USER MOD reduce.3.24.130724 H: found=0, std=0, add=570, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 571 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 155 MET CE :methyl 169:sc= 0 (180deg=-0.134) USER MOD Set 1.2: A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 26:sc= 0.099 USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 100 MET CE :methyl -177:sc= 0 (180deg=-0.00848) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= 0.73 K(o=0.73,f=-0.019) USER MOD Single : A 106 SER OG : rot 98:sc= 1.22 USER MOD Single : A 107 GLN : amide:sc= 0.55 K(o=0.55,f=-0.47) USER MOD Single : A 108 GLN : amide:sc= 0.692 K(o=0.69,f=-0.38) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN :FLIP amide:sc= 1.31 F(o=0.8,f=1.3) USER MOD Single : A 123 GLN : amide:sc= 0.232 X(o=0.23,f=0) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 ASN : amide:sc= 0.656 K(o=0.66,f=0) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 MET CE :methyl -155:sc= -0.22 (180deg=-1.67) USER MOD Single : A 148 LYS NZ :NH3+ 176:sc= 1.14 (180deg=1.13) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 151 HIS : no HD1:sc= -0.141 X(o=-0.14,f=-0.15) USER MOD Single : A 158 GLN : amide:sc= 1.19 K(o=1.2,f=0) USER MOD Single : A 159 SER OG : rot 180:sc= 0.597 USER MOD Single : A 163 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 98 6.256 -7.468 -15.357 1.00 0.00 N ATOM 2 CA SER A 98 4.888 -7.703 -14.820 1.00 0.00 C ATOM 3 C SER A 98 4.425 -6.555 -13.917 1.00 0.00 C ATOM 4 O SER A 98 5.247 -5.889 -13.286 1.00 0.00 O ATOM 5 CB SER A 98 4.803 -9.036 -14.062 1.00 0.00 C ATOM 6 OG SER A 98 5.209 -10.099 -14.912 1.00 0.00 O ATOM 0 HA SER A 98 4.219 -7.750 -15.680 1.00 0.00 H new ATOM 0 HB2 SER A 98 5.438 -9.003 -13.177 1.00 0.00 H new ATOM 0 HB3 SER A 98 3.783 -9.204 -13.716 1.00 0.00 H new ATOM 0 HG SER A 98 5.824 -9.756 -15.594 1.00 0.00 H new ATOM 14 N HIS A 99 3.107 -6.325 -13.840 1.00 0.00 N ATOM 15 CA HIS A 99 2.469 -5.252 -13.049 1.00 0.00 C ATOM 16 C HIS A 99 1.297 -5.773 -12.199 1.00 0.00 C ATOM 17 O HIS A 99 0.707 -6.814 -12.505 1.00 0.00 O ATOM 18 CB HIS A 99 1.989 -4.134 -13.991 1.00 0.00 C ATOM 19 CG HIS A 99 3.099 -3.454 -14.758 1.00 0.00 C ATOM 20 ND1 HIS A 99 3.983 -2.503 -14.237 1.00 0.00 N ATOM 21 CD2 HIS A 99 3.398 -3.659 -16.075 1.00 0.00 C ATOM 22 CE1 HIS A 99 4.796 -2.159 -15.254 1.00 0.00 C ATOM 23 NE2 HIS A 99 4.467 -2.839 -16.367 1.00 0.00 N ATOM 0 H HIS A 99 2.429 -6.898 -14.342 1.00 0.00 H new ATOM 0 HA HIS A 99 3.215 -4.859 -12.358 1.00 0.00 H new ATOM 0 HB2 HIS A 99 1.276 -4.553 -14.701 1.00 0.00 H new ATOM 0 HB3 HIS A 99 1.455 -3.385 -13.406 1.00 0.00 H new ATOM 0 HD2 HIS A 99 2.895 -4.332 -16.754 1.00 0.00 H new ATOM 0 HE1 HIS A 99 5.598 -1.439 -15.186 1.00 0.00 H new ATOM 0 HE2 HIS A 99 4.930 -2.761 -17.273 1.00 0.00 H new ATOM 31 N MET A 100 0.938 -5.032 -11.146 1.00 0.00 N ATOM 32 CA MET A 100 -0.237 -5.308 -10.303 1.00 0.00 C ATOM 33 C MET A 100 -1.554 -4.912 -11.001 1.00 0.00 C ATOM 34 O MET A 100 -1.561 -4.058 -11.894 1.00 0.00 O ATOM 35 CB MET A 100 -0.100 -4.591 -8.947 1.00 0.00 C ATOM 36 CG MET A 100 1.123 -5.049 -8.136 1.00 0.00 C ATOM 37 SD MET A 100 1.212 -6.821 -7.735 1.00 0.00 S ATOM 38 CE MET A 100 -0.192 -6.982 -6.595 1.00 0.00 C ATOM 0 H MET A 100 1.462 -4.209 -10.848 1.00 0.00 H new ATOM 0 HA MET A 100 -0.276 -6.384 -10.132 1.00 0.00 H new ATOM 0 HB2 MET A 100 -0.032 -3.517 -9.118 1.00 0.00 H new ATOM 0 HB3 MET A 100 -1.002 -4.764 -8.360 1.00 0.00 H new ATOM 0 HG2 MET A 100 2.021 -4.779 -8.691 1.00 0.00 H new ATOM 0 HG3 MET A 100 1.144 -4.486 -7.203 1.00 0.00 H new ATOM 0 HE1 MET A 100 -0.239 -8.003 -6.217 1.00 0.00 H new ATOM 0 HE2 MET A 100 -0.064 -6.292 -5.761 1.00 0.00 H new ATOM 0 HE3 MET A 100 -1.117 -6.747 -7.122 1.00 0.00 H new ATOM 48 N ALA A 101 -2.673 -5.519 -10.586 1.00 0.00 N ATOM 49 CA ALA A 101 -4.000 -5.313 -11.179 1.00 0.00 C ATOM 50 C ALA A 101 -5.123 -5.161 -10.130 1.00 0.00 C ATOM 51 O ALA A 101 -5.080 -5.753 -9.046 1.00 0.00 O ATOM 52 CB ALA A 101 -4.286 -6.468 -12.147 1.00 0.00 C ATOM 0 H ALA A 101 -2.681 -6.182 -9.811 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.988 -4.366 -11.718 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -5.269 -6.331 -12.597 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.528 -6.483 -12.930 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -4.265 -7.412 -11.603 1.00 0.00 H new ATOM 58 N SER A 102 -6.141 -4.372 -10.481 1.00 0.00 N ATOM 59 CA SER A 102 -7.354 -4.072 -9.695 1.00 0.00 C ATOM 60 C SER A 102 -8.493 -3.604 -10.628 1.00 0.00 C ATOM 61 O SER A 102 -8.209 -3.162 -11.750 1.00 0.00 O ATOM 62 CB SER A 102 -7.040 -2.992 -8.641 1.00 0.00 C ATOM 63 OG SER A 102 -6.502 -1.815 -9.229 1.00 0.00 O ATOM 0 H SER A 102 -6.146 -3.891 -11.380 1.00 0.00 H new ATOM 0 HA SER A 102 -7.680 -4.977 -9.183 1.00 0.00 H new ATOM 0 HB2 SER A 102 -7.950 -2.742 -8.096 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.332 -3.390 -7.914 1.00 0.00 H new ATOM 0 HG SER A 102 -6.318 -1.154 -8.529 1.00 0.00 H new ATOM 69 N PRO A 103 -9.780 -3.692 -10.226 1.00 0.00 N ATOM 70 CA PRO A 103 -10.890 -3.194 -11.037 1.00 0.00 C ATOM 71 C PRO A 103 -10.961 -1.656 -11.016 1.00 0.00 C ATOM 72 O PRO A 103 -10.362 -0.972 -10.181 1.00 0.00 O ATOM 73 CB PRO A 103 -12.152 -3.828 -10.442 1.00 0.00 C ATOM 74 CG PRO A 103 -11.791 -3.817 -8.965 1.00 0.00 C ATOM 75 CD PRO A 103 -10.309 -4.214 -8.972 1.00 0.00 C ATOM 0 HA PRO A 103 -10.769 -3.462 -12.086 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -13.049 -3.246 -10.655 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -12.328 -4.835 -10.819 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -11.944 -2.834 -8.519 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -12.396 -4.523 -8.396 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -9.784 -3.790 -8.116 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -10.191 -5.296 -8.915 1.00 0.00 H new ATOM 83 N GLN A 104 -11.748 -1.126 -11.948 1.00 0.00 N ATOM 84 CA GLN A 104 -12.158 0.280 -12.027 1.00 0.00 C ATOM 85 C GLN A 104 -13.685 0.364 -12.057 1.00 0.00 C ATOM 86 O GLN A 104 -14.308 -0.035 -13.042 1.00 0.00 O ATOM 87 CB GLN A 104 -11.498 0.946 -13.250 1.00 0.00 C ATOM 88 CG GLN A 104 -11.926 2.409 -13.480 1.00 0.00 C ATOM 89 CD GLN A 104 -11.644 3.320 -12.285 1.00 0.00 C ATOM 90 OE1 GLN A 104 -10.504 3.569 -11.913 1.00 0.00 O ATOM 91 NE2 GLN A 104 -12.658 3.837 -11.619 1.00 0.00 N ATOM 0 H GLN A 104 -12.137 -1.688 -12.705 1.00 0.00 H new ATOM 0 HA GLN A 104 -11.821 0.827 -11.146 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -10.415 0.911 -13.129 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -11.738 0.365 -14.140 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -11.406 2.799 -14.355 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -12.992 2.437 -13.705 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -13.615 3.641 -11.914 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -12.486 4.433 -10.809 1.00 0.00 H new ATOM 100 N PHE A 105 -14.307 0.902 -11.008 1.00 0.00 N ATOM 101 CA PHE A 105 -15.756 1.119 -10.989 1.00 0.00 C ATOM 102 C PHE A 105 -16.142 2.203 -12.007 1.00 0.00 C ATOM 103 O PHE A 105 -15.491 3.248 -12.096 1.00 0.00 O ATOM 104 CB PHE A 105 -16.209 1.461 -9.562 1.00 0.00 C ATOM 105 CG PHE A 105 -15.749 0.468 -8.502 1.00 0.00 C ATOM 106 CD1 PHE A 105 -15.922 -0.922 -8.681 1.00 0.00 C ATOM 107 CD2 PHE A 105 -15.103 0.938 -7.341 1.00 0.00 C ATOM 108 CE1 PHE A 105 -15.467 -1.822 -7.700 1.00 0.00 C ATOM 109 CE2 PHE A 105 -14.649 0.035 -6.363 1.00 0.00 C ATOM 110 CZ PHE A 105 -14.834 -1.345 -6.541 1.00 0.00 C ATOM 0 H PHE A 105 -13.829 1.197 -10.157 1.00 0.00 H new ATOM 0 HA PHE A 105 -16.274 0.207 -11.286 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -15.834 2.451 -9.302 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -17.297 1.517 -9.543 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -16.404 -1.295 -9.572 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -14.956 1.999 -7.201 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -15.605 -2.884 -7.839 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -14.158 0.404 -5.475 1.00 0.00 H new ATOM 0 HZ PHE A 105 -14.490 -2.039 -5.788 1.00 0.00 H new ATOM 120 N SER A 106 -17.187 1.943 -12.796 1.00 0.00 N ATOM 121 CA SER A 106 -17.627 2.810 -13.905 1.00 0.00 C ATOM 122 C SER A 106 -18.302 4.093 -13.406 1.00 0.00 C ATOM 123 O SER A 106 -18.259 5.130 -14.071 1.00 0.00 O ATOM 124 CB SER A 106 -18.620 2.054 -14.804 1.00 0.00 C ATOM 125 OG SER A 106 -18.154 0.757 -15.136 1.00 0.00 O ATOM 0 H SER A 106 -17.765 1.110 -12.685 1.00 0.00 H new ATOM 0 HA SER A 106 -16.733 3.085 -14.465 1.00 0.00 H new ATOM 0 HB2 SER A 106 -19.581 1.975 -14.296 1.00 0.00 H new ATOM 0 HB3 SER A 106 -18.788 2.624 -15.718 1.00 0.00 H new ATOM 0 HG SER A 106 -18.563 0.099 -14.536 1.00 0.00 H new ATOM 131 N GLN A 107 -18.934 4.007 -12.231 1.00 0.00 N ATOM 132 CA GLN A 107 -19.645 5.083 -11.539 1.00 0.00 C ATOM 133 C GLN A 107 -19.772 4.773 -10.039 1.00 0.00 C ATOM 134 O GLN A 107 -19.574 3.634 -9.612 1.00 0.00 O ATOM 135 CB GLN A 107 -21.030 5.290 -12.191 1.00 0.00 C ATOM 136 CG GLN A 107 -21.904 4.026 -12.320 1.00 0.00 C ATOM 137 CD GLN A 107 -23.253 4.315 -12.986 1.00 0.00 C ATOM 138 OE1 GLN A 107 -23.567 5.417 -13.420 1.00 0.00 O ATOM 139 NE2 GLN A 107 -24.114 3.333 -13.102 1.00 0.00 N ATOM 0 H GLN A 107 -18.964 3.132 -11.708 1.00 0.00 H new ATOM 0 HA GLN A 107 -19.076 6.008 -11.632 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -21.578 6.031 -11.609 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -20.884 5.711 -13.186 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -21.369 3.275 -12.901 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -22.074 3.602 -11.330 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -23.880 2.405 -12.750 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -25.018 3.497 -13.545 1.00 0.00 H new ATOM 148 N GLN A 108 -20.196 5.771 -9.257 1.00 0.00 N ATOM 149 CA GLN A 108 -20.483 5.674 -7.815 1.00 0.00 C ATOM 150 C GLN A 108 -21.362 4.464 -7.448 1.00 0.00 C ATOM 151 O GLN A 108 -21.134 3.847 -6.408 1.00 0.00 O ATOM 152 CB GLN A 108 -21.079 7.031 -7.375 1.00 0.00 C ATOM 153 CG GLN A 108 -21.929 7.045 -6.090 1.00 0.00 C ATOM 154 CD GLN A 108 -23.393 6.683 -6.357 1.00 0.00 C ATOM 155 OE1 GLN A 108 -24.084 7.310 -7.149 1.00 0.00 O ATOM 156 NE2 GLN A 108 -23.926 5.655 -5.739 1.00 0.00 N ATOM 0 H GLN A 108 -20.357 6.709 -9.623 1.00 0.00 H new ATOM 0 HA GLN A 108 -19.562 5.483 -7.264 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -20.257 7.734 -7.243 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -21.695 7.410 -8.191 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -21.508 6.342 -5.371 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -21.879 8.034 -5.635 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -23.371 5.116 -5.074 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -24.895 5.395 -5.924 1.00 0.00 H new ATOM 165 N ARG A 109 -22.326 4.075 -8.301 1.00 0.00 N ATOM 166 CA ARG A 109 -23.217 2.939 -7.996 1.00 0.00 C ATOM 167 C ARG A 109 -22.496 1.593 -7.976 1.00 0.00 C ATOM 168 O ARG A 109 -22.766 0.802 -7.086 1.00 0.00 O ATOM 169 CB ARG A 109 -24.445 2.876 -8.914 1.00 0.00 C ATOM 170 CG ARG A 109 -25.185 4.212 -9.050 1.00 0.00 C ATOM 171 CD ARG A 109 -26.682 4.071 -9.340 1.00 0.00 C ATOM 172 NE ARG A 109 -26.945 3.286 -10.558 1.00 0.00 N ATOM 173 CZ ARG A 109 -28.120 3.062 -11.107 1.00 0.00 C ATOM 174 NH1 ARG A 109 -29.222 3.597 -10.673 1.00 0.00 N ATOM 175 NH2 ARG A 109 -28.186 2.244 -12.103 1.00 0.00 N ATOM 0 H ARG A 109 -22.508 4.524 -9.198 1.00 0.00 H new ATOM 0 HA ARG A 109 -23.570 3.134 -6.983 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -24.131 2.543 -9.903 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -25.136 2.126 -8.530 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -25.056 4.782 -8.130 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -24.724 4.791 -9.850 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -27.171 3.594 -8.491 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -27.124 5.062 -9.447 1.00 0.00 H new ATOM 0 HE ARG A 109 -26.135 2.875 -11.023 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -29.202 4.225 -9.869 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -30.107 3.389 -11.136 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -27.340 1.789 -12.446 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -29.084 2.052 -12.547 1.00 0.00 H new ATOM 189 N GLU A 110 -21.554 1.338 -8.885 1.00 0.00 N ATOM 190 CA GLU A 110 -20.766 0.091 -8.872 1.00 0.00 C ATOM 191 C GLU A 110 -19.960 -0.042 -7.563 1.00 0.00 C ATOM 192 O GLU A 110 -19.970 -1.091 -6.911 1.00 0.00 O ATOM 193 CB GLU A 110 -19.807 0.042 -10.080 1.00 0.00 C ATOM 194 CG GLU A 110 -20.240 -0.927 -11.183 1.00 0.00 C ATOM 195 CD GLU A 110 -19.028 -1.294 -12.055 1.00 0.00 C ATOM 196 OE1 GLU A 110 -18.613 -0.456 -12.888 1.00 0.00 O ATOM 197 OE2 GLU A 110 -18.427 -2.377 -11.867 1.00 0.00 O ATOM 0 H GLU A 110 -21.313 1.976 -9.644 1.00 0.00 H new ATOM 0 HA GLU A 110 -21.465 -0.743 -8.937 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -19.722 1.043 -10.503 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -18.814 -0.242 -9.731 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -20.669 -1.827 -10.742 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -21.017 -0.471 -11.797 1.00 0.00 H new ATOM 204 N GLU A 111 -19.312 1.054 -7.151 1.00 0.00 N ATOM 205 CA GLU A 111 -18.557 1.125 -5.896 1.00 0.00 C ATOM 206 C GLU A 111 -19.462 0.861 -4.678 1.00 0.00 C ATOM 207 O GLU A 111 -19.135 0.032 -3.826 1.00 0.00 O ATOM 208 CB GLU A 111 -17.884 2.506 -5.807 1.00 0.00 C ATOM 209 CG GLU A 111 -16.925 2.626 -4.620 1.00 0.00 C ATOM 210 CD GLU A 111 -16.348 4.050 -4.519 1.00 0.00 C ATOM 211 OE1 GLU A 111 -15.439 4.404 -5.309 1.00 0.00 O ATOM 212 OE2 GLU A 111 -16.788 4.817 -3.625 1.00 0.00 O ATOM 0 H GLU A 111 -19.297 1.923 -7.684 1.00 0.00 H new ATOM 0 HA GLU A 111 -17.793 0.347 -5.888 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -17.337 2.698 -6.730 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -18.653 3.275 -5.726 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -17.449 2.376 -3.698 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -16.113 1.908 -4.730 1.00 0.00 H new ATOM 219 N ASP A 112 -20.627 1.516 -4.622 1.00 0.00 N ATOM 220 CA ASP A 112 -21.617 1.328 -3.561 1.00 0.00 C ATOM 221 C ASP A 112 -22.198 -0.086 -3.521 1.00 0.00 C ATOM 222 O ASP A 112 -22.346 -0.638 -2.437 1.00 0.00 O ATOM 223 CB ASP A 112 -22.747 2.362 -3.708 1.00 0.00 C ATOM 224 CG ASP A 112 -22.478 3.629 -2.876 1.00 0.00 C ATOM 225 OD1 ASP A 112 -21.968 3.529 -1.732 1.00 0.00 O ATOM 226 OD2 ASP A 112 -22.774 4.737 -3.377 1.00 0.00 O ATOM 0 H ASP A 112 -20.911 2.201 -5.323 1.00 0.00 H new ATOM 0 HA ASP A 112 -21.096 1.476 -2.615 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -22.856 2.634 -4.758 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -23.691 1.915 -3.395 1.00 0.00 H new ATOM 231 N ILE A 113 -22.491 -0.703 -4.667 1.00 0.00 N ATOM 232 CA ILE A 113 -23.053 -2.051 -4.759 1.00 0.00 C ATOM 233 C ILE A 113 -22.120 -3.093 -4.141 1.00 0.00 C ATOM 234 O ILE A 113 -22.550 -3.886 -3.299 1.00 0.00 O ATOM 235 CB ILE A 113 -23.351 -2.326 -6.242 1.00 0.00 C ATOM 236 CG1 ILE A 113 -24.673 -1.600 -6.559 1.00 0.00 C ATOM 237 CG2 ILE A 113 -23.395 -3.820 -6.558 1.00 0.00 C ATOM 238 CD1 ILE A 113 -25.078 -1.522 -8.022 1.00 0.00 C ATOM 0 H ILE A 113 -22.341 -0.269 -5.578 1.00 0.00 H new ATOM 0 HA ILE A 113 -23.977 -2.121 -4.185 1.00 0.00 H new ATOM 0 HB ILE A 113 -22.552 -1.947 -6.879 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -25.473 -2.097 -6.011 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -24.604 -0.584 -6.171 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -23.609 -3.962 -7.617 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -22.432 -4.271 -6.319 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -24.176 -4.295 -5.964 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -26.024 -0.988 -8.110 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -24.309 -0.993 -8.585 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -25.192 -2.529 -8.422 1.00 0.00 H new ATOM 250 N TYR A 114 -20.843 -3.075 -4.531 1.00 0.00 N ATOM 251 CA TYR A 114 -19.851 -3.996 -3.982 1.00 0.00 C ATOM 252 C TYR A 114 -19.699 -3.794 -2.470 1.00 0.00 C ATOM 253 O TYR A 114 -19.838 -4.738 -1.694 1.00 0.00 O ATOM 254 CB TYR A 114 -18.526 -3.764 -4.711 1.00 0.00 C ATOM 255 CG TYR A 114 -17.430 -4.714 -4.279 1.00 0.00 C ATOM 256 CD1 TYR A 114 -16.691 -4.487 -3.098 1.00 0.00 C ATOM 257 CD2 TYR A 114 -17.196 -5.865 -5.052 1.00 0.00 C ATOM 258 CE1 TYR A 114 -15.716 -5.421 -2.696 1.00 0.00 C ATOM 259 CE2 TYR A 114 -16.216 -6.797 -4.656 1.00 0.00 C ATOM 260 CZ TYR A 114 -15.477 -6.577 -3.471 1.00 0.00 C ATOM 261 OH TYR A 114 -14.545 -7.479 -3.064 1.00 0.00 O ATOM 0 H TYR A 114 -20.473 -2.429 -5.228 1.00 0.00 H new ATOM 0 HA TYR A 114 -20.173 -5.026 -4.133 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -18.686 -3.869 -5.784 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -18.198 -2.739 -4.537 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -16.872 -3.602 -2.506 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -17.769 -6.035 -5.952 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -15.149 -5.252 -1.792 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -16.030 -7.676 -5.255 1.00 0.00 H new ATOM 0 HH TYR A 114 -14.502 -8.218 -3.706 1.00 0.00 H new ATOM 271 N ARG A 115 -19.483 -2.543 -2.046 1.00 0.00 N ATOM 272 CA ARG A 115 -19.297 -2.144 -0.643 1.00 0.00 C ATOM 273 C ARG A 115 -20.483 -2.501 0.246 1.00 0.00 C ATOM 274 O ARG A 115 -20.303 -3.027 1.339 1.00 0.00 O ATOM 275 CB ARG A 115 -19.053 -0.637 -0.660 1.00 0.00 C ATOM 276 CG ARG A 115 -18.575 -0.068 0.682 1.00 0.00 C ATOM 277 CD ARG A 115 -17.841 1.246 0.412 1.00 0.00 C ATOM 278 NE ARG A 115 -18.727 