USER MOD reduce.3.24.130724 H: found=0, std=0, add=1411, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1411 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 88 ASN : amide:sc= 0 K(o=-0.88,f=-1.9) USER MOD Set 1.2: A 133 TYR OH : rot 101:sc= -0.879 USER MOD Set 2.1: A 16 LYS NZ :NH3+ 155:sc= 0.769 (180deg=0) USER MOD Set 2.2: A 19 GLN : amide:sc= 0.415 K(o=0.91,f=-13!) USER MOD Set 2.3: A 20 LYS NZ :NH3+ -166:sc= -0.277 (180deg=-0.222) USER MOD Single : A 1 MET CE :methyl 158:sc= -0.252 (180deg=-0.998) USER MOD Single : A 1 MET N :NH3+ -122:sc= 0.401 (180deg=-0.179) USER MOD Single : A 2 SER OG : rot -1:sc= 0.757 USER MOD Single : A 3 GLN : amide:sc= -1.91! C(o=-1.9!,f=-7!) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -3.1! C(o=-3.1!,f=-6.5!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 TYR OH : rot 180:sc= 0.438 USER MOD Single : A 18 SER OG : rot -98:sc= 1.3 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.0045 USER MOD Single : A 26 GLN : amide:sc= -1.12 K(o=-1.1,f=-0.044) USER MOD Single : A 28 SER OG : rot 180:sc= -0.0609 USER MOD Single : A 33 ASN : amide:sc= -1.12 K(o=-1.1,f=-0.021) USER MOD Single : A 35 THR OG1 : rot -106:sc= 0.894 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot -163:sc= 1.36 USER MOD Single : A 47 LYS NZ :NH3+ 176:sc= 1.34 (180deg=1.24) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 61 TYR OH : rot 180:sc= 0.412 USER MOD Single : A 66 SER OG : rot 74:sc= 0.46 USER MOD Single : A 69 THR OG1 : rot -81:sc= 1.13 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -1.49! K(o=-1.5!,f=-0.061) USER MOD Single : A 73 HIS : no HD1:sc= -0.151 X(o=-0.15,f=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.463 USER MOD Single : A 80 TYR OH : rot -127:sc= 1.2 USER MOD Single : A 81 GLN : amide:sc= -0.988 K(o=-0.99,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -0.144 X(o=-0.14,f=-0.14) USER MOD Single : A 96 ASN : amide:sc= -0.947 K(o=-0.95,f=-7.8!) USER MOD Single : A 105 SER OG : rot 76:sc= 1.29 USER MOD Single : A 111 CYS SG : rot -77:sc= 0.164 USER MOD Single : A 114 SER OG : rot -84:sc= 1.1 USER MOD Single : A 117 LYS NZ :NH3+ -160:sc= -0.0978 (180deg=-0.531) USER MOD Single : A 119 MET CE :methyl -174:sc= -2.7 (180deg=-2.92) USER MOD Single : A 120 GLN : amide:sc= -0.0698 K(o=-0.07,f=-0.86) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl 176:sc= -3.5! (180deg=-3.73!) USER MOD Single : A 132 THR OG1 : rot 71:sc= 0.867 USER MOD Single : A 135 ASN : amide:sc= -0.254 X(o=-0.25,f=-0.35) USER MOD Single : A 137 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 GLN : amide:sc= -0.217 X(o=-0.22,f=-0.09) USER MOD Single : A 145 ASN : amide:sc= 1.17 K(o=1.2,f=0) USER MOD Single : A 150 THR OG1 : rot 89:sc=-0.00637 USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 ASN : amide:sc= -0.118 K(o=-0.12,f=-2.3!) USER MOD Single : A 158 ASN : amide:sc= -1.05 K(o=-1,f=-3.8!) USER MOD Single : A 163 SER OG : rot -72:sc= 1.12 USER MOD Single : A 165 LYS NZ :NH3+ 163:sc= -0.0551 (180deg=-0.311) USER MOD Single : A 167 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 172 HIS : no HD1:sc= -0.0264 X(o=-0.026,f=0) USER MOD Single : A 173 HIS : no HD1:sc= -1.02 K(o=-1,f=0.27) USER MOD Single : A 174 HIS : no HD1:sc= -0.0418 X(o=-0.042,f=0) USER MOD Single : A 175 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 176 HIS : no HE2:sc= 1.13 K(o=1.1,f=-4.5!) USER MOD Single : A 177 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 180 HIS : no HD1:sc= -0.225 K(o=-0.22,f=-0.73) USER MOD Single : A 181 HIS : no HD1:sc= 0 X(o=0,f=-0.0074) USER MOD Single : A 182 HIS : no HD1:sc= 0 X(o=0,f=-0.0093) USER MOD Single : A 183 HIS : no HD1:sc= -0.0266 X(o=-0.027,f=0) USER MOD Single : A 184 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 185 HIS : no HD1:sc= 0 X(o=0,f=-0.0083) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.001 2.531 17.272 1.00 3.19 N ATOM 2 CA MET A 1 10.226 1.083 17.042 1.00 2.85 C ATOM 3 C MET A 1 10.238 0.775 15.548 1.00 2.27 C ATOM 4 O MET A 1 10.920 -0.149 15.109 1.00 2.72 O ATOM 5 CB MET A 1 9.141 0.235 17.720 1.00 3.07 C ATOM 6 CG MET A 1 9.059 0.404 19.230 1.00 3.85 C ATOM 7 SD MET A 1 8.280 1.955 19.727 1.00 4.63 S ATOM 8 CE MET A 1 6.639 1.764 19.032 1.00 5.45 C ATOM 0 H1 MET A 1 10.794 2.923 17.818 1.00 3.19 H new ATOM 0 H2 MET A 1 9.935 3.022 16.357 1.00 3.19 H new ATOM 0 H3 MET A 1 9.116 2.665 17.802 1.00 3.19 H new ATOM 0 HA MET A 1 11.193 0.831 17.477 1.00 2.85 H new ATOM 0 HB2 MET A 1 8.174 0.490 17.286 1.00 3.07 H new ATOM 0 HB3 MET A 1 9.325 -0.815 17.494 1.00 3.07 H new ATOM 0 HG2 MET A 1 8.498 -0.429 19.653 1.00 3.85 H new ATOM 0 HG3 MET A 1 10.064 0.358 19.650 1.00 3.85 H new ATOM 0 HE1 MET A 1 5.942 2.416 19.559 1.00 5.45 H new ATOM 0 HE2 MET A 1 6.658 2.032 17.976 1.00 5.45 H new ATOM 0 HE3 MET A 1 6.317 0.728 19.138 1.00 5.45 H new ATOM 20 N SER A 2 9.460 1.549 14.785 1.00 1.75 N ATOM 21 CA SER A 2 9.362 1.431 13.322 1.00 1.66 C ATOM 22 C SER A 2 8.951 0.025 12.877 1.00 1.36 C ATOM 23 O SER A 2 9.127 -0.346 11.716 1.00 1.24 O ATOM 24 CB SER A 2 10.674 1.856 12.637 1.00 2.18 C ATOM 25 OG SER A 2 11.762 1.017 12.987 1.00 2.93 O ATOM 0 H SER A 2 8.871 2.287 15.170 1.00 1.75 H new ATOM 0 HA SER A 2 8.573 2.114 13.007 1.00 1.66 H new ATOM 0 HB2 SER A 2 10.538 1.839 11.556 1.00 2.18 H new ATOM 0 HB3 SER A 2 10.908 2.884 12.912 1.00 2.18 H new ATOM 0 HG SER A 2 11.457 0.332 13.619 1.00 2.93 H new ATOM 31 N GLN A 3 8.355 -0.737 13.784 1.00 1.37 N ATOM 32 CA GLN A 3 7.974 -2.106 13.483 1.00 1.24 C ATOM 33 C GLN A 3 6.631 -2.141 12.774 1.00 0.92 C ATOM 34 O GLN A 3 6.442 -2.913 11.837 1.00 0.86 O ATOM 35 CB GLN A 3 7.937 -2.955 14.755 1.00 1.49 C ATOM 36 CG GLN A 3 9.301 -3.135 15.407 1.00 1.69 C ATOM 37 CD GLN A 3 10.277 -3.925 14.546 1.00 2.43 C ATOM 38 OE1 GLN A 3 10.206 -3.905 13.316 1.00 3.10 O ATOM 39 NE2 GLN A 3 11.201 -4.623 15.185 1.00 2.97 N ATOM 0 H GLN A 3 8.127 -0.430 14.730 1.00 1.37 H new ATOM 0 HA GLN A 3 8.726 -2.530 12.817 1.00 1.24 H new ATOM 0 HB2 GLN A 3 7.259 -2.491 15.472 1.00 1.49 H new ATOM 0 HB3 GLN A 3 7.526 -3.936 14.516 1.00 1.49 H new ATOM 0 HG2 GLN A 3 9.727 -2.155 15.621 1.00 1.69 H new ATOM 0 HG3 GLN A 3 9.176 -3.644 16.363 1.00 1.69 H new ATOM 0 HE21 GLN A 3 11.231 -4.617 16.205 1.00 2.97 H new ATOM 0 HE22 GLN A 3 11.884 -5.167 14.658 1.00 2.97 H new ATOM 48 N SER A 4 5.712 -1.288 13.208 1.00 0.88 N ATOM 49 CA SER A 4 4.409 -1.185 12.564 1.00 0.77 C ATOM 50 C SER A 4 4.566 -0.581 11.170 1.00 0.62 C ATOM 51 O SER A 4 3.845 -0.936 10.239 1.00 0.64 O ATOM 52 CB SER A 4 3.463 -0.340 13.420 1.00 1.02 C ATOM 53 OG SER A 4 4.068 0.894 13.775 1.00 1.34 O ATOM 0 H SER A 4 5.844 -0.660 14.000 1.00 0.88 H new ATOM 0 HA SER A 4 3.979 -2.181 12.463 1.00 0.77 H new ATOM 0 HB2 SER A 4 2.540 -0.153 12.872 1.00 1.02 H new ATOM 0 HB3 SER A 4 3.193 -0.890 14.321 1.00 1.02 H new ATOM 0 HG SER A 4 3.445 1.419 14.320 1.00 1.34 H new ATOM 59 N ASN A 5 5.539 0.319 11.032 1.00 0.59 N ATOM 60 CA ASN A 5 5.860 0.911 9.735 1.00 0.55 C ATOM 61 C ASN A 5 6.375 -0.174 8.796 1.00 0.43 C ATOM 62 O ASN A 5 6.073 -0.183 7.604 1.00 0.44 O ATOM 63 CB ASN A 5 6.925 2.014 9.878 1.00 0.65 C ATOM 64 CG ASN A 5 6.603 3.004 10.983 1.00 0.94 C ATOM 65 OD1 ASN A 5 6.951 2.784 12.140 1.00 1.71 O ATOM 66 ND2 ASN A 5 5.947 4.101 10.641 1.00 0.67 N ATOM 0 H ASN A 5 6.118 0.654 11.802 1.00 0.59 H new ATOM 0 HA ASN A 5 4.954 1.359 9.327 1.00 0.55 H new ATOM 0 HB2 ASN A 5 7.893 1.554 10.079 1.00 0.65 H new ATOM 0 HB3 ASN A 5 7.017 2.549 8.933 1.00 0.65 H new ATOM 0 HD21 ASN A 5 5.714 4.798 11.349 1.00 0.67 H new ATOM 0 HD22 ASN A 5 5.674 4.250 9.670 1.00 0.67 H new ATOM 73 N ARG A 6 7.143 -1.103 9.355 1.00 0.41 N ATOM 74 CA ARG A 6 7.702 -2.202 8.589 1.00 0.41 C ATOM 75 C ARG A 6 6.618 -3.209 8.206 1.00 0.37 C ATOM 76 O ARG A 6 6.705 -3.846 7.158 1.00 0.38 O ATOM 77 CB ARG A 6 8.816 -2.882 9.395 1.00 0.54 C ATOM 78 CG ARG A 6 9.520 -4.012 8.657 1.00 0.65 C ATOM 79 CD ARG A 6 10.715 -4.531 9.442 1.00 0.83 C ATOM 80 NE ARG A 6 11.331 -5.702 8.816 1.00 1.50 N ATOM 81 CZ ARG A 6 12.640 -5.814 8.574 1.00 2.14 C ATOM 82 NH1 ARG A 6 13.451 -4.779 8.780 1.00 2.16 N ATOM 83 NH2 ARG A 6 13.131 -6.951 8.099 1.00 3.18 N ATOM 0 H ARG A 6 7.392 -1.113 10.344 1.00 0.41 H new ATOM 0 HA ARG A 6 8.125 -1.805 7.666 1.00 0.41 H new ATOM 0 HB2 ARG A 6 9.555 -2.132 9.677 1.00 0.54 H new ATOM 0 HB3 ARG A 6 8.392 -3.275 10.319 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.817 -4.826 8.481 1.00 0.65 H new ATOM 0 HG3 ARG A 6 9.850 -3.660 7.680 1.00 0.65 H new ATOM 0 HD2 ARG A 6 11.458 -3.739 9.533 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.398 -4.788 10.453 1.00 0.83 H new ATOM 0 HE ARG A 6 10.725 -6.478 8.549 1.00 1.50 H new ATOM 0 HH11 ARG A 6 13.074 -3.896 9.124 1.00 2.16 H new ATOM 0 HH12 ARG A 6 14.450 -4.869 8.594 1.00 2.16 H new ATOM 0 HH21 ARG A 6 12.509 -7.739 7.919 1.00 3.18 H new ATOM 0 HH22 ARG A 6 14.130 -7.037 7.914 1.00 3.18 H new ATOM 97 N GLU A 7 5.586 -3.329 9.041 1.00 0.36 N ATOM 98 CA GLU A 7 4.480 -4.248 8.765 1.00 0.37 C ATOM 99 C GLU A 7 3.754 -3.846 7.492 1.00 0.29 C ATOM 100 O GLU A 7 3.311 -4.697 6.724 1.00 0.29 O ATOM 101 CB GLU A 7 3.474 -4.278 9.916 1.00 0.46 C ATOM 102 CG GLU A 7 4.038 -4.789 11.227 1.00 0.60 C ATOM 103 CD GLU A 7 2.957 -5.017 12.261 1.00 1.39 C ATOM 104 OE1 GLU A 7 2.260 -4.047 12.625 1.00 2.00 O ATOM 105 OE2 GLU A 7 2.794 -6.173 12.705 1.00 1.58 O ATOM 0 H GLU A 7 5.492 -2.804 9.911 1.00 0.36 H new ATOM 0 HA GLU A 7 4.913 -5.241 8.647 1.00 0.37 H new ATOM 0 HB2 GLU A 7 3.086 -3.271 10.069 1.00 0.46 H new ATOM 0 HB3 GLU A 7 2.630 -4.905 9.629 1.00 0.46 H new ATOM 0 HG2 GLU A 7 4.574 -5.722 11.052 1.00 0.60 H new ATOM 0 HG3 GLU A 7 4.763 -4.073 11.613 1.00 0.60 H new ATOM 112 N LEU A 8 3.653 -2.541 7.272 1.00 0.27 N ATOM 113 CA LEU A 8 2.949 -2.004 6.114 1.00 0.28 C ATOM 114 C LEU A 8 3.617 -2.457 4.832 1.00 0.28 C ATOM 115 O LEU A 8 2.982 -2.576 3.789 1.00 0.39 O ATOM 116 CB LEU A 8 2.923 -0.479 6.181 1.00 0.31 C ATOM 117 CG LEU A 8 2.389 0.085 7.491 1.00 0.33 C ATOM 118 CD1 LEU A 8 2.319 1.600 7.430 1.00 0.36 C ATOM 119 CD2 LEU A 8 1.029 -0.511 7.796 1.00 0.35 C ATOM 0 H LEU A 8 4.053 -1.831 7.885 1.00 0.27 H new ATOM 0 HA LEU A 8 1.925 -2.378 6.123 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.934 -0.103 6.023 1.00 0.31 H new ATOM 0 HB3 LEU A 8 2.311 -0.102 5.361 1.00 0.31 H new ATOM 0 HG LEU A 8 3.072 -0.185 8.296 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.935 1.985 8.375 1.00 0.36 H new ATOM 0 HD12 LEU A 8 3.316 2.003 7.252 1.00 0.36 H new ATOM 0 HD13 LEU A 8 1.656 1.901 6.619 1.00 0.36 H new ATOM 0 HD21 LEU A 8 0.655 -0.102 8.735 1.00 0.35 H new ATOM 0 HD22 LEU A 8 0.336 -0.266 6.991 1.00 0.35 H new ATOM 0 HD23 LEU A 8 1.117 -1.594 7.882 1.00 0.35 H new ATOM 131 N VAL A 9 4.908 -2.704 4.930 1.00 0.26 N ATOM 132 CA VAL A 9 5.670 -3.233 3.825 1.00 0.28 C ATOM 133 C VAL A 9 5.649 -4.758 3.864 1.00 0.29 C ATOM 134 O VAL A 9 5.122 -5.400 2.964 1.00 0.31 O ATOM 135 CB VAL A 9 7.122 -2.741 3.889 1.00 0.32 C ATOM 136 CG1 VAL A 9 7.899 -3.226 2.682 1.00 0.38 C ATOM 137 CG2 VAL A 9 7.167 -1.226 3.988 1.00 0.31 C ATOM 0 H VAL A 9 5.454 -2.543 5.777 1.00 0.26 H new ATOM 0 HA VAL A 9 5.219 -2.885 2.896 1.00 0.28 H new ATOM 0 HB VAL A 9 7.589 -3.154 4.783 1.00 0.32 H new ATOM 0 HG11 VAL A 9 8.927 -2.868 2.743 1.00 0.38 H new ATOM 0 HG12 VAL A 9 7.895 -4.316 2.660 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.435 -2.843 1.773 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.205 -0.895 4.032 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.684 -0.790 3.114 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.645 -0.905 4.889 1.00 0.31 H new ATOM 147 N VAL A 10 6.209 -5.317 4.935 1.00 0.30 N ATOM 148 CA VAL A 10 6.349 -6.763 5.099 1.00 0.32 C ATOM 149 C VAL A 10 5.040 -7.507 4.863 1.00 0.35 C ATOM 150 O VAL A 10 4.965 -8.372 3.990 1.00 0.36 O ATOM 151 CB VAL A 10 6.870 -7.098 6.512 1.00 0.37 C ATOM 152 CG1 VAL A 10 6.765 -8.587 6.794 1.00 0.42 C ATOM 153 CG2 VAL A 10 8.305 -6.632 6.669 1.00 0.38 C ATOM 0 H VAL A 10 6.580 -4.777 5.717 1.00 0.30 H new ATOM 0 HA VAL A 10 7.065 -7.092 4.346 1.00 0.32 H new ATOM 0 HB VAL A 10 6.247 -6.572 7.236 1.00 0.37 H new ATOM 0 HG11 VAL A 10 7.139 -8.795 7.797 1.00 0.42 H new ATOM 0 HG12 VAL A 10 5.723 -8.898 6.724 1.00 0.42 H new ATOM 0 HG13 VAL A 10 7.358 -9.138 6.064 1.00 0.42 H new ATOM 0 HG21 VAL A 10 8.659 -6.875 7.671 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.933 -7.132 5.931 1.00 0.38 H new ATOM 0 HG23 VAL A 10 8.356 -5.554 6.518 1.00 0.38 H new ATOM 163 N ASP A 11 4.018 -7.171 5.636 1.00 0.39 N ATOM 164 CA ASP A 11 2.754 -7.901 5.584 1.00 0.46 C ATOM 165 C ASP A 11 2.098 -7.726 4.218 1.00 0.44 C ATOM 166 O ASP A 11 1.393 -8.613 3.734 1.00 0.50 O ATOM 167 CB ASP A 11 1.807 -7.425 6.694 1.00 0.55 C ATOM 168 CG ASP A 11 0.736 -8.448 7.017 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.307 -8.466 6.338 1.00 0.84 O ATOM 170 OD2 ASP A 11 0.933 -9.247 7.957 1.00 0.92 O ATOM 0 H ASP A 11 4.036 -6.401 6.305 1.00 0.39 H new ATOM 0 HA ASP A 11 2.962 -8.959 5.740 1.00 0.46 H new ATOM 0 HB2 ASP A 11 2.384 -7.211 7.593 1.00 0.55 H new ATOM 0 HB3 ASP A 11 1.334 -6.492 6.389 1.00 0.55 H new ATOM 175 N PHE A 12 2.364 -6.589 3.589 1.00 0.41 N ATOM 176 CA PHE A 12 1.819 -6.302 2.267 1.00 0.42 C ATOM 177 C PHE A 12 2.568 -7.105 1.207 1.00 0.37 C ATOM 178 O PHE A 12 1.954 -7.673 0.302 1.00 0.41 O ATOM 179 CB PHE A 12 1.907 -4.800 1.960 1.00 0.44 C ATOM 180 CG PHE A 12 1.091 -4.380 0.768 1.00 0.48 C ATOM 181 CD1 PHE A 12 -0.272 -4.167 0.892 1.00 0.62 C ATOM 182 CD2 PHE A 12 1.683 -4.198 -0.474 1.00 0.46 C ATOM 183 CE1 PHE A 12 -1.030 -3.784 -0.197 1.00 0.68 C ATOM 184 CE2 PHE A 12 0.929 -3.815 -1.567 1.00 0.51 C ATOM 185 CZ PHE A 12 -0.430 -3.609 -1.428 1.00 0.60 C ATOM 0 H PHE A 12 2.954 -5.850 3.972 1.00 0.41 H new ATOM 0 HA PHE A 12 0.769 -6.593 2.253 1.00 0.42 H new ATOM 0 HB2 PHE A 12 1.574 -4.239 2.833 1.00 0.44 H new ATOM 0 HB3 PHE A 12 2.950 -4.533 1.788 1.00 0.44 H new ATOM 0 HD1 PHE A 12 -0.748 -4.302 1.852 1.00 0.62 H new ATOM 0 HD2 PHE A 12 2.745 -4.358 -0.588 1.00 0.46 H new ATOM 0 HE1 PHE A 12 -2.092 -3.621 -0.086 1.00 0.68 H new ATOM 0 HE2 PHE A 12 1.401 -3.677 -2.528 1.00 0.51 H new ATOM 0 HZ PHE A 12 -1.022 -3.312 -2.281 1.00 0.60 H new ATOM 195 N LEU A 13 3.891 -7.170 1.327 1.00 0.33 N ATOM 196 CA LEU A 13 4.699 -7.948 0.400 1.00 0.32 C ATOM 197 C LEU A 13 4.388 -9.427 0.565 1.00 0.33 C ATOM 198 O LEU A 13 4.290 -10.169 -0.410 1.00 0.35 O ATOM 199 CB LEU A 13 6.196 -7.700 0.626 1.00 0.32 C ATOM 200 CG LEU A 13 6.631 -6.231 0.585 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.148 -6.118 0.643 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.088 -5.539 -0.655 1.00 0.38 C ATOM 0 H LEU A 13 4.423 -6.694 2.056 1.00 0.33 H new ATOM 0 HA LEU A 13 4.454 -7.634 -0.614 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.474 -8.117 1.594 1.00 0.32 H new ATOM 0 HB3 LEU A 13 6.757 -8.249 -0.131 1.00 0.32 H new ATOM 0 HG LEU A 13 6.217 -5.731 1.460 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.436 -5.067 0.613 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.511 -6.567 1.567 1.00 0.40 H new ATOM 0 HD13 LEU A 13 8.584 -6.639 -0.209 1.00 0.40 H new ATOM 0 HD21 LEU A 13 6.410 -4.498 -0.661 1.00 0.38 H new ATOM 0 HD22 LEU A 13 6.465 -6.041 -1.546 1.00 0.38 H new ATOM 0 HD23 LEU A 13 4.999 -5.582 -0.648 1.00 0.38 H new ATOM 214 N SER A 14 4.214 -9.840 1.814 1.00 0.34 N ATOM 215 CA SER A 14 3.817 -11.205 2.131 1.00 0.38 C ATOM 216 C SER A 14 2.489 -11.543 1.456 1.00 0.39 C ATOM 217 O SER A 14 2.293 -12.658 0.969 1.00 0.41 O ATOM 218 CB SER A 14 3.710 -11.381 3.651 1.00 0.45 C ATOM 219 OG SER A 14 3.181 -12.651 3.991 1.00 1.14 O ATOM 0 H SER A 14 4.343 -9.242 2.631 1.00 0.34 H new ATOM 0 HA SER A 14 4.576 -11.890 1.753 1.00 0.38 H new ATOM 0 HB2 SER A 14 4.695 -11.264 4.102 1.00 0.45 H new ATOM 0 HB3 SER A 14 3.074 -10.598 4.065 1.00 0.45 H new ATOM 0 HG SER A 14 3.127 -12.732 4.966 1.00 1.14 H new ATOM 225 N TYR A 15 1.594 -10.562 1.396 1.00 0.42 N ATOM 226 CA TYR A 15 0.282 -10.743 0.780 1.00 0.47 C ATOM 227 C TYR A 15 0.423 -10.917 -0.730 1.00 0.45 C ATOM 228 O TYR A 15 -0.364 -11.620 -1.367 1.00 0.52 O ATOM 229 CB TYR A 15 -0.616 -9.539 1.103 1.00 0.55 C ATOM 230 CG TYR A 15 -1.990 -9.590 0.463 1.00 0.66 C ATOM 231 CD1 TYR A 15 -2.952 -10.490 0.904 1.00 0.79 C ATOM 232 CD2 TYR A 15 -2.326 -8.728 -0.575 1.00 0.78 C ATOM 233 CE1 TYR A 15 -4.207 -10.533 0.325 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.578 -8.765 -1.157 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.514 -9.669 -0.704 1.00 1.02 C ATOM 236 OH TYR A 15 -5.763 -9.704 -1.283 1.00 1.20 O ATOM 0 H TYR A 15 1.754 -9.626 1.769 1.00 0.42 H new ATOM 0 HA TYR A 15 -0.179 -11.644 1.185 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.735 -9.470 2.184 1.00 0.55 H new ATOM 0 HB3 TYR A 15 -0.112 -8.628 0.779 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.716 -11.167 1.712 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -1.595 -8.017 -0.932 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -4.943 -11.240 0.677 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -3.822 -8.089 -1.963 1.00 0.94 H new ATOM 0 HH TYR A 15 -5.814 -9.029 -1.992 1.00 1.20 H new ATOM 246 N LYS A 16 1.449 -10.293 -1.290 1.00 0.40 N ATOM 247 CA LYS A 16 1.685 -10.339 -2.722 1.00 0.41 C ATOM 248 C LYS A 16 2.411 -11.629 -3.100 1.00 0.35 C ATOM 249 O LYS A 16 2.111 -12.250 -4.119 1.00 0.39 O ATOM 250 CB LYS A 16 2.512 -9.126 -3.150 1.00 0.49 C ATOM 251 CG LYS A 16 2.112 -8.546 -4.496 1.00 0.90 C ATOM 252 CD LYS A 16 0.719 -7.937 -4.450 1.00 0.83 C ATOM 253 CE LYS A 16 0.409 -7.136 -5.707 1.00 1.35 C ATOM 254 NZ LYS A 16 0.407 -7.984 -6.930 1.00 1.39 N ATOM 0 H LYS A 16 2.134 -9.746 -0.769 1.00 0.40 H new ATOM 0 HA LYS A 16 0.725 -10.317 -3.238 1.00 0.41 H new ATOM 0 HB2 LYS A 16 2.419 -8.350 -2.390 1.00 0.49 H new ATOM 0 HB3 LYS A 16 3.563 -9.411 -3.187 1.00 0.49 H new ATOM 0 HG2 LYS A 16 2.833 -7.785 -4.794 1.00 0.90 H new ATOM 0 HG3 LYS A 16 2.143 -9.329 -5.254 1.00 0.90 H new ATOM 0 HD2 LYS A 16 -0.020 -8.729 -4.333 1.00 0.83 H new ATOM 0 HD3 LYS A 16 0.634 -7.290 -3.577 1.00 0.83 H new ATOM 0 HE2 LYS A 16 -0.564 -6.656 -5.599 1.00 1.35 H new ATOM 0 HE3 LYS A 16 1.146 -6.341 -5.820 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 -0.193 -7.544 -7.657 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 1.378 -8.075 -7.291 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 0.034 -8.927 -6.698 1.00 1.39 H new ATOM 268 N LEU A 17 3.364 -12.025 -2.265 1.00 0.30 N ATOM 269 CA LEU A 17 4.130 -13.244 -2.483 1.00 0.27 C ATOM 270 C LEU A 17 3.270 -14.488 -2.301 1.00 0.31 C ATOM 271 O LEU A 17 3.390 -15.447 -3.064 1.00 0.32 O ATOM 272 CB LEU A 17 5.322 -13.284 -1.532 1.00 0.25 C ATOM 273 CG LEU A 17 6.364 -12.206 -1.785 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.366 -12.167 -0.652 1.00 0.29 C ATOM 275 CD2 LEU A 17 7.063 -12.449 -3.109 1.00 0.25 C ATOM 0 H LEU A 17 3.626 -11.513 -1.423 1.00 0.30 H new ATOM 0 HA LEU A 17 4.487 -13.237 -3.513 1.00 0.27 H new ATOM 0 HB2 LEU A 17 4.958 -13.188 -0.509 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.801 -14.260 -1.610 1.00 0.25 H new ATOM 0 HG LEU A 17 5.862 -11.240 -1.834 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.106 -11.391 -0.847 1.00 0.29 H new ATOM 0 HD12 LEU A 17 6.850 -11.950 0.283 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.865 -13.133 -0.575 1.00 0.29 H new ATOM 0 HD21 LEU A 17 7.806 -11.669 -3.277 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.555 -13.421 -3.087 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.330 -12.431 -3.916 1.00 0.25 H new ATOM 287 N SER A 18 2.400 -14.472 -1.297 1.00 0.37 N ATOM 288 CA SER A 18 1.484 -15.587 -1.071 1.00 0.44 C ATOM 289 C SER A 18 0.518 -15.708 -2.245 1.00 0.47 C ATOM 290 O SER A 18 0.098 -16.806 -2.613 1.00 0.51 O ATOM 291 CB SER A 18 0.717 -15.398 0.243 1.00 0.54 C ATOM 292 OG SER A 18 0.187 -14.088 0.342 1.00 1.26 O ATOM 0 H SER A 18 2.309 -13.706 -0.630 1.00 0.37 H new ATOM 0 HA SER A 18 2.062 -16.508 -0.994 1.00 0.44 H new ATOM 0 HB2 SER A 18 -0.092 -16.126 0.303 1.00 0.54 H new ATOM 0 HB3 SER A 18 1.381 -15.589 1.086 1.00 0.54 H new ATOM 0 HG SER A 18 0.785 -13.533 0.885 1.00 1.26 H new ATOM 298 N GLN A 19 0.197 -14.561 -2.838 1.00 0.48 N ATOM 299 CA GLN A 19 -0.617 -14.499 -4.042 1.00 0.53 C ATOM 300 C GLN A 19 0.110 -15.173 -5.202 1.00 0.48 C ATOM 301 O GLN A 19 -0.503 -15.811 -6.058 1.00 0.55 O ATOM 302 CB GLN A 19 -0.917 -13.029 -4.364 1.00 0.59 C ATOM 303 CG GLN A 19 -1.505 -12.778 -5.744 1.00 0.71 C ATOM 304 CD GLN A 19 -1.553 -11.298 -6.074 1.00 1.06 C ATOM 305 OE1 GLN A 19 -0.592 -10.739 -6.606 1.00 1.72 O ATOM 306 NE2 GLN A 19 -2.661 -10.650 -5.762 1.00 1.65 N ATOM 0 H GLN A 19 0.496 -13.648 -2.494 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.556 -15.028 -3.883 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.609 -12.643 -3.616 1.00 0.59 H new ATOM 0 HB3 GLN A 19 0.006 -12.457 -4.270 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -0.909 -13.299 -6.493 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -2.511 -13.194 -5.792 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -3.436 -11.147 -5.322 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -2.742 -9.653 -5.961 1.00 1.65 H new ATOM 315 N LYS A 20 1.430 -15.045 -5.204 1.00 0.41 N ATOM 316 CA LYS A 20 2.264 -15.629 -6.246 1.00 0.40 C ATOM 317 C LYS A 20 2.607 -17.086 -5.933 1.00 0.44 C ATOM 318 O LYS A 20 3.346 -17.730 -6.676 1.00 0.48 O ATOM 319 CB LYS A 20 3.545 -14.813 -6.405 1.00 0.36 C ATOM 320 CG LYS A 20 3.317 -13.414 -6.957 1.00 0.68 C ATOM 321 CD LYS A 20 3.012 -13.443 -8.448 1.00 0.61 C ATOM 322 CE LYS A 20 2.626 -12.068 -8.972 1.00 1.06 C ATOM 323 NZ LYS A 20 1.330 -11.604 -8.415 1.00 1.87 N ATOM 0 H LYS A 20 1.950 -14.537 -4.489 1.00 0.41 H new