USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 920 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 28 TYR OH : rot -125:sc= 1.26 USER MOD Set 1.2: A 29 ASN : amide:sc= -3.03! K(o=-9.3!,f=-4.9) USER MOD Set 1.3: A 32 GLN : amide:sc= -2.65 K(o=-9.3,f=-4.9) USER MOD Set 1.4: A 33 HIS : no HE2:sc= -4.83! C(o=-9.3!,f=-17!) USER MOD Single : A 13 SER OG : rot -38:sc= 0.105 USER MOD Single : A 14 SER OG : rot -15:sc= 1.19 USER MOD Single : A 25 HIS : no HD1:sc= -3.91! C(o=-3.9!,f=-3.4!) USER MOD Single : A 26 LYS NZ :NH3+ 174:sc= 1.13 (180deg=1.02) USER MOD Single : A 34 LYS NZ :NH3+ -155:sc= 0.154 (180deg=0.027) USER MOD Single : A 36 SER OG : rot 142:sc= 1.13 USER MOD Single : A 41 TYR OH : rot 2:sc= -1.45! USER MOD Single : A 42 ASN : amide:sc= -4.52! C(o=-4.5!,f=-13!) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 88:sc= -0.817! USER MOD Single : A 58 THR OG1 : rot 73:sc= 0.373 USER MOD Single : A 59 THR OG1 : rot 87:sc= 1.11 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= 1.29 K(o=1.3,f=-0.013) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot -169:sc= 1.32 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0.0273 USER MOD Single : A 67 GLN : amide:sc= -1.6 K(o=-1.6,f=-2.5!) USER MOD Single : A 70 THR OG1 : rot 47:sc= -0.794! USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl 159:sc= -4.62! (180deg=-5.67!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= -2.16! K(o=-2.2!,f=-0.27) USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 HIS : no HD1:sc= -4.12! C(o=-4.1!,f=-12!) USER MOD Single : A 119 TYR OH : rot 35:sc= -6.56! USER MOD Single : A 121 TYR OH : rot 150:sc= 0 USER MOD Single : A 122 MET CE :methyl -120:sc= -8.58! (180deg=-13.6!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 166:sc=-0.000368 (180deg=-0.15) USER MOD Single : A 125 THR OG1 : rot 59:sc= 1.32 USER MOD Single : A 126 LYS NZ :NH3+ 164:sc= -0.0207 (180deg=-0.194) USER MOD Single : A 138 ASN : amide:sc= -1.31! C(o=-1.3!,f=-6.3!) USER MOD Single : A 140 THR OG1 : rot 70:sc=0.000933 USER MOD Single : A 141 SER OG : rot -110:sc= 2.08 USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 LYS NZ :NH3+ 159:sc= 1.19 (180deg=0.749) USER MOD ----------------------------------------------------------------- ATOM 34 N SER A 13 -10.441 14.105 -0.648 1.00 0.52 N ATOM 35 CA SER A 13 -11.571 13.388 -0.082 1.00 0.53 C ATOM 36 C SER A 13 -11.375 11.889 -0.265 1.00 0.41 C ATOM 37 O SER A 13 -12.174 11.080 0.211 1.00 0.53 O ATOM 38 CB SER A 13 -12.863 13.855 -0.764 1.00 0.79 C ATOM 39 OG SER A 13 -14.018 13.371 -0.101 1.00 1.58 O ATOM 0 HA SER A 13 -11.643 13.597 0.985 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.888 14.944 -0.787 1.00 0.79 H new ATOM 0 HB3 SER A 13 -12.870 13.515 -1.799 1.00 0.79 H new ATOM 0 HG SER A 13 -13.858 12.455 0.208 1.00 1.58 H new ATOM 45 N SER A 14 -10.286 11.526 -0.926 1.00 0.32 N ATOM 46 CA SER A 14 -9.992 10.167 -1.230 1.00 0.22 C ATOM 47 C SER A 14 -8.576 10.111 -1.718 1.00 0.21 C ATOM 48 O SER A 14 -7.893 11.129 -1.830 1.00 0.35 O ATOM 49 CB SER A 14 -10.947 9.642 -2.302 1.00 0.25 C ATOM 50 OG SER A 14 -10.769 10.329 -3.534 1.00 1.17 O ATOM 0 H SER A 14 -9.585 12.187 -1.262 1.00 0.32 H new ATOM 0 HA SER A 14 -10.115 9.542 -0.345 1.00 0.22 H new ATOM 0 HB2 SER A 14 -10.779 8.575 -2.451 1.00 0.25 H new ATOM 0 HB3 SER A 14 -11.977 9.759 -1.964 1.00 0.25 H new ATOM 0 HG SER A 14 -10.253 11.148 -3.380 1.00 1.17 H new ATOM 56 N ILE A 15 -8.140 8.928 -1.980 1.00 0.18 N ATOM 57 CA ILE A 15 -6.841 8.703 -2.515 1.00 0.18 C ATOM 58 C ILE A 15 -6.869 8.875 -4.032 1.00 0.17 C ATOM 59 O ILE A 15 -5.845 9.116 -4.660 1.00 0.19 O ATOM 60 CB ILE A 15 -6.396 7.298 -2.127 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.447 6.297 -2.593 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.214 7.217 -0.619 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.889 4.949 -2.966 1.00 0.38 C ATOM 0 H ILE A 15 -8.682 8.078 -1.827 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.131 9.426 -2.112 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.444 7.064 -2.603 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.185 6.166 -1.802 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -7.972 6.712 -3.453 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -5.896 6.211 -0.344 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.457 7.936 -0.305 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.159 7.446 -0.126 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.700 4.295 -3.286 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.173 5.064 -3.780 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.389 4.510 -2.102 1.00 0.38 H new ATOM 75 N PHE A 16 -8.069 8.804 -4.613 1.00 0.18 N ATOM 76 CA PHE A 16 -8.237 8.955 -6.058 1.00 0.19 C ATOM 77 C PHE A 16 -7.996 10.389 -6.478 1.00 0.21 C ATOM 78 O PHE A 16 -8.007 10.718 -7.666 1.00 0.30 O ATOM 79 CB PHE A 16 -9.629 8.543 -6.492 1.00 0.20 C ATOM 80 CG PHE A 16 -9.961 7.137 -6.144 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.201 6.106 -6.648 1.00 0.22 C ATOM 82 CD2 PHE A 16 -11.036 6.844 -5.336 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.511 4.799 -6.355 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.346 5.538 -5.035 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.583 4.516 -5.549 1.00 0.19 C ATOM 0 H PHE A 16 -8.938 8.643 -4.104 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.506 8.306 -6.539 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.358 9.207 -6.028 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.720 8.674 -7.570 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.353 6.326 -7.280 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.640 7.645 -4.936 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.911 3.997 -6.759 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.188 5.316 -4.396 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.828 3.490 -5.318 1.00 0.19 H new ATOM 95 N ASP A 17 -7.806 11.239 -5.489 1.00 0.21 N ATOM 96 CA ASP A 17 -7.402 12.606 -5.718 1.00 0.26 C ATOM 97 C ASP A 17 -5.976 12.611 -6.228 1.00 0.25 C ATOM 98 O ASP A 17 -5.507 13.594 -6.801 1.00 0.32 O ATOM 99 CB ASP A 17 -7.486 13.419 -4.425 1.00 0.32 C ATOM 100 CG ASP A 17 -8.910 13.704 -3.981 1.00 1.13 C ATOM 101 OD1 ASP A 17 -9.596 12.777 -3.500 1.00 2.11 O ATOM 102 OD2 ASP A 17 -9.347 14.870 -4.093 1.00 1.30 O ATOM 0 H ASP A 17 -7.928 10.999 -4.505 1.00 0.21 H new ATOM 0 HA ASP A 17 -8.069 13.059 -6.451 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -6.967 12.880 -3.632 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.961 14.364 -4.564 1.00 0.32 H new ATOM 107 N PHE A 18 -5.286 11.498 -6.007 1.00 0.22 N ATOM 108 CA PHE A 18 -3.909 11.374 -6.401 1.00 0.23 C ATOM 109 C PHE A 18 -3.717 10.259 -7.385 1.00 0.26 C ATOM 110 O PHE A 18 -3.822 9.078 -7.055 1.00 0.29 O ATOM 111 CB PHE A 18 -3.038 11.157 -5.193 1.00 0.21 C ATOM 112 CG PHE A 18 -3.152 12.290 -4.236 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.729 13.546 -4.595 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.661 12.089 -2.966 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.815 14.590 -3.710 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.747 13.130 -2.071 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.403 14.405 -2.473 1.00 0.31 C ATOM 0 H PHE A 18 -5.671 10.670 -5.553 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.618 12.304 -6.889 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.324 10.229 -4.698 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -2.000 11.045 -5.506 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.325 13.713 -5.583 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -3.995 11.104 -2.674 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.422 15.559 -3.980 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -4.082 12.951 -1.060 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.592 15.250 -1.827 1.00 0.31 H new ATOM 127 N GLU A 19 -3.467 10.673 -8.599 1.00 0.35 N ATOM 128 CA GLU A 19 -3.061 9.781 -9.664 1.00 0.43 C ATOM 129 C GLU A 19 -1.924 8.868 -9.190 1.00 0.34 C ATOM 130 O GLU A 19 -1.078 9.268 -8.384 1.00 0.37 O ATOM 131 CB GLU A 19 -2.632 10.634 -10.858 1.00 0.63 C ATOM 132 CG GLU A 19 -2.297 9.862 -12.107 1.00 1.08 C ATOM 133 CD GLU A 19 -2.199 10.771 -13.312 1.00 2.04 C ATOM 134 OE1 GLU A 19 -1.191 11.500 -13.425 1.00 2.30 O ATOM 135 OE2 GLU A 19 -3.115 10.745 -14.159 1.00 2.86 O ATOM 0 H GLU A 19 -3.539 11.650 -8.884 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.888 9.135 -9.958 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -3.432 11.338 -11.088 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -1.762 11.224 -10.570 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -1.352 9.337 -11.969 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -3.060 9.104 -12.283 1.00 1.08 H new ATOM 142 N VAL A 20 -1.904 7.653 -9.703 1.00 0.29 N ATOM 143 CA VAL A 20 -0.941 6.649 -9.279 1.00 0.26 C ATOM 144 C VAL A 20 0.037 6.382 -10.406 1.00 0.25 C ATOM 145 O VAL A 20 -0.189 6.808 -11.528 1.00 0.28 O ATOM 146 CB VAL A 20 -1.670 5.346 -8.837 1.00 0.31 C ATOM 147 CG1 VAL A 20 -0.743 4.152 -8.717 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.352 5.592 -7.515 1.00 0.49 C ATOM 0 H VAL A 20 -2.551 7.332 -10.423 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.385 7.019 -8.418 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.395 5.100 -9.613 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.314 3.278 -8.406 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.276 3.956 -9.682 1.00 0.67 H new ATOM 0 HG13 VAL A 20 0.029 4.363 -7.977 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -2.866 4.685 -7.196 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.608 5.869 -6.768 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.076 6.400 -7.624 1.00 0.49 H new ATOM 158 N LEU A 21 1.145 5.735 -10.096 1.00 0.28 N ATOM 159 CA LEU A 21 2.180 5.500 -11.069 1.00 0.35 C ATOM 160 C LEU A 21 2.538 4.036 -11.147 1.00 0.38 C ATOM 161 O LEU A 21 3.123 3.508 -10.211 1.00 0.58 O ATOM 162 CB LEU A 21 3.422 6.301 -10.695 1.00 0.45 C ATOM 163 CG LEU A 21 3.216 7.803 -10.716 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.457 8.529 -10.245 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.844 8.222 -12.115 1.00 0.68 C ATOM 0 H LEU A 21 1.346 5.362 -9.168 1.00 0.28 H new ATOM 0 HA LEU A 21 1.807 5.815 -12.043 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.748 6.003 -9.698 1.00 0.45 H new ATOM 0 HB3 LEU A 21 4.228 6.045 -11.383 1.00 0.45 H new ATOM 0 HG LEU A 21 2.410 8.067 -10.031 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.281 9.604 -10.270 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.692 8.224 -9.225 1.00 0.69 H new ATOM 0 HD13 LEU A 21 5.293 8.283 -10.900 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.693 9.301 -12.144 1.00 0.68 H new ATOM 0 HD22 LEU A 21 3.645 7.949 -12.802 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.924 7.719 -12.413 1.00 0.68 H new ATOM 177 N ASP A 22 2.204 3.394 -12.266 1.00 0.33 N ATOM 178 CA ASP A 22 2.677 2.039 -12.542 1.00 0.37 C ATOM 179 C ASP A 22 4.188 2.062 -12.417 1.00 0.35 C ATOM 180 O ASP A 22 4.789 3.132 -12.465 1.00 0.40 O ATOM 181 CB ASP A 22 2.269 1.611 -13.959 1.00 0.50 C ATOM 182 CG ASP A 22 2.495 0.133 -14.230 1.00 1.16 C ATOM 183 OD1 ASP A 22 3.643 -0.256 -14.532 1.00 1.87 O ATOM 184 OD2 ASP A 22 1.520 -0.645 -14.161 1.00 1.48 O ATOM 0 H ASP A 22 1.609 3.790 -12.994 1.00 0.33 H new ATOM 0 HA ASP A 22 2.240 1.327 -11.842 1.00 0.37 H new ATOM 0 HB2 ASP A 22 1.215 1.844 -14.112 1.00 0.50 H new ATOM 0 HB3 ASP A 22 2.834 2.197 -14.684 1.00 0.50 H new ATOM 189 N ALA A 23 4.797 0.897 -12.260 1.00 0.39 N ATOM 190 CA ALA A 23 6.184 0.802 -11.811 1.00 0.42 C ATOM 191 C ALA A 23 7.162 1.568 -12.709 1.00 0.47 C ATOM 192 O ALA A 23 8.318 1.767 -12.339 1.00 0.59 O ATOM 193 CB ALA A 23 6.596 -0.658 -11.698 1.00 0.52 C ATOM 0 H ALA A 23 4.352 -0.003 -12.437 1.00 0.39 H new ATOM 0 HA ALA A 23 6.233 1.275 -10.830 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.631 -0.719 -11.363 1.00 0.52 H new ATOM 0 HB2 ALA A 23 5.951 -1.163 -10.979 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.501 -1.139 -12.671 1.00 0.52 H new ATOM 199 N ASP A 24 6.688 2.012 -13.870 1.00 0.46 N ATOM 200 CA ASP A 24 7.509 2.765 -14.813 1.00 0.54 C ATOM 201 C ASP A 24 7.426 4.278 -14.553 1.00 0.51 C ATOM 202 O ASP A 24 8.108 5.057 -15.218 1.00 0.62 O ATOM 203 CB ASP A 24 7.048 2.462 -16.241 1.00 0.69 C ATOM 204 CG ASP A 24 8.091 2.810 -17.285 1.00 1.43 C ATOM 205 OD1 ASP A 24 9.125 2.116 -17.361 1.00 1.51 O ATOM 206 OD2 ASP A 24 7.887 3.793 -18.026 1.00 2.34 O ATOM 0 H ASP A 24 5.729 1.861 -14.182 1.00 0.46 H new ATOM 0 HA ASP A 24 8.547 2.459 -14.680 1.00 0.54 H new ATOM 0 HB2 ASP A 24 6.801 1.403 -16.321 1.00 0.69 H new ATOM 0 HB3 ASP A 24 6.134 3.019 -16.448 1.00 0.69 H new ATOM 211 N HIS A 25 6.573 4.680 -13.591 1.00 0.43 N ATOM 212 CA HIS A 25 6.332 6.094 -13.252 1.00 0.44 C ATOM 213 C HIS A 25 5.373 6.684 -14.258 1.00 0.47 C ATOM 214 O HIS A 25 5.293 7.893 -14.446 1.00 0.54 O ATOM 215 CB HIS A 25 7.614 6.941 -13.159 1.00 0.54 C ATOM 216 CG HIS A 25 8.438 6.642 -11.950 1.00 0.64 C ATOM 217 ND1 HIS A 25 8.377 7.373 -10.779 1.00 0.73 N ATOM 218 CD2 HIS A 25 9.315 5.648 -11.723 1.00 1.47 C ATOM 219 CE1 HIS A 25 9.184 6.830 -9.882 1.00 0.59 C ATOM 220 NE2 HIS A 25 9.766 5.784 -10.435 1.00 1.26 N ATOM 0 H HIS A 25 6.029 4.029 -13.025 1.00 0.43 H new ATOM 0 HA HIS A 25 5.900 6.116 -12.252 1.00 0.44 H new ATOM 0 HB2 HIS A 25 8.217 6.772 -14.051 1.00 0.54 H new ATOM 0 HB3 HIS A 25 7.343 7.997 -13.152 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.610 4.883 -12.426 1.00 1.47 H new ATOM 0 HE1 HIS A 25 9.339 7.182 -8.873 1.00 0.59 H new ATOM 0 HE2 HIS A 25 10.443 5.174 -9.978 1.00 1.26 H new ATOM 229 N LYS A 26 4.649 5.793 -14.906 1.00 0.48 N ATOM 230 CA LYS A 26 3.615 6.171 -15.836 1.00 0.53 C ATOM 231 C LYS A 26 2.274 5.948 -15.175 1.00 0.41 C ATOM 232 O LYS A 26 2.007 4.866 -14.653 1.00 0.38 O ATOM 233 CB LYS A 26 3.747 5.356 -17.115 1.00 0.67 C ATOM 234 CG LYS A 26 5.130 5.474 -17.727 1.00 1.00 C ATOM 235 CD LYS A 26 5.501 6.927 -17.982 1.00 2.12 C ATOM 236 CE LYS A 26 6.959 7.201 -17.647 1.00 3.15 C ATOM 237 NZ LYS A 26 7.893 6.362 -18.440 1.00 4.25 N ATOM 0 H LYS A 26 4.765 4.785 -14.799 1.00 0.48 H new ATOM 0 HA LYS A 26 3.707 7.223 -16.106 1.00 0.53 H new ATOM 0 HB2 LYS A 26 3.534 4.309 -16.901 1.00 0.67 H new ATOM 0 HB3 