 1.00 0.00 H new ATOM 0 HD21 LEU A 51 27.771 13.261 -11.794 1.00 0.00 H new ATOM 0 HD22 LEU A 51 28.928 13.861 -13.006 1.00 0.00 H new ATOM 0 HD23 LEU A 51 28.347 14.943 -11.718 1.00 0.00 H new ATOM 811 N SER A 52 27.350 19.001 -14.952 1.00 0.00 N ATOM 812 CA SER A 52 27.881 20.062 -15.831 1.00 0.00 C ATOM 813 C SER A 52 28.643 21.171 -15.086 1.00 0.00 C ATOM 814 O SER A 52 29.480 21.843 -15.695 1.00 0.00 O ATOM 815 CB SER A 52 26.758 20.694 -16.669 1.00 0.00 C ATOM 816 OG SER A 52 26.192 19.747 -17.562 1.00 0.00 O ATOM 0 H SER A 52 26.331 18.955 -14.940 1.00 0.00 H new ATOM 0 HA SER A 52 28.601 19.561 -16.478 1.00 0.00 H new ATOM 0 HB2 SER A 52 25.983 21.084 -16.009 1.00 0.00 H new ATOM 0 HB3 SER A 52 27.152 21.539 -17.233 1.00 0.00 H new ATOM 0 HG SER A 52 25.728 19.051 -17.050 1.00 0.00 H new ATOM 822 N LYS A 53 28.404 21.352 -13.773 1.00 0.00 N ATOM 823 CA LYS A 53 29.158 22.295 -12.918 1.00 0.00 C ATOM 824 C LYS A 53 30.455 21.713 -12.324 1.00 0.00 C ATOM 825 O LYS A 53 31.227 22.457 -11.719 1.00 0.00 O ATOM 826 CB LYS A 53 28.241 22.903 -11.837 1.00 0.00 C ATOM 827 CG LYS A 53 27.053 23.661 -12.455 1.00 0.00 C ATOM 828 CD LYS A 53 26.456 24.728 -11.525 1.00 0.00 C ATOM 829 CE LYS A 53 25.877 24.162 -10.218 1.00 0.00 C ATOM 830 NZ LYS A 53 25.299 25.247 -9.375 1.00 0.00 N ATOM 0 H LYS A 53 27.676 20.844 -13.270 1.00 0.00 H new ATOM 0 HA LYS A 53 29.497 23.097 -13.574 1.00 0.00 H new ATOM 0 HB2 LYS A 53 27.868 22.110 -11.189 1.00 0.00 H new ATOM 0 HB3 LYS A 53 28.819 23.582 -11.210 1.00 0.00 H new ATOM 0 HG2 LYS A 53 27.378 24.137 -13.380 1.00 0.00 H new ATOM 0 HG3 LYS A 53 26.275 22.946 -12.721 1.00 0.00 H new ATOM 0 HD2 LYS A 53 27.228 25.458 -11.283 1.00 0.00 H new ATOM 0 HD3 LYS A 53 25.669 25.262 -12.058 1.00 0.00 H new ATOM 0 HE2 LYS A 53 25.107 23.425 -10.446 1.00 0.00 H new ATOM 0 HE3 LYS A 53 26.660 23.644 -9.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 24.885 24.835 -8.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 26.048 25.918 -9.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 24.560 25.746 -9.910 1.00 0.00 H new ATOM 844 N GLN A 54 30.726 20.418 -12.517 1.00 0.00 N ATOM 845 CA GLN A 54 31.991 19.771 -12.130 1.00 0.00 C ATOM 846 C GLN A 54 33.072 19.947 -13.219 1.00 0.00 C ATOM 847 O GLN A 54 32.767 20.237 -14.377 1.00 0.00 O ATOM 848 CB GLN A 54 31.759 18.281 -11.797 1.00 0.00 C ATOM 849 CG GLN A 54 30.694 18.024 -10.715 1.00 0.00 C ATOM 850 CD GLN A 54 31.032 18.681 -9.376 1.00 0.00 C ATOM 851 OE1 GLN A 54 30.489 19.711 -8.998 1.00 0.00 O ATOM 852 NE2 GLN A 54 31.958 18.131 -8.618 1.00 0.00 N ATOM 0 H GLN A 54 30.064 19.777 -12.953 1.00 0.00 H new ATOM 0 HA GLN A 54 32.361 20.263 -11.230 1.00 0.00 H new ATOM 0 HB2 GLN A 54 31.465 17.760 -12.708 1.00 0.00 H new ATOM 0 HB3 GLN A 54 32.703 17.844 -11.470 1.00 0.00 H new ATOM 0 HG2 GLN A 54 29.732 18.398 -11.064 1.00 0.00 H new ATOM 0 HG3 GLN A 54 30.584 16.949 -10.569 1.00 0.00 H new ATOM 0 HE21 GLN A 54 32.420 17.273 -8.919 1.00 0.00 H new ATOM 0 HE22 GLN A 54 32.213 18.563 -7.730 1.00 0.00 H new ATOM 861 N THR A 55 34.345 19.743 -12.859 1.00 0.00 N ATOM 862 CA THR A 55 35.494 19.896 -13.780 1.00 0.00 C ATOM 863 C THR A 55 35.581 18.784 -14.834 1.00 0.00 C ATOM 864 O THR A 55 35.954 19.061 -15.977 1.00 0.00 O ATOM 865 CB THR A 55 36.822 19.953 -13.005 1.00 0.00 C ATOM 866 OG1 THR A 55 36.905 18.871 -12.095 1.00 0.00 O ATOM 867 CG2 THR A 55 36.947 21.249 -12.203 1.00 0.00 C ATOM 0 H THR A 55 34.616 19.465 -11.916 1.00 0.00 H new ATOM 0 HA THR A 55 35.323 20.837 -14.302 1.00 0.00 H new ATOM 0 HB THR A 55 37.624 19.901 -13.741 1.00 0.00 H new ATOM 0 HG1 THR A 55 37.755 18.917 -11.609 1.00 0.00 H new ATOM 0 HG21 THR A 55 37.897 21.256 -11.668 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.906 22.102 -12.881 1.00 0.00 H new ATOM 0 HG23 THR A 55 36.127 21.315 -11.488 1.00 0.00 H new ATOM 875 N SER A 56 35.177 17.557 -14.468 1.00 0.00 N ATOM 876 CA SER A 56 35.209 16.323 -15.278 1.00 0.00 C ATOM 877 C SER A 56 36.604 15.839 -15.723 1.00 0.00 C ATOM 878 O SER A 56 37.542 16.617 -15.922 1.00 0.00 O ATOM 879 CB SER A 56 34.236 16.429 -16.463 1.00 0.00 C ATOM 880 OG SER A 56 34.099 15.173 -17.114 1.00 0.00 O ATOM 0 H SER A 56 34.794 17.387 -13.538 1.00 0.00 H new ATOM 0 HA SER A 56 34.877 15.538 -14.599 1.00 0.00 H new ATOM 0 HB2 SER A 56 33.262 16.770 -16.111 1.00 0.00 H new ATOM 0 HB3 SER A 56 34.598 17.174 -17.172 1.00 0.00 H new ATOM 0 HG SER A 56 33.475 15.260 -17.864 1.00 0.00 H new ATOM 886 N GLY A 57 36.740 14.517 -15.891 1.00 0.00 N ATOM 887 CA GLY A 57 37.904 13.866 -16.510 1.00 0.00 C ATOM 888 C GLY A 57 37.812 13.733 -18.041 1.00 0.00 C ATOM 889 O GLY A 57 38.782 13.315 -18.676 1.00 0.00 O ATOM 0 H GLY A 57 36.026 13.853 -15.593 1.00 0.00 H new ATOM 0 HA2 GLY A 57 38.800 14.434 -16.259 1.00 0.00 H new ATOM 0 HA3 GLY A 57 38.024 12.873 -16.077 1.00 0.00 H new ATOM 893 N GLY A 58 36.655 14.057 -18.637 1.00 0.00 N ATOM 894 CA GLY A 58 36.389 13.936 -20.076 1.00 0.00 C ATOM 895 C GLY A 58 37.032 15.025 -20.954 1.00 0.00 C ATOM 896 O GLY A 58 37.509 16.053 -20.459 1.00 0.00 O ATOM 0 H GLY A 58 35.857 14.420 -18.116 1.00 0.00 H new ATOM 0 HA2 GLY A 58 36.744 12.962 -20.414 1.00 0.00 H new ATOM 0 HA3 GLY A 58 35.311 13.955 -20.233 1.00 0.00 H new ATOM 900 N SER A 59 37.001 14.800 -22.271 1.00 0.00 N ATOM 901 CA