ATOM 0 HA LYS A 20 1.702 -15.609 -7.180 1.00 0.40 H new ATOM 0 HB2 LYS A 20 4.038 -14.735 -5.436 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.226 -15.348 -7.067 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.491 -12.943 -6.425 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.202 -12.803 -6.778 1.00 0.68 H new ATOM 0 HD2 LYS A 20 3.884 -13.807 -8.991 1.00 0.61 H new ATOM 0 HD3 LYS A 20 2.201 -14.146 -8.640 1.00 0.61 H new ATOM 0 HE2 LYS A 20 3.407 -11.351 -8.719 1.00 1.06 H new ATOM 0 HE3 LYS A 20 2.563 -12.099 -10.060 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 0.988 -10.790 -8.964 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 0.634 -12.375 -8.468 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 1.460 -11.322 -7.422 1.00 1.87 H new ATOM 337 N GLY A 21 2.080 -17.592 -4.824 1.00 0.48 N ATOM 338 CA GLY A 21 2.266 -18.993 -4.485 1.00 0.54 C ATOM 339 C GLY A 21 3.515 -19.264 -3.661 1.00 0.53 C ATOM 340 O GLY A 21 3.889 -20.421 -3.471 1.00 0.67 O ATOM 0 H GLY A 21 1.527 -17.059 -4.153 1.00 0.48 H new ATOM 0 HA2 GLY A 21 1.394 -19.342 -3.932 1.00 0.54 H new ATOM 0 HA3 GLY A 21 2.315 -19.576 -5.404 1.00 0.54 H new ATOM 344 N TYR A 22 4.164 -18.218 -3.164 1.00 0.43 N ATOM 345 CA TYR A 22 5.365 -18.396 -2.349 1.00 0.42 C ATOM 346 C TYR A 22 5.046 -18.169 -0.874 1.00 0.43 C ATOM 347 O TYR A 22 4.044 -17.535 -0.541 1.00 0.46 O ATOM 348 CB TYR A 22 6.479 -17.445 -2.808 1.00 0.40 C ATOM 349 CG TYR A 22 6.899 -17.665 -4.246 1.00 0.48 C ATOM 350 CD1 TYR A 22 7.298 -18.920 -4.696 1.00 0.65 C ATOM 351 CD2 TYR A 22 6.882 -16.617 -5.155 1.00 0.47 C ATOM 352 CE1 TYR A 22 7.670 -19.118 -6.011 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.251 -16.809 -6.472 1.00 0.57 C ATOM 354 CZ TYR A 22 7.643 -18.060 -6.895 1.00 0.69 C ATOM 355 OH TYR A 22 8.012 -18.251 -8.205 1.00 0.81 O ATOM 0 H TYR A 22 3.885 -17.247 -3.307 1.00 0.43 H new ATOM 0 HA TYR A 22 5.716 -19.420 -2.476 1.00 0.42 H new ATOM 0 HB2 TYR A 22 6.141 -16.416 -2.689 1.00 0.40 H new ATOM 0 HB3 TYR A 22 7.346 -17.572 -2.160 1.00 0.40 H new ATOM 0 HD1 TYR A 22 7.317 -19.751 -4.007 1.00 0.65 H new ATOM 0 HD2 TYR A 22 6.575 -15.635 -4.827 1.00 0.47 H new ATOM 0 HE1 TYR A 22 7.981 -20.097 -6.346 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.232 -15.982 -7.167 1.00 0.57 H new ATOM 0 HH TYR A 22 7.935 -17.405 -8.693 1.00 0.81 H new ATOM 365 N SER A 23 5.892 -18.687 0.006 1.00 0.45 N ATOM 366 CA SER A 23 5.653 -18.587 1.437 1.00 0.49 C ATOM 367 C SER A 23 6.608 -17.589 2.077 1.00 0.43 C ATOM 368 O SER A 23 7.828 -17.723 1.967 1.00 0.44 O ATOM 369 CB SER A 23 5.813 -19.956 2.104 1.00 0.59 C ATOM 370 OG SER A 23 5.564 -19.876 3.498 1.00 1.41 O ATOM 0 H SER A 23 6.749 -19.180 -0.247 1.00 0.45 H new ATOM 0 HA SER A 23 4.631 -18.237 1.583 1.00 0.49 H new ATOM 0 HB2 SER A 23 5.125 -20.669 1.649 1.00 0.59 H new ATOM 0 HB3 SER A 23 6.822 -20.332 1.932 1.00 0.59 H new ATOM 0 HG SER A 23 5.671 -20.763 3.901 1.00 1.41 H new ATOM 376 N TRP A 24 6.050 -16.605 2.771 1.00 0.43 N ATOM 377 CA TRP A 24 6.853 -15.589 3.437 1.00 0.41 C ATOM 378 C TRP A 24 7.582 -16.200 4.635 1.00 0.47 C ATOM 379 O TRP A 24 8.616 -15.692 5.078 1.00 0.53 O ATOM 380 CB TRP A 24 5.965 -14.411 3.873 1.00 0.44 C ATOM 381 CG TRP A 24 6.699 -13.361 4.649 1.00 0.46 C ATOM 382 CD1 TRP A 24 6.636 -13.150 5.998 1.00 0.55 C ATOM 383 CD2 TRP A 24 7.612 -12.382 4.131 1.00 0.43 C ATOM 384 NE1 TRP A 24 7.456 -12.109 6.351 1.00 0.57 N ATOM 385 CE2 TRP A 24 8.065 -11.619 5.223 1.00 0.50 C ATOM 386 CE3 TRP A 24 8.093 -12.078 2.853 1.00 0.39 C ATOM 387 CZ2 TRP A 24 8.976 -10.576 5.077 1.00 0.51 C ATOM 388 CZ3 TRP A 24 8.996 -11.040 2.710 1.00 0.43 C ATOM 389 CH2 TRP A 24 9.429 -10.300 3.816 1.00 0.48 C ATOM 0 H TRP A 24 5.043 -16.489 2.887 1.00 0.43 H new ATOM 0 HA TRP A 24 7.600 -15.210 2.739 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.522 -13.954 2.988 1.00 0.44 H new ATOM 0 HB3 TRP A 24 5.143 -14.792 4.480 1.00 0.44 H new ATOM 0 HD1 TRP A 24 6.029 -13.720 6.686 1.00 0.55 H new ATOM 0 HE1 TRP A 24 7.591 -11.756 7.298 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.765 -12.644 1.993 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 9.313 -10.005 5.929 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 9.373 -10.796 1.728 1.00 0.43 H new ATOM 0 HH2 TRP A 24 10.135 -9.495 3.671 1.00 0.48 H new ATOM 400 N SER A 25 7.058 -17.319 5.123 1.00 0.54 N ATOM 401 CA SER A 25 7.649 -18.023 6.253 1.00 0.63 C ATOM 402 C SER A 25 9.065 -18.502 5.923 1.00 0.63 C ATOM 403 O SER A 25 9.889 -18.698 6.816 1.00 0.75 O ATOM 404 CB SER A 25 6.762 -19.213 6.625 1.00 0.75 C ATOM 405 OG SER A 25 5.395 -18.827 6.670 1.00 1.20 O ATOM 0 H SER A 25 6.218 -17.760 4.749 1.00 0.54 H new ATOM 0 HA SER A 25 7.717 -17.337 7.098 1.00 0.63 H new ATOM 0 HB2 SER A 25 6.895 -20.013 5.897 1.00 0.75 H new ATOM 0 HB3 SER A 25 7.065 -19.610 7.594 1.00 0.75 H new ATOM 0 HG SER A 25 4.844 -19.602 6.908 1.00 1.20 H new ATOM 411 N GLN A 26 9.342 -18.670 4.632 1.00 0.61 N ATOM 412 CA GLN A 26 10.644 -19.136 4.176 1.00 0.73 C ATOM 413 C GLN A 26 11.572 -17.966 3.855 1.00 0.79 C ATOM 414 O GLN A 26 12.758 -18.161 3.585 1.00 0.93 O ATOM 415 CB GLN A 26 10.477 -20.018 2.934 1.00 0.80 C ATOM 416 CG GLN A 26 9.726 -21.316 3.203 1.00 1.25 C ATOM 417 CD GLN A 26 10.491 -22.256 4.119 1.00 1.53 C ATOM 418 OE1 GLN A 26 9.896 -23.020 4.876 1.00 1.91 O ATOM 419 NE2 GLN A 26 11.815 -22.216 4.054 1.00 2.26 N ATOM 0 H GLN A 26 8.676 -18.488 3.881 1.00 0.61 H new ATOM 0 HA GLN A 26 11.094 -19.717 4.981 1.00 0.73 H new ATOM 0 HB2 GLN A 26 9.947 -19.454 2.167 1.00 0.80 H new ATOM 0 HB3 GLN A 26 11.462 -20.255 2.532 1.00 0.80 H new ATOM 0 HG2 GLN A 26 8.759 -21.086 3.651 1.00 1.25 H new ATOM 0 HG3 GLN A 26 9.527 -21.819 2.257 1.00 1.25 H new ATOM 0 HE21 GLN A 26 12.275 -21.569 3.414 1.00 2.26 H new ATOM 0 HE22 GLN A 26 12.373 -22.832 4.644 1.00 2.26 H new ATOM 428 N PHE A 27 11.036 -16.753 3.890 1.00 0.76 N ATOM 429 CA PHE A 27 11.818 -15.578 3.526 1.00 0.92 C ATOM 430 C PHE A 27 12.259 -14.808 4.764 1.00 0.98 C ATOM 431 O PHE A 27 13.413 -14.396 4.869 1.00 1.18 O ATOM 432 CB PHE A 27 11.022 -14.651 2.596 1.00 0.99 C ATOM 433 CG PHE A 27 10.502 -15.324 1.355 1.00 0.97 C ATOM 434 CD1 PHE A 27 11.274 -16.261 0.687 1.00 1.07 C ATOM 435 CD2 PHE A 27 9.247 -15.016 0.851 1.00 0.93 C ATOM 436 CE1 PHE A 27 10.804 -16.879 -0.456 1.00 1.13 C ATOM 437 CE2 PHE A 27 8.774 -15.631 -0.292 1.00 0.96 C ATOM 438 CZ PHE A 27 9.525 -16.569 -0.930 1.00 1.05 C ATOM 0 H PHE A 27 10.073 -16.557 4.164 1.00 0.76 H new ATOM 0 HA PHE A 27 12.704 -15.929 2.997 1.00 0.92 H new ATOM 0 HB2 PHE A 27 10.181 -14.234 3.150 1.00 0.99 H new ATOM 0 HB3 PHE A 27 11.657 -13.815 2.304 1.00 0.99 H new ATOM 0 HD1 PHE A 27 12.255 -16.511 1.064 1.00 1.07 H new ATOM 0 HD2 PHE A 27 8.632 -14.287 1.358 1.00 0.93 H new ATOM 0 HE1 PHE A 27 11.419 -17.596 -0.979 1.00 1.13 H new ATOM 0 HE2 PHE A 27 7.802 -15.366 -0.681 1.00 0.96 H new ATOM 0 HZ PHE A 27 9.134 -17.074 -1.801 1.00 1.05 H new ATOM 448 N SER A 28 11.350 -14.635 5.708 1.00 0.93 N ATOM 449 CA SER A 28 11.636 -13.835 6.889 1.00 1.07 C ATOM 450 C SER A 28 12.008 -14.730 8.065 1.00 1.04 C ATOM 451 O SER A 28 11.883 -15.958 7.993 1.00 1.02 O ATOM 452 CB SER A 28 10.426 -12.966 7.244 1.00 1.21 C ATOM 453 OG SER A 28 10.738 -12.002 8.237 1.00 1.73 O ATOM 0 H SER A 28 10.412 -15.035 5.682 1.00 0.93 H new ATOM 0 HA SER A 28 12.483 -13.185 6.670 1.00 1.07 H new ATOM 0 HB2 SER A 28 10.067 -12.460 6.348 1.00 1.21 H new ATOM 0 HB3 SER A 28 9.614 -13.602 7.598 1.00 1.21 H new ATOM 0 HG SER A 28 9.941 -11.467 8.435 1.00 1.73 H new ATOM 459 N ASP A 29 12.462 -14.111 9.145 1.00 1.25 N ATOM 460 CA ASP A 29 12.839 -14.840 10.343 1.00 1.33 C ATOM 461 C ASP A 29 11.604 -15.149 11.174 1.00 1.40 C ATOM 462 O ASP A 29 11.074 -14.284 11.874 1.00 1.62 O ATOM 463 CB ASP A 29 13.846 -14.039 11.177 1.00 1.63 C ATOM 464 CG ASP A 29 15.155 -13.814 10.450 1.00 1.96 C ATOM 465 OD1 ASP A 29 16.018 -14.719 10.473 1.00 2.43 O ATOM 466 OD2 ASP A 29 15.328 -12.733 9.846 1.00 2.16 O ATOM 0 H ASP A 29 12.578 -13.100 9.214 1.00 1.25 H new ATOM 0 HA ASP A 29 13.312 -15.775 10.041 1.00 1.33 H new ATOM 0 HB2 ASP A 29 13.410 -13.075 11.439 1.00 1.63 H new ATOM 0 HB3 ASP A 29 14.039 -14.566 12.111 1.00 1.63 H new ATOM 471 N VAL A 30 11.121 -16.373 11.044 1.00 1.40 N ATOM 472 CA VAL A 30 9.968 -16.833 11.799 1.00 1.63 C ATOM 473 C VAL A 30 10.386 -17.887 12.821 1.00 1.66 C ATOM 474 O VAL A 30 10.387 -17.637 14.027 1.00 1.79 O ATOM 475 CB VAL A 30 8.901 -17.431 10.863 1.00 1.89 C ATOM 476 CG1 VAL A 30 7.644 -17.798 11.638 1.00 2.24 C ATOM 477 CG2 VAL A 30 8.576 -16.468 9.731 1.00 1.95 C ATOM 0 H VAL A 30 11.515 -17.073 10.415 1.00 1.40 H new ATOM 0 HA VAL A 30 9.545 -15.972 12.316 1.00 1.63 H new ATOM 0 HB VAL A 30 9.307 -18.344 10.427 1.00 1.89 H new ATOM 0 HG11 VAL A 30 6.905 -18.218 10.955 1.00 2.24 H new ATOM 0 HG12 VAL A 30 7.890 -18.534 12.404 1.00 2.24 H new ATOM 0 HG13 VAL A 30 7.235 -16.905 12.111 1.00 2.24 H new ATOM 0 HG21 VAL A 30 7.820 -16.911 9.082 1.00 1.95 H new ATOM 0 HG22 VAL A 30 8.196 -15.534 10.145 1.00 1.95 H new ATOM 0 HG23 VAL A 30 9.478 -16.268 9.153 1.00 1.95 H new ATOM 487 N GLU A 31 10.743 -19.067 12.324 1.00 1.67 N ATOM 488 CA GLU A 31 11.110 -20.191 13.179 1.00 1.83 C ATOM 489 C GLU A 31 12.486 -19.995 13.801 1.00 1.78 C ATOM 490 O GLU A 31 12.755 -20.487 14.900 1.00 1.99 O ATOM 491 CB GLU A 31 11.084 -21.492 12.379 1.00 2.07 C ATOM 492 CG GLU A 31 9.685 -21.934 11.985 1.00 2.55 C ATOM 493 CD GLU A 31 8.852 -22.341 13.180 1.00 2.93 C ATOM 494 OE1 GLU A 31 8.172 -21.475 13.766 1.00 3.27 O ATOM 495 OE2 GLU A 31 8.872 -23.537 13.540 1.00 3.42 O ATOM 0 H GLU A 31 10.786 -19.271 11.325 1.00 1.67 H new ATOM 0 HA GLU A 31 10.379 -20.245 13.986 1.00 1.83 H new ATOM 0 HB2 GLU A 31 11.684 -21.367 11.478 1.00 2.07 H new ATOM 0 HB3 GLU A 31 11.553 -22.280 12.968 1.00 2.07 H new ATOM 0 HG2 GLU A 31 9.185 -21.122 11.457 1.00 2.55 H new ATOM 0 HG3 GLU A 31 9.753 -22.771 11.291 1.00 2.55 H new ATOM 502 N GLU A 32 13.353 -19.282 13.100 1.00 1.61 N ATOM 503 CA GLU A 32 14.702 -19.032 13.588 1.00 1.65 C ATOM 504 C GLU A 32 14.683 -17.936 14.641 1.00 1.75 C ATOM 505 O GLU A 32 14.947 -18.184 15.817 1.00 2.00 O ATOM 506 CB GLU A 32 15.616 -18.647 12.427 1.00 1.54 C ATOM 507 CG GLU A 32 15.723 -19.732 11.371 1.00 1.79 C ATOM 508 CD GLU A 32 16.380 -19.245 10.103 1.00 2.33 C ATOM 509 OE1 GLU A 32 17.624 -19.331 10.008 1.00 2.57 O ATOM 510 OE2 GLU A 32 15.663 -18.771 9.199 1.00 3.01 O ATOM 0 H GLU A 32 13.148 -18.866 12.192 1.00 1.61 H new ATOM 0 HA GLU A 32 15.089 -19.943 14.046 1.00 1.65 H new ATOM 0 HB2 GLU A 32 15.242 -17.734 11.965 1.00 1.54 H new ATOM 0 HB3 GLU A 32 16.611 -18.424 12.813 1.00 1.54 H new ATOM 0 HG2 GLU A 32 16.293 -20.570 11.773 1.00 1.79 H new ATOM 0 HG3 GLU A 32 14.726 -20.107 11.138 1.00 1.79 H new ATOM 517 N ASN A 33 14.356 -16.728 14.218 1.00 1.77 N ATOM 518 CA ASN A 33 14.220 -15.611 15.138 1.00 2.01 C ATOM 519 C ASN A 33 12.747 -15.345 15.395 1.00 1.89 C ATOM 520 O ASN A 33 12.018 -14.977 14.477 1.00 2.13 O ATOM 521 CB ASN A 33 14.884 -14.347 14.574 1.00 2.35 C ATOM 522 CG ASN A 33 16.400 -14.443 14.501 1.00 3.05 C ATOM 523 OD1 ASN A 33 17.024 -13.892 13.594 1.00 3.61 O ATOM 524 ND2 ASN A 33 17.007 -15.126 15.459 1.00 3.58 N ATOM 0 H ASN A 33 14.179 -16.494 13.241 1.00 1.77 H new ATOM 0 HA ASN A 33 14.719 -15.870 16.072 1.00 2.01 H new ATOM 0 HB2 ASN A 33 14.491 -14.154 13.576 1.00 2.35 H new ATOM 0 HB3 ASN A 33 14.611 -13.494 15.195 1.00 2.35 H new ATOM 0 HD21 ASN A 33 18.024 -15.208 15.461 1.00 3.58 H new ATOM 0 HD22 ASN A 33 16.458 -15.570 16.195 1.00 3.58 H new ATOM 531 N ARG A 34 12.299 -15.556 16.626 1.00 1.88 N ATOM 532 CA ARG A 34 10.910 -15.289 16.972 1.00 1.96 C ATOM 533 C ARG A 34 10.635 -13.794 16.934 1.00 1.98 C ATOM 534 O ARG A 34 10.938 -13.069 17.883 1.00 2.34 O ATOM 535 CB ARG A 34 10.548 -15.862 18.349 1.00 2.42 C ATOM 536 CG ARG A 34 10.035 -17.294 18.299 1.00 2.86 C ATOM 537 CD ARG A 34 11.108 -18.272 17.851 1.00 3.54 C ATOM 538 NE ARG A 34 12.145 -18.450 18.865 1.00 3.97 N ATOM 539 CZ ARG A 34 13.125 -19.346 18.775 1.00 4.63 C ATOM 540 NH1 ARG A 34 13.211 -20.134 17.711 1.00 4.92 N ATOM 541 NH2 ARG A 34 14.019 -19.447 19.750 1.00 5.33 N ATOM 0 H ARG A 34 12.871 -15.908 17.394 1.00 1.88 H new ATOM 0 HA ARG A 34 10.283 -15.786 16.232 1.00 1.96 H new ATOM 0 HB2 ARG A 34 11.427 -15.822 18.992 1.00 2.42 H new ATOM 0 HB3 ARG A 34 9.789 -15.229 18.808 1.00 2.42 H new ATOM 0 HG2 ARG A 34 9.671 -17.583 19.285 1.00 2.86 H new ATOM 0 HG3 ARG A 34 9.186 -17.351 17.617 1.00 2.86 H new ATOM 0 HD2 ARG A 34 10.650 -19.236 17.628 1.00 3.54 H new ATOM 0 HD3 ARG A 34 11.562 -17.914 16.927 1.00 3.54 H new ATOM 0 HE ARG A 34 12.116 -17.852 19.691 1.00 3.97 H new ATOM 0 HH11 ARG A 34 12.525 -20.054 16.960 1.00 4.92 H new ATOM 0 HH12 ARG A 34 13.963 -20.820 17.644 1.00 4.92 H new ATOM 0 HH21 ARG A 34 13.954 -18.839 20.566 1.00 5.33 H new ATOM 0 HH22 ARG A 34 14.771 -20.133 19.683 1.00 5.33 H new ATOM 555 N THR A 35 10.073 -13.342 15.826 1.00 1.80 N ATOM 556 CA THR A 35 9.768 -11.940 15.642 1.00 1.96 C ATOM 557 C THR A 35 8.357 -11.647 16.128 1.00 1.86 C ATOM 558 O THR A 35 7.372 -11.933 15.444 1.00 2.02 O ATOM 559 CB THR A 35 9.911 -11.547 14.158 1.00 2.32 C ATOM 560 OG1 THR A 35 9.336 -12.564 13.325 1.00 2.88 O ATOM 561 CG2 THR A 35 11.372 -11.347 13.784 1.00 2.78 C ATOM 0 H THR A 35 9.818 -13.934 15.036 1.00 1.80 H new ATOM 0 HA THR A 35 10.474 -11.350 16.226 1.00 1.96 H new ATOM 0 HB THR A 35 9.383 -10.606 14.004 1.00 2.32 H new ATOM 0 HG1 THR A 35 10.051 -13.074 12.890 1.00 2.88 H new ATOM 0 HG21 THR A 35 11.444 -11.071 12.732 1.00 2.78 H new ATOM 0 HG22 THR A 35 11.799 -10.554 14.398 1.00 2.78 H new ATOM 0 HG23 THR A 35 11.921 -12.273 13.954 1.00 2.78 H new ATOM 569 N GLU A 36 8.273 -11.124 17.341 1.00 1.87 N ATOM 570 CA GLU A 36 6.996 -10.831 17.970 1.00 1.94 C ATOM 571 C GLU A 36 6.322 -9.653 17.282 1.00 1.78 C ATOM 572 O GLU A 36 6.721 -8.502 17.472 1.00 1.92 O ATOM 573 CB GLU A 36 7.203 -10.526 19.455 1.00 2.27 C ATOM 574 CG GLU A 36 7.889 -11.648 20.213 1.00 2.71 C ATOM 575 CD GLU A 36 8.279 -11.241 21.615 1.00 3.32 C ATOM 576 OE1 GLU A 36 9.373 -10.663 21.784 1.00 3.69 O ATOM 577 OE2 GLU A 36 7.496 -11.487 22.553 1.00 3.86 O ATOM 0 H GLU A 36 9.084 -10.892 17.914 1.00 1.87 H new ATOM 0 HA GLU A 36 6.350 -11.704 17.873 1.00 1.94 H new ATOM 0 HB2 GLU A 36 7.796 -9.617 19.552 1.00 2.27 H new ATOM 0 HB3 GLU A 36 6.235 -10.326 19.915 1.00 2.27 H new ATOM 0 HG2 GLU A 36 7.225 -12.511 20.260 1.00 2.71 H new ATOM 0 HG3 GLU A 36 8.779 -11.960 19.667 1.00 2.71 H new ATOM 584 N ALA A 37 5.325 -9.951 16.458 1.00 1.73 N ATOM 585 CA ALA A 37 4.562 -8.921 15.774 1.00 1.70 C ATOM 586 C ALA A 37 3.885 -7.999 16.781 1.00 1.55 C ATOM 587 O ALA A 37 3.331 -8.463 17.780 1.00 1.78 O ATOM 588 CB ALA A 37 3.528 -9.553 14.858 1.00 2.06 C ATOM 0 H ALA A 37 5.027 -10.904 16.248 1.00 1.73 H new ATOM 0 HA ALA A 37 5.248 -8.327 15.170 1.00 1.70 H new ATOM 0 HB1 ALA A 37 2.963 -8.770 14.352 1.00 2.06 H new ATOM 0 HB2 ALA A 37 4.030 -10.175 14.117 1.00 2.06 H new ATOM 0 HB3 ALA A 37 2.848 -10.168 15.447 1.00 2.06 H new ATOM 594 N PRO A 38 3.940 -6.683 16.541 1.00 1.53 N ATOM 595 CA PRO A 38 3.321 -5.692 17.418 1.00 1.68 C ATOM 596 C PRO A 38 1.809 -5.649 17.247 1.00 1.55 C ATOM 597 O PRO A 38 1.237 -6.402 16.454 1.00 1.51 O ATOM 598 CB PRO A 38 3.946 -4.357 16.974 1.00 2.02 C ATOM 599 CG PRO A 38 4.993 -4.708 15.966 1.00 2.11 C ATOM 600 CD PRO A 38 4.608 -6.044 15.403 1.00 1.77 C ATOM 0 HA PRO A 38 3.493 -5.920 18.470 1.00 1.68 H new ATOM 0 HB2 PRO A 38 3.193 -3.698 16.541 1.00 2.02 H new ATOM 0 HB3 PRO A 38 4.382 -3.829 17.822 1.00 2.02 H new ATOM 0 HG2 PRO A 38 5.043 -3.955 15.180 1.00 2.11 H new ATOM 0 HG3 PRO A 38 5.979 -4.751 16.429 1.00 2.11 H new ATOM 0 HD2 PRO A 38 3.944 -5.947 14.544 1.00 1.77 H new ATOM 0 HD3 PRO A 38 5.478 -6.611 15.071 1.00 1.77 H new ATOM 608 N GLU A 39 1.163 -4.776 18.000 1.00 1.87 N ATOM 609 CA GLU A 39 -0.273 -4.588 17.879 1.00 1.91 C ATOM 610 C GLU A 39 -0.578 -3.825 16.594 1.00 1.53 C ATOM 611 O GLU A 39 -0.392 -2.609 16.520 1.00 1.78 O ATOM 612 CB GLU A 39 -0.816 -3.845 19.101 1.00 2.57 C ATOM 613 CG GLU A 39 -0.473 -4.531 20.414 1.00 3.24 C ATOM 614 CD GLU A 39 -1.061 -3.827 21.617 1.00 3.67 C ATOM 615 OE1 GLU A 39 -0.465 -2.825 22.071 1.00 4.19 O ATOM 616 OE2 GLU A 39 -2.126 -4.260 22.106 1.00 3.88 O ATOM 0 H GLU A 39 1.610 -4.186 18.702 1.00 1.87 H new ATOM 0 HA GLU A 39 -0.764 -5.560 17.834 1.00 1.91 H new ATOM 0 HB2 GLU A 39 -0.415 -2.832 19.111 1.00 2.57 H new ATOM 0 HB3 GLU A 39 -1.899 -3.758 19.015 1.00 2.57 H new ATOM 0 HG2 GLU A 39 -0.836 -5.558 20.387 1.00 3.24 H new ATOM 0 HG3 GLU A 39 0.611 -4.579 20.521 1.00 3.24 H new ATOM 623 N GLY A 40 -1.024 -4.552 15.577 1.00 1.33 N ATOM 624 CA GLY A 40 -1.213 -3.968 14.265 1.00 1.39 C ATOM 625 C GLY A 40 -2.558 -3.291 14.100 1.00 1.23 C ATOM 626 O GLY A 40 -3.291 -3.577 13.153 1.00 1.20 O ATOM 0 H GLY A 40 -1.259 -5.542 15.640 1.00 1.33 H new ATOM 0 HA2 GLY A 40 -0.423 -3.240 14.081 1.00 1.39 H new ATOM 0 HA3 GLY A 40 -1.111 -4.747 13.510 1.00 1.39 H new ATOM 630 N THR A 41 -2.883 -2.396 15.022 1.00 1.33 N ATOM 631 CA THR A 41 -4.105 -1.613 14.928 1.00 1.34 C ATOM 632 C THR A 41 -4.001 -0.647 13.753 1.00 1.09 C ATOM 633 O THR A 41 -4.746 -0.752 12.774 1.00 1.05 O ATOM 634 CB THR A 41 -4.349 -0.816 16.224 1.00 1.62 C ATOM 635 OG1 THR A 41 -4.091 -1.642 17.367 1.00 1.89 O ATOM 636 CG2 THR A 41 -5.776 -0.297 16.280 1.00 1.79 C ATOM 0 H THR A 41 -2.315 -2.194 15.845 1.00 1.33 H new ATOM 0 HA THR A 41 -4.941 -2.296 14.777 1.00 1.34 H new ATOM 0 HB THR A 41 -3.669 0.035 16.232 1.00 1.62 H new ATOM 0 HG1 THR A 41 -4.247 -1.126 18.185 1.00 1.89 H new ATOM 0 HG21 THR A 41 -5.924 0.262 17.204 1.00 1.79 H new ATOM 0 HG22 THR A 41 -5.959 0.356 15.427 1.00 1.79 H new ATOM 0 HG23 THR A 41 -6.470 -1.137 16.249 1.00 1.79 H new ATOM 644 N GLU A 42 -3.055 0.282 13.853 1.00 1.02 N ATOM 645 CA GLU A 42 -2.803 1.247 12.797 1.00 0.87 C ATOM 646 C GLU A 42 -2.400 0.531 11.516 1.00 0.73 C ATOM 647 O GLU A 42 -2.883 0.855 10.431 1.00 0.63 O ATOM 648 CB GLU A 42 -1.684 2.204 13.215 1.00 1.05 C ATOM 649 CG GLU A 42 -1.533 3.399 12.296 1.00 1.53 C ATOM 650 CD GLU A 42 -2.640 4.407 12.491 1.00 2.12 C ATOM 651 OE1 GLU A 42 -3.732 4.208 11.916 1.00 2.42 O ATOM 652 OE2 GLU A 42 -2.425 5.409 13.196 1.00 2.82 O ATOM 0 H GLU A 42 -2.446 0.384 14.665 1.00 1.02 H new ATOM 0 HA GLU A 42 -3.717 1.814 12.621 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -1.879 2.557 14.228 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -0.742 1.657 13.244 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -0.571 3.877 12.479 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -1.529 3.061 11.260 1.00 1.53 H new ATOM 659 N SER A 43 -1.530 -0.463 11.667 1.00 0.79 N ATOM 660 CA SER A 43 -0.970 -1.194 10.539 1.00 0.75 C ATOM 661 C SER A 43 -2.060 -1.746 9.625 1.00 0.67 C ATOM 662 O SER A 43 -2.000 -1.570 8.410 1.00 0.62 O ATOM 663 CB SER A 43 -0.095 -2.340 11.052 1.00 0.94 C ATOM 664 OG SER A 43 0.709 -1.918 12.143 1.00 1.14 O ATOM 0 H SER A 43 -1.194 -0.783 12.575 1.00 0.79 H new ATOM 0 HA SER A 43 -0.367 -0.498 9.955 1.00 0.75 H new ATOM 0 HB2 SER A 43 -0.726 -3.173 11.362 1.00 0.94 H new ATOM 0 HB3 SER A 43 0.542 -2.705 10.246 1.00 0.94 H new ATOM 0 HG SER A 43 1.441 -2.556 12.275 1.00 1.14 H new ATOM 670 N GLU A 44 -3.070 -2.375 10.213 1.00 0.72 N ATOM 671 CA GLU A 44 -4.113 -3.039 9.437 1.00 0.73 C ATOM 672 C GLU A 44 -4.947 -2.020 8.653 1.00 0.61 C ATOM 673 O GLU A 44 -5.557 -2.353 7.636 1.00 0.66 O ATOM 674 CB GLU A 44 -5.009 -3.863 10.364 1.00 0.85 C ATOM 675 CG GLU A 44 -5.824 -4.931 9.650 1.00 1.32 C ATOM 676 CD GLU A 44 -4.955 -5.993 9.002 1.00 1.96 C ATOM 677 OE1 GLU A 44 -4.263 -6.731 9.731 1.00 1.90 O ATOM 678 OE2 GLU A 44 -4.946 -6.087 7.758 1.00 2.98 O ATOM 0 H GLU A 44 -3.190 -2.440 11.224 1.00 0.72 H new ATOM 0 HA GLU A 44 -3.636 -3.706 8.719 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -4.388 -4.341 11.122 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -5.689 -3.191 10.887 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -6.499 -5.405 10.363 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -6.445 -4.460 8.888 1.00 1.32 H new ATOM 685 N ALA A 45 -4.941 -0.773 9.109 1.00 0.53 N ATOM 686 CA ALA A 45 -5.721 0.276 8.471 1.00 0.45 C ATOM 687 C ALA A 45 -5.030 0.769 7.206 1.00 0.39 C ATOM 688 O ALA A 45 -5.616 0.770 6.125 1.00 0.39 O ATOM 689 CB ALA A 45 -5.946 1.425 9.437 1.00 0.48 C ATOM 0 H ALA A 45 -4.403 -0.465 9.919 1.00 0.53 H new ATOM 0 HA ALA A 45 -6.689 -0.138 8.189 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -6.531 2.203 8.947 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -6.485 1.064 10.313 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -4.984 1.834 9.746 1.00 0.48 H new ATOM 695 N VAL A 46 -3.777 1.180 7.344 1.00 0.36 N ATOM 696 CA VAL A 46 -3.000 1.648 6.206 1.00 0.32 C ATOM 697 C VAL A 46 -2.722 0.504 5.233 1.00 0.34 C ATOM 698 O VAL A 46 -2.720 0.696 4.019 1.00 0.35 O ATOM 699 CB VAL A 46 -1.683 2.328 6.651 1.00 0.33 C ATOM 700 CG1 VAL A 46 -1.285 1.889 8.049 1.00 0.34 C ATOM 701 CG2 VAL A 46 -0.565 2.039 5.667 1.00 0.34 C ATOM 0 H VAL A 46 -3.277 1.199 8.233 1.00 0.36 H new ATOM 0 HA VAL A 46 -3.596 2.401 5.690 1.00 0.32 H new ATOM 0 HB VAL A 46 -1.856 3.404 6.669 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -0.356 2.383 8.335 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.072 2.160 8.753 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.141 0.809 8.064 1.00 0.34 H new ATOM 0 HG21 VAL A 46 0.350 2.528 6.002 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -0.401 0.963 5.608 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -0.840 2.418 4.683 1.00 0.34 H new ATOM 711 N LYS A 47 -2.497 -0.681 5.773 1.00 0.41 N ATOM 712 CA LYS A 47 -2.371 -1.888 4.960 1.00 0.50 C ATOM 