USER MOD reduce.3.24.130724 H: found=0, std=0, add=1247, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1248 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 143 THR OG1 : rot -39:sc= 0.24 USER MOD Set 1.2: A 144 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 23 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 130 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.00522) USER MOD Set 3.1: A 44 THR OG1 : rot -61:sc= 0.474 USER MOD Set 3.2: A 48 SER OG : rot -163:sc= -1.89 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.455 USER MOD Single : A 22 SER OG : rot -110:sc= -0.624 USER MOD Single : A 28 LYS NZ :NH3+ 177:sc= -0.182 (180deg=-0.185) USER MOD Single : A 29 GLN : amide:sc= -0.281 X(o=-0.28,f=-0.1) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 CYS SG : rot 150:sc= -0.555 USER MOD Single : A 46 ASN : amide:sc= -0.192 X(o=-0.19,f=-0.024) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0.184 K(o=0.18,f=-1.4!) USER MOD Single : A 50 MET CE :methyl 141:sc= -2.32 (180deg=-5.52!) USER MOD Single : A 62 ASN : amide:sc= -1.69! K(o=-1.7!,f=-0.32) USER MOD Single : A 64 ASN : amide:sc= -1.51 K(o=-1.5,f=-0.97) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -114:sc= -5.39! (180deg=-10.9!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -1.34 X(o=-1.3,f=-1.1!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.0666) USER MOD Single : A 90 THR OG1 : rot 54:sc= -1.39! USER MOD Single : A 98 TYR OH : rot 180:sc= -5.22! USER MOD Single : A 101 TYR OH : rot 141:sc= -2.65! USER MOD Single : A 103 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 104 ASN : amide:sc= -0.402 K(o=-0.4,f=-2.8!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot -152:sc= -1.47! USER MOD Single : A 112 GLN : amide:sc= -0.0882 K(o=-0.088,f=-2.5!) USER MOD Single : A 117 GLN : amide:sc= -0.355 K(o=-0.36,f=-3.9!) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot 144:sc= 0 USER MOD Single : A 120 THR OG1 : rot 125:sc= -2.32! USER MOD Single : A 121 LYS NZ :NH3+ 155:sc= -0.0337 (180deg=-0.309) USER MOD Single : A 125 GLN : amide:sc= -0.217 X(o=-0.22,f=-0.034) USER MOD Single : A 128 GLN : amide:sc= -0.531 K(o=-0.53,f=-1.8) USER MOD Single : A 129 LYS NZ :NH3+ 148:sc= -0.672 (180deg=-2.01!) USER MOD Single : A 132 LYS NZ :NH3+ -165:sc=-0.00507 (180deg=-0.193) USER MOD Single : A 133 ASN : amide:sc= -0.253 K(o=-0.25,f=-2.5!) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot -150:sc= -1.21 USER MOD Single : A 145 ASN : amide:sc= -3.63! K(o=-3.6!,f=-1) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 GLN : amide:sc= -0.288 K(o=-0.29,f=-3.6!) USER MOD Single : A 155 GLN : amide:sc= -4.24 K(o=-4.2,f=-9.2!) USER MOD Single : A 156 ASN : amide:sc= -0.589 K(o=-0.59,f=-4.8!) USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 162 MET CE :methyl -136:sc= -5.93! (180deg=-12.3!) USER MOD Single : A 163 THR OG1 : rot 73:sc= 0.954 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-2.6!) USER MOD Single : A 170 SER OG : rot 85:sc= -2.41! USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 SER OG : rot 180:sc= 0.0019 USER MOD Single : A 178 SER OG : rot -59:sc= 1.27 USER MOD Single : A 184 GLN : amide:sc= -0.715 K(o=-0.72,f=-1.5!) USER MOD Single : A 185 MET CE :methyl 139:sc= -2.21 (180deg=-5.13!) USER MOD ----------------------------------------------------------------- ATOM 20 N THR A 21 20.282 10.847 1.401 1.00 0.93 N ATOM 21 CA THR A 21 20.620 9.857 0.339 1.00 0.87 C ATOM 22 C THR A 21 19.351 9.488 -0.433 1.00 0.70 C ATOM 23 O THR A 21 18.260 9.889 -0.081 1.00 0.69 O ATOM 24 CB THR A 21 21.225 8.600 0.978 1.00 0.96 C ATOM 25 OG1 THR A 21 21.210 7.537 0.036 1.00 1.03 O ATOM 26 CG2 THR A 21 20.415 8.198 2.212 1.00 1.03 C ATOM 0 HA THR A 21 21.347 10.292 -0.347 1.00 0.87 H new ATOM 0 HB THR A 21 22.251 8.811 1.278 1.00 0.96 H new ATOM 0 HG1 THR A 21 21.598 6.734 0.443 1.00 1.03 H new ATOM 0 HG21 THR A 21 20.852 7.305 2.659 1.00 1.03 H new ATOM 0 HG22 THR A 21 20.430 9.011 2.938 1.00 1.03 H new ATOM 0 HG23 THR A 21 19.385 7.991 1.920 1.00 1.03 H new ATOM 34 N SER A 22 19.489 8.733 -1.489 1.00 0.58 N ATOM 35 CA SER A 22 18.296 8.343 -2.291 1.00 0.42 C ATOM 36 C SER A 22 17.242 7.699 -1.384 1.00 0.42 C ATOM 37 O SER A 22 16.062 7.966 -1.503 1.00 0.27 O ATOM 38 CB SER A 22 18.716 7.343 -3.369 1.00 0.36 C ATOM 39 OG SER A 22 18.810 6.046 -2.795 1.00 2.30 O ATOM 0 H SER A 22 20.378 8.369 -1.831 1.00 0.58 H new ATOM 0 HA SER A 22 17.871 9.232 -2.757 1.00 0.42 H new ATOM 0 HB2 SER A 22 17.991 7.342 -4.183 1.00 0.36 H new ATOM 0 HB3 SER A 22 19.675 7.634 -3.798 1.00 0.36 H new ATOM 0 HG SER A 22 19.751 5.774 -2.754 1.00 2.30 H new ATOM 45 N SER A 23 17.653 6.849 -0.483 1.00 0.62 N ATOM 46 CA SER A 23 16.669 6.188 0.423 1.00 0.68 C ATOM 47 C SER A 23 15.964 7.243 1.277 1.00 0.67 C ATOM 48 O SER A 23 14.757 7.233 1.415 1.00 0.59 O ATOM 49 CB SER A 23 17.399 5.196 1.330 1.00 0.90 C ATOM 50 OG SER A 23 16.453 4.314 1.917 1.00 1.25 O ATOM 0 H SER A 23 18.627 6.583 -0.335 1.00 0.62 H new ATOM 0 HA SER A 23 15.928 5.657 -0.174 1.00 0.68 H new ATOM 0 HB2 SER A 23 18.132 4.631 0.755 1.00 0.90 H new ATOM 0 HB3 SER A 23 17.946 5.730 2.107 1.00 0.90 H new ATOM 0 HG SER A 23 16.917 3.676 2.498 1.00 1.25 H new ATOM 56 N GLU A 24 16.700 8.158 1.848 1.00 0.81 N ATOM 57 CA GLU A 24 16.054 9.210 2.681 1.00 0.87 C ATOM 58 C GLU A 24 15.016 9.940 1.828 1.00 0.69 C ATOM 59 O GLU A 24 14.034 10.454 2.325 1.00 0.63 O ATOM 60 CB GLU A 24 17.111 10.201 3.174 1.00 1.08 C ATOM 61 CG GLU A 24 16.615 10.879 4.453 1.00 0.87 C ATOM 62 CD GLU A 24 17.648 10.686 5.564 1.00 1.70 C ATOM 63 OE1 GLU A 24 18.828 10.805 5.276 1.00 2.52 O ATOM 64 OE2 GLU A 24 17.241 10.424 6.684 1.00 2.08 O ATOM 0 H GLU A 24 17.715 8.222 1.774 1.00 0.81 H new ATOM 0 HA GLU A 24 15.570 8.755 3.545 1.00 0.87 H new ATOM 0 HB2 GLU A 24 18.050 9.682 3.365 1.00 1.08 H new ATOM 0 HB3 GLU A 24 17.310 10.949 2.407 1.00 1.08 H new ATOM 0 HG2 GLU A 24 16.451 11.942 4.274 1.00 0.87 H new ATOM 0 HG3 GLU A 24 15.657 10.455 4.754 1.00 0.87 H new ATOM 71 N ARG A 25 15.221 9.971 0.538 1.00 0.65 N ATOM 72 CA ARG A 25 14.242 10.645 -0.357 1.00 0.54 C ATOM 73 C ARG A 25 13.012 9.755 -0.488 1.00 0.33 C ATOM 74 O ARG A 25 11.892 10.224 -0.542 1.00 0.38 O ATOM 75 CB ARG A 25 14.869 10.851 -1.736 1.00 0.56 C ATOM 76 CG ARG A 25 14.159 11.999 -2.455 1.00 0.77 C ATOM 77 CD ARG A 25 15.175 13.088 -2.798 1.00 0.48 C ATOM 78 NE ARG A 25 14.729 13.817 -4.018 1.00 0.88 N ATOM 79 CZ ARG A 25 15.281 14.955 -4.332 1.00 1.00 C ATOM 80 NH1 ARG A 25 16.567 15.120 -4.183 1.00 1.36 N ATOM 81 NH2 ARG A 25 14.548 15.930 -4.796 1.00 2.13 N ATOM 0 H ARG A 25 16.026 9.558 0.067 1.00 0.65 H new ATOM 0 HA ARG A 25 13.962 11.613 0.058 1.00 0.54 H new ATOM 0 HB2 ARG A 25 15.931 11.074 -1.634 1.00 0.56 H new ATOM 0 HB3 ARG A 25 14.790 9.936 -2.323 1.00 0.56 H new ATOM 0 HG2 ARG A 25 13.681 11.633 -3.364 1.00 0.77 H new ATOM 0 HG3 ARG A 25 13.371 12.407 -1.822 1.00 0.77 H new ATOM 0 HD2 ARG A 25 15.276 13.782 -1.963 1.00 0.48 H new ATOM 0 HD3 ARG A 25 16.157 12.645 -2.965 1.00 0.48 H new ATOM 0 HE ARG A 25 13.993 13.426 -4.606 1.00 0.88 H new ATOM 0 HH11 ARG A 25 17.140 14.358 -3.821 1.00 1.36 H new ATOM 0 HH12 ARG A 25 16.999 16.011 -4.429 1.00 1.36 H new ATOM 0 HH21 ARG A 25 13.543 15.801 -4.913 1.00 2.13 H new ATOM 0 HH22 ARG A 25 14.980 16.821 -5.042 1.00 2.13 H new ATOM 95 N ILE A 26 13.211 8.464 -0.529 1.00 0.26 N ATOM 96 CA ILE A 26 12.055 7.537 -0.645 1.00 0.19 C ATOM 97 C ILE A 26 11.109 7.792 0.536 1.00 0.16 C ATOM 98 O ILE A 26 9.906 7.807 0.385 1.00 0.24 O ATOM 99 CB ILE A 26 12.566 6.080 -0.652 1.00 0.37 C ATOM 100 CG1 ILE A 26 13.103 5.760 -2.062 1.00 0.38 C ATOM 101 CG2 ILE A 26 11.431 5.102 -0.289 1.00 0.61 C ATOM 102 CD1 ILE A 26 13.341 4.252 -2.229 1.00 0.82 C ATOM 0 H ILE A 26 14.126 8.014 -0.487 1.00 0.26 H new ATOM 0 HA ILE A 26 11.512 7.707 -1.575 1.00 0.19 H new ATOM 0 HB ILE A 26 13.357 5.968 0.090 1.00 0.37 H new ATOM 0 HG12 ILE A 26 12.393 6.105 -2.813 1.00 0.38 H new ATOM 0 HG13 ILE A 26 14.034 6.300 -2.232 1.00 0.38 H new ATOM 0 HG21 ILE A 26 11.813 4.081 -0.300 1.00 0.61 H new ATOM 0 HG22 ILE A 26 11.052 5.337 0.706 1.00 0.61 H new ATOM 0 HG23 ILE A 26 10.624 5.195 -1.016 1.00 0.61 H new ATOM 0 HD11 ILE A 26 13.719 4.052 -3.231 1.00 0.82 H new ATOM 0 HD12 ILE A 26 14.070 3.915 -1.492 1.00 0.82 H new ATOM 0 HD13 ILE A 26 12.403 3.717 -2.082 1.00 0.82 H new ATOM 114 N ASP A 27 11.644 8.000 1.707 1.00 0.20 N ATOM 115 CA ASP A 27 10.767 8.260 2.880 1.00 0.18 C ATOM 116 C ASP A 27 9.943 9.522 2.617 1.00 0.16 C ATOM 117 O ASP A 27 8.755 9.565 2.870 1.00 0.23 O ATOM 118 CB ASP A 27 11.627 8.462 4.131 1.00 0.24 C ATOM 119 CG ASP A 27 10.724 8.770 5.327 1.00 0.37 C ATOM 120 OD1 ASP A 27 10.288 9.903 5.440 1.00 0.60 O ATOM 121 OD2 ASP A 27 10.481 7.864 6.109 1.00 1.22 O ATOM 0 H ASP A 27 12.645 8.001 1.901 1.00 0.20 H new ATOM 0 HA ASP A 27 10.102 7.411 3.036 1.00 0.18 H new ATOM 0 HB2 ASP A 27 12.217 7.567 4.328 1.00 0.24 H new ATOM 0 HB3 ASP A 27 12.331 9.279 3.973 1.00 0.24 H new ATOM 126 N LYS A 28 10.568 10.552 2.116 1.00 0.25 N ATOM 127 CA LYS A 28 9.831 11.812 1.841 1.00 0.37 C ATOM 128 C LYS A 28 8.724 11.565 0.815 1.00 0.30 C ATOM 129 O LYS A 28 7.745 12.281 0.765 1.00 0.49 O ATOM 130 CB LYS A 28 10.805 12.860 1.290 1.00 0.53 C ATOM 131 CG LYS A 28 10.088 14.206 1.151 1.00 0.58 C ATOM 132 CD LYS A 28 9.448 14.577 2.490 1.00 1.48 C ATOM 133 CE LYS A 28 9.073 16.061 2.491 1.00 1.73 C ATOM 134 NZ LYS A 28 7.682 16.220 3.002 1.00 2.88 N ATOM 0 H LYS A 28 11.561 10.573 1.885 1.00 0.25 H new ATOM 0 HA LYS A 28 9.384 12.170 2.768 1.00 0.37 H new ATOM 0 HB2 LYS A 28 11.662 12.960 1.956 1.00 0.53 H new ATOM 0 HB3 LYS A 28 11.190 12.540 0.322 1.00 0.53 H new ATOM 0 HG2 LYS A 28 10.795 14.978 0.846 1.00 0.58 H new ATOM 0 HG3 LYS A 28 9.326 14.147 0.374 1.00 0.58 H new ATOM 0 HD2 LYS A 28 8.560 13.968 2.661 1.00 1.48 H new ATOM 0 HD3 LYS A 28 10.140 14.367 3.305 1.00 1.48 H new ATOM 0 HE2 LYS A 28 9.768 16.623 3.115 1.00 1.73 H new ATOM 0 HE3 LYS A 28 9.150 16.468 1.483 1.00 1.73 H new ATOM 0 HZ1 LYS A 28 7.444 17.231 3.051 1.00 2.88 H new ATOM 0 HZ2 LYS A 28 7.019 15.739 2.361 1.00 2.88 H new ATOM 0 HZ3 LYS A 28 7.611 15.801 3.951 1.00 2.88 H new ATOM 148 N GLN A 29 8.871 10.567 -0.010 1.00 0.08 N ATOM 149 CA GLN A 29 7.825 10.294 -1.035 1.00 0.12 C ATOM 150 C GLN A 29 6.685 9.481 -0.413 1.00 0.13 C ATOM 151 O GLN A 29 5.553 9.563 -0.845 1.00 0.06 O ATOM 152 CB GLN A 29 8.442 9.516 -2.197 1.00 0.22 C ATOM 153 CG GLN A 29 8.331 10.339 -3.483 1.00 0.71 C ATOM 154 CD GLN A 29 9.679 10.998 -3.784 1.00 0.84 C ATOM 155 OE1 GLN A 29 9.751 12.194 -3.990 1.00 1.81 O ATOM 156 NE2 GLN A 29 10.758 10.264 -3.816 1.00 1.94 N ATOM 0 H GLN A 29 9.668 9.930 -0.020 1.00 0.08 H new ATOM 0 HA GLN A 29 7.426 11.239 -1.403 1.00 0.12 H new ATOM 0 HB2 GLN A 29 9.488 9.294 -1.985 1.00 0.22 H new ATOM 0 HB3 GLN A 29 7.932 8.561 -2.320 1.00 0.22 H new ATOM 0 HG2 GLN A 29 8.034 9.698 -4.313 1.00 0.71 H new ATOM 0 HG3 GLN A 29 7.558 11.100 -3.375 1.00 0.71 H new ATOM 0 HE21 GLN A 29 10.698 9.261 -3.643 1.00 1.94 H new ATOM 0 HE22 GLN A 29 11.662 10.694 -4.014 1.00 1.94 H new ATOM 165 N ILE A 30 6.961 8.708 0.606 1.00 0.22 N ATOM 166 CA ILE A 30 5.866 7.916 1.239 1.00 0.23 C ATOM 167 C ILE A 30 4.953 8.876 1.998 1.00 0.24 C ATOM 168 O ILE A 30 3.746 8.741 1.989 1.00 0.25 O ATOM 169 CB ILE A 30 6.439 6.894 2.217 1.00 0.30 C ATOM 170 CG1 ILE A 30 7.491 6.018 1.512 1.00 0.35 C ATOM 171 CG2 ILE A 30 5.308 6.030 2.765 1.00 0.26 C ATOM 172 CD1 ILE A 30 6.813 5.005 0.580 1.00 0.83 C ATOM 0 H ILE A 30 7.885 8.592 1.022 1.00 0.22 H new ATOM 0 HA ILE A 30 5.312 7.385 0.465 1.00 0.23 H new ATOM 0 HB ILE A 30 6.924 7.414 3.043 1.00 0.30 H new ATOM 0 HG12 ILE A 30 8.172 6.648 0.940 1.00 0.35 H new ATOM 0 HG13 ILE A 30 8.091 5.492 2.255 1.00 0.35 H new ATOM 0 HG21 ILE A 30 5.714 5.299 3.464 1.00 0.26 H new ATOM 0 HG22 ILE A 30 4.585 6.662 3.280 1.00 0.26 H new ATOM 0 HG23 ILE A 30 4.815 5.511 1.943 1.00 0.26 H new ATOM 0 HD11 ILE A 30 7.573 4.395 0.091 1.00 0.83 H new ATOM 0 HD12 ILE A 30 6.151 4.363 1.161 1.00 0.83 H new ATOM 0 HD13 ILE A 30 6.233 5.536 -0.175 1.00 0.83 H new ATOM 184 N ARG A 31 5.524 9.858 2.645 1.00 0.24 N ATOM 185 CA ARG A 31 4.698 10.845 3.389 1.00 0.25 C ATOM 186 C ARG A 31 3.683 11.451 2.416 1.00 0.26 C ATOM 187 O ARG A 31 2.585 11.826 2.784 1.00 0.27 O ATOM 188 CB ARG A 31 5.612 11.940 3.940 1.00 0.24 C ATOM 189 CG ARG A 31 4.803 12.895 4.814 1.00 0.41 C ATOM 190 CD ARG A 31 5.634 14.147 5.107 1.00 0.84 C ATOM 191 NE ARG A 31 6.857 13.765 5.869 1.00 1.94 N ATOM 192 CZ ARG A 31 7.232 14.475 6.898 1.00 2.24 C ATOM 193 NH1 ARG A 31 7.537 15.735 6.745 1.00 2.26 N ATOM 194 NH2 ARG A 31 7.305 13.925 8.079 1.00 3.05 N ATOM 0 H ARG A 31 6.531 10.017 2.688 1.00 0.24 H new ATOM 0 HA ARG A 31 4.175 10.367 4.217 1.00 0.25 H new ATOM 0 HB2 ARG A 31 6.419 11.495 4.522 1.00 0.24 H new ATOM 0 HB3 ARG A 31 6.075 12.487 3.119 1.00 0.24 H new ATOM 0 HG2 ARG A 31 3.877 13.170 4.310 1.00 0.41 H new ATOM 0 HG3 ARG A 31 4.524 12.404 5.746 1.00 0.41 H new ATOM 0 HD2 ARG A 31 5.912 14.638 4.175 1.00 0.84 H new ATOM 0 HD3 ARG A 31 5.044 14.862 5.680 1.00 0.84 H new ATOM 0 HE ARG A 31 7.400 12.949 5.586 1.00 1.94 H new ATOM 0 HH11 ARG A 31 7.482 16.164 5.821 1.00 2.26 H new ATOM 0 HH12 ARG A 31 7.830 16.290 7.549 1.00 2.26 H new ATOM 0 HH21 ARG A 31 7.069 12.940 8.198 1.00 3.05 H new ATOM 0 HH22 ARG A 31 7.598 14.480 8.883 1.00 3.05 H new ATOM 208 N TYR A 32 4.043 11.515 1.163 1.00 0.27 N ATOM 209 CA TYR A 32 3.116 12.057 0.140 1.00 0.31 C ATOM 210 C TYR A 32 2.055 10.998 -0.137 1.00 0.34 C ATOM 211 O TYR A 32 0.890 11.294 -0.324 1.00 0.39 O ATOM 212 CB TYR A 32 3.901 12.345 -1.140 1.00 0.30 C ATOM 213 CG TYR A 32 3.192 13.401 -1.948 1.00 0.19 C ATOM 214 CD1 TYR A 32 3.004 14.679 -1.414 1.00 1.06 C ATOM 215 CD2 TYR A 32 2.729 13.102 -3.233 1.00 1.45 C ATOM 216 CE1 TYR A 32 2.351 15.662 -2.166 1.00 0.79 C ATOM 217 CE2 TYR A 32 2.077 14.084 -3.987 1.00 1.76 C ATOM 218 CZ TYR A 32 1.887 15.364 -3.454 1.00 0.72 C ATOM 219 OH TYR A 32 1.245 16.333 -4.196 1.00 1.02 O ATOM 0 H TYR A 32 4.949 11.211 0.805 1.00 0.27 H new ATOM 0 HA TYR A 32 2.648 12.978 0.488 1.00 0.31 H new ATOM 0 HB2 TYR A 32 4.908 12.679 -0.892 1.00 0.30 H new ATOM 0 HB3 TYR A 32 4.004 11.433 -1.727 1.00 0.30 H new ATOM 0 HD1 TYR A 32 3.363 14.908 -0.421 1.00 1.06 H new ATOM 0 HD2 TYR A 32 2.875 12.114 -3.643 1.00 1.45 H new ATOM 0 HE1 TYR A 32 2.205 16.650 -1.754 1.00 0.79 H new ATOM 0 HE2 TYR A 32 1.720 13.854 -4.980 1.00 1.76 H new ATOM 0 HH TYR A 32 0.989 15.962 -5.066 1.00 1.02 H new ATOM 229 N ILE A 33 2.456 9.755 -0.152 1.00 0.31 N ATOM 230 CA ILE A 33 1.486 8.658 -0.401 1.00 0.35 C ATOM 231 C ILE A 33 0.338 8.760 0.603 1.00 0.42 C ATOM 232 O ILE A 33 -0.817 8.640 0.254 1.00 0.47 O ATOM 233 CB ILE A 33 2.181 7.305 -0.238 1.00 0.33 C ATOM 234 CG1 ILE A 33 3.348 7.209 -1.222 1.00 0.27 C ATOM 235 CG2 ILE A 33 1.179 6.188 -0.529 1.00 0.38 C ATOM 236 CD1 ILE A 33 4.038 5.851 -1.071 1.00 0.26 C ATOM 0 H ILE A 33 3.419 9.454 -0.001 1.00 0.31 H new ATOM 0 HA ILE A 33 1.098 8.744 -1.416 1.00 0.35 H new ATOM 0 HB ILE A 33 2.557 7.207 0.780 1.00 0.33 H new ATOM 0 HG12 ILE A 33 2.987 7.333 -2.243 1.00 0.27 H new ATOM 0 HG13 ILE A 33 4.060 8.013 -1.036 1.00 0.27 H new ATOM 0 HG21 ILE A 33 1.669 5.221 -0.414 1.00 0.38 H new ATOM 0 HG22 ILE A 33 0.344 6.257 0.169 1.00 0.38 H new ATOM 0 HG23 ILE A 33 0.808 6.288 -1.549 1.00 0.38 H new ATOM 0 HD11 ILE A 33 4.869 5.785 -1.773 1.00 0.26 H new ATOM 0 HD12 ILE A 33 4.414 5.745 -0.053 1.00 0.26 H new ATOM 0 HD13 ILE A 33 3.323 5.055 -1.279 1.00 0.26 H new ATOM 248 N LEU A 34 0.652 8.978 1.850 1.00 0.43 N ATOM 249 CA LEU A 34 -0.413 9.084 2.886 1.00 0.49 C ATOM 250 C LEU A 34 -1.260 10.335 2.639 1.00 0.51 C ATOM 251 O LEU A 34 -2.467 10.307 2.768 1.00 0.53 O ATOM 252 CB LEU A 34 0.233 9.171 4.269 1.00 0.55 C ATOM 253 CG LEU A 34 0.296 7.777 4.895 1.00 0.49 C ATOM 254 CD1 LEU A 34 1.673 7.164 4.641 1.00 0.67 C ATOM 255 CD2 LEU A 34 0.059 7.883 6.403 1.00 0.60 C ATOM 0 H LEU A 34 1.605 9.088 2.197 1.00 0.43 H new ATOM 0 HA LEU A 34 -1.054 8.204 2.834 1.00 0.49 H new ATOM 0 HB2 LEU A 34 1.236 9.589 4.187 1.00 0.55 H new ATOM 0 HB3 LEU A 34 -0.341 9.842 4.908 1.00 0.55 H new ATOM 0 HG LEU A 34 -0.472 7.145 4.448 1.00 0.49 H new ATOM 0 HD11 LEU A 34 1.717 6.171 5.087 1.00 0.67 H new ATOM 0 HD12 LEU A 34 1.845 7.087 3.567 1.00 0.67 H new ATOM 0 HD13 LEU A 34 2.441 7.796 5.087 1.00 0.67 H new ATOM 0 HD21 LEU A 34 0.104 6.889 6.849 1.00 0.60 H new ATOM 0 HD22 LEU A 34 0.827 8.516 6.848 1.00 0.60 H new ATOM 0 HD23 LEU A 34 -0.923 8.319 6.587 1.00 0.60 H new ATOM 267 N ASP A 35 -0.646 11.434 2.278 1.00 0.51 N ATOM 268 CA ASP A 35 -1.441 12.674 2.019 1.00 0.53 C ATOM 269 C ASP A 35 -2.545 12.345 1.022 1.00 0.47 C ATOM 270 O ASP A 35 -3.645 12.856 1.100 1.00 0.43 O ATOM 271 CB ASP A 35 -0.529 13.759 1.444 1.00 0.54 C ATOM 272 CG ASP A 35 -0.074 14.694 2.566 1.00 0.51 C ATOM 273 OD1 ASP A 35 0.420 14.194 3.564 1.00 1.45 O ATOM 274 OD2 ASP A 35 -0.226 15.894 2.409 1.00 0.69 O ATOM 0 H ASP A 35 0.362 11.527 2.152 1.00 0.51 H new ATOM 0 HA ASP A 35 -1.878 13.038 2.949 1.00 0.53 H new ATOM 0 HB2 ASP A 35 0.337 13.303 0.963 1.00 0.54 H new ATOM 0 HB3 ASP A 35 -1.059 14.325 0.678 1.00 0.54 H new ATOM 279 N GLY A 36 -2.266 11.471 0.102 1.00 0.47 N ATOM 280 CA GLY A 36 -3.304 11.080 -0.882 1.00 0.41 C ATOM 281 C GLY A 36 -4.335 10.208 -0.166 1.00 0.40 C ATOM 282 O GLY A 36 -5.524 10.408 -0.286 1.00 0.37 O ATOM 0 H GLY A 36 -1.363 11.010 -0.011 1.00 0.47 H new ATOM 0 HA2 GLY A 36 -3.781 11.965 -1.303 1.00 0.41 H new ATOM 0 HA3 GLY A 36 -2.855 10.534 -1.712 1.00 0.41 H new ATOM 286 N ILE A 37 -3.874 9.241 0.578 1.00 0.42 N ATOM 287 CA ILE A 37 -4.799 8.331 1.315 1.00 0.41 C ATOM 288 C ILE A 37 -5.773 9.126 2.189 1.00 0.43 C ATOM 289 O ILE A 37 -6.834 8.642 2.531 1.00 0.40 O ATOM 290 CB ILE A 37 -3.982 7.401 2.206 1.00 0.48 C ATOM 291 CG1 ILE A 37 -3.026 6.579 1.340 1.00 0.43 C ATOM 292 CG2 ILE A 37 -4.922 6.465 2.967 1.00 0.53 C ATOM 293 CD1 ILE A 37 -3.822 5.736 0.343 1.00 0.36 C ATOM 0 H ILE A 37 -2.883 9.039 0.709 1.00 0.42 H new ATOM 0 HA ILE A 37 -5.372 7.758 0.586 1.00 0.41 H new ATOM 0 HB ILE A 37 -3.407 7.991 2.920 1.00 0.48 H new ATOM 0 HG12 ILE A 37 -2.344 7.241 0.807 1.00 0.43 H new ATOM 0 HG13 ILE A 37 -2.415 5.933 1.970 1.00 0.43 H new ATOM 0 HG21 ILE A 37 -4.337 5.801 3.603 1.00 0.53 H new ATOM 0 HG22 ILE A 37 -5.601 7.054 3.584 1.00 0.53 H new ATOM 0 HG23 ILE A 37 -5.499 5.872 2.257 1.00 0.53 H new ATOM 0 HD11 ILE A 37 -3.135 5.153 -0.271 1.00 0.36 H new ATOM 0 HD12 ILE A 37 -4.486 5.062 0.885 1.00 0.36 H new ATOM 0 HD13 ILE A 37 -4.413 6.391 -0.297 1.00 0.36 H new ATOM 305 N SER A 38 -5.442 10.334 2.552 1.00 0.47 N ATOM 306 CA SER A 38 -6.375 11.124 3.392 1.00 0.48 C ATOM 307 C SER A 38 -7.609 11.395 2.553 1.00 0.39 C ATOM 308 O SER A 38 -8.735 11.232 2.989 1.00 0.35 O ATOM 309 CB SER A 38 -5.722 12.447 3.797 1.00 0.57 C ATOM 310 OG SER A 38 -5.467 12.436 5.196 1.00 0.43 O ATOM 0 H SER A 38 -4.571 10.803 2.304 1.00 0.47 H new ATOM 0 HA SER A 38 -6.633 10.581 4.301 1.00 0.48 H new ATOM 0 HB2 SER A 38 -4.792 12.590 3.247 1.00 0.57 H new ATOM 0 HB3 SER A 38 -6.375 13.281 3.541 1.00 0.57 H new ATOM 0 HG SER A 38 -5.047 13.282 5.459 1.00 0.43 H new ATOM 316 N ALA A 39 -7.394 11.781 1.332 1.00 0.38 N ATOM 317 CA ALA A 39 -8.536 12.044 0.435 1.00 0.33 C ATOM 318 C ALA A 39 -9.079 10.712 -0.090 1.00 0.24 C ATOM 319 O ALA A 39 -10.177 10.640 -0.603 1.00 0.19 O ATOM 320 CB ALA A 39 -8.084 12.919 -0.735 1.00 0.40 C ATOM 0 H ALA A 39 -6.473 11.925 0.919 1.00 0.38 H new ATOM 0 HA ALA A 39 -9.320 12.566 0.984 1.00 0.33 H new ATOM 0 HB1 ALA A 39 -8.931 13.110 -1.394 1.00 0.40 H new ATOM 0 HB2 ALA A 39 -7.699 13.865 -0.354 1.00 0.40 H new ATOM 0 HB3 ALA A 39 -7.300 12.406 -1.291 1.00 0.40 H new ATOM 326 N LEU A 40 -8.322 9.650 0.043 1.00 0.25 N ATOM 327 CA LEU A 40 -8.809 8.329 -0.442 1.00 0.18 C ATOM 328 C LEU A 40 -9.427 7.543 0.716 1.00 0.18 C ATOM 329 O LEU A 40 -9.949 6.465 0.526 1.00 0.17 O ATOM 330 CB LEU A 40 -7.648 7.521 -1.026 1.00 0.22 C ATOM 331 CG LEU A 40 -6.874 8.380 -2.025 1.00 0.25 C ATOM 332 CD1 LEU A 40 -5.474 7.798 -2.223 1.00 0.52 C ATOM 333 CD2 LEU A 40 -7.614 8.389 -3.360 1.00 0.20 C ATOM 0 H LEU A 40 -7.393 9.644 0.465 1.00 0.25 H new ATOM 0 HA LEU A 40 -9.560 8.499 -1.214 1.00 0.18 H new ATOM 0 HB2 LEU A 40 -6.985 7.189 -0.227 1.00 0.22 H new ATOM 0 HB3 LEU A 40 -8.027 6.626 -1.519 1.00 0.22 H new ATOM 0 HG LEU A 40 -6.792 9.398 -1.644 1.00 0.25 H new ATOM 0 HD11 LEU A 40 -4.923 8.411 -2.936 1.00 0.52 H new ATOM 0 HD12 LEU A 40 -4.946 7.787 -1.269 1.00 0.52 H new ATOM 0 HD13 LEU A 40 -5.554 6.780 -2.605 1.00 0.52 H new ATOM 0 HD21 LEU A 40 -7.065 9.001 -4.076 1.00 0.20 H new ATOM 0 HD22 LEU A 40 -7.693 7.370 -3.739 1.00 0.20 H new ATOM 0 HD23 LEU A 40 -8.613 8.803 -3.220 1.00 0.20 H new ATOM 345 N ARG A 41 -9.369 8.059 1.916 1.00 0.23 N ATOM 346 CA ARG A 41 -9.953 7.314 3.063 1.00 0.24 C ATOM 347 C ARG A 41 -11.079 8.128 3.701 1.00 0.22 C ATOM 348 O ARG A 41 -11.828 7.625 4.511 1.00 0.36 O ATOM 349 CB ARG A 41 -8.870 7.050 4.105 1.00 0.55 C ATOM 350 CG ARG A 41 -9.326 5.924 5.031 1.00 0.58 C ATOM 351 CD ARG A 41 -8.377 5.832 6.225 1.00 1.11 C ATOM 352 NE ARG A 41 -9.157 5.951 7.490 1.00 1.15 N ATOM 353 CZ ARG A 41 -8.553 6.218 8.620 1.00 1.40 C ATOM 354 NH1 ARG A 41 -7.256 6.076 8.733 1.00 1.91 N ATOM 355 NH2 ARG A 41 -9.250 6.624 9.646 1.00 1.95 N ATOM 0 H ARG A 41 -8.945 8.957 2.147 1.00 0.23 H new ATOM 0 HA ARG A 41 -10.355 6.368 2.701 1.00 0.24 H new ATOM 0 HB2 ARG A 41 -7.936 6.777 3.614 1.00 0.55 H new ATOM 0 HB3 ARG A 41 -8.675 7.954 4.681 1.00 0.55 H new ATOM 0 HG2 ARG A 41 -10.343 6.111 5.375 1.00 0.58 H new ATOM 0 HG3 ARG A 41 -9.341 4.978 4.491 1.00 0.58 H new ATOM 0 HD2 ARG A 41 -7.840 4.884 6.204 1.00 1.11 H new ATOM 0 HD3 ARG A 41 -7.629 6.623 6.171 1.00 1.11 H new ATOM 0 HE ARG A 41 -10.169 5.823 7.475 1.00 1.15 H new ATOM 0 HH11 ARG A 41 -6.707 5.755 7.936 1.00 1.91 H new ATOM 0 HH12 ARG A 41 -6.795 6.287 9.618 1.00 1.91 H new ATOM 0 HH21 ARG A 41 -10.261 6.732 9.565 1.00 1.95 H new ATOM 0 HH22 ARG A 41 -8.784 6.833 10.529 1.00 1.95 H new ATOM 369 N LYS A 42 -11.220 9.374 3.350 1.00 0.23 N ATOM 370 CA LYS A 42 -12.314 10.177 3.949 1.00 0.44 C ATOM 371 C LYS A 42 -13.633 9.729 3.329 1.00 0.51 C ATOM 372 O LYS A 42 -14.670 9.729 3.964 1.00 0.62 O ATOM 373 CB LYS A 42 -12.086 11.660 3.651 1.00 0.66 C ATOM 374 CG LYS A 42 -12.370 12.485 4.908 1.00 0.39 C ATOM 375 CD LYS A 42 -13.558 13.413 4.653 1.00 1.79 C ATOM 376 CE LYS A 42 -14.476 13.413 5.878 1.00 2.70 C ATOM 377 NZ LYS A 42 -15.438 14.547 5.776 1.00 3.69 N ATOM 0 H LYS A 42 -10.629 9.866 2.680 1.00 0.23 H new ATOM 0 HA LYS A 42 -12.337 10.033 5.029 1.00 0.44 H new ATOM 0 HB2 LYS A 42 -11.060 11.822 3.322 1.00 0.66 H new ATOM 0 HB3 LYS A 42 -12.736 11.982 2.838 1.00 0.66 H new ATOM 0 HG2 LYS A 42 -12.585 11.825 5.748 1.00 0.39 H new ATOM 0 HG3 LYS A 42 -11.490 13.069 5.179 1.00 0.39 H new ATOM 0 HD2 LYS A 42 -13.206 14.424 4.449 1.00 1.79 H new ATOM 0 HD3 LYS A 42 -14.109 13.083 3.772 1.00 1.79 H new ATOM 0 HE2 LYS A 42 -15.016 12.468 5.941 1.00 2.70 H new ATOM 0 HE3 LYS A 42 -13.885 13.504 6.789 1.00 2.70 H new ATOM 0 HZ1 LYS A 42 -16.062 14.548 6.608 1.00 3.69 H new ATOM 0 HZ2 LYS A 42 -14.914 15.444 5.735 1.00 3.69 H new ATOM 0 HZ3 LYS A 42 -16.010 14.441 4.914 1.00 3.69 H new ATOM 391 N GLU A 43 -13.596 9.336 2.087 1.00 0.60 N ATOM 392 CA GLU A 43 -14.834 8.892 1.412 1.00 0.87 C ATOM 393 C GLU A 43 -15.070 7.411 1.685 1.00 0.82 C ATOM 394 O GLU A 43 -16.126 7.018 2.157 1.00 0.86 O ATOM 395 CB GLU A 43 -14.691 9.113 -0.096 1.00 1.09 C ATOM 396 CG GLU A 43 -14.683 10.613 -0.394 1.00 1.35 C ATOM 397 CD GLU A 43 -13.428 10.966 -1.194 1.00 2.86 C ATOM 398 OE1 GLU A 43 -13.103 10.224 -2.106 1.00 3.12 O ATOM 399 OE2 GLU A 43 -12.814 11.973 -0.881 1.00 4.08 O ATOM 0 H GLU A 43 -12.754 9.305 1.512 1.00 0.60 H new ATOM 0 HA GLU A 43 -15.679 9.466 1.792 1.00 0.87 H new ATOM 0 HB2 GLU A 43 -13.769 8.655 -0.455 1.00 1.09 H new ATOM 0 HB3 GLU A 43 -15.514 8.631 -0.624 1.00 1.09 H new ATOM 0 HG2 GLU A 43 -15.575 10.888 -0.956 1.00 1.35 H new ATOM 0 HG3 GLU A 43 -14.706 11.180 0.537 1.00 1.35 H new ATOM 406 N THR A 44 -14.097 6.587 1.380 1.00 0.79 N ATOM 407 CA THR A 44 -14.255 5.123 1.600 1.00 0.86 C ATOM 408 C THR A 44 -13.871 4.757 3.035 1.00 0.78 C ATOM 409 O THR A 44 -13.051 3.892 3.272 1.00 1.03 O ATOM 410 CB THR A 44 -13.368 4.355 0.617 1.00 0.94 C ATOM 411 OG1 THR A 44 -13.575 2.960 0.791 1.00 1.19 O ATOM 412 CG2 THR A 44 -11.901 4.690 0.879 1.00 0.79 C ATOM 0 H THR A 44 -13.199 6.870 0.987 1.00 0.79 H new ATOM 0 HA THR A 44 -15.298 4.853 1.435 1.00 0.86 H new ATOM 0 HB THR A 44 -13.624 4.639 -0.404 1.00 0.94 H new ATOM 0 HG1 THR A 44 -13.332 2.705 1.706 1.00 1.19 H new ATOM 0 HG21 THR A 44 -11.272 4.142 0.178 1.00 0.79 H new ATOM 0 HG22 THR A 44 -11.743 5.761 0.748 1.00 0.79 H new ATOM 0 HG23 THR A 44 -11.640 4.407 1.899 1.00 0.79 H new ATOM 420 N CYS A 45 -14.471 5.403 3.986 1.00 0.55 N ATOM 421 CA CYS A 45 -14.182 5.114 5.412 1.00 0.47 C ATOM 422 C CYS A 45 -15.127 5.976 6.242 1.00 0.38 C ATOM 423 O CYS A 45 -15.700 5.528 7.215 1.00 0.47 O ATOM 424 CB CYS A 45 -12.725 5.452 5.732 1.00 0.46 C ATOM 425 SG CYS A 45 -12.009 4.153 6.772 1.00 0.81 S ATOM 0 H CYS A 45 -15.165 6.135 3.833 1.00 0.55 H new ATOM 0 HA CYS A 45 -14.331 4.058 5.636 1.00 0.47 H new ATOM 0 HB2 CYS A 45 -12.153 5.548 4.809 1.00 0.46 H new ATOM 0 HB3 CYS A 45 -12.669 6.413 6.244 1.00 0.46 H new ATOM 0 HG CYS A 45 -10.734 4.061 6.535 1.00 0.81 H new ATOM 430 N ASN A 46 -15.336 7.204 5.839 1.00 0.31 N ATOM 431 CA ASN A 46 -16.289 8.059 6.587 1.00 0.25 C ATOM 432 C ASN A 46 -17.695 7.619 6.188 1.00 0.30 C ATOM 433 O ASN A 46 -18.536 7.354 7.025 1.00 0.21 O ATOM 434 CB ASN A 46 -16.077 9.530 6.224 1.00 0.34 C ATOM 435 CG ASN A 46 -16.633 10.412 7.341 1.00 0.43 C ATOM 436 OD1 ASN A 46 -17.503 11.228 7.112 1.00 1.74 O ATOM 437 ND2 ASN A 46 -16.164 10.280 8.552 1.00 0.88 N ATOM 0 H ASN A 46 -14.891 7.642 5.033 1.00 0.31 H new ATOM 0 HA ASN A 46 -16.139 7.955 7.662 1.00 0.25 H new ATOM 0 HB2 ASN A 46 -15.015 9.732 6.080 1.00 0.34 H new ATOM 0 HB3 ASN A 46 -16.575 9.759 5.282 1.00 0.34 H new ATOM 0 HD21 ASN A 46 -16.528 10.862 9.306 1.00 0.88 H new ATOM 0 HD22 ASN A 46 -15.433 9.595 8.744 1.00 0.88 H new ATOM 444 N LYS A 47 -17.948 7.503 4.907 1.00 0.53 N ATOM 445 CA LYS A 47 -19.289 7.039 4.459 1.00 0.66 C ATOM 446 C LYS A 47 -19.264 5.520 4.288 1.00 0.82 C ATOM 447 O LYS A 47 -20.290 4.887 4.137 1.00 1.25 O ATOM 448 CB LYS A 47 -19.655 7.703 3.129 1.00 0.90 C ATOM 449 CG LYS A 47 -20.886 8.594 3.324 1.00 0.89 C ATOM 450 CD LYS A 47 -21.894 8.330 2.202 1.00 2.06 C ATOM 451 CE LYS A 47 -22.726 7.091 2.541 1.00 3.44 C ATOM 452 NZ LYS A 47 -24.165 7.469 2.641 1.00 3.94 N ATOM 0 H LYS A 47 -17.285 7.709 4.160 1.00 0.53 H new ATOM 0 HA LYS A 47 -20.035 7.312 5.206 1.00 0.66 H new ATOM 0 HB2 LYS A 47 -18.817 8.297 2.764 1.00 0.90 H new ATOM 0 HB3 LYS A 47 -19.859 6.943 2.375 1.00 0.90 H new ATOM 0 HG2 LYS A 47 -21.344 8.392 4.293 1.00 0.89 H new ATOM 0 HG3 LYS A 47 -20.592 9.644 3.323 1.00 0.89 H new ATOM 0 HD2 LYS A 47 -22.546 9.194 2.074 1.00 2.06 H new ATOM 0 HD3 LYS A 47 -21.371 8.182 1.257 1.00 2.06 H new ATOM 0 HE2 LYS A 47 -22.592 6.329 1.773 1.00 3.44 H new ATOM 0 HE3 LYS A 47 -22.387 6.659 3.482 1.00 3.44 H new ATOM 0 HZ1 LYS A 47 -24.730 6.627 2.871 1.00 3.94 H new ATOM 0 HZ2 LYS A 47 -24.286 8.182 3.389 1.00 3.94 H new ATOM 0 HZ3 LYS A 47 -24.485 7.862 1.733 1.00 3.94 H new ATOM 466 N SER A 48 -18.102 4.929 4.308 1.00 0.70 N ATOM 467 CA SER A 48 -18.013 3.456 4.145 1.00 0.84 C ATOM 468 C SER A 48 -18.536 2.771 5.406 1.00 0.85 C ATOM 469 O SER A 48 -17.881 2.742 6.429 1.00 1.91 O ATOM 470 CB SER A 48 -16.559 3.055 3.908 1.00 1.01 C ATOM 471 OG SER A 48 -16.248 3.216 2.530 1.00 1.05 O ATOM 0 H SER A 48 -17.209 5.406 4.431 1.00 0.70 H new ATOM 0 HA SER A 48 -18.615 3.148 3.290 1.00 0.84 H new ATOM 0 HB2 SER A 48 -15.896 3.670 4.517 1.00 1.01 H new ATOM 0 HB3 SER A 48 -16.401 2.020 4.210 1.00 1.01 H new ATOM 0 HG SER A 48 -15.430 2.720 2.319 1.00 1.05 H new ATOM 477 N ASN A 49 -19.710 2.209 5.331 1.00 1.14 N ATOM 478 CA ASN A 49 -20.309 1.505 6.505 1.00 0.91 C ATOM 479 C ASN A 49 -19.273 0.610 7.207 1.00 0.80 C ATOM 480 O ASN A 49 -19.443 0.248 8.355 1.00 1.17 O ATOM 481 CB ASN A 49 -21.473 0.636 6.026 1.00 1.30 C ATOM 482 CG ASN A 49 -22.420 1.476 5.166 1.00 1.59 C ATOM 483 OD1 ASN A 49 -22.235 1.589 3.971 1.00 2.95 O ATOM 484 ND2 ASN A 49 -23.434 2.076 5.729 1.00 1.07 N ATOM 0 H ASN A 49 -20.291 2.207 4.493 1.00 1.14 H new ATOM 0 HA ASN A 49 -20.655 2.256 7.216 1.00 0.91 H new ATOM 0 HB2 ASN A 49 -21.096 -0.209 5.450 1.00 1.30 H new ATOM 0 HB3 ASN A 49 -22.010 0.225 6.881 1.00 1.30 H new ATOM 0 HD21 ASN A 49 -24.070 2.639 5.165 1.00 1.07 H new ATOM 0 HD22 ASN A 49 -23.590 1.981 6.733 1.00 1.07 H new ATOM 491 N MET A 50 -18.209 0.241 6.540 1.00 0.91 N ATOM 492 CA MET A 50 -17.194 -0.630 7.191 1.00 0.96 C ATOM 493 C MET A 50 -16.044 0.231 7.717 1.00 0.92 C ATOM 494 O MET A 50 -14.886 -0.072 7.505 1.00 0.95 O ATOM 495 CB MET A 50 -16.652 -1.627 6.165 1.00 1.32 C ATOM 496 CG MET A 50 -17.765 -2.597 5.758 1.00 0.79 C ATOM 497 SD MET A 50 -17.948 -2.595 3.957 1.00 0.82 S ATOM 498 CE MET A 50 -17.707 -4.370 3.703 1.00 1.36 C ATOM 0 H MET A 50 -18.003 0.506 5.577 1.00 0.91 H new ATOM 0 HA MET A 50 -17.653 -1.169 8.020 1.00 0.96 H new ATOM 0 HB2 MET A 50 -16.279 -1.097 5.289 1.00 1.32 H new ATOM 0 HB3 MET A 50 -15.811 -2.178 6.586 1.00 1.32 H new ATOM 0 HG2 MET A 50 -17.531 -3.602 6.108 1.00 0.79 H new ATOM 0 HG3 MET A 50 -18.704 -2.306 6.229 1.00 0.79 H new ATOM 0 HE1 MET A 50 -18.390 -4.723 2.930 1.00 1.36 H new ATOM 0 HE2 MET A 50 -16.679 -4.557 3.392 1.00 1.36 H new ATOM 0 HE3 MET A 50 -17.907 -4.901 4.634 1.00 1.36 H new ATOM 660 N ASN A 62 -9.012 -9.126 4.812 1.00 1.54 N ATOM 661 CA ASN A 62 -7.605 -9.066 4.311 1.00 1.80 C ATOM 662 C ASN A 62 -7.430 -10.059 3.163 1.00 1.65 C ATOM 663 O ASN A 62 -7.029 -11.189 3.361 1.00 1.85 O ATOM 664 CB ASN A 62 -6.621 -9.411 5.439 1.00 2.10 C ATOM 665 CG ASN A 62 -7.082 -8.773 6.753 1.00 1.95 C ATOM 666 OD1 ASN A 62 -6.788 -9.278 7.820 1.00 2.42 O ATOM 667 ND2 ASN A 62 -7.795 -7.680 6.727 1.00 2.39 N ATOM 0 HA ASN A 62 -7.399 -8.055 3.959 1.00 1.80 H new ATOM 0 HB2 ASN A 62 -6.553 -10.493 5.555 1.00 2.10 H new ATOM 0 HB3 ASN A 62 -5.623 -9.055 5.183 1.00 2.10 H new ATOM 0 HD21 ASN A 62 -8.104 -7.252 7.600 1.00 2.39 H new ATOM 0 HD22 ASN A 62 -8.043 -7.254 5.834 1.00 2.39 H new ATOM 674 N LEU A 63 -7.723 -9.644 1.961 1.00 1.65 N ATOM 675 CA LEU A 63 -7.569 -10.561 0.797 1.00 1.82 C ATOM 676 C LEU A 63 -6.134 -11.104 0.770 1.00 1.77 C ATOM 677 O LEU A 63 -5.826 -12.077 1.429 1.00 2.25 O ATOM 678 CB LEU A 63 -7.880 -9.795 -0.490 1.00 2.52 C ATOM 679 CG LEU A 63 -9.381 -9.514 -0.561 1.00 2.62 C ATOM 680 CD1 LEU A 63 -9.630 -8.018 -0.349 1.00 2.49 C ATOM 681 CD2 LEU A 63 -9.915 -9.930 -1.936 1.00 2.71 C ATOM 0 H LEU A 63 -8.062 -8.709 1.735 1.00 1.65 H new ATOM 0 HA LEU A 63 -8.260 -11.400 0.882 1.00 1.82 H new ATOM 0 HB2 LEU A 63 -7.322 -8.859 -0.514 1.00 2.52 H new ATOM 0 HB3 LEU A 63 -7.566 -10.376 -1.357 1.00 2.52 H new ATOM 0 HG LEU A 63 -9.894 -10.082 0.215 1.00 2.62 H new ATOM 0 HD11 LEU A 63 -10.700 -7.817 -0.399 1.00 2.49 H new ATOM 0 HD12 LEU A 63 -9.251 -7.721 0.629 1.00 2.49 H new ATOM 0 HD13 LEU A 63 -9.117 -7.450 -1.125 1.00 2.49 H new ATOM 0 HD21 LEU A 63 -10.985 -9.730 -1.987 1.00 2.71 H new ATOM 0 HD22 LEU A 63 -9.402 -9.362 -2.712 1.00 2.71 H new ATOM 0 HD23 LEU A 63 -9.738 -10.995 -2.088 1.00 2.71 H new ATOM 693 N ASN A 64 -5.250 -10.488 0.030 1.00 1.31 N ATOM 694 CA ASN A 64 -3.848 -10.984 -0.005 1.00 1.49 C ATOM 695 C ASN A 64 -2.918 -9.829 -0.368 1.00 1.30 C ATOM 696 O ASN A 64 -1.883 -10.013 -0.978 1.00 1.48 O ATOM 697 CB ASN A 64 -3.722 -12.100 -1.041 1.00 1.84 C ATOM 698 CG ASN A 64 -2.301 -12.662 -1.013 1.00 2.85 C ATOM 699 OD1 ASN A 64 -1.934 -13.374 -0.099 1.00 2.93 O ATOM 700 ND2 ASN A 64 -1.480 -12.369 -1.982 1.00 4.02 N ATOM 0 H ASN A 64 -5.439 -9.668 -0.547 1.00 1.31 H new ATOM 0 HA ASN A 64 -3.573 -11.378 0.973 1.00 1.49 H new ATOM 0 HB2 ASN A 64 -4.442 -12.891 -0.829 1.00 1.84 H new ATOM 0 HB3 ASN A 64 -3.953 -11.716 -2.035 1.00 1.84 H new ATOM 0 HD21 ASN A 64 -0.529 -12.737 -1.974 1.00 4.02 H new ATOM 0 HD22 ASN A 64 -1.789 -11.771 -2.749 1.00 4.02 H new ATOM 707 N LEU A 65 -3.287 -8.639 0.009 1.00 1.14 N ATOM 708 CA LEU A 65 -2.441 -7.457 -0.303 1.00 1.27 C ATOM 709 C LEU A 65 -1.421 -7.110 0.826 1.00 1.41 C ATOM 710 O LEU A 65 -0.487 -6.382 0.554 1.00 2.06 O ATOM 711 CB LEU A 65 -3.354 -6.245 -0.566 1.00 1.26 C ATOM 712 CG LEU A 65 -3.842 -5.639 0.753 1.00 0.98 C ATOM 713 CD1 LEU A 65 -3.148 -4.294 0.973 1.00 0.80 C ATOM 714 CD2 LEU A 65 -5.355 -5.427 0.697 1.00 1.00 C ATOM 0 H LEU A 65 -4.144 -8.433 0.523 1.00 1.14 H new ATOM 0 HA LEU A 65 -1.852 -7.705 -1.186 1.00 1.27 H new ATOM 0 HB2 LEU A 65 -2.812 -5.493 -1.139 1.00 1.26 H new ATOM 0 HB3 LEU A 65 -4.208 -6.551 -1.170 1.00 1.26 H new ATOM 0 HG LEU A 65 -3.606 -6.316 1.574 1.00 0.98 H new ATOM 0 HD11 LEU A 65 -3.491 -3.857 1.911 1.00 0.80 H new ATOM 0 HD12 LEU A 65 -2.069 -4.444 1.016 1.00 0.80 H new ATOM 0 HD13 LEU A 65 -3.389 -3.621 0.150 1.00 0.80 H new ATOM 0 HD21 LEU A 65 -5.697 -4.996 1.638 1.00 1.00 H new ATOM 0 HD22 LEU A 65 -5.597 -4.750 -0.122 1.00 1.00 H new ATOM 0 HD23 LEU A 65 -5.851 -6.384 0.535 1.00 1.00 H new ATOM 726 N PRO A 66 -1.601 -7.584 2.057 1.00 1.18 N ATOM 727 CA PRO A 66 -0.665 -7.236 3.146 1.00 1.40 C ATOM 728 C PRO A 66 0.637 -8.034 3.041 1.00 0.80 C ATOM 729 O PRO A 66 0.760 -8.952 2.254 1.00 1.05 O ATOM 730 CB PRO A 66 -1.426 -7.605 4.421 1.00 1.98 C ATOM 731 CG PRO A 66 -2.489 -8.645 4.009 1.00 2.12 C ATOM 732 CD PRO A 66 -2.698 -8.484 2.494 1.00 1.46 C ATOM 0 HA PRO A 66 -0.370 -6.187 3.117 1.00 1.40 H new ATOM 0 HB2 PRO A 66 -0.751 -8.016 5.171 1.00 1.98 H new ATOM 0 HB3 PRO A 66 -1.894 -6.725 4.862 1.00 1.98 H new ATOM 0 HG2 PRO A 66 -2.156 -9.655 4.249 1.00 2.12 H new ATOM 0 HG3 PRO A 66 -3.422 -8.480 4.548 1.00 2.12 H new ATOM 0 HD2 PRO A 66 -2.649 -9.445 1.983 1.00 1.46 H new ATOM 0 HD3 PRO A 66 -3.675 -8.055 2.272 1.00 1.46 H new ATOM 740 N LYS A 67 1.607 -7.679 3.838 1.00 0.74 N ATOM 741 CA LYS A 67 2.912 -8.396 3.811 1.00 0.92 C ATOM 742 C LYS A 67 3.854 -7.751 4.826 1.00 0.76 C ATOM 743 O LYS A 67 5.006 -7.485 4.545 1.00 0.89 O ATOM 744 CB LYS A 67 3.526 -8.300 2.413 1.00 1.91 C ATOM 745 CG LYS A 67 4.004 -9.683 1.969 1.00 2.47 C ATOM 746 CD LYS A 67 2.820 -10.480 1.419 1.00 2.34 C ATOM 747 CE LYS A 67 3.329 -11.763 0.762 1.00 3.30 C ATOM 748 NZ LYS A 67 2.283 -12.820 0.860 1.00 3.37 N ATOM 0 H LYS A 67 1.550 -6.916 4.513 1.00 0.74 H new ATOM 0 HA LYS A 67 2.758 -9.445 4.062 1.00 0.92 H new ATOM 0 HB2 LYS A 67 2.791 -7.914 1.707 1.00 1.91 H new ATOM 0 HB3 LYS A 67 4.361 -7.599 2.418 1.00 1.91 H new ATOM 0 HG2 LYS A 67 4.776 -9.585 1.206 1.00 2.47 H new ATOM 0 HG3 LYS A 67 4.453 -10.212 2.810 1.00 2.47 H new ATOM 0 HD2 LYS A 67 2.126 -10.722 2.224 1.00 2.34 H new ATOM 0 HD3 LYS A 67 2.270 -9.881 0.693 1.00 2.34 H new ATOM 0 HE2 LYS A 67 3.575 -11.576 -0.283 1.00 3.30 H new ATOM 0 HE3 LYS A 67 4.245 -12.096 1.251 1.00 3.30 H new ATOM 0 HZ1 LYS