USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1030 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 23 SER OG : rot 75:sc= -0.382 USER MOD Set 1.2: B 74 LYS NZ :NH3+ -148:sc= 0.93 (180deg=0.14) USER MOD Set 2.1: B 20 THR OG1 : rot 59:sc= -2.15! USER MOD Set 2.2: B 68 SER OG : rot 75:sc= -3.11! USER MOD Set 3.1: A 38 SER OG : rot -63:sc= 0.133 USER MOD Set 3.2: B 40 SER OG : rot 75:sc= 0.29 USER MOD Set 4.1: B 21 GLN :FLIP amide:sc= -2.65! C(o=-4.9!,f=-1.9!) USER MOD Set 4.2: B 24 SER OG : rot 108:sc= 0.711 USER MOD Set 5.1: A 20 THR OG1 : rot 73:sc= -2.28! USER MOD Set 5.2: A 68 SER OG : rot 80:sc= -3.45! USER MOD Set 6.1: A 40 SER OG : rot 75:sc= 0.285 USER MOD Set 6.2: B 38 SER OG : rot -63:sc= 0.134 USER MOD Set 7.1: A 23 SER OG : rot 75:sc= -0.393 USER MOD Set 7.2: A 74 LYS NZ :NH3+ -151:sc= 0.945 (180deg=0.18) USER MOD Set 8.1: A 21 GLN :FLIP amide:sc= -2.53! C(o=-4.6!,f=-1.7!) USER MOD Set 8.2: A 24 SER OG : rot 107:sc= 0.868 USER MOD Single : A 1 ASP N :NH3+ 175:sc= -0.129 (180deg=-0.187) USER MOD Single : A 2 GLN : amide:sc= -4.66! C(o=-4.7!,f=-7.4!) USER MOD Single : A 4 SER OG : rot 180:sc= -0.236 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 TYR OH : rot -60:sc= 0.227 USER MOD Single : A 13 ASN :FLIP amide:sc= -14.9! C(o=-21!,f=-15!) USER MOD Single : A 27 ASN :FLIP amide:sc= -0.666 F(o=-7.6!,f=-0.67) USER MOD Single : A 35 SER OG : rot 74:sc= 0.406 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot -48:sc= 0.108 USER MOD Single : A 66 THR OG1 : rot -52:sc= -3.33! USER MOD Single : A 67 SER OG : rot 136:sc= -6.21! USER MOD Single : A 70 THR OG1 : rot -153:sc= 2.09 USER MOD Single : B 1 ASP N :NH3+ 177:sc= -0.143 (180deg=-0.188) USER MOD Single : B 2 GLN : amide:sc= -4.6! C(o=-4.6!,f=-7.5!) USER MOD Single : B 4 SER OG : rot 180:sc= -0.212 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 TYR OH : rot -51:sc= 0.243 USER MOD Single : B 13 ASN :FLIP amide:sc= -15.1! C(o=-21!,f=-15!) USER MOD Single : B 27 ASN :FLIP amide:sc= -0.727 F(o=-7.8!,f=-0.73) USER MOD Single : B 35 SER OG : rot 73:sc= 0.397 USER MOD Single : B 36 SER OG : rot 180:sc= 0 USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 64 THR OG1 : rot -49:sc= 0.109 USER MOD Single : B 66 THR OG1 : rot -71:sc= -3.29! USER MOD Single : B 67 SER OG : rot 139:sc= -6.26! USER MOD Single : B 70 THR OG1 : rot -155:sc= 2.01 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 -8.069 14.988 -2.942 1.00 0.00 N ATOM 2 CA ASP A 1 -8.553 14.457 -1.641 1.00 0.00 C ATOM 3 C ASP A 1 -9.283 13.134 -1.834 1.00 0.00 C ATOM 4 O ASP A 1 -9.947 12.640 -0.921 1.00 0.00 O ATOM 5 CB ASP A 1 -9.485 15.468 -0.970 1.00 0.00 C ATOM 6 CG ASP A 1 -10.759 15.691 -1.761 1.00 0.00 C ATOM 7 OD1 ASP A 1 -10.768 16.585 -2.633 1.00 0.00 O ATOM 8 OD2 ASP A 1 -11.749 14.971 -1.509 1.00 0.00 O ATOM 0 H1 ASP A 1 -7.650 15.929 -2.799 1.00 0.00 H new ATOM 0 H2 ASP A 1 -7.351 14.345 -3.334 1.00 0.00 H new ATOM 0 H3 ASP A 1 -8.867 15.062 -3.605 1.00 0.00 H new ATOM 0 HA ASP A 1 -7.687 14.287 -1.001 1.00 0.00 H new ATOM 0 HB2 ASP A 1 -9.738 15.117 0.030 1.00 0.00 H new ATOM 0 HB3 ASP A 1 -8.963 16.417 -0.852 1.00 0.00 H new ATOM 15 N GLN A 2 -9.154 12.567 -3.031 1.00 0.00 N ATOM 16 CA GLN A 2 -9.797 11.299 -3.359 1.00 0.00 C ATOM 17 C GLN A 2 -11.315 11.402 -3.205 1.00 0.00 C ATOM 18 O GLN A 2 -11.900 10.769 -2.327 1.00 0.00 O ATOM 19 CB GLN A 2 -9.250 10.179 -2.468 1.00 0.00 C ATOM 20 CG GLN A 2 -7.803 9.809 -2.764 1.00 0.00 C ATOM 21 CD GLN A 2 -6.848 10.974 -2.591 1.00 0.00 C ATOM 22 OE1 GLN A 2 -6.300 11.191 -1.510 1.00 0.00 O ATOM 23 NE2 GLN A 2 -6.644 11.733 -3.661 1.00 0.00 N ATOM 0 H GLN A 2 -8.607 12.969 -3.793 1.00 0.00 H new ATOM 0 HA GLN A 2 -9.573 11.063 -4.399 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -9.331 10.485 -1.425 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -9.874 9.293 -2.590 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -7.499 8.996 -2.105 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -7.731 9.435 -3.785 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -7.119 11.517 -4.537 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -6.012 12.532 -3.607 1.00 0.00 H new ATOM 32 N PRO A 3 -11.972 12.203 -4.064 1.00 0.00 N ATOM 33 CA PRO A 3 -13.427 12.389 -4.014 1.00 0.00 C ATOM 34 C PRO A 3 -14.193 11.130 -4.407 1.00 0.00 C ATOM 35 O PRO A 3 -15.388 11.014 -4.137 1.00 0.00 O ATOM 36 CB PRO A 3 -13.682 13.509 -5.024 1.00 0.00 C ATOM 37 CG PRO A 3 -12.533 13.441 -5.968 1.00 0.00 C ATOM 38 CD PRO A 3 -11.354 12.987 -5.152 1.00 0.00 C ATOM 0 HA PRO A 3 -13.769 12.622 -3.005 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -14.629 13.365 -5.543 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -13.733 14.481 -4.532 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -12.737 12.744 -6.781 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -12.342 14.414 -6.422 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -10.666 12.382 -5.742 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -10.784 13.832 -4.765 1.00 0.00 H new ATOM 46 N SER A 4 -13.503 10.187 -5.046 1.00 0.00 N ATOM 47 CA SER A 4 -14.134 8.940 -5.467 1.00 0.00 C ATOM 48 C SER A 4 -13.190 7.773 -5.242 1.00 0.00 C ATOM 49 O SER A 4 -12.056 7.969 -4.824 1.00 0.00 O ATOM 50 CB SER A 4 -14.527 9.013 -6.942 1.00 0.00 C ATOM 51 OG SER A 4 -15.259 7.866 -7.335 1.00 0.00 O ATOM 0 H SER A 4 -12.514 10.263 -5.282 1.00 0.00 H new ATOM 0 HA SER A 4 -15.034 8.790 -4.870 1.00 0.00 H new ATOM 0 HB2 SER A 4 -15.125 9.907 -7.118 1.00 0.00 H new ATOM 0 HB3 SER A 4 -13.631 9.103 -7.556 1.00 0.00 H new ATOM 0 HG SER A 4 -15.499 7.940 -8.282 1.00 0.00 H new ATOM 57 N VAL A 5 -13.658 6.561 -5.507 1.00 0.00 N ATOM 58 CA VAL A 5 -12.818 5.383 -5.330 1.00 0.00 C ATOM 59 C VAL A 5 -11.857 5.234 -6.512 1.00 0.00 C ATOM 60 O VAL A 5 -10.646 5.132 -6.325 1.00 0.00 O ATOM 61 CB VAL A 5 -13.650 4.087 -5.137 1.00 0.00 C ATOM 62 CG1 VAL A 5 -15.118 4.411 -4.892 1.00 0.00 C ATOM 63 CG2 VAL A 5 -13.482 3.123 -6.311 1.00 0.00 C ATOM 0 H VAL A 5 -14.602 6.368 -5.841 1.00 0.00 H new ATOM 0 HA VAL A 5 -12.242 5.530 -4.416 1.00 0.00 H new ATOM 0 HB VAL A 5 -13.265 3.582 -4.251 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -15.678 3.485 -4.760 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -15.211 5.022 -3.994 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -15.517 4.958 -5.746 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -14.081 2.229 -6.136 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -13.813 3.607 -7.230 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -12.433 2.844 -6.405 1.00 0.00 H new ATOM 73 N GLY A 6 -12.406 5.231 -7.727 1.00 0.00 N ATOM 74 CA GLY A 6 -11.580 5.097 -8.912 1.00 0.00 C ATOM 75 C GLY A 6 -10.680 6.299 -9.107 1.00 0.00 C ATOM 76 O GLY A 6 -9.493 6.159 -9.410 1.00 0.00 O ATOM 0 H GLY A 6 -13.406 5.319 -7.909 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -10.972 4.196 -8.831 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -12.217 4.974 -9.788 1.00 0.00 H new ATOM 80 N ASP A 7 -11.250 7.485 -8.927 1.00 0.00 N ATOM 81 CA ASP A 7 -10.493 8.722 -9.063 1.00 0.00 C ATOM 82 C ASP A 7 -9.411 8.778 -8.006 1.00 0.00 C ATOM 83 O ASP A 7 -8.310 9.271 -8.251 1.00 0.00 O ATOM 84 CB ASP A 7 -11.415 9.931 -8.918 1.00 0.00 C ATOM 85 CG ASP A 7 -12.396 10.058 -10.068 