713 C LYS A 47 -3.592 -2.039 4.051 1.00 0.51 C ATOM 714 O LYS A 47 -3.469 -2.387 2.876 1.00 0.59 O ATOM 715 CB LYS A 47 -2.235 -3.108 5.874 1.00 0.63 C ATOM 716 CG LYS A 47 -2.337 -4.444 5.163 1.00 0.84 C ATOM 717 CD LYS A 47 -2.308 -5.578 6.166 1.00 1.45 C ATOM 718 CE LYS A 47 -2.820 -6.872 5.565 1.00 1.93 C ATOM 719 NZ LYS A 47 -2.892 -7.949 6.583 1.00 2.14 N ATOM 0 H LYS A 47 -2.397 -0.838 6.776 1.00 0.41 H new ATOM 0 HA LYS A 47 -1.482 -1.810 4.335 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -1.274 -3.056 6.386 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -3.008 -3.059 6.641 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -3.259 -4.486 4.584 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -1.513 -4.552 4.458 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -1.288 -5.721 6.524 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -2.915 -5.314 7.032 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -3.808 -6.709 5.134 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -2.165 -7.182 4.751 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -3.309 -8.801 6.158 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -1.935 -8.166 6.927 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -3.483 -7.635 7.379 1.00 2.14 H new ATOM 733 N GLN A 48 -4.761 -1.746 4.606 1.00 0.47 N ATOM 734 CA GLN A 48 -6.009 -1.774 3.852 1.00 0.52 C ATOM 735 C GLN A 48 -6.019 -0.653 2.819 1.00 0.48 C ATOM 736 O GLN A 48 -6.477 -0.829 1.689 1.00 0.54 O ATOM 737 CB GLN A 48 -7.191 -1.614 4.810 1.00 0.55 C ATOM 738 CG GLN A 48 -8.545 -1.546 4.127 1.00 0.85 C ATOM 739 CD GLN A 48 -9.645 -1.126 5.081 1.00 1.50 C ATOM 740 OE1 GLN A 48 -9.596 -1.418 6.276 1.00 2.23 O ATOM 741 NE2 GLN A 48 -10.637 -0.421 4.567 1.00 2.02 N ATOM 0 H GLN A 48 -4.872 -1.484 5.585 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.094 -2.729 3.334 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -7.192 -2.450 5.510 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -7.047 -0.707 5.397 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -8.497 -0.841 3.297 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -8.786 -2.521 3.703 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -10.642 -0.199 3.572 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -11.397 -0.099 5.166 1.00 2.02 H new ATOM 750 N ALA A 49 -5.490 0.496 3.219 1.00 0.42 N ATOM 751 CA ALA A 49 -5.411 1.657 2.353 1.00 0.40 C ATOM 752 C ALA A 49 -4.566 1.357 1.123 1.00 0.39 C ATOM 753 O ALA A 49 -4.976 1.627 -0.004 1.00 0.42 O ATOM 754 CB ALA A 49 -4.833 2.830 3.119 1.00 0.36 C ATOM 0 H ALA A 49 -5.105 0.646 4.152 1.00 0.42 H new ATOM 0 HA ALA A 49 -6.416 1.912 2.017 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -4.776 3.699 2.464 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -5.473 3.059 3.971 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -3.834 2.576 3.473 1.00 0.36 H new ATOM 760 N LEU A 50 -3.390 0.781 1.349 1.00 0.38 N ATOM 761 CA LEU A 50 -2.491 0.422 0.255 1.00 0.39 C ATOM 762 C LEU A 50 -3.072 -0.722 -0.567 1.00 0.46 C ATOM 763 O LEU A 50 -2.783 -0.852 -1.754 1.00 0.49 O ATOM 764 CB LEU A 50 -1.097 0.039 0.770 1.00 0.39 C ATOM 765 CG LEU A 50 -0.128 1.209 0.997 1.00 0.33 C ATOM 766 CD1 LEU A 50 0.036 2.029 -0.275 1.00 0.31 C ATOM 767 CD2 LEU A 50 -0.592 2.092 2.140 1.00 0.29 C ATOM 0 H LEU A 50 -3.036 0.552 2.278 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.388 1.302 -0.380 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.212 -0.501 1.710 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -0.644 -0.652 0.059 1.00 0.39 H new ATOM 0 HG LEU A 50 0.841 0.789 1.266 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.726 2.852 -0.091 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.431 1.395 -1.068 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -0.932 2.428 -0.578 1.00 0.31 H new ATOM 0 HD21 LEU A 50 0.114 2.911 2.277 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -1.578 2.497 1.910 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -0.646 1.503 3.056 1.00 0.29 H new ATOM 779 N ARG A 51 -3.901 -1.540 0.069 1.00 0.52 N ATOM 780 CA ARG A 51 -4.551 -2.652 -0.610 1.00 0.61 C ATOM 781 C ARG A 51 -5.486 -2.129 -1.696 1.00 0.62 C ATOM 782 O ARG A 51 -5.546 -2.672 -2.800 1.00 0.69 O ATOM 783 CB ARG A 51 -5.328 -3.501 0.398 1.00 0.67 C ATOM 784 CG ARG A 51 -5.814 -4.828 -0.153 1.00 0.98 C ATOM 785 CD ARG A 51 -6.581 -5.606 0.900 1.00 1.49 C ATOM 786 NE ARG A 51 -6.900 -6.962 0.466 1.00 2.00 N ATOM 787 CZ ARG A 51 -7.417 -7.892 1.266 1.00 2.89 C ATOM 788 NH1 ARG A 51 -7.723 -7.595 2.522 1.00 3.39 N ATOM 789 NH2 ARG A 51 -7.633 -9.116 0.807 1.00 3.74 N ATOM 0 H ARG A 51 -4.139 -1.453 1.057 1.00 0.52 H new ATOM 0 HA ARG A 51 -3.789 -3.276 -1.077 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -4.693 -3.690 1.263 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.187 -2.930 0.752 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -6.453 -4.654 -1.019 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -4.963 -5.416 -0.497 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -5.992 -5.650 1.816 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -7.504 -5.077 1.139 1.00 1.49 H new ATOM 0 HE ARG A 51 -6.716 -7.212 -0.506 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -7.562 -6.652 2.877 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -8.119 -8.309 3.133 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -7.403 -9.346 -0.160 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -8.029 -9.828 1.420 1.00 3.74 H new ATOM 803 N GLU A 52 -6.212 -1.065 -1.377 1.00 0.59 N ATOM 804 CA GLU A 52 -7.066 -0.403 -2.357 1.00 0.62 C ATOM 805 C GLU A 52 -6.232 0.474 -3.283 1.00 0.59 C ATOM 806 O GLU A 52 -6.522 0.598 -4.472 1.00 0.65 O ATOM 807 CB GLU A 52 -8.131 0.444 -1.656 1.00 0.66 C ATOM 808 CG GLU A 52 -9.204 -0.379 -0.963 1.00 0.92 C ATOM 809 CD GLU A 52 -10.083 -1.128 -1.943 1.00 1.23 C ATOM 810 OE1 GLU A 52 -9.689 -2.234 -2.372 1.00 1.88 O ATOM 811 OE2 GLU A 52 -11.171 -0.616 -2.292 1.00 1.45 O ATOM 0 H GLU A 52 -6.227 -0.642 -0.449 1.00 0.59 H new ATOM 0 HA GLU A 52 -7.563 -1.170 -2.951 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -7.646 1.086 -0.921 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -8.603 1.098 -2.389 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -8.731 -1.091 -0.286 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -9.824 0.278 -0.352 1.00 0.92 H new ATOM 818 N ALA A 53 -5.185 1.069 -2.728 1.00 0.52 N ATOM 819 CA ALA A 53 -4.313 1.961 -3.473 1.00 0.49 C ATOM 820 C ALA A 53 -3.612 1.241 -4.620 1.00 0.52 C ATOM 821 O ALA A 53 -3.614 1.722 -5.753 1.00 0.53 O ATOM 822 CB ALA A 53 -3.298 2.579 -2.532 1.00 0.43 C ATOM 0 H ALA A 53 -4.918 0.946 -1.751 1.00 0.52 H new ATOM 0 HA ALA A 53 -4.926 2.747 -3.915 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -2.644 3.248 -3.091 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -3.817 3.143 -1.757 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -2.702 1.791 -2.071 1.00 0.43 H new ATOM 828 N GLY A 54 -3.022 0.089 -4.319 1.00 0.57 N ATOM 829 CA GLY A 54 -2.320 -0.683 -5.333 1.00 0.64 C ATOM 830 C GLY A 54 -3.234 -1.115 -6.463 1.00 0.74 C ATOM 831 O GLY A 54 -2.793 -1.282 -7.601 1.00 0.82 O ATOM 0 H GLY A 54 -3.017 -0.327 -3.388 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -1.502 -0.087 -5.738 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -1.875 -1.564 -4.872 1.00 0.64 H new ATOM 835 N ASP A 55 -4.510 -1.283 -6.147 1.00 0.79 N ATOM 836 CA ASP A 55 -5.510 -1.643 -7.146 1.00 0.92 C ATOM 837 C ASP A 55 -5.884 -0.421 -7.974 1.00 0.88 C ATOM 838 O ASP A 55 -5.969 -0.488 -9.203 1.00 0.97 O ATOM 839 CB ASP A 55 -6.758 -2.227 -6.470 1.00 1.04 C ATOM 840 CG ASP A 55 -7.935 -2.360 -7.420 1.00 1.12 C ATOM 841 OD1 ASP A 55 -7.919 -3.283 -8.264 1.00 1.34 O ATOM 842 OD2 ASP A 55 -8.870 -1.534 -7.342 1.00 1.29 O ATOM 0 H ASP A 55 -4.880 -1.176 -5.203 1.00 0.79 H new ATOM 0 HA ASP A 55 -5.087 -2.401 -7.805 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -6.517 -3.207 -6.058 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -7.043 -1.590 -5.632 1.00 1.04 H new ATOM 847 N GLU A 56 -6.077 0.696 -7.282 1.00 0.79 N ATOM 848 CA GLU A 56 -6.443 1.956 -7.912 1.00 0.83 C ATOM 849 C GLU A 56 -5.362 2.404 -8.892 1.00 0.78 C ATOM 850 O GLU A 56 -5.632 2.654 -10.068 1.00 0.85 O ATOM 851 CB GLU A 56 -6.633 3.032 -6.838 1.00 0.83 C ATOM 852 CG GLU A 56 -7.193 4.344 -7.362 1.00 0.94 C ATOM 853 CD GLU A 56 -8.659 4.246 -7.703 1.00 1.27 C ATOM 854 OE1 GLU A 56 -9.500 4.488 -6.818 1.00 2.06 O ATOM 855 OE2 GLU A 56 -8.978 3.918 -8.865 1.00 1.38 O ATOM 0 H GLU A 56 -5.984 0.752 -6.268 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.374 1.811 -8.460 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -7.301 2.647 -6.068 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -5.673 3.225 -6.359 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -7.048 5.123 -6.614 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -6.636 4.646 -8.249 1.00 0.94 H new ATOM 862 N PHE A 57 -4.130 2.482 -8.397 1.00 0.72 N ATOM 863 CA PHE A 57 -3.019 3.010 -9.178 1.00 0.76 C ATOM 864 C PHE A 57 -2.742 2.139 -10.399 1.00 0.82 C ATOM 865 O PHE A 57 -2.470 2.652 -11.485 1.00 0.90 O ATOM 866 CB PHE A 57 -1.757 3.122 -8.313 1.00 0.77 C ATOM 867 CG PHE A 57 -0.605 3.809 -9.001 1.00 0.94 C ATOM 868 CD1 PHE A 57 -0.525 5.193 -9.027 1.00 1.07 C ATOM 869 CD2 PHE A 57 0.397 3.074 -9.619 1.00 1.05 C ATOM 870 CE1 PHE A 57 0.527 5.830 -9.657 1.00 1.26 C ATOM 871 CE2 PHE A 57 1.452 3.706 -10.251 1.00 1.25 C ATOM 872 CZ PHE A 57 1.517 5.086 -10.270 1.00 1.34 C ATOM 0 H PHE A 57 -3.877 2.185 -7.455 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.299 4.005 -9.524 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -2.000 3.667 -7.401 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -1.444 2.122 -8.013 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -1.295 5.781 -8.549 1.00 1.07 H new ATOM 0 HD2 PHE A 57 0.352 1.995 -9.606 1.00 1.05 H new ATOM 0 HE1 PHE A 57 0.575 6.909 -9.670 1.00 1.26 H new ATOM 0 HE2 PHE A 57 2.224 3.122 -10.729 1.00 1.25 H new ATOM 0 HZ PHE A 57 2.340 5.582 -10.763 1.00 1.34 H new ATOM 882 N GLU A 58 -2.838 0.825 -10.229 1.00 0.83 N ATOM 883 CA GLU A 58 -2.496 -0.101 -11.300 1.00 0.95 C ATOM 884 C GLU A 58 -3.599 -0.139 -12.356 1.00 0.99 C ATOM 885 O GLU A 58 -3.329 -0.323 -13.537 1.00 1.08 O ATOM 886 CB GLU A 58 -2.241 -1.508 -10.742 1.00 1.05 C ATOM 887 CG GLU A 58 -1.677 -2.484 -11.767 1.00 1.35 C ATOM 888 CD GLU A 58 -1.482 -3.876 -11.207 1.00 1.27 C ATOM 889 OE1 GLU A 58 -0.453 -4.120 -10.543 1.00 1.45 O ATOM 890 OE2 GLU A 58 -2.357 -4.737 -11.438 1.00 1.61 O ATOM 0 H GLU A 58 -3.148 0.380 -9.365 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.580 0.253 -11.772 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -1.548 -1.436 -9.903 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.176 -1.908 -10.350 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -2.349 -2.533 -12.623 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -0.722 -2.108 -12.133 1.00 1.35 H new ATOM 897 N LEU A 59 -4.845 0.043 -11.936 1.00 0.98 N ATOM 898 CA LEU A 59 -5.953 0.074 -12.878 1.00 1.10 C ATOM 899 C LEU A 59 -5.945 1.380 -13.658 1.00 1.10 C ATOM 900 O LEU A 59 -6.265 1.413 -14.847 1.00 1.24 O ATOM 901 CB LEU A 59 -7.289 -0.082 -12.153 1.00 1.19 C ATOM 902 CG LEU A 59 -8.516 -0.059 -13.064 1.00 1.36 C ATOM 903 CD1 LEU A 59 -8.538 -1.282 -13.969 1.00 1.59 C ATOM 904 CD2 LEU A 59 -9.788 0.029 -12.242 1.00 1.56 C ATOM 0 H LEU A 59 -5.110 0.170 -10.959 1.00 0.98 H new ATOM 0 HA LEU A 59 -5.831 -0.760 -13.569 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -7.280 -1.022 -11.602 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.384 0.717 -11.418 1.00 1.19 H new ATOM 0 HG LEU A 59 -8.458 0.827 -13.696 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -9.420 -1.245 -14.609 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -7.641 -1.293 -14.588 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -8.569 -2.185 -13.360 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -10.651 0.044 -12.908 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -9.855 -0.835 -11.581 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -9.773 0.941 -11.646 1.00 1.56 H new ATOM 916 N ARG A 60 -5.558 2.451 -12.985 1.00 1.00 N ATOM 917 CA ARG A 60 -5.574 3.781 -13.583 1.00 1.06 C ATOM 918 C ARG A 60 -4.351 4.016 -14.460 1.00 1.00 C ATOM 919 O ARG A 60 -4.474 4.484 -15.592 1.00 1.07 O ATOM 920 CB ARG A 60 -5.661 4.865 -12.499 1.00 1.10 C ATOM 921 CG ARG A 60 -7.083 5.180 -12.047 1.00 1.19 C ATOM 922 CD ARG A 60 -7.872 5.880 -13.146 1.00 1.31 C ATOM 923 NE ARG A 60 -7.232 7.130 -13.556 1.00 1.81 N ATOM 924 CZ ARG A 60 -7.365 7.680 -14.762 1.00 2.26 C ATOM 925 NH1 ARG A 60 -8.149 7.114 -15.674 1.00 2.15 N ATOM 926 NH2 ARG A 60 -6.717 8.803 -15.054 1.00 3.21 N ATOM 0 H ARG A 60 -5.227 2.428 -12.020 1.00 1.00 H new ATOM 0 HA ARG A 60 -6.460 3.842 -14.215 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -5.078 4.547 -11.634 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -5.200 5.778 -12.875 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -7.590 4.257 -11.764 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -7.053 5.812 -11.159 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -7.963 5.218 -14.007 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -8.883 6.086 -12.794 1.00 1.31 H new ATOM 0 HE ARG A 60 -6.646 7.612 -12.874 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -8.652 6.255 -15.452 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -8.248 7.539 -16.596 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -6.118 9.243 -14.355 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -6.818 9.225 -15.977 1.00 3.21 H new ATOM 940 N TYR A 61 -3.174 3.691 -13.945 1.00 0.91 N ATOM 941 CA TYR A 61 -1.935 3.957 -14.659 1.00 0.90 C ATOM 942 C TYR A 61 -1.056 2.709 -14.688 1.00 0.84 C ATOM 943 O TYR A 61 0.055 2.704 -14.153 1.00 0.83 O ATOM 944 CB TYR A 61 -1.186 5.132 -14.012 1.00 0.96 C ATOM 945 CG TYR A 61 -2.029 6.385 -13.868 1.00 1.05 C ATOM 946 CD1 TYR A 61 -2.547 7.040 -14.982 1.00 1.27 C ATOM 947 CD2 TYR A 61 -2.316 6.909 -12.613 1.00 1.04 C ATOM 948 CE1 TYR A 61 -3.327 8.174 -14.847 1.00 1.38 C ATOM 949 CE2 TYR A 61 -3.093 8.045 -12.471 1.00 1.14 C ATOM 950 CZ TYR A 61 -3.595 8.672 -13.591 1.00 1.27 C ATOM 951 OH TYR A 61 -4.379 9.797 -13.454 1.00 1.41 O ATOM 0 H TYR A 61 -3.052 3.243 -13.037 1.00 0.91 H new ATOM 0 HA TYR A 61 -2.178 4.228 -15.686 1.00 0.90 H new ATOM 0 HB2 TYR A 61 -0.831 4.828 -13.027 1.00 0.96 H new ATOM 0 HB3 TYR A 61 -0.305 5.364 -14.610 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -2.336 6.656 -15.969 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -1.925 6.420 -11.733 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -3.724 8.667 -15.722 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -3.305 8.438 -11.488 1.00 1.14 H new ATOM 0 HH TYR A 61 -4.473 10.017 -12.504 1.00 1.41 H new ATOM 961 N ARG A 62 -1.567 1.647 -15.302 1.00 0.86 N ATOM 962 CA ARG A 62 -0.835 0.385 -15.393 1.00 0.85 C ATOM 963 C ARG A 62 0.446 0.550 -16.204 1.00 0.87 C ATOM 964 O ARG A 62 1.481 -0.033 -15.875 1.00 0.85 O ATOM 965 CB ARG A 62 -1.713 -0.700 -16.026 1.00 0.95 C ATOM 966 CG ARG A 62 -1.080 -2.085 -16.030 1.00 1.04 C ATOM 967 CD ARG A 62 -2.022 -3.126 -16.614 1.00 1.23 C ATOM 968 NE ARG A 62 -3.239 -3.278 -15.812 1.00 1.73 N ATOM 969 CZ ARG A 62 -4.474 -3.087 -16.281 1.00 2.16 C ATOM 970 NH1 ARG A 62 -4.662 -2.656 -17.525 1.00 2.24 N ATOM 971 NH2 ARG A 62 -5.519 -3.307 -15.494 1.00 3.02 N ATOM 0 H ARG A 62 -2.486 1.633 -15.745 1.00 0.86 H new ATOM 0 HA ARG A 62 -0.567 0.083 -14.381 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.660 -0.746 -15.488 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -1.943 -0.414 -17.052 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -0.157 -2.063 -16.609 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -0.811 -2.366 -15.012 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -2.291 -2.841 -17.631 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -1.508 -4.085 -16.678 1.00 1.23 H new ATOM 0 HE ARG A 62 -3.136 -3.547 -14.833 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -3.860 -2.469 -18.127 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -5.608 -2.512 -17.877 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -5.377 -3.621 -14.534 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -6.464 -3.162 -15.849 1.00 3.02 H new ATOM 985 N ARG A 63 0.374 1.345 -17.263 1.00 0.94 N ATOM 986 CA ARG A 63 1.531 1.583 -18.114 1.00 1.01 C ATOM 987 C ARG A 63 2.632 2.285 -17.325 1.00 0.95 C ATOM 988 O ARG A 63 3.809 1.938 -17.446 1.00 0.99 O ATOM 989 CB ARG A 63 1.131 2.406 -19.345 1.00 1.16 C ATOM 990 CG ARG A 63 2.263 2.621 -20.340 1.00 1.70 C ATOM 991 CD ARG A 63 1.755 3.274 -21.612 1.00 2.14 C ATOM 992 NE ARG A 63 2.826 3.520 -22.573 1.00 2.71 N ATOM 993 CZ ARG A 63 2.616 3.867 -23.842 1.00 3.58 C ATOM 994 NH1 ARG A 63 1.380 3.942 -24.322 1.00 3.92 N ATOM 995 NH2 ARG A 63 3.647 4.127 -24.634 1.00 4.52 N ATOM 0 H ARG A 63 -0.472 1.835 -17.553 1.00 0.94 H new ATOM 0 HA ARG A 63 1.916 0.623 -18.459 1.00 1.01 H new ATOM 0 HB2 ARG A 63 0.306 1.905 -19.852 1.00 1.16 H new ATOM 0 HB3 ARG A 63 0.761 3.377 -19.016 1.00 1.16 H new ATOM 0 HG2 ARG A 63 3.034 3.246 -19.889 1.00 1.70 H new ATOM 0 HG3 ARG A 63 2.728 1.665 -20.579 1.00 1.70 H new ATOM 0 HD2 ARG A 63 0.999 2.635 -22.069 1.00 2.14 H new ATOM 0 HD3 ARG A 63 1.268 4.217 -21.364 1.00 2.14 H new ATOM 0 HE ARG A 63 3.790 3.421 -22.255 1.00 2.71 H new ATOM 0 HH11 ARG A 63 0.585 3.733 -23.718 1.00 3.92 H new ATOM 0 HH12 ARG A 63 1.226 4.208 -25.294 1.00 3.92 H new ATOM 0 HH21 ARG A 63 4.598 4.061 -24.271 1.00 4.52 H new ATOM 0 HH22 ARG A 63 3.489 4.393 -25.606 1.00 4.52 H new ATOM 1009 N ALA A 64 2.245 3.251 -16.499 1.00 0.90 N ATOM 1010 CA ALA A 64 3.194 3.948 -15.646 1.00 0.89 C ATOM 1011 C ALA A 64 3.785 2.992 -14.618 1.00 0.75 C ATOM 1012 O ALA A 64 4.989 2.996 -14.371 1.00 0.73 O ATOM 1013 CB ALA A 64 2.529 5.124 -14.952 1.00 0.94 C ATOM 0 H ALA A 64 1.280 3.567 -16.404 1.00 0.90 H new ATOM 0 HA ALA A 64 4.001 4.330 -16.272 1.00 0.89 H new ATOM 0 HB1 ALA A 64 3.257 5.632 -14.319 1.00 0.94 H new ATOM 0 HB2 ALA A 64 2.150 5.821 -15.700 1.00 0.94 H new ATOM 0 HB3 ALA A 64 1.703 4.765 -14.339 1.00 0.94 H new ATOM 1019 N PHE A 65 2.925 2.162 -14.039 1.00 0.69 N ATOM 1020 CA PHE A 65 3.347 1.175 -13.050 1.00 0.61 C ATOM 1021 C PHE A 65 4.406 0.236 -13.627 1.00 0.59 C ATOM 1022 O PHE A 65 5.472 0.050 -13.036 1.00 0.59 O ATOM 1023 CB PHE A 65 2.141 0.365 -12.551 1.00 0.62 C ATOM 1024 CG PHE A 65 2.499 -0.670 -11.519 1.00 0.59 C ATOM 1025 CD1 PHE A 65 2.793 -0.297 -10.215 1.00 0.60 C ATOM 1026 CD2 PHE A 65 2.541 -2.012 -11.853 1.00 0.64 C ATOM 1027 CE1 PHE A 65 3.119 -1.245 -9.268 1.00 0.64 C ATOM 1028 CE2 PHE A 65 2.867 -2.964 -10.908 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.162 -2.579 -9.614 1.00 0.66 C ATOM 0 H PHE A 65 1.925 2.153 -14.239 1.00 0.69 H new ATOM 0 HA PHE A 65 3.786 1.711 -12.209 1.00 0.61 H new ATOM 0 HB2 PHE A 65 1.404 1.048 -12.129 1.00 0.62 H new ATOM 0 HB3 PHE A 65 1.668 -0.128 -13.400 1.00 0.62 H new ATOM 0 HD1 PHE A 65 2.766 0.747 -9.939 1.00 0.60 H new ATOM 0 HD2 PHE A 65 2.316 -2.318 -12.864 1.00 0.64 H new ATOM 0 HE1 PHE A 65 3.341 -0.942 -8.255 1.00 0.64 H new ATOM 0 HE2 PHE A 65 2.891 -4.009 -11.180 1.00 0.68 H new ATOM 0 HZ PHE A 65 3.426 -3.321 -8.875 1.00 0.66 H new ATOM 1039 N SER A 66 4.113 -0.347 -14.784 1.00 0.64 N ATOM 1040 CA SER A 66 5.032 -1.279 -15.431 1.00 0.68 C ATOM 1041 C SER A 66 6.336 -0.583 -15.836 1.00 0.66 C ATOM 1042 O SER A 66 7.407 -1.193 -15.827 1.00 0.68 O ATOM 1043 CB SER A 66 4.360 -1.907 -16.655 1.00 0.83 C ATOM 1044 OG SER A 66 3.116 -2.497 -16.305 1.00 1.20 O ATOM 0 H SER A 66 3.244 -0.191 -15.295 1.00 0.64 H new ATOM 0 HA SER A 66 5.282 -2.064 -14.717 1.00 0.68 H new ATOM 0 HB2 SER A 66 4.203 -1.146 -17.419 1.00 0.83 H new ATOM 0 HB3 SER A 66 5.016 -2.662 -17.087 1.00 0.83 H new ATOM 0 HG SER A 66 2.454 -1.793 -16.143 1.00 1.20 H new ATOM 1050 N ASP A 67 6.240 0.697 -16.174 1.00 0.68 N ATOM 1051 CA ASP A 67 7.414 1.477 -16.563 1.00 0.73 C ATOM 1052 C ASP A 67 8.279 1.796 -15.342 1.00 0.65 C ATOM 1053 O ASP A 67 9.489 1.564 -15.350 1.00 0.66 O ATOM 1054 CB ASP A 67 6.982 2.772 -17.268 1.00 0.89 C ATOM 1055 CG ASP A 67 8.152 3.622 -17.732 1.00 1.36 C ATOM 1056 OD1 ASP A 67 8.670 4.420 -16.920 1.00 2.06 O ATOM 1057 OD2 ASP A 67 8.537 3.520 -18.918 1.00 1.41 O ATOM 0 H ASP A 67 5.364 1.219 -16.187 1.00 0.68 H new ATOM 0 HA ASP A 67 8.009 0.883 -17.257 1.00 0.73 H new ATOM 0 HB2 ASP A 67 6.361 2.520 -18.128 1.00 0.89 H new ATOM 0 HB3 ASP A 67 6.363 3.358 -16.589 1.00 0.89 H new ATOM 1062 N LEU A 68 7.647 2.293 -14.281 1.00 0.63 N ATOM 1063 CA LEU A 68 8.360 2.696 -13.073 1.00 0.66 C ATOM 1064 C LEU A 68 8.997 1.503 -12.363 1.00 0.57 C ATOM 1065 O LEU A 68 10.090 1.619 -11.804 1.00 0.63 O ATOM 1066 CB LEU A 68 7.417 3.430 -12.117 1.00 0.75 C ATOM 1067 CG LEU A 68 6.929 4.798 -12.595 1.00 0.81 C ATOM 1068 CD1 LEU A 68 5.977 5.409 -11.579 1.00 1.64 C ATOM 1069 CD2 LEU A 68 8.106 5.728 -12.841 1.00 1.07 C ATOM 0 H LEU A 68 6.637 2.426 -14.235 1.00 0.63 H new ATOM 0 HA LEU A 68 9.161 3.369 -13.378 1.00 0.66 H new ATOM 0 HB2 LEU A 68 6.548 2.797 -11.934 1.00 0.75 H new ATOM 0 HB3 LEU A 68 7.925 3.558 -11.161 1.00 0.75 H new ATOM 0 HG LEU A 68 6.393 4.662 -13.534 1.00 0.81 H new ATOM 0 HD11 LEU A 68 5.640 6.382 -11.936 1.00 1.64 H new ATOM 0 HD12 LEU A 68 5.117 4.753 -11.446 1.00 1.64 H new ATOM 0 HD13 LEU A 68 6.491 5.530 -10.626 1.00 1.64 H new ATOM 0 HD21 LEU A 68 7.739 6.697 -13.181 1.00 1.07 H new ATOM 0 HD22 LEU A 68 8.668 5.857 -11.916 1.00 1.07 H new ATOM 0 HD23 LEU A 68 8.756 5.298 -13.603 