2.269 -0.192 1.00 0.00 N ATOM 279 CZ ARG A 115 -18.351 3.244 -0.998 1.00 0.00 C ATOM 280 NH1 ARG A 115 -17.099 3.522 -1.216 1.00 0.00 N ATOM 281 NH2 ARG A 115 -19.221 3.970 -1.632 1.00 0.00 N ATOM 0 H ARG A 115 -19.431 -1.754 -2.690 1.00 0.00 H new ATOM 0 HA ARG A 115 -18.456 -2.688 -0.212 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -18.311 -0.408 -1.425 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -19.975 -0.133 -0.949 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -19.422 0.100 1.347 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -17.914 -0.777 1.181 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -17.431 1.629 1.346 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -16.998 1.059 -0.254 1.00 0.00 H new ATOM 0 HE ARG A 115 -19.720 2.214 0.036 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -16.368 2.978 -0.757 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -16.848 4.284 -1.846 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -20.218 3.792 -1.512 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -18.907 4.718 -2.250 1.00 0.00 H new ATOM 295 N PHE A 116 -21.693 -2.284 -0.255 1.00 0.00 N ATOM 296 CA PHE A 116 -22.938 -2.663 0.408 1.00 0.00 C ATOM 297 C PHE A 116 -23.012 -4.180 0.632 1.00 0.00 C ATOM 298 O PHE A 116 -23.133 -4.633 1.768 1.00 0.00 O ATOM 299 CB PHE A 116 -24.119 -2.140 -0.423 1.00 0.00 C ATOM 300 CG PHE A 116 -25.478 -2.426 0.170 1.00 0.00 C ATOM 301 CD1 PHE A 116 -25.836 -1.847 1.400 1.00 0.00 C ATOM 302 CD2 PHE A 116 -26.387 -3.262 -0.505 1.00 0.00 C ATOM 303 CE1 PHE A 116 -27.087 -2.123 1.972 1.00 0.00 C ATOM 304 CE2 PHE A 116 -27.636 -3.549 0.076 1.00 0.00 C ATOM 305 CZ PHE A 116 -27.982 -2.983 1.318 1.00 0.00 C ATOM 0 H PHE A 116 -21.841 -1.829 -1.156 1.00 0.00 H new ATOM 0 HA PHE A 116 -22.979 -2.210 1.399 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -24.010 -1.063 -0.547 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -24.071 -2.582 -1.418 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -25.146 -1.188 1.906 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -26.127 -3.682 -1.465 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -27.361 -1.674 2.915 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -28.330 -4.204 -0.431 1.00 0.00 H new ATOM 0 HZ PHE A 116 -28.937 -3.211 1.768 1.00 0.00 H new ATOM 315 N LEU A 117 -22.837 -4.995 -0.415 1.00 0.00 N ATOM 316 CA LEU A 117 -22.895 -6.456 -0.274 1.00 0.00 C ATOM 317 C LEU A 117 -21.693 -7.030 0.488 1.00 0.00 C ATOM 318 O LEU A 117 -21.782 -8.129 1.026 1.00 0.00 O ATOM 319 CB LEU A 117 -23.012 -7.134 -1.640 1.00 0.00 C ATOM 320 CG LEU A 117 -24.311 -6.810 -2.386 1.00 0.00 C ATOM 321 CD1 LEU A 117 -24.219 -7.330 -3.820 1.00 0.00 C ATOM 322 CD2 LEU A 117 -25.519 -7.440 -1.692 1.00 0.00 C ATOM 0 H LEU A 117 -22.655 -4.671 -1.365 1.00 0.00 H new ATOM 0 HA LEU A 117 -23.787 -6.668 0.315 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -22.166 -6.833 -2.257 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -22.941 -8.213 -1.506 1.00 0.00 H new ATOM 0 HG LEU A 117 -24.443 -5.728 -2.389 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -25.143 -7.100 -4.351 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -23.381 -6.853 -4.327 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -24.068 -8.409 -3.807 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -26.426 -7.193 -2.244 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -25.397 -8.523 -1.661 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -25.597 -7.054 -0.675 1.00 0.00 H new ATOM 334 N LYS A 118 -20.586 -6.291 0.582 1.00 0.00 N ATOM 335 CA LYS A 118 -19.447 -6.606 1.450 1.00 0.00 C ATOM 336 C LYS A 118 -19.794 -6.368 2.918 1.00 0.00 C ATOM 337 O LYS A 118 -19.389 -7.140 3.787 1.00 0.00 O ATOM 338 CB LYS A 118 -18.238 -5.790 0.967 1.00 0.00 C ATOM 339 CG LYS A 118 -17.070 -5.670 1.955 1.00 0.00 C ATOM 340 CD LYS A 118 -16.315 -6.983 2.227 1.00 0.00 C ATOM 341 CE LYS A 118 -15.559 -7.481 0.984 1.00 0.00 C ATOM 342 NZ LYS A 118 -14.724 -8.675 1.294 1.00 0.00 N ATOM 0 H LYS A 118 -20.452 -5.435 0.044 1.00 0.00 H new ATOM 0 HA LYS A 118 -19.192 -7.664 1.386 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -17.865 -6.240 0.047 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -18.580 -4.786 0.715 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -16.363 -4.934 1.572 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -17.451 -5.284 2.901 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -15.610 -6.833 3.044 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -17.021 -7.747 2.552 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -16.273 -7.729 0.198 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -14.925 -6.683 0.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -14.228 -8.985 0.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -14.027 -8.431 2.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -15.333 -9.445 1.638 1.00 0.00 H new ATOM 356 N ASP A 119 -20.555 -5.312 3.185 1.00 0.00 N ATOM 357 CA ASP A 119 -20.845 -4.858 4.534 1.00 0.00 C ATOM 358 C ASP A 119 -21.993 -5.650 5.182 1.00 0.00 C ATOM 359 O ASP A 119 -21.907 -5.994 6.364 1.00 0.00 O ATOM 360 CB ASP A 119 -21.169 -3.364 4.509 1.00 0.00 C ATOM 361 CG ASP A 119 -21.326 -2.799 5.930 1.00 0.00 C ATOM 362 OD1 ASP A 119 -20.302 -2.685 6.648 1.00 0.00 O ATOM 363 OD2 ASP A 119 -22.462 -2.453 6.332 1.00 0.00 O ATOM 0 H ASP A 119 -20.991 -4.743 2.460 1.00 0.00 H new ATOM 0 HA ASP A 119 -19.960 -5.033 5.145 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -20.376 -2.827 3.988 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -22.088 -3.199 3.947 1.00 0.00 H new ATOM 368 N ASN A 120 -23.040 -5.975 4.405 1.00 0.00 N ATOM 369 CA ASN A 120 -24.181 -6.770 4.886 1.00 0.00 C ATOM 370 C ASN A 120 -24.150 -8.242 4.447 1.00 0.00 C ATOM 371 O ASN A 120 -24.698 -9.095 5.148 1.00 0.00 O ATOM 372 CB ASN A 120 -25.546 -6.122 4.556 1.00 0.00 C ATOM 373 CG ASN A 120 -25.589 -4.984 3.553 1.00 0.00 C ATOM 374 OD1 ASN A 120 -26.009 -5.243 2.330 1.00 0.00 O flip ATOM 375 ND2 ASN A 120 -25.318 -3.839 3.885 1.00 0.00 N flip ATOM 0 H ASN A 120 -23.119 -5.694 3.428 1.00 0.00 H new ATOM 0 HA ASN A 120 -24.067 -6.772 5.970 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -26.206 -6.909 4.191 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -25.972 -5.756 5.490 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -24.994 -3.646 4.833 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -25.416 -3.077 3.214 1.00 0.00 H new ATOM 382 N GLY A 121 -23.546 -8.548 3.297 1.00 0.00 N ATOM 383 CA GLY A 121 -23.609 -9.886 2.691 1.00 0.00 C ATOM 384 C GLY A 121 -24.689 -9.925 1.614 1.00 0.00 C ATOM 385 O GLY A 121 -25.212 -8.870 1.248 1.00 0.00 O ATOM 0 H GLY A 121 -22.999 -7.878 2.757 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -22.643 -10.143 2.257 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -23.822 -10.631 3.458 1.00 0.00 H new ATOM 389 N PRO A 122 -25.064 -11.109 1.114 1.00 0.00 N ATOM 390 CA PRO A 122 -25.924 -11.255 -0.058 1.00 0.00 C ATOM 391 C PRO A 122 -27.362 -10.749 0.152 1.00 0.00 C ATOM 392 O PRO A 122 -28.037 -11.144 1.104 1.00 0.00 O ATOM 393 CB PRO A 122 -25.885 -12.746 -0.382 1.00 0.00 C ATOM 394 CG PRO A 122 -25.557 -13.418 0.948 1.00 0.00 C ATOM 395 CD PRO A 122 -24.636 -12.407 1.611 1.00 0.00 C ATOM 0 HA PRO A 122 -25.562 -10.636 -0.879 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -26.841 -13.092 -0.776 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -25.130 -12.969 -1.136 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -26.453 -13.601 1.542 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -25.067 -14.381 0.806 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -24.715 -12.457 2.697 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -23.594 -12.600 1.358 1.00 0.00 H new ATOM 403 N GLN A 123 -27.842 -9.902 -0.765 1.00 0.00 N ATOM 404 CA GLN A 123 -29.174 -9.266 -0.739 1.00 0.00 C ATOM 405 C GLN A 123 -29.784 -9.209 -2.149 1.00 0.00 C ATOM 406 O GLN A 123 -29.058 -9.271 -3.131 1.00 0.00 O ATOM 407 CB GLN A 123 -29.082 -7.824 -0.208 1.00 0.00 C ATOM 408 CG GLN A 123 -28.263 -7.533 1.046 1.00 0.00 C ATOM 409 CD GLN A 123 -28.617 -8.343 2.283 1.00 0.00 C ATOM 410 OE1 GLN A 123 -29.769 -8.534 2.650 1.00 0.00 O ATOM 411 NE2 GLN A 123 -27.603 -8.771 3.002 1.00 0.00 N ATOM 0 H GLN A 123 -27.295 -9.626 -1.581 1.00 0.00 H new ATOM 0 HA GLN A 123 -29.802 -9.869 -0.084 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -28.680 -7.206 -1.011 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -30.099 -7.480 -0.020 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -27.211 -7.703 0.815 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -28.370 -6.475 1.287 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -26.648 -8.606 2.685 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -27.772 -9.268 3.876 1.00 0.00 H new ATOM 420 N ARG A 124 -31.100 -9.031 -2.306 1.00 