USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 586 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 7 THR OG1 : rot -75:sc= 1.29 USER MOD Set 1.2: A 9 THR OG1 : rot 67:sc= 1 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 142:sc= 1.32 (180deg=0.925) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -150:sc= 1.02 (180deg=0.96) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -71:sc= 0.0561 USER MOD Single : A 20 SER OG : rot -32:sc= 0.0175 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 150:sc= 1.03 (180deg=0.827) USER MOD Single : A 29 LYS NZ :NH3+ 160:sc= 0.579 (180deg=0.382) USER MOD Single : A 31 GLN : amide:sc= -0.0359 X(o=-0.036,f=-0.14) USER MOD Single : A 33 LYS NZ :NH3+ 151:sc= 1.23 (180deg=1.08) USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 41 GLN : amide:sc= 1.09 K(o=1.1,f=-2) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.636 K(o=-0.64,f=0) USER MOD Single : A 55 THR OG1 : rot -48:sc= 0.811 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 70:sc= 0.881 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= -0.641 K(o=-0.64,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc=-0.00477 X(o=-0.0048,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.271 31.086 16.472 1.00 0.00 N ATOM 2 CA MET A 1 13.301 31.370 17.917 1.00 0.00 C ATOM 3 C MET A 1 14.752 31.715 18.249 1.00 0.00 C ATOM 4 O MET A 1 15.681 31.315 17.553 1.00 0.00 O ATOM 5 CB MET A 1 12.810 30.134 18.668 1.00 0.00 C ATOM 6 CG MET A 1 13.585 28.830 18.465 1.00 0.00 C ATOM 7 SD MET A 1 12.633 27.429 19.115 1.00 0.00 S ATOM 8 CE MET A 1 13.832 26.097 19.386 1.00 0.00 C ATOM 0 H1 MET A 1 12.618 30.298 16.287 1.00 0.00 H new ATOM 0 H2 MET A 1 12.949 31.931 15.959 1.00 0.00 H new ATOM 0 H3 MET A 1 14.225 30.828 16.149 1.00 0.00 H new ATOM 0 HA MET A 1 12.653 32.197 18.207 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.813 30.365 19.733 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.773 29.957 18.383 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.788 28.680 17.405 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.550 28.889 18.969 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.318 25.220 19.779 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.313 25.843 18.442 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.587 26.426 20.100 1.00 0.00 H new ATOM 20 N GLN A 2 14.980 32.507 19.290 1.00 0.00 N ATOM 21 CA GLN A 2 16.343 32.886 19.609 1.00 0.00 C ATOM 22 C GLN A 2 16.780 31.908 20.707 1.00 0.00 C ATOM 23 O GLN A 2 15.995 31.441 21.532 1.00 0.00 O ATOM 24 CB GLN A 2 16.307 34.282 20.248 1.00 0.00 C ATOM 25 CG GLN A 2 15.955 35.371 19.247 1.00 0.00 C ATOM 26 CD GLN A 2 16.311 36.803 19.621 1.00 0.00 C ATOM 27 OE1 GLN A 2 16.743 37.557 18.757 1.00 0.00 O ATOM 28 NE2 GLN A 2 16.249 37.186 20.894 1.00 0.00 N ATOM 0 H GLN A 2 14.262 32.887 19.907 1.00 0.00 H new ATOM 0 HA GLN A 2 16.994 32.876 18.734 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.578 34.288 21.058 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.279 34.500 20.691 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.449 35.136 18.304 1.00 0.00 H new ATOM 0 HG3 GLN A 2 14.881 35.327 19.064 1.00 0.00 H new ATOM 0 HE21 GLN A 2 15.887 36.547 21.602 1.00 0.00 H new ATOM 0 HE22 GLN A 2 16.564 38.119 21.162 1.00 0.00 H new ATOM 37 N ILE A 3 18.054 31.556 20.648 1.00 0.00 N ATOM 38 CA ILE A 3 18.870 30.862 21.636 1.00 0.00 C ATOM 39 C ILE A 3 20.103 31.733 21.896 1.00 0.00 C ATOM 40 O ILE A 3 20.488 32.615 21.151 1.00 0.00 O ATOM 41 CB ILE A 3 19.021 29.363 21.411 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.137 28.969 20.441 1.00 0.00 C ATOM 43 CG2 ILE A 3 17.724 28.620 21.068 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.521 28.741 21.061 1.00 0.00 C ATOM 0 H ILE A 3 18.603 31.773 19.816 1.00 0.00 H new ATOM 0 HA ILE A 3 18.365 30.773 22.598 1.00 0.00 H new ATOM 0 HB ILE A 3 19.322 29.025 22.403 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.837 28.056 19.926 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.224 29.748 19.684 1.00 0.00 H new ATOM 0 HG21 ILE A 3 17.938 27.561 20.927 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.009 28.741 21.882 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.302 29.030 20.151 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.229 28.467 20.279 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.856 29.656 21.550 1.00 0.00 H new ATOM 0 HD13 ILE A 3 21.463 27.938 21.795 1.00 0.00 H new ATOM 56 N PHE A 4 20.707 31.517 23.065 1.00 0.00 N ATOM 57 CA PHE A 4 21.893 32.191 23.569 1.00 0.00 C ATOM 58 C PHE A 4 22.989 31.122 23.619 1.00 0.00 C ATOM 59 O PHE A 4 22.752 30.048 24.157 1.00 0.00 O ATOM 60 CB PHE A 4 21.562 32.858 24.901 1.00 0.00 C ATOM 61 CG PHE A 4 20.532 33.967 24.916 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.775 35.229 24.367 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.378 33.834 25.709 1.00 0.00 C ATOM 64 CE1 PHE A 4 19.872 36.286 24.521 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.410 34.845 25.784 1.00 0.00 C ATOM 66 CZ PHE A 4 18.678 36.091 25.214 1.00 0.00 C ATOM 0 H PHE A 4 20.355 30.822 23.723 1.00 0.00 H new ATOM 0 HA PHE A 4 22.250 33.006 22.940 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.223 32.081 25.586 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.489 33.261 25.310 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.685 35.393 23.809 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.234 32.927 26.277 1.00 0.00 H new ATOM 0 HE1 PHE A 4 20.100 37.255 24.102 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.467 34.662 26.277 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.966 36.897 25.309 1.00 0.00 H new ATOM 76 N VAL A 5 24.176 31.579 23.214 1.00 0.00 N ATOM 77 CA VAL A 5 25.396 30.807 23.353 1.00 0.00 C ATOM 78 C VAL A 5 26.227 31.679 24.295 1.00 0.00 C ATOM 79 O VAL A 5 26.582 32.800 23.954 1.00 0.00 O ATOM 80 CB VAL A 5 26.012 30.666 21.962 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.369 29.960 21.998 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.061 29.797 21.134 1.00 0.00 C ATOM 0 H VAL A 5 24.310 32.493 22.782 1.00 0.00 H new ATOM 0 HA VAL A 5 25.290 29.795 23.744 1.00 0.00 H new ATOM 0 HB VAL A 5 26.158 31.662 21.544 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.766 29.884 20.986 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.060 30.532 22.617 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.248 28.961 22.417 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.465 29.671 20.130 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.955 28.821 21.608 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.086 30.280 21.075 1.00 0.00 H new ATOM 92 N LYS A 6 26.484 31.196 25.508 1.00 0.00 N ATOM 93 CA LYS A 6 27.383 31.875 26.421 1.00 0.00 C ATOM 94 C LYS A 6 28.711 31.114 26.378 1.00 0.00 C ATOM 95 O LYS A 6 28.794 29.897 26.560 1.00 0.00 O ATOM 96 CB LYS A 6 26.767 31.784 27.828 1.00 0.00 C ATOM 97 CG LYS A 6 27.620 32.076 29.058 1.00 0.00 C ATOM 98 CD LYS A 6 26.848 31.832 30.358 1.00 0.00 C ATOM 99 CE LYS A 6 27.458 32.499 31.587 1.00 0.00 C ATOM 100 NZ LYS A 6 26.764 32.046 32.797 1.00 0.00 N ATOM 0 H LYS A 6 26.079 30.335 25.877 1.00 0.00 H new ATOM 0 HA LYS A 6 27.539 32.921 26.159 1.00 0.00 H new ATOM 0 HB2 LYS A 6 25.918 32.467 27.854 1.00 0.00 H new ATOM 0 HB3 LYS A 6 26.369 30.776 27.942 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.510 31.447 29.041 1.00 0.00 H new ATOM 0 HG3 LYS A 6 27.961 33.111 29.027 1.00 0.00 H new ATOM 0 HD2 LYS A 6 25.827 32.192 30.233 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.788 30.758 30.535 1.00 0.00 H new ATOM 0 HE2 LYS A 6 28.519 32.257 31.654 1.00 0.00 H new ATOM 0 HE3 LYS A 6 27.383 33.583 31.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 27.185 32.504 33.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.757 32.298 32.