USER MOD reduce.3.24.130724 H: found=0, std=0, add=833, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 831 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: B 4 G O2' : rot -17:sc= 0.344 USER MOD Set 1.2: B 6 U O2' : rot 24:sc= 0.4 USER MOD Set 2.1: A 15 LYS NZ :NH3+ 160:sc= 2.29 (180deg=1.06) USER MOD Set 2.2: A 61 THR OG1 : rot 76:sc= -0.169! USER MOD Set 3.1: A 4 SER OG : rot 180:sc= 0.0809 USER MOD Set 3.2: A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 1 ALA N :NH3+ -95:sc= 0.0473 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ -160:sc= -1.22 (180deg=-2.51!) USER MOD Single : A 8 LYS NZ :NH3+ 160:sc= -0.159 (180deg=-0.517) USER MOD Single : A 12 GLN :FLIP amide:sc= -1.53 F(o=-2.1,f=-1.5) USER MOD Single : A 22 SER OG : rot 180:sc= -0.447 USER MOD Single : A 25 THR OG1 : rot 87:sc= 0.151 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.868 USER MOD Single : A 29 SER OG : rot 6:sc= 0.972 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 HIS :FLIP no HE2:sc= -0.0596 F(o=-0.56,f=-0.06) USER MOD Single : A 36 GLN :FLIP amide:sc= -0.0729 F(o=-0.95!,f=-0.073) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 CYS SG : rot 36:sc= -0.283 USER MOD Single : A 46 MET CE :methyl 148:sc= -7.13! (180deg=-11.5!) USER MOD Single : A 50 ASN : amide:sc= 0.382 K(o=0.38,f=-0.37) USER MOD Single : A 51 THR OG1 : rot 180:sc= -1.61! USER MOD Single : A 52 LYS NZ :NH3+ -164:sc= -0.0141 (180deg=-0.183) USER MOD Single : A 54 SER OG : rot 180:sc= 0.187 USER MOD Single : A 62 TYR OH : rot 45:sc= 1.2 USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.199 USER MOD Single : A 72 MET CE :methyl -170:sc= -1.24 (180deg=-2.19!) USER MOD Single : A 73 ASN : amide:sc= 0.727 K(o=0.73,f=-0.23) USER MOD Single : A 77 HIS : no HD1:sc= -0.276 K(o=-0.28,f=-4.7!) USER MOD Single : A 78 LYS NZ :NH3+ 168:sc= -0.0261 (180deg=-0.183) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 170:sc= 0.196 USER MOD Single : A 95 SER OG : rot -119:sc= 1.32 USER MOD Single : A 96 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : B 1 U O2' : rot 22:sc= -1.53! USER MOD Single : B 1 U O5' : rot -26:sc= 0.213 USER MOD Single : B 2 U O2' : rot 14:sc= 0.185 USER MOD Single : B 3 A O2' : rot -177:sc= -2.07 USER MOD Single : B 5 G O2' : rot -14:sc= 0.236 USER MOD Single : B 7 C O2' : rot -18:sc= 0.101 USER MOD Single : B 7 C O3' : rot -108:sc= 0.532 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -8.536 -0.133 -0.116 1.00 72.20 N ATOM 2 CA ALA A 1 -7.528 0.210 -1.140 1.00 61.31 C ATOM 3 C ALA A 1 -6.479 -0.887 -1.235 1.00 71.30 C ATOM 4 O ALA A 1 -6.169 -1.544 -0.240 1.00 13.15 O ATOM 5 CB ALA A 1 -6.873 1.545 -0.816 1.00 52.54 C ATOM 0 H1 ALA A 1 -9.350 -0.594 -0.571 1.00 72.20 H new ATOM 0 H2 ALA A 1 -8.116 -0.781 0.581 1.00 72.20 H new ATOM 0 H3 ALA A 1 -8.853 0.734 0.363 1.00 72.20 H new ATOM 0 HA ALA A 1 -8.028 0.297 -2.104 1.00 61.31 H new ATOM 0 HB1 ALA A 1 -6.133 1.782 -1.580 1.00 52.54 H new ATOM 0 HB2 ALA A 1 -7.633 2.326 -0.791 1.00 52.54 H new ATOM 0 HB3 ALA A 1 -6.384 1.484 0.156 1.00 52.54 H new ATOM 13 N SER A 2 -5.935 -1.087 -2.430 1.00 2.14 N ATOM 14 CA SER A 2 -4.934 -2.122 -2.651 1.00 15.02 C ATOM 15 C SER A 2 -3.577 -1.720 -2.068 1.00 50.51 C ATOM 16 O SER A 2 -2.646 -1.366 -2.793 1.00 4.42 O ATOM 17 CB SER A 2 -4.810 -2.427 -4.145 1.00 72.04 C ATOM 18 OG SER A 2 -6.059 -2.834 -4.687 1.00 24.45 O ATOM 0 H SER A 2 -6.171 -0.545 -3.261 1.00 2.14 H new ATOM 0 HA SER A 2 -5.261 -3.024 -2.133 1.00 15.02 H new ATOM 0 HB2 SER A 2 -4.452 -1.543 -4.672 1.00 72.04 H new ATOM 0 HB3 SER A 2 -4.069 -3.212 -4.299 1.00 72.04 H new ATOM 0 HG SER A 2 -5.955 -3.022 -5.643 1.00 24.45 H new ATOM 24 N LYS A 3 -3.500 -1.738 -0.747 1.00 71.50 N ATOM 25 CA LYS A 3 -2.252 -1.509 -0.032 1.00 71.30 C ATOM 26 C LYS A 3 -2.254 -2.354 1.235 1.00 64.13 C ATOM 27 O LYS A 3 -1.390 -2.221 2.099 1.00 21.31 O ATOM 28 CB LYS A 3 -2.098 -0.027 0.332 1.00 54.30 C ATOM 29 CG LYS A 3 -0.685 0.347 0.760 1.00 14.24 C ATOM 30 CD LYS A 3 -0.625 1.709 1.433 1.00 51.34 C ATOM 31 CE LYS A 3 -0.962 1.634 2.919 1.00 44.41 C ATOM 32 NZ LYS A 3 -2.399 1.343 3.173 1.00 24.24 N ATOM 0 H LYS A 3 -4.300 -1.912 -0.139 1.00 71.50 H new ATOM 0 HA LYS A 3 -1.415 -1.790 -0.671 1.00 71.30 H new ATOM 0 HB2 LYS A 3 -2.383 0.582 -0.526 1.00 54.30 H new ATOM 0 HB3 LYS A 3 -2.790 0.215 1.138 1.00 54.30 H new ATOM 0 HG2 LYS A 3 -0.303 -0.411 1.444 1.00 14.24 H new ATOM 0 HG3 LYS A 3 -0.032 0.347 -0.113 1.00 14.24 H new ATOM 0 HD2 LYS A 3 0.373 2.130 1.310 1.00 51.34 H new ATOM 0 HD3 LYS A 3 -1.320 2.387 0.939 1.00 51.34 H new ATOM 0 HE2 LYS A 3 -0.352 0.861 3.386 1.00 44.41 H new ATOM 0 HE3 LYS A 3 -0.698 2.579 3.394 1.00 44.41 H new ATOM 0 HZ1 LYS A 3 -2.646 1.631 4.141 1.00 24.24 H new ATOM 0 HZ2 LYS A 3 -2.985 1.871 2.495 1.00 24.24 H new ATOM 0 HZ3 LYS A 3 -2.572 0.324 3.060 1.00 24.24 H new ATOM 46 N SER A 4 -3.241 -3.228 1.327 1.00 51.41 N ATOM 47 CA SER A 4 -3.455 -4.027 2.515 1.00 72.55 C ATOM 48 C SER A 4 -2.508 -5.219 2.558 1.00 10.13 C ATOM 49 O SER A 4 -2.056 -5.706 1.518 1.00 1.31 O ATOM 50 CB SER A 4 -4.907 -4.494 2.539 1.00 12.41 C ATOM 51 OG SER A 4 -5.322 -4.907 1.246 1.00 61.32 O ATOM 0 H SER A 4 -3.914 -3.402 0.580 1.00 51.41 H new ATOM 0 HA SER A 4 -3.248 -3.418 3.395 1.00 72.55 H new ATOM 0 HB2 SER A 4 -5.017 -5.319 3.243 1.00 12.41 H new ATOM 0 HB3 SER A 4 -5.548 -3.686 2.892 1.00 12.41 H new ATOM 0 HG SER A 4 -6.255 -5.205 1.281 1.00 61.32 H new ATOM 57 N GLU A 5 -2.198 -5.670 3.763 1.00 12.45 N ATOM 58 CA GLU A 5 -1.383 -6.857 3.945 1.00 25.04 C ATOM 59 C GLU A 5 -2.236 -8.098 3.722 1.00 75.04 C ATOM 60 O GLU A 5 -2.633 -8.772 4.674 1.00 2.43 O ATOM 61 CB GLU A 5 -0.761 -6.899 5.347 1.00 41.24 C ATOM 62 CG GLU A 5 0.278 -5.817 5.619 1.00 30.45 C ATOM 63 CD GLU A 5 -0.303 -4.417 5.657 1.00 1.52 C ATOM 64 OE1 GLU A 5 -1.428 -4.244 6.176 1.00 73.04 O ATOM 65 OE2 GLU A 5 0.371 -3.481 5.183 1.00 3.40 O ATOM 0 H GLU A 5 -2.501 -5.229 4.632 1.00 12.45 H new ATOM 0 HA GLU A 5 -0.571 -6.829 3.218 1.00 25.04 H new ATOM 0 HB2 GLU A 5 -1.558 -6.811 6.085 1.00 41.24 H new ATOM 0 HB3 GLU A 5 -0.296 -7.874 5.494 1.00 41.24 H new ATOM 0 HG2 GLU A 5 0.767 -6.025 6.571 1.00 30.45 H new ATOM 0 HG3 GLU A 5 1.048 -5.862 4.849 1.00 30.45 H new ATOM 72 N SER A 6 -2.562 -8.355 2.466 1.00 13.04 N ATOM 73 CA SER A 6 -3.369 -9.503 2.104 1.00 12.23 C ATOM 74 C SER A 6 -2.580 -10.790 2.316 1.00 50.33 C ATOM 75 O SER A 6 -1.522 -10.982 1.709 1.00 62.13 O ATOM 76 CB SER A 6 -3.810 -9.384 0.645 1.00 51.42 C ATOM 77 OG SER A 6 -4.348 -8.096 0.381 1.00 41.32 O ATOM 0 H SER A 6 -2.276 -7.777 1.676 1.00 13.04 H new ATOM 0 HA SER A 6 -4.253 -9.532 2.740 1.00 12.23 H new ATOM 0 HB2 SER A 6 -2.960 -9.569 -0.012 1.00 51.42 H new ATOM 0 HB3 SER A 6 -4.556 -10.147 0.423 1.00 51.42 H new ATOM 0 HG SER A 6 -4.622 -8.042 -0.558 1.00 41.32 H new ATOM 83 N PRO A 7 -3.082 -11.678 3.191 1.00 53.31 N ATOM 84 CA PRO A 7 -2.424 -12.948 3.505 1.00 15.31 C ATOM 85 C PRO A 7 -2.147 -13.769 2.253 1.00 45.02 C ATOM 86 O PRO A 7 -2.996 -13.873 1.363 1.00 23.32 O ATOM 87 CB PRO A 7 -3.424 -13.672 4.418 1.00 54.32 C ATOM 88 CG PRO A 7 -4.711 -12.932 4.263 1.00 42.32 C ATOM 89 CD PRO A 7 -4.335 -11.517 3.938 1.00 0.03 C ATOM 0 HA PRO A 7 -1.451 -12.796 3.973 1.00 15.31 H new ATOM 0 HB2 PRO A 7 -3.535 -14.717 4.129 1.00 54.32 H new ATOM 0 HB3 PRO A 7 -3.088 -13.662 5.455 1.00 54.32 H new ATOM 0 HG2 PRO A 7 -5.318 -13.367 3.469 1.00 42.32 H new ATOM 0 HG3 PRO A 7 -5.301 -12.979 5.178 1.00 42.32 H new ATOM 0 HD2 PRO A 7 -5.101 -11.022 3.341 1.00 0.03 H new ATOM 0 HD3 PRO A 7 -4.195 -10.918 4.838 1.00 0.03 H new ATOM 97 N LYS A 8 -0.957 -14.344 2.183 1.00 72.21 N ATOM 98 CA LYS A 8 -0.539 -15.102 1.013 1.00 64.03 C ATOM 99 C LYS A 8 -1.061 -16.530 1.058 1.00 54.31 C ATOM 100 O LYS A 8 -0.295 -17.489 0.972 1.00 15.41 O ATOM 101 CB LYS A 8 0.987 -15.097 0.870 1.00 21.54 C ATOM 102 CG LYS A 8 1.539 -13.816 0.261 1.00 21.52 C ATOM 103 CD LYS A 8 1.344 -12.619 1.176 1.00 50.12 C ATOM 104 CE LYS A 8 1.498 -11.313 0.420 1.00 73.44 C ATOM 105 NZ LYS A 8 0.463 -11.161 -0.638 1.00 40.14 N ATOM 0 H LYS A 8 -0.260 -14.300 2.926 1.00 72.21 H new ATOM 0 HA LYS A 8 -0.970 -14.613 0.140 1.00 64.03 H new ATOM 0 HB2 LYS A 8 1.436 -15.245 1.852 1.00 21.54 H new ATOM 0 HB3 LYS A 8 1.288 -15.942 0.251 1.00 21.54 H new ATOM 0 HG2 LYS A 8 2.601 -13.943 0.052 1.00 21.52 H new ATOM 0 HG3 LYS A 8 1.047 -13.627 -0.693 1.00 21.52 H new ATOM 0 HD2 LYS A 8 0.354 -12.664 1.630 1.00 50.12 H new ATOM 0 HD3 LYS A 8 2.069 -12.658 1.989 1.00 50.12 H new ATOM 0 HE2 LYS A 8 1.429 -10.479 1.118 1.00 73.44 H new ATOM 0 HE3 LYS A 8 2.489 -11.269 -0.032 1.00 73.44 H new ATOM 0 HZ1 LYS A 8 0.376 -10.158 -0.897 1.00 40.14 H new ATOM 0 HZ2 LYS A 8 0.739 -11.712 -1.476 1.00 40.14 H new ATOM 0 HZ3 LYS A 8 -0.451 -11.507 -0.282 1.00 40.14 H new ATOM 119 N GLU A 9 -2.368 -16.665 1.208 1.00 41.41 N ATOM 120 CA GLU A 9 -3.007 -17.956 1.081 1.00 4.22 C ATOM 121 C GLU A 9 -3.525 -18.082 -0.342 1.00 40.13 C ATOM 122 O GLU A 9 -4.229 -17.192 -0.827 1.00 43.43 O ATOM 123 CB GLU A 9 -4.150 -18.109 2.085 1.00 23.23 C ATOM 124 CG GLU A 9 -4.661 -19.536 2.204 1.00 11.23 C ATOM 125 CD GLU A 9 -5.806 -19.669 3.182 1.00 73.15 C ATOM 126 OE1 GLU A 9 -5.586 -19.472 4.395 1.00 44.21 O ATOM 127 OE2 GLU A 9 -6.934 -19.970 2.744 1.00 60.13 O ATOM 0 H GLU A 9 -3.003 -15.895 1.418 1.00 41.41 H new ATOM 0 HA GLU A 9 -2.287 -18.746 1.295 1.00 4.22 H new ATOM 0 HB2 GLU A 9 -3.812 -17.769 3.064 1.00 23.23 H new ATOM 0 HB3 GLU A 9 -4.974 -17.459 1.789 1.00 23.23 H new ATOM 0 HG2 GLU A 9 -4.985 -19.884 1.223 1.00 11.23 H new ATOM 0 HG3 GLU A 9 -3.843 -20.185 2.518 1.00 11.23 H new ATOM 134 N PRO A 10 -3.158 -19.168 -1.038 1.00 63.43 N ATOM 135 CA PRO A 10 -3.470 -19.343 -2.454 1.00 53.41 C ATOM 136 C PRO A 10 -4.935 -19.093 -2.782 1.00 70.54 C ATOM 137 O PRO A 10 -5.833 -19.663 -2.162 1.00 15.44 O ATOM 138 CB PRO A 10 -3.125 -20.807 -2.731 1.00 60.04 C ATOM 139 CG PRO A 10 -2.151 -21.198 -1.675 1.00 31.55 C ATOM 140 CD PRO A 10 -2.413 -20.314 -0.484 1.00 75.23 C ATOM 0 HA PRO A 10 -2.915 -18.629 -3.062 1.00 53.41 H new ATOM 0 HB2 PRO A 10 -4.016 -21.433 -2.693 1.00 60.04 H new ATOM 0 HB3 PRO A 10 -2.694 -20.926 -3.725 1.00 60.04 H new ATOM 0 HG2 PRO A 10 -2.271 -22.248 -1.409 1.00 31.55 H new ATOM 0 HG3 PRO A 10 -1.128 -21.074 -2.029 1.00 31.55 H new ATOM 0 HD2 PRO A 10 -2.993 -20.835 0.278 1.00 75.23 H new ATOM 0 HD3 PRO A 10 -1.483 -19.994 -0.014 1.00 75.23 H new ATOM 148 N GLU A 11 -5.175 -18.238 -3.767 1.00 72.45 N ATOM 149 CA GLU A 11 -6.514 -18.076 -4.304 1.00 51.34 C ATOM 150 C GLU A 11 -6.897 -19.362 -5.020 1.00 2.22 C ATOM 151 O GLU A 11 -8.059 -19.613 -5.290 1.00 43.14 O ATOM 152 CB GLU A 11 -6.581 -16.895 -5.271 1.00 45.35 C ATOM 153 CG GLU A 11 -5.936 -17.185 -6.609 1.00 63.32 C ATOM 154 CD GLU A 11 -5.965 -16.002 -7.548 1.00 4.21 C ATOM 155 OE1 GLU A 11 -6.890 -15.924 -8.386 1.00 5.01 O ATOM 156 OE2 GLU A 11 -5.052 -15.154 -7.467 1.00 65.24 O ATOM 0 H GLU A 11 -4.465 -17.652 -4.206 1.00 72.45 H new ATOM 0 HA GLU A 11 -7.209 -17.872 -3.490 1.00 51.34 H new ATOM 0 HB2 GLU A 11 -7.624 -16.622 -5.429 1.00 45.35 H new ATOM 0 HB3 GLU A 11 -6.091 -16.034 -4.817 1.00 45.35 H new ATOM 0 HG2 GLU A 11 -4.902 -17.489 -6.449 1.00 63.32 H new ATOM 0 HG3 GLU A 11 -6.447 -18.026 -7.078 1.00 63.32 H new ATOM 163 N GLN A 12 -5.874 -20.159 -5.320 1.00 52.51 N ATOM 164 CA GLN A 12 -6.026 -21.483 -5.905 1.00 62.22 C ATOM 165 C GLN A 12 -7.057 -22.321 -5.149 1.00 63.24 C ATOM 166 O GLN A 12 -8.042 -22.768 -5.731 1.00 3.35 O ATOM 167 CB GLN A 12 -4.656 -22.173 -5.909 1.00 62.30 C ATOM 168 CG GLN A 12 -4.703 -23.689 -5.957 1.00 4.10 C ATOM 169 CD GLN A 12 -3.319 -24.302 -6.015 1.00 32.23 C ATOM 170 OE1 GLN A 12 -3.225 -25.493 -6.575 1.00 2.13 O flip ATOM 171 NE2 GLN A 12 -2.344 -23.719 -5.539 1.00 62.43 N flip ATOM 0 H GLN A 12 -4.902 -19.896 -5.160 1.00 52.51 H new ATOM 0 HA GLN A 12 -6.395 -21.382 -6.926 1.00 62.22 H new ATOM 0 HB2 GLN A 12 -4.088 -21.815 -6.767 1.00 62.30 H new ATOM 0 HB3 GLN A 12 -4.110 -21.869 -5.016 1.00 62.30 H new ATOM 0 HG2 GLN A 12 -5.228 -24.063 -5.078 1.00 4.10 H new ATOM 0 HG3 GLN A 12 -5.276 -24.006 -6.829 1.00 4.10 H new ATOM 0 HE21 GLN A 12 -2.457 -22.799 -5.114 1.00 62.43 H new ATOM 0 HE22 GLN A 12 -1.423 -24.157 -5.570 1.00 62.43 H new ATOM 180 N LEU A 13 -6.855 -22.504 -3.847 1.00 54.12 N ATOM 181 CA LEU A 13 -7.739 -23.369 -3.076 1.00 4.41 C ATOM 182 C LEU A 13 -9.003 -22.618 -2.663 1.00 21.14 C ATOM 183 O LEU A 13 -9.951 -23.212 -2.142 1.00 40.41 O ATOM 184 CB LEU A 13 -7.023 -23.943 -1.843 1.00 72.33 C ATOM 185 CG LEU A 13 -7.244 -23.191 -0.529 1.00 12.11 C ATOM 186 CD1 LEU A 13 -7.115 -24.143 0.647 1.00 1.13 C ATOM 187 CD2 LEU A 13 -6.255 -22.049 -0.388 1.00 32.15 C ATOM 0 H LEU A 13 -6.101 -22.073 -3.312 1.00 54.12 H new ATOM 0 HA LEU A 13 -8.026 -24.205 -3.714 1.00 4.41 H new ATOM 0 HB2 LEU A 13 -7.347 -24.975 -1.707 1.00 72.33 H new ATOM 0 HB3 LEU A 13 -5.953 -23.969 -2.048 1.00 72.33 H new ATOM 0 HG LEU A 13 -8.251 -22.773 -0.539 1.00 12.11 H new ATOM 0 HD11 LEU A 