SER A 59 37.554 15.683 -23.318 1.00 0.00 C ATOM 902 C SER A 59 36.582 15.844 -24.501 1.00 0.00 C ATOM 903 O SER A 59 35.738 14.976 -24.750 1.00 0.00 O ATOM 904 CB SER A 59 38.894 15.134 -23.834 1.00 0.00 C ATOM 905 OG SER A 59 39.868 15.086 -22.796 1.00 0.00 O ATOM 0 H SER A 59 36.571 13.961 -22.660 1.00 0.00 H new ATOM 0 HA SER A 59 37.708 16.662 -22.863 1.00 0.00 H new ATOM 0 HB2 SER A 59 38.746 14.135 -24.244 1.00 0.00 H new ATOM 0 HB3 SER A 59 39.257 15.762 -24.648 1.00 0.00 H new ATOM 0 HG SER A 59 40.709 14.731 -23.153 1.00 0.00 H new ATOM 911 N GLY A 60 36.704 16.947 -25.249 1.00 0.00 N ATOM 912 CA GLY A 60 35.885 17.230 -26.438 1.00 0.00 C ATOM 913 C GLY A 60 36.160 16.278 -27.614 1.00 0.00 C ATOM 914 O GLY A 60 37.284 15.802 -27.799 1.00 0.00 O ATOM 0 H GLY A 60 37.383 17.680 -25.044 1.00 0.00 H new ATOM 0 HA2 GLY A 60 34.831 17.165 -26.167 1.00 0.00 H new ATOM 0 HA3 GLY A 60 36.069 18.255 -26.760 1.00 0.00 H new ATOM 918 N GLY A 61 35.127 16.003 -28.419 1.00 0.00 N ATOM 919 CA GLY A 61 35.179 15.047 -29.539 1.00 0.00 C ATOM 920 C GLY A 61 35.861 15.563 -30.817 1.00 0.00 C ATOM 921 O GLY A 61 36.247 14.753 -31.664 1.00 0.00 O ATOM 0 H GLY A 61 34.214 16.445 -28.311 1.00 0.00 H new ATOM 0 HA2 GLY A 61 35.702 14.151 -29.205 1.00 0.00 H new ATOM 0 HA3 GLY A 61 34.160 14.748 -29.787 1.00 0.00 H new ATOM 925 N SER A 62 36.040 16.887 -30.951 1.00 0.00 N ATOM 926 CA SER A 62 36.558 17.577 -32.153 1.00 0.00 C ATOM 927 C SER A 62 35.742 17.308 -33.439 1.00 0.00 C ATOM 928 O SER A 62 34.659 16.709 -33.404 1.00 0.00 O ATOM 929 CB SER A 62 38.058 17.277 -32.308 1.00 0.00 C ATOM 930 OG SER A 62 38.683 18.235 -33.155 1.00 0.00 O ATOM 0 H SER A 62 35.820 17.537 -30.196 1.00 0.00 H new ATOM 0 HA SER A 62 36.432 18.649 -31.999 1.00 0.00 H new ATOM 0 HB2 SER A 62 38.537 17.284 -31.329 1.00 0.00 H new ATOM 0 HB3 SER A 62 38.192 16.278 -32.722 1.00 0.00 H new ATOM 0 HG SER A 62 39.637 18.026 -33.238 1.00 0.00 H new ATOM 936 N LYS A 63 36.228 17.801 -34.586 1.00 0.00 N ATOM 937 CA LYS A 63 35.610 17.623 -35.914 1.00 0.00 C ATOM 938 C LYS A 63 35.718 16.183 -36.445 1.00 0.00 C ATOM 939 O LYS A 63 36.589 15.417 -36.025 1.00 0.00 O ATOM 940 CB LYS A 63 36.189 18.645 -36.912 1.00 0.00 C ATOM 941 CG LYS A 63 37.711 18.508 -37.142 1.00 0.00 C ATOM 942 CD LYS A 63 38.093 18.607 -38.625 1.00 0.00 C ATOM 943 CE LYS A 63 37.742 19.978 -39.228 1.00 0.00 C ATOM 944 NZ LYS A 63 37.939 19.986 -40.704 1.00 0.00 N ATOM 0 H LYS A 63 37.086 18.351 -34.620 1.00 0.00 H new ATOM 0 HA LYS A 63 34.542 17.811 -35.800 1.00 0.00 H new ATOM 0 HB2 LYS A 63 35.676 18.534 -37.868 1.00 0.00 H new ATOM 0 HB3 LYS A 63 35.976 19.651 -36.550 1.00 0.00 H new ATOM 0 HG2 LYS A 63 38.231 19.286 -36.584 1.00 0.00 H new ATOM 0 HG3 LYS A 63 38.050 17.551 -36.746 1.00 0.00 H new ATOM 0 HD2 LYS A 63 39.162 18.427 -38.735 1.00 0.00 H new ATOM 0 HD3 LYS A 63 37.579 17.825 -39.183 1.00 0.00 H new ATOM 0 HE2 LYS A 63 36.706 20.225 -38.996 1.00 0.00 H new ATOM 0 HE3 LYS A 63 38.364 20.748 -38.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 37.711 20.929 -41.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 38.929 19.757 -40.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 37.315 19.278 -41.141 1.00 0.00 H new ATOM 958 N LEU A 64 34.844 15.837 -37.399 1.00 0.00 N ATOM 959 CA LEU A 64 34.738 14.491 -37.995 1.00 0.00 C ATOM 960 C LEU A 64 34.917 14.448 -39.531 1.00 0.00 C ATOM 961 O LEU A 64 34.824 13.369 -40.123 1.00 0.00 O ATOM 962 CB LEU A 64 33.397 13.860 -37.559 1.00 0.00 C ATOM 963 CG LEU A 64 33.214 13.664 -36.038 1.00 0.00 C ATOM 964 CD1 LEU A 64 31.800 13.149 -35.759 1.00 0.00 C ATOM 965 CD2 LEU A 64 34.206 12.656 -35.452 1.00 0.00 C ATOM 0 H LEU A 64 34.173 16.498 -37.790 1.00 0.00 H new ATOM 0 HA LEU A 64 35.576 13.905 -37.617 1.00 0.00 H new ATOM 0 HB2 LEU A 64 32.585 14.487 -37.927 1.00 0.00 H new ATOM 0 HB3 LEU A 64 33.297 12.890 -38.047 1.00 0.00 H new ATOM 0 HG LEU A 64 33.390 14.632 -35.570 1.00 0.00 H new ATOM 0 HD11 LEU A 64 31.669 13.010 -34.686 1.00 0.00 H new ATOM 0 HD12 LEU A 64 31.071 13.873 -36.123 1.00 0.00 H new ATOM 0 HD13 LEU A 64 31.652 12.197 -36.269 1.00 0.00 H new ATOM 0 HD21 LEU A 64 34.033 12.556 -34.380 1.00 0.00 H new ATOM 0 HD22 LEU A 64 34.068 11.688 -35.933 1.00 0.00 H new ATOM 0 HD23 LEU A 64 35.224 13.005 -35.624 1.00 0.00 H new ATOM 977 N GLY A 65 35.175 15.583 -40.194 1.00 0.00 N ATOM 978 CA GLY A 65 35.326 15.646 -41.656 1.00 0.00 C ATOM 979 C GLY A 65 35.582 17.049 -42.218 1.00 0.00 C ATOM 980 O GLY A 65 36.032 17.952 -41.505 1.00 0.00 O ATOM 0 H GLY A 65 35.285 16.486 -39.732 1.00 0.00 H new ATOM 0 HA2 GLY A 65 36.151 14.997 -41.950 1.00 0.00 H new ATOM 0 HA3 GLY A 65 34.424 15.244 -42.118 1.00 0.00 H new ATOM 984 N GLY A 66 35.312 17.222 -43.515 1.00 0.00 N ATOM 985 CA GLY A 66 35.401 18.501 -44.236 1.00 0.00 C ATOM 986 C GLY A 66 34.196 19.435 -44.022 1.00 0.00 C ATOM 987 O GLY A 66 33.314 19.176 -43.196 1.00 0.00 O ATOM 0 H GLY A 66 35.015 16.452 -44.114 1.00 0.00 H new ATOM 0 HA2 GLY A 66 36.307 19.019 -43.922 1.00 0.00 H new ATOM 0 HA3 GLY A 66 35.503 18.297 -45.302 1.00 0.00 H new ATOM 991 N SER A 67 34.156 20.530 -44.785 1.00 0.00 N ATOM 992 CA SER A 67 33.058 21.515 -44.790 1.00 0.00 C ATOM 993 C SER A 67 31.798 21.011 -45.521 1.00 0.00 C ATOM 994 O SER A 67 31.843 20.046 -46.293 1.00 0.00 O ATOM 