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 26.858 31.014 32.885 1.00 0.00 H new ATOM 114 N THR A 7 29.839 31.811 26.297 1.00 0.00 N ATOM 115 CA THR A 7 31.146 31.204 26.411 1.00 0.00 C ATOM 116 C THR A 7 31.571 31.023 27.868 1.00 0.00 C ATOM 117 O THR A 7 30.966 31.632 28.752 1.00 0.00 O ATOM 118 CB THR A 7 32.114 32.085 25.607 1.00 0.00 C ATOM 119 OG1 THR A 7 32.248 33.373 26.151 1.00 0.00 O ATOM 120 CG2 THR A 7 31.745 32.256 24.135 1.00 0.00 C ATOM 0 H THR A 7 29.865 32.820 26.149 1.00 0.00 H new ATOM 0 HA THR A 7 31.141 30.192 26.005 1.00 0.00 H new ATOM 0 HB THR A 7 33.053 31.534 25.671 1.00 0.00 H new ATOM 0 HG1 THR A 7 31.445 33.898 25.951 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.483 32.892 23.646 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.728 31.281 23.649 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.760 32.717 24.058 1.00 0.00 H new ATOM 128 N LEU A 8 32.594 30.188 28.060 1.00 0.00 N ATOM 129 CA LEU A 8 33.200 29.843 29.323 1.00 0.00 C ATOM 130 C LEU A 8 33.752 31.122 29.969 1.00 0.00 C ATOM 131 O LEU A 8 33.963 31.147 31.177 1.00 0.00 O ATOM 132 CB LEU A 8 34.377 28.881 29.156 1.00 0.00 C ATOM 133 CG LEU A 8 34.228 27.499 29.793 1.00 0.00 C ATOM 134 CD1 LEU A 8 35.453 26.632 29.466 1.00 0.00 C ATOM 135 CD2 LEU A 8 33.959 27.414 31.291 1.00 0.00 C ATOM 0 H LEU A 8 33.042 29.710 27.278 1.00 0.00 H new ATOM 0 HA LEU A 8 32.434 29.364 29.933 1.00 0.00 H new ATOM 0 HB2 LEU A 8 34.558 28.747 28.090 1.00 0.00 H new ATOM 0 HB3 LEU A 8 35.266 29.354 29.573 1.00 0.00 H new ATOM 0 HG LEU A 8 33.306 27.135 29.340 1.00 0.00 H new ATOM 0 HD11 LEU A 8 35.337 25.650 29.924 1.00 0.00 H new ATOM 0 HD12 LEU A 8 35.541 26.520 28.385 1.00 0.00 H new ATOM 0 HD13 LEU A 8 36.352 27.110 29.856 1.00 0.00 H new ATOM 0 HD21 LEU A 8 33.879 26.368 31.588 1.00 0.00 H new ATOM 0 HD22 LEU A 8 34.778 27.884 31.835 1.00 0.00 H new ATOM 0 HD23 LEU A 8 33.027 27.929 31.523 1.00 0.00 H new ATOM 147 N THR A 9 34.108 32.090 29.131 1.00 0.00 N ATOM 148 CA THR A 9 34.604 33.440 29.296 1.00 0.00 C ATOM 149 C THR A 9 33.545 34.498 29.623 1.00 0.00 C ATOM 150 O THR A 9 33.902 35.606 30.013 1.00 0.00 O ATOM 151 CB THR A 9 35.343 33.842 28.026 1.00 0.00 C ATOM 152 OG1 THR A 9 34.969 33.103 26.883 1.00 0.00 O ATOM 153 CG2 THR A 9 36.855 33.770 28.187 1.00 0.00 C ATOM 0 H THR A 9 34.037 31.895 28.132 1.00 0.00 H new ATOM 0 HA THR A 9 35.256 33.414 30.169 1.00 0.00 H new ATOM 0 HB THR A 9 35.041 34.877 27.865 1.00 0.00 H new ATOM 0 HG1 THR A 9 34.040 33.309 26.650 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.335 34.066 27.254 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.168 34.442 28.986 1.00 0.00 H new ATOM 0 HG23 THR A 9 37.146 32.750 28.437 1.00 0.00 H new ATOM 161 N GLY A 10 32.241 34.261 29.471 1.00 0.00 N ATOM 162 CA GLY A 10 31.245 35.143 30.047 1.00 0.00 C ATOM 163 C GLY A 10 30.517 35.993 28.998 1.00 0.00 C ATOM 164 O GLY A 10 29.616 36.741 29.377 1.00 0.00 O ATOM 0 H GLY A 10 31.859 33.468 28.955 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.514 34.548 30.595 1.00 0.00 H new ATOM 0 HA3 GLY A 10 31.726 35.802 30.770 1.00 0.00 H new ATOM 168 N LYS A 11 31.000 35.959 27.759 1.00 0.00 N ATOM 169 CA LYS A 11 30.470 36.749 26.658 1.00 0.00 C ATOM 170 C LYS A 11 29.402 35.820 26.071 1.00 0.00 C ATOM 171 O LYS A 11 29.589 34.630 25.840 1.00 0.00 O ATOM 172 CB LYS A 11 31.619 36.882 25.671 1.00 0.00 C ATOM 173 CG LYS A 11 31.158 37.873 24.604 1.00 0.00 C ATOM 174 CD LYS A 11 32.130 38.006 23.428 1.00 0.00 C ATOM 175 CE LYS A 11 31.860 39.178 22.481 1.00 0.00 C ATOM 176 NZ LYS A 11 32.855 39.179 21.394 1.00 0.00 N ATOM 0 H LYS A 11 31.787 35.369 27.490 1.00 0.00 H new ATOM 0 HA LYS A 11 30.078 37.733 26.913 1.00 0.00 H new ATOM 0 HB2 LYS A 11 32.520 37.239 26.170 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.862 35.917 25.226 1.00 0.00 H new ATOM 0 HG2 LYS A 11 30.185 37.560 24.226 1.00 0.00 H new ATOM 0 HG3 LYS A 11 31.022 38.852 25.064 1.00 0.00 H new ATOM 0 HD2 LYS A 11 33.141 38.106 23.824 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.104 37.082 22.851 1.00 0.00 H new ATOM 0 HE2 LYS A 11 30.855 39.099 22.067 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.906 40.119 23.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.019 40.155 21.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 33.748 38.774 21.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 32.502 38.609 20.599 1.00 0.00 H new ATOM 190 N THR A 12 28.236 36.451 25.957 1.00 0.00 N ATOM 191 CA THR A 12 27.024 35.779 25.536 1.00 0.00 C ATOM 192 C THR A 12 26.469 36.355 24.223 1.00 0.00 C ATOM 193 O THR A 12 26.215 37.559 24.236 1.00 0.00 O ATOM 194 CB THR A 12 26.052 35.704 26.710 1.00 0.00 C ATOM 195 OG1 THR A 12 26.709 34.911 27.676 1.00 0.00 O ATOM 196 CG2 THR A 12 24.818 34.844 26.476 1.00 0.00 C ATOM 0 H THR A 12 28.112 37.444 26.156 1.00 0.00 H new ATOM 0 HA THR A 12 27.235 34.744 25.266 1.00 0.00 H new ATOM 0 HB THR A 12 25.774 36.733 26.938 1.00 0.00 H new ATOM 0 HG1 THR A 12 26.138 34.820 28.468 1.00 0.00 H new ATOM 0 HG21 THR A 12 24.192 34.856 27.368 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.254 35.239 25.631 1.00 0.00 H new ATOM 0 HG23 THR A 12 25.124 33.820 26.261 1.00 0.00 H new ATOM 204 N ILE A 13 26.310 35.622 23.124 1.00 0.00 N ATOM 205 CA ILE A 13 25.689 36.105 21.901 1.00 0.00 C ATOM 206 C ILE A 13 24.361 35.387 21.660 1.00 0.00 C ATOM 207 O ILE A 13 24.057 34.249 22.027 1.00 0.00 O ATOM 208 CB ILE A 13 26.600 36.071 20.668 1.00 0.00 C ATOM 209 CG1 ILE A 13 27.026 34.654 20.274 1.00 0.00 C ATOM 210 CG2 ILE A 13 27.818 36.931 20.971 1.00 0.00 C ATOM 211 CD1 ILE A 13 27.108 34.430 18.772 1.00 0.00 C ATOM 0 H ILE A 13 26.618 34.652 23.061 1.00 0.00 H new ATOM 0 HA ILE A 13 25.493 37.166 22.056 1.00 0.00 H new ATOM 0 HB ILE A 13 26.045 36.458 19.814 1.00 0.00 H new ATOM 0 HG12 ILE A 13 27.999 34.441 20.717 1.00 0.00 H new ATOM 0 HG13 ILE A 13 26.320 33.941 20.700 1.00 0.00 H new ATOM 0 HG21 ILE A 13 28.488 36.928 20.112 1.00 0.00 H new ATOM 0 HG22 ILE A 13 27.499 37.952 21.179 1.00 0.00 H new ATOM 0 HG23 ILE A 13 28.340 36.529 21.840 1.00 0.00 H new ATOM 0 HD11 ILE A 13 27.416 33.403 18.574 1.00 0.00 H new ATOM 0 HD12 ILE A 13 26.131 34.609 18.324 1.00 0.00 H new ATOM 0 HD13 ILE A 13 27.836 35.117 18.341 1.00 0.00 H new ATOM 223 N THR A 14 23.510 36.084 20.908 1.00 0.00 N ATOM 224 CA THR A 14 22.139 35.710 20.625 1.00 0.00 C ATOM 225 C THR A 14 22.102 35.152 19.204 1.00 0.00 C ATOM 226 O THR A 14 22.583 35.855 18.311 1.00 0.00 O ATOM 227 CB THR A 14 21.421 37.051 20.784 1.00 0.00 C ATOM 228 OG1 THR A 14 21.846 37.738 21.931 1.00 0.00 O ATOM 229 CG2 THR A 14 19.904 36.909 20.916 1.00 0.00 C ATOM 0 H THR A 14 23.776 36.962 20.463 1.00 0.00 H new ATOM 0 HA THR A 14 21.688 34.943 21.254 1.00 0.00 H new ATOM 0 HB THR A 14 21.671 37.597 19.874 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.512 37.279 22.730 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.454 37.896 21.026 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.505 36.425 20.024 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.670 36.304 21.792 1.00 0.00 H new ATOM 237 N LEU A 15 21.677 33.906 19.061 1.00 0.00 N ATOM 238 CA LEU A 15 21.770 33.077 17.874 1.00 0.00 C ATOM 239 C LEU A 15 20.367 32.762 17.347 1.00 0.00 C ATOM 240 O LEU A 15 19.547 32.291 18.124 1.00 0.00 O ATOM 241 CB LEU A 15 22.456 31.776 18.265 1.00 0.00 C ATOM 242 CG LEU A 15 23.164 31.004 17.150 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.491 31.681 16.814 1.00 0.00 C ATOM 244 CD2 LEU A 15 23.441 29.591 17.654 1.00 0.00 C ATOM 0 H LEU A 15 21.224 33.413 19.831 1.00 0.00 H new ATOM 0 HA LEU A 15 22.332 33.596 17.098 1.00 0.00 H new ATOM 0 HB2 LEU A 15 23.188 31.999 19.041 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.709 31.119 18.711 1.00 0.00 H new ATOM 0 HG LEU A 15 22.539 30.981 16.257 1.00 0.00 H new ATOM 0 HD11 LEU A 15 24.991 31.127 16.019 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.305 32.703 16.483 1.00 0.00 H new ATOM 0 HD13 LEU A 15 25.126 31.697 17.700 1.00 0.00 H new ATOM 0 HD21 LEU A 15 23.946 29.020 16.875 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.075 29.638 18.539 1.00 0.00 H new ATOM 0 HD23 LEU A 15 22.499 29.104 17.908 1.00 0.00 H new ATOM 256 N GLU A 16 20.135 33.043 16.068 1.00 0.00 N ATOM 257 CA GLU A 16 18.857 32.882 15.408 1.00 0.00 C ATOM 258 C GLU A 16 18.796 31.468 14.815 1.00 0.00 C ATOM 259 O GLU A 16 19.607 31.092 13.970 1.00 0.00 O ATOM 260 CB GLU A 16 18.796 33.899 14.265 1.00 0.00 C ATOM 261 CG GLU A 16 17.350 34.170 13.846 1.00 0.00 C ATOM 262 CD GLU A 16 16.709 35.366 14.544 1.00 0.00 C ATOM 263 OE1 GLU A 16 17.373 36.412 14.511 1.00 0.00 O ATOM 264 OE2 GLU A 16 15.508 35.351 14.913 1.00 0.00 O ATOM 0 H GLU A 16 20.861 33.401 15.447 1.00 0.00 H new ATOM 0 HA GLU A 16 18.031 33.032 16.104 1.00 0.00 H new ATOM 0 HB2 GLU A 16 19.268 34.831 14.577 1.00 0.00 H new ATOM 0 HB3 GLU A 16 19.361 33.526 13.411 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.321 34.334 12.769 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.752 33.282 14.050 1.00 0.00 H new ATOM 271 N VAL A 17 17.888 30.653 15.348 1.00 0.00 N ATOM 