13 -7.274 -23.597 1.577 1.00 1.13 H new ATOM 0 HD12 LEU A 13 -7.860 -24.934 0.559 1.00 1.13 H new ATOM 0 HD13 LEU A 13 -6.118 -24.583 0.651 1.00 1.13 H new ATOM 0 HD21 LEU A 13 -6.431 -21.529 0.554 1.00 32.15 H new ATOM 0 HD22 LEU A 13 -5.239 -22.444 -0.400 1.00 32.15 H new ATOM 0 HD23 LEU A 13 -6.383 -21.352 -1.217 1.00 32.15 H new ATOM 199 N ARG A 14 -9.013 -21.311 -2.900 1.00 33.41 N ATOM 200 CA ARG A 14 -10.179 -20.490 -2.607 1.00 74.03 C ATOM 201 C ARG A 14 -10.982 -20.243 -3.879 1.00 22.11 C ATOM 202 O ARG A 14 -12.016 -19.575 -3.858 1.00 3.22 O ATOM 203 CB ARG A 14 -9.771 -19.152 -1.982 1.00 33.10 C ATOM 204 CG ARG A 14 -9.050 -19.296 -0.653 1.00 22.50 C ATOM 205 CD ARG A 14 -8.965 -17.970 0.087 1.00 63.55 C ATOM 206 NE ARG A 14 -8.428 -18.139 1.435 1.00 53.40 N ATOM 207 CZ ARG A 14 -8.785 -17.408 2.490 1.00 45.32 C ATOM 208 NH1 ARG A 14 -9.672 -16.430 2.372 1.00 1.15 N ATOM 209 NH2 ARG A 14 -8.257 -17.667 3.675 1.00 34.11 N ATOM 0 H ARG A 14 -8.225 -20.798 -3.295 1.00 33.41 H new ATOM 0 HA ARG A 14 -10.797 -21.029 -1.889 1.00 74.03 H new ATOM 0 HB2 ARG A 14 -9.127 -18.616 -2.679 1.00 33.10 H new ATOM 0 HB3 ARG A 14 -10.662 -18.541 -1.838 1.00 33.10 H new ATOM 0 HG2 ARG A 14 -9.571 -20.026 -0.033 1.00 22.50 H new ATOM 0 HG3 ARG A 14 -8.045 -19.682 -0.824 1.00 22.50 H new ATOM 0 HD2 ARG A 14 -8.333 -17.280 -0.473 1.00 63.55 H new ATOM 0 HD3 ARG A 14 -9.956 -17.520 0.144 1.00 63.55 H new ATOM 0 HE ARG A 14 -7.730 -18.869 1.579 1.00 53.40 H new ATOM 0 HH11 ARG A 14 -10.091 -16.229 1.464 1.00 1.15 H new ATOM 0 HH12 ARG A 14 -9.935 -15.879 3.189 1.00 1.15 H new ATOM 0 HH21 ARG A 14 -7.580 -18.423 3.777 1.00 34.11 H new ATOM 0 HH22 ARG A 14 -8.527 -17.110 4.486 1.00 34.11 H new ATOM 223 N LYS A 15 -10.489 -20.776 -4.987 1.00 20.44 N ATOM 224 CA LYS A 15 -11.152 -20.620 -6.267 1.00 25.22 C ATOM 225 C LYS A 15 -11.829 -21.919 -6.669 1.00 71.21 C ATOM 226 O LYS A 15 -11.295 -23.008 -6.455 1.00 44.32 O ATOM 227 CB LYS A 15 -10.145 -20.208 -7.346 1.00 14.33 C ATOM 228 CG LYS A 15 -10.785 -19.752 -8.650 1.00 52.24 C ATOM 229 CD LYS A 15 -9.752 -19.585 -9.757 1.00 14.41 C ATOM 230 CE LYS A 15 -8.607 -18.673 -9.342 1.00 14.14 C ATOM 231 NZ LYS A 15 -9.043 -17.266 -9.122 1.00 14.13 N ATOM 0 H LYS A 15 -9.628 -21.322 -5.022 1.00 20.44 H new ATOM 0 HA LYS A 15 -11.905 -19.838 -6.170 1.00 25.22 H new ATOM 0 HB2 LYS A 15 -9.522 -19.402 -6.958 1.00 14.33 H new ATOM 0 HB3 LYS A 15 -9.485 -21.050 -7.553 1.00 14.33 H new ATOM 0 HG2 LYS A 15 -11.536 -20.478 -8.960 1.00 52.24 H new ATOM 0 HG3 LYS A 15 -11.303 -18.806 -8.490 1.00 52.24 H new ATOM 0 HD2 LYS A 15 -9.355 -20.562 -10.031 1.00 14.41 H new ATOM 0 HD3 LYS A 15 -10.236 -19.177 -10.645 1.00 14.41 H new ATOM 0 HE2 LYS A 15 -8.156 -19.057 -8.427 1.00 14.14 H new ATOM 0 HE3 LYS A 15 -7.835 -18.694 -10.111 1.00 14.14 H new ATOM 0 HZ1 LYS A 15 -8.342 -16.773 -8.533 1.00 14.13 H new ATOM 0 HZ2 LYS A 15 -9.127 -16.781 -10.038 1.00 14.13 H new ATOM 0 HZ3 LYS A 15 -9.965 -17.259 -8.641 1.00 14.13 H new ATOM 245 N LEU A 16 -13.011 -21.794 -7.225 1.00 24.02 N ATOM 246 CA LEU A 16 -13.737 -22.930 -7.743 1.00 41.31 C ATOM 247 C LEU A 16 -13.613 -22.999 -9.261 1.00 62.33 C ATOM 248 O LEU A 16 -13.799 -21.998 -9.959 1.00 71.51 O ATOM 249 CB LEU A 16 -15.205 -22.833 -7.331 1.00 55.43 C ATOM 250 CG LEU A 16 -15.611 -23.694 -6.135 1.00 44.51 C ATOM 251 CD1 LEU A 16 -17.105 -23.600 -5.893 1.00 42.33 C ATOM 252 CD2 LEU A 16 -15.204 -25.139 -6.346 1.00 53.43 C ATOM 0 H LEU A 16 -13.496 -20.903 -7.331 1.00 24.02 H new ATOM 0 HA LEU A 16 -13.310 -23.842 -7.327 1.00 41.31 H new ATOM 0 HB2 LEU A 16 -15.432 -21.792 -7.101 1.00 55.43 H new ATOM 0 HB3 LEU A 16 -15.823 -23.113 -8.184 1.00 55.43 H new ATOM 0 HG LEU A 16 -15.090 -23.315 -5.255 1.00 44.51 H new ATOM 0 HD11 LEU A 16 -17.375 -24.220 -5.038 1.00 42.33 H new ATOM 0 HD12 LEU A 16 -17.376 -22.564 -5.690 1.00 42.33 H new ATOM 0 HD13 LEU A 16 -17.639 -23.949 -6.777 1.00 42.33 H new ATOM 0 HD21 LEU A 16 -15.504 -25.731 -5.482 1.00 53.43 H new ATOM 0 HD22 LEU A 16 -15.693 -25.528 -7.239 1.00 53.43 H new ATOM 0 HD23 LEU A 16 -14.123 -25.198 -6.469 1.00 53.43 H new ATOM 264 N PHE A 17 -13.271 -24.177 -9.753 1.00 62.45 N ATOM 265 CA PHE A 17 -13.193 -24.431 -11.182 1.00 34.44 C ATOM 266 C PHE A 17 -14.530 -24.953 -11.676 1.00 12.42 C ATOM 267 O PHE A 17 -14.998 -26.000 -11.225 1.00 14.20 O ATOM 268 CB PHE A 17 -12.088 -25.448 -11.486 1.00 72.32 C ATOM 269 CG PHE A 17 -11.990 -25.830 -12.940 1.00 62.33 C ATOM 270 CD1 PHE A 17 -11.958 -27.162 -13.319 1.00 2.41 C ATOM 271 CD2 PHE A 17 -11.931 -24.859 -13.927 1.00 12.32 C ATOM 272 CE1 PHE A 17 -11.868 -27.516 -14.651 1.00 13.11 C ATOM 273 CE2 PHE A 17 -11.841 -25.207 -15.261 1.00 4.14 C ATOM 274 CZ PHE A 17 -11.808 -26.537 -15.623 1.00 21.21 C ATOM 0 H PHE A 17 -13.040 -24.984 -9.174 1.00 62.45 H new ATOM 0 HA PHE A 17 -12.954 -23.500 -11.696 1.00 34.44 H new ATOM 0 HB2 PHE A 17 -11.131 -25.037 -11.164 1.00 72.32 H new ATOM 0 HB3 PHE A 17 -12.264 -26.347 -10.896 1.00 72.32 H new ATOM 0 HD1 PHE A 17 -12.004 -27.933 -12.564 1.00 2.41 H new ATOM 0 HD2 PHE A 17 -11.956 -23.816 -13.649 1.00 12.32 H new ATOM 0 HE1 PHE A 17 -11.845 -28.558 -14.932 1.00 13.11 H new ATOM 0 HE2 PHE A 17 -11.797 -24.439 -16.019 1.00 4.14 H new ATOM 0 HZ PHE A 17 -11.735 -26.813 -16.665 1.00 21.21 H new ATOM 284 N ILE A 18 -15.148 -24.215 -12.583 1.00 50.44 N ATOM 285 CA ILE A 18 -16.461 -24.574 -13.086 1.00 22.23 C ATOM 286 C ILE A 18 -16.364 -25.042 -14.522 1.00 12.32 C ATOM 287 O ILE A 18 -16.306 -24.228 -15.440 1.00 3.42 O ATOM 288 CB ILE A 18 -17.441 -23.384 -13.017 1.00 34.02 C ATOM 289 CG1 ILE A 18 -17.360 -22.704 -11.652 1.00 44.35 C ATOM 290 CG2 ILE A 18 -18.862 -23.843 -13.301 1.00 54.24 C ATOM 291 CD1 ILE A 18 -17.482 -23.659 -10.485 1.00 32.33 C ATOM 0 H ILE A 18 -14.760 -23.362 -12.986 1.00 50.44 H new ATOM 0 HA ILE A 18 -16.839 -25.378 -12.454 1.00 22.23 H new ATOM 0 HB ILE A 18 -17.157 -22.660 -13.781 1.00 34.02 H new ATOM 0 HG12 ILE A 18 -16.411 -22.173 -11.577 1.00 44.35 H new ATOM 0 HG13 ILE A 18 -18.150 -21.956 -11.582 1.00 44.35 H new ATOM 0 HG21 ILE A 18 -19.538 -22.989 -13.248 1.00 54.24 H new ATOM 0 HG22 ILE A 18 -18.910 -24.282 -14.297 1.00 54.24 H new ATOM 0 HG23 ILE A 18 -19.159 -24.587 -12.562 1.00 54.24 H new ATOM 0 HD11 ILE A 18 -17.415 -23.102 -9.550 1.00 32.33 H new ATOM 0 HD12 ILE A 18 -18.442 -24.172 -10.534 1.00 32.33 H new ATOM 0 HD13 ILE A 18 -16.676 -24.392 -10.529 1.00 32.33 H new ATOM 303 N GLY A 19 -16.339 -26.345 -14.716 1.00 32.10 N ATOM 304 CA GLY A 19 -16.212 -26.878 -16.052 1.00 1.25 C ATOM 305 C GLY A 19 -17.481 -27.546 -16.525 1.00 24.13 C ATOM 306 O GLY A 19 -18.213 -28.135 -15.727 1.00 23.13 O ATOM 0 H GLY A 19 -16.404 -27.044 -13.976 1.00 32.10 H new ATOM 0 HA2 GLY A 19 -15.950 -26.073 -16.739 1.00 1.25 H new ATOM 0 HA3 GLY A 19 -15.394 -27.598 -16.078 1.00 1.25 H new ATOM 310 N GLY A 20 -17.750 -27.441 -17.818 1.00 71.53 N ATOM 311 CA GLY A 20 -18.909 -28.092 -18.390 1.00 40.00 C ATOM 312 C GLY A 20 -20.148 -27.227 -18.323 1.00 72.12 C ATOM 313 O GLY A 20 -21.248 -27.726 -18.083 1.00 11.24 O ATOM 0 H GLY A 20 -17.184 -26.914 -18.483 1.00 71.53 H new ATOM 0 HA2 GLY A 20 -18.703 -28.347 -19.430 1.00 40.00 H new ATOM 0 HA3 GLY A 20 -19.094 -29.028 -17.863 1.00 40.00 H new ATOM 317 N LEU A 21 -19.973 -25.928 -18.525 1.00 10.23 N ATOM 318 CA LEU A 21 -21.101 -25.009 -18.531 1.00 41.23 C ATOM 319 C LEU A 21 -21.462 -24.605 -19.955 1.00 44.54 C ATOM 320 O LEU A 21 -20.721 -24.889 -20.899 1.00 72.40 O ATOM 321 CB LEU A 21 -20.823 -23.779 -17.649 1.00 53.01 C ATOM 322 CG LEU A 21 -19.465 -23.090 -17.834 1.00 74.51 C ATOM 323 CD1 LEU A 21 -19.435 -22.252 -19.101 1.00 12.33 C ATOM 324 CD2 LEU A 21 -19.151 -22.230 -16.622 1.00 72.12 C ATOM 0 H LEU A 21 -19.066 -25.490 -18.686 1.00 10.23 H new ATOM 0 HA LEU A 21 -21.960 -25.526 -18.104 1.00 41.23 H new ATOM 0 HB2 LEU A 21 -21.606 -23.043 -17.835 1.00 53.01 H new ATOM 0 HB3 LEU A 21 -20.911 -24.082 -16.606 1.00 53.01 H new ATOM 0 HG LEU A 21 -18.703 -23.863 -17.932 1.00 74.51 H new ATOM 0 HD11 LEU A 21 -18.458 -21.778 -19.201 1.00 12.33 H new ATOM 0 HD12 LEU A 21 -19.618 -22.891 -19.965 1.00 12.33 H new ATOM 0 HD13 LEU A 21 -20.207 -21.484 -19.048 1.00 12.33 H new ATOM 0 HD21 LEU A 21 -18.185 -21.744 -16.761 1.00 72.12 H new ATOM 0 HD22 LEU A 21 -19.925 -21.472 -16.504 1.00 72.12 H new ATOM 0 HD23 LEU A 21 -19.117 -22.856 -15.730 1.00 72.12 H new ATOM 336 N SER A 22 -22.599 -23.945 -20.099 1.00 34.54 N ATOM 337 CA SER A 22 -23.117 -23.594 -21.407 1.00 34.34 C ATOM 338 C SER A 22 -22.329 -22.437 -22.020 1.00 50.02 C ATOM 339 O SER A 22 -21.639 -21.698 -21.316 1.00 1.30 O ATOM 340 CB SER A 22 -24.591 -23.215 -21.289 1.00 53.25 C ATOM 341 OG SER A 22 -25.329 -24.231 -20.630 1.00 60.22 O ATOM 0 H SER A 22 -23.183 -23.641 -19.320 1.00 34.54 H new ATOM 0 HA SER A 22 -23.012 -24.459 -22.062 1.00 34.34 H new ATOM 0 HB2 SER A 22 -24.686 -22.278 -20.740 1.00 53.25 H new ATOM 0 HB3 SER A 22 -25.007 -23.046 -22.282 1.00 53.25 H new ATOM 0 HG SER A 22 -26.269 -23.963 -20.566 1.00 60.22 H new ATOM 347 N PHE A 23 -22.455 -22.259 -23.326 1.00 64.32 N ATOM 348 CA PHE A 23 -21.761 -21.178 -24.014 1.00 55.54 C ATOM 349 C PHE A 23 -22.556 -19.884 -23.909 1.00 11.04 C ATOM 350 O PHE A 23 -22.233 -18.879 -24.546 1.00 1.44 O ATOM 351 CB PHE A 23 -21.507 -21.548 -25.474 1.00 2.34 C ATOM 352 CG PHE A 23 -20.636 -22.759 -25.620 1.00 30.14 C ATOM 353 CD1 PHE A 23 -21.180 -23.977 -25.984 1.00 40.43 C ATOM 354 CD2 PHE A 23 -19.275 -22.682 -25.373 1.00 72.35 C ATOM 355 CE1 PHE A 23 -20.383 -25.098 -26.102 1.00 72.12 C ATOM 356 CE2 PHE A 23 -18.472 -23.798 -25.489 1.00 12.52 C ATOM 357 CZ PHE A 23 -19.026 -25.009 -25.854 1.00 32.41 C ATOM 0 H PHE A 23 -23.029 -22.846 -23.931 1.00 64.32 H new ATOM 0 HA PHE A 23 -20.795 -21.022 -23.533 1.00 55.54 H new ATOM 0 HB2 PHE A 23 -22.461 -21.729 -25.970 1.00 2.34 H new ATOM 0 HB3 PHE A 23 -21.039 -20.705 -25.982 1.00 2.34 H new ATOM 0 HD1 PHE A 23 -22.240 -24.052 -26.178 1.00 40.43 H new ATOM 0 HD2 PHE A 23 -18.837 -21.737 -25.086 1.00 72.35 H new ATOM 0 HE1 PHE A 23 -20.819 -26.044 -26.388 1.00 72.12 H new ATOM 0 HE2 PHE A 23 -17.412 -23.725 -25.295 1.00 12.52 H new ATOM 0 HZ PHE A 23 -18.401 -25.885 -25.946 1.00 32.41 H new ATOM 367 N GLU A 24 -23.595 -19.923 -23.091 1.00 65.11 N ATOM 368 CA GLU A 24 -24.403 -18.753 -22.810 1.00 64.42 C ATOM 369 C GLU A 24 -24.094 -18.247 -21.408 1.00 14.31 C ATOM 370 O GLU A 24 -24.552 -17.180 -21.002 1.00 53.14 O ATOM 371 CB GLU A 24 -25.887 -19.097 -22.941 1.00 33.53 C ATOM 372 CG GLU A 24 -26.211 -19.886 -24.199 1.00 13.15 C ATOM 373 CD GLU A 24 -27.699 -20.021 -24.440 1.00 31.51 C ATOM 374 OE1 GLU A 24 -28.277 -19.131 -25.096 1.00 45.41 O ATOM 375 OE2 GLU A 24 -28.296 -21.021 -23.989 1.00 1.10 O ATOM 0 H GLU A 24 -23.900 -20.766 -22.605 1.00 65.11 H new ATOM 0 HA GLU A 24 -24.167 -17.968 -23.529 1.00 64.42 H new ATOM 0 HB2 GLU A 24 -26.198 -19.672 -22.069 1.00 33.53 H new ATOM 0 HB3 GLU A 24 -26.468 -18.175 -22.939 1.00 33.53 H new ATOM 0 HG2 GLU A 24 -25.751 -19.397 -25.058 1.00 13.15 H new ATOM 0 HG3 GLU A 24 -25.768 -20.879 -24.124 1.00 13.15 H new ATOM 382 N THR A 25 -23.307 -19.031 -20.677 1.00 2.24 N ATOM 383 CA THR A 25 -22.890 -18.672 -19.333 1.00 60.22 C ATOM 384 C THR A 25 -21.904 -17.509 -19.378 1.00 3.23 C ATOM 385 O THR A 25 -20.829 -17.613 -19.970 1.00 44.30 O ATOM 386 CB THR A 25 -22.240 -19.875 -18.623 1.00 3.31 C ATOM 387 OG1 THR A 25 -23.107 -21.015 -18.722 1.00 40.10 O ATOM 388 CG2 THR A 25 -21.977 -19.562 -17.156 1.00 3.35 C ATOM 0 H THR A 25 -22.944 -19.928 -21.001 1.00 2.24 H new ATOM 0 HA THR A 25 -23.775 -18.371 -18.773 1.00 60.22 H new ATOM 0 HB THR A 25 -21.287 -20.090 -19.107 1.00 3.31 H new ATOM 0 HG1 THR A 25 -22.924 -21.493 -19.558 1.00 40.10 H new ATOM 0 HG21 THR A 25 -21.518 -20.426 -16.676 1.00 3.35 H new ATOM 0 HG22 THR A 25 -21.306 -18.706 -17.081 1.00 3.35 H new ATOM 0 HG23 THR A 25 -22.919 -19.329 -16.659 1.00 3.35 H new ATOM 396 N THR A 26 -22.286 -16.398 -18.770 1.00 74.04 N ATOM 397 CA THR A 26 -21.462 -15.207 -18.768 1.00 24.40 C ATOM 398 C THR A 26 -21.099 -14.819 -17.344 1.00 12.12 C ATOM 399 O THR A 26 -21.703 -15.303 -16.395 1.00 72.13 O ATOM 400 CB THR A 26 -22.160 -14.047 -19.520 1.00 2.22 C ATOM 401 OG1 THR A 26 -21.369 -12.854 -19.457 1.00 64.00 O ATOM 402 CG2 THR A 26 -23.551 -13.783 -18.969 1.00 33.40 C ATOM 0 H THR A 26 -23.169 -16.299 -18.269 1.00 74.04 H new ATOM 0 HA THR A 26 -20.536 -15.423 -19.301 1.00 24.40 H new ATOM 0 HB THR A 26 -22.262 -14.348 -20.563 1.00 2.22 H new ATOM 0 HG1 THR A 26 -21.825 -12.133 -19.939 1.00 64.00 H new ATOM 0 HG21 THR A 26 -24.011 -12.963 -19.520 1.00 33.40 H new ATOM 0 HG22 THR A 26 -24.161 -14.680 -19.076 1.00 33.40 H new ATOM 0 HG23 THR A 26 -23.480 -13.517 -17.914 1.00 33.40 H new ATOM 410 N ASP A 27 -20.094 -13.962 -17.209 1.00 75.10 N ATOM 411 CA ASP A 27 -19.526 -13.611 -15.909 1.00 22.41 C ATOM 412 C ASP A 27 -20.604 -13.165 -14.931 1.00 13.00 C ATOM 413 O ASP A 27 -20.627 -13.594 -13.773 1.00 42.35 O ATOM 414 CB