LYS A 26 3.002 5.691 -17.837 1.00 0.67 H new ATOM 0 HG2 LYS A 26 5.864 5.021 -17.061 1.00 1.00 H new ATOM 0 HG3 LYS A 26 5.164 4.918 -18.664 1.00 1.00 H new ATOM 0 HD2 LYS A 26 5.315 7.172 -19.028 1.00 2.12 H new ATOM 0 HD3 LYS A 26 4.862 7.576 -17.384 1.00 2.12 H new ATOM 0 HE2 LYS A 26 7.178 8.253 -17.828 1.00 3.15 H new ATOM 0 HE3 LYS A 26 7.125 7.019 -16.585 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 8.872 6.657 -18.249 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 7.774 5.364 -18.174 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 7.688 6.477 -19.453 1.00 4.25 H new ATOM 251 N PRO A 27 1.444 6.990 -15.149 1.00 0.41 N ATOM 252 CA PRO A 27 0.221 7.014 -14.348 1.00 0.37 C ATOM 253 C PRO A 27 -0.666 5.781 -14.492 1.00 0.32 C ATOM 254 O PRO A 27 -1.216 5.492 -15.555 1.00 0.36 O ATOM 255 CB PRO A 27 -0.490 8.261 -14.865 1.00 0.46 C ATOM 256 CG PRO A 27 0.630 9.159 -15.243 1.00 0.54 C ATOM 257 CD PRO A 27 1.652 8.257 -15.868 1.00 0.50 C ATOM 0 HA PRO A 27 0.450 7.022 -13.282 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.130 8.035 -15.718 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -1.124 8.709 -14.100 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.301 9.928 -15.942 1.00 0.54 H new ATOM 0 HG3 PRO A 27 1.036 9.673 -14.372 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.493 8.145 -16.940 1.00 0.50 H new ATOM 0 HD3 PRO A 27 2.665 8.638 -15.734 1.00 0.50 H new ATOM 265 N TYR A 28 -0.769 5.071 -13.382 1.00 0.28 N ATOM 266 CA TYR A 28 -1.784 4.050 -13.158 1.00 0.26 C ATOM 267 C TYR A 28 -3.065 4.712 -12.671 1.00 0.25 C ATOM 268 O TYR A 28 -3.038 5.502 -11.723 1.00 0.37 O ATOM 269 CB TYR A 28 -1.269 3.069 -12.099 1.00 0.30 C ATOM 270 CG TYR A 28 -2.240 2.010 -11.623 1.00 0.37 C ATOM 271 CD1 TYR A 28 -3.104 1.423 -12.530 1.00 0.50 C ATOM 272 CD2 TYR A 28 -2.314 1.611 -10.295 1.00 0.82 C ATOM 273 CE1 TYR A 28 -4.015 0.472 -12.146 1.00 0.64 C ATOM 274 CE2 TYR A 28 -3.227 0.651 -9.894 1.00 1.10 C ATOM 275 CZ TYR A 28 -3.966 0.050 -10.674 1.00 0.92 C ATOM 276 OH TYR A 28 -4.986 -0.879 -10.437 1.00 1.20 O ATOM 0 H TYR A 28 -0.135 5.189 -12.591 1.00 0.28 H new ATOM 0 HA TYR A 28 -1.990 3.514 -14.085 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.388 2.567 -12.500 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -0.942 3.644 -11.233 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -3.060 1.721 -13.567 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -1.652 2.055 -9.567 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -4.725 0.046 -12.840 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -3.295 0.417 -8.842 1.00 1.10 H new ATOM 0 HH TYR A 28 -5.545 -0.569 -9.694 1.00 1.20 H new ATOM 286 N ASN A 29 -4.183 4.414 -13.314 1.00 0.34 N ATOM 287 CA ASN A 29 -5.443 4.960 -12.858 1.00 0.42 C ATOM 288 C ASN A 29 -5.906 4.233 -11.605 1.00 0.34 C ATOM 289 O ASN A 29 -6.443 3.128 -11.637 1.00 0.44 O ATOM 290 CB ASN A 29 -6.537 4.973 -13.942 1.00 0.67 C ATOM 291 CG ASN A 29 -6.829 3.629 -14.580 1.00 0.73 C ATOM 292 OD1 ASN A 29 -6.361 3.326 -15.673 1.00 1.18 O ATOM 293 ND2 ASN A 29 -7.589 2.813 -13.881 1.00 1.51 N ATOM 0 H ASN A 29 -4.241 3.811 -14.134 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.265 6.008 -12.617 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -7.458 5.356 -13.502 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.243 5.672 -14.724 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -7.811 1.886 -14.244 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -7.956 3.108 -12.976 1.00 1.51 H new ATOM 300 N LEU A 30 -5.655 4.864 -10.488 1.00 0.25 N ATOM 301 CA LEU A 30 -6.058 4.347 -9.201 1.00 0.20 C ATOM 302 C LEU A 30 -7.567 4.223 -9.125 1.00 0.19 C ATOM 303 O LEU A 30 -8.102 3.302 -8.507 1.00 0.19 O ATOM 304 CB LEU A 30 -5.575 5.310 -8.133 1.00 0.22 C ATOM 305 CG LEU A 30 -5.959 4.981 -6.702 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.297 3.691 -6.260 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.559 6.127 -5.797 1.00 0.28 C ATOM 0 H LEU A 30 -5.163 5.756 -10.442 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.626 3.357 -9.052 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.488 5.366 -8.190 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -5.958 6.303 -8.370 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.038 4.842 -6.641 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.583 3.469 -5.232 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.618 2.876 -6.909 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.214 3.798 -6.321 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.834 5.892 -4.769 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.482 6.280 -5.858 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -6.073 7.035 -6.111 1.00 0.28 H new ATOM 319 N VAL A 31 -8.235 5.141 -9.808 1.00 0.20 N ATOM 320 CA VAL A 31 -9.672 5.337 -9.679 1.00 0.19 C ATOM 321 C VAL A 31 -10.485 4.130 -10.133 1.00 0.20 C ATOM 322 O VAL A 31 -11.699 4.111 -9.975 1.00 0.23 O ATOM 323 CB VAL A 31 -10.129 6.562 -10.480 1.00 0.22 C ATOM 324 CG1 VAL A 31 -9.216 7.741 -10.219 1.00 1.02 C ATOM 325 CG2 VAL A 31 -10.165 6.230 -11.950 1.00 0.87 C ATOM 0 H VAL A 31 -7.792 5.776 -10.472 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.854 5.486 -8.615 1.00 0.19 H new ATOM 0 HB VAL A 31 -11.134 6.837 -10.159 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -9.557 8.600 -10.797 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -9.234 7.987 -9.157 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -8.198 7.486 -10.515 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -10.491 7.105 -12.513 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -9.169 5.936 -12.281 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -10.861 5.409 -12.121 1.00 0.87 H new ATOM 335 N GLN A 32 -9.835 3.125 -10.692 1.00 0.21 N ATOM 336 CA GLN A 32 -10.553 1.927 -11.089 1.00 0.23 C ATOM 337 C GLN A 32 -10.946 1.129 -9.852 1.00 0.22 C ATOM 338 O GLN A 32 -11.681 0.151 -9.934 1.00 0.28 O ATOM 339 CB GLN A 32 -9.718 1.062 -12.036 1.00 0.26 C ATOM 340 CG GLN A 32 -8.402 0.593 -11.439 1.00 0.29 C ATOM 341 CD GLN A 32 -7.736 -0.488 -12.268 1.00 0.35 C ATOM 342 OE1 GLN A 32 -7.983 -1.677 -12.072 1.00 1.02 O ATOM 343 NE2 GLN A 32 -6.872 -0.085 -13.185 1.00 0.75 N ATOM 0 H GLN A 32 -8.832 3.112 -10.879 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.452 2.230 -11.625 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.304 0.191 -12.329 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.513 1.628 -12.944 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.726 1.443 -11.347 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -8.579 0.216 -10.432 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -6.695 0.911 -13.316 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -6.383 -0.770 -13.761 1.00 0.75 H new ATOM 352 N HIS A 33 -10.438 1.564 -8.704 1.00 0.17 N ATOM 353 CA HIS A 33 -10.780 0.950 -7.429 1.00 0.16 C ATOM 354 C HIS A 33 -11.848 1.768 -6.734 1.00 0.16 C ATOM 355 O HIS A 33 -12.013 1.717 -5.522 1.00 0.17 O ATOM 356 CB HIS A 33 -9.513 0.783 -6.584 1.00 0.16 C ATOM 357 CG HIS A 33 -8.521 -0.077 -7.290 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.810 -1.373 -7.638 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.288 0.191 -7.810 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.821 -1.869 -8.339 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.884 -0.944 -8.465 1.00 0.28 N ATOM 0 H HIS A 33 -9.785 2.344 -8.632 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.196 -0.045 -7.586 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -9.075 1.760 -6.379 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.767 0.339 -5.621 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.664 -1.873 -7.389 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.738 1.116 -7.723 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.778 -2.868 -8.747 1.00 0.27 H new ATOM 370 N LYS A 34 -12.565 2.539 -7.538 1.00 0.19 N ATOM 371 CA LYS A 34 -13.758 3.214 -7.082 1.00 0.19 C ATOM 372 C LYS A 34 -14.909 2.223 -7.047 1.00 0.21 C ATOM 373 O LYS A 34 -15.235 1.606 -8.064 1.00 0.33 O ATOM 374 CB LYS A 34 -14.125 4.361 -8.017 1.00 0.22 C ATOM 375 CG LYS A 34 -13.295 5.612 -7.843 1.00 0.28 C ATOM 376 CD LYS A 34 -13.755 6.689 -8.806 1.00 0.69 C ATOM 377 CE LYS A 34 -12.899 7.931 -8.701 1.00 1.01 C ATOM 378 NZ LYS A 34 -13.174 8.713 -7.465 1.00 1.56 N ATOM 0 H LYS A 34 -12.334 2.710 -8.517 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.569 3.617 -6.087 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -14.027 4.017 -9.047 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -15.174 4.614 -7.864 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -13.379 5.972 -6.818 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.243 5.385 -8.016 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -13.718 6.306 -9.826 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -14.794 6.944 -8.599 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -11.847 7.645 -8.719 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -13.073 8.562 -9.572 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -12.915 9.708 -7.619 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -14.186 8.651 -7.233 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -12.614 8.327 -6.678 1.00 1.56 H new ATOM 392 N GLY A 35 -15.510 2.055 -5.891 1.00 0.18 N ATOM 393 CA GLY A 35 -16.627 1.150 -5.769 1.00 0.20 C ATOM 394 C GLY A 35 -16.344 0.035 -4.794 1.00 0.17 C ATOM 395 O GLY A 35 -17.214 -0.342 -4.006 1.00 0.20 O ATOM 0 H GLY A 35 -15.246 2.530 -5.028 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.508 1.703 -5.443 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.860 0.727 -6.746 1.00 0.20 H new ATOM 399 N SER A 36 -15.132 -0.501 -4.837 1.00 0.16 N ATOM 400 CA SER A 36 -14.717 -1.472 -3.863 1.00 0.16 C ATOM 401 C SER A 36 -13.384 -1.056 -3.299 1.00 0.14 C ATOM 402 O SER A 36 -12.488 -0.670 -4.048 1.00 0.16 O ATOM 403 CB SER A 36 -14.611 -2.854 -4.492 1.00 0.20 C ATOM 404 OG SER A 36 -15.862 -3.270 -5.023 1.00 0.29 O ATOM 0 H SER A 36 -14.428 -0.273 -5.539 1.00 0.16 H new ATOM 0 HA SER A 36 -15.458 -1.521 -3.065 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.862 -2.840 -5.284 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.272 -3.572 -3.745 1.00 0.20 H new ATOM 0 HG SER A 36 -15.717 -3.751 -5.865 1.00 0.29 H new ATOM 410 N PRO A 37 -13.262 -1.095 -1.969 1.00 0.12 N ATOM 411 CA PRO A 37 -12.033 -0.790 -1.258 1.00 0.12 C ATOM 412 C PRO A 37 -10.820 -1.408 -1.908 1.00 0.12 C ATOM 413 O PRO A 37 -10.900 -2.428 -2.581 1.00 0.15 O ATOM 414 CB PRO A 37 -12.262 -1.390 0.143 1.00 0.15 C ATOM 415 CG PRO A 37 -13.540 -2.131 0.037 1.00 0.18 C ATOM 416 CD PRO A 37 -14.317 -1.434 -1.029 1.00 0.15 C ATOM 0 HA PRO A 37 -11.830 0.281 -1.246 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.444 -2.052 0.428 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.320 -0.610 0.902 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.368 -3.176 -0.222 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -14.079 -2.122 0.985 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -15.074 -2.079 -1.475 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.832 -0.551 -0.652 1.00 0.15 H new ATOM 424 N LEU A 38 -9.716 -0.751 -1.699 1.00 0.14 N ATOM 425 CA LEU A 38 -8.434 -1.162 -2.206 1.00 0.13 C ATOM 426 C LEU A 38 -7.445 -0.962 -1.077 1.00 0.13 C ATOM 427 O LEU A 38 -7.663 -0.137 -0.212 1.00 0.20 O ATOM 428 CB LEU A 38 -8.031 -0.334 -3.433 1.00 0.16 C ATOM 429 CG LEU A 38 -8.115 1.186 -3.293 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.402 1.844 -4.444 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.560 1.672 -3.258 1.00 0.26 C ATOM 0 H LEU A 38 -9.679 0.111 -1.155 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.461 -2.202 -2.530 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -7.007 -0.595 -3.698 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.663 -0.634 -4.269 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.641 1.456 -2.350 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.465 2.927 -4.340 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.355 1.540 -4.445 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.869 1.542 -5.382 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.577 2.757 -3.158 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -10.063 1.385 -4.182 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -10.075 1.221 -2.410 1.00 0.26 H new ATOM 443 N LEU A 39 -6.409 -1.738 -1.032 1.00 0.18 N ATOM 444 CA LEU A 39 -5.399 -1.542 -0.037 1.00 0.19 C ATOM 445 C LEU A 39 -4.113 -1.179 -0.697 1.00 0.18 C ATOM 446 O LEU A 39 -3.609 -1.898 -1.558 1.00 0.21 O ATOM 447 CB LEU A 39 -5.185 -2.764 0.825 1.00 0.23 C ATOM 448 CG LEU A 39 -5.752 -2.663 2.239 1.00 0.35 C ATOM 449 CD1 LEU A 39 -7.255 -2.851 2.229 1.00 1.10 C ATOM 450 CD2 LEU A 39 -5.093 -3.669 3.159 1.00 1.19 C ATOM 0 H LEU A 39 -6.239 -2.514 -1.672 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.742 -0.737 0.613 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.636 -3.623 0.329 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -4.115 -2.960 0.892 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.535 -1.665 2.619 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -7.638 -2.775 3.247 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -7.714 -2.080 1.610 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -7.496 -3.833 1.823 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -5.514 -3.577 4.160 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -5.269 -4.677 2.782 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -4.020 -3.479 3.198 1.00 1.19 H new ATOM 462 N ILE A 40 -3.604 -0.052 -0.316 1.00 0.19 N ATOM 463 CA ILE A 40 -2.345 0.393 -0.828 1.00 0.20 C ATOM 464 C ILE A 40 -1.266 0.156 0.212 1.00 0.18 C ATOM 465 O ILE A 40 -1.390 0.596 1.360 1.00 0.20 O ATOM 466 CB ILE A 40 -2.430 1.868 -1.206 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.858 2.198 -1.629 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.467 2.180 -2.336 1.00 0.37 C ATOM 469 CD1 ILE A 40 -3.955 3.523 -2.326 1.00 0.35 C ATOM 0 H ILE A 40 -4.043 0.582 0.352 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.091 -0.171 -1.726 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.156 2.475 -0.343 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.229 1.415 -2.290 