272 CA VAL A 17 17.637 29.283 14.963 1.00 0.00 C ATOM 273 C VAL A 17 16.155 28.924 14.827 1.00 0.00 C ATOM 274 O VAL A 17 15.324 29.641 15.386 1.00 0.00 O ATOM 275 CB VAL A 17 18.363 28.400 15.979 1.00 0.00 C ATOM 276 CG1 VAL A 17 19.881 28.374 15.766 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.947 28.535 17.434 1.00 0.00 C ATOM 0 H VAL A 17 17.276 30.958 16.105 1.00 0.00 H new ATOM 0 HA VAL A 17 18.020 29.120 13.955 1.00 0.00 H new ATOM 0 HB VAL A 17 17.992 27.403 15.742 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.343 27.732 16.516 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.102 27.987 14.771 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.279 29.385 15.859 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.539 27.855 18.046 1.00 0.00 H new ATOM 0 HG22 VAL A 17 18.113 29.560 17.766 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.890 28.288 17.535 1.00 0.00 H new ATOM 287 N GLU A 18 15.804 27.802 14.204 1.00 0.00 N ATOM 288 CA GLU A 18 14.502 27.161 14.234 1.00 0.00 C ATOM 289 C GLU A 18 14.661 25.709 14.684 1.00 0.00 C ATOM 290 O GLU A 18 15.702 25.168 14.326 1.00 0.00 O ATOM 291 CB GLU A 18 13.770 27.248 12.896 1.00 0.00 C ATOM 292 CG GLU A 18 13.317 28.608 12.357 1.00 0.00 C ATOM 293 CD GLU A 18 12.490 29.438 13.322 1.00 0.00 C ATOM 294 OE1 GLU A 18 11.918 28.954 14.322 1.00 0.00 O ATOM 295 OE2 GLU A 18 12.440 30.680 13.132 1.00 0.00 O ATOM 0 H GLU A 18 16.469 27.286 13.628 1.00 0.00 H new ATOM 0 HA GLU A 18 13.881 27.698 14.951 1.00 0.00 H new ATOM 0 HB2 GLU A 18 14.418 26.800 12.142 1.00 0.00 H new ATOM 0 HB3 GLU A 18 12.884 26.617 12.970 1.00 0.00 H new ATOM 0 HG2 GLU A 18 14.199 29.181 12.072 1.00 0.00 H new ATOM 0 HG3 GLU A 18 12.735 28.447 11.449 1.00 0.00 H new ATOM 302 N PRO A 19 13.685 25.042 15.295 1.00 0.00 N ATOM 303 CA PRO A 19 13.803 23.684 15.786 1.00 0.00 C ATOM 304 C PRO A 19 14.352 22.622 14.831 1.00 0.00 C ATOM 305 O PRO A 19 14.966 21.700 15.371 1.00 0.00 O ATOM 306 CB PRO A 19 12.391 23.215 16.127 1.00 0.00 C ATOM 307 CG PRO A 19 11.633 24.512 16.388 1.00 0.00 C ATOM 308 CD PRO A 19 12.391 25.596 15.613 1.00 0.00 C ATOM 0 HA PRO A 19 14.520 23.755 16.604 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.948 22.650 15.307 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.385 22.565 17.002 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.600 24.437 16.048 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.603 24.741 17.453 1.00 0.00 H new ATOM 0 HD2 PRO A 19 11.853 25.872 14.706 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.493 26.501 16.211 1.00 0.00 H new ATOM 316 N SER A 20 14.134 22.739 13.524 1.00 0.00 N ATOM 317 CA SER A 20 14.500 21.983 12.347 1.00 0.00 C ATOM 318 C SER A 20 15.936 22.111 11.838 1.00 0.00 C ATOM 319 O SER A 20 16.423 21.361 10.984 1.00 0.00 O ATOM 320 CB SER A 20 13.459 22.339 11.288 1.00 0.00 C ATOM 321 OG SER A 20 13.553 21.443 10.207 1.00 0.00 O ATOM 0 H SER A 20 13.579 23.539 13.220 1.00 0.00 H new ATOM 0 HA SER A 20 14.494 20.926 12.614 1.00 0.00 H new ATOM 0 HB2 SER A 20 12.459 22.299 11.720 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.615 23.360 10.940 1.00 0.00 H new ATOM 0 HG SER A 20 14.486 21.165 10.093 1.00 0.00 H new ATOM 327 N ASP A 21 16.771 22.930 12.479 1.00 0.00 N ATOM 328 CA ASP A 21 18.134 23.306 12.159 1.00 0.00 C ATOM 329 C ASP A 21 19.088 22.248 12.719 1.00 0.00 C ATOM 330 O ASP A 21 18.904 21.849 13.872 1.00 0.00 O ATOM 331 CB ASP A 21 18.619 24.594 12.812 1.00 0.00 C ATOM 332 CG ASP A 21 18.068 25.883 12.204 1.00 0.00 C ATOM 333 OD1 ASP A 21 17.432 25.856 11.130 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.462 26.907 12.794 1.00 0.00 O ATOM 0 H ASP A 21 16.464 23.396 13.333 1.00 0.00 H new ATOM 0 HA ASP A 21 18.133 23.418 11.075 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.354 24.568 13.869 1.00 0.00 H new ATOM 0 HB3 ASP A 21 19.707 24.622 12.757 1.00 0.00 H new ATOM 339 N THR A 22 20.129 21.803 12.027 1.00 0.00 N ATOM 340 CA THR A 22 21.116 20.878 12.541 1.00 0.00 C ATOM 341 C THR A 22 22.230 21.554 13.331 1.00 0.00 C ATOM 342 O THR A 22 22.476 22.736 13.111 1.00 0.00 O ATOM 343 CB THR A 22 21.796 20.145 11.392 1.00 0.00 C ATOM 344 OG1 THR A 22 22.565 20.972 10.536 1.00 0.00 O ATOM 345 CG2 THR A 22 20.810 19.267 10.612 1.00 0.00 C ATOM 0 H THR A 22 20.310 22.088 11.064 1.00 0.00 H new ATOM 0 HA THR A 22 20.564 20.208 13.200 1.00 0.00 H new ATOM 0 HB THR A 22 22.524 19.489 11.869 1.00 0.00 H new ATOM 0 HG1 THR A 22 22.968 20.426 9.829 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.335 18.762 9.801 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.376 18.524 11.281 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.017 19.890 10.198 1.00 0.00 H new ATOM 353 N ILE A 23 22.934 20.812 14.186 1.00 0.00 N ATOM 354 CA ILE A 23 24.005 21.374 14.999 1.00 0.00 C ATOM 355 C ILE A 23 25.150 21.828 14.083 1.00 0.00 C ATOM 356 O ILE A 23 25.888 22.756 14.415 1.00 0.00 O ATOM 357 CB ILE A 23 24.455 20.343 16.021 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.414 19.764 16.991 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.730 20.663 16.814 1.00 0.00 C ATOM 360 CD1 ILE A 23 22.192 20.603 17.362 1.00 0.00 C ATOM 0 H ILE A 23 22.778 19.815 14.332 1.00 0.00 H new ATOM 0 HA ILE A 23 23.655 22.248 15.548 1.00 0.00 H new ATOM 0 HB ILE A 23 24.674 19.562 15.293 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.052 18.829 16.564 1.00 0.00 H new ATOM 0 HG13 ILE A 23 23.932 19.512 17.916 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.941 19.849 17.508 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.567 20.779 16.126 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.588 21.588 17.373 1.00 0.00 H new ATOM 0 HD11 ILE A 23 21.563 20.043 18.054 1.00 0.00 H new ATOM 0 HD12 ILE A 23 22.517 21.530 17.835 1.00 0.00 H new ATOM 0 HD13 ILE A 23 21.623 20.835 16.462 1.00 0.00 H new ATOM 372 N GLU A 24 25.264 21.315 12.861 1.00 0.00 N ATOM 373 CA GLU A 24 26.174 21.644 11.789 1.00 0.00 C ATOM 374 C GLU A 24 25.994 23.085 11.297 1.00 0.00 C ATOM 375 O GLU A 24 26.997 23.780 11.123 1.00 0.00 O ATOM 376 CB GLU A 24 25.985 20.683 10.615 1.00 0.00 C ATOM 377 CG GLU A 24 27.179 19.863 10.127 1.00 0.00 C ATOM 378 CD GLU A 24 28.155 20.688 9.301 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.750 21.301 8.284 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.320 20.811 9.724 1.00 0.00 O ATOM 0 H GLU A 24 24.636 20.564 12.573 1.00 0.00 H new ATOM 0 HA GLU A 24 27.183 21.547 12.190 1.00 0.00 H new ATOM 0 HB2 GLU A 24 25.195 19.983 10.887 1.00 0.00 H new ATOM 0 HB3 GLU A 24 25.618 21.265 9.769 1.00 0.00 H new ATOM 0 HG2 GLU A 24 27.701 19.441 10.986 1.00 0.00 H new ATOM 0 HG3 GLU A 24 26.820 19.025 9.529 1.00 0.00 H new ATOM 387 N ASN A 25 24.745 23.527 11.296 1.00 0.00 N ATOM 388 CA ASN A 25 24.354 24.880 10.958 1.00 0.00 C ATOM 389 C ASN A 25 24.723 25.837 12.092 1.00 0.00 C ATOM 390 O ASN A 25 25.016 27.014 11.892 1.00 0.00 O ATOM 391 CB ASN A 25 22.841 24.844 10.704 1.00 0.00 C ATOM 392 CG ASN A 25 22.482 26.005 9.795 1.00 0.00 C ATOM 393 OD1 ASN A 25 21.997 27.037 10.250 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.573 25.914 8.467 1.00 0.00 N ATOM 0 H ASN A 25 23.953 22.932 11.539 1.00 0.00 H new ATOM 0 HA ASN A 25 24.874 25.243 10.071 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.556 23.898 10.243 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.296 24.916 11.645 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.247 26.682 7.880 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.969 25.077 8.039 1.00 0.00 H new ATOM 401 N VAL A 26 24.638 25.363 13.338 1.00 0.00 N ATOM 402 CA VAL A 26 24.834 26.084 14.577 1.00 0.00 C ATOM 403 C VAL A 26 26.313 26.234 14.910 1.00 0.00 C ATOM 404 O VAL A 26 26.822 27.340 15.072 1.00 0.00 O ATOM 405 CB VAL A 26 24.137 25.331 15.715 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.362 25.946 17.094 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.637 25.150 15.494 1.00 0.00 C ATOM 0 H VAL A 26 24.411 24.383 13.509 1.00 0.00 H new ATOM 0 HA VAL A 26 24.409 27.081 14.460 1.00 0.00 H new ATOM 0 HB VAL A 26 24.616 24.352 15.695 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.837 25.356 17.845 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.428 25.954 17.319 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.981 26.967 17.103 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.208 24.609 16.337 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.161 26.127 15.409 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.470 24.584 14.577 1.00 0.00 H new ATOM 417 N LYS A 27 27.073 25.149 14.712 1.00 0.00 N ATOM 418 CA LYS A 27 28.510 25.284 14.617 1.00 0.00 C ATOM 419 C LYS A 27 29.152 26.253 13.621 1.00 0.00 C ATOM 420 O LYS A 27 30.136 26.824 14.078 1.00 0.00 O ATOM 421 CB LYS A 27 29.094 23.888 14.402 1.00 0.00 C ATOM 422 CG LYS A 27 29.031 22.996 15.636 1.00 0.00 C ATOM 423 CD LYS A 27 29.922 21.767 15.479 1.00 0.00 C ATOM 424 CE LYS A 27 29.523 20.551 14.639 1.00 0.00 C ATOM 425 NZ LYS A 27 30.301 19.320 14.775 1.00 0.00 N ATOM 0 H LYS A 27 26.718 24.197 14.618 1.00 0.00 H new ATOM 0 HA LYS A 27 28.760 25.770 15.560 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.558 23.402 13.587 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.133 23.984 14.088 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.342 23.563 16.513 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.002 22.682 15.808 1.00 0.00 H new ATOM 0 HD2 LYS A 27 30.871 22.122 15.078 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.119 21.397 16.485 1.00 0.00 H new ATOM 0 HE2 LYS A 27 28.485 20.314 14.872 1.00 0.00 H new ATOM 0 HE3 LYS A 27 29.554 20.848 13.