0.00 N ATOM 421 CA ARG A 124 -31.741 -8.902 -3.638 1.00 0.00 C ATOM 422 C ARG A 124 -31.556 -7.524 -4.237 1.00 0.00 C ATOM 423 O ARG A 124 -31.414 -6.569 -3.487 1.00 0.00 O ATOM 424 CB ARG A 124 -33.241 -9.155 -3.523 1.00 0.00 C ATOM 425 CG ARG A 124 -33.561 -10.579 -3.091 1.00 0.00 C ATOM 426 CD ARG A 124 -34.998 -10.560 -2.598 1.00 0.00 C ATOM 427 NE ARG A 124 -35.433 -11.930 -2.266 1.00 0.00 N ATOM 428 CZ ARG A 124 -36.496 -12.296 -1.575 1.00 0.00 C ATOM 429 NH1 ARG A 124 -37.295 -11.431 -1.015 1.00 0.00 N ATOM 430 NH2 ARG A 124 -36.776 -13.560 -1.447 1.00 0.00 N ATOM 0 H ARG A 124 -31.755 -8.971 -1.526 1.00 0.00 H new ATOM 0 HA ARG A 124 -31.261 -9.637 -4.284 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -33.670 -8.456 -2.805 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -33.715 -8.955 -4.484 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -33.444 -11.274 -3.923 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -32.884 -10.908 -2.303 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -35.082 -9.920 -1.720 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -35.649 -10.138 -3.364 1.00 0.00 H new ATOM 0 HE ARG A 124 -34.841 -12.685 -2.612 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -37.108 -10.432 -1.103 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -38.107 -11.753 -0.489 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -36.175 -14.262 -1.879 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -37.596 -13.849 -0.914 1.00 0.00 H new ATOM 444 N ALA A 125 -31.736 -7.385 -5.555 1.00 0.00 N ATOM 445 CA ALA A 125 -31.582 -6.098 -6.262 1.00 0.00 C ATOM 446 C ALA A 125 -32.472 -4.999 -5.675 1.00 0.00 C ATOM 447 O ALA A 125 -32.065 -3.850 -5.614 1.00 0.00 O ATOM 448 CB ALA A 125 -31.809 -6.222 -7.764 1.00 0.00 C ATOM 0 H ALA A 125 -31.993 -8.160 -6.167 1.00 0.00 H new ATOM 0 HA ALA A 125 -30.543 -5.805 -6.109 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -31.683 -5.246 -8.233 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -31.087 -6.922 -8.184 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -32.819 -6.586 -7.950 1.00 0.00 H new ATOM 454 N LEU A 126 -33.640 -5.360 -5.148 1.00 0.00 N ATOM 455 CA LEU A 126 -34.550 -4.402 -4.506 1.00 0.00 C ATOM 456 C LEU A 126 -33.938 -3.816 -3.229 1.00 0.00 C ATOM 457 O LEU A 126 -34.001 -2.610 -3.016 1.00 0.00 O ATOM 458 CB LEU A 126 -35.899 -5.078 -4.216 1.00 0.00 C ATOM 459 CG LEU A 126 -37.006 -4.113 -3.738 1.00 0.00 C ATOM 460 CD1 LEU A 126 -37.292 -2.987 -4.736 1.00 0.00 C ATOM 461 CD2 LEU A 126 -38.299 -4.898 -3.518 1.00 0.00 C ATOM 0 H LEU A 126 -33.985 -6.320 -5.152 1.00 0.00 H new ATOM 0 HA LEU A 126 -34.715 -3.571 -5.191 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -36.240 -5.584 -5.119 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -35.751 -5.846 -3.457 1.00 0.00 H new ATOM 0 HG LEU A 126 -36.649 -3.657 -2.814 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -38.079 -2.343 -4.343 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -36.387 -2.400 -4.892 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -37.614 -3.415 -5.685 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -39.083 -4.220 -3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -38.603 -5.368 -4.453 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -38.134 -5.667 -2.763 1.00 0.00 H new ATOM 473 N VAL A 127 -33.272 -4.654 -2.425 1.00 0.00 N ATOM 474 CA VAL A 127 -32.526 -4.203 -1.235 1.00 0.00 C ATOM 475 C VAL A 127 -31.439 -3.208 -1.654 1.00 0.00 C ATOM 476 O VAL A 127 -31.327 -2.126 -1.082 1.00 0.00 O ATOM 477 CB VAL A 127 -31.889 -5.388 -0.485 1.00 0.00 C ATOM 478 CG1 VAL A 127 -31.204 -4.911 0.800 1.00 0.00 C ATOM 479 CG2 VAL A 127 -32.895 -6.463 -0.082 1.00 0.00 C ATOM 0 H VAL A 127 -33.233 -5.662 -2.577 1.00 0.00 H new ATOM 0 HA VAL A 127 -33.230 -3.718 -0.559 1.00 0.00 H new ATOM 0 HB VAL A 127 -31.175 -5.818 -1.188 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -30.761 -5.764 1.314 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -30.424 -4.192 0.551 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -31.940 -4.438 1.450 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -32.378 -7.267 0.442 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -33.649 -6.028 0.574 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -33.378 -6.862 -0.974 1.00 0.00 H new ATOM 489 N ILE A 128 -30.685 -3.551 -2.707 1.00 0.00 N ATOM 490 CA ILE A 128 -29.587 -2.725 -3.241 1.00 0.00 C ATOM 491 C ILE A 128 -30.128 -1.375 -3.730 1.00 0.00 C ATOM 492 O ILE A 128 -29.559 -0.330 -3.434 1.00 0.00 O ATOM 493 CB ILE A 128 -28.855 -3.434 -4.407 1.00 0.00 C ATOM 494 CG1 ILE A 128 -28.793 -4.962 -4.366 1.00 0.00 C ATOM 495 CG2 ILE A 128 -27.425 -2.938 -4.551 1.00 0.00 C ATOM 496 CD1 ILE A 128 -28.295 -5.647 -3.111 1.00 0.00 C ATOM 0 H ILE A 128 -30.820 -4.422 -3.221 1.00 0.00 H new ATOM 0 HA ILE A 128 -28.874 -2.567 -2.432 1.00 0.00 H new ATOM 0 HB ILE A 128 -29.485 -3.168 -5.256 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -29.796 -5.337 -4.568 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -28.159 -5.287 -5.191 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -26.941 -3.457 -5.379 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -27.430 -1.866 -4.748 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -26.877 -3.135 -3.630 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -28.316 -6.727 -3.253 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -27.273 -5.328 -2.904 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -28.936 -5.379 -2.271 1.00 0.00 H new ATOM 508 N ALA A 129 -31.265 -1.399 -4.436 1.00 0.00 N ATOM 509 CA ALA A 129 -31.910 -0.224 -5.026 1.00 0.00 C ATOM 510 C ALA A 129 -32.202 0.817 -3.939 1.00 0.00 C ATOM 511 O ALA A 129 -31.727 1.949 -4.009 1.00 0.00 O ATOM 512 CB ALA A 129 -33.225 -0.619 -5.734 1.00 0.00 C ATOM 0 H ALA A 129 -31.775 -2.263 -4.617 1.00 0.00 H new ATOM 0 HA ALA A 129 -31.231 0.204 -5.764 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -33.687 0.269 -6.165 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -33.011 -1.337 -6.526 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -33.906 -1.068 -5.012 1.00 0.00 H new ATOM 518 N GLN A 130 -32.914 0.398 -2.888 1.00 0.00 N ATOM 519 CA GLN A 130 -33.284 1.273 -1.768 1.00 0.00 C ATOM 520 C GLN A 130 -32.058 1.764 -0.994 1.00 0.00 C ATOM 521 O GLN A 130 -32.018 2.911 -0.552 1.00 0.00 O ATOM 522 CB GLN A 130 -34.217 0.541 -0.795 1.00 0.00 C ATOM 523 CG GLN A 130 -35.501 0.071 -1.488 1.00 0.00 C ATOM 524 CD GLN A 130 -36.615 -0.248 -0.496 1.00 0.00 C ATOM 525 OE1 GLN A 130 -37.524 0.541 -0.268 1.00 0.00 O ATOM 526 NE2 GLN A 130 -36.589 -1.401 0.143 1.00 0.00 N ATOM 0 H GLN A 130 -33.251 -0.559 -2.789 1.00 0.00 H new ATOM 0 HA GLN A 130 -33.793 2.134 -2.200 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -33.698 -0.318 -0.369 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -34.471 1.203 0.033 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -35.842 0.844 -2.177 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -35.285 -0.815 -2.085 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -35.838 -2.067 -0.037 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -37.320 -1.627 0.818 1.00 0.00 H new ATOM 535 N ALA A 131 -31.037 0.913 -0.887 1.00 0.00 N ATOM 536 CA ALA A 131 -29.782 1.242 -0.218 1.00 0.00 C ATOM 537 C ALA A 131 -28.941 2.290 -0.989 1.00 0.00 C ATOM 538 O ALA A 131 -28.179 3.043 -0.379 1.00 0.00 O ATOM 539 CB ALA A 131 -29.027 -0.067 0.003 1.00 0.00 C ATOM 0 H ALA A 131 -31.060 -0.033 -1.267 1.00 0.00 H new ATOM 0 HA ALA A 131 -29.991 1.721 0.739 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -28.080 0.139 0.503 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -29.627 -0.733 0.623 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -28.834 -0.542 -0.959 1.00 0.00 H new ATOM 545 N LEU A 132 -29.124 2.380 -2.313 1.00 0.00 N ATOM 546 CA LEU A 132 -28.562 3.426 -3.187 1.00 0.00 C ATOM 547 C LEU A 132 -29.480 4.657 -3.336 1.00 0.00 C ATOM 548 O LEU A 132 -29.036 5.690 -3.840 1.00 0.00 O ATOM 549 CB LEU A 132 -28.289 2.790 -4.562 1.00 0.00 C ATOM 550 CG LEU A 132 -27.001 1.959 -4.595 1.00 0.00 C ATOM 551 CD1 LEU A 132 -27.143 0.760 -5.524 1.00 0.00 C ATOM 552 CD2 LEU A 132 -25.834 2.793 -5.114 1.00 0.00 C ATOM 0 H LEU A 132 -29.688 1.703 -2.827 1.00 0.00 H new ATOM 0 HA LEU A 132 -27.645 3.799 -2.731 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -29.131 2.155 -4.835 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -28.226 3.577 -5.314 1.00 0.00 H new ATOM 0 HG LEU A 132 -26.816 1.627 -3.573 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -26.214 0.190 -5.527 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -27.958 0.125 -5.176 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -27.359 1.106 -6.535 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -24.930 2.184 -5.129 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -26.055 3.140 -6.123 