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.502 2.205 -0.750 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.539 3.236 -2.594 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.449 1.953 -2.020 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.720 1.575 -3.207 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -4.991 3.711 -2.607 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.611 4.312 -1.657 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.333 3.510 -3.221 1.00 0.35 H new ATOM 481 N TYR A 41 -0.234 -0.583 -0.170 1.00 0.18 N ATOM 482 CA TYR A 41 0.803 -0.964 0.770 1.00 0.19 C ATOM 483 C TYR A 41 2.101 -0.217 0.469 1.00 0.20 C ATOM 484 O TYR A 41 2.566 -0.190 -0.670 1.00 0.27 O ATOM 485 CB TYR A 41 1.094 -2.489 0.728 1.00 0.20 C ATOM 486 CG TYR A 41 -0.058 -3.426 1.052 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.351 -3.160 0.644 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.174 -4.617 1.739 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.375 -4.044 0.903 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.853 -5.505 2.011 1.00 0.35 C ATOM 491 CZ TYR A 41 -2.125 -5.209 1.586 1.00 0.33 C ATOM 492 OH TYR A 41 -3.150 -6.092 1.826 1.00 0.42 O ATOM 0 H TYR A 41 -0.095 -0.928 -1.120 1.00 0.18 H new ATOM 0 HA TYR A 41 0.436 -0.702 1.762 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.460 -2.736 -0.269 1.00 0.20 H new ATOM 0 HB3 TYR A 41 1.905 -2.697 1.426 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.562 -2.244 0.113 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.176 -4.852 2.066 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.377 -3.820 0.568 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.656 -6.419 2.551 1.00 0.35 H new ATOM 0 HH TYR A 41 -3.976 -5.752 1.423 1.00 0.42 H new ATOM 502 N ASN A 42 2.668 0.387 1.496 1.00 0.28 N ATOM 503 CA ASN A 42 4.017 0.942 1.430 1.00 0.34 C ATOM 504 C ASN A 42 4.983 -0.211 1.581 1.00 0.37 C ATOM 505 O ASN A 42 5.344 -0.569 2.699 1.00 0.54 O ATOM 506 CB ASN A 42 4.262 1.887 2.612 1.00 0.46 C ATOM 507 CG ASN A 42 3.135 2.857 2.883 1.00 1.50 C ATOM 508 OD1 ASN A 42 3.188 4.013 2.491 1.00 2.27 O ATOM 509 ND2 ASN A 42 2.106 2.401 3.572 1.00 2.35 N ATOM 0 H ASN A 42 2.212 0.509 2.400 1.00 0.28 H new ATOM 0 HA ASN A 42 4.145 1.481 0.491 1.00 0.34 H new ATOM 0 HB2 ASN A 42 4.434 1.291 3.508 1.00 0.46 H new ATOM 0 HB3 ASN A 42 5.175 2.453 2.425 1.00 0.46 H new ATOM 0 HD21 ASN A 42 1.325 3.019 3.791 1.00 2.35 H new ATOM 0 HD22 ASN A 42 2.092 1.430 3.885 1.00 2.35 H new ATOM 516 N VAL A 43 5.431 -0.789 0.497 1.00 0.36 N ATOM 517 CA VAL A 43 6.189 -2.012 0.617 1.00 0.38 C ATOM 518 C VAL A 43 7.658 -1.765 0.408 1.00 0.42 C ATOM 519 O VAL A 43 8.062 -0.892 -0.365 1.00 0.50 O ATOM 520 CB VAL A 43 5.730 -3.103 -0.370 1.00 0.39 C ATOM 521 CG1 VAL A 43 4.295 -3.502 -0.134 1.00 1.03 C ATOM 522 CG2 VAL A 43 5.921 -2.653 -1.792 1.00 0.98 C ATOM 0 H VAL A 43 5.291 -0.447 -0.454 1.00 0.36 H new ATOM 0 HA VAL A 43 6.008 -2.369 1.631 1.00 0.38 H new ATOM 0 HB VAL A 43 6.352 -3.980 -0.194 1.00 0.39 H new ATOM 0 HG11 VAL A 43 4.009 -4.273 -0.850 1.00 1.03 H new ATOM 0 HG12 VAL A 43 4.187 -3.889 0.879 1.00 1.03 H new ATOM 0 HG13 VAL A 43 3.650 -2.632 -0.261 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.590 -3.440 -2.470 1.00 0.98 H new ATOM 0 HG22 VAL A 43 5.336 -1.751 -1.970 1.00 0.98 H new ATOM 0 HG23 VAL A 43 6.976 -2.442 -1.968 1.00 0.98 H new ATOM 650 N GLY A 52 4.554 -11.413 6.085 1.00 0.45 N ATOM 651 CA GLY A 52 3.171 -11.793 5.930 1.00 0.51 C ATOM 652 C GLY A 52 2.496 -10.910 4.908 1.00 0.41 C ATOM 653 O GLY A 52 1.584 -11.340 4.208 1.00 0.41 O ATOM 0 HA2 GLY A 52 3.106 -12.836 5.619 1.00 0.51 H new ATOM 0 HA3 GLY A 52 2.655 -11.713 6.887 1.00 0.51 H new ATOM 657 N GLY A 53 2.973 -9.667 4.834 1.00 0.44 N ATOM 658 CA GLY A 53 2.512 -8.705 3.844 1.00 0.50 C ATOM 659 C GLY A 53 2.410 -9.286 2.449 1.00 0.36 C ATOM 660 O GLY A 53 1.401 -9.112 1.781 1.00 0.32 O ATOM 0 H GLY A 53 3.690 -9.303 5.461 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.536 -8.324 4.144 1.00 0.50 H new ATOM 0 HA3 GLY A 53 3.194 -7.855 3.828 1.00 0.50 H new ATOM 664 N TYR A 54 3.452 -9.981 2.011 1.00 0.37 N ATOM 665 CA TYR A 54 3.526 -10.483 0.645 1.00 0.36 C ATOM 666 C TYR A 54 2.386 -11.453 0.342 1.00 0.26 C ATOM 667 O TYR A 54 1.553 -11.194 -0.529 1.00 0.25 O ATOM 668 CB TYR A 54 4.862 -11.183 0.437 1.00 0.45 C ATOM 669 CG TYR A 54 5.392 -11.118 -0.974 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.511 -11.137 -2.039 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.757 -11.043 -1.244 1.00 0.53 C ATOM 672 CE1 TYR A 54 4.960 -11.079 -3.335 1.00 0.46 C ATOM 673 CE2 TYR A 54 7.222 -10.981 -2.547 1.00 0.65 C ATOM 674 CZ TYR A 54 6.421 -11.000 -3.551 1.00 0.56 C ATOM 675 OH TYR A 54 6.757 -10.933 -4.894 1.00 0.70 O ATOM 0 H TYR A 54 4.262 -10.211 2.586 1.00 0.37 H new ATOM 0 HA TYR A 54 3.435 -9.636 -0.035 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.598 -10.740 1.108 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.758 -12.229 0.724 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.450 -11.199 -1.848 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.462 -11.033 -0.426 1.00 0.53 H new ATOM 0 HE1 TYR A 54 4.271 -11.091 -4.167 1.00 0.46 H new ATOM 0 HE2 TYR A 54 8.285 -10.915 -2.724 1.00 0.65 H new ATOM 0 HH TYR A 54 7.731 -10.881 -4.985 1.00 0.70 H new ATOM 685 N GLU A 55 2.350 -12.558 1.075 1.00 0.25 N ATOM 686 CA GLU A 55 1.342 -13.597 0.872 1.00 0.27 C ATOM 687 C GLU A 55 -0.064 -13.058 1.127 1.00 0.22 C ATOM 688 O GLU A 55 -1.052 -13.567 0.591 1.00 0.25 O ATOM 689 CB GLU A 55 1.627 -14.800 1.781 1.00 0.36 C ATOM 690 CG GLU A 55 1.910 -14.434 3.232 1.00 1.14 C ATOM 691 CD GLU A 55 3.392 -14.271 3.511 1.00 1.92 C ATOM 692 OE1 GLU A 55 3.981 -13.244 3.095 1.00 2.61 O ATOM 693 OE2 GLU A 55 3.979 -15.176 4.142 1.00 2.39 O ATOM 0 H GLU A 55 3.013 -12.761 1.823 1.00 0.25 H new ATOM 0 HA GLU A 55 1.394 -13.921 -0.167 1.00 0.27 H new ATOM 0 HB2 GLU A 55 0.772 -15.476 1.749 1.00 0.36 H new ATOM 0 HB3 GLU A 55 2.481 -15.347 1.383 1.00 0.36 H new ATOM 0 HG2 GLU A 55 1.393 -13.506 3.477 1.00 1.14 H new ATOM 0 HG3 GLU A 55 1.504 -15.207 3.884 1.00 1.14 H new ATOM 700 N THR A 56 -0.134 -12.005 1.918 1.00 0.25 N ATOM 701 CA THR A 56 -1.389 -11.361 2.255 1.00 0.24 C ATOM 702 C THR A 56 -1.883 -10.532 1.093 1.00 0.21 C ATOM 703 O THR A 56 -2.971 -10.757 0.568 1.00 0.22 O ATOM 704 CB THR A 56 -1.199 -10.474 3.494 1.00 0.26 C ATOM 705 OG1 THR A 56 -0.972 -11.304 4.637 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.392 -9.571 3.729 1.00 0.25 C ATOM 0 H THR A 56 0.682 -11.570 2.347 1.00 0.25 H new ATOM 0 HA THR A 56 -2.133 -12.127 2.474 1.00 0.24 H new ATOM 0 HB THR A 56 -0.336 -9.830 3.325 1.00 0.26 H new ATOM 0 HG1 THR A 56 -0.014 -11.491 4.721 1.00 0.33 H new ATOM 0 HG21 THR A 56 -2.217 -8.960 4.615 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.534 -8.923 2.864 1.00 0.25 H new ATOM 0 HG23 THR A 56 -3.285 -10.179 3.878 1.00 0.25 H new ATOM 714 N ALA A 57 -1.050 -9.604 0.681 1.00 0.19 N ATOM 715 CA ALA A 57 -1.353 -8.711 -0.409 1.00 0.20 C ATOM 716 C ALA A 57 -1.653 -9.488 -1.681 1.00 0.19 C ATOM 717 O ALA A 57 -2.548 -9.126 -2.447 1.00 0.22 O ATOM 718 CB ALA A 57 -0.180 -7.776 -0.607 1.00 0.22 C ATOM 0 H ALA A 57 -0.133 -9.448 1.099 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.244 -8.131 -0.170 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.394 -7.093 -1.429 1.00 0.22 H new ATOM 0 HB2 ALA A 57 -0.013 -7.204 0.306 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.713 -8.356 -0.840 1.00 0.22 H new ATOM 724 N THR A 58 -0.907 -10.566 -1.890 1.00 0.17 N ATOM 725 CA THR A 58 -1.088 -11.406 -3.061 1.00 0.17 C ATOM 726 C THR A 58 -2.499 -11.995 -3.082 1.00 0.17 C ATOM 727 O THR A 58 -3.270 -11.781 -4.024 1.00 0.19 O ATOM 728 CB THR A 58 -0.074 -12.564 -3.080 1.00 0.20 C ATOM 729 OG1 THR A 58 1.265 -12.058 -2.994 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.218 -13.400 -4.342 1.00 0.26 C ATOM 0 H THR A 58 -0.169 -10.878 -1.259 1.00 0.17 H new ATOM 0 HA THR A 58 -0.931 -10.778 -3.938 1.00 0.17 H new ATOM 0 HB THR A 58 -0.279 -13.197 -2.217 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.434 -11.733 -2.085 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.511 -14.210 -4.327 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.224 -13.818 -4.389 1.00 0.26 H new ATOM 0 HG23 THR A 58 -0.045 -12.772 -5.216 1.00 0.26 H new ATOM 738 N THR A 59 -2.831 -12.715 -2.017 1.00 0.16 N ATOM 739 CA THR A 59 -4.098 -13.420 -1.919 1.00 0.17 C ATOM 740 C THR A 59 -5.275 -12.450 -1.847 1.00 0.16 C ATOM 741 O THR A 59 -6.313 -12.688 -2.449 1.00 0.19 O ATOM 742 CB THR A 59 -4.107 -14.338 -0.681 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.937 -15.169 -0.690 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.353 -15.212 -0.652 1.00 0.46 C ATOM 0 H THR A 59 -2.230 -12.825 -1.200 1.00 0.16 H new ATOM 0 HA THR A 59 -4.207 -14.024 -2.820 1.00 0.17 H new ATOM 0 HB THR A 59 -4.110 -13.710 0.210 1.00 0.20 H new ATOM 0 HG1 THR A 59 -2.196 -14.695 -0.257 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.331 -15.848 0.233 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.240 -14.580 -0.622 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.382 -15.835 -1.546 1.00 0.46 H new ATOM 752 N LEU A 60 -5.089 -11.341 -1.144 1.00 0.13 N ATOM 753 CA LEU A 60 -6.156 -10.381 -0.920 1.00 0.13 C ATOM 754 C LEU A 60 -6.580 -9.747 -2.215 1.00 0.13 C ATOM 755 O LEU A 60 -7.768 -9.665 -2.522 1.00 0.15 O ATOM 756 CB LEU A 60 -5.693 -9.309 0.043 1.00 0.13 C ATOM 757 CG LEU A 60 -5.803 -9.700 1.500 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.249 -8.601 2.379 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.252 -9.977 1.845 1.00 0.35 C ATOM 0 H LEU A 60 -4.199 -11.084 -0.716 1.00 0.13 H new ATOM 0 HA LEU A 60 -7.009 -10.909 -0.493 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.655 -9.060 -0.178 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.280 -8.406 -0.125 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.220 -10.604 1.674 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.334 -8.894 3.425 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -4.201 -8.432 2.133 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.813 -7.683 2.213 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.329 -10.259 2.895 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.846 -9.081 1.665 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.625 -10.791 1.223 1.00 0.35 H new ATOM 771 N TYR A 61 -5.596 -9.306 -2.973 1.00 0.14 N ATOM 772 CA TYR A 61 -5.847 -8.708 -4.259 1.00 0.15 C ATOM 773 C TYR A 61 -6.626 -9.664 -5.146 1.00 0.17 C ATOM 774 O TYR A 61 -7.649 -9.315 -5.673 1.00 0.22 O ATOM 775 CB TYR A 61 -4.548 -8.353 -4.948 1.00 0.17 C ATOM 776 CG TYR A 61 -4.796 -7.696 -6.273 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.871 -6.860 -6.474 1.00 0.16 C ATOM 778 CD2 TYR A 61 -3.941 -7.934 -7.330 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.104 -6.277 -7.702 1.00 0.18 C ATOM 780 CE2 TYR A 61 -4.156 -7.357 -8.561 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.263 -6.435 -8.695 1.00 0.23 C ATOM 782 OH TYR A 61 -5.469 -5.960 -9.978 1.00 0.28 O ATOM 0 H TYR A 61 -4.611 -9.353 -2.714 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.429 -7.801 -4.095 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.967 -7.685 -4.312 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.952 -9.254 -5.092 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.545 -6.657 -5.655 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -3.090 -8.583 -7.189 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -6.993 -5.681 -7.848 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.518 -7.586 -9.402 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.704 -6.199 -10.542 1.00 0.28 H new ATOM 792 N ASN A 62 -6.148 -10.881 -5.259 1.00 0.18 N ATOM 793 CA ASN A 62 -6.705 -11.850 -6.190 1.00 0.22 C ATOM 794 C ASN A 62 -8.055 -12.335 -5.706 1.00 0.20 C ATOM 795 O ASN A 62 -8.894 -12.756 -6.501 1.00 0.24 O ATOM 796 CB ASN A 62 -5.747 -13.028 -6.394 1.00 0.27 C ATOM 797 CG ASN A 62 -4.591 -12.678 -7.312 1.00 0.75 C ATOM 798 OD1 ASN A 62 -4.684 -12.837 -8.529 1.00 1.21 O ATOM 799 ND2 ASN A 62 -3.496 -12.195 -6.744 1.00 1.12 N ATOM 0 H ASN A 62 -5.363 -11.233 -4.711 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.841 -11.357 -7.153 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.357 -13.348 -5.428 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.296 -13.872 -6.811 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -2.693 -11.941 -7.319 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -3.456 -12.077 -5.732 1.00 1.12 H new ATOM 806 N LYS A 63 -8.270 -12.247 -4.403 1.00 0.18 N ATOM 807 CA LYS A 63 -9.486 -12.728 -3.804 1.00 0.20 C ATOM 808 C LYS A 63 -10.559 -11.673 -3.947 1.00 0.18 C ATOM 809 O LYS A 63 -11.750 -11.981 -3.987 1.00 0.22 O ATOM 810 CB LYS A 63 -9.219 -13.041 -2.326 1.00 0.26 C ATOM 811 CG LYS A 63 -10.443 -13.384 -1.492 1.00 0.29 C ATOM 812 CD LYS A 63 -10.049 -13.653 -0.047 1.00 0.64 C ATOM 813 CE LYS A 63 -9.363 -14.996 0.115 1.00 0.91 C ATOM 814 NZ LYS A 63 -10.351 -16.102 0.211 1.00 1.54 N ATOM 0 H LYS A 63 -7.607 -11.842 -3.743 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.826 -13.637 -4.300 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.520 -13.875 -2.271 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -8.725 -12.180 -1.875 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.159 -12.563 -1.532 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -10.939 -14.261 -1.908 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -9.384 -12.862 0.301 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -10.938 -13.622 0.583 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.699 -15.172 -0.732 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -8.741 -14.983 1.010 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -9.850 -17.007 0.321 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.968 -15.946 1.033 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -10.927 -16.129 -0.654 1.00 1.54 H new ATOM 828 N TYR A 64 -10.134 -10.415 -4.045 1.00 0.16 N ATOM 829 CA TYR A 64 -11.078 -9.332 -3.945 1.00 0.16 C ATOM 830 C TYR A 64 -11.036 -8.322 -5.080 1.00 0.17 C ATOM 831 O TYR A 64 -11.903 -7.447 -5.151 1.00 0.17 O ATOM 832 CB TYR A 64 -10.919 -8.677 -2.594 1.00 0.15 C ATOM 833 CG TYR A 64 -11.417 -9.561 -1.488 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.699 -10.079 -1.551 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.630 -9.873 -0.394 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.194 -10.880 -0.556 1.00 0.23 C ATOM 837 CE2 TYR A 64 -11.116 -10.680 0.617 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.403 -11.181 0.532 1.00 0.24 C ATOM 839 OH TYR A 64 -12.888 -11.995 1.528 1.00 0.31 O ATOM 0 H TYR A 64 -9.164 -10.136 -4.190 1.00 0.16 H new ATOM 0 HA TYR A 64 -12.072 -9.769 -4.044 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.869 -8.440 -2.426 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.465 -7.734 -2.580 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.322 -9.847 -2.402 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.625 -9.482 -0.329 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.198 -11.273 -0.624 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.495 -10.918 1.468 1.00 0.23 H new ATOM 0 HH TYR A 64 -12.281 -11.968 2.297 1.00 0.31 H new ATOM 849 N LYS A 65 -10.084 -8.442 -5.988 1.00 0.20 N ATOM 850 CA LYS A 65 -10.109 -7.630 -7.199 1.00 0.23 C ATOM 851 C LYS A 65 -11.332 -8.002 -7.982 1.00 0.20 C ATOM 852 O LYS A 65 -11.906 -7.188 -8.703 1.00 0.22 O ATOM 853 CB LYS A 65 -8.862 -7.815 -8.061 1.00 0.34 C ATOM 854 CG LYS A 65 -8.529 -9.258 -8.378 1.00 0.29 C ATOM 855 CD LYS A 65 -7.305 -9.351 -9.266 1.00 0.38 C ATOM 856 CE LYS A 65 -7.695 -9.532 -10.723 1.00 0.80 C ATOM 857 NZ LYS A 65 -6.512 -9.604 -11.618 1.00 1.35 N ATOM 0 H LYS A 65 -9.294 -9.083 -5.916 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.129 -6.580 -6.908 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -8.998 -7.272 -8.996 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -8.012 -7.362 -7.551 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.353 -9.806 -7.452 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -9.378 -9.731 -8.872 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -6.704 -8.448 -9.157 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.684 -10.188 -8.947 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -8.284 -10.443 -10.829 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -8.332 -8.703 -11.032 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -6.828 -9.728 -12.601 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -5.963 -8.725 -11.539 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -5.916 -10.410 -11.342 1.00 1.35 H new ATOM 871 N SER A 66 -11.733 -9.245 -7.787 1.00 0.23 N ATOM 872 CA SER A 66 -12.982 -9.746 -8.330 1.00 0.26 C ATOM 873 C SER A 66 -14.136 -8.781 -8.022 1.00 0.25 C ATOM 874 O SER A 66 -15.050 -8.619 -8.831 1.00 0.31 O ATOM 875 CB SER A 66 -13.269 -11.123 -7.739 1.00 0.32 C ATOM 876 OG SER A 66 -12.111 -11.940 -7.789 1.00 1.28 O ATOM 0 H SER A 66 -11.205 -9.933 -7.250 1.00 0.23 H new ATOM 0 HA SER A 66 -12.893 -9.826 -9.413 1.00 0.26 H new ATOM 0 HB2 SER A 66 -13.603 -11.019 -6.707 1.00 0.32 H new ATOM 0 HB3 SER A 66 -14.080 -11.599 -8.290 1.00 0.32 H new ATOM 0 HG SER A 66 -12.313 -12.818 -7.404 1.00 1.28 H new ATOM 882 N GLN A 67 -14.088 -8.139 -6.854 1.00 0.21 N ATOM 883 CA GLN A 67 -15.095 -7.147 -6.490 1.00 0.20 C ATOM 884 C GLN A 67 -14.648 -5.726 -6.866 1.00 0.20 C ATOM 885 O GLN A 67 -15.475 -4.871 -7.186 1.00 0.27 O ATOM 886 CB GLN A 67 -15.386 -7.234 -4.994 1.00 0.21 C ATOM 887 CG GLN A 67 -15.687 -8.651 -4.546 1.00 0.38 C ATOM 888 CD GLN A 67 -16.054 -8.746 -3.087 1.00 0.52 C ATOM 889 OE1 GLN A 67 -16.660 -7.840 -2.519 1.00 1.11 O ATOM 890 NE2 GLN A 67 -15.659 -9.837 -2.463 1.00 0.46 N ATOM 0 H GLN A 67 -13.366 -8.288 -6.149 1.00 0.21 H new ATOM 0 HA GLN A 67 -16.005 -7.364 -7.050 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.530 -6.854 -4.437 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -16.233 -6.592 -4.753 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -16.505 -9.049 -5.147 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -14.816 -9.278 -4.737 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -15.159 -10.564 -2.974 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -15.854 -9.955 -1.469 1.00 0.46 H new ATOM 899 N GLY A 68 -13.340 -5.485 -6.835 1.00 0.17 N ATOM 900 CA GLY A 68 -12.797 -4.170 -7.128 1.00 0.18 C ATOM 901 C GLY A 68 -11.576 -3.871 -6.275 1.00 0.15 C ATOM 902 O GLY A 68 -10.882 -2.872 -6.489 1.00 0.17 O ATOM 0 H GLY A 68 -12.637 -6.189 -6.609 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.529 -4.113 -8.183 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.560 -3.412 -6.952 1.00 0.18 H new ATOM 906 N PHE A 69 -11.313 -4.761 -5.321 1.00 0.14 N ATOM 907 CA PHE A 69 -10.211 -4.603 -4.375 1.00 0.13 C ATOM 908 C PHE A 69 -8.873 -4.766 -5.064 1.00 0.14 C ATOM 909 O PHE A 69 -8.724 -5.587 -5.953 1.00 0.18 O ATOM 910 CB PHE A 69 -10.328 -5.639 -3.249 1.00 0.14 C ATOM 911 CG PHE A 69 -9.278 -5.490 -2.195 1.00 0.12 C ATOM 912 CD1 PHE A 69 -8.976 -4.265 -1.615 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.605 -6.598 -1.777 1.00 0.14 C ATOM 914 CE1 PHE A 69 -8.000 -4.176 -0.637 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.653 -6.527 -0.816 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.343 -5.114 -0.258 1.00 0.14 C ATOM 0 H PHE A 69 -11.858 -5.612 -5.182 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.271 -3.597 -3.959 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.311 -5.553 -2.787 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.263 -6.639 -3.677 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.505 -3.377 -1.928 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.836 -7.555 -2.222 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.816 -3.211 -0.188 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.138 -7.406 -0.458 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.549 -4.971 0.460 1.00 0.14 H new ATOM 926 N THR A 70 -7.901 -3.971 -4.671 1.00 0.13 N ATOM 927 CA THR A 70 -6.574 -4.133 -5.156 1.00 0.12 C ATOM 928 C THR A 70 -5.650 -4.057 -3.997 1.00 0.12 C ATOM 929 O THR A 70 -5.970 -3.460 -2.989 1.00 0.19 O ATOM 930 CB THR A 70 -6.220 -3.036 -6.157 1.00 0.15 C ATOM 931 OG1 THR A 70 -5.113 -3.422 -6.966 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.902 -1.740 -5.452 1.00 0.19 C ATOM 0 H THR A 70 -8.021 -3.203 -4.010 1.00 0.13 H new ATOM 0 HA THR A 70 -6.488 -5.094 -5.663 1.00 0.12 H new ATOM 0 HB THR A 70 -7.090 -2.885 -6.796 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.253 -4.333 -7.299 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.653 -0.976 -6.189 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.768 -1.418 -4.874 1.00 0.19 H new ATOM 0 HG23 THR A 70 -5.054 -1.888 -4.783 1.00 0.19 H new ATOM 940 N VAL A 71 -4.547 -4.696 -4.108 1.00 0.13 N ATOM 941 CA VAL A 71 -3.454 -4.349 -3.284 1.00 0.13 C ATOM 942 C VAL A 71 -2.397 -3.721 -4.148 1.00 0.13 C ATOM 943 O VAL A 71 -1.670 -4.406 -4.854 1.00 0.15 O ATOM 944 CB VAL A 71 -2.897 -5.560 -2.535 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.530 -5.238 -1.959 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.853 -5.978 -1.433 1.00 0.17 C ATOM 0 H VAL A 71 -4.377 -5.461 -4.761 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.788 -3.644 -2.523 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.790 -6.389 -3.235 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.145 -6.109 -1.428 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.848 -4.974 -2.767 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.615 -4.400 -1.268 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.446 -6.841 -0.906 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.983 -5.153 -0.732 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.817 -6.240 -1.868 1.00 0.17 H new ATOM 956 N LEU A 72 -2.336 -2.409 -4.128 1.00 0.17 N ATOM 957 CA LEU A 72 -1.275 -1.750 -4.854 1.00 0.22 C ATOM 958 C LEU A 72 -0.175 -1.449 -3.885 1.00 0.19 C ATOM 959 O LEU A 72 -0.383 -0.766 -2.889 1.00 0.28 O ATOM 960 CB LEU A 72 -1.660 -0.447 -5.578 1.00 0.43 C ATOM 961 CG LEU A 72 -3.122 -0.064 -5.667 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.680 0.319 -4.309 1.00 1.04 C ATOM 963 CD2 LEU A 72 -3.283 1.071 -6.646 1.00 1.00 C ATOM 0 H LEU A 72 -2.984 -1.795 -3.635 1.00 0.17 H new ATOM 0 HA LEU A 72 -0.984 -2.439 -5.647 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -1.134 0.371 -5.086 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.273 -0.508 -6.595 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.686 -0.928 -6.017 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.731 0.588 -4.410 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.586 -0.525 -3.626 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -3.124 1.169 -3.914 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -4.335 1.348 -6.712 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -2.702 1.929 -6.307 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -2.928 0.758 -7.628 1.00 1.00 H new ATOM 975 N ALA A 73 0.982 -1.968 -4.167 1.00 0.22 N ATOM 976 CA ALA A 73 2.118 -1.743 -3.328 1.00 0.30 C ATOM 977 C ALA A 73 3.134 -0.875 -4.041 1.00 0.23 C ATOM 978 O ALA A 73 3.654 -1.242 -5.093 1.00 0.32 O ATOM 979 CB ALA A 73 2.721 -3.065 -2.922 1.00 0.51 C ATOM 0 H ALA A 73 1.164 -2.556 -4.980 1.00 0.22 H new ATOM 0 HA ALA A 73 1.802 -1.217 -2.427 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.586 -2.889 -2.283 1.00 0.51 H new ATOM 0 HB2 ALA A 73 1.980 -3.651 -2.377 1.00 0.51 H new ATOM 0 HB3 ALA A 73 3.033 -3.612 -3.812 1.00 0.51 H new ATOM 985 N PHE A 74 3.381 0.295 -3.496 1.00 0.29 N ATOM 986 CA PHE A 74 4.432 1.152 -4.004 1.00 0.33 C ATOM 987 C PHE A 74 5.726 0.800 -3.264 1.00 0.35 C ATOM 988 O PHE A 74 5.867 1.084 -2.074 1.00 0.37 O ATOM 989 CB PHE A 74 4.071 2.631 -3.811 1.00 0.44 C ATOM 990 CG PHE A 74 2.861 3.139 -4.587 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.802 2.309 -4.946 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.775 4.485 -4.916 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.701 2.808 -5.620 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.666 4.996 -5.592 1.00 0.43 C ATOM 995 CZ PHE A 74 0.627 4.146 -5.945 1.00 0.35 C ATOM 0 H PHE A 74 2.869 0.676 -2.701 1.00 0.29 H new ATOM 0 HA PHE A 74 4.562 0.993 -5.075 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.894 2.804 -2.750 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.935 3.233 -4.092 1.00 0.44 H new ATOM 0 HD1 PHE A 74 1.840 1.259 -4.695 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.582 5.149 -4.644 1.00 0.41 H new ATOM 0 HE1 PHE A 74 -0.106 2.145 -5.893 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.617 6.046 -5.839 1.00 0.43 H new ATOM 0 HZ PHE A 74 -0.234 4.530 -6.471 1.00 0.35 H new ATOM 1005 N PRO A 75 6.671 0.144 -3.960 1.00 0.37 N ATOM 1006 CA PRO A 75 7.856 -0.481 -3.341 1.00 0.46 C ATOM 1007 C PRO A 75 8.947 0.489 -2.903 1.00 0.61 C ATOM 1008 O PRO A 75 10.060 0.415 -3.407 1.00 1.30 O ATOM 1009 CB PRO A 75 8.377 -1.395 -4.446 1.00 0.54 C ATOM 1010 CG PRO A 75 7.965 -0.728 -5.710 1.00 0.44 C ATOM 1011 CD PRO A 75 6.645 -0.055 -5.418 1.00 0.38 C ATOM 0 HA PRO A 75 7.580 -0.981 -2.412 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.460 -1.506 -4.391 1.00 0.54 H new ATOM 0 HB3 PRO A 75 7.950 -2.395 -4.368 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.712 -0.000 -6.028 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.863 -1.453 -6.518 1.00 0.44 H new ATOM 0 HD2 PRO A 75 6.552 0.892 -5.950 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.803 -0.676 -5.723 1.00 0.38 H new ATOM 1019 N SER A 76 8.591 1.335 -1.933 1.00 0.41 N ATOM 1020 CA SER A 76 9.469 2.314 -1.247 1.00 0.37 C ATOM 1021 C SER A 76 10.822 2.581 -1.888 1.00 0.50 C ATOM 1022 O SER A 76 11.655 1.684 -2.063 1.00 0.74 O ATOM 1023 CB SER A 76 9.678 1.837 0.197 1.00 0.53 C ATOM 1024 OG SER A 76 10.514 2.706 0.934 1.00 1.44 O ATOM 0 H SER A 76 7.635 1.365 -1.579 1.00 0.41 H new ATOM 0 HA SER A 76 8.948 3.269 -1.315 1.00 0.37 H new ATOM 0 HB2 SER A 76 8.711 1.758 0.695 1.00 0.53 H new ATOM 0 HB3 SER A 76 10.114 0.838 0.188 1.00 0.53 H new ATOM 0 HG SER A 76 10.618 2.364 1.847 1.00 1.44 H new ATOM 1388 N ALA A 100 4.985 -8.449 -7.847 1.00 0.51 N ATOM 1389 CA ALA A 100 3.971 -9.266 -7.210 1.00 0.43 C ATOM 1390 C ALA A 100 2.850 -9.622 -8.161 1.00 0.40 C ATOM 1391 O ALA A 100 2.890 -9.296 -9.348 1.00 0.55 O ATOM 1392 CB ALA A 100 3.405 -8.532 -6.017 1.00 0.43 C ATOM 0 HA ALA A 100 4.446 -10.194 -6.892 1.00 0.43 H new ATOM 0 HB1 ALA A 100 2.643 -9.147 -5.539 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.204 -8.325 -5.305 1.00 0.43 H new ATOM 0 HB3 ALA A 100 2.960 -7.593 -6.345 1.00 0.43 H new ATOM 1398 N GLU A 101 1.840 -10.288 -7.620 1.00 0.34 N ATOM 1399 CA GLU A 101 0.669 -10.649 -8.390 1.00 0.40 C ATOM 1400 C GLU A 101 -0.400 -9.567 -8.235 1.00 0.43 C ATOM 1401 O GLU A 101 -1.560 -9.756 -8.604 1.00 0.67 O ATOM 1402 CB GLU A 101 0.120 -12.006 -7.942 1.00 0.50 C ATOM 1403 CG GLU A 101 1.185 -13.085 -7.773 1.00 0.67 C ATOM 1404 CD GLU A 101 2.091 -13.231 -8.979 1.00 1.24 C ATOM 1405 OE1 GLU A 101 1.576 -13.525 -10.078 1.00 1.57 O ATOM 1406 OE2 GLU A 101 3.317 -13.046 -8.841 1.00 1.99 O ATOM 0 H GLU A 101 1.813 -10.588 -6.646 1.00 0.34 H new ATOM 0 HA GLU A 101 0.951 -10.729 -9.440 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.406 -11.878 -6.996 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -0.615 -12.347 -8.671 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.792 -12.852 -6.898 1.00 0.67 H new ATOM 0 HG3 GLU A 101 0.697 -14.040 -7.577 1.00 0.67 H new ATOM 1413 N PHE A 102 0.014 -8.439 -7.669 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.841 -7.294 -7.458 1.00 0.40 C ATOM 1415 C PHE A 102 -0.080 -6.043 -7.898 1.00 0.45 C ATOM 1416 O PHE A 102 1.138 -6.103 -8.069 1.00 0.80 O ATOM 1417 CB PHE A 102 -1.281 -7.215 -5.989 1.00 0.84 C ATOM 1418 CG PHE A 102 -0.205 -7.481 -4.997 1.00 0.45 C ATOM 1419 CD1 PHE A 102 0.117 -8.771 -4.644 1.00 0.52 C ATOM 1420 CD2 PHE A 102 0.470 -6.438 -4.416 1.00 0.62 C ATOM 1421 CE1 PHE A 102 1.105 -9.019 -3.718 1.00 0.59 C ATOM 1422 CE2 PHE A 102 1.462 -6.672 -3.491 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.782 -7.971 -3.144 1.00 0.44 C ATOM 0 H PHE A 102 0.970 -8.300 -7.341 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.752 -7.381 -8.051 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -1.691 -6.223 -5.801 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -2.088 -7.930 -5.828 1.00 0.84 H new ATOM 0 HD1 PHE A 102 -0.410 -9.597 -5.098 1.00 0.52 H new ATOM 0 HD2 PHE A 102 0.221 -5.423 -4.687 1.00 0.62 H new ATOM 0 HE1 PHE A 102 1.347 -10.035 -3.444 1.00 0.59 H new ATOM 0 HE2 PHE A 102 1.988 -5.844 -3.038 1.00 0.58 H new ATOM 0 HZ PHE A 102 2.563 -8.162 -2.423 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.776 -4.912 -8.114 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.179 -3.678 -8.665 1.00 0.39 C ATOM 1435 C PRO A 103 0.995 -3.141 -7.856 1.00 0.41 C ATOM 1436 O PRO A 103 0.803 -2.427 -6.878 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.344 -2.679 -8.640 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.290 -3.250 -7.652 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.204 -4.723 -7.836 1.00 0.27 C ATOM 0 HA PRO A 103 0.243 -3.859 -9.654 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.010 -1.685 -8.343 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.805 -2.580 -9.623 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -2.019 -2.964 -6.636 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -3.304 -2.890 -7.824 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -2.522 -5.265 -6.945 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.829 -5.069 -8.659 1.00 0.27 H new ATOM 1447 N ILE A 104 2.215 -3.463 -8.272 1.00 0.35 N ATOM 1448 CA ILE A 104 3.378 -2.868 -7.644 1.00 0.35 C ATOM 1449 C ILE A 104 3.853 -1.745 -8.519 1.00 0.33 C ATOM 1450 O ILE A 104 4.132 -1.931 -9.704 1.00 0.44 O ATOM 1451 CB ILE A 104 4.555 -3.827 -7.383 1.00 0.41 C ATOM 1452 CG1 ILE A 104 4.084 -5.094 -6.670 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.623 -3.105 -6.560 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.072 -4.836 -5.593 1.00 1.34 C ATOM 0 H ILE A 104 2.418 -4.119 -9.026 1.00 0.35 H new ATOM 0 HA ILE A 104 3.054 -2.536 -6.658 1.00 0.35 H new ATOM 0 HB ILE A 104 4.983 -4.131 -8.338 1.00 0.41 H new ATOM 0 HG12 ILE A 104 3.655 -5.776 -7.404 1.00 0.52 H new ATOM 0 HG13 ILE A 104 4.947 -5.597 -6.233 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.457 -3.781 -6.374 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.978 -2.233 -7.109 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.196 -2.785 -5.610 1.00 0.45 H new ATOM 0 HD11 ILE A 104 2.784 -5.780 -5.131 1.00 1.34 H new ATOM 0 HD12 ILE A 104 3.504 -4.179 -4.838 1.00 1.34 H new ATOM 0 HD13 ILE A 104 2.192 -4.361 -6.027 1.00 1.34 H new ATOM 1466 N MET A 105 3.930 -0.582 -7.939 1.00 0.29 N ATOM 1467 CA MET A 105 4.063 0.621 -8.711 1.00 0.30 C ATOM 1468 C MET A 105 5.493 1.119 -8.734 1.00 0.27 C ATOM 1469 O MET A 105 6.426 0.391 -8.401 1.00 0.35 O ATOM 1470 CB MET A 105 3.114 1.656 -8.140 1.00 0.43 C ATOM 1471 CG MET A 105 1.696 1.144 -8.041 1.00 1.50 C ATOM 1472 SD MET A 105 0.825 1.085 -9.626 1.00 2.49 S ATOM 1473 CE MET A 105 1.407 -0.446 -10.346 1.00 3.03 C ATOM 0 H MET A 105 3.903 -0.440 -6.929 1.00 0.29 H new ATOM 0 HA MET A 105 3.802 0.420 -9.750 1.00 0.30 H new ATOM 0 HB2 MET A 105 3.459 1.955 -7.150 1.00 0.43 H new ATOM 0 HB3 MET A 105 3.133 2.547 -8.767 1.00 0.43 H new ATOM 0 HG2 MET A 105 1.711 0.144 -7.608 1.00 1.50 H new ATOM 0 HG3 MET A 105 1.138 1.780 -7.354 1.00 1.50 H new ATOM 0 HE1 MET A 105 0.702 -0.782 -11.106 1.00 3.03 H new ATOM 0 HE2 MET A 105 2.384 -0.285 -10.803 1.00 3.03 H new ATOM 0 HE3 MET A 105 1.491 -1.205 -9.568 1.00 3.03 H new ATOM 1483 N ALA A 106 5.647 2.369 -9.128 1.00 0.33 N ATOM 1484 CA ALA A 106 6.950 2.943 -9.429 1.00 0.52 C ATOM 1485 C ALA A 106 7.807 3.174 -8.193 1.00 0.66 C ATOM 1486 O ALA A 106 8.916 3.681 -8.312 1.00 1.46 O ATOM 1487 CB ALA A 106 6.752 4.249 -10.175 1.00 0.70 C ATOM 0 H ALA A 106 4.871 3.019 -9.250 1.00 0.33 H new ATOM 0 HA ALA A 106 7.489 2.222 -10.044 1.00 0.52 H new ATOM 0 HB1 ALA A 106 7.723 4.687 -10.405 1.00 0.70 H new ATOM 0 HB2 ALA A 106 6.210 4.060 -11.102 1.00 0.70 H new ATOM 0 HB3 ALA A 106 6.180 4.939 -9.555 1.00 0.70 H new ATOM 1493 N LYS A 107 7.288 2.746 -7.034 1.00 0.40 N ATOM 1494 CA LYS A 107 7.847 3.048 -5.707 1.00 0.36 C ATOM 1495 C LYS A 107 8.023 4.522 -5.508 1.00 0.38 C ATOM 1496 O LYS A 107 8.678 5.221 -6.275 1.00 0.59 O ATOM 1497 CB LYS A 107 9.179 2.336 -5.395 1.00 0.49 C ATOM 1498 CG LYS A 107 10.421 2.859 -6.100 1.00 0.84 C ATOM 1499 CD LYS A 107 11.691 2.231 -5.545 1.00 0.83 C ATOM 1500 CE LYS A 107 11.755 0.733 -5.810 1.00 0.95 C ATOM 1501 NZ LYS A 107 12.755 0.062 -4.931 1.00 1.76 N ATOM 0 H LYS A 107 6.449 2.167 -6.991 1.00 0.40 H new ATOM 0 HA LYS A 107 7.107 2.657 -5.009 1.00 0.36 H new ATOM 0 HB2 LYS A 107 9.350 2.393 -4.320 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.066 1.281 -5.645 1.00 0.49 H new ATOM 0 HG2 LYS A 107 10.348 2.650 -7.167 1.00 0.84 H new ATOM 0 HG3 LYS A 107 10.473 3.942 -5.990 1.00 0.84 H new ATOM 0 HD2 LYS A 107 12.559 2.715 -5.993 1.00 0.83 H new ATOM 0 HD3 LYS A 107 11.744 2.411 -4.471 1.00 0.83 H new ATOM 0 HE2 LYS A 107 10.772 0.292 -5.646 1.00 0.95 H new ATOM 0 HE3 LYS A 107 12.013 0.558 -6.855 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 12.772 -0.957 -5.139 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 13.697 0.466 -5.105 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 12.495 0.208 -3.935 1.00 1.76 H new ATOM 1515 N ILE A 108 7.420 5.008 -4.476 1.00 0.31 N ATOM 1516 CA ILE A 108 7.666 6.336 -4.088 1.00 0.35 C ATOM 1517 C ILE A 108 8.159 6.328 -2.662 1.00 0.36 C ATOM 1518 O ILE A 108 8.274 5.273 -2.032 1.00 0.42 O ATOM 1519 CB ILE A 108 6.428 7.238 -4.226 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.530 7.107 -2.992 1.00 0.82 C ATOM 1521 CG2 ILE A 108 5.664 6.893 -5.508 1.00 0.68 C ATOM 1522 CD1 ILE A 108 4.851 5.779 -2.864 1.00 0.64 C ATOM 0 H ILE A 108 6.756 4.499 -3.893 1.00 0.31 H new ATOM 0 HA ILE A 108 8.419 6.755 -4.756 1.00 0.35 H new ATOM 0 HB ILE A 108 6.752 8.276 -4.294 1.00 0.48 H new ATOM 0 HG12 ILE A 108 6.131 7.283 -2.099 1.00 0.82 H new ATOM 0 HG13 ILE A 108 4.771 7.889 -3.024 1.00 0.82 H new ATOM 0 HG21 ILE A 108 4.790 7.538 -5.595 1.00 0.68 H new ATOM 0 HG22 ILE A 108 6.313 7.044 -6.370 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.345 5.851 -5.472 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.235 5.770 -1.965 1.00 0.64 H new ATOM 0 HD12 ILE A 108 4.221 5.607 -3.737 1.00 0.64 H new ATOM 0 HD13 ILE A 108 5.602 4.991 -2.797 1.00 0.64 H new ATOM 1534 N ASN A 109 8.469 7.494 -2.196 1.00 0.38 N ATOM 1535 CA ASN A 109 8.961 7.708 -0.851 1.00 0.44 C ATOM 1536 C ASN A 109 7.867 7.495 0.174 1.00 0.47 C ATOM 1537 O ASN A 109 7.385 8.450 0.770 1.00 0.76 O ATOM 1538 CB ASN A 109 9.502 9.126 -0.806 1.00 0.53 C ATOM 1539 CG ASN A 109 10.350 9.459 0.408 1.00 0.98 C ATOM 1540 OD1 ASN A 109 11.360 10.143 0.280 1.00 1.73 O ATOM 1541 ND2 ASN A 109 9.938 9.035 1.588 1.00 1.16 N ATOM 0 H ASN A 109 8.390 8.351 -2.743 1.00 0.38 H new ATOM 0 HA ASN A 109 9.745 6.992 -0.604 1.00 0.44 H new ATOM 0 HB2 ASN A 109 10.097 9.299 -1.703 1.00 0.53 H new ATOM 0 HB3 ASN A 109 8.662 9.819 -0.843 1.00 0.53 H new ATOM 0 HD21 ASN A 109 10.464 9.275 2.428 1.00 1.16 H new ATOM 0 HD22 ASN A 109 9.093 8.468 1.660 1.00 1.16 H new ATOM 1548 N VAL A 110 7.469 6.248 0.395 1.00 0.41 N ATOM 1549 CA VAL A 110 6.495 5.995 1.431 1.00 0.42 C ATOM 1550 C VAL A 110 7.173 6.179 2.773 1.00 0.44 C ATOM 1551 O VAL A 110 7.743 5.257 3.354 1.00 0.48 O ATOM 1552 CB VAL A 110 5.911 4.570 1.322 1.00 0.43 C ATOM 1553 CG1 VAL A 110 5.004 4.458 0.120 1.00 0.60 C ATOM 1554 CG2 VAL A 110 7.009 3.525 1.221 1.00 0.77 C ATOM 0 H VAL A 110 7.796 5.426 -0.113 1.00 0.41 H new ATOM 0 HA VAL A 110 5.665 6.694 1.322 1.00 0.42 H new ATOM 0 HB VAL A 110 5.337 4.385 2.230 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.602 3.446 0.060 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.184 5.169 0.216 1.00 0.60 H new ATOM 0 HG13 VAL A 110 5.571 4.677 -0.785 1.00 0.60 H new ATOM 0 HG21 VAL A 110 6.562 2.534 1.146 1.00 0.77 H new ATOM 0 HG22 VAL A 110 7.615 3.718 0.336 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.639 3.572 2.109 1.00 0.77 H new ATOM 1564 N ASN A 111 7.067 7.388 3.274 1.00 0.48 N ATOM 1565 CA ASN A 111 7.738 7.764 4.487 1.00 0.56 C ATOM 1566 C ASN A 111 7.503 9.230 4.760 1.00 0.62 C ATOM 1567 O ASN A 111 6.794 9.905 4.010 1.00 0.67 O ATOM 1568 CB ASN A 111 9.226 7.477 4.423 1.00 0.65 C ATOM 1569 CG ASN A 111 9.748 7.150 5.798 1.00 1.20 C ATOM 1570 OD1 ASN A 111 10.183 8.034 6.535 1.00 1.90 O ATOM 1571 ND2 ASN A 111 9.661 5.888 6.174 1.00 1.72 N ATOM 0 H ASN A 111 6.514 8.133 2.850 1.00 0.48 H new ATOM 0 HA ASN A 111 7.326 7.165 5.299 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.415 6.644 3.746 1.00 0.65 H new ATOM 0 HB3 ASN A 111 9.754 8.341 4.021 1.00 0.65 H new ATOM 0 HD21 ASN A 111 9.961 5.613 7.109 1.00 1.72 H new ATOM 0 HD22 ASN A 111 9.294 5.188 5.529 1.00 1.72 H new ATOM 1624 N HIS A 116 4.454 10.251 -1.547 1.00 0.42 N ATOM 1625 CA HIS A 116 3.793 10.613 -2.756 1.00 0.35 C ATOM 1626 C HIS A 116 2.456 11.171 -2.374 1.00 0.29 C ATOM 1627 O HIS A 116 1.837 10.614 -1.495 1.00 0.29 O ATOM 1628 CB HIS A 116 3.666 9.384 -3.654 1.00 0.35 C ATOM 1629 CG HIS A 116 2.731 9.550 -4.780 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.404 9.606 -4.557 1.00 0.33 N ATOM 1631 CD2 HIS A 116 2.912 9.752 -6.102 1.00 0.31 C ATOM 1632 CE1 HIS A 116 0.777 9.860 -5.660 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.662 9.951 -6.638 1.00 0.32 N ATOM 0 HA HIS A 116 4.351 11.362 -3.318 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.651 9.134 -4.049 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.341 8.538 -3.048 1.00 0.35 H new ATOM 0 HD2 HIS A 116 3.852 9.756 -6.633 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.291 9.978 -5.764 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.454 10.137 -7.619 1.00 0.32 H new ATOM 1642 N PRO A 117 2.024 12.282 -2.992 1.00 0.31 N ATOM 1643 CA PRO A 117 0.730 12.913 -2.748 1.00 0.31 C ATOM 1644 C PRO A 117 -0.342 11.940 -2.250 1.00 0.26 C ATOM 1645 O PRO A 117 -1.028 12.211 -1.280 1.00 0.27 O ATOM 1646 CB PRO A 117 0.388 13.448 -4.137 1.00 0.37 C ATOM 1647 CG PRO A 117 1.702 13.741 -4.794 1.00 0.40 C ATOM 1648 CD PRO A 117 2.781 13.057 -3.984 1.00 0.38 C ATOM 0 HA PRO A 117 0.770 13.665 -1.960 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.181 12.715 -4.709 1.00 0.37 H new ATOM 0 HB3 PRO A 117 -0.225 14.347 -4.070 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.706 13.377 -5.821 1.00 0.40 H new ATOM 0 HG3 PRO A 117 1.878 14.816 -4.836 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.403 12.414 -4.606 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.445 13.779 -3.508 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.438 10.788 -2.909 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.365 9.726 -2.530 1.00 0.23 C ATOM 1658 C LEU A 118 -1.082 9.182 -1.121 1.00 0.27 C ATOM 1659 O LEU A 118 -1.974 9.116 -0.282 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.273 8.610 -3.554 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.101 7.376 -3.259 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.567 7.703 -3.414 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.701 6.231 -4.171 1.00 0.27 C ATOM 0 H LEU A 118 0.129 10.564 -3.727 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.373 10.141 -2.510 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.577 9.005 -4.523 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.229 8.311 -3.645 1.00 0.24 H new ATOM 0 HG LEU A 118 -1.917 7.060 -2.232 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.162 6.815 -3.202 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -3.838 8.497 -2.718 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.760 8.034 -4.434 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.308 5.355 -3.942 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.859 6.521 -5.210 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.648 5.994 -4.017 1.00 0.27 H new ATOM 1675 N TYR A 119 0.166 8.807 -0.857 1.00 0.32 N ATOM 1676 CA TYR A 119 0.528 8.221 0.424 1.00 0.42 C ATOM 1677 C TYR A 119 0.689 9.295 1.442 1.00 0.40 C ATOM 1678 O TYR A 119 0.422 9.099 2.616 1.00 0.41 O ATOM 1679 CB TYR A 119 1.812 7.435 0.338 1.00 0.57 C ATOM 1680 CG TYR A 119 1.637 6.079 -0.253 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.636 5.902 -1.623 1.00 0.92 C ATOM 1682 CD2 TYR A 119 1.437 4.986 0.552 1.00 1.09 C ATOM 1683 CE1 TYR A 119 1.415 4.661 -2.179 1.00 1.74 C ATOM 1684 CE2 TYR A 119 1.236 3.747 0.012 1.00 1.88 C ATOM 1685 CZ TYR A 119 1.413 3.552 -1.339 1.00 2.20 C ATOM 1686 OH TYR A 119 0.959 2.350 -1.898 1.00 3.04 O ATOM 0 H TYR A 119 0.941 8.899 -1.514 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.274 7.541 0.710 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.532 7.994 -0.260 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.236 7.336 1.337 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.811 6.750 -2.269 1.00 0.92 H new ATOM 0 HD2 TYR A 119 1.438 5.106 1.625 1.00 1.09 H new ATOM 0 HE1 TYR A 119 1.248 4.552 -3.240 1.00 1.74 H new ATOM 0 HE2 TYR A 119 0.939 2.923 0.644 1.00 1.88 H new ATOM 0 HH TYR A 119 1.222 2.308 -2.841 1.00 3.04 H new ATOM 1696 N GLU A 120 1.159 10.429 0.977 1.00 0.40 N ATOM 1697 CA GLU A 120 1.222 11.603 1.788 1.00 0.42 C ATOM 1698 C GLU A 120 -0.158 11.866 2.282 1.00 0.37 C ATOM 1699 O GLU A 120 -0.361 12.175 3.450 1.00 0.43 O ATOM 1700 CB GLU A 120 1.708 12.791 0.969 1.00 0.50 C ATOM 1701 CG GLU A 120 2.216 13.922 1.817 1.00 0.76 C ATOM 1702 CD GLU A 120 2.268 15.243 1.076 1.00 1.58 C ATOM 1703 OE1 GLU A 120 1.191 15.824 0.809 1.00 2.44 O ATOM 1704 OE2 GLU A 120 3.378 15.719 0.772 1.00 1.93 O ATOM 0 H GLU A 120 1.506 10.555 0.026 1.00 0.40 H new ATOM 0 HA GLU A 120 1.918 11.459 2.615 1.00 0.42 H new ATOM 0 HB2 GLU A 120 2.502 12.462 0.299 1.00 0.50 H new ATOM 0 HB3 GLU A 120 0.892 13.152 0.343 1.00 0.50 H new ATOM 0 HG2 GLU A 120 1.575 14.028 2.692 1.00 0.76 H new ATOM 0 HG3 GLU A 120 3.214 13.676 2.180 1.00 0.76 H new ATOM 1711 N TYR A 121 -1.116 11.674 1.389 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.501 11.779 1.783 1.00 0.28 C ATOM 1713 C TYR A 121 -2.855 10.668 2.759 1.00 0.27 C ATOM 1714 O TYR A 121 -3.630 10.867 3.685 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.422 11.711 0.570 1.00 0.28 C ATOM 1716 CG TYR A 121 -4.880 11.710 0.935 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.522 12.889 1.270 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.608 10.531 0.965 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -6.849 12.896 1.623 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -6.937 