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 29.688 18.500 14.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 31.084 19.327 14.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 30.685 19.257 15.739 1.00 0.00 H new ATOM 439 N ALA A 28 28.725 26.282 12.360 1.00 0.00 N ATOM 440 CA ALA A 28 29.180 27.235 11.366 1.00 0.00 C ATOM 441 C ALA A 28 28.881 28.679 11.743 1.00 0.00 C ATOM 442 O ALA A 28 29.723 29.552 11.558 1.00 0.00 O ATOM 443 CB ALA A 28 28.538 26.924 10.020 1.00 0.00 C ATOM 0 H ALA A 28 28.035 25.624 11.998 1.00 0.00 H new ATOM 0 HA ALA A 28 30.264 27.133 11.308 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.883 27.643 9.277 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.817 25.918 9.708 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.454 26.988 10.111 1.00 0.00 H new ATOM 449 N LYS A 29 27.683 28.955 12.257 1.00 0.00 N ATOM 450 CA LYS A 29 27.278 30.251 12.767 1.00 0.00 C ATOM 451 C LYS A 29 28.269 30.821 13.795 1.00 0.00 C ATOM 452 O LYS A 29 28.464 32.029 13.713 1.00 0.00 O ATOM 453 CB LYS A 29 25.862 30.288 13.330 1.00 0.00 C ATOM 454 CG LYS A 29 24.812 30.577 12.260 1.00 0.00 C ATOM 455 CD LYS A 29 23.335 30.405 12.600 1.00 0.00 C ATOM 456 CE LYS A 29 22.464 30.481 11.341 1.00 0.00 C ATOM 457 NZ LYS A 29 21.037 30.159 11.510 1.00 0.00 N ATOM 0 H LYS A 29 26.947 28.253 12.329 1.00 0.00 H new ATOM 0 HA LYS A 29 27.285 30.892 11.885 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.639 29.332 13.804 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.804 31.051 14.107 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.955 31.606 11.930 1.00 0.00 H new ATOM 0 HG3 LYS A 29 25.029 29.935 11.406 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.182 29.445 13.094 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.029 31.178 13.304 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.541 31.489 10.933 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.881 29.803 10.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.495 30.557 10.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.914 29.126 11.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.693 30.566 12.403 1.00 0.00 H new ATOM 471 N ILE A 30 28.832 30.006 14.686 1.00 0.00 N ATOM 472 CA ILE A 30 29.789 30.428 15.690 1.00 0.00 C ATOM 473 C ILE A 30 30.984 31.093 15.011 1.00 0.00 C ATOM 474 O ILE A 30 31.349 32.188 15.437 1.00 0.00 O ATOM 475 CB ILE A 30 30.183 29.303 16.649 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.911 28.862 17.380 1.00 0.00 C ATOM 477 CG2 ILE A 30 31.211 29.604 17.725 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.972 27.501 18.077 1.00 0.00 C ATOM 0 H ILE A 30 28.625 29.008 14.725 1.00 0.00 H new ATOM 0 HA ILE A 30 29.312 31.170 16.331 1.00 0.00 H new ATOM 0 HB ILE A 30 30.655 28.560 16.006 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.664 29.618 18.125 1.00 0.00 H new ATOM 0 HG13 ILE A 30 28.092 28.843 16.661 1.00 0.00 H new ATOM 0 HG21 ILE A 30 31.384 28.709 18.323 1.00 0.00 H new ATOM 0 HG22 ILE A 30 32.146 29.915 17.258 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.842 30.404 18.367 1.00 0.00 H new ATOM 0 HD11 ILE A 30 28.016 27.296 18.559 1.00 0.00 H new ATOM 0 HD12 ILE A 30 29.181 26.724 17.341 1.00 0.00 H new ATOM 0 HD13 ILE A 30 29.762 27.512 18.828 1.00 0.00 H new ATOM 490 N GLN A 31 31.513 30.475 13.956 1.00 0.00 N ATOM 491 CA GLN A 31 32.618 30.948 13.152 1.00 0.00 C ATOM 492 C GLN A 31 32.179 32.218 12.406 1.00 0.00 C ATOM 493 O GLN A 31 32.839 33.251 12.510 1.00 0.00 O ATOM 494 CB GLN A 31 32.984 29.715 12.327 1.00 0.00 C ATOM 495 CG GLN A 31 33.741 29.968 11.023 1.00 0.00 C ATOM 496 CD GLN A 31 34.986 30.806 11.290 1.00 0.00 C ATOM 497 OE1 GLN A 31 35.768 30.413 12.154 1.00 0.00 O ATOM 498 NE2 GLN A 31 35.232 31.907 10.588 1.00 0.00 N ATOM 0 H GLN A 31 31.154 29.578 13.628 1.00 0.00 H new ATOM 0 HA GLN A 31 33.514 31.288 13.671 1.00 0.00 H new ATOM 0 HB2 GLN A 31 33.588 29.055 12.950 1.00 0.00 H new ATOM 0 HB3 GLN A 31 32.066 29.178 12.090 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.024 29.019 10.568 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.094 30.482 10.312 1.00 0.00 H new ATOM 0 HE21 GLN A 31 34.571 32.216 9.876 1.00 0.00 H new ATOM 0 HE22 GLN A 31 36.082 32.443 10.761 1.00 0.00 H new ATOM 507 N ASP A 32 31.009 32.295 11.774 1.00 0.00 N ATOM 508 CA ASP A 32 30.513 33.479 11.107 1.00 0.00 C ATOM 509 C ASP A 32 30.442 34.734 11.974 1.00 0.00 C ATOM 510 O ASP A 32 30.845 35.825 11.580 1.00 0.00 O ATOM 511 CB ASP A 32 29.203 33.235 10.348 1.00 0.00 C ATOM 512 CG ASP A 32 28.455 34.431 9.782 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.106 35.326 9.212 1.00 0.00 O ATOM 514 OD2 ASP A 32 27.205 34.383 9.814 1.00 0.00 O ATOM 0 H ASP A 32 30.366 31.505 11.715 1.00 0.00 H new ATOM 0 HA ASP A 32 31.285 33.694 10.368 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.421 32.560 9.521 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.525 32.708 11.019 1.00 0.00 H new ATOM 519 N LYS A 33 29.962 34.611 13.211 1.00 0.00 N ATOM 520 CA LYS A 33 29.868 35.592 14.280 1.00 0.00 C ATOM 521 C LYS A 33 31.174 35.793 15.056 1.00 0.00 C ATOM 522 O LYS A 33 31.849 36.779 14.773 1.00 0.00 O ATOM 523 CB LYS A 33 28.655 35.258 15.155 1.00 0.00 C ATOM 524 CG LYS A 33 27.199 35.411 14.740 1.00 0.00 C ATOM 525 CD LYS A 33 26.920 35.502 13.231 1.00 0.00 C ATOM 526 CE LYS A 33 25.531 35.255 12.661 1.00 0.00 C ATOM 527 NZ LYS A 33 25.293 35.580 11.248 1.00 0.00 N ATOM 0 H LYS A 33 29.587 33.714 13.519 1.00 0.00 H new ATOM 0 HA LYS A 33 29.706 36.575 13.838 1.00 0.00 H new ATOM 0 HB2 LYS A 33 28.774 34.213 15.442 1.00 0.00 H new ATOM 0 HB3 LYS A 33 28.770 35.852 16.061 1.00 0.00 H new ATOM 0 HG2 LYS A 33 26.640 34.565 15.140 1.00 0.00 H new ATOM 0 HG3 LYS A 33 26.802 36.308 15.215 1.00 0.00 H new ATOM 0 HD2 LYS A 33 27.219 36.501 12.914 1.00 0.00 H new ATOM 0 HD3 LYS A 33 27.593 34.797 12.742 1.00 0.00 H new ATOM 0 HE2 LYS A 33 25.295 34.201 12.805 1.00 0.00 H new ATOM 0 HE3 LYS A 33 24.820 35.825 13.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 24.552 34.957 10.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 24.987 36.571 11.