USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=33 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 42 ASN : amide:sc= -1.64! C(o=-3.4!,f=-5.6!) USER MOD Set 1.2: A 140 THR OG1 : rot 72:sc= -1.72! USER MOD Set 2.1: A 28 TYR OH : rot -109:sc= 1.24 USER MOD Set 2.2: A 33 HIS : no HE2:sc= -5.43! C(o=-6.3!,f=-17!) USER MOD Set 2.3: A 70 THR OG1 : rot 52:sc= -2.11! USER MOD Single : A 13 SER OG : rot -34:sc= 0.17 USER MOD Single : A 14 SER OG : rot -160:sc= -0.362 USER MOD Single : A 25 HIS : no HD1:sc= -2.75! C(o=-2.8!,f=-4!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN :FLIP amide:sc= -0.606 F(o=-1.4,f=-0.61) USER MOD Single : A 32 GLN : amide:sc= -0.372 K(o=-0.37,f=-1) USER MOD Single : A 34 LYS NZ :NH3+ -170:sc= -2.44! (180deg=-3.33!) USER MOD Single : A 36 SER OG : rot 141:sc= 0.49 USER MOD Single : A 41 TYR OH : rot 11:sc= -0.537 USER MOD Single : A 54 TYR OH : rot 180:sc= -0.413 USER MOD Single : A 56 THR OG1 : rot 170:sc= -0.68! USER MOD Single : A 58 THR OG1 : rot 81:sc= 0.724 USER MOD Single : A 59 THR OG1 : rot 89:sc= 1.29 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -0.768 X(o=-0.77,f=-0.54) USER MOD Single : A 63 LYS NZ :NH3+ 171:sc= 0.234 (180deg=0.109) USER MOD Single : A 64 TYR OH : rot -143:sc= 0.944 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0.0679 USER MOD Single : A 67 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 76 SER OG : rot -70:sc= 0.745 USER MOD Single : A 105 MET CE :methyl -148:sc= -3.91! (180deg=-6.22!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 ASN : amide:sc= -0.0861 K(o=-0.086,f=-0.78) USER MOD Single : A 116 HIS : no HD1:sc= -5.42! C(o=-5.4!,f=-12!) USER MOD Single : A 119 TYR OH : rot 42:sc= -2.68! USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 MET CE :methyl -124:sc= -7.15! (180deg=-13.6!) USER MOD Single : A 123 LYS NZ :NH3+ -131:sc= 0.684 (180deg=-0.89) USER MOD Single : A 124 LYS NZ :NH3+ 140:sc= -0.405 (180deg=-2.7!) USER MOD Single : A 125 THR OG1 : rot 95:sc= 1.27 USER MOD Single : A 126 LYS NZ :NH3+ 162:sc= 1.31 (180deg=1.03) USER MOD Single : A 138 ASN : amide:sc= -0.169 X(o=-0.17,f=-0.66) USER MOD Single : A 141 SER OG : rot -92:sc= 1.92 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+ -146:sc= -0.957! (180deg=-3.36!) USER MOD Single : A 166 LYS NZ :NH3+ -170:sc= 1.22 (180deg=1.16) USER MOD ----------------------------------------------------------------- ATOM 34 N SER A 13 -10.505 14.355 -1.136 1.00 0.52 N ATOM 35 CA SER A 13 -11.765 13.776 -0.693 1.00 0.53 C ATOM 36 C SER A 13 -11.668 12.252 -0.701 1.00 0.41 C ATOM 37 O SER A 13 -12.604 11.545 -0.319 1.00 0.53 O ATOM 38 CB SER A 13 -12.893 14.254 -1.609 1.00 0.79 C ATOM 39 OG SER A 13 -14.171 13.899 -1.107 1.00 1.58 O ATOM 0 HA SER A 13 -11.980 14.099 0.326 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.835 15.337 -1.721 1.00 0.79 H new ATOM 0 HB3 SER A 13 -12.761 13.824 -2.602 1.00 0.79 H new ATOM 0 HG SER A 13 -14.114 13.034 -0.651 1.00 1.58 H new ATOM 45 N SER A 14 -10.510 11.768 -1.123 1.00 0.32 N ATOM 46 CA SER A 14 -10.225 10.374 -1.266 1.00 0.22 C ATOM 47 C SER A 14 -8.816 10.315 -1.769 1.00 0.21 C ATOM 48 O SER A 14 -8.244 11.337 -2.155 1.00 0.35 O ATOM 49 CB SER A 14 -11.181 9.705 -2.256 1.00 0.25 C ATOM 50 OG SER A 14 -11.026 10.232 -3.566 1.00 1.17 O ATOM 0 H SER A 14 -9.725 12.367 -1.381 1.00 0.32 H new ATOM 0 HA SER A 14 -10.350 9.842 -0.323 1.00 0.22 H new ATOM 0 HB2 SER A 14 -10.998 8.631 -2.271 1.00 0.25 H new ATOM 0 HB3 SER A 14 -12.209 9.849 -1.924 1.00 0.25 H new ATOM 0 HG SER A 14 -11.828 10.037 -4.094 1.00 1.17 H new ATOM 56 N ILE A 15 -8.257 9.152 -1.757 1.00 0.18 N ATOM 57 CA ILE A 15 -6.931 8.958 -2.262 1.00 0.18 C ATOM 58 C ILE A 15 -6.905 9.167 -3.778 1.00 0.17 C ATOM 59 O ILE A 15 -5.851 9.344 -4.381 1.00 0.19 O ATOM 60 CB ILE A 15 -6.470 7.552 -1.904 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.476 6.531 -2.429 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.330 7.432 -0.402 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.862 5.214 -2.839 1.00 0.38 C ATOM 0 H ILE A 15 -8.702 8.307 -1.398 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.255 9.685 -1.813 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.502 7.357 -2.365 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.225 6.346 -1.659 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -7.998 6.958 -3.285 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -6.000 6.425 -0.147 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.597 8.155 -0.046 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.293 7.629 0.070 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.643 4.545 -3.200 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.134 5.383 -3.632 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.365 4.762 -1.981 1.00 0.38 H new ATOM 75 N PHE A 16 -8.092 9.212 -4.373 1.00 0.18 N ATOM 76 CA PHE A 16 -8.236 9.317 -5.818 1.00 0.19 C ATOM 77 C PHE A 16 -7.934 10.720 -6.317 1.00 0.21 C ATOM 78 O PHE A 16 -8.070 11.009 -7.505 1.00 0.30 O ATOM 79 CB PHE A 16 -9.640 8.936 -6.231 1.00 0.20 C ATOM 80 CG PHE A 16 -9.999 7.526 -5.899 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.189 6.484 -6.310 1.00 0.22 C ATOM 82 CD2 PHE A 16 -11.163 7.238 -5.221 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.539 5.179 -6.055 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.510 5.935 -4.951 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.698 4.906 -5.375 1.00 0.19 C ATOM 0 H PHE A 16 -8.978 9.177 -3.868 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.515 8.632 -6.265 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.348 9.607 -5.744 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.747 9.086 -7.305 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.271 6.697 -6.837 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.808 8.042 -4.899 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.904 4.372 -6.389 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.418 5.719 -4.407 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.975 3.882 -5.171 1.00 0.19 H new ATOM 95 N ASP A 17 -7.518 11.582 -5.409 1.00 0.21 N ATOM 96 CA ASP A 17 -7.099 12.921 -5.766 1.00 0.26 C ATOM 97 C ASP A 17 -5.671 12.861 -6.257 1.00 0.25 C ATOM 98 O ASP A 17 -5.116 13.853 -6.739 1.00 0.32 O ATOM 99 CB ASP A 17 -7.182 13.864 -4.563 1.00 0.32 C ATOM 100 CG ASP A 17 -8.533 14.544 -4.416 1.00 1.13 C ATOM 101 OD1 ASP A 17 -8.734 15.608 -5.044 1.00 1.30 O ATOM 102 OD2 ASP A 17 -9.384 14.039 -3.652 1.00 2.11 O ATOM 0 H ASP A 17 -7.462 11.375 -4.412 1.00 0.21 H new ATOM 0 HA ASP A 17 -7.760 13.304 -6.544 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -6.967 13.301 -3.655 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.409 14.627 -4.656 1.00 0.32 H new ATOM 107 N PHE A 18 -5.078 11.680 -6.116 1.00 0.22 N ATOM 108 CA PHE A 18 -3.685 11.486 -6.438 1.00 0.23 C ATOM 109 C PHE A 18 -3.485 10.360 -7.412 1.00 0.26 C ATOM 110 O PHE A 18 -3.768 9.196 -7.125 1.00 0.29 O ATOM 111 CB PHE A 18 -2.895 11.252 -5.173 1.00 0.21 C ATOM 112 CG PHE A 18 -2.997 12.426 -4.263 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.514 13.651 -4.648 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.549 12.289 -3.000 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.581 14.727 -3.797 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.614 13.364 -2.139 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.245 14.626 -2.601 1.00 0.31 C ATOM 0 H PHE A 18 -5.552 10.843 -5.778 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.322 12.392 -6.923 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.265 10.360 -4.667 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.850 11.067 -5.420 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.077 13.770 -5.629 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -3.933 11.330 -2.686 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.108 15.658 -4.071 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -3.946 13.230 -1.120 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.478 15.510 -2.027 1.00 0.31 H new ATOM 127 N GLU A 19 -3.033 10.752 -8.582 1.00 0.35 N ATOM 128 CA GLU A 19 -2.613 9.824 -9.617 1.00 0.43 C ATOM 129 C GLU A 19 -1.628 8.806 -9.045 1.00 0.34 C ATOM 130 O GLU A 19 -0.775 9.135 -8.213 1.00 0.37 O ATOM 131 CB GLU A 19 -1.960 10.591 -10.771 1.00 0.63 C ATOM 132 CG GLU A 19 -1.724 9.753 -12.016 1.00 1.08 C ATOM 133 CD GLU A 19 -3.017 9.329 -12.683 1.00 2.04 C ATOM 134 OE1 GLU A 19 -3.674 10.179 -13.314 1.00 2.30 O ATOM 135 OE2 GLU A 19 -3.387 8.142 -12.561 1.00 2.86 O ATOM 0 H GLU A 19 -2.944 11.733 -8.848 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.489 9.294 -9.991 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -2.591 11.441 -11.032 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -1.006 10.995 -10.431 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -1.123 10.322 -12.725 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -1.148 8.866 -11.750 1.00 1.08 H new ATOM 142 N VAL A 20 -1.751 7.579 -9.504 1.00 0.29 N ATOM 143 CA VAL A 20 -0.915 6.485 -9.045 1.00 0.26 C ATOM 144 C VAL A 20 -0.034 6.014 -10.195 1.00 0.25 C ATOM 145 O VAL A 20 -0.209 6.466 -11.318 1.00 0.28 O ATOM 146 CB VAL A 20 -1.810 5.340 -8.496 1.00 0.31 C ATOM 147 CG1 VAL A 20 -1.033 4.075 -8.180 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.518 5.831 -7.258 1.00 0.49 C ATOM 0 H VAL A 20 -2.436 7.309 -10.209 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.266 6.816 -8.234 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.524 5.075 -9.276 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.715 3.314 -7.801 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.549 3.709 -9.086 1.00 0.67 H new ATOM 0 HG13 VAL A 20 -0.276 4.292 -7.426 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -3.151 5.037 -6.861 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.782 6.117 -6.507 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.134 6.694 -7.510 1.00 0.49 H new ATOM 158 N LEU A 21 0.943 5.166 -9.915 1.00 0.28 N ATOM 159 CA LEU A 21 1.805 4.644 -10.957 1.00 0.35 C ATOM 160 C LEU A 21 1.864 3.134 -10.919 1.00 0.38 C ATOM 161 O LEU A 21 1.670 2.521 -9.877 1.00 0.58 O ATOM 162 CB LEU A 21 3.222 5.206 -10.822 1.00 0.45 C ATOM 163 CG LEU A 21 3.322 6.714 -10.958 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.732 7.192 -10.701 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.866 7.116 -12.336 1.00 0.68 C ATOM 0 H LEU A 21 1.156 4.827 -8.977 1.00 0.28 H new ATOM 0 HA LEU A 21 1.380 4.955 -11.911 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.623 4.915 -9.851 1.00 0.45 H new ATOM 0 HB3 LEU A 21 3.855 4.744 -11.579 1.00 0.45 H new ATOM 0 HG LEU A 21 2.679 7.181 -10.212 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.773 8.276 -10.805 1.00 0.69 H new ATOM 0 HD12 LEU A 21 5.032 6.913 -9.691 1.00 0.69 H new ATOM 0 HD13 LEU A 21 5.409 6.732 -11.421 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.935 8.199 -12.441 1.00 0.68 H new ATOM 0 HD22 LEU A 21 3.500 6.638 -13.083 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.832 6.803 -12.483 1.00 0.68 H new ATOM 177 N ASP A 22 2.074 2.550 -12.079 1.00 0.33 N ATOM 178 CA ASP A 22 2.519 1.175 -12.177 1.00 0.37 C ATOM 179 C ASP A 22 4.037 1.205 -12.037 1.00 0.35 C ATOM 180 O ASP A 22 4.634 2.280 -12.115 1.00 0.40 O ATOM 181 CB ASP A 22 2.049 0.572 -13.516 1.00 0.50 C ATOM 182 CG ASP A 22 3.133 -0.163 -14.285 1.00 1.16 C ATOM 183 OD1 ASP A 22 3.978 0.501 -14.922 1.00 1.87 O ATOM 184 OD2 ASP A 22 3.131 -1.411 -14.267 1.00 1.48 O ATOM 0 H ASP A 22 1.942 3.012 -12.979 1.00 0.33 H new ATOM 0 HA ASP A 22 2.097 0.540 -11.398 1.00 0.37 H new ATOM 0 HB2 ASP A 22 1.227 -0.117 -13.322 1.00 0.50 H new ATOM 0 HB3 ASP A 22 1.654 1.372 -14.143 1.00 0.50 H new ATOM 189 N ALA A 23 4.652 0.052 -11.791 1.00 0.39 N ATOM 190 CA ALA A 23 6.067 -0.020 -11.405 1.00 0.42 C ATOM 191 C ALA A 23 7.020 0.577 -12.444 1.00 0.47 C ATOM 192 O ALA A 23 8.218 0.715 -12.177 1.00 0.59 O ATOM 193 CB ALA A 23 6.460 -1.459 -11.105 1.00 0.52 C ATOM 0 H ALA A 23 4.192 -0.856 -11.852 1.00 0.39 H new ATOM 0 HA ALA A 23 6.167 0.591 -10.508 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.511 -1.497 -10.820 1.00 0.52 H new ATOM 0 HB2 ALA A 23 5.849 -1.840 -10.287 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.302 -2.072 -11.992 1.00 0.52 H new ATOM 199 N ASP A 24 6.499 0.935 -13.611 1.00 0.46 N ATOM 200 CA ASP A 24 7.304 1.582 -14.638 1.00 0.54 C ATOM 201 C ASP A 24 7.111 3.099 -14.643 1.00 0.51 C ATOM 202 O ASP A 24 7.676 3.783 -15.494 1.00 0.62 O ATOM 203 CB ASP A 24 6.967 1.019 -16.018 1.00 0.69 C ATOM 204 CG ASP A 24 7.842 -0.158 -16.393 1.00 1.43 C ATOM 205 OD1 ASP A 24 8.985 0.067 -16.847 1.00 1.51 O ATOM 206 OD2 ASP A 24 7.393 -1.315 -16.253 1.00 2.34 O ATOM 0 H ASP A 24 5.523 0.788 -13.869 1.00 0.46 H new ATOM 0 HA ASP A 24 8.348 1.374 -14.404 1.00 0.54 H new ATOM 0 HB2 ASP A 24 5.922 0.711 -16.036 1.00 0.69 H new ATOM 0 HB3 ASP A 24 7.080 1.805 -16.765 1.00 0.69 H new ATOM 211 N HIS A 25 6.292 3.619 -13.709 1.00 0.43 N ATOM 212 CA HIS A 25 6.039 5.062 -13.584 1.00 0.44 C ATOM 213 C HIS A 25 5.006 5.481 -14.616 1.00 0.47 C ATOM 214 O HIS A 25 4.860 6.661 -14.942 1.00 0.54 O ATOM 215 CB HIS A 25 7.316 5.915 -13.719 1.00 0.54 C ATOM 216 CG HIS A 25 8.230 5.884 -12.526 1.00 0.64 C ATOM 217 ND1 HIS A 25 8.011 6.611 -11.368 1.00 0.73 N ATOM 218 CD2 HIS A 25 9.360 5.178 -12.311 1.00 1.47 C ATOM 219 CE1 HIS A 25 8.970 6.342 -10.493 1.00 0.59 C ATOM 220 NE2 HIS A 25 9.801 5.479 -11.046 1.00 1.26 N ATOM 0 H HIS A 25 5.791 3.052 -13.025 1.00 0.43 H new ATOM 0 HA HIS A 25 5.661 5.242 -12.578 1.00 0.44 H new ATOM 0 HB2 HIS A 25 7.872 5.574 -14.593 1.00 0.54 H new ATOM 0 HB3 HIS A 25 7.026 6.948 -13.909 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.831 4.500 -13.007 1.00 1.47 H new ATOM 0 HE1 HIS A 25 9.056 6.757 -9.500 1.00 0.59 H new ATOM 0 HE2 HIS A 25 10.637 5.097 -10.604 1.00 1.26 H new ATOM 229 N LYS A 26 4.302 4.485 -15.134 1.00 0.48 N ATOM 230 CA LYS A 26 3.163 4.710 -16.003 1.00 0.53 C ATOM 231 C LYS A 26 1.949 4.896 -15.128 1.00 0.41 C ATOM 232 O LYS A 26 1.632 4.012 -14.333 1.00 0.38 O ATOM 233 CB LYS A 26 2.951 3.510 -16.921 1.00 0.67 C ATOM 234 CG LYS A 26 4.215 3.054 -17.615 1.00 1.00 C ATOM 235 CD LYS A 26 4.786 4.144 -18.503 1.00 2.12 C ATOM 236 CE LYS A 26 6.242 4.413 -18.178 1.00 3.15 C ATOM 237 NZ LYS A 26 6.807 5.497 -19.022 1.00 4.25 N ATOM 0 H LYS A 26 4.506 