1.00 0.00 C ATOM 86 OD1 ASP A 7 -11.988 10.545 -11.143 1.00 0.00 O ATOM 87 OD2 ASP A 7 -13.570 9.670 -9.894 1.00 0.00 O ATOM 0 H ASP A 7 -12.233 7.615 -8.687 1.00 0.00 H new ATOM 0 HA ASP A 7 -10.037 8.745 -10.053 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -11.967 9.852 -7.981 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -10.813 10.837 -8.857 1.00 0.00 H new ATOM 92 N ALA A 8 -9.740 8.271 -6.823 1.00 0.00 N ATOM 93 CA ALA A 8 -8.795 8.243 -5.725 1.00 0.00 C ATOM 94 C ALA A 8 -7.505 7.592 -6.168 1.00 0.00 C ATOM 95 O ALA A 8 -6.417 8.124 -5.956 1.00 0.00 O ATOM 96 CB ALA A 8 -9.354 7.463 -4.561 1.00 0.00 C ATOM 0 H ALA A 8 -10.655 7.875 -6.605 1.00 0.00 H new ATOM 0 HA ALA A 8 -8.608 9.271 -5.416 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -8.629 7.454 -3.747 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -10.277 7.931 -4.219 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -9.560 6.440 -4.874 1.00 0.00 H new ATOM 102 N PHE A 9 -7.650 6.424 -6.784 1.00 0.00 N ATOM 103 CA PHE A 9 -6.519 5.669 -7.263 1.00 0.00 C ATOM 104 C PHE A 9 -5.620 6.540 -8.121 1.00 0.00 C ATOM 105 O PHE A 9 -4.452 6.692 -7.815 1.00 0.00 O ATOM 106 CB PHE A 9 -6.992 4.441 -8.022 1.00 0.00 C ATOM 107 CG PHE A 9 -7.139 3.264 -7.118 1.00 0.00 C ATOM 108 CD1 PHE A 9 -6.077 2.407 -6.891 1.00 0.00 C ATOM 109 CD2 PHE A 9 -8.333 3.033 -6.467 1.00 0.00 C ATOM 110 CE1 PHE A 9 -6.212 1.341 -6.027 1.00 0.00 C ATOM 111 CE2 PHE A 9 -8.471 1.968 -5.609 1.00 0.00 C ATOM 112 CZ PHE A 9 -7.412 1.123 -5.385 1.00 0.00 C ATOM 0 H PHE A 9 -8.553 5.984 -6.960 1.00 0.00 H new ATOM 0 HA PHE A 9 -5.932 5.332 -6.409 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -7.947 4.654 -8.502 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.282 4.206 -8.815 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -5.136 2.574 -7.394 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -9.169 3.696 -6.633 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -5.378 0.677 -5.853 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -9.413 1.796 -5.110 1.00 0.00 H new ATOM 0 HZ PHE A 9 -7.519 0.289 -4.707 1.00 0.00 H new ATOM 122 N ASP A 10 -6.183 7.196 -9.132 1.00 0.00 N ATOM 123 CA ASP A 10 -5.380 8.031 -10.023 1.00 0.00 C ATOM 124 C ASP A 10 -4.402 8.868 -9.209 1.00 0.00 C ATOM 125 O ASP A 10 -3.191 8.886 -9.470 1.00 0.00 O ATOM 126 CB ASP A 10 -6.292 8.942 -10.842 1.00 0.00 C ATOM 127 CG ASP A 10 -6.325 8.563 -12.311 1.00 0.00 C ATOM 128 OD1 ASP A 10 -5.414 8.988 -13.053 1.00 0.00 O ATOM 129 OD2 ASP A 10 -7.259 7.843 -12.718 1.00 0.00 O ATOM 0 H ASP A 10 -7.178 7.168 -9.354 1.00 0.00 H new ATOM 0 HA ASP A 10 -4.817 7.390 -10.701 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -7.303 8.899 -10.436 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -5.953 9.973 -10.744 1.00 0.00 H new ATOM 134 N LYS A 11 -4.940 9.523 -8.196 1.00 0.00 N ATOM 135 CA LYS A 11 -4.146 10.349 -7.299 1.00 0.00 C ATOM 136 C LYS A 11 -3.124 9.491 -6.568 1.00 0.00 C ATOM 137 O LYS A 11 -1.944 9.830 -6.488 1.00 0.00 O ATOM 138 CB LYS A 11 -5.049 11.036 -6.287 1.00 0.00 C ATOM 139 CG LYS A 11 -4.437 12.262 -5.678 1.00 0.00 C ATOM 140 CD LYS A 11 -5.121 13.436 -6.271 1.00 0.00 C ATOM 141 CE LYS A 11 -4.308 14.713 -6.134 1.00 0.00 C ATOM 142 NZ LYS A 11 -4.976 15.871 -6.788 1.00 0.00 N ATOM 0 H LYS A 11 -5.935 9.499 -7.971 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.626 11.105 -7.888 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.985 11.310 -6.774 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -5.296 10.330 -5.494 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.557 12.254 -4.595 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.366 12.298 -5.880 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.316 13.244 -7.326 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.089 13.571 -5.788 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -4.153 14.933 -5.078 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -3.323 14.565 -6.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -4.389 16.722 -6.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.101 15.673 -7.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -5.905 16.029 -6.349 1.00 0.00 H new ATOM 156 N TYR A 12 -3.607 8.374 -6.036 1.00 0.00 N ATOM 157 CA TYR A 12 -2.777 7.431 -5.304 1.00 0.00 C ATOM 158 C TYR A 12 -1.617 6.945 -6.126 1.00 0.00 C ATOM 159 O TYR A 12 -0.472 7.139 -5.769 1.00 0.00 O ATOM 160 CB TYR A 12 -3.568 6.189 -4.913 1.00 0.00 C ATOM 161 CG TYR A 12 -2.841 5.336 -3.891 1.00 0.00 C ATOM 162 CD1 TYR A 12 -2.016 5.922 -2.931 1.00 0.00 C ATOM 163 CD2 TYR A 12 -2.962 3.950 -3.886 1.00 0.00 C ATOM 164 CE1 TYR A 12 -1.340 5.157 -2.005 1.00 0.00 C ATOM 165 CE2 TYR A 12 -2.284 3.183 -2.961 1.00 0.00 C ATOM 166 CZ TYR A 12 -1.474 3.788 -2.024 1.00 0.00 C ATOM 167 OH TYR A 12 -0.800 3.020 -1.104 1.00 0.00 O ATOM 0 H TYR A 12 -4.587 8.098 -6.101 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.425 7.973 -4.426 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -4.535 6.490 -4.509 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -3.767 5.593 -5.804 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -1.905 6.996 -2.913 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -3.595 3.468 -4.616 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -0.708 5.630 -1.268 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -2.388 2.108 -2.971 1.00 0.00 H new ATOM 0 HH TYR A 12 0.165 3.159 -1.206 1.00 0.00 H new ATOM 177 N ASN A 13 -1.955 6.335 -7.246 1.00 0.00 N ATOM 178 CA ASN A 13 -0.985 5.726 -8.138 1.00 0.00 C ATOM 179 C ASN A 13 0.274 6.554 -8.255 1.00 0.00 C ATOM 180 O ASN A 13 1.364 6.083 -7.941 1.00 0.00 O ATOM 181 CB ASN A 13 -1.581 5.565 -9.528 1.00 0.00 C ATOM 182 CG ASN A 13 -3.068 5.234 -9.534 1.00 0.00 C ATOM 183 OD1 ASN A 13 -3.573 4.641 -8.452 1.00 0.00 O flip ATOM 184 ND2 ASN A 13 -3.762 5.512 -10.511 1.00 0.00 N flip ATOM 0 H ASN A 13 -2.920 6.247 -7.566 1.00 0.00 H new ATOM 0 HA ASN A 13 -0.729 4.755 -7.713 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.423 6.487 -10.088 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.042 4.776 -10.053 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -3.342 5.966 -11.322 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -4.757 5.289 -10.510 1.00 0.00 H new ATOM 191 N GLU A 14 0.129 7.779 -8.710 1.00 0.00 N ATOM 192 CA GLU A 14 1.280 8.652 -8.849 1.00 0.00 C ATOM 193 C GLU A 14 2.034 8.725 -7.515 1.00 0.00 C ATOM 194 O GLU A 14 3.264 8.671 -7.459 1.00 0.00 O ATOM 195 CB GLU A 14 0.812 10.046 -9.287 1.00 0.00 C ATOM 196 CG GLU A 14 0.488 10.967 -8.125 1.00 0.00 C ATOM 197 CD GLU A 14 -0.456 12.089 -8.512 1.00 0.00 C ATOM 198 OE1 GLU A 14 -0.047 12.959 -9.310 1.00 0.00 O ATOM 199 OE2 GLU A 14 -1.602 12.097 -8.018 1.00 0.00 O ATOM 0 H GLU A 14 -0.761 8.192 -8.988 1.00 0.00 H new ATOM 0 HA GLU A 14 1.956 8.257 -9.607 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.588 10.506 -9.900 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -0.072 9.943 -9.916 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.042 10.385 -7.319 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.413 11.394 -7.736 1.00 0.00 H new ATOM 206 N ALA A 15 1.253 8.771 -6.444 1.00 0.00 N ATOM 207 CA ALA A 15 1.757 8.891 -5.083 1.00 0.00 C ATOM 208 C