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 26.171 35.443 10.708 1.00 0.00 H new ATOM 541 N GLU A 34 31.559 34.957 16.021 1.00 0.00 N ATOM 542 CA GLU A 34 32.672 35.216 16.914 1.00 0.00 C ATOM 543 C GLU A 34 34.025 34.722 16.419 1.00 0.00 C ATOM 544 O GLU A 34 35.006 34.949 17.124 1.00 0.00 O ATOM 545 CB GLU A 34 32.278 34.619 18.268 1.00 0.00 C ATOM 546 CG GLU A 34 31.204 35.380 19.046 1.00 0.00 C ATOM 547 CD GLU A 34 31.317 36.904 19.093 1.00 0.00 C ATOM 548 OE1 GLU A 34 32.289 37.375 19.723 1.00 0.00 O ATOM 549 OE2 GLU A 34 30.466 37.622 18.532 1.00 0.00 O ATOM 0 H GLU A 34 31.093 34.068 16.201 1.00 0.00 H new ATOM 0 HA GLU A 34 32.836 36.291 16.982 1.00 0.00 H new ATOM 0 HB2 GLU A 34 31.928 33.600 18.106 1.00 0.00 H new ATOM 0 HB3 GLU A 34 33.172 34.554 18.889 1.00 0.00 H new ATOM 0 HG2 GLU A 34 30.234 35.127 18.617 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.205 35.010 20.071 1.00 0.00 H new ATOM 556 N GLY A 35 34.049 33.934 15.348 1.00 0.00 N ATOM 557 CA GLY A 35 35.257 33.358 14.802 1.00 0.00 C ATOM 558 C GLY A 35 35.937 32.179 15.518 1.00 0.00 C ATOM 559 O GLY A 35 37.152 32.164 15.687 1.00 0.00 O ATOM 0 H GLY A 35 33.208 33.678 14.831 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.031 33.034 13.786 1.00 0.00 H new ATOM 0 HA3 GLY A 35 35.992 34.159 14.725 1.00 0.00 H new ATOM 563 N ILE A 36 35.187 31.219 16.032 1.00 0.00 N ATOM 564 CA ILE A 36 35.730 30.052 16.695 1.00 0.00 C ATOM 565 C ILE A 36 35.304 28.787 15.951 1.00 0.00 C ATOM 566 O ILE A 36 34.154 28.404 16.104 1.00 0.00 O ATOM 567 CB ILE A 36 35.315 30.011 18.164 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.446 31.311 18.972 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.977 28.912 18.999 1.00 0.00 C ATOM 570 CD1 ILE A 36 34.592 31.373 20.235 1.00 0.00 C ATOM 0 H ILE A 36 34.168 31.231 15.998 1.00 0.00 H new ATOM 0 HA ILE A 36 36.818 30.109 16.675 1.00 0.00 H new ATOM 0 HB ILE A 36 34.255 29.803 18.017 1.00 0.00 H new ATOM 0 HG12 ILE A 36 36.491 31.444 19.251 1.00 0.00 H new ATOM 0 HG13 ILE A 36 35.179 32.150 18.329 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.616 28.968 20.026 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.728 27.937 18.580 1.00 0.00 H new ATOM 0 HG23 ILE A 36 37.059 29.047 18.987 1.00 0.00 H new ATOM 0 HD11 ILE A 36 34.753 32.327 20.736 1.00 0.00 H new ATOM 0 HD12 ILE A 36 33.540 31.276 19.968 1.00 0.00 H new ATOM 0 HD13 ILE A 36 34.873 30.560 20.904 1.00 0.00 H new ATOM 582 N PRO A 37 36.126 28.253 15.059 1.00 0.00 N ATOM 583 CA PRO A 37 35.729 27.080 14.308 1.00 0.00 C ATOM 584 C PRO A 37 35.646 25.839 15.198 1.00 0.00 C ATOM 585 O PRO A 37 36.269 25.754 16.257 1.00 0.00 O ATOM 586 CB PRO A 37 36.757 26.978 13.167 1.00 0.00 C ATOM 587 CG PRO A 37 38.014 27.552 13.827 1.00 0.00 C ATOM 588 CD PRO A 37 37.490 28.653 14.736 1.00 0.00 C ATOM 0 HA PRO A 37 34.721 27.157 13.900 1.00 0.00 H new ATOM 0 HB2 PRO A 37 36.902 25.949 12.837 1.00 0.00 H new ATOM 0 HB3 PRO A 37 36.455 27.554 12.292 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.550 26.790 14.393 1.00 0.00 H new ATOM 0 HG3 PRO A 37 38.709 27.945 13.085 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.098 28.746 15.636 1.00 0.00 H new ATOM 0 HD3 PRO A 37 37.510 29.621 14.236 1.00 0.00 H new ATOM 596 N PRO A 38 34.899 24.807 14.810 1.00 0.00 N ATOM 597 CA PRO A 38 34.764 23.544 15.497 1.00 0.00 C ATOM 598 C PRO A 38 35.990 22.863 16.099 1.00 0.00 C ATOM 599 O PRO A 38 35.798 22.256 17.148 1.00 0.00 O ATOM 600 CB PRO A 38 33.976 22.591 14.594 1.00 0.00 C ATOM 601 CG PRO A 38 33.062 23.594 13.898 1.00 0.00 C ATOM 602 CD PRO A 38 33.983 24.801 13.683 1.00 0.00 C ATOM 0 HA PRO A 38 34.241 23.810 16.416 1.00 0.00 H new ATOM 0 HB2 PRO A 38 34.616 22.053 13.895 1.00 0.00 H new ATOM 0 HB3 PRO A 38 33.421 21.842 15.159 1.00 0.00 H new ATOM 0 HG2 PRO A 38 32.678 23.205 12.955 1.00 0.00 H new ATOM 0 HG3 PRO A 38 32.199 23.849 14.513 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.524 24.717 12.740 1.00 0.00 H new ATOM 0 HD3 PRO A 38 33.410 25.727 13.640 1.00 0.00 H new ATOM 610 N ASP A 39 37.189 22.927 15.532 1.00 0.00 N ATOM 611 CA ASP A 39 38.486 22.628 16.091 1.00 0.00 C ATOM 612 C ASP A 39 38.649 23.132 17.521 1.00 0.00 C ATOM 613 O ASP A 39 39.383 22.530 18.309 1.00 0.00 O ATOM 614 CB ASP A 39 39.606 23.226 15.242 1.00 0.00 C ATOM 615 CG ASP A 39 40.794 22.273 15.118 1.00 0.00 C ATOM 616 OD1 ASP A 39 40.740 21.391 14.236 1.00 0.00 O ATOM 617 OD2 ASP A 39 41.699 22.360 15.962 1.00 0.00 O ATOM 0 H ASP A 39 37.276 23.224 14.560 1.00 0.00 H new ATOM 0 HA ASP A 39 38.554 21.540 16.097 1.00 0.00 H new ATOM 0 HB2 ASP A 39 39.223 23.461 14.249 1.00 0.00 H new ATOM 0 HB3 ASP A 39 39.938 24.164 15.686 1.00 0.00 H new ATOM 622 N GLN A 40 38.056 24.278 17.812 1.00 0.00 N ATOM 623 CA GLN A 40 38.224 25.043 19.030 1.00 0.00 C ATOM 624 C GLN A 40 36.958 24.998 19.878 1.00 0.00 C ATOM 625 O GLN A 40 36.973 25.209 21.084 1.00 0.00 O ATOM 626 CB GLN A 40 38.589 26.511 18.787 1.00 0.00 C ATOM 627 CG GLN A 40 40.056 26.662 18.356 1.00 0.00 C ATOM 628 CD GLN A 40 40.367 28.147 18.434 1.00 0.00 C ATOM 629 OE1 GLN A 40 39.489 28.970 18.142 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.656 28.428 18.604 1.00 0.00 N ATOM 0 H GLN A 40 37.406 24.723 17.164 1.00 0.00 H new ATOM 0 HA GLN A 40 39.057 24.572 19.552 1.00 0.00 H new ATOM 0 HB2 GLN A 40 37.938 26.926 18.018 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.415 27.086 19.697 1.00 0.00 H new ATOM 0 HG2 GLN A 40 40.715 26.091 19.010 1.00 0.00 H new ATOM 0 HG3 GLN A 40 40.206 26.285 17.344 1.00 0.00 H new ATOM 0 HE21 GLN A 40 42.312 27.685 18.844 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.988 29.386 18.494 1.00 0.00 H new ATOM 639 N GLN A 41 35.879 24.432 19.335 1.00 0.00 N ATOM 640 CA GLN A 41 34.634 24.334 20.084 1.00 0.00 C ATOM 641 C GLN A 41 34.430 22.947 20.688 1.00 0.00 C ATOM 642 O GLN A 41 34.905 21.912 20.233 1.00 0.00 O ATOM 643 CB GLN A 41 33.489 24.460 19.085 1.00 0.00 C ATOM 644 CG GLN A 41 33.349 25.795 18.363 1.00 0.00 C ATOM 645 CD GLN A 41 32.239 25.758 17.321 1.00 0.00 C ATOM 646 OE1 GLN A 41 31.343 24.922 17.401 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.173 26.612 16.295 1.00 0.00 N ATOM 0 H GLN A 41 35.845 24.041 18.393 1.00 0.00 H new ATOM 0 HA GLN A 41 34.664 25.097 20.862 1.00 0.00 H new ATOM 0 HB2 GLN A 41 33.606 23.679 18.334 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.556 24.259 19.611 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.141 26.581 19.089 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.293 26.049 17.880 1.00 0.00 H new ATOM 0 HE21 GLN A 41 32.891 27.327 16.180 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.405 26.548 15.627 1.00 0.00 H new ATOM 656 N ARG A 42 33.640 22.963 21.759 1.00 0.00 N ATOM 657 CA ARG A 42 33.089 21.777 22.400 1.00 0.00 C ATOM 658 C ARG A 42 31.785 22.329 22.958 1.00 0.00 C ATOM 659 O ARG A 42 31.749 23.070 23.940 1.00 0.00 O ATOM 660 CB ARG A 42 34.075 21.346 23.487 1.00 0.00 C ATOM 661 CG ARG A 42 33.745 20.087 24.282 1.00 0.00 C ATOM 662 CD ARG A 42 34.395 18.833 23.702 1.00 0.00 C ATOM 663 NE ARG A 42 34.156 17.558 24.364 1.00 0.00 N ATOM 664 CZ ARG A 42 34.437 16.288 24.020 1.00 0.00 C ATOM 665 NH1 ARG A 42 34.918 16.057 22.787 1.00 0.00 N ATOM 666 NH2 ARG A 42 34.079 15.288 24.825 1.00 0.00 N ATOM 0 H ARG A 42 33.358 23.830 22.217 1.00 0.00 H new ATOM 0 HA ARG A 42 32.926 20.899 21.775 1.00 0.00 H new ATOM 0 HB2 ARG A 42 35.049 21.202 23.019 1.00 0.00 H new ATOM 0 HB3 ARG A 42 34.179 22.171 24.192 1.00 0.00 H new ATOM 0 HG2 ARG A 42 34.074 20.217 25.313 1.00 0.00 H new ATOM 0 HG3 ARG A 42 32.664 19.952 24.307 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.065 18.737 22.668 1.00 0.00 H new ATOM 0 HD3 ARG A 42 35.472 18.998 23.679 1.00 0.00 H new ATOM 0 HE ARG A 42 33.683 17.645 25.264 1.00 0.00 H new ATOM 0 HH11 ARG A 42 35.061 16.834 22.141 1.00 0.00 H new ATOM 0 HH12 ARG A 42 35.141 15.105 22.497 1.00 0.00 H new ATOM 0 HH21 ARG A 42 33.593 15.486 25.700 1.00 0.00 H new ATOM 0 HH22 ARG A 42 34.291 14.324 24.566 1.00 0.00 H new ATOM 680 N LEU A 43 30.676 21.968 22.309 1.00 0.00 N ATOM 681 CA LEU A 43 29.323 22.109 22.809 1.00 0.00 C ATOM 682 C LEU A 43 28.991 20.948 23.747 1.00 0.00 C ATOM 683 O LEU A 43 28.143 20.104 23.479 1.00 0.00 O ATOM 684 CB LEU A 43 28.470 22.104 21.540 1.00 0.00 C ATOM 685 CG LEU A 43 28.830 23.240 20.576 1.00 0.00 C ATOM 686 CD1 LEU A 43 28.028 23.084 19.276 1.00 0.00 C ATOM 687 CD2 LEU A 43 28.735 24.658 21.117 1.00 0.00 C ATOM 0 H LEU A 43 30.707 21.551 21.379 1.00 0.00 H new ATOM 0 HA LEU A 43 29.157 23.011 23.398 1.00 0.00 H new ATOM 0 HB2 LEU A 43 28.592 21.149 21.030 1.00 0.00 H new ATOM 0 HB3 LEU A 43 27.418 22.187 21.815 1.00 0.00 H new ATOM 0 HG LEU A 43 29.899 23.123 20.396 1.00 0.00 H new ATOM 0 HD11 LEU A 43 28.285 23.892 18.591 1.00 0.00 H new ATOM 0 HD12 LEU A 43 28.267 22.127 18.813 1.00 0.00 H new ATOM 0 HD13 LEU A 43 26.962 23.122 19.499 1.00 0.00 H new ATOM 0 HD21 LEU A 43 29.016 25.365 20.336 1.00 0.00 H new ATOM 0 HD22 LEU A 43 27.712 24.858 21.437 1.00 0.00 H new ATOM 0 HD23 LEU A 43 29.409 24.769 21.966 1.00 0.00 H new ATOM 699 N ILE A 44 29.608 21.025 24.930 1.00 0.00 N ATOM 700 CA ILE A 44 29.141 20.423 26.158 1.00 0.00 C ATOM 701 C ILE A 44 27.912 21.213 26.611 1.00 0.00 C ATOM 702 O ILE A 44 28.028 22.208 27.325 1.00 0.00 O ATOM 703 CB ILE A 44 30.172 20.192 27.263 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.723 19.760 28.666 1.00 0.00 C ATOM 705 CG2 ILE A 44 31.142 21.375 27.386 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.721 18.809 29.330 1.00 0.00 C ATOM 0 H ILE A 44 30.484 21.533 25.051 1.00 0.00 H new ATOM 0 HA ILE A 44 28.884 19.388 25.934 1.00 0.00 H new ATOM 0 