ASP A 27 -18.494 -12.493 -16.066 1.00 1.53 C ATOM 415 CG ASP A 27 -17.359 -12.849 -17.004 1.00 54.51 C ATOM 416 OD1 ASP A 27 -17.520 -12.682 -18.232 1.00 14.41 O ATOM 417 OD2 ASP A 27 -16.291 -13.276 -16.521 1.00 21.43 O ATOM 0 H ASP A 27 -19.649 -13.490 -17.996 1.00 75.10 H new ATOM 0 HA ASP A 27 -19.045 -14.504 -15.510 1.00 22.41 H new ATOM 0 HB2 ASP A 27 -18.993 -11.597 -16.435 1.00 1.53 H new ATOM 0 HB3 ASP A 27 -18.083 -12.248 -15.087 1.00 1.53 H new ATOM 422 N GLU A 28 -21.504 -12.315 -15.409 1.00 0.23 N ATOM 423 CA GLU A 28 -22.568 -11.772 -14.579 1.00 44.04 C ATOM 424 C GLU A 28 -23.511 -12.861 -14.080 1.00 3.31 C ATOM 425 O GLU A 28 -23.944 -12.826 -12.928 1.00 74.13 O ATOM 426 CB GLU A 28 -23.352 -10.699 -15.345 1.00 24.43 C ATOM 427 CG GLU A 28 -23.987 -11.203 -16.631 1.00 65.01 C ATOM 428 CD GLU A 28 -24.766 -10.133 -17.364 1.00 70.32 C ATOM 429 OE1 GLU A 28 -24.173 -9.439 -18.218 1.00 43.42 O ATOM 430 OE2 GLU A 28 -25.975 -9.986 -17.102 1.00 60.33 O ATOM 0 H GLU A 28 -21.516 -11.986 -16.374 1.00 0.23 H new ATOM 0 HA GLU A 28 -22.100 -11.316 -13.706 1.00 44.04 H new ATOM 0 HB2 GLU A 28 -24.133 -10.301 -14.697 1.00 24.43 H new ATOM 0 HB3 GLU A 28 -22.682 -9.872 -15.581 1.00 24.43 H new ATOM 0 HG2 GLU A 28 -23.208 -11.591 -17.287 1.00 65.01 H new ATOM 0 HG3 GLU A 28 -24.652 -12.035 -16.400 1.00 65.01 H new ATOM 437 N SER A 29 -23.813 -13.840 -14.923 1.00 4.45 N ATOM 438 CA SER A 29 -24.730 -14.894 -14.529 1.00 14.32 C ATOM 439 C SER A 29 -23.986 -15.970 -13.756 1.00 51.42 C ATOM 440 O SER A 29 -24.548 -16.636 -12.889 1.00 11.15 O ATOM 441 CB SER A 29 -25.428 -15.484 -15.751 1.00 41.33 C ATOM 442 OG SER A 29 -24.495 -15.851 -16.749 1.00 4.41 O ATOM 0 H SER A 29 -23.441 -13.924 -15.869 1.00 4.45 H new ATOM 0 HA SER A 29 -25.495 -14.469 -13.879 1.00 14.32 H new ATOM 0 HB2 SER A 29 -26.009 -16.357 -15.454 1.00 41.33 H new ATOM 0 HB3 SER A 29 -26.131 -14.757 -16.157 1.00 41.33 H new ATOM 0 HG SER A 29 -23.585 -15.737 -16.404 1.00 4.41 H new ATOM 448 N LEU A 30 -22.703 -16.105 -14.057 1.00 74.44 N ATOM 449 CA LEU A 30 -21.851 -17.064 -13.376 1.00 63.41 C ATOM 450 C LEU A 30 -21.751 -16.676 -11.911 1.00 71.14 C ATOM 451 O LEU A 30 -22.049 -17.472 -11.021 1.00 24.33 O ATOM 452 CB LEU A 30 -20.459 -17.098 -14.033 1.00 44.15 C ATOM 453 CG LEU A 30 -19.532 -18.265 -13.642 1.00 55.31 C ATOM 454 CD1 LEU A 30 -18.962 -18.086 -12.242 1.00 51.41 C ATOM 455 CD2 LEU A 30 -20.269 -19.591 -13.749 1.00 11.41 C ATOM 0 H LEU A 30 -22.228 -15.557 -14.774 1.00 74.44 H new ATOM 0 HA LEU A 30 -22.280 -18.063 -13.453 1.00 63.41 H new ATOM 0 HB2 LEU A 30 -20.595 -17.120 -15.114 1.00 44.15 H new ATOM 0 HB3 LEU A 30 -19.949 -16.165 -13.795 1.00 44.15 H new ATOM 0 HG LEU A 30 -18.696 -18.269 -14.342 1.00 55.31 H new ATOM 0 HD11 LEU A 30 -18.314 -18.929 -12.003 1.00 51.41 H new ATOM 0 HD12 LEU A 30 -18.386 -17.161 -12.199 1.00 51.41 H new ATOM 0 HD13 LEU A 30 -19.778 -18.039 -11.520 1.00 51.41 H new ATOM 0 HD21 LEU A 30 -19.599 -20.404 -13.469 1.00 11.41 H new ATOM 0 HD22 LEU A 30 -21.130 -19.584 -13.080 1.00 11.41 H new ATOM 0 HD23 LEU A 30 -20.608 -19.737 -14.775 1.00 11.41 H new ATOM 467 N ARG A 31 -21.369 -15.432 -11.664 1.00 2.12 N ATOM 468 CA ARG A 31 -21.207 -14.968 -10.305 1.00 64.24 C ATOM 469 C ARG A 31 -22.559 -14.923 -9.602 1.00 33.33 C ATOM 470 O ARG A 31 -22.657 -15.260 -8.435 1.00 75.40 O ATOM 471 CB ARG A 31 -20.507 -13.600 -10.260 1.00 22.31 C ATOM 472 CG ARG A 31 -21.434 -12.397 -10.308 1.00 23.14 C ATOM 473 CD ARG A 31 -20.643 -11.100 -10.335 1.00 53.42 C ATOM 474 NE ARG A 31 -21.504 -9.924 -10.430 1.00 0.03 N ATOM 475 CZ ARG A 31 -21.321 -8.806 -9.727 1.00 14.23 C ATOM 476 NH1 ARG A 31 -20.372 -8.744 -8.800 1.00 30.21 N ATOM 477 NH2 ARG A 31 -22.102 -7.756 -9.939 1.00 31.31 N ATOM 0 H ARG A 31 -21.168 -14.736 -12.382 1.00 2.12 H new ATOM 0 HA ARG A 31 -20.567 -15.673 -9.775 1.00 64.24 H new ATOM 0 HB2 ARG A 31 -19.912 -13.544 -9.348 1.00 22.31 H new ATOM 0 HB3 ARG A 31 -19.813 -13.537 -11.098 1.00 22.31 H new ATOM 0 HG2 ARG A 31 -22.069 -12.458 -11.192 1.00 23.14 H new ATOM 0 HG3 ARG A 31 -22.093 -12.407 -9.440 1.00 23.14 H new ATOM 0 HD2 ARG A 31 -20.035 -11.030 -9.433 1.00 53.42 H new ATOM 0 HD3 ARG A 31 -19.957 -11.114 -11.182 1.00 53.42 H new ATOM 0 HE ARG A 31 -22.294 -9.960 -11.074 1.00 0.03 H new ATOM 0 HH11 ARG A 31 -19.778 -9.554 -8.623 1.00 30.21 H new ATOM 0 HH12 ARG A 31 -20.237 -7.886 -8.265 1.00 30.21 H new ATOM 0 HH21 ARG A 31 -22.842 -7.804 -10.639 1.00 31.31 H new ATOM 0 HH22 ARG A 31 -21.963 -6.900 -9.402 1.00 31.31 H new ATOM 491 N SER A 32 -23.609 -14.571 -10.333 1.00 40.21 N ATOM 492 CA SER A 32 -24.936 -14.448 -9.742 1.00 55.34 C ATOM 493 C SER A 32 -25.441 -15.802 -9.231 1.00 62.11 C ATOM 494 O SER A 32 -26.167 -15.867 -8.238 1.00 64.42 O ATOM 495 CB SER A 32 -25.917 -13.861 -10.763 1.00 33.21 C ATOM 496 OG SER A 32 -27.152 -13.511 -10.160 1.00 24.55 O ATOM 0 H SER A 32 -23.569 -14.366 -11.331 1.00 40.21 H new ATOM 0 HA SER A 32 -24.868 -13.772 -8.889 1.00 55.34 H new ATOM 0 HB2 SER A 32 -25.475 -12.979 -11.227 1.00 33.21 H new ATOM 0 HB3 SER A 32 -26.092 -14.586 -11.558 1.00 33.21 H new ATOM 0 HG SER A 32 -27.753 -13.139 -10.838 1.00 24.55 H new ATOM 502 N HIS A 33 -25.046 -16.880 -9.898 1.00 72.23 N ATOM 503 CA HIS A 33 -25.472 -18.215 -9.499 1.00 32.15 C ATOM 504 C HIS A 33 -24.487 -18.851 -8.522 1.00 13.32 C ATOM 505 O HIS A 33 -24.746 -19.923 -7.989 1.00 11.14 O ATOM 506 CB HIS A 33 -25.668 -19.117 -10.725 1.00 54.41 C ATOM 507 CG HIS A 33 -26.929 -18.821 -11.482 1.00 61.05 C ATOM 508 ND1 HIS A 33 -27.259 -17.735 -12.219 1.00 21.12 N flip ATOM 509 CD2 HIS A 33 -27.985 -19.702 -11.489 1.00 41.21 C flip ATOM 510 CE1 HIS A 33 -28.531 -17.939 -12.687 1.00 73.44 C flip ATOM 511 NE2 HIS A 33 -28.925 -19.132 -12.223 1.00 33.30 N flip ATOM 0 H HIS A 33 -24.434 -16.856 -10.714 1.00 72.23 H new ATOM 0 HA HIS A 33 -26.429 -18.111 -8.988 1.00 32.15 H new ATOM 0 HB2 HIS A 33 -24.815 -19.001 -11.394 1.00 54.41 H new ATOM 0 HB3 HIS A 33 -25.681 -20.158 -10.403 1.00 54.41 H new ATOM 0 HD1 HIS A 33 -26.672 -16.919 -12.393 1.00 21.12 H new ATOM 0 HD2 HIS A 33 -28.036 -20.662 -10.996 1.00 41.21 H new ATOM 0 HE1 HIS A 33 -29.104 -17.268 -13.309 1.00 73.44 H new ATOM 519 N PHE A 34 -23.360 -18.194 -8.282 1.00 31.31 N ATOM 520 CA PHE A 34 -22.389 -18.709 -7.323 1.00 5.15 C ATOM 521 C PHE A 34 -22.295 -17.832 -6.074 1.00 34.50 C ATOM 522 O PHE A 34 -21.884 -18.302 -5.016 1.00 62.44 O ATOM 523 CB PHE A 34 -21.015 -18.880 -7.971 1.00 41.43 C ATOM 524 CG PHE A 34 -20.886 -20.160 -8.750 1.00 34.24 C ATOM 525 CD1 PHE A 34 -20.354 -21.292 -8.153 1.00 14.24 C ATOM 526 CD2 PHE A 34 -21.304 -20.236 -10.067 1.00 12.43 C ATOM 527 CE1 PHE A 34 -20.238 -22.474 -8.858 1.00 40.32 C ATOM 528 CE2 PHE A 34 -21.190 -21.415 -10.779 1.00 33.32 C ATOM 529 CZ PHE A 34 -20.658 -22.536 -10.174 1.00 55.14 C ATOM 0 H PHE A 34 -23.097 -17.316 -8.730 1.00 31.31 H new ATOM 0 HA PHE A 34 -22.743 -19.689 -7.005 1.00 5.15 H new ATOM 0 HB2 PHE A 34 -20.825 -18.037 -8.635 1.00 41.43 H new ATOM 0 HB3 PHE A 34 -20.249 -18.854 -7.196 1.00 41.43 H new ATOM 0 HD1 PHE A 34 -20.026 -21.249 -7.125 1.00 14.24 H new ATOM 0 HD2 PHE A 34 -21.724 -19.363 -10.544 1.00 12.43 H new ATOM 0 HE1 PHE A 34 -19.820 -23.349 -8.382 1.00 40.32 H new ATOM 0 HE2 PHE A 34 -21.517 -21.459 -11.807 1.00 33.32 H new ATOM 0 HZ PHE A 34 -20.570 -23.459 -10.727 1.00 55.14 H new ATOM 539 N GLU A 35 -22.710 -16.571 -6.186 1.00 34.14 N ATOM 540 CA GLU A 35 -22.731 -15.657 -5.038 1.00 32.34 C ATOM 541 C GLU A 35 -23.850 -16.024 -4.064 1.00 53.24 C ATOM 542 O GLU A 35 -24.131 -15.297 -3.116 1.00 44.11 O ATOM 543 CB GLU A 35 -22.917 -14.208 -5.489 1.00 44.13 C ATOM 544 CG GLU A 35 -21.702 -13.606 -6.170 1.00 34.14 C ATOM 545 CD GLU A 35 -21.932 -12.172 -6.589 1.00 44.42 C ATOM 546 OE1 GLU A 35 -21.321 -11.266 -5.983 1.00 74.34 O ATOM 547 OE2 GLU A 35 -22.738 -11.939 -7.511 1.00 42.41 O ATOM 0 H GLU A 35 -23.037 -16.156 -7.059 1.00 34.14 H new ATOM 0 HA GLU A 35 -21.769 -15.754 -4.534 1.00 32.34 H new ATOM 0 HB2 GLU A 35 -23.764 -14.158 -6.173 1.00 44.13 H new ATOM 0 HB3 GLU A 35 -23.172 -13.599 -4.621 1.00 44.13 H new ATOM 0 HG2 GLU A 35 -20.849 -13.652 -5.493 1.00 34.14 H new ATOM 0 HG3 GLU A 35 -21.447 -14.202 -7.046 1.00 34.14 H new ATOM 554 N GLN A 36 -24.482 -17.157 -4.308 1.00 4.02 N ATOM 555 CA GLN A 36 -25.569 -17.625 -3.469 1.00 71.32 C ATOM 556 C GLN A 36 -25.041 -18.393 -2.263 1.00 32.43 C ATOM 557 O GLN A 36 -25.671 -18.420 -1.206 1.00 31.31 O ATOM 558 CB GLN A 36 -26.514 -18.495 -4.289 1.00 41.05 C ATOM 559 CG GLN A 36 -27.471 -17.683 -5.153 1.00 44.24 C ATOM 560 CD GLN A 36 -28.164 -18.498 -6.232 1.00 33.05 C ATOM 561 OE1 GLN A 36 -27.470 -19.487 -6.773 1.00 12.34 O flip ATOM 562 NE2 GLN A 36 -29.307 -18.218 -6.598 1.00 43.20 N flip ATOM 0 H GLN A 36 -24.258 -17.775 -5.088 1.00 4.02 H new ATOM 0 HA GLN A 36 -26.116 -16.760 -3.095 1.00 71.32 H new ATOM 0 HB2 GLN A 36 -25.928 -19.156 -4.928 1.00 41.05 H new ATOM 0 HB3 GLN A 36 -27.090 -19.130 -3.616 1.00 41.05 H new ATOM 0 HG2 GLN A 36 -28.227 -17.228 -4.513 1.00 44.24 H new ATOM 0 HG3 GLN A 36 -26.919 -16.869 -5.623 1.00 44.24 H new ATOM 0 HE21 GLN A 36 -29.810 -17.448 -6.156 1.00 43.20 H new ATOM 0 HE22 GLN A 36 -29.750 -18.756 -7.343 1.00 43.20 H new ATOM 571 N TRP A 37 -23.877 -19.008 -2.415 1.00 24.54 N ATOM 572 CA TRP A 37 -23.280 -19.759 -1.321 1.00 63.14 C ATOM 573 C TRP A 37 -22.060 -19.032 -0.774 1.00 12.02 C ATOM 574 O TRP A 37 -21.340 -19.562 0.072 1.00 40.52 O ATOM 575 CB TRP A 37 -22.910 -21.182 -1.763 1.00 73.32 C ATOM 576 CG TRP A 37 -24.101 -22.003 -2.172 1.00 24.13 C ATOM 577 CD1 TRP A 37 -24.807 -22.867 -1.387 1.00 74.14 C ATOM 578 CD2 TRP A 37 -24.728 -22.036 -3.460 1.00 74.52 C ATOM 579 NE1 TRP A 37 -25.836 -23.424 -2.100 1.00 22.31 N ATOM 580 CE2 TRP A 37 -25.809 -22.935 -3.375 1.00 20.33 C ATOM 581 CE3 TRP A 37 -24.486 -21.396 -4.675 1.00 72.01 C ATOM 582 CZ2 TRP A 37 -26.642 -23.207 -4.456 1.00 20.25 C ATOM 583 CZ3 TRP A 37 -25.313 -21.668 -5.745 1.00 10.12 C ATOM 584 CH2 TRP A 37 -26.381 -22.565 -5.631 1.00 74.22 C ATOM 0 H TRP A 37 -23.332 -19.002 -3.277 1.00 24.54 H new ATOM 0 HA TRP A 37 -24.020 -19.837 -0.525 1.00 63.14 H new ATOM 0 HB2 TRP A 37 -22.211 -21.126 -2.598 1.00 73.32 H new ATOM 0 HB3 TRP A 37 -22.392 -21.686 -0.947 1.00 73.32 H new ATOM 0 HD1 TRP A 37 -24.586 -23.081 -0.352 1.00 74.14 H new ATOM 0 HE1 TRP A 37 -26.513 -24.095 -1.737 1.00 22.31 H new ATOM 0 HE3 TRP A 37 -23.666 -20.700 -4.776 1.00 72.01 H new ATOM 0 HZ2 TRP A 37 -27.465 -23.901 -4.368 1.00 20.25 H new ATOM 0 HZ3 TRP A 37 -25.132 -21.178 -6.691 1.00 10.12 H new ATOM 0 HH2 TRP A 37 -27.010 -22.752 -6.489 1.00 74.22 H new ATOM 595 N GLY A 38 -21.845 -17.806 -1.242 1.00 53.14 N ATOM 596 CA GLY A 38 -20.718 -17.031 -0.755 1.00 24.12 C ATOM 597 C GLY A 38 -20.433 -15.787 -1.575 1.00 73.34 C ATOM 598 O GLY A 38 -21.180 -15.450 -2.488 1.00 73.34 O ATOM 0 H GLY A 38 -22.423 -17.340 -1.941 1.00 53.14 H new ATOM 0 HA2 GLY A 38 -20.909 -16.739 0.278 1.00 24.12 H new ATOM 0 HA3 GLY A 38 -19.830 -17.663 -0.749 1.00 24.12 H new ATOM 602 N THR A 39 -19.338 -15.117 -1.244 1.00 55.32 N ATOM 603 CA THR A 39 -18.943 -13.880 -1.905 1.00 72.34 C ATOM 604 C THR A 39 -17.819 -14.139 -2.901 1.00 12.33 C ATOM 605 O THR A 39 -16.786 -14.686 -2.536 1.00 44.54 O ATOM 606 CB THR A 39 -18.470 -12.848 -0.859 1.00 34.30 C ATOM 607 OG1 THR A 39 -19.583 -12.425 -0.056 1.00 4.12 O ATOM 608 CG2 THR A 39 -17.803 -11.642 -1.515 1.00 12.45 C ATOM 0 H THR A 39 -18.697 -15.416 -0.509 1.00 55.32 H new ATOM 0 HA THR A 39 -19.808 -13.488 -2.440 1.00 72.34 H new ATOM 0 HB THR A 39 -17.725 -13.329 -0.225 1.00 34.30 H new ATOM 0 HG1 THR A 39 -19.278 -11.771 0.608 1.00 4.12 H new ATOM 0 HG21 THR A 39 -17.484 -10.939 -0.745 1.00 12.45 H new ATOM 0 HG22 THR A 39 -16.936 -11.972 -2.087 1.00 12.45 H new ATOM 0 HG23 THR A 39 -18.512 -11.152 -2.182 1.00 12.45 H new ATOM 616 N LEU A 40 -18.012 -13.758 -4.160 1.00 34.34 N ATOM 617 CA LEU A 40 -16.984 -13.981 -5.163 1.00 42.40 C ATOM 618 C LEU A 40 -16.074 -12.773 -5.291 1.00 13.11 C ATOM 619 O LEU A 40 -16.491 -11.702 -5.741 1.00 33.34 O ATOM 620 CB LEU A 40 -17.601 -14.314 -6.518 1.00 4.41 C ATOM 621 CG LEU A 40 -18.737 -15.330 -6.474 1.00 23.42 C ATOM 622 CD1 LEU A 40 -19.081 -15.806 -7.867 1.00 33.23 C ATOM 623 CD2 LEU A 40 -18.398 -16.487 -5.554 1.00 2.25 C ATOM 0 H LEU A 40 -18.857 -13.301 -4.503 1.00 34.34 H new ATOM 0 HA LEU A 40 -16.388 -14.832 -4.834 1.00 42.40 H new ATOM 0 HB2 LEU A 40 -17.974 -13.393 -6.967 1.00 4.41 H new ATOM 0 HB3 LEU A 40 -16.818 -14.695 -7.174 1.00 4.41 H new ATOM 0 HG LEU A 40 -19.620 -14.840 -6.064 1.00 23.42 H new ATOM 0 HD11 LEU A 40 -19.894 -16.530 -7.814 1.00 33.23 H new ATOM 0 HD12 LEU A 40 -19.391 -14.957 -8.475 1.00 33.23 H new ATOM 0 HD13 LEU A 40 -18.206 -16.275 -8.318 1.00 33.23 H new ATOM 0 HD21 LEU A 40 -19.225 -17.196 -5.541 1.00 2.25 H new ATOM 0 HD22 LEU A 40 -17.498 -16.986 -5.913 1.00 2.25 H new ATOM 0 HD23 LEU A 40 -18.227 -16.112 -4.545 1.00 2.25 H new ATOM 635 N THR A 41 -14.833 -12.955 -4.886 1.00 23.51 N ATOM 636 CA THR A 41 -13.826 -11.922 -4.999 1.00 41.12 C ATOM 637 C THR A 41 -13.257 -11.900 -6.418 1.00 21.21 C ATOM 638 O THR A 41 -12.819 -10.859 -6.914 1.00 15.11 O ATOM 639 CB THR A 41 -12.695 -12.153 -3.975 1.00 2.15 C ATOM 640 OG1 THR A 41 -12.107 -13.448 -4.174 1.00 12.32 O ATOM 641 CG2 THR A 41 -13.228 -12.057 -2.552 1.00 54.31 C ATOM 0 H THR A 41 -14.496 -13.823 -4.470 1.00 23.51 H new ATOM 0 HA THR A 41 -14.290 -10.959 -4.788 1.00 41.12 H new ATOM 0 HB THR A 41 -11.940 -11.381 -4.123 1.00 2.15 H new ATOM 0 HG1 THR A 41 -11.389 -13.585 -3.521 1.00 12.32 H new ATOM 0 HG21 THR A 41 -12.414 -12.223 -1.847 1.00 54.31 H new ATOM 0 HG22 THR A 41 -13.653 -11.067 -2.389 1.00 54.31 H new ATOM 0 HG23 THR A 41 -13.999 -12.812 -2.401 1.00 54.31 H new ATOM 649 N ASP A 42 -13.291 -13.058 -7.071 1.00 33.34 N ATOM 650 CA ASP A 42 -12.842 -13.181 -8.456 1.00 4.34 C ATOM 651 C ASP A 42 -13.729 -14.138 -9.235 1.00 12.42 C ATOM 652 O ASP A 42 -13.538 -15.356 -9.192 1.00 54.34 O ATOM 653 CB ASP A 42 -11.392 -13.662 -8.540 1.00 41.54 C ATOM 654 CG ASP A 42 -10.398 -12.526 -8.618 1.00 74.30 C ATOM 655 OD1 ASP A 42 -10.406 -11.795 -9.629 1.00 41.44 O ATOM 656 OD2 ASP A 42 -9.587 -12.377 -7.683 1.00 61.35 O ATOM 0 H ASP A 42 -13.627 -13.930 -6.661 1.00 33.34 H new ATOM 0 HA ASP A 42 -12.908 -12.186 -8.896 1.00 4.34 H new ATOM 0 HB2 ASP A 42 -11.167 -14.275 -7.667 1.00 41.54 H new ATOM 0 HB3 ASP A 42 -11.276 -14.300 -9.416 1.00 41.54 H new ATOM 661 N CYS A 43 -14.710 -13.585 -9.920 1.00 22.20 N ATOM 662 CA CYS A 43 -15.576 -14.361 -10.791 1.00 64.23 C ATOM 663 C CYS A 43 -15.231 -14.057 -12.244 1.00 20.14 C ATOM 664 O CYS A 43 -15.161 -12.891 -12.634 1.00 75.13 O ATOM 665 CB CYS A 43 -17.036 -14.016 -10.510 1.00 53.43 C ATOM 666 SG CYS A 43 -17.377 -12.240 -10.513 1.00 12.31 S ATOM 0 H CYS A 43 -14.930 -12.590 -9.890 1.00 22.20 H new ATOM 0 HA CYS A 43 -15.427 -15.424 -10.603 1.00 64.23 H new ATOM 0 HB2 CYS A 43 -17.665 -14.499 -11.258 1.00 53.43 H new ATOM 0 HB3 CYS A 43 -17.318 -14.429 -9.542 1.00 53.43 H new ATOM 0 HG CYS A 43 -16.651 -11.660 -11.422 1.00 12.31 H new ATOM 672 N VAL A 44 -15.000 -15.089 -13.042 1.00 72.13 N ATOM 673 CA VAL A 44 -14.573 -14.880 -14.417 1.00 25.31 C ATOM 674 C VAL A 44 -14.883 -16.085 -15.302 1.00 1.54 C ATOM 675 O VAL A 44 -14.588 -17.224 -14.952 1.00 51.52 O ATOM 676 CB VAL A 44 -13.060 -14.549 -14.477 1.00 24.40 C ATOM 677 CG1 VAL A 44 -12.225 -15.662 -13.857 1.00 30.32 C ATOM 678 CG2 VAL A 44 -12.619 -14.278 -15.905 1.00 40.52 C ATOM 0 H VAL A 44 -15.099 -16.066 -12.766 1.00 72.13 H new ATOM 0 HA VAL A 44 -15.139 -14.032 -14.802 1.00 25.31 H new ATOM 0 HB VAL A 44 -12.897 -13.644 -13.892 1.00 24.40 H new ATOM 0 HG11 VAL A 44 -11.169 -15.400 -13.915 1.00 30.32 H new ATOM 0 HG12 VAL A 44 -12.510 -15.792 -12.813 1.00 30.32 H new ATOM 0 HG13 VAL A 44 -12.398 -16.592 -14.399 1.00 30.32 H new ATOM 0 HG21 VAL A 44 -11.554 -14.048 -15.919 1.00 40.52 H new ATOM 0 HG22 VAL A 44 -12.809 -15.159 -16.518 1.00 40.52 H new ATOM 0 HG23 VAL A 44 -13.178 -13.432 -16.304 1.00 40.52 H new ATOM 688 N VAL A 45 -15.507 -15.824 -16.438 1.00 64.11 N ATOM 689 CA VAL A 45 -15.773 -16.856 -17.427 1.00 54.12 C ATOM 690 C VAL A 45 -14.858 -16.675 -18.631 1.00 21.45 C ATOM 691 O VAL A 45 -14.740 -15.572 -19.167 1.00 32.03 O ATOM 692 CB VAL A 45 -17.243 -16.831 -17.900 1.00 15.12 C ATOM 693 CG1 VAL A 45 -17.482 -17.874 -18.980 1.00 63.30 C ATOM 694 CG2 VAL A 45 -18.184 -17.053 -16.729 1.00 40.12 C ATOM 0 H VAL A 45 -15.842 -14.897 -16.700 1.00 64.11 H new ATOM 0 HA VAL A 45 -15.582 -17.818 -16.952 1.00 54.12 H new ATOM 0 HB VAL A 45 -17.446 -15.848 -18.325 1.00 15.12 H new ATOM 0 HG11 VAL A 45 -18.524 -17.837 -19.297 1.00 63.30 H new ATOM 0 HG12 VAL A 45 -16.836 -17.669 -19.833 1.00 63.30 H new ATOM 0 HG13 VAL A 45 -17.258 -18.865 -18.585 1.00 63.30 H new ATOM 0 HG21 VAL A 45 -19.215 -17.032 -17.082 1.00 40.12 H new ATOM 0 HG22 VAL A 45 -17.976 -18.021 -16.273 1.00 40.12 H new ATOM 0 HG23 VAL A 45 -18.037 -16.265 -15.990 1.00 40.12 H new ATOM 704 N MET A 46 -14.212 -17.751 -19.053 1.00 35.50 N ATOM 705 CA MET A 46 -13.306 -17.687 -20.190 1.00 11.34 C ATOM 706 C MET A 46 -14.103 -17.742 -21.480 1.00 54.31 C ATOM 707 O MET A 46 -15.101 -18.464 -21.564 1.00 41.21 O ATOM 708 CB MET A 46 -12.307 -18.844 -20.152 1.00 50.42 C ATOM 709 CG MET A 46 -11.559 -18.964 -18.842 1.00 3.51 C ATOM 710 SD MET A 46 -10.586 -17.504 -18.461 1.00 44.13 S ATOM 711 CE MET A 46 -9.891 -18.011 -16.897 1.00 64.14 C ATOM 0 H MET A 46 -14.297 -18.674 -18.628 1.00 35.50 H new ATOM 0 HA MET A 46 -12.752 -16.750 -20.141 1.00 11.34 H new ATOM 0 HB2 MET A 46 -12.838 -19.776 -20.343 1.00 50.42 H new ATOM 0 HB3 MET A 46 -11.587 -18.716 -20.960 1.00 50.42 H new ATOM 0 HG2 MET A 46 -12.272 -19.140 -18.037 1.00 3.51 H new ATOM 0 HG3 MET A 46 -10.902 -19.833 -18.882 1.00 3.51 H new ATOM 0 HE1 MET A 46 -8.901 -17.571 -16.779 1.00 64.14 H new ATOM 0 HE2 MET A 46 -10.537 -17.675 -16.086 1.00 64.14 H new ATOM 0 HE3 MET A 46 -9.810 -19.098 -16.870 1.00 64.14 H new ATOM 721 N ARG A 47 -13.687 -16.983 -22.481 1.00 31.23 N ATOM 722 CA ARG A 47 -14.394 -16.980 -23.749 1.00 63.22 C ATOM 723 C ARG A 47 -13.528 -17.560 -24.847 1.00 43.35 C ATOM 724 O ARG A 47 -12.299 -17.556 -24.754 1.00 34.20 O ATOM 725 CB ARG A 47 -14.815 -15.562 -24.148 1.00 53.33 C ATOM 726 CG ARG A 47 -15.382 -14.732 -23.008 1.00 23.13 C ATOM 727 CD ARG A 47 -16.635 -15.357 -22.425 1.00 21.15 C ATOM 728 NE ARG A 47 -17.201 -14.537 -21.362 1.00 53.11 N ATOM 729 CZ ARG A 47 -18.463 -14.122 -21.341 1.00 25.21 C ATOM 730 NH1 ARG A 47 -19.290 -14.455 -22.323 1.00 11.13 N ATOM 731 NH2 ARG A 47 -18.896 -13.370 -20.341 1.00 24.04 N ATOM 0 H ARG A 47 -12.874 -16.369 -22.441 1.00 31.23 H new ATOM 0 HA ARG A 47 -15.285 -17.594 -23.621 1.00 63.22 H new ATOM 0 HB2 ARG A 47 -13.952 -15.043 -24.565 1.00 53.33 H new ATOM 0 HB3 ARG A 47 -15.561 -15.627 -24.940 1.00 53.33 H new ATOM 0 HG2 ARG A 47 -14.630 -14.627 -22.226 1.00 23.13 H new ATOM 0 HG3 ARG A 47 -15.610 -13.728 -23.367 1.00 23.13 H new ATOM 0 HD2 ARG A 47 -17.375 -15.492 -23.214 1.00 21.15 H new ATOM 0 HD3 ARG A 47 -16.400 -16.347 -22.035 1.00 21.15 H new ATOM 0 HE ARG A 47 -16.593 -14.266 -20.589 1.00 53.11 H new ATOM 0 HH11 ARG A 47 -18.958 -15.031 -23.096 1.00 11.13 H new ATOM 0 HH12 ARG A 47 -20.258 -14.135 -22.305 1.00 11.13 H new ATOM 0 HH21 ARG A 47 -18.261 -13.109 -19.587 1.00 24.04 H new ATOM 0 HH22 ARG A 47 -19.865 -13.051 -20.325 1.00 24.04 H new ATOM 745 N ASP A 48 -14.178 -18.082 -25.873 1.00 42.25 N ATOM 746 CA ASP A 48 -13.476 -18.575 -27.043 1.00 72.55 C ATOM 747 C ASP A 48 -12.794 -17.414 -27.738 1.00 31.20 C ATOM 748 O ASP A 48 -13.399 -16.358 -27.897 1.00 45.32 O ATOM 749 CB ASP A 48 -14.454 -19.226 -28.011 1.00 72.24 C ATOM 750 CG ASP A 48 -13.766 -20.078 -29.047 1.00 65.23 C ATOM 751 OD1 ASP A 48 -13.350 -21.203 -28.719 1.00 71.35 O ATOM 752 OD2 ASP A 48 -13.643 -19.617 -30.198 1.00 52.23 O ATOM 0 H ASP A 48 -15.193 -18.175 -25.918 1.00 42.25 H new ATOM 0 HA ASP A 48 -12.739 -19.314 -26.729 1.00 72.55 H new ATOM 0 HB2 ASP A 48 -15.159 -19.840 -27.451 1.00 72.24 H new ATOM 0 HB3 ASP A 48 -15.034 -18.451 -28.511 1.00 72.24 H new ATOM 757 N PRO A 49 -11.541 -17.583 -28.163 1.00 61.15 N ATOM 758 CA PRO A 49 -10.799 -16.523 -28.847 1.00 61.23 C ATOM 759 C PRO A 49 -11.428 -16.153 -30.188 1.00 73.13 C ATOM 760 O PRO A 49 -11.170 -15.084 -30.735 1.00 44.33 O ATOM 761 CB PRO A 49 -9.410 -17.133 -29.056 1.00 11.23 C ATOM 762 CG PRO A 49 -9.621 -18.607 -28.985 1.00 40.22 C ATOM 763 CD PRO A 49 -10.747 -18.813 -28.016 1.00 24.32 C ATOM 0 HA PRO A 49 -10.786 -15.597 -28.271 1.00 61.23 H new ATOM 0 HB2 PRO A 49 -8.991 -16.840 -30.019 1.00 11.23 H new ATOM 0 HB3 PRO A 49 -8.712 -16.797 -28.289 1.00 11.23 H new ATOM 0 HG2 PRO A 49 -9.869 -19.014 -29.965 1.00 40.22 H new ATOM 0 HG3 PRO A 49 -8.718 -19.115 -28.648 1.00 40.22 H new ATOM 0 HD2 PRO A 49 -11.330 -19.701 -28.259 1.00 24.32 H new ATOM 0 HD3 PRO A 49 -10.384 -18.939 -26.996 1.00 24.32 H new ATOM 771 N ASN A 50 -12.272 -17.039 -30.700 1.00 21.52 N ATOM 772 CA ASN A 50 -12.885 -16.846 -32.005 1.00 62.34 C ATOM 773 C ASN A 50 -14.341 -16.435 -31.852 1.00 54.35 C ATOM 774 O ASN A 50 -14.751 -15.372 -32.324 1.00 51.23 O ATOM 775 CB ASN A 50 -12.812 -18.134 -32.830 1.00 64.35 C ATOM 776 CG ASN A 50 -11.500 -18.872 -32.664 1.00 24.51 C ATOM 777 OD1 ASN A 50 -10.544 -18.650 -33.407 1.00 12.45 O ATOM 778 ND2 ASN A 50 -11.450 -19.753 -31.676 1.00 62.44 N ATOM 0 H ASN A 50 -12.548 -17.901 -30.229 1.00 21.52 H new ATOM 0 HA ASN A 50 -12.337 -16.057 -32.520 1.00 62.34 H new ATOM 0 HB2 ASN A 50 -13.631 -18.792 -32.539 1.00 64.35 H new ATOM 0 HB3 ASN A 50 -12.955 -17.892 -33.883 1.00 64.35 H new ATOM 0 HD21 ASN A 50 -10.594 -20.280 -31.506 1.00 62.44 H new ATOM 0 HD22 ASN A 50 -12.268 -19.904 -31.085 1.00 62.44 H new ATOM 785 N THR A 51 -15.120 -17.279 -31.184 1.00 63.00 N ATOM 786 CA THR A 51 -16.549 -17.042 -31.039 1.00 10.33 C ATOM 787 C THR A 51 -16.813 -15.932 -30.028 1.00 44.34 C ATOM 788 O THR A 51 -17.788 -15.187 -30.152 1.00 51.34 O ATOM 789 CB THR A 51 -17.300 -18.319 -30.595 1.00 31.23 C ATOM 790 OG1 THR A 51 -17.062 -18.580 -29.205 1.00 22.23 O ATOM 791 CG2 THR A 51 -16.852 -19.520 -31.413 1.00 14.12 C ATOM 0 H THR A 51 -14.785 -18.132 -30.736 1.00 63.00 H new ATOM 0 HA THR A 51 -16.921 -16.742 -32.019 1.00 10.33 H new ATOM 0 HB THR A 51 -18.365 -18.155 -30.757 1.00 31.23 H new ATOM 0 HG1 THR A 51 -17.544 -19.390 -28.937 1.00 22.23 H new ATOM 0 HG21 THR A 51 -17.393 -20.407 -31.084 1.00 14.12 H new ATOM 0 HG22 THR A 51 -17.059 -19.339 -32.468 1.00 14.12 H new ATOM 0 HG23 THR A 51 -15.782 -19.676 -31.275 1.00 14.12 H new ATOM 799 N LYS A 52 -15.928 -15.832 -29.032 1.00 15.15 N ATOM 800 CA LYS A 52 -16.053 -14.850 -27.953 1.00 72.41 C ATOM 801 C LYS A 52 -17.327 -15.102 -27.154 1.00 73.01 C ATOM 802 O LYS A 52 -17.902 -14.188 -26.567 1.00 20.22 O ATOM 803 CB LYS A 52 -16.030 -13.419 -28.514 1.00 65.41 C ATOM 804 CG LYS A 52 -14.805 -13.124 -29.374 1.00 64.32 C ATOM 805 CD LYS A 52 -13.513 -13.297 -28.591 1.00 55.23 C ATOM 806 CE LYS A 52 -13.187 -12.074 -27.751 1.00 72.40 C ATOM 807 NZ LYS A 52 -12.758 -10.927 -28.595 1.00 45.04 N ATOM 0 H LYS A 52 -15.105 -16.430 -28.952 1.00 15.15 H new ATOM 0 HA LYS A 52 -15.200 -14.960 -27.283 1.00 72.41 H new ATOM 0 HB2 LYS A 52 -16.929 -13.255 -29.108 1.00 65.41 H new ATOM 0 HB3 LYS A 52 -16.062 -12.711 -27.685 1.00 65.41 H new ATOM 0 HG2 LYS A 52 -14.799 -13.788 -30.238 1.00 64.32 H new ATOM 0 HG3 LYS A 52 -14.865 -12.105 -29.756 1.00 64.32 H new ATOM 0 HD2 LYS A 52 -13.596 -14.170 -27.943 1.00 55.23 H new ATOM 0 HD3 LYS A 52 -12.693 -13.490 -29.283 1.00 55.23 H new ATOM 0 HE2 LYS A 52 -14.062 -11.789 -27.167 1.00 72.40 H new ATOM 0 HE3 LYS A 52 -12.397 -12.320 -27.041 1.00 72.40 H new ATOM 0 HZ1 LYS A 52 -12.291 -10.213 -28.000 1.00 45.04 H new ATOM 0 HZ2 LYS A 52 -12.093 -11.260 -29.322 1.00 45.04 H new ATOM 0 HZ3 LYS A 52 -13.590 -10.504 -29.055 1.00 45.04 H new ATOM 821 N ARG A 53 -17.746 -16.363 -27.117 1.00 64.00 N ATOM 822 CA ARG A 53 -18.965 -16.749 -26.412 1.00 71.14 C ATOM 823 C ARG A 53 -18.631 -17.331 -25.050 1.00 63.32 C ATOM 824 O ARG A 53 -18.903 -16.722 -24.016 1.00 22.20 O ATOM 825 CB ARG A 53 -19.770 -17.768 -27.226 1.00 61.11 C ATOM 826 CG ARG A 53 -20.936 -17.162 -27.988 1.00 23.42 C ATOM 827 CD ARG A 53 -20.475 -16.113 -28.982 1.00 3.30 C ATOM 828 NE ARG A 53 -21.596 -15.420 -29.609 1.00 42.04 N ATOM 829 CZ ARG A 53 -21.460 -14.381 -30.431 1.00 25.14 C ATOM 830 NH1 ARG A 53 -20.250 -13.932 -30.746 1.00 60.03 N ATOM 831 NH2 ARG A 53 -22.532 -13.793 -30.941 1.00 70.50 N ATOM 0 H ARG A 53 -17.258 -17.137 -27.568 1.00 64.00 H new ATOM 0 HA ARG A 53 -19.571 -15.853 -26.278 1.00 71.14 H new ATOM 0 HB2 ARG A 53 -19.104 -18.262 -27.933 1.00 61.11 H new ATOM 0 HB3 ARG A 53 -20.149 -18.538 -26.554 1.00 61.11 H new ATOM 0 HG2 ARG A 53 -21.475 -17.950 -28.515 1.00 23.42 H new ATOM 0 HG3 ARG A 53 -21.636 -16.713 -27.284 1.00 23.42 H new ATOM 0 HD2 ARG A 53 -19.839 -15.388 -28.474 1.00 3.30 H new ATOM 0 HD3 ARG A 53 -19.866 -16.587 -29.752 1.00 3.30 H new ATOM 0 HE ARG A 53 -22.539 -15.751 -29.406 1.00 42.04 H new ATOM 0 HH11 ARG A 53 -19.422 -14.383 -30.358 1.00 60.03 H new ATOM 0 HH12 ARG A 53 -20.149 -13.136 -31.376 1.00 60.03 H new ATOM 0 HH21 ARG A 53 -23.463 -14.136 -30.704 1.00 70.50 H new ATOM 0 HH22 ARG A 53 -22.426 -12.997 -31.570 1.00 70.50 H new ATOM 845 N SER A 54 -18.038 -18.512 -25.060 1.00 64.01 N ATOM 846 CA SER A 54 -17.629 -19.175 -23.840 1.00 30.13 C ATOM 847 C SER A 54 -16.624 -20.265 -24.168 1.00 2.20 C ATOM 848 O SER A 54 -16.519 -20.696 -25.317 1.00 2.22 O ATOM 849 CB SER A 54 -18.846 -19.766 -23.118 1.00 52.03 C ATOM 850 OG SER A 54 -18.478 -20.388 -21.897 1.00 0.54 O ATOM 0 H SER A 54 -17.828 -19.034 -25.911 1.00 64.01 H new ATOM 0 HA SER A 54 -17.162 -18.447 -23.177 1.00 30.13 H new ATOM 0 HB2 SER A 54 -19.571 -18.977 -22.921 1.00 52.03 H new ATOM 0 HB3 SER A 54 -19.335 -20.494 -23.765 1.00 52.03 H new ATOM 0 HG