995 CB SER A 67 33.552 22.843 -45.385 1.00 0.00 C ATOM 996 OG SER A 67 34.047 22.664 -46.708 1.00 0.00 O ATOM 0 H SER A 67 34.904 20.768 -45.436 1.00 0.00 H new ATOM 0 HA SER A 67 32.758 21.673 -43.754 1.00 0.00 H new ATOM 0 HB2 SER A 67 32.736 23.566 -45.394 1.00 0.00 H new ATOM 0 HB3 SER A 67 34.338 23.257 -44.753 1.00 0.00 H new ATOM 0 HG SER A 67 34.353 23.525 -47.062 1.00 0.00 H new ATOM 1002 N GLY A 68 30.656 21.671 -45.283 1.00 0.00 N ATOM 1003 CA GLY A 68 29.352 21.297 -45.852 1.00 0.00 C ATOM 1004 C GLY A 68 28.711 20.065 -45.193 1.00 0.00 C ATOM 1005 O GLY A 68 29.089 19.657 -44.091 1.00 0.00 O ATOM 0 H GLY A 68 30.611 22.493 -44.680 1.00 0.00 H new ATOM 0 HA2 GLY A 68 28.670 22.142 -45.758 1.00 0.00 H new ATOM 0 HA3 GLY A 68 29.474 21.104 -46.918 1.00 0.00 H new ATOM 1009 N GLY A 69 27.708 19.483 -45.861 1.00 0.00 N ATOM 1010 CA GLY A 69 26.993 18.281 -45.394 1.00 0.00 C ATOM 1011 C GLY A 69 26.033 18.512 -44.216 1.00 0.00 C ATOM 1012 O GLY A 69 25.642 17.559 -43.540 1.00 0.00 O ATOM 0 H GLY A 69 27.363 19.836 -46.754 1.00 0.00 H new ATOM 0 HA2 GLY A 69 26.427 17.866 -46.228 1.00 0.00 H new ATOM 0 HA3 GLY A 69 27.727 17.530 -45.103 1.00 0.00 H new ATOM 1016 N SER A 70 25.642 19.767 -43.956 1.00 0.00 N ATOM 1017 CA SER A 70 24.873 20.190 -42.767 1.00 0.00 C ATOM 1018 C SER A 70 23.388 19.789 -42.776 1.00 0.00 C ATOM 1019 O SER A 70 22.689 19.977 -41.777 1.00 0.00 O ATOM 1020 CB SER A 70 25.002 21.708 -42.614 1.00 0.00 C ATOM 1021 OG SER A 70 24.380 22.362 -43.718 1.00 0.00 O ATOM 0 H SER A 70 25.856 20.543 -44.583 1.00 0.00 H new ATOM 0 HA SER A 70 25.304 19.659 -41.918 1.00 0.00 H new ATOM 0 HB2 SER A 70 24.538 22.029 -41.681 1.00 0.00 H new ATOM 0 HB3 SER A 70 26.054 21.989 -42.560 1.00 0.00 H new ATOM 0 HG SER A 70 24.600 23.317 -43.699 1.00 0.00 H new ATOM 1027 N ARG A 71 22.887 19.241 -43.894 1.00 0.00 N ATOM 1028 CA ARG A 71 21.467 18.891 -44.106 1.00 0.00 C ATOM 1029 C ARG A 71 21.015 17.626 -43.353 1.00 0.00 C ATOM 1030 O ARG A 71 19.812 17.367 -43.267 1.00 0.00 O ATOM 1031 CB ARG A 71 21.185 18.768 -45.616 1.00 0.00 C ATOM 1032 CG ARG A 71 21.533 20.001 -46.475 1.00 0.00 C ATOM 1033 CD ARG A 71 20.817 21.297 -46.063 1.00 0.00 C ATOM 1034 NE ARG A 71 21.490 21.981 -44.936 1.00 0.00 N ATOM 1035 CZ ARG A 71 20.937 22.770 -44.032 1.00 0.00 C ATOM 1036 NH1 ARG A 71 19.663 23.046 -44.026 1.00 0.00 N ATOM 1037 NH2 ARG A 71 21.679 23.304 -43.107 1.00 0.00 N ATOM 0 H ARG A 71 23.472 19.022 -44.700 1.00 0.00 H new ATOM 0 HA ARG A 71 20.876 19.702 -43.682 1.00 0.00 H new ATOM 0 HB2 ARG A 71 21.742 17.914 -46.000 1.00 0.00 H new ATOM 0 HB3 ARG A 71 20.127 18.544 -45.750 1.00 0.00 H new ATOM 0 HG2 ARG A 71 22.609 20.167 -46.428 1.00 0.00 H new ATOM 0 HG3 ARG A 71 21.289 19.783 -47.515 1.00 0.00 H new ATOM 0 HD2 ARG A 71 20.772 21.971 -46.918 1.00 0.00 H new ATOM 0 HD3 ARG A 71 19.789 21.067 -45.783 1.00 0.00 H new ATOM 0 HE ARG A 71 22.494 21.826 -44.847 1.00 0.00 H new ATOM 0 HH11 ARG A 71 19.051 22.647 -44.738 1.00 0.00 H new ATOM 0 HH12 ARG A 71 19.278 23.661 -43.309 1.00 0.00 H new ATOM 0 HH21 ARG A 71 22.681 23.113 -43.083 1.00 0.00 H new ATOM 0 HH22 ARG A 71 21.259 23.914 -42.406 1.00 0.00 H new ATOM 1051 N LYS A 72 21.960 16.857 -42.799 1.00 0.00 N ATOM 1052 CA LYS A 72 21.741 15.650 -41.978 1.00 0.00 C ATOM 1053 C LYS A 72 22.670 15.607 -40.756 1.00 0.00 C ATOM 1054 O LYS A 72 23.701 16.280 -40.722 1.00 0.00 O ATOM 1055 CB LYS A 72 21.864 14.388 -42.858 1.00 0.00 C ATOM 1056 CG LYS A 72 23.262 14.186 -43.474 1.00 0.00 C ATOM 1057 CD LYS A 72 23.300 12.921 -44.344 1.00 0.00 C ATOM 1058 CE LYS A 72 24.696 12.746 -44.958 1.00 0.00 C ATOM 1059 NZ LYS A 72 24.770 11.528 -45.817 1.00 0.00 N ATOM 0 H LYS A 72 22.951 17.067 -42.915 1.00 0.00 H new ATOM 0 HA LYS A 72 20.728 15.684 -41.576 1.00 0.00 H new ATOM 0 HB2 LYS A 72 21.613 13.513 -42.258 1.00 0.00 H new ATOM 0 HB3 LYS A 72 21.129 14.445 -43.661 1.00 0.00 H new ATOM 0 HG2 LYS A 72 23.527 15.055 -44.077 1.00 0.00 H new ATOM 0 HG3 LYS A 72 24.006 14.109 -42.681 1.00 0.00 H new ATOM 0 HD2 LYS A 72 23.047 12.048 -43.742 1.00 0.00 H new ATOM 0 HD3 LYS A 72 22.553 12.991 -45.134 1.00 0.00 H new ATOM 0 HE2 LYS A 72 24.946 13.626 -45.551 1.00 0.00 H new ATOM 0 HE3 LYS A 72 25.438 12.676 -44.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 25.727 11.442 -46.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 24.556 10.686 -45.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 24.079 11.606 -46.590 1.00 0.00 H new ATOM 1073 N ASP A 73 22.300 14.807 -39.755 1.00 0.00 N ATOM 1074 CA ASP A 73 23.048 14.615 -38.503 1.00 0.00 C ATOM 1075 C ASP A 73 22.829 13.203 -37.924 1.00 0.00 C ATOM 1076 O ASP A 73 21.772 12.601 -38.130 1.00 0.00 O ATOM 1077 CB ASP A 73 22.622 15.691 -37.491 1.00 0.00 C ATOM 1078 CG ASP A 73 23.465 15.622 -36.208 1.00 0.00 C ATOM 1079 OD1 ASP A 73 24.633 16.076 -36.229 1.00 0.00 O ATOM 1080 OD2 ASP A 73 22.973 15.080 -35.191 1.00 0.00 O ATOM 0 H ASP A 73 21.443 14.255 -39.791 1.00 0.00 H new ATOM 0 HA ASP A 73 24.113 14.713 -38.713 1.00 0.00 H new ATOM 0 HB2 ASP A 73 22.725 16.678 -37.943 1.00 0.00 H new ATOM 0 HB3 ASP A 73 21.568 15.562 -37.243 1.00 0.00 H new ATOM 1085 N LEU A 74 23.804 12.676 -37.173 1.00 0.00 N ATOM 1086 CA LEU A 74 23.732 11.354 -36.530 1.00 0.00 C ATOM 1087 C LEU A 74 22.500 11.218 -35.608 1.00 0.00 