1.00 1.07 H new ATOM 1081 N THR A 69 8.327 0.353 -12.394 1.00 0.49 N ATOM 1082 CA THR A 69 8.864 -0.847 -11.762 1.00 0.49 C ATOM 1083 C THR A 69 10.129 -1.320 -12.468 1.00 0.46 C ATOM 1084 O THR A 69 10.966 -1.996 -11.873 1.00 0.51 O ATOM 1085 CB THR A 69 7.836 -1.994 -11.724 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.137 -2.076 -12.972 1.00 0.71 O ATOM 1087 CG2 THR A 69 6.843 -1.800 -10.593 1.00 0.63 C ATOM 0 H THR A 69 7.421 0.228 -12.845 1.00 0.49 H new ATOM 0 HA THR A 69 9.106 -0.573 -10.735 1.00 0.49 H new ATOM 0 HB THR A 69 8.378 -2.924 -11.552 1.00 0.51 H new ATOM 0 HG1 THR A 69 6.426 -1.402 -12.994 1.00 0.71 H new ATOM 0 HG21 THR A 69 6.129 -2.624 -10.590 1.00 0.63 H new ATOM 0 HG22 THR A 69 7.375 -1.777 -9.642 1.00 0.63 H new ATOM 0 HG23 THR A 69 6.310 -0.859 -10.734 1.00 0.63 H new ATOM 1095 N SER A 70 10.278 -0.934 -13.729 1.00 0.46 N ATOM 1096 CA SER A 70 11.454 -1.300 -14.499 1.00 0.49 C ATOM 1097 C SER A 70 12.653 -0.468 -14.052 1.00 0.48 C ATOM 1098 O SER A 70 13.794 -0.929 -14.097 1.00 0.53 O ATOM 1099 CB SER A 70 11.196 -1.110 -16.000 1.00 0.57 C ATOM 1100 OG SER A 70 12.308 -1.536 -16.769 1.00 1.31 O ATOM 0 H SER A 70 9.598 -0.368 -14.237 1.00 0.46 H new ATOM 0 HA SER A 70 11.674 -2.353 -14.322 1.00 0.49 H new ATOM 0 HB2 SER A 70 10.310 -1.673 -16.294 1.00 0.57 H new ATOM 0 HB3 SER A 70 10.989 -0.060 -16.206 1.00 0.57 H new ATOM 0 HG SER A 70 12.117 -1.405 -17.721 1.00 1.31 H new ATOM 1106 N GLN A 71 12.385 0.751 -13.599 1.00 0.49 N ATOM 1107 CA GLN A 71 13.436 1.636 -13.115 1.00 0.53 C ATOM 1108 C GLN A 71 13.936 1.161 -11.756 1.00 0.46 C ATOM 1109 O GLN A 71 15.120 1.261 -11.443 1.00 0.53 O ATOM 1110 CB GLN A 71 12.918 3.074 -13.006 1.00 0.63 C ATOM 1111 CG GLN A 71 13.962 4.063 -12.512 1.00 0.69 C ATOM 1112 CD GLN A 71 13.380 5.427 -12.182 1.00 0.83 C ATOM 1113 OE1 GLN A 71 14.054 6.448 -12.317 1.00 1.22 O ATOM 1114 NE2 GLN A 71 12.132 5.458 -11.731 1.00 0.82 N ATOM 0 H GLN A 71 11.447 1.149 -13.557 1.00 0.49 H new ATOM 0 HA GLN A 71 14.261 1.614 -13.827 1.00 0.53 H new ATOM 0 HB2 GLN A 71 12.558 3.396 -13.983 1.00 0.63 H new ATOM 0 HB3 GLN A 71 12.063 3.093 -12.330 1.00 0.63 H new ATOM 0 HG2 GLN A 71 14.447 3.657 -11.624 1.00 0.69 H new ATOM 0 HG3 GLN A 71 14.734 4.178 -13.273 1.00 0.69 H new ATOM 0 HE21 GLN A 71 11.604 4.591 -11.632 1.00 0.82 H new ATOM 0 HE22 GLN A 71 11.701 6.349 -11.483 1.00 0.82 H new ATOM 1123 N LEU A 72 13.021 0.617 -10.968 1.00 0.39 N ATOM 1124 CA LEU A 72 13.334 0.183 -9.613 1.00 0.33 C ATOM 1125 C LEU A 72 13.626 -1.317 -9.586 1.00 0.34 C ATOM 1126 O LEU A 72 13.678 -1.928 -8.520 1.00 0.37 O ATOM 1127 CB LEU A 72 12.168 0.528 -8.673 1.00 0.37 C ATOM 1128 CG LEU A 72 12.447 0.363 -7.178 1.00 0.46 C ATOM 1129 CD1 LEU A 72 13.658 1.181 -6.764 1.00 0.96 C ATOM 1130 CD2 LEU A 72 11.228 0.773 -6.368 1.00 0.92 C ATOM 0 H LEU A 72 12.051 0.465 -11.244 1.00 0.39 H new ATOM 0 HA LEU A 72 14.226 0.707 -9.270 1.00 0.33 H new ATOM 0 HB2 LEU A 72 11.872 1.561 -8.856 1.00 0.37 H new ATOM 0 HB3 LEU A 72 11.316 -0.099 -8.936 1.00 0.37 H new ATOM 0 HG LEU A 72 12.662 -0.687 -6.981 1.00 0.46 H new ATOM 0 HD11 LEU A 72 13.839 1.049 -5.697 1.00 0.96 H new ATOM 0 HD12 LEU A 72 14.531 0.847 -7.324 1.00 0.96 H new ATOM 0 HD13 LEU A 72 13.474 2.235 -6.973 1.00 0.96 H new ATOM 0 HD21 LEU A 72 11.439 0.651 -5.306 1.00 0.92 H new ATOM 0 HD22 LEU A 72 10.989 1.817 -6.573 1.00 0.92 H new ATOM 0 HD23 LEU A 72 10.380 0.146 -6.644 1.00 0.92 H new ATOM 1142 N HIS A 73 13.825 -1.890 -10.774 1.00 0.41 N ATOM 1143 CA HIS A 73 14.140 -3.315 -10.925 1.00 0.46 C ATOM 1144 C HIS A 73 15.256 -3.726 -9.966 1.00 0.41 C ATOM 1145 O HIS A 73 16.355 -3.170 -10.018 1.00 0.45 O ATOM 1146 CB HIS A 73 14.561 -3.601 -12.373 1.00 0.60 C ATOM 1147 CG HIS A 73 14.899 -5.036 -12.640 1.00 1.34 C ATOM 1148 ND1 HIS A 73 16.195 -5.498 -12.739 1.00 2.07 N ATOM 1149 CD2 HIS A 73 14.103 -6.110 -12.843 1.00 2.33 C ATOM 1150 CE1 HIS A 73 16.179 -6.793 -12.993 1.00 2.86 C ATOM 1151 NE2 HIS A 73 14.922 -7.187 -13.061 1.00 3.01 N ATOM 0 H HIS A 73 13.773 -1.383 -11.657 1.00 0.41 H new ATOM 0 HA HIS A 73 13.250 -3.896 -10.685 1.00 0.46 H new ATOM 0 HB2 HIS A 73 13.754 -3.299 -13.041 1.00 0.60 H new ATOM 0 HB3 HIS A 73 15.426 -2.984 -12.617 1.00 0.60 H new ATOM 0 HD2 HIS A 73 13.023 -6.118 -12.835 1.00 2.33 H new ATOM 0 HE1 HIS A 73 17.047 -7.423 -13.123 1.00 2.86 H new ATOM 0 HE2 HIS A 73 14.610 -8.140 -13.246 1.00 3.01 H new ATOM 1160 N ILE A 74 14.980 -4.697 -9.100 1.00 0.37 N ATOM 1161 CA ILE A 74 15.937 -5.080 -8.075 1.00 0.36 C ATOM 1162 C ILE A 74 17.132 -5.816 -8.684 1.00 0.45 C ATOM 1163 O ILE A 74 17.018 -6.937 -9.188 1.00 0.61 O ATOM 1164 CB ILE A 74 15.287 -5.926 -6.950 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.336 -6.275 -5.892 1.00 0.31 C ATOM 1166 CG2 ILE A 74 14.634 -7.189 -7.500 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.760 -6.891 -4.643 1.00 0.34 C ATOM 0 H ILE A 74 14.109 -5.227 -9.089 1.00 0.37 H new ATOM 0 HA ILE A 74 16.295 -4.157 -7.619 1.00 0.36 H new ATOM 0 HB ILE A 74 14.499 -5.331 -6.490 1.00 0.31 H new ATOM 0 HG12 ILE A 74 17.060 -6.965 -6.326 1.00 0.31 H new ATOM 0 HG13 ILE A 74 16.881 -5.370 -5.622 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.190 -7.755 -6.681 1.00 0.35 H new ATOM 0 HG22 ILE A 74 13.858 -6.916 -8.215 1.00 0.35 H new ATOM 0 HG23 ILE A 74 15.387 -7.801 -7.997 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.565 -7.110 -3.941 1.00 0.34 H new ATOM 0 HD12 ILE A 74 15.058 -6.195 -4.184 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.240 -7.814 -4.899 1.00 0.34 H new ATOM 1179 N THR A 75 18.268 -5.143 -8.680 1.00 0.61 N ATOM 1180 CA THR A 75 19.501 -5.707 -9.186 1.00 0.73 C ATOM 1181 C THR A 75 20.055 -6.738 -8.205 1.00 0.58 C ATOM 1182 O THR A 75 20.074 -6.502 -6.995 1.00 0.57 O ATOM 1183 CB THR A 75 20.543 -4.593 -9.400 1.00 1.02 C ATOM 1184 OG1 THR A 75 19.910 -3.449 -9.997 1.00 1.38 O ATOM 1185 CG2 THR A 75 21.682 -5.065 -10.291 1.00 1.56 C ATOM 0 H THR A 75 18.360 -4.191 -8.326 1.00 0.61 H new ATOM 0 HA THR A 75 19.292 -6.195 -10.138 1.00 0.73 H new ATOM 0 HB THR A 75 20.958 -4.325 -8.428 1.00 1.02 H new ATOM 0 HG1 THR A 75 20.574 -2.741 -10.131 1.00 1.38 H new ATOM 0 HG21 THR A 75 22.400 -4.256 -10.423 1.00 1.56 H new ATOM 0 HG22 THR A 75 22.177 -5.918 -9.827 1.00 1.56 H new ATOM 0 HG23 THR A 75 21.286 -5.360 -11.263 1.00 1.56 H new ATOM 1193 N PRO A 76 20.484 -7.907 -8.709 1.00 0.66 N ATOM 1194 CA PRO A 76 21.120 -8.935 -7.883 1.00 0.73 C ATOM 1195 C PRO A 76 22.305 -8.377 -7.101 1.00 0.72 C ATOM 1196 O PRO A 76 23.321 -7.995 -7.681 1.00 0.81 O ATOM 1197 CB PRO A 76 21.589 -9.975 -8.902 1.00 0.93 C ATOM 1198 CG PRO A 76 20.688 -9.791 -10.072 1.00 1.06 C ATOM 1199 CD PRO A 76 20.368 -8.323 -10.118 1.00 0.90 C ATOM 0 HA PRO A 76 20.441 -9.341 -7.133 1.00 0.73 H new ATOM 0 HB2 PRO A 76 22.632 -9.818 -9.177 1.00 0.93 H new ATOM 0 HB3 PRO A 76 21.514 -10.985 -8.500 1.00 0.93 H new ATOM 0 HG2 PRO A 76 21.173 -10.114 -10.993 1.00 1.06 H new ATOM 0 HG3 PRO A 76 19.781 -10.385 -9.964 1.00 1.06 H new ATOM 0 HD2 PRO A 76 21.064 -7.779 -10.757 1.00 0.90 H new ATOM 0 HD3 PRO A 76 19.367 -8.141 -10.510 1.00 0.90 H new ATOM 1207 N GLY A 77 22.152 -8.303 -5.788 1.00 0.86 N ATOM 1208 CA GLY A 77 23.201 -7.761 -4.949 1.00 1.10 C ATOM 1209 C GLY A 77 23.217 -6.245 -4.957 1.00 1.00 C ATOM 1210 O GLY A 77 24.272 -5.629 -5.106 1.00 1.32 O ATOM 0 H GLY A 77 21.318 -8.609 -5.287 1.00 0.86 H new ATOM 0 HA2 GLY A 77 23.066 -8.116 -3.927 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.166 -8.134 -5.291 1.00 1.10 H new ATOM 1214 N THR A 78 22.046 -5.639 -4.815 1.00 0.85 N ATOM 1215 CA THR A 78 21.943 -4.189 -4.758 1.00 0.82 C ATOM 1216 C THR A 78 21.932 -3.721 -3.296 1.00 0.85 C ATOM 1217 O THR A 78 22.225 -4.507 -2.392 1.00 1.52 O ATOM 1218 CB THR A 78 20.688 -3.681 -5.511 1.00 0.90 C ATOM 1219 OG1 THR A 78 20.733 -2.256 -5.664 1.00 1.52 O ATOM 1220 CG2 THR A 78 19.406 -4.076 -4.791 1.00 1.15 C ATOM 0 H THR A 78 21.155 -6.130 -4.737 1.00 0.85 H new ATOM 0 HA THR A 78 22.814 -3.764 -5.257 1.00 0.82 H new ATOM 0 HB THR A 78 20.689 -4.150 -6.495 1.00 0.90 H new ATOM 0 HG1 THR A 78 19.934 -1.953 -6.143 1.00 1.52 H new ATOM 0 HG21 THR A 78 18.546 -3.703 -5.348 1.00 1.15 H new ATOM 0 HG22 THR A 78 19.349 -5.162 -4.720 1.00 1.15 H new ATOM 0 HG23 THR A 78 19.404 -3.646 -3.789 1.00 1.15 H new ATOM 1228 N ALA A 79 21.588 -2.459 -3.063 1.00 0.68 N ATOM 1229 CA ALA A 79 21.618 -1.894 -1.722 1.00 0.73 C ATOM 1230 C ALA A 79 20.574 -0.793 -1.564 1.00 0.62 C ATOM 1231 O ALA A 79 20.022 -0.302 -2.554 1.00 0.56 O ATOM 1232 CB ALA A 79 23.006 -1.350 -1.418 1.00 0.85 C ATOM 0 H ALA A 79 21.285 -1.808 -3.788 1.00 0.68 H new ATOM 0 HA ALA A 79 21.380 -2.687 -1.013 1.00 0.73 H new ATOM 0 HB1 ALA A 79 23.020 -0.929 -0.413 1.00 0.85 H new ATOM 0 HB2 ALA A 79 23.736 -2.157 -1.483 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.259 -0.573 -2.140 1.00 0.85 H new ATOM 1238 N TYR A 80 20.319 -0.400 -0.316 1.00 0.63 N ATOM 1239 CA TYR A 80 19.339 0.643 -0.018 1.00 0.58 C ATOM 1240 C TYR A 80 19.708 1.959 -0.693 1.00 0.50 C ATOM 1241 O TYR A 80 18.832 2.703 -1.115 1.00 0.46 O ATOM 1242 CB TYR A 80 19.197 0.856 1.497 1.00 0.67 C ATOM 1243 CG TYR A 80 18.276 2.004 1.855 1.00 0.80 C ATOM 1244 CD1 TYR A 80 16.935 1.988 1.487 1.00 0.89 C ATOM 1245 CD2 TYR A 80 18.752 3.117 2.539 1.00 1.14 C ATOM 1246 CE1 TYR A 80 16.098 3.042 1.792 1.00 1.24 C ATOM 1247 CE2 TYR A 80 17.920 4.175 2.843 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.596 4.132 2.469 1.00 1.58 C ATOM 1249 OH TYR A 80 15.772 5.192 2.762 1.00 2.03 O ATOM 0 H TYR A 80 20.779 -0.790 0.507 1.00 0.63 H new ATOM 0 HA TYR A 80 18.381 0.306 -0.414 1.00 0.58 H new ATOM 0 HB2 TYR A 80 18.819 -0.060 1.952 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.182 1.042 1.925 1.00 0.67 H new ATOM 0 HD1 TYR A 80 16.542 1.136 0.953 1.00 0.89 H new ATOM 0 HD2 TYR A 80 19.789 3.154 2.837 1.00 1.14 H new ATOM 0 HE1 TYR A 80 15.058 3.012 1.501 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.306 5.034 3.372 1.00 1.55 H new ATOM 0 HH TYR A 80 16.181 6.023 2.442 1.00 2.03 H new ATOM 1259 N GLN A 81 21.001 2.240 -0.801 1.00 0.56 N ATOM 1260 CA GLN A 81 21.459 3.472 -1.433 1.00 0.59 C ATOM 1261 C GLN A 81 20.935 3.569 -2.864 1.00 0.54 C ATOM 1262 O GLN A 81 20.362 4.584 -3.255 1.00 0.63 O ATOM 1263 CB GLN A 81 22.989 3.545 -1.415 1.00 0.72 C ATOM 1264 CG GLN A 81 23.555 4.801 -2.065 1.00 0.84 C ATOM 1265 CD GLN A 81 25.070 4.866 -1.995 1.00 1.40 C ATOM 1266 OE1 GLN A 81 25.652 5.949 -1.955 1.00 2.01 O ATOM 1267 NE2 GLN A 81 25.719 3.713 -1.981 1.00 2.18 N ATOM 0 H GLN A 81 21.748 1.635 -0.461 1.00 0.56 H new ATOM 0 HA GLN A 81 21.066 4.316 -0.867 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.333 3.496 -0.382 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.391 2.670 -1.927 1.00 0.72 H new ATOM 0 HG2 GLN A 81 23.242 4.838 -3.108 1.00 0.84 H new ATOM 0 HG3 GLN A 81 23.135 5.679 -1.575 1.00 0.84 H new ATOM 0 HE21 GLN A 81 25.200 2.835 -2.015 1.00 2.18 H new ATOM 0 HE22 GLN A 81 26.738 3.702 -1.936 1.00 2.18 H new ATOM 1276 N SER A 82 21.103 2.494 -3.626 1.00 0.48 N ATOM 1277 CA SER A 82 20.648 2.452 -5.009 1.00 0.47 C ATOM 1278 C SER A 82 19.123 2.484 -5.069 1.00 0.40 C ATOM 1279 O SER A 82 18.535 3.100 -5.961 1.00 0.42 O ATOM 1280 CB SER A 82 21.185 1.191 -5.688 1.00 0.55 C ATOM 1281 OG SER A 82 22.589 1.088 -5.509 1.00 1.17 O ATOM 0 H SER A 82 21.553 1.636 -3.306 1.00 0.48 H new ATOM 0 HA SER A 82 21.027 3.328 -5.536 1.00 0.47 H new ATOM 0 HB2 SER A 82 20.694 0.311 -5.273 1.00 0.55 H new ATOM 0 HB3 SER A 82 20.949 1.216 -6.752 1.00 0.55 H new ATOM 0 HG SER A 82 22.916 0.275 -5.948 1.00 1.17 H new ATOM 1287 N PHE A 83 18.498 1.830 -4.098 1.00 0.36 N ATOM 1288 CA PHE A 83 17.044 1.789 -3.997 1.00 0.33 C ATOM 1289 C PHE A 83 16.496 3.184 -3.698 1.00 0.31 C ATOM 1290 O PHE A 83 15.515 3.625 -4.303 1.00 0.32 O ATOM 1291 CB PHE A 83 16.639 0.793 -2.894 1.00 0.35 C ATOM 1292 CG PHE A 83 15.159 0.539 -2.783 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.542 -0.400 -3.594 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.389 1.225 -1.855 1.00 0.32 C ATOM 1295 CE1 PHE A 83 13.187 -0.648 -3.483 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.034 0.983 -1.742 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.433 0.046 -2.557 1.00 0.38 C ATOM 0 H PHE A 83 18.981 1.315 -3.362 1.00 0.36 H new ATOM 0 HA PHE A 83 16.621 1.458 -4.945 1.00 0.33 H new ATOM 0 HB2 PHE A 83 17.143 -0.156 -3.078 1.00 0.35 H new ATOM 0 HB3 PHE A 83 17.002 1.166 -1.936 1.00 0.35 H new ATOM 0 HD1 PHE A 83 15.127 -0.944 -4.321 1.00 0.38 H new ATOM 0 HD2 PHE A 83 14.855 1.958 -1.213 1.00 0.32 H new ATOM 0 HE1 PHE A 83 12.718 -1.384 -4.120 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.446 1.526 -1.017 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.373 -0.145 -2.471 1.00 0.38 H new ATOM 1307 N GLU A 84 17.162 3.889 -2.790 1.00 0.34 N ATOM 1308 CA GLU A 84 16.716 5.209 -2.362 1.00 0.39 C ATOM 1309 C GLU A 84 16.901 6.236 -3.475 1.00 0.37 C ATOM 1310 O GLU A 84 16.108 7.162 -3.597 1.00 0.40 O ATOM 1311 CB GLU A 84 17.470 5.652 -1.101 1.00 0.51 C ATOM 1312 CG GLU A 84 16.977 6.971 -0.522 1.00 0.64 C ATOM 1313 CD GLU A 84 17.708 7.361 0.745 1.00 0.90 C ATOM 1314 OE1 GLU A 84 18.863 7.829 0.650 1.00 1.58 O ATOM 1315 OE2 GLU A 84 17.135 7.199 1.842 1.00 0.95 O ATOM 0 H GLU A 84 18.016 3.566 -2.335 1.00 0.34 H new ATOM 0 HA GLU A 84 15.653 5.144 -2.129 1.00 0.39 H new ATOM 0 HB2 GLU A 84 17.377 4.875 -0.342 1.00 0.51 H new ATOM 0 HB3 GLU A 84 18.530 5.743 -1.336 1.00 0.51 H new ATOM 0 HG2 GLU A 84 17.101 7.759 -1.265 1.00 0.64 H new ATOM 0 HG3 GLU A 84 15.910 6.895 -0.313 1.00 0.64 H new ATOM 1322 N GLN A 85 17.929 6.057 -4.304 1.00 0.37 N ATOM 1323 CA GLN A 85 18.181 6.986 -5.408 1.00 0.42 C ATOM 1324 C GLN A 85 16.967 7.071 -6.328 1.00 0.38 C ATOM 1325 O GLN A 85 16.709 8.105 -6.944 1.00 0.46 O ATOM 1326 CB GLN A 85 19.405 6.564 -6.229 1.00 0.50 C ATOM 1327 CG GLN A 85 20.726 6.588 -5.471 1.00 0.61 C ATOM 1328 CD GLN A 85 20.961 7.879 -4.712 1.00 1.44 C ATOM 1329 OE1 GLN A 85 21.497 8.845 -5.254 1.00 1.90 O ATOM 1330 NE2 GLN A 85 20.592 7.897 -3.441 1.00 2.16 N ATOM 0 H GLN A 85 18.594 5.287 -4.235 1.00 0.37 H new ATOM 0 HA GLN A 85 18.375 7.964 -4.967 1.00 0.42 H new ATOM 0 HB2 GLN A 85 19.239 5.556 -6.609 1.00 0.50 H new ATOM 0 HB3 GLN A 85 19.488 7.221 -7.095 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.749 5.754 -4.770 1.00 0.61 H new ATOM 0 HG3 GLN A 85 21.544 6.435 -6.176 1.00 0.61 H new ATOM 0 HE21 GLN A 85 20.150 7.076 -3.027 1.00 2.16 H new ATOM 0 HE22 GLN A 85 20.749 8.732 -2.876 1.00 2.16 H new ATOM 1339 N VAL A 86 16.223 5.979 -6.403 1.00 0.31 N ATOM 1340 CA VAL A 86 15.034 5.915 -7.229 1.00 0.31 C ATOM 1341 C VAL A 86 13.829 6.437 -6.464 1.00 0.29 C ATOM 1342 O VAL A 86 13.175 7.391 -6.880 1.00 0.32 O ATOM 1343 CB VAL A 86 14.747 4.467 -7.660 1.00 0.33 C ATOM 1344 CG1 VAL A 86 13.491 4.397 -8.511 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.937 3.878 -8.399 1.00 0.36 C ATOM 0 H VAL A 86 16.427 5.118 -5.895 1.00 0.31 H new ATOM 0 HA VAL A 86 15.211 6.531 -8.111 1.00 0.31 H new ATOM 0 HB VAL A 86 14.580 3.872 -6.762 1.00 0.33 H new ATOM 0 HG11 VAL A 86 13.307 3.363 -8.804 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.642 4.768 -7.937 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.621 5.010 -9.403 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.711 2.853 -8.694 1.00 0.36 H new ATOM 0 HG22 VAL A 86 16.145 4.474 -9.288 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.810 3.883 -7.746 1.00 0.36 H new ATOM 1355 N VAL A 87 13.551 5.800 -5.337 1.00 0.28 N ATOM 1356 CA VAL A 87 12.340 6.069 -4.579 1.00 0.32 C ATOM 1357 C VAL A 87 12.327 7.472 -3.972 1.00 0.35 C ATOM 1358 O VAL A 87 11.268 7.992 -3.634 1.00 0.37 O ATOM 1359 CB VAL A 87 12.137 5.018 -3.477 1.00 0.38 C ATOM 1360 CG1 VAL A 87 12.198 3.626 -4.076 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.165 5.174 -2.369 1.00 0.41 C ATOM 0 H VAL A 87 14.153 5.088 -4.925 1.00 0.28 H new ATOM 0 HA VAL A 87 11.513 6.011 -5.287 1.00 0.32 H new ATOM 0 HB VAL A 87 11.153 5.170 -3.033 1.00 0.38 H new ATOM 0 HG11 VAL A 87 12.053 2.885 -3.290 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.414 3.518 -4.825 1.00 0.38 H new ATOM 0 HG13 VAL A 87 13.171 3.474 -4.544 1.00 0.38 H new ATOM 0 HG21 VAL A 87 12.994 4.416 -1.605 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.166 5.054 -2.782 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.073 6.165 -1.924 1.00 0.41 H new ATOM 1371 N ASN A 88 13.496 8.094 -3.860 1.00 0.38 N ATOM 1372 CA ASN A 88 13.579 9.461 -3.342 1.00 0.47 C ATOM 1373 C ASN A 88 13.019 10.437 -4.370 1.00 0.44 C ATOM 1374 O ASN A 88 12.619 11.554 -4.039 1.00 0.45 O ATOM 1375 CB ASN A 88 15.026 9.840 -2.991 1.00 0.61 C ATOM 1376 CG ASN A 88 15.120 11.153 -2.226 1.00 0.78 C ATOM 1377 OD1 ASN A 88 14.208 11.526 -1.488 1.00 0.87 O ATOM 1378 ND2 ASN A 88 16.223 11.869 -2.396 1.00 0.97 N ATOM 0 H ASN A 88 14.393 7.681 -4.117 1.00 0.38 H new ATOM 0 HA ASN A 88 12.987 9.514 -2.428 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.471 9.044 -2.394 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.610 9.916 -3.908 1.00 0.61 H new ATOM 0 HD21 ASN A 88 16.334 12.758 -1.908 1.00 0.97 H new ATOM 0 HD22 ASN A 88 16.960 11.531 -3.015 1.00 0.97 H new ATOM 1385 N GLU A 89 12.967 9.999 -5.626 1.00 0.42 N ATOM 1386 CA GLU A 89 12.402 10.815 -6.688 1.00 0.45 C ATOM 1387 C GLU A 89 10.894 10.911 -6.534 1.00 0.38 C ATOM 1388 O GLU A 89 10.267 11.810 -7.079 1.00 0.43 O ATOM 1389 CB GLU A 89 12.761 10.257 -8.064 1.00 0.54 C ATOM 1390 CG GLU A 89 14.210 10.491 -8.442 1.00 0.65 C ATOM 1391 CD GLU A 89 14.560 11.964 -8.453 1.00 1.23 C ATOM 1392 OE1 GLU A 89 14.018 12.701 -9.303 1.00 1.28 O ATOM 1393 OE2 GLU A 89 15.375 12.392 -7.610 1.00 2.04 O ATOM 0 H GLU A 89 13.309 9.087 -5.928 1.00 0.42 H new ATOM 0 HA GLU A 89 12.829 11.815 -6.608 1.00 0.45 H new ATOM 0 HB2 GLU A 89 12.556 9.187 -8.080 1.00 0.54 H new ATOM 0 HB3 GLU A 89 12.117 10.716 -8.815 1.00 0.54 H new ATOM 0 HG2 GLU A 89 14.858 9.969 -7.737 1.00 0.65 H new ATOM 0 HG3 GLU A 89 14.402 10.065 -9.427 1.00 0.65 H new ATOM 1400 N LEU A 90 10.320 9.987 -5.775 1.00 0.31 N ATOM 1401 CA LEU A 90 8.898 10.025 -5.478 1.00 0.27 C ATOM 1402 C LEU A 90 8.607 11.206 -4.567 1.00 0.25 C ATOM 1403 O LEU A 90 7.571 11.857 -4.680 1.00 0.26 O ATOM 1404 CB LEU A 90 8.454 8.729 -4.803 1.00 0.26 C ATOM 1405 CG LEU A 90 8.779 7.450 -5.568 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.427 6.238 -4.729 1.00 0.31 C ATOM 1407 CD2 LEU A 90 8.038 7.411 -6.893 1.00 0.37 C ATOM 0 H LEU A 90 10.819 9.203 -5.355 1.00 0.31 H new ATOM 0 HA LEU A 90 8.345 10.134 -6.411 1.00 0.27 H new ATOM 0 HB2 LEU A 90 8.921 8.673 -3.820 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.377 8.773 -4.643 1.00 0.26 H new ATOM 0 HG LEU A 90 9.849 7.435 -5.777 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.663 5.330 -5.284 1.00 0.31 H new ATOM 0 HD12 LEU A 90 9.002 6.257 -3.803 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.362 6.254 -4.495 1.00 0.31 H new ATOM 0 HD21 LEU A 90 8.285 6.490 -7.421 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.964 7.448 -6.710 1.00 0.37 H new ATOM 0 HD23 LEU A 90 8.332 8.267 -7.500 1.00 0.37 H new ATOM 1419 N PHE A 91 9.547 11.480 -3.672 1.00 0.27 N ATOM 1420 CA PHE A 91 9.432 12.608 -2.761 1.00 0.29 C ATOM 1421 C PHE A 91 9.736 13.903 -3.510 1.00 0.33 C ATOM 1422 O PHE A 91 9.034 14.902 -3.360 1.00 0.33 O ATOM 1423 CB PHE A 91 10.396 12.439 -1.578 1.00 0.35 C ATOM 1424 CG PHE A 91 9.974 13.172 -0.335 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.242 14.524 -0.196 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.313 12.517 0.692 1.00 0.37 C ATOM 1427 CE1 PHE A 91 9.861 15.208 0.942 1.00 0.53 C ATOM 1428 CE2 PHE A 91 8.929 13.197 1.832 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.186 14.511 1.971 1.00 0.50 C ATOM 0 H PHE A 91 10.400 10.933 -3.558 1.00 0.27 H new ATOM 0 HA PHE A 91 8.415 12.650 -2.372 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.489 11.378 -1.347 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.385 12.789 -1.876 1.00 0.35 H new ATOM 0 HD1 PHE A 91 10.755 15.050 -0.987 1.00 0.46 H new ATOM 0 HD2 PHE A 91 9.096 11.463 0.600 1.00 0.37 H new ATOM 0 HE1 PHE A 91 10.076 16.261 1.045 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.416 12.668 2.621 1.00 0.43 H new ATOM 0 HZ PHE A 91 8.878 15.031 2.866 1.00 0.50 H new ATOM 1439 N ARG A 92 10.771 13.858 -4.348 1.00 0.39 N ATOM 1440 CA ARG A 92 11.203 15.021 -5.119 1.00 0.49 C ATOM 1441 C ARG A 92 10.182 15.376 -6.202 1.00 0.51 C ATOM 1442 O ARG A 92 10.194 16.479 -6.750 1.00 0.62 O ATOM 1443 CB ARG A 92 12.574 14.745 -5.749 1.00 0.56 C ATOM 1444 CG ARG A 92 13.152 15.904 -6.558 1.00 1.24 C ATOM 1445 CD ARG A 92 13.537 17.092 -5.682 1.00 1.54 C ATOM 1446 NE ARG A 92 12.375 17.747 -5.076 1.00 2.30 N ATOM 1447 CZ ARG A 92 12.451 18.637 -4.088 1.00 2.99 C ATOM 1448 NH1 ARG A 92 13.631 19.016 -3.615 1.00 3.13 N ATOM 1449 NH2 ARG A 92 11.347 19.157 -3.577 1.00 3.95 N ATOM 0 H ARG A 92 11.330 13.020 -4.510 1.00 0.39 H new ATOM 0 HA ARG A 92 11.282 15.872 -4.443 1.00 0.49 H new ATOM 0 HB2 ARG A 92 13.277 14.487 -4.957 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.491 13.873 -6.398 1.00 0.56 H new ATOM 0 HG2 ARG A 92 14.030 15.560 -7.104 1.00 1.24 H new ATOM 0 HG3 ARG A 92 12.421 16.225 -7.300 1.00 1.24 H new ATOM 0 HD2 ARG A 92 14.211 16.754 -4.894 1.00 1.54 H new ATOM 0 HD3 ARG A 92 14.086 17.818 -6.282 1.00 1.54 H new ATOM 0 HE ARG A 92 11.450 17.506 -5.433 1.00 2.30 H new ATOM 0 HH11 ARG A 92 14.487 18.625 -4.008 1.00 3.13 H new ATOM 0 HH12 ARG A 92 13.682 19.698 -2.858 1.00 3.13 H new ATOM 0 HH21 ARG A 92 10.436 18.876 -3.940 1.00 3.95 H new ATOM 0 HH22 ARG A 92 11.407 19.838 -2.820 1.00 3.95 H new ATOM 1463 N ASP A 93 