3.501 -14.962 1.00 0.48 H new ATOM 0 HA LYS A 26 3.333 5.589 -16.624 1.00 0.53 H new ATOM 0 HB2 LYS A 26 2.547 2.683 -16.338 1.00 0.67 H new ATOM 0 HB3 LYS A 26 2.204 3.765 -17.673 1.00 0.67 H new ATOM 0 HG2 LYS A 26 4.956 2.765 -16.870 1.00 1.00 H new ATOM 0 HG3 LYS A 26 4.003 2.169 -18.214 1.00 1.00 H new ATOM 0 HD2 LYS A 26 4.693 3.850 -19.549 1.00 2.12 H new ATOM 0 HD3 LYS A 26 4.208 5.059 -18.376 1.00 2.12 H new ATOM 0 HE2 LYS A 26 6.335 4.686 -17.127 1.00 3.15 H new ATOM 0 HE3 LYS A 26 6.821 3.501 -18.323 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 7.804 5.650 -18.769 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 6.742 5.226 -20.024 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 6.271 6.374 -18.865 1.00 4.25 H new ATOM 251 N PRO A 27 1.277 6.047 -15.218 1.00 0.41 N ATOM 252 CA PRO A 27 0.192 6.375 -14.302 1.00 0.37 C ATOM 253 C PRO A 27 -0.874 5.296 -14.231 1.00 0.32 C ATOM 254 O PRO A 27 -1.619 5.048 -15.178 1.00 0.36 O ATOM 255 CB PRO A 27 -0.366 7.673 -14.883 1.00 0.46 C ATOM 256 CG PRO A 27 0.813 8.284 -15.546 1.00 0.54 C ATOM 257 CD PRO A 27 1.535 7.131 -16.176 1.00 0.50 C ATOM 0 HA PRO A 27 0.537 6.467 -13.272 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.172 7.483 -15.591 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -0.771 8.321 -14.105 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.511 9.018 -16.293 1.00 0.54 H new ATOM 0 HG3 PRO A 27 1.447 8.803 -14.827 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.147 6.900 -17.168 1.00 0.50 H new ATOM 0 HD3 PRO A 27 2.601 7.330 -16.289 1.00 0.50 H new ATOM 265 N TYR A 28 -0.922 4.683 -13.070 1.00 0.28 N ATOM 266 CA TYR A 28 -1.947 3.728 -12.706 1.00 0.26 C ATOM 267 C TYR A 28 -3.211 4.463 -12.299 1.00 0.25 C ATOM 268 O TYR A 28 -3.212 5.212 -11.322 1.00 0.37 O ATOM 269 CB TYR A 28 -1.418 2.893 -11.544 1.00 0.30 C ATOM 270 CG TYR A 28 -2.276 1.734 -11.128 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.963 0.975 -12.056 1.00 0.50 C ATOM 272 CD2 TYR A 28 -2.371 1.390 -9.793 1.00 0.82 C ATOM 273 CE1 TYR A 28 -3.730 -0.098 -11.661 1.00 0.64 C ATOM 274 CE2 TYR A 28 -3.129 0.323 -9.384 1.00 1.10 C ATOM 275 CZ TYR A 28 -3.814 -0.425 -10.322 1.00 0.92 C ATOM 276 OH TYR A 28 -4.596 -1.487 -9.924 1.00 1.20 O ATOM 0 H TYR A 28 -0.233 4.838 -12.334 1.00 0.28 H new ATOM 0 HA TYR A 28 -2.188 3.081 -13.550 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.433 2.513 -11.814 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -1.282 3.548 -10.683 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -2.898 1.227 -13.104 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -1.838 1.973 -9.057 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -4.264 -0.682 -12.396 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -3.190 0.069 -8.336 1.00 1.10 H new ATOM 0 HH TYR A 28 -5.384 -1.152 -9.448 1.00 1.20 H new ATOM 286 N ASN A 29 -4.276 4.258 -13.053 1.00 0.34 N ATOM 287 CA ASN A 29 -5.540 4.909 -12.759 1.00 0.42 C ATOM 288 C ASN A 29 -6.159 4.301 -11.506 1.00 0.34 C ATOM 289 O ASN A 29 -6.908 3.329 -11.542 1.00 0.44 O ATOM 290 CB ASN A 29 -6.506 4.867 -13.957 1.00 0.67 C ATOM 291 CG ASN A 29 -6.739 3.478 -14.519 1.00 0.73 C ATOM 292 OD1 ASN A 29 -7.725 2.795 -13.981 1.00 1.18 O flip ATOM 293 ND2 ASN A 29 -6.038 3.029 -15.424 1.00 1.51 N flip ATOM 0 H ASN A 29 -4.291 3.648 -13.871 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.343 5.964 -12.568 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -7.464 5.289 -13.652 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.114 5.506 -14.748 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -5.283 3.594 -15.812 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -6.212 2.091 -15.786 1.00 1.51 H new ATOM 300 N LEU A 30 -5.788 4.886 -10.391 1.00 0.25 N ATOM 301 CA LEU A 30 -6.232 4.469 -9.074 1.00 0.20 C ATOM 302 C LEU A 30 -7.751 4.338 -8.999 1.00 0.19 C ATOM 303 O LEU A 30 -8.283 3.401 -8.400 1.00 0.19 O ATOM 304 CB LEU A 30 -5.787 5.535 -8.092 1.00 0.22 C ATOM 305 CG LEU A 30 -6.096 5.285 -6.642 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.373 4.047 -6.143 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.722 6.499 -5.814 1.00 0.28 C ATOM 0 H LEU A 30 -5.154 5.685 -10.370 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.805 3.492 -8.846 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.709 5.663 -8.194 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -6.249 6.479 -8.381 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.167 5.110 -6.539 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.611 3.885 -5.092 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.690 3.181 -6.724 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.297 4.184 -6.254 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.950 6.308 -4.765 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.656 6.700 -5.923 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -6.291 7.363 -6.157 1.00 0.28 H new ATOM 319 N VAL A 31 -8.429 5.283 -9.638 1.00 0.20 N ATOM 320 CA VAL A 31 -9.875 5.449 -9.518 1.00 0.19 C ATOM 321 C VAL A 31 -10.686 4.293 -10.106 1.00 0.20 C ATOM 322 O VAL A 31 -11.915 4.342 -10.102 1.00 0.23 O ATOM 323 CB VAL A 31 -10.349 6.769 -10.155 1.00 0.22 C ATOM 324 CG1 VAL A 31 -10.438 7.876 -9.134 1.00 1.02 C ATOM 325 CG2 VAL A 31 -9.415 7.191 -11.252 1.00 0.87 C ATOM 0 H VAL A 31 -7.989 5.962 -10.259 1.00 0.20 H new ATOM 0 HA VAL A 31 -10.061 5.464 -8.444 1.00 0.19 H new ATOM 0 HB VAL A 31 -11.343 6.589 -10.565 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -10.775 8.792 -9.619 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -11.147 7.596 -8.354 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -9.456 8.041 -8.690 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.766 8.125 -11.690 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.415 7.335 -10.843 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -9.384 6.419 -12.021 1.00 0.87 H new ATOM 335 N GLN A 32 -10.030 3.270 -10.634 1.00 0.21 N ATOM 336 CA GLN A 32 -10.754 2.071 -11.044 1.00 0.23 C ATOM 337 C GLN A 32 -11.090 1.229 -9.817 1.00 0.22 C ATOM 338 O GLN A 32 -11.801 0.230 -9.901 1.00 0.28 O ATOM 339 CB GLN A 32 -9.969 1.242 -12.061 1.00 0.26 C ATOM 340 CG GLN A 32 -8.627 0.742 -11.561 1.00 0.29 C ATOM 341 CD GLN A 32 -7.955 -0.183 -12.556 1.00 0.35 C ATOM 342 OE1 GLN A 32 -8.618 -0.916 -13.287 1.00 1.02 O ATOM 343 NE2 GLN A 32 -6.641 -0.139 -12.607 1.00 0.75 N ATOM 0 H GLN A 32 -9.022 3.242 -10.787 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.674 2.389 -11.534 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.574 0.385 -12.358 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.808 1.844 -12.955 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.976 1.593 -11.361 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -8.766 0.217 -10.616 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -6.127 0.483 -11.983 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -6.136 -0.727 -13.270 1.00 0.75 H new ATOM 352 N HIS A 33 -10.559 1.648 -8.673 1.00 0.17 N ATOM 353 CA HIS A 33 -10.885 1.028 -7.393 1.00 0.16 C ATOM 354 C HIS A 33 -11.882 1.899 -6.664 1.00 0.16 C ATOM 355 O HIS A 33 -11.984 1.887 -5.443 1.00 0.17 O ATOM 356 CB HIS A 33 -9.607 0.785 -6.576 1.00 0.16 C ATOM 357 CG HIS A 33 -8.667 -0.119 -7.305 1.00 0.16 C ATOM 358 ND1 HIS A 33 -9.004 -1.415 -7.610 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.441 0.099 -7.868 1.00 0.22 C ATOM 360 CE1 HIS A 33 -8.049 -1.963 -8.323 1.00 0.27 C ATOM 361 NE2 HIS A 33 -7.089 -1.067 -8.504 1.00 0.28 N ATOM 0 H HIS A 33 -9.896 2.420 -8.606 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.343 0.052 -7.552 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -9.116 1.736 -6.371 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.865 0.346 -5.613 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.866 -1.881 -7.325 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.862 1.010 -7.822 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -8.045 -2.975 -8.700 1.00 0.27 H new ATOM 370 N LYS A 34 -12.608 2.675 -7.453 1.00 0.19 N ATOM 371 CA LYS A 34 -13.752 3.404 -6.963 1.00 0.19 C ATOM 372 C LYS A 34 -14.956 2.479 -6.966 1.00 0.21 C ATOM 373 O LYS A 34 -15.448 2.092 -8.030 1.00 0.33 O ATOM 374 CB LYS A 34 -14.049 4.613 -7.843 1.00 0.22 C ATOM 375 CG LYS A 34 -13.055 5.751 -7.725 1.00 0.28 C ATOM 376 CD LYS A 34 -13.687 7.067 -8.144 1.00 0.69 C ATOM 377 CE LYS A 34 -14.420 6.924 -9.463 1.00 1.01 C ATOM 378 NZ LYS A 34 -13.505 6.967 -10.635 1.00 1.56 N ATOM 0 H LYS A 34 -12.417 2.813 -8.445 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.538 3.757 -5.954 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -14.083 4.287 -8.883 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -15.041 4.990 -7.594 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -12.700 5.824 -6.697 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.185 5.546 -8.349 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -14.381 7.403 -7.373 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -12.916 7.832 -8.234 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -14.968 5.982 -9.469 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -15.157 7.722 -9.553 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -14.064 7.036 -11.509 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -12.880 7.795 -10.557 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -12.930 6.101 -10.659 1.00 1.56 H new ATOM 392 N GLY A 35 -15.417 2.112 -5.794 1.00 0.18 N ATOM 393 CA GLY A 35 -16.538 1.211 -5.695 1.00 0.20 C ATOM 394 C GLY A 35 -16.265 0.094 -4.724 1.00 0.17 C ATOM 395 O GLY A 35 -17.136 -0.286 -3.941 1.00 0.20 O ATOM 0 H GLY A 35 -15.035 2.422 -4.900 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.422 1.763 -5.377 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.759 0.794 -6.678 1.00 0.20 H new ATOM 399 N SER A 36 -15.057 -0.446 -4.763 1.00 0.16 N ATOM 400 CA SER A 36 -14.645 -1.405 -3.781 1.00 0.16 C ATOM 401 C SER A 36 -13.312 -0.981 -3.217 1.00 0.14 C ATOM 402 O SER A 36 -12.438 -0.529 -3.954 1.00 0.16 O ATOM 403 CB SER A 36 -14.542 -2.792 -4.399 1.00 0.20 C ATOM 404 OG SER A 36 -15.772 -3.170 -4.996 1.00 0.29 O ATOM 0 H SER A 36 -14.353 -0.229 -5.469 1.00 0.16 H new ATOM 0 HA SER A 36 -15.385 -1.448 -2.982 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.750 -2.803 -5.148 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.266 -3.517 -3.633 1.00 0.20 H new ATOM 0 HG SER A 36 -15.596 -3.649 -5.833 1.00 0.29 H new ATOM 410 N PRO A 37 -13.169 -1.086 -1.897 1.00 0.12 N ATOM 411 CA PRO A 37 -11.938 -0.786 -1.185 1.00 0.12 C ATOM 412 C PRO A 37 -10.720 -1.371 -1.861 1.00 0.12 C ATOM 413 O PRO A 37 -10.797 -2.370 -2.571 1.00 0.15 O ATOM 414 CB PRO A 37 -12.153 -1.434 0.193 1.00 0.15 C ATOM 415 CG PRO A 37 -13.388 -2.237 0.045 1.00 0.18 C ATOM 416 CD PRO A 37 -14.203 -1.511 -0.968 1.00 0.15 C ATOM 0 HA PRO A 37 -11.747 0.286 -1.141 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.305 -2.060 0.472 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.263 -0.680 0.972 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.162 -3.251 -0.284 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -13.920 -2.321 0.993 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -14.944 -2.156 -1.441 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.743 -0.668 -0.537 1.00 0.15 H new ATOM 424 N LEU A 38 -9.612 -0.723 -1.632 1.00 0.14 N ATOM 425 CA LEU A 38 -8.334 -1.119 -2.162 1.00 0.13 C ATOM 426 C LEU A 38 -7.313 -0.896 -1.063 1.00 0.13 C ATOM 427 O LEU A 38 -7.474 -0.013 -0.251 1.00 0.20 O ATOM 428 CB LEU A 38 -7.972 -0.308 -3.413 1.00 0.16 C ATOM 429 CG LEU A 38 -8.013 1.214 -3.292 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.358 1.843 -4.499 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.437 1.741 -3.163 1.00 0.26 C ATOM 0 H LEU A 38 -9.570 0.118 -1.056 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.357 -2.165 -2.467 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -6.968 -0.596 -3.724 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.650 -0.602 -4.214 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.471 1.482 -2.385 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.391 2.929 -4.406 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.320 1.515 -4.562 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.890 1.540 -5.401 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.417 2.828 -3.080 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -10.012 1.455 -4.044 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -9.902 1.318 -2.273 1.00 0.26 H new ATOM 443 N LEU A 39 -6.309 -1.713 -0.985 1.00 0.18 N ATOM 444 CA LEU A 39 -5.273 -1.506 -0.016 1.00 0.19 C ATOM 445 C LEU A 39 -3.994 -1.168 -0.706 1.00 0.18 C ATOM 446 O LEU A 39 -3.439 -1.970 -1.454 1.00 0.21 O ATOM 447 CB LEU A 39 -5.051 -2.714 0.866 1.00 0.23 C ATOM 448 CG LEU A 39 -5.667 -2.625 2.256 1.00 0.35 C ATOM 449 CD1 LEU A 39 -7.166 -2.810 2.194 1.00 1.10 C ATOM 450 CD2 LEU A 39 -5.041 -3.639 3.189 1.00 1.19 C ATOM 0 H LEU A 39 -6.183 -2.531 -1.581 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.596 -0.683 0.621 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.457 -3.591 0.362 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -3.978 -2.875 0.971 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.464 -1.629 2.651 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -7.583 -2.742 3.199 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -7.603 -2.033 1.567 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -7.395 -3.788 1.772 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -5.497 -3.556 4.175 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -5.204 -4.643 2.797 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -3.971 -3.449 3.267 1.00 1.19 H new ATOM 462 N ILE A 40 -3.542 0.021 -0.471 1.00 0.19 N ATOM 463 CA ILE A 40 -2.286 0.451 -1.021 1.00 0.20 C ATOM 464 C ILE A 40 -1.203 0.232 0.014 1.00 0.18 C ATOM 465 O ILE A 40 -1.266 0.805 1.102 1.00 0.20 O ATOM 466 CB ILE A 40 -2.359 1.927 -1.418 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.809 2.309 -1.702 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.490 2.203 -2.638 1.00 0.37 C ATOM 469 CD1 ILE A 40 -3.935 3.703 -2.250 1.00 0.35 C ATOM 0 H ILE A 40 -4.021 0.718 0.099 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.057 -0.127 -1.916 1.00 0.20 H new ATOM 0 HB ILE A 40 -1.983 2.532 -0.593 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.236 1.602 -2.413 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.390 2.228 -0.783 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.558 3.258 -2.902 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.454 1.951 -2.411 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.836 1.597 -3.475 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -4.985 3.927 -2.436 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.534 4.415 -1.529 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.377 3.779 -3.183 1.00 0.35 H new ATOM 481 N TYR A 41 -0.237 -0.627 -0.285 1.00 0.18 N ATOM 482 CA TYR A 41 0.777 -0.935 0.701 1.00 0.19 C ATOM 483 C TYR A 41 2.041 -0.163 0.389 1.00 0.20 C ATOM 484 O TYR A 41 2.506 -0.178 -0.740 1.00 0.27 O ATOM 485 CB TYR A 41 1.146 -2.440 0.743 1.00 0.20 C ATOM 486 CG TYR A 41 0.029 -3.432 1.022 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.284 -3.112 0.678 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.260 -4.653 1.629 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.326 -3.982 0.936 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.778 -5.525 1.884 1.00 0.35 C ATOM 491 CZ TYR A 41 -1.963 -5.304 1.524 1.00 0.33 C ATOM 492 OH TYR A 41 -3.093 -6.053 1.813 1.00 0.42 O ATOM 0 H TYR A 41 -0.138 -1.109 -1.179 1.00 0.18 H new ATOM 0 HA TYR A 41 0.358 -0.656 1.668 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.596 -2.702 -0.214 1.00 0.20 H new ATOM 0 HB3 TYR A 41 1.914 -2.576 1.504 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.490 -2.166 0.201 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.267 -4.928 1.907 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.351 -3.718 0.723 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.564 -6.439 2.417 1.00 0.35 H new ATOM 0 HH TYR A 41 -3.879 -5.628 1.410 1.00 0.42 H new ATOM 502 N ASN A 42 2.600 0.507 1.372 1.00 0.28 N ATOM 503 CA ASN A 42 3.967 0.973 1.251 1.00 0.34 C ATOM 504 C ASN A 42 4.810 -0.262 1.502 1.00 0.37 C ATOM 505 O ASN A 42 4.638 -0.939 2.503 1.00 0.54 O ATOM 506 CB ASN A 42 4.280 2.070 2.282 1.00 0.46 C ATOM 507 CG ASN A 42 4.867 1.522 3.570 1.00 1.50 C ATOM 508 OD1 ASN A 42 4.148 1.108 4.468 1.00 2.27 O ATOM 509 ND2 ASN A 42 6.182 1.522 3.671 1.00 2.35 N ATOM 0 H ASN A 42 2.140 0.740 2.252 1.00 0.28 H new ATOM 0 HA ASN A 42 4.162 1.421 0.277 1.00 0.34 H new ATOM 0 HB2 ASN A 42 4.979 2.783 1.845 1.00 0.46 H new ATOM 0 HB3 ASN A 42 3.366 2.618 2.510 1.00 0.46 H new ATOM 0 HD21 ASN A 42 6.628 1.169 4.518 1.00 2.35 H new ATOM 0 HD22 ASN A 42 6.753 1.875 2.903 1.00 2.35 H new ATOM 516 N VAL A 43 5.656 -0.629 0.586 1.00 0.36 N ATOM 517 CA VAL A 43 6.330 -1.896 0.733 1.00 0.38 C ATOM 518 C VAL A 43 7.819 -1.756 0.588 1.00 0.42 C ATOM 519 O VAL A 43 8.316 -0.784 0.029 1.00 0.50 O ATOM 520 CB VAL A 43 5.804 -2.954 -0.264 1.00 0.39 C ATOM 521 CG1 VAL A 43 4.348 -3.258 -0.001 1.00 1.03 C ATOM 522 CG2 VAL A 43 5.975 -2.510 -1.697 1.00 0.98 C ATOM 0 H VAL A 43 5.895 -0.093 -0.248 1.00 0.36 H new ATOM 0 HA VAL A 43 6.110 -2.240 1.744 1.00 0.38 H new ATOM 0 HB VAL A 43 6.397 -3.856 -0.113 1.00 0.39 H new ATOM 0 HG11 VAL A 43 3.998 -4.005 -0.714 1.00 1.03 H new ATOM 0 HG12 VAL A 43 4.234 -3.642 1.013 1.00 1.03 H new ATOM 0 HG13 VAL A 43 3.760 -2.347 -0.112 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.593 -3.282 -2.365 1.00 0.98 H new ATOM 0 HG22 VAL A 43 5.423 -1.584 -1.859 1.00 0.98 H new ATOM 0 HG23 VAL A 43 7.032 -2.343 -1.903 1.00 0.98 H new ATOM 650 N GLY A 52 4.777 -11.361 6.107 1.00 0.45 N ATOM 651 CA GLY A 52 3.606 -12.063 5.597 1.00 0.51 C ATOM 652 C GLY A 52 2.702 -11.183 4.758 1.00 0.41 C ATOM 653 O GLY A 52 1.918 -11.687 3.961 1.00 0.41 O ATOM 0 HA2 GLY A 52 3.932 -12.913 4.998 1.00 0.51 H new ATOM 0 HA3 GLY A 52 3.036 -12.463 6.436 1.00 0.51 H new ATOM 657 N GLY A 53 2.830 -9.868 4.931 1.00 0.44 N ATOM 658 CA GLY A 53 2.080 -8.911 4.139 1.00 0.50 C ATOM 659 C GLY A 53 2.190 -9.147 2.647 1.00 0.36 C ATOM 660 O GLY A 53 1.312 -8.747 1.902 1.00 0.32 O ATOM 0 H GLY A 53 3.452 -9.445 5.619 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.030 -8.954 4.430 1.00 0.50 H new ATOM 0 HA3 GLY A 53 2.433 -7.905 4.367 1.00 0.50 H new ATOM 664 N TYR A 54 3.270 -9.784 2.198 1.00 0.37 N ATOM 665 CA TYR A 54 3.409 -10.131 0.795 1.00 0.36 C ATOM 666 C TYR A 54 2.357 -11.162 0.423 1.00 0.26 C ATOM 667 O TYR A 54 1.569 -10.967 -0.506 1.00 0.25 O ATOM 668 CB TYR A 54 4.800 -10.701 0.527 1.00 0.45 C ATOM 669 CG TYR A 54 5.195 -10.699 -0.933 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.225 -10.633 -1.914 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.526 -10.785 -1.327 1.00 0.53 C ATOM 672 CE1 TYR A 54 4.561 -10.643 -3.247 1.00 0.46 C ATOM 673 CE2 TYR A 54 6.878 -10.796 -2.660 1.00 0.65 C ATOM 674 CZ TYR A 54 5.953 -10.669 -3.603 1.00 0.56 C ATOM 675 OH TYR A 54 6.224 -10.731 -4.956 1.00 0.70 O ATOM 0 H TYR A 54 4.054 -10.067 2.786 1.00 0.37 H new ATOM 0 HA TYR A 54 3.273 -9.233 0.192 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.533 -10.124 1.092 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.841 -11.723 0.902 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.185 -10.573 -1.629 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.298 -10.844 -0.575 1.00 0.53 H new ATOM 0 HE1 TYR A 54 3.796 -10.632 -4.009 1.00 0.46 H new ATOM 0 HE2 TYR A 54 7.915 -10.909 -2.939 1.00 0.65 H new ATOM 0 HH TYR A 54 7.194 -10.743 -5.095 1.00 0.70 H new ATOM 685 N GLU A 55 2.350 -12.253 1.167 1.00 0.25 N ATOM 686 CA GLU A 55 1.388 -13.318 0.967 1.00 0.27 C ATOM 687 C GLU A 55 -0.022 -12.786 1.188 1.00 0.22 C ATOM 688 O GLU A 55 -0.984 -13.216 0.548 1.00 0.25 O ATOM 689 CB GLU A 55 1.679 -14.455 1.939 1.00 0.36 C ATOM 690 CG GLU A 55 0.825 -15.674 1.694 1.00 1.14 C ATOM 691 CD GLU A 55 1.086 -16.781 2.688 1.00 1.92 C ATOM 692 OE1 GLU A 55 0.480 -16.764 3.781 1.00 2.61 O ATOM 693 OE2 GLU A 55 1.895 -17.677 2.382 1.00 2.39 O ATOM 0 H GLU A 55 3.010 -12.424 1.925 1.00 0.25 H new ATOM 0 HA GLU A 55 1.467 -13.693 -0.054 1.00 0.27 H new ATOM 0 HB2 GLU A 55 2.730 -14.733 1.860 1.00 0.36 H new ATOM 0 HB3 GLU A 55 1.518 -14.104 2.958 1.00 0.36 H new ATOM 0 HG2 GLU A 55 -0.226 -15.391 1.741 1.00 1.14 H new ATOM 0 HG3 GLU A 55 1.011 -16.046 0.686 1.00 1.14 H new ATOM 700 N THR A 56 -0.107 -11.814 2.076 1.00 0.25 N ATOM 701 CA THR A 56 -1.350 -11.163 2.417 1.00 0.24 C ATOM 702 C THR A 56 -1.858 -10.384 1.222 1.00 0.21 C ATOM 703 O THR A 56 -2.965 -10.603 0.741 1.00 0.22 O ATOM 704 CB THR A 56 -1.122 -10.218 3.615 1.00 0.26 C ATOM 705 OG1 THR A 56 -0.724 -10.977 4.763 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.364 -9.420 3.940 1.00 0.25 C ATOM 0 H THR A 56 0.699 -11.452 2.586 1.00 0.25 H new ATOM 0 HA THR A 56 -2.094 -11.910 2.692 1.00 0.24 H new ATOM 0 HB THR A 56 -0.333 -9.517 3.341 1.00 0.26 H new ATOM 0 HG1 THR A 56 -0.425 -10.368 5.470 1.00 0.33 H new ATOM 0 HG21 THR A 56 -2.165 -8.766 4.789 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.646 -8.818 3.076 1.00 0.25 H new ATOM 0 HG23 THR A 56 -3.179 -10.100 4.189 1.00 0.25 H new ATOM 714 N ALA A 57 -1.000 -9.519 0.726 1.00 0.19 N ATOM 715 CA ALA A 57 -1.293 -8.677 -0.407 1.00 0.20 C ATOM 716 C ALA A 57 -1.666 -9.496 -1.632 1.00 0.19 C ATOM 717 O ALA A 57 -2.674 -9.222 -2.286 1.00 0.22 O ATOM 718 CB ALA A 57 -0.083 -7.821 -0.697 1.00 0.22 C ATOM 0 H ALA A 57 -0.064 -9.381 1.107 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.151 -8.049 -0.167 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.289 -7.178 -1.552 1.00 0.22 H new ATOM 0 HB2 ALA A 57 0.144 -7.206 0.173 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.770 -8.461 -0.922 1.00 0.22 H new ATOM 724 N THR A 58 -0.851 -10.501 -1.931 1.00 0.17 N ATOM 725 CA THR A 58 -1.075 -11.355 -3.088 1.00 0.17 C ATOM 726 C THR A 58 -2.475 -11.982 -3.038 1.00 0.17 C ATOM 727 O THR A 58 -3.281 -11.847 -3.970 1.00 0.19 O ATOM 728 CB THR A 58 -0.040 -12.496 -3.146 1.00 0.20 C ATOM 729 OG1 THR A 58 1.287 -11.978 -2.981 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.128 -13.246 -4.469 1.00 0.26 C ATOM 0 H THR A 58 -0.025 -10.744 -1.384 1.00 0.17 H new ATOM 0 HA THR A 58 -0.978 -10.726 -3.973 1.00 0.17 H new ATOM 0 HB THR A 58 -0.263 -13.187 -2.333 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.465 -11.831 -2.028 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.613 -14.046 -4.484 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.125 -13.673 -4.580 1.00 0.26 H new ATOM 0 HG23 THR A 58 0.065 -12.557 -5.291 1.00 0.26 H new ATOM 738 N THR A 59 -2.753 -12.649 -1.922 1.00 0.16 N ATOM 739 CA THR A 59 -3.992 -13.391 -1.745 1.00 0.17 C ATOM 740 C THR A 59 -5.195 -12.456 -1.634 1.00 0.16 C ATOM 741 O THR A 59 -6.283 -12.777 -2.103 1.00 0.19 O ATOM 742 CB THR A 59 -3.912 -14.282 -0.488 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.667 -14.993 -0.483 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.062 -15.277 -0.442 1.00 0.46 C ATOM 0 H THR A 59 -2.126 -12.689 -1.118 1.00 0.16 H new ATOM 0 HA THR A 59 -4.125 -14.018 -2.627 1.00 0.17 H new ATOM 0 HB THR A 59 -3.980 -13.639 0.389 1.00 0.20 H new ATOM 0 HG1 THR A 59 -1.985 -14.455 -0.030 1.00 0.48 H new ATOM 0 HG21 THR A 59 -4.977 -15.890 0.455 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.009 -14.738 -0.425 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.025 -15.917 -1.323 1.00 0.46 H new ATOM 752 N LEU A 60 -4.985 -11.290 -1.046 1.00 0.13 N ATOM 753 CA LEU A 60 -6.057 -10.345 -0.829 1.00 0.13 C ATOM 754 C LEU A 60 -6.484 -9.729 -2.119 1.00 0.13 C ATOM 755 O LEU A 60 -7.676 -9.661 -2.415 1.00 0.15 O ATOM 756 CB LEU A 60 -5.616 -9.259 0.114 1.00 0.13 C ATOM 757 CG LEU A 60 -5.761 -9.619 1.572 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.149 -8.545 2.439 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.228 -9.796 1.900 1.00 0.35 C ATOM 0 H LEU A 60 -4.074 -10.978 -0.710 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.898 -10.885 -0.393 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.573 -9.017 -0.088 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.197 -8.359 -0.087 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.236 -10.554 1.769 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.260 -8.817 3.489 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -4.090 -8.444 2.201 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.654 -7.597 2.255 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.337 -10.056 2.953 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.760 -8.866 1.699 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.645 -10.593 1.284 1.00 0.35 H new ATOM 771 N TYR A 61 -5.503 -9.276 -2.883 1.00 0.14 N ATOM 772 CA TYR A 61 -5.785 -8.667 -4.150 1.00 0.15 C ATOM 773 C TYR A 61 -6.634 -9.595 -4.975 1.00 0.17 C ATOM 774 O TYR A 61 -7.776 -9.315 -5.185 1.00 0.22 O ATOM 775 CB TYR A 61 -4.508 -8.359 -4.907 1.00 0.17 C ATOM 776 CG TYR A 61 -4.796 -7.679 -6.216 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.883 -6.845 -6.373 1.00 0.16 C ATOM 778 CD2 TYR A 61 -3.971 -7.897 -7.303 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.153 -6.249 -7.589 1.00 0.18 C ATOM 780 CE2 TYR A 61 -4.227 -7.304 -8.519 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.331 -6.369 -8.599 1.00 0.23 C ATOM 782 OH TYR A 61 -5.583 -5.903 -9.878 1.00 0.28 O ATOM 0 H TYR A 61 -4.513 -9.323 -2.640 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.314 -7.732 -3.967 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.867 -7.722 -4.298 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.959 -9.283 -5.088 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.533 -6.655 -5.532 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -3.112 -8.543 -7.197 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -7.059 -5.674 -7.708 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.624 -7.529 -9.386 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.820 -6.110 -10.458 1.00 0.28 H new ATOM 792 N ASN A 62 -6.114 -10.758 -5.296 1.00 0.18 N ATOM 793 CA ASN A 62 -6.734 -11.627 -6.280 1.00 0.22 C ATOM 794 C ASN A 62 -8.056 -12.170 -5.767 1.00 0.20 C ATOM 795 O ASN A 62 -8.939 -12.496 -6.559 1.00 0.24 O ATOM 796 CB ASN A 62 -5.803 -12.774 -6.668 1.00 0.27 C ATOM 797 CG ASN A 62 -5.977 -13.960 -5.761 1.00 0.75 C ATOM 798 OD1 ASN A 62 -6.715 -14.898 -6.063 1.00 1.21 O ATOM 799 ND2 ASN A 62 -5.319 -13.917 -4.634 1.00 1.12 N ATOM 0 H ASN A 62 -5.256 -11.129 -4.888 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.928 -11.030 -7.171 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -6.001 -13.071 -7.698 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -4.768 -12.433 -6.627 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -5.406 -14.681 -3.963 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -4.718 -13.120 -4.424 1.00 1.12 H new ATOM 806 N LYS A 63 -8.216 -12.255 -4.443 1.00 0.18 N ATOM 807 CA LYS A 63 -9.430 -12.813 -3.903 1.00 0.20 C ATOM 808 C LYS A 63 -10.495 -11.746 -3.955 1.00 0.18 C ATOM 809 O LYS A 63 -11.694 -12.035 -3.940 1.00 0.22 O ATOM 810 CB LYS A 63 -9.222 -13.320 -2.463 1.00 0.26 C ATOM 811 CG LYS A 63 -10.471 -13.930 -1.835 1.00 0.29 C ATOM 812 CD LYS A 63 -10.140 -14.817 -0.639 1.00 0.64 C ATOM 813 CE LYS A 63 -9.591 -14.020 0.536 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.412 -14.868 1.747 1.00 1.54 N ATOM 0 H LYS A 63 -7.531 -11.949 -3.751 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.736 -13.676 -4.495 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.426 -14.065 -2.462 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -8.883 -12.491 -1.842 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.143 -13.132 -1.519 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -11.003 -14.517 -2.584 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -11.037 -15.351 -0.326 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -9.410 -15.569 -0.938 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.635 -13.577 0.259 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -10.269 -13.198 0.765 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -8.898 -14.331 2.474 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.343 -15.147 2.116 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -8.870 -15.720 1.497 1.00 1.54 H new ATOM 828 N TYR A 64 -10.056 -10.494 -4.043 1.00 0.16 N ATOM 829 CA TYR A 64 -10.992 -9.408 -3.975 1.00 0.16 C ATOM 830 C TYR A 64 -10.921 -8.417 -5.129 1.00 0.17 C ATOM 831 