C ATOM 1088 O LEU A 74 21.833 10.180 -35.612 1.00 0.00 O ATOM 1089 CB LEU A 74 25.071 11.136 -35.786 1.00 0.00 C ATOM 1090 CG LEU A 74 25.358 9.763 -35.142 1.00 0.00 C ATOM 1091 CD1 LEU A 74 24.648 9.538 -33.804 1.00 0.00 C ATOM 1092 CD2 LEU A 74 25.059 8.591 -36.076 1.00 0.00 C ATOM 0 H LEU A 74 24.681 13.163 -36.991 1.00 0.00 H new ATOM 0 HA LEU A 74 23.596 10.573 -37.278 1.00 0.00 H new ATOM 0 HB2 LEU A 74 25.876 11.343 -36.491 1.00 0.00 H new ATOM 0 HB3 LEU A 74 25.136 11.888 -34.999 1.00 0.00 H new ATOM 0 HG LEU A 74 26.430 9.794 -34.946 1.00 0.00 H new ATOM 0 HD11 LEU A 74 24.902 8.551 -33.419 1.00 0.00 H new ATOM 0 HD12 LEU A 74 24.966 10.299 -33.091 1.00 0.00 H new ATOM 0 HD13 LEU A 74 23.570 9.604 -33.949 1.00 0.00 H new ATOM 0 HD21 LEU A 74 25.281 7.654 -35.566 1.00 0.00 H new ATOM 0 HD22 LEU A 74 24.006 8.610 -36.358 1.00 0.00 H new ATOM 0 HD23 LEU A 74 25.676 8.672 -36.971 1.00 0.00 H new ATOM 1104 N SER A 75 22.151 12.282 -34.878 1.00 0.00 N ATOM 1105 CA SER A 75 21.054 12.318 -33.897 1.00 0.00 C ATOM 1106 C SER A 75 19.739 12.906 -34.453 1.00 0.00 C ATOM 1107 O SER A 75 18.889 13.364 -33.686 1.00 0.00 O ATOM 1108 CB SER A 75 21.504 13.036 -32.615 1.00 0.00 C ATOM 1109 OG SER A 75 22.655 12.406 -32.059 1.00 0.00 O ATOM 0 H SER A 75 22.639 13.174 -34.954 1.00 0.00 H new ATOM 0 HA SER A 75 20.819 11.281 -33.655 1.00 0.00 H new ATOM 0 HB2 SER A 75 21.727 14.080 -32.837 1.00 0.00 H new ATOM 0 HB3 SER A 75 20.693 13.031 -31.886 1.00 0.00 H new ATOM 0 HG SER A 75 22.926 12.880 -31.245 1.00 0.00 H new ATOM 1115 N VAL A 76 19.547 12.906 -35.783 1.00 0.00 N ATOM 1116 CA VAL A 76 18.322 13.426 -36.434 1.00 0.00 C ATOM 1117 C VAL A 76 17.071 12.569 -36.157 1.00 0.00 C ATOM 1118 O VAL A 76 15.950 13.081 -36.164 1.00 0.00 O ATOM 1119 CB VAL A 76 18.562 13.624 -37.947 1.00 0.00 C ATOM 1120 CG1 VAL A 76 18.581 12.309 -38.740 1.00 0.00 C ATOM 1121 CG2 VAL A 76 17.531 14.566 -38.580 1.00 0.00 C ATOM 0 H VAL A 76 20.236 12.545 -36.443 1.00 0.00 H new ATOM 0 HA VAL A 76 18.109 14.396 -35.985 1.00 0.00 H new ATOM 0 HB VAL A 76 19.553 14.074 -38.008 1.00 0.00 H new ATOM 0 HG11 VAL A 76 18.754 12.523 -39.795 1.00 0.00 H new ATOM 0 HG12 VAL A 76 19.379 11.669 -38.364 1.00 0.00 H new ATOM 0 HG13 VAL A 76 17.624 11.801 -38.625 1.00 0.00 H new ATOM 0 HG21 VAL A 76 17.742 14.674 -39.644 1.00 0.00 H new ATOM 0 HG22 VAL A 76 16.531 14.153 -38.448 1.00 0.00 H new ATOM 0 HG23 VAL A 76 17.586 15.542 -38.099 1.00 0.00 H new ATOM 1131 N LYS A 77 17.253 11.267 -35.881 1.00 0.00 N ATOM 1132 CA LYS A 77 16.172 10.316 -35.558 1.00 0.00 C ATOM 1133 C LYS A 77 15.634 10.513 -34.133 1.00 0.00 C ATOM 1134 O LYS A 77 16.365 10.941 -33.234 1.00 0.00 O ATOM 1135 CB LYS A 77 16.653 8.868 -35.777 1.00 0.00 C ATOM 1136 CG LYS A 77 16.990 8.574 -37.250 1.00 0.00 C ATOM 1137 CD LYS A 77 17.390 7.105 -37.444 1.00 0.00 C ATOM 1138 CE LYS A 77 17.711 6.831 -38.920 1.00 0.00 C ATOM 1139 NZ LYS A 77 18.106 5.411 -39.144 1.00 0.00 N ATOM 0 H LYS A 77 18.177 10.835 -35.876 1.00 0.00 H new ATOM 0 HA LYS A 77 15.342 10.515 -36.236 1.00 0.00 H new ATOM 0 HB2 LYS A 77 17.535 8.685 -35.163 1.00 0.00 H new ATOM 0 HB3 LYS A 77 15.880 8.177 -35.440 1.00 0.00 H new ATOM 0 HG2 LYS A 77 16.128 8.805 -37.876 1.00 0.00 H new ATOM 0 HG3 LYS A 77 17.804 9.222 -37.576 1.00 0.00 H new ATOM 0 HD2 LYS A 77 18.258 6.873 -36.827 1.00 0.00 H new ATOM 0 HD3 LYS A 77 16.581 6.454 -37.114 1.00 0.00 H new ATOM 0 HE2 LYS A 77 16.840 7.067 -39.532 1.00 0.00 H new ATOM 0 HE3 LYS A 77 18.517 7.489 -39.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 18.315 5.264 -40.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 18.952 5.193 -38.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 17.327 4.785 -38.857 1.00 0.00 H new ATOM 1153 N GLY A 78 14.359 10.177 -33.919 1.00 0.00 N ATOM 1154 CA GLY A 78 13.684 10.284 -32.617 1.00 0.00 C ATOM 1155 C GLY A 78 14.210 9.302 -31.556 1.00 0.00 C ATOM 1156 O GLY A 78 14.743 8.236 -31.881 1.00 0.00 O ATOM 0 H GLY A 78 13.754 9.816 -34.657 1.00 0.00 H new ATOM 0 HA2 GLY A 78 13.797 11.302 -32.243 1.00 0.00 H new ATOM 0 HA3 GLY A 78 12.617 10.113 -32.758 1.00 0.00 H new ATOM 1160 N MET A 79 14.049 9.665 -30.279 1.00 0.00 N ATOM 1161 CA MET A 79 14.472 8.877 -29.110 1.00 0.00 C ATOM 1162 C MET A 79 13.518 9.089 -27.917 1.00 0.00 C ATOM 1163 O MET A 79 12.931 10.162 -27.769 1.00 0.00 O ATOM 1164 CB MET A 79 15.921 9.265 -28.751 1.00 0.00 C ATOM 1165 CG MET A 79 16.553 8.399 -27.653 1.00 0.00 C ATOM 1166 SD MET A 79 16.511 6.600 -27.923 1.00 0.00 S ATOM 1167 CE MET A 79 17.550 6.456 -29.404 1.00 0.00 C ATOM 0 H MET A 79 13.605 10.546 -30.019 1.00 0.00 H new ATOM 0 HA MET A 79 14.434 7.815 -29.354 1.00 0.00 H new ATOM 0 HB2 MET A 79 16.536 9.198 -29.649 1.00 0.00 H new ATOM 0 HB3 MET A 79 15.937 10.307 -28.430 1.00 0.00 H new ATOM 0 HG2 MET A 79 17.593 8.703 -27.533 1.00 0.00 H new ATOM 0 HG3 MET A 79 16.047 8.616 -26.712 1.00 0.00 H new ATOM 0 HE1 MET A 79 17.666 5.404 -29.666 1.00 0.00 H new ATOM 0 HE2 MET A 79 17.079 6.986 -30.232 1.00 0.00 H new ATOM 0 HE3 MET A 79 18.530 6.891 -29.205 1.00 0.00 H new ATOM 1177 N LEU A 80 13.374 8.069 -27.060 1.00 0.00 N ATOM 1178 CA LEU A 80 12.491 8.057 -25.883 1.00 0.00 C ATOM 1179 C LEU A 80 13.224 7.576 -24.614 1.00 0.00 C ATOM 1180 O LEU A 80 14.217 6.846 -24.687 1.00 0.00 O ATOM 1181 CB LEU