ALA A 15 2.370 7.610 -4.533 1.00 0.00 C ATOM 209 O ALA A 15 3.365 7.659 -3.807 1.00 0.00 O ATOM 210 CB ALA A 15 0.605 9.307 -4.184 1.00 0.00 C ATOM 0 H ALA A 15 0.235 8.725 -6.498 1.00 0.00 H new ATOM 0 HA ALA A 15 2.557 9.631 -5.104 1.00 0.00 H new ATOM 0 HB1 ALA A 15 0.960 9.403 -3.158 1.00 0.00 H new ATOM 0 HB2 ALA A 15 0.208 10.264 -4.521 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.181 8.553 -4.227 1.00 0.00 H new ATOM 216 N VAL A 16 1.791 6.468 -4.869 1.00 0.00 N ATOM 217 CA VAL A 16 2.266 5.217 -4.328 1.00 0.00 C ATOM 218 C VAL A 16 3.373 4.639 -5.140 1.00 0.00 C ATOM 219 O VAL A 16 4.385 4.186 -4.605 1.00 0.00 O ATOM 220 CB VAL A 16 1.132 4.197 -4.159 1.00 0.00 C ATOM 221 CG1 VAL A 16 0.161 4.278 -5.315 1.00 0.00 C ATOM 222 CG2 VAL A 16 1.682 2.788 -3.990 1.00 0.00 C ATOM 0 H VAL A 16 1.000 6.387 -5.508 1.00 0.00 H new ATOM 0 HA VAL A 16 2.663 5.444 -3.339 1.00 0.00 H new ATOM 0 HB VAL A 16 0.586 4.444 -3.249 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.634 3.546 -5.174 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -0.270 5.278 -5.359 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.686 4.068 -6.247 1.00 0.00 H new ATOM 0 HG21 VAL A 16 0.856 2.087 -3.872 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.265 2.517 -4.870 1.00 0.00 H new ATOM 0 HG23 VAL A 16 2.319 2.750 -3.106 1.00 0.00 H new ATOM 232 N ARG A 17 3.179 4.650 -6.425 1.00 0.00 N ATOM 233 CA ARG A 17 4.163 4.118 -7.309 1.00 0.00 C ATOM 234 C ARG A 17 5.503 4.746 -7.069 1.00 0.00 C ATOM 235 O ARG A 17 6.539 4.077 -7.107 1.00 0.00 O ATOM 236 CB ARG A 17 3.693 4.247 -8.750 1.00 0.00 C ATOM 237 CG ARG A 17 2.438 3.447 -9.039 1.00 0.00 C ATOM 238 CD ARG A 17 2.275 2.265 -8.098 1.00 0.00 C ATOM 239 NE ARG A 17 0.974 2.216 -7.513 1.00 0.00 N ATOM 240 CZ ARG A 17 0.700 1.450 -6.504 1.00 0.00 C ATOM 241 NH1 ARG A 17 1.514 0.472 -6.157 1.00 0.00 N ATOM 242 NH2 ARG A 17 -0.407 1.628 -5.864 1.00 0.00 N ATOM 0 H ARG A 17 2.346 5.023 -6.881 1.00 0.00 H new ATOM 0 HA ARG A 17 4.291 3.055 -7.106 1.00 0.00 H new ATOM 0 HB2 ARG A 17 3.507 5.298 -8.973 1.00 0.00 H new ATOM 0 HB3 ARG A 17 4.489 3.916 -9.417 1.00 0.00 H new ATOM 0 HG2 ARG A 17 1.568 4.098 -8.954 1.00 0.00 H new ATOM 0 HG3 ARG A 17 2.468 3.088 -10.068 1.00 0.00 H new ATOM 0 HD2 ARG A 17 2.461 1.340 -8.644 1.00 0.00 H new ATOM 0 HD3 ARG A 17 3.024 2.325 -7.309 1.00 0.00 H new ATOM 0 HE ARG A 17 0.236 2.803 -7.902 1.00 0.00 H new ATOM 0 HH11 ARG A 17 2.372 0.311 -6.685 1.00 0.00 H new ATOM 0 HH12 ARG A 17 1.286 -0.123 -5.361 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -1.052 2.363 -6.155 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -0.637 1.033 -5.068 1.00 0.00 H new ATOM 256 N VAL A 18 5.500 6.010 -6.773 1.00 0.00 N ATOM 257 CA VAL A 18 6.741 6.660 -6.514 1.00 0.00 C ATOM 258 C VAL A 18 7.258 6.265 -5.140 1.00 0.00 C ATOM 259 O VAL A 18 8.416 5.922 -4.994 1.00 0.00 O ATOM 260 CB VAL A 18 6.595 8.186 -6.597 1.00 0.00 C ATOM 261 CG1 VAL A 18 6.081 8.578 -7.972 1.00 0.00 C ATOM 262 CG2 VAL A 18 5.665 8.691 -5.500 1.00 0.00 C ATOM 0 H VAL A 18 4.670 6.599 -6.706 1.00 0.00 H new ATOM 0 HA VAL A 18 7.454 6.343 -7.275 1.00 0.00 H new ATOM 0 HB VAL A 18 7.570 8.649 -6.447 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.979 9.662 -8.027 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.785 8.241 -8.733 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.110 8.113 -8.144 1.00 0.00 H new ATOM 0 HG21 VAL A 18 5.572 9.775 -5.572 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.682 8.234 -5.617 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.075 8.426 -4.525 1.00 0.00 H new ATOM 272 N PHE A 19 6.364 6.194 -4.162 1.00 0.00 N ATOM 273 CA PHE A 19 6.768 5.927 -2.791 1.00 0.00 C ATOM 274 C PHE A 19 7.420 4.548 -2.580 1.00 0.00 C ATOM 275 O PHE A 19 8.480 4.450 -1.934 1.00 0.00 O ATOM 276 CB PHE A 19 5.584 6.239 -1.824 1.00 0.00 C ATOM 277 CG PHE A 19 4.601 5.142 -1.458 1.00 0.00 C ATOM 278 CD1 PHE A 19 4.988 3.851 -1.174 1.00 0.00 C ATOM 279 CD2 PHE A 19 3.254 5.446 -1.377 1.00 0.00 C ATOM 280 CE1 PHE A 19 4.062 2.886 -0.839 1.00 0.00 C ATOM 281 CE2 PHE A 19 2.320 4.485 -1.041 1.00 0.00 C ATOM 282 CZ PHE A 19 2.727 3.201 -0.778 1.00 0.00 C ATOM 0 H PHE A 19 5.360 6.317 -4.293 1.00 0.00 H new ATOM 0 HA PHE A 19 7.583 6.607 -2.544 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.013 6.615 -0.895 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.011 7.056 -2.264 1.00 0.00 H new ATOM 0 HD1 PHE A 19 6.035 3.590 -1.214 1.00 0.00 H new ATOM 0 HD2 PHE A 19 2.926 6.455 -1.580 1.00 0.00 H new ATOM 0 HE1 PHE A 19 4.388 1.879 -0.624 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.273 4.743 -0.985 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.001 2.443 -0.524 1.00 0.00 H new ATOM 292 N THR A 20 6.872 3.484 -3.156 1.00 0.00 N ATOM 293 CA THR A 20 7.458 2.180 -2.895 1.00 0.00 C ATOM 294 C THR A 20 8.697 1.925 -3.725 1.00 0.00 C ATOM 295 O THR A 20 9.730 1.541 -3.175 1.00 0.00 O ATOM 296 CB THR A 20 6.474 1.022 -3.051 1.00 0.00 C ATOM 297 OG1 THR A 20 5.595 0.986 -1.938 1.00 0.00 O ATOM 298 CG2 THR A 20 7.215 -0.292 -3.158 1.00 0.00 C ATOM 0 H THR A 20 6.063 3.494 -3.777 1.00 0.00 H new ATOM 0 HA THR A 20 7.747 2.217 -1.845 1.00 0.00 H new ATOM 0 HB THR A 20 5.898 1.174 -3.964 1.00 0.00 H new ATOM 0 HG1 THR A 20 4.955 1.725 -2.003 1.00 0.00 H new ATOM 0 HG21 THR A 20 6.498 -1.106 -3.269 1.00 0.00 H new ATOM 0 HG22 THR A 20 7.874 -0.268 -4.026 1.00 0.00 H new ATOM 0 HG23 THR A 20 7.807 -0.450 -2.257 1.00 0.00 H new ATOM 306 N GLN A 21 8.630 2.122 -5.039 1.00 0.00 N ATOM 307 CA GLN A 21 9.819 1.885 -5.828 1.00 0.00 C ATOM 308 C GLN A 21 10.886 2.874 -5.412 1.00 0.00 C ATOM 309 O GLN A 21 12.047 2.725 -5.761 1.00 0.00 O ATOM 310 CB GLN A 21 9.551 1.923 -7.329 1.00 0.00 C ATOM 311 CG GLN A 21 9.153 0.557 -7.902 1.00 0.00 C ATOM 312 CD GLN A 21 9.882 -0.597 -7.257 1.00 0.00 C ATOM 313 OE1 GLN A 21 9.292 -1.134 -6.192 1.00 0.00 O flip ATOM 314 NE2 GLN A 21 10.954 -1.002 -7.705 1.00 0.00 N flip ATOM 0 H GLN A 21 7.805 2.430 -5.554 1.00 0.00 H new ATOM 0 HA GLN A 21 10.171 0.872 -5.631 1.00 0.00 H new ATOM 0 HB2 GLN A 21 8.757 2.641 -7.533 1.00 0.00 H new ATOM 0 HB3 GLN A 21 10.443 2.280 -7.843 1.00 0.00 H new ATOM 0 HG2 GLN A 21 8.080 0.416 -7.775 1.00 0.00 H new ATOM 0 HG3 GLN A 21 9.351 0.549 -8.974 1.00 0.00 H new ATOM 0 HE21 GLN A 21 11.365 -0.556 -8.525 1.00 0.00 H new ATOM 0 HE22 GLN A 21 11.431 -1.784 -7.257 1.00 0.00 H new ATOM 323 N LEU A 22 10.490 3.894 -4.655 1.00 0.00 N ATOM 324 CA LEU A 22 11.465 4.834 -4.144 1.00 0.00 C ATOM 325 C LEU A 22 12.425 4.040 -3.289 1.00 0.00 C ATOM 326 O LEU A 22 13.640 4.198 -3.382 1.00 0.00 O ATOM 327 CB LEU A 22 10.821 5.946 -3.300 1.00 0.00 C ATOM 328 CG LEU A 22 10.470 7.261 -4.026 1.00 0.00 C ATOM 329 CD1 LEU A 22 11.183 8.424 -3.368 1.00 0.00 C ATOM 330 CD2 LEU A 22 10.798 7.211 -5.519 1.00 0.00 C ATOM 0 H LEU A 22 9.523 4.083 -4.390 1.00 0.00 H new ATOM 0 HA LEU A 22 11.965 5.328 -4.977 1.00 0.00 H new ATOM 0 HB2 LEU A 22 9.908 5.549 -2.857 1.00 0.00 H new ATOM 0 HB3 LEU A 22 11.497 6.183 -2.478 1.00 0.00 H new ATOM 0 HG LEU A 22 9.392 7.400 -3.942 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.929 9.348 -3.888 1.00 0.00 H new ATOM 0 HD12 LEU A 22 10.874 8.497 -2.325 1.00 0.00 H new ATOM 0 HD13 LEU A 22 12.260 8.265 -3.417 1.00 