HB ILE A 44 30.645 19.288 26.880 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.595 20.643 29.292 1.00 0.00 H new ATOM 0 HG13 ILE A 44 28.750 19.273 28.599 1.00 0.00 H new ATOM 0 HG21 ILE A 44 31.860 21.175 28.181 1.00 0.00 H new ATOM 0 HG22 ILE A 44 31.672 21.510 26.443 1.00 0.00 H new ATOM 0 HG23 ILE A 44 30.583 22.281 27.621 1.00 0.00 H new ATOM 0 HD11 ILE A 44 30.357 18.533 30.320 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.830 17.912 28.720 1.00 0.00 H new ATOM 0 HD13 ILE A 44 31.688 19.304 29.423 1.00 0.00 H new ATOM 718 N PHE A 45 26.716 20.771 26.223 1.00 0.00 N ATOM 719 CA PHE A 45 25.484 21.512 26.443 1.00 0.00 C ATOM 720 C PHE A 45 24.967 21.541 27.882 1.00 0.00 C ATOM 721 O PHE A 45 24.248 22.465 28.252 1.00 0.00 O ATOM 722 CB PHE A 45 24.352 20.983 25.556 1.00 0.00 C ATOM 723 CG PHE A 45 23.782 19.595 25.611 1.00 0.00 C ATOM 724 CD1 PHE A 45 24.483 18.527 25.032 1.00 0.00 C ATOM 725 CD2 PHE A 45 22.565 19.305 26.244 1.00 0.00 C ATOM 726 CE1 PHE A 45 23.960 17.228 25.021 1.00 0.00 C ATOM 727 CE2 PHE A 45 21.921 18.081 26.015 1.00 0.00 C ATOM 728 CZ PHE A 45 22.628 17.045 25.391 1.00 0.00 C ATOM 0 H PHE A 45 26.579 19.881 25.744 1.00 0.00 H new ATOM 0 HA PHE A 45 25.765 22.533 26.185 1.00 0.00 H new ATOM 0 HB2 PHE A 45 23.510 21.657 25.714 1.00 0.00 H new ATOM 0 HB3 PHE A 45 24.687 21.127 24.529 1.00 0.00 H new ATOM 0 HD1 PHE A 45 25.449 18.711 24.584 1.00 0.00 H new ATOM 0 HD2 PHE A 45 22.121 20.029 26.912 1.00 0.00 H new ATOM 0 HE1 PHE A 45 24.574 16.388 24.733 1.00 0.00 H new ATOM 0 HE2 PHE A 45 20.894 17.939 26.316 1.00 0.00 H new ATOM 0 HZ PHE A 45 22.140 16.102 25.196 1.00 0.00 H new ATOM 738 N ALA A 46 25.258 20.511 28.669 1.00 0.00 N ATOM 739 CA ALA A 46 24.950 20.395 30.077 1.00 0.00 C ATOM 740 C ALA A 46 26.035 19.529 30.742 1.00 0.00 C ATOM 741 O ALA A 46 26.886 20.156 31.365 1.00 0.00 O ATOM 742 CB ALA A 46 23.525 19.881 30.329 1.00 0.00 C ATOM 0 H ALA A 46 25.745 19.689 28.313 1.00 0.00 H new ATOM 0 HA ALA A 46 24.962 21.384 30.534 1.00 0.00 H new ATOM 0 HB1 ALA A 46 23.347 19.813 31.402 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.806 20.569 29.885 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.409 18.895 29.879 1.00 0.00 H new ATOM 748 N GLY A 47 25.985 18.207 30.666 1.00 0.00 N ATOM 749 CA GLY A 47 26.943 17.293 31.265 1.00 0.00 C ATOM 750 C GLY A 47 27.676 16.518 30.177 1.00 0.00 C ATOM 751 O GLY A 47 28.637 15.840 30.566 1.00 0.00 O ATOM 0 H GLY A 47 25.242 17.722 30.163 1.00 0.00 H new ATOM 0 HA2 GLY A 47 27.658 17.849 31.871 1.00 0.00 H new ATOM 0 HA3 GLY A 47 26.429 16.601 31.932 1.00 0.00 H new ATOM 755 N LYS A 48 27.247 16.523 28.918 1.00 0.00 N ATOM 756 CA LYS A 48 27.705 15.680 27.832 1.00 0.00 C ATOM 757 C LYS A 48 27.851 16.616 26.638 1.00 0.00 C ATOM 758 O LYS A 48 27.366 17.745 26.620 1.00 0.00 O ATOM 759 CB LYS A 48 26.728 14.530 27.624 1.00 0.00 C ATOM 760 CG LYS A 48 27.380 13.375 26.863 1.00 0.00 C ATOM 761 CD LYS A 48 26.515 12.123 27.039 1.00 0.00 C ATOM 762 CE LYS A 48 27.189 11.285 28.125 1.00 0.00 C ATOM 763 NZ LYS A 48 26.280 10.321 28.768 1.00 0.00 N ATOM 0 H LYS A 48 26.516 17.166 28.614 1.00 0.00 H new ATOM 0 HA LYS A 48 28.661 15.191 28.021 1.00 0.00 H new ATOM 0 HB2 LYS A 48 26.370 14.175 28.591 1.00 0.00 H new ATOM 0 HB3 LYS A 48 25.857 14.885 27.073 1.00 0.00 H new ATOM 0 HG2 LYS A 48 27.474 13.624 25.806 1.00 0.00 H new ATOM 0 HG3 LYS A 48 28.387 13.195 27.239 1.00 0.00 H new ATOM 0 HD2 LYS A 48 25.499 12.390 27.329 1.00 0.00 H new ATOM 0 HD3 LYS A 48 26.444 11.565 26.105 1.00 0.00 H new ATOM 0 HE2 LYS A 48 28.029 10.745 27.688 1.00 0.00 H new ATOM 0 HE3 LYS A 48 27.598 11.950 28.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 26.798 9.786 29.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 25.491 10.832 29.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 25.908 9.664 28.053 1.00 0.00 H new ATOM 777 N GLN A 49 28.574 16.176 25.605 1.00 0.00 N ATOM 778 CA GLN A 49 28.674 16.868 24.336 1.00 0.00 C ATOM 779 C GLN A 49 27.444 16.695 23.444 1.00 0.00 C ATOM 780 O GLN A 49 26.753 15.692 23.595 1.00 0.00 O ATOM 781 CB GLN A 49 29.965 16.389 23.676 1.00 0.00 C ATOM 782 CG GLN A 49 30.500 17.377 22.634 1.00 0.00 C ATOM 783 CD GLN A 49 31.495 16.890 21.602 1.00 0.00 C ATOM 784 OE1 GLN A 49 32.150 17.697 20.947 1.00 0.00 O ATOM 785 NE2 GLN A 49 31.759 15.583 21.519 1.00 0.00 N ATOM 0 H GLN A 49 29.113 15.311 25.637 1.00 0.00 H new ATOM 0 HA GLN A 49 28.707 17.945 24.502 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.723 16.231 24.443 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.788 15.425 23.199 1.00 0.00 H new ATOM 0 HG2 GLN A 49 29.643 17.785 22.098 1.00 0.00 H new ATOM 0 HG3 GLN A 49 30.963 18.204 23.172 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.213 14.917 22.065 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.507 15.251 20.910 1.00 0.00 H new ATOM 794 N LEU A 50 27.217 17.638 22.537 1.00 0.00 N ATOM 795 CA LEU A 50 26.200 17.555 21.514 1.00 0.00 C ATOM 796 C LEU A 50 26.571 16.471 20.502 1.00 0.00 C ATOM 797 O LEU A 50 27.764 16.179 20.372 1.00 0.00 O ATOM 798 CB LEU A 50 25.945 18.881 20.780 1.00 0.00 C ATOM 799 CG LEU A 50 25.200 20.057 21.418 1.00 0.00 C ATOM 800 CD1 LEU A 50 25.000 21.284 20.529 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.813 19.674 21.924 1.00 0.00 C ATOM 0 H LEU A 50 27.755 18.504 22.498 1.00 0.00 H new ATOM 0 HA LEU A 50 25.272 17.304 22.027 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.921 19.260 20.478 1.00 0.00 H new ATOM 0 HB3 LEU A 50 25.404 18.631 19.867 1.00 0.00 H new ATOM 0 HG LEU A 50 25.876 20.321 22.232 1.00 0.00 H new ATOM 0 HD11 LEU A 50 24.462 22.052 21.085 1.00 0.00 H new ATOM 0 HD12 LEU A 50 25.971 21.672 20.221 1.00 0.00 H new ATOM 0 HD13 LEU A 50 24.424 21.004 19.647 1.00 0.00 H new ATOM 0 HD21 LEU A 50 23.333 20.547 22.366 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.210 19.310 21.092 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.904 18.890 22.676 1.00 0.00 H new ATOM 813 N GLU A 51 25.636 15.828 19.826 1.00 0.00 N ATOM 814 CA GLU A 51 25.984 14.814 18.843 1.00 0.00 C ATOM 815 C GLU A 51 25.700 15.357 17.441 1.00 0.00 C ATOM 816 O GLU A 51 24.568 15.724 17.119 1.00 0.00 O ATOM 817 CB GLU A 51 25.191 13.545 19.171 1.00 0.00 C ATOM 818 CG GLU A 51 25.479 12.294 18.356 1.00 0.00 C ATOM 819 CD GLU A 51 24.726 11.088 18.913 1.00 0.00 C ATOM 820 OE1 GLU A 51 23.763 11.249 19.694 1.00 0.00 O ATOM 821 OE2 GLU A 51 25.144 9.934 18.667 1.00 0.00 O ATOM 0 H GLU A 51 24.635 15.987 19.937 1.00 0.00 H new ATOM 0 HA GLU A 51 27.044 14.562 18.873 1.00 0.00 H new ATOM 0 HB2 GLU A 51 25.361 13.306 20.221 1.00 0.00 H new ATOM 0 HB3 GLU A 51 24.131 13.776 19.065 1.00 0.00 H new ATOM 0 HG2 GLU A 51 25.191 12.459 17.318 1.00 0.00 H new ATOM 0 HG3 GLU A 51 26.550 12.092 18.361 1.00 0.00 H new ATOM 828 N ASP A 52 26.658 15.264 16.523 1.00 0.00 N ATOM 829 CA ASP A 52 26.659 15.427 15.088 1.00 0.00 C ATOM 830 C ASP A 52 25.520 14.739 14.331 1.00 0.00 C ATOM 831 O ASP A 52 25.570 13.525 14.131 1.00 0.00 O ATOM 832 CB ASP A 52 28.012 15.106 14.450 1.00 0.00 C ATOM 833 CG ASP A 52 29.055 16.149 14.854 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.624 16.049 15.963 1.00 0.00 O ATOM 835 OD2 ASP A 52 29.313 17.117 14.102 1.00 0.00 O ATOM 0 H ASP A 52 27.602 15.034 16.833 1.00 0.00 H new ATOM 0 HA ASP A 52 26.466 16.494 14.975 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.341 14.114 14.761 1.00 0.00 H new ATOM 0 HB3 ASP A 52 27.913 15.083 13.365 1.00 0.00 H new ATOM 840 N GLY A 53 24.543 15.500 13.866 1.00 0.00 N ATOM 841 CA GLY A 53 23.425 15.097 13.043 1.00 0.00 C ATOM 842 C GLY A 53 22.028 15.320 13.635 1.00 0.00 C ATOM 843 O GLY A 53 21.031 15.140 12.940 1.00 0.00 O ATOM 0 H GLY A 53 24.514 16.498 14.075 1.00 0.00 H new ATOM 0 HA2 GLY A 53 23.485 15.635 12.097 1.00 0.00 H new ATOM 0 HA3 GLY A 53 23.534 14.037 12.814 1.00 0.00 H new ATOM 847 N ARG A 54 21.976 15.787 14.881 1.00 0.00 N ATOM 848 CA ARG A 54 20.723 15.992 15.576 1.00 0.00 C ATOM 849 C ARG A 54 20.465 17.488 15.401 1.00 0.00 C ATOM 850 O ARG A 54 21.297 18.314 15.028 1.00 0.00 O ATOM 851 CB ARG A 54 21.021 15.688 17.038 1.00 0.00 C ATOM 852 CG ARG A 54 21.148 14.185 17.261 1.00 0.00 C ATOM 853 CD ARG A 54 20.946 13.629 18.665 1.00 0.00 C ATOM 854 NE ARG A 54 21.402 12.232 18.704 1.00 0.00 N ATOM 855 CZ ARG A 54 20.779 11.101 18.352 1.00 0.00 C ATOM 856 NH1 ARG A 54 19.640 11.073 17.643 1.00 0.00 N ATOM 857 NH2 ARG A 54 21.333 9.979 18.834 1.00 0.00 N ATOM 0 H ARG A 54 22.801 16.031 15.428 