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -25.682 3.652 -4.461 1.00 0.00 H new ATOM 564 N GLY A 133 -30.740 4.564 -2.897 1.00 0.00 N ATOM 565 CA GLY A 133 -31.749 5.627 -3.014 1.00 0.00 C ATOM 566 C GLY A 133 -32.610 5.551 -4.286 1.00 0.00 C ATOM 567 O GLY A 133 -33.368 6.479 -4.576 1.00 0.00 O ATOM 0 H GLY A 133 -31.097 3.726 -2.438 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -32.404 5.586 -2.144 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -31.245 6.593 -2.989 1.00 0.00 H new ATOM 571 N MET A 134 -32.508 4.449 -5.035 1.00 0.00 N ATOM 572 CA MET A 134 -33.384 4.104 -6.163 1.00 0.00 C ATOM 573 C MET A 134 -34.705 3.489 -5.657 1.00 0.00 C ATOM 574 O MET A 134 -34.902 3.289 -4.455 1.00 0.00 O ATOM 575 CB MET A 134 -32.665 3.140 -7.127 1.00 0.00 C ATOM 576 CG MET A 134 -31.217 3.517 -7.478 1.00 0.00 C ATOM 577 SD MET A 134 -31.004 5.144 -8.259 1.00 0.00 S ATOM 578 CE MET A 134 -29.856 5.932 -7.096 1.00 0.00 C ATOM 0 H MET A 134 -31.788 3.746 -4.868 1.00 0.00 H new ATOM 0 HA MET A 134 -33.623 5.018 -6.707 1.00 0.00 H new ATOM 0 HB2 MET A 134 -32.666 2.144 -6.685 1.00 0.00 H new ATOM 0 HB3 MET A 134 -33.241 3.080 -8.050 1.00 0.00 H new ATOM 0 HG2 MET A 134 -30.621 3.490 -6.566 1.00 0.00 H new ATOM 0 HG3 MET A 134 -30.813 2.756 -8.146 1.00 0.00 H new ATOM 0 HE1 MET A 134 -29.627 6.941 -7.438 1.00 0.00 H new ATOM 0 HE2 MET A 134 -30.314 5.979 -6.108 1.00 0.00 H new ATOM 0 HE3 MET A 134 -28.936 5.350 -7.042 1.00 0.00 H new ATOM 588 N ARG A 135 -35.630 3.190 -6.579 1.00 0.00 N ATOM 589 CA ARG A 135 -37.002 2.738 -6.249 1.00 0.00 C ATOM 590 C ARG A 135 -37.288 1.260 -6.529 1.00 0.00 C ATOM 591 O ARG A 135 -38.091 0.657 -5.819 1.00 0.00 O ATOM 592 CB ARG A 135 -38.033 3.642 -6.955 1.00 0.00 C ATOM 593 CG ARG A 135 -37.903 5.149 -6.682 1.00 0.00 C ATOM 594 CD ARG A 135 -37.820 5.501 -5.194 1.00 0.00 C ATOM 595 NE ARG A 135 -39.003 5.035 -4.439 1.00 0.00 N ATOM 596 CZ ARG A 135 -39.024 4.361 -3.300 1.00 0.00 C ATOM 597 NH1 ARG A 135 -37.937 3.996 -2.678 1.00 0.00 N ATOM 598 NH2 ARG A 135 -40.162 4.032 -2.759 1.00 0.00 N ATOM 0 H ARG A 135 -35.454 3.253 -7.582 1.00 0.00 H new ATOM 0 HA ARG A 135 -37.091 2.831 -5.167 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -37.954 3.479 -8.030 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -39.032 3.323 -6.656 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -37.012 5.525 -7.185 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -38.758 5.664 -7.121 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -36.921 5.056 -4.767 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -37.724 6.581 -5.083 1.00 0.00 H new ATOM 0 HE ARG A 135 -39.912 5.260 -4.844 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -37.024 4.229 -3.068 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -38.000 3.477 -1.802 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -41.037 4.294 -3.213 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -40.178 3.513 -1.881 1.00 0.00 H new ATOM 612 N THR A 136 -36.652 0.679 -7.549 1.00 0.00 N ATOM 613 CA THR A 136 -36.950 -0.678 -8.056 1.00 0.00 C ATOM 614 C THR A 136 -35.680 -1.477 -8.352 1.00 0.00 C ATOM 615 O THR A 136 -34.626 -0.917 -8.649 1.00 0.00 O ATOM 616 CB THR A 136 -37.826 -0.620 -9.327 1.00 0.00 C ATOM 617 OG1 THR A 136 -37.138 0.045 -10.363 1.00 0.00 O ATOM 618 CG2 THR A 136 -39.155 0.106 -9.113 1.00 0.00 C ATOM 0 H THR A 136 -35.900 1.141 -8.061 1.00 0.00 H new ATOM 0 HA THR A 136 -37.497 -1.187 -7.263 1.00 0.00 H new ATOM 0 HB THR A 136 -38.038 -1.657 -9.587 1.00 0.00 H new ATOM 0 HG1 THR A 136 -37.702 0.074 -11.164 1.00 0.00 H new ATOM 0 HG21 THR A 136 -39.721 0.111 -10.044 1.00 0.00 H new ATOM 0 HG22 THR A 136 -39.730 -0.407 -8.342 1.00 0.00 H new ATOM 0 HG23 THR A 136 -38.963 1.132 -8.800 1.00 0.00 H new ATOM 626 N ALA A 137 -35.787 -2.811 -8.352 1.00 0.00 N ATOM 627 CA ALA A 137 -34.694 -3.731 -8.702 1.00 0.00 C ATOM 628 C ALA A 137 -34.122 -3.506 -10.113 1.00 0.00 C ATOM 629 O ALA A 137 -32.929 -3.706 -10.355 1.00 0.00 O ATOM 630 CB ALA A 137 -35.254 -5.152 -8.567 1.00 0.00 C ATOM 0 H ALA A 137 -36.652 -3.292 -8.104 1.00 0.00 H new ATOM 0 HA ALA A 137 -33.855 -3.554 -8.029 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -34.477 -5.875 -8.817 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -35.586 -5.316 -7.542 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -36.098 -5.277 -9.246 1.00 0.00 H new ATOM 636 N LYS A 138 -34.957 -3.031 -11.037 1.00 0.00 N ATOM 637 CA LYS A 138 -34.578 -2.689 -12.415 1.00 0.00 C ATOM 638 C LYS A 138 -33.677 -1.462 -12.515 1.00 0.00 C ATOM 639 O LYS A 138 -32.874 -1.377 -13.442 1.00 0.00 O ATOM 640 CB LYS A 138 -35.877 -2.512 -13.200 1.00 0.00 C ATOM 641 CG LYS A 138 -35.672 -2.223 -14.696 1.00 0.00 C ATOM 642 CD LYS A 138 -36.991 -2.149 -15.482 1.00 0.00 C ATOM 643 CE LYS A 138 -37.699 -3.510 -15.571 1.00 0.00 C ATOM 644 NZ LYS A 138 -38.933 -3.431 -16.400 1.00 0.00 N ATOM 0 H LYS A 138 -35.945 -2.867 -10.846 1.00 0.00 H new ATOM 0 HA LYS A 138 -33.973 -3.493 -12.834 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -36.479 -3.415 -13.094 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -36.448 -1.695 -12.758 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -35.136 -1.280 -14.808 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -35.042 -3.001 -15.127 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -37.655 -1.428 -15.005 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -36.791 -1.781 -16.488 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -37.019 -4.247 -15.998 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -37.954 -3.855 -14.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -39.386 -4.367 -16.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -39.591 -2.745 -15.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -38.685 -3.126 -17.363 1.00 0.00 H new ATOM 658 N ASP A 139 -33.732 -0.557 -11.534 1.00 0.00 N ATOM 659 CA ASP A 139 -32.852 0.610 -11.516 1.00 0.00 C ATOM 660 C ASP A 139 -31.396 0.196 -11.263 1.00 0.00 C ATOM 661 O ASP A 139 -30.468 0.837 -11.742 1.00 0.00 O ATOM 662 CB ASP A 139 -33.355 1.620 -10.479 1.00 0.00 C ATOM 663 CG ASP A 139 -33.033 3.077 -10.875 1.00 0.00 C ATOM 664 OD1 ASP A 139 -31.902 3.361 -11.337 1.00 0.00 O ATOM 665 OD2 ASP A 139 -33.932 3.939 -10.729 1.00 0.00 O ATOM 0 H ASP A 139 -34.376 -0.611 -10.745 1.00 0.00 H new ATOM 0 HA ASP A 139 -32.874 1.092 -12.493 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -34.433 1.508 -10.359 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -32.902 1.400 -9.512 1.00 0.00 H new ATOM 670 N VAL A 140 -31.190 -0.929 -10.567 1.00 0.00 N ATOM 671 CA VAL A 140 -29.848 -1.383 -10.121 1.00 0.00 C ATOM 672 C VAL A 140 -29.288 -2.486 -10.994 1.00 0.00 C ATOM 673 O VAL A 140 -28.079 -2.602 -11.148 1.00 0.00 O ATOM 674 CB VAL A 140 -29.833 -1.913 -8.676 1.00 0.00 C ATOM 675 CG1 VAL A 140 -28.797 -1.223 -7.825 1.00 0.00 C ATOM 676 CG2 VAL A 140 -31.159 -1.834 -7.950 1.00 0.00 C ATOM 0 H VAL A 140 -31.945 -1.558 -10.292 1.00 0.00 H new ATOM 0 HA VAL A 140 -29.235 -0.485 -10.193 1.00 0.00 H new ATOM 0 HB VAL A 140 -29.588 -2.967 -8.806 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -28.825 -1.631 -6.815 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -27.808 -1.384 -8.254 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -29.008 -0.154 -7.790 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -31.046 -2.231 -6.941 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -31.483 -0.795 -7.897 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -31.904 -2.420 -8.489 1.00 0.00 H new ATOM 686 N ASN A 141 -30.177 -3.307 -11.545 1.00 0.00 N ATOM 687 CA ASN A 141 -29.874 -4.480 -12.370 1.00 0.00 C ATOM 688 C ASN A 141 -28.788 -4.201 -13.413 1.00 0.00 C ATOM 689 O ASN A 141 -27.873 -5.005 -13.552 1.00 0.00 O ATOM 690 CB ASN A 141 -31.170 -4.976 -13.044 1.00 0.00 C ATOM 691 CG ASN A 141 -31.589 -6.331 -12.503 1.00 0.00 C ATOM 692 OD1 ASN A 141 -31.402 -7.364 -13.126 1.00 0.00 O ATOM 693 ND2 ASN A 141 -32.135 -6.369 -11.307 1.00 0.00 N ATOM 0 H ASN A 141 -31.180 -3.168 -11.424 1.00 0.00 H new ATOM 0 HA ASN A 141 -29.477 -5.257 -11.717 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -31.969 -4.253 -12.878 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -31.020 -5.043 -14.121 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -32.404 -7.264 -10.897 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -32.290 -5.504 -10.789 1.00 0.00 H new ATOM 700 N ARG A 142 -28.837 -3.031 -14.064 1.00 0.00 N ATOM 701 CA ARG A 142 -27.826 -2.564 -15.029 1.00 0.00 C ATOM 702 C ARG A 142 -26.405 -2.559 -14.456 1.00 0.00 C ATOM 703 O ARG A 142 -25.484 -3.036 -15.101 1.00 0.00 O ATOM 704 CB ARG A 142 -28.205 -1.160 -15.524 1.00 0.00 C ATOM 705 CG ARG A 142 -28.054 -1.046 -17.047 1.00 0.00 C ATOM 706 CD ARG A 142 -28.392 0.370 -17.522 1.00 0.00 C ATOM 707 NE ARG A 142 -28.304 0.481 -18.992 1.00 0.00 N ATOM 708 CZ ARG A 142 -28.500 1.572 -19.713 1.00 0.00 C ATOM 709 NH1 ARG A 142 -28.786 2.721 -19.167 1.00 0.00 N ATOM 710 NH2 ARG A 142 -28.412 1.529 -21.012 1.00 0.00 N ATOM 0 H ARG A 142 -29.598 -2.365 -13.933 1.00 0.00 H new ATOM 0 HA ARG A 142 -27.820 -3.270 -15.860 1.00 0.00 H new ATOM 0 HB2 ARG A 142 -29.234 -0.938 -15.241 1.00 0.00 H new ATOM 0 HB3 ARG A 142 -27.573 -0.417 -15.037 1.00 0.00 H new ATOM 0 HG2 ARG A 142 -27.033 -1.297 -17.336 1.00 0.00 H new ATOM 0 HG3 ARG A 142 -28.710 -1.765 -17.537 1.00 0.00 H new ATOM 0 HD2 ARG A 142 -29.398 0.635 -17.195 1.00 0.00 H new ATOM 0 HD3 ARG A 142 -27.709 1.083 -17.060 1.00 0.00 H new ATOM 0 HE ARG A 142 -28.068 -0.370 -19.503 1.00 0.00 H new ATOM 0 HH11 ARG A 142 -28.865 2.798 -18.153 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -28.931 3.543 -19.754 1.00 0.00 H new ATOM 0 HH21 ARG A 142 -28.191 0.650 -21.479 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -28.564 2.375 -21.562 1.00 0.00 H new ATOM 724 N ASP A 143 -26.236 -2.060 -13.232 1.00 0.00 N ATOM 725 CA ASP A 143 -24.957 -2.068 -12.513 1.00 0.00 C ATOM 726 C ASP A 143 -24.620 -3.461 -11.962 1.00 0.00 C ATOM 727 O ASP A 143 -23.486 -3.924 -12.073 1.00 0.00 O ATOM 728 CB ASP A 143 -24.991 -1.034 -11.373 1.00 0.00 C ATOM 729 CG ASP A 143 -24.718 0.383 -11.874 1.00 0.00 C ATOM 730 OD1 ASP A 143 -23.550 0.737 -12.147 1.00 0.00 O ATOM 731 OD2 ASP A 143 -25.688 1.165 -11.979 1.00 0.00 O ATOM 0 H ASP A 143 -26.994 -1.631 -12.701 1.00 0.00 H new ATOM 0 HA ASP A 143 -24.173 -1.800 -13.221 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -25.966 -1.064 -10.886 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -24.250 -1.301 -10.620 1.00 0.00 H new ATOM 736 N LEU A 144 -25.618 -4.157 -11.411 1.00 0.00 N ATOM 737 CA LEU A 144 -25.466 -5.478 -10.794 1.00 0.00 C ATOM 738 C LEU A 144 -24.958 -6.536 -11.787 1.00 0.00 C ATOM 739 O LEU A 144 -23.935 -7.184 -11.557 1.00 0.00 O ATOM 740 CB LEU A 144 -26.822 -5.905 -10.211 1.00 0.00 C ATOM 741 CG LEU A 144 -27.267 -5.121 -8.968 1.00 0.00 C ATOM 742 CD1 LEU A 144 -28.683 -5.499 -8.572 1.00 0.00 C ATOM 743 CD2 LEU A 144 -26.383 -5.426 -7.764 1.00 0.00 C ATOM 0 H LEU A 144 -26.577 -3.810 -11.381 1.00 0.00 H new ATOM 0 HA LEU A 144 -24.715 -5.404 -10.007 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -27.584 -5.796 -10.983 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -26.775 -6.964 -9.957 1.00 0.00 H new ATOM 0 HG LEU A 144 -27.198 -4.066 -9.233 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -28.978 -4.932 -7.689 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -29.363 -5.272 -9.393 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -28.726 -6.565 -8.349 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -26.729 -4.853 -6.904 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -26.435 -6.490 -7.535 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -25.352 -5.153 -7.991 1.00 0.00 H new ATOM 755 N TYR A 145 -25.632 -6.662 -12.934 1.00 0.00 N ATOM 756 CA TYR A 145 -25.250 -7.602 -13.996 1.00 0.00 C ATOM 757 C TYR A 145 -23.899 -7.225 -14.600 1.00 0.00 C ATOM 758 O TYR A 145 -23.112 -8.107 -14.946 1.00 0.00 O ATOM 759 CB TYR A 145 -26.345 -7.703 -15.071 1.00 0.00 C ATOM 760 CG TYR A 145 -26.084 -6.985 -16.385 1.00 0.00 C ATOM 761 CD1 TYR A 145 -25.286 -7.584 -17.380 1.00 0.00 C ATOM 762 CD2 TYR A 145 -26.645 -5.716 -16.610 1.00 0.00 C ATOM 763 CE1 TYR A 145 -25.062 -6.916 -18.600 1.00 0.00 C ATOM 764 CE2 TYR A 145 -26.449 -5.055 -17.836 1.00 0.00 C ATOM 765 CZ TYR A 145 -25.653 -5.655 -18.837 1.00 0.00 C ATOM 766 OH TYR A 145 -25.452 -5.026 -20.025 1.00 0.00 O ATOM 0 H TYR A 145 -26.463 -6.113 -13.155 1.00 0.00 H new ATOM 0 HA TYR A 145 -25.145 -8.590 -13.549 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -26.512 -8.758 -15.288 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -27.272 -7.314 -14.649 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -24.846 -8.555 -17.207 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -27.231 -5.245 -15.835 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -24.437 -7.369 -19.356 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -26.905 -4.092 -18.011 1.00 0.00 H new ATOM 0 HH TYR A 145 -25.929 -4.170 -20.027 1.00 0.00 H new ATOM 776 N ARG A 146 -23.591 -5.922 -14.663 1.00 0.00 N ATOM 777 CA ARG A 146 -22.295 -5.447 -15.150 1.00 0.00 C ATOM 778 C ARG A 146 -21.166 -5.903 -14.232 1.00 0.00 C ATOM 779 O ARG A 146 -20.180 -6.426 -14.741 1.00 0.00 O ATOM 780 CB ARG A 146 -22.314 -3.922 -15.346 1.00 0.00 C ATOM 781 CG ARG A 146 -22.845 -3.551 -16.738 1.00 0.00 C ATOM 782 CD ARG A 146 -22.935 -2.029 -16.904 1.00 0.00 C ATOM 783 NE ARG A 146 -23.437 -1.665 -18.244 1.00 0.00 N ATOM 784 CZ ARG A 146 -23.783 -0.458 -18.657 1.00 0.00 C ATOM 785 NH1 ARG A 146 -23.733 0.583 -17.873 1.00 0.00 N ATOM 786 NH2 ARG A 146 -24.191 -0.271 -19.880 1.00 0.00 N ATOM 0 H ARG A 146 -24.228 -5.177 -14.380 1.00 0.00 H new ATOM 0 HA ARG A 146 -22.105 -5.892 -16.126 1.00 0.00 H new ATOM 0 HB2 ARG A 146 -22.938 -3.461 -14.580 1.00 0.00 H new ATOM 0 HB3 ARG A 146 -21.308 -3.523 -15.219 1.00 0.00 H new ATOM 0 HG2 ARG A 146 -22.189 -3.966 -17.504 1.00 0.00 H new ATOM 0 HG3 ARG A 146 -23.829 -3.995 -16.886 1.00 0.00 H new ATOM 0 HD2 ARG A 146 -23.595 -1.616 -16.141 1.00 0.00 H new ATOM 0 HD3 ARG A 146 -21.952 -1.585 -16.749 1.00 0.00 H new ATOM 0 HE ARG A 146 -23.526 -2.423 -18.921 1.00 0.00 H new ATOM 0 HH11 ARG A 146 -23.419 0.480 -16.908 1.00 0.00 H new ATOM 0 HH12 ARG A 146 -24.008 1.500 -18.225 1.00 0.00 H new ATOM 0 HH21 ARG A 146 -24.245 -1.059 -20.526 1.00 0.00 H new ATOM 0 HH22 ARG A 146 -24.456 0.663 -20.192 1.00 0.00 H new ATOM 800 N MET A 147 -21.339 -5.844 -12.905 1.00 0.00 N ATOM 801 CA MET A 147 -20.367 -6.390 -11.948 1.00 0.00 C ATOM 802 C MET A 147 -20.234 -7.917 -12.065 1.00 0.00 C ATOM 803 O MET A 147 -19.141 -8.458 -11.923 1.00 0.00 O ATOM 804 CB MET A 147 -20.766 -6.048 -10.513 1.00 0.00 C ATOM 805 CG MET A 147 -20.809 -4.569 -10.176 1.00 0.00 C ATOM 806 SD MET A 147 -20.322 -4.141 -8.484 1.00 0.00 S ATOM 807 CE MET A 147 -18.675 -3.472 -8.803 1.00 0.00 C ATOM 0 H MET A 147 -22.155 -5.418 -12.465 1.00 0.00 H new ATOM 0 HA MET A 147 -19.408 -5.933 -12.191 1.00 0.00 H new ATOM 0 HB2 MET A 147 -21.750 -6.475 -10.317 1.00 0.00 H new ATOM 0 HB3 MET A 147 -20.066 -6.536 -9.835 1.00 0.00 H new ATOM 0 HG2 MET A 147 -20.157 -4.037 -10.869 1.00 0.00 H new ATOM 0 HG3 MET A 147 -21.822 -4.204 -10.347 1.00 0.00 H new ATOM 0 HE1 MET A 147 -18.063 -3.569 -7.906 1.00 0.00 H new ATOM 0 HE2 MET A 147 -18.210 -4.023 -9.621 1.00 0.00 H new ATOM 0 HE3 MET A 147 -18.756 -2.420 -9.075 1.00 0.00 H new ATOM 817 N LYS A 148 -21.319 -8.645 -12.346 1.00 0.00 N ATOM 818 CA LYS A 148 -21.268 -10.098 -12.612 1.00 0.00 C ATOM 819 C LYS A 148 -20.495 -10.435 -13.886 1.00 0.00 C ATOM 820 O LYS A 148 -19.635 -11.313 -13.872 1.00 0.00 O ATOM 821 CB LYS A 148 -22.692 -10.688 -12.575 1.00 0.00 C ATOM 822 CG LYS A 148 -22.767 -12.134 -13.087 1.00 0.00 C ATOM 823 CD LYS A 148 -24.129 -12.751 -12.736 1.00 0.00 C ATOM 824 CE LYS A 148 -24.313 -14.179 -13.283 1.00 0.00 C ATOM 825 NZ LYS A 148 -23.335 -15.164 -12.727 1.00 0.00 N ATOM 0 H LYS A 148 -22.258 -8.251 -12.397 1.00 0.00 H new ATOM 0 HA LYS A 148 -20.697 -10.578 -11.817 1.00 0.00 H new ATOM 0 HB2 LYS A 148 -23.065 -10.653 -11.551 1.00 0.00 H new ATOM 0 HB3 LYS A 148 -23.352 -10.063 -13.176 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -22.618 -12.153 -14.167 1.00 0.00 H new ATOM 0 HG3 LYS A 148 -21.966 -12.726 -12.644 1.00 0.00 H new ATOM 0 HD2 LYS A 148 -24.244 -12.768 -11.652 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -24.921 -12.114 -13.131 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -25.324 -14.518 -13.058 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -24.218 -14.158 -14.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -23.558 -16.115 -13.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -22.373 -14.901 -13.