9.288 14.441 -6.487 1.00 0.46 N ATOM 1464 CA ASP A 93 8.266 14.625 -7.515 1.00 0.53 C ATOM 1465 C ASP A 93 7.060 15.375 -6.945 1.00 0.50 C ATOM 1466 O ASP A 93 5.985 15.395 -7.541 1.00 0.60 O ATOM 1467 CB ASP A 93 7.832 13.251 -8.062 1.00 0.62 C ATOM 1468 CG ASP A 93 6.950 13.342 -9.290 1.00 0.90 C ATOM 1469 OD1 ASP A 93 7.464 13.697 -10.372 1.00 1.14 O ATOM 1470 OD2 ASP A 93 5.734 13.083 -9.176 1.00 1.11 O ATOM 0 H ASP A 93 9.247 13.537 -6.017 1.00 0.46 H new ATOM 0 HA ASP A 93 8.683 15.219 -8.328 1.00 0.53 H new ATOM 0 HB2 ASP A 93 8.720 12.668 -8.305 1.00 0.62 H new ATOM 0 HB3 ASP A 93 7.299 12.709 -7.281 1.00 0.62 H new ATOM 1475 N GLY A 94 7.242 16.014 -5.794 1.00 0.45 N ATOM 1476 CA GLY A 94 6.125 16.683 -5.156 1.00 0.47 C ATOM 1477 C GLY A 94 5.289 15.713 -4.356 1.00 0.39 C ATOM 1478 O GLY A 94 4.066 15.853 -4.309 1.00 0.42 O ATOM 0 H GLY A 94 8.131 16.080 -5.298 1.00 0.45 H new ATOM 0 HA2 GLY A 94 6.496 17.472 -4.502 1.00 0.47 H new ATOM 0 HA3 GLY A 94 5.505 17.162 -5.913 1.00 0.47 H new ATOM 1482 N VAL A 95 5.979 14.725 -3.760 1.00 0.32 N ATOM 1483 CA VAL A 95 5.372 13.563 -3.089 1.00 0.26 C ATOM 1484 C VAL A 95 3.914 13.770 -2.692 1.00 0.25 C ATOM 1485 O VAL A 95 3.583 14.554 -1.804 1.00 0.29 O ATOM 1486 CB VAL A 95 6.188 13.143 -1.842 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.426 14.324 -0.915 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.492 12.005 -1.103 1.00 0.33 C ATOM 0 H VAL A 95 6.999 14.712 -3.731 1.00 0.32 H new ATOM 0 HA VAL A 95 5.392 12.766 -3.833 1.00 0.26 H new ATOM 0 HB VAL A 95 7.161 12.788 -2.182 1.00 0.31 H new ATOM 0 HG11 VAL A 95 7.001 13.997 -0.049 1.00 0.40 H new ATOM 0 HG12 VAL A 95 6.979 15.098 -1.447 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.468 14.725 -0.584 1.00 0.40 H new ATOM 0 HG21 VAL A 95 6.081 11.724 -0.230 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.502 12.330 -0.784 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.395 11.146 -1.767 1.00 0.33 H new ATOM 1498 N ASN A 96 3.049 13.083 -3.405 1.00 0.24 N ATOM 1499 CA ASN A 96 1.635 13.060 -3.095 1.00 0.29 C ATOM 1500 C ASN A 96 1.250 11.676 -2.589 1.00 0.23 C ATOM 1501 O ASN A 96 2.102 10.786 -2.507 1.00 0.21 O ATOM 1502 CB ASN A 96 0.804 13.458 -4.323 1.00 0.41 C ATOM 1503 CG ASN A 96 1.081 12.610 -5.557 1.00 1.33 C ATOM 1504 OD1 ASN A 96 1.473 11.448 -5.460 1.00 2.13 O ATOM 1505 ND2 ASN A 96 0.868 13.186 -6.733 1.00 2.00 N ATOM 0 H ASN A 96 3.306 12.523 -4.218 1.00 0.24 H new ATOM 0 HA ASN A 96 1.425 13.788 -2.311 1.00 0.29 H new ATOM 0 HB2 ASN A 96 -0.254 13.383 -4.073 1.00 0.41 H new ATOM 0 HB3 ASN A 96 1.002 14.503 -4.560 1.00 0.41 H new ATOM 0 HD21 ASN A 96 1.029 12.663 -7.594 1.00 2.00 H new ATOM 0 HD22 ASN A 96 0.543 14.152 -6.776 1.00 2.00 H new ATOM 1512 N TRP A 97 -0.021 11.483 -2.260 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.483 10.196 -1.753 1.00 0.24 C ATOM 1514 C TRP A 97 -0.295 9.091 -2.797 1.00 0.25 C ATOM 1515 O TRP A 97 -0.100 7.928 -2.447 1.00 0.25 O ATOM 1516 CB TRP A 97 -1.950 10.277 -1.308 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.170 11.222 -0.156 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -2.827 12.422 -0.186 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.721 11.049 1.198 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.815 12.998 1.064 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -2.142 12.177 1.926 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -1.003 10.051 1.867 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -1.873 12.333 3.282 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.737 10.209 3.215 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -1.170 11.343 3.909 1.00 0.30 C ATOM 0 H TRP A 97 -0.747 12.196 -2.334 1.00 0.25 H new ATOM 0 HA TRP A 97 0.124 9.944 -0.883 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.562 10.595 -2.152 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.292 9.282 -1.023 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.288 12.854 -1.062 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -3.240 13.893 1.308 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.662 9.172 1.339 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -2.208 13.207 3.821 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 -0.185 9.443 3.741 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.945 11.438 4.961 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.315 9.467 -4.076 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.149 8.496 -5.145 1.00 0.29 C ATOM 1538 C GLY A 98 1.273 7.969 -5.239 1.00 0.26 C ATOM 1539 O GLY A 98 1.496 6.839 -5.673 1.00 0.27 O ATOM 0 H GLY A 98 -0.444 10.429 -4.390 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -0.832 7.662 -4.983 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.426 8.955 -6.094 1.00 0.29 H new ATOM 1543 N ARG A 99 2.236 8.784 -4.824 1.00 0.26 N ATOM 1544 CA ARG A 99 3.639 8.373 -4.832 1.00 0.25 C ATOM 1545 C ARG A 99 3.877 7.338 -3.747 1.00 0.21 C ATOM 1546 O ARG A 99 4.672 6.416 -3.920 1.00 0.20 O ATOM 1547 CB ARG A 99 4.578 9.566 -4.622 1.00 0.30 C ATOM 1548 CG ARG A 99 4.626 10.562 -5.780 1.00 0.70 C ATOM 1549 CD ARG A 99 5.143 9.934 -7.069 1.00 1.40 C ATOM 1550 NE ARG A 99 4.085 9.255 -7.817 1.00 1.74 N ATOM 1551 CZ ARG A 99 4.212 8.832 -9.076 1.00 2.46 C ATOM 1552 NH1 ARG A 99 5.367 8.971 -9.719 1.00 3.06 N ATOM 1553 NH2 ARG A 99 3.176 8.275 -9.688 1.00 2.98 N ATOM 0 H ARG A 99 2.074 9.730 -4.479 1.00 0.26 H new ATOM 0 HA ARG A 99 3.856 7.942 -5.809 1.00 0.25 H new ATOM 0 HB2 ARG A 99 4.272 10.095 -3.720 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.585 9.189 -4.445 1.00 0.30 H new ATOM 0 HG2 ARG A 99 3.627 10.964 -5.951 1.00 0.70 H new ATOM 0 HG3 ARG A 99 5.265 11.401 -5.507 1.00 0.70 H new ATOM 0 HD2 ARG A 99 5.589 10.707 -7.695 1.00 1.40 H new ATOM 0 HD3 ARG A 99 5.933 9.221 -6.832 1.00 1.40 H new ATOM 0 HE ARG A 99 3.194 9.095 -7.347 1.00 1.74 H new ATOM 0 HH11 ARG A 99 6.163 9.403 -9.250 1.00 3.06 H new ATOM 0 HH12 ARG A 99 5.457 8.645 -10.681 1.00 3.06 H new ATOM 0 HH21 ARG A 99 2.288 8.172 -9.196 1.00 2.98 H new ATOM 0 HH22 ARG A 99 3.267 7.950 -10.650 1.00 2.98 H new ATOM 1567 N ILE A 100 3.171 7.494 -2.632 1.00 0.22 N ATOM 1568 CA ILE A 100 3.226 6.526 -1.550 1.00 0.21 C ATOM 1569 C ILE A 100 2.625 5.208 -2.016 1.00 0.20 C ATOM 1570 O ILE A 100 3.162 4.133 -1.745 1.00 0.19 O ATOM 1571 CB ILE A 100 2.478 7.037 -0.302 1.00 0.24 C ATOM 1572 CG1 ILE A 100 3.169 8.286 0.250 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.395 5.953 0.761 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.574 8.789 1.543 1.00 0.30 C ATOM 0 H ILE A 100 2.553 8.286 -2.457 1.00 0.22 H new ATOM 0 HA ILE A 100 4.270 6.376 -1.275 1.00 0.21 H new ATOM 0 HB ILE A 100 1.461 7.300 -0.591 1.00 0.24 H new ATOM 0 HG12 ILE A 100 4.225 8.066 0.408 1.00 0.26 H new ATOM 0 HG13 ILE A 100 3.117 9.079 -0.496 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.863 6.337 1.632 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.861 5.091 0.361 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.401 5.653 1.054 1.00 0.24 H new ATOM 0 HD11 ILE A 100 3.116 9.676 1.872 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.525 9.042 1.387 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.651 8.013 2.305 1.00 0.30 H new ATOM 1586 N VAL A 101 1.512 5.309 -2.733 1.00 0.21 N ATOM 1587 CA VAL A 101 0.888 4.152 -3.349 1.00 0.21 C ATOM 1588 C VAL A 101 1.895 3.423 -4.217 1.00 0.20 C ATOM 1589 O VAL A 101 2.154 2.236 -4.025 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.303 4.560 -4.231 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -0.910 3.342 -4.895 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.342 5.301 -3.421 1.00 0.26 C ATOM 0 H VAL A 101 1.023 6.188 -2.901 1.00 0.21 H new ATOM 0 HA VAL A 101 0.533 3.505 -2.546 1.00 0.21 H new ATOM 0 HB VAL A 101 0.060 5.232 -5.009 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -1.752 3.648 -5.516 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.159 2.854 -5.517 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.256 2.646 -4.131 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.175 5.580 -4.066 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.704 4.659 -2.618 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.897 6.200 -2.994 1.00 0.26 H new ATOM 1602 N ALA A 102 2.454 4.155 -5.170 1.00 0.19 N ATOM 1603 CA ALA A 102 3.423 3.608 -6.099 1.00 0.19 C ATOM 1604 C ALA A 102 4.587 2.965 -5.355 1.00 0.17 C ATOM 1605 O ALA A 102 5.010 1.865 -5.696 1.00 0.19 O ATOM 1606 CB ALA A 102 3.919 4.700 -7.030 1.00 0.21 C ATOM 0 H ALA A 102 2.247 5.143 -5.318 1.00 0.19 H new ATOM 0 HA ALA A 102 2.938 2.833 -6.692 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.647 4.282 -7.726 1.00 0.21 H new ATOM 0 HB2 ALA A 102 3.078 5.112 -7.588 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.388 5.491 -6.445 1.00 0.21 H new ATOM 1612 N PHE A 103 5.068 3.643 -4.317 1.00 0.16 N ATOM 1613 CA PHE A 103 6.194 3.157 -3.519 1.00 0.17 C ATOM 1614 C PHE A 103 5.928 1.749 -2.991 1.00 0.17 C ATOM 1615 O PHE A 103 6.780 0.865 -3.093 1.00 0.21 O ATOM 1616 CB PHE A 103 6.471 4.115 -2.351 1.00 0.17 C ATOM 1617 CG PHE A 103 7.623 3.695 -1.475 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.923 3.770 -1.942 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.405 3.222 -0.188 1.00 0.17 C ATOM 1620 CE1 PHE A 103 9.985 3.383 -1.146 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.463 2.834 0.610 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.754 2.913 0.130 1.00 0.26 C ATOM 0 H PHE A 103 4.693 4.539 -4.005 1.00 0.16 H new ATOM 0 HA PHE A 103 7.072 3.118 -4.164 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.674 5.109 -2.750 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.573 4.195 -1.739 1.00 0.17 H new ATOM 0 HD1 PHE A 103 9.111 4.135 -2.941 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.397 3.157 0.193 1.00 0.17 H new ATOM 0 HE1 PHE A 103 10.995 3.449 -1.523 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.280 2.469 1.610 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.582 2.607 0.752 1.00 0.26 H new ATOM 1632 N PHE A 104 4.738 1.539 -2.447 1.00 0.16 N ATOM 1633 CA PHE A 104 4.381 0.240 -1.889 1.00 0.18 C ATOM 1634 C PHE A 104 3.999 -0.737 -2.996 1.00 0.19 C ATOM 1635 O PHE A 104 4.242 -1.941 -2.888 1.00 0.23 O ATOM 1636 CB PHE A 104 3.235 0.378 -0.882 1.00 0.19 C ATOM 1637 CG PHE A 104 3.655 0.946 0.449 1.00 0.21 C ATOM 1638 CD1 PHE A 104 3.974 2.290 0.586 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.727 0.131 1.567 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.356 2.804 1.809 1.00 0.27 C ATOM 1641 CE2 PHE A 104 4.108 0.641 2.792 1.00 0.33 C ATOM 1642 CZ PHE A 104 4.423 1.979 2.913 1.00 0.30 C ATOM 0 H PHE A 104 4.006 2.246 -2.380 1.00 0.16 H new ATOM 0 HA PHE A 104 5.253 -0.154 -1.367 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.463 1.017 -1.311 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.785 -0.602 -0.722 1.00 0.19 H new ATOM 0 HD1 PHE A 104 3.923 2.941 -0.274 1.00 0.24 H new ATOM 0 HD2 PHE A 104 3.482 -0.917 1.479 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.602 3.851 1.902 1.00 0.27 H new ATOM 0 HE2 PHE A 104 4.159 -0.007 3.655 1.00 0.33 H new ATOM 0 HZ PHE A 104 4.722 2.380 3.870 1.00 0.30 H new ATOM 1652 N SER A 105 3.419 -0.212 -4.066 1.00 0.18 N ATOM 1653 CA SER A 105 3.022 -1.033 -5.201 1.00 0.21 C ATOM 1654 C SER A 105 4.247 -1.617 -5.906 1.00 0.21 C ATOM 1655 O SER A 105 4.194 -2.730 -6.435 1.00 0.23 O ATOM 1656 CB SER A 105 2.182 -0.211 -6.182 1.00 0.25 C ATOM 1657 OG SER A 105 1.026 0.310 -5.545 1.00 1.04 O ATOM 0 H SER A 105 3.212 0.781 -4.172 1.00 0.18 H new ATOM 0 HA SER A 105 2.418 -1.861 -4.830 1.00 0.21 H new ATOM 0 HB2 SER A 105 2.781 0.607 -6.583 1.00 0.25 H new ATOM 0 HB3 SER A 105 1.887 -0.835 -7.026 1.00 0.25 H new ATOM 0 HG SER A 105 1.279 1.069 -4.979 1.00 1.04 H new ATOM 1663 N PHE A 106 5.355 -0.868 -5.901 1.00 0.20 N ATOM 1664 CA PHE A 106 6.598 -1.341 -6.499 1.00 0.21 C ATOM 1665 C PHE A 106 7.103 -2.561 -5.750 1.00 0.22 C ATOM 1666 O PHE A 106 7.478 -3.559 -6.362 1.00 0.24 O ATOM 1667 CB PHE A 106 7.687 -0.257 -6.487 1.00 0.23 C ATOM 1668 CG PHE A 106 7.369 0.974 -7.291 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.562 0.883 -8.415 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.873 2.216 -6.934 1.00 0.27 C ATOM 1671 CE1 PHE A 106 6.264 2.001 -9.166 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.579 3.339 -7.683 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.789 3.266 -8.752 1.00 0.33 C ATOM 0 H PHE A 106 5.412 0.064 -5.490 1.00 0.20 H new ATOM 0 HA PHE A 106 6.383 -1.598 -7.536 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.872 0.040 -5.455 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.613 -0.690 -6.865 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.161 -0.077 -8.706 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.502 2.306 -6.061 1.00 0.27 H new ATOM 0 HE1 PHE A 106 5.647 1.923 -10.049 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.997 4.293 -7.396 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.545 4.160 -9.306 1.00 0.33 H new ATOM 1683 N GLY A 107 7.092 -2.479 -4.420 1.00 0.23 N ATOM 1684 CA GLY A 107 7.549 -3.585 -3.599 1.00 0.27 C ATOM 1685 C GLY A 107 6.789 -4.861 -3.887 1.00 0.32 C ATOM 1686 O GLY A 107 7.364 -5.946 -3.874 1.00 0.37 O ATOM 0 H GLY A 107 6.773 -1.663 -3.897 1.00 0.23 H new ATOM 0 HA2 GLY A 107 8.612 -3.750 -3.773 1.00 0.27 H new ATOM 0 HA3 GLY A 107 7.435 -3.326 -2.546 1.00 0.27 H new ATOM 1690 N GLY A 108 5.495 -4.723 -4.164 1.00 0.33 N ATOM 1691 CA GLY A 108 4.666 -5.869 -4.505 1.00 0.41 C ATOM 1692 C GLY A 108 5.161 -6.602 -5.740 1.00 0.42 C ATOM 1693 O GLY A 108 4.928 -7.798 -5.900 1.00 0.63 O ATOM 0 H GLY A 108 5.002 -3.830 -4.158 1.00 0.33 H new ATOM 0 HA2 GLY A 108 4.643 -6.560 -3.662 1.00 0.41 H new ATOM 0 HA3 GLY A 108 3.642 -5.535 -4.671 1.00 0.41 H new ATOM 1697 N ALA A 109 5.834 -5.880 -6.620 1.00 0.27 N ATOM 1698 CA ALA A 109 6.441 -6.479 -7.799 1.00 0.26 C ATOM 1699 C ALA A 109 7.874 -6.908 -7.505 1.00 0.23 C ATOM 1700 O ALA A 109 8.306 -7.991 -7.901 1.00 0.24 O ATOM 1701 CB ALA A 109 6.409 -5.496 -8.953 1.00 0.29 C ATOM 0 H ALA A 109 5.975 -4.873 -6.540 1.00 0.27 H new ATOM 0 HA ALA A 109 5.870 -7.365 -8.075 1.00 0.26 H new ATOM 0 HB1 ALA A 109 6.865 -5.952 -9.832 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.376 -5.231 -9.177 1.00 0.29 H new ATOM 0 HB3 ALA A 109 6.963 -4.598 -8.681 1.00 0.29 H new ATOM 1707 N LEU A 110 8.593 -6.048 -6.793 1.00 0.22 N ATOM 1708 CA LEU A 110 9.994 -6.275 -6.464 1.00 0.23 C ATOM 1709 C LEU A 110 10.177 -7.563 -5.685 1.00 0.21 C ATOM 1710 O LEU A 110 11.064 -8.365 -5.986 1.00 0.21 O ATOM 1711 CB LEU A 110 10.529 -5.108 -5.643 1.00 0.25 C ATOM 1712 CG LEU A 110 10.506 -3.761 -6.350 1.00 0.28 C ATOM 1713 CD1 LEU A 110 10.999 -2.675 -5.416 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.349 -3.816 -7.610 1.00 0.36 C ATOM 0 H LEU A 110 8.220 -5.172 -6.427 1.00 0.22 H new ATOM 0 HA LEU A 110 10.548 -6.357 -7.399 1.00 0.23 H new ATOM 0 HB2 LEU A 110 9.945 -5.030 -4.726 1.00 0.25 H new ATOM 0 HB3 LEU A 110 11.555 -5.330 -5.349 1.00 0.25 H new ATOM 0 HG LEU A 110 9.481 -3.527 -6.637 1.00 0.28 H new ATOM 0 HD11 LEU A 110 10.979 -1.715 -5.932 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.354 -2.629 -4.538 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.020 -2.898 -5.105 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.324 -2.846 -8.107 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.378 -4.064 -7.349 1.00 0.36 H new ATOM 0 HD23 LEU A 110 10.951 -4.577 -8.281 1.00 0.36 H new ATOM 1726 N CYS A 111 9.337 -7.755 -4.679 1.00 0.21 N ATOM 1727 CA CYS A 111 9.421 -8.930 -3.830 1.00 0.21 C ATOM 1728 C CYS A 111 9.266 -10.205 -4.649 1.00 0.21 C ATOM 1729 O CYS A 111 9.850 -11.232 -4.330 1.00 0.25 O ATOM 1730 CB CYS A 111 8.359 -8.872 -2.731 1.00 0.22 C ATOM 1731 SG CYS A 111 6.662 -8.736 -3.334 1.00 1.34 S ATOM 0 H CYS A 111 8.588 -7.109 -4.431 1.00 0.21 H new ATOM 0 HA CYS A 111 10.406 -8.942 -3.364 1.00 0.21 H new ATOM 0 HB2 CYS A 111 8.442 -9.768 -2.116 1.00 0.22 H new ATOM 0 HB3 CYS A 111 8.570 -8.021 -2.084 1.00 0.22 H new ATOM 0 HG CYS A 111 6.436 -7.516 -3.723 1.00 1.34 H new ATOM 1737 N VAL A 112 8.494 -10.119 -5.718 1.00 0.19 N ATOM 1738 CA VAL A 112 8.240 -11.263 -6.570 1.00 0.20 C ATOM 1739 C VAL A 112 9.391 -11.499 -7.541 1.00 0.22 C ATOM 1740 O VAL A 112 9.922 -12.610 -7.630 1.00 0.25 O ATOM 1741 CB VAL A 112 6.936 -11.069 -7.357 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.696 -12.234 -8.297 1.00 0.27 C ATOM 1743 CG2 VAL A 112 5.771 -10.903 -6.400 1.00 0.25 C ATOM 0 H VAL A 112 8.030 -9.261 -6.017 1.00 0.19 H new ATOM 0 HA VAL A 112 8.147 -12.137 -5.925 1.00 0.20 H new ATOM 0 HB VAL A 112 7.025 -10.165 -7.960 1.00 0.23 H new ATOM 0 HG11 VAL A 112 5.767 -12.075 -8.844 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.524 -12.309 -9.002 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.625 -13.157 -7.722 1.00 0.27 H new ATOM 0 HG21 VAL A 112 4.851 -10.766 -6.968 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.683 -11.792 -5.776 1.00 0.25 H new ATOM 0 HG23 VAL A 112 5.941 -10.031 -5.768 1.00 0.25 H new ATOM 1753 N GLU A 113 9.771 -10.456 -8.272 1.00 0.22 N ATOM 1754 CA GLU A 113 10.818 -10.576 -9.286 1.00 0.25 C ATOM 1755 C GLU A 113 12.151 -11.007 -8.672 1.00 0.25 C ATOM 1756 O GLU A 113 12.975 -11.631 -9.340 1.00 0.30 O ATOM 1757 CB GLU A 113 10.988 -9.269 -10.068 1.00 0.29 C ATOM 1758 CG GLU A 113 11.405 -8.075 -9.225 1.00 0.30 C ATOM 1759 CD GLU A 113 11.633 -6.835 -10.067 1.00 0.39 C ATOM 1760 OE1 GLU A 113 10.731 -6.458 -10.842 1.00 0.51 O ATOM 1761 OE2 GLU A 113 12.718 -6.226 -9.949 1.00 0.50 O ATOM 0 H GLU A 113 9.373 -9.521 -8.184 1.00 0.22 H new ATOM 0 HA GLU A 113 10.501 -11.353 -9.981 1.00 0.25 H new ATOM 0 HB2 GLU A 113 11.732 -9.423 -10.849 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.047 -9.034 -10.566 1.00 0.29 H new ATOM 0 HG2 GLU A 113 10.635 -7.871 -8.481 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.318 -8.317 -8.681 1.00 0.30 H new ATOM 1768 N SER A 114 12.352 -10.691 -7.400 1.00 0.23 N ATOM 1769 CA SER A 114 13.557 -11.103 -6.705 1.00 0.28 C ATOM 1770 C SER A 114 13.525 -12.606 -6.438 1.00 0.27 C ATOM 1771 O SER A 114 14.541 -13.291 -6.573 1.00 0.31 O ATOM 1772 CB SER A 114 13.726 -10.319 -5.401 1.00 0.33 C ATOM 1773 OG SER A 114 12.527 -10.302 -4.652 1.00 0.99 O ATOM 0 H SER A 114 11.697 -10.153 -6.833 1.00 0.23 H new ATOM 0 HA SER A 114 14.416 -10.885 -7.340 1.00 0.28 H new ATOM 0 HB2 SER A 114 14.522 -10.766 -4.806 1.00 0.33 H new ATOM 0 HB3 SER A 114 14.031 -9.297 -5.626 1.00 0.33 H new ATOM 0 HG SER A 114 11.952 -9.576 -4.972 1.00 0.99 H new ATOM 1779 N VAL A 115 12.348 -13.120 -6.094 1.00 0.28 N ATOM 1780 CA VAL A 115 12.173 -14.547 -5.863 1.00 0.33 C ATOM 1781 C VAL A 115 12.403 -15.326 -7.151 1.00 0.37 C ATOM 1782 O VAL A 115 13.032 -16.385 -7.145 1.00 0.42 O ATOM 1783 CB VAL A 115 10.766 -14.864 -5.323 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.590 -16.362 -5.128 1.00 0.45 C ATOM 1785 CG2 VAL A 115 10.518 -14.125 -4.022 1.00 0.41 C ATOM 0 H VAL A 115 11.500 -12.567 -5.969 1.00 0.28 H new ATOM 0 HA VAL A 115 12.907 -14.847 -5.116 1.00 0.33 H new ATOM 0 HB VAL A 115 10.034 -14.527 -6.057 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.589 -16.564 -4.746 1.00 0.45 H new ATOM 0 HG12 VAL A 115 10.724 -16.871 -6.082 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.331 -16.726 -4.416 1.00 0.45 H new ATOM 0 HG21 VAL A 115 9.519 -14.360 -3.655 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.258 -14.431 -3.283 1.00 0.41 H new ATOM 0 HG23 VAL A 115 10.598 -13.051 -4.192 1.00 0.41 H new ATOM 1795 N ASP A 116 11.898 -14.790 -8.256 1.00 0.38 N ATOM 1796 CA ASP A 116 12.086 -15.407 -9.569 1.00 0.46 C ATOM 1797 C ASP A 116 13.571 -15.570 -9.889 1.00 0.47 C ATOM 1798 O ASP A 116 13.974 -16.526 -10.551 1.00 0.56 O ATOM 1799 CB ASP A 116 11.408 -14.572 -10.662 1.00 0.49 C ATOM 1800 CG ASP A 116 11.637 -15.142 -12.050 1.00 1.08 C ATOM 1801 OD1 ASP A 116 10.928 -16.098 -12.435 1.00 1.23 O ATOM 1802 OD2 ASP A 116 12.531 -14.640 -12.765 1.00 1.89 O ATOM 0 H ASP A 116 11.354 -13.928 -8.271 1.00 0.38 H new ATOM 0 HA ASP A 116 11.625 -16.394 -9.541 1.00 0.46 H new ATOM 0 HB2 ASP A 116 10.337 -14.521 -10.465 1.00 0.49 H new ATOM 0 HB3 ASP A 116 11.788 -13.551 -10.624 1.00 0.49 H new ATOM 1807 N LYS A 117 14.383 -14.645 -9.395 1.00 0.43 N ATOM 1808 CA LYS A 117 15.825 -14.692 -9.621 1.00 0.49 C ATOM 1809 C LYS A 117 16.532 -15.484 -8.524 1.00 0.47 C ATOM 1810 O LYS A 117 17.759 -15.428 -8.407 1.00 0.52 O ATOM 1811 CB LYS A 117 16.403 -13.277 -9.690 1.00 0.53 C ATOM 1812 CG LYS A 117 15.895 -12.468 -10.870 1.00 0.61 C ATOM 1813 CD LYS A 117 16.559 -11.105 -10.934 1.00 1.20 C ATOM 1814 CE LYS A 117 16.161 -10.360 -12.197 1.00 1.32 C ATOM 1815 NZ LYS A 117 16.530 -11.115 -13.424 1.00 1.90 N ATOM 0 H LYS A 117 14.070 -13.852 -8.835 1.00 0.43 H new ATOM 0 HA LYS A 117 15.993 -15.196 -10.573 1.00 0.49 H new ATOM 0 HB2 LYS A 117 16.160 -12.749 -8.768 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.490 -13.340 -9.745 1.00 0.53 H new ATOM 0 HG2 LYS A 117 16.087 -13.012 -11.795 1.00 0.61 H new ATOM 0 HG3 LYS A 117 14.815 -12.345 -10.791 1.00 0.61 H new ATOM 0 HD2 LYS A 117 16.278 -10.519 -10.059 1.00 1.20 H new ATOM 0 HD3 LYS A 117 17.642 -11.223 -10.904 1.00 1.20 H new ATOM 0 HE2 LYS A 117 15.086 -10.181 -12.190 1.00 1.32 H new ATOM 0 HE3 LYS A 117 16.646 -9.384 -12.211 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 16.563 -10.465 -14.235 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 17.464 -11.554 -13.294 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 15.821 -11.855 -13.603 1.00 1.90 H new ATOM 1829 N GLU A 118 15.746 -16.206 -7.723 