O TYR A 64 -11.716 -7.475 -5.170 1.00 0.17 O ATOM 832 CB TYR A 64 -10.868 -8.742 -2.624 1.00 0.15 C ATOM 833 CG TYR A 64 -11.319 -9.669 -1.528 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.607 -10.179 -1.487 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.442 -10.010 -0.510 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.004 -11.009 -0.456 1.00 0.23 C ATOM 837 CE2 TYR A 64 -10.825 -10.835 0.515 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.192 -11.418 0.438 1.00 0.24 C ATOM 839 OH TYR A 64 -12.497 -12.158 1.573 1.00 0.31 O ATOM 0 H TYR A 64 -9.079 -10.223 -4.159 1.00 0.16 H new ATOM 0 HA TYR A 64 -11.988 -9.835 -4.088 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.833 -8.446 -2.453 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.467 -7.832 -2.606 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.308 -9.925 -2.269 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.436 -9.617 -0.525 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.037 -11.322 -0.406 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.165 -11.052 1.341 1.00 0.23 H new ATOM 0 HH TYR A 64 -11.936 -11.859 2.319 1.00 0.31 H new ATOM 849 N LYS A 65 -10.030 -8.641 -6.095 1.00 0.20 N ATOM 850 CA LYS A 65 -10.059 -7.858 -7.321 1.00 0.23 C ATOM 851 C LYS A 65 -11.393 -8.119 -7.945 1.00 0.20 C ATOM 852 O LYS A 65 -12.024 -7.244 -8.535 1.00 0.22 O ATOM 853 CB LYS A 65 -8.991 -8.242 -8.358 1.00 0.34 C ATOM 854 CG LYS A 65 -7.880 -9.175 -7.912 1.00 0.29 C ATOM 855 CD LYS A 65 -6.898 -9.400 -9.047 1.00 0.38 C ATOM 856 CE LYS A 65 -7.599 -9.887 -10.306 1.00 0.80 C ATOM 857 NZ LYS A 65 -6.680 -9.958 -11.472 1.00 1.35 N ATOM 0 H LYS A 65 -9.294 -9.346 -6.051 1.00 0.20 H new ATOM 0 HA LYS A 65 -9.868 -6.819 -7.052 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -9.497 -8.704 -9.206 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -8.532 -7.323 -8.723 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -7.362 -8.751 -7.052 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -8.302 -10.128 -7.592 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -6.369 -8.471 -9.261 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.149 -10.130 -8.741 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -8.027 -10.873 -10.123 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -8.428 -9.218 -10.540 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -7.202 -10.295 -12.306 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -6.291 -9.013 -11.665 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -5.903 -10.616 -11.262 1.00 1.35 H new ATOM 871 N SER A 66 -11.809 -9.359 -7.741 1.00 0.23 N ATOM 872 CA SER A 66 -13.085 -9.859 -8.216 1.00 0.26 C ATOM 873 C SER A 66 -14.232 -8.894 -7.889 1.00 0.25 C ATOM 874 O SER A 66 -15.178 -8.771 -8.662 1.00 0.31 O ATOM 875 CB SER A 66 -13.340 -11.219 -7.581 1.00 0.32 C ATOM 876 OG SER A 66 -12.157 -12.000 -7.583 1.00 1.28 O ATOM 0 H SER A 66 -11.261 -10.054 -7.234 1.00 0.23 H new ATOM 0 HA SER A 66 -13.045 -9.950 -9.301 1.00 0.26 H new ATOM 0 HB2 SER A 66 -13.694 -11.088 -6.558 1.00 0.32 H new ATOM 0 HB3 SER A 66 -14.127 -11.740 -8.127 1.00 0.32 H new ATOM 0 HG SER A 66 -12.339 -12.870 -7.170 1.00 1.28 H new ATOM 882 N GLN A 67 -14.153 -8.213 -6.751 1.00 0.21 N ATOM 883 CA GLN A 67 -15.144 -7.197 -6.417 1.00 0.20 C ATOM 884 C GLN A 67 -14.678 -5.794 -6.835 1.00 0.20 C ATOM 885 O GLN A 67 -15.482 -4.979 -7.290 1.00 0.27 O ATOM 886 CB GLN A 67 -15.474 -7.247 -4.925 1.00 0.21 C ATOM 887 CG GLN A 67 -16.250 -8.496 -4.536 1.00 0.38 C ATOM 888 CD GLN A 67 -16.501 -8.600 -3.048 1.00 0.52 C ATOM 889 OE1 GLN A 67 -15.615 -9.287 -2.348 1.00 1.11 O flip ATOM 890 NE2 GLN A 67 -17.497 -8.093 -2.534 1.00 0.46 N flip ATOM 0 H GLN A 67 -13.422 -8.344 -6.052 1.00 0.21 H new ATOM 0 HA GLN A 67 -16.052 -7.414 -6.979 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.548 -7.206 -4.351 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -16.055 -6.365 -4.656 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -17.205 -8.501 -5.061 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.700 -9.376 -4.868 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -18.157 -7.570 -3.109 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -17.662 -8.196 -1.533 1.00 0.46 H new ATOM 899 N GLY A 68 -13.380 -5.531 -6.713 1.00 0.17 N ATOM 900 CA GLY A 68 -12.831 -4.228 -7.045 1.00 0.18 C ATOM 901 C GLY A 68 -11.617 -3.892 -6.195 1.00 0.15 C ATOM 902 O GLY A 68 -11.004 -2.834 -6.354 1.00 0.17 O ATOM 0 H GLY A 68 -12.690 -6.208 -6.385 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.553 -4.209 -8.099 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.596 -3.465 -6.903 1.00 0.18 H new ATOM 906 N PHE A 69 -11.268 -4.810 -5.302 1.00 0.14 N ATOM 907 CA PHE A 69 -10.165 -4.622 -4.368 1.00 0.13 C ATOM 908 C PHE A 69 -8.826 -4.752 -5.068 1.00 0.14 C ATOM 909 O PHE A 69 -8.667 -5.582 -5.957 1.00 0.18 O ATOM 910 CB PHE A 69 -10.245 -5.665 -3.251 1.00 0.14 C ATOM 911 CG PHE A 69 -9.199 -5.496 -2.196 1.00 0.12 C ATOM 912 CD1 PHE A 69 -8.913 -4.241 -1.746 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.506 -6.573 -1.663 1.00 0.14 C ATOM 914 CE1 PHE A 69 -7.969 -4.029 -0.795 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.542 -6.372 -0.690 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.269 -5.093 -0.257 1.00 0.14 C ATOM 0 H PHE A 69 -11.743 -5.708 -5.205 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.248 -3.618 -3.951 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.229 -5.612 -2.786 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.152 -6.660 -3.687 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.449 -3.398 -2.155 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.720 -7.574 -2.009 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.763 -3.024 -0.457 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.007 -7.213 -0.273 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.514 -4.923 0.497 1.00 0.14 H new ATOM 926 N THR A 70 -7.865 -3.924 -4.684 1.00 0.13 N ATOM 927 CA THR A 70 -6.533 -4.060 -5.169 1.00 0.12 C ATOM 928 C THR A 70 -5.593 -3.934 -4.022 1.00 0.12 C ATOM 929 O THR A 70 -5.842 -3.188 -3.097 1.00 0.19 O ATOM 930 CB THR A 70 -6.215 -2.987 -6.209 1.00 0.15 C ATOM 931 OG1 THR A 70 -5.063 -3.344 -6.962 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.990 -1.644 -5.560 1.00 0.19 C ATOM 0 H THR A 70 -8.002 -3.151 -4.033 1.00 0.13 H new ATOM 0 HA THR A 70 -6.427 -5.035 -5.645 1.00 0.12 H new ATOM 0 HB THR A 70 -7.075 -2.915 -6.875 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.172 -4.251 -7.316 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.766 -0.902 -6.327 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.888 -1.346 -5.019 1.00 0.19 H new ATOM 0 HG23 THR A 70 -5.153 -1.711 -4.865 1.00 0.19 H new ATOM 940 N VAL A 71 -4.556 -4.695 -4.040 1.00 0.13 N ATOM 941 CA VAL A 71 -3.436 -4.366 -3.242 1.00 0.13 C ATOM 942 C VAL A 71 -2.399 -3.746 -4.140 1.00 0.13 C ATOM 943 O VAL A 71 -1.682 -4.444 -4.846 1.00 0.15 O ATOM 944 CB VAL A 71 -2.858 -5.592 -2.545 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.488 -5.273 -1.968 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.796 -6.066 -1.456 1.00 0.17 C ATOM 0 H VAL A 71 -4.463 -5.545 -4.596 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.743 -3.671 -2.460 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.746 -6.392 -3.277 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.087 -6.157 -1.473 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.816 -4.971 -2.771 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.577 -4.462 -1.245 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.371 -6.942 -0.966 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.933 -5.271 -0.723 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.760 -6.326 -1.894 1.00 0.17 H new ATOM 956 N LEU A 72 -2.325 -2.440 -4.136 1.00 0.17 N ATOM 957 CA LEU A 72 -1.294 -1.790 -4.913 1.00 0.22 C ATOM 958 C LEU A 72 -0.143 -1.494 -3.989 1.00 0.19 C ATOM 959 O LEU A 72 -0.293 -0.768 -3.016 1.00 0.28 O ATOM 960 CB LEU A 72 -1.741 -0.492 -5.626 1.00 0.43 C ATOM 961 CG LEU A 72 -3.205 -0.082 -5.552 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.667 0.133 -4.125 1.00 1.04 C ATOM 963 CD2 LEU A 72 -3.417 1.182 -6.349 1.00 1.00 C ATOM 0 H LEU A 72 -2.946 -1.817 -3.620 1.00 0.17 H new ATOM 0 HA LEU A 72 -1.017 -2.472 -5.717 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -1.148 0.328 -5.221 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.478 -0.587 -6.679 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.797 -0.896 -5.970 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.717 0.424 -4.123 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.545 -0.791 -3.560 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -3.071 0.921 -3.664 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -4.466 1.474 -6.295 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -2.797 1.979 -5.939 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -3.142 1.007 -7.389 1.00 1.00 H new ATOM 975 N ALA A 73 0.999 -2.056 -4.286 1.00 0.22 N ATOM 976 CA ALA A 73 2.146 -1.890 -3.425 1.00 0.30 C ATOM 977 C ALA A 73 3.114 -0.874 -3.994 1.00 0.23 C ATOM 978 O ALA A 73 3.330 -0.804 -5.188 1.00 0.32 O ATOM 979 CB ALA A 73 2.830 -3.217 -3.180 1.00 0.51 C ATOM 0 H ALA A 73 1.162 -2.631 -5.113 1.00 0.22 H new ATOM 0 HA ALA A 73 1.794 -1.510 -2.466 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.691 -3.068 -2.529 1.00 0.51 H new ATOM 0 HB2 ALA A 73 2.131 -3.905 -2.705 1.00 0.51 H new ATOM 0 HB3 ALA A 73 3.162 -3.636 -4.130 1.00 0.51 H new ATOM 985 N PHE A 74 3.668 -0.075 -3.125 1.00 0.29 N ATOM 986 CA PHE A 74 4.576 0.986 -3.493 1.00 0.33 C ATOM 987 C PHE A 74 5.913 0.747 -2.775 1.00 0.35 C ATOM 988 O PHE A 74 6.059 1.119 -1.611 1.00 0.37 O ATOM 989 CB PHE A 74 3.951 2.334 -3.076 1.00 0.44 C ATOM 990 CG PHE A 74 2.800 2.835 -3.944 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.964 1.913 -4.564 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.529 4.193 -4.131 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.894 2.326 -5.348 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.458 4.603 -4.898 1.00 0.43 C ATOM 995 CZ PHE A 74 0.745 3.822 -5.556 1.00 0.35 C ATOM 0 H PHE A 74 3.501 -0.141 -2.121 1.00 0.29 H new ATOM 0 HA PHE A 74 4.753 1.004 -4.568 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.594 2.244 -2.050 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.735 3.091 -3.075 1.00 0.44 H new ATOM 0 HD1 PHE A 74 2.150 0.857 -4.434 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.167 4.932 -3.669 1.00 0.41 H new ATOM 0 HE1 PHE A 74 0.205 1.620 -5.786 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.226 5.657 -4.930 1.00 0.43 H new ATOM 0 HZ PHE A 74 0.028 4.205 -6.267 1.00 0.35 H new ATOM 1005 N PRO A 75 6.905 0.109 -3.444 1.00 0.37 N ATOM 1006 CA PRO A 75 8.105 -0.407 -2.774 1.00 0.46 C ATOM 1007 C PRO A 75 9.150 0.650 -2.472 1.00 0.61 C ATOM 1008 O PRO A 75 10.210 0.668 -3.077 1.00 1.30 O ATOM 1009 CB PRO A 75 8.634 -1.441 -3.756 1.00 0.54 C ATOM 1010 CG PRO A 75 8.260 -0.903 -5.087 1.00 0.44 C ATOM 1011 CD PRO A 75 6.957 -0.143 -4.897 1.00 0.38 C ATOM 0 HA PRO A 75 7.866 -0.809 -1.789 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.713 -1.562 -3.664 1.00 0.54 H new ATOM 0 HB3 PRO A 75 8.188 -2.420 -3.582 1.00 0.54 H new ATOM 0 HG2 PRO A 75 9.039 -0.246 -5.472 1.00 0.44 H new ATOM 0 HG3 PRO A 75 8.137 -1.709 -5.810 1.00 0.44 H new ATOM 0 HD2 PRO A 75 6.950 0.787 -5.465 1.00 0.38 H new ATOM 0 HD3 PRO A 75 6.100 -0.728 -5.233 1.00 0.38 H new ATOM 1019 N SER A 76 8.804 1.464 -1.488 1.00 0.41 N ATOM 1020 CA SER A 76 9.598 2.568 -0.934 1.00 0.37 C ATOM 1021 C SER A 76 10.976 2.800 -1.538 1.00 0.50 C ATOM 1022 O SER A 76 11.828 1.913 -1.627 1.00 0.74 O ATOM 1023 CB SER A 76 9.707 2.356 0.580 1.00 0.53 C ATOM 1024 OG SER A 76 10.329 1.118 0.870 1.00 1.44 O ATOM 0 H SER A 76 7.903 1.372 -1.019 1.00 0.41 H new ATOM 0 HA SER A 76 9.060 3.479 -1.198 1.00 0.37 H new ATOM 0 HB2 SER A 76 10.280 3.169 1.025 1.00 0.53 H new ATOM 0 HB3 SER A 76 8.714 2.383 1.028 1.00 0.53 H new ATOM 0 HG SER A 76 9.728 0.384 0.623 1.00 1.44 H new ATOM 1388 N ALA A 100 4.782 -8.197 -8.040 1.00 0.51 N ATOM 1389 CA ALA A 100 4.034 -9.378 -7.646 1.00 0.43 C ATOM 1390 C ALA A 100 2.787 -9.551 -8.479 1.00 0.40 C ATOM 1391 O ALA A 100 2.664 -8.979 -9.564 1.00 0.55 O ATOM 1392 CB ALA A 100 3.644 -9.280 -6.191 1.00 0.43 C ATOM 0 HA ALA A 100 4.679 -10.242 -7.805 1.00 0.43 H new ATOM 0 HB1 ALA A 100 3.083 -10.170 -5.904 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.542 -9.203 -5.578 1.00 0.43 H new ATOM 0 HB3 ALA A 100 3.025 -8.396 -6.039 1.00 0.43 H new ATOM 1398 N GLU A 101 1.839 -10.313 -7.946 1.00 0.34 N ATOM 1399 CA GLU A 101 0.627 -10.623 -8.674 1.00 0.40 C ATOM 1400 C GLU A 101 -0.427 -9.532 -8.472 1.00 0.43 C ATOM 1401 O GLU A 101 -1.590 -9.687 -8.851 1.00 0.67 O ATOM 1402 CB GLU A 101 0.085 -11.991 -8.259 1.00 0.50 C ATOM 1403 CG GLU A 101 1.105 -13.115 -8.397 1.00 0.67 C ATOM 1404 CD GLU A 101 1.666 -13.243 -9.805 1.00 1.24 C ATOM 1405 OE1 GLU A 101 2.582 -12.473 -10.162 1.00 1.99 O ATOM 1406 OE2 GLU A 101 1.183 -14.102 -10.570 1.00 1.57 O ATOM 0 H GLU A 101 1.891 -10.724 -7.014 1.00 0.34 H new ATOM 0 HA GLU A 101 0.868 -10.661 -9.736 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.251 -11.941 -7.223 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -0.789 -12.227 -8.867 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.925 -12.941 -7.700 1.00 0.67 H new ATOM 0 HG3 GLU A 101 0.639 -14.058 -8.111 1.00 0.67 H new ATOM 1413 N PHE A 102 0.000 -8.429 -7.869 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.850 -7.277 -7.651 1.00 0.40 C ATOM 1415 C PHE A 102 -0.188 -6.031 -8.248 1.00 0.45 C ATOM 1416 O PHE A 102 0.914 -6.118 -8.786 1.00 0.80 O ATOM 1417 CB PHE A 102 -1.203 -7.114 -6.160 1.00 0.84 C ATOM 1418 CG PHE A 102 -0.142 -7.464 -5.178 1.00 0.45 C ATOM 1419 CD1 PHE A 102 0.205 -8.779 -4.969 1.00 0.52 C ATOM 1420 CD2 PHE A 102 0.535 -6.474 -4.498 1.00 0.62 C ATOM 1421 CE1 PHE A 102 1.217 -9.106 -4.091 1.00 0.59 C ATOM 1422 CE2 PHE A 102 1.539 -6.790 -3.614 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.772 -8.128 -3.297 1.00 0.44 C ATOM 0 H PHE A 102 0.951 -8.313 -7.518 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.800 -7.426 -8.165 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -1.494 -6.077 -5.991 