A 67 2.629 -13.693 0.413 1.00 3.37 H new ATOM 0 HZ2 LYS A 67 2.069 -13.005 1.861 1.00 3.37 H new ATOM 0 HZ3 LYS A 67 1.420 -12.501 0.375 1.00 3.37 H new ATOM 762 N MET A 68 3.364 -7.495 6.004 1.00 0.69 N ATOM 763 CA MET A 68 4.213 -6.864 7.053 1.00 0.66 C ATOM 764 C MET A 68 3.455 -6.884 8.381 1.00 1.20 C ATOM 765 O MET A 68 2.244 -6.988 8.412 1.00 1.54 O ATOM 766 CB MET A 68 4.521 -5.416 6.663 1.00 1.05 C ATOM 767 CG MET A 68 5.919 -5.039 7.157 1.00 0.44 C ATOM 768 SD MET A 68 6.798 -4.137 5.854 1.00 1.74 S ATOM 769 CE MET A 68 6.664 -2.487 6.587 1.00 0.61 C ATOM 0 H MET A 68 2.406 -7.697 6.289 1.00 0.69 H new ATOM 0 HA MET A 68 5.148 -7.415 7.151 1.00 0.66 H new ATOM 0 HB2 MET A 68 4.463 -5.300 5.581 1.00 1.05 H new ATOM 0 HB3 MET A 68 3.778 -4.746 7.096 1.00 1.05 H new ATOM 0 HG2 MET A 68 5.846 -4.424 8.054 1.00 0.44 H new ATOM 0 HG3 MET A 68 6.474 -5.936 7.431 1.00 0.44 H new ATOM 0 HE1 MET A 68 6.035 -1.859 5.957 1.00 0.61 H new ATOM 0 HE2 MET A 68 6.221 -2.565 7.580 1.00 0.61 H new ATOM 0 HE3 MET A 68 7.656 -2.043 6.667 1.00 0.61 H new ATOM 779 N ALA A 69 4.151 -6.788 9.479 1.00 1.39 N ATOM 780 CA ALA A 69 3.458 -6.805 10.798 1.00 2.06 C ATOM 781 C ALA A 69 4.478 -6.587 11.916 1.00 2.16 C ATOM 782 O ALA A 69 4.400 -5.632 12.664 1.00 3.09 O ATOM 783 CB ALA A 69 2.767 -8.156 10.993 1.00 2.33 C ATOM 0 H ALA A 69 5.166 -6.699 9.521 1.00 1.39 H new ATOM 0 HA ALA A 69 2.714 -6.008 10.827 1.00 2.06 H new ATOM 0 HB1 ALA A 69 2.260 -8.169 11.958 1.00 2.33 H new ATOM 0 HB2 ALA A 69 2.038 -8.310 10.198 1.00 2.33 H new ATOM 0 HB3 ALA A 69 3.510 -8.953 10.963 1.00 2.33 H new ATOM 789 N GLU A 70 5.436 -7.464 12.037 1.00 1.58 N ATOM 790 CA GLU A 70 6.459 -7.307 13.109 1.00 1.57 C ATOM 791 C GLU A 70 7.581 -8.318 12.891 1.00 1.35 C ATOM 792 O GLU A 70 8.746 -8.021 13.073 1.00 1.31 O ATOM 793 CB GLU A 70 5.811 -7.552 14.472 1.00 1.83 C ATOM 794 CG GLU A 70 6.541 -6.735 15.540 1.00 2.22 C ATOM 795 CD GLU A 70 5.531 -5.882 16.311 1.00 3.14 C ATOM 796 OE1 GLU A 70 4.661 -6.457 16.945 1.00 3.13 O ATOM 797 OE2 GLU A 70 5.644 -4.668 16.252 1.00 4.04 O ATOM 0 H GLU A 70 5.555 -8.282 11.440 1.00 1.58 H new ATOM 0 HA GLU A 70 6.867 -6.297 13.077 1.00 1.57 H new ATOM 0 HB2 GLU A 70 4.758 -7.272 14.441 1.00 1.83 H new ATOM 0 HB3 GLU A 70 5.851 -8.613 14.720 1.00 1.83 H new ATOM 0 HG2 GLU A 70 7.068 -7.400 16.224 1.00 2.22 H new ATOM 0 HG3 GLU A 70 7.292 -6.096 15.074 1.00 2.22 H new ATOM 804 N LYS A 71 7.238 -9.513 12.503 1.00 1.24 N ATOM 805 CA LYS A 71 8.276 -10.552 12.274 1.00 1.11 C ATOM 806 C LYS A 71 9.222 -10.097 11.161 1.00 0.85 C ATOM 807 O LYS A 71 10.376 -10.476 11.120 1.00 0.79 O ATOM 808 CB LYS A 71 7.593 -11.854 11.861 1.00 1.16 C ATOM 809 CG LYS A 71 7.192 -12.635 13.113 1.00 1.96 C ATOM 810 CD LYS A 71 6.993 -14.107 12.753 1.00 1.66 C ATOM 811 CE LYS A 71 5.820 -14.241 11.778 1.00 1.79 C ATOM 812 NZ LYS A 71 4.536 -14.306 12.538 1.00 3.04 N ATOM 0 H LYS A 71 6.279 -9.815 12.334 1.00 1.24 H new ATOM 0 HA LYS A 71 8.848 -10.708 13.189 1.00 1.11 H new ATOM 0 HB2 LYS A 71 6.713 -11.640 11.255 1.00 1.16 H new ATOM 0 HB3 LYS A 71 8.266 -12.452 11.246 1.00 1.16 H new ATOM 0 HG2 LYS A 71 7.963 -12.538 13.878 1.00 1.96 H new ATOM 0 HG3 LYS A 71 6.273 -12.225 13.532 1.00 1.96 H new ATOM 0 HD2 LYS A 71 7.901 -14.508 12.303 1.00 1.66 H new ATOM 0 HD3 LYS A 71 6.799 -14.690 13.654 1.00 1.66 H new ATOM 0 HE2 LYS A 71 5.806 -13.393 11.093 1.00 1.79 H new ATOM 0 HE3 LYS A 71 5.940 -15.139 11.171 1.00 1.79 H new ATOM 0 HZ1 LYS A 71 3.743 -14.397 11.872 1.00 3.04 H new ATOM 0 HZ2 LYS A 71 4.550 -15.129 13.174 1.00 3.04 H new ATOM 0 HZ3 LYS A 71 4.420 -13.438 13.098 1.00 3.04 H new ATOM 826 N ASP A 72 8.743 -9.286 10.259 1.00 0.76 N ATOM 827 CA ASP A 72 9.616 -8.808 9.149 1.00 0.53 C ATOM 828 C ASP A 72 10.799 -8.029 9.727 1.00 0.41 C ATOM 829 O ASP A 72 11.918 -8.153 9.272 1.00 0.60 O ATOM 830 CB ASP A 72 8.810 -7.896 8.223 1.00 0.97 C ATOM 831 CG ASP A 72 7.487 -8.574 7.862 1.00 1.73 C ATOM 832 OD1 ASP A 72 6.538 -8.415 8.612 1.00 3.31 O ATOM 833 OD2 ASP A 72 7.447 -9.243 6.843 1.00 1.61 O ATOM 0 H ASP A 72 7.786 -8.934 10.242 1.00 0.76 H new ATOM 0 HA ASP A 72 9.986 -9.664 8.585 1.00 0.53 H new ATOM 0 HB2 ASP A 72 8.619 -6.941 8.712 1.00 0.97 H new ATOM 0 HB3 ASP A 72 9.380 -7.683 7.319 1.00 0.97 H new ATOM 838 N GLY A 73 10.558 -7.223 10.725 1.00 0.54 N ATOM 839 CA GLY A 73 11.669 -6.433 11.327 1.00 0.71 C ATOM 840 C GLY A 73 11.452 -4.948 11.033 1.00 0.60 C ATOM 841 O GLY A 73 12.384 -4.168 11.008 1.00 0.73 O ATOM 0 H GLY A 73 9.642 -7.078 11.149 1.00 0.54 H new ATOM 0 HA2 GLY A 73 11.708 -6.600 12.403 1.00 0.71 H new ATOM 0 HA3 GLY A 73 12.625 -6.760 10.919 1.00 0.71 H new ATOM 845 N CYS A 74 10.229 -4.552 10.807 1.00 0.61 N ATOM 846 CA CYS A 74 9.951 -3.117 10.513 1.00 0.85 C ATOM 847 C CYS A 74 9.583 -2.386 11.806 1.00 1.01 C ATOM 848 O CYS A 74 8.899 -1.382 11.790 1.00 1.22 O ATOM 849 CB CYS A 74 8.792 -3.016 9.521 1.00 0.85 C ATOM 850 SG CYS A 74 9.301 -3.710 7.929 1.00 1.19 S ATOM 0 H CYS A 74 9.410 -5.160 10.813 1.00 0.61 H new ATOM 0 HA CYS A 74 10.841 -2.658 10.082 1.00 0.85 H new ATOM 0 HB2 CYS A 74 7.924 -3.553 9.903 1.00 0.85 H new ATOM 0 HB3 CYS A 74 8.494 -1.975 9.398 1.00 0.85 H new ATOM 855 N PHE A 75 10.033 -2.881 12.928 1.00 0.94 N ATOM 856 CA PHE A 75 9.710 -2.214 14.221 1.00 1.13 C ATOM 857 C PHE A 75 10.910 -2.328 15.165 1.00 1.15 C ATOM 858 O PHE A 75 11.880 -2.998 14.871 1.00 0.87 O ATOM 859 CB PHE A 75 8.493 -2.892 14.853 1.00 1.17 C ATOM 860 CG PHE A 75 7.251 -2.510 14.086 1.00 1.33 C ATOM 861 CD1 PHE A 75 6.591 -1.312 14.379 1.00 1.93 C ATOM 862 CD2 PHE A 75 6.759 -3.353 13.082 1.00 1.19 C ATOM 863 CE1 PHE A 75 5.439 -0.956 13.669 1.00 2.09 C ATOM 864 CE2 PHE A 75 5.608 -2.997 12.371 1.00 1.30 C ATOM 865 CZ PHE A 75 4.947 -1.799 12.664 1.00 1.64 C ATOM 0 H PHE A 75 10.610 -3.718 13.004 1.00 0.94 H new ATOM 0 HA PHE A 75 9.487 -1.162 14.044 1.00 1.13 H new ATOM 0 HB2 PHE A 75 8.621 -3.974 14.844 1.00 1.17 H new ATOM 0 HB3 PHE A 75 8.396 -2.591 15.896 1.00 1.17 H new ATOM 0 HD1 PHE A 75 6.971 -0.662 15.153 1.00 1.93 H new ATOM 0 HD2 PHE A 75 7.268 -4.278 12.856 1.00 1.19 H new ATOM 0 HE1 PHE A 75 4.929 -0.031 13.896 1.00 2.09 H new ATOM 0 HE2 PHE A 75 5.230 -3.647 11.596 1.00 1.30 H new ATOM 0 HZ PHE A 75 4.058 -1.524 12.116 1.00 1.64 H new ATOM 875 N GLN A 76 10.853 -1.679 16.298 1.00 1.55 N ATOM 876 CA GLN A 76 11.994 -1.751 17.257 1.00 1.62 C ATOM 877 C GLN A 76 12.315 -3.217 17.560 1.00 1.50 C ATOM 878 O GLN A 76 13.463 -3.600 17.673 1.00 1.51 O ATOM 879 CB GLN A 76 11.620 -1.035 18.557 1.00 1.74 C ATOM 880 CG GLN A 76 12.799 -0.178 19.025 1.00 2.15 C ATOM 881 CD GLN A 76 12.340 1.270 19.207 1.00 3.06 C ATOM 882 OE1 GLN A 76 12.263 2.020 18.254 1.00 3.87 O ATOM 883 NE2 GLN A 76 12.029 1.698 20.400 1.00 3.23 N ATOM 0 H GLN A 76 10.067 -1.103 16.600 1.00 1.55 H new ATOM 0 HA GLN A 76 12.866 -1.269 16.815 1.00 1.62 H new ATOM 0 HB2 GLN A 76 10.741 -0.409 18.400 1.00 1.74 H new ATOM 0 HB3 GLN A 76 11.359 -1.764 19.324 1.00 1.74 H new ATOM 0 HG2 GLN A 76 13.194 -0.566 19.964 1.00 2.15 H new ATOM 0 HG3 GLN A 76 13.608 -0.225 18.296 1.00 2.15 H new ATOM 0 HE21 GLN A 76 12.093 1.069 21.200 1.00 3.23 H new ATOM 0 HE22 GLN A 76 11.721 2.662 20.532 1.00 3.23 H new ATOM 892 N SER A 77 11.311 -4.039 17.694 1.00 1.42 N ATOM 893 CA SER A 77 11.561 -5.478 17.989 1.00 1.32 C ATOM 894 C SER A 77 12.369 -6.100 16.849 1.00 1.28 C ATOM 895 O SER A 77 11.832 -6.466 15.822 1.00 1.67 O ATOM 896 CB SER A 77 10.226 -6.210 18.126 1.00 1.36 C ATOM 897 OG SER A 77 10.235 -6.984 19.319 1.00 0.93 O ATOM 0 H SER A 77 10.329 -3.777 17.612 1.00 1.42 H new ATOM 0 HA SER A 77 12.120 -5.566 18.920 1.00 1.32 H new ATOM 0 HB2 SER A 77 9.406 -5.493 18.150 1.00 1.36 H new ATOM 0 HB3 SER A 77 10.061 -6.854 17.262 1.00 1.36 H new ATOM 0 HG SER A 77 9.380 -7.453 19.411 1.00 0.93 H new ATOM 903 N GLY A 78 13.657 -6.225 17.021 1.00 1.04 N ATOM 904 CA GLY A 78 14.498 -6.825 15.946 1.00 0.98 C ATOM 905 C GLY A 78 14.347 -6.005 14.663 1.00 0.98 C ATOM 906 O GLY A 78 14.123 -6.541 13.596 1.00 0.90 O ATOM 0 H GLY A 78 14.163 -5.938 17.859 1.00 1.04 H new ATOM 0 HA2 GLY A 78 15.543 -6.846 16.256 1.00 0.98 H new ATOM 0 HA3 GLY A 78 14.197 -7.857 15.768 1.00 0.98 H new ATOM 910 N PHE A 79 14.466 -4.710 14.760 1.00 1.09 N ATOM 911 CA PHE A 79 14.329 -3.853 13.549 1.00 1.14 C ATOM 912 C PHE A 79 15.341 -4.298 12.488 1.00 1.14 C ATOM 913 O PHE A 79 16.474 -3.863 12.480 1.00 1.52 O ATOM 914 CB PHE A 79 14.591 -2.390 13.928 1.00 1.22 C ATOM 915 CG PHE A 79 14.565 -1.527 12.688 1.00 1.11 C ATOM 916 CD1 PHE A 79 13.349 -1.029 12.200 1.00 1.55 C ATOM 917 CD2 PHE A 79 15.759 -1.228 12.022 1.00 0.67 C ATOM 918 CE1 PHE A 79 13.332 -0.234 11.047 1.00 1.43 C ATOM 919 CE2 PHE A 79 15.741 -0.434 10.870 1.00 0.67 C ATOM 920 CZ PHE A 79 14.526 0.064 10.383 1.00 0.94 C ATOM 0 H PHE A 79 14.653 -4.207 15.628 1.00 1.09 H new ATOM 0 HA PHE A 79 13.320 -3.949 13.147 1.00 1.14 H new ATOM 0 HB2 PHE A 79 13.836 -2.048 14.636 1.00 1.22 H new ATOM 0 HB3 PHE A 79 15.558 -2.301 14.424 1.00 1.22 H new ATOM 0 HD1 PHE A 79 12.426 -1.258 12.712 1.00 1.55 H new ATOM 0 HD2 PHE A 79 16.696 -1.611 12.398 1.00 0.67 H new ATOM 0 HE1 PHE A 79 12.395 0.149 10.670 1.00 1.43 H new ATOM 0 HE2 PHE A 79 16.663 -0.205 10.357 1.00 0.67 H new ATOM 0 HZ PHE A 79 14.511 0.678 9.495 1.00 0.94 H new ATOM 930 N ASN A 80 14.938 -5.155 11.591 1.00 1.06 N ATOM 931 CA ASN A 80 15.878 -5.617 10.531 1.00 1.08 C ATOM 932 C ASN A 80 16.137 -4.468 9.553 1.00 1.04 C ATOM 933 O ASN A 80 15.663 -3.365 9.739 1.00 1.72 O ATOM 934 CB ASN A 80 15.261 -6.801 9.781 1.00 1.22 C ATOM 935 CG ASN A 80 15.083 -7.977 10.744 1.00 2.13 C ATOM 936 OD1 ASN A 80 14.013 -8.542 10.838 1.00 3.58 O ATOM 937 ND2 ASN A 80 16.096 -8.370 11.467 1.00 1.82 N ATOM 0 H ASN A 80 14.001 -5.555 11.546 1.00 1.06 H new ATOM 0 HA ASN A 80 16.818 -5.930 10.985 1.00 1.08 H new ATOM 0 HB2 ASN A 80 14.298 -6.515 9.357 1.00 1.22 H new ATOM 0 HB3 ASN A 80 15.902 -7.092 8.949 1.00 1.22 H new ATOM 0 HD21 ASN A 80 15.989 -9.153 12.112 1.00 1.82 H new ATOM 0 HD22 ASN A 80 16.995 -7.894 11.387 1.00 1.82 H new ATOM 944 N GLU A 81 16.885 -4.716 8.513 1.00 0.49 N ATOM 945 CA GLU A 81 17.170 -3.633 7.531 1.00 0.44 C ATOM 946 C GLU A 81 16.847 -4.126 6.119 1.00 0.45 C ATOM 947 O GLU A 81 16.058 -3.533 5.408 1.00 0.26 O ATOM 948 CB GLU A 81 18.650 -3.248 7.608 1.00 0.50 C ATOM 949 CG GLU A 81 18.955 -2.658 8.986 1.00 0.58 C ATOM 950 CD GLU A 81 20.462 -2.717 9.246 1.00 1.02 C ATOM 951 OE1 GLU A 81 21.089 -3.651 8.771 1.00 1.98 O ATOM 952 OE2 GLU A 81 20.965 -1.828 9.913 1.00 0.46 O ATOM 0 H GLU A 81 17.310 -5.619 8.302 1.00 0.49 H new ATOM 0 HA GLU A 81 16.555 -2.763 7.763 1.00 0.44 H new ATOM 0 HB2 GLU A 81 19.274 -4.124 7.430 1.00 0.50 H new ATOM 0 HB3 GLU A 81 18.889 -2.523 6.830 1.00 0.50 H new ATOM 0 HG2 GLU A 81 18.607 -1.626 9.036 1.00 0.58 H new ATOM 0 HG3 GLU A 81 18.420 -3.213 9.757 1.00 0.58 H new ATOM 959 N GLU A 82 17.455 -5.203 5.705 1.00 0.70 N ATOM 960 CA GLU A 82 17.188 -5.730 4.337 1.00 0.74 C ATOM 961 C GLU A 82 15.909 -6.572 4.344 1.00 0.75 C ATOM 962 O GLU A 82 15.295 -6.783 3.320 1.00 0.79 O ATOM 963 CB GLU A 82 18.363 -6.599 3.888 1.00 0.79 C ATOM 964 CG GLU A 82 18.514 -6.505 2.369 1.00 0.65 C ATOM 965 CD GLU A 82 18.660 -7.909 1.781 1.00 1.14 C ATOM 966 OE1 GLU A 82 19.323 -8.723 2.402 1.00 0.89 O ATOM 967 OE2 GLU A 82 18.106 -8.146 0.720 1.00 2.20 O ATOM 0 H GLU A 82 18.125 -5.741 6.255 1.00 0.70 H new ATOM 0 HA GLU A 82 17.065 -4.894 3.649 1.00 0.74 H new ATOM 0 HB2 GLU A 82 19.280 -6.270 4.377 1.00 0.79 H new ATOM 0 HB3 GLU A 82 18.198 -7.635 4.185 1.00 0.79 H new ATOM 0 HG2 GLU A 82 17.646 -6.007 1.937 1.00 0.65 H new ATOM 0 HG3 GLU A 82 19.386 -5.901 2.117 1.00 0.65 H new ATOM 974 N THR A 83 15.497 -7.047 5.487 1.00 0.72 N ATOM 975 CA THR A 83 14.256 -7.867 5.540 1.00 0.74 C ATOM 976 C THR A 83 13.052 -6.932 5.563 1.00 0.70 C ATOM 977 O THR A 83 12.035 -7.194 4.950 1.00 0.71 O ATOM 978 CB THR A 83 14.264 -8.728 6.806 1.00 0.72 C ATOM 979 OG1 THR A 83 15.543 -9.326 6.961 1.00 0.63 O ATOM 980 CG2 THR A 83 13.199 -9.818 6.689 1.00 0.72 C ATOM 0 H THR A 83 15.964 -6.903 6.382 1.00 0.72 H new ATOM 0 HA THR A 83 14.203 -8.518 4.668 1.00 0.74 H new ATOM 0 HB THR A 83 14.047 -8.104 7.673 1.00 0.72 H new ATOM 0 HG1 THR A 83 15.551 -9.876 7.772 1.00 0.63 H new ATOM 0 HG21 THR A 83 13.205 -10.431 7.590 1.00 0.72 H new ATOM 0 HG22 THR A 83 12.218 -9.357 6.570 1.00 0.72 H new ATOM 0 HG23 THR A 83 13.413 -10.444 5.823 1.00 0.72 H new ATOM 988 N CYS A 84 13.165 -5.835 6.255 1.00 0.66 N ATOM 989 CA CYS A 84 12.033 -4.877 6.306 1.00 0.61 C ATOM 990 C CYS A 84 11.930 -4.175 4.954 1.00 0.57 C ATOM 991 O CYS A 84 10.893 -4.167 4.320 1.00 0.55 O ATOM 992 CB CYS A 84 12.282 -3.843 7.408 1.00 0.59 C ATOM 993 SG CYS A 84 10.935 -2.633 7.428 1.00 0.94 S ATOM 0 H CYS A 84 13.992 -5.562 6.786 1.00 0.66 H new ATOM 0 HA CYS A 84 11.105 -5.406 6.523 1.00 0.61 H new ATOM 0 HB2 CYS A 84 12.352 -4.339 8.376 1.00 0.59 H new ATOM 0 HB3 CYS A 84 13.234 -3.339 7.239 1.00 0.59 H new ATOM 998 N LEU A 85 13.006 -3.592 4.504 1.00 0.57 N ATOM 999 CA LEU A 85 12.987 -2.893 3.192 1.00 0.55 C ATOM 1000 C LEU A 85 12.510 -3.860 2.107 1.00 0.54 C ATOM 1001 O LEU A 85 11.774 -3.490 1.215 1.00 0.49 O ATOM 1002 CB LEU A 85 14.398 -2.407 2.862 1.00 0.55 C ATOM 1003 CG LEU A 85 14.392 -1.682 1.514 1.00 0.57 C ATOM 1004 CD1 LEU A 85 13.412 -0.508 1.566 1.00 0.84 C ATOM 1005 CD2 LEU A 85 15.797 -1.158 1.212 1.00 0.50 C ATOM 0 H LEU A 85 13.901 -3.570 4.992 1.00 0.57 H new ATOM 0 HA LEU A 85 12.309 -2.041 3.238 1.00 0.55 H new ATOM 0 HB2 LEU A 85 14.755 -1.737 3.644 1.00 0.55 H new ATOM 0 HB3 LEU A 85 15.086 -3.252 2.828 1.00 0.55 H new ATOM 0 HG LEU A 85 14.084 -2.376 0.732 1.00 0.57 H new ATOM 0 HD11 LEU A 85 13.409 0.007 0.605 1.00 0.84 H new ATOM 0 HD12 LEU A 85 12.410 -0.880 1.781 1.00 0.84 H new ATOM 0 HD13 LEU A 85 13.717 0.186 2.349 1.00 0.84 H new ATOM 0 HD21 LEU A 85 15.794 -0.641 0.252 1.00 0.50 H new ATOM 0 HD22 LEU A 85 16.103 -0.465 1.996 1.00 0.50 H new ATOM 0 HD23 LEU A 85 16.496 -1.993 1.172 1.00 0.50 H new ATOM 1017 N VAL A 86 12.919 -5.100 2.174 1.00 0.59 N ATOM 1018 CA VAL A 86 12.476 -6.080 1.144 1.00 0.59 C ATOM 1019 C VAL A 86 10.947 -6.132 1.140 1.00 0.55 C ATOM 1020 O VAL A 86 10.330 -5.995 0.114 1.00 0.49 O ATOM 1021 CB VAL A 86 13.077 -7.469 1.461 1.00 0.70 C ATOM 1022 CG1 VAL A 86 12.243 -8.599 0.835 1.00 0.96 C ATOM 1023 CG2 VAL A 86 14.493 -7.544 0.891 1.00 0.75 C ATOM 0 H VAL A 86 13.537 -5.473 2.894 1.00 0.59 H new ATOM 0 HA VAL A 86 12.822 -5.777 0.156 1.00 0.59 H new ATOM 0 HB VAL A 86 13.082 -7.595 2.544 1.00 0.70 H new ATOM 0 HG11 VAL A 86 12.694 -9.561 1.078 1.00 0.96 H new ATOM 0 HG12 VAL A 86 11.228 -8.564 1.230 1.00 0.96 H new ATOM 0 HG13 VAL A 86 12.215 -8.474 -0.247 1.00 0.96 H new ATOM 0 HG21 VAL A 86 14.923 -8.521 1.111 1.00 0.75 H new ATOM 0 HG22 VAL A 86 14.459 -7.398 -0.189 1.00 0.75 H new ATOM 0 HG23 VAL A 86 15.109 -6.767 1.343 1.00 0.75 H new ATOM 1033 N LYS A 87 10.332 -6.330 2.272 1.00 0.61 N ATOM 1034 CA LYS A 87 8.842 -6.389 2.296 1.00 0.61 C ATOM 1035 C LYS A 87 8.266 -5.072 1.772 1.00 0.51 C ATOM 1036 O LYS A 87 7.147 -5.019 1.304 1.00 0.54 O ATOM 1037 CB LYS A 87 8.358 -6.618 3.730 1.00 0.72 C ATOM 1038 CG LYS A 87 9.010 -7.879 4.298 1.00 0.52 C ATOM 1039 CD LYS A 87 8.157 -9.100 3.950 1.00 0.56 C ATOM 1040 CE LYS A 87 8.846 -10.363 4.468 1.00 0.75 C ATOM 1041 NZ LYS A 87 9.968 -10.725 3.558 1.00 1.88 N ATOM 0 H LYS A 87 10.790 -6.453 3.175 1.00 0.61 H new ATOM 0 HA LYS A 87 8.507 -7.211 1.663 1.00 0.61 H new ATOM 0 HB2 LYS A 87 8.607 -5.757 4.350 1.00 0.72 H new ATOM 0 HB3 LYS A 87 7.273 -6.719 3.746 1.00 0.72 H new ATOM 0 HG2 LYS A 87 10.014 -7.996 3.890 1.00 0.52 H new ATOM 0 HG3 LYS A 87 9.113 -7.791 5.380 1.00 0.52 H new ATOM 0 HD2 LYS A 87 7.166 -9.004 4.394 1.00 0.56 H new ATOM 0 HD3 LYS A 87 8.017 -9.165 2.871 1.00 0.56 H new ATOM 0 HE2 LYS A 87 9.222 -10.197 5.478 1.00 0.75 H new ATOM 0 HE3 LYS A 87 8.130 -11.183 4.525 1.00 0.75 H new ATOM 0 HZ1 LYS A 87 10.082 -11.759 3.542 1.00 1.88 H new ATOM 0 HZ2 LYS A 87 9.760 -10.384 2.598 1.00 1.88 H new ATOM 0 HZ3 LYS A 87 10.847 -10.285 3.898 1.00 1.88 H new ATOM 1055 N ILE A 88 9.019 -4.006 1.843 1.00 0.40 N ATOM 1056 CA ILE A 88 8.506 -2.697 1.342 1.00 0.32 C ATOM 1057 C ILE A 88 8.475 -2.724 -0.190 1.00 0.32 C ATOM 1058 O ILE A 88 7.543 -2.252 -0.811 1.00 0.34 O ATOM 1059 CB ILE A 88 9.427 -1.571 1.825 1.00 0.16 C ATOM 1060 CG1 ILE A 88 9.374 -1.489 3.354 1.00 0.22 C ATOM 1061 CG2 ILE A 88 8.973 -0.236 1.232 1.00 0.29 C ATOM 1062 CD1 ILE A 88 7.938 -1.212 3.805 1.00 0.45 C ATOM 0 H ILE A 88 9.964 -3.985 2.225 1.00 0.40 H new ATOM 0 HA ILE A 88 7.499 -2.523 1.722 1.00 0.32 H new ATOM 0 HB ILE A 88 10.447 -1.781 1.502 1.00 0.16 H new ATOM 0 HG12 ILE A 88 9.729 -2.422 3.791 1.00 0.22 H new ATOM 0 HG13 ILE A 88 10.036 -0.699 3.709 1.00 0.22 H new ATOM 0 HG21 ILE A 88 9.632 0.559 1.580 1.00 0.29 H new ATOM 0 HG22 ILE A 88 9.011 -0.289 0.144 1.00 0.29 H new ATOM 0 HG23 ILE A 88 7.952 -0.025 1.549 1.00 0.29 H new ATOM 0 HD11 ILE A 88 7.903 -1.154 4.893 1.00 0.45 H new ATOM 0 HD12 ILE A 88 7.599 -0.267 3.380 1.00 0.45 H new ATOM 0 HD13 ILE A 88 7.288 -2.017 3.463 1.00 0.45 H new ATOM 1074 N ILE A 89 9.476 -3.295 -0.801 1.00 0.32 N ATOM 1075 CA ILE A 89 9.496 -3.380 -2.290 1.00 0.32 C ATOM 1076 C ILE A 89 8.368 -4.311 -2.715 1.00 0.37 C ATOM 1077 O ILE A 89 7.557 -4.008 -3.567 1.00 0.25 O ATOM 1078 CB ILE A 89 10.829 -3.986 -2.738 1.00 0.32 C ATOM 1079 CG1 ILE A 89 11.988 -3.253 -2.051 1.00 0.38 C ATOM 1080 CG2 ILE A 89 10.978 -3.851 -4.260 1.00 0.39 C ATOM 1081 CD1 ILE A 89 13.321 -3.823 -2.540 1.00 0.85 C ATOM 0 H ILE A 89 10.283 -3.707 -0.333 1.00 0.32 H new ATOM 0 HA ILE A 89 9.375 -2.392 -2.734 1.00 0.32 H new ATOM 0 HB ILE A 89 10.849 -5.041 -2.463 1.00 0.32 H new ATOM 0 HG12 ILE A 89 11.936 -2.186 -2.268 1.00 0.38 H new ATOM 0 HG13 ILE A 89 11.910 -3.362 -0.969 1.00 0.38 H new ATOM 0 HG21 ILE A 89 11.928 -4.284 -4.572 1.00 0.39 H new ATOM 0 HG22 ILE A 89 10.160 -4.376 -4.754 1.00 0.39 H new ATOM 0 HG23 ILE A 89 10.951 -2.797 -4.536 1.00 0.39 H new ATOM 0 HD11 ILE A 89 14.142 -3.300 -2.050 1.00 0.85 H new ATOM 0 HD12 ILE A 89 13.373 -4.885 -2.300 1.00 0.85 H new ATOM 0 HD13 ILE A 89 13.399 -3.691 -3.619 1.00 0.85 H new ATOM 1093 N THR A 90 8.329 -5.446 -2.092 1.00 0.57 N ATOM 1094 CA THR A 90 7.285 -6.463 -2.380 1.00 0.63 C ATOM 1095 C THR A 90 5.917 -5.930 -1.938 1.00 0.62 C ATOM 1096 O THR A 90 4.887 -6.431 -2.342 1.00 0.62 O ATOM 1097 CB THR A 90 7.597 -7.744 -1.588 1.00 0.83 C ATOM 1098 OG1 THR A 90 8.797 -7.592 -0.846 1.00 1.59 O ATOM 1099 CG2 THR A 90 7.748 -8.923 -2.541 1.00 0.95 C ATOM 0 H THR A 90 8.997 -5.722 -1.372 1.00 0.57 H new ATOM 0 HA THR A 90 7.271 -6.677 -3.449 1.00 0.63 H new ATOM 0 HB THR A 90 6.771 -7.929 -0.901 1.00 0.83 H new ATOM 0 HG1 THR A 90 8.736 -6.790 -0.287 1.00 1.59 H new ATOM 0 HG21 THR A 90 7.969 -9.826 -1.971 1.00 0.95 H new ATOM 0 HG22 THR A 90 6.821 -9.063 -3.097 1.00 0.95 H new ATOM 0 HG23 THR A 90 8.563 -8.726 -3.238 1.00 0.95 H new ATOM 1107 N GLY A 91 5.900 -4.931 -1.095 1.00 0.70 N ATOM 1108 CA GLY A 91 4.601 -4.383 -0.610 1.00 0.77 C ATOM 1109 C GLY A 91 4.121 -3.262 -1.533 1.00 0.71 C ATOM 1110 O GLY A 91 2.948 -2.949 -1.581 1.00 0.82 O ATOM 0 H GLY A 91 6.731 -4.471 -0.722 1.00 0.70 H new ATOM 0 HA2 GLY A 91 3.855 -5.177 -0.572 1.00 0.77 H new ATOM 0 HA3 GLY A 91 4.715 -4.004 0.406 1.00 0.77 H new ATOM 1114 N LEU A 92 5.012 -2.641 -2.253 1.00 0.56 N ATOM 1115 CA LEU A 92 4.589 -1.530 -3.151 1.00 0.53 C ATOM 1116 C LEU A 92 4.159 -2.083 -4.518 1.00 0.51 C ATOM 1117 O LEU A 92 3.259 -1.562 -5.140 1.00 0.48 O ATOM 1118 CB LEU A 92 5.750 -0.554 -3.336 1.00 0.45 C ATOM 1119 CG LEU A 92 6.073 0.116 -2.001 1.00 0.17 C ATOM 1120 CD1 LEU A 92 7.446 0.786 -2.087 1.00 0.18 C ATOM 1121 CD2 LEU A 92 5.010 1.172 -1.690 1.00 0.46 C ATOM 0 H LEU A 92 6.010 -2.853 -2.259 1.00 0.56 H new ATOM 0 HA LEU A 92 3.743 -1.013 -2.699 1.00 0.53 H new ATOM 0 HB2 LEU A 92 6.627 -1.082 -3.711 1.00 0.45 H new ATOM 0 HB3 LEU A 92 5.490 0.200 -4.079 1.00 0.45 H new ATOM 0 HG LEU A 92 6.082 -0.634 -1.210 1.00 0.17 H new ATOM 0 HD11 LEU A 92 7.678 1.264 -1.135 1.00 0.18 H new ATOM 0 HD12 LEU A 92 8.204 0.035 -2.310 1.00 0.18 H new ATOM 0 HD13 LEU A 92 7.436 1.537 -2.877 1.00 0.18 H new ATOM 0 HD21 LEU A 92 5.240 1.650 -0.738 1.00 0.46 H new ATOM 0 HD22 LEU A 92 5.001 1.923 -2.480 1.00 0.46 H new ATOM 0 HD23 LEU A 92 4.031 0.696 -1.630 1.00 0.46 H new ATOM 1133 N LEU A 93 4.787 -3.133 -4.993 1.00 0.53 N ATOM 1134 CA LEU A 93 4.381 -3.702 -6.318 1.00 0.53 C ATOM 1135 C LEU A 93 2.996 -4.332 -6.158 1.00 0.43 C ATOM 1136 O LEU A 93 2.087 -4.105 -6.948 1.00 0.36 O ATOM 1137 CB LEU A 93 5.395 -4.762 -6.763 1.00 0.62 C ATOM 1138 CG LEU A 93 6.804 -4.170 -6.708 1.00 0.61 C ATOM 1139 CD1 LEU A 93 7.822 -5.286 -6.460 1.00 0.53 C ATOM 1140 CD2 LEU A 93 7.121 -3.480 -8.036 1.00 0.96 C ATOM 0 H LEU A 93 5.555 -3.616 -4.527 1.00 0.53 H new ATOM 0 HA LEU A 93 4.351 -2.918 -7.075 1.00 0.53 H new ATOM 0 HB2 LEU A 93 5.331 -5.637 -6.116 1.00 0.62 H new ATOM 0 HB3 LEU A 93 5.168 -5.096 -7.775 1.00 0.62 H new ATOM 0 HG LEU A 93 6.858 -3.443 -5.897 1.00 0.61 H new ATOM 0 HD11 LEU A 93 8.825 -4.861 -6.421 1.00 0.53 H new ATOM 0 HD12 LEU A 93 7.599 -5.778 -5.513 1.00 0.53 H new ATOM 0 HD13 LEU A 93 7.767 -6.015 -7.269 1.00 0.53 H new ATOM 0 HD21 LEU A 93 8.125 -3.058 -7.996 1.00 0.96 H new ATOM 0 HD22 LEU A 93 7.064 -4.207 -8.846 1.00 0.96 H new ATOM 0 HD23 LEU A 93 6.399 -2.683 -8.213 1.00 0.96 H new ATOM 1152 N GLU A 94 2.813 -5.090 -5.111 1.00 0.46 N ATOM 1153 CA GLU A 94 1.477 -5.686 -4.868 1.00 0.38 C ATOM 1154 C GLU A 94 0.521 -4.523 -4.644 1.00 0.39 C ATOM 1155 O GLU A 94 -0.549 -4.456 -5.207 1.00 0.42 O ATOM 1156 CB GLU A 94 1.521 -6.573 -3.620 1.00 0.44 C ATOM 1157 CG GLU A 94 2.562 -7.681 -3.812 1.00 1.06 C ATOM 1158 CD GLU A 94 1.863 -8.997 -4.167 1.00 1.23 C ATOM 1159 OE1 GLU A 94 0.696 -9.136 -3.838 1.00 0.87 O ATOM 1160 OE2 GLU A 94 2.508 -9.845 -4.762 1.00 2.26 O ATOM 0 H GLU A 94 3.528 -5.319 -4.420 1.00 0.46 H new ATOM 0 HA GLU A 94 1.160 -6.304 -5.708 1.00 0.38 H new ATOM 0 HB2 GLU A 94 1.771 -5.974 -2.744 1.00 0.44 H new ATOM 0 HB3 GLU A 94 0.539 -7.010 -3.438 1.00 0.44 H new ATOM 0 HG2 GLU A 94 3.259 -7.404 -4.603 1.00 1.06 H new ATOM 0 HG3 GLU A 94 3.147 -7.804 -2.901 1.00 1.06 H new ATOM 1167 N PHE A 95 0.938 -3.574 -3.849 1.00 0.41 N ATOM 1168 CA PHE A 95 0.096 -2.372 -3.605 1.00 0.45 C ATOM 1169 C PHE A 95 -0.221 -1.722 -4.949 1.00 0.43 C ATOM 1170 O PHE A 95 -1.210 -1.042 -5.101 1.00 0.48 O ATOM 1171 CB PHE A 95 0.888 -1.371 -2.760 1.00 0.51 C ATOM 1172 CG PHE A 95 0.621 -1.575 -1.287 1.00 0.55 C ATOM 1173 CD1 PHE A 95 0.306 -2.844 -0.785 1.00 0.26 C ATOM 1174 CD2 PHE A 95 0.694 -0.480 -0.420 1.00 1.12 C ATOM 1175 CE1 PHE A 95 0.063 -3.016 0.578 1.00 0.24 C ATOM 1176 CE2 PHE A 95 0.453 -0.650 0.944 1.00 1.17 C ATOM 1177 CZ PHE A 95 0.137 -1.917 1.447 1.00 0.64 C ATOM 0 H PHE A 95 1.831 -3.582 -3.356 1.00 0.41 H new ATOM 0 HA PHE A 95 -0.821 -2.657 -3.089 1.00 0.45 H new ATOM 0 HB2 PHE A 95 1.954 -1.484 -2.959 1.00 0.51 H new ATOM 0 HB3 PHE A 95 0.617 -0.354 -3.045 1.00 0.51 H new ATOM 0 HD1 PHE A 95 0.251 -3.690 -1.454 1.00 0.26 H new ATOM 0 HD2 PHE A 95 0.937 0.499 -0.807 1.00 1.12 H new ATOM 0 HE1 PHE A 95 -0.182 -3.995 0.964 1.00 0.24 H new ATOM 0 HE2 PHE A 95 0.510 0.197 1.612 1.00 1.17 H new ATOM 0 HZ PHE A 95 -0.050 -2.049 2.503 1.00 0.64 H new ATOM 1187 N GLU A 96 0.633 -1.919 -5.917 1.00 0.37 N ATOM 1188 CA GLU A 96 0.418 -1.315 -7.259 1.00 0.37 C ATOM 1189 C GLU A 96 -0.838 -1.905 -7.897 1.00 0.40 C ATOM 1190 O GLU A 96 -1.666 -1.187 -8.419 1.00 0.41 O ATOM 1191 CB GLU A 96 1.630 -1.604 -8.141 1.00 0.30 C ATOM 1192 CG GLU A 96 1.668 -0.615 -9.308 1.00 0.85 C ATOM 1193 CD GLU A 96 0.818 -1.147 -10.467 1.00 1.34 C ATOM 1194 OE1 GLU A 96 0.300 -2.247 -10.346 1.00 1.57 O ATOM 1195 OE2 GLU A 96 0.700 -0.444 -11.457 1.00 2.01 O ATOM 0 H GLU A 96 1.480 -2.480 -5.832 1.00 0.37 H new ATOM 0 HA GLU A 96 0.291 -0.237 -7.157 1.00 0.37 H new ATOM 0 HB2 GLU A 96 2.545 -1.524 -7.555 1.00 0.30 H new ATOM 0 HB3 GLU A 96 1.581 -2.625 -8.519 1.00 0.30 H new ATOM 0 HG2 GLU A 96 1.293 0.356 -8.986 1.00 0.85 H new ATOM 0 HG3 GLU A 96 2.696 -0.466 -9.637 1.00 0.85 H new ATOM 1202 N VAL A 97 -1.004 -3.202 -7.862 1.00 0.40 N ATOM 1203 CA VAL A 97 -2.243 -3.778 -8.472 1.00 0.44 C ATOM 1204 C VAL A 97 -3.447 -3.261 -7.669 1.00 0.42 C ATOM 1205 O VAL A 97 -4.457 -2.857 -8.220 1.00 0.47 O ATOM 1206 CB VAL A 97 -2.181 -5.325 -8.482 1.00 0.49 C ATOM 1207 CG1 VAL A 97 -2.529 -5.922 -7.110 1.00 0.53 C ATOM 1208 CG2 VAL A 97 -3.171 -5.857 -9.521 1.00 0.70 C ATOM 0 H VAL A 97 -0.356 -3.873 -7.450 1.00 0.40 H new ATOM 0 HA VAL A 97 -2.338 -3.465 -9.512 1.00 0.44 H new ATOM 0 HB VAL A 97 -1.161 -5.619 -8.729 1.00 0.49 H new ATOM 0 HG11 VAL A 97 -2.473 -7.009 -7.162 1.00 0.53 H new ATOM 0 HG12 VAL A 97 -1.822 -5.557 -6.365 1.00 0.53 H new ATOM 0 HG13 VAL A 97 -3.539 -5.623 -6.829 1.00 0.53 H new ATOM 0 HG21 VAL A 97 -3.134 -6.946 -9.535 1.00 0.70 H new ATOM 0 HG22 VAL A 97 -4.179 -5.532 -9.263 1.00 0.70 H new ATOM 0 HG23 VAL A 97 -2.906 -5.473 -10.506 1.00 0.70 H new ATOM 1218 N TYR A 98 -3.329 -3.235 -6.368 1.00 0.38 N ATOM 1219 CA TYR A 98 -4.440 -2.710 -5.528 1.00 0.36 C ATOM 1220 C TYR A 98 -4.575 -1.205 -5.790 1.00 0.27 C ATOM 1221 O TYR A 98 -5.611 -0.608 -5.553 1.00 0.18 O ATOM 1222 CB TYR A 98 -4.124 -2.960 -4.054 1.00 0.38 C ATOM 1223 CG TYR A 98 -3.966 -4.445 -3.831 1.00 0.52 C ATOM 1224 CD1 TYR A 98 -5.080 -5.289 -3.912 1.00 0.69 C ATOM 1225 CD2 TYR A 98 -2.703 -4.979 -3.555 1.00 0.51 C ATOM 1226 CE1 TYR A 98 -4.930 -6.666 -3.714 1.00 0.85 C ATOM 1227 CE2 TYR A 98 -2.552 -6.356 -3.360 1.00 0.68 C ATOM 1228 CZ TYR A 98 -3.666 -7.200 -3.438 1.00 0.84 C ATOM 1229 OH TYR A 98 -3.518 -8.557 -3.240 1.00 1.01 O ATOM 0 H TYR A 98 -2.510 -3.555 -5.852 1.00 0.38 H new ATOM 0 HA TYR A 98 -5.375 -3.213 -5.776 1.00 0.36 H new ATOM 0 HB2 TYR A 98 -3.210 -2.437 -3.771 1.00 0.38 H new ATOM 0 HB3 TYR A 98 -4.924 -2.568 -3.426 1.00 0.38 H new ATOM 0 HD1 TYR A 98 -6.055 -4.877 -4.127 1.00 0.69 H new ATOM 0 HD2 TYR A 98 -1.844 -4.328 -3.492 1.00 0.51 H new ATOM 0 HE1 TYR A 98 -5.790 -7.317 -3.774 1.00 0.85 H new ATOM 0 HE2 TYR A 98 -1.576 -6.768 -3.149 1.00 0.68 H new ATOM 0 HH TYR A 98 -2.576 -8.761 -3.060 1.00 1.01 H new ATOM 1239 N LEU A 99 -3.547 -0.592 -6.322 1.00 0.30 N ATOM 1240 CA LEU A 99 -3.635 0.853 -6.644 1.00 0.22 C ATOM 1241 C LEU A 99 -4.478 0.958 -7.901 1.00 0.23 C ATOM 1242 O LEU A 99 -5.246 1.879 -8.079 1.00 0.19 O ATOM 1243 CB LEU A 99 -2.245 1.436 -6.900 1.00 0.24 C ATOM 1244 CG LEU A 99 -1.574 1.763 -5.569 1.00 0.31 C ATOM 1245 CD1 LEU A 99 -0.059 1.819 -5.761 1.00 0.23 C ATOM 1246 CD2 LEU A 99 -2.076 3.116 -5.073 1.00 0.57 C ATOM 0 H LEU A 99 -2.655 -1.034 -6.544 1.00 0.30 H new ATOM 0 HA LEU A 99 -4.074 1.410 -5.816 1.00 0.22 H new ATOM 0 HB2 LEU A 99 -1.638 0.724 -7.459 1.00 0.24 H new ATOM 0 HB3 LEU A 99 -2.324 2.336 -7.510 1.00 0.24 H new ATOM 0 HG LEU A 99 -1.816 0.992 -4.837 1.00 0.31 H new ATOM 0 HD11 LEU A 99 0.420 2.053 -4.810 1.00 0.23 H new ATOM 0 HD12 LEU A 99 0.298 0.854 -6.120 1.00 0.23 H new ATOM 0 HD13 LEU A 99 0.187 2.591 -6.490 1.00 0.23 H new ATOM 0 HD21 LEU A 99 -1.600 3.355 -4.122 1.00 0.57 H new ATOM 0 HD22 LEU A 99 -1.831 3.886 -5.805 1.00 0.57 H new ATOM 0 HD23 LEU A 99 -3.157 3.076 -4.937 1.00 0.57 H new ATOM 1258 N GLU A 100 -4.385 -0.041 -8.746 1.00 0.33 N ATOM 1259 CA GLU A 100 -5.229 -0.073 -9.960 1.00 0.37 C ATOM 1260 C GLU A 100 -6.668 -0.077 -9.458 1.00 0.32 C ATOM 1261 O GLU A 100 -7.560 0.501 -10.045 1.00 0.32 O ATOM 1262 CB GLU A 100 -4.937 -1.362 -10.733 1.00 0.47 C ATOM 1263 CG GLU A 100 -4.893 -1.073 -12.232 1.00 0.60 C ATOM 1264 CD GLU A 100 -6.296 -0.723 -12.731 1.00 0.82 C ATOM 1265 OE1 GLU A 100 -7.247 -1.263 -12.188 1.00 1.29 O ATOM 1266 OE2 GLU A 100 -6.396 0.077 -13.645 1.00 0.96 O ATOM 0 H GLU A 100 -3.754 -0.835 -8.638 1.00 0.33 H new ATOM 0 HA GLU A 100 -5.041 0.772 -10.623 1.00 0.37 H new ATOM 0 HB2 GLU A 100 -3.986 -1.784 -10.407 1.00 0.47 H new ATOM 0 HB3 GLU A 100 -5.705 -2.106 -10.520 1.00 0.47 H new ATOM 0 HG2 GLU A 100 -4.209 -0.249 -12.433 1.00 0.60 H new ATOM 0 HG3 GLU A 100 -4.512 -1.942 -12.769 1.00 0.60 H new ATOM 1273 N TYR A 101 -6.866 -0.707 -8.326 1.00 0.28 N ATOM 1274 CA TYR A 101 -8.206 -0.738 -7.704 1.00 0.23 C ATOM 1275 C TYR A 101 -8.652 0.692 -7.448 1.00 0.21 C ATOM 1276 O TYR A 101 -9.749 1.092 -7.786 1.00 0.21 O ATOM 1277 CB TYR A 101 -8.118 -1.484 -6.369 1.00 0.21 C ATOM 1278 CG TYR A 101 -9.188 -2.535 -6.318 1.00 0.23 C ATOM 1279 CD1 TYR A 101 -9.313 -3.436 -7.376 1.00 0.34 C ATOM 1280 CD2 TYR A 101 -10.059 -2.605 -5.225 1.00 0.22 C ATOM 1281 CE1 TYR A 101 -10.313 -4.411 -7.349 1.00 0.42 C ATOM 1282 CE2 TYR A 101 -11.058 -3.584 -5.193 1.00 0.33 C ATOM 1283 CZ TYR A 101 -11.187 -4.486 -6.257 1.00 0.42 C ATOM 1284 OH TYR A 101 -12.177 -5.445 -6.231 1.00 0.54 O ATOM 0 H TYR A 101 -6.141 -1.204 -7.808 1.00 0.28 H new ATOM 0 HA TYR A 101 -8.917 -1.241 -8.360 1.00 0.23 H new ATOM 0 HB2 TYR A 101 -7.135 -1.943 -6.260 1.00 0.21 H new ATOM 0 HB3 TYR A 101 -8.238 -0.786 -5.540 1.00 0.21 H new ATOM 0 HD1 TYR A 101 -8.636 -3.380 -8.216 1.00 0.34 H new ATOM 0 HD2 TYR A 101 -9.960 -1.905 -4.408 1.00 0.22 H new ATOM 0 HE1 TYR A 101 -10.412 -5.106 -8.169 1.00 0.42 H new ATOM 0 HE2 TYR A 101 -11.729 -3.644 -4.349 1.00 0.33 H new ATOM 0 HH TYR A 101 -12.270 -5.795 -5.320 1.00 0.54 H new ATOM 1294 N LEU A 102 -7.804 1.457 -6.833 1.00 0.20 N ATOM 1295 CA LEU A 102 -8.152 2.866 -6.517 1.00 0.19 C ATOM 1296 C LEU A 102 -7.698 3.795 -7.651 1.00 0.21 C ATOM 1297 O LEU A 102 -7.750 5.001 -7.527 1.00 0.21 O ATOM 1298 CB LEU A 102 -7.463 3.260 -5.211 1.00 0.20 C ATOM 1299 CG LEU A 102 -7.663 2.147 -4.174 1.00 0.18 C ATOM 1300 CD1 LEU A 102 -6.352 1.887 -3.438 1.00 0.16 C ATOM 1301 CD2 LEU A 102 -8.737 2.574 -3.179 1.00 0.20 C ATOM 0 H LEU A 102 -6.874 1.165 -6.532 1.00 0.20 H new ATOM 0 HA LEU A 102 -9.233 2.960 -6.410 1.00 0.19 H new ATOM 0 HB2 LEU A 102 -6.399 3.425 -5.383 1.00 0.20 H new ATOM 0 HB3 LEU A 102 -7.875 4.198 -4.838 1.00 0.20 H new ATOM 0 HG LEU A 102 -7.976 1.232 -4.677 1.00 0.18 H new ATOM 0 HD11 LEU A 102 -6.498 1.096 -2.702 1.00 0.16 H new ATOM 0 HD12 LEU A 102 -5.588 1.581 -4.153 1.00 0.16 H new ATOM 0 HD13 LEU A 102 -6.032 2.798 -2.932 1.00 0.16 H new ATOM 0 HD21 LEU A 102 -8.882 1.786 -2.440 1.00 0.20 H new ATOM 0 HD22 LEU A 102 -8.424 3.489 -2.677 1.00 0.20 H new ATOM 0 HD23 LEU A 102 -9.673 2.752 -3.708 1.00 0.20 H new ATOM 1313 N GLN A 103 -7.260 3.251 -8.755 1.00 0.22 N ATOM 1314 CA GLN A 103 -6.814 4.117 -9.882 1.00 0.26 C ATOM 1315 C GLN A 103 -7.948 4.236 -10.901 1.00 0.21 C ATOM 1316 O GLN A 103 -7.724 4.322 -12.092 1.00 0.98 O ATOM 1317 CB GLN A 103 -5.585 3.496 -10.553 1.00 0.34 C ATOM 1318 CG GLN A 103 -4.924 4.531 -11.467 1.00 0.44 C ATOM 1319 CD GLN A 103 -4.114 3.814 -12.549 1.00 0.62 C ATOM 1320 OE1 GLN A 103 -3.722 2.677 -12.379 1.00 1.00 O ATOM 1321 NE2 GLN A 103 -3.844 4.437 -13.664 1.00 1.25 N ATOM 0 H GLN A 103 -7.192 2.247 -8.924 1.00 0.22 H new ATOM 0 HA GLN A 103 -6.554 5.106 -9.504 1.00 0.26 H new ATOM 0 HB2 GLN A 103 -4.877 3.158 -9.797 1.00 0.34 H new ATOM 0 HB3 GLN A 103 -5.877 2.619 -11.131 1.00 0.34 H new ATOM 0 HG2 GLN A 103 -5.683 5.164 -11.926 1.00 0.44 H new ATOM 0 HG3 GLN A 103 -4.274 5.184 -10.884 1.00 0.44 H new ATOM 0 HE21 GLN A 103 -4.173 5.392 -13.807 1.00 1.25 H new ATOM 0 HE22 GLN A 103 -3.304 3.969 -14.392 1.00 1.25 H new ATOM 1330 N ASN A 104 -9.166 4.238 -10.438 1.00 0.69 N ATOM 1331 CA ASN A 104 -10.322 4.348 -11.372 1.00 0.53 C ATOM 1332 C ASN A 104 -11.623 4.314 -10.568 1.00 0.53 C ATOM 1333 O ASN A 104 -12.586 4.980 -10.898 1.00 0.54 O ATOM 1334 CB ASN A 104 -10.294 3.173 -12.353 1.00 0.46 C ATOM 1335 CG ASN A 104 -10.159 3.703 -13.783 1.00 0.40 C ATOM 1336 OD1 ASN A 104 -9.738 4.823 -13.993 1.00 1.22 O ATOM 1337 ND2 ASN A 104 -10.500 2.937 -14.783 1.00 0.49 N ATOM 0 H ASN A 104 -9.412 4.168 -9.451 1.00 0.69 H new ATOM 0 HA ASN A 104 -10.261 5.284 -11.927 1.00 0.53 H new ATOM 0 HB2 ASN A 104 -9.461 2.511 -12.119 1.00 0.46 H new ATOM 0 HB3 ASN A 104 -11.206 2.584 -12.257 1.00 0.46 H new ATOM 0 HD21 ASN A 104 -10.413 3.279 -15.740 1.00 0.49 H new ATOM 0 HD22 ASN A 104 -10.854 1.996 -14.608 1.00 0.49 H new ATOM 1344 N ARG A 105 -11.660 3.546 -9.512 1.00 0.52 N ATOM 1345 CA ARG A 105 -12.897 3.472 -8.686 1.00 0.51 C ATOM 1346 C ARG A 105 -13.267 4.876 -8.202 1.00 0.52 C ATOM 1347 O ARG A 105 -14.426 5.203 -8.044 1.00 0.52 O ATOM 1348 CB ARG A 105 -12.651 2.564 -7.479 1.00 0.54 C ATOM 1349 CG ARG A 105 -13.483 1.287 -7.617 1.00 0.14 C ATOM 1350 CD ARG A 105 -13.598 0.603 -6.254 1.00 1.04 C ATOM 1351 NE ARG A 105 -14.884 0.991 -5.610 1.00 1.69 N ATOM 1352 CZ ARG A 105 -15.955 0.275 -5.815 1.00 1.38 C ATOM 1353 NH1 ARG A 105 -15.940 -1.006 -5.563 1.00 2.23 N ATOM 1354 NH2 ARG A 105 -17.039 0.837 -6.276 1.00 1.36 N ATOM 0 H ARG A 105 -10.886 2.967 -9.187 1.00 0.52 H new ATOM 0 HA ARG A 105 -13.712 3.066 -9.285 1.00 0.51 H new ATOM 0 HB2 ARG A 105 -11.592 2.314 -7.409 1.00 0.54 H new ATOM 0 HB3 ARG A 105 -12.917 3.085 -6.559 1.00 0.54 H new ATOM 0 HG2 ARG A 105 -14.475 1.526 -8.000 1.00 0.14 H new ATOM 0 HG3 ARG A 105 -13.017 0.613 -8.336 1.00 0.14 H new ATOM 0 HD2 ARG A 105 -13.551 -0.479 -6.373 1.00 1.04 H new ATOM 0 HD3 ARG A 105 -12.760 0.890 -5.619 1.00 1.04 H new ATOM 0 HE ARG A 105 -14.927 1.815 -5.010 1.00 1.69 H new ATOM 0 HH11 ARG A 105 -15.092 -1.446 -5.206 1.00 2.23 H new ATOM 0 HH12 ARG A 105 -16.777 -1.567 -5.723 1.00 2.23 H new ATOM 0 HH21 ARG A 105 -17.049 1.837 -6.476 1.00 1.36 H new ATOM 0 HH22 ARG A 105 -17.876 0.276 -6.436 1.00 1.36 H new ATOM 1368 N PHE A 106 -12.289 5.708 -7.963 1.00 0.53 N ATOM 1369 CA PHE A 106 -12.584 7.089 -7.488 1.00 0.53 C ATOM 1370 C PHE A 106 -12.975 7.969 -8.677 1.00 0.52 C ATOM 1371 O PHE A 106 -12.166 8.268 -9.533 1.00 0.16 O ATOM 1372 CB PHE A 106 -11.344 7.670 -6.806 1.00 0.55 C ATOM 1373 CG PHE A 106 -11.374 7.324 -5.337 1.00 0.47 C ATOM 1374 CD1 PHE A 106 -12.390 7.833 -4.519 1.00 1.00 C ATOM 1375 CD2 PHE A 106 -10.388 6.491 -4.793 1.00 0.25 C ATOM 1376 CE1 PHE A 106 -12.420 7.510 -3.157 1.00 0.94 C ATOM 1377 CE2 PHE A 106 -10.418 6.168 -3.431 1.00 0.31 C ATOM 1378 CZ PHE A 106 -11.435 6.677 -2.614 1.00 0.35 C ATOM 0 H PHE A 106 -11.299 5.490 -8.076 1.00 0.53 H new ATOM 0 HA PHE A 106 -13.409 7.058 -6.776 1.00 0.53 H new ATOM 0 HB2 PHE A 106 -10.441 7.271 -7.267 1.00 0.55 H new ATOM 0 HB3 PHE A 106 -11.317 8.752 -6.936 1.00 0.55 H new ATOM 0 HD1 PHE A 106 -13.151 8.475 -4.939 1.00 1.00 H new ATOM 0 HD2 PHE A 106 -9.605 6.098 -5.424 1.00 0.25 H new ATOM 0 HE1 PHE A 106 -13.203 7.903 -2.526 1.00 0.94 H new ATOM 0 HE2 PHE A 106 -9.657 5.527 -3.011 1.00 0.31 H new ATOM 0 HZ PHE A 106 -11.459 6.427 -1.564 1.00 0.35 H new ATOM 1388 N GLU A 107 -14.210 8.386 -8.738 1.00 1.00 N ATOM 1389 CA GLU A 107 -14.655 9.246 -9.870 1.00 1.01 C ATOM 1390 C GLU A 107 -14.746 10.701 -9.400 1.00 1.03 C ATOM 1391 O GLU A 107 -14.593 11.626 -10.173 1.00 1.05 O ATOM 1392 CB GLU A 107 -16.030 8.777 -10.353 1.00 1.24 C ATOM 1393 CG GLU A 107 -16.544 9.720 -11.443 1.00 2.01 C ATOM 1394 CD GLU A 107 -17.511 8.966 -12.359 1.00 1.68 C ATOM 1395 OE1 GLU A 