1.00 0.45 N ATOM 1830 CA GLU A 118 16.268 -17.044 -6.643 1.00 0.49 C ATOM 1831 C GLU A 118 16.925 -16.180 -5.564 1.00 0.45 C ATOM 1832 O GLU A 118 17.712 -16.656 -4.747 1.00 0.55 O ATOM 1833 CB GLU A 118 17.250 -18.088 -7.199 1.00 0.59 C ATOM 1834 CG GLU A 118 17.680 -19.140 -6.187 1.00 1.07 C ATOM 1835 CD GLU A 118 18.682 -20.120 -6.753 1.00 1.72 C ATOM 1836 OE1 GLU A 118 19.754 -19.677 -7.221 1.00 2.54 O ATOM 1837 OE2 GLU A 118 18.405 -21.337 -6.735 1.00 1.89 O ATOM 0 H GLU A 118 14.730 -16.226 -7.805 1.00 0.45 H new ATOM 0 HA GLU A 118 15.438 -17.579 -6.182 1.00 0.49 H new ATOM 0 HB2 GLU A 118 16.789 -18.587 -8.051 1.00 0.59 H new ATOM 0 HB3 GLU A 118 18.136 -17.575 -7.572 1.00 0.59 H new ATOM 0 HG2 GLU A 118 18.113 -18.646 -5.317 1.00 1.07 H new ATOM 0 HG3 GLU A 118 16.802 -19.684 -5.840 1.00 1.07 H new ATOM 1844 N MET A 119 16.557 -14.912 -5.534 1.00 0.35 N ATOM 1845 CA MET A 119 17.110 -13.982 -4.567 1.00 0.33 C ATOM 1846 C MET A 119 16.152 -13.846 -3.395 1.00 0.31 C ATOM 1847 O MET A 119 15.683 -12.754 -3.072 1.00 0.27 O ATOM 1848 CB MET A 119 17.373 -12.618 -5.213 1.00 0.34 C ATOM 1849 CG MET A 119 18.258 -12.692 -6.448 1.00 0.41 C ATOM 1850 SD MET A 119 18.657 -11.070 -7.130 1.00 0.47 S ATOM 1851 CE MET A 119 17.028 -10.340 -7.265 1.00 0.44 C ATOM 0 H MET A 119 15.874 -14.502 -6.171 1.00 0.35 H new ATOM 0 HA MET A 119 18.064 -14.367 -4.207 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.420 -12.164 -5.485 1.00 0.34 H new ATOM 0 HB3 MET A 119 17.841 -11.962 -4.479 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.183 -13.211 -6.195 1.00 0.41 H new ATOM 0 HG3 MET A 119 17.757 -13.288 -7.211 1.00 0.41 H new ATOM 0 HE1 MET A 119 17.102 -9.377 -7.770 1.00 0.44 H new ATOM 0 HE2 MET A 119 16.379 -11.002 -7.838 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.610 -10.196 -6.269 1.00 0.44 H new ATOM 1861 N GLN A 120 15.873 -14.975 -2.758 1.00 0.36 N ATOM 1862 CA GLN A 120 14.908 -15.035 -1.665 1.00 0.39 C ATOM 1863 C GLN A 120 15.452 -14.357 -0.414 1.00 0.41 C ATOM 1864 O GLN A 120 14.722 -14.134 0.546 1.00 0.47 O ATOM 1865 CB GLN A 120 14.540 -16.490 -1.359 1.00 0.49 C ATOM 1866 CG GLN A 120 13.833 -17.196 -2.509 1.00 0.53 C ATOM 1867 CD GLN A 120 13.498 -18.646 -2.202 1.00 0.65 C ATOM 1868 OE1 GLN A 120 13.291 -19.024 -1.047 1.00 0.71 O ATOM 1869 NE2 GLN A 120 13.427 -19.469 -3.237 1.00 0.70 N ATOM 0 H GLN A 120 16.306 -15.871 -2.981 1.00 0.36 H new ATOM 0 HA GLN A 120 14.011 -14.501 -1.978 1.00 0.39 H new ATOM 0 HB2 GLN A 120 15.447 -17.040 -1.109 1.00 0.49 H new ATOM 0 HB3 GLN A 120 13.898 -16.516 -0.478 1.00 0.49 H new ATOM 0 HG2 GLN A 120 12.914 -16.660 -2.747 1.00 0.53 H new ATOM 0 HG3 GLN A 120 14.465 -17.155 -3.396 1.00 0.53 H new ATOM 0 HE21 GLN A 120 13.605 -19.120 -4.179 1.00 0.70 H new ATOM 0 HE22 GLN A 120 13.195 -20.452 -3.092 1.00 0.70 H new ATOM 1878 N VAL A 121 16.737 -14.041 -0.426 1.00 0.39 N ATOM 1879 CA VAL A 121 17.341 -13.286 0.658 1.00 0.44 C ATOM 1880 C VAL A 121 17.217 -11.785 0.410 1.00 0.38 C ATOM 1881 O VAL A 121 17.424 -10.980 1.313 1.00 0.47 O ATOM 1882 CB VAL A 121 18.825 -13.646 0.853 1.00 0.52 C ATOM 1883 CG1 VAL A 121 18.969 -15.091 1.301 1.00 0.98 C ATOM 1884 CG2 VAL A 121 19.606 -13.399 -0.427 1.00 0.92 C ATOM 0 H VAL A 121 17.381 -14.296 -1.175 1.00 0.39 H new ATOM 0 HA VAL A 121 16.799 -13.553 1.565 1.00 0.44 H new ATOM 0 HB VAL A 121 19.236 -13.005 1.633 1.00 0.52 H new ATOM 0 HG11 VAL A 121 20.025 -15.327 1.434 1.00 0.98 H new ATOM 0 HG12 VAL A 121 18.444 -15.233 2.246 1.00 0.98 H new ATOM 0 HG13 VAL A 121 18.542 -15.750 0.546 1.00 0.98 H new ATOM 0 HG21 VAL A 121 20.653 -13.659 -0.270 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.195 -14.014 -1.228 1.00 0.92 H new ATOM 0 HG23 VAL A 121 19.531 -12.347 -0.702 1.00 0.92 H new ATOM 1894 N LEU A 122 16.860 -11.415 -0.816 1.00 0.30 N ATOM 1895 CA LEU A 122 16.719 -10.010 -1.174 1.00 0.27 C ATOM 1896 C LEU A 122 15.318 -9.496 -0.891 1.00 0.23 C ATOM 1897 O LEU A 122 15.132 -8.312 -0.625 1.00 0.23 O ATOM 1898 CB LEU A 122 17.055 -9.773 -2.643 1.00 0.28 C ATOM 1899 CG LEU A 122 18.517 -9.449 -2.933 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.405 -10.637 -2.617 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.675 -9.020 -4.377 1.00 0.41 C ATOM 0 H LEU A 122 16.664 -12.067 -1.575 1.00 0.30 H new ATOM 0 HA LEU A 122 17.426 -9.460 -0.554 1.00 0.27 H new ATOM 0 HB2 LEU A 122 16.777 -10.662 -3.210 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.438 -8.954 -3.012 1.00 0.28 H new ATOM 0 HG LEU A 122 18.828 -8.625 -2.291 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.443 -10.383 -2.832 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.305 -10.896 -1.563 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.106 -11.488 -3.229 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.722 -8.790 -4.576 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.349 -9.827 -5.034 1.00 0.41 H new ATOM 0 HD23 LEU A 122 18.068 -8.134 -4.562 1.00 0.41 H new ATOM 1913 N VAL A 123 14.336 -10.384 -0.952 1.00 0.23 N ATOM 1914 CA VAL A 123 12.948 -9.996 -0.751 1.00 0.25 C ATOM 1915 C VAL A 123 12.728 -9.400 0.643 1.00 0.27 C ATOM 1916 O VAL A 123 11.964 -8.446 0.808 1.00 0.31 O ATOM 1917 CB VAL A 123 11.990 -11.182 -0.987 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.353 -12.367 -0.115 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.556 -10.759 -0.745 1.00 0.31 C ATOM 0 H VAL A 123 14.475 -11.377 -1.139 1.00 0.23 H new ATOM 0 HA VAL A 123 12.722 -9.226 -1.489 1.00 0.25 H new ATOM 0 HB VAL A 123 12.091 -11.493 -2.027 1.00 0.28 H new ATOM 0 HG11 VAL A 123 11.659 -13.185 -0.306 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.368 -12.691 -0.345 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.294 -12.078 0.934 1.00 0.31 H new ATOM 0 HG21 VAL A 123 9.893 -11.607 -0.916 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.447 -10.414 0.283 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.295 -9.951 -1.428 1.00 0.31 H new ATOM 1929 N SER A 124 13.423 -9.940 1.633 1.00 0.29 N ATOM 1930 CA SER A 124 13.332 -9.422 2.990 1.00 0.35 C ATOM 1931 C SER A 124 13.992 -8.053 3.073 1.00 0.34 C ATOM 1932 O SER A 124 13.541 -7.172 3.807 1.00 0.44 O ATOM 1933 CB SER A 124 13.996 -10.387 3.973 1.00 0.43 C ATOM 1934 OG SER A 124 15.339 -10.641 3.597 1.00 1.32 O ATOM 0 H SER A 124 14.054 -10.734 1.523 1.00 0.29 H new ATOM 0 HA SER A 124 12.280 -9.323 3.256 1.00 0.35 H new ATOM 0 HB2 SER A 124 13.968 -9.966 4.978 1.00 0.43 H new ATOM 0 HB3 SER A 124 13.439 -11.323 4.004 1.00 0.43 H new ATOM 0 HG SER A 124 15.747 -11.259 4.239 1.00 1.32 H new ATOM 1940 N ARG A 125 15.048 -7.875 2.286 1.00 0.28 N ATOM 1941 CA ARG A 125 15.784 -6.621 2.263 1.00 0.31 C ATOM 1942 C ARG A 125 14.932 -5.544 1.611 1.00 0.24 C ATOM 1943 O ARG A 125 14.968 -4.390 2.016 1.00 0.24 O ATOM 1944 CB ARG A 125 17.113 -6.785 1.512 1.00 0.41 C ATOM 1945 CG ARG A 125 18.002 -7.890 2.080 1.00 0.91 C ATOM 1946 CD ARG A 125 19.245 -8.140 1.230 1.00 0.74 C ATOM 1947 NE ARG A 125 19.946 -9.354 1.647 1.00 1.01 N ATOM 1948 CZ ARG A 125 20.937 -9.922 0.961 1.00 1.24 C ATOM 1949 NH1 ARG A 125 21.395 -9.363 -0.153 1.00 1.28 N ATOM 1950 NH2 ARG A 125 21.478 -11.048 1.398 1.00 1.84 N ATOM 0 H ARG A 125 15.413 -8.588 1.654 1.00 0.28 H new ATOM 0 HA ARG A 125 16.012 -6.325 3.287 1.00 0.31 H new ATOM 0 HB2 ARG A 125 16.905 -7.000 0.464 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.657 -5.841 1.542 1.00 0.41 H new ATOM 0 HG2 ARG A 125 18.306 -7.622 3.092 1.00 0.91 H new ATOM 0 HG3 ARG A 125 17.426 -8.812 2.154 1.00 0.91 H new ATOM 0 HD2 ARG A 125 18.959 -8.226 0.182 1.00 0.74 H new ATOM 0 HD3 ARG A 125 19.918 -7.286 1.308 1.00 0.74 H new ATOM 0 HE ARG A 125 19.657 -9.795 2.520 1.00 1.01 H new ATOM 0 HH11 ARG A 125 20.988 -8.491 -0.491 1.00 1.28 H new ATOM 0 HH12 ARG A 125 22.154 -9.806 -0.671 1.00 1.28 H new ATOM 0 HH21 ARG A 125 21.136 -11.478 2.257 1.00 1.84 H new ATOM 0 HH22 ARG A 125 22.237 -11.486 0.875 1.00 1.84 H new ATOM 1964 N ILE A 126 14.151 -5.943 0.612 1.00 0.21 N ATOM 1965 CA ILE A 126 13.197 -5.048 -0.031 1.00 0.19 C ATOM 1966 C ILE A 126 12.269 -4.442 1.011 1.00 0.19 C ATOM 1967 O ILE A 126 12.137 -3.220 1.111 1.00 0.19 O ATOM 1968 CB ILE A 126 12.366 -5.802 -1.090 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.252 -6.177 -2.274 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.177 -4.969 -1.550 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.545 -6.998 -3.322 1.00 0.23 C ATOM 0 H ILE A 126 14.161 -6.888 0.228 1.00 0.21 H new ATOM 0 HA ILE A 126 13.754 -4.253 -0.527 1.00 0.19 H new ATOM 0 HB ILE A 126 11.975 -6.714 -0.638 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.633 -5.266 -2.735 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.115 -6.734 -1.909 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.610 -5.526 -2.296 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.536 -4.748 -0.697 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.534 -4.036 -1.987 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.237 -7.227 -4.133 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.188 -7.927 -2.877 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.699 -6.435 -3.715 1.00 0.23 H new ATOM 1983 N ALA A 127 11.639 -5.312 1.789 1.00 0.22 N ATOM 1984 CA ALA A 127 10.754 -4.886 2.859 1.00 0.25 C ATOM 1985 C ALA A 127 11.480 -3.976 3.839 1.00 0.24 C ATOM 1986 O ALA A 127 10.926 -2.981 4.307 1.00 0.26 O ATOM 1987 CB ALA A 127 10.195 -6.097 3.583 1.00 0.30 C ATOM 0 H ALA A 127 11.727 -6.324 1.696 1.00 0.22 H new ATOM 0 HA ALA A 127 9.932 -4.321 2.419 1.00 0.25 H new ATOM 0 HB1 ALA A 127 9.532 -5.768 4.384 1.00 0.30 H new ATOM 0 HB2 ALA A 127 9.636 -6.715 2.880 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.014 -6.678 4.006 1.00 0.30 H new ATOM 1993 N ALA A 128 12.723 -4.324 4.135 1.00 0.22 N ATOM 1994 CA ALA A 128 13.540 -3.547 5.054 1.00 0.23 C ATOM 1995 C ALA A 128 13.808 -2.151 4.505 1.00 0.19 C ATOM 1996 O ALA A 128 13.588 -1.155 5.193 1.00 0.19 O ATOM 1997 CB ALA A 128 14.846 -4.269 5.329 1.00 0.27 C ATOM 0 H ALA A 128 13.190 -5.145 3.749 1.00 0.22 H new ATOM 0 HA ALA A 128 12.992 -3.439 5.990 1.00 0.23 H new ATOM 0 HB1 ALA A 128 15.450 -3.679 6.018 1.00 0.27 H new ATOM 0 HB2 ALA A 128 14.637 -5.243 5.772 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.390 -4.405 4.394 1.00 0.27 H new ATOM 2003 N TRP A 129 14.262 -2.086 3.256 1.00 0.17 N ATOM 2004 CA TRP A 129 14.596 -0.813 2.621 1.00 0.17 C ATOM 2005 C TRP A 129 13.366 0.083 2.518 1.00 0.15 C ATOM 2006 O TRP A 129 13.445 1.289 2.759 1.00 0.18 O ATOM 2007 CB TRP A 129 15.195 -1.026 1.224 1.00 0.20 C ATOM 2008 CG TRP A 129 16.442 -1.862 1.216 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.380 -1.958 2.203 1.00 0.27 C ATOM 2010 CD2 TRP A 129 16.888 -2.714 0.154 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.380 -2.822 1.822 1.00 0.33 N ATOM 2012 CE2 TRP A 129 18.100 -3.298 0.567 1.00 0.36 C ATOM 2013 CE3 TRP A 129 16.376 -3.042 -1.105 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 18.808 -4.191 -0.236 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 17.077 -3.928 -1.900 1.00 0.47 C ATOM 2016 CH2 TRP A 129 18.282 -4.494 -1.464 1.00 0.50 C ATOM 0 H TRP A 129 14.408 -2.902 2.662 1.00 0.17 H new ATOM 0 HA TRP A 129 15.341 -0.325 3.249 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.448 -1.500 0.588 1.00 0.20 H new ATOM 0 HB3 TRP A 129 15.418 -0.054 0.783 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.342 -1.432 3.146 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.196 -3.068 2.382 1.00 0.33 H new ATOM 0 HE3 TRP A 129 15.448 -2.610 -1.450 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.737 -4.628 0.098 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 16.690 -4.189 -2.874 1.00 0.47 H new ATOM 0 HH2 TRP A 129 18.807 -5.183 -2.109 1.00 0.50 H new ATOM 2027 N MET A 130 12.229 -0.514 2.177 1.00 0.16 N ATOM 2028 CA MET A 130 10.987 0.241 2.050 1.00 0.21 C ATOM 2029 C MET A 130 10.556 0.788 3.402 1.00 0.19 C ATOM 2030 O MET A 130 10.138 1.939 3.510 1.00 0.21 O ATOM 2031 CB MET A 130 9.870 -0.625 1.467 1.00 0.29 C ATOM 2032 CG MET A 130 10.047 -0.975 -0.002 1.00 0.33 C ATOM 2033 SD MET A 130 8.687 -1.974 -0.635 1.00 0.71 S ATOM 2034 CE MET A 130 7.294 -0.932 -0.208 1.00 0.29 C ATOM 0 H MET A 130 12.141 -1.512 1.985 1.00 0.16 H new ATOM 0 HA MET A 130 11.173 1.071 1.368 1.00 0.21 H new ATOM 0 HB2 MET A 130 9.805 -1.548 2.042 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.921 -0.104 1.592 1.00 0.29 H new ATOM 0 HG2 MET A 130 10.123 -0.057 -0.585 1.00 0.33 H new ATOM 0 HG3 MET A 130 10.984 -1.515 -0.134 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.376 -1.374 -0.596 1.00 0.29 H new ATOM 0 HE2 MET A 130 7.225 -0.844 0.876 1.00 0.29 H new ATOM 0 HE3 MET A 130 7.432 0.057 -0.644 1.00 0.29 H new ATOM 2044 N ALA A 131 10.677 -0.041 4.431 1.00 0.18 N ATOM 2045 CA ALA A 131 10.307 0.350 5.781 1.00 0.20 C ATOM 2046 C ALA A 131 11.185 1.490 6.272 1.00 0.21 C ATOM 2047 O ALA A 131 10.706 2.434 6.899 1.00 0.23 O ATOM 2048 CB ALA A 131 10.417 -0.840 6.714 1.00 0.23 C ATOM 0 H ALA A 131 11.031 -0.994 4.353 1.00 0.18 H new ATOM 0 HA ALA A 131 9.274 0.697 5.770 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.138 -0.538 7.723 1.00 0.23 H new ATOM 0 HB2 ALA A 131 9.749 -1.632 6.374 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.443 -1.207 6.716 1.00 0.23 H new ATOM 2054 N THR A 132 12.471 1.391 5.974 1.00 0.22 N ATOM 2055 CA THR A 132 13.429 2.420 6.337 1.00 0.25 C ATOM 2056 C THR A 132 13.083 3.751 5.666 1.00 0.24 C ATOM 2057 O THR A 132 12.956 4.777 6.338 1.00 0.25 O ATOM 2058 CB THR A 132 14.858 1.985 5.957 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.169 0.751 6.614 1.00 0.33 O ATOM 2060 CG2 THR A 132 15.877 3.038 6.356 1.00 0.37 C ATOM 0 H THR A 132 12.877 0.599 5.476 1.00 0.22 H new ATOM 0 HA THR A 132 13.381 2.560 7.417 1.00 0.25 H new ATOM 0 HB THR A 132 14.902 1.858 4.875 1.00 0.31 H new ATOM 0 HG1 THR A 132 14.655 0.024 6.205 1.00 0.33 H new ATOM 0 HG21 THR A 132 16.875 2.703 6.075 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.652 3.974 5.846 1.00 0.37 H new ATOM 0 HG23 THR A 132 15.836 3.194 7.434 1.00 0.37 H new ATOM 2068 N TYR A 133 12.915 3.730 4.343 1.00 0.23 N ATOM 2069 CA TYR A 133 12.571 4.943 3.605 1.00 0.24 C ATOM 2070 C TYR A 133 11.252 5.520 4.111 1.00 0.21 C ATOM 2071 O TYR A 133 11.117 6.734 4.282 1.00 0.23 O ATOM 2072 CB TYR A 133 12.480 4.666 2.098 1.00 0.27 C ATOM 2073 CG TYR A 133 12.136 5.897 1.285 1.00 0.33 C ATOM 2074 CD1 TYR A 133 13.127 6.778 0.869 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.822 6.173 0.923 1.00 0.36 C ATOM 2076 CE1 TYR A 133 12.822 7.896 0.119 1.00 0.50 C ATOM 2077 CE2 TYR A 133 10.510 7.288 0.171 1.00 0.45 C ATOM 2078 CZ TYR A 133 11.496 8.169 -0.188 1.00 0.51 C ATOM 2079 OH TYR A 133 11.205 9.255 -0.982 1.00 0.61 O ATOM 0 H TYR A 133 13.011 2.894 3.766 1.00 0.23 H new ATOM 0 HA TYR A 133 13.364 5.672 3.772 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.432 4.264 1.751 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.726 3.899 1.921 1.00 0.27 H new ATOM 0 HD1 TYR A 133 14.155 6.584 1.138 1.00 0.42 H new ATOM 0 HD2 TYR A 133 10.033 5.505 1.235 1.00 0.36 H new ATOM 0 HE1 TYR A 133 13.608 8.552 -0.226 1.00 0.50 H new ATOM 0 HE2 TYR A 133 9.489 7.466 -0.134 1.00 0.45 H new ATOM 0 HH TYR A 133 11.035 8.954 -1.899 1.00 0.61 H new ATOM 2089 N LEU A 134 10.291 4.640 4.360 1.00 0.20 N ATOM 2090 CA LEU A 134 8.986 5.042 4.862 1.00 0.20 C ATOM 2091 C LEU A 134 9.111 5.740 6.214 1.00 0.21 C ATOM 2092 O LEU A 134 8.543 6.809 6.422 1.00 0.24 O ATOM 2093 CB LEU A 134 8.079 3.816 4.976 1.00 0.20 C ATOM 2094 CG LEU A 134 6.814 4.002 5.812 1.00 0.22 C ATOM 2095 CD1 LEU A 134 5.915 5.057 5.196 1.00 0.26 C ATOM 2096 CD2 LEU A 134 6.073 2.683 5.951 1.00 0.26 C ATOM 0 H LEU A 134 10.394 3.635 4.221 1.00 0.20 H new ATOM 0 HA LEU A 134 8.546 5.750 4.160 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.787 3.509 3.972 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.658 2.997 5.404 1.00 0.20 H new ATOM 0 HG LEU A 134 7.105 4.342 6.806 1.00 0.22 H new ATOM 0 HD11 LEU A 134 5.020 5.174 5.807 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.448 6.006 5.148 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.630 4.750 4.190 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.174 2.832 6.549 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.795 2.316 4.963 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.718 1.953 6.441 1.00 0.26 H new ATOM 2108 N ASN A 135 9.873 5.142 7.114 1.00 0.24 N ATOM 2109 CA ASN A 135 9.999 5.655 8.473 1.00 0.29 C ATOM 2110 C ASN A 135 10.775 6.972 8.515 1.00 0.30 C ATOM 2111 O ASN A 135 10.381 7.911 9.206 1.00 0.33 O ATOM 2112 CB ASN A 135 10.692 4.621 9.362 1.00 0.37 C ATOM 2113 CG ASN A 135 10.808 5.076 10.808 1.00 0.92 C ATOM 2114 OD1 ASN A 135 9.920 5.745 11.335 1.00 1.17 O ATOM 2115 ND2 ASN A 135 11.910 4.729 11.454 1.00 1.46 N ATOM 0 H ASN A 135 10.416 4.298 6.930 1.00 0.24 H new ATOM 0 HA ASN A 135 8.993 5.847 8.845 1.00 0.29 H new ATOM 0 HB2 ASN A 135 10.137 3.684 9.323 1.00 0.37 H new ATOM 0 HB3 ASN A 135 11.688 4.418 8.968 1.00 0.37 H new ATOM 0 HD21 ASN A 135 12.045 5.017 12.423 1.00 1.46 H new ATOM 0 HD22 ASN A 135 12.624 4.173 10.983 1.00 1.46 H new ATOM 2122 N ASP A 136 11.870 7.047 7.769 1.00 0.32 N ATOM 2123 CA ASP A 136 12.764 8.200 7.856 1.00 0.37 C ATOM 2124 C ASP A 136 12.388 9.311 6.876 1.00 0.34 C ATOM 2125 O ASP A 136 12.235 10.466 7.272 1.00 0.36 O ATOM 2126 CB ASP A 136 14.222 7.783 7.626 1.00 0.46 C ATOM 2127 CG ASP A 136 14.804 6.986 8.778 1.00 1.19 C ATOM 2128 OD1 ASP A 136 15.129 7.591 9.823 1.00 1.27 O ATOM 2129 OD2 ASP A 136 14.972 5.757 8.633 1.00 2.07 O ATOM 0 H ASP A 136 12.161 6.332 7.102 1.00 0.32 H new ATOM 0 HA ASP A 136 12.654 8.596 8.865 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.284 7.189 6.714 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.828 8.675 7.467 1.00 0.46 H new ATOM 2134 N HIS A 137 12.244 8.973 5.600 1.00 0.33 N ATOM 2135 CA HIS A 137 12.039 9.991 4.565 1.00 0.35 C ATOM 2136 C HIS A 137 10.567 10.290 4.316 1.00 0.29 C ATOM 2137 O HIS A 137 10.192 11.442 4.113 1.00 0.32 O ATOM 2138 CB HIS A 137 12.701 9.579 3.243 1.00 0.45 C ATOM 2139 CG HIS A 137 14.135 9.994 3.121 1.00 0.63 C ATOM 2140 ND1 HIS A 137 15.180 9.255 3.622 1.00 1.07 N ATOM 2141 CD2 HIS A 137 14.695 11.076 2.533 1.00 1.53 C ATOM 2142 CE1 HIS A 137 16.318 9.864 3.350 1.00 0.95 C ATOM 2143 NE2 HIS A 137 16.052 10.971 2.687 1.00 1.34 N ATOM 0 H HIS A 137 12.264 8.013 5.255 1.00 0.33 H new ATOM 0 HA HIS A 137 12.508 10.899 4.943 1.00 0.35 H new ATOM 0 HB2 HIS A 137 12.637 8.496 3.140 1.00 0.45 H new ATOM 0 HB3 HIS A 137 12.137 10.012 2.417 1.00 0.45 H new ATOM 0 HD2 HIS A 137 14.169 11.876 2.034 1.00 1.53 H new ATOM 0 HE1 HIS A 137 17.302 9.514 3.625 1.00 0.95 H new ATOM 0 HE2 HIS A 137 16.742 11.639 2.345 1.00 1.34 H new ATOM 2152 N LEU A 138 9.736 9.261 4.334 1.00 0.26 N ATOM 2153 CA LEU A 138 8.345 9.397 3.917 1.00 0.25 C ATOM 2154 C LEU A 138 7.455 9.906 5.055 1.00 0.24 C ATOM 2155 O LEU A 138 6.579 10.746 4.839 1.00 0.25 O ATOM 2156 CB LEU A 138 7.840 8.051 3.399 1.00 0.23 C ATOM 2157 CG LEU A 138 6.516 8.089 2.641 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.610 9.036 1.458 1.00 0.26 C ATOM 2159 CD2 LEU A 138 6.140 6.692 2.177 1.00 0.22 C ATOM 0 H LEU A 138 9.998 8.321 4.632 1.00 0.26 H new ATOM 0 HA LEU A 138 8.296 10.139 3.120 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.601 7.626 2.744 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.734 7.373 4.246 1.00 0.23 H new ATOM 0 HG LEU A 138 5.738 8.455 3.311 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.658 9.052 0.928 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.844 10.040 1.813 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.396 8.698 0.783 1.00 0.26 H new ATOM 0 HD21 LEU A 138 5.194 6.730 1.637 1.00 0.22 H new ATOM 0 HD22 LEU A 138 6.918 6.306 1.519 1.00 0.22 H new ATOM 0 HD23 LEU A 138 6.038 6.036 3.042 1.00 0.22 H new ATOM 2171 N GLU A 139 7.698 9.400 6.261 1.00 0.26 N ATOM 2172 CA GLU A 139 6.922 9.768 7.450 1.00 0.29 C ATOM 2173 C GLU A 139 6.784 11.294 7.634 1.00 0.30 C ATOM 2174 O GLU A 139 5.685 11.769 7.923 1.00 0.30 O ATOM 2175 CB GLU A 139 7.548 9.146 8.704 1.00 0.36 C ATOM 2176 CG GLU A 139 6.695 9.284 9.956 1.00 0.52 C ATOM 2177 CD GLU A 139 5.398 8.510 9.864 1.00 1.00 C ATOM 2178 OE1 GLU A 139 5.387 7.320 10.250 1.00 1.46 O ATOM 2179 OE2 GLU A 139 4.388 9.081 9.412 1.00 1.74 O ATOM 0 H GLU A 139 8.438 8.723 6.445 1.00 0.26 H new ATOM 0 HA GLU A 139 5.917 9.374 7.300 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.734 8.088 8.518 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.517 9.613 8.884 1.00 0.36 H new ATOM 0 HG2 GLU A 139 7.262 8.934 10.818 1.00 0.52 H new ATOM 0 HG3 GLU A 139 6.474 10.338 10.126 1.00 0.52 H new ATOM 2186 N PRO A 140 7.877 12.094 7.493 1.00 0.33 N ATOM 2187 CA PRO A 140 7.804 13.559 7.629 1.00 0.36 C ATOM 2188 C PRO A 140 6.680 14.197 6.812 1.00 0.31 C ATOM 2189 O PRO A 140 6.071 15.173 7.249 1.00 0.36 O ATOM 2190 CB PRO A 140 9.163 14.036 7.117 1.00 0.42 C ATOM 2191 CG PRO A 140 10.081 12.909 7.415 1.00 0.42 C ATOM 2192 CD PRO A 140 9.268 11.653 7.236 1.00 0.35 C ATOM 0 HA PRO A 140 7.586 13.843 8.659 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.132 14.253 6.049 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.479 14.950 7.619 1.00 0.42 H new ATOM 0 HG2 PRO A 140 10.940 12.917 6.744 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.470 12.981 8.431 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.379 11.244 6.232 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.576 10.874 7.933 1.00 0.35 H new ATOM 2200 N TRP A 141 6.401 13.653 5.633 1.00 0.28 N ATOM 2201 CA TRP A 141 5.333 14.187 4.798 1.00 0.25 C ATOM 2202 C TRP A 141 