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -2.078 -7.729 -5.949 1.00 0.84 H new ATOM 0 HD1 PHE A 102 -0.320 -9.562 -5.497 1.00 0.52 H new ATOM 0 HD2 PHE A 102 0.274 -5.439 -4.662 1.00 0.62 H new ATOM 0 HE1 PHE A 102 1.572 -10.124 -4.027 1.00 0.59 H new ATOM 0 HE2 PHE A 102 2.141 -6.011 -3.170 1.00 0.58 H new ATOM 0 HZ PHE A 102 2.378 -8.392 -2.443 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.875 -4.881 -8.242 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.380 -3.633 -8.837 1.00 0.39 C ATOM 1435 C PRO A 103 0.665 -2.929 -7.992 1.00 0.41 C ATOM 1436 O PRO A 103 0.354 -2.022 -7.229 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.646 -2.772 -8.957 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.770 -3.709 -8.678 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.216 -4.688 -7.710 1.00 0.27 C ATOM 0 HA PRO A 103 0.126 -3.820 -9.784 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.632 -1.947 -8.245 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.734 -2.334 -9.951 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -3.629 -3.183 -8.261 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -3.109 -4.202 -9.589 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -2.203 -4.298 -6.692 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.788 -5.615 -7.689 1.00 0.27 H new ATOM 1447 N ILE A 104 1.909 -3.341 -8.130 1.00 0.35 N ATOM 1448 CA ILE A 104 2.984 -2.645 -7.465 1.00 0.35 C ATOM 1449 C ILE A 104 3.426 -1.472 -8.327 1.00 0.33 C ATOM 1450 O ILE A 104 3.594 -1.603 -9.540 1.00 0.44 O ATOM 1451 CB ILE A 104 4.191 -3.553 -7.143 1.00 0.41 C ATOM 1452 CG1 ILE A 104 3.788 -4.690 -6.186 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.322 -2.725 -6.539 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.041 -5.816 -6.844 1.00 1.34 C ATOM 0 H ILE A 104 2.195 -4.144 -8.690 1.00 0.35 H new ATOM 0 HA ILE A 104 2.601 -2.295 -6.506 1.00 0.35 H new ATOM 0 HB ILE A 104 4.538 -4.004 -8.073 1.00 0.41 H new ATOM 0 HG12 ILE A 104 4.687 -5.091 -5.717 1.00 0.52 H new ATOM 0 HG13 ILE A 104 3.170 -4.276 -5.389 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.169 -3.374 -6.315 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.631 -1.958 -7.249 1.00 0.45 H new ATOM 0 HG23 ILE A 104 4.976 -2.251 -5.621 1.00 0.45 H new ATOM 0 HD11 ILE A 104 2.796 -6.574 -6.100 1.00 1.34 H new ATOM 0 HD12 ILE A 104 2.122 -5.433 -7.288 1.00 1.34 H new ATOM 0 HD13 ILE A 104 3.663 -6.259 -7.622 1.00 1.34 H new ATOM 1466 N MET A 105 3.576 -0.326 -7.688 1.00 0.29 N ATOM 1467 CA MET A 105 3.900 0.904 -8.373 1.00 0.30 C ATOM 1468 C MET A 105 5.404 1.049 -8.527 1.00 0.27 C ATOM 1469 O MET A 105 6.178 0.206 -8.077 1.00 0.35 O ATOM 1470 CB MET A 105 3.318 2.096 -7.601 1.00 0.43 C ATOM 1471 CG MET A 105 4.299 2.842 -6.710 1.00 1.50 C ATOM 1472 SD MET A 105 4.925 4.361 -7.456 1.00 2.49 S ATOM 1473 CE MET A 105 3.447 5.366 -7.501 1.00 3.03 C ATOM 0 H MET A 105 3.476 -0.226 -6.678 1.00 0.29 H new ATOM 0 HA MET A 105 3.460 0.880 -9.370 1.00 0.30 H new ATOM 0 HB2 MET A 105 2.898 2.801 -8.319 1.00 0.43 H new ATOM 0 HB3 MET A 105 2.493 1.739 -6.984 1.00 0.43 H new ATOM 0 HG2 MET A 105 3.811 3.083 -5.766 1.00 1.50 H new ATOM 0 HG3 MET A 105 5.138 2.187 -6.477 1.00 1.50 H new ATOM 0 HE1 MET A 105 3.482 6.026 -8.368 1.00 3.03 H new ATOM 0 HE2 MET A 105 2.571 4.721 -7.570 1.00 3.03 H new ATOM 0 HE3 MET A 105 3.386 5.964 -6.592 1.00 3.03 H new ATOM 1483 N ALA A 106 5.800 2.152 -9.133 1.00 0.33 N ATOM 1484 CA ALA A 106 7.187 2.404 -9.488 1.00 0.52 C ATOM 1485 C ALA A 106 8.030 2.819 -8.283 1.00 0.66 C ATOM 1486 O ALA A 106 9.116 3.367 -8.457 1.00 1.46 O ATOM 1487 CB ALA A 106 7.228 3.474 -10.544 1.00 0.70 C ATOM 0 H ALA A 106 5.165 2.905 -9.396 1.00 0.33 H new ATOM 0 HA ALA A 106 7.617 1.477 -9.867 1.00 0.52 H new ATOM 0 HB1 ALA A 106 8.263 3.673 -10.820 1.00 0.70 H new ATOM 0 HB2 ALA A 106 6.676 3.140 -11.423 1.00 0.70 H new ATOM 0 HB3 ALA A 106 6.774 4.386 -10.156 1.00 0.70 H new ATOM 1493 N LYS A 107 7.509 2.507 -7.088 1.00 0.40 N ATOM 1494 CA LYS A 107 8.059 2.906 -5.779 1.00 0.36 C ATOM 1495 C LYS A 107 8.336 4.380 -5.665 1.00 0.38 C ATOM 1496 O LYS A 107 9.005 5.006 -6.483 1.00 0.59 O ATOM 1497 CB LYS A 107 9.310 2.124 -5.379 1.00 0.49 C ATOM 1498 CG LYS A 107 10.568 2.432 -6.154 1.00 0.84 C ATOM 1499 CD LYS A 107 11.496 1.235 -6.141 1.00 0.83 C ATOM 1500 CE LYS A 107 12.375 1.211 -4.908 1.00 0.95 C ATOM 1501 NZ LYS A 107 13.162 -0.045 -4.821 1.00 1.76 N ATOM 0 H LYS A 107 6.660 1.948 -7.000 1.00 0.40 H new ATOM 0 HA LYS A 107 7.260 2.655 -5.081 1.00 0.36 H new ATOM 0 HB2 LYS A 107 9.505 2.308 -4.323 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.096 1.060 -5.483 1.00 0.49 H new ATOM 0 HG2 LYS A 107 10.316 2.695 -7.181 1.00 0.84 H new ATOM 0 HG3 LYS A 107 11.070 3.296 -5.718 1.00 0.84 H new ATOM 0 HD2 LYS A 107 10.907 0.319 -6.184 1.00 0.83 H new ATOM 0 HD3 LYS A 107 12.123 1.253 -7.033 1.00 0.83 H new ATOM 0 HE2 LYS A 107 13.052 2.065 -4.927 1.00 0.95 H new ATOM 0 HE3 LYS A 107 11.756 1.315 -4.017 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 13.752 -0.026 -3.965 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 12.515 -0.858 -4.778 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 13.771 -0.132 -5.659 1.00 1.76 H new ATOM 1515 N ILE A 108 7.801 4.919 -4.615 1.00 0.31 N ATOM 1516 CA ILE A 108 8.083 6.259 -4.237 1.00 0.35 C ATOM 1517 C ILE A 108 8.598 6.255 -2.809 1.00 0.36 C ATOM 1518 O ILE A 108 8.616 5.217 -2.141 1.00 0.42 O ATOM 1519 CB ILE A 108 6.839 7.163 -4.369 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.871 6.963 -3.200 1.00 0.82 C ATOM 1521 CG2 ILE A 108 6.143 6.891 -5.703 1.00 0.68 C ATOM 1522 CD1 ILE A 108 5.340 5.564 -3.053 1.00 0.64 C ATOM 0 H ILE A 108 7.152 4.434 -3.995 1.00 0.31 H new ATOM 0 HA ILE A 108 8.839 6.668 -4.907 1.00 0.35 H new ATOM 0 HB ILE A 108 7.166 8.202 -4.342 1.00 0.48 H new ATOM 0 HG12 ILE A 108 6.377 7.244 -2.276 1.00 0.82 H new ATOM 0 HG13 ILE A 108 5.030 7.645 -3.323 1.00 0.82 H new ATOM 0 HG21 ILE A 108 5.265 7.531 -5.793 1.00 0.68 H new ATOM 0 HG22 ILE A 108 6.831 7.102 -6.522 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.836 5.846 -5.747 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.664 5.519 -2.199 1.00 0.64 H new ATOM 0 HD12 ILE A 108 4.802 5.282 -3.958 1.00 0.64 H new ATOM 0 HD13 ILE A 108 6.169 4.875 -2.895 1.00 0.64 H new ATOM 1534 N ASN A 109 9.024 7.402 -2.373 1.00 0.38 N ATOM 1535 CA ASN A 109 9.543 7.614 -1.032 1.00 0.44 C ATOM 1536 C ASN A 109 8.459 7.511 0.031 1.00 0.47 C ATOM 1537 O ASN A 109 8.248 8.467 0.771 1.00 0.76 O ATOM 1538 CB ASN A 109 10.144 9.003 -1.001 1.00 0.53 C ATOM 1539 CG ASN A 109 11.653 9.009 -1.068 1.00 0.98 C ATOM 1540 OD1 ASN A 109 12.241 8.956 -2.147 1.00 1.73 O ATOM 1541 ND2 ASN A 109 12.291 9.096 0.085 1.00 1.16 N ATOM 0 H ASN A 109 9.025 8.246 -2.946 1.00 0.38 H new ATOM 0 HA ASN A 109 10.280 6.842 -0.809 1.00 0.44 H new ATOM 0 HB2 ASN A 109 9.749 9.580 -1.837 1.00 0.53 H new ATOM 0 HB3 ASN A 109 9.827 9.507 -0.088 1.00 0.53 H new ATOM 0 HD21 ASN A 109 13.311 9.122 0.103 1.00 1.16 H new ATOM 0 HD22 ASN A 109 11.764 9.138 0.957 1.00 1.16 H new ATOM 1548 N VAL A 110 7.770 6.369 0.127 1.00 0.41 N ATOM 1549 CA VAL A 110 6.747 6.233 1.155 1.00 0.42 C ATOM 1550 C VAL A 110 7.385 6.180 2.527 1.00 0.44 C ATOM 1551 O VAL A 110 7.791 5.124 3.013 1.00 0.48 O ATOM 1552 CB VAL A 110 5.884 4.969 0.973 1.00 0.43 C ATOM 1553 CG1 VAL A 110 4.598 5.305 0.262 1.00 0.60 C ATOM 1554 CG2 VAL A 110 6.635 3.899 0.213 1.00 0.77 C ATOM 0 H VAL A 110 7.898 5.555 -0.474 1.00 0.41 H new ATOM 0 HA VAL A 110 6.101 7.106 1.061 1.00 0.42 H new ATOM 0 HB VAL A 110 5.649 4.581 1.964 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.001 4.401 0.142 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.038 6.034 0.848 1.00 0.60 H new ATOM 0 HG13 VAL A 110 4.823 5.724 -0.719 1.00 0.60 H new ATOM 0 HG21 VAL A 110 6.001 3.020 0.100 1.00 0.77 H new ATOM 0 HG22 VAL A 110 6.910 4.277 -0.772 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.537 3.628 0.762 1.00 0.77 H new ATOM 1564 N ASN A 111 7.465 7.354 3.113 1.00 0.48 N ATOM 1565 CA ASN A 111 7.808 7.566 4.497 1.00 0.56 C ATOM 1566 C ASN A 111 7.887 9.064 4.687 1.00 0.62 C ATOM 1567 O ASN A 111 7.648 9.815 3.737 1.00 0.67 O ATOM 1568 CB ASN A 111 9.108 6.889 4.927 1.00 0.65 C ATOM 1569 CG ASN A 111 8.983 6.382 6.362 1.00 1.20 C ATOM 1570 OD1 ASN A 111 8.264 6.969 7.170 1.00 1.90 O ATOM 1571 ND2 ASN A 111 9.658 5.298 6.690 1.00 1.72 N ATOM 0 H ASN A 111 7.284 8.224 2.613 1.00 0.48 H new ATOM 0 HA ASN A 111 7.047 7.108 5.129 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.334 6.059 4.258 1.00 0.65 H new ATOM 0 HB3 ASN A 111 9.936 7.593 4.852 1.00 0.65 H new ATOM 0 HD21 ASN A 111 9.593 4.923 7.636 1.00 1.72 H new ATOM 0 HD22 ASN A 111 10.246 4.834 5.997 1.00 1.72 H new ATOM 1624 N HIS A 116 4.503 10.410 -0.990 1.00 0.42 N ATOM 1625 CA HIS A 116 3.937 10.671 -2.277 1.00 0.35 C ATOM 1626 C HIS A 116 2.568 11.236 -2.047 1.00 0.29 C ATOM 1627 O HIS A 116 1.872 10.727 -1.195 1.00 0.29 O ATOM 1628 CB HIS A 116 3.905 9.366 -3.081 1.00 0.35 C ATOM 1629 CG HIS A 116 2.979 9.372 -4.243 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.640 9.446 -4.057 1.00 0.33 N ATOM 1631 CD2 HIS A 116 3.174 9.368 -5.585 1.00 0.31 C ATOM 1632 CE1 HIS A 116 1.035 9.512 -5.204 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.934 9.462 -6.161 1.00 0.32 N ATOM 0 HA HIS A 116 4.524 11.386 -2.853 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.912 9.151 -3.438 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.623 8.552 -2.414 1.00 0.35 H new ATOM 0 HD2 HIS A 116 4.121 9.303 -6.099 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.032 9.594 -5.348 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.742 9.489 -7.162 1.00 0.32 H new ATOM 1642 N PRO A 117 2.181 12.285 -2.793 1.00 0.31 N ATOM 1643 CA PRO A 117 0.892 12.962 -2.672 1.00 0.31 C ATOM 1644 C PRO A 117 -0.234 12.053 -2.161 1.00 0.26 C ATOM 1645 O PRO A 117 -0.961 12.417 -1.252 1.00 0.27 O ATOM 1646 CB PRO A 117 0.623 13.415 -4.111 1.00 0.37 C ATOM 1647 CG PRO A 117 1.948 13.394 -4.821 1.00 0.40 C ATOM 1648 CD PRO A 117 2.986 12.925 -3.835 1.00 0.38 C ATOM 0 HA PRO A 117 0.921 13.769 -1.940 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.089 12.751 -4.600 1.00 0.37 H new ATOM 0 HB3 PRO A 117 0.190 14.415 -4.128 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.910 12.728 -5.683 1.00 0.40 H new ATOM 0 HG3 PRO A 117 2.197 14.387 -5.196 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.688 12.226 -4.289 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.572 13.755 -3.440 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.336 10.857 -2.733 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.335 9.873 -2.340 1.00 0.23 C ATOM 1658 C LEU A 118 -1.124 9.382 -0.899 1.00 0.27 C ATOM 1659 O LEU A 118 -2.042 9.411 -0.088 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.281 8.717 -3.322 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.157 7.522 -3.005 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.611 7.886 -3.201 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.776 6.335 -3.873 1.00 0.27 C ATOM 0 H LEU A 118 0.276 10.543 -3.486 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.320 10.338 -2.364 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.559 9.092 -4.307 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.248 8.375 -3.391 1.00 0.24 H new ATOM 0 HG LEU A 118 -2.005 7.238 -1.964 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.236 7.023 -2.972 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -3.872 8.710 -2.537 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.774 8.188 -4.236 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.416 5.487 -3.631 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.903 6.597 -4.923 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.735 6.069 -3.689 1.00 0.27 H new ATOM 1675 N TYR A 119 0.092 8.952 -0.577 1.00 0.32 N ATOM 1676 CA TYR A 119 0.382 8.435 0.754 1.00 0.42 C ATOM 1677 C TYR A 119 0.541 9.556 1.733 1.00 0.40 C ATOM 1678 O TYR A 119 0.241 9.406 2.910 1.00 0.41 O ATOM 1679 CB TYR A 119 1.638 7.595 0.772 1.00 0.57 C ATOM 1680 CG TYR A 119 1.405 6.191 0.327 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.329 5.890 -1.014 1.00 0.92 C ATOM 1682 CD2 TYR A 119 1.275 5.166 1.251 1.00 1.09 C ATOM 1683 CE1 TYR A 119 1.139 4.604 -1.436 1.00 1.74 C ATOM 1684 CE2 TYR A 119 1.080 3.868 0.839 1.00 1.88 C ATOM 1685 CZ TYR A 119 1.016 3.591 -0.507 1.00 2.20 C ATOM 1686 OH TYR A 119 0.843 2.299 -0.924 1.00 3.04 O ATOM 0 H TYR A 119 0.887 8.951 -1.216 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.463 7.808 1.037 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.386 8.056 0.127 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.049 7.587 1.781 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.421 6.681 -1.743 1.00 0.92 H new ATOM 0 HD2 TYR A 119 1.327 5.389 2.306 1.00 1.09 H new ATOM 0 HE1 TYR A 119 1.085 4.382 -2.492 1.00 1.74 H new ATOM 0 HE2 TYR A 119 0.978 3.075 1.565 1.00 1.88 H new ATOM 0 HH TYR A 119 1.435 2.119 -1.684 1.00 3.04 H new ATOM 1696 N GLU A 120 1.042 10.668 1.243 1.00 0.40 N ATOM 1697 CA GLU A 120 1.091 11.867 2.025 1.00 0.42 C ATOM 1698 C GLU A 120 -0.320 12.191 2.402 1.00 0.37 C ATOM 1699 O GLU A 120 -0.597 12.545 3.535 1.00 0.43 O ATOM 1700 CB GLU A 120 1.706 13.016 1.230 1.00 0.50 C ATOM 1701 CG GLU A 120 2.609 13.901 2.061 1.00 0.76 C ATOM 1702 CD GLU A 120 1.943 14.385 3.336 1.00 1.58 C ATOM 1703 OE1 GLU A 120 1.146 15.341 3.262 1.00 2.44 O ATOM 1704 OE2 GLU A 120 2.219 13.819 4.415 1.00 1.93 O ATOM 0 H GLU A 120 1.421 10.759 0.301 1.00 0.40 H new ATOM 0 HA GLU A 120 1.714 11.724 2.908 1.00 0.42 H new ATOM 0 HB2 GLU A 120 2.276 12.607 0.396 1.00 0.50 H new ATOM 0 HB3 GLU A 120 0.907 13.622 0.803 1.00 0.50 H new ATOM 0 HG2 GLU A 120 3.515 13.351 2.315 1.00 0.76 H new ATOM 0 HG3 GLU A 120 2.915 14.762 1.466 1.00 0.76 H new ATOM 1711 N TYR A 121 -1.225 11.983 1.458 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.636 12.166 1.761 1.00 0.28 C ATOM 1713 C TYR A 121 -3.095 11.126 2.775 1.00 0.27 C ATOM 1714 O TYR A 121 -3.963 11.384 3.608 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.494 12.084 0.498 1.00 0.28 C ATOM 1716 CG TYR A 121 -4.973 12.060 0.777 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.684 13.237 0.950 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.653 10.859 0.885 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -7.035 