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -23.393 -15.163 -11.689 1.00 0.00 H new ATOM 839 N SER A 149 -20.703 -9.656 -14.943 1.00 0.00 N ATOM 840 CA SER A 149 -19.980 -9.772 -16.215 1.00 0.00 C ATOM 841 C SER A 149 -18.466 -9.488 -16.095 1.00 0.00 C ATOM 842 O SER A 149 -17.703 -9.888 -16.978 1.00 0.00 O ATOM 843 CB SER A 149 -20.659 -8.843 -17.228 1.00 0.00 C ATOM 844 OG SER A 149 -20.247 -9.127 -18.554 1.00 0.00 O ATOM 0 H SER A 149 -21.395 -8.907 -14.944 1.00 0.00 H new ATOM 0 HA SER A 149 -20.033 -10.807 -16.553 1.00 0.00 H new ATOM 0 HB2 SER A 149 -21.741 -8.950 -17.152 1.00 0.00 H new ATOM 0 HB3 SER A 149 -20.423 -7.806 -16.987 1.00 0.00 H new ATOM 0 HG SER A 149 -20.699 -8.518 -19.175 1.00 0.00 H new ATOM 850 N ARG A 150 -18.000 -8.860 -14.993 1.00 0.00 N ATOM 851 CA ARG A 150 -16.575 -8.590 -14.721 1.00 0.00 C ATOM 852 C ARG A 150 -15.993 -9.351 -13.524 1.00 0.00 C ATOM 853 O ARG A 150 -14.914 -8.990 -13.061 1.00 0.00 O ATOM 854 CB ARG A 150 -16.322 -7.077 -14.657 1.00 0.00 C ATOM 855 CG ARG A 150 -17.009 -6.409 -13.466 1.00 0.00 C ATOM 856 CD ARG A 150 -16.397 -5.051 -13.097 1.00 0.00 C ATOM 857 NE ARG A 150 -16.134 -4.200 -14.280 1.00 0.00 N ATOM 858 CZ ARG A 150 -15.794 -2.927 -14.239 1.00 0.00 C ATOM 859 NH1 ARG A 150 -16.037 -2.190 -13.205 1.00 0.00 N ATOM 860 NH2 ARG A 150 -15.184 -2.357 -15.238 1.00 0.00 N ATOM 0 H ARG A 150 -18.617 -8.521 -14.255 1.00 0.00 H new ATOM 0 HA ARG A 150 -16.017 -8.995 -15.565 1.00 0.00 H new ATOM 0 HB2 ARG A 150 -15.249 -6.895 -14.600 1.00 0.00 H new ATOM 0 HB3 ARG A 150 -16.675 -6.615 -15.579 1.00 0.00 H new ATOM 0 HG2 ARG A 150 -18.066 -6.274 -13.694 1.00 0.00 H new ATOM 0 HG3 ARG A 150 -16.952 -7.072 -12.603 1.00 0.00 H new ATOM 0 HD2 ARG A 150 -17.071 -4.526 -12.420 1.00 0.00 H new ATOM 0 HD3 ARG A 150 -15.464 -5.213 -12.557 1.00 0.00 H new ATOM 0 HE ARG A 150 -16.223 -4.633 -15.199 1.00 0.00 H new ATOM 0 HH11 ARG A 150 -16.504 -2.591 -12.391 1.00 0.00 H new ATOM 0 HH12 ARG A 150 -15.762 -1.208 -13.203 1.00 0.00 H new ATOM 0 HH21 ARG A 150 -14.960 -2.897 -16.074 1.00 0.00 H new ATOM 0 HH22 ARG A 150 -14.930 -1.371 -15.185 1.00 0.00 H new ATOM 874 N HIS A 151 -16.686 -10.391 -13.039 1.00 0.00 N ATOM 875 CA HIS A 151 -16.236 -11.288 -11.957 1.00 0.00 C ATOM 876 C HIS A 151 -16.226 -10.614 -10.565 1.00 0.00 C ATOM 877 O HIS A 151 -15.340 -10.865 -9.747 1.00 0.00 O ATOM 878 CB HIS A 151 -14.907 -11.929 -12.419 1.00 0.00 C ATOM 879 CG HIS A 151 -14.396 -13.186 -11.750 1.00 0.00 C ATOM 880 ND1 HIS A 151 -13.486 -13.240 -10.685 1.00 0.00 N ATOM 881 CD2 HIS A 151 -14.501 -14.437 -12.289 1.00 0.00 C ATOM 882 CE1 HIS A 151 -13.097 -14.523 -10.588 1.00 0.00 C ATOM 883 NE2 HIS A 151 -13.683 -15.261 -11.546 1.00 0.00 N ATOM 0 H HIS A 151 -17.607 -10.642 -13.399 1.00 0.00 H new ATOM 0 HA HIS A 151 -16.953 -12.092 -11.788 1.00 0.00 H new ATOM 0 HB2 HIS A 151 -15.005 -12.146 -13.483 1.00 0.00 H new ATOM 0 HB3 HIS A 151 -14.130 -11.171 -12.319 1.00 0.00 H new ATOM 0 HD2 HIS A 151 -15.108 -14.725 -13.135 1.00 0.00 H new ATOM 0 HE1 HIS A 151 -12.412 -14.906 -9.846 1.00 0.00 H new ATOM 0 HE2 HIS A 151 -13.546 -16.260 -11.698 1.00 0.00 H new ATOM 891 N LEU A 152 -17.218 -9.745 -10.290 1.00 0.00 N ATOM 892 CA LEU A 152 -17.349 -8.975 -9.039 1.00 0.00 C ATOM 893 C LEU A 152 -18.665 -9.231 -8.295 1.00 0.00 C ATOM 894 O LEU A 152 -18.656 -9.222 -7.069 1.00 0.00 O ATOM 895 CB LEU A 152 -17.211 -7.467 -9.320 1.00 0.00 C ATOM 896 CG LEU A 152 -15.767 -6.944 -9.171 1.00 0.00 C ATOM 897 CD1 LEU A 152 -14.841 -7.406 -10.292 1.00 0.00 C ATOM 898 CD2 LEU A 152 -15.781 -5.422 -9.205 1.00 0.00 C ATOM 0 H LEU A 152 -17.971 -9.554 -10.951 1.00 0.00 H new ATOM 0 HA LEU A 152 -16.542 -9.319 -8.392 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -17.562 -7.260 -10.331 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -17.860 -6.917 -8.639 1.00 0.00 H new ATOM 0 HG LEU A 152 -15.393 -7.340 -8.227 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -13.841 -7.004 -10.127 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -14.797 -8.495 -10.302 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -15.222 -7.050 -11.249 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -14.763 -5.046 -9.100 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -16.197 -5.083 -10.154 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -16.393 -5.045 -8.385 1.00 0.00 H new ATOM 910 N LEU A 153 -19.777 -9.485 -8.994 1.00 0.00 N ATOM 911 CA LEU A 153 -21.065 -9.896 -8.401 1.00 0.00 C ATOM 912 C LEU A 153 -21.523 -11.285 -8.888 1.00 0.00 C ATOM 913 O LEU A 153 -21.097 -11.746 -9.938 1.00 0.00 O ATOM 914 CB LEU A 153 -22.142 -8.857 -8.703 1.00 0.00 C ATOM 915 CG LEU A 153 -22.472 -7.916 -7.534 1.00 0.00 C ATOM 916 CD1 LEU A 153 -21.281 -7.231 -6.875 1.00 0.00 C ATOM 917 CD2 LEU A 153 -23.457 -6.860 -7.982 1.00 0.00 C ATOM 0 H LEU A 153 -19.812 -9.410 -10.011 1.00 0.00 H new ATOM 0 HA LEU A 153 -20.912 -9.964 -7.324 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -21.821 -8.257 -9.555 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -23.053 -9.375 -9.003 1.00 0.00 H new ATOM 0 HG LEU A 153 -22.893 -8.570 -6.771 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -21.631 -6.592 -6.064 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -20.603 -7.985 -6.475 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -20.756 -6.625 -7.613 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -23.685 -6.198 -7.147 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -23.023 -6.280 -8.797 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -24.374 -7.340 -8.325 1.00 0.00 H new ATOM 929 N ASP A 154 -22.445 -11.927 -8.177 1.00 0.00 N ATOM 930 CA ASP A 154 -23.112 -13.167 -8.575 1.00 0.00 C ATOM 931 C ASP A 154 -24.571 -13.165 -8.100 1.00 0.00 C ATOM 932 O ASP A 154 -24.832 -13.073 -6.905 1.00 0.00 O ATOM 933 CB ASP A 154 -22.400 -14.395 -7.983 1.00 0.00 C ATOM 934 CG ASP A 154 -22.776 -15.680 -8.748 1.00 0.00 C ATOM 935 OD1 ASP A 154 -22.991 -15.615 -9.985 1.00 0.00 O ATOM 936 OD2 ASP A 154 -22.843 -16.758 -8.112 1.00 0.00 O ATOM 0 H ASP A 154 -22.762 -11.585 -7.270 1.00 0.00 H new ATOM 0 HA ASP A 154 -23.076 -13.224 -9.663 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -21.321 -14.247 -8.023 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -22.668 -14.503 -6.932 1.00 0.00 H new ATOM 941 N MET A 155 -25.536 -13.271 -9.010 1.00 0.00 N ATOM 942 CA MET A 155 -26.950 -13.445 -8.651 1.00 0.00 C ATOM 943 C MET A 155 -27.324 -14.926 -8.473 1.00 0.00 C ATOM 944 O MET A 155 -26.862 -15.791 -9.223 1.00 0.00 O ATOM 945 CB MET A 155 -27.846 -12.771 -9.689 1.00 0.00 C ATOM 946 CG MET A 155 -29.288 -12.609 -9.177 1.00 0.00 C ATOM 947 SD MET A 155 -30.490 -11.985 -10.382 1.00 0.00 S ATOM 948 CE MET A 155 -30.605 -13.427 -11.475 1.00 0.00 C ATOM 0 H MET A 155 -25.366 -13.239 -10.015 1.00 0.00 H new ATOM 0 HA MET A 155 -27.109 -12.963 -7.686 1.00 0.00 H new ATOM 0 HB2 MET A 155 -27.438 -11.793 -9.942 1.00 0.00 H new ATOM 0 HB3 MET A 155 -27.849 -13.361 -10.605 1.00 0.00 H new ATOM 0 HG2 MET A 155 -29.635 -13.576 -8.814 1.00 0.00 H new ATOM 0 HG3 MET A 155 -29.276 -11.933 -8.322 1.00 0.00 H new ATOM 0 HE1 MET A 155 -31.442 -13.298 -12.161 1.00 0.00 H new ATOM 0 HE2 MET A 155 -29.681 -13.526 -12.045 1.00 0.00 H new ATOM 0 HE3 MET A 155 -30.761 -14.325 -10.877 1.00 0.00 H new ATOM 958 N ASP A 156 -28.215 -15.209 -7.522 1.00 0.00 N ATOM 959 CA ASP A 156 -28.806 -16.520 -7.281 1.00 0.00 C ATOM 960 C ASP A 156 -30.165 -16.613 -7.967 1.00 0.00 C ATOM 961 O ASP A 156 -31.064 -15.823 -7.705 1.00 0.00 O ATOM 962 CB ASP A 156 -28.968 -16.764 -5.774 1.00 0.00 C ATOM 963 CG ASP A 156 -28.543 -18.187 -5.395 1.00 0.00 C ATOM 964 OD1 ASP A 156 -29.242 -19.139 -5.813 1.00 0.00 O ATOM 965 OD2 ASP A 156 -27.529 -18.358 -4.677 1.00 0.00 O ATOM 0 H ASP A 156 -28.557 -14.500 -6.873 1.00 0.00 H new ATOM 0 HA ASP A 156 -28.143 -17.281 -7.692 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -28.368 -16.042 -5.219 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -30.007 -16.603 -5.486 1.00 0.00 H new ATOM 970 N GLU A 157 -30.357 -17.628 -8.784 1.00 0.00 N ATOM 971 CA GLU A 157 -31.611 -17.902 -9.496 1.00 0.00 C ATOM 972 C GLU A 157 -32.728 -18.462 -8.589 1.00 0.00 C ATOM 973 O GLU A 157 -33.861 -18.654 -9.034 1.00 0.00 O ATOM 974 CB GLU A 157 -31.337 -18.769 -10.720 1.00 0.00 C ATOM 975 CG GLU A 157 -30.774 -20.141 -10.370 1.00 0.00 C ATOM 976 CD GLU A 157 -29.240 -20.198 -10.501 1.00 0.00 C ATOM 977 OE1 GLU A 157 -28.532 -19.694 -9.595 1.00 0.00 O ATOM 978 OE2 GLU A 157 -28.734 -20.752 -11.509 1.00 0.00 O ATOM 0 H GLU A 157 -29.628 -18.313 -8.984 1.00 0.00 H new ATOM 0 HA GLU A 157 -32.009 -16.948 -9.842 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -32.262 -18.896 -11.282 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -30.635 -18.252 -11.374 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -31.058 -20.398 -9.350 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -31.220 -20.891 -11.023 1.00 0.00 H new ATOM 985 N GLN A 158 -32.408 -18.708 -7.314 1.00 0.00 N ATOM 986 CA GLN A 158 -33.312 -19.325 -6.331 1.00 0.00 C ATOM 987 C GLN A 158 -34.144 -18.289 -5.552 1.00 0.00 C ATOM 988 O GLN A 158 -35.298 -18.552 -5.208 1.00 0.00 O ATOM 989 CB GLN A 158 -32.478 -20.189 -5.372 1.00 0.00 C ATOM 990 CG GLN A 158 -31.833 -21.396 -6.072 1.00 0.00 C ATOM 991 CD GLN A 158 -30.948 -22.194 -5.116 1.00 0.00 C ATOM 992 OE1 GLN A 158 -31.296 -23.272 -4.648 1.00 0.00 O ATOM 993 NE2 GLN A 158 -29.778 -21.693 -4.785 1.00 0.00 N ATOM 0 H GLN A 158 -31.493 -18.479 -6.926 1.00 0.00 H new ATOM 0 HA GLN A 158 -34.031 -19.943 -6.869 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -31.698 -19.575 -4.922 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -33.114 -20.542 -4.560 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -32.612 -22.044 -6.473 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -31.238 -21.052 -6.918 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -29.480 -20.797 -5.169 