A 80 11.260 7.169 -26.170 1.00 0.00 C ATOM 1182 CG LEU A 80 10.322 7.669 -27.287 1.00 0.00 C ATOM 1183 CD1 LEU A 80 9.235 6.626 -27.552 1.00 0.00 C ATOM 1184 CD2 LEU A 80 9.627 8.982 -26.923 1.00 0.00 C ATOM 0 H LEU A 80 13.889 7.195 -27.171 1.00 0.00 H new ATOM 0 HA LEU A 80 12.167 9.080 -25.693 1.00 0.00 H new ATOM 0 HB2 LEU A 80 11.609 6.170 -26.433 1.00 0.00 H new ATOM 0 HB3 LEU A 80 10.682 7.073 -25.251 1.00 0.00 H new ATOM 0 HG LEU A 80 10.943 7.834 -28.167 1.00 0.00 H new ATOM 0 HD11 LEU A 80 8.574 6.982 -28.342 1.00 0.00 H new ATOM 0 HD12 LEU A 80 9.698 5.689 -27.861 1.00 0.00 H new ATOM 0 HD13 LEU A 80 8.658 6.463 -26.642 1.00 0.00 H new ATOM 0 HD21 LEU A 80 8.978 9.290 -27.743 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.030 8.840 -26.022 1.00 0.00 H new ATOM 0 HD23 LEU A 80 10.376 9.753 -26.744 1.00 0.00 H new ATOM 1196 N TYR A 81 12.707 7.973 -23.449 1.00 0.00 N ATOM 1197 CA TYR A 81 13.220 7.626 -22.115 1.00 0.00 C ATOM 1198 C TYR A 81 12.079 7.459 -21.091 1.00 0.00 C ATOM 1199 O TYR A 81 10.959 7.933 -21.299 1.00 0.00 O ATOM 1200 CB TYR A 81 14.233 8.694 -21.654 1.00 0.00 C ATOM 1201 CG TYR A 81 13.690 10.112 -21.615 1.00 0.00 C ATOM 1202 CD1 TYR A 81 12.957 10.563 -20.499 1.00 0.00 C ATOM 1203 CD2 TYR A 81 13.897 10.974 -22.710 1.00 0.00 C ATOM 1204 CE1 TYR A 81 12.413 11.862 -20.487 1.00 0.00 C ATOM 1205 CE2 TYR A 81 13.360 12.276 -22.702 1.00 0.00 C ATOM 1206 CZ TYR A 81 12.607 12.720 -21.592 1.00 0.00 C ATOM 1207 OH TYR A 81 12.072 13.975 -21.582 1.00 0.00 O ATOM 0 H TYR A 81 11.883 8.572 -23.404 1.00 0.00 H new ATOM 0 HA TYR A 81 13.727 6.663 -22.181 1.00 0.00 H new ATOM 0 HB2 TYR A 81 14.591 8.430 -20.659 1.00 0.00 H new ATOM 0 HB3 TYR A 81 15.095 8.668 -22.320 1.00 0.00 H new ATOM 0 HD1 TYR A 81 12.812 9.911 -19.651 1.00 0.00 H new ATOM 0 HD2 TYR A 81 14.470 10.635 -23.560 1.00 0.00 H new ATOM 0 HE1 TYR A 81 11.847 12.202 -19.632 1.00 0.00 H new ATOM 0 HE2 TYR A 81 13.524 12.934 -23.543 1.00 0.00 H new ATOM 0 HH TYR A 81 12.300 14.434 -22.417 1.00 0.00 H new ATOM 1217 N ASP A 82 12.370 6.795 -19.966 1.00 0.00 N ATOM 1218 CA ASP A 82 11.461 6.637 -18.819 1.00 0.00 C ATOM 1219 C ASP A 82 12.251 6.559 -17.495 1.00 0.00 C ATOM 1220 O ASP A 82 13.240 5.826 -17.399 1.00 0.00 O ATOM 1221 CB ASP A 82 10.601 5.378 -19.014 1.00 0.00 C ATOM 1222 CG ASP A 82 9.621 5.181 -17.847 1.00 0.00 C ATOM 1223 OD1 ASP A 82 8.717 6.033 -17.666 1.00 0.00 O ATOM 1224 OD2 ASP A 82 9.747 4.175 -17.108 1.00 0.00 O ATOM 0 H ASP A 82 13.271 6.338 -19.822 1.00 0.00 H new ATOM 0 HA ASP A 82 10.809 7.509 -18.764 1.00 0.00 H new ATOM 0 HB2 ASP A 82 10.045 5.457 -19.948 1.00 0.00 H new ATOM 0 HB3 ASP A 82 11.247 4.504 -19.100 1.00 0.00 H new ATOM 1229 N SER A 83 11.824 7.318 -16.479 1.00 0.00 N ATOM 1230 CA SER A 83 12.435 7.341 -15.138 1.00 0.00 C ATOM 1231 C SER A 83 11.448 7.837 -14.064 1.00 0.00 C ATOM 1232 O SER A 83 10.354 8.316 -14.372 1.00 0.00 O ATOM 1233 CB SER A 83 13.700 8.216 -15.159 1.00 0.00 C ATOM 1234 OG SER A 83 14.482 7.970 -13.999 1.00 0.00 O ATOM 0 H SER A 83 11.027 7.948 -16.565 1.00 0.00 H new ATOM 0 HA SER A 83 12.707 6.319 -14.874 1.00 0.00 H new ATOM 0 HB2 SER A 83 14.285 8.002 -16.054 1.00 0.00 H new ATOM 0 HB3 SER A 83 13.423 9.269 -15.204 1.00 0.00 H new ATOM 0 HG SER A 83 15.286 8.530 -14.022 1.00 0.00 H new ATOM 1240 N ASP A 84 11.843 7.755 -12.793 1.00 0.00 N ATOM 1241 CA ASP A 84 11.058 8.108 -11.601 1.00 0.00 C ATOM 1242 C ASP A 84 10.970 9.627 -11.322 1.00 0.00 C ATOM 1243 O ASP A 84 10.791 10.030 -10.178 1.00 0.00 O ATOM 1244 CB ASP A 84 11.594 7.307 -10.393 1.00 0.00 C ATOM 1245 CG ASP A 84 11.044 5.875 -10.356 1.00 0.00 C ATOM 1246 OD1 ASP A 84 11.640 4.966 -10.981 1.00 0.00 O ATOM 1247 OD2 ASP A 84 10.018 5.660 -9.665 1.00 0.00 O ATOM 0 H ASP A 84 12.775 7.421 -12.549 1.00 0.00 H new ATOM 0 HA ASP A 84 10.022 7.827 -11.791 1.00 0.00 H new ATOM 0 HB2 ASP A 84 12.683 7.275 -10.435 1.00 0.00 H new ATOM 0 HB3 ASP A 84 11.325 7.821 -9.470 1.00 0.00 H new ATOM 1252 N SER A 85 11.079 10.490 -12.339 1.00 0.00 N ATOM 1253 CA SER A 85 11.191 11.957 -12.202 1.00 0.00 C ATOM 1254 C SER A 85 10.198 12.590 -11.216 1.00 0.00 C ATOM 1255 O SER A 85 10.617 13.329 -10.330 1.00 0.00 O ATOM 1256 CB SER A 85 11.029 12.596 -13.584 1.00 0.00 C ATOM 1257 OG SER A 85 12.237 12.430 -14.312 1.00 0.00 O ATOM 0 H SER A 85 11.093 10.183 -13.312 1.00 0.00 H new ATOM 0 HA SER A 85 12.177 12.152 -11.781 1.00 0.00 H new ATOM 0 HB2 SER A 85 10.200 12.133 -14.119 1.00 0.00 H new ATOM 0 HB3 SER A 85 10.792 13.655 -13.484 1.00 0.00 H new ATOM 0 HG SER A 85 12.142 12.835 -15.200 1.00 0.00 H new ATOM 1263 N GLN A 86 8.903 12.255 -11.289 1.00 0.00 N ATOM 1264 CA GLN A 86 7.879 12.810 -10.379 1.00 0.00 C ATOM 1265 C GLN A 86 7.996 12.271 -8.940 1.00 0.00 C ATOM 1266 O GLN A 86 7.861 13.027 -7.981 1.00 0.00 O ATOM 1267 CB GLN A 86 6.471 12.549 -10.953 1.00 0.00 C ATOM 1268 CG GLN A 86 6.178 13.295 -12.271 1.00 0.00 C ATOM 1269 CD GLN A 86 6.052 14.818 -12.145 1.00 0.00 C ATOM 1270 OE1 GLN A 86 6.125 15.412 -11.077 1.00 0.00 O ATOM 1271 NE2 GLN A 86 5.845 15.519 -13.240 1.00 0.00 N ATOM 0 H GLN A 86 8.532 11.596 -11.974 1.00 0.00 H new ATOM 0 HA GLN A 86 8.052 13.884 -10.314 1.00 0.00 H new ATOM 0 HB2 GLN A 86 6.352 11.479 -11.120 1.00 0.00 H new ATOM 0 HB3 GLN A 86 5.728 12.841 -10.210 1.00 0.00 H new ATOM 0 HG2 