1.00 0.00 H new ATOM 0 HA ARG A 54 19.882 15.391 15.231 1.00 0.00 H new ATOM 0 HB2 ARG A 54 21.944 16.184 17.337 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.226 16.088 17.667 1.00 0.00 H new ATOM 0 HG2 ARG A 54 20.430 13.693 16.605 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.142 13.885 16.928 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.502 14.225 19.388 1.00 0.00 H new ATOM 0 HD3 ARG A 54 19.894 13.688 18.944 1.00 0.00 H new ATOM 0 HE ARG A 54 22.350 12.103 19.058 1.00 0.00 H new ATOM 0 HH11 ARG A 54 19.204 11.945 17.343 1.00 0.00 H new ATOM 0 HH12 ARG A 54 19.210 10.180 17.404 1.00 0.00 H new ATOM 0 HH21 ARG A 54 22.166 10.033 19.420 1.00 0.00 H new ATOM 0 HH22 ARG A 54 20.922 9.072 18.614 1.00 0.00 H new ATOM 871 N THR A 55 19.177 17.754 15.573 1.00 0.00 N ATOM 872 CA THR A 55 18.547 19.059 15.485 1.00 0.00 C ATOM 873 C THR A 55 18.124 19.357 16.924 1.00 0.00 C ATOM 874 O THR A 55 18.363 18.557 17.824 1.00 0.00 O ATOM 875 CB THR A 55 17.376 19.057 14.501 1.00 0.00 C ATOM 876 OG1 THR A 55 16.444 18.116 14.963 1.00 0.00 O ATOM 877 CG2 THR A 55 17.800 18.591 13.112 1.00 0.00 C ATOM 0 H THR A 55 18.506 17.018 15.791 1.00 0.00 H new ATOM 0 HA THR A 55 19.211 19.829 15.094 1.00 0.00 H new ATOM 0 HB THR A 55 16.982 20.071 14.437 1.00 0.00 H new ATOM 0 HG1 THR A 55 16.905 17.280 15.184 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.938 18.605 12.445 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.570 19.258 12.724 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.195 17.577 13.173 1.00 0.00 H new ATOM 885 N LEU A 56 17.695 20.584 17.230 1.00 0.00 N ATOM 886 CA LEU A 56 17.097 21.131 18.426 1.00 0.00 C ATOM 887 C LEU A 56 15.884 20.322 18.896 1.00 0.00 C ATOM 888 O LEU A 56 15.812 20.127 20.108 1.00 0.00 O ATOM 889 CB LEU A 56 16.769 22.603 18.203 1.00 0.00 C ATOM 890 CG LEU A 56 17.943 23.579 18.221 1.00 0.00 C ATOM 891 CD1 LEU A 56 19.126 23.015 17.436 1.00 0.00 C ATOM 892 CD2 LEU A 56 17.558 24.961 17.708 1.00 0.00 C ATOM 0 H LEU A 56 17.778 21.318 16.527 1.00 0.00 H new ATOM 0 HA LEU A 56 17.820 21.059 19.239 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.264 22.697 17.242 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.058 22.913 18.969 1.00 0.00 H new ATOM 0 HG LEU A 56 18.242 23.701 19.262 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.952 23.726 17.461 1.00 0.00 H new ATOM 0 HD12 LEU A 56 19.444 22.073 17.884 1.00 0.00 H new ATOM 0 HD13 LEU A 56 18.827 22.842 16.402 1.00 0.00 H new ATOM 0 HD21 LEU A 56 18.428 25.617 17.741 1.00 0.00 H new ATOM 0 HD22 LEU A 56 17.203 24.882 16.681 1.00 0.00 H new ATOM 0 HD23 LEU A 56 16.768 25.374 18.334 1.00 0.00 H new ATOM 904 N SER A 57 15.079 19.742 18.009 1.00 0.00 N ATOM 905 CA SER A 57 13.969 18.883 18.354 1.00 0.00 C ATOM 906 C SER A 57 14.343 17.502 18.881 1.00 0.00 C ATOM 907 O SER A 57 13.502 16.849 19.511 1.00 0.00 O ATOM 908 CB SER A 57 13.235 18.655 17.035 1.00 0.00 C ATOM 909 OG SER A 57 12.491 19.782 16.606 1.00 0.00 O ATOM 0 H SER A 57 15.192 19.866 17.003 1.00 0.00 H new ATOM 0 HA SER A 57 13.408 19.369 19.152 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.960 18.392 16.265 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.562 17.804 17.144 1.00 0.00 H new ATOM 0 HG SER A 57 12.046 19.576 15.758 1.00 0.00 H new ATOM 915 N ASP A 58 15.554 17.035 18.588 1.00 0.00 N ATOM 916 CA ASP A 58 16.162 15.846 19.165 1.00 0.00 C ATOM 917 C ASP A 58 16.605 16.025 20.615 1.00 0.00 C ATOM 918 O ASP A 58 16.593 15.058 21.369 1.00 0.00 O ATOM 919 CB ASP A 58 17.310 15.280 18.332 1.00 0.00 C ATOM 920 CG ASP A 58 16.924 15.036 16.891 1.00 0.00 C ATOM 921 OD1 ASP A 58 16.233 14.040 16.568 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.365 15.786 15.990 1.00 0.00 O ATOM 0 H ASP A 58 16.162 17.497 17.912 1.00 0.00 H new ATOM 0 HA ASP A 58 15.353 15.115 19.155 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.152 15.971 18.366 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.648 14.344 18.776 1.00 0.00 H new ATOM 927 N TYR A 59 16.997 17.221 21.039 1.00 0.00 N ATOM 928 CA TYR A 59 17.320 17.565 22.411 1.00 0.00 C ATOM 929 C TYR A 59 16.172 18.327 23.074 1.00 0.00 C ATOM 930 O TYR A 59 16.244 18.805 24.200 1.00 0.00 O ATOM 931 CB TYR A 59 18.541 18.487 22.378 1.00 0.00 C ATOM 932 CG TYR A 59 19.740 17.648 21.990 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.164 16.578 22.788 1.00 0.00 C ATOM 934 CD2 TYR A 59 20.446 18.054 20.848 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.396 15.972 22.519 1.00 0.00 C ATOM 936 CE2 TYR A 59 21.530 17.268 20.460 1.00 0.00 C ATOM 937 CZ TYR A 59 22.077 16.353 21.362 1.00 0.00 C ATOM 938 OH TYR A 59 23.252 15.718 21.062 1.00 0.00 O ATOM 0 H TYR A 59 17.102 18.011 20.403 1.00 0.00 H new ATOM 0 HA TYR A 59 17.506 16.651 22.976 1.00 0.00 H new ATOM 0 HB2 TYR A 59 18.391 19.295 21.662 1.00 0.00 H new ATOM 0 HB3 TYR A 59 18.697 18.950 23.352 1.00 0.00 H new ATOM 0 HD1 TYR A 59 19.547 16.225 23.601 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.162 18.936 20.294 1.00 0.00 H new ATOM 0 HE1 TYR A 59 21.808 15.231 23.188 1.00 0.00 H new ATOM 0 HE2 TYR A 59 21.944 17.366 19.467 1.00 0.00 H new ATOM 0 HH TYR A 59 23.066 14.793 20.797 1.00 0.00 H new ATOM 948 N ASN A 60 15.055 18.538 22.380 1.00 0.00 N ATOM 949 CA ASN A 60 13.882 19.236 22.854 1.00 0.00 C ATOM 950 C ASN A 60 13.977 20.743 23.115 1.00 0.00 C ATOM 951 O ASN A 60 13.184 21.286 23.875 1.00 0.00 O ATOM 952 CB ASN A 60 13.182 18.457 23.972 1.00 0.00 C ATOM 953 CG ASN A 60 12.816 17.041 23.552 1.00 0.00 C ATOM 954 OD1 ASN A 60 11.832 16.850 22.840 1.00 0.00 O ATOM 955 ND2 ASN A 60 13.492 16.043 24.105 1.00 0.00 N ATOM 0 H ASN A 60 14.948 18.205 21.422 1.00 0.00 H new ATOM 0 HA ASN A 60 13.240 19.249 21.973 1.00 0.00 H new ATOM 0 HB2 ASN A 60 13.833 18.417 24.846 1.00 0.00 H new ATOM 0 HB3 ASN A 60 12.279 18.989 24.271 1.00 0.00 H new ATOM 0 HD21 ASN A 60 13.200 15.079 23.945 1.00 0.00 H new ATOM 0 HD22 ASN A 60 14.304 16.240 24.690 1.00 0.00 H new ATOM 962 N ILE A 61 15.026 21.385 22.621 1.00 0.00 N ATOM 963 CA ILE A 61 15.448 22.708 23.062 1.00 0.00 C ATOM 964 C ILE A 61 14.317 23.640 22.636 1.00 0.00 C ATOM 965 O ILE A 61 13.558 23.392 21.693 1.00 0.00 O ATOM 966 CB ILE A 61 16.794 23.125 22.468 1.00 0.00 C ATOM 967 CG1 ILE A 61 17.921 22.221 22.959 1.00 0.00 C ATOM 968 CG2 ILE A 61 17.230 24.570 22.711 1.00 0.00 C ATOM 969 CD1 ILE A 61 19.172 22.125 22.086 1.00 0.00 C ATOM 0 H ILE A 61 15.619 20.994 21.889 1.00 0.00 H new ATOM 0 HA ILE A 61 15.615 22.735 24.139 1.00 0.00 H new ATOM 0 HB ILE A 61 16.617 23.026 21.397 1.00 0.00 H new ATOM 0 HG12 ILE A 61 18.225 22.567 23.947 1.00 0.00 H new ATOM 0 HG13 ILE A 61 17.518 21.216 23.083 1.00 0.00 H new ATOM 0 HG21 ILE A 61 18.198 24.742 22.241 1.00 0.00 H new ATOM 0 HG22 ILE A 61 16.493 25.249 22.283 1.00 0.00 H new ATOM 0 HG23 ILE A 61 17.310 24.751 23.783 1.00 0.00 H new ATOM 0 HD11 ILE A 61 19.890 21.451 22.552 1.00 0.00 H new ATOM 0 HD12 ILE A 61 18.901 21.742 21.102 1.00 0.00 H new ATOM 0 HD13 ILE A 61 19.618 23.114 21.980 1.00 0.00 H new ATOM 981 N GLN A 62 14.188 24.749 23.345 1.00 0.00 N ATOM 982 CA GLN A 62 13.143 25.752 23.358 1.00 0.00 C ATOM 983 C GLN A 62 13.645 27.186 23.194 1.00 0.00 C ATOM 984 O GLN A 62 14.837 27.450 23.033 1.00 0.00 O ATOM 985 CB GLN A 62 12.360 25.507 24.649 1.00 0.00 C ATOM 986 CG GLN A 62 13.198 25.701 25.913 1.00 0.00 C ATOM 987 CD GLN A 62 12.285 25.467 27.106 1.00 0.00 C ATOM 988 OE1 GLN A 62 12.907 25.473 28.165 1.00 0.00 O ATOM 989 NE2 GLN A 62 10.960 25.426 27.038 1.00 0.00 N ATOM 0 H GLN A 62 14.916 24.997 24.015 1.00 0.00 H new ATOM 0 HA GLN A 62 12.498 25.649 22.485 1.00 0.00 H new ATOM 0 HB2 GLN A 62 11.506 26.183 24.681 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.963 24.492 24.637 1.00 0.00 H new ATOM 0 HG2 GLN A 62 14.036 25.004 25.929 1.00 0.00 H new ATOM 0 HG3 GLN A 62 13.619 26.706 25.944 1.00 0.00 H new ATOM 0 HE21 GLN A 62 10.496 25.423 26.130 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.406 25.397 27.894 1.00 0.00 H new ATOM 998 N LYS A 63 12.666 28.091 23.191 1.00 0.00 N ATOM 999 CA LYS A 63 12.874 29.506 23.006 1.00 0.00 C ATOM 1000 C LYS A 63 13.677 30.067 24.179 1.00 0.00 C ATOM 1001 O LYS A 63 13.238 29.742 25.283 1.00 0.00 O ATOM 1002 CB LYS A 63 11.524 30.210 22.817 1.00 0.00 C ATOM 1003 CG LYS A 63 11.395 31.727 22.989 1.00 0.00 C ATOM 1004 CD LYS A 63 10.092 32.157 22.304 1.00 0.00 C ATOM 1005 CE LYS A 63 9.814 33.662 22.309 1.00 0.00 C ATOM 1006 NZ LYS A 63 8.378 33.953 22.468 1.00 0.00 N ATOM 0 H LYS A 63 11.685 27.842 23.321 1.00 0.00 H new ATOM 0 HA LYS A 63 13.457 29.687 22.103 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.178 29.972 21.811 1.00 0.00 H new ATOM 0 HB3 LYS A 63 10.823 29.749 23.513 1.00 0.00 H new ATOM 0 HG2 LYS A 63 11.379 31.993 24.046 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.249 32.238 22.544 1.00 0.00 H new ATOM 0 HD2 LYS A 63 10.114 31.812 21.270 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.260 31.649 22.792 1.00 0.00 H new ATOM 0 HE2 LYS A 63 10.372 34.132 23.119 1.00 0.00 H new ATOM 0 HE3 LYS A 63 10.173 34.101 21.