SER A 54 -19.277 -20.752 -21.462 1.00 0.54 H new ATOM 856 N ARG A 55 -15.874 -20.680 -23.167 1.00 73.41 N ATOM 857 CA ARG A 55 -14.911 -21.753 -23.320 1.00 35.55 C ATOM 858 C ARG A 55 -15.477 -23.051 -22.769 1.00 44.45 C ATOM 859 O ARG A 55 -14.840 -24.099 -22.844 1.00 34.34 O ATOM 860 CB ARG A 55 -13.621 -21.395 -22.590 1.00 4.52 C ATOM 861 CG ARG A 55 -12.814 -20.307 -23.269 1.00 32.41 C ATOM 862 CD ARG A 55 -12.083 -20.816 -24.500 1.00 65.35 C ATOM 863 NE ARG A 55 -10.922 -21.627 -24.145 1.00 3.13 N ATOM 864 CZ ARG A 55 -9.706 -21.123 -23.918 1.00 31.44 C ATOM 865 NH1 ARG A 55 -9.508 -19.807 -23.966 1.00 32.14 N ATOM 866 NH2 ARG A 55 -8.691 -21.928 -23.634 1.00 62.12 N ATOM 0 H ARG A 55 -15.914 -20.285 -22.228 1.00 73.41 H new ATOM 0 HA ARG A 55 -14.697 -21.888 -24.380 1.00 35.55 H new ATOM 0 HB2 ARG A 55 -13.865 -21.075 -21.577 1.00 4.52 H new ATOM 0 HB3 ARG A 55 -13.005 -22.290 -22.502 1.00 4.52 H new ATOM 0 HG2 ARG A 55 -13.477 -19.490 -23.554 1.00 32.41 H new ATOM 0 HG3 ARG A 55 -12.091 -19.899 -22.562 1.00 32.41 H new ATOM 0 HD2 ARG A 55 -12.766 -21.407 -25.110 1.00 65.35 H new ATOM 0 HD3 ARG A 55 -11.763 -19.970 -25.108 1.00 65.35 H new ATOM 0 HE ARG A 55 -11.047 -22.636 -24.066 1.00 3.13 H new ATOM 0 HH11 ARG A 55 -10.286 -19.182 -24.176 1.00 32.14 H new ATOM 0 HH12 ARG A 55 -8.579 -19.424 -23.792 1.00 32.14 H new ATOM 0 HH21 ARG A 55 -8.837 -22.936 -23.588 1.00 62.12 H new ATOM 0 HH22 ARG A 55 -7.764 -21.539 -23.461 1.00 62.12 H new ATOM 880 N GLY A 56 -16.681 -22.967 -22.218 1.00 30.23 N ATOM 881 CA GLY A 56 -17.306 -24.125 -21.614 1.00 30.51 C ATOM 882 C GLY A 56 -16.881 -24.305 -20.174 1.00 72.21 C ATOM 883 O GLY A 56 -17.119 -25.355 -19.573 1.00 53.11 O ATOM 0 H GLY A 56 -17.237 -22.113 -22.179 1.00 30.23 H new ATOM 0 HA2 GLY A 56 -18.390 -24.020 -21.663 1.00 30.51 H new ATOM 0 HA3 GLY A 56 -17.046 -25.017 -22.184 1.00 30.51 H new ATOM 887 N PHE A 57 -16.265 -23.268 -19.617 1.00 1.13 N ATOM 888 CA PHE A 57 -15.826 -23.286 -18.229 1.00 4.15 C ATOM 889 C PHE A 57 -15.563 -21.874 -17.721 1.00 54.11 C ATOM 890 O PHE A 57 -15.356 -20.937 -18.502 1.00 25.03 O ATOM 891 CB PHE A 57 -14.577 -24.166 -18.032 1.00 34.13 C ATOM 892 CG PHE A 57 -13.428 -23.855 -18.949 1.00 0.30 C ATOM 893 CD1 PHE A 57 -12.671 -22.704 -18.786 1.00 4.03 C ATOM 894 CD2 PHE A 57 -13.099 -24.725 -19.970 1.00 63.24 C ATOM 895 CE1 PHE A 57 -11.614 -22.427 -19.630 1.00 54.20 C ATOM 896 CE2 PHE A 57 -12.043 -24.454 -20.819 1.00 62.33 C ATOM 897 CZ PHE A 57 -11.300 -23.302 -20.650 1.00 35.23 C ATOM 0 H PHE A 57 -16.058 -22.400 -20.110 1.00 1.13 H new ATOM 0 HA PHE A 57 -16.636 -23.723 -17.645 1.00 4.15 H new ATOM 0 HB2 PHE A 57 -14.238 -24.063 -17.001 1.00 34.13 H new ATOM 0 HB3 PHE A 57 -14.861 -25.209 -18.171 1.00 34.13 H new ATOM 0 HD1 PHE A 57 -12.911 -22.016 -17.989 1.00 4.03 H new ATOM 0 HD2 PHE A 57 -13.674 -25.629 -20.107 1.00 63.24 H new ATOM 0 HE1 PHE A 57 -11.034 -21.527 -19.492 1.00 54.20 H new ATOM 0 HE2 PHE A 57 -11.799 -25.143 -21.614 1.00 62.33 H new ATOM 0 HZ PHE A 57 -10.476 -23.087 -21.314 1.00 35.23 H new ATOM 907 N GLY A 58 -15.579 -21.737 -16.409 1.00 53.04 N ATOM 908 CA GLY A 58 -15.330 -20.462 -15.779 1.00 31.11 C ATOM 909 C GLY A 58 -14.760 -20.645 -14.393 1.00 34.31 C ATOM 910 O GLY A 58 -14.603 -21.776 -13.928 1.00 34.11 O ATOM 0 H GLY A 58 -15.763 -22.500 -15.758 1.00 53.04 H new ATOM 0 HA2 GLY A 58 -14.637 -19.881 -16.387 1.00 31.11 H new ATOM 0 HA3 GLY A 58 -16.258 -19.893 -15.722 1.00 31.11 H new ATOM 914 N PHE A 59 -14.449 -19.549 -13.730 1.00 23.22 N ATOM 915 CA PHE A 59 -13.880 -19.607 -12.399 1.00 33.53 C ATOM 916 C PHE A 59 -14.643 -18.719 -11.437 1.00 5.34 C ATOM 917 O PHE A 59 -15.195 -17.685 -11.816 1.00 14.21 O ATOM 918 CB PHE A 59 -12.406 -19.210 -12.418 1.00 23.43 C ATOM 919 CG PHE A 59 -11.535 -20.201 -13.128 1.00 73.11 C ATOM 920 CD1 PHE A 59 -11.065 -21.321 -12.466 1.00 14.23 C ATOM 921 CD2 PHE A 59 -11.185 -20.013 -14.452 1.00 74.24 C ATOM 922 CE1 PHE A 59 -10.261 -22.235 -13.114 1.00 55.12 C ATOM 923 CE2 PHE A 59 -10.382 -20.925 -15.107 1.00 34.03 C ATOM 924 CZ PHE A 59 -9.920 -22.037 -14.437 1.00 14.50 C ATOM 0 H PHE A 59 -14.581 -18.605 -14.093 1.00 23.22 H new ATOM 0 HA PHE A 59 -13.961 -20.638 -12.054 1.00 33.53 H new ATOM 0 HB2 PHE A 59 -12.305 -18.237 -12.899 1.00 23.43 H new ATOM 0 HB3 PHE A 59 -12.054 -19.096 -11.393 1.00 23.43 H new ATOM 0 HD1 PHE A 59 -11.330 -21.481 -11.431 1.00 14.23 H new ATOM 0 HD2 PHE A 59 -11.544 -19.142 -14.980 1.00 74.24 H new ATOM 0 HE1 PHE A 59 -9.898 -23.105 -12.587 1.00 55.12 H new ATOM 0 HE2 PHE A 59 -10.117 -20.767 -16.142 1.00 34.03 H new ATOM 0 HZ PHE A 59 -9.292 -22.753 -14.946 1.00 14.50 H new ATOM 934 N VAL A 60 -14.644 -19.132 -10.188 1.00 50.44 N ATOM 935 CA VAL A 60 -15.380 -18.458 -9.139 1.00 70.13 C ATOM 936 C VAL A 60 -14.599 -18.532 -7.833 1.00 23.22 C ATOM 937 O VAL A 60 -14.512 -19.576 -7.196 1.00 13.22 O ATOM 938 CB VAL A 60 -16.803 -19.043 -8.991 1.00 5.04 C ATOM 939 CG1 VAL A 60 -16.809 -20.540 -9.192 1.00 34.44 C ATOM 940 CG2 VAL A 60 -17.387 -18.703 -7.646 1.00 74.51 C ATOM 0 H VAL A 60 -14.129 -19.953 -9.869 1.00 50.44 H new ATOM 0 HA VAL A 60 -15.498 -17.408 -9.408 1.00 70.13 H new ATOM 0 HB VAL A 60 -17.420 -18.591 -9.767 1.00 5.04 H new ATOM 0 HG11 VAL A 60 -17.825 -20.918 -9.081 1.00 34.44 H new ATOM 0 HG12 VAL A 60 -16.442 -20.774 -10.191 1.00 34.44 H new ATOM 0 HG13 VAL A 60 -16.164 -21.009 -8.449 1.00 34.44 H new ATOM 0 HG21 VAL A 60 -18.388 -19.126 -7.567 1.00 74.51 H new ATOM 0 HG22 VAL A 60 -16.755 -19.117 -6.860 1.00 74.51 H new ATOM 0 HG23 VAL A 60 -17.441 -17.620 -7.536 1.00 74.51 H new ATOM 950 N THR A 61 -13.977 -17.423 -7.479 1.00 71.30 N ATOM 951 CA THR A 61 -13.169 -17.351 -6.277 1.00 44.43 C ATOM 952 C THR A 61 -13.978 -16.728 -5.155 1.00 74.14 C ATOM 953 O THR A 61 -14.438 -15.596 -5.278 1.00 41.02 O ATOM 954 CB THR A 61 -11.903 -16.508 -6.520 1.00 53.31 C ATOM 955 OG1 THR A 61 -11.376 -16.798 -7.824 1.00 20.24 O ATOM 956 CG2 THR A 61 -10.844 -16.791 -5.465 1.00 71.22 C ATOM 0 H THR A 61 -14.017 -16.554 -8.012 1.00 71.30 H new ATOM 0 HA THR A 61 -12.870 -18.362 -6.002 1.00 44.43 H new ATOM 0 HB THR A 61 -12.175 -15.454 -6.456 1.00 53.31 H new ATOM 0 HG1 THR A 61 -11.929 -16.361 -8.505 1.00 20.24 H new ATOM 0 HG21 THR A 61 -9.962 -16.182 -5.662 1.00 71.22 H new ATOM 0 HG22 THR A 61 -11.239 -16.549 -4.479 1.00 71.22 H new ATOM 0 HG23 THR A 61 -10.571 -17.846 -5.497 1.00 71.22 H new ATOM 964 N TYR A 62 -14.166 -17.470 -4.080 1.00 73.23 N ATOM 965 CA TYR A 62 -14.944 -16.987 -2.953 1.00 0.32 C ATOM 966 C TYR A 62 -14.063 -16.205 -1.989 1.00 52.33 C ATOM 967 O TYR A 62 -12.844 -16.130 -2.166 1.00 33.22 O ATOM 968 CB TYR A 62 -15.609 -18.152 -2.222 1.00 5.22 C ATOM 969 CG TYR A 62 -16.797 -18.730 -2.952 1.00 2.43 C ATOM 970 CD1 TYR A 62 -18.085 -18.357 -2.604 1.00 33.15 C ATOM 971 CD2 TYR A 62 -16.637 -19.651 -3.977 1.00 33.32 C ATOM 972 CE1 TYR A 62 -19.182 -18.882 -3.255 1.00 60.00 C ATOM 973 CE2 TYR A 62 -17.729 -20.179 -4.635 1.00 33.40 C ATOM 974 CZ TYR A 62 -18.999 -19.793 -4.269 1.00 72.13 C ATOM 975 OH TYR A 62 -20.091 -20.318 -4.921 1.00 5.01 O ATOM 0 H TYR A 62 -13.790 -18.411 -3.963 1.00 73.23 H new ATOM 0 HA TYR A 62 -15.719 -16.323 -3.336 1.00 0.32 H new ATOM 0 HB2 TYR A 62 -14.872 -18.939 -2.066 1.00 5.22 H new ATOM 0 HB3 TYR A 62 -15.929 -17.815 -1.236 1.00 5.22 H new ATOM 0 HD1 TYR A 62 -18.233 -17.642 -1.808 1.00 33.15 H new ATOM 0 HD2 TYR A 62 -15.643 -19.959 -4.264 1.00 33.32 H new ATOM 0 HE1 TYR A 62 -20.179 -18.579 -2.970 1.00 60.00 H new ATOM 0 HE2 TYR A 62 -17.588 -20.892 -5.434 1.00 33.40 H new ATOM 0 HH TYR A 62 -20.722 -19.599 -5.133 1.00 5.01 H new ATOM 985 N ALA A 63 -14.683 -15.635 -0.965 1.00 34.02 N ATOM 986 CA ALA A 63 -13.963 -14.840 0.012 1.00 45.21 C ATOM 987 C ALA A 63 -13.146 -15.747 0.916 1.00 34.00 C ATOM 988 O ALA A 63 -12.008 -15.442 1.268 1.00 10.02 O ATOM 989 CB ALA A 63 -14.932 -13.999 0.828 1.00 54.44 C ATOM 0 H ALA A 63 -15.685 -15.710 -0.792 1.00 34.02 H new ATOM 0 HA ALA A 63 -13.284 -14.166 -0.510 1.00 45.21 H new ATOM 0 HB1 ALA A 63 -14.377 -13.408 1.557 1.00 54.44 H new ATOM 0 HB2 ALA A 63 -15.483 -13.332 0.165 1.00 54.44 H new ATOM 0 HB3 ALA A 63 -15.632 -14.653 1.349 1.00 54.44 H new ATOM 995 N THR A 64 -13.730 -16.882 1.260 1.00 14.52 N ATOM 996 CA THR A 64 -13.068 -17.860 2.097 1.00 63.01 C ATOM 997 C THR A 64 -13.343 -19.266 1.575 1.00 43.33 C ATOM 998 O THR A 64 -14.276 -19.478 0.794 1.00 21.03 O ATOM 999 CB THR A 64 -13.514 -17.740 3.576 1.00 75.44 C ATOM 1000 OG1 THR A 64 -12.960 -18.811 4.353 1.00 75.30 O ATOM 1001 CG2 THR A 64 -15.029 -17.747 3.697 1.00 32.31 C ATOM 0 H THR A 64 -14.670 -17.148 0.968 1.00 14.52 H new ATOM 0 HA THR A 64 -11.996 -17.664 2.058 1.00 63.01 H new ATOM 0 HB THR A 64 -13.144 -16.789 3.958 1.00 75.44 H new ATOM 0 HG1 THR A 64 -13.248 -18.722 5.285 1.00 75.30 H new ATOM 0 HG21 THR A 64 -15.311 -17.661 4.747 1.00 32.31 H new ATOM 0 HG22 THR A 64 -15.442 -16.906 3.141 1.00 32.31 H new ATOM 0 HG23 THR A 64 -15.422 -18.679 3.291 1.00 32.31 H new ATOM 1009 N VAL A 65 -12.527 -20.220 2.003 1.00 72.10 N ATOM 1010 CA VAL A 65 -12.648 -21.601 1.557 1.00 30.31 C ATOM 1011 C VAL A 65 -13.998 -22.197 1.954 1.00 34.32 C ATOM 1012 O VAL A 65 -14.542 -23.037 1.242 1.00 21.23 O ATOM 1013 CB VAL A 65 -11.508 -22.476 2.120 1.00 5.40 C ATOM 1014 CG1 VAL A 65 -10.182 -22.084 1.491 1.00 73.25 C ATOM 1015 CG2 VAL A 65 -11.428 -22.355 3.636 1.00 71.11 C ATOM 0 H VAL A 65 -11.767 -20.060 2.665 1.00 72.10 H new ATOM 0 HA VAL A 65 -12.576 -21.591 0.469 1.00 30.31 H new ATOM 0 HB VAL A 65 -11.723 -23.515 1.871 1.00 5.40 H new ATOM 0 HG11 VAL A 65 -9.387 -22.710 1.898 1.00 73.25 H new ATOM 0 HG12 VAL A 65 -10.236 -22.223 0.411 1.00 73.25 H new ATOM 0 HG13 VAL A 65 -9.969 -21.038 1.712 1.00 73.25 H new ATOM 0 HG21 VAL A 65 -10.617 -22.981 4.009 1.00 71.11 H new ATOM 0 HG22 VAL A 65 -11.240 -21.317 3.909 1.00 71.11 H new ATOM 0 HG23 VAL A 65 -12.370 -22.681 4.077 1.00 71.11 H new ATOM 1025 N GLU A 66 -14.541 -21.722 3.071 1.00 41.44 N ATOM 1026 CA GLU A 66 -15.819 -22.206 3.587 1.00 30.40 C ATOM 1027 C GLU A 66 -16.931 -22.045 2.560 1.00 13.42 C ATOM 1028 O GLU A 66 -17.796 -22.909 2.419 1.00 51.31 O ATOM 1029 CB GLU A 66 -16.184 -21.449 4.861 1.00 31.43 C ATOM 1030 CG GLU A 66 -15.266 -21.754 6.029 1.00 44.23 C ATOM 1031 CD GLU A 66 -15.384 -23.192 6.486 1.00 43.30 C ATOM 1032 OE1 GLU A 66 -16.286 -23.490 7.299 1.00 23.13 O ATOM 1033 OE2 GLU A 66 -14.577 -24.032 6.037 1.00 52.25 O ATOM 0 H GLU A 66 -14.111 -20.994 3.642 1.00 41.44 H new ATOM 0 HA GLU A 66 -15.711 -23.268 3.807 1.00 30.40 H new ATOM 0 HB2 GLU A 66 -16.158 -20.378 4.658 1.00 31.43 H new ATOM 0 HB3 GLU A 66 -17.208 -21.696 5.140 1.00 31.43 H new ATOM 0 HG2 GLU A 66 -14.235 -21.549 5.742 1.00 44.23 H new ATOM 0 HG3 GLU A 66 -15.504 -21.089 6.860 1.00 44.23 H new ATOM 1040 N GLU A 67 -16.895 -20.938 1.835 1.00 51.41 N ATOM 1041 CA GLU A 67 -17.926 -20.640 0.857 1.00 12.11 C ATOM 1042 C GLU A 67 -17.779 -21.547 -0.359 1.00 25.12 C ATOM 1043 O GLU A 67 -18.769 -21.980 -0.950 1.00 55.33 O ATOM 1044 CB GLU A 67 -17.852 -19.175 0.450 1.00 52.35 C ATOM 1045 CG GLU A 67 -17.747 -18.226 1.629 1.00 41.22 C ATOM 1046 CD GLU A 67 -17.978 -16.783 1.242 1.00 65.55 C ATOM 1047 OE1 GLU A 67 -17.205 -16.250 0.426 1.00 12.52 O ATOM 1048 OE2 GLU A 67 -18.937 -16.171 1.762 1.00 51.24 O ATOM 0 H GLU A 67 -16.162 -20.232 1.906 1.00 51.41 H new ATOM 0 HA GLU A 67 -18.903 -20.825 1.304 1.00 12.11 H new ATOM 0 HB2 GLU A 67 -16.990 -19.030 -0.201 1.00 52.35 H new ATOM 0 HB3 GLU A 67 -18.738 -18.922 -0.132 1.00 52.35 H new ATOM 0 HG2 GLU A 67 -18.474 -18.515 2.388 1.00 41.22 H new ATOM 0 HG3 GLU A 67 -16.760 -18.323 2.081 1.00 41.22 H new ATOM 1055 N VAL A 68 -16.533 -21.836 -0.719 1.00 72.43 N ATOM 1056 CA VAL A 68 -16.244 -22.794 -1.782 1.00 54.24 C ATOM 1057 C VAL A 68 -16.812 -24.160 -1.430 1.00 41.32 C ATOM 1058 O VAL A 68 -17.509 -24.782 -2.232 1.00 4.12 O ATOM 1059 CB VAL A 68 -14.725 -22.925 -2.040 1.00 43.23 C ATOM 1060 CG1 VAL A 68 -14.406 -24.173 -2.851 1.00 60.44 C ATOM 1061 CG2 VAL A 68 -14.208 -21.700 -2.764 1.00 63.31 C ATOM 0 H VAL A 68 -15.706 -21.421 -0.290 1.00 72.43 H new ATOM 0 HA VAL A 68 -16.715 -22.419 -2.691 1.00 54.24 H new ATOM 0 HB VAL A 68 -14.231 -23.010 -1.072 1.00 43.23 H new ATOM 0 HG11 VAL A 68 -13.330 -24.235 -3.015 1.00 60.44 H new ATOM 0 HG12 VAL A 68 -14.742 -25.056 -2.307 1.00 60.44 H new ATOM 0 HG13 VAL A 68 -14.917 -24.123 -3.812 1.00 60.44 H new ATOM 0 HG21 VAL A 68 -13.137 -21.806 -2.939 1.00 63.31 H new ATOM 0 HG22 VAL A 68 -14.723 -21.597 -3.719 1.00 63.31 H new ATOM 0 HG23 VAL A 68 -14.390 -20.814 -2.156 1.00 63.31 H new ATOM 1071 N ASP A 69 -16.523 -24.611 -0.216 1.00 74.04 N ATOM 1072 CA ASP A 69 -17.007 -25.899 0.255 1.00 73.42 C ATOM 1073 C ASP A 69 -18.530 -25.940 0.259 1.00 53.53 C ATOM 1074 O ASP A 69 -19.125 -26.966 -0.059 1.00 24.41 O ATOM 1075 CB ASP A 69 -16.462 -26.212 1.651 1.00 33.24 C ATOM 1076 CG ASP A 69 -14.988 -26.576 1.635 1.00 2.23 C ATOM 1077 OD1 ASP A 69 -14.148 -25.711 1.942 