107 -17.210 7.834 -12.699 1.00 1.06 O ATOM 1396 OE2 GLU A 107 -18.534 9.534 -12.702 1.00 2.27 O ATOM 0 H GLU A 107 -14.931 8.167 -8.051 1.00 1.00 H new ATOM 0 HA GLU A 107 -13.938 9.174 -10.688 1.00 1.01 H new ATOM 0 HB2 GLU A 107 -15.963 7.760 -10.741 1.00 1.24 H new ATOM 0 HB3 GLU A 107 -16.731 8.754 -9.518 1.00 1.24 H new ATOM 0 HG2 GLU A 107 -17.047 10.575 -10.991 1.00 2.01 H new ATOM 0 HG3 GLU A 107 -15.708 10.112 -12.023 1.00 2.01 H new ATOM 1403 N SER A 108 -14.984 10.907 -8.136 1.00 1.07 N ATOM 1404 CA SER A 108 -15.074 12.299 -7.612 1.00 1.14 C ATOM 1405 C SER A 108 -13.682 12.730 -7.169 1.00 0.99 C ATOM 1406 O SER A 108 -13.220 13.811 -7.473 1.00 1.04 O ATOM 1407 CB SER A 108 -16.030 12.341 -6.419 1.00 1.28 C ATOM 1408 OG SER A 108 -17.286 12.856 -6.840 1.00 1.92 O ATOM 0 H SER A 108 -15.120 10.172 -7.442 1.00 1.07 H new ATOM 0 HA SER A 108 -15.449 12.969 -8.385 1.00 1.14 H new ATOM 0 HB2 SER A 108 -16.155 11.341 -6.003 1.00 1.28 H new ATOM 0 HB3 SER A 108 -15.615 12.965 -5.628 1.00 1.28 H new ATOM 0 HG SER A 108 -17.901 12.882 -6.077 1.00 1.92 H new ATOM 1414 N SER A 109 -13.005 11.866 -6.473 1.00 0.86 N ATOM 1415 CA SER A 109 -11.626 12.180 -6.021 1.00 0.76 C ATOM 1416 C SER A 109 -10.657 11.391 -6.898 1.00 0.61 C ATOM 1417 O SER A 109 -9.586 11.000 -6.477 1.00 0.51 O ATOM 1418 CB SER A 109 -11.460 11.764 -4.559 1.00 0.66 C ATOM 1419 OG SER A 109 -10.685 12.742 -3.880 1.00 0.81 O ATOM 0 H SER A 109 -13.351 10.948 -6.195 1.00 0.86 H new ATOM 0 HA SER A 109 -11.428 13.249 -6.104 1.00 0.76 H new ATOM 0 HB2 SER A 109 -12.436 11.662 -4.084 1.00 0.66 H new ATOM 0 HB3 SER A 109 -10.973 10.791 -4.498 1.00 0.66 H new ATOM 0 HG SER A 109 -10.207 12.321 -3.135 1.00 0.81 H new ATOM 1425 N GLU A 110 -11.048 11.143 -8.121 1.00 0.63 N ATOM 1426 CA GLU A 110 -10.193 10.368 -9.055 1.00 0.53 C ATOM 1427 C GLU A 110 -8.759 10.909 -9.043 1.00 0.37 C ATOM 1428 O GLU A 110 -7.807 10.166 -8.922 1.00 0.32 O ATOM 1429 CB GLU A 110 -10.766 10.485 -10.466 1.00 0.62 C ATOM 1430 CG GLU A 110 -10.318 9.286 -11.303 1.00 0.76 C ATOM 1431 CD GLU A 110 -11.446 8.866 -12.249 1.00 1.47 C ATOM 1432 OE1 GLU A 110 -12.393 9.624 -12.387 1.00 1.92 O ATOM 1433 OE2 GLU A 110 -11.343 7.793 -12.820 1.00 1.67 O ATOM 0 H GLU A 110 -11.938 11.451 -8.513 1.00 0.63 H new ATOM 0 HA GLU A 110 -10.176 9.325 -8.740 1.00 0.53 H new ATOM 0 HB2 GLU A 110 -11.854 10.526 -10.425 1.00 0.62 H new ATOM 0 HB3 GLU A 110 -10.429 11.412 -10.930 1.00 0.62 H new ATOM 0 HG2 GLU A 110 -9.427 9.543 -11.876 1.00 0.76 H new ATOM 0 HG3 GLU A 110 -10.049 8.455 -10.651 1.00 0.76 H new ATOM 1440 N GLU A 111 -8.601 12.197 -9.180 1.00 0.30 N ATOM 1441 CA GLU A 111 -7.231 12.788 -9.189 1.00 0.17 C ATOM 1442 C GLU A 111 -6.477 12.390 -7.917 1.00 0.19 C ATOM 1443 O GLU A 111 -5.325 12.009 -7.963 1.00 0.14 O ATOM 1444 CB GLU A 111 -7.337 14.313 -9.259 1.00 0.20 C ATOM 1445 CG GLU A 111 -6.576 14.823 -10.483 1.00 0.76 C ATOM 1446 CD GLU A 111 -7.258 16.084 -11.018 1.00 0.94 C ATOM 1447 OE1 GLU A 111 -8.421 15.998 -11.376 1.00 1.64 O ATOM 1448 OE2 GLU A 111 -6.606 17.114 -11.059 1.00 1.15 O ATOM 0 H GLU A 111 -9.362 12.867 -9.286 1.00 0.30 H new ATOM 0 HA GLU A 111 -6.688 12.414 -10.057 1.00 0.17 H new ATOM 0 HB2 GLU A 111 -8.383 14.613 -9.318 1.00 0.20 H new ATOM 0 HB3 GLU A 111 -6.928 14.758 -8.352 1.00 0.20 H new ATOM 0 HG2 GLU A 111 -5.542 15.041 -10.217 1.00 0.76 H new ATOM 0 HG3 GLU A 111 -6.551 14.054 -11.255 1.00 0.76 H new ATOM 1455 N GLN A 112 -7.114 12.481 -6.782 1.00 0.33 N ATOM 1456 CA GLN A 112 -6.424 12.111 -5.512 1.00 0.37 C ATOM 1457 C GLN A 112 -5.932 10.666 -5.601 1.00 0.36 C ATOM 1458 O GLN A 112 -4.870 10.330 -5.118 1.00 0.36 O ATOM 1459 CB GLN A 112 -7.399 12.258 -4.344 1.00 0.43 C ATOM 1460 CG GLN A 112 -7.871 13.711 -4.262 1.00 0.38 C ATOM 1461 CD GLN A 112 -6.792 14.563 -3.591 1.00 1.00 C ATOM 1462 OE1 GLN A 112 -5.740 14.066 -3.239 1.00 1.70 O ATOM 1463 NE2 GLN A 112 -7.008 15.835 -3.395 1.00 1.35 N ATOM 0 H GLN A 112 -8.079 12.794 -6.678 1.00 0.33 H new ATOM 0 HA GLN A 112 -5.570 12.770 -5.353 1.00 0.37 H new ATOM 0 HB2 GLN A 112 -8.252 11.593 -4.481 1.00 0.43 H new ATOM 0 HB3 GLN A 112 -6.915 11.967 -3.412 1.00 0.43 H new ATOM 0 HG2 GLN A 112 -8.081 14.093 -5.261 1.00 0.38 H new ATOM 0 HG3 GLN A 112 -8.800 13.771 -3.696 1.00 0.38 H new ATOM 0 HE21 GLN A 112 -7.890 16.254 -3.690 1.00 1.35 H new ATOM 0 HE22 GLN A 112 -6.295 16.410 -2.947 1.00 1.35 H new ATOM 1472 N ALA A 113 -6.692 9.811 -6.227 1.00 0.34 N ATOM 1473 CA ALA A 113 -6.263 8.389 -6.359 1.00 0.33 C ATOM 1474 C ALA A 113 -4.996 8.327 -7.212 1.00 0.31 C ATOM 1475 O ALA A 113 -4.054 7.620 -6.904 1.00 0.42 O ATOM 1476 CB ALA A 113 -7.375 7.589 -7.036 1.00 0.33 C ATOM 0 H ALA A 113 -7.591 10.035 -6.653 1.00 0.34 H new ATOM 0 HA ALA A 113 -6.062 7.968 -5.374 1.00 0.33 H new ATOM 0 HB1 ALA A 113 -7.066 6.548 -7.135 1.00 0.33 H new ATOM 0 HB2 ALA A 113 -8.281 7.643 -6.433 1.00 0.33 H new ATOM 0 HB3 ALA A 113 -7.572 8.004 -8.024 1.00 0.33 H new ATOM 1482 N ARG A 114 -4.967 9.069 -8.284 1.00 0.17 N ATOM 1483 CA ARG A 114 -3.768 9.069 -9.165 1.00 0.16 C ATOM 1484 C ARG A 114 -2.571 9.651 -8.407 1.00 0.16 C ATOM 1485 O ARG A 114 -1.436 9.486 -8.804 1.00 0.32 O ATOM 1486 CB ARG A 114 -4.052 9.927 -10.400 1.00 0.18 C ATOM 1487 CG ARG A 114 -3.323 9.344 -11.611 1.00 0.16 C ATOM 1488 CD ARG A 114 -4.075 9.729 -12.885 1.00 0.14 C ATOM 1489 NE ARG A 114 -3.994 8.612 -13.868 1.00 1.02 N ATOM 1490 CZ ARG A 114 -2.944 8.488 -14.633 1.00 1.19 C ATOM 1491 NH1 ARG A 114 -1.840 7.987 -14.149 1.00 3.07 N ATOM 1492 NH2 ARG A 114 -2.998 8.863 -15.882 1.00 0.66 N ATOM 0 H ARG A 114 -5.727 9.678 -8.588 1.00 0.17 H new ATOM 0 HA ARG A 114 -3.540 8.047 -9.469 1.00 0.16 H new ATOM 0 HB2 ARG A 114 -5.124 9.962 -10.591 1.00 0.18 H new ATOM 0 HB3 ARG A 114 -3.725 10.952 -10.226 1.00 0.18 H new ATOM 0 HG2 ARG A 114 -2.301 9.720 -11.650 1.00 0.16 H new ATOM 0 HG3 ARG A 114 -3.261 8.259 -11.525 1.00 0.16 H new ATOM 0 HD2 ARG A 114 -5.117 9.948 -12.653 1.00 0.14 H new ATOM 0 HD3 ARG A 114 -3.647 10.635 -13.313 1.00 0.14 H new ATOM 0 HE ARG A 114 -4.760 7.943 -13.943 1.00 1.02 H new ATOM 0 HH11 ARG A 114 -1.798 7.693 -13.173 1.00 3.07 H new ATOM 0 HH12 ARG A 114 -1.019 7.890 -14.747 1.00 3.07 H new ATOM 0 HH21 ARG A 114 -3.861 9.253 -16.260 1.00 0.66 H new ATOM 0 HH22 ARG A 114 -2.177 8.766 -16.480 1.00 0.66 H new ATOM 1506 N ALA A 115 -2.813 10.339 -7.323 1.00 0.21 N ATOM 1507 CA ALA A 115 -1.684 10.935 -6.556 1.00 0.23 C ATOM 1508 C ALA A 115 -1.077 9.888 -5.618 1.00 0.23 C ATOM 1509 O ALA A 115 0.128 9.772 -5.505 1.00 0.34 O ATOM 1510 CB ALA A 115 -2.199 12.113 -5.729 1.00 0.28 C ATOM 0 H ALA A 115 -3.741 10.513 -6.938 1.00 0.21 H new ATOM 0 HA ALA A 115 -0.920 11.278 -7.254 1.00 0.23 H new ATOM 0 HB1 ALA A 115 -1.374 12.551 -5.167 1.00 0.28 H new ATOM 0 HB2 ALA A 115 -2.625 12.865 -6.393 1.00 0.28 H new ATOM 0 HB3 ALA A 115 -2.965 11.764 -5.037 1.00 0.28 H new ATOM 1516 N VAL A 116 -1.893 9.131 -4.935 1.00 0.34 N ATOM 1517 CA VAL A 116 -1.341 8.111 -4.002 1.00 0.34 C ATOM 1518 C VAL A 116 -0.583 7.037 -4.795 1.00 0.38 C ATOM 1519 O VAL A 116 0.401 6.495 -4.334 1.00 0.42 O ATOM 1520 CB VAL A 116 -2.479 7.470 -3.193 1.00 0.30 C ATOM 1521 CG1 VAL A 116 -3.390 6.653 -4.113 1.00 0.30 C ATOM 1522 CG2 VAL A 116 -1.882 6.548 -2.124 1.00 0.73 C ATOM 0 H VAL A 116 -2.911 9.175 -4.983 1.00 0.34 H new ATOM 0 HA VAL A 116 -0.649 8.594 -3.312 1.00 0.34 H new ATOM 0 HB VAL A 116 -3.066 8.258 -2.721 1.00 0.30 H new ATOM 0 HG11 VAL A 116 -4.192 6.205 -3.526 1.00 0.30 H new ATOM 0 HG12 VAL A 116 -3.818 7.306 -4.874 1.00 0.30 H new ATOM 0 HG13 VAL A 116 -2.809 5.866 -4.595 1.00 0.30 H new ATOM 0 HG21 VAL A 116 -2.686 6.091 -1.547 1.00 0.73 H new ATOM 0 HG22 VAL A 116 -1.292 5.768 -2.605 1.00 0.73 H new ATOM 0 HG23 VAL A 116 -1.243 7.128 -1.459 1.00 0.73 H new ATOM 1532 N GLN A 117 -1.031 6.726 -5.982 1.00 0.40 N ATOM 1533 CA GLN A 117 -0.340 5.690 -6.798 1.00 0.47 C ATOM 1534 C GLN A 117 0.905 6.285 -7.464 1.00 0.47 C ATOM 1535 O GLN A 117 1.950 5.670 -7.497 1.00 0.47 O ATOM 1536 CB GLN A 117 -1.302 5.189 -7.878 1.00 0.46 C ATOM 1537 CG GLN A 117 -0.615 4.117 -8.723 1.00 0.70 C ATOM 1538 CD GLN A 117 -1.189 4.141 -10.141 1.00 0.13 C ATOM 1539 OE1 GLN A 117 -1.832 5.094 -10.532 1.00 0.70 O ATOM 1540 NE2 GLN A 117 -0.985 3.123 -10.934 1.00 0.66 N ATOM 0 H GLN A 117 -1.849 7.147 -6.422 1.00 0.40 H new ATOM 0 HA GLN A 117 -0.035 4.866 -6.153 1.00 0.47 H new ATOM 0 HB2 GLN A 117 -2.201 4.781 -7.417 1.00 0.46 H new ATOM 0 HB3 GLN A 117 -1.617 6.018 -8.511 1.00 0.46 H new ATOM 0 HG2 GLN A 117 0.460 4.294 -8.751 1.00 0.70 H new ATOM 0 HG3 GLN A 117 -0.764 3.135 -8.275 1.00 0.70 H new ATOM 0 HE21 GLN A 117 -0.445 2.322 -10.607 1.00 0.66 H new ATOM 0 HE22 GLN A 117 -1.366 3.129 -11.880 1.00 0.66 H new ATOM 1549 N MET A 118 0.801 7.465 -8.010 1.00 0.52 N ATOM 1550 CA MET A 118 1.983 8.078 -8.686 1.00 0.55 C ATOM 1551 C MET A 118 3.196 8.053 -7.752 1.00 0.47 C ATOM 1552 O MET A 118 4.213 7.465 -8.061 1.00 0.27 O ATOM 1553 CB MET A 118 1.658 9.525 -9.063 1.00 0.70 C ATOM 1554 CG MET A 118 0.895 9.547 -10.390 1.00 0.76 C ATOM 1555 SD MET A 118 1.948 10.247 -11.685 1.00 1.29 S ATOM 1556 CE MET A 118 1.048 11.803 -11.890 1.00 1.79 C ATOM 0 H MET A 118 -0.047 8.031 -8.018 1.00 0.52 H new ATOM 0 HA MET A 118 2.216 7.507 -9.585 1.00 0.55 H new ATOM 0 HB2 MET A 118 1.060 9.991 -8.280 1.00 0.70 H new ATOM 0 HB3 MET A 118 2.577 10.105 -9.150 1.00 0.70 H new ATOM 0 HG2 MET A 118 0.590 8.537 -10.662 1.00 0.76 H new ATOM 0 HG3 MET A 118 -0.015 10.138 -10.288 1.00 0.76 H new ATOM 0 HE1 MET A 118 1.533 12.406 -12.658 1.00 1.79 H new ATOM 0 HE2 MET A 118 0.021 11.593 -12.189 1.00 1.79 H new ATOM 0 HE3 MET A 118 1.046 12.349 -10.947 1.00 1.79 H new ATOM 1566 N SER A 119 3.102 8.687 -6.616 1.00 0.67 N ATOM 1567 CA SER A 119 4.255 8.694 -5.670 1.00 0.65 C ATOM 1568 C SER A 119 4.524 7.265 -5.193 1.00 0.50 C ATOM 1569 O SER A 119 5.656 6.825 -5.105 1.00 0.38 O ATOM 1570 CB SER A 119 3.920 9.576 -4.468 1.00 0.90 C ATOM 1571 OG SER A 119 5.034 10.407 -4.167 1.00 1.59 O ATOM 0 H SER A 119 2.278 9.200 -6.301 1.00 0.67 H new ATOM 0 HA SER A 119 5.139 9.085 -6.173 1.00 0.65 H new ATOM 0 HB2 SER A 119 3.044 10.188 -4.685 1.00 0.90 H new ATOM 0 HB3 SER A 119 3.671 8.956 -3.606 1.00 0.90 H new ATOM 0 HG SER A 119 4.716 11.283 -3.862 1.00 1.59 H new ATOM 1577 N THR A 120 3.486 6.535 -4.889 1.00 0.56 N ATOM 1578 CA THR A 120 3.666 5.134 -4.419 1.00 0.54 C ATOM 1579 C THR A 120 4.469 4.341 -5.466 1.00 0.48 C ATOM 1580 O THR A 120 5.065 3.327 -5.163 1.00 0.53 O ATOM 1581 CB THR A 120 2.277 4.512 -4.181 1.00 0.69 C ATOM 1582 OG1 THR A 120 1.752 5.013 -2.960 1.00 2.14 O ATOM 1583 CG2 THR A 120 2.365 2.986 -4.097 1.00 1.00 C ATOM 0 H THR A 120 2.518 6.851 -4.946 1.00 0.56 H new ATOM 0 HA THR A 120 4.224 5.109 -3.483 1.00 0.54 H new ATOM 0 HB THR A 120 1.629 4.776 -5.017 1.00 0.69 H new ATOM 0 HG1 THR A 120 0.876 5.421 -3.123 1.00 2.14 H new ATOM 0 HG21 THR A 120 1.370 2.573 -3.929 1.00 1.00 H new ATOM 0 HG22 THR A 120 2.768 2.593 -5.030 1.00 1.00 H new ATOM 0 HG23 THR A 120 3.019 2.704 -3.272 1.00 1.00 H new ATOM 1591 N LYS A 121 4.508 4.808 -6.685 1.00 0.48 N ATOM 1592 CA LYS A 121 5.293 4.099 -7.737 1.00 0.48 C ATOM 1593 C LYS A 121 6.722 4.642 -7.714 1.00 0.49 C ATOM 1594 O LYS A 121 7.678 3.943 -7.988 1.00 0.56 O ATOM 1595 CB LYS A 121 4.673 4.372 -9.110 1.00 0.46 C ATOM 1596 CG LYS A 121 3.659 3.278 -9.446 1.00 0.69 C ATOM 1597 CD LYS A 121 4.337 2.193 -10.286 1.00 0.83 C ATOM 1598 CE LYS A 121 3.336 1.623 -11.292 1.00 1.22 C ATOM 1599 NZ LYS A 121 3.094 2.622 -12.370 1.00 0.91 N ATOM 0 H LYS A 121 4.029 5.652 -6.998 1.00 0.48 H new ATOM 0 HA LYS A 121 5.289 3.025 -7.549 1.00 0.48 H new ATOM 0 HB2 LYS A 121 4.185 5.346 -9.112 1.00 0.46 H new ATOM 0 HB3 LYS A 121 5.452 4.405 -9.871 1.00 0.46 H new ATOM 0 HG2 LYS A 121 3.258 2.845 -8.529 1.00 0.69 H new ATOM 0 HG3 LYS A 121 2.817 3.703 -9.993 1.00 0.69 H new ATOM 0 HD2 LYS A 121 5.198 2.609 -10.810 1.00 0.83 H new ATOM 0 HD3 LYS A 121 4.711 1.399 -9.640 1.00 0.83 H new ATOM 0 HE2 LYS A 121 3.720 0.697 -11.719 1.00 1.22 H new ATOM 0 HE3 LYS A 121 2.399 1.378 -10.791 1.00 1.22 H new ATOM 0 HZ1 LYS A 121 2.784 2.133 -13.234 1.00 0.91 H new ATOM 0 HZ2 LYS A 121 2.356 3.289 -12.066 1.00 0.91 H new ATOM 0 HZ3 LYS A 121 3.973 3.143 -12.564 1.00 0.91 H new ATOM 1613 N VAL A 122 6.860 5.896 -7.387 1.00 0.44 N ATOM 1614 CA VAL A 122 8.204 6.530 -7.332 1.00 0.45 C ATOM 1615 C VAL A 122 9.088 5.790 -6.331 1.00 0.42 C ATOM 1616 O VAL A 122 10.284 5.708 -6.506 1.00 0.38 O ATOM 1617 CB VAL A 122 8.046 7.987 -6.903 1.00 0.57 C ATOM 1618 CG1 VAL A 122 9.422 8.646 -6.780 1.00 0.58 C ATOM 1619 CG2 VAL A 122 7.228 8.725 -7.959 1.00 0.62 C ATOM 0 H VAL A 122 6.086 6.517 -7.152 1.00 0.44 H new ATOM 0 HA VAL A 122 8.672 6.483 -8.315 1.00 0.45 H new ATOM 0 HB VAL A 122 7.542 8.030 -5.938 1.00 0.57 H new ATOM 0 HG11 VAL A 122 9.302 9.685 -6.474 1.00 0.58 H new ATOM 0 HG12 VAL A 122 10.015 8.115 -6.035 1.00 0.58 H new ATOM 0 HG13 VAL A 122 9.931 8.608 -7.743 1.00 0.58 H new ATOM 0 HG21 VAL A 122 7.108 9.767 -7.664 1.00 0.62 H new ATOM 0 HG22 VAL A 122 7.744 8.677 -8.918 1.00 0.62 H new ATOM 0 HG23 VAL A 122 6.247 8.259 -8.051 1.00 0.62 H new ATOM 1629 N LEU A 123 8.524 5.254 -5.283 1.00 0.49 N ATOM 1630 CA LEU A 123 9.375 4.520 -4.300 1.00 0.49 C ATOM 1631 C LEU A 123 9.682 3.125 -4.848 1.00 0.35 C ATOM 1632 O LEU A 123 10.661 2.503 -4.485 1.00 0.34 O ATOM 1633 CB LEU A 123 8.654 4.395 -2.948 1.00 0.65 C ATOM 1634 CG LEU A 123 8.380 5.780 -2.329 1.00 0.39 C ATOM 1635 CD1 LEU A 123 9.552 6.742 -2.564 1.00 0.94 C ATOM 1636 CD2 LEU A 123 7.114 6.370 -2.946 1.00 0.49 C ATOM 0 H LEU A 123 7.528 5.290 -5.066 1.00 0.49 H new ATOM 0 HA LEU A 123 10.301 5.074 -4.148 1.00 0.49 H new ATOM 0 HB2 LEU A 123 7.713 3.862 -3.083 1.00 0.65 H new ATOM 0 HB3 LEU A 123 9.260 3.802 -2.263 1.00 0.65 H new ATOM 0 HG LEU A 123 8.254 5.651 -1.254 1.00 0.39 H new ATOM 0 HD11 LEU A 123 9.325 7.709 -2.115 1.00 0.94 H new ATOM 0 HD12 LEU A 123 10.455 6.334 -2.110 1.00 0.94 H new ATOM 0 HD13 LEU A 123 9.710 6.868 -3.635 1.00 0.94 H new ATOM 0 HD21 LEU A 123 6.919 7.349 -2.509 1.00 0.49 H new ATOM 0 HD22 LEU A 123 7.248 6.473 -4.023 1.00 0.49 H new ATOM 0 HD23 LEU A 123 6.270 5.709 -2.747 1.00 0.49 H new ATOM 1648 N ILE A 124 8.850 2.632 -5.723 1.00 0.29 N ATOM 1649 CA ILE A 124 9.085 1.283 -6.306 1.00 0.17 C ATOM 1650 C ILE A 124 10.305 1.325 -7.225 1.00 0.19 C ATOM 1651 O ILE A 124 11.164 0.467 -7.173 1.00 0.18 O ATOM 1652 CB ILE A 124 7.857 0.863 -7.117 1.00 0.23 C ATOM 1653 CG1 ILE A 124 6.638 0.796 -6.197 1.00 0.56 C ATOM 1654 CG2 ILE A 124 8.094 -0.513 -7.736 1.00 0.26 C ATOM 1655 CD1 ILE A 124 5.407 0.392 -7.011 1.00 0.51 C ATOM 0 H ILE A 124 8.014 3.109 -6.060 1.00 0.29 H new ATOM 0 HA ILE A 124 9.261 0.567 -5.503 1.00 0.17 H new ATOM 0 HB ILE A 124 7.683 1.593 -7.908 1.00 0.23 H new ATOM 0 HG12 ILE A 124 6.811 0.075 -5.398 1.00 0.56 H new ATOM 0 HG13 ILE A 124 6.473 1.764 -5.723 1.00 0.56 H new ATOM 0 HG21 ILE A 124 7.217 -0.808 -8.313 1.00 0.26 H new ATOM 0 HG22 ILE A 124 8.963 -0.472 -8.392 1.00 0.26 H new ATOM 0 HG23 ILE A 124 8.271 -1.242 -6.945 1.00 0.26 H new ATOM 0 HD11 ILE A 124 4.537 0.344 -6.356 1.00 0.51 H new ATOM 0 HD12 ILE A 124 5.231 1.129 -7.794 1.00 0.51 H new ATOM 0 HD13 ILE A 124 5.575 -0.585 -7.464 1.00 0.51 H new ATOM 1667 N GLN A 125 10.385 2.311 -8.075 1.00 0.25 N ATOM 1668 CA GLN A 125 11.540 2.399 -9.001 1.00 0.30 C ATOM 1669 C GLN A 125 12.738 2.999 -8.265 1.00 0.32 C ATOM 1670 O GLN A 125 13.872 2.629 -8.494 1.00 0.32 O ATOM 1671 CB GLN A 125 11.154 3.290 -10.177 1.00 0.36 C ATOM 1672 CG GLN A 125 10.723 2.414 -11.351 1.00 0.40 C ATOM 1673 CD GLN A 125 11.456 2.855 -12.620 1.00 0.93 C ATOM 1674 OE1 GLN A 125 11.908 2.032 -13.391 1.00 2.41 O ATOM 1675 NE2 GLN A 125 11.594 4.129 -12.870 1.00 1.39 N ATOM 0 H GLN A 125 9.697 3.059 -8.166 1.00 0.25 H new ATOM 0 HA GLN A 125 11.809 1.407 -9.363 1.00 0.30 H new ATOM 0 HB2 GLN A 125 10.343 3.959 -9.890 1.00 0.36 H new ATOM 0 HB3 GLN A 125 11.998 3.917 -10.466 1.00 0.36 H new ATOM 0 HG2 GLN A 125 10.943 1.368 -11.137 1.00 0.40 H new ATOM 0 HG3 GLN A 125 9.645 2.489 -11.497 1.00 0.40 H new ATOM 0 HE21 GLN A 125 11.214 4.820 -12.223 1.00 1.39 H new ATOM 0 HE22 GLN A 125 12.081 4.433 -13.713 1.00 1.39 H new ATOM 1684 N PHE A 126 12.491 3.924 -7.382 1.00 0.33 N ATOM 1685 CA PHE A 126 13.609 4.555 -6.627 1.00 0.34 C ATOM 1686 C PHE A 126 14.308 3.497 -5.767 1.00 0.36 C ATOM 1687 O PHE A 126 15.488 3.586 -5.501 1.00 0.39 O ATOM 1688 CB PHE A 126 13.053 5.654 -5.711 1.00 0.35 C ATOM 1689 CG PHE A 126 12.802 6.935 -6.487 1.00 0.22 C ATOM 1690 CD1 PHE A 126 12.463 6.899 -7.850 1.00 0.38 C ATOM 1691 CD2 PHE A 126 12.899 8.169 -5.830 1.00 0.35 C ATOM 1692 CE1 PHE A 126 12.228 8.091 -8.546 1.00 0.26 C ATOM 1693 CE2 PHE A 126 12.661 9.359 -6.526 1.00 0.51 C ATOM 1694 CZ PHE A 126 12.326 9.320 -7.885 1.00 0.33 C ATOM 0 H PHE A 126 11.561 4.272 -7.149 1.00 0.33 H new ATOM 0 HA PHE A 126 14.320 4.986 -7.332 1.00 0.34 H new ATOM 0 HB2 PHE A 126 12.124 5.315 -5.253 1.00 0.35 H new ATOM 0 HB3 PHE A 126 13.756 5.847 -4.901 1.00 0.35 H new ATOM 0 HD1 PHE A 126 12.384 5.951 -8.361 1.00 0.38 H new ATOM 0 HD2 PHE A 126 13.159 8.201 -4.782 1.00 0.35 H new ATOM 0 HE1 PHE A 126 11.971 8.062 -9.595 1.00 0.26 H new ATOM 0 HE2 PHE A 126 12.736 10.308 -6.015 1.00 0.51 H new ATOM 0 HZ PHE A 126 12.143 10.239 -8.423 1.00 0.33 H new ATOM 1704 N LEU A 127 13.587 2.502 -5.325 1.00 0.37 N ATOM 1705 CA LEU A 127 14.208 1.444 -4.473 1.00 0.40 C ATOM 1706 C LEU A 127 14.940 0.431 -5.355 1.00 0.40 C ATOM 1707 O LEU A 127 16.120 0.189 -5.190 1.00 0.51 O ATOM 