13.217 1.220 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -7.001 10.828 1.159 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.690 12.010 1.326 1.00 0.46 C ATOM 1722 OH TYR A 121 -9.037 11.984 1.599 1.00 0.56 O ATOM 0 H TYR A 121 -1.017 11.695 0.502 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.760 13.162 2.187 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.267 12.937 -0.142 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -3.223 11.187 -0.058 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -5.171 14.184 0.872 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -5.117 9.931 0.752 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.577 14.142 1.348 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.516 9.883 1.243 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.345 11.054 1.639 1.00 0.56 H new ATOM 1732 N MET A 122 -2.471 9.967 2.723 1.00 0.27 N ATOM 1733 CA MET A 122 -2.929 8.821 3.483 1.00 0.29 C ATOM 1734 C MET A 122 -2.573 8.972 4.950 1.00 0.33 C ATOM 1735 O MET A 122 -3.444 8.922 5.812 1.00 0.35 O ATOM 1736 CB MET A 122 -2.361 7.534 2.907 1.00 0.33 C ATOM 1737 CG MET A 122 -3.435 6.504 2.649 1.00 0.71 C ATOM 1738 SD MET A 122 -3.009 5.380 1.315 1.00 0.56 S ATOM 1739 CE MET A 122 -3.202 6.487 -0.065 1.00 0.55 C ATOM 0 H MET A 122 -1.640 9.793 2.158 1.00 0.27 H new ATOM 0 HA MET A 122 -4.015 8.770 3.408 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.839 7.754 1.976 1.00 0.33 H new ATOM 0 HB3 MET A 122 -1.624 7.123 3.597 1.00 0.33 H new ATOM 0 HG2 MET A 122 -3.610 5.931 3.560 1.00 0.71 H new ATOM 0 HG3 MET A 122 -4.369 7.011 2.407 1.00 0.71 H new ATOM 0 HE1 MET A 122 -3.911 6.062 -0.776 1.00 0.55 H new ATOM 0 HE2 MET A 122 -3.575 7.448 0.289 1.00 0.55 H new ATOM 0 HE3 MET A 122 -2.239 6.629 -0.555 1.00 0.55 H new ATOM 1749 N LYS A 123 -1.292 9.179 5.228 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.842 9.402 6.594 1.00 0.45 C ATOM 1751 C LYS A 123 -1.291 10.763 7.105 1.00 0.47 C ATOM 1752 O LYS A 123 -1.427 10.958 8.306 1.00 0.54 O ATOM 1753 CB LYS A 123 0.679 9.254 6.739 1.00 0.53 C ATOM 1754 CG LYS A 123 1.471 9.725 5.537 1.00 0.48 C ATOM 1755 CD LYS A 123 2.930 10.005 5.881 1.00 1.00 C ATOM 1756 CE LYS A 123 3.072 11.027 7.003 1.00 1.05 C ATOM 1757 NZ LYS A 123 2.828 12.422 6.548 1.00 1.46 N ATOM 0 H LYS A 123 -0.550 9.197 4.528 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.306 8.627 7.204 1.00 0.45 H new ATOM 0 HB2 LYS A 123 1.004 9.814 7.615 1.00 0.53 H new ATOM 0 HB3 LYS A 123 0.914 8.206 6.926 1.00 0.53 H new ATOM 0 HG2 LYS A 123 1.423 8.969 4.754 1.00 0.48 H new ATOM 0 HG3 LYS A 123 1.014 10.629 5.135 1.00 0.48 H new ATOM 0 HD2 LYS A 123 3.417 9.075 6.175 1.00 1.00 H new ATOM 0 HD3 LYS A 123 3.447 10.369 4.993 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.371 10.783 7.801 1.00 1.05 H new ATOM 0 HE3 LYS A 123 4.074 10.958 7.426 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 3.599 13.035 6.880 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 2.789 12.446 5.509 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 1.925 12.761 6.937 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.516 11.719 6.209 1.00 0.43 N ATOM 1772 CA LYS A 124 -1.978 13.019 6.657 1.00 0.50 C ATOM 1773 C LYS A 124 -3.438 12.933 7.089 1.00 0.49 C ATOM 1774 O LYS A 124 -3.900 13.715 7.918 1.00 0.57 O ATOM 1775 CB LYS A 124 -1.760 14.118 5.606 1.00 0.56 C ATOM 1776 CG LYS A 124 -2.902 14.326 4.623 1.00 0.59 C ATOM 1777 CD LYS A 124 -2.504 15.259 3.476 1.00 0.97 C ATOM 1778 CE LYS A 124 -2.117 16.662 3.945 1.00 1.41 C ATOM 1779 NZ LYS A 124 -0.762 16.714 4.566 1.00 1.99 N ATOM 0 H LYS A 124 -1.390 11.621 5.202 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.375 13.307 7.518 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.575 15.059 6.124 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -0.858 13.882 5.042 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -3.212 13.363 4.217 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.762 14.742 5.148 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -1.666 14.820 2.934 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -3.334 15.334 2.773 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -2.148 17.345 3.096 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -2.855 17.015 4.665 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -0.275 17.582 4.264 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -0.855 16.711 5.602 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -0.210 15.885 4.266 1.00 1.99 H new ATOM 1793 N THR A 125 -4.157 11.973 6.520 1.00 0.42 N ATOM 1794 CA THR A 125 -5.535 11.711 6.923 1.00 0.44 C ATOM 1795 C THR A 125 -5.569 10.771 8.129 1.00 0.44 C ATOM 1796 O THR A 125 -6.331 10.977 9.076 1.00 0.56 O ATOM 1797 CB THR A 125 -6.353 11.096 5.766 1.00 0.49 C ATOM 1798 OG1 THR A 125 -6.306 11.963 4.623 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.805 10.872 6.173 1.00 0.59 C ATOM 0 H THR A 125 -3.810 11.363 5.779 1.00 0.42 H new ATOM 0 HA THR A 125 -5.985 12.666 7.194 1.00 0.44 H new ATOM 0 HB THR A 125 -5.912 10.130 5.518 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.585 11.676 4.025 1.00 0.57 H new ATOM 0 HG21 THR A 125 -8.354 10.438 5.337 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.844 10.192 7.024 1.00 0.59 H new ATOM 0 HG23 THR A 125 -8.257 11.825 6.449 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.724 9.752 8.096 1.00 0.44 N ATOM 1808 CA LYS A 126 -4.647 8.775 9.170 1.00 0.54 C ATOM 1809 C LYS A 126 -3.186 8.384 9.387 1.00 0.57 C ATOM 1810 O LYS A 126 -2.682 7.442 8.772 1.00 0.68 O ATOM 1811 CB LYS A 126 -5.495 7.549 8.811 1.00 0.78 C ATOM 1812 CG LYS A 126 -5.952 6.751 10.018 1.00 1.26 C ATOM 1813 CD LYS A 126 -7.091 5.815 9.659 1.00 0.92 C ATOM 1814 CE LYS A 126 -7.801 5.291 10.898 1.00 1.27 C ATOM 1815 NZ LYS A 126 -6.979 4.322 11.675 1.00 1.85 N ATOM 0 H LYS A 126 -4.075 9.580 7.328 1.00 0.44 H new ATOM 0 HA LYS A 126 -5.037 9.202 10.094 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -6.370 7.875 8.249 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -4.918 6.899 8.153 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -5.116 6.175 10.414 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -6.272 7.432 10.807 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -7.806 6.339 9.024 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.704 4.977 9.079 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -8.066 6.131 11.540 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -8.733 4.811 10.600 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -7.364 4.233 12.637 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -7.001 3.394 11.206 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -5.997 4.661 11.725 1.00 1.85 H new ATOM 1985 N TRP A 137 6.285 0.680 8.660 1.00 0.69 N ATOM 1986 CA TRP A 137 7.148 -0.444 8.349 1.00 0.45 C ATOM 1987 C TRP A 137 7.195 -0.691 6.858 1.00 0.43 C ATOM 1988 O TRP A 137 6.760 0.146 6.075 1.00 0.55 O ATOM 1989 CB TRP A 137 6.643 -1.715 9.062 1.00 0.42 C ATOM 1990 CG TRP A 137 7.424 -2.110 10.269 1.00 0.62 C ATOM 1991 CD1 TRP A 137 7.937 -3.340 10.564 1.00 0.93 C ATOM 1992 CD2 TRP A 137 7.763 -1.265 11.351 1.00 1.00 C ATOM 1993 NE1 TRP A 137 8.589 -3.288 11.773 1.00 1.11 N ATOM 1994 CE2 TRP A 137 8.499 -2.016 12.267 1.00 1.16 C ATOM 1995 CE3 TRP A 137 7.515 0.064 11.614 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 8.991 -1.468 13.443 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 8.002 0.623 12.773 1.00 1.97 C ATOM 1998 CH2 TRP A 137 8.743 -0.143 13.679 1.00 1.97 C ATOM 0 HA TRP A 137 8.152 -0.204 8.698 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.604 -1.562 9.354 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.656 -2.542 8.352 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.845 -4.219 9.943 1.00 0.93 H new ATOM 0 HE1 TRP A 137 9.062 -4.069 12.227 1.00 1.11 H new ATOM 0 HE3 TRP A 137 6.944 0.661 10.918 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 9.550 -2.066 14.147 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 7.810 1.664 12.986 1.00 1.97 H new ATOM 0 HH2 TRP A 137 9.125 0.318 14.578 1.00 1.97 H new ATOM 2009 N ASN A 138 7.891 -1.764 6.515 1.00 0.37 N ATOM 2010 CA ASN A 138 7.716 -2.514 5.258 1.00 0.38 C ATOM 2011 C ASN A 138 6.240 -2.539 4.806 1.00 0.31 C ATOM 2012 O ASN A 138 5.510 -1.603 5.013 1.00 0.30 O ATOM 2013 CB ASN A 138 8.182 -3.958 5.456 1.00 0.41 C ATOM 2014 CG ASN A 138 9.537 -4.063 6.134 1.00 1.06 C ATOM 2015 OD1 ASN A 138 9.621 -4.129 7.357 1.00 2.04 O ATOM 2016 ND2 ASN A 138 10.599 -4.095 5.348 1.00 1.40 N ATOM 0 H ASN A 138 8.617 -2.157 7.114 1.00 0.37 H new ATOM 0 HA ASN A 138 8.308 -2.013 4.492 1.00 0.38 H new ATOM 0 HB2 ASN A 138 7.443 -4.493 6.052 1.00 0.41 H new ATOM 0 HB3 ASN A 138 8.229 -4.454 4.486 1.00 0.41 H new ATOM 0 HD21 ASN A 138 11.531 -4.177 5.754 1.00 1.40 H new ATOM 0 HD22 ASN A 138 10.486 -4.038 4.336 1.00 1.40 H new ATOM 2023 N PHE A 139 5.868 -3.597 4.095 1.00 0.34 N ATOM 2024 CA PHE A 139 4.563 -3.767 3.405 1.00 0.36 C ATOM 2025 C PHE A 139 3.320 -3.043 3.999 1.00 0.32 C ATOM 2026 O PHE A 139 2.339 -2.944 3.279 1.00 0.57 O ATOM 2027 CB PHE A 139 4.272 -5.255 3.364 1.00 0.55 C ATOM 2028 CG PHE A 139 4.390 -5.868 2.007 1.00 0.55 C ATOM 2029 CD1 PHE A 139 5.639 -5.971 1.431 1.00 0.61 C ATOM 2030 CD2 PHE A 139 3.273 -6.321 1.293 1.00 1.23 C ATOM 2031 CE1 PHE A 139 5.800 -6.510 0.181 1.00 1.22 C ATOM 2032 CE2 PHE A 139 3.435 -6.859 0.032 1.00 1.93 C ATOM 2033 CZ PHE A 139 4.517 -7.058 -0.492 1.00 1.89 C ATOM 0 H PHE A 139 6.482 -4.402 3.969 1.00 0.34 H new ATOM 0 HA PHE A 139 4.696 -3.291 2.434 1.00 0.36 H new ATOM 0 HB2 PHE A 139 4.957 -5.766 4.041 1.00 0.55 H new ATOM 0 HB3 PHE A 139 3.264 -5.427 3.741 1.00 0.55 H new ATOM 0 HD1 PHE A 139 6.505 -5.621 1.974 1.00 0.61 H new ATOM 0 HD2 PHE A 139 2.287 -6.249 1.728 1.00 1.23 H new ATOM 0 HE1 PHE A 139 6.763 -6.550 -0.305 1.00 1.22 H new ATOM 0 HE2 PHE A 139 2.547 -7.120 -0.525 1.00 1.93 H new ATOM 0 HZ PHE A 139 4.581 -7.611 -1.417 1.00 1.89 H new ATOM 2043 N THR A 140 3.316 -2.651 5.288 1.00 0.25 N ATOM 2044 CA THR A 140 2.283 -1.788 5.887 1.00 0.25 C ATOM 2045 C THR A 140 1.310 -1.181 4.867 1.00 0.22 C ATOM 2046 O THR A 140 1.669 -0.340 4.042 1.00 0.29 O ATOM 2047 CB THR A 140 2.930 -0.630 6.664 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.175 -1.055 7.220 1.00 0.48 O ATOM 2049 CG2 THR A 140 2.020 -0.146 7.778 1.00 0.60 C ATOM 0 H THR A 140 4.040 -2.929 5.950 1.00 0.25 H new ATOM 0 HA THR A 140 1.714 -2.444 6.546 1.00 0.25 H new ATOM 0 HB THR A 140 3.097 0.193 5.969 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.834 -1.162 6.503 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.502 0.673 8.311 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.078 0.202 7.353 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.825 -0.965 8.470 1.00 0.60 H new ATOM 2057 N SER A 141 0.077 -1.609 4.961 1.00 0.19 N ATOM 2058 CA SER A 141 -0.954 -1.244 4.007 1.00 0.20 C ATOM 2059 C SER A 141 -1.664 0.013 4.464 1.00 0.22 C ATOM 2060 O SER A 141 -1.435 0.474 5.569 1.00 0.39 O ATOM 2061 CB SER A 141 -1.953 -2.376 3.937 1.00 0.26 C ATOM 2062 OG SER A 141 -1.317 -3.614 4.188 1.00 0.62 O ATOM 0 H SER A 141 -0.248 -2.226 5.706 1.00 0.19 H new ATOM 0 HA SER A 141 -0.505 -1.062 3.031 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.747 -2.214 4.666 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.422 -2.394 2.953 1.00 0.26 H new ATOM 0 HG SER A 141 -1.033 -4.014 3.340 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.515 0.564 3.618 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.517 1.490 4.061 1.00 0.18 C ATOM 2070 C PHE A 142 -4.817 0.941 3.555 1.00 0.18 C ATOM 2071 O PHE A 142 -4.982 0.754 2.364 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.319 2.892 3.500 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.472 3.810 4.333 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -3.017 4.461 5.428 1.00 0.35 C ATOM 2075 CD2 PHE A 142 -1.154 4.065 3.996 1.00 0.42 C ATOM 2076 CE1 PHE A 142 -2.264 5.348 6.172 1.00 0.50 C ATOM 2077 CE2 PHE A 142 -0.395 4.947 4.742 1.00 0.55 C ATOM 2078 CZ PHE A 142 -0.951 5.590 5.827 1.00 0.57 C ATOM 0 H PHE A 142 -2.524 0.379 2.615 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.476 1.587 5.146 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -2.868 2.808 2.511 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.298 3.352 3.366 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -4.044 4.272 5.703 1.00 0.35 H new ATOM 0 HD2 PHE A 142 -0.715 3.570 3.142 1.00 0.42 H new ATOM 0 HE1 PHE A 142 -2.702 5.851 7.022 1.00 0.50 H new ATOM 0 HE2 PHE A 142 0.635 5.133 4.474 1.00 0.55 H new ATOM 0 HZ PHE A 142 -0.359 6.283 6.406 1.00 0.57 H new ATOM 2088 N LEU A 143 -5.730 0.647 4.423 1.00 0.17 N ATOM 2089 CA LEU A 143 -6.966 0.102 3.960 1.00 0.16 C ATOM 2090 C LEU A 143 -7.819 1.223 3.450 1.00 0.15 C ATOM 2091 O LEU A 143 -8.347 2.023 4.197 1.00 0.18 O ATOM 2092 CB LEU A 143 -7.654 -0.680 5.059 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.185 -0.664 5.017 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -9.724 -1.611 3.957 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -9.760 -0.998 6.378 1.00 0.43 C ATOM 0 H LEU A 143 -5.649 0.770 5.432 1.00 0.17 H new ATOM 0 HA LEU A 143 -6.785 -0.601 3.147 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.317 -1.715 5.011 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.330 -0.284 6.021 1.00 0.21 H new ATOM 0 HG LEU A 143 -9.498 0.344 4.747 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -10.813 -1.574 3.956 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.349 -1.312 2.978 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.396 -2.627 4.176 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -10.849 -0.981 6.327 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -9.426 -1.990 6.681 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -9.420 -0.263 7.107 1.00 0.43 H new ATOM 2107 N ILE A 144 -7.898 1.279 2.154 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.609 2.311 1.464 1.00 0.14 C ATOM 2109 C ILE A 144 -10.024 1.818 1.215 1.00 0.15 C ATOM 2110 O ILE A 144 -10.219 0.630 0.988 1.00 0.19 O ATOM 2111 CB ILE A 144 -7.903 2.599 0.132 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.424 2.917 0.341 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.603 3.717 -0.602 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.162 