3.987 13.616 5.234 1.00 0.22 C ATOM 2203 O TRP A 141 2.991 14.338 5.321 1.00 0.22 O ATOM 2204 CB TRP A 141 5.581 13.874 3.315 1.00 0.29 C ATOM 2205 CG TRP A 141 4.614 14.573 2.411 1.00 0.29 C ATOM 2206 CD1 TRP A 141 4.737 15.831 1.898 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.368 14.061 1.923 1.00 0.30 C ATOM 2208 NE1 TRP A 141 3.643 16.134 1.128 1.00 0.35 N ATOM 2209 CE2 TRP A 141 2.790 15.065 1.127 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.687 12.852 2.082 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 1.561 14.899 0.495 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.468 12.688 1.454 1.00 0.35 C ATOM 2213 CH2 TRP A 141 0.916 13.706 0.669 1.00 0.36 C ATOM 0 H TRP A 141 6.893 12.852 5.238 1.00 0.28 H new ATOM 0 HA TRP A 141 5.319 15.270 4.920 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.597 14.167 3.050 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.508 12.798 3.157 1.00 0.29 H new ATOM 0 HD1 TRP A 141 5.573 16.492 2.073 1.00 0.32 H new ATOM 0 HE1 TRP A 141 3.490 17.014 0.636 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.106 12.060 2.685 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.133 15.684 -0.111 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 0.932 11.758 1.571 1.00 0.35 H new ATOM 0 HH2 TRP A 141 -0.039 13.546 0.191 1.00 0.36 H new ATOM 2224 N ILE A 142 3.975 12.321 5.525 1.00 0.20 N ATOM 2225 CA ILE A 142 2.758 11.623 5.925 1.00 0.19 C ATOM 2226 C ILE A 142 2.172 12.233 7.196 1.00 0.20 C ATOM 2227 O ILE A 142 1.028 12.695 7.205 1.00 0.20 O ATOM 2228 CB ILE A 142 3.045 10.123 6.157 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.487 9.458 4.854 1.00 0.21 C ATOM 2230 CG2 ILE A 142 1.823 9.413 6.721 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.916 8.024 5.033 1.00 0.23 C ATOM 0 H ILE A 142 4.804 11.727 5.491 1.00 0.20 H new ATOM 0 HA ILE A 142 2.033 11.729 5.118 1.00 0.19 H new ATOM 0 HB ILE A 142 3.852 10.043 6.886 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.667 9.498 4.137 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.313 10.026 4.426 1.00 0.21 H new ATOM 0 HG21 ILE A 142 2.053 8.359 6.874 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.546 9.866 7.673 1.00 0.25 H new ATOM 0 HG23 ILE A 142 0.993 9.505 6.020 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.217 7.611 4.070 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.756 7.979 5.726 1.00 0.23 H new ATOM 0 HD13 ILE A 142 3.085 7.443 5.433 1.00 0.23 H new ATOM 2243 N GLN A 143 2.971 12.244 8.257 1.00 0.25 N ATOM 2244 CA GLN A 143 2.537 12.737 9.559 1.00 0.30 C ATOM 2245 C GLN A 143 2.091 14.196 9.472 1.00 0.29 C ATOM 2246 O GLN A 143 1.117 14.596 10.111 1.00 0.31 O ATOM 2247 CB GLN A 143 3.678 12.598 10.571 1.00 0.40 C ATOM 2248 CG GLN A 143 3.249 12.774 12.021 1.00 0.51 C ATOM 2249 CD GLN A 143 2.299 11.681 12.486 1.00 0.95 C ATOM 2250 OE1 GLN A 143 2.737 10.634 12.964 1.00 1.51 O ATOM 2251 NE2 GLN A 143 0.997 11.911 12.363 1.00 1.60 N ATOM 0 H GLN A 143 3.935 11.912 8.239 1.00 0.25 H new ATOM 0 HA GLN A 143 1.686 12.141 9.887 1.00 0.30 H new ATOM 0 HB2 GLN A 143 4.134 11.615 10.455 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.447 13.335 10.339 1.00 0.40 H new ATOM 0 HG2 GLN A 143 4.132 12.778 12.660 1.00 0.51 H new ATOM 0 HG3 GLN A 143 2.766 13.744 12.138 1.00 0.51 H new ATOM 0 HE21 GLN A 143 0.670 12.790 11.962 1.00 1.60 H new ATOM 0 HE22 GLN A 143 0.324 11.209 12.669 1.00 1.60 H new ATOM 2260 N GLU A 144 2.801 14.976 8.658 1.00 0.29 N ATOM 2261 CA GLU A 144 2.498 16.397 8.474 1.00 0.33 C ATOM 2262 C GLU A 144 1.091 16.594 7.910 1.00 0.29 C ATOM 2263 O GLU A 144 0.404 17.559 8.242 1.00 0.35 O ATOM 2264 CB GLU A 144 3.530 17.040 7.539 1.00 0.41 C ATOM 2265 CG GLU A 144 3.292 18.519 7.276 1.00 0.64 C ATOM 2266 CD GLU A 144 4.295 19.099 6.303 1.00 1.09 C ATOM 2267 OE1 GLU A 144 5.364 19.568 6.747 1.00 1.25 O ATOM 2268 OE2 GLU A 144 4.020 19.103 5.083 1.00 1.75 O ATOM 0 H GLU A 144 3.596 14.646 8.111 1.00 0.29 H new ATOM 0 HA GLU A 144 2.545 16.880 9.450 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.523 16.914 7.970 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.525 16.507 6.588 1.00 0.41 H new ATOM 0 HG2 GLU A 144 2.285 18.658 6.882 1.00 0.64 H new ATOM 0 HG3 GLU A 144 3.344 19.066 8.217 1.00 0.64 H new ATOM 2275 N ASN A 145 0.659 15.666 7.068 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.666 15.748 6.455 1.00 0.28 C ATOM 2277 C ASN A 145 -1.708 15.015 7.293 1.00 0.30 C ATOM 2278 O ASN A 145 -2.813 14.731 6.823 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.645 15.184 5.027 1.00 0.32 C ATOM 2280 CG ASN A 145 0.004 16.133 4.031 1.00 0.34 C ATOM 2281 OD1 ASN A 145 -0.677 16.955 3.416 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.312 16.028 3.853 1.00 0.33 N ATOM 0 H ASN A 145 1.203 14.848 6.792 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.942 16.802 6.410 1.00 0.28 H new ATOM 0 HB2 ASN A 145 -0.107 14.236 5.023 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.666 14.973 4.709 1.00 0.32 H new ATOM 0 HD21 ASN A 145 1.787 16.640 3.189 1.00 0.33 H new ATOM 0 HD22 ASN A 145 1.844 15.336 4.380 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.356 14.709 8.535 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.303 14.090 9.444 1.00 0.30 C ATOM 2291 C GLY A 146 -1.931 12.665 9.788 1.00 0.30 C ATOM 2292 O GLY A 146 -2.304 12.156 10.846 1.00 0.41 O ATOM 0 H GLY A 146 -0.431 14.878 8.930 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -2.360 14.678 10.360 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.296 14.104 8.994 1.00 0.30 H new ATOM 2296 N GLY A 147 -1.197 12.020 8.901 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.809 10.647 9.120 1.00 0.22 C ATOM 2298 C GLY A 147 -1.524 9.712 8.172 1.00 0.19 C ATOM 2299 O GLY A 147 -2.167 10.159 7.219 1.00 0.20 O ATOM 0 H GLY A 147 -0.861 12.426 8.028 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.268 10.547 8.988 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -1.032 10.364 10.149 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.425 8.419 8.434 1.00 0.20 N ATOM 2304 CA TRP A 148 -2.056 7.420 7.587 1.00 0.21 C ATOM 2305 C TRP A 148 -3.574 7.528 7.625 1.00 0.23 C ATOM 2306 O TRP A 148 -4.241 7.146 6.667 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.626 6.011 7.991 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.214 5.693 7.611 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.856 5.547 8.447 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.282 5.485 6.285 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.982 5.246 7.722 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.655 5.206 6.393 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.303 5.506 5.016 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.450 4.945 5.283 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.490 5.249 3.914 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.855 4.971 4.056 1.00 0.24 C ATOM 0 H TRP A 148 -0.912 8.036 9.228 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.726 7.612 6.566 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.739 5.899 9.069 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.293 5.287 7.524 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.821 5.653 9.521 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.911 5.079 8.110 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.355 5.719 4.899 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.503 4.729 5.389 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 0.050 5.263 2.928 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.449 4.773 3.176 1.00 0.24 H new ATOM 2327 N ASP A 149 -4.114 8.062 8.723 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.567 8.225 8.870 1.00 0.31 C ATOM 2329 C ASP A 149 -6.154 8.967 7.677 1.00 0.30 C ATOM 2330 O ASP A 149 -7.258 8.664 7.224 1.00 0.37 O ATOM 2331 CB ASP A 149 -5.916 8.984 10.155 1.00 0.40 C ATOM 2332 CG ASP A 149 -5.503 8.245 11.407 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -6.098 7.188 11.700 1.00 1.94 O ATOM 2334 OD2 ASP A 149 -4.581 8.712 12.103 1.00 1.96 O ATOM 0 H ASP A 149 -3.571 8.389 9.522 1.00 0.26 H new ATOM 0 HA ASP A 149 -5.998 7.225 8.922 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -5.430 9.959 10.138 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -6.991 9.164 10.184 1.00 0.40 H new ATOM 2339 N THR A 150 -5.398 9.930 7.169 1.00 0.27 N ATOM 2340 CA THR A 150 -5.804 10.698 6.007 1.00 0.29 C ATOM 2341 C THR A 150 -5.890 9.789 4.783 1.00 0.28 C ATOM 2342 O THR A 150 -6.916 9.728 4.105 1.00 0.33 O ATOM 2343 CB THR A 150 -4.788 11.826 5.734 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.546 12.563 6.942 1.00 0.38 O ATOM 2345 CG2 THR A 150 -5.290 12.768 4.652 1.00 0.37 C ATOM 0 H THR A 150 -4.491 10.198 7.551 1.00 0.27 H new ATOM 0 HA THR A 150 -6.783 11.135 6.204 1.00 0.29 H new ATOM 0 HB THR A 150 -3.860 11.371 5.387 1.00 0.33 H new ATOM 0 HG1 THR A 150 -3.806 12.150 7.434 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.553 13.552 4.482 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.447 12.211 3.728 1.00 0.37 H new ATOM 0 HG23 THR A 150 -6.231 13.217 4.969 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.807 9.064 4.540 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.670 8.220 3.361 1.00 0.25 C ATOM 2355 C PHE A 151 -5.665 7.058 3.390 1.00 0.26 C ATOM 2356 O PHE A 151 -6.279 6.729 2.373 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.233 7.695 3.283 1.00 0.25 C ATOM 2358 CG PHE A 151 -2.948 6.866 2.066 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -2.954 7.440 0.807 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -2.667 5.517 2.182 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -2.688 6.683 -0.313 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -2.401 4.754 1.066 1.00 0.28 C ATOM 2363 CZ PHE A 151 -2.411 5.335 -0.184 1.00 0.34 C ATOM 0 H PHE A 151 -3.995 9.045 5.158 1.00 0.24 H new ATOM 0 HA PHE A 151 -4.891 8.815 2.475 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.547 8.542 3.301 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.027 7.099 4.172 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -3.170 8.493 0.701 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -2.656 5.056 3.159 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -2.696 7.142 -1.290 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -2.185 3.701 1.171 1.00 0.28 H new ATOM 0 HZ PHE A 151 -2.203 4.739 -1.060 1.00 0.34 H new ATOM 2373 N VAL A 152 -5.827 6.451 4.560 1.00 0.25 N ATOM 2374 CA VAL A 152 -6.746 5.333 4.724 1.00 0.29 C ATOM 2375 C VAL A 152 -8.177 5.771 4.446 1.00 0.35 C ATOM 2376 O VAL A 152 -8.926 5.082 3.752 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.650 4.731 6.140 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.630 3.582 6.309 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.231 4.264 6.422 1.00 0.28 C ATOM 0 H VAL A 152 -5.332 6.716 5.411 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.461 4.565 4.004 1.00 0.29 H new ATOM 0 HB VAL A 152 -6.911 5.508 6.858 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.543 3.174 7.316 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.646 3.944 6.151 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.405 2.802 5.581 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.180 3.842 7.425 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -4.946 3.505 5.694 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.548 5.111 6.349 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.543 6.926 4.983 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.870 7.480 4.765 1.00 0.46 C ATOM 2391 C GLU A 153 -10.122 7.715 3.276 1.00 0.51 C ATOM 2392 O GLU A 153 -11.224 7.467 2.780 1.00 0.62 O ATOM 2393 CB GLU A 153 -10.032 8.785 5.549 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.356 9.485 5.302 1.00 0.70 C ATOM 2395 CD GLU A 153 -11.550 10.698 6.185 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -10.636 11.545 6.251 1.00 2.17 O ATOM 2397 OE2 GLU A 153 -12.621 10.807 6.817 1.00 1.42 O ATOM 0 H GLU A 153 -7.939 7.498 5.573 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.607 6.762 5.124 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.936 8.573 6.614 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -9.219 9.461 5.284 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -11.412 9.789 4.257 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -12.171 8.782 5.473 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.090 8.159 2.565 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.205 8.449 1.135 1.00 0.59 C ATOM 2406 C LEU A 154 -9.590 7.199 0.344 1.00 0.68 C ATOM 2407 O LEU A 154 -10.466 7.250 -0.519 1.00 0.74 O ATOM 2408 CB LEU A 154 -7.894 9.029 0.587 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.455 10.361 1.198 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.113 10.790 0.627 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.503 11.435 0.954 1.00 0.67 C ATOM 0 H LEU A 154 -8.162 8.327 2.954 1.00 0.50 H new ATOM 0 HA LEU A 154 -9.996 9.190 1.016 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.100 8.298 0.744 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -7.998 9.160 -0.490 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.347 10.225 2.274 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -5.815 11.739 1.072 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.363 10.032 0.852 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.198 10.906 -0.453 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.171 12.374 1.397 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.644 11.569 -0.119 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.446 11.133 1.409 1.00 0.67 H new ATOM 2423 N TYR A 155 -8.951 6.073 0.647 1.00 0.75 N ATOM 2424 CA TYR A 155 -9.218 4.831 -0.081 1.00 0.90 C ATOM 2425 C TYR A 155 -10.231 3.955 0.649 1.00 0.97 C ATOM 2426 O TYR A 155 -10.422 2.789 0.300 1.00 1.15 O ATOM 2427 CB TYR A 155 -7.922 4.048 -0.324 1.00 0.98 C ATOM 2428 CG TYR A 155 -7.062 4.644 -1.413 1.00 0.98 C ATOM 2429 CD1 TYR A 155 -7.227 4.265 -2.738 1.00 1.05 C ATOM 2430 CD2 TYR A 155 -6.092 5.590 -1.119 1.00 0.98 C ATOM 2431 CE1 TYR A 155 -6.452 4.813 -3.740 1.00 1.10 C ATOM 2432 CE2 TYR A 155 -5.313 6.143 -2.115 1.00 1.03 C ATOM 2433 CZ TYR A 155 -5.496 5.751 -3.422 1.00 1.08 C ATOM 2434 OH TYR A 155 -4.719 6.299 -4.415 1.00 1.17 O ATOM 0 H TYR A 155 -8.251 5.992 1.384 1.00 0.75 H new ATOM 0 HA TYR A 155 -9.646 5.110 -1.044 1.00 0.90 H new ATOM 0 HB2 TYR A 155 -7.349 4.010 0.602 1.00 0.98 H new ATOM 0 HB3 TYR A 155 -8.170 3.020 -0.588 1.00 0.98 H new ATOM 0 HD1 TYR A 155 -7.975 3.528 -2.989 1.00 1.05 H new ATOM 0 HD2 TYR A 155 -5.944 5.899 -0.095 1.00 0.98 H new ATOM 0 HE1 TYR A 155 -6.595 4.508 -4.766 1.00 1.10 H new ATOM 0 HE2 TYR A 155 -4.563 6.880 -1.870 1.00 1.03 H new ATOM 0 HH TYR A 155 -4.095 6.945 -4.023 1.00 1.17 H new ATOM 2444 N GLY A 156 -10.892 4.521 1.646 1.00 0.89 N ATOM 2445 CA GLY A 156 -11.905 3.778 2.367 1.00 1.02 C ATOM 2446 C GLY A 156 -13.220 4.526 2.442 1.00 1.11 C ATOM 2447 O GLY A 156 -14.134 4.264 1.658 1.00 1.68 O ATOM 0 H GLY A 156 -10.747 5.478 1.969 1.00 0.89 H new ATOM 0 HA2 GLY A 156 -12.064 2.816 1.879 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -11.550 3.569 3.376 1.00 1.02 H new ATOM 2451 N ASN A 157 -13.305 5.477 3.363 1.00 1.62 N ATOM 2452 CA ASN A 157 -14.540 6.223 3.591 1.00 2.05 C ATOM 2453 C ASN A 157 -14.848 7.141 2.414 1.00 2.33 C ATOM 2454 O ASN A 157 -15.977 7.186 1.930 1.00 2.52 O ATOM 2455 CB ASN A 157 -14.448 7.053 4.876 1.00 3.21 C ATOM 2456 CG ASN A 157 -14.335 6.208 6.135 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -13.757 5.121 6.128 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -14.897 6.703 7.227 1.00 4.60 N ATOM 0 H ASN A 157 -12.531 5.752 3.968 1.00 1.62 H new ATOM 0 HA ASN A 157 -15.346 5.497 3.694 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -13.583 7.713 4.812 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -15.330 7.689 4.952 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -14.860 6.180 8.102 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -15.367 7.608 7.193 1.00 4.60 H new ATOM 2465 N ASN A 158 -13.839 7.869 1.955 1.00 2.99 N ATOM 2466 CA ASN A 158 -14.011 8.804 0.844 1.00 4.03 C ATOM 2467 C ASN A 158 -14.268 8.051 -0.450 1.00 4.18 C ATOM 2468 O ASN A 158 -15.132 8.433 -1.242 1.00 4.81 O ATOM 2469 CB ASN A 158 -12.781 9.701 0.681 1.00 5.08 C ATOM 2470 CG ASN A 158 -12.642 10.720 1.793 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -13.058 10.486 2.925 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -12.063 11.866 1.474 1.00 6.76 N ATOM 0 H ASN A 158 -12.892 7.832 2.332 1.00 2.99 H new ATOM 0 HA ASN A 158 -14.872 9.433 1.071 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -11.886 9.080 0.651 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -12.841 10.220 -0.275 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -11.949 12.594 2.180 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -11.731 12.022 0.522 1.00 6.76 H new ATOM 2479 N ALA A 159 -13.520 6.972 -0.648 1.00 3.95 N ATOM 2480 CA ALA A 159 -13.665 6.135 -1.832 1.00 4.72 C ATOM 2481 C ALA A 159 -15.097 5.639 -1.985 1.00 4.66 C ATOM 2482 O ALA A 159 -15.615 5.553 -3.094 1.00 5.63 O ATOM 2483 CB ALA A 159 -12.708 4.957 -1.761 1.00 4.78 C ATOM 0 H ALA A 159 -12.801 6.655 0.002 1.00 3.95 H new ATOM 0 HA ALA A 159 -13.422 6.741 -2.705 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -12.825 4.339 -2.651 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -11.683 5.324 -1.707 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -12.928 4.362 -0.874 1.00 4.78 H new ATOM 2489 N ALA A 160 -15.734 5.340 -0.856 1.00 3.75 N ATOM 2490 CA ALA A 160 -17.106 4.835 -0.842 1.00 4.08 C ATOM 2491 C ALA A 160 -18.076 5.789 -1.538 1.00 4.33 C ATOM 2492 O ALA A 160 -19.080 5.362 -2.108 1.00 5.11 O ATOM 2493 CB ALA A 160 -17.551 4.588 0.590 1.00 3.59 C ATOM 0 H ALA A 160 -15.318 5.440 0.070 1.00 3.75 H new ATOM 0 HA ALA A 160 -17.119 3.897 -1.397 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -18.574 4.212 0.593 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -16.893 3.853 1.054 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -17.506 5.521 1.151 1.00 3.59 H new ATOM 2499 N ALA A 161 -17.779 7.077 -1.491 1.00 3.93 N ATOM 2500 CA ALA A 161 -18.627 8.070 -2.133 1.00 4.43 C ATOM 2501 C ALA A 161 -18.190 8.309 -3.574 1.00 5.54 C ATOM 2502 O ALA A 161 -19.020 8.542 -4.455 1.00 6.11 O ATOM 2503 CB ALA A 161 -18.608 9.370 -1.345 1.00 4.39 C ATOM 0 H ALA A 161 -16.961 7.459 -1.017 1.00 3.93 H new ATOM 0 HA ALA A 161 -19.648 7.689 -2.150 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -19.247 10.103 -1.837 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -18.975 9.189 -0.335 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -17.588 9.751 -1.297 1.00 4.39 H new ATOM 2509 N GLU A 162 -16.887 8.223 -3.812 1.00 5.98 N ATOM 2510 CA GLU A 162 -16.327 8.513 -5.127 1.00 7.23 C ATOM 2511 C GLU A 162 -16.609 7.387 -6.118 1.00 7.80 C ATOM 2512 O GLU A 162 -17.078 7.637 -7.229 1.00 8.75 O ATOM 2513 CB GLU A 162 -14.824 8.753 -5.022 1.00 7.72 C ATOM 2514 CG GLU A 162 -14.458 9.902 -4.098 1.00 7.99 C ATOM 2515 CD GLU A 162 -12.976 10.200 -4.106 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -12.230 9.552 -3.347 1.00 9.03 O ATOM 2517 OE2 GLU A 162 -12.549 11.082 -4.883 1.00 9.09 O ATOM 0 H GLU A 162 -16.197 7.954 -3.111 1.00 5.98 H new ATOM 0 HA GLU A 162 -16.810 9.417 -5.499 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -14.343 7.843 -4.665 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -14.426 8.956 -6.016 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -15.007 10.795 -4.398 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -14.772 9.662 -3.082 1.00 7.99 H new ATOM 2524 N SER A 163 -16.341 6.149 -5.715 1.00 7.39 N ATOM 2525 CA SER A 163 -16.570 5.004 -6.586 1.00 8.21 C ATOM 2526 C SER A 163 -18.060 4.831 -6.854 1.00 8.28 C ATOM 2527 O SER A 163 -18.461 4.302 -7.891 1.00 9.15 O ATOM 2528 CB SER A 163 -15.993 3.733 -5.967 1.00 8.03 C ATOM 2529 OG SER A 163 -16.539 3.499 -4.681 1.00 7.86 O ATOM 0 H SER A 163 -15.967 5.915 -4.795 1.00 7.39 H new ATOM 0 HA SER A 163 -16.063 5.187 -7.533 1.00 8.21 H new ATOM 0 HB2 SER A 163 -16.202 2.882 -6.615 1.00 8.03 H new ATOM 0 HB3 SER A 163 -14.909 3.820 -5.895 1.00 8.03 H new ATOM 0 HG SER A 163 -16.179 4.155 -4.048 1.00 7.86 H new ATOM 2535 N ARG A 164 -18.878 5.286 -5.910 1.00 7.47 N ATOM 2536 CA ARG A 164 -20.319 5.268 -6.087 1.00 7.60 C ATOM 2537 C ARG A 164 -20.715 6.225 -7.202 1.00 8.33 C ATOM 2538 O ARG A 164 -21.585 5.918 -8.014 1.00 8.87 O ATOM 2539 CB ARG A 164 -21.038 5.642 -4.788 1.00 6.69 C ATOM 2540 CG ARG A 164 -22.552 5.644 -4.925 1.00 6.19 C ATOM 2541 CD ARG A 164 -23.075 4.271 -5.312 1.00 5.74 C ATOM 2542 NE ARG A 164 -24.447 4.328 -5.804 1.00 5.66 N ATOM 2543 CZ ARG A 164 -25.423 3.527 -5.392 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -25.183 2.598 -4.476 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -26.640 3.651 -5.907 1.00 6.02 N ATOM 0 H ARG A 164 -18.565 5.670 -5.018 1.00 7.47 H new ATOM 0 HA ARG A 164 -20.619 4.256 -6.359 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -20.751 4.940 -4.005 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -20.707 6.630 -4.467 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -23.004 5.955 -3.983 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -22.850 6.374 -5.678 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -22.432 3.841 -6.080 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -23.027 3.608 -4.448 1.00 5.74 H new ATOM 0 HE ARG A 164 -24.671 5.029 -6.510 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -24.246 2.497 -4.085 