GLN A 86 6.973 13.070 -12.982 1.00 0.00 H new ATOM 0 HG3 GLN A 86 5.253 12.904 -12.693 1.00 0.00 H new ATOM 0 HE21 GLN A 86 5.780 15.048 -14.142 1.00 0.00 H new ATOM 0 HE22 GLN A 86 5.749 16.533 -13.186 1.00 0.00 H new ATOM 1280 N GLN A 87 8.299 10.979 -8.774 1.00 0.00 N ATOM 1281 CA GLN A 87 8.473 10.334 -7.460 1.00 0.00 C ATOM 1282 C GLN A 87 9.761 10.810 -6.753 1.00 0.00 C ATOM 1283 O GLN A 87 9.737 11.183 -5.573 1.00 0.00 O ATOM 1284 CB GLN A 87 8.400 8.813 -7.703 1.00 0.00 C ATOM 1285 CG GLN A 87 8.693 7.939 -6.478 1.00 0.00 C ATOM 1286 CD GLN A 87 7.963 6.593 -6.533 1.00 0.00 C ATOM 1287 OE1 GLN A 87 7.073 6.319 -5.739 1.00 0.00 O ATOM 1288 NE2 GLN A 87 8.277 5.702 -7.450 1.00 0.00 N ATOM 0 H GLN A 87 8.433 10.340 -9.557 1.00 0.00 H new ATOM 0 HA GLN A 87 7.685 10.618 -6.763 1.00 0.00 H new ATOM 0 HB2 GLN A 87 7.405 8.568 -8.074 1.00 0.00 H new ATOM 0 HB3 GLN A 87 9.106 8.553 -8.491 1.00 0.00 H new ATOM 0 HG2 GLN A 87 9.767 7.764 -6.408 1.00 0.00 H new ATOM 0 HG3 GLN A 87 8.397 8.473 -5.575 1.00 0.00 H new ATOM 0 HE21 GLN A 87 9.015 5.903 -8.125 1.00 0.00 H new ATOM 0 HE22 GLN A 87 7.782 4.811 -7.485 1.00 0.00 H new ATOM 1297 N ILE A 88 10.858 10.906 -7.512 1.00 0.00 N ATOM 1298 CA ILE A 88 12.115 11.529 -7.073 1.00 0.00 C ATOM 1299 C ILE A 88 11.877 12.998 -6.716 1.00 0.00 C ATOM 1300 O ILE A 88 12.263 13.401 -5.628 1.00 0.00 O ATOM 1301 CB ILE A 88 13.224 11.357 -8.142 1.00 0.00 C ATOM 1302 CG1 ILE A 88 13.630 9.879 -8.346 1.00 0.00 C ATOM 1303 CG2 ILE A 88 14.473 12.197 -7.806 1.00 0.00 C ATOM 1304 CD1 ILE A 88 14.458 9.234 -7.221 1.00 0.00 C ATOM 0 H ILE A 88 10.900 10.547 -8.466 1.00 0.00 H new ATOM 0 HA ILE A 88 12.466 11.023 -6.174 1.00 0.00 H new ATOM 0 HB ILE A 88 12.794 11.719 -9.076 1.00 0.00 H new ATOM 0 HG12 ILE A 88 12.722 9.291 -8.482 1.00 0.00 H new ATOM 0 HG13 ILE A 88 14.198 9.806 -9.273 1.00 0.00 H new ATOM 0 HG21 ILE A 88 15.228 12.050 -8.578 1.00 0.00 H new ATOM 0 HG22 ILE A 88 14.201 13.251 -7.760 1.00 0.00 H new ATOM 0 HG23 ILE A 88 14.874 11.884 -6.842 1.00 0.00 H new ATOM 0 HD11 ILE A 88 14.680 8.199 -7.480 1.00 0.00 H new ATOM 0 HD12 ILE A 88 15.390 9.784 -7.094 1.00 0.00 H new ATOM 0 HD13 ILE A 88 13.891 9.261 -6.290 1.00 0.00 H new ATOM 1316 N LEU A 89 11.186 13.787 -7.549 1.00 0.00 N ATOM 1317 CA LEU A 89 10.838 15.177 -7.221 1.00 0.00 C ATOM 1318 C LEU A 89 10.051 15.267 -5.912 1.00 0.00 C ATOM 1319 O LEU A 89 10.419 16.069 -5.060 1.00 0.00 O ATOM 1320 CB LEU A 89 10.041 15.807 -8.388 1.00 0.00 C ATOM 1321 CG LEU A 89 9.583 17.264 -8.163 1.00 0.00 C ATOM 1322 CD1 LEU A 89 10.765 18.237 -8.164 1.00 0.00 C ATOM 1323 CD2 LEU A 89 8.619 17.691 -9.268 1.00 0.00 C ATOM 0 H LEU A 89 10.854 13.483 -8.464 1.00 0.00 H new ATOM 0 HA LEU A 89 11.763 15.736 -7.079 1.00 0.00 H new ATOM 0 HB2 LEU A 89 10.656 15.772 -9.287 1.00 0.00 H new ATOM 0 HB3 LEU A 89 9.161 15.192 -8.579 1.00 0.00 H new ATOM 0 HG LEU A 89 9.093 17.296 -7.190 1.00 0.00 H new ATOM 0 HD11 LEU A 89 10.401 19.252 -8.003 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.458 17.969 -7.366 1.00 0.00 H new ATOM 0 HD13 LEU A 89 11.279 18.184 -9.124 1.00 0.00 H new ATOM 0 HD21 LEU A 89 8.303 18.720 -9.098 1.00 0.00 H new ATOM 0 HD22 LEU A 89 9.118 17.620 -10.234 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.746 17.038 -9.262 1.00 0.00 H new ATOM 1335 N ASN A 90 9.028 14.427 -5.721 1.00 0.00 N ATOM 1336 CA ASN A 90 8.224 14.435 -4.501 1.00 0.00 C ATOM 1337 C ASN A 90 9.102 14.202 -3.261 1.00 0.00 C ATOM 1338 O ASN A 90 9.191 15.085 -2.407 1.00 0.00 O ATOM 1339 CB ASN A 90 7.090 13.398 -4.645 1.00 0.00 C ATOM 1340 CG ASN A 90 6.085 13.417 -3.498 1.00 0.00 C ATOM 1341 OD1 ASN A 90 6.028 14.323 -2.680 1.00 0.00 O ATOM 1342 ND2 ASN A 90 5.242 12.413 -3.414 1.00 0.00 N ATOM 0 H ASN A 90 8.738 13.728 -6.405 1.00 0.00 H new ATOM 0 HA ASN A 90 7.767 15.414 -4.357 1.00 0.00 H new ATOM 0 HB2 ASN A 90 6.562 13.580 -5.581 1.00 0.00 H new ATOM 0 HB3 ASN A 90 7.528 12.402 -4.714 1.00 0.00 H new ATOM 0 HD21 ASN A 90 4.545 12.393 -2.669 1.00 0.00 H new ATOM 0 HD22 ASN A 90 5.284 11.654 -4.094 1.00 0.00 H new ATOM 1349 N ARG A 91 9.862 13.094 -3.194 1.00 0.00 N ATOM 1350 CA ARG A 91 10.710 12.833 -2.007 1.00 0.00 C ATOM 1351 C ARG A 91 11.890 13.807 -1.889 1.00 0.00 C ATOM 1352 O ARG A 91 12.284 14.139 -0.777 1.00 0.00 O ATOM 1353 CB ARG A 91 11.101 11.343 -1.954 1.00 0.00 C ATOM 1354 CG ARG A 91 11.980 10.906 -0.760 1.00 0.00 C ATOM 1355 CD ARG A 91 11.564 11.382 0.645 1.00 0.00 C ATOM 1356 NE ARG A 91 10.138 11.157 0.939 1.00 0.00 N ATOM 1357 CZ ARG A 91 9.580 10.196 1.644 1.00 0.00 C ATOM 1358 NH1 ARG A 91 10.250 9.186 2.116 1.00 0.00 N ATOM 1359 NH2 ARG A 91 8.307 10.276 1.872 1.00 0.00 N ATOM 0 H ARG A 91 9.910 12.381 -3.922 1.00 0.00 H new ATOM 0 HA ARG A 91 10.124 13.036 -1.110 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.187 10.750 -1.940 1.00 0.00 H new ATOM 0 HB3 ARG A 91 11.628 11.095 -2.875 1.00 0.00 H new ATOM 0 HG2 ARG A 91 12.014 9.817 -0.749 1.00 0.00 H new ATOM 0 HG3 ARG A 91 12.996 11.255 -0.946 1.00 0.00 H new ATOM 0 HD2 ARG A 91 12.167 10.863 1.390 1.00 0.00 H new ATOM 0 HD3 ARG A 91 11.784 12.445 0.741 1.00 0.00 H new ATOM 0 HE ARG A 91 9.494 11.841 0.541 1.00 0.00 H new ATOM 0 HH11 ARG A 91 11.253 9.115 1.945 1.00 0.00 H new ATOM 0 HH12 ARG A 91 9.772 8.465 2.657 1.00 0.00 H new ATOM 0 HH21 ARG