1.00 11.13 O ATOM 1078 OD2 ASP A 69 -14.654 -27.733 1.308 1.00 44.44 O ATOM 0 H ASP A 69 -15.954 -24.101 0.460 1.00 74.04 H new ATOM 0 HA ASP A 69 -16.644 -26.662 -0.434 1.00 73.42 H new ATOM 0 HB2 ASP A 69 -16.612 -25.347 2.298 1.00 33.24 H new ATOM 0 HB3 ASP A 69 -17.031 -27.035 2.083 1.00 33.24 H new ATOM 1083 N ALA A 70 -19.164 -24.819 0.584 1.00 63.51 N ATOM 1084 CA ALA A 70 -20.620 -24.753 0.594 1.00 44.33 C ATOM 1085 C ALA A 70 -21.174 -24.957 -0.809 1.00 51.12 C ATOM 1086 O ALA A 70 -22.123 -25.712 -1.007 1.00 3.13 O ATOM 1087 CB ALA A 70 -21.097 -23.427 1.162 1.00 11.41 C ATOM 0 H ALA A 70 -18.697 -23.950 0.842 1.00 63.51 H new ATOM 0 HA ALA A 70 -20.991 -25.553 1.234 1.00 44.33 H new ATOM 0 HB1 ALA A 70 -22.187 -23.401 1.159 1.00 11.41 H new ATOM 0 HB2 ALA A 70 -20.734 -23.317 2.184 1.00 11.41 H new ATOM 0 HB3 ALA A 70 -20.713 -22.610 0.551 1.00 11.41 H new ATOM 1093 N ALA A 71 -20.554 -24.298 -1.783 1.00 13.54 N ATOM 1094 CA ALA A 71 -20.950 -24.443 -3.178 1.00 50.44 C ATOM 1095 C ALA A 71 -20.704 -25.867 -3.656 1.00 74.23 C ATOM 1096 O ALA A 71 -21.409 -26.374 -4.530 1.00 24.03 O ATOM 1097 CB ALA A 71 -20.188 -23.461 -4.050 1.00 34.45 C ATOM 0 H ALA A 71 -19.775 -23.658 -1.631 1.00 13.54 H new ATOM 0 HA ALA A 71 -22.016 -24.227 -3.256 1.00 50.44 H new ATOM 0 HB1 ALA A 71 -20.495 -23.582 -5.089 1.00 34.45 H new ATOM 0 HB2 ALA A 71 -20.402 -22.443 -3.725 1.00 34.45 H new ATOM 0 HB3 ALA A 71 -19.118 -23.652 -3.964 1.00 34.45 H new ATOM 1103 N MET A 72 -19.700 -26.512 -3.075 1.00 12.50 N ATOM 1104 CA MET A 72 -19.400 -27.896 -3.399 1.00 21.30 C ATOM 1105 C MET A 72 -20.499 -28.813 -2.883 1.00 61.32 C ATOM 1106 O MET A 72 -20.925 -29.725 -3.575 1.00 51.42 O ATOM 1107 CB MET A 72 -18.058 -28.329 -2.812 1.00 23.20 C ATOM 1108 CG MET A 72 -16.854 -27.632 -3.415 1.00 33.40 C ATOM 1109 SD MET A 72 -15.312 -28.465 -2.997 1.00 14.23 S ATOM 1110 CE MET A 72 -14.215 -27.733 -4.199 1.00 34.03 C ATOM 0 H MET A 72 -19.082 -26.097 -2.378 1.00 12.50 H new ATOM 0 HA MET A 72 -19.342 -27.972 -4.485 1.00 21.30 H new ATOM 0 HB2 MET A 72 -18.069 -28.144 -1.738 1.00 23.20 H new ATOM 0 HB3 MET A 72 -17.946 -29.405 -2.949 1.00 23.20 H new ATOM 0 HG2 MET A 72 -16.963 -27.593 -4.499 1.00 33.40 H new ATOM 0 HG3 MET A 72 -16.817 -26.602 -3.061 1.00 33.40 H new ATOM 0 HE1 MET A 72 -13.264 -28.266 -4.196 1.00 34.03 H new ATOM 0 HE2 MET A 72 -14.665 -27.799 -5.190 1.00 34.03 H new ATOM 0 HE3 MET A 72 -14.045 -26.686 -3.947 1.00 34.03 H new ATOM 1120 N ASN A 73 -20.971 -28.558 -1.670 1.00 33.02 N ATOM 1121 CA ASN A 73 -22.069 -29.342 -1.102 1.00 14.23 C ATOM 1122 C ASN A 73 -23.355 -29.098 -1.880 1.00 34.51 C ATOM 1123 O ASN A 73 -24.318 -29.857 -1.771 1.00 45.31 O ATOM 1124 CB ASN A 73 -22.297 -28.999 0.375 1.00 12.00 C ATOM 1125 CG ASN A 73 -21.219 -29.550 1.289 1.00 43.55 C ATOM 1126 OD1 ASN A 73 -21.299 -30.692 1.745 1.00 14.33 O ATOM 1127 ND2 ASN A 73 -20.215 -28.740 1.579 1.00 4.53 N ATOM 0 H ASN A 73 -20.616 -27.821 -1.061 1.00 33.02 H new ATOM 0 HA ASN A 73 -21.791 -30.393 -1.176 1.00 14.23 H new ATOM 0 HB2 ASN A 73 -22.341 -27.916 0.487 1.00 12.00 H new ATOM 0 HB3 ASN A 73 -23.265 -29.391 0.687 1.00 12.00 H new ATOM 0 HD21 ASN A 73 -19.470 -29.054 2.201 1.00 4.53 H new ATOM 0 HD22 ASN A 73 -20.186 -27.801 1.181 1.00 4.53 H new ATOM 1134 N ALA A 74 -23.355 -28.037 -2.675 1.00 64.34 N ATOM 1135 CA ALA A 74 -24.525 -27.651 -3.442 1.00 0.13 C ATOM 1136 C ALA A 74 -24.537 -28.307 -4.827 1.00 23.22 C ATOM 1137 O ALA A 74 -25.450 -28.071 -5.621 1.00 51.43 O ATOM 1138 CB ALA A 74 -24.581 -26.136 -3.565 1.00 63.13 C ATOM 0 H ALA A 74 -22.549 -27.425 -2.804 1.00 64.34 H new ATOM 0 HA ALA A 74 -25.410 -28.002 -2.912 1.00 0.13 H new ATOM 0 HB1 ALA A 74 -25.461 -25.850 -4.142 1.00 63.13 H new ATOM 0 HB2 ALA A 74 -24.638 -25.692 -2.571 1.00 63.13 H new ATOM 0 HB3 ALA A 74 -23.684 -25.779 -4.071 1.00 63.13 H new ATOM 1144 N ARG A 75 -23.532 -29.130 -5.119 1.00 53.40 N ATOM 1145 CA ARG A 75 -23.486 -29.837 -6.390 1.00 51.22 C ATOM 1146 C ARG A 75 -24.353 -31.097 -6.323 1.00 32.14 C ATOM 1147 O ARG A 75 -24.584 -31.633 -5.237 1.00 35.21 O ATOM 1148 CB ARG A 75 -22.042 -30.184 -6.785 1.00 61.53 C ATOM 1149 CG ARG A 75 -21.393 -31.262 -5.933 1.00 50.02 C ATOM 1150 CD ARG A 75 -19.914 -31.397 -6.251 1.00 61.42 C ATOM 1151 NE ARG A 75 -19.227 -32.296 -5.325 1.00 10.24 N ATOM 1152 CZ ARG A 75 -17.914 -32.537 -5.354 1.00 61.34 C ATOM 1153 NH1 ARG A 75 -17.137 -31.918 -6.239 1.00 1.52 N ATOM 1154 NH2 ARG A 75 -17.377 -33.391 -4.491 1.00 44.23 N ATOM 0 H ARG A 75 -22.747 -29.321 -4.497 1.00 53.40 H new ATOM 0 HA ARG A 75 -23.885 -29.179 -7.162 1.00 51.22 H new ATOM 0 HB2 ARG A 75 -22.032 -30.507 -7.826 1.00 61.53 H new ATOM 0 HB3 ARG A 75 -21.436 -29.280 -6.726 1.00 61.53 H new ATOM 0 HG2 ARG A 75 -21.520 -31.021 -4.878 1.00 50.02 H new ATOM 0 HG3 ARG A 75 -21.893 -32.215 -6.105 1.00 50.02 H new ATOM 0 HD2 ARG A 75 -19.796 -31.768 -7.269 1.00 61.42 H new ATOM 0 HD3 ARG A 75 -19.445 -30.414 -6.214 1.00 61.42 H new ATOM 0 HE ARG A 75 -19.785 -32.768 -4.613 1.00 10.24 H new ATOM 0 HH11 ARG A 75 -17.544 -31.256 -6.900 1.00 1.52 H new ATOM 0 HH12 ARG A 75 -16.135 -32.106 -6.257 1.00 1.52 H new ATOM 0 HH21 ARG A 75 -17.967 -33.863 -3.806 1.00 44.23 H new ATOM 0 HH22 ARG A 75 -16.374 -33.575 -4.513 1.00 44.23 H new ATOM 1168 N PRO A 76 -24.864 -31.578 -7.474 1.00 30.33 N ATOM 1169 CA PRO A 76 -24.618 -30.967 -8.787 1.00 75.44 C ATOM 1170 C PRO A 76 -25.097 -29.522 -8.862 1.00 51.14 C ATOM 1171 O PRO A 76 -26.236 -29.205 -8.508 1.00 24.41 O ATOM 1172 CB PRO A 76 -25.409 -31.847 -9.762 1.00 62.55 C ATOM 1173 CG PRO A 76 -25.633 -33.128 -9.034 1.00 14.00 C ATOM 1174 CD PRO A 76 -25.723 -32.766 -7.580 1.00 31.24 C ATOM 0 HA PRO A 76 -23.552 -30.922 -9.010 1.00 75.44 H new ATOM 0 HB2 PRO A 76 -26.354 -31.379 -10.037 1.00 62.55 H new ATOM 0 HB3 PRO A 76 -24.853 -32.010 -10.685 1.00 62.55 H new ATOM 0 HG2 PRO A 76 -26.548 -33.615 -9.372 1.00 14.00 H new ATOM 0 HG3 PRO A 76 -24.816 -33.827 -9.213 1.00 14.00 H new ATOM 0 HD2 PRO A 76 -26.749 -32.549 -7.282 1.00 31.24 H new ATOM 0 HD3 PRO A 76 -25.370 -33.576 -6.941 1.00 31.24 H new ATOM 1182 N HIS A 77 -24.201 -28.652 -9.301 1.00 54.41 N ATOM 1183 CA HIS A 77 -24.469 -27.224 -9.323 1.00 40.14 C ATOM 1184 C HIS A 77 -25.305 -26.860 -10.546 1.00 53.11 C ATOM 1185 O HIS A 77 -25.421 -27.646 -11.488 1.00 54.34 O ATOM 1186 CB HIS A 77 -23.152 -26.443 -9.322 1.00 52.13 C ATOM 1187 CG HIS A 77 -23.271 -25.061 -8.759 1.00 61.11 C ATOM 1188 ND1 HIS A 77 -23.805 -24.032 -9.492 1.00 44.11 N ATOM 1189 CD2 HIS A 77 -22.914 -24.598 -7.538 1.00 62.34 C ATOM 1190 CE1 HIS A 77 -23.766 -22.971 -8.710 1.00 33.03 C ATOM 1191 NE2 HIS A 77 -23.233 -23.264 -7.513 1.00 31.05 N ATOM 0 H HIS A 77 -23.278 -28.912 -9.648 1.00 54.41 H new ATOM 0 HA HIS A 77 -25.034 -26.958 -8.429 1.00 40.14 H new ATOM 0 HB2 HIS A 77 -22.412 -26.998 -8.746 1.00 52.13 H new ATOM 0 HB3 HIS A 77 -22.778 -26.378 -10.344 1.00 52.13 H new ATOM 0 HD2 HIS A 77 -22.465 -25.168 -6.738 1.00 62.34 H new ATOM 0 HE1 HIS A 77 -24.118 -21.991 -8.996 1.00 33.03 H new ATOM 0 HE2 HIS A 77 -23.092 -22.619 -6.735 1.00 31.05 H new ATOM 1199 N LYS A 78 -25.861 -25.662 -10.535 1.00 1.15 N ATOM 1200 CA LYS A 78 -26.772 -25.231 -11.577 1.00 64.04 C ATOM 1201 C LYS A 78 -26.553 -23.756 -11.897 1.00 30.44 C ATOM 1202 O LYS A 78 -26.849 -22.884 -11.078 1.00 71.13 O ATOM 1203 CB LYS A 78 -28.220 -25.458 -11.130 1.00 53.04 C ATOM 1204 CG LYS A 78 -29.262 -25.073 -12.171 1.00 32.51 C ATOM 1205 CD LYS A 78 -29.160 -25.941 -13.416 1.00 14.33 C ATOM 1206 CE LYS A 78 -29.463 -27.401 -13.111 1.00 61.22 C ATOM 1207 NZ LYS A 78 -30.861 -27.599 -12.642 1.00 23.35 N ATOM 0 H LYS A 78 -25.695 -24.966 -9.809 1.00 1.15 H new ATOM 0 HA LYS A 78 -26.578 -25.817 -12.476 1.00 64.04 H new ATOM 0 HB2 LYS A 78 -28.349 -26.510 -10.875 1.00 53.04 H new ATOM 0 HB3 LYS A 78 -28.402 -24.885 -10.221 1.00 53.04 H new ATOM 0 HG2 LYS A 78 -30.259 -25.169 -11.741 1.00 32.51 H new ATOM 0 HG3 LYS A 78 -29.133 -24.026 -12.446 1.00 32.51 H new ATOM 0 HD2 LYS A 78 -29.855 -25.576 -14.172 1.00 14.33 H new ATOM 0 HD3 LYS A 78 -28.158 -25.858 -13.837 1.00 14.33 H new ATOM 0 HE2 LYS A 78 -29.294 -28.000 -14.006 1.00 61.22 H new ATOM 0 HE3 LYS A 78 -28.772 -27.762 -12.350 1.00 61.22 H new ATOM 0 HZ1 LYS A 78 -31.086 -28.614 -12.641 1.00 23.35 H new ATOM 0 HZ2 LYS A 78 -30.961 -27.221 -11.678 1.00 23.35 H new ATOM 0 HZ3 LYS A 78 -31.515 -27.100 -13.279 1.00 23.35 H new ATOM 1221 N VAL A 79 -26.023 -23.484 -13.079 1.00 34.24 N ATOM 1222 CA VAL A 79 -25.848 -22.115 -13.544 1.00 14.35 C ATOM 1223 C VAL A 79 -26.188 -22.030 -15.027 1.00 74.13 C ATOM 1224 O VAL A 79 -25.721 -22.846 -15.823 1.00 53.33 O ATOM 1225 CB VAL A 79 -24.415 -21.584 -13.275 1.00 75.11 C ATOM 1226 CG1 VAL A 79 -23.368 -22.611 -13.658 1.00 62.03 C ATOM 1227 CG2 VAL A 79 -24.168 -20.269 -14.007 1.00 35.01 C ATOM 0 H VAL A 79 -25.705 -24.196 -13.737 1.00 34.24 H new ATOM 0 HA VAL A 79 -26.529 -21.478 -12.980 1.00 14.35 H new ATOM 0 HB VAL A 79 -24.331 -21.398 -12.204 1.00 75.11 H new ATOM 0 HG11 VAL A 79 -22.374 -22.210 -13.458 1.00 62.03 H new ATOM 0 HG12 VAL A 79 -23.517 -23.518 -13.073 1.00 62.03 H new ATOM 0 HG13 VAL A 79 -23.458 -22.844 -14.719 1.00 62.03 H new ATOM 0 HG21 VAL A 79 -23.156 -19.922 -13.799 1.00 35.01 H new ATOM 0 HG22 VAL A 79 -24.286 -20.422 -15.080 1.00 35.01 H new ATOM 0 HG23 VAL A 79 -24.885 -19.522 -13.666 1.00 35.01 H new ATOM 1237 N ASP A 80 -27.050 -21.071 -15.377 1.00 34.21 N ATOM 1238 CA ASP A 80 -27.527 -20.893 -16.754 1.00 51.31 C ATOM 1239 C ASP A 80 -28.405 -22.079 -17.166 1.00 33.13 C ATOM 1240 O ASP A 80 -28.664 -22.310 -18.345 1.00 62.24 O ATOM 1241 CB ASP A 80 -26.344 -20.723 -17.725 1.00 63.25 C ATOM 1242 CG ASP A 80 -26.777 -20.315 -19.119 1.00 30.20 C ATOM 1243 OD1 ASP A 80 -27.324 -19.202 -19.271 1.00 71.21 O ATOM 1244 OD2 ASP A 80 -26.565 -21.096 -20.068 1.00 3.24 O ATOM 0 H ASP A 80 -27.437 -20.397 -14.716 1.00 34.21 H new ATOM 0 HA ASP A 80 -28.129 -19.985 -16.798 1.00 51.31 H new ATOM 0 HB2 ASP A 80 -25.660 -19.972 -17.328 1.00 63.25 H new ATOM 0 HB3 ASP A 80 -25.790 -21.660 -17.782 1.00 63.25 H new ATOM 1249 N GLY A 81 -28.888 -22.818 -16.173 1.00 23.45 N ATOM 1250 CA GLY A 81 -29.661 -24.016 -16.441 1.00 10.04 C ATOM 1251 C GLY A 81 -28.769 -25.198 -16.757 1.00 42.13 C ATOM 1252 O GLY A 81 -29.244 -26.278 -17.109 1.00 31.31 O ATOM 0 H GLY A 81 -28.757 -22.607 -15.184 1.00 23.45 H new ATOM 0 HA2 GLY A 81 -30.282 -24.250 -15.576 1.00 10.04 H new ATOM 0 HA3 GLY A 81 -30.335 -23.835 -17.278 1.00 10.04 H new ATOM 1256 N ARG A 82 -27.473 -24.990 -16.609 1.00 3.20 N ATOM 1257 CA ARG A 82 -26.488 -26.000 -16.931 1.00 41.42 C ATOM 1258 C ARG A 82 -25.952 -26.634 -15.656 1.00 14.21 C ATOM 1259 O ARG A 82 -25.532 -25.932 -14.735 1.00 13.11 O ATOM 1260 CB ARG A 82 -25.349 -25.361 -17.734 1.00 52.14 C ATOM 1261 CG ARG A 82 -24.276 -26.334 -18.190 1.00 43.20 C ATOM 1262 CD ARG A 82 -24.865 -27.475 -18.998 1.00 22.22 C ATOM 1263 NE ARG A 82 -25.572 -27.002 -20.187 1.00 55.54 N ATOM 1264 CZ ARG A 82 -26.364 -27.772 -20.933 1.00 75.12 C ATOM 1265 NH1 ARG A 82 -26.547 -29.047 -20.605 1.00 24.10 N ATOM 1266 NH2 ARG A 82 -26.975 -27.267 -21.999 1.00 61.02 N ATOM 0 H ARG A 82 -27.077 -24.116 -16.262 1.00 3.20 H new ATOM 0 HA ARG A 82 -26.952 -26.782 -17.532 1.00 41.42 H new ATOM 0 HB2 ARG A 82 -25.771 -24.869 -18.610 1.00 52.14 H new ATOM 0 HB3 ARG A 82 -24.883 -24.585 -17.126 1.00 52.14 H new ATOM 0 HG2 ARG A 82 -23.536 -25.805 -18.791 1.00 43.20 H new ATOM 0 HG3 ARG A 82 -23.754 -26.734 -17.321 1.00 43.20 H new ATOM 0 HD2 ARG A 82 -24.068 -28.155 -19.298 1.00 22.22 H new ATOM 0 HD3 ARG A 82 -25.551 -28.045 -18.372 1.00 22.22 H new ATOM 0 HE ARG A 82 -25.452 -26.027 -20.461 1.00 55.54 H new ATOM 0 HH11 ARG A 82 -26.082 -29.434 -19.784 1.00 24.10 H new ATOM 0 HH12 ARG A 82 -27.153 -29.638 -21.174 1.00 24.10 H new ATOM 0 HH21 ARG A 82 -26.839 -26.287 -22.249 1.00 61.02 H new ATOM 0 HH22 ARG A 82 -27.580 -27.859 -22.568 1.00 61.02 H new ATOM 1280 N VAL A 83 -25.995 -27.958 -15.594 1.00 10.44 N ATOM 1281 CA VAL A 83 -25.442 -28.679 -14.459 1.00 45.02 C ATOM 1282 C VAL A 83 -23.926 -28.734 -14.576 1.00 72.11 C ATOM 1283 O VAL A 83 -23.381 -29.438 -15.427 1.00 74.14 O ATOM 1284 CB VAL A 83 -25.999 -30.113 -14.356 1.00 62.22 C ATOM 1285 CG1 VAL A 83 -25.390 -30.840 -13.168 1.00 30.13 C ATOM 1286 CG2 VAL A 83 -27.514 -30.102 -14.253 1.00 43.11 C ATOM 0 H VAL A 83 -26.406 -28.552 -16.314 1.00 10.44 H new ATOM 0 HA VAL A 83 -25.733 -28.142 -13.556 1.00 45.02 H new ATOM 0 HB VAL A 83 -25.725 -30.647 -15.266 1.00 62.22 H new ATOM 0 HG11 VAL A 83 -25.796 -31.850 -13.113 1.00 30.13 H new ATOM 0 HG12 VAL A 83 -24.308 -30.890 -13.288 1.00 30.13 H new ATOM 0 HG13 VAL A 83 -25.629 -30.302 -12.251 1.00 30.13 H new ATOM 0 HG21 VAL A 83 -27.881 -31.126 -14.182 1.00 43.11 H new ATOM 0 HG22 VAL A 83 -27.814 -29.546 -13.365 1.00 43.11 H new ATOM 0 HG23 VAL A 83 -27.935 -29.626 -15.139 1.00 43.11 H new ATOM 1296 N VAL A 84 -23.251 -27.978 -13.733 1.00 42.35 N ATOM 1297 CA