0.00 H new ATOM 0 HD21 LEU A 22 10.532 8.161 -5.982 1.00 0.00 H new ATOM 0 HD22 LEU A 22 11.865 7.029 -5.651 1.00 0.00 H new ATOM 0 HD23 LEU A 22 10.232 6.407 -5.989 1.00 0.00 H new ATOM 342 N SER A 23 11.857 3.161 -2.461 1.00 0.00 N ATOM 343 CA SER A 23 12.677 2.309 -1.603 1.00 0.00 C ATOM 344 C SER A 23 13.386 1.205 -2.408 1.00 0.00 C ATOM 345 O SER A 23 14.584 0.981 -2.233 1.00 0.00 O ATOM 346 CB SER A 23 11.837 1.697 -0.475 1.00 0.00 C ATOM 347 OG SER A 23 11.651 2.628 0.578 1.00 0.00 O ATOM 0 H SER A 23 10.851 3.023 -2.368 1.00 0.00 H new ATOM 0 HA SER A 23 13.446 2.941 -1.159 1.00 0.00 H new ATOM 0 HB2 SER A 23 10.868 1.385 -0.865 1.00 0.00 H new ATOM 0 HB3 SER A 23 12.330 0.803 -0.093 1.00 0.00 H new ATOM 0 HG SER A 23 10.993 3.302 0.306 1.00 0.00 H new ATOM 353 N SER A 24 12.655 0.516 -3.288 1.00 0.00 N ATOM 354 CA SER A 24 13.247 -0.556 -4.096 1.00 0.00 C ATOM 355 C SER A 24 14.255 -0.025 -5.096 1.00 0.00 C ATOM 356 O SER A 24 15.420 -0.420 -5.079 1.00 0.00 O ATOM 357 CB SER A 24 12.178 -1.340 -4.841 1.00 0.00 C ATOM 358 OG SER A 24 12.720 -1.990 -5.977 1.00 0.00 O ATOM 0 H SER A 24 11.663 0.678 -3.459 1.00 0.00 H new ATOM 0 HA SER A 24 13.762 -1.215 -3.397 1.00 0.00 H new ATOM 0 HB2 SER A 24 11.733 -2.078 -4.174 1.00 0.00 H new ATOM 0 HB3 SER A 24 11.378 -0.667 -5.150 1.00 0.00 H new ATOM 0 HG SER A 24 12.776 -2.953 -5.807 1.00 0.00 H new ATOM 364 N ALA A 25 13.796 0.851 -5.982 1.00 0.00 N ATOM 365 CA ALA A 25 14.666 1.438 -6.986 1.00 0.00 C ATOM 366 C ALA A 25 15.927 1.934 -6.306 1.00 0.00 C ATOM 367 O ALA A 25 17.017 1.886 -6.871 1.00 0.00 O ATOM 368 CB ALA A 25 13.954 2.574 -7.719 1.00 0.00 C ATOM 0 H ALA A 25 12.827 1.168 -6.023 1.00 0.00 H new ATOM 0 HA ALA A 25 14.929 0.686 -7.730 1.00 0.00 H new ATOM 0 HB1 ALA A 25 14.623 3.000 -8.467 1.00 0.00 H new ATOM 0 HB2 ALA A 25 13.061 2.187 -8.210 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.670 3.346 -7.004 1.00 0.00 H new ATOM 374 N ALA A 26 15.761 2.371 -5.062 1.00 0.00 N ATOM 375 CA ALA A 26 16.873 2.871 -4.269 1.00 0.00 C ATOM 376 C ALA A 26 17.938 1.800 -4.054 1.00 0.00 C ATOM 377 O ALA A 26 19.131 2.093 -4.129 1.00 0.00 O ATOM 378 CB ALA A 26 16.381 3.402 -2.930 1.00 0.00 C ATOM 0 H ALA A 26 14.862 2.388 -4.581 1.00 0.00 H new ATOM 0 HA ALA A 26 17.330 3.688 -4.827 1.00 0.00 H new ATOM 0 HB1 ALA A 26 17.228 3.771 -2.352 1.00 0.00 H new ATOM 0 HB2 ALA A 26 15.674 4.215 -3.098 1.00 0.00 H new ATOM 0 HB3 ALA A 26 15.888 2.601 -2.380 1.00 0.00 H new ATOM 384 N ASN A 27 17.524 0.557 -3.787 1.00 0.00 N ATOM 385 CA ASN A 27 18.505 -0.504 -3.562 1.00 0.00 C ATOM 386 C ASN A 27 17.959 -1.933 -3.705 1.00 0.00 C ATOM 387 O ASN A 27 18.660 -2.800 -4.228 1.00 0.00 O ATOM 388 CB ASN A 27 19.143 -0.341 -2.179 1.00 0.00 C ATOM 389 CG ASN A 27 18.162 0.134 -1.118 1.00 0.00 C ATOM 390 OD1 ASN A 27 16.871 -0.096 -1.340 1.00 0.00 O flip ATOM 391 ND2 ASN A 27 18.562 0.716 -0.110 1.00 0.00 N flip ATOM 0 H ASN A 27 16.548 0.268 -3.723 1.00 0.00 H new ATOM 0 HA ASN A 27 19.243 -0.385 -4.356 1.00 0.00 H new ATOM 0 HB2 ASN A 27 19.570 -1.295 -1.869 1.00 0.00 H new ATOM 0 HB3 ASN A 27 19.966 0.370 -2.247 1.00 0.00 H new ATOM 0 HD21 ASN A 27 19.561 0.874 0.025 1.00 0.00 H new ATOM 0 HD22 ASN A 27 17.895 1.040 0.590 1.00 0.00 H new ATOM 398 N CYS A 28 16.726 -2.195 -3.262 1.00 0.00 N ATOM 399 CA CYS A 28 16.191 -3.560 -3.326 1.00 0.00 C ATOM 400 C CYS A 28 14.730 -3.633 -2.893 1.00 0.00 C ATOM 401 O CYS A 28 14.212 -2.713 -2.290 1.00 0.00 O ATOM 402 CB CYS A 28 17.038 -4.456 -2.416 1.00 0.00 C ATOM 403 SG CYS A 28 16.128 -5.769 -1.546 1.00 0.00 S ATOM 0 H CYS A 28 16.093 -1.501 -2.865 1.00 0.00 H new ATOM 0 HA CYS A 28 16.236 -3.895 -4.362 1.00 0.00 H new ATOM 0 HB2 CYS A 28 17.822 -4.918 -3.017 1.00 0.00 H new ATOM 0 HB3 CYS A 28 17.533 -3.828 -1.675 1.00 0.00 H new ATOM 408 N ASP A 29 14.075 -4.742 -3.223 1.00 0.00 N ATOM 409 CA ASP A 29 12.680 -4.970 -2.840 1.00 0.00 C ATOM 410 C ASP A 29 12.577 -6.159 -1.884 1.00 0.00 C ATOM 411 O ASP A 29 13.384 -7.086 -1.965 1.00 0.00 O ATOM 412 CB ASP A 29 11.826 -5.238 -4.080 1.00 0.00 C ATOM 413 CG ASP A 29 12.629 -5.835 -5.219 1.00 0.00 C ATOM 414 OD1 ASP A 29 12.741 -7.077 -5.279 1.00 0.00 O ATOM 415 OD2 ASP A 29 13.145 -5.060 -6.052 1.00 0.00 O ATOM 0 H ASP A 29 14.490 -5.504 -3.759 1.00 0.00 H new ATOM 0 HA ASP A 29 12.313 -4.075 -2.338 1.00 0.00 H new ATOM 0 HB2 ASP A 29 11.013 -5.916 -3.818 1.00 0.00 H new ATOM 0 HB3 ASP A 29 11.369 -4.305 -4.411 1.00 0.00 H new ATOM 420 N TRP A 30 11.590 -6.151 -0.975 1.00 0.00 N ATOM 421 CA TRP A 30 11.444 -7.273 -0.051 1.00 0.00 C ATOM 422 C TRP A 30 11.027 -8.502 -0.851 1.00 0.00 C ATOM 423 O TRP A 30 11.596 -9.582 -0.690 1.00 0.00 O ATOM 424 CB TRP A 30 10.450 -6.980 1.106 1.00 0.00 C ATOM 425 CG TRP A 30 9.125 -6.453 0.696 1.00 0.00 C ATOM 426 CD1 TRP A 30 8.150 -7.065 -0.031 1.00 0.00 C ATOM 427 CD2 TRP A 30 8.624 -5.178 1.050 1.00 0.00 C ATOM 428 NE1 TRP A 30 7.090 -6.210 -0.196 1.00 0.00 N ATOM 429 CE2 TRP A 30 7.368 -5.043 0.466 1.00 0.00 C ATOM 430 CE3 TRP A 30 9.141 -4.126 1.796 1.00 0.00 C ATOM 431 CZ2 TRP A 30 6.622 -3.890 0.601 1.00 0.00 C ATOM 432 CZ3 TRP A 30 8.400 -2.983 1.937 1.00 0.00 C ATOM 433 CH2 TRP A 30 7.154 -2.867 1.340 1.00 0.00 C ATOM 0 H TRP A 30 10.904 -5.404 -0.865 1.00 0.00 H new ATOM 0 HA TRP A 30 12.403 -7.451 0.435 1.00 0.00 H new ATOM 0 HB2 TRP A 30 10.296 -7.900 1.670 1.00 0.00 H new ATOM 0 HB3 TRP A 30 10.912 -6.263 1.785 1.00 0.00 H new ATOM 0 HD1 TRP A 30 8.203 -8.071 -0.419 1.00 0.00 H new ATOM 0 HE1 TRP A 30 6.239 -6.409 -0.722 1.00 0.00 H new ATOM 0 HE3 TRP A 30 10.114 -4.209 2.258 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 5.650 -3.797 0.139 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 8.791 -2.162 2.520 1.00 0.00 H new ATOM 0 HH2 TRP A 30 6.592 -1.952 1.460 1.00 0.00 H new ATOM 444 N ALA A 31 10.051 -8.293 -1.741 1.00 0.00 N ATOM 445 CA ALA A 31 9.531 -9.329 -2.632 1.00 0.00 C ATOM 446 C ALA A 31 8.732 -10.392 -1.881 1.00 0.00 C ATOM 447 O ALA A 31 7.660 -10.812 -2.314 1.00 0.00 O ATOM 448 CB ALA A 31 10.673 -9.964 -3.403 1.00 0.00 C ATOM 0 H ALA A 31 9.596 -7.388 -1.862 1.00 0.00 H new ATOM 0 HA ALA A 31 8.843 -8.852 -3.329 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.280 -10.735 -4.065 1.00 0.00 H new ATOM 0 HB2 ALA A 31 11.181 -9.202 -3.994 1.00 0.00 H new ATOM 0 HB3 ALA A 31 11.380 -10.411 -2.704 1.00 0.00 H new ATOM 454 N ALA A 32 9.264 -10.819 -0.754 1.00 0.00 N ATOM 455 CA ALA A 32 8.617 -11.838 0.058 1.00 0.00 C ATOM 456 C ALA A 32 7.338 -11.306 0.695 1.00 0.00 C ATOM 457 O ALA A 32 6.313 -11.993 0.729 1.00 0.00 O ATOM 458 CB ALA A 32 9.572 -12.341 1.130 1.00 0.00 C ATOM 0 H ALA A 32 10.147 -10.476 -0.375 1.00 0.00 H new ATOM 0 HA ALA A 32 8.347 -12.669 -0.594 1.00 0.00 H new ATOM 0 HB1 ALA A 32 9.076 -13.103 1.731 1.00 0.00 H new ATOM 0 HB2 ALA A 32 10.456 -12.770 0.658 1.00 0.00 H new ATOM 0 HB3 ALA A 32 9.870 -11.511 1.771 1.00 0.00 H new ATOM 464 N CYS A 33 7.398 -10.076 1.187 1.00 0.00 N ATOM 465 CA CYS A 33 6.249 -9.469 1.838 1.00 0.00 C ATOM 466 C CYS A 33 5.120 -9.192 0.865 1.00 0.00 C ATOM 467 O CYS A 33 3.981 -9.529 1.132 1.00 0.00 O ATOM 468 CB CYS A 33 6.637 -8.180 2.544 1.00 0.00 C ATOM 469 SG CYS A 33 6.082 -8.108 4.282 1.00 0.00 S ATOM 0 H CYS A 33 8.227 -9.483 1.147 1.00 0.00 H new ATOM 0 HA CYS A 33 5.895 -10.191 2.574 1.00 