A 91 7.772 11.065 1.509 1.00 0.00 H new ATOM 0 HH22 ARG A 91 7.839 9.550 2.415 1.00 0.00 H new ATOM 1373 N LEU A 92 12.403 14.354 -2.989 1.00 0.00 N ATOM 1374 CA LEU A 92 13.467 15.364 -2.952 1.00 0.00 C ATOM 1375 C LEU A 92 12.959 16.675 -2.341 1.00 0.00 C ATOM 1376 O LEU A 92 13.593 17.210 -1.433 1.00 0.00 O ATOM 1377 CB LEU A 92 14.009 15.514 -4.385 1.00 0.00 C ATOM 1378 CG LEU A 92 15.184 16.463 -4.624 1.00 0.00 C ATOM 1379 CD1 LEU A 92 14.812 17.937 -4.575 1.00 0.00 C ATOM 1380 CD2 LEU A 92 16.348 16.214 -3.669 1.00 0.00 C ATOM 0 H LEU A 92 12.096 14.112 -3.931 1.00 0.00 H new ATOM 0 HA LEU A 92 14.287 15.056 -2.303 1.00 0.00 H new ATOM 0 HB2 LEU A 92 14.306 14.524 -4.733 1.00 0.00 H new ATOM 0 HB3 LEU A 92 13.185 15.841 -5.019 1.00 0.00 H new ATOM 0 HG LEU A 92 15.497 16.231 -5.642 1.00 0.00 H new ATOM 0 HD11 LEU A 92 15.700 18.543 -4.754 1.00 0.00 H new ATOM 0 HD12 LEU A 92 14.067 18.150 -5.342 1.00 0.00 H new ATOM 0 HD13 LEU A 92 14.401 18.176 -3.594 1.00 0.00 H new ATOM 0 HD21 LEU A 92 17.153 16.917 -3.885 1.00 0.00 H new ATOM 0 HD22 LEU A 92 16.012 16.353 -2.642 1.00 0.00 H new ATOM 0 HD23 LEU A 92 16.712 15.195 -3.797 1.00 0.00 H new ATOM 1392 N ARG A 93 11.792 17.163 -2.778 1.00 0.00 N ATOM 1393 CA ARG A 93 11.154 18.350 -2.177 1.00 0.00 C ATOM 1394 C ARG A 93 10.818 18.121 -0.706 1.00 0.00 C ATOM 1395 O ARG A 93 11.104 18.991 0.109 1.00 0.00 O ATOM 1396 CB ARG A 93 9.913 18.807 -2.968 1.00 0.00 C ATOM 1397 CG ARG A 93 10.266 19.356 -4.361 1.00 0.00 C ATOM 1398 CD ARG A 93 9.095 20.111 -5.008 1.00 0.00 C ATOM 1399 NE ARG A 93 9.042 21.524 -4.568 1.00 0.00 N ATOM 1400 CZ ARG A 93 9.641 22.563 -5.129 1.00 0.00 C ATOM 1401 NH1 ARG A 93 10.410 22.473 -6.173 1.00 0.00 N ATOM 1402 NH2 ARG A 93 9.511 23.769 -4.666 1.00 0.00 N ATOM 0 H ARG A 93 11.265 16.755 -3.550 1.00 0.00 H new ATOM 0 HA ARG A 93 11.883 19.159 -2.230 1.00 0.00 H new ATOM 0 HB2 ARG A 93 9.227 17.967 -3.076 1.00 0.00 H new ATOM 0 HB3 ARG A 93 9.389 19.576 -2.401 1.00 0.00 H new ATOM 0 HG2 ARG A 93 11.124 20.024 -4.279 1.00 0.00 H new ATOM 0 HG3 ARG A 93 10.565 18.531 -5.008 1.00 0.00 H new ATOM 0 HD2 ARG A 93 9.192 20.071 -6.093 1.00 0.00 H new ATOM 0 HD3 ARG A 93 8.158 19.616 -4.754 1.00 0.00 H new ATOM 0 HE ARG A 93 8.481 21.719 -3.739 1.00 0.00 H new ATOM 0 HH11 ARG A 93 10.579 21.565 -6.605 1.00 0.00 H new ATOM 0 HH12 ARG A 93 10.844 23.311 -6.560 1.00 0.00 H new ATOM 0 HH21 ARG A 93 8.932 23.940 -3.844 1.00 0.00 H new ATOM 0 HH22 ARG A 93 9.988 24.545 -5.125 1.00 0.00 H new ATOM 1416 N GLU A 94 10.323 16.940 -0.326 1.00 0.00 N ATOM 1417 CA GLU A 94 10.086 16.618 1.093 1.00 0.00 C ATOM 1418 C GLU A 94 11.385 16.652 1.922 1.00 0.00 C ATOM 1419 O GLU A 94 11.433 17.309 2.964 1.00 0.00 O ATOM 1420 CB GLU A 94 9.397 15.252 1.246 1.00 0.00 C ATOM 1421 CG GLU A 94 7.968 15.226 0.693 1.00 0.00 C ATOM 1422 CD GLU A 94 7.294 13.856 0.922 1.00 0.00 C ATOM 1423 OE1 GLU A 94 7.923 12.798 0.666 1.00 0.00 O ATOM 1424 OE2 GLU A 94 6.127 13.823 1.387 1.00 0.00 O ATOM 0 H GLU A 94 10.078 16.191 -0.974 1.00 0.00 H new ATOM 0 HA GLU A 94 9.423 17.391 1.481 1.00 0.00 H new ATOM 0 HB2 GLU A 94 9.991 14.495 0.734 1.00 0.00 H new ATOM 0 HB3 GLU A 94 9.375 14.980 2.301 1.00 0.00 H new ATOM 0 HG2 GLU A 94 7.378 16.007 1.172 1.00 0.00 H new ATOM 0 HG3 GLU A 94 7.986 15.449 -0.374 1.00 0.00 H new ATOM 1431 N ARG A 95 12.459 16.007 1.431 1.00 0.00 N ATOM 1432 CA ARG A 95 13.784 15.990 2.086 1.00 0.00 C ATOM 1433 C ARG A 95 14.338 17.408 2.286 1.00 0.00 C ATOM 1434 O ARG A 95 14.837 17.723 3.366 1.00 0.00 O ATOM 1435 CB ARG A 95 14.753 15.108 1.262 1.00 0.00 C ATOM 1436 CG ARG A 95 16.200 15.113 1.800 1.00 0.00 C ATOM 1437 CD ARG A 95 17.204 14.405 0.880 1.00 0.00 C ATOM 1438 NE ARG A 95 17.401 12.984 1.224 1.00 0.00 N ATOM 1439 CZ ARG A 95 18.553 12.348 1.346 1.00 0.00 C ATOM 1440 NH1 ARG A 95 19.727 12.908 1.318 1.00 0.00 N ATOM 1441 NH2 ARG A 95 18.580 11.066 1.502 1.00 0.00 N ATOM 0 H ARG A 95 12.433 15.477 0.560 1.00 0.00 H new ATOM 0 HA ARG A 95 13.677 15.560 3.082 1.00 0.00 H new ATOM 0 HB2 ARG A 95 14.381 14.084 1.253 1.00 0.00 H new ATOM 0 HB3 ARG A 95 14.757 15.454 0.229 1.00 0.00 H new ATOM 0 HG2 ARG A 95 16.520 16.145 1.946 1.00 0.00 H new ATOM 0 HG3 ARG A 95 16.216 14.633 2.778 1.00 0.00 H new ATOM 0 HD2 ARG A 95 16.858 14.479 -0.151 1.00 0.00 H new ATOM 0 HD3 ARG A 95 18.162 14.922 0.932 1.00 0.00 H new ATOM 0 HE ARG A 95 16.558 12.433 1.385 1.00 0.00 H new ATOM 0 HH11 ARG A 95 19.808 13.917 1.194 1.00 0.00 H new ATOM 0 HH12 ARG A 95 20.567 12.338 1.420 1.00 0.00 H new ATOM 0 HH21 ARG A 95 17.708 10.537 1.532 1.00 0.00 H new ATOM 0 HH22 ARG A 95 19.473 10.582 1.595 1.00 0.00 H new ATOM 1455 N VAL A 96 14.266 18.250 1.250 1.00 0.00 N ATOM 1456 CA VAL A 96 14.905 19.583 1.250 1.00 0.00 C ATOM 1457 C VAL A 96 14.058 20.633 1.975 1.00 0.00 C ATOM 1458 O VAL A 96 14.611 21.444 2.721 1.00 0.00 O ATOM 1459 CB VAL A 96 15.280 20.011 -0.181 1.00 0.00 C ATOM 1460 CG1 VAL A 96 15.906 21.410 -0.221 1.00 0.00 C ATOM 1461 CG2 VAL A 96 16.326 19.043 -0.746 1.00 0.00 C ATOM 0 H VAL A 96 13.766 18.034 0.387 1.00 0.00 H new ATOM 0 HA VAL A 96 15.831 19.506 1.819 1.00 0.00 H new ATOM 0 HB VAL A 96 14.358 20.008 -0.763 1.00 0.00 H new ATOM 0 HG11 VAL A 96 16.154 21.668 -1.251 1.00 0.00 H new ATOM 0 HG12 VAL A 96 15.197 22.137 0.175 1.00 0.00 H new ATOM 0 HG13 