VAL A 84 -21.805 -27.880 -13.798 1.00 44.45 C ATOM 1298 C VAL A 84 -21.155 -28.641 -12.658 1.00 3.13 C ATOM 1299 O VAL A 84 -21.836 -29.137 -11.755 1.00 12.14 O ATOM 1300 CB VAL A 84 -21.338 -26.412 -13.758 1.00 1.22 C ATOM 1301 CG1 VAL A 84 -21.893 -25.648 -14.947 1.00 32.11 C ATOM 1302 CG2 VAL A 84 -21.754 -25.746 -12.454 1.00 71.15 C ATOM 0 H VAL A 84 -23.681 -27.422 -12.994 1.00 42.35 H new ATOM 0 HA VAL A 84 -21.499 -28.322 -14.746 1.00 44.45 H new ATOM 0 HB VAL A 84 -20.249 -26.398 -13.813 1.00 1.22 H new ATOM 0 HG11 VAL A 84 -21.554 -24.613 -14.905 1.00 32.11 H new ATOM 0 HG12 VAL A 84 -21.541 -26.107 -15.871 1.00 32.11 H new ATOM 0 HG13 VAL A 84 -22.982 -25.675 -14.920 1.00 32.11 H new ATOM 0 HG21 VAL A 84 -21.413 -24.711 -12.449 1.00 71.15 H new ATOM 0 HG22 VAL A 84 -22.840 -25.771 -12.363 1.00 71.15 H new ATOM 0 HG23 VAL A 84 -21.307 -26.279 -11.615 1.00 71.15 H new ATOM 1312 N GLU A 85 -19.840 -28.731 -12.702 1.00 61.01 N ATOM 1313 CA GLU A 85 -19.089 -29.412 -11.667 1.00 12.23 C ATOM 1314 C GLU A 85 -18.009 -28.493 -11.117 1.00 53.34 C ATOM 1315 O GLU A 85 -17.021 -28.206 -11.793 1.00 33.32 O ATOM 1316 CB GLU A 85 -18.470 -30.696 -12.216 1.00 72.32 C ATOM 1317 CG GLU A 85 -17.657 -31.465 -11.192 1.00 15.03 C ATOM 1318 CD GLU A 85 -17.126 -32.766 -11.742 1.00 43.51 C ATOM 1319 OE1 GLU A 85 -16.107 -32.742 -12.461 1.00 40.13 O ATOM 1320 OE2 GLU A 85 -17.728 -33.822 -11.457 1.00 21.41 O ATOM 0 H GLU A 85 -19.267 -28.338 -13.449 1.00 61.01 H new ATOM 0 HA GLU A 85 -19.768 -29.678 -10.857 1.00 12.23 H new ATOM 0 HB2 GLU A 85 -19.264 -31.339 -12.594 1.00 72.32 H new ATOM 0 HB3 GLU A 85 -17.830 -30.448 -13.063 1.00 72.32 H new ATOM 0 HG2 GLU A 85 -16.824 -30.848 -10.856 1.00 15.03 H new ATOM 0 HG3 GLU A 85 -18.276 -31.668 -10.318 1.00 15.03 H new ATOM 1327 N PRO A 86 -18.207 -27.994 -9.893 1.00 34.02 N ATOM 1328 CA PRO A 86 -17.269 -27.105 -9.240 1.00 63.32 C ATOM 1329 C PRO A 86 -16.226 -27.864 -8.422 1.00 75.51 C ATOM 1330 O PRO A 86 -16.561 -28.615 -7.502 1.00 20.21 O ATOM 1331 CB PRO A 86 -18.170 -26.255 -8.336 1.00 14.13 C ATOM 1332 CG PRO A 86 -19.486 -26.978 -8.236 1.00 33.11 C ATOM 1333 CD PRO A 86 -19.373 -28.243 -9.045 1.00 23.32 C ATOM 0 HA PRO A 86 -16.687 -26.518 -9.950 1.00 63.32 H new ATOM 0 HB2 PRO A 86 -17.722 -26.129 -7.351 1.00 14.13 H new ATOM 0 HB3 PRO A 86 -18.307 -25.258 -8.754 1.00 14.13 H new ATOM 0 HG2 PRO A 86 -19.719 -27.208 -7.196 1.00 33.11 H new ATOM 0 HG3 PRO A 86 -20.296 -26.353 -8.613 1.00 33.11 H new ATOM 0 HD2 PRO A 86 -19.229 -29.116 -8.409 1.00 23.32 H new ATOM 0 HD3 PRO A 86 -20.270 -28.424 -9.637 1.00 23.32 H new ATOM 1341 N LYS A 87 -14.962 -27.673 -8.770 1.00 51.12 N ATOM 1342 CA LYS A 87 -13.865 -28.352 -8.091 1.00 1.23 C ATOM 1343 C LYS A 87 -12.808 -27.347 -7.647 1.00 1.34 C ATOM 1344 O LYS A 87 -12.752 -26.238 -8.171 1.00 12.45 O ATOM 1345 CB LYS A 87 -13.245 -29.399 -9.020 1.00 63.30 C ATOM 1346 CG LYS A 87 -14.236 -30.461 -9.472 1.00 61.22 C ATOM 1347 CD LYS A 87 -13.594 -31.488 -10.388 1.00 60.13 C ATOM 1348 CE LYS A 87 -13.062 -30.852 -11.663 1.00 20.33 C ATOM 1349 NZ LYS A 87 -12.531 -31.871 -12.605 1.00 44.32 N ATOM 0 H LYS A 87 -14.668 -27.050 -9.523 1.00 51.12 H new ATOM 0 HA LYS A 87 -14.257 -28.852 -7.205 1.00 1.23 H new ATOM 0 HB2 LYS A 87 -12.833 -28.899 -9.897 1.00 63.30 H new ATOM 0 HB3 LYS A 87 -12.413 -29.882 -8.508 1.00 63.30 H new ATOM 0 HG2 LYS A 87 -14.651 -30.964 -8.599 1.00 61.22 H new ATOM 0 HG3 LYS A 87 -15.068 -29.983 -9.990 1.00 61.22 H new ATOM 0 HD2 LYS A 87 -12.779 -31.985 -9.862 1.00 60.13 H new ATOM 0 HD3 LYS A 87 -14.325 -32.256 -10.642 1.00 60.13 H new ATOM 0 HE2 LYS A 87 -13.859 -30.288 -12.148 1.00 20.33 H new ATOM 0 HE3 LYS A 87 -12.274 -30.141 -11.414 1.00 20.33 H new ATOM 0 HZ1 LYS A 87 -12.177 -31.400 -13.462 1.00 44.32 H new ATOM 0 HZ2 LYS A 87 -11.754 -32.392 -12.151 1.00 44.32 H new ATOM 0 HZ3 LYS A 87 -13.289 -32.535 -12.862 1.00 44.32 H new ATOM 1363 N ARG A 88 -11.989 -27.728 -6.669 1.00 61.52 N ATOM 1364 CA ARG A 88 -10.920 -26.863 -6.177 1.00 13.20 C ATOM 1365 C ARG A 88 -9.969 -26.524 -7.316 1.00 32.22 C ATOM 1366 O ARG A 88 -9.437 -27.421 -7.977 1.00 70.31 O ATOM 1367 CB ARG A 88 -10.147 -27.542 -5.039 1.00 25.00 C ATOM 1368 CG ARG A 88 -9.992 -26.682 -3.789 1.00 62.55 C ATOM 1369 CD ARG A 88 -11.337 -26.436 -3.128 1.00 33.02 C ATOM 1370 NE ARG A 88 -11.237 -25.741 -1.843 1.00 45.25 N ATOM 1371 CZ ARG A 88 -12.031 -26.000 -0.798 1.00 71.53 C ATOM 1372 NH1 ARG A 88 -12.895 -27.009 -0.848 1.00 11.50 N ATOM 1373 NH2 ARG A 88 -11.946 -25.270 0.306 1.00 52.12 N ATOM 0 H ARG A 88 -12.046 -28.632 -6.201 1.00 61.52 H new ATOM 0 HA ARG A 88 -11.367 -25.947 -5.790 1.00 13.20 H new ATOM 0 HB2 ARG A 88 -10.657 -28.467 -4.769 1.00 25.00 H new ATOM 0 HB3 ARG A 88 -9.157 -27.818 -5.402 1.00 25.00 H new ATOM 0 HG2 ARG A 88 -9.321 -27.175 -3.085 1.00 62.55 H new ATOM 0 HG3 ARG A 88 -9.533 -25.729 -4.053 1.00 62.55 H new ATOM 0 HD2 ARG A 88 -11.962 -25.850 -3.802 1.00 33.02 H new ATOM 0 HD3 ARG A 88 -11.839 -27.392 -2.977 1.00 33.02 H new ATOM 0 HE ARG A 88 -10.523 -25.020 -1.739 1.00 45.25 H new ATOM 0 HH11 ARG A 88 -12.954 -27.589 -1.685 1.00 11.50 H new ATOM 0 HH12 ARG A 88 -13.499 -27.203 -0.049 1.00 11.50 H new ATOM 0 HH21 ARG A 88 -11.272 -24.506 0.362 1.00 52.12 H new ATOM 0 HH22 ARG A 88 -12.554 -25.472 1.099 1.00 52.12 H new ATOM 1387 N ALA A 89 -9.777 -25.237 -7.550 1.00 64.04 N ATOM 1388 CA ALA A 89 -8.959 -24.777 -8.656 1.00 54.54 C ATOM 1389 C ALA A 89 -7.480 -25.045 -8.412 1.00 44.43 C ATOM 1390 O ALA A 89 -7.047 -25.242 -7.277 1.00 4.32 O ATOM 1391 CB ALA A 89 -9.193 -23.296 -8.900 1.00 63.43 C ATOM 0 H ALA A 89 -10.180 -24.490 -6.985 1.00 64.04 H new ATOM 0 HA ALA A 89 -9.254 -25.338 -9.543 1.00 54.54 H new ATOM 0 HB1 ALA A 89 -8.574 -22.962 -9.732 1.00 63.43 H new ATOM 0 HB2 ALA A 89 -10.243 -23.128 -9.139 1.00 63.43 H new ATOM 0 HB3 ALA A 89 -8.930 -22.734 -8.004 1.00 63.43 H new ATOM 1397 N VAL A 90 -6.717 -25.066 -9.493 1.00 12.22 N ATOM 1398 CA VAL A 90 -5.275 -25.217 -9.421 1.00 30.34 C ATOM 1399 C VAL A 90 -4.619 -23.900 -9.806 1.00 4.31 C ATOM 1400 O VAL A 90 -5.111 -23.203 -10.680 1.00 2.01 O ATOM 1401 CB VAL A 90 -4.771 -26.334 -10.361 1.00 42.01 C ATOM 1402 CG1 VAL A 90 -3.276 -26.551 -10.189 1.00 11.34 C ATOM 1403 CG2 VAL A 90 -5.534 -27.627 -10.121 1.00 44.20 C ATOM 0 H VAL A 90 -7.080 -24.979 -10.442 1.00 12.22 H new ATOM 0 HA VAL A 90 -5.011 -25.493 -8.400 1.00 30.34 H new ATOM 0 HB VAL A 90 -4.952 -26.019 -11.389 1.00 42.01 H new ATOM 0 HG11 VAL A 90 -2.943 -27.342 -10.861 1.00 11.34 H new ATOM 0 HG12 VAL A 90 -2.745 -25.628 -10.424 1.00 11.34 H new ATOM 0 HG13 VAL A 90 -3.066 -26.838 -9.159 1.00 11.34 H new ATOM 0 HG21 VAL A 90 -5.162 -28.399 -10.794 1.00 44.20 H new ATOM 0 HG22 VAL A 90 -5.393 -27.947 -9.089 1.00 44.20 H new ATOM 0 HG23 VAL A 90 -6.595 -27.463 -10.308 1.00 44.20 H new ATOM 1413 N SER A 91 -3.530 -23.545 -9.155 1.00 65.45 N ATOM 1414 CA SER A 91 -2.855 -22.300 -9.474 1.00 23.34 C ATOM 1415 C SER A 91 -2.299 -22.352 -10.893 1.00 52.15 C ATOM 1416 O SER A 91 -1.797 -23.385 -11.333 1.00 31.21 O ATOM 1417 CB SER A 91 -1.727 -22.020 -8.479 1.00 1.25 C ATOM 1418 OG SER A 91 -1.073 -20.801 -8.791 1.00 75.40 O ATOM 0 H SER A 91 -3.097 -24.092 -8.411 1.00 65.45 H new ATOM 0 HA SER A 91 -3.582 -21.491 -9.405 1.00 23.34 H new ATOM 0 HB2 SER A 91 -2.131 -21.973 -7.468 1.00 1.25 H new ATOM 0 HB3 SER A 91 -1.008 -22.839 -8.497 1.00 1.25 H new ATOM 0 HG SER A 91 -0.468 -20.558 -8.059 1.00 75.40 H new ATOM 1424 N ARG A 92 -2.390 -21.236 -11.610 1.00 0.42 N ATOM 1425 CA ARG A 92 -1.815 -21.143 -12.951 1.00 22.31 C ATOM 1426 C ARG A 92 -0.291 -21.167 -12.862 1.00 63.12 C ATOM 1427 O ARG A 92 0.406 -21.318 -13.865 1.00 1.02 O ATOM 1428 CB ARG A 92 -2.289 -19.872 -13.680 1.00 61.43 C ATOM 1429 CG ARG A 92 -2.006 -18.579 -12.928 1.00 71.34 C ATOM 1430 CD ARG A 92 -3.218 -18.108 -12.135 1.00 11.12 C ATOM 1431 NE ARG A 92 -2.860 -17.099 -11.141 1.00 1.31 N ATOM 1432 CZ ARG A 92 -3.738 -16.457 -10.370 1.00 21.52 C ATOM 1433 NH1 ARG A 92 -5.044 -16.628 -10.548 1.00 44.13 N ATOM 1434 NH2 ARG A 92 -3.306 -15.625 -9.434 1.00 75.31 N ATOM 0 H ARG A 92 -2.854 -20.386 -11.288 1.00 0.42 H new ATOM 0 HA ARG A 92 -2.157 -22.002 -13.529 1.00 22.31 H new ATOM 0 HB2 ARG A 92 -1.806 -19.825 -14.656 1.00 61.43 H new ATOM 0 HB3 ARG A 92 -3.362 -19.948 -13.859 1.00 61.43 H new ATOM 0 HG2 ARG A 92 -1.165 -18.729 -12.251 1.00 71.34 H new ATOM 0 HG3 ARG A 92 -1.711 -17.804 -13.636 1.00 71.34 H new ATOM 0 HD2 ARG A 92 -3.961 -17.697 -12.818 1.00 11.12 H new ATOM 0 HD3 ARG A 92 -3.680 -18.961 -11.637 1.00 11.12 H new ATOM 0 HE ARG A 92 -1.872 -16.870 -11.029 1.00 1.31 H new ATOM 0 HH11 ARG A 92 -5.381 -17.254 -11.279 1.00 44.13 H new ATOM 0 HH12 ARG A 92 -5.709 -16.133 -9.954 1.00 44.13 H new ATOM 0 HH21 ARG A 92 -2.305 -15.478 -9.305 1.00 75.31 H new ATOM 0 HH22 ARG A 92 -3.974 -15.132 -8.842 1.00 75.31 H new ATOM 1448 N GLU A 93 0.208 -21.023 -11.643 1.00 72.34 N ATOM 1449 CA GLU A 93 1.631 -21.108 -11.363 1.00 43.13 C ATOM 1450 C GLU A 93 2.053 -22.567 -11.230 1.00 72.50 C ATOM 1451 O GLU A 93 3.229 -22.903 -11.358 1.00 73.45 O ATOM 1452 CB GLU A 93 1.935 -20.355 -10.072 1.00 20.44 C ATOM 1453 CG GLU A 93 1.507 -18.899 -10.117 1.00 52.31 C ATOM 1454 CD GLU A 93 1.594 -18.215 -8.770 1.00 12.45 C ATOM 1455 OE1 GLU A 93 0.674 -18.398 -7.944 1.00 63.05 O ATOM 1456 OE2 GLU A 93 2.566 -17.469 -8.540 1.00 43.33 O ATOM 0 H GLU A 93 -0.366 -20.843 -10.819 1.00 72.34 H new ATOM 0 HA GLU A 93 2.189 -20.659 -12.185 1.00 43.13 H new ATOM 0 HB2 GLU A 93 1.431 -20.850 -9.242 1.00 20.44 H new ATOM 0 HB3 GLU A 93 3.005 -20.407 -9.871 1.00 20.44 H new ATOM 0 HG2 GLU A 93 2.133 -18.364 -10.831 1.00 52.31 H new ATOM 0 HG3 GLU A 93 0.482 -18.838 -10.484 1.00 52.31 H new ATOM 1463 N ASP A 94 1.072 -23.423 -10.970 1.00 23.24 N ATOM 1464 CA ASP A 94 1.304 -24.853 -10.801 1.00 41.14 C ATOM 1465 C ASP A 94 0.823 -25.623 -12.023 1.00 14.01 C ATOM 1466 O ASP A 94 1.157 -26.795 -12.212 1.00 0.24 O ATOM 1467 CB ASP A 94 0.571 -25.362 -9.558 1.00 70.04 C ATOM 1468 CG ASP A 94 1.222 -24.929 -8.264 1.00 73.33 C ATOM 1469 OD1 ASP A 94 1.067 -23.751 -7.881 1.00 55.01 O ATOM 1470 OD2 ASP A 94 1.879 -25.768 -7.612 1.00 73.52 O ATOM 0 H ASP A 94 0.095 -23.147 -10.870 1.00 23.24 H new ATOM 0 HA ASP A 94 2.376 -25.013 -10.682 1.00 41.14 H new ATOM 0 HB2 ASP A 94 -0.458 -25.002 -9.578 1.00 70.04 H new ATOM 0 HB3 ASP A 94 0.529 -26.451 -9.589 1.00 70.04 H new ATOM 1475 N SER A 95 0.020 -24.959 -12.838 1.00 22.13 N ATOM 1476 CA SER A 95 -0.520 -25.561 -14.044 1.00 61.31 C ATOM 1477 C SER A 95 0.451 -25.402 -15.205 1.00 55.34 C ATOM 1478 O SER A 95 1.017 -24.325 -15.412 1.00 42.31 O ATOM 1479 CB SER A 95 -1.869 -24.924 -14.393 1.00 75.51 C ATOM 1480 OG SER A 95 -2.398 -25.457 -15.598 1.00 45.00 O ATOM 0 H SER A 95 -0.274 -23.995 -12.683 1.00 22.13 H new ATOM 0 HA SER A 95 -0.667 -26.625 -13.862 1.00 61.31 H new ATOM 0 HB2 SER A 95 -2.574 -25.092 -13.579 1.00 75.51 H new ATOM 0 HB3 SER A 95 -1.749 -23.845 -14.493 1.00 75.51 H new ATOM 0 HG SER A 95 -2.491 -24.740 -16.260 1.00 45.00 H new ATOM 1486 N GLN A 96 0.652 -26.483 -15.947 1.00 12.11 N ATOM 1487 CA GLN A 96 1.496 -26.451 -17.132 1.00 44.23 C ATOM 1488 C GLN A 96 0.838 -25.617 -18.226 1.00 20.54 C ATOM 1489 O GLN A 96 1.515 -24.926 -18.988 1.00 62.10 O ATOM 1490 CB GLN A 96 1.752 -27.869 -17.649 1.00 62.43 C ATOM 1491 CG GLN A 96 2.454 -28.774 -16.648 1.00 5.22 C ATOM 1492 CD GLN A 96 2.677 -30.176 -17.188 1.00 13.05 C ATOM 1493 OE1 GLN A 96 2.852 -30.288 -18.497 1.00 25.04 O flip ATOM 1494 NE2 GLN A 96 2.697 -31.149 -16.435 1.00 54.54 N flip ATOM 0 H GLN A 96 0.240 -27.395 -15.748 1.00 12.11 H new ATOM 0 HA GLN A 96 2.449 -25.998 -16.860 1.00 44.23 H new ATOM 0 HB2 GLN A 96 0.800 -28.321 -17.927 1.00 62.43 H new ATOM 0 HB3 GLN A 96 2.354 -27.811 -18.556 1.00 62.43 H new ATOM 0 HG2 GLN A 96 3.414 -28.335 -16.378 1.00 5.22 H new ATOM 0 HG3 GLN A 96 1.861 -28.830 -15.735 1.00 5.22 H new ATOM 0 HE21 GLN A 96 2.558 -31.021 -15.433 1.00 54.54 H new ATOM 0 HE22 GLN A 96 2.853 -32.083 -16.813 1.00 54.54 H new ATOM 1503 N ARG A 97 -0.483 -25.681 -18.294 1.00 10.33 N ATOM 1504 CA ARG A 97 -1.233 -24.932 -19.291 1.00 23.12 C ATOM 1505 C ARG A 97 -1.731 -23.626 -18.686 1.00 22.41 C ATOM 1506 O ARG A 97 -1.841 -22.626 -19.423 1.00 24.13 O ATOM 1507 CB ARG A 97 -2.412 -25.754 -19.825 1.00 63.51 C ATOM 1508 CG ARG A 97 -3.554 -25.907 -18.836 1.00 61.11 C ATOM 1509 CD ARG A 97 -4.710 -26.696 -19.430 1.00 20.52 C ATOM 1510 NE ARG A 97 -4.425 -28.127 -19.488 1.00 54.30 N ATOM 1511 CZ ARG A 97 -4.881 -28.944 -20.435 1.00 64.31 C ATOM 1512 NH1 ARG A 97 -5.553 -28.464 -21.477 1.00 3.41 N ATOM 1513 NH2 ARG A 97 -4.645 -30.244 -20.344 1.00 4.15 N ATOM 1514 OXT ARG A 97 -1.972 -23.599 -17.457 1.00 38.30 O ATOM 0 H ARG A 97 -1.059 -26.245 -17.669 1.00 10.33 H new ATOM 0 HA ARG A 97 -0.571 -24.711 -20.128 1.00 23.12 H new ATOM 0 HB2 ARG A 97 -2.790 -25.282 -20.732 1.00 63.51 H new ATOM 0 HB3 ARG A 97 -2.054 -26.744 -20.107 1.00 63.51 H new ATOM 0 HG2 