10.527 1.321 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.557 11.714 1.650 1.00 0.46 C ATOM 1722 OH TYR A 121 -8.886 11.724 2.011 1.00 0.56 O ATOM 0 H TYR A 121 -0.960 11.449 0.406 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.640 12.745 2.269 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.218 12.560 -0.082 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -3.196 10.810 -0.000 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -4.971 13.818 1.254 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -5.125 9.601 0.705 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.336 13.825 1.879 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.491 9.600 1.343 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.354 10.994 1.555 1.00 0.56 H new ATOM 1732 N MET A 122 -2.243 9.512 2.574 1.00 0.27 N ATOM 1733 CA MET A 122 -2.673 8.312 3.276 1.00 0.29 C ATOM 1734 C MET A 122 -2.229 8.344 4.730 1.00 0.33 C ATOM 1735 O MET A 122 -3.045 8.223 5.644 1.00 0.35 O ATOM 1736 CB MET A 122 -2.176 7.050 2.587 1.00 0.33 C ATOM 1737 CG MET A 122 -3.301 6.073 2.327 1.00 0.71 C ATOM 1738 SD MET A 122 -2.944 4.955 0.972 1.00 0.56 S ATOM 1739 CE MET A 122 -3.040 6.121 -0.371 1.00 0.55 C ATOM 0 H MET A 122 -1.450 9.377 1.947 1.00 0.27 H new ATOM 0 HA MET A 122 -3.763 8.293 3.251 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.699 7.315 1.643 1.00 0.33 H new ATOM 0 HB3 MET A 122 -1.416 6.573 3.206 1.00 0.33 H new ATOM 0 HG2 MET A 122 -3.490 5.494 3.231 1.00 0.71 H new ATOM 0 HG3 MET A 122 -4.214 6.626 2.106 1.00 0.71 H new ATOM 0 HE1 MET A 122 -3.821 5.812 -1.066 1.00 0.55 H new ATOM 0 HE2 MET A 122 -3.275 7.110 0.022 1.00 0.55 H new ATOM 0 HE3 MET A 122 -2.083 6.155 -0.892 1.00 0.55 H new ATOM 1749 N LYS A 123 -0.925 8.525 4.942 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.386 8.609 6.288 1.00 0.45 C ATOM 1751 C LYS A 123 -0.836 9.884 6.972 1.00 0.47 C ATOM 1752 O LYS A 123 -0.902 9.934 8.197 1.00 0.54 O ATOM 1753 CB LYS A 123 1.146 8.502 6.330 1.00 0.53 C ATOM 1754 CG LYS A 123 1.851 8.935 5.063 1.00 0.48 C ATOM 1755 CD LYS A 123 3.222 9.541 5.340 1.00 1.00 C ATOM 1756 CE LYS A 123 3.149 10.725 6.300 1.00 1.05 C ATOM 1757 NZ LYS A 123 2.606 11.958 5.663 1.00 1.46 N ATOM 0 H LYS A 123 -0.231 8.615 4.200 1.00 0.37 H new ATOM 0 HA LYS A 123 -0.782 7.749 6.828 1.00 0.45 H new ATOM 0 HB2 LYS A 123 1.515 9.107 7.158 1.00 0.53 H new ATOM 0 HB3 LYS A 123 1.418 7.468 6.544 1.00 0.53 H new ATOM 0 HG2 LYS A 123 1.963 8.076 4.401 1.00 0.48 H new ATOM 0 HG3 LYS A 123 1.234 9.664 4.538 1.00 0.48 H new ATOM 0 HD2 LYS A 123 3.877 8.777 5.759 1.00 1.00 H new ATOM 0 HD3 LYS A 123 3.670 9.865 4.401 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.524 10.457 7.152 1.00 1.05 H new ATOM 0 HE3 LYS A 123 4.146 10.932 6.689 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 2.580 12.727 6.362 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 3.215 12.234 4.867 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 1.643 11.774 5.315 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.140 10.921 6.191 1.00 0.43 N ATOM 1772 CA LYS A 124 -1.628 12.147 6.788 1.00 0.50 C ATOM 1773 C LYS A 124 -3.075 11.967 7.229 1.00 0.49 C ATOM 1774 O LYS A 124 -3.541 12.626 8.159 1.00 0.57 O ATOM 1775 CB LYS A 124 -1.475 13.361 5.860 1.00 0.56 C ATOM 1776 CG LYS A 124 -2.666 13.639 4.960 1.00 0.59 C ATOM 1777 CD LYS A 124 -2.402 14.837 4.064 1.00 0.97 C ATOM 1778 CE LYS A 124 -3.631 15.213 3.257 1.00 1.41 C ATOM 1779 NZ LYS A 124 -4.718 15.750 4.118 1.00 1.99 N ATOM 0 H LYS A 124 -1.058 10.932 5.174 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.011 12.356 7.662 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.287 14.244 6.471 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -0.594 13.212 5.235 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -2.877 12.762 4.348 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.551 13.823 5.569 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -2.092 15.686 4.673 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -1.577 14.612 3.388 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -3.360 15.957 2.508 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -3.994 14.337 2.719 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -5.436 16.210 3.523 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -5.156 14.971 4.650 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -4.323 16.445 4.784 1.00 1.99 H new ATOM 1793 N THR A 125 -3.776 11.060 6.558 1.00 0.42 N ATOM 1794 CA THR A 125 -5.156 10.752 6.906 1.00 0.44 C ATOM 1795 C THR A 125 -5.239 9.981 8.221 1.00 0.44 C ATOM 1796 O THR A 125 -5.886 10.427 9.170 1.00 0.56 O ATOM 1797 CB THR A 125 -5.871 9.951 5.797 1.00 0.49 C ATOM 1798 OG1 THR A 125 -6.001 10.758 4.621 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.251 9.491 6.247 1.00 0.59 C ATOM 0 H THR A 125 -3.410 10.526 5.770 1.00 0.42 H new ATOM 0 HA THR A 125 -5.663 11.710 7.019 1.00 0.44 H new ATOM 0 HB THR A 125 -5.268 9.070 5.579 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.113 11.041 4.319 1.00 0.57 H new ATOM 0 HG21 THR A 125 -7.728 8.930 5.443 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.153 8.854 7.126 1.00 0.59 H new ATOM 0 HG23 THR A 125 -7.861 10.360 6.495 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.576 8.832 8.291 1.00 0.44 N ATOM 1808 CA LYS A 126 -4.712 7.981 9.459 1.00 0.54 C ATOM 1809 C LYS A 126 -3.424 7.232 9.782 1.00 0.57 C ATOM 1810 O LYS A 126 -2.808 6.614 8.908 1.00 0.68 O ATOM 1811 CB LYS A 126 -5.852 6.988 9.240 1.00 0.78 C ATOM 1812 CG LYS A 126 -6.373 6.372 10.526 1.00 1.26 C ATOM 1813 CD LYS A 126 -7.486 5.382 10.252 1.00 0.92 C ATOM 1814 CE LYS A 126 -8.155 4.916 11.534 1.00 1.27 C ATOM 1815 NZ LYS A 126 -8.907 6.013 12.199 1.00 1.85 N ATOM 0 H LYS A 126 -3.952 8.477 7.567 1.00 0.44 H new ATOM 0 HA LYS A 126 -4.935 8.623 10.311 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -6.672 7.495 8.731 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -5.509 6.193 8.578 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -5.558 5.870 11.048 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -6.738 7.159 11.187 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -8.229 5.842 9.601 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -7.083 4.521 9.718 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -8.835 4.094 11.310 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -7.399 4.528 12.217 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -9.559 5.610 12.902 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -8.239 6.654 12.673 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -9.449 6.543 11.487 1.00 1.85 H new ATOM 1985 N TRP A 137 6.931 0.677 8.898 1.00 0.69 N ATOM 1986 CA TRP A 137 7.286 -0.703 8.612 1.00 0.45 C ATOM 1987 C TRP A 137 7.357 -0.989 7.116 1.00 0.43 C ATOM 1988 O TRP A 137 7.118 -0.118 6.284 1.00 0.55 O ATOM 1989 CB TRP A 137 6.267 -1.660 9.224 1.00 0.42 C ATOM 1990 CG TRP A 137 6.441 -1.959 10.678 1.00 0.62 C ATOM 1991 CD1 TRP A 137 7.016 -3.069 11.226 1.00 0.93 C ATOM 1992 CD2 TRP A 137 5.995 -1.156 11.772 1.00 1.00 C ATOM 1993 NE1 TRP A 137 6.975 -2.989 12.595 1.00 1.11 N ATOM 1994 CE2 TRP A 137 6.353 -1.823 12.952 1.00 1.16 C ATOM 1995 CE3 TRP A 137 5.340 0.070 11.867 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 6.074 -1.309 14.210 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 5.060 0.581 13.117 1.00 1.97 C ATOM 1998 CH2 TRP A 137 5.430 -0.107 14.277 1.00 1.97 C ATOM 0 HA TRP A 137 8.273 -0.857 9.049 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.271 -1.242 9.076 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.304 -2.600 8.673 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.440 -3.889 10.665 1.00 0.93 H new ATOM 0 HE1 TRP A 137 7.347 -3.685 13.241 1.00 1.11 H new ATOM 0 HE3 TRP A 137 5.056 0.611 10.977 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 6.357 -1.842 15.106 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 4.547 1.528 13.201 1.00 1.97 H new ATOM 0 HH2 TRP A 137 5.202 0.320 15.243 1.00 1.97 H new ATOM 2009 N ASN A 138 7.792 -2.212 6.829 1.00 0.37 N ATOM 2010 CA ASN A 138 7.541 -2.948 5.573 1.00 0.38 C ATOM 2011 C ASN A 138 6.095 -2.733 5.050 1.00 0.31 C ATOM 2012 O ASN A 138 5.480 -1.728 5.339 1.00 0.30 O ATOM 2013 CB ASN A 138 7.831 -4.433 5.833 1.00 0.41 C ATOM 2014 CG ASN A 138 8.006 -5.260 4.571 1.00 1.06 C ATOM 2015 OD1 ASN A 138 7.076 -5.918 4.117 1.00 2.04 O ATOM 2016 ND2 ASN A 138 9.194 -5.223 3.997 1.00 1.40 N ATOM 0 H ASN A 138 8.355 -2.750 7.488 1.00 0.37 H new ATOM 0 HA ASN A 138 8.198 -2.569 4.790 1.00 0.38 H new ATOM 0 HB2 ASN A 138 8.735 -4.516 6.437 1.00 0.41 H new ATOM 0 HB3 ASN A 138 7.015 -4.854 6.421 1.00 0.41 H new ATOM 0 HD21 ASN A 138 9.365 -5.755 3.143 1.00 1.40 H new ATOM 0 HD22 ASN A 138 9.941 -4.663 4.407 1.00 1.40 H new ATOM 2023 N PHE A 139 5.579 -3.687 4.268 1.00 0.34 N ATOM 2024 CA PHE A 139 4.356 -3.544 3.445 1.00 0.36 C ATOM 2025 C PHE A 139 3.311 -2.540 3.971 1.00 0.32 C ATOM 2026 O PHE A 139 2.791 -1.793 3.163 1.00 0.57 O ATOM 2027 CB PHE A 139 3.700 -4.915 3.374 1.00 0.55 C ATOM 2028 CG PHE A 139 3.985 -5.696 2.126 1.00 0.55 C ATOM 2029 CD1 PHE A 139 5.298 -5.875 1.735 1.00 0.61 C ATOM 2030 CD2 PHE A 139 2.967 -6.222 1.325 1.00 1.23 C ATOM 2031 CE1 PHE A 139 5.606 -6.566 0.586 1.00 1.22 C ATOM 2032 CE2 PHE A 139 3.276 -6.910 0.168 1.00 1.93 C ATOM 2033 CZ PHE A 139 4.427 -7.198 -0.166 1.00 1.89 C ATOM 0 H PHE A 139 6.007 -4.609 4.182 1.00 0.34 H new ATOM 0 HA PHE A 139 4.677 -3.151 2.480 1.00 0.36 H new ATOM 0 HB2 PHE A 139 4.027 -5.501 4.233 1.00 0.55 H new ATOM 0 HB3 PHE A 139 2.621 -4.789 3.466 1.00 0.55 H new ATOM 0 HD1 PHE A 139 6.094 -5.467 2.340 1.00 0.61 H new ATOM 0 HD2 PHE A 139 1.934 -6.090 1.612 1.00 1.23 H new ATOM 0 HE1 PHE A 139 6.622 -6.659 0.232 1.00 1.22 H new ATOM 0 HE2 PHE A 139 2.466 -7.212 -0.479 1.00 1.93 H new ATOM 0 HZ PHE A 139 4.604 -7.887 -0.979 1.00 1.89 H new ATOM 2043 N THR A 140 2.991 -2.545 5.278 1.00 0.25 N ATOM 2044 CA THR A 140 2.153 -1.513 5.909 1.00 0.25 C ATOM 2045 C THR A 140 1.065 -0.963 4.997 1.00 0.22 C ATOM 2046 O THR A 140 1.275 -0.040 4.207 1.00 0.29 O ATOM 2047 CB THR A 140 3.001 -0.351 6.454 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.042 -0.866 7.287 1.00 0.48 O ATOM 2049 CG2 THR A 140 2.150 0.618 7.258 1.00 0.60 C ATOM 0 H THR A 140 3.307 -3.266 5.926 1.00 0.25 H new ATOM 0 HA THR A 140 1.655 -2.022 6.734 1.00 0.25 H new ATOM 0 HB THR A 140 3.429 0.184 5.606 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.700 -1.337 6.735 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.776 1.429 7.631 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.366 1.028 6.622 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.697 0.093 8.099 1.00 0.60 H new ATOM 2057 N SER A 141 -0.107 -1.507 5.164 1.00 0.19 N ATOM 2058 CA SER A 141 -1.213 -1.231 4.269 1.00 0.20 C ATOM 2059 C SER A 141 -1.977 0.006 4.682 1.00 0.22 C ATOM 2060 O SER A 141 -1.744 0.545 5.747 1.00 0.39 O ATOM 2061 CB SER A 141 -2.160 -2.398 4.301 1.00 0.26 C ATOM 2062 OG SER A 141 -1.461 -3.621 4.219 1.00 0.62 O ATOM 0 H SER A 141 -0.330 -2.154 5.920 1.00 0.19 H new ATOM 0 HA SER A 141 -0.806 -1.069 3.271 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.745 -2.371 5.220 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.864 -2.322 3.473 1.00 0.26 H new ATOM 0 HG SER A 141 -1.638 -4.041 3.352 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.884 0.449 3.830 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.921 1.370 4.221 1.00 0.18 C ATOM 2070 C PHE A 142 -5.189 0.828 3.658 1.00 0.18 C ATOM 2071 O PHE A 142 -5.290 0.617 2.462 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.691 2.777 3.677 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.536 3.517 4.289 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -2.705 4.267 5.440 1.00 0.35 C ATOM 2075 CD2 PHE A 142 -1.270 3.427 3.731 1.00 0.42 C ATOM 2076 CE1 PHE A 142 -1.634 4.917 6.019 1.00 0.50 C ATOM 2077 CE2 PHE A 142 -0.199 4.082 4.305 1.00 0.55 C ATOM 2078 CZ PHE A 142 -0.423 4.941 5.388 1.00 0.57 C ATOM 0 H PHE A 142 -2.917 0.176 2.848 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.942 1.457 5.307 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.531 2.712 2.601 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.598 3.361 3.830 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -3.684 4.344 5.889 1.00 0.35 H new ATOM 0 HD2 PHE A 142 -1.120 2.838 2.838 1.00 0.42 H new ATOM 0 HE1 PHE A 142 -1.754 5.408 6.973 1.00 0.50 H new ATOM 0 HE2 PHE A 142 0.800 3.934 3.923 1.00 0.55 H new ATOM 0 HZ PHE A 142 0.353 5.615 5.720 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.153 0.565 4.486 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.378 0.076 3.954 1.00 0.16 C ATOM 2090 C LEU A 143 -8.150 1.234 3.415 1.00 0.15 C ATOM 2091 O LEU A 143 -8.697 2.055 4.144 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.172 -0.708 4.972 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.679 -0.746 4.722 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -10.020 -1.556 3.480 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.408 -1.292 5.931 1.00 0.43 C ATOM 0 H LEU A 143 -6.116 0.677 5.499 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.165 -0.628 3.149 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.796 -1.731 4.995 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.993 -0.281 5.959 1.00 0.21 H new ATOM 0 HG LEU A 143 -10.010 0.278 4.550 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -11.100 -1.561 3.334 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.538 -1.109 2.610 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.666 -2.579 3.605 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.480 -1.311 5.732 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -10.060 -2.304 6.139 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.210 -0.655 6.793 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.125 1.293 2.121 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.753 2.327 1.377 1.00 0.14 C ATOM 2109 C ILE A 144 -10.166 1.890 1.086 1.00 0.15 C ATOM 2110 O ILE A 144 -10.398 0.723 0.796 1.00 0.19 O ATOM 2111 CB ILE A 144 -7.994 2.543 0.069 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.519 2.834 0.320 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.637 3.649 -0.719 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.269 4.042 1.168 1.00 0.19 C ATOM 0 H ILE A 144 -7.652 0.600 1.540 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.755 3.262 1.937 1.00 0.14 H new ATOM 0 HB ILE A 144 -8.044 1.623 -0.513 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -6.065 1.967 0.800 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -6.018 2.967 -0.639 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -8.090 3.797 -1.650 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.670 3.383 -0.943 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.618 4.570 -0.136 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.196 4.179 1.299 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.690 4.922 0.681 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.739 3.906 2.142 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.109 2.798 1.165 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.513 2.389 1.104 1.00 0.15 C ATOM 2128 C ASP A 145 -13.047 2.421 -0.328 1.00 0.14 C ATOM 2129 O ASP A 145 -12.287 2.634 -1.267 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.373 3.232 2.059 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.260 4.249 1.363 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -13.717 5.238 0.827 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.494 4.091 1.375 1.00 0.75 O ATOM 0 H ASP A 145 -10.949 3.800 1.269 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.574 1.353 1.438 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -13.999 2.565 2.651 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.717 3.755 2.755 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.346 2.182 -0.487 1.00 0.17 N ATOM 2139 CA ARG A 146 -14.973 2.103 -1.803 1.00 0.17 C ATOM 2140 C ARG A 146 -14.735 3.372 -2.614 1.00 0.18 C ATOM 2141 O ARG A 146 -14.495 3.311 -3.816 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.475 1.871 -1.655 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.816 0.780 -0.662 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.309 0.552 -0.565 1.00 0.29 C ATOM 2145 NE ARG A 146 -18.648 -0.145 0.670 1.00 1.00 N ATOM 2146 CZ ARG A 146 -19.311 0.423 1.676 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -19.811 1.644 1.531 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -19.495 -0.239 2.813 1.00 2.22 N ATOM 0 H ARG A 146 -14.991 2.038 0.290 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.520 1.266 -2.334 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -16.950 2.800 -1.341 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.893 1.612 -2.628 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.326 -0.147 -0.959 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.425 1.047 0.320 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.831 1.508 -0.603 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.649 -0.030 -1.421 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.362 -1.119 0.769 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -19.687 2.145 0.651 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -20.319 2.082 2.300 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -19.128 -1.185 2.917 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -20.003 0.199 3.582 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.771 4.522 -1.956 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.589 5.781 -2.657 1.00 0.21 C ATOM 2164 C ASP A 147 -13.163 6.240 -2.434 1.00 0.18 C ATOM 2165 O ASP A 147 -12.828 7.408 -2.578 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.589 6.840 -2.172 1.00 0.28 C ATOM 2167 CG ASP A 147 -15.714 8.013 -3.133 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -16.489 7.909 -4.110 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -15.057 9.051 -2.914 1.00 2.00 O ATOM 0 H ASP A 147 -14.923 4.608 -0.951 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.775 5.639 -3.722 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -16.567 6.377 -2.041 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.277 7.208 -1.195 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.322 5.280 -2.090 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.922 5.536 -1.905 1.00 0.16 C ATOM 2176 C GLY A 148 -10.573 6.376 -0.694 1.00 0.15 C ATOM 2177 O GLY A 148 -9.657 7.184 -0.767 1.00 0.17 O ATOM 0 H GLY A 148 -12.597 4.310 -1.934 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.402 4.581 -1.827 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.540 6.035 -2.795 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.254 6.215 0.427 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.789 6.896 1.622 1.00 0.18 C ATOM 2183 C VAL A 149 -10.149 5.903 2.601 1.00 0.17 C ATOM 2184 O VAL A 149 -10.753 4.907 2.988 1.00 0.24 O ATOM 2185 CB VAL A 149 -11.882 7.762 2.308 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -12.866 6.940 3.115 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -11.241 8.826 3.182 1.00 1.12 C ATOM 0 H VAL A 149 -12.093 5.646 0.536 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.024 7.601 1.298 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.451 8.240 1.510 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -13.605 7.600 3.570 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -13.369 6.229 2.460 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -12.333 6.399 3.897 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -12.019 9.425 3.656 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -10.633 8.348 3.950 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -10.611 9.470 2.568 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.875 6.145 2.950 1.00 0.21 N ATOM 2198 CA PRO A 150 -8.121 5.298 3.882 1.00 0.20 C ATOM 2199 C PRO A 150 -8.725 5.334 5.283 1.00 0.23 C ATOM 2200 O PRO A 150 -8.873 6.405 5.876 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.722 5.914 3.909 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.845 7.266 3.292 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.088 7.276 2.455 1.00 0.41 C ATOM 0 HA PRO A 150 -8.127 4.254 3.569 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.349 5.986 4.931 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -6.015 5.297 3.354 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -6.898 8.035 4.063 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -5.971 7.488 2.680 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.631 8.215 2.563 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -7.854 7.163 1.396 1.00 0.41 H new ATOM 2211 N VAL A 151 -9.062 4.173 5.813 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.690 4.087 7.118 1.00 0.29 C ATOM 2213 C VAL A 151 -8.890 3.174 8.034 1.00 0.32 C ATOM 2214 O VAL A 151 -9.153 3.098 9.228 1.00 0.61 O ATOM 2215 CB VAL A 151 -11.149 3.585 7.028 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -12.029 4.607 6.326 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.220 2.246 6.311 1.00 1.13 C ATOM 0 H VAL A 151 -8.910 3.273 5.358 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.707 5.095 7.532 1.00 0.29 H new ATOM 0 HB VAL A 151 -11.519 3.450 8.044 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -13.051 4.232 6.274 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -12.014 5.544 6.883 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -11.654 4.778 5.317 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.257 1.915 6.261 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -10.824 2.353 5.301 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -10.630 1.510 6.856 1.00 1.13 H new ATOM 2227 N GLU A 152 -7.913 2.480 7.463 1.00 0.19 N ATOM 2228 CA GLU A 152 -7.012 1.637 8.250 1.00 0.20 C ATOM 2229 C GLU A 152 -5.603 1.696 7.702 1.00 0.20 C ATOM 2230 O GLU A 152 -5.367 2.191 6.606 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.427 0.163 8.254 1.00 0.21 C ATOM 2232 CG GLU A 152 -8.864 -0.085 8.640 1.00 0.57 C ATOM 2233 CD GLU A 152 -9.086 -0.070 10.138 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -8.397 -0.822 10.855 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -9.938 0.708 10.606 1.00 1.17 O ATOM 0 H GLU A 152 -7.722 2.482 6.461 1.00 0.19 H new ATOM 0 HA GLU A 152 -7.062 2.030 9.265 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.255 -0.252 7.261 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -6.781 -0.381 8.943 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.495 0.674 8.177 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.180 -1.049 8.241 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.686 1.209 8.503 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.337 0.904 8.069 1.00 0.24 C ATOM 2244 C ARG A 153 -2.820 -0.275 8.869 1.00 0.25 C ATOM 2245 O ARG A 153 -2.996 -0.336 10.087 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.428 2.126 8.186 1.00 0.36 C ATOM 2247 CG ARG A 153 -0.926 1.841 8.162 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.188 2.708 9.170 1.00 0.47 C ATOM 2249 NE ARG A 153 -0.357 4.146 8.913 1.00 0.65 N ATOM 2250 CZ ARG A 153 0.303 5.097 9.573 1.00 1.51 C ATOM 2251 NH1 ARG A 153 1.159 4.770 10.531 1.00 2.16 N ATOM 2252 NH2 ARG A 153 0.095 6.376 9.287 1.00 1.85 N ATOM 0 H ARG A 153 -4.855 1.009 9.489 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.343 0.632 7.013 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.662 2.809 7.370 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.666 2.645 9.115 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -0.749 0.789 8.384 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.534 2.026 7.162 1.00 0.40 H new ATOM 0 HD2 ARG A 153 -0.547 2.478 10.173 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.873 2.461 9.147 1.00 0.47 H new ATOM 0 HE ARG A 153 -1.016 4.431 8.189 1.00 0.65 H new ATOM 0 HH11 ARG A 153 1.313 3.789 10.764 1.00 2.16 H new ATOM 0 HH12 ARG A 153 1.663 5.499 11.035 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -0.572 6.634 8.560 1.00 1.85 H new ATOM 0 HH22 ARG A 153 0.602 7.101 9.794 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.191 -1.205 8.180 1.00 0.24 N ATOM 2267 CA PHE A 154 -1.845 -2.484 8.764 1.00 0.22 C ATOM 2268 C PHE A 154 -0.340 -2.631 8.776 1.00 0.24 C ATOM 2269 O PHE A 154 0.340 -1.999 7.979 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.469 -3.620 7.945 1.00 0.22 C ATOM 2271 CG PHE A 154 -3.973 -3.620 7.929 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.672 -2.908 6.965 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -4.690 -4.316 8.891 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.055 -2.892 6.961 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.072 -4.300 8.892 1.00 0.22 C ATOM 2276 CZ PHE A 154 -6.754 -3.653 7.871 1.00 0.22 C ATOM 0 H PHE A 154 -1.907 -1.097 7.206 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.228 -2.534 9.783 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.107 -3.554 6.919 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.122 -4.573 8.345 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.130 -2.360 6.209 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.162 -4.877 9.648 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.586 -2.283 6.245 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.619 -4.789 9.684 1.00 0.22 H new ATOM 0 HZ PHE A 154 -7.827 -3.746 7.791 1.00 0.22 H new ATOM 2286 N SER A 155 0.184 -3.436 9.676 1.00 0.22 N ATOM 2287 CA SER A 155 1.609 -3.701 9.699 1.00 0.25 C ATOM 2288 C SER A 155 1.940 -4.804 8.690 1.00 0.22 C ATOM 2289 O SER A 155 1.044 -5.509 8.243 1.00 0.26 O ATOM 2290 CB SER A 155 2.036 -4.106 11.113 1.00 0.35 C ATOM 2291 OG SER A 155 1.645 -3.122 12.060 1.00 1.11 O ATOM 0 H SER A 155 -0.352 -3.917 10.399 1.00 0.22 H new ATOM 0 HA SER A 155 2.157 -2.801 9.420 1.00 0.25 H new ATOM 0 HB2 SER A 155 1.588 -5.065 11.372 1.00 0.35 H new ATOM 0 HB3 SER A 155 3.117 -4.240 11.147 1.00 0.35 H new ATOM 0 HG SER A 155 1.926 -3.401 12.957 1.00 1.11 H new ATOM 2297 N PRO A 156 3.212 -4.967 8.300 1.00 0.25 N ATOM 2298 CA PRO A 156 3.627 -6.068 7.421 1.00 0.29 C ATOM 2299 C PRO A 156 3.330 -7.412 8.067 1.00 0.39 C ATOM 2300 O PRO A 156 3.075 -8.406 7.393 1.00 0.78 O ATOM 2301 CB PRO A 156 5.137 -5.864 7.272 1.00 0.34 C ATOM 2302 CG PRO A 156 5.523 -4.993 8.419 1.00 0.36 C ATOM 2303 CD PRO A 156 4.338 -4.110 8.673 1.00 0.33 C ATOM 0 HA PRO A 156 3.102 -6.067 6.466 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.669 -6.815 7.302 1.00 0.34 H new ATOM 0 HB3 PRO A 156 5.380 -5.393 6.319 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.764 -5.589 9.300 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.408 -4.402 8.182 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.281 -3.798 9.716 1.00 0.33 H new ATOM 0 HD3 PRO A 156 4.373 -3.202 8.071 1.00 0.33 H new ATOM 2311 N GLY A 157 3.400 -7.410 9.387 1.00 0.36 N ATOM 2312 CA GLY A 157 3.028 -8.559 10.177 1.00 0.46 C ATOM 2313 C GLY A 157 1.534 -8.841 10.146 1.00 0.41 C ATOM 2314 O GLY A 157 1.106 -9.941 10.498 1.00 0.50 O ATOM 0 H GLY A 157 3.716 -6.611 9.936 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.565 -9.434 9.811 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.341 -8.401 11.209 1.00 0.46 H new ATOM 2318 N ALA A 158 0.732 -7.864 9.718 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.699 -8.083 9.590 1.00 0.31 C ATOM 2320 C ALA A 158 -0.953 -8.890 8.334 1.00 0.34 C ATOM 2321 O ALA A 158 -0.341 -8.642 7.297 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.458 -6.766 9.556 1.00 0.37 C ATOM 0 H ALA A 158 1.048 -6.929 9.459 1.00 0.34 H new ATOM 0 HA ALA A 158 -1.060 -8.633 10.459 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.526 -6.964 9.460 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.273 -6.215 10.478 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.121 -6.173 8.706 1.00 0.37 H new ATOM 2328 N SER A 159 -1.838 -9.860 8.420 1.00 0.26 N ATOM 2329 CA SER A 159 -1.995 -10.800 7.346 1.00 0.30 C ATOM 2330 C SER A 159 -3.384 -10.695 6.738 1.00 0.23 C ATOM 2331 O SER A 159 -4.178 -9.832 7.126 1.00 0.22 O ATOM 2332 CB SER A 159 -1.723 -12.208 7.870 1.00 0.41 C ATOM 2333 OG SER A 159 -0.540 -12.231 8.655 1.00 1.42 O ATOM 0 H SER A 159 -2.453 -10.013 9.219 1.00 0.26 H new ATOM 0 HA SER A 159 -1.279 -10.573 6.556 1.00 0.30 H new ATOM 0 HB2 SER A 159 -2.569 -12.549 8.467 1.00 0.41 H new ATOM 0 HB3 SER A 159 -1.624 -12.900 7.034 1.00 0.41 H new ATOM 0 HG SER A 159 -0.383 -13.141 8.983 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.647 -11.568 5.775 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.911 -11.611 5.046 1.00 0.20 C ATOM 2341 C VAL A 160 -6.111 -11.429 5.978 1.00 0.21 