1708 CB LEU A 127 13.106 0.726 -3.682 1.00 0.41 C ATOM 1709 CG LEU A 127 13.672 0.113 -2.390 1.00 1.64 C ATOM 1710 CD1 LEU A 127 14.894 -0.754 -2.706 1.00 3.24 C ATOM 1711 CD2 LEU A 127 14.076 1.226 -1.418 1.00 0.72 C ATOM 0 H LEU A 127 12.593 2.375 -5.517 1.00 0.37 H new ATOM 0 HA LEU A 127 14.920 1.902 -3.787 1.00 0.40 H new ATOM 0 HB2 LEU A 127 12.310 1.430 -3.438 1.00 0.41 H new ATOM 0 HB3 LEU A 127 12.662 -0.057 -4.297 1.00 0.41 H new ATOM 0 HG LEU A 127 12.902 -0.508 -1.933 1.00 1.64 H new ATOM 0 HD11 LEU A 127 15.285 -1.182 -1.783 1.00 3.24 H new ATOM 0 HD12 LEU A 127 14.605 -1.557 -3.384 1.00 3.24 H new ATOM 0 HD13 LEU A 127 15.663 -0.141 -3.176 1.00 3.24 H new ATOM 0 HD21 LEU A 127 14.476 0.784 -0.505 1.00 0.72 H new ATOM 0 HD22 LEU A 127 14.837 1.855 -1.881 1.00 0.72 H new ATOM 0 HD23 LEU A 127 13.203 1.832 -1.176 1.00 0.72 H new ATOM 1723 N GLN A 128 14.251 -0.167 -6.287 1.00 0.46 N ATOM 1724 CA GLN A 128 14.898 -1.171 -7.179 1.00 0.45 C ATOM 1725 C GLN A 128 16.184 -0.577 -7.767 1.00 0.35 C ATOM 1726 O GLN A 128 17.116 -1.284 -8.096 1.00 0.43 O ATOM 1727 CB GLN A 128 13.939 -1.535 -8.315 1.00 0.50 C ATOM 1728 CG GLN A 128 12.891 -2.524 -7.798 1.00 0.82 C ATOM 1729 CD GLN A 128 12.761 -3.690 -8.779 1.00 1.43 C ATOM 1730 OE1 GLN A 128 13.251 -4.772 -8.524 1.00 2.80 O ATOM 1731 NE2 GLN A 128 12.114 -3.514 -9.900 1.00 0.65 N ATOM 0 H GLN A 128 13.261 -0.002 -6.470 1.00 0.46 H new ATOM 0 HA GLN A 128 15.140 -2.066 -6.606 1.00 0.45 H new ATOM 0 HB2 GLN A 128 13.452 -0.638 -8.696 1.00 0.50 H new ATOM 0 HB3 GLN A 128 14.491 -1.975 -9.145 1.00 0.50 H new ATOM 0 HG2 GLN A 128 13.179 -2.894 -6.814 1.00 0.82 H new ATOM 0 HG3 GLN A 128 11.930 -2.024 -7.682 1.00 0.82 H new ATOM 0 HE21 GLN A 128 11.703 -2.606 -10.114 1.00 0.65 H new ATOM 0 HE22 GLN A 128 12.020 -4.285 -10.561 1.00 0.65 H new ATOM 1740 N LYS A 129 16.238 0.722 -7.896 1.00 0.34 N ATOM 1741 CA LYS A 129 17.457 1.370 -8.458 1.00 0.23 C ATOM 1742 C LYS A 129 18.484 1.585 -7.345 1.00 0.40 C ATOM 1743 O LYS A 129 19.660 1.333 -7.516 1.00 0.39 O ATOM 1744 CB LYS A 129 17.082 2.724 -9.065 1.00 0.37 C ATOM 1745 CG LYS A 129 16.007 2.526 -10.135 1.00 0.51 C ATOM 1746 CD LYS A 129 16.672 2.166 -11.465 1.00 1.72 C ATOM 1747 CE LYS A 129 16.995 3.444 -12.241 1.00 1.28 C ATOM 1748 NZ LYS A 129 18.318 3.976 -11.803 1.00 2.57 N ATOM 0 H LYS A 129 15.488 1.363 -7.636 1.00 0.34 H new ATOM 0 HA LYS A 129 17.883 0.727 -9.229 1.00 0.23 H new ATOM 0 HB2 LYS A 129 16.716 3.394 -8.287 1.00 0.37 H new ATOM 0 HB3 LYS A 129 17.963 3.194 -9.502 1.00 0.37 H new ATOM 0 HG2 LYS A 129 15.320 1.735 -9.834 1.00 0.51 H new ATOM 0 HG3 LYS A 129 15.417 3.436 -10.246 1.00 0.51 H new ATOM 0 HD2 LYS A 129 17.585 1.598 -11.285 1.00 1.72 H new ATOM 0 HD3 LYS A 129 16.011 1.529 -12.053 1.00 1.72 H new ATOM 0 HE2 LYS A 129 17.011 3.237 -13.311 1.00 1.28 H new ATOM 0 HE3 LYS A 129 16.218 4.190 -12.072 1.00 1.28 H new ATOM 0 HZ1 LYS A 129 18.784 4.449 -12.603 1.00 2.57 H new ATOM 0 HZ2 LYS A 129 18.179 4.658 -11.030 1.00 2.57 H new ATOM 0 HZ3 LYS A 129 18.914 3.192 -11.469 1.00 2.57 H new ATOM 1762 N LYS A 130 18.052 2.054 -6.204 1.00 0.63 N ATOM 1763 CA LYS A 130 19.011 2.285 -5.090 1.00 0.81 C ATOM 1764 C LYS A 130 19.120 1.029 -4.221 1.00 0.92 C ATOM 1765 O LYS A 130 19.567 1.089 -3.093 1.00 1.12 O ATOM 1766 CB LYS A 130 18.558 3.488 -4.244 1.00 0.98 C ATOM 1767 CG LYS A 130 17.335 3.122 -3.393 1.00 1.36 C ATOM 1768 CD LYS A 130 17.694 3.240 -1.911 1.00 1.41 C ATOM 1769 CE LYS A 130 17.126 2.042 -1.150 1.00 2.05 C ATOM 1770 NZ LYS A 130 18.050 1.679 -0.039 1.00 2.15 N ATOM 0 H LYS A 130 17.080 2.286 -5.998 1.00 0.63 H new ATOM 0 HA LYS A 130 19.994 2.504 -5.507 1.00 0.81 H new ATOM 0 HB2 LYS A 130 19.373 3.812 -3.597 1.00 0.98 H new ATOM 0 HB3 LYS A 130 18.316 4.327 -4.896 1.00 0.98 H new ATOM 0 HG2 LYS A 130 16.502 3.783 -3.630 1.00 1.36 H new ATOM 0 HG3 LYS A 130 17.011 2.106 -3.620 1.00 1.36 H new ATOM 0 HD2 LYS A 130 18.777 3.280 -1.791 1.00 1.41 H new ATOM 0 HD3 LYS A 130 17.293 4.167 -1.502 1.00 1.41 H new ATOM 0 HE2 LYS A 130 16.140 2.283 -0.753 1.00 2.05 H new ATOM 0 HE3 LYS A 130 17.000 1.195 -1.824 1.00 2.05 H new ATOM 0 HZ1 LYS A 130 17.522 1.175 0.701 1.00 2.15 H new ATOM 0 HZ2 LYS A 130 18.807 1.065 -0.403 1.00 2.15 H new ATOM 0 HZ3 LYS A 130 18.468 2.543 0.361 1.00 2.15 H new ATOM 1784 N ALA A 131 18.727 -0.109 -4.733 1.00 0.83 N ATOM 1785 CA ALA A 131 18.834 -1.356 -3.923 1.00 1.01 C ATOM 1786 C ALA A 131 20.238 -1.954 -4.092 1.00 1.18 C ATOM 1787 O ALA A 131 20.393 -3.140 -4.307 1.00 1.42 O ATOM 1788 CB ALA A 131 17.785 -2.372 -4.387 1.00 0.91 C ATOM 0 H ALA A 131 18.340 -0.227 -5.669 1.00 0.83 H new ATOM 0 HA ALA A 131 18.660 -1.119 -2.873 1.00 1.01 H new ATOM 0 HB1 ALA A 131 17.869 -3.280 -3.791 1.00 0.91 H new ATOM 0 HB2 ALA A 131 16.788 -1.948 -4.263 1.00 0.91 H new ATOM 0 HB3 ALA A 131 17.950 -2.611 -5.438 1.00 0.91 H new ATOM 1794 N LYS A 132 21.265 -1.148 -3.995 1.00 1.12 N ATOM 1795 CA LYS A 132 22.648 -1.682 -4.145 1.00 1.27 C ATOM 1796 C LYS A 132 22.885 -2.760 -3.088 1.00 1.30 C ATOM 1797 O LYS A 132 22.484 -2.626 -1.949 1.00 1.26 O ATOM 1798 CB LYS A 132 23.659 -0.548 -3.951 1.00 1.38 C ATOM 1799 CG LYS A 132 23.290 0.254 -2.702 1.00 1.23 C ATOM 1800 CD LYS A 132 24.510 1.037 -2.213 1.00 1.35 C ATOM 1801 CE LYS A 132 24.127 1.860 -0.981 1.00 1.10 C ATOM 1802 NZ LYS A 132 23.268 3.005 -1.397 1.00 1.24 N ATOM 0 H LYS A 132 21.203 -0.145 -3.819 1.00 1.12 H new ATOM 0 HA LYS A 132 22.770 -2.108 -5.141 1.00 1.27 H new ATOM 0 HB2 LYS A 132 24.665 -0.956 -3.851 1.00 1.38 H new ATOM 0 HB3 LYS A 132 23.665 0.102 -4.826 1.00 1.38 H new ATOM 0 HG2 LYS A 132 22.472 0.939 -2.926 1.00 1.23 H new ATOM 0 HG3 LYS A 132 22.938 -0.417 -1.918 1.00 1.23 H new ATOM 0 HD2 LYS A 132 25.321 0.351 -1.968 1.00 1.35 H new ATOM 0 HD3 LYS A 132 24.875 1.693 -3.003 1.00 1.35 H new ATOM 0 HE2 LYS A 132 23.596 1.235 -0.263 1.00 1.10 H new ATOM 0 HE3 LYS A 132 25.024 2.227 -0.482 1.00 1.10 H new ATOM 0 HZ1 LYS A 132 23.216 3.699 -0.624 1.00 1.24 H new ATOM 0 HZ2 LYS A 132 23.676 3.456 -2.241 1.00 1.24 H new ATOM 0 HZ3 LYS A 132 22.312 2.660 -1.617 1.00 1.24 H new ATOM 1816 N ASN A 133 23.527 -3.835 -3.457 1.00 1.38 N ATOM 1817 CA ASN A 133 23.780 -4.928 -2.475 1.00 1.42 C ATOM 1818 C ASN A 133 22.457 -5.344 -1.840 1.00 1.16 C ATOM 1819 O ASN A 133 22.378 -5.648 -0.666 1.00 1.20 O ATOM 1820 CB ASN A 133 24.746 -4.443 -1.393 1.00 1.64 C ATOM 1821 CG ASN A 133 25.551 -5.630 -0.858 1.00 2.11 C ATOM 1822 OD1 ASN A 133 25.760 -6.600 -1.559 1.00 2.91 O ATOM 1823 ND2 ASN A 133 26.015 -5.595 0.361 1.00 1.91 N ATOM 0 H ASN A 133 23.887 -4.004 -4.396 1.00 1.38 H new ATOM 0 HA ASN A 133 24.225 -5.782 -2.986 1.00 1.42 H new ATOM 0 HB2 ASN A 133 25.418 -3.689 -1.802 1.00 1.64 H new ATOM 0 HB3 ASN A 133 24.192 -3.970 -0.582 1.00 1.64 H new ATOM 0 HD21 ASN A 133 26.553 -6.382 0.725 1.00 1.91 H new ATOM 0 HD22 ASN A 133 25.840 -4.781 0.950 1.00 1.91 H new ATOM 1830 N LEU A 134 21.423 -5.362 -2.624 1.00 0.98 N ATOM 1831 CA LEU A 134 20.089 -5.757 -2.107 1.00 0.83 C ATOM 1832 C LEU A 134 19.577 -6.946 -2.913 1.00 1.54 C ATOM 1833 O LEU A 134 20.345 -7.728 -3.436 1.00 2.21 O ATOM 1834 CB LEU A 134 19.116 -4.579 -2.216 1.00 0.62 C ATOM 1835 CG LEU A 134 18.275 -4.502 -0.939 1.00 0.35 C ATOM 1836 CD1 LEU A 134 18.934 -3.536 0.048 1.00 0.54 C ATOM 1837 CD2 LEU A 134 16.871 -4.003 -1.282 1.00 0.95 C ATOM 0 H LEU A 134 21.445 -5.117 -3.614 1.00 0.98 H new ATOM 0 HA LEU A 134 20.169 -6.040 -1.057 1.00 0.83 H new ATOM 0 HB2 LEU A 134 19.666 -3.649 -2.360 1.00 0.62 H new ATOM 0 HB3 LEU A 134 18.470 -4.705 -3.085 1.00 0.62 H new ATOM 0 HG LEU A 134 18.208 -5.492 -0.488 1.00 0.35 H new ATOM 0 HD11 LEU A 134 18.336 -3.481 0.957 1.00 0.54 H new ATOM 0 HD12 LEU A 134 19.935 -3.892 0.293 1.00 0.54 H new ATOM 0 HD13 LEU A 134 19.002 -2.546 -0.402 1.00 0.54 H new ATOM 0 HD21 LEU A 134 16.272 -3.948 -0.373 1.00 0.95 H new ATOM 0 HD22 LEU A 134 16.937 -3.013 -1.733 1.00 0.95 H new ATOM 0 HD23 LEU A 134 16.402 -4.692 -1.985 1.00 0.95 H new ATOM 1849 N ASP A 135 18.291 -7.106 -2.999 1.00 1.43 N ATOM 1850 CA ASP A 135 17.748 -8.271 -3.755 1.00 2.12 C ATOM 1851 C ASP A 135 16.899 -7.814 -4.924 1.00 1.31 C ATOM 1852 O ASP A 135 16.861 -8.452 -5.957 1.00 1.73 O ATOM 1853 CB ASP A 135 16.903 -9.138 -2.819 1.00 3.09 C ATOM 1854 CG ASP A 135 17.690 -10.392 -2.439 1.00 4.01 C ATOM 1855 OD1 ASP A 135 18.577 -10.282 -1.609 1.00 4.70 O ATOM 1856 OD2 ASP A 135 17.393 -11.441 -2.986 1.00 4.39 O ATOM 0 H ASP A 135 17.594 -6.488 -2.584 1.00 1.43 H new ATOM 0 HA ASP A 135 18.586 -8.849 -4.144 1.00 2.12 H new ATOM 0 HB2 ASP A 135 16.640 -8.575 -1.923 1.00 3.09 H new ATOM 0 HB3 ASP A 135 15.969 -9.416 -3.307 1.00 3.09 H new ATOM 1861 N ALA A 136 16.196 -6.738 -4.742 1.00 0.98 N ATOM 1862 CA ALA A 136 15.285 -6.188 -5.793 1.00 0.70 C ATOM 1863 C ALA A 136 13.901 -6.791 -5.609 1.00 0.47 C ATOM 1864 O ALA A 136 12.895 -6.193 -5.938 1.00 1.09 O ATOM 1865 CB ALA A 136 15.800 -6.465 -7.213 1.00 0.66 C ATOM 0 H ALA A 136 16.212 -6.194 -3.880 1.00 0.98 H new ATOM 0 HA ALA A 136 15.246 -5.105 -5.677 1.00 0.70 H new ATOM 0 HB1 ALA A 136 15.104 -6.046 -7.940 1.00 0.66 H new ATOM 0 HB2 ALA A 136 16.780 -6.005 -7.341 1.00 0.66 H new ATOM 0 HB3 ALA A 136 15.882 -7.541 -7.367 1.00 0.66 H new ATOM 1871 N ILE A 137 13.845 -7.951 -5.032 1.00 0.50 N ATOM 1872 CA ILE A 137 12.552 -8.598 -4.747 1.00 0.57 C ATOM 1873 C ILE A 137 11.736 -8.826 -6.031 1.00 0.27 C ATOM 1874 O ILE A 137 10.580 -9.192 -5.978 1.00 0.52 O ATOM 1875 CB ILE A 137 11.810 -7.708 -3.738 1.00 0.95 C ATOM 1876 CG1 ILE A 137 12.490 -7.830 -2.364 1.00 1.62 C ATOM 1877 CG2 ILE A 137 10.350 -8.137 -3.605 1.00 1.01 C ATOM 1878 CD1 ILE A 137 13.921 -7.281 -2.417 1.00 1.56 C ATOM 0 H ILE A 137 14.663 -8.487 -4.741 1.00 0.50 H new ATOM 0 HA ILE A 137 12.707 -9.590 -4.323 1.00 0.57 H new ATOM 0 HB ILE A 137 11.844 -6.678 -4.093 1.00 0.95 H new ATOM 0 HG12 ILE A 137 11.913 -7.284 -1.617 1.00 1.62 H new ATOM 0 HG13 ILE A 137 12.507 -8.874 -2.053 1.00 1.62 H new ATOM 0 HG21 ILE A 137 9.845 -7.492 -2.885 1.00 1.01 H new ATOM 0 HG22 ILE A 137 9.857 -8.055 -4.574 1.00 1.01 H new ATOM 0 HG23 ILE A 137 10.304 -9.170 -3.261 1.00 1.01 H new ATOM 0 HD11 ILE A 137 14.384 -7.377 -1.435 1.00 1.56 H new ATOM 0 HD12 ILE A 137 14.500 -7.845 -3.148 1.00 1.56 H new ATOM 0 HD13 ILE A 137 13.897 -6.230 -2.706 1.00 1.56 H new ATOM 1890 N THR A 138 12.331 -8.656 -7.184 1.00 0.85 N ATOM 1891 CA THR A 138 11.588 -8.897 -8.458 1.00 1.43 C ATOM 1892 C THR A 138 10.187 -8.268 -8.395 1.00 1.33 C ATOM 1893 O THR A 138 9.951 -7.325 -7.665 1.00 1.11 O ATOM 1894 CB THR A 138 11.461 -10.407 -8.680 1.00 1.86 C ATOM 1895 OG1 THR A 138 12.497 -11.077 -7.973 1.00 2.03 O ATOM 1896 CG2 THR A 138 11.577 -10.719 -10.172 1.00 2.47 C ATOM 0 H THR A 138 13.300 -8.360 -7.298 1.00 0.85 H new ATOM 0 HA THR A 138 12.135 -8.440 -9.282 1.00 1.43 H new ATOM 0 HB THR A 138 10.492 -10.746 -8.315 1.00 1.86 H new ATOM 0 HG1 THR A 138 12.416 -12.044 -8.113 1.00 2.03 H new ATOM 0 HG21 THR A 138 11.486 -11.794 -10.327 1.00 2.47 H new ATOM 0 HG22 THR A 138 10.782 -10.206 -10.714 1.00 2.47 H new ATOM 0 HG23 THR A 138 12.545 -10.380 -10.540 1.00 2.47 H new ATOM 1904 N THR A 139 9.255 -8.792 -9.145 1.00 1.51 N ATOM 1905 CA THR A 139 7.874 -8.238 -9.119 1.00 1.43 C ATOM 1906 C THR A 139 6.906 -9.282 -9.704 1.00 1.60 C ATOM 1907 O THR A 139 7.285 -10.036 -10.578 1.00 1.76 O ATOM 1908 CB THR A 139 7.833 -6.934 -9.939 1.00 1.60 C ATOM 1909 OG1 THR A 139 6.651 -6.215 -9.629 1.00 1.51 O ATOM 1910 CG2 THR A 139 7.862 -7.235 -11.443 1.00 1.88 C ATOM 0 H THR A 139 9.393 -9.582 -9.776 1.00 1.51 H new ATOM 0 HA THR A 139 7.574 -8.013 -8.096 1.00 1.43 H new ATOM 0 HB THR A 139 8.710 -6.339 -9.684 1.00 1.60 H new ATOM 0 HG1 THR A 139 6.371 -5.694 -10.410 1.00 1.51 H new ATOM 0 HG21 THR A 139 7.832 -6.300 -12.002 1.00 1.88 H new ATOM 0 HG22 THR A 139 8.776 -7.775 -11.688 1.00 1.88 H new ATOM 0 HG23 THR A 139 6.998 -7.844 -11.709 1.00 1.88 H new ATOM 1958 N THR A 143 0.311 -10.559 -15.534 1.00 2.04 N ATOM 1959 CA THR A 143 -0.639 -11.600 -16.014 1.00 1.98 C ATOM 1960 C THR A 143 -1.219 -12.318 -14.798 1.00 1.87 C ATOM 1961 O THR A 143 -2.404 -12.577 -14.722 1.00 1.77 O ATOM 1962 CB THR A 143 0.098 -12.603 -16.905 1.00 2.09 C ATOM 1963 OG1 THR A 143 1.262 -13.065 -16.232 1.00 2.09 O ATOM 1964 CG2 THR A 143 0.498 -11.925 -18.215 1.00 2.70 C ATOM 0 HA THR A 143 -1.438 -11.139 -16.594 1.00 1.98 H new ATOM 0 HB THR A 143 -0.556 -13.448 -17.121 1.00 2.09 H new ATOM 0 HG1 THR A 143 1.680 -12.320 -15.752 1.00 2.09 H new ATOM 0 HG21 THR A 143 1.023 -12.640 -18.849 1.00 2.70 H new ATOM 0 HG22 THR A 143 -0.396 -11.571 -18.729 1.00 2.70 H new ATOM 0 HG23 THR A 143 1.153 -11.080 -18.002 1.00 2.70 H new ATOM 1972 N THR A 144 -0.393 -12.620 -13.833 1.00 1.92 N ATOM 1973 CA THR A 144 -0.894 -13.293 -12.605 1.00 1.85 C ATOM 1974 C THR A 144 -1.546 -12.236 -11.719 1.00 1.61 C ATOM 1975 O THR A 144 -2.511 -12.492 -11.024 1.00 1.49 O ATOM 1976 CB THR A 144 0.275 -13.945 -11.864 1.00 2.03 C ATOM 1977 OG1 THR A 144 1.175 -14.509 -12.809 1.00 2.32 O ATOM 1978 CG2 THR A 144 -0.250 -15.042 -10.939 1.00 2.15 C ATOM 0 H THR A 144 0.609 -12.428 -13.844 1.00 1.92 H new ATOM 0 HA THR A 144 -1.618 -14.066 -12.862 1.00 1.85 H new ATOM 0 HB THR A 144 0.794 -13.193 -11.270 1.00 2.03 H new ATOM 0 HG1 THR A 144 1.926 -14.926 -12.337 1.00 2.32 H new ATOM 0 HG21 THR A 144 0.585 -15.505 -10.413 1.00 2.15 H new ATOM 0 HG22 THR A 144 -0.940 -14.608 -10.215 1.00 2.15 H new ATOM 0 HG23 THR A 144 -0.770 -15.797 -11.529 1.00 2.15 H new ATOM 1986 N ASN A 145 -1.038 -11.033 -11.761 1.00 1.55 N ATOM 1987 CA ASN A 145 -1.642 -9.947 -10.949 1.00 1.32 C ATOM 1988 C ASN A 145 -3.017 -9.621 -11.529 1.00 1.16 C ATOM 1989 O ASN A 145 -3.859 -9.054 -10.867 1.00 0.98 O ATOM 1990 CB ASN A 145 -0.750 -8.705 -10.992 1.00 1.27 C ATOM 1991 CG ASN A 145 -0.440 -8.256 -9.563 1.00 1.19 C ATOM 1992 OD1 ASN A 145 0.654 -7.813 -9.276 1.00 1.18 O ATOM 1993 ND2 ASN A 145 -1.364 -8.352 -8.646 1.00 1.14 N ATOM 0 H ASN A 145 -0.232 -10.760 -12.323 1.00 1.55 H new ATOM 0 HA ASN A 145 -1.740 -10.266 -9.911 1.00 1.32 H new ATOM 0 HB2 ASN A 145 0.175 -8.926 -11.525 1.00 1.27 H new ATOM 0 HB3 ASN A 145 -1.249 -7.904 -11.537 1.00 1.27 H new ATOM 0 HD21 ASN A 145 -1.167 -8.055 -7.690 1.00 1.14 H new ATOM 0 HD22 ASN A 145 -2.283 -8.724 -8.885 1.00 1.14 H new ATOM 2000 N ALA A 146 -3.260 -9.999 -12.758 1.00 1.25 N ATOM 2001 CA ALA A 146 -4.591 -9.744 -13.369 1.00 1.16 C ATOM 2002 C ALA A 146 -5.574 -10.758 -12.797 1.00 1.10 C ATOM 2003 O ALA A 146 -6.761 -10.517 -12.721 1.00 0.96 O ATOM 2004 CB ALA A 146 -4.496 -9.912 -14.887 1.00 1.43 C ATOM 0 H ALA A 146 -2.590 -10.474 -13.363 1.00 1.25 H new ATOM 0 HA ALA A 146 -4.925 -8.730 -13.149 1.00 1.16 H new ATOM 0 HB1 ALA A 146 -5.472 -9.725 -15.336 1.00 1.43 H new ATOM 0 HB2 ALA A 146 -3.771 -9.203 -15.287 1.00 1.43 H new ATOM 0 HB3 ALA A 146 -4.177 -10.928 -15.121 1.00 1.43 H new ATOM 2010 N SER A 147 -5.080 -11.889 -12.375 1.00 1.24 N ATOM 2011 CA SER A 147 -5.976 -12.911 -11.783 1.00 1.26 C ATOM 2012 C SER A 147 -6.315 -12.488 -10.353 1.00 1.15 C ATOM 2013 O SER A 147 -7.416 -12.676 -9.886 1.00 1.10 O ATOM 2014 CB SER A 147 -5.270 -14.266 -11.778 1.00 1.49 C ATOM 2015 OG SER A 147 -5.397 -14.867 -13.060 1.00 2.81 O ATOM 0 H SER A 147 -4.094 -12.146 -12.416 1.00 1.24 H new ATOM 0 HA SER A 147 -6.892 -12.997 -12.367 1.00 1.26 H new ATOM 0 HB2 SER A 147 -4.217 -14.139 -11.526 1.00 1.49 H new ATOM 0 HB3 SER A 147 -5.705 -14.913 -11.016 1.00 1.49 H new ATOM 0 HG SER A 147 -4.944 -15.736 -13.060 1.00 2.81 H new ATOM 2021 N LEU A 148 -5.382 -11.893 -9.656 1.00 1.14 N ATOM 2022 CA LEU A 148 -5.684 -11.438 -8.268 1.00 1.05 C ATOM 2023 C LEU A 148 -6.676 -10.276 -8.361 1.00 0.87 C ATOM 2024 O LEU A 148 -7.617 -10.196 -7.607 1.00 0.80 O ATOM 2025 CB LEU A 148 -4.392 -10.976 -7.569 1.00 1.03 C ATOM 2026 CG LEU A 148 -4.721 -10.047 -6.382 1.00 0.94 C ATOM 2027 CD1 LEU A 148 -5.691 -10.733 -5.418 1.00 1.03 C ATOM 2028 CD2 LEU A 148 -3.440 -9.703 -5.638 1.00 0.94 C ATOM 0 H LEU A 148 -4.435 -11.704 -9.984 1.00 1.14 H new ATOM 0 HA LEU A 148 -6.110 -12.255 -7.686 1.00 1.05 H new ATOM 0 HB2 LEU A 148 -3.833 -11.843 -7.216 1.00 1.03 H new ATOM 0 HB3 LEU A 148 -3.753 -10.453 -8.281 1.00 1.03 H new ATOM 0 HG LEU A 148 -5.185 -9.139 -6.767 1.00 0.94 H new ATOM 0 HD11 LEU A 148 -5.912 -10.064 -4.587 1.00 1.03 H new ATOM 0 HD12 LEU A 148 -6.614 -10.977 -5.943 1.00 1.03 H new ATOM 0 HD13 LEU A 148 -5.238 -11.648 -5.036 1.00 1.03 H new ATOM 0 HD21 LEU A 148 -3.672 -9.047 -4.799 1.00 0.94 H new ATOM 0 HD22 LEU A 148 -2.978 -10.618 -5.266 1.00 0.94 H new ATOM 0 HD23 LEU A 148 -2.751 -9.198 -6.315 1.00 0.94 H new ATOM 2040 N LEU A 149 -6.461 -9.379 -9.286 1.00 0.80 N ATOM 2041 CA LEU A 149 -7.383 -8.221 -9.442 1.00 0.63 C ATOM 2042 C LEU A 149 -8.752 -8.754 -9.853 1.00 0.53 C ATOM 2043 O LEU A 149 -9.776 -8.238 -9.456 1.00 0.42 O ATOM 2044 CB LEU A 149 -6.832 -7.281 -10.521 1.00 0.61 C ATOM 2045 CG LEU A 149 -7.846 -6.175 -10.827 1.00 0.56 C ATOM 2046 CD1 LEU A 149 -8.177 -5.412 -9.543 1.00 0.56 C ATOM 2047 CD2 LEU A 149 -7.250 -5.209 -11.854 1.00 0.63 C ATOM 0 H LEU A 149 -5.681 -9.401 -9.943 1.00 0.80 H new ATOM 0 HA LEU A 149 -7.471 -7.667 -8.507 1.00 0.63 H new ATOM 0 HB2 LEU A 149 -5.893 -6.841 -10.185 1.00 0.61 H new ATOM 0 HB3 LEU A 149 -6.613 -7.845 -11.428 1.00 0.61 H new ATOM 0 HG LEU A 149 -8.757 -6.619 -11.229 1.00 0.56 H new ATOM 0 HD11 LEU A 149 -8.899 -4.625 -9.763 1.00 0.56 H new ATOM 0 HD12 LEU A 149 -8.601 -6.099 -8.811 1.00 0.56 H new ATOM 0 HD13 LEU A 149 -7.267 -4.967 -9.139 1.00 0.56 H new ATOM 0 HD21 LEU A 149 -7.970 -4.421 -12.073 1.00 0.63 H new ATOM 0 HD22 LEU A 149 -6.339 -4.766 -11.451 1.00 0.63 H new ATOM 0 HD23 LEU A 149 -7.015 -5.751 -12.770 1.00 0.63 H new ATOM 2059 N THR A 150 -8.777 -9.804 -10.626 1.00 0.58 N ATOM 2060 CA THR A 150 -10.081 -10.385 -11.031 1.00 0.49 C ATOM 2061 C THR A 150 -10.740 -10.973 -9.773 1.00 0.47 C ATOM 2062 O THR A 150 -11.947 -11.071 -9.671 1.00 0.36 O ATOM 2063 CB THR A 150 -9.848 -11.452 -12.134 1.00 0.54 C ATOM 2064 OG1 THR A 150 -10.983 -11.493 -12.985 1.00 0.57 O ATOM 2065 CG2 THR A 150 -9.609 -12.855 -11.555 1.00 0.55 C ATOM 0 H THR A 150 -7.953 -10.281 -10.992 1.00 0.58 H new ATOM 0 HA THR A 150 -10.747 -9.632 -11.453 1.00 0.49 H new ATOM 0 HB THR A 150 -8.952 -11.165 -12.684 1.00 0.54 H new ATOM 0 HG1 THR A 150 -10.843 -12.164 -13.686 1.00 0.57 H new ATOM 0 HG21 THR A 150 -9.452 -13.563 -12.369 1.00 0.55 H new ATOM 0 HG22 THR A 150 -8.728 -12.839 -10.913 1.00 0.55 H new ATOM 0 HG23 THR A 150 -10.477 -13.161 -10.971 1.00 0.55 H new ATOM 2073 N LYS A 151 -9.933 -11.355 -8.813 1.00 0.64 N ATOM 2074 CA LYS A 151 -10.465 -11.927 -7.547 1.00 0.70 C ATOM 2075 C LYS A 151 -11.028 -10.798 -6.683 1.00 0.67 C ATOM 2076 O LYS A 151 -12.050 -10.948 -6.042 1.00 0.66 O ATOM 2077 CB LYS A 151 -9.329 -12.623 -6.793 1.00 0.83 C ATOM 2078 CG LYS A 151 -9.684 -14.092 -6.569 1.00 1.90 C ATOM 2079 CD LYS A 151 -8.632 -14.735 -5.664 1.00 2.47 C ATOM 2080 CE LYS A 151 -9.075 -14.618 -4.206 1.00 2.26 C ATOM 2081 NZ LYS A 151 -10.025 -15.722 -3.890 1.00 2.98 N ATOM 0 H LYS A 151 -8.916 -11.292 -8.858 1.00 0.64 H new ATOM 0 HA LYS A 151 -11.253 -12.647 -7.769 1.00 0.70 H new ATOM 0 HB2 LYS A 151 -8.402 -12.545 -7.361 1.00 0.83 H new ATOM 0 HB3 LYS A 151 -9.159 -12.130 -5.836 1.00 0.83 H new ATOM 0 HG2 LYS A 151 -10.671 -14.174 -6.114 1.00 1.90 H new ATOM 0 HG3 LYS A 151 -9.729 -14.617 -7.523 1.00 1.90 H new ATOM 0 HD2 LYS A 151 -8.498 -15.783 -5.932 1.00 2.47 H new ATOM 0 HD3 LYS A 151 -7.668 -14.245 -5.803 1.00 2.47 H new ATOM 0 HE2 LYS A 151 -8.209 -14.668 -3.546 1.00 2.26 H new ATOM 0 HE3 LYS A 151 -9.551 -13.653 -4.035 1.00 2.26 H new ATOM 0 HZ1 LYS A 151 -10.329 -15.645 -2.898 1.00 2.98 H new ATOM 0 HZ2 LYS A 151 -10.855 -15.654 -4.513 1.00 2.98 H new ATOM 0 HZ3 LYS A 151 -9.555 -16.638 -4.038 1.00 2.98 H new ATOM 2095 N LEU A 152 -10.384 -9.660 -6.670 1.00 0.67 N ATOM 2096 CA LEU A 152 -10.909 -8.533 -5.860 1.00 0.65 C ATOM 2097 C LEU A 152 -12.223 -8.093 -6.486 1.00 0.56 C ATOM 2098 O LEU A 152 -13.128 -7.635 -5.817 1.00 0.54 O ATOM 2099 CB LEU A 152 -9.943 -7.338 -5.881 1.00 0.70 C ATOM 2100 CG LEU A 152 -8.481 -7.793 -5.901 1.00 0.82 C ATOM 2101 CD1 LEU A 152 -7.576 -6.569 -5.748 1.00 0.53 C ATOM 2102 CD2 LEU A 152 -8.218 -8.758 -4.746 1.00 1.01 C ATOM 0 H LEU A 152 -9.524 -9.468 -7.183 1.00 0.67 H new ATOM 0 HA LEU A 152 -11.035 -8.860 -4.828 1.00 0.65 H new ATOM 0 HB2 LEU A 152 -10.145 -6.722 -6.757 1.00 0.70 H new ATOM 0 HB3 LEU A 152 -10.118 -6.713 -5.005 1.00 0.70 H new ATOM 0 HG LEU A 152 -8.274 -8.298 -6.844 1.00 0.82 H new ATOM 0 HD11 LEU A 152 -6.533 -6.884 -5.761 1.00 0.53 H new ATOM 0 HD12 LEU A 152 -7.757 -5.878 -6.571 1.00 0.53 H new ATOM 0 HD13 LEU A 152 -7.793 -6.072 -4.802 1.00 0.53 H new ATOM 0 HD21 LEU A 152 -7.176 -9.076 -4.768 1.00 1.01 H new ATOM 0 HD22 LEU A 152 -8.425 -8.258 -3.800 1.00 1.01 H new ATOM 0 HD23 LEU A 152 -8.866 -9.629 -4.845 1.00 1.01 H new ATOM 2114 N GLN A 153 -12.324 -8.221 -7.781 1.00 0.58 N ATOM 2115 CA GLN A 153 -13.563 -7.804 -8.477 1.00 0.58 C ATOM 2116 C GLN A 153 -14.530 -8.989 -8.602 1.00 0.69 C ATOM 2117 O GLN A 153 -15.664 -8.830 -9.010 1.00 0.88 O ATOM 2118 CB GLN A 153 -13.204 -7.278 -9.868 1.00 0.48 C ATOM 2119 CG GLN A 153 -12.837 -5.795 -9.773 1.00 0.41 C ATOM 2120 CD GLN A 153 -14.015 -4.938 -10.240 1.00 0.87 C ATOM 2121 OE1 GLN A 153 -15.030 -5.456 -10.661 1.00 1.39 O ATOM 2122 NE2 GLN A 153 -13.923 -3.637 -10.183 1.00 1.49 N ATOM 0 H GLN A 153 -11.595 -8.599 -8.386 1.00 0.58 H new ATOM 0 HA GLN A 153 -14.051 -7.018 -7.901 1.00 0.58 H new ATOM 0 HB2 GLN A 153 -12.368 -7.845 -10.279 1.00 0.48 H new ATOM 0 HB3 GLN A 153 -14.045 -7.413 -10.548 1.00 0.48 H new ATOM 0 HG2 GLN A 153 -12.575 -5.541 -8.746 1.00 0.41 H new ATOM 0 HG3 GLN A 153 -11.960 -5.588 -10.386 1.00 0.41 H new ATOM 0 HE21 GLN A 153 -13.071 -3.201 -9.830 1.00 1.49 H new ATOM 0 HE22 GLN A 153 -14.703 -3.057 -10.492 1.00 1.49 H new ATOM 2131 N ALA A 154 -14.099 -10.174 -8.256 1.00 0.62 N ATOM 2132 CA ALA A 154 -15.003 -11.354 -8.359 1.00 0.74 C ATOM 2133 C ALA A 154 -15.547 -11.699 -6.970 1.00 0.99 C ATOM 2134 O ALA A 154 -15.636 -12.851 -6.595 1.00 1.56 O ATOM 2135 CB ALA A 154 -14.224 -12.551 -8.910 1.00 0.80 C ATOM 0 H ALA A 154 -13.162 -10.374 -7.907 1.00 0.62 H new ATOM 0 HA ALA A 154 -15.830 -11.120 -9.029 1.00 0.74 H new ATOM 0 HB1 ALA A 154 -14.887 -13.413 -8.985 1.00 0.80 H new ATOM 0 HB2 ALA A 154 -13.833 -12.307 -9.898 1.00 0.80 H new ATOM 0 HB3 ALA A 154 -13.397 -12.786 -8.240 1.00 0.80 H new ATOM 2141 N GLN A 155 -15.910 -10.707 -6.203 1.00 0.68 N ATOM 2142 CA GLN A 155 -16.446 -10.975 -4.836 1.00 0.87 C ATOM 2143 C GLN A 155 -17.831 -10.335 -4.706 1.00 0.89 C ATOM 2144 O GLN A 155 -18.279 -9.624 -5.584 1.00 0.85 O ATOM 2145 CB GLN A 155 -15.515 -10.373 -3.772 1.00 0.97 C ATOM 2146 CG GLN A 155 -14.048 -10.506 -4.200 1.00 0.86 C ATOM 2147 CD GLN A 155 -13.611 -11.967 -4.095 1.00 1.95 C ATOM 2148 OE1 GLN A 155 -14.370 -12.865 -4.400 1.00 2.34 O ATOM 2149 NE2 GLN A 155 -12.406 -12.243 -3.671 1.00 2.55 N ATOM 0 H GLN A 155 -15.859 -9.722 -6.463 1.00 0.68 H new ATOM 0 HA GLN A 155 -16.512 -12.052 -4.685 1.00 0.87 H new ATOM 0 HB2 GLN A 155 -15.761 -9.322 -3.619 1.00 0.97 H new ATOM 0 HB3 GLN A 155 -15.669 -10.879 -2.819 1.00 0.97 H new ATOM 0 HG2 GLN A 155 -13.924 -10.152 -5.223 1.00 0.86 H new ATOM 0 HG3 GLN A 155 -13.417 -9.881 -3.568 1.00 0.86 H new ATOM 0 HE21 GLN A 155 -11.770 -11.488 -3.415 1.00 2.55 H new ATOM 0 HE22 GLN A 155 -12.102 -13.214 -3.596 1.00 2.55 H new ATOM 2158 N ASN A 156 -18.508 -10.571 -3.616 1.00 1.01 N ATOM 2159 CA ASN A 156 -19.856 -9.962 -3.432 1.00 1.09 C ATOM 2160 C ASN A 156 -19.693 -8.457 -3.239 1.00 1.07 C ATOM 2161 O ASN A 156 -18.602 -7.973 -3.019 1.00 1.15 O ATOM 2162 CB ASN A 156 -20.523 -10.563 -2.193 1.00 1.26 C ATOM 2163 CG ASN A 156 -20.618 -12.081 -2.345 1.00 1.77 C ATOM 2164 OD1 ASN A 156 -19.641 -12.736 -2.645 1.00 3.21 O ATOM 2165 ND2 ASN A 156 -21.764 -12.671 -2.147 1.00 1.01 N ATOM 0 H ASN A 156 -18.187 -11.158 -2.846 1.00 1.01 H new ATOM 0 HA ASN A 156 -20.475 -10.161 -4.307 1.00 1.09 H new ATOM 0 HB2 ASN A 156 -19.949 -10.312 -1.301 1.00 1.26 H new ATOM 0 HB3 ASN A 156 -21.518 -10.138 -2.061 1.00 1.26 H new ATOM 0 HD21 ASN A 156 -21.840 -13.684 -2.244 1.00 1.01 H new ATOM 0 HD22 ASN A 156 -22.584 -12.120 -1.895 1.00 1.01 H new ATOM 2172 N GLN A 157 -20.759 -7.708 -3.310 1.00 1.05 N ATOM 2173 CA GLN A 157 -20.631 -6.238 -3.112 1.00 1.04 C ATOM 2174 C GLN A 157 -20.046 -5.991 -1.723 1.00 1.07 C ATOM 2175 O GLN A 157 -19.272 -5.079 -1.512 1.00 1.09 O ATOM 2176 CB GLN A 157 -22.004 -5.571 -3.216 1.00 1.09 C ATOM 2177 CG GLN A 157 -21.856 -4.067 -2.977 1.00 1.07 C ATOM 2178 CD GLN A 157 -23.207 -3.474 -2.576 1.00 2.38 C ATOM 2179 OE1 GLN A 157 -23.955 -3.016 -3.416 1.00 2.12 O ATOM 2180 NE2 GLN A 157 -23.551 -3.461 -1.317 1.00 4.02 N ATOM 0 H GLN A 157 -21.703 -8.046 -3.495 1.00 1.05 H new ATOM 0 HA GLN A 157 -19.981 -5.816 -3.879 1.00 1.04 H new ATOM 0 HB2 GLN A 157 -22.436 -5.754 -4.200 1.00 1.09 H new ATOM 0 HB3 GLN A 157 -22.687 -6.002 -2.483 1.00 1.09 H new ATOM 0 HG2 GLN A 157 -21.121 -3.884 -2.193 1.00 1.07 H new ATOM 0 HG3 GLN A 157 -21.488 -3.580 -3.880 1.00 1.07 H new ATOM 0 HE21 GLN A 157 -22.922 -3.846 -0.612 1.00 4.02 H new ATOM 0 HE22 GLN A 157 -24.449 -3.066 -1.038 1.00 4.02 H new ATOM 2189 N TRP A 158 -20.407 -6.811 -0.777 1.00 1.10 N ATOM 2190 CA TRP A 158 -19.875 -6.653 0.601 1.00 1.16 C ATOM 2191 C TRP A 158 -18.346 -6.762 0.553 1.00 1.04 C ATOM 2192 O TRP A 158 -17.636 -5.825 0.856 1.00 0.98 O ATOM 2193 CB TRP A 158 -20.475 -7.759 1.489 1.00 1.29 C ATOM 2194 CG TRP A 158 -19.657 -7.944 2.731 1.00 1.82 C ATOM 2195 CD1 TRP A 158 -19.426 -6.996 3.664 1.00 0.75 C ATOM 2196 CD2 TRP A 158 -18.951 -9.135 3.171 1.00 3.96 C ATOM 2197 NE1 TRP A 158 -18.623 -7.535 4.656 1.00 1.58 N ATOM 2198 CE2 TRP A 158 -18.306 -8.854 4.396 1.00 3.76 C ATOM 2199 CE3 TRP A 158 -18.817 -10.420 2.627 1.00 6.10 C ATOM 2200 CZ2 TRP A 158 -17.548 -9.820 5.060 1.00 5.62 C ATOM 2201 CZ3 TRP A 158 -18.057 -11.397 3.288 1.00 7.99 C ATOM 2202 CH2 TRP A 158 -17.424 -11.098 4.505 1.00 7.74 C ATOM 0 H TRP A 158 -21.053 -7.590 -0.902 1.00 1.10 H new ATOM 0 HA TRP A 158 -20.145 -5.682 1.016 1.00 1.16 H new ATOM 0 HB2 TRP A 158 -21.499 -7.501 1.757 1.00 1.29 H new ATOM 0 HB3 TRP A 158 -20.518 -8.696 0.933 1.00 1.29 H new ATOM 0 HD1 TRP A 158 -19.805 -5.985 3.641 1.00 0.75 H new ATOM 0 HE1 TRP A 158 -18.305 -7.021 5.478 1.00 1.58 H new ATOM 0 HE3 TRP A 158 -19.302 -10.660 1.692 1.00 6.10 H new ATOM 0 HZ2 TRP A 158 -17.061 -9.583 5.994 1.00 5.62 H new ATOM 0 HZ3 TRP A 158 -17.959 -12.383 2.859 1.00 7.99 H new ATOM 0 HH2 TRP A 158 -16.842 -11.854 5.012 1.00 7.74 H new ATOM 2213 N LEU A 159 -17.843 -7.904 0.178 1.00 1.02 N ATOM 2214 CA LEU A 159 -16.366 -8.084 0.113 1.00 0.94 C ATOM 2215 C LEU A 159 -15.755 -7.039 -0.830 1.00 0.74 C ATOM 2216 O LEU A 159 -14.570 -6.775 -0.789 1.00 0.75 O ATOM 2217 CB LEU A 159 -16.050 -9.489 -0.407 1.00 0.94 C ATOM 2218 CG LEU A 159 -14.543 -9.738 -0.333 1.00 2.64 C ATOM 2219 CD1 LEU A 159 -14.075 -9.625 1.119 1.00 3.35 C ATOM 2220 CD2 LEU A 159 -14.232 -11.140 -0.858 1.00 3.38 C ATOM 0 H LEU A 159 -18.392 -8.722 -0.087 1.00 1.02 H new ATOM 0 HA LEU A 159 -15.942 -7.957 1.109 1.00 0.94 H new ATOM 0 HB2 LEU A 159 -16.581 -10.234 0.185 1.00 0.94 H new ATOM 0 HB3 LEU A 159 -16.396 -9.593 -1.435 1.00 0.94 H new ATOM 0 HG LEU A 159 -14.024 -8.997 -0.941 1.00 2.64 H new ATOM 0 HD11 LEU A 159 -13.001 -9.803 1.170 1.00 3.35 H new ATOM 0 HD12 LEU A 159 -14.296 -8.626 1.496 1.00 3.35 H new ATOM 0 HD13 LEU A 159 -14.594 -10.365 1.727 1.00 3.35 H new ATOM 0 HD21 LEU A 159 -13.158 -11.318 -0.806 1.00 3.38 H new ATOM 0 HD22 LEU A 159 -14.753 -11.880 -0.250 1.00 3.38 H new ATOM 0 HD23 LEU A 159 -14.563 -11.223 -1.893 1.00 3.38 H new ATOM 2232 N GLN A 160 -16.551 -6.441 -1.678 1.00 0.61 N ATOM 2233 CA GLN A 160 -16.013 -5.415 -2.615 1.00 0.46 C ATOM 2234 C GLN A 160 -15.706 -4.135 -1.835 1.00 0.56 C ATOM 2235 O GLN A 160 -14.687 -3.505 -2.033 1.00 0.48 O ATOM 2236 CB GLN A 160 -17.053 -5.117 -3.698 1.00 0.51 C ATOM 2237 CG GLN A 160 -16.448 -5.385 -5.078 1.00 0.53 C ATOM 2238 CD GLN A 160 -17.485 -5.078 -6.159 1.00 0.93 C ATOM 2239 OE1 GLN A 160 -17.536 -3.978 -6.673 1.00 0.62 O ATOM 2240 NE2 GLN A 160 -18.320 -6.009 -6.530 1.00 2.31 N ATOM 0 H GLN A 160 -17.552 -6.620 -1.761 1.00 0.61 H new ATOM 0 HA GLN A 160 -15.102 -5.787 -3.083 1.00 0.46 H new ATOM 0 HB2 GLN A 160 -17.936 -5.739 -3.550 1.00 0.51 H new ATOM 0 HB3 GLN A 160 -17.379 -4.079 -3.628 1.00 0.51 H new ATOM 0 HG2 GLN A 160 -15.561 -4.768 -5.224 1.00 0.53 H new ATOM 0 HG3 GLN A 160 -16.128 -6.424 -5.151 1.00 0.53 H new ATOM 0 HE21 GLN A 160 -18.278 -6.933 -6.099 1.00 2.31 H new ATOM 0 HE22 GLN A 160 -19.015 -5.813 -7.251 1.00 2.31 H new ATOM 2249 N ASP A 161 -16.577 -3.753 -0.941 1.00 0.74 N ATOM 2250 CA ASP A 161 -16.330 -2.523 -0.142 1.00 0.85 C ATOM 2251 C ASP A 161 -15.185 -2.796 0.832 1.00 0.88 C ATOM 2252 O ASP A 161 -14.405 -1.923 1.155 1.00 0.91 O ATOM 2253 CB ASP A 161 -17.595 -2.160 0.642 1.00 1.06 C ATOM 2254 CG ASP A 161 -17.372 -0.849 1.400 1.00 1.36 C ATOM 2255 OD1 ASP A 161 -16.422 -0.780 2.161 1.00 2.38 O ATOM 2256 OD2 ASP A 161 -18.157 0.065 1.204 1.00 0.56 O ATOM 0 H ASP A 161 -17.448 -4.240 -0.731 1.00 0.74 H new ATOM 0 HA ASP A 161 -16.069 -1.695 -0.801 1.00 0.85 H new ATOM 0 HB2 ASP A 161 -18.440 -2.059 -0.039 1.00 1.06 H new ATOM 0 HB3 ASP A 161 -17.843 -2.958 1.341 1.00 1.06 H new ATOM 2261 N MET A 162 -15.079 -4.011 1.296 1.00 0.92 N ATOM 2262 CA MET A 162 -13.986 -4.359 2.243 1.00 1.03 C ATOM 2263 C MET A 162 -12.644 -4.247 1.507 1.00 0.85 C ATOM 2264 O MET A 162 -11.672 -3.771 2.046 1.00 0.84 O ATOM 2265 CB MET A 162 -14.240 -5.791 2.791 1.00 1.18 C ATOM 2266 CG MET A 162 -12.978 -6.676 2.743 1.00 1.37 C ATOM 2267 SD MET A 162 -11.716 -6.011 3.858 1.00 0.98 S ATOM 2268 CE MET A 162 -10.302 -6.212 2.743 1.00 1.16 C ATOM 0 H MET A 162 -15.706 -4.780 1.058 1.00 0.92 H new ATOM 0 HA MET A 162 -13.960 -3.676 3.092 1.00 1.03 H new ATOM 0 HB2 MET A 162 -14.594 -5.725 3.820 1.00 1.18 H new ATOM 0 HB3 MET A 162 -15.033 -6.263 2.211 1.00 1.18 H new ATOM 0 HG2 MET A 162 -13.228 -7.697 3.031 1.00 1.37 H new ATOM 0 HG3 MET A 162 -12.591 -6.717 1.725 1.00 1.37 H new ATOM 0 HE1 MET A 162 -9.458 -6.623 3.297 1.00 1.16 H new ATOM 0 HE2 MET A 162 -10.570 -6.891 1.934 1.00 1.16 H new ATOM 0 HE3 MET A 162 -10.026 -5.243 2.327 1.00 1.16 H new ATOM 2278 N THR A 163 -12.581 -4.690 0.283 1.00 0.72 N ATOM 2279 CA THR A 163 -11.296 -4.612 -0.468 1.00 0.57 C ATOM 2280 C THR A 163 -10.760 -3.176 -0.436 1.00 0.43 C ATOM 2281 O THR A 163 -9.659 -2.926 0.013 1.00 0.31 O ATOM 2282 CB THR A 163 -11.523 -5.047 -1.917 1.00 0.51 C ATOM 2283 OG1 THR A 163 -12.075 -6.357 -1.934 1.00 0.65 O ATOM 2284 CG2 THR A 163 -10.191 -5.045 -2.665 1.00 0.43 C ATOM 0 H THR A 163 -13.361 -5.102 -0.229 1.00 0.72 H new ATOM 0 HA THR A 163 -10.566 -5.274 -0.002 1.00 0.57 H new ATOM 0 HB THR A 163 -12.211 -4.355 -2.402 1.00 0.51 H new ATOM 0 HG1 THR A 163 -13.010 -6.322 -1.643 1.00 0.65 H new ATOM 0 HG21 THR A 163 -10.353 -5.355 -3.697 1.00 0.43 H new ATOM 0 HG22 THR A 163 -9.767 -4.041 -2.650 1.00 0.43 H new ATOM 0 HG23 THR A 163 -9.502 -5.738 -2.182 1.00 0.43 H new ATOM 2292 N THR A 164 -11.526 -2.229 -0.902 1.00 0.47 N ATOM 2293 CA THR A 164 -11.050 -0.815 -0.893 1.00 0.42 C ATOM 2294 C THR A 164 -10.766 -0.373 0.547 1.00 0.40 C ATOM 2295 O THR A 164 -9.932 0.474 0.793 1.00 0.40 O ATOM 2296 CB THR A 164 -12.126 0.088 -1.500 1.00 0.56 C ATOM 2297 OG1 THR A 164 -12.440 -0.366 -2.809 1.00 1.49 O ATOM 2298 CG2 THR A 164 -11.609 1.526 -1.566 1.00 0.52 C ATOM 0 H THR A 164 -12.459 -2.371 -1.288 1.00 0.47 H new ATOM 0 HA THR A 164 -10.135 -0.739 -1.480 1.00 0.42 H new ATOM 0 HB THR A 164 -13.022 0.055 -0.880 1.00 0.56 H new ATOM 0 HG1 THR A 164 -13.130 0.210 -3.198 1.00 1.49 H new ATOM 0 HG21 THR A 164 -12.376 2.169 -1.998 1.00 0.52 H new ATOM 0 HG22 THR A 164 -11.369 1.873 -0.561 1.00 0.52 H new ATOM 0 HG23 THR A 164 -10.713 1.562 -2.186 1.00 0.52 H new ATOM 2306 N HIS A 165 -11.458 -0.938 1.497 1.00 0.55 N ATOM 2307 CA HIS A 165 -11.240 -0.552 2.922 1.00 0.53 C ATOM 2308 C HIS A 165 -9.829 -0.973 3.368 1.00 0.33 C ATOM 2309 O HIS A 165 -8.951 -0.152 3.538 1.00 0.37 O ATOM 2310 CB HIS A 165 -12.312 -1.244 3.785 1.00 0.69 C ATOM 2311 CG HIS A 165 -11.932 -1.204 5.244 1.00 0.72 C ATOM 2312 ND1 HIS A 165 -11.220 -2.229 5.845 1.00 0.96 N ATOM 2313 CD2 HIS A 165 -12.155 -0.273 6.227 1.00 0.87 C ATOM 2314 CE1 HIS A 165 -11.039 -1.895 7.135 1.00 0.97 C ATOM 2315 NE2 HIS A 165 -11.590 -0.712 7.423 1.00 0.85 N ATOM 0 H HIS A 165 -12.169 -1.654 1.348 1.00 0.55 H new ATOM 0 HA HIS A 165 -11.323 0.529 3.037 1.00 0.53 H new ATOM 0 HB2 HIS A 165 -13.274 -0.752 3.641 1.00 0.69 H new ATOM 0 HB3 HIS A 165 -12.432 -2.279 3.464 1.00 0.69 H new ATOM 0 HD2 HIS A 165 -12.687 0.658 6.094 1.00 0.87 H new ATOM 0 HE1 HIS A 165 -10.512 -2.508 7.851 1.00 0.97 H new ATOM 0 HE2 HIS A 165 -11.596 -0.234 8.324 1.00 0.85 H new ATOM 2323 N LEU A 166 -9.623 -2.245 3.582 1.00 0.28 N ATOM 2324 CA LEU A 166 -8.289 -2.742 4.042 1.00 0.19 C ATOM 2325 C LEU A 166 -7.156 -2.094 3.235 1.00 0.09 C ATOM 2326 O LEU A 166 -6.087 -1.857 3.758 1.00 0.14 O ATOM 2327 CB LEU A 166 -8.248 -4.268 3.880 1.00 0.34 C ATOM 2328 CG LEU A 166 -7.129 -4.885 4.733 1.00 0.79 C ATOM 2329 CD1 LEU A 166 -5.765 -4.467 4.189 1.00 1.90 C ATOM 2330 CD2 LEU A 166 -7.264 -4.427 6.189 1.00 1.48 C ATOM 0 H LEU A 166 -10.329 -2.971 3.457 1.00 0.28 H new ATOM 0 HA LEU A 166 -8.148 -2.475 5.089 1.00 0.19 H new ATOM 0 HB2 LEU A 166 -9.208 -4.694 4.171 1.00 0.34 H new ATOM 0 HB3 LEU A 166 -8.092 -4.521 2.831 1.00 0.34 H new ATOM 0 HG LEU A 166 -7.215 -5.971 4.690 1.00 0.79 H new ATOM 0 HD11 LEU A 166 -4.978 -4.909 4.800 1.00 1.90 H new ATOM 0 HD12 LEU A 166 -5.662 -4.812 3.160 1.00 1.90 H new ATOM 0 HD13 LEU A 166 -5.679 -3.381 4.218 1.00 1.90 H new ATOM 0 HD21 LEU A 166 -6.466 -4.870 6.785 1.00 1.48 H new ATOM 0 HD22 LEU A 166 -7.192 -3.340 6.237 1.00 1.48 H new ATOM 0 HD23 LEU A 166 -8.230 -4.744 6.582 1.00 1.48 H new ATOM 2342 N ILE A 167 -7.365 -1.795 1.976 1.00 0.09 N ATOM 2343 CA ILE A 167 -6.266 -1.157 1.194 1.00 0.23 C ATOM 2344 C ILE A 167 -6.019 0.243 1.755 1.00 0.44 C ATOM 2345 O ILE A 167 -4.897 0.643 1.987 1.00 0.67 O ATOM 2346 CB ILE A 167 -6.647 -1.049 -0.288 1.00 0.10 C ATOM 2347 CG1 ILE A 167 -6.782 -2.450 -0.886 1.00 0.25 C ATOM 2348 CG2 ILE A 167 -5.555 -0.280 -1.051 1.00 0.30 C ATOM 2349 CD1 ILE A 167 -7.239 -2.333 -2.341 1.00 0.42 C ATOM 0 H ILE A 167 -8.232 -1.962 1.466 1.00 0.09 H new ATOM 0 HA ILE A 167 -5.367 -1.767 1.276 1.00 0.23 H new ATOM 0 HB ILE A 167 -7.595 -0.519 -0.374 1.00 0.10 H new ATOM 0 HG12 ILE A 167 -5.828 -2.975 -0.833 1.00 0.25 H new ATOM 0 HG13 ILE A 167 -7.500 -3.036 -0.312 1.00 0.25 H new ATOM 0 HG21 ILE A 167 -5.830 -0.206 -2.103 1.00 0.30 H new ATOM 0 HG22 ILE A 167 -5.454 0.721 -0.631 1.00 0.30 H new ATOM 0 HG23 ILE A 167 -4.606 -0.809 -0.960 1.00 0.30 H new ATOM 0 HD11 ILE A 167 -7.337 -3.329 -2.773 1.00 0.42 H new ATOM 0 HD12 ILE A 167 -8.202 -1.824 -2.380 1.00 0.42 H new ATOM 0 HD13 ILE A 167 -6.504 -1.762 -2.908 1.00 0.42 H new ATOM 