ARG A 97 -3.193 -26.410 -17.939 1.00 61.11 H new ATOM 0 HG3 ARG A 97 -3.905 -24.921 -18.530 1.00 61.11 H new ATOM 0 HD2 ARG A 97 -5.607 -26.529 -18.833 1.00 20.52 H new ATOM 0 HD3 ARG A 97 -4.922 -26.328 -20.434 1.00 20.52 H new ATOM 0 HE ARG A 97 -3.838 -28.527 -18.755 1.00 54.30 H new ATOM 0 HH11 ARG A 97 -5.723 -27.461 -21.556 1.00 3.41 H new ATOM 0 HH12 ARG A 97 -5.898 -29.098 -22.197 1.00 3.41 H new ATOM 0 HH21 ARG A 97 -4.117 -30.612 -19.553 1.00 4.15 H new ATOM 0 HH22 ARG A 97 -4.991 -30.877 -21.065 1.00 4.15 H new TER 1528 ARG A 97 ATOM 1529 O5' U B 1 -18.089 -30.869 -20.954 1.00 63.40 O ATOM 1530 C5' U B 1 -17.057 -29.887 -20.874 1.00 43.23 C ATOM 1531 C4' U B 1 -16.439 -29.624 -22.226 1.00 41.14 C ATOM 1532 O4' U B 1 -17.488 -29.634 -23.230 1.00 11.22 O ATOM 1533 C3' U B 1 -15.762 -28.269 -22.375 1.00 64.34 C ATOM 1534 O3' U B 1 -14.697 -28.326 -23.317 1.00 60.35 O ATOM 1535 C2' U B 1 -16.894 -27.363 -22.843 1.00 21.31 C ATOM 1536 O2' U B 1 -16.424 -26.307 -23.654 1.00 52.11 O ATOM 1537 C1' U B 1 -17.717 -28.320 -23.703 1.00 32.13 C ATOM 1538 N1 U B 1 -19.161 -28.055 -23.657 1.00 41.34 N ATOM 1539 C2 U B 1 -19.853 -28.062 -24.854 1.00 71.43 C ATOM 1540 O2 U B 1 -19.320 -28.291 -25.927 1.00 33.54 O ATOM 1541 N3 U B 1 -21.194 -27.789 -24.749 1.00 4.11 N ATOM 1542 C4 U B 1 -21.899 -27.515 -23.597 1.00 54.42 C ATOM 1543 O4 U B 1 -23.106 -27.277 -23.666 1.00 54.33 O ATOM 1544 C5 U B 1 -21.111 -27.529 -22.403 1.00 62.23 C ATOM 1545 C6 U B 1 -19.801 -27.792 -22.467 1.00 42.23 C ATOM 0 H5' U B 1 -16.287 -30.223 -20.180 1.00 43.23 H new ATOM 0 H5'' U B 1 -17.466 -28.960 -20.473 1.00 43.23 H new ATOM 0 H4' U B 1 -15.685 -30.402 -22.343 1.00 41.14 H new ATOM 0 H3' U B 1 -15.298 -27.914 -21.455 1.00 64.34 H new ATOM 0 H2' U B 1 -17.428 -26.892 -22.017 1.00 21.31 H new ATOM 0 HO2' U B 1 -15.555 -26.550 -24.037 1.00 52.11 H new ATOM 0 HO5' U B 1 -18.472 -30.868 -21.856 1.00 63.40 H new ATOM 0 H1' U B 1 -17.402 -28.185 -24.738 1.00 32.13 H new ATOM 0 H3 U B 1 -21.727 -27.789 -25.619 1.00 4.11 H new ATOM 0 H5 U B 1 -21.574 -27.327 -21.449 1.00 62.23 H new ATOM 0 H6 U B 1 -19.225 -27.798 -21.553 1.00 42.23 H new ATOM 1557 P U B 2 -13.207 -27.926 -22.862 1.00 33.43 P ATOM 1558 OP1 U B 2 -13.123 -26.445 -22.877 1.00 38.30 O ATOM 1559 OP2 U B 2 -12.244 -28.721 -23.666 1.00 38.30 O ATOM 1560 O5' U B 2 -13.112 -28.414 -21.347 1.00 55.22 O ATOM 1561 C5' U B 2 -13.922 -27.823 -20.334 1.00 22.31 C ATOM 1562 C4' U B 2 -13.173 -27.750 -19.025 1.00 21.25 C ATOM 1563 O4' U B 2 -14.116 -27.988 -17.947 1.00 30.43 O ATOM 1564 C3' U B 2 -12.062 -28.780 -18.839 1.00 2.30 C ATOM 1565 O3' U B 2 -10.944 -28.207 -18.174 1.00 20.10 O ATOM 1566 C2' U B 2 -12.710 -29.871 -17.995 1.00 62.04 C ATOM 1567 O2' U B 2 -11.775 -30.533 -17.168 1.00 35.13 O ATOM 1568 C1' U B 2 -13.647 -29.037 -17.128 1.00 2.31 C ATOM 1569 N1 U B 2 -14.802 -29.790 -16.625 1.00 40.52 N ATOM 1570 C2 U B 2 -14.901 -30.005 -15.261 1.00 3.52 C ATOM 1571 O2 U B 2 -14.069 -29.610 -14.462 1.00 63.13 O ATOM 1572 N3 U B 2 -16.011 -30.708 -14.866 1.00 55.13 N ATOM 1573 C4 U B 2 -17.008 -31.207 -15.677 1.00 43.51 C ATOM 1574 O4 U B 2 -17.951 -31.819 -15.172 1.00 21.14 O ATOM 1575 C5 U B 2 -16.829 -30.943 -17.071 1.00 23.10 C ATOM 1576 C6 U B 2 -15.757 -30.263 -17.490 1.00 21.23 C ATOM 0 H5' U B 2 -14.834 -28.406 -20.205 1.00 22.31 H new ATOM 0 H5'' U B 2 -14.225 -26.822 -20.642 1.00 22.31 H new ATOM 0 H4' U B 2 -12.709 -26.764 -19.022 1.00 21.25 H new ATOM 0 H3' U B 2 -11.677 -29.161 -19.785 1.00 2.30 H new ATOM 0 H2' U B 2 -13.177 -30.657 -18.589 1.00 62.04 H new ATOM 0 HO2' U B 2 -10.943 -30.016 -17.135 1.00 35.13 H new ATOM 0 H1' U B 2 -13.098 -28.693 -16.251 1.00 2.31 H new ATOM 0 H3 U B 2 -16.109 -30.880 -13.865 1.00 55.13 H new ATOM 0 H5 U B 2 -17.560 -31.293 -17.785 1.00 23.10 H new ATOM 0 H6 U B 2 -15.638 -30.079 -18.548 1.00 21.23 H new ATOM 1587 P A B 3 -9.719 -27.613 -19.027 1.00 44.24 P ATOM 1588 OP1 A B 3 -10.242 -27.227 -20.364 1.00 38.30 O ATOM 1589 OP2 A B 3 -8.586 -28.568 -18.931 1.00 38.30 O ATOM 1590 O5' A B 3 -9.314 -26.286 -18.243 1.00 54.53 O ATOM 1591 C5' A B 3 -9.811 -25.010 -18.638 1.00 72.22 C ATOM 1592 C4' A B 3 -9.029 -23.914 -17.954 1.00 75.41 C ATOM 1593 O4' A B 3 -9.071 -24.145 -16.522 1.00 14.11 O ATOM 1594 C3' A B 3 -7.544 -23.882 -18.286 1.00 21.30 C ATOM 1595 O3' A B 3 -6.989 -22.594 -18.045 1.00 24.24 O ATOM 1596 C2' A B 3 -6.983 -24.921 -17.327 1.00 63.11 C ATOM 1597 O2' A B 3 -5.617 -24.703 -17.044 1.00 10.25 O ATOM 1598 C1' A B 3 -7.810 -24.610 -16.081 1.00 51.10 C ATOM 1599 N9 A B 3 -8.027 -25.762 -15.210 1.00 53.43 N ATOM 1600 C8 A B 3 -8.019 -27.094 -15.542 1.00 41.52 C ATOM 1601 N7 A B 3 -8.259 -27.891 -14.528 1.00 30.31 N ATOM 1602 C5 A B 3 -8.437 -27.024 -13.458 1.00 2.04 C ATOM 1603 C6 A B 3 -8.722 -27.239 -12.099 1.00 65.32 C ATOM 1604 N6 A B 3 -8.890 -28.447 -11.556 1.00 33.22 N ATOM 1605 N1 A B 3 -8.836 -26.153 -11.305 1.00 24.21 N ATOM 1606 C2 A B 3 -8.674 -24.939 -11.849 1.00 63.42 C ATOM 1607 N3 A B 3 -8.402 -24.612 -13.104 1.00 12.04 N ATOM 1608 C4 A B 3 -8.297 -25.712 -13.866 1.00 42.23 C ATOM 0 H5' A B 3 -10.867 -24.928 -18.382 1.00 72.22 H new ATOM 0 H5'' A B 3 -9.735 -24.901 -19.720 1.00 72.22 H new ATOM 0 H4' A B 3 -9.490 -22.986 -18.293 1.00 75.41 H new ATOM 0 H3' A B 3 -7.321 -24.089 -19.333 1.00 21.30 H new ATOM 0 H2' A B 3 -7.039 -25.942 -17.705 1.00 63.11 H new ATOM 0 HO2' A B 3 -5.285 -25.418 -16.462 1.00 10.25 H new ATOM 0 H1' A B 3 -7.258 -23.876 -15.494 1.00 51.10 H new ATOM 0 H8 A B 3 -7.833 -27.452 -16.544 1.00 41.52 H new ATOM 0 H61 A B 3 -9.095 -28.535 -10.561 1.00 33.22 H new ATOM 0 H62 A B 3 -8.813 -29.282 -12.136 1.00 33.22 H new ATOM 0 H2 A B 3 -8.780 -24.108 -11.167 1.00 63.42 H new ATOM 1620 P G B 4 -5.577 -22.189 -18.698 1.00 44.24 P ATOM 1621 OP1 G B 4 -5.165 -23.295 -19.600 1.00 38.30 O ATOM 1622 OP2 G B 4 -4.666 -21.750 -17.612 1.00 38.30 O ATOM 1623 O5' G B 4 -5.920 -20.925 -19.603 1.00 71.22 O ATOM 1624 C5' G B 4 -7.151 -20.230 -19.441 1.00 30.12 C ATOM 1625 C4' G B 4 -6.985 -19.096 -18.458 1.00 10.44 C ATOM 1626 O4' G B 4 -7.476 -19.516 -17.162 1.00 74.42 O ATOM 1627 C3' G B 4 -5.549 -18.630 -18.209 1.00 32.50 C ATOM 1628 O3' G B 4 -5.391 -17.266 -18.582 1.00 72.04 O ATOM 1629 C2' G B 4 -5.324 -18.824 -16.706 1.00 3.04 C ATOM 1630 O2' G B 4 -4.587 -17.761 -16.134 1.00 5.21 O ATOM 1631 C1' G B 4 -6.764 -18.770 -16.209 1.00 61.45 C ATOM 1632 N9 G B 4 -7.011 -19.334 -14.886 1.00 20.11 N ATOM 1633 C8 G B 4 -7.784 -18.778 -13.895 1.00 21.32 C ATOM 1634 N7 G B 4 -7.920 -19.547 -12.852 1.00 73.11 N ATOM 1635 C5 G B 4 -7.186 -20.680 -13.169 1.00 44.10 C ATOM 1636 C6 G B 4 -6.968 -21.860 -12.422 1.00 72.24 C ATOM 1637 O6 G B 4 -7.414 -22.150 -11.304 1.00 64.40 O ATOM 1638 N1 G B 4 -6.160 -22.766 -13.105 1.00 21.52 N ATOM 1639 C2 G B 4 -5.633 -22.549 -14.356 1.00 5.21 C ATOM 1640 N2 G B 4 -4.846 -23.519 -14.842 1.00 2.45 N ATOM 1641 N3 G B 4 -5.832 -21.452 -15.068 1.00 4.21 N ATOM 1642 C4 G B 4 -6.614 -20.565 -14.418 1.00 40.02 C ATOM 0 H5' G B 4 -7.921 -20.917 -19.089 1.00 30.12 H new ATOM 0 H5'' G B 4 -7.487 -19.841 -20.402 1.00 30.12 H new ATOM 0 H4' G B 4 -7.533 -18.271 -18.913 1.00 10.44 H new ATOM 0 H3' G B 4 -4.825 -19.191 -18.800 1.00 32.50 H new ATOM 0 H2' G B 4 -4.762 -19.725 -16.459 1.00 3.04 H new ATOM 0 HO2' G B 4 -4.142 -17.252 -16.844 1.00 5.21 H new ATOM 0 H1' G B 4 -7.058 -17.726 -16.102 1.00 61.45 H new ATOM 0 H8 G B 4 -8.235 -17.800 -13.973 1.00 21.32 H new ATOM 0 H1 G B 4 -5.945 -23.651 -12.646 1.00 21.52 H new ATOM 0 H21 G B 4 -4.424 -23.419 -15.765 1.00 2.45 H new ATOM 0 H22 G B 4 -4.669 -24.357 -14.289 1.00 2.45 H new ATOM 1654 P G B 5 -5.574 -16.816 -20.116 1.00 22.33 P ATOM 1655 OP1 G B 5 -6.707 -17.585 -20.690 1.00 38.30 O ATOM 1656 OP2 G B 5 -4.243 -16.866 -20.771 1.00 38.30 O ATOM 1657 O5' G B 5 -6.027 -15.293 -20.014 1.00 21.12 O ATOM 1658 C5' G B 5 -6.486 -14.745 -18.781 1.00 44.44 C ATOM 1659 C4' G B 5 -7.790 -14.015 -18.983 1.00 73.43 C ATOM 1660 O4' G B 5 -8.851 -14.799 -18.378 1.00 53.21 O ATOM 1661 C3' G B 5 -7.858 -12.632 -18.343 1.00 4.20 C ATOM 1662 O3' G B 5 -7.790 -11.617 -19.336 1.00 33.30 O ATOM 1663 C2' G B 5 -9.196 -12.595 -17.606 1.00 53.22 C ATOM 1664 O2' G B 5 -10.235 -12.095 -18.424 1.00 62.50 O ATOM 1665 C1' G B 5 -9.447 -14.074 -17.324 1.00 64.20 C ATOM 1666 N9 G B 5 -8.888 -14.537 -16.058 1.00 65.25 N ATOM 1667 C8 G B 5 -8.015 -15.580 -15.877 1.00 11.13 C ATOM 1668 N7 G B 5 -7.716 -15.796 -14.626 1.00 24.44 N ATOM 1669 C5 G B 5 -8.435 -14.832 -13.933 1.00 33.13 C ATOM 1670 C6 G B 5 -8.511 -14.570 -12.541 1.00 21.41 C ATOM 1671 O6 G B 5 -7.956 -15.176 -11.614 1.00 31.43 O ATOM 1672 N1 G B 5 -9.353 -13.498 -12.259 1.00 65.44 N ATOM 1673 C2 G B 5 -10.038 -12.775 -13.208 1.00 54.22 C ATOM 1674 N2 G B 5 -10.812 -11.781 -12.747 1.00 53.32 N ATOM 1675 N3 G B 5 -9.977 -13.008 -14.510 1.00 10.22 N ATOM 1676 C4 G B 5 -9.163 -14.045 -14.801 1.00 50.54 C ATOM 0 H5' G B 5 -5.738 -14.062 -18.379 1.00 44.44 H new ATOM 0 H5'' G B 5 -6.617 -15.541 -18.048 1.00 44.44 H new ATOM 0 H4' G B 5 -7.889 -13.884 -20.061 1.00 73.43 H new ATOM 0 H3' G B 5 -7.023 -12.452 -17.665 1.00 4.20 H new ATOM 0 H2' G B 5 -9.172 -11.953 -16.726 1.00 53.22 H new ATOM 0 HO2' G B 5 -9.850 -11.660 -19.213 1.00 62.50 H new ATOM 0 H1' G B 5 -10.524 -14.227 -17.253 1.00 64.20 H new ATOM 0 H8 G B 5 -7.614 -16.165 -16.691 1.00 11.13 H new ATOM 0 H1 G B 5 -9.470 -13.230 -11.282 1.00 65.44 H new ATOM 0 H21 G B 5 -11.346 -11.207 -13.399 1.00 53.32 H new ATOM 0 H22 G B 5 -10.866 -11.600 -11.745 1.00 53.32 H new ATOM 1688 P U B 6 -6.638 -10.498 -19.259 1.00 1.43 P ATOM 1689 OP1 U B 6 -6.924 -9.649 -18.076 1.00 38.30 O ATOM 1690 OP2 U B 6 -6.509 -9.870 -20.599 1.00 38.30 O ATOM 1691 O5' U B 6 -5.310 -11.326 -18.964 1.00 20.40 O ATOM 1692 C5' U B 6 -4.917 -12.407 -19.804 1.00 62.42 C ATOM 1693 C4' U B 6 -3.519 -12.858 -19.455 1.00 32.10 C ATOM 1694 O4' U B 6 -3.265 -12.566 -18.053 1.00 15.52 O ATOM 1695 C3' U B 6 -3.258 -14.351 -19.615 1.00 15.00 C ATOM 1696 O3' U B 6 -1.923 -14.593 -20.044 1.00 40.45 O ATOM 1697 C2' U B 6 -3.513 -14.908 -18.220 1.00 23.15 C ATOM 1698 O2' U B 6 -2.751 -16.072 -17.967 1.00 51.10 O ATOM 1699 C1' U B 6 -2.994 -13.764 -17.352 1.00 41.21 C ATOM 1700 N1 U B 6 -3.627 -13.689 -16.028 1.00 53.00 N ATOM 1701 C2 U B 6 -2.800 -13.594 -14.924 1.00 10.12 C ATOM 1702 O2 U B 6 -1.581 -13.570 -15.006 1.00 40.41 O ATOM 1703 N3 U B 6 -3.450 -13.533 -13.715 1.00 70.12 N ATOM 1704 C4 U B 6 -4.812 -13.558 -13.504 1.00 4.21 C ATOM 1705 O4 U B 6 -5.248 -13.510 -12.354 1.00 24.12 O ATOM 1706 C5 U B 6 -5.595 -13.656 -14.697 1.00 12.13 C ATOM 1707 C6 U B 6 -4.996 -13.716 -15.891 1.00 24.21 C ATOM 0 H5' U B 6 -4.957 -12.098 -20.849 1.00 62.42 H new ATOM 0 H5'' U B 6 -5.614 -13.237 -19.690 1.00 62.42 H new ATOM 0 H4' U B 6 -2.874 -12.324 -20.153 1.00 32.10 H new ATOM 0 H3' U B 6 -3.889 -14.818 -20.371 1.00 15.00 H new ATOM 0 H2' U B 6 -4.551 -15.197 -18.053 1.00 23.15 H new ATOM 0 HO2' U B 6 -1.962 -16.079 -18.549 1.00 51.10 H new ATOM 0 H1' U B 6 -1.932 -13.928 -17.172 1.00 41.21 H new ATOM 0 H3 U B 6 -2.862 -13.462 -12.885 1.00 70.12 H new ATOM 0 H5 U B 6 -6.673 -13.682 -14.633 1.00 12.13 H new ATOM 0 H6 U B 6 -5.608 -13.788 -16.778 1.00 24.21 H new ATOM 1718 P C B 7 -1.520 -14.328 -21.576 1.00 3.11 P ATOM 1719 OP1 C B 7 -0.133 -14.825 -21.752 1.00 38.30 O ATOM 1720 OP2 C B 7 -1.846 -12.921 -21.909 1.00 38.30 O ATOM 1721 O5' C B 7 -2.497 -15.277 -22.403 1.00 53.12 O ATOM 1722 C5' C B 7 -1.986 -16.188 -23.375 1.00 71.20 C ATOM 1723 C4' C B 7 -1.964 -15.547 -24.743 1.00 14.20 C ATOM 1724 O4' C B 7 -2.947 -16.214 -25.582 1.00 52.13 O ATOM 1725 C3' C B 7 -2.331 -14.067 -24.787 1.00 40.11 C ATOM 1726 O3' C B 7 -1.172 -13.233 -24.712 1.00 71.51 O ATOM 1727 C2' C B 7 -3.035 -13.921 -26.130 1.00 11.04 C ATOM 1728 O2' C B 7 -2.117 -13.821 -27.202 1.00 45.42 O ATOM 1729 C1' C B 7 -3.772 -15.255 -26.212 1.00 52.02 C ATOM 1730 N1 C B 7 -5.085 -15.247 -25.545 1.00 1.20 N ATOM 1731 C2 C B 7 -6.220 -14.915 -26.292 1.00 64.05 C ATOM 1732 O2 C B 7 -6.090 -14.638 -27.495 1.00 50.42 O ATOM 1733 N3 C B 7 -7.429 -14.904 -25.687 1.00 2.30 N ATOM 1734 C4 C B 7 -7.530 -15.205 -24.390 1.00 13.34 C ATOM 1735 N4 C B 7 -8.744 -15.184 -23.836 1.00 32.15 N ATOM 1736 C5 C B 7 -6.390 -15.546 -23.605 1.00 42.11 C ATOM 1737 C6 C B 7 -5.200 -15.554 -24.217 1.00 20.34 C ATOM 0 H5' C B 7 -2.602 -17.087 -23.398 1.00 71.20 H new ATOM 0 H5'' C B 7 -0.979 -16.499 -23.097 1.00 71.20 H new ATOM 0 H4' C B 7 -0.931 -15.644 -25.076 1.00 14.20 H new ATOM 0 H3' C B 7 -2.951 -13.761 -23.945 1.00 40.11 H new ATOM 0 H2' C B 7 -3.658 -13.029 -26.200 1.00 11.04 H new ATOM 0 HO2' C B 7 -1.235 -13.571 -26.855 1.00 45.42 H new ATOM 0 HO3' C B 7 -1.137 -12.800 -23.834 1.00 71.51 H new ATOM 0 H1' C B 7 -3.965 -15.476 -27.262 1.00 52.02 H new ATOM 0 H41 C B 7 -8.857 -15.409 -22.848 1.00 32.15 H new ATOM 0 H42 C B 7 -9.558 -14.943 -24.401 1.00 32.15 H new ATOM 0 H5 C B 7 -6.483 -15.789 -22.557 1.00 42.11 H new ATOM 0 H6 C B 7 -4.315 -15.807 -23.652 1.00 20.34 H new TER 1750 C B 7