0.00 H new ATOM 0 HB2 CYS A 33 7.721 -8.069 2.512 1.00 0.00 H new ATOM 0 HB3 CYS A 33 6.214 -7.335 2.000 1.00 0.00 H new ATOM 474 N LEU A 34 5.417 -8.578 -0.263 1.00 0.00 N ATOM 475 CA LEU A 34 4.368 -8.275 -1.219 1.00 0.00 C ATOM 476 C LEU A 34 3.560 -9.517 -1.545 1.00 0.00 C ATOM 477 O LEU A 34 2.346 -9.443 -1.732 1.00 0.00 O ATOM 478 CB LEU A 34 4.937 -7.633 -2.468 1.00 0.00 C ATOM 479 CG LEU A 34 6.304 -8.156 -2.878 1.00 0.00 C ATOM 480 CD1 LEU A 34 6.162 -9.178 -3.991 1.00 0.00 C ATOM 481 CD2 LEU A 34 7.201 -7.010 -3.298 1.00 0.00 C ATOM 0 H LEU A 34 6.354 -8.284 -0.538 1.00 0.00 H new ATOM 0 HA LEU A 34 3.691 -7.552 -0.764 1.00 0.00 H new ATOM 0 HB2 LEU A 34 4.240 -7.789 -3.291 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.006 -6.557 -2.309 1.00 0.00 H new ATOM 0 HG LEU A 34 6.766 -8.649 -2.023 1.00 0.00 H new ATOM 0 HD11 LEU A 34 7.148 -9.545 -4.276 1.00 0.00 H new ATOM 0 HD12 LEU A 34 5.551 -10.011 -3.644 1.00 0.00 H new ATOM 0 HD13 LEU A 34 5.685 -8.713 -4.854 1.00 0.00 H new ATOM 0 HD21 LEU A 34 8.177 -7.399 -3.589 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.752 -6.487 -4.143 1.00 0.00 H new ATOM 0 HD23 LEU A 34 7.321 -6.317 -2.465 1.00 0.00 H new ATOM 493 N SER A 35 4.229 -10.658 -1.613 1.00 0.00 N ATOM 494 CA SER A 35 3.530 -11.907 -1.855 1.00 0.00 C ATOM 495 C SER A 35 2.513 -12.113 -0.739 1.00 0.00 C ATOM 496 O SER A 35 1.415 -12.614 -0.958 1.00 0.00 O ATOM 497 CB SER A 35 4.518 -13.071 -1.878 1.00 0.00 C ATOM 498 OG SER A 35 5.522 -12.870 -2.857 1.00 0.00 O ATOM 0 H SER A 35 5.240 -10.744 -1.506 1.00 0.00 H new ATOM 0 HA SER A 35 3.026 -11.867 -2.821 1.00 0.00 H new ATOM 0 HB2 SER A 35 4.980 -13.179 -0.897 1.00 0.00 H new ATOM 0 HB3 SER A 35 3.986 -14.000 -2.084 1.00 0.00 H new ATOM 0 HG SER A 35 6.153 -12.188 -2.544 1.00 0.00 H new ATOM 504 N SER A 36 2.919 -11.699 0.459 1.00 0.00 N ATOM 505 CA SER A 36 2.094 -11.796 1.671 1.00 0.00 C ATOM 506 C SER A 36 0.690 -11.196 1.478 1.00 0.00 C ATOM 507 O SER A 36 -0.308 -11.822 1.838 1.00 0.00 O ATOM 508 CB SER A 36 2.808 -11.102 2.838 1.00 0.00 C ATOM 509 OG SER A 36 2.454 -11.688 4.079 1.00 0.00 O ATOM 0 H SER A 36 3.836 -11.283 0.622 1.00 0.00 H new ATOM 0 HA SER A 36 1.960 -12.855 1.892 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.887 -11.167 2.697 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.551 -10.043 2.847 1.00 0.00 H new ATOM 0 HG SER A 36 2.925 -11.227 4.805 1.00 0.00 H new ATOM 515 N LEU A 37 0.605 -9.982 0.923 1.00 0.00 N ATOM 516 CA LEU A 37 -0.703 -9.346 0.699 1.00 0.00 C ATOM 517 C LEU A 37 -1.485 -10.223 -0.236 1.00 0.00 C ATOM 518 O LEU A 37 -2.615 -10.611 0.041 1.00 0.00 O ATOM 519 CB LEU A 37 -0.583 -7.935 0.092 1.00 0.00 C ATOM 520 CG LEU A 37 -1.813 -7.445 -0.677 1.00 0.00 C ATOM 521 CD1 LEU A 37 -2.972 -7.192 0.268 1.00 0.00 C ATOM 522 CD2 LEU A 37 -1.494 -6.201 -1.481 1.00 0.00 C ATOM 0 H LEU A 37 1.407 -9.427 0.625 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.200 -9.234 1.663 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.372 -7.229 0.895 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.275 -7.919 -0.580 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.106 -8.229 -1.375 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.835 -6.845 -0.300 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.227 -8.116 0.787 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.688 -6.433 0.997 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.386 -5.875 -2.017 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.165 -5.408 -0.809 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.702 -6.423 -2.196 1.00 0.00 H new ATOM 534 N SER A 38 -0.845 -10.532 -1.350 1.00 0.00 N ATOM 535 CA SER A 38 -1.425 -11.387 -2.359 1.00 0.00 C ATOM 536 C SER A 38 -1.514 -12.825 -1.845 1.00 0.00 C ATOM 537 O SER A 38 -1.951 -13.730 -2.558 1.00 0.00 O ATOM 538 CB SER A 38 -0.583 -11.315 -3.633 1.00 0.00 C ATOM 539 OG SER A 38 0.065 -12.549 -3.892 1.00 0.00 O ATOM 0 H SER A 38 0.091 -10.195 -1.576 1.00 0.00 H new ATOM 0 HA SER A 38 -2.435 -11.047 -2.587 1.00 0.00 H new ATOM 0 HB2 SER A 38 -1.219 -11.052 -4.478 1.00 0.00 H new ATOM 0 HB3 SER A 38 0.161 -10.524 -3.536 1.00 0.00 H new ATOM 0 HG SER A 38 0.694 -12.746 -3.167 1.00 0.00 H new ATOM 545 N ALA A 39 -1.093 -13.015 -0.597 1.00 0.00 N ATOM 546 CA ALA A 39 -1.119 -14.324 0.047 1.00 0.00 C ATOM 547 C ALA A 39 -2.308 -14.422 0.992 1.00 0.00 C ATOM 548 O ALA A 39 -2.622 -15.500 1.498 1.00 0.00 O ATOM 549 CB ALA A 39 0.181 -14.580 0.796 1.00 0.00 C ATOM 0 H ALA A 39 -0.726 -12.269 -0.006 1.00 0.00 H new ATOM 0 HA ALA A 39 -1.223 -15.087 -0.724 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.141 -15.561 1.269 1.00 0.00 H new ATOM 0 HB2 ALA A 39 1.016 -14.548 0.096 1.00 0.00 H new ATOM 0 HB3 ALA A 39 0.318 -13.814 1.560 1.00 0.00 H new ATOM 555 N SER A 40 -2.934 -13.265 1.235 1.00 0.00 N ATOM 556 CA SER A 40 -4.124 -13.149 2.085 1.00 0.00 C ATOM 557 C SER A 40 -3.794 -12.893 3.550 1.00 0.00 C ATOM 558 O SER A 40 -3.116 -13.684 4.204 1.00 0.00 O ATOM 559 CB SER A 40 -5.026 -14.383 1.967 1.00 0.00 C ATOM 560 OG SER A 40 -6.278 -14.162 2.592 1.00 0.00 O ATOM 0 H SER A 40 -2.626 -12.375 0.844 1.00 0.00 H new ATOM 0 HA SER A 40 -4.660 -12.276 1.713 1.00 0.00 H new ATOM 0 HB2 SER A 40 -5.179 -14.626 0.916 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.534 -15.242 2.424 1.00 0.00 H new ATOM 0 HG SER A 40 -6.824 -13.571 2.032 1.00 0.00 H new ATOM 566 N SER A 41 -4.292 -11.762 4.047 1.00 0.00 N ATOM 567 CA SER A 41 -4.124 -11.378 5.441 1.00 0.00 C ATOM 568 C SER A 41 -5.498 -11.251 6.067 1.00 0.00 C ATOM 569 O SER A 41 -6.423 -10.739 5.442 1.00 0.00 O ATOM 570 CB SER A 41 -3.382 -10.048 5.585 1.00 0.00 C ATOM 571 OG SER A 41 -2.612 -10.022 6.774 1.00 0.00 O ATOM 0 H SER A 41 -4.822 -11.089 3.493 1.00 0.00 H new ATOM 0 HA SER A 41 -3.528 -12.142 5.940 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.732 -9.895 4.723 1.00 0.00 H new ATOM 0 HB3 SER A 41 -4.099 -9.227 5.594 1.00 0.00 H new ATOM 0 HG SER A 41 -2.146 -9.163 6.843 1.00 0.00 H new ATOM 577 N ALA A 42 -5.625 -11.703 7.299 1.00 0.00 N ATOM 578 CA ALA A 42 -6.902 -11.650 8.004 1.00 0.00 C ATOM 579 C ALA A 42 -7.403 -10.216 8.122 1.00 0.00 C ATOM 580 O ALA A 42 -8.542 -9.970 8.524 1.00 0.00 O ATOM 581 CB ALA A 42 -6.762 -12.271 9.383 1.00 0.00 C ATOM 0 H ALA A 42 -4.862 -12.113 7.838 1.00 0.00 H new ATOM 0 HA ALA A 42 -7.633 -12.218 7.429 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -7.720 -12.227 9.901 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -6.451 -13.311 9.284 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -6.014 -11.722 9.955 1.00 0.00 H new ATOM 587 N ALA A 43 -6.546 -9.279 7.752 1.00 0.00 N ATOM 588 CA ALA A 43 -6.864 -7.867 7.845 1.00 0.00 C ATOM 589 C ALA A 43 -7.574 -7.332 6.615 1.00 0.00 C ATOM 590 O ALA A 43 -8.700 -6.863 6.715 1.00 0.00 O ATOM 591 CB ALA A 43 -5.588 -7.084 8.108 1.00 0.00 C ATOM 0 H ALA A 43 -5.616 -9.475 7.381 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.562 -7.742 8.673 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.821 -6.022 8.179 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.141 -7.421 9.043 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.886 -7.248 7.291 1.00 0.00 H new ATOM 597 N CYS A 44 -6.922 -7.406 5.464 1.00 0.00 N ATOM 598 CA CYS A 