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 8.230 34.982 22.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.848 33.526 21.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 8.041 33.556 23.368 1.00 0.00 H new ATOM 1020 N GLU A 64 14.693 30.907 24.021 1.00 0.00 N ATOM 1021 CA GLU A 64 15.379 31.693 25.027 1.00 0.00 C ATOM 1022 C GLU A 64 16.381 30.885 25.838 1.00 0.00 C ATOM 1023 O GLU A 64 17.040 31.399 26.744 1.00 0.00 O ATOM 1024 CB GLU A 64 14.486 32.638 25.831 1.00 0.00 C ATOM 1025 CG GLU A 64 14.540 34.069 25.274 1.00 0.00 C ATOM 1026 CD GLU A 64 13.623 35.011 26.039 1.00 0.00 C ATOM 1027 OE1 GLU A 64 13.105 34.630 27.107 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.568 36.169 25.561 1.00 0.00 O ATOM 0 H GLU A 64 15.091 31.066 23.096 1.00 0.00 H new ATOM 0 HA GLU A 64 15.994 32.395 24.464 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.458 32.276 25.810 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.802 32.640 26.874 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.564 34.439 25.324 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.255 34.060 24.222 1.00 0.00 H new ATOM 1035 N SER A 65 16.513 29.597 25.530 1.00 0.00 N ATOM 1036 CA SER A 65 17.405 28.629 26.124 1.00 0.00 C ATOM 1037 C SER A 65 18.868 29.033 25.977 1.00 0.00 C ATOM 1038 O SER A 65 19.293 29.560 24.947 1.00 0.00 O ATOM 1039 CB SER A 65 17.228 27.294 25.389 1.00 0.00 C ATOM 1040 OG SER A 65 16.360 26.398 26.037 1.00 0.00 O ATOM 0 H SER A 65 15.945 29.177 24.794 1.00 0.00 H new ATOM 0 HA SER A 65 17.162 28.559 27.184 1.00 0.00 H new ATOM 0 HB2 SER A 65 16.849 27.490 24.386 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.203 26.821 25.275 1.00 0.00 H new ATOM 0 HG SER A 65 16.293 25.572 25.514 1.00 0.00 H new ATOM 1046 N THR A 66 19.684 28.787 27.003 1.00 0.00 N ATOM 1047 CA THR A 66 21.077 29.181 26.986 1.00 0.00 C ATOM 1048 C THR A 66 21.864 27.865 26.875 1.00 0.00 C ATOM 1049 O THR A 66 21.664 26.955 27.668 1.00 0.00 O ATOM 1050 CB THR A 66 21.412 29.914 28.276 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.677 31.123 28.306 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.878 30.341 28.266 1.00 0.00 C ATOM 0 H THR A 66 19.393 28.313 27.858 1.00 0.00 H new ATOM 0 HA THR A 66 21.317 29.855 26.164 1.00 0.00 H new ATOM 0 HB THR A 66 21.190 29.256 29.116 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.880 31.609 29.133 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.111 30.865 29.193 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.513 29.459 28.179 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.058 31.003 27.419 1.00 0.00 H new ATOM 1060 N LEU A 67 22.812 27.886 25.945 1.00 0.00 N ATOM 1061 CA LEU A 67 23.771 26.812 25.742 1.00 0.00 C ATOM 1062 C LEU A 67 25.168 27.333 26.071 1.00 0.00 C ATOM 1063 O LEU A 67 25.384 28.553 26.033 1.00 0.00 O ATOM 1064 CB LEU A 67 23.700 26.344 24.295 1.00 0.00 C ATOM 1065 CG LEU A 67 22.437 25.544 23.979 1.00 0.00 C ATOM 1066 CD1 LEU A 67 22.205 25.362 22.483 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.345 24.205 24.717 1.00 0.00 C ATOM 0 H LEU A 67 22.936 28.666 25.300 1.00 0.00 H new ATOM 0 HA LEU A 67 23.543 25.968 26.393 1.00 0.00 H new ATOM 0 HB2 LEU A 67 23.746 27.212 23.637 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.574 25.731 24.075 1.00 0.00 H new ATOM 0 HG LEU A 67 21.627 26.164 24.365 1.00 0.00 H new ATOM 0 HD11 LEU A 67 21.293 24.786 22.324 1.00 0.00 H new ATOM 0 HD12 LEU A 67 22.105 26.338 22.009 1.00 0.00 H new ATOM 0 HD13 LEU A 67 23.051 24.831 22.046 1.00 0.00 H new ATOM 0 HD21 LEU A 67 21.421 23.699 24.439 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.196 23.581 24.446 1.00 0.00 H new ATOM 0 HD23 LEU A 67 22.352 24.381 25.793 1.00 0.00 H new ATOM 1079 N HIS A 68 26.058 26.449 26.491 1.00 0.00 N ATOM 1080 CA HIS A 68 27.352 26.726 27.080 1.00 0.00 C ATOM 1081 C HIS A 68 28.407 26.420 26.013 1.00 0.00 C ATOM 1082 O HIS A 68 28.136 25.532 25.196 1.00 0.00 O ATOM 1083 CB HIS A 68 27.533 25.614 28.110 1.00 0.00 C ATOM 1084 CG HIS A 68 26.927 26.006 29.426 1.00 0.00 C ATOM 1085 ND1 HIS A 68 25.544 26.163 29.516 1.00 0.00 N ATOM 1086 CD2 HIS A 68 27.591 26.462 30.526 1.00 0.00 C ATOM 1087 CE1 HIS A 68 25.456 26.824 30.675 1.00 0.00 C ATOM 1088 NE2 HIS A 68 26.615 27.045 31.317 1.00 0.00 N ATOM 0 H HIS A 68 25.879 25.447 26.423 1.00 0.00 H new ATOM 0 HA HIS A 68 27.430 27.741 27.469 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.067 24.697 27.748 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.594 25.402 28.241 1.00 0.00 H new ATOM 0 HD2 HIS A 68 28.648 26.385 30.735 1.00 0.00 H new ATOM 0 HE1 HIS A 68 24.509 27.160 31.071 1.00 0.00 H new ATOM 0 HE2 HIS A 68 26.748 27.538 32.200 1.00 0.00 H new ATOM 1096 N LEU A 69 29.550 27.083 25.971 1.00 0.00 N ATOM 1097 CA LEU A 69 30.673 26.703 25.134 1.00 0.00 C ATOM 1098 C LEU A 69 31.991 26.636 25.911 1.00 0.00 C ATOM 1099 O LEU A 69 32.291 27.524 26.700 1.00 0.00 O ATOM 1100 CB LEU A 69 30.686 27.653 23.940 1.00 0.00 C ATOM 1101 CG LEU A 69 31.761 27.356 22.894 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.313 27.827 21.511 1.00 0.00 C ATOM 1103 CD2 LEU A 69 33.128 27.978 23.179 1.00 0.00 C ATOM 0 H LEU A 69 29.726 27.918 26.530 1.00 0.00 H new ATOM 0 HA LEU A 69 30.557 25.683 24.768 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.710 27.619 23.456 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.826 28.670 24.305 1.00 0.00 H new ATOM 0 HG LEU A 69 31.882 26.274 22.935 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.092 27.606 20.781 1.00 0.00 H new ATOM 0 HD12 LEU A 69 30.396 27.310 21.230 1.00 0.00 H new ATOM 0 HD13 LEU A 69 31.131 28.901 21.534 1.00 0.00 H new ATOM 0 HD21 LEU A 69 33.822 27.711 22.382 1.00 0.00 H new ATOM 0 HD22 LEU A 69 33.031 29.063 23.228 1.00 0.00 H new ATOM 0 HD23 LEU A 69 33.507 27.604 24.130 1.00 0.00 H new ATOM 1115 N VAL A 70 32.811 25.615 25.690 1.00 0.00 N ATOM 1116 CA VAL A 70 34.066 25.278 26.332 1.00 0.00 C ATOM 1117 C VAL A 70 35.127 25.155 25.242 1.00 0.00 C ATOM 1118 O VAL A 70 34.875 24.678 24.133 1.00 0.00 O ATOM 1119 CB VAL A 70 33.876 24.028 27.187 1.00 0.00 C ATOM 1120 CG1 VAL A 70 35.129 23.397 27.801 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.720 24.037 28.182 1.00 0.00 C ATOM 0 H VAL A 70 32.581 24.927 24.973 1.00 0.00 H new ATOM 0 HA VAL A 70 34.407 26.049 27.022 1.00 0.00 H new ATOM 0 HB VAL A 70 33.575 23.356 26.384 1.00 0.00 H new ATOM 0 HG11 VAL A 70 34.847 22.519 28.382 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.814 23.102 27.006 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.619 24.121 28.453 1.00 0.00 H new ATOM 0 HG21 VAL A 70 32.698 23.091 28.723 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.854 24.856 28.888 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.780 24.170 27.646 1.00 0.00 H new ATOM 1131 N LEU A 71 36.307 25.686 25.567 1.00 0.00 N ATOM 1132 CA LEU A 71 37.300 26.103 24.594 1.00 0.00 C ATOM 1133 C LEU A 71 38.349 24.990 24.661 1.00 0.00 C ATOM 1134 O LEU A 71 38.879 24.816 25.752 1.00 0.00 O ATOM 1135 CB LEU A 71 37.908 27.406 25.118 1.00 0.00 C ATOM 1136 CG LEU A 71 38.827 28.252 24.226 1.00 0.00 C ATOM 1137 CD1 LEU A 71 38.047 28.868 23.073 1.00 0.00 C ATOM 1138 CD2 LEU A 71 39.527 29.269 25.127 1.00 0.00 C ATOM 0 H LEU A 71 36.598 25.838 26.533 1.00 0.00 H new ATOM 0 HA LEU A 71 36.919 26.259 23.585 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.081 28.046 25.426 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.472 27.159 26.018 1.00 0.00 H new ATOM 0 HG LEU A 71 39.592 27.644 23.742 1.00 0.00 H new ATOM 0 HD11 LEU A 71 38.720 29.463 22.455 1.00 0.00 H new ATOM 0 HD12 LEU A 71 37.605 28.076 22.469 1.00 0.00 H new ATOM 0 HD13 LEU A 71 37.257 29.507 23.468 1.00 0.00 H new ATOM 0 HD21 LEU A 71 40.191 29.891 24.527 1.00 0.00 H new ATOM 0 HD22 LEU A 71 38.781 29.898 25.613 1.00 0.00 H new ATOM 0 HD23 LEU A 71 40.108 28.744 25.885 1.00 0.00 H new