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -29.169 -22.201 -4.144 1.00 0.00 H new ATOM 1002 N SER A 159 -33.564 -17.109 -5.286 1.00 0.00 N ATOM 1003 CA SER A 159 -34.198 -16.007 -4.532 1.00 0.00 C ATOM 1004 C SER A 159 -33.871 -14.611 -5.104 1.00 0.00 C ATOM 1005 O SER A 159 -34.137 -13.596 -4.461 1.00 0.00 O ATOM 1006 CB SER A 159 -33.780 -16.139 -3.055 1.00 0.00 C ATOM 1007 OG SER A 159 -34.635 -15.425 -2.174 1.00 0.00 O ATOM 0 H SER A 159 -32.618 -16.885 -5.595 1.00 0.00 H new ATOM 0 HA SER A 159 -35.281 -16.094 -4.625 1.00 0.00 H new ATOM 0 HB2 SER A 159 -33.777 -17.193 -2.776 1.00 0.00 H new ATOM 0 HB3 SER A 159 -32.759 -15.775 -2.937 1.00 0.00 H new ATOM 0 HG SER A 159 -34.327 -15.543 -1.251 1.00 0.00 H new ATOM 1013 N LYS A 160 -33.253 -14.553 -6.300 1.00 0.00 N ATOM 1014 CA LYS A 160 -32.659 -13.357 -6.945 1.00 0.00 C ATOM 1015 C LYS A 160 -31.698 -12.584 -6.036 1.00 0.00 C ATOM 1016 O LYS A 160 -31.662 -11.354 -6.037 1.00 0.00 O ATOM 1017 CB LYS A 160 -33.729 -12.474 -7.610 1.00 0.00 C ATOM 1018 CG LYS A 160 -34.692 -13.207 -8.559 1.00 0.00 C ATOM 1019 CD LYS A 160 -34.025 -13.760 -9.828 1.00 0.00 C ATOM 1020 CE LYS A 160 -35.104 -14.398 -10.717 1.00 0.00 C ATOM 1021 NZ LYS A 160 -34.567 -14.839 -12.035 1.00 0.00 N ATOM 0 H LYS A 160 -33.147 -15.386 -6.879 1.00 0.00 H new ATOM 0 HA LYS A 160 -32.025 -13.725 -7.751 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -34.314 -11.991 -6.828 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -33.228 -11.683 -8.168 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -35.160 -14.031 -8.019 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -35.489 -12.523 -8.850 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -33.517 -12.960 -10.366 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -33.268 -14.498 -9.565 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -35.538 -15.254 -10.200 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -35.909 -13.681 -10.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -35.332 -15.262 -12.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -34.177 -14.020 -12.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -33.817 -15.543 -11.886 1.00 0.00 H new ATOM 1035 N ALA A 161 -30.922 -13.323 -5.243 1.00 0.00 N ATOM 1036 CA ALA A 161 -30.001 -12.744 -4.265 1.00 0.00 C ATOM 1037 C ALA A 161 -28.663 -12.420 -4.934 1.00 0.00 C ATOM 1038 O ALA A 161 -27.977 -13.313 -5.422 1.00 0.00 O ATOM 1039 CB ALA A 161 -29.849 -13.693 -3.070 1.00 0.00 C ATOM 0 H ALA A 161 -30.914 -14.343 -5.261 1.00 0.00 H new ATOM 0 HA ALA A 161 -30.403 -11.805 -3.883 1.00 0.00 H new ATOM 0 HB1 ALA A 161 -29.162 -13.257 -2.344 1.00 0.00 H new ATOM 0 HB2 ALA A 161 -30.821 -13.847 -2.602 1.00 0.00 H new ATOM 0 HB3 ALA A 161 -29.455 -14.650 -3.413 1.00 0.00 H new ATOM 1045 N TRP A 162 -28.291 -11.145 -4.955 1.00 0.00 N ATOM 1046 CA TRP A 162 -26.981 -10.677 -5.388 1.00 0.00 C ATOM 1047 C TRP A 162 -25.963 -10.822 -4.260 1.00 0.00 C ATOM 1048 O TRP A 162 -26.110 -10.265 -3.174 1.00 0.00 O ATOM 1049 CB TRP A 162 -27.087 -9.238 -5.896 1.00 0.00 C ATOM 1050 CG TRP A 162 -27.840 -9.143 -7.181 1.00 0.00 C ATOM 1051 CD1 TRP A 162 -29.161 -8.901 -7.319 1.00 0.00 C ATOM 1052 CD2 TRP A 162 -27.321 -9.308 -8.530 1.00 0.00 C ATOM 1053 NE1 TRP A 162 -29.499 -8.948 -8.661 1.00 0.00 N ATOM 1054 CE2 TRP A 162 -28.394 -9.159 -9.457 1.00 0.00 C ATOM 1055 CE3 TRP A 162 -26.036 -9.540 -9.058 1.00 0.00 C ATOM 1056 CZ2 TRP A 162 -28.199 -9.232 -10.844 1.00 0.00 C ATOM 1057 CZ3 TRP A 162 -25.828 -9.602 -10.448 1.00 0.00 C ATOM 1058 CH2 TRP A 162 -26.907 -9.463 -11.341 1.00 0.00 C ATOM 0 H TRP A 162 -28.910 -10.388 -4.663 1.00 0.00 H new ATOM 0 HA TRP A 162 -26.627 -11.293 -6.215 1.00 0.00 H new ATOM 0 HB2 TRP A 162 -27.581 -8.625 -5.142 1.00 0.00 H new ATOM 0 HB3 TRP A 162 -26.086 -8.829 -6.033 1.00 0.00 H new ATOM 0 HD1 TRP A 162 -29.847 -8.702 -6.509 1.00 0.00 H new ATOM 0 HE1 TRP A 162 -30.449 -8.840 -9.017 1.00 0.00 H new ATOM 0 HE3 TRP A 162 -25.200 -9.672 -8.387 1.00 0.00 H new ATOM 0 HZ2 TRP A 162 -29.032 -9.112 -11.521 1.00 0.00 H new ATOM 0 HZ3 TRP A 162 -24.831 -9.758 -10.833 1.00 0.00 H new ATOM 0 HH2 TRP A 162 -26.741 -9.534 -12.406 1.00 0.00 H new ATOM 1069 N THR A 163 -24.913 -11.579 -4.541 1.00 0.00 N ATOM 1070 CA THR A 163 -23.710 -11.754 -3.722 1.00 0.00 C ATOM 1071 C THR A 163 -22.521 -11.119 -4.451 1.00 0.00 C ATOM 1072 O THR A 163 -22.591 -10.797 -5.637 1.00 0.00 O ATOM 1073 CB THR A 163 -23.470 -13.250 -3.372 1.00 0.00 C ATOM 1074 OG1 THR A 163 -22.461 -13.829 -4.169 1.00 0.00 O ATOM 1075 CG2 THR A 163 -24.684 -14.182 -3.508 1.00 0.00 C ATOM 0 H THR A 163 -24.870 -12.125 -5.401 1.00 0.00 H new ATOM 0 HA THR A 163 -23.839 -11.248 -2.765 1.00 0.00 H new ATOM 0 HB THR A 163 -23.196 -13.184 -2.319 1.00 0.00 H new ATOM 0 HG1 THR A 163 -22.342 -14.768 -3.915 1.00 0.00 H new ATOM 0 HG21 THR A 163 -24.395 -15.198 -3.238 1.00 0.00 H new ATOM 0 HG22 THR A 163 -25.480 -13.842 -2.845 1.00 0.00 H new ATOM 0 HG23 THR A 163 -25.040 -14.168 -4.538 1.00 0.00 H new ATOM 1083 N ILE A 164 -21.422 -10.895 -3.738 1.00 0.00 N ATOM 1084 CA ILE A 164 -20.134 -10.503 -4.314 1.00 0.00 C ATOM 1085 C ILE A 164 -19.405 -11.767 -4.781 1.00 0.00 C ATOM 1086 O ILE A 164 -19.238 -12.713 -4.010 1.00 0.00 O ATOM 1087 CB ILE A 164 -19.289 -9.668 -3.321 1.00 0.00 C ATOM 1088 CG1 ILE A 164 -19.795 -9.760 -1.872 1.00 0.00 C ATOM 1089 CG2 ILE A 164 -19.317 -8.201 -3.762 1.00 0.00 C ATOM 1090 CD1 ILE A 164 -18.879 -9.109 -0.848 1.00 0.00 C ATOM 0 H ILE A 164 -21.398 -10.982 -2.722 1.00 0.00 H new ATOM 0 HA ILE A 164 -20.301 -9.852 -5.172 1.00 0.00 H new ATOM 0 HB ILE A 164 -18.277 -10.074 -3.336 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -20.778 -9.293 -1.812 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -19.925 -10.810 -1.611 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -18.725 -7.602 -3.070 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -18.900 -8.115 -4.765 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -20.346 -7.841 -3.765 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -19.310 -9.219 0.147 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -17.902 -9.591 -0.876 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -18.768 -8.050 -1.080 1.00 0.00 H new ATOM 1102 N TYR A 165 -18.979 -11.779 -6.043 1.00 0.00 N ATOM 1103 CA TYR A 165 -18.251 -12.878 -6.688 1.00 0.00 C ATOM 1104 C TYR A 165 -16.870 -13.120 -6.036 1.00 0.00 C ATOM 1105 O TYR A 165 -15.843 -12.545 -6.412 1.00 0.00 O ATOM 1106 CB TYR A 165 -18.130 -12.595 -8.188 1.00 0.00 C ATOM 1107 CG TYR A 165 -17.999 -13.826 -9.061 1.00 0.00 C ATOM 1108 CD1 TYR A 165 -16.759 -14.466 -9.221 1.00 0.00 C ATOM 1109 CD2 TYR A 165 -19.131 -14.330 -9.725 1.00 0.00 C ATOM 1110 CE1 TYR A 165 -16.670 -15.615 -10.028 1.00 0.00 C ATOM 1111 CE2 TYR A 165 -19.053 -15.479 -10.527 1.00 0.00 C ATOM 1112 CZ TYR A 165 -17.810 -16.131 -10.681 1.00 0.00 C ATOM 1113 OH TYR A 165 -17.704 -17.243 -11.459 1.00 0.00 O ATOM 0 H TYR A 165 -19.137 -10.992 -6.673 1.00 0.00 H new ATOM 0 HA TYR A 165 -18.816 -13.800 -6.548 1.00 0.00 H new ATOM 0 HB2 TYR A 165 -19.006 -12.032 -8.508 1.00 0.00 H new ATOM 0 HB3 TYR A 165 -17.263 -11.956 -8.354 1.00 0.00 H new ATOM 0 HD1 TYR A 165 -15.880 -14.079 -8.728 1.00 0.00 H new ATOM 0 HD2 TYR A 165 -20.079 -13.823 -9.616 1.00 0.00 H new ATOM 0 HE1 TYR A 165 -15.717 -16.109 -10.149 1.00 0.00 H new ATOM 0 HE2 TYR A 165 -19.934 -15.860 -11.021 1.00 0.00 H new ATOM 0 HH TYR A 165 -18.582 -17.465 -11.834 1.00 0.00 H new ATOM 1123 N ARG A 166 -16.882 -13.974 -5.014 1.00 0.00 N ATOM 1124 CA ARG A 166 -15.739 -14.437 -4.204 1.00 0.00 C ATOM 1125 C ARG A 166 -15.798 -15.939 -3.875 1.00 0.00 C ATOM 1126 O ARG A 166 -14.856 -16.435 -3.214 1.00 0.00 O ATOM 1127 CB ARG A 166 -15.623 -13.557 -2.939 1.00 0.00 C ATOM 1128 CG ARG A 166 -16.771 -13.734 -1.919 1.00 0.00 C ATOM 1129 CD ARG A 166 -16.301 -14.258 -0.553 1.00 0.00 C ATOM 1130 NE ARG A 166 -15.650 -15.573 -0.670 1.00 0.00 N ATOM 1131 CZ ARG A 166 -15.383 -16.442 0.279 1.00 0.00 C ATOM 1132 NH1 ARG A 166 -15.678 -16.234 1.530 1.00 0.00 N ATOM 1133 NH2 ARG A 166 -14.799 -17.559 -0.040 1.00 0.00 N ATOM 1134 OXT ARG A 166 -16.786 -16.617 -4.243 1.00 0.00 O ATOM 0 H ARG A 166 -17.755 -14.397 -4.700 1.00 0.00 H new ATOM 0 HA ARG A 166 -14.832 -14.323 -4.798 1.00 0.00 H new ATOM 0 HB2 ARG A 166 -14.678 -13.780 -2.444 1.00 0.00 H new ATOM 0 HB3 ARG A 166 -15.584 -12.511 -3.243 1.00 0.00 H new ATOM 0 HG2 ARG A 166 -17.273 -12.777 -1.779 1.00 0.00 H new ATOM 0 HG3 ARG A 166 -17.508 -14.424 -2.330 1.00 0.00 H new ATOM 0 HD2 ARG A 166 -15.605 -13.546 -0.109 1.00 0.00 H new ATOM 0 HD3 ARG A 166 -17.154 -14.333 0.121 1.00 0.00 H new ATOM 0 HE ARG A 166 -15.369 -15.846 -1.612 1.00 0.00 H new ATOM 0 HH11 ARG A 166 -16.136 -15.366 1.808 1.00 0.00 H new ATOM 0 HH12 ARG A 166 -15.451 -16.939 2.232 1.00 0.00 H new ATOM 0 HH21 ARG A 166 -14.556 -17.748 -1.013 1.00 0.00 H new ATOM 0 HH22 ARG A 166 -14.583 -18.246 0.682 1.00 0.00 H new TER 1148 ARG A 166