C ATOM 2342 O VAL A 160 -6.960 -10.579 5.745 1.00 0.20 O ATOM 2343 CB VAL A 160 -5.047 -12.969 4.339 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.326 -13.048 3.522 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.843 -13.247 3.462 1.00 0.26 C ATOM 0 H VAL A 160 -2.979 -12.277 5.473 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.903 -10.794 4.325 1.00 0.20 H new ATOM 0 HB VAL A 160 -5.096 -13.734 5.114 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.388 -14.022 3.037 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.186 -12.914 4.178 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.323 -12.265 2.764 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -3.964 -14.214 2.973 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.756 -12.467 2.706 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.942 -13.261 4.075 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.142 -12.206 7.056 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.281 -12.224 7.967 1.00 0.31 C ATOM 2357 C LYS A 161 -7.394 -10.907 8.731 1.00 0.26 C ATOM 2358 O LYS A 161 -8.496 -10.420 9.001 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.130 -13.388 8.946 1.00 0.45 C ATOM 2360 CG LYS A 161 -8.250 -13.511 9.962 1.00 1.12 C ATOM 2361 CD LYS A 161 -7.913 -14.561 11.001 1.00 1.80 C ATOM 2362 CE LYS A 161 -8.993 -14.687 12.060 1.00 2.67 C ATOM 2363 NZ LYS A 161 -8.569 -15.590 13.162 1.00 3.46 N ATOM 0 H LYS A 161 -5.385 -12.836 7.321 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.192 -12.352 7.383 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -7.069 -14.317 8.379 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -6.185 -13.277 9.478 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -8.414 -12.550 10.449 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -9.179 -13.776 9.457 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -7.774 -15.524 10.510 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -6.967 -14.307 11.478 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -9.225 -13.702 12.464 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -9.907 -15.069 11.606 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -9.329 -15.655 13.869 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -8.371 -16.536 12.779 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -7.710 -15.211 13.610 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.247 -10.324 9.050 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.196 -9.095 9.827 1.00 0.27 C ATOM 2379 C ASP A 162 -6.717 -7.942 8.995 1.00 0.22 C ATOM 2380 O ASP A 162 -7.359 -7.022 9.498 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.760 -8.799 10.260 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.194 -9.855 11.180 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -4.437 -9.779 12.403 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.509 -10.774 10.682 1.00 1.40 O ATOM 0 H ASP A 162 -5.333 -10.687 8.780 1.00 0.26 H new ATOM 0 HA ASP A 162 -6.817 -9.217 10.714 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.128 -8.719 9.375 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.729 -7.832 10.762 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.432 -8.014 7.712 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.855 -6.998 6.776 1.00 0.15 C ATOM 2391 C ILE A 163 -8.302 -7.199 6.357 1.00 0.14 C ATOM 2392 O ILE A 163 -9.095 -6.257 6.400 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.953 -6.995 5.530 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.590 -6.366 5.854 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.636 -6.260 4.386 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.565 -6.556 4.761 1.00 0.21 C ATOM 0 H ILE A 163 -5.902 -8.777 7.291 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.771 -6.036 7.281 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.782 -8.025 5.219 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.724 -5.299 6.034 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.209 -6.800 6.778 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.986 -6.266 3.511 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.576 -6.757 4.144 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.836 -5.230 4.683 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.627 -6.087 5.057 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.402 -7.621 4.596 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.926 -6.097 3.840 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.646 -8.425 5.966 1.00 0.13 N ATOM 2409 CA GLU A 164 -9.986 -8.720 5.475 1.00 0.13 C ATOM 2410 C GLU A 164 -11.043 -8.246 6.455 1.00 0.15 C ATOM 2411 O GLU A 164 -12.049 -7.688 6.061 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.217 -10.215 5.273 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.522 -10.841 4.088 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.963 -12.277 3.892 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -10.991 -12.511 3.224 1.00 0.60 O ATOM 2416 OE2 GLU A 164 -9.260 -13.185 4.373 1.00 0.67 O ATOM 0 H GLU A 164 -8.015 -9.227 5.980 1.00 0.13 H new ATOM 0 HA GLU A 164 -10.066 -8.199 4.521 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -9.895 -10.737 6.174 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.289 -10.386 5.172 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.740 -10.265 3.189 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.443 -10.806 4.235 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.808 -8.483 7.733 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.794 -8.169 8.762 1.00 0.21 C ATOM 2425 C GLU A 165 -12.197 -6.694 8.722 1.00 0.21 C ATOM 2426 O GLU A 165 -13.297 -6.333 9.137 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.259 -8.537 10.153 1.00 0.27 C ATOM 2428 CG GLU A 165 -10.253 -7.547 10.721 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.826 -7.895 12.134 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -10.693 -7.960 13.031 1.00 0.87 O ATOM 2431 OE2 GLU A 165 -8.614 -8.099 12.356 1.00 0.83 O ATOM 0 H GLU A 165 -9.944 -8.892 8.088 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.684 -8.765 8.558 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.099 -8.618 10.842 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -10.793 -9.521 10.101 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.374 -7.518 10.077 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -10.688 -6.548 10.713 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.307 -5.857 8.215 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.592 -4.444 8.056 1.00 0.20 C ATOM 2440 C LYS A 166 -12.047 -4.165 6.628 1.00 0.19 C ATOM 2441 O LYS A 166 -12.867 -3.283 6.372 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.348 -3.622 8.385 1.00 0.25 C ATOM 2443 CG LYS A 166 -9.861 -3.796 9.813 1.00 0.38 C ATOM 2444 CD LYS A 166 -10.823 -3.173 10.809 1.00 0.58 C ATOM 2445 CE LYS A 166 -10.332 -3.334 12.238 1.00 1.09 C ATOM 2446 NZ LYS A 166 -8.907 -2.928 12.381 1.00 1.71 N ATOM 0 H LYS A 166 -10.376 -6.136 7.905 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.391 -4.160 8.741 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.547 -3.902 7.701 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.563 -2.568 8.210 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.745 -4.857 10.032 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -8.877 -3.339 9.921 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -10.946 -2.114 10.583 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -11.804 -3.637 10.707 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -10.950 -2.733 12.905 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -10.447 -4.373 12.547 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -8.707 -2.709 13.378 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -8.291 -3.705 12.067 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -8.726 -2.086 11.798 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.515 -4.965 5.722 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.725 -4.821 4.293 1.00 0.15 C ATOM 2462 C LEU A 167 -13.114 -5.290 3.865 1.00 0.15 C ATOM 2463 O LEU A 167 -13.824 -4.597 3.136 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.668 -5.654 3.573 1.00 0.13 C ATOM 2465 CG LEU A 167 -10.969 -5.954 2.116 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.801 -4.703 1.278 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.082 -7.079 1.612 1.00 0.16 C ATOM 0 H LEU A 167 -10.911 -5.751 5.965 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.645 -3.765 4.035 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.714 -5.131 3.631 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.547 -6.598 4.105 1.00 0.13 H new ATOM 0 HG LEU A 167 -12.005 -6.282 2.029 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -11.020 -4.932 0.235 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.486 -3.933 1.632 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.776 -4.343 1.363 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.311 -7.282 0.566 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.036 -6.787 1.705 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.262 -7.977 2.203 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.481 -6.477 4.327 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.699 -7.152 3.905 1.00 0.19 C ATOM 2481 C ILE A 168 -15.954 -6.301 4.132 1.00 0.22 C ATOM 2482 O ILE A 168 -16.780 -6.192 3.231 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.840 -8.525 4.597 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.655 -9.423 4.210 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.161 -9.189 4.227 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.676 -10.782 4.875 1.00 0.24 C ATOM 0 H ILE A 168 -12.937 -7.003 5.011 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.611 -7.309 2.830 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.835 -8.375 5.677 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.652 -9.558 3.128 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.726 -8.916 4.471 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.236 -10.154 4.727 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -16.989 -8.553 4.541 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.205 -9.335 3.148 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.809 -11.358 4.553 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.647 -10.658 5.958 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.587 -11.310 4.594 1.00 0.24 H new ATOM 2498 N PRO A 169 -16.128 -5.675 5.321 1.00 0.24 N ATOM 2499 CA PRO A 169 -17.241 -4.744 5.562 1.00 0.29 C ATOM 2500 C PRO A 169 -17.337 -3.648 4.497 1.00 0.29 C ATOM 2501 O PRO A 169 -18.414 -3.103 4.244 1.00 0.41 O ATOM 2502 CB PRO A 169 -16.907 -4.135 6.921 1.00 0.34 C ATOM 2503 CG PRO A 169 -16.099 -5.174 7.610 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.298 -5.853 6.533 1.00 0.24 C ATOM 0 HA PRO A 169 -18.205 -5.253 5.529 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -16.348 -3.206 6.812 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.811 -3.899 7.482 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.446 -4.728 8.360 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -16.740 -5.887 8.129 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.315 -5.397 6.417 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -15.136 -6.907 6.757 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.213 -3.329 3.864 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.200 -2.330 2.811 1.00 0.22 C ATOM 2514 C LEU A 170 -16.452 -2.960 1.448 1.00 0.20 C ATOM 2515 O LEU A 170 -17.257 -2.443 0.676 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.891 -1.538 2.801 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.665 -0.603 3.983 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.275 0.008 3.894 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.728 0.485 4.005 1.00 0.69 C ATOM 0 H LEU A 170 -15.305 -3.748 4.063 1.00 0.22 H new ATOM 0 HA LEU A 170 -17.012 -1.634 3.021 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -14.062 -2.245 2.759 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.853 -0.948 1.885 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.741 -1.172 4.910 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -13.116 0.676 4.741 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.527 -0.785 3.912 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.184 0.571 2.965 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.555 1.146 4.854 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.678 1.061 3.081 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.714 0.029 4.096 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.767 -4.059 1.144 1.00 0.18 N ATOM 2532 CA LEU A 171 -15.999 -4.768 -0.120 1.00 0.20 C ATOM 2533 C LEU A 171 -17.438 -5.208 -0.204 1.00 0.27 C ATOM 2534 O LEU A 171 -18.167 -4.887 -1.143 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.135 -6.020 -0.225 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.645 -5.779 -0.323 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -12.904 -7.097 -0.346 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.317 -4.968 -1.565 1.00 0.31 C ATOM 0 H LEU A 171 -15.055 -4.477 1.743 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.747 -4.079 -0.926 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.327 -6.646 0.646 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.452 -6.586 -1.101 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.327 -5.213 0.552 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -11.832 -6.911 -0.417 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.117 -7.650 0.569 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.228 -7.682 -1.207 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.241 -4.804 -1.619 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.646 -5.510 -2.451 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.828 -4.007 -1.517 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.816 -5.946 0.813 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.108 -6.557 0.874 1.00 0.39 C ATOM 2552 C GLY A 172 -20.221 -5.582 1.180 1.00 0.66 C ATOM 2553 O GLY A 172 -21.273 -5.626 0.550 1.00 1.12 O ATOM 0 H GLY A 172 -17.226 -6.136 1.623 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.315 -7.046 -0.078 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.098 -7.336 1.637 1.00 0.39 H new