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -25.935 1.985 -4.162 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -26.823 4.360 -6.617 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -27.392 3.037 -5.593 1.00 6.02 H new ATOM 2559 N LYS A 165 -20.048 7.373 -7.251 1.00 8.52 N ATOM 2560 CA LYS A 165 -20.312 8.362 -8.285 1.00 9.41 C ATOM 2561 C LYS A 165 -19.984 7.787 -9.656 1.00 10.47 C ATOM 2562 O LYS A 165 -20.715 8.003 -10.624 1.00 11.24 O ATOM 2563 CB LYS A 165 -19.493 9.632 -8.044 1.00 9.61 C ATOM 2564 CG LYS A 165 -19.788 10.728 -9.051 1.00 9.69 C ATOM 2565 CD LYS A 165 -18.948 11.967 -8.808 1.00 10.12 C ATOM 2566 CE LYS A 165 -19.334 13.084 -9.761 1.00 10.34 C ATOM 2567 NZ LYS A 165 -20.729 13.547 -9.534 1.00 10.42 N ATOM 0 H LYS A 165 -19.322 7.640 -6.587 1.00 8.52 H new ATOM 0 HA LYS A 165 -21.370 8.620 -8.248 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -19.697 10.004 -7.040 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -18.432 9.386 -8.083 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -19.600 10.355 -10.058 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -20.845 10.991 -9.001 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -19.077 12.302 -7.779 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -17.893 11.725 -8.934 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -18.648 13.922 -9.636 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -19.229 12.737 -10.789 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -20.864 14.475 -9.984 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -21.394 12.862 -9.947 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -20.906 13.628 -8.512 1.00 10.42 H new ATOM 2581 N GLY A 166 -18.887 7.045 -9.727 1.00 10.61 N ATOM 2582 CA GLY A 166 -18.507 6.395 -10.966 1.00 11.72 C ATOM 2583 C GLY A 166 -19.448 5.263 -11.334 1.00 12.02 C ATOM 2584 O GLY A 166 -19.560 4.895 -12.501 1.00 13.02 O ATOM 0 H GLY A 166 -18.252 6.881 -8.946 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -18.494 7.130 -11.771 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -17.493 6.006 -10.874 1.00 11.72 H new ATOM 2588 N GLN A 167 -20.129 4.713 -10.336 1.00 11.25 N ATOM 2589 CA GLN A 167 -21.091 3.640 -10.564 1.00 11.64 C ATOM 2590 C GLN A 167 -22.371 4.205 -11.176 1.00 12.01 C ATOM 2591 O GLN A 167 -23.056 3.532 -11.944 1.00 12.84 O ATOM 2592 CB GLN A 167 -21.403 2.905 -9.253 1.00 10.86 C ATOM 2593 CG GLN A 167 -22.284 1.679 -9.432 1.00 11.50 C ATOM 2594 CD GLN A 167 -22.630 1.012 -8.115 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -23.630 1.351 -7.480 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -21.816 0.051 -7.702 1.00 12.41 N ATOM 0 H GLN A 167 -20.033 4.992 -9.360 1.00 11.25 H new ATOM 0 HA GLN A 167 -20.654 2.924 -11.260 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -20.466 2.603 -8.785 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -21.893 3.596 -8.567 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -23.203 1.968 -9.941 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -21.775 0.961 -10.076 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -20.998 -0.199 -8.258 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -22.007 -0.439 -6.828 1.00 12.41 H new ATOM 2605 N GLU A 168 -22.660 5.466 -10.857 1.00 11.51 N ATOM 2606 CA GLU A 168 -23.841 6.156 -11.382 1.00 11.94 C ATOM 2607 C GLU A 168 -23.685 6.453 -12.876 1.00 13.03 C ATOM 2608 O GLU A 168 -24.592 6.988 -13.514 1.00 13.73 O ATOM 2609 CB GLU A 168 -24.065 7.473 -10.633 1.00 11.38 C ATOM 2610 CG GLU A 168 -24.172 7.325 -9.124 1.00 10.85 C ATOM 2611 CD GLU A 168 -25.336 6.457 -8.701 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -26.493 6.858 -8.921 1.00 10.98 O ATOM 2613 OE2 GLU A 168 -25.101 5.361 -8.153 1.00 10.74 O ATOM 0 H GLU A 168 -22.088 6.035 -10.233 1.00 11.51 H new ATOM 0 HA GLU A 168 -24.699 5.499 -11.237 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -23.244 8.152 -10.862 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -24.977 7.939 -11.006 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -23.247 6.897 -8.739 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -24.278 8.312 -8.673 1.00 10.85 H new ATOM 2620 N ARG A 169 -22.533 6.090 -13.425 1.00 13.26 N ATOM 2621 CA ARG A 169 -22.206 6.384 -14.816 1.00 14.38 C ATOM 2622 C ARG A 169 -22.958 5.455 -15.767 1.00 15.16 C ATOM 2623 O ARG A 169 -22.914 5.629 -16.985 1.00 16.19 O ATOM 2624 CB ARG A 169 -20.694 6.254 -15.018 1.00 14.52 C ATOM 2625 CG ARG A 169 -20.177 6.845 -16.317 1.00 14.72 C ATOM 2626 CD ARG A 169 -18.659 6.923 -16.310 1.00 14.96 C ATOM 2627 NE ARG A 169 -18.168 7.623 -15.121 1.00 14.97 N ATOM 2628 CZ ARG A 169 -16.889 7.698 -14.765 1.00 15.22 C ATOM 2629 NH1 ARG A 169 -15.944 7.170 -15.531 1.00 15.46 N ATOM 2630 NH2 ARG A 169 -16.561 8.324 -13.643 1.00 15.37 N ATOM 0 H ARG A 169 -21.802 5.586 -12.923 1.00 13.26 H new ATOM 0 HA ARG A 169 -22.515 7.404 -15.043 1.00 14.38 H new ATOM 0 HB2 ARG A 169 -20.186 6.741 -14.185 1.00 14.52 H new ATOM 0 HB3 ARG A 169 -20.425 5.198 -14.982 1.00 14.52 H new ATOM 0 HG2 ARG A 169 -20.510 6.235 -17.157 1.00 14.72 H new ATOM 0 HG3 ARG A 169 -20.596 7.841 -16.460 1.00 14.72 H new ATOM 0 HD2 ARG A 169 -18.241 5.917 -16.341 1.00 14.96 H new ATOM 0 HD3 ARG A 169 -18.315 7.439 -17.206 1.00 14.96 H new ATOM 0 HE ARG A 169 -18.855 8.085 -14.525 1.00 14.97 H new ATOM 0 HH11 ARG A 169 -16.196 6.702 -16.401 1.00 15.46 H new ATOM 0 HH12 ARG A 169 -14.966 7.232 -15.250 1.00 15.46 H new ATOM 0 HH21 ARG A 169 -17.287 8.743 -13.062 1.00 15.37 H new ATOM 0 HH22 ARG A 169 -15.583 8.387 -13.361 1.00 15.37 H new ATOM 2644 N LEU A 170 -23.668 4.481 -15.201 1.00 14.77 N ATOM 2645 CA LEU A 170 -24.440 3.534 -16.000 1.00 15.59 C ATOM 2646 C LEU A 170 -25.618 4.235 -16.669 1.00 16.06 C ATOM 2647 O LEU A 170 -26.175 3.737 -17.650 1.00 17.05 O ATOM 2648 CB LEU A 170 -24.952 2.365 -15.140 1.00 15.16 C ATOM 2649 CG LEU A 170 -26.223 2.628 -14.317 1.00 15.47 C ATOM 2650 CD1 LEU A 170 -26.747 1.330 -13.726 1.00 16.05 C ATOM 2651 CD2 LEU A 170 -25.963 3.636 -13.207 1.00 15.45 C ATOM 0 H LEU A 170 -23.724 4.328 -14.194 1.00 14.77 H new ATOM 0 HA LEU A 170 -23.778 3.133 -16.767 1.00 15.59 H new ATOM 0 HB2 LEU A 170 -25.139 1.515 -15.796 1.00 15.16 H new ATOM 0 HB3 LEU A 170 -24.157 2.070 -14.456 1.00 15.16 H new ATOM 0 HG LEU A 170 -26.974 3.046 -14.987 1.00 15.47 H new ATOM 0 HD11 LEU A 170 -27.647 1.532 -13.146 1.00 16.05 H new ATOM 0 HD12 LEU A 170 -26.982 0.633 -14.530 1.00 16.05 H new ATOM 0 HD13 LEU A 170 -25.988 0.893 -13.077 1.00 16.05 H new ATOM 0 HD21 LEU A 170 -26.881 3.801 -12.643 1.00 15.45 H new ATOM 0 HD22 LEU A 170 -25.191 3.252 -12.540 1.00 15.45 H new ATOM 0 HD23 LEU A 170 -25.630 4.578 -13.642 1.00 15.45 H new ATOM 2663 N GLU A 171 -25.992 5.392 -16.130 1.00 15.42 N ATOM 2664 CA GLU A 171 -27.107 6.157 -16.664 1.00 15.90 C ATOM 2665 C GLU A 171 -26.742 6.734 -18.026 1.00 16.52 C ATOM 2666 O GLU A 171 -27.601 6.901 -18.894 1.00 17.29 O ATOM 2667 CB GLU A 171 -27.499 7.276 -15.700 1.00 15.17 C ATOM 2668 CG GLU A 171 -28.853 7.889 -16.009 1.00 15.22 C ATOM 2669 CD GLU A 171 -29.983 6.889 -15.864 1.00 14.93 C ATOM 2670 OE1 GLU A 171 -30.207 6.088 -16.796 1.00 14.68 O ATOM 2671 OE2 GLU A 171 -30.652 6.892 -14.811 1.00 15.07 O ATOM 0 H GLU A 171 -25.537 5.818 -15.323 1.00 15.42 H new ATOM 0 HA GLU A 171 -27.961 5.491 -16.783 1.00 15.90 H new ATOM 0 HB2 GLU A 171 -27.510 6.883 -14.683 1.00 15.17 H new ATOM 0 HB3 GLU A 171 -26.739 8.057 -15.732 1.00 15.17 H new ATOM 0 HG2 GLU A 171 -29.029 8.732 -15.341 1.00 15.22 H new ATOM 0 HG3 GLU A 171 -28.848 8.283 -17.025 1.00 15.22 H new ATOM 2678 N HIS A 172 -25.465 7.040 -18.209 1.00 16.27 N ATOM 2679 CA HIS A 172 -24.970 7.458 -19.509 1.00 16.96 C ATOM 2680 C HIS A 172 -24.762 6.237 -20.391 1.00 17.80 C ATOM 2681 O HIS A 172 -23.744 5.550 -20.293 1.00 18.06 O ATOM 2682 CB HIS A 172 -23.669 8.259 -19.384 1.00 16.71 C ATOM 2683 CG HIS A 172 -23.867 9.646 -18.854 1.00 16.63 C ATOM 2684 ND1 HIS A 172 -23.124 10.176 -17.821 1.00 16.51 N ATOM 2685 CD2 HIS A 172 -24.726 10.622 -19.230 1.00 16.83 C ATOM 2686 CE1 HIS A 172 -23.518 11.412 -17.584 1.00 16.61 C ATOM 2687 NE2 HIS A 172 -24.488 11.708 -18.426 1.00 16.80 N ATOM 0 H HIS A 172 -24.757 7.006 -17.476 1.00 16.27 H new ATOM 0 HA HIS A 172 -25.712 8.112 -19.966 1.00 16.96 H new ATOM 0 HB2 HIS A 172 -22.984 7.723 -18.728 1.00 16.71 H new ATOM 0 HB3 HIS A 172 -23.193 8.318 -20.363 1.00 16.71 H new ATOM 0 HD2 HIS A 172 -25.463 10.558 -20.017 1.00 16.83 H new ATOM 0 HE1 HIS A 172 -23.115 12.070 -16.828 1.00 16.61 H new ATOM 0 HE2 HIS A 172 -24.981 12.599 -18.472 1.00 16.80 H new ATOM 2696 N HIS A 173 -25.752 5.956 -21.225 1.00 18.31 N ATOM 2697 CA HIS A 173 -25.710 4.795 -22.100 1.00 19.22 C ATOM 2698 C HIS A 173 -24.719 5.019 -23.229 1.00 19.76 C ATOM 2699 O HIS A 173 -24.649 6.110 -23.798 1.00 19.79 O ATOM 2700 CB HIS A 173 -27.100 4.487 -22.667 1.00 19.61 C ATOM 2701 CG HIS A 173 -28.050 3.897 -21.665 1.00 20.05 C ATOM 2702 ND1 HIS A 173 -28.655 2.671 -21.834 1.00 20.25 N ATOM 2703 CD2 HIS A 173 -28.504 4.376 -20.484 1.00 20.44 C ATOM 2704 CE1 HIS A 173 -29.438 2.422 -20.802 1.00 20.74 C ATOM 2705 NE2 HIS A 173 -29.366 3.440 -19.966 1.00 20.87 N ATOM 0 H HIS A 173 -26.598 6.519 -21.314 1.00 18.31 H new ATOM 0 HA HIS A 173 -25.384 3.938 -21.511 1.00 19.22 H new ATOM 0 HB2 HIS A 173 -27.531 5.406 -23.064 1.00 19.61 H new ATOM 0 HB3 HIS A 173 -26.995 3.796 -23.504 1.00 19.61 H new ATOM 0 HD2 HIS A 173 -28.238 5.320 -20.032 1.00 20.44 H new ATOM 0 HE1 HIS A 173 -30.037 1.534 -20.665 1.00 20.74 H new ATOM 0 HE2 HIS A 173 -29.867 3.519 -19.081 1.00 20.87 H new ATOM 2714 N HIS A 174 -23.951 3.987 -23.544 1.00 20.30 N ATOM 2715 CA HIS A 174 -22.928 4.077 -24.579 1.00 20.96 C ATOM 2716 C HIS A 174 -23.569 4.110 -25.959 1.00 21.59 C ATOM 2717 O HIS A 174 -22.955 4.538 -26.935 1.00 21.97 O ATOM 2718 CB HIS A 174 -21.943 2.911 -24.460 1.00 21.33 C ATOM 2719 CG HIS A 174 -21.208 2.899 -23.152 1.00 21.43 C ATOM 2720 ND1 HIS A 174 -20.513 1.810 -22.677 1.00 21.76 N ATOM 2721 CD2 HIS A 174 -21.083 3.859 -22.206 1.00 21.37 C ATOM 2722 CE1 HIS A 174 -19.996 2.101 -21.497 1.00 21.89 C ATOM 2723 NE2 HIS A 174 -20.327 3.341 -21.189 1.00 21.66 N ATOM 0 H HIS A 174 -24.016 3.073 -23.096 1.00 20.30 H new ATOM 0 HA HIS A 174 -22.373 5.005 -24.441 1.00 20.96 H new ATOM 0 HB2 HIS A 174 -22.484 1.972 -24.576 1.00 21.33 H new ATOM 0 HB3 HIS A 174 -21.222 2.966 -25.276 1.00 21.33 H new ATOM 0 HD2 HIS A 174 -21.503 4.853 -22.246 1.00 21.37 H new ATOM 0 HE1 HIS A 174 -19.402 1.436 -20.887 1.00 21.89 H new ATOM 0 HE2 HIS A 174 -20.063 3.832 -20.335 1.00 21.66 H new ATOM 2732 N HIS A 175 -24.809 3.652 -26.029 1.00 21.78 N ATOM 2733 CA HIS A 175 -25.614 3.802 -27.227 1.00 22.46 C ATOM 2734 C HIS A 175 -26.432 5.076 -27.110 1.00 23.08 C ATOM 2735 O HIS A 175 -27.398 5.138 -26.346 1.00 23.17 O ATOM 2736 CB HIS A 175 -26.540 2.599 -27.433 1.00 22.43 C ATOM 2737 CG HIS A 175 -25.817 1.307 -27.654 1.00 22.30 C ATOM 2738 ND1 HIS A 175 -26.333 0.082 -27.291 1.00 22.32 N ATOM 2739 CD2 HIS A 175 -24.614 1.053 -28.215 1.00 22.27 C ATOM 2740 CE1 HIS A 175 -25.477 -0.867 -27.617 1.00 22.31 C ATOM 2741 NE2 HIS A 175 -24.426 -0.303 -28.180 1.00 22.28 N ATOM 0 H HIS A 175 -25.281 3.170 -25.264 1.00 21.78 H new ATOM 0 HA HIS A 175 -24.952 3.858 -28.091 1.00 22.46 H new ATOM 0 HB2 HIS A 175 -27.187 2.497 -26.561 1.00 22.43 H new ATOM 0 HB3 HIS A 175 -27.187 2.793 -28.289 1.00 22.43 H new ATOM 0 HD2 HIS A 175 -23.928 1.784 -28.617 1.00 22.27 H new ATOM 0 HE1 HIS A 175 -25.613 -1.925 -27.451 1.00 22.31 H new ATOM 0 HE2 HIS A 175 -23.606 -0.797 -28.532 1.00 22.28 H new ATOM 2750 N HIS A 176 -26.026 6.102 -27.836 1.00 23.60 N ATOM 2751 CA HIS A 176 -26.672 7.398 -27.746 1.00 24.32 C ATOM 2752 C HIS A 176 -26.723 8.087 -29.100 1.00 24.96 C ATOM 2753 O HIS A 176 -25.734 8.116 -29.835 1.00 25.33 O ATOM 2754 CB HIS A 176 -25.959 8.296 -26.720 1.00 24.63 C ATOM 2755 CG HIS A 176 -24.469 8.399 -26.906 1.00 24.68 C ATOM 2756 ND1 HIS A 176 -23.867 9.330 -27.726 1.00 24.97 N ATOM 2757 CD2 HIS A 176 -23.459 7.686 -26.353 1.00 24.59 C ATOM 2758 CE1 HIS A 176 -22.557 9.184 -27.669 1.00 25.05 C ATOM 2759 NE2 HIS A 176 -22.286 8.196 -26.845 1.00 24.83 N ATOM 0 H HIS A 176 -25.250 6.062 -28.496 1.00 23.60 H new ATOM 0 HA HIS A 176 -27.696 7.230 -27.411 1.00 24.32 H new ATOM 0 HB2 HIS A 176 -26.388 9.296 -26.772 1.00 24.63 H new ATOM 0 HB3 HIS A 176 -26.161 7.914 -25.719 1.00 24.63 H new ATOM 0 HD1 HIS A 176 -24.358 10.024 -28.289 1.00 24.97 H new ATOM 0 HD2 HIS A 176 -23.559 6.868 -25.655 1.00 24.59 H new ATOM 0 HE1 HIS A 176 -21.831 9.775 -28.207 1.00 25.05 H new ATOM 2768 N HIS A 177 -27.884 8.643 -29.418 1.00 25.19 N ATOM 2769 CA HIS A 177 -28.058 9.416 -30.639 1.00 25.89 C ATOM 2770 C HIS A 177 -27.347 10.754 -30.494 1.00 26.38 C ATOM 2771 O HIS A 177 -26.981 11.391 -31.483 1.00 26.64 O ATOM 2772 CB HIS A 177 -29.549 9.628 -30.929 1.00 26.07 C ATOM 2773 CG HIS A 177 -29.827 10.347 -32.214 1.00 26.41 C ATOM 2774 ND1 HIS A 177 -30.266 11.650 -32.264 1.00 26.57 N ATOM 2775 CD2 HIS A 177 -29.737 9.933 -33.500 1.00 26.71 C ATOM 2776 CE1 HIS A 177 -30.436 12.007 -33.523 1.00 26.95 C ATOM 2777 NE2 HIS A 177 -30.122 10.984 -34.292 1.00 27.04 N ATOM 0 H HIS A 177 -28.724 8.572 -28.843 1.00 25.19 H new ATOM 0 HA HIS A 177 -27.625 8.869 -31.477 1.00 25.89 H new ATOM 0 HB2 HIS A 177 -30.045 8.658 -30.954 1.00 26.07 H new ATOM 0 HB3 HIS A 177 -29.991 10.191 -30.107 1.00 26.07 H new ATOM 0 HD2 HIS A 177 -29.421 8.957 -33.839 1.00 26.71 H new ATOM 0 HE1 HIS A 177 -30.775 12.974 -33.865 1.00 26.95 H new ATOM 0 HE2 HIS A 177 -30.159 10.975 -35.311 1.00 27.04 H new ATOM 2786 N LEU A 178 -27.161 11.162 -29.241 1.00 26.60 N ATOM 2787 CA LEU A 178 -26.393 12.353 -28.915 1.00 27.15 C ATOM 2788 C LEU A 178 -25.010 12.255 -29.545 1.00 27.42 C ATOM 2789 O LEU A 178 -24.403 11.185 -29.533 1.00 27.57 O ATOM 2790 CB LEU A 178 -26.259 12.491 -27.396 1.00 27.23 C ATOM 2791 CG LEU A 178 -27.572 12.416 -26.613 1.00 27.46 C ATOM 2792 CD1 LEU A 178 -27.303 12.453 -25.119 1.00 27.88 C ATOM 2793 CD2 LEU A 178 -28.504 13.551 -27.013 1.00 27.61 C ATOM 0 H LEU A 178 -27.539 10.676 -28.428 1.00 26.60 H new ATOM 0 HA LEU A 178 -26.910 13.229 -29.306 1.00 27.15 H new ATOM 0 HB2 LEU A 178 -25.594 11.707 -27.034 1.00 27.23 H new ATOM 0 HB3 LEU A 178 -25.778 13.444 -27.176 1.00 27.23 H new ATOM 0 HG LEU A 178 -28.059 11.471 -26.855 1.00 27.46 H new ATOM 0 HD11 LEU A 178 -28.248 12.399 -24.578 1.00 27.88 H new ATOM 0 HD12 LEU A 178 -26.676 11.606 -24.841 1.00 27.88 H new ATOM 0 HD13 LEU A 178 -26.792 13.381 -24.864 1.00 27.88 H new ATOM 0 HD21 LEU A 178 -29.431 13.478 -26.444 1.00 27.61 H new ATOM 0 HD22 LEU A 178 -28.024 14.507 -26.804 1.00 27.61 H new ATOM 0 HD23 LEU A 178 -28.725 13.482 -28.078 1.00 27.61 H new ATOM 2805 N GLU A 179 -24.527 13.356 -30.101 1.00 27.58 N ATOM 2806 CA GLU A 179 -23.248 13.360 -30.802 1.00 27.93 C ATOM 2807 C GLU A 179 -22.090 12.934 -29.892 1.00 28.01 C ATOM 2808 O GLU A 179 -21.546 11.838 -30.048 1.00 27.88 O ATOM 2809 CB GLU A 179 -22.982 14.736 -31.430 1.00 28.15 C ATOM 2810 CG GLU A 179 -23.233 15.912 -30.500 1.00 28.46 C ATOM 2811 CD GLU A 179 -22.884 17.238 -31.139 1.00 28.92 C ATOM 2812 OE1 GLU A 179 -21.717 17.666 -31.026 1.00 29.07 O ATOM 2813 OE2 GLU A 179 -23.775 17.866 -31.749 1.00 29.20 O ATOM 0 H GLU A 179 -25.000 14.259 -30.081 1.00 27.58 H new ATOM 0 HA GLU A 179 -23.310 12.621 -31.601 1.00 27.93 H new ATOM 0 HB2 GLU A 179 -21.947 14.772 -31.770 1.00 28.15 H new ATOM 0 HB3 GLU A 179 -23.612 14.846 -32.313 1.00 28.15 H new ATOM 0 HG2 GLU A 179 -24.282 15.920 -30.204 1.00 28.46 H new ATOM 0 HG3 GLU A 179 -22.646 15.784 -29.591 1.00 28.46 H new ATOM 2820 N HIS A 180 -21.731 13.785 -28.939 1.00 28.32 N ATOM 2821 CA HIS A 180 -20.595 13.537 -28.057 1.00 28.53 C ATOM 2822 C HIS A 180 -20.477 14.677 -27.054 1.00 28.95 C ATOM 2823 O HIS A 180 -20.980 15.773 -27.304 1.00 29.23 O ATOM 2824 CB HIS A 180 -19.302 13.418 -28.885 1.00 28.74 C ATOM 2825 CG HIS A 180 -18.062 13.141 -28.088 1.00 28.72 C ATOM 2826 ND1 HIS A 180 -17.057 14.070 -27.917 1.00 28.77 N ATOM 2827 CD2 HIS A 180 -17.657 12.031 -27.428 1.00 28.77 C ATOM 2828 CE1 HIS A 180 -16.094 13.545 -27.188 1.00 28.84 C ATOM 2829 NE2 HIS A 180 -16.433 12.310 -26.877 1.00 28.84 N ATOM 0 H HIS A 180 -22.216 14.663 -28.755 1.00 28.32 H new ATOM 0 HA HIS A 180 -20.749 12.601 -27.519 1.00 28.53 H new ATOM 0 HB2 HIS A 180 -19.430 12.622 -29.618 1.00 28.74 H new ATOM 0 HB3 HIS A 180 -19.159 14.344 -29.442 1.00 28.74 H new ATOM 0 HD2 HIS A 180 -18.197 11.099 -27.350 1.00 28.77 H new ATOM 0 HE1 HIS A 180 -15.181 14.042 -26.895 1.00 28.84 H new ATOM 0 HE2 HIS A 180 -15.875 11.666 -26.317 1.00 28.84 H new ATOM 2838 N HIS A 181 -19.843 14.412 -25.916 1.00 29.09 N ATOM 2839 CA HIS A 181 -19.578 15.450 -24.922 1.00 29.57 C ATOM 2840 C HIS A 181 -18.711 16.558 -25.517 1.00 29.91 C ATOM 2841 O HIS A 181 -18.116 16.393 -26.583 1.00 30.13 O ATOM 2842 CB HIS A 181 -18.883 14.869 -23.685 1.00 29.72 C ATOM 2843 CG HIS A 181 -19.716 13.898 -22.906 1.00 29.81 C ATOM 2844 ND1 HIS A 181 -20.960 14.205 -22.398 1.00 29.72 N ATOM 2845 CD2 HIS A 181 -19.472 12.617 -22.548 1.00 30.08 C ATOM 2846 CE1 HIS A 181 -21.443 13.156 -21.759 1.00 29.92 C ATOM 2847 NE2 HIS A 181 -20.560 12.179 -21.836 1.00 30.14 N ATOM 0 H HIS A 181 -19.502 13.486 -25.658 1.00 29.09 H new ATOM 0 HA HIS A 181 -20.539 15.867 -24.621 1.00 29.57 H new ATOM 0 HB2 HIS A 181 -17.965 14.372 -23.999 1.00 29.72 H new ATOM 0 HB3 HIS A 181 -18.593 15.689 -23.028 1.00 29.72 H new ATOM 0 HD2 HIS A 181 -18.586 12.045 -22.779 1.00 30.08 H new ATOM 0 HE1 HIS A 181 -22.399 13.106 -21.258 1.00 29.92 H new ATOM 0 HE2 HIS A 181 -20.668 11.249 -21.432 1.00 30.14 H new ATOM 2856 N HIS A 182 -18.642 17.683 -24.820 1.00 30.03 N ATOM 2857 CA HIS A 182 -17.871 18.829 -25.284 1.00 30.43 C ATOM 2858 C HIS A 182 -16.378 18.527 -25.275 1.00 30.87 C ATOM 2859 O HIS A 182 -15.750 18.457 -24.218 1.00 31.02 O ATOM 2860 CB HIS A 182 -18.163 20.061 -24.423 1.00 30.52 C ATOM 2861 CG HIS A 182 -19.554 20.589 -24.580 1.00 30.37 C ATOM 2862 ND1 HIS A 182 -20.446 20.705 -23.532 1.00 30.34 N ATOM 2863 CD2 HIS A 182 -20.206 21.046 -25.675 1.00 30.33 C ATOM 2864 CE1 HIS A 182 -21.582 21.206 -23.978 1.00 30.28 C ATOM 2865 NE2 HIS A 182 -21.461 21.421 -25.273 1.00 30.28 N ATOM 0 H HIS A 182 -19.113 17.828 -23.927 1.00 30.03 H new ATOM 0 HA HIS A 182 -18.172 19.038 -26.311 1.00 30.43 H new ATOM 0 HB2 HIS A 182 -17.996 19.809 -23.376 1.00 30.52 H new ATOM 0 HB3 HIS A 182 -17.454 20.848 -24.679 1.00 30.52 H new ATOM 0 HD2 HIS A 182 -19.811 21.104 -26.678 1.00 30.33 H new ATOM 0 HE1 HIS A 182 -22.461 21.406 -23.384 1.00 30.28 H new ATOM 0 HE2 HIS A 182 -22.186 21.805 -25.879 1.00 30.28 H new ATOM 2874 N HIS A 183 -15.821 18.327 -26.459 1.00 31.15 N ATOM 2875 CA HIS A 183 -14.397 18.071 -26.605 1.00 31.67 C ATOM 2876 C HIS A 183 -13.657 19.388 -26.784 1.00 32.06 C ATOM 2877 O HIS A 183 -13.885 20.112 -27.752 1.00 32.12 O ATOM 2878 CB HIS A 183 -14.136 17.143 -27.800 1.00 31.92 C ATOM 2879 CG HIS A 183 -12.685 16.826 -28.024 1.00 31.89 C ATOM 2880 ND1 HIS A 183 -12.065 15.710 -27.504 1.00 31.92 N ATOM 2881 CD2 HIS A 183 -11.731 17.488 -28.721 1.00 31.92 C ATOM 2882 CE1 HIS A 183 -10.798 15.702 -27.868 1.00 31.97 C ATOM 2883 NE2 HIS A 183 -10.567 16.770 -28.607 1.00 31.97 N ATOM 0 H HIS A 183 -16.338 18.337 -27.338 1.00 31.15 H new ATOM 0 HA HIS A 183 -14.032 17.576 -25.705 1.00 31.67 H new ATOM 0 HB2 HIS A 183 -14.681 16.211 -27.649 1.00 31.92 H new ATOM 0 HB3 HIS A 183 -14.539 17.606 -28.701 1.00 31.92 H new ATOM 0 HD2 HIS A 183 -11.862 18.411 -29.266 1.00 31.92 H new ATOM 0 HE1 HIS A 183 -10.071 14.948 -27.605 1.00 31.97 H new ATOM 0 HE2 HIS A 183 -9.671 17.021 -29.025 1.00 31.97 H new ATOM 2892 N HIS A 184 -12.779 19.697 -25.845 1.00 32.40 N ATOM 2893 CA HIS A 184 -12.030 20.945 -25.883 1.00 32.88 C ATOM 2894 C HIS A 184 -10.958 20.898 -26.958 1.00 33.44 C ATOM 2895 O HIS A 184 -10.240 19.905 -27.093 1.00 33.70 O ATOM 2896 CB HIS A 184 -11.393 21.243 -24.526 1.00 33.08 C ATOM 2897 CG HIS A 184 -12.383 21.576 -23.457 1.00 32.98 C ATOM 2898 ND1 HIS A 184 -12.868 22.849 -23.253 1.00 33.08 N ATOM 2899 CD2 HIS A 184 -12.976 20.797 -22.523 1.00 32.87 C ATOM 2900 CE1 HIS A 184 -13.711 22.837 -22.241 1.00 33.03 C ATOM 2901 NE2 HIS A 184 -13.797 21.606 -21.779 1.00 32.91 N ATOM 0 H HIS A 184 -12.566 19.101 -25.045 1.00 32.40 H new ATOM 0 HA HIS A 184 -12.732 21.745 -26.121 1.00 32.88 H new ATOM 0 HB2 HIS A 184 -10.809 20.378 -24.211 1.00 33.08 H new ATOM 0 HB3 HIS A 184 -10.697 22.075 -24.636 1.00 33.08 H new ATOM 0 HD2 HIS A 184 -12.830 19.735 -22.388 1.00 32.87 H new ATOM 0 HE1 HIS A 184 -14.243 23.694 -21.854 1.00 33.03 H new ATOM 0 HE2 HIS A 184 -14.378 21.304 -20.997 1.00 32.91 H new ATOM 2910 N HIS A 185 -10.863 21.969 -27.725 1.00 33.68 N ATOM 2911 CA HIS A 185 -9.865 22.069 -28.775 1.00 34.28 C ATOM 2912 C HIS A 185 -8.624 22.771 -28.248 1.00 34.40 C ATOM 2913 O HIS A 185 -7.682 22.074 -27.823 1.00 34.51 O ATOM 2914 CB HIS A 185 -10.426 22.816 -29.989 1.00 34.66 C ATOM 2915 CG HIS A 185 -11.446 22.032 -30.758 1.00 35.20 C ATOM 2916 ND1 HIS A 185 -11.236 21.583 -32.041 1.00 35.58 N ATOM 2917 CD2 HIS A 185 -12.685 21.612 -30.414 1.00 35.50 C ATOM 2918 CE1 HIS A 185 -12.300 20.923 -32.454 1.00 36.07 C ATOM 2919 NE2 HIS A 185 -13.196 20.923 -31.485 1.00 36.03 N ATOM 2920 OXT HIS A 185 -8.604 24.021 -28.233 1.00 34.44 O ATOM 0 H HIS A 185 -11.468 22.786 -27.640 1.00 33.68 H new ATOM 0 HA HIS A 185 -9.594 21.062 -29.092 1.00 34.28 H new ATOM 0 HB2 HIS A 185 -10.876 23.751 -29.654 1.00 34.66 H new ATOM 0 HB3 HIS A 185 -9.604 23.078 -30.655 1.00 34.66 H new ATOM 0 HD2 HIS A 185 -13.181 21.787 -29.470 1.00 35.50 H new ATOM 0 HE1 HIS A 185 -12.418 20.460 -33.423 1.00 36.07 H new ATOM 0 HE2 HIS A 185 -14.116 20.484 -31.525 1.00 36.03 H new TER 2929 HIS A 185