4.096 1.225 1.00 0.19 C ATOM 0 H ILE A 144 -7.461 0.595 1.536 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.636 3.229 2.052 1.00 0.14 H new ATOM 0 HB ILE A 144 -7.956 1.699 -0.481 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -5.934 2.042 0.769 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -5.963 3.097 -0.630 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -8.091 3.910 -1.545 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.636 3.431 -0.802 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.589 4.619 0.010 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.087 4.249 1.318 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.619 4.985 0.791 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.589 3.913 2.211 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.010 2.701 1.255 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.401 2.234 1.224 1.00 0.15 C ATOM 2128 C ASP A 145 -12.989 2.331 -0.182 1.00 0.14 C ATOM 2129 O ASP A 145 -12.272 2.656 -1.128 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.260 2.987 2.254 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.151 4.061 1.659 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -13.606 5.050 1.125 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.383 3.940 1.743 1.00 0.75 O ATOM 0 H ASP A 145 -10.889 3.712 1.307 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.406 1.180 1.502 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -13.883 2.268 2.785 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.602 3.445 2.993 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.285 2.032 -0.311 1.00 0.17 N ATOM 2139 CA ARG A 146 -14.960 2.007 -1.607 1.00 0.17 C ATOM 2140 C ARG A 146 -14.713 3.288 -2.387 1.00 0.18 C ATOM 2141 O ARG A 146 -14.462 3.260 -3.589 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.467 1.843 -1.430 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.879 0.710 -0.511 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.390 0.537 -0.524 1.00 0.29 C ATOM 2145 NE ARG A 146 -19.074 1.826 -0.378 1.00 1.00 N ATOM 2146 CZ ARG A 146 -20.277 2.107 -0.882 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -21.004 1.161 -1.457 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -20.767 3.336 -0.777 1.00 2.22 N ATOM 0 H ARG A 146 -14.891 1.802 0.477 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.551 1.160 -2.158 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -16.877 2.775 -1.041 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.918 1.681 -2.409 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.398 -0.216 -0.827 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.539 0.915 0.504 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.696 0.064 -1.457 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.689 -0.130 0.285 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.596 2.559 0.146 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.645 0.208 -1.517 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -21.923 1.385 -1.839 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -20.224 4.063 -0.312 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -21.686 3.553 -1.162 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.775 4.411 -1.691 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.664 5.701 -2.339 1.00 0.21 C ATOM 2164 C ASP A 147 -13.252 6.228 -2.202 1.00 0.18 C ATOM 2165 O ASP A 147 -13.012 7.424 -2.324 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.657 6.702 -1.739 1.00 0.28 C ATOM 2167 CG ASP A 147 -17.099 6.341 -2.026 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.590 6.668 -3.130 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -17.754 5.744 -1.145 1.00 2.00 O ATOM 0 H ASP A 147 -14.901 4.453 -0.680 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.901 5.575 -3.396 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.508 6.753 -0.660 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.450 7.695 -2.137 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.318 5.317 -1.960 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.928 5.683 -1.844 1.00 0.16 C ATOM 2176 C GLY A 148 -10.597 6.438 -0.577 1.00 0.15 C ATOM 2177 O GLY A 148 -9.736 7.310 -0.586 1.00 0.17 O ATOM 0 H GLY A 148 -12.506 4.322 -1.842 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.320 4.779 -1.886 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.651 6.294 -2.703 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.260 6.127 0.520 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.920 6.769 1.776 1.00 0.18 C ATOM 2183 C VAL A 149 -10.300 5.778 2.764 1.00 0.17 C ATOM 2184 O VAL A 149 -10.976 4.891 3.283 1.00 0.24 O ATOM 2185 CB VAL A 149 -12.138 7.463 2.419 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -11.731 8.213 3.680 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -12.797 8.409 1.424 1.00 1.12 C ATOM 0 H VAL A 149 -12.021 5.449 0.569 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.180 7.534 1.541 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.860 6.696 2.699 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -12.607 8.694 4.116 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -11.307 7.512 4.399 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -10.988 8.970 3.429 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -13.655 8.891 1.893 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -12.079 9.168 1.114 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -13.129 7.846 0.552 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.979 5.902 2.973 1.00 0.21 N ATOM 2198 CA PRO A 150 -8.224 5.149 3.981 1.00 0.20 C ATOM 2199 C PRO A 150 -8.936 5.116 5.342 1.00 0.23 C ATOM 2200 O PRO A 150 -9.159 6.157 5.967 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.909 5.933 4.118 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.949 7.032 3.099 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.114 6.781 2.197 1.00 0.41 C ATOM 0 HA PRO A 150 -8.097 4.109 3.682 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.806 6.342 5.123 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -6.052 5.281 3.950 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -7.047 8.002 3.587 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.022 7.055 2.527 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.622 7.709 1.933 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -7.802 6.312 1.264 1.00 0.41 H new ATOM 2211 N VAL A 151 -9.277 3.921 5.789 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.922 3.708 7.072 1.00 0.29 C ATOM 2213 C VAL A 151 -8.893 3.179 8.030 1.00 0.32 C ATOM 2214 O VAL A 151 -9.042 3.246 9.246 1.00 0.61 O ATOM 2215 CB VAL A 151 -11.019 2.631 6.996 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -12.059 2.843 8.082 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.670 2.587 5.622 1.00 1.13 C ATOM 0 H VAL A 151 -9.112 3.061 5.265 1.00 0.22 H new ATOM 0 HA VAL A 151 -10.359 4.657 7.382 1.00 0.29 H new ATOM 0 HB VAL A 151 -10.542 1.665 7.161 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -12.824 2.070 8.009 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -11.580 2.788 9.060 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -12.520 3.823 7.958 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.439 1.814 5.608 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -12.123 3.554 5.403 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -10.915 2.361 4.869 1.00 1.13 H new ATOM 2227 N GLU A 152 -7.848 2.636 7.446 1.00 0.19 N ATOM 2228 CA GLU A 152 -6.879 1.864 8.179 1.00 0.20 C ATOM 2229 C GLU A 152 -5.531 1.925 7.517 1.00 0.20 C ATOM 2230 O GLU A 152 -5.380 2.430 6.413 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.295 0.391 8.246 1.00 0.21 C ATOM 2232 CG GLU A 152 -7.363 -0.198 9.639 1.00 0.57 C ATOM 2233 CD GLU A 152 -7.822 0.792 10.697 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -7.038 1.713 11.041 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -8.952 0.645 11.202 1.00 1.17 O ATOM 0 H GLU A 152 -7.649 2.719 6.449 1.00 0.19 H new ATOM 0 HA GLU A 152 -6.826 2.289 9.181 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -8.273 0.285 7.776 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -6.592 -0.196 7.655 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -8.043 -1.050 9.631 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -6.379 -0.578 9.912 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.562 1.468 8.249 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.304 1.029 7.699 1.00 0.24 C ATOM 2244 C ARG A 153 -2.873 -0.188 8.490 1.00 0.25 C ATOM 2245 O ARG A 153 -2.882 -0.171 9.724 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.249 2.132 7.737 1.00 0.36 C ATOM 2247 CG ARG A 153 -1.009 1.788 8.544 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.249 3.043 8.913 1.00 0.47 C ATOM 2249 NE ARG A 153 -1.133 4.172 9.235 1.00 0.65 N ATOM 2250 CZ ARG A 153 -1.993 4.201 10.257 1.00 1.51 C ATOM 2251 NH1 ARG A 153 -2.119 3.155 11.069 1.00 2.16 N ATOM 2252 NH2 ARG A 153 -2.736 5.280 10.456 1.00 1.85 N ATOM 0 H ARG A 153 -4.618 1.386 9.264 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.421 0.776 6.645 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -1.949 2.366 6.716 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.699 3.034 8.152 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -1.294 1.250 9.448 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.366 1.123 7.967 1.00 0.40 H new ATOM 0 HD2 ARG A 153 0.393 2.835 9.769 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.404 3.323 8.086 1.00 0.47 H new ATOM 0 HE ARG A 153 -1.087 4.995 8.634 1.00 0.65 H new ATOM 0 HH11 ARG A 153 -1.556 2.319 10.915 1.00 2.16 H new ATOM 0 HH12 ARG A 153 -2.779 3.189 11.846 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -2.649 6.081 9.831 1.00 1.85 H new ATOM 0 HH22 ARG A 153 -3.395 5.309 11.234 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.538 -1.246 7.792 1.00 0.24 N ATOM 2267 CA PHE A 154 -2.248 -2.502 8.444 1.00 0.22 C ATOM 2268 C PHE A 154 -0.740 -2.708 8.526 1.00 0.24 C ATOM 2269 O PHE A 154 -0.029 -2.382 7.589 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.880 -3.661 7.680 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.366 -3.760 7.853 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.909 -4.515 8.880 1.00 0.21 C ATOM 2273 CD2 PHE A 154 -5.221 -3.085 6.995 1.00 0.22 C ATOM 2274 CE1 PHE A 154 -6.275 -4.593 9.047 1.00 0.22 C ATOM 2275 CE2 PHE A 154 -6.589 -3.163 7.159 1.00 0.24 C ATOM 2276 CZ PHE A 154 -7.113 -3.966 8.162 1.00 0.22 C ATOM 0 H PHE A 154 -2.459 -1.264 6.775 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.667 -2.473 9.450 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.653 -3.552 6.619 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.422 -4.594 8.009 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.256 -5.047 9.556 1.00 0.21 H new ATOM 0 HD2 PHE A 154 -4.812 -2.492 6.190 1.00 0.22 H new ATOM 0 HE1 PHE A 154 -6.686 -5.149 9.877 1.00 0.22 H new ATOM 0 HE2 PHE A 154 -7.247 -2.603 6.511 1.00 0.24 H new ATOM 0 HZ PHE A 154 -8.182 -4.097 8.245 1.00 0.22 H new ATOM 2286 N SER A 155 -0.255 -3.248 9.634 1.00 0.22 N ATOM 2287 CA SER A 155 1.175 -3.532 9.788 1.00 0.25 C ATOM 2288 C SER A 155 1.610 -4.600 8.774 1.00 0.22 C ATOM 2289 O SER A 155 0.798 -5.438 8.397 1.00 0.26 O ATOM 2290 CB SER A 155 1.443 -4.016 11.212 1.00 0.35 C ATOM 2291 OG SER A 155 0.923 -3.097 12.162 1.00 1.11 O ATOM 0 H SER A 155 -0.825 -3.500 10.442 1.00 0.22 H new ATOM 0 HA SER A 155 1.748 -2.624 9.603 1.00 0.25 H new ATOM 0 HB2 SER A 155 0.988 -4.996 11.360 1.00 0.35 H new ATOM 0 HB3 SER A 155 2.516 -4.136 11.365 1.00 0.35 H new ATOM 0 HG SER A 155 1.103 -3.426 13.068 1.00 1.11 H new ATOM 2297 N PRO A 156 2.872 -4.599 8.316 1.00 0.25 N ATOM 2298 CA PRO A 156 3.320 -5.514 7.257 1.00 0.29 C ATOM 2299 C PRO A 156 3.097 -6.976 7.625 1.00 0.39 C ATOM 2300 O PRO A 156 2.545 -7.743 6.843 1.00 0.78 O ATOM 2301 CB PRO A 156 4.817 -5.218 7.120 1.00 0.34 C ATOM 2302 CG PRO A 156 5.186 -4.494 8.366 1.00 0.36 C ATOM 2303 CD PRO A 156 3.958 -3.742 8.795 1.00 0.33 C ATOM 0 HA PRO A 156 2.763 -5.362 6.333 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.392 -6.138 7.014 1.00 0.34 H new ATOM 0 HB3 PRO A 156 5.020 -4.611 6.237 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.506 -5.191 9.141 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.017 -3.812 8.188 1.00 0.36 H new ATOM 0 HD2 PRO A 156 3.922 -3.609 9.876 1.00 0.33 H new ATOM 0 HD3 PRO A 156 3.916 -2.748 8.350 1.00 0.33 H new ATOM 2311 N GLY A 157 3.549 -7.352 8.813 1.00 0.36 N ATOM 2312 CA GLY A 157 3.315 -8.690 9.330 1.00 0.46 C ATOM 2313 C GLY A 157 1.856 -9.010 9.643 1.00 0.41 C ATOM 2314 O GLY A 157 1.581 -9.976 10.358 1.00 0.50 O ATOM 0 H GLY A 157 4.081 -6.746 9.438 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.683 -9.414 8.604 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.904 -8.821 10.238 1.00 0.46 H new ATOM 2318 N ALA A 158 0.914 -8.223 9.129 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.488 -8.600 9.209 1.00 0.31 C ATOM 2320 C ALA A 158 -0.772 -9.640 8.136 1.00 0.34 C ATOM 2321 O ALA A 158 -0.082 -9.691 7.118 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.403 -7.393 9.039 1.00 0.37 C ATOM 0 H ALA A 158 1.095 -7.335 8.661 1.00 0.34 H new ATOM 0 HA ALA A 158 -0.689 -9.016 10.196 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.443 -7.713 9.104 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.197 -6.666 9.825 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.225 -6.935 8.066 1.00 0.37 H new ATOM 2328 N SER A 159 -1.775 -10.468 8.355 1.00 0.26 N ATOM 2329 CA SER A 159 -2.088 -11.512 7.422 1.00 0.30 C ATOM 2330 C SER A 159 -3.355 -11.161 6.672 1.00 0.23 C ATOM 2331 O SER A 159 -4.068 -10.229 7.049 1.00 0.22 O ATOM 2332 CB SER A 159 -2.248 -12.847 8.147 1.00 0.41 C ATOM 2333 OG SER A 159 -1.060 -13.192 8.847 1.00 1.42 O ATOM 0 H SER A 159 -2.382 -10.431 9.174 1.00 0.26 H new ATOM 0 HA SER A 159 -1.269 -11.609 6.710 1.00 0.30 H new ATOM 0 HB2 SER A 159 -3.082 -12.788 8.846 1.00 0.41 H new ATOM 0 HB3 SER A 159 -2.490 -13.629 7.427 1.00 0.41 H new ATOM 0 HG SER A 159 -1.187 -14.049 9.305 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.606 -11.904 5.614 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.784 -11.741 4.777 1.00 0.20 C ATOM 2341 C VAL A 160 -6.039 -11.472 5.611 1.00 0.21 C ATOM 2342 O VAL