VAL A 96 16.813 21.420 0.384 1.00 0.00 H new ATOM 0 HG21 VAL A 96 16.592 19.345 -1.759 1.00 0.00 H new ATOM 0 HG22 VAL A 96 17.216 19.061 -0.117 1.00 0.00 H new ATOM 0 HG23 VAL A 96 15.915 18.034 -0.765 1.00 0.00 H new ATOM 1471 N SER A 97 12.728 20.596 1.831 1.00 0.00 N ATOM 1472 CA SER A 97 11.824 21.469 2.596 1.00 0.00 C ATOM 1473 C SER A 97 11.686 21.030 4.069 1.00 0.00 C ATOM 1474 O SER A 97 11.351 21.854 4.924 1.00 0.00 O ATOM 1475 CB SER A 97 10.438 21.546 1.944 1.00 0.00 C ATOM 1476 OG SER A 97 10.534 22.150 0.660 1.00 0.00 O ATOM 0 H SER A 97 12.249 19.966 1.187 1.00 0.00 H new ATOM 0 HA SER A 97 12.278 22.460 2.585 1.00 0.00 H new ATOM 0 HB2 SER A 97 10.014 20.546 1.853 1.00 0.00 H new ATOM 0 HB3 SER A 97 9.762 22.122 2.576 1.00 0.00 H new ATOM 0 HG SER A 97 9.644 22.193 0.251 1.00 0.00 H new ATOM 1482 N GLY A 98 11.971 19.755 4.383 1.00 0.00 N ATOM 1483 CA GLY A 98 12.088 19.221 5.751 1.00 0.00 C ATOM 1484 C GLY A 98 10.850 18.478 6.276 1.00 0.00 C ATOM 1485 O GLY A 98 10.792 18.149 7.461 1.00 0.00 O ATOM 0 H GLY A 98 12.131 19.045 3.669 1.00 0.00 H new ATOM 0 HA2 GLY A 98 12.940 18.542 5.786 1.00 0.00 H new ATOM 0 HA3 GLY A 98 12.309 20.046 6.427 1.00 0.00 H new ATOM 1489 N SER A 99 9.865 18.188 5.418 1.00 0.00 N ATOM 1490 CA SER A 99 8.607 17.511 5.781 1.00 0.00 C ATOM 1491 C SER A 99 8.726 15.983 5.931 1.00 0.00 C ATOM 1492 O SER A 99 7.751 15.321 6.296 1.00 0.00 O ATOM 1493 CB SER A 99 7.501 17.895 4.794 1.00 0.00 C ATOM 1494 OG SER A 99 7.901 17.631 3.458 1.00 0.00 O ATOM 0 H SER A 99 9.919 18.422 4.427 1.00 0.00 H new ATOM 0 HA SER A 99 8.345 17.866 6.778 1.00 0.00 H new ATOM 0 HB2 SER A 99 6.593 17.337 5.023 1.00 0.00 H new ATOM 0 HB3 SER A 99 7.261 18.953 4.904 1.00 0.00 H new ATOM 0 HG SER A 99 7.179 17.882 2.845 1.00 0.00 H new ATOM 1500 N THR A 100 9.918 15.408 5.719 1.00 0.00 N ATOM 1501 CA THR A 100 10.234 14.000 6.039 1.00 0.00 C ATOM 1502 C THR A 100 10.295 13.723 7.551 1.00 0.00 C ATOM 1503 O THR A 100 10.126 12.574 7.967 1.00 0.00 O ATOM 1504 CB THR A 100 11.577 13.576 5.419 1.00 0.00 C ATOM 1505 OG1 THR A 100 12.557 14.561 5.684 1.00 0.00 O ATOM 1506 CG2 THR A 100 11.479 13.423 3.905 1.00 0.00 C ATOM 0 H THR A 100 10.706 15.913 5.314 1.00 0.00 H new ATOM 0 HA THR A 100 9.416 13.418 5.614 1.00 0.00 H new ATOM 0 HB THR A 100 11.846 12.617 5.862 1.00 0.00 H new ATOM 0 HG1 THR A 100 13.411 14.287 5.289 1.00 0.00 H new ATOM 0 HG21 THR A 100 12.448 13.123 3.506 1.00 0.00 H new ATOM 0 HG22 THR A 100 10.736 12.663 3.663 1.00 0.00 H new ATOM 0 HG23 THR A 100 11.183 14.374 3.462 1.00 0.00 H new ATOM 1514 N ALA A 101 10.504 14.750 8.386 1.00 0.00 N ATOM 1515 CA ALA A 101 10.519 14.629 9.847 1.00 0.00 C ATOM 1516 C ALA A 101 9.115 14.337 10.426 1.00 0.00 C ATOM 1517 O ALA A 101 8.113 14.894 9.972 1.00 0.00 O ATOM 1518 CB ALA A 101 11.136 15.903 10.441 1.00 0.00 C ATOM 0 H ALA A 101 10.670 15.702 8.059 1.00 0.00 H new ATOM 0 HA ALA A 101 11.131 13.771 10.126 1.00 0.00 H new ATOM 0 HB1 ALA A 101 11.153 15.826 11.528 1.00 0.00 H new ATOM 0 HB2 ALA A 101 12.154 16.022 10.069 1.00 0.00 H new ATOM 0 HB3 ALA A 101 10.540 16.767 10.148 1.00 0.00 H new ATOM 1524 N GLN A 102 9.047 13.478 11.454 1.00 0.00 N ATOM 1525 CA GLN A 102 7.781 13.023 12.063 1.00 0.00 C ATOM 1526 C GLN A 102 7.283 13.917 13.220 1.00 0.00 C ATOM 1527 O GLN A 102 6.118 13.809 13.616 1.00 0.00 O ATOM 1528 CB GLN A 102 7.929 11.560 12.519 1.00 0.00 C ATOM 1529 CG GLN A 102 8.181 10.591 11.350 1.00 0.00 C ATOM 1530 CD GLN A 102 8.191 9.133 11.811 1.00 0.00 C ATOM 1531 OE1 GLN A 102 7.215 8.403 11.689 1.00 0.00 O ATOM 1532 NE2 GLN A 102 9.285 8.648 12.365 1.00 0.00 N ATOM 0 H GLN A 102 9.875 13.074 11.892 1.00 0.00 H new ATOM 0 HA GLN A 102 7.013 13.100 11.293 1.00 0.00 H new ATOM 0 HB2 GLN A 102 8.753 11.487 13.229 1.00 0.00 H new ATOM 0 HB3 GLN A 102 7.026 11.256 13.048 1.00 0.00 H new ATOM 0 HG2 GLN A 102 7.409 10.727 10.593 1.00 0.00 H new ATOM 0 HG3 GLN A 102 9.135 10.830 10.880 1.00 0.00 H new ATOM 0 HE21 GLN A 102 10.107 9.241 12.475 1.00 0.00 H new ATOM 0 HE22 GLN A 102 9.309 7.679 12.684 1.00 0.00 H new ATOM 1541 N SER A 103 8.137 14.808 13.743 1.00 0.00 N ATOM 1542 CA SER A 103 7.856 15.690 14.893 1.00 0.00 C ATOM 1543 C SER A 103 8.378 17.118 14.671 1.00 0.00 C ATOM 1544 O SER A 103 9.350 17.326 13.932 1.00 0.00 O ATOM 1545 CB SER A 103 8.487 15.123 16.175 1.00 0.00 C ATOM 1546 OG SER A 103 7.969 13.835 16.484 1.00 0.00 O ATOM 0 H SER A 103 9.076 14.942 13.367 1.00 0.00 H new ATOM 0 HA SER A 103 6.772 15.733 14.996 1.00 0.00 H new ATOM 0 HB2 SER A 103 9.568 15.062 16.054 1.00 0.00 H new ATOM 0 HB3 SER A 103 8.297 15.802 17.006 1.00 0.00 H new ATOM 0 HG SER A 103 8.391 13.501 17.303 1.00 0.00 H new ATOM 1552 N ALA A 104 7.742 18.101 15.322 1.00 0.00 N ATOM 1553 CA ALA A 104 8.139 19.518 15.308 1.00 0.00 C ATOM 1554 C ALA A 104 9.406 19.796 16.150 1.00 0.00 C ATOM 1555 O ALA A 104 10.267 20.581 15.689 1.00 0.00 O ATOM 1556 CB ALA A 104 6.945 20.375 15.754 1.00 0.00 C ATOM 1557 OXT ALA A 104 9.532 19.245 17.271 1.00 0.00 O ATOM 0 H ALA A 104 6.913 17.929 15.890 1.00 0.00 H new ATOM 0 HA ALA A 104 8.414 19.790 14.289 1.00 0.00 H new ATOM 0 HB1 ALA A 104 7.230 21.427 15.747 1.00 0.00 H new ATOM 0 HB2 ALA A 104 6.110 20.220 15.070 1.00 0.00 H new ATOM 0 HB3 ALA A 104 6.647 20.087 16.762 1.00 0.00 H new TER 1563 ALA A 104