2361 N LEU A 168 -7.065 0.991 1.971 1.00 0.48 N ATOM 2362 CA LEU A 168 -6.901 2.366 2.514 1.00 0.76 C ATOM 2363 C LEU A 168 -6.278 2.299 3.912 1.00 0.70 C ATOM 2364 O LEU A 168 -5.648 3.233 4.366 1.00 0.85 O ATOM 2365 CB LEU A 168 -8.273 3.042 2.602 1.00 0.91 C ATOM 2366 CG LEU A 168 -8.467 3.978 1.408 1.00 0.89 C ATOM 2367 CD1 LEU A 168 -7.408 5.080 1.443 1.00 2.27 C ATOM 2368 CD2 LEU A 168 -8.334 3.182 0.107 1.00 1.48 C ATOM 0 H LEU A 168 -8.029 0.707 1.794 1.00 0.48 H new ATOM 0 HA LEU A 168 -6.249 2.940 1.855 1.00 0.76 H new ATOM 0 HB2 LEU A 168 -9.060 2.288 2.616 1.00 0.91 H new ATOM 0 HB3 LEU A 168 -8.353 3.604 3.533 1.00 0.91 H new ATOM 0 HG LEU A 168 -9.459 4.428 1.459 1.00 0.89 H new ATOM 0 HD11 LEU A 168 -7.548 5.746 0.592 1.00 2.27 H new ATOM 0 HD12 LEU A 168 -7.505 5.648 2.368 1.00 2.27 H new ATOM 0 HD13 LEU A 168 -6.415 4.632 1.394 1.00 2.27 H new ATOM 0 HD21 LEU A 168 -8.472 3.849 -0.744 1.00 1.48 H new ATOM 0 HD22 LEU A 168 -7.343 2.730 0.056 1.00 1.48 H new ATOM 0 HD23 LEU A 168 -9.092 2.399 0.081 1.00 1.48 H new ATOM 2380 N ARG A 169 -6.455 1.202 4.602 1.00 0.54 N ATOM 2381 CA ARG A 169 -5.876 1.086 5.972 1.00 0.60 C ATOM 2382 C ARG A 169 -4.458 0.512 5.896 1.00 0.52 C ATOM 2383 O ARG A 169 -3.676 0.654 6.816 1.00 0.38 O ATOM 2384 CB ARG A 169 -6.756 0.170 6.825 1.00 0.81 C ATOM 2385 CG ARG A 169 -6.909 0.772 8.225 1.00 1.21 C ATOM 2386 CD ARG A 169 -8.363 1.189 8.447 1.00 2.76 C ATOM 2387 NE ARG A 169 -8.458 2.044 9.664 1.00 3.70 N ATOM 2388 CZ ARG A 169 -9.540 2.737 9.892 1.00 5.07 C ATOM 2389 NH1 ARG A 169 -9.940 3.627 9.026 1.00 6.41 N ATOM 2390 NH2 ARG A 169 -10.223 2.540 10.987 1.00 5.26 N ATOM 0 H ARG A 169 -6.973 0.386 4.277 1.00 0.54 H new ATOM 0 HA ARG A 169 -5.835 2.076 6.426 1.00 0.60 H new ATOM 0 HB2 ARG A 169 -7.734 0.050 6.360 1.00 0.81 H new ATOM 0 HB3 ARG A 169 -6.311 -0.823 6.891 1.00 0.81 H new ATOM 0 HG2 ARG A 169 -6.609 0.045 8.979 1.00 1.21 H new ATOM 0 HG3 ARG A 169 -6.252 1.635 8.335 1.00 1.21 H new ATOM 0 HD2 ARG A 169 -8.732 1.734 7.578 1.00 2.76 H new ATOM 0 HD3 ARG A 169 -8.992 0.306 8.561 1.00 2.76 H new ATOM 0 HE ARG A 169 -7.677 2.088 10.319 1.00 3.70 H new ATOM 0 HH11 ARG A 169 -9.407 3.781 8.170 1.00 6.41 H new ATOM 0 HH12 ARG A 169 -10.786 4.168 9.205 1.00 6.41 H new ATOM 0 HH21 ARG A 169 -9.911 1.844 11.665 1.00 5.26 H new ATOM 0 HH22 ARG A 169 -11.069 3.082 11.165 1.00 5.26 H new ATOM 2404 N SER A 170 -4.105 -0.117 4.805 1.00 0.64 N ATOM 2405 CA SER A 170 -2.735 -0.669 4.686 1.00 0.62 C ATOM 2406 C SER A 170 -1.804 0.484 4.346 1.00 0.53 C ATOM 2407 O SER A 170 -0.808 0.708 4.989 1.00 0.46 O ATOM 2408 CB SER A 170 -2.690 -1.711 3.568 1.00 0.78 C ATOM 2409 OG SER A 170 -3.683 -2.698 3.805 1.00 1.99 O ATOM 0 H SER A 170 -4.708 -0.269 3.997 1.00 0.64 H new ATOM 0 HA SER A 170 -2.434 -1.148 5.618 1.00 0.62 H new ATOM 0 HB2 SER A 170 -2.859 -1.233 2.603 1.00 0.78 H new ATOM 0 HB3 SER A 170 -1.704 -2.174 3.526 1.00 0.78 H new ATOM 0 HG SER A 170 -4.539 -2.396 3.437 1.00 1.99 H new ATOM 2415 N PHE A 171 -2.141 1.244 3.348 1.00 0.54 N ATOM 2416 CA PHE A 171 -1.285 2.400 2.983 1.00 0.47 C ATOM 2417 C PHE A 171 -1.052 3.255 4.228 1.00 0.41 C ATOM 2418 O PHE A 171 0.035 3.716 4.478 1.00 0.42 O ATOM 2419 CB PHE A 171 -1.978 3.222 1.897 1.00 0.52 C ATOM 2420 CG PHE A 171 -1.692 2.598 0.556 1.00 0.53 C ATOM 2421 CD1 PHE A 171 -2.169 1.315 0.261 1.00 0.73 C ATOM 2422 CD2 PHE A 171 -0.931 3.294 -0.386 1.00 0.72 C ATOM 2423 CE1 PHE A 171 -1.887 0.731 -0.978 1.00 0.76 C ATOM 2424 CE2 PHE A 171 -0.643 2.709 -1.623 1.00 0.70 C ATOM 2425 CZ PHE A 171 -1.121 1.429 -1.921 1.00 0.56 C ATOM 0 H PHE A 171 -2.971 1.115 2.769 1.00 0.54 H new ATOM 0 HA PHE A 171 -0.326 2.052 2.600 1.00 0.47 H new ATOM 0 HB2 PHE A 171 -3.053 3.254 2.076 1.00 0.52 H new ATOM 0 HB3 PHE A 171 -1.621 4.252 1.918 1.00 0.52 H new ATOM 0 HD1 PHE A 171 -2.755 0.776 0.991 1.00 0.73 H new ATOM 0 HD2 PHE A 171 -0.565 4.284 -0.159 1.00 0.72 H new ATOM 0 HE1 PHE A 171 -2.259 -0.257 -1.208 1.00 0.76 H new ATOM 0 HE2 PHE A 171 -0.051 3.246 -2.349 1.00 0.70 H new ATOM 0 HZ PHE A 171 -0.900 0.979 -2.877 1.00 0.56 H new ATOM 2435 N LYS A 172 -2.061 3.445 5.027 1.00 0.36 N ATOM 2436 CA LYS A 172 -1.882 4.253 6.264 1.00 0.30 C ATOM 2437 C LYS A 172 -0.804 3.612 7.147 1.00 0.28 C ATOM 2438 O LYS A 172 0.274 4.151 7.319 1.00 0.27 O ATOM 2439 CB LYS A 172 -3.205 4.307 7.031 1.00 0.26 C ATOM 2440 CG LYS A 172 -3.257 5.582 7.876 1.00 0.77 C ATOM 2441 CD LYS A 172 -3.911 6.703 7.067 1.00 0.52 C ATOM 2442 CE LYS A 172 -3.333 8.052 7.503 1.00 1.24 C ATOM 2443 NZ LYS A 172 -4.294 8.750 8.408 1.00 1.18 N ATOM 0 H LYS A 172 -3.001 3.077 4.879 1.00 0.36 H new ATOM 0 HA LYS A 172 -1.574 5.264 5.996 1.00 0.30 H new ATOM 0 HB2 LYS A 172 -4.042 4.287 6.334 1.00 0.26 H new ATOM 0 HB3 LYS A 172 -3.302 3.430 7.671 1.00 0.26 H new ATOM 0 HG2 LYS A 172 -3.822 5.402 8.791 1.00 0.77 H new ATOM 0 HG3 LYS A 172 -2.250 5.874 8.175 1.00 0.77 H new ATOM 0 HD2 LYS A 172 -3.736 6.547 6.002 1.00 0.52 H new ATOM 0 HD3 LYS A 172 -4.991 6.692 7.217 1.00 0.52 H new ATOM 0 HE2 LYS A 172 -2.382 7.902 8.015 1.00 1.24 H new ATOM 0 HE3 LYS A 172 -3.130 8.670 6.628 1.00 1.24 H new ATOM 0 HZ1 LYS A 172 -3.894 9.665 8.700 1.00 1.18 H new ATOM 0 HZ2 LYS A 172 -5.191 8.908 7.906 1.00 1.18 H new ATOM 0 HZ3 LYS A 172 -4.467 8.164 9.249 1.00 1.18 H new ATOM 2457 N GLU A 173 -1.085 2.467 7.712 1.00 0.29 N ATOM 2458 CA GLU A 173 -0.080 1.800 8.592 1.00 0.27 C ATOM 2459 C GLU A 173 1.092 1.280 7.754 1.00 0.29 C ATOM 2460 O GLU A 173 2.210 1.722 7.910 1.00 0.23 O ATOM 2461 CB GLU A 173 -0.746 0.634 9.324 1.00 0.28 C ATOM 2462 CG GLU A 173 -0.252 0.590 10.772 1.00 0.38 C ATOM 2463 CD GLU A 173 1.234 0.230 10.796 1.00 2.14 C ATOM 2464 OE1 GLU A 173 1.649 -0.546 9.951 1.00 2.79 O ATOM 2465 OE2 GLU A 173 1.932 0.735 11.660 1.00 2.96 O ATOM 0 H GLU A 173 -1.966 1.965 7.602 1.00 0.29 H new ATOM 0 HA GLU A 173 0.298 2.521 9.316 1.00 0.27 H new ATOM 0 HB2 GLU A 173 -1.830 0.748 9.302 1.00 0.28 H new ATOM 0 HB3 GLU A 173 -0.514 -0.305 8.821 1.00 0.28 H new ATOM 0 HG2 GLU A 173 -0.410 1.557 11.250 1.00 0.38 H new ATOM 0 HG3 GLU A 173 -0.824 -0.144 11.340 1.00 0.38 H new ATOM 2472 N PHE A 174 0.838 0.331 6.885 1.00 0.38 N ATOM 2473 CA PHE A 174 1.918 -0.265 6.022 1.00 0.41 C ATOM 2474 C PHE A 174 2.948 0.794 5.582 1.00 0.37 C ATOM 2475 O PHE A 174 4.123 0.683 5.881 1.00 0.36 O ATOM 2476 CB PHE A 174 1.271 -0.888 4.780 1.00 0.47 C ATOM 2477 CG PHE A 174 2.043 -2.108 4.352 1.00 0.48 C ATOM 2478 CD1 PHE A 174 3.438 -2.057 4.273 1.00 0.38 C ATOM 2479 CD2 PHE A 174 1.363 -3.288 4.030 1.00 1.22 C ATOM 2480 CE1 PHE A 174 4.158 -3.188 3.872 1.00 0.23 C ATOM 2481 CE2 PHE A 174 2.081 -4.420 3.628 1.00 1.35 C ATOM 2482 CZ PHE A 174 3.479 -4.371 3.550 1.00 0.70 C ATOM 0 H PHE A 174 -0.089 -0.066 6.732 1.00 0.38 H new ATOM 0 HA PHE A 174 2.444 -1.020 6.605 1.00 0.41 H new ATOM 0 HB2 PHE A 174 0.238 -1.159 4.996 1.00 0.47 H new ATOM 0 HB3 PHE A 174 1.247 -0.160 3.969 1.00 0.47 H new ATOM 0 HD1 PHE A 174 3.960 -1.145 4.521 1.00 0.38 H new ATOM 0 HD2 PHE A 174 0.285 -3.325 4.092 1.00 1.22 H new ATOM 0 HE1 PHE A 174 5.236 -3.149 3.811 1.00 0.23 H new ATOM 0 HE2 PHE A 174 1.558 -5.331 3.378 1.00 1.35 H new ATOM 0 HZ PHE A 174 4.034 -5.245 3.242 1.00 0.70 H new ATOM 2492 N LEU A 175 2.531 1.814 4.877 1.00 0.36 N ATOM 2493 CA LEU A 175 3.517 2.847 4.437 1.00 0.32 C ATOM 2494 C LEU A 175 4.155 3.498 5.666 1.00 0.27 C ATOM 2495 O LEU A 175 5.336 3.788 5.681 1.00 0.27 O ATOM 2496 CB LEU A 175 2.816 3.919 3.602 1.00 0.33 C ATOM 2497 CG LEU A 175 2.354 3.326 2.269 1.00 0.37 C ATOM 2498 CD1 LEU A 175 1.264 4.208 1.668 1.00 0.42 C ATOM 2499 CD2 LEU A 175 3.531 3.272 1.295 1.00 0.29 C ATOM 0 H LEU A 175 1.566 1.976 4.590 1.00 0.36 H new ATOM 0 HA LEU A 175 4.287 2.369 3.831 1.00 0.32 H new ATOM 0 HB2 LEU A 175 1.961 4.316 4.149 1.00 0.33 H new ATOM 0 HB3 LEU A 175 3.494 4.753 3.423 1.00 0.33 H new ATOM 0 HG LEU A 175 1.968 2.321 2.442 1.00 0.37 H new ATOM 0 HD11 LEU A 175 0.936 3.785 0.719 1.00 0.42 H new ATOM 0 HD12 LEU A 175 0.418 4.260 2.354 1.00 0.42 H new ATOM 0 HD13 LEU A 175 1.658 5.211 1.501 1.00 0.42 H new ATOM 0 HD21 LEU A 175 3.199 2.849 0.347 1.00 0.29 H new ATOM 0 HD22 LEU A 175 3.913 4.279 1.130 1.00 0.29 H new ATOM 0 HD23 LEU A 175 4.321 2.649 1.713 1.00 0.29 H new ATOM 2511 N GLN A 176 3.388 3.735 6.698 1.00 0.22 N ATOM 2512 CA GLN A 176 3.963 4.368 7.921 1.00 0.17 C ATOM 2513 C GLN A 176 5.174 3.559 8.397 1.00 0.19 C ATOM 2514 O GLN A 176 6.149 4.103 8.881 1.00 0.17 O ATOM 2515 CB GLN A 176 2.904 4.398 9.028 1.00 0.16 C ATOM 2516 CG GLN A 176 2.597 5.849 9.410 1.00 0.27 C ATOM 2517 CD GLN A 176 2.780 6.030 10.919 1.00 0.78 C ATOM 2518 OE1 GLN A 176 1.828 6.275 11.632 1.00 0.71 O ATOM 2519 NE2 GLN A 176 3.972 5.919 11.437 1.00 2.01 N ATOM 0 H GLN A 176 2.392 3.519 6.747 1.00 0.22 H new ATOM 0 HA GLN A 176 4.275 5.386 7.688 1.00 0.17 H new ATOM 0 HB2 GLN A 176 1.995 3.901 8.689 1.00 0.16 H new ATOM 0 HB3 GLN A 176 3.260 3.850 9.900 1.00 0.16 H new ATOM 0 HG2 GLN A 176 3.258 6.526 8.869 1.00 0.27 H new ATOM 0 HG3 GLN A 176 1.577 6.103 9.124 1.00 0.27 H new ATOM 0 HE21 GLN A 176 4.771 5.713 10.838 1.00 2.01 H new ATOM 0 HE22 GLN A 176 4.105 6.038 12.441 1.00 2.01 H new ATOM 2528 N SER A 177 5.123 2.261 8.259 1.00 0.36 N ATOM 2529 CA SER A 177 6.266 1.416 8.698 1.00 0.42 C ATOM 2530 C SER A 177 7.444 1.632 7.750 1.00 0.36 C ATOM 2531 O SER A 177 8.584 1.688 8.163 1.00 0.34 O ATOM 2532 CB SER A 177 5.851 -0.055 8.669 1.00 0.57 C ATOM 2533 OG SER A 177 4.528 -0.180 9.174 1.00 1.07 O ATOM 0 H SER A 177 4.336 1.750 7.860 1.00 0.36 H new ATOM 0 HA SER A 177 6.557 1.690 9.712 1.00 0.42 H new ATOM 0 HB2 SER A 177 5.901 -0.439 7.650 1.00 0.57 H new ATOM 0 HB3 SER A 177 6.539 -0.651 9.269 1.00 0.57 H new ATOM 0 HG SER A 177 4.258 -1.122 9.155 1.00 1.07 H new ATOM 2539 N SER A 178 7.177 1.755 6.479 1.00 0.37 N ATOM 2540 CA SER A 178 8.285 1.972 5.505 1.00 0.33 C ATOM 2541 C SER A 178 8.975 3.306 5.807 1.00 0.33 C ATOM 2542 O SER A 178 10.136 3.500 5.502 1.00 0.50 O ATOM 2543 CB SER A 178 7.716 2.001 4.086 1.00 0.35 C ATOM 2544 OG SER A 178 7.209 3.300 3.808 1.00 1.55 O ATOM 0 H SER A 178 6.242 1.715 6.073 1.00 0.37 H new ATOM 0 HA SER A 178 9.009 1.162 5.590 1.00 0.33 H new ATOM 0 HB2 SER A 178 8.491 1.739 3.366 1.00 0.35 H new ATOM 0 HB3 SER A 178 6.923 1.260 3.985 1.00 0.35 H new ATOM 0 HG SER A 178 6.507 3.522 4.454 1.00 1.55 H new ATOM 2550 N LEU A 179 8.267 4.230 6.397 1.00 0.20 N ATOM 2551 CA LEU A 179 8.874 5.555 6.713 1.00 0.27 C ATOM 2552 C LEU A 179 9.827 5.427 7.905 1.00 0.22 C ATOM 2553 O LEU A 179 10.989 5.769 7.820 1.00 0.25 O ATOM 2554 CB LEU A 179 7.763 6.549 7.061 1.00 0.33 C ATOM 2555 CG LEU A 179 7.523 7.487 5.878 1.00 0.44 C ATOM 2556 CD1 LEU A 179 6.051 7.427 5.468 1.00 0.83 C ATOM 2557 CD2 LEU A 179 7.878 8.920 6.284 1.00 0.75 C ATOM 0 H LEU A 179 7.291 4.124 6.675 1.00 0.20 H new ATOM 0 HA LEU A 179 9.432 5.908 5.846 1.00 0.27 H new ATOM 0 HB2 LEU A 179 6.846 6.013 7.305 1.00 0.33 H new ATOM 0 HB3 LEU A 179 8.040 7.125 7.944 1.00 0.33 H new ATOM 0 HG LEU A 179 8.147 7.179 5.039 1.00 0.44 H new ATOM 0 HD11 LEU A 179 5.881 8.096 4.625 1.00 0.83 H new ATOM 0 HD12 LEU A 179 5.795 6.407 5.180 1.00 0.83 H new ATOM 0 HD13 LEU A 179 5.427 7.735 6.307 1.00 0.83 H new ATOM 0 HD21 LEU A 179 7.707 9.590 5.441 1.00 0.75 H new ATOM 0 HD22 LEU A 179 7.253 9.226 7.123 1.00 0.75 H new ATOM 0 HD23 LEU A 179 8.927 8.966 6.577 1.00 0.75 H new ATOM 2569 N ARG A 180 9.342 4.951 9.019 1.00 0.21 N ATOM 2570 CA ARG A 180 10.220 4.817 10.218 1.00 0.21 C ATOM 2571 C ARG A 180 11.411 3.907 9.903 1.00 0.33 C ATOM 2572 O ARG A 180 12.481 4.055 10.461 1.00 0.52 O ATOM 2573 CB ARG A 180 9.415 4.215 11.372 1.00 0.13 C ATOM 2574 CG ARG A 180 9.279 5.243 12.496 1.00 0.40 C ATOM 2575 CD ARG A 180 7.856 5.804 12.501 1.00 1.31 C ATOM 2576 NE ARG A 180 7.722 6.807 13.593 1.00 1.85 N ATOM 2577 CZ ARG A 180 7.561 6.410 14.826 1.00 1.34 C ATOM 2578 NH1 ARG A 180 6.546 5.651 15.139 1.00 1.04 N ATOM 2579 NH2 ARG A 180 8.417 6.768 15.743 1.00 2.01 N ATOM 0 H ARG A 180 8.377 4.649 9.152 1.00 0.21 H new ATOM 0 HA ARG A 180 10.590 5.803 10.498 1.00 0.21 H new ATOM 0 HB2 ARG A 180 8.428 3.913 11.021 1.00 0.13 H new ATOM 0 HB3 ARG A 180 9.910 3.318 11.744 1.00 0.13 H new ATOM 0 HG2 ARG A 180 9.502 4.779 13.457 1.00 0.40 H new ATOM 0 HG3 ARG A 180 9.999 6.049 12.356 1.00 0.40 H new ATOM 0 HD2 ARG A 180 7.632 6.266 11.539 1.00 1.31 H new ATOM 0 HD3 ARG A 180 7.136 4.998 12.643 1.00 1.31 H new ATOM 0 HE ARG A 180 7.756 7.803 13.378 1.00 1.85 H new ATOM 0 HH11 ARG A 180 5.880 5.369 14.420 1.00 1.04 H new ATOM 0 HH12 ARG A 180 6.419 5.340 16.102 1.00 1.04 H new ATOM 0 HH21 ARG A 180 9.212 7.358 15.496 1.00 2.01 H new ATOM 0 HH22 ARG A 180 8.292 6.458 16.707 1.00 2.01 H new ATOM 2593 N ALA A 181 11.240 2.966 9.014 1.00 0.23 N ATOM 2594 CA ALA A 181 12.366 2.052 8.677 1.00 0.33 C ATOM 2595 C ALA A 181 13.301 2.744 7.687 1.00 0.50 C ATOM 2596 O ALA A 181 14.473 2.438 7.608 1.00 0.69 O ATOM 2597 CB ALA A 181 11.815 0.772 8.047 1.00 0.18 C ATOM 0 H ALA A 181 10.371 2.792 8.508 1.00 0.23 H new ATOM 0 HA ALA A 181 12.915 1.802 9.585 1.00 0.33 H new ATOM 0 HB1 ALA A 181 12.640 0.103 7.801 1.00 0.18 H new ATOM 0 HB2 ALA A 181 11.146 0.278 8.752 1.00 0.18 H new ATOM 0 HB3 ALA A 181 11.266 1.021 7.139 1.00 0.18 H new ATOM 2603 N LEU A 182 12.790 3.673 6.929 1.00 0.51 N ATOM 2604 CA LEU A 182 13.649 4.380 5.944 1.00 0.70 C ATOM 2605 C LEU A 182 14.467 5.459 6.657 1.00 0.81 C ATOM 2606 O LEU A 182 15.518 5.860 6.198 1.00 1.13 O ATOM 2607 CB LEU A 182 12.771 5.025 4.872 1.00 0.77 C ATOM 2608 CG LEU A 182 12.363 3.971 3.842 1.00 1.20 C ATOM 2609 CD1 LEU A 182 11.258 4.534 2.947 1.00 2.07 C ATOM 2610 CD2 LEU A 182 13.576 3.602 2.983 1.00 0.91 C ATOM 0 H LEU A 182 11.815 3.972 6.950 1.00 0.51 H new ATOM 0 HA LEU A 182 14.326 3.666 5.475 1.00 0.70 H new ATOM 0 HB2 LEU A 182 11.884 5.464 5.329 1.00 0.77 H new ATOM 0 HB3 LEU A 182 13.312 5.835 4.383 1.00 0.77 H new ATOM 0 HG LEU A 182 11.997 3.082 4.356 1.00 1.20 H new ATOM 0 HD11 LEU A 182 10.967 3.783 2.213 1.00 2.07 H new ATOM 0 HD12 LEU A 182 10.395 4.798 3.558 1.00 2.07 H new ATOM 0 HD13 LEU A 182 11.624 5.422 2.432 1.00 2.07 H new ATOM 0 HD21 LEU A 182 13.287 2.851 2.248 1.00 0.91 H new ATOM 0 HD22 LEU A 182 13.941 4.491 2.469 1.00 0.91 H new ATOM 0 HD23 LEU A 182 14.365 3.202 3.620 1.00 0.91 H new ATOM 2622 N ARG A 183 13.996 5.932 7.778 1.00 0.57 N ATOM 2623 CA ARG A 183 14.749 6.983 8.518 1.00 0.70 C ATOM 2624 C ARG A 183 15.770 6.323 9.447 1.00 0.83 C ATOM 2625 O ARG A 183 16.833 6.858 9.695 1.00 1.05 O ATOM 2626 CB ARG A 183 13.774 7.825 9.344 1.00 0.58 C ATOM 2627 CG ARG A 183 13.870 9.289 8.910 1.00 1.17 C ATOM 2628 CD ARG A 183 12.694 9.625 7.991 1.00 2.49 C ATOM 2629 NE ARG A 183 12.775 11.056 7.585 1.00 3.07 N ATOM 2630 CZ ARG A 183 11.864 11.901 7.987 1.00 3.52 C ATOM 2631 NH1 ARG A 183 10.600 11.592 7.891 1.00 4.45 N ATOM 2632 NH2 ARG A 183 12.218 13.055 8.484 1.00 3.41 N ATOM 0 H ARG A 183 13.122 5.636 8.213 1.00 0.57 H new ATOM 0 HA ARG A 183 15.269 7.625 7.807 1.00 0.70 H new ATOM 0 HB2 ARG A 183 12.756 7.460 9.208 1.00 0.58 H new ATOM 0 HB3 ARG A 183 14.006 7.733 10.405 1.00 0.58 H new ATOM 0 HG2 ARG A 183 13.860 9.940 9.784 1.00 1.17 H new ATOM 0 HG3 ARG A 183 14.813 9.465 8.392 1.00 1.17 H new ATOM 0 HD2 ARG A 183 12.713 8.984 7.110 1.00 2.49 H new ATOM 0 HD3 ARG A 183 11.751 9.434 8.504 1.00 2.49 H new ATOM 0 HE ARG A 183 13.542 11.376 6.993 1.00 3.07 H new ATOM 0 HH11 ARG A 183 10.323 10.691 7.502 1.00 4.45 H new ATOM 0 HH12 ARG A 183 9.888 12.252 8.205 1.00 4.45 H new ATOM 0 HH21 ARG A 183 13.206 13.297 8.558 1.00 3.41 H new ATOM 0 HH22 ARG A 183 11.506 13.715 8.798 1.00 3.41 H new ATOM 2646 N GLN A 184 15.458 5.164 9.963 1.00 0.74 N ATOM 2647 CA GLN A 184 16.418 4.476 10.874 1.00 0.93 C ATOM 2648 C GLN A 184 17.478 3.755 10.042 1.00 0.97 C ATOM 2649 O GLN A 184 18.579 3.513 10.496 1.00 1.20 O ATOM 2650 CB GLN A 184 15.668 3.453 11.733 1.00 0.90 C ATOM 2651 CG GLN A 184 14.816 4.183 12.772 1.00 1.22 C ATOM 2652 CD GLN A 184 15.713 5.059 13.647 1.00 2.09 C ATOM 2653 OE1 GLN A 184 15.955 6.208 13.330 1.00 3.20 O ATOM 2654 NE2 GLN A 184 16.224 4.565 14.742 1.00 1.83 N ATOM 0 H GLN A 184 14.584 4.666 9.794 1.00 0.74 H new ATOM 0 HA GLN A 184 16.896 5.213 11.520 1.00 0.93 H new ATOM 0 HB2 GLN A 184 15.035 2.828 11.103 1.00 0.90 H new ATOM 0 HB3 GLN A 184 16.377 2.790 12.230 1.00 0.90 H new ATOM 0 HG2 GLN A 184 14.065 4.797 12.275 1.00 1.22 H new ATOM 0 HG3 GLN A 184 14.281 3.462 13.390 1.00 1.22 H new ATOM 0 HE21 GLN A 184 16.022 3.602 15.010 1.00 1.83 H new ATOM 0 HE22 GLN A 184 16.825 5.142 15.330 1.00 1.83 H new ATOM 2663 N MET A 185 17.157 3.408 8.827 1.00 0.82 N ATOM 2664 CA MET A 185 18.148 2.700 7.969 1.00 0.95 C ATOM 2665 C MET A 185 19.382 3.584 7.779 1.00 0.93 C ATOM 2666 O MET A 185 20.239 3.564 8.646 1.00 0.62 O ATOM 2667 CB MET A 185 17.521 2.395 6.606 1.00 1.21 C ATOM 2668 CG MET A 185 16.745 1.078 6.686 1.00 0.70 C ATOM 2669 SD MET A 185 15.565 0.989 5.315 1.00 1.16 S ATOM 2670 CE MET A 185 14.407 -0.168 6.086 1.00 0.56 C ATOM 2671 OXT MET A 185 19.447 4.266 6.769 1.00 1.99 O ATOM 0 H MET A 185 16.252 3.584 8.391 1.00 0.82 H new ATOM 0 HA MET A 185 18.441 1.766 8.449 1.00 0.95 H new ATOM 0 HB2 MET A 185 16.854 3.205 6.311 1.00 1.21 H new ATOM 0 HB3 MET A 185 18.297 2.327 5.844 1.00 1.21 H new ATOM 0 HG2 MET A 185 17.434 0.234 6.642 1.00 0.70 H new ATOM 0 HG3 MET A 185 16.219 1.011 7.638 1.00 0.70 H new ATOM 0 HE1 MET A 185 13.385 0.142 5.869 1.00 0.56 H new ATOM 0 HE2 MET A 185 14.575 -1.169 5.689 1.00 0.56 H new ATOM 0 HE3 MET A 185 14.563 -0.174 7.165 1.00 0.56 H new