A 160 -6.707 -10.458 5.427 1.00 0.20 O ATOM 2343 CB VAL A 160 -4.991 -13.030 3.974 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.236 -12.962 3.106 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.770 -13.341 3.124 1.00 0.26 C ATOM 0 H VAL A 160 -2.987 -12.653 5.303 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.625 -10.886 4.121 1.00 0.20 H new ATOM 0 HB VAL A 160 -5.132 -13.837 4.693 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.346 -13.895 2.554 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.111 -12.809 3.737 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.145 -12.133 2.404 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -3.941 -14.260 2.564 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.592 -12.520 2.429 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.900 -13.466 3.769 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.314 -12.360 6.563 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.554 -12.316 7.331 1.00 0.31 C ATOM 2357 C LYS A 161 -7.579 -11.120 8.282 1.00 0.26 C ATOM 2358 O LYS A 161 -8.646 -10.598 8.605 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.732 -13.621 8.113 1.00 0.45 C ATOM 2360 CG LYS A 161 -9.108 -13.783 8.742 1.00 1.12 C ATOM 2361 CD LYS A 161 -10.223 -13.856 7.699 1.00 1.80 C ATOM 2362 CE LYS A 161 -10.222 -15.175 6.930 1.00 2.67 C ATOM 2363 NZ LYS A 161 -9.089 -15.284 5.973 1.00 3.46 N ATOM 0 H LYS A 161 -5.689 -13.124 6.822 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.382 -12.201 6.631 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -7.549 -14.462 7.444 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -6.977 -13.668 8.898 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -9.122 -14.688 9.349 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -9.298 -12.946 9.414 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -11.186 -13.728 8.193 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -10.113 -13.030 6.996 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -10.175 -16.003 7.638 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -11.162 -15.274 6.386 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -9.393 -15.818 5.134 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -8.784 -14.332 5.686 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -8.296 -15.778 6.429 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.401 -10.677 8.705 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.290 -9.541 9.609 1.00 0.27 C ATOM 2379 C ASP A 162 -6.718 -8.281 8.894 1.00 0.22 C ATOM 2380 O ASP A 162 -7.311 -7.381 9.481 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.855 -9.383 10.109 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.464 -10.447 11.106 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -4.746 -10.272 12.311 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.868 -11.461 10.692 1.00 1.40 O ATOM 0 H ASP A 162 -5.508 -11.089 8.435 1.00 0.26 H new ATOM 0 HA ASP A 162 -6.939 -9.717 10.467 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.173 -9.419 9.260 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.741 -8.401 10.568 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.405 -8.233 7.617 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.803 -7.134 6.767 1.00 0.15 C ATOM 2391 C ILE A 163 -8.246 -7.301 6.321 1.00 0.14 C ATOM 2392 O ILE A 163 -9.027 -6.346 6.363 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.885 -7.046 5.533 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.506 -6.487 5.924 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.536 -6.206 4.444 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.519 -6.441 4.775 1.00 0.21 C ATOM 0 H ILE A 163 -5.867 -8.956 7.139 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.714 -6.212 7.341 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.736 -8.050 5.136 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.632 -5.481 6.324 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.090 -7.098 6.725 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.874 -6.154 3.580 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.482 -6.661 4.150 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.719 -5.200 4.821 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.570 -6.036 5.126 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.363 -7.448 4.389 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.913 -5.806 3.982 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.597 -8.519 5.917 1.00 0.13 N ATOM 2409 CA GLU A 164 -9.929 -8.804 5.406 1.00 0.13 C ATOM 2410 C GLU A 164 -11.009 -8.298 6.351 1.00 0.15 C ATOM 2411 O GLU A 164 -12.007 -7.751 5.921 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.152 -10.302 5.214 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.376 -10.927 4.079 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.779 -12.365 3.844 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -10.841 -12.591 3.238 1.00 0.60 O ATOM 2416 OE2 GLU A 164 -9.040 -13.281 4.258 1.00 0.67 O ATOM 0 H GLU A 164 -7.973 -9.325 5.935 1.00 0.13 H new ATOM 0 HA GLU A 164 -9.997 -8.291 4.447 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -9.887 -10.814 6.139 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.215 -10.476 5.046 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.539 -10.351 3.168 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.310 -10.880 4.300 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.810 -8.488 7.641 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.827 -8.126 8.618 1.00 0.21 C ATOM 2425 C GLU A 165 -12.156 -6.632 8.594 1.00 0.21 C ATOM 2426 O GLU A 165 -13.265 -6.234 8.950 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.417 -8.553 10.027 1.00 0.27 C ATOM 2428 CG GLU A 165 -10.068 -8.026 10.474 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.823 -8.272 11.948 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -10.357 -7.515 12.785 1.00 0.87 O ATOM 2431 OE2 GLU A 165 -9.067 -9.215 12.273 1.00 0.83 O ATOM 0 H GLU A 165 -9.960 -8.888 8.038 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.731 -8.665 8.335 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.177 -8.215 10.731 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.401 -9.642 10.073 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.281 -8.504 9.891 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -10.011 -6.957 10.270 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.210 -5.798 8.175 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.500 -4.378 8.037 1.00 0.20 C ATOM 2440 C LYS A 166 -11.752 -4.041 6.569 1.00 0.19 C ATOM 2441 O LYS A 166 -12.153 -2.933 6.224 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.386 -3.494 8.631 1.00 0.25 C ATOM 2443 CG LYS A 166 -10.001 -3.850 10.063 1.00 0.38 C ATOM 2444 CD LYS A 166 -11.203 -3.844 10.995 1.00 0.58 C ATOM 2445 CE LYS A 166 -10.780 -3.832 12.457 1.00 1.09 C ATOM 2446 NZ LYS A 166 -9.825 -4.926 12.785 1.00 1.71 N ATOM 0 H LYS A 166 -10.259 -6.073 7.931 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.402 -4.162 8.610 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.501 -3.571 7.999 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.709 -2.453 8.602 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.535 -4.835 10.079 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -9.258 -3.140 10.426 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -11.820 -2.970 10.787 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -11.819 -4.722 10.801 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -10.321 -2.871 12.691 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -11.664 -3.925 13.088 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -9.700 -4.980 13.816 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -10.199 -5.830 12.434 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -8.908 -4.733 12.335 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.554 -5.039 5.721 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.680 -4.890 4.279 1.00 0.15 C ATOM 2462 C LEU A 167 -13.046 -5.359 3.772 1.00 0.15 C ATOM 2463 O LEU A 167 -13.730 -4.646 3.038 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.592 -5.718 3.596 1.00 0.13 C ATOM 2465 CG LEU A 167 -10.850 -6.007 2.126 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.579 -4.772 1.290 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.021 -7.185 1.651 1.00 0.16 C ATOM 0 H LEU A 167 -11.300 -5.982 6.016 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.575 -3.831 4.042 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.641 -5.193 3.689 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.486 -6.664 4.126 1.00 0.13 H new ATOM 0 HG LEU A 167 -11.900 -6.275 2.006 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -10.768 -4.995 0.240 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.234 -3.963 1.613 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.539 -4.469 1.415 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.224 -7.371 0.596 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -8.962 -6.962 1.783 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.280 -8.070 2.232 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.419 -6.569 4.166 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.597 -7.250 3.641 1.00 0.19 C ATOM 2481 C ILE A 168 -15.885 -6.435 3.812 1.00 0.22 C ATOM 2482 O ILE A 168 -16.655 -6.323 2.862 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.767 -8.652 4.267 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.520 -9.503 4.001 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.010 -9.340 3.713 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.565 -10.871 4.647 1.00 0.24 C ATOM 0 H ILE A 168 -12.909 -7.111 4.864 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.423 -7.361 2.571 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.891 -8.539 5.344 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.397 -9.624 2.925 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.642 -8.968 4.365 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.112 -10.326 4.166 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -16.891 -8.741 3.944 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -15.916 -9.445 2.632 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.649 -11.414 4.414 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.656 -10.760 5.728 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.422 -11.426 4.265 1.00 0.24 H new ATOM 2498 N PRO A 169 -16.155 -5.854 5.005 1.00 0.24 N ATOM 2499 CA PRO A 169 -17.330 -4.989 5.206 1.00 0.29 C ATOM 2500 C PRO A 169 -17.404 -3.851 4.184 1.00 0.29 C ATOM 2501 O PRO A 169 -18.482 -3.327 3.892 1.00 0.41 O ATOM 2502 CB PRO A 169 -17.122 -4.424 6.611 1.00 0.34 C ATOM 2503 CG PRO A 169 -16.282 -5.437 7.304 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.378 -6.012 6.253 1.00 0.24 C ATOM 0 HA PRO A 169 -18.262 -5.542 5.085 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -16.626 -3.454 6.578 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -18.073 -4.279 7.124 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.705 -4.981 8.109 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -16.900 -6.214 7.755 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.429 -5.479 6.205 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -15.146 -7.058 6.452 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.254 -3.474 3.642 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.191 -2.440 2.625 1.00 0.22 C ATOM 2514 C LEU A 170 -16.405 -3.037 1.230 1.00 0.20 C ATOM 2515 O LEU A 170 -17.160 -2.489 0.429 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.855 -1.701 2.697 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.584 -0.929 3.984 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.157 -0.404 3.974 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.581 0.212 4.137 1.00 0.69 C ATOM 0 H LEU A 170 -15.349 -3.873 3.893 1.00 0.22 H new ATOM 0 HA LEU A 170 -16.991 -1.724 2.813 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -14.054 -2.426 2.557 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.803 -1.003 1.861 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.705 -1.598 4.836 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -12.966 0.147 4.895 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.462 -1.241 3.901 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.019 0.258 3.119 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.375 0.754 5.060 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.490 0.891 3.289 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.593 -0.191 4.171 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.735 -4.159 0.944 1.00 0.18 N ATOM 2532 CA LEU A 171 -15.897 -4.858 -0.342 1.00 0.20 C ATOM 2533 C LEU A 171 -17.327 -5.277 -0.528 1.00 0.27 C ATOM 2534 O LEU A 171 -17.974 -4.966 -1.528 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.049 -6.123 -0.391 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.561 -5.898 -0.331 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -12.834 -7.224 -0.309 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.113 -5.068 -1.517 1.00 0.31 C ATOM 0 H LEU A 171 -15.076 -4.604 1.583 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.585 -4.166 -1.124 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.337 -6.767 0.440 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.282 -6.663 -1.309 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.321 -5.356 0.584 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -11.759 -7.049 -0.266 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.144 -7.795 0.566 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.074 -7.786 -1.212 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.036 -4.911 -1.465 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.359 -5.591 -2.441 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.622 -4.104 -1.500 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.790 -6.002 0.466 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.129 -6.518 0.471 1.00 0.39 C ATOM 2552 C GLY A 172 -20.182 -5.429 0.471 1.00 0.66 C ATOM 2553 O GLY A 172 -21.364 -5.706 0.268 1.00 1.12 O ATOM 0 H GLY A 172 -17.243 -6.247 1.292 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.271 -7.153 -0.403 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.266 -7.149 1.349 1.00 0.39 H new