44 -7.498 -6.898 4.222 1.00 0.00 C ATOM 599 C CYS A 44 -8.986 -7.215 4.097 1.00 0.00 C ATOM 600 O CYS A 44 -9.752 -6.442 3.518 1.00 0.00 O ATOM 601 CB CYS A 44 -6.726 -7.435 3.021 1.00 0.00 C ATOM 602 SG CYS A 44 -5.609 -8.827 3.396 1.00 0.00 S ATOM 0 H CYS A 44 -5.992 -7.813 5.362 1.00 0.00 H new ATOM 0 HA CYS A 44 -7.409 -5.812 4.244 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -7.439 -7.753 2.260 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -6.141 -6.623 2.589 1.00 0.00 H new ATOM 607 N ILE A 45 -9.392 -8.348 4.636 1.00 0.00 N ATOM 608 CA ILE A 45 -10.789 -8.744 4.595 1.00 0.00 C ATOM 609 C ILE A 45 -11.565 -8.088 5.735 1.00 0.00 C ATOM 610 O ILE A 45 -12.639 -7.471 5.538 1.00 0.00 O ATOM 611 CB ILE A 45 -10.950 -10.272 4.643 1.00 0.00 C ATOM 612 CG1 ILE A 45 -9.662 -10.962 4.189 1.00 0.00 C ATOM 613 CG2 ILE A 45 -12.113 -10.703 3.761 1.00 0.00 C ATOM 614 CD1 ILE A 45 -9.010 -11.799 5.268 1.00 0.00 C ATOM 0 H ILE A 45 -8.776 -9.011 5.107 1.00 0.00 H new ATOM 0 HA ILE A 45 -11.200 -8.400 3.646 1.00 0.00 H new ATOM 0 HB ILE A 45 -11.157 -10.567 5.672 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -9.883 -11.598 3.332 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.954 -10.205 3.851 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -12.218 -11.787 3.802 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -13.031 -10.235 4.116 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -11.923 -10.396 2.733 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -8.103 -12.258 4.874 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -8.757 -11.165 6.117 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -9.700 -12.579 5.590 1.00 0.00 H new ATOM 626 N ALA A 46 -10.994 -8.172 6.934 1.00 0.00 N ATOM 627 CA ALA A 46 -11.638 -7.560 8.090 1.00 0.00 C ATOM 628 C ALA A 46 -11.780 -6.087 7.770 1.00 0.00 C ATOM 629 O ALA A 46 -12.595 -5.341 8.328 1.00 0.00 O ATOM 630 CB ALA A 46 -10.821 -7.781 9.353 1.00 0.00 C ATOM 0 H ALA A 46 -10.111 -8.644 7.127 1.00 0.00 H new ATOM 0 HA ALA A 46 -12.613 -8.009 8.281 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -11.325 -7.314 10.199 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -10.718 -8.850 9.537 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -9.833 -7.337 9.229 1.00 0.00 H new ATOM 636 N ALA A 47 -10.965 -5.712 6.807 1.00 0.00 N ATOM 637 CA ALA A 47 -10.898 -4.376 6.297 1.00 0.00 C ATOM 638 C ALA A 47 -12.150 -4.047 5.519 1.00 0.00 C ATOM 639 O ALA A 47 -12.751 -2.994 5.719 1.00 0.00 O ATOM 640 CB ALA A 47 -9.690 -4.265 5.399 1.00 0.00 C ATOM 0 H ALA A 47 -10.316 -6.353 6.350 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.815 -3.671 7.125 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -9.624 -3.252 5.001 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -8.790 -4.490 5.971 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -9.783 -4.973 4.575 1.00 0.00 H new ATOM 646 N VAL A 48 -12.551 -4.966 4.640 1.00 0.00 N ATOM 647 CA VAL A 48 -13.732 -4.759 3.814 1.00 0.00 C ATOM 648 C VAL A 48 -14.828 -4.127 4.624 1.00 0.00 C ATOM 649 O VAL A 48 -15.573 -3.278 4.139 1.00 0.00 O ATOM 650 CB VAL A 48 -14.276 -6.082 3.244 1.00 0.00 C ATOM 651 CG1 VAL A 48 -15.378 -5.818 2.228 1.00 0.00 C ATOM 652 CG2 VAL A 48 -13.162 -6.908 2.633 1.00 0.00 C ATOM 0 H VAL A 48 -12.076 -5.855 4.485 1.00 0.00 H new ATOM 0 HA VAL A 48 -13.429 -4.111 2.992 1.00 0.00 H new ATOM 0 HB VAL A 48 -14.704 -6.655 4.067 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -15.748 -6.766 1.838 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -16.195 -5.280 2.709 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -14.981 -5.219 1.409 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -13.573 -7.837 2.238 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -12.693 -6.346 1.825 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -12.418 -7.136 3.396 1.00 0.00 H new ATOM 662 N GLY A 49 -14.920 -4.553 5.859 1.00 0.00 N ATOM 663 CA GLY A 49 -15.947 -4.012 6.731 1.00 0.00 C ATOM 664 C GLY A 49 -15.574 -2.737 7.484 1.00 0.00 C ATOM 665 O GLY A 49 -16.456 -1.976 7.874 1.00 0.00 O ATOM 0 H GLY A 49 -14.314 -5.256 6.282 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -16.836 -3.812 6.133 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.218 -4.776 7.460 1.00 0.00 H new ATOM 669 N GLU A 50 -14.286 -2.469 7.662 1.00 0.00 N ATOM 670 CA GLU A 50 -13.862 -1.336 8.497 1.00 0.00 C ATOM 671 C GLU A 50 -13.432 -0.010 7.838 1.00 0.00 C ATOM 672 O GLU A 50 -12.599 0.680 8.413 1.00 0.00 O ATOM 673 CB GLU A 50 -12.858 -1.815 9.520 1.00 0.00 C ATOM 674 CG GLU A 50 -13.551 -2.609 10.593 1.00 0.00 C ATOM 675 CD GLU A 50 -13.307 -2.061 11.986 1.00 0.00 C ATOM 676 OE1 GLU A 50 -14.084 -1.185 12.423 1.00 0.00 O ATOM 677 OE2 GLU A 50 -12.341 -2.506 12.639 1.00 0.00 O ATOM 0 H GLU A 50 -13.523 -3.006 7.250 1.00 0.00 H new ATOM 0 HA GLU A 50 -14.797 -1.011 8.952 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -12.099 -2.429 9.036 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -12.344 -0.962 9.963 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -14.623 -2.619 10.395 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -13.209 -3.643 10.550 1.00 0.00 H new ATOM 684 N LEU A 51 -13.866 0.285 6.610 1.00 0.00 N ATOM 685 CA LEU A 51 -13.590 1.605 5.971 1.00 0.00 C ATOM 686 C LEU A 51 -12.554 1.521 4.888 1.00 0.00 C ATOM 687 O LEU A 51 -11.340 1.406 5.150 1.00 0.00 O ATOM 688 CB LEU A 51 -13.224 2.694 6.969 1.00 0.00 C ATOM 689 CG LEU A 51 -13.405 4.121 6.454 1.00 0.00 C ATOM 690 CD1 LEU A 51 -14.880 4.462 6.279 1.00 0.00 C ATOM 691 CD2 LEU A 51 -12.718 5.120 7.373 1.00 0.00 C ATOM 0 H LEU A 51 -14.407 -0.357 6.030 1.00 0.00 H new ATOM 0 HA LEU A 51 -14.536 1.890 5.511 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -13.832 2.566 7.865 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -12.184 2.559 7.268 1.00 0.00 H new ATOM 0 HG LEU A 51 -12.933 4.185 5.474 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -14.976 5.484 5.912 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -15.330 3.775 5.562 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -15.391 4.372 7.238 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -12.861 6.129 6.986 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -13.148 5.051 8.372 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -11.652 4.897 7.421 1.00 0.00 H new ATOM 703 N GLY A 52 -13.085 1.599 3.661 1.00 0.00 N ATOM 704 CA GLY A 52 -12.309 1.489 2.453 1.00 0.00 C ATOM 705 C GLY A 52 -11.406 0.325 2.554 1.00 0.00 C ATOM 706 O GLY A 52 -10.480 0.157 1.763 1.00 0.00 O ATOM 0 H GLY A 52 -14.081 1.742 3.494 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -12.969 1.378 1.593 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -11.731 2.399 2.295 1.00 0.00 H new ATOM 710 N LEU A 53 -11.729 -0.477 3.555 1.00 0.00 N ATOM 711 CA LEU A 53 -11.017 -1.661 3.904 1.00 0.00 C ATOM 712 C LEU A 53 -10.031 -1.307 5.000 1.00 0.00 C ATOM 713 O LEU A 53 -8.835 -1.565 4.870 1.00 0.00 O ATOM 714 CB LEU A 53 -10.319 -2.319 2.708 1.00 0.00 C ATOM 715 CG LEU A 53 -11.198 -2.696 1.492 1.00 0.00 C ATOM 716 CD1 LEU A 53 -11.045 -4.165 1.151 1.00 0.00 C ATOM 717 CD2 LEU A 53 -12.666 -2.356 1.724 1.00 0.00 C ATOM 0 H LEU A 53 -12.530 -0.300 4.162 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.728 -2.407 4.259 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -9.536 -1.645 2.362 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.826 -3.225 3.062 1.00 0.00 H new ATOM 0 HG LEU A 53 -10.850 -2.101 0.648 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.672 -4.407 0.293 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.003 -4.376 0.910 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -11.349 -4.770 2.005 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -13.248 -2.637 0.846 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -13.033 -2.903 2.593 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -12.768 -1.285 1.899 1.00 0.00 H new ATOM 729 N ASP A 54 -10.556 -0.702 6.089 1.00 0.00 N ATOM 730 CA ASP A 54 -9.734 -0.289 7.221 1.00 0.00 C ATOM 731 C ASP A 54 -8.285 -0.297 6.833 1.00 0.00 C ATOM 732 O ASP A 54 -7.676 -1.357 6.793 1.00 0.00 O ATOM 733 CB ASP A 54 -9.919 -1.237 8.391 1.00 0.00 C ATOM 734 CG ASP A 54 -9.876 -0.531 9.733 1.00 0.00 C ATOM 735 OD1 ASP A 54 -10.163 0.684 9.776 1.00 0.00 O ATOM 736 OD2 ASP A 54 -9.560 -1.196 10.742 1.00 0.00 O ATOM 0 H ASP A 54 -11.549 -0.494 6.196 1.00 0.00 H new ATOM 0 HA ASP A 54 -10.042 0.715 7.511 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -10.874 -1.753 8.287 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -9.140 -1.999 8.362 1.00 0.00 H new ATOM 741 N VAL A 55 -7.732 0.855 6.520 1.00 0.00 N ATOM 742 CA VAL A 55 -6.325 0.884 6.122 1.00 0.00 C ATOM 743 C VAL A 55 -5.472 -0.006 7.012 1.00 0.00 C ATOM 744 O VAL A 55 -4.699 -0.801 6.480 1.00 0.00 O ATOM 745 CB VAL A 55 -5.700 2.297 6.044 1.00 0.00 C ATOM 746 CG1 VAL A 55 -4.845 2.623 7.270 1.00 0.00 C ATOM 747 CG2 VAL A 55 -4.865 2.404 4.775 1.00 0.00 C ATOM 0 H VAL A 55 -8.207 1.758 6.529 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.329 0.495 5.104 1.00 0.00 H new ATOM 0 HB VAL A 55 -6.512 3.024 6.023 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -4.429 3.625 7.167 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -5.463 2.577 8.167 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -4.034 1.900 7.350 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -4.422 3.398 4.714 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.074 1.654 4.796 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.501 2.236 3.906 1.00 0.00 H new ATOM 757 N PRO A 56 -5.614 0.070 8.371 1.00 0.00 N ATOM 758 CA PRO A 56 -4.811 -0.756 9.270 1.00 0.00 C ATOM 759 C PRO A 56 -4.971 -2.219 8.926 1.00 0.00 C ATOM 760 O PRO A 56 -4.179 -3.064 9.345 1.00 0.00 O ATOM 761 CB PRO A 56 -5.373 -0.462 10.668 1.00 0.00 C ATOM 762 CG PRO A 56 -6.700 0.167 10.429 1.00 0.00 C ATOM 763 CD PRO A 56 -6.571 0.905 9.130 1.00 0.00 C ATOM 0 HA PRO A 56 -3.746 -0.536 9.199 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -5.470 -1.376 11.254 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -4.715 0.205 11.225 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -7.486 -0.586 10.375 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -6.964 0.846 11.240 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -7.529 0.990 8.617 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -6.196 1.918 9.276 1.00 0.00 H new ATOM 771 N LEU A 57 -6.049 -2.518 8.218 1.00 0.00 N ATOM 772 CA LEU A 57 -6.307 -3.866 7.785 1.00 0.00 C ATOM 773 C LEU A 57 -5.870 -4.129 6.337 1.00 0.00 C ATOM 774 O LEU A 57 -4.927 -4.869 6.110 1.00 0.00 O ATOM 775 CB LEU A 57 -7.773 -4.224 7.978 1.00 0.00 C ATOM 776 CG LEU A 57 -8.307 -4.062 9.407 1.00 0.00 C ATOM 777 CD1 LEU A 57 -9.765 -4.480 9.483 1.00 0.00 C ATOM 778 CD2 LEU A 57 -7.476 -4.872 10.390 1.00 0.00 C ATOM 0 H LEU A 57 -6.755 -1.838 7.935 1.00 0.00 H new ATOM 0 HA LEU A 57 -5.697 -4.513 8.415 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -8.372 -3.603 7.312 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.921 -5.259 7.668 1.00 0.00 H new ATOM 0 HG LEU A 57 -8.231 -3.009 9.678 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -10.126 -4.358 10.504 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -10.357 -3.858 8.812 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -9.860 -5.525 9.187 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -7.873 -4.741 11.397 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -7.516 -5.927 10.118 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -6.442 -4.529 10.361 1.00 0.00 H new ATOM 790 N ASP A 58 -6.563 -3.510 5.366 1.00 0.00 N ATOM 791 CA ASP A 58 -6.289 -3.737 3.934 1.00 0.00 C ATOM 792 C ASP A 58 -5.007 -3.153 3.403 1.00 0.00 C ATOM 793 O ASP A 58 -4.162 -3.891 2.913 1.00 0.00 O ATOM 794 CB ASP A 58 -7.421 -3.204 3.091 1.00 0.00 C ATOM 795 CG ASP A 58 -7.158 -3.348 1.605 1.00 0.00 C ATOM 796 OD1 ASP A 58 -6.554 -4.363 1.204 1.00 0.00 O ATOM 797 OD2 ASP A 58 -7.558 -2.443 0.844 1.00 0.00 O ATOM 0 H ASP A 58 -7.318 -2.848 5.546 1.00 0.00 H new ATOM 0 HA ASP A 58 -6.187 -4.820 3.863 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -8.340 -3.732 3.347 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.582 -2.152 3.328 1.00 0.00 H new ATOM 802 N LEU A 59 -4.859 -1.846 3.448 1.00 0.00 N ATOM 803 CA LEU A 59 -3.662 -1.249 2.907 1.00 0.00 C ATOM 804 C LEU A 59 -2.522 -1.542 3.811 1.00 0.00 C ATOM 805 O LEU A 59 -1.386 -1.264 3.495 1.00 0.00 O ATOM 806 CB LEU A 59 -3.812 0.220 2.611 1.00 0.00 C ATOM 807 CG LEU A 59 -4.052 0.513 1.135 1.00 0.00 C ATOM 808 CD1 LEU A 59 -2.770 0.436 0.335 1.00 0.00 C ATOM 809 CD2 LEU A 59 -5.095 -0.439 0.552 1.00 0.00 C ATOM 0 H LEU A 59 -5.535 -1.192 3.843 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.463 -1.699 1.934 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -4.642 0.619 3.194 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.913 0.744 2.937 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.431 1.533 1.066 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.981 0.651 -0.713 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.057 1.166 0.719 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.346 -0.565 0.422 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.248 -0.209 -0.502 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.746 -1.467 0.652 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.036 -0.321 1.090 1.00 0.00 H new ATOM 821 N ALA A 60 -2.874 -2.002 4.988 1.00 0.00 N ATOM 822 CA ALA A 60 -1.902 -2.419 5.958 1.00 0.00 C ATOM 823 C ALA A 60 -1.585 -3.873 5.666 1.00 0.00 C ATOM 824 O ALA A 60 -0.493 -4.348 5.934 1.00 0.00 O ATOM 825 CB ALA A 60 -2.434 -2.238 7.351 1.00 0.00 C ATOM 0 H ALA A 60 -3.842 -2.096 5.296 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.996 -1.816 5.893 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -1.683 -2.560 8.072 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.669 -1.187 7.517 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.337 -2.836 7.476 1.00 0.00 H new ATOM 831 N CYS A 61 -2.589 -4.572 5.127 1.00 0.00 N ATOM 832 CA CYS A 61 -2.434 -5.955 4.694 1.00 0.00 C ATOM 833 C CYS A 61 -1.572 -5.894 3.450 1.00 0.00 C ATOM 834 O CYS A 61 -0.700 -6.728 3.187 1.00 0.00 O ATOM 835 CB CYS A 61 -3.801 -6.571 4.357 1.00 0.00 C ATOM 836 SG CYS A 61 -3.742 -8.019 3.253 1.00 0.00 S ATOM 0 H CYS A 61 -3.525 -4.193 4.981 1.00 0.00 H new ATOM 0 HA CYS A 61 -1.987 -6.572 5.473 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -4.291 -6.861 5.286 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -4.424 -5.805 3.894 1.00 0.00 H new ATOM 841 N ALA A 62 -1.820 -4.827 2.716 1.00 0.00 N ATOM 842 CA ALA A 62 -1.121 -4.543 1.496 1.00 0.00 C ATOM 843 C ALA A 62 0.228 -3.905 1.798 1.00 0.00 C ATOM 844 O ALA A 62 1.237 -4.261 1.194 1.00 0.00 O ATOM 845 CB ALA A 62 -1.977 -3.644 0.621 1.00 0.00 C ATOM 0 H ALA A 62 -2.523 -4.129 2.960 1.00 0.00 H new ATOM 0 HA ALA A 62 -0.933 -5.471 0.956 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -1.447 -3.427 -0.306 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -2.917 -4.146 0.393 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.182 -2.712 1.148 1.00 0.00 H new ATOM 851 N ALA A 63 0.232 -2.944 2.733 1.00 0.00 N ATOM 852 CA ALA A 63 1.464 -2.269 3.125 1.00 0.00 C ATOM 853 C ALA A 63 2.351 -3.268 3.797 1.00 0.00 C ATOM 854 O ALA A 63 3.570 -3.207 3.698 1.00 0.00 O ATOM 855 CB ALA A 63 1.214 -1.089 4.044 1.00 0.00 C ATOM 0 H ALA A 63 -0.602 -2.623 3.225 1.00 0.00 H new ATOM 0 HA ALA A 63 1.938 -1.867 2.229 1.00 0.00 H new ATOM 0 HB1 ALA A 63 2.164 -0.623 4.305 1.00 0.00 H new ATOM 0 HB2 ALA A 63 0.580 -0.361 3.537 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.718 -1.433 4.951 1.00 0.00 H new ATOM 861 N THR A 64 1.714 -4.208 4.477 1.00 0.00 N ATOM 862 CA THR A 64 2.455 -5.272 5.124 1.00 0.00 C ATOM 863 C THR A 64 2.891 -6.233 4.039 1.00 0.00 C ATOM 864 O THR A 64 3.312 -7.357 4.315 1.00 0.00 O ATOM 865 CB THR A 64 1.669 -6.032 6.236 1.00 0.00 C ATOM 866 OG1 THR A 64 2.591 -6.725 7.084 1.00 0.00 O ATOM 867 CG2 THR A 64 0.665 -7.040 5.670 1.00 0.00 C ATOM 0 H THR A 64 0.702 -4.254 4.593 1.00 0.00 H new ATOM 0 HA THR A 64 3.299 -4.822 5.647 1.00 0.00 H new ATOM 0 HB THR A 64 1.107 -5.284 6.796 1.00 0.00 H new ATOM 0 HG1 THR A 64 3.234 -7.219 6.534 1.00 0.00 H new ATOM 0 HG21 THR A 64 0.148 -7.538 6.490 1.00 0.00 H new ATOM 0 HG22 THR A 64 -0.061 -6.519 5.046 1.00 0.00 H new ATOM 0 HG23 THR A 64 1.193 -7.781 5.070 1.00 0.00 H new ATOM 875 N ALA A 65 2.782 -5.771 2.781 1.00 0.00 N ATOM 876 CA ALA A 65 3.132 -6.604 1.655 1.00 0.00 C ATOM 877 C ALA A 65 3.296 -5.854 0.315 1.00 0.00 C ATOM 878 O ALA A 65 4.321 -5.240 0.071 1.00 0.00 O ATOM 879 CB ALA A 65 2.092 -7.678 1.528 1.00 0.00 C ATOM 0 H ALA A 65 2.457 -4.835 2.537 1.00 0.00 H new ATOM 0 HA ALA A 65 4.120 -7.017 1.860 1.00 0.00 H new ATOM 0 HB1 ALA A 65 2.335 -8.322 0.682 1.00 0.00 H new ATOM 0 HB2 ALA A 65 2.069 -8.272 2.442 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.115 -7.222 1.368 1.00 0.00 H new ATOM 885 N THR A 66 2.282 -5.932 -0.559 1.00 0.00 N ATOM 886 CA THR A 66 2.367 -5.352 -1.913 1.00 0.00 C ATOM 887 C THR A 66 2.099 -3.854 -2.009 1.00 0.00 C ATOM 888 O THR A 66 2.841 -3.170 -2.711 1.00 0.00 O ATOM 889 CB THR A 66 1.448 -6.096 -2.897 1.00 0.00 C ATOM 890 OG1 THR A 66 1.055 -7.353 -2.345 1.00 0.00 O ATOM 891 CG2 THR A 66 2.151 -6.339 -4.220 1.00 0.00 C ATOM 0 H THR A 66 1.393 -6.390 -0.356 1.00 0.00 H new ATOM 0 HA THR A 66 3.414 -5.485 -2.184 1.00 0.00 H new ATOM 0 HB THR A 66 0.570 -5.474 -3.070 1.00 0.00 H new ATOM 0 HG1 THR A 66 1.851 -7.845 -2.054 1.00 0.00 H new ATOM 0 HG21 THR A 66 1.479 -6.866 -4.897 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.435 -5.384 -4.662 1.00 0.00 H new ATOM 0 HG23 THR A 66 3.044 -6.941 -4.052 1.00 0.00 H new ATOM 899 N SER A 67 1.061 -3.309 -1.361 1.00 0.00 N ATOM 900 CA SER A 67 0.864 -1.848 -1.463 1.00 0.00 C ATOM 901 C SER A 67 2.189 -1.229 -1.123 1.00 0.00 C ATOM 902 O SER A 67 2.501 -0.089 -1.469 1.00 0.00 O ATOM 903 CB SER A 67 -0.216 -1.289 -0.559 1.00 0.00 C ATOM 904 OG SER A 67 0.026 -1.597 0.784 1.00 0.00 O ATOM 0 H SER A 67 0.381 -3.815 -0.793 1.00 0.00 H new ATOM 0 HA SER A 67 0.522 -1.614 -2.471 1.00 0.00 H new ATOM 0 HB2 SER A 67 -0.269 -0.207 -0.681 1.00 0.00 H new ATOM 0 HB3 SER A 67 -1.184 -1.691 -0.856 1.00 0.00 H new ATOM 0 HG SER A 67 -0.132 -0.802 1.335 1.00 0.00 H new ATOM 910 N SER A 68 2.926 -2.035 -0.379 1.00 0.00 N ATOM 911 CA SER A 68 4.277 -1.803 -0.010 1.00 0.00 C ATOM 912 C SER A 68 4.521 -0.721 1.004 1.00 0.00 C ATOM 913 O SER A 68 4.426 0.469 0.734 1.00 0.00 O ATOM 914 CB SER A 68 5.163 -1.618 -1.231 1.00 0.00 C ATOM 915 OG SER A 68 4.439 -1.162 -2.358 1.00 0.00 O ATOM 0 H SER A 68 2.561 -2.911 -0.005 1.00 0.00 H new ATOM 0 HA SER A 68 4.555 -2.717 0.514 1.00 0.00 H new ATOM 0 HB2 SER A 68 5.954 -0.905 -0.998 1.00 0.00 H new ATOM 0 HB3 SER A 68 5.647 -2.564 -1.472 1.00 0.00 H new ATOM 0 HG SER A 68 4.289 -0.197 -2.282 1.00 0.00 H new ATOM 921 N ALA A 69 4.850 -1.207 2.179 1.00 0.00 N ATOM 922 CA ALA A 69 5.230 -0.383 3.314 1.00 0.00 C ATOM 923 C ALA A 69 5.286 -1.235 4.569 1.00 0.00 C ATOM 924 O ALA A 69 4.771 -0.860 5.623 1.00 0.00 O ATOM 925 CB ALA A 69 4.287 0.792 3.501 1.00 0.00 C ATOM 0 H ALA A 69 4.863 -2.207 2.381 1.00 0.00 H new ATOM 0 HA ALA A 69 6.219 0.031 3.117 1.00 0.00 H new ATOM 0 HB1 ALA A 69 4.607 1.382 4.360 1.00 0.00 H new ATOM 0 HB2 ALA A 69 4.301 1.415 2.607 1.00 0.00 H new ATOM 0 HB3 ALA A 69 3.275 0.423 3.671 1.00 0.00 H new ATOM 931 N THR A 70 5.923 -2.390 4.436 1.00 0.00 N ATOM 932 CA THR A 70 6.049 -3.331 5.535 1.00 0.00 C ATOM 933 C THR A 70 7.402 -3.206 6.216 1.00 0.00 C ATOM 934 O THR A 70 8.406 -3.735 5.740 1.00 0.00 O ATOM 935 CB THR A 70 5.843 -4.784 5.058 1.00 0.00 C ATOM 936 OG1 THR A 70 6.779 -5.655 5.702 1.00 0.00 O ATOM 937 CG2 THR A 70 5.989 -4.893 3.547 1.00 0.00 C ATOM 0 H THR A 70 6.363 -2.698 3.569 1.00 0.00 H new ATOM 0 HA THR A 70 5.268 -3.085 6.255 1.00 0.00 H new ATOM 0 HB THR A 70 4.830 -5.084 5.326 1.00 0.00 H new ATOM 0 HG1 THR A 70 6.944 -6.436 5.133 1.00 0.00 H new ATOM 0 HG21 THR A 70 5.839 -5.928 3.241 1.00 0.00 H new ATOM 0 HG22 THR A 70 5.246 -4.260 3.063 1.00 0.00 H new ATOM 0 HG23 THR A 70 6.988 -4.569 3.254 1.00 0.00 H new ATOM 945 N GLU A 71 7.413 -2.501 7.337 1.00 0.00 N ATOM 946 CA GLU A 71 8.627 -2.296 8.113 1.00 0.00 C ATOM 947 C GLU A 71 9.139 -3.619 8.666 1.00 0.00 C ATOM 948 O GLU A 71 10.199 -3.682 9.290 1.00 0.00 O ATOM 949 CB GLU A 71 8.338 -1.297 9.238 1.00 0.00 C ATOM 950 CG GLU A 71 9.452 -1.166 10.269 1.00 0.00 C ATOM 951 CD GLU A 71 9.135 -0.146 11.345 1.00 0.00 C ATOM 952 OE1 GLU A 71 9.317 1.063 11.090 1.00 0.00 O ATOM 953 OE2 GLU A 71 8.705 -0.556 12.444 1.00 0.00 O ATOM 0 H GLU A 71 6.585 -2.057 7.733 1.00 0.00 H new ATOM 0 HA GLU A 71 9.408 -1.889 7.471 1.00 0.00 H new ATOM 0 HB2 GLU A 71 8.151 -0.318 8.798 1.00 0.00 H new ATOM 0 HB3 GLU A 71 7.422 -1.598 9.747 1.00 0.00 H new ATOM 0 HG2 GLU A 71 9.627 -2.136 10.734 1.00 0.00 H new ATOM 0 HG3 GLU A 71 10.376 -0.882 9.766 1.00 0.00 H new ATOM 960 N ALA A 72 8.391 -4.685 8.409 1.00 0.00 N ATOM 961 CA ALA A 72 8.766 -5.999 8.895 1.00 0.00 C ATOM 962 C ALA A 72 9.591 -6.780 7.871 1.00 0.00 C ATOM 963 O ALA A 72 10.496 -7.528 8.243 1.00 0.00 O ATOM 964 CB ALA A 72 7.531 -6.788 9.297 1.00 0.00 C ATOM 0 H ALA A 72 7.526 -4.662 7.869 1.00 0.00 H new ATOM 0 HA ALA A 72 9.396 -5.852 9.772 1.00 0.00 H new ATOM 0 HB1 ALA A 72 7.830 -7.772 9.659 1.00 0.00 H new ATOM 0 HB2 ALA A 72 7.000 -6.256 10.087 1.00 0.00 H new ATOM 0 HB3 ALA A 72 6.876 -6.903 8.434 1.00 0.00 H new ATOM 970 N CYS A 73 9.285 -6.611 6.584 1.00 0.00 N ATOM 971 CA CYS A 73 10.021 -7.320 5.537 1.00 0.00 C ATOM 972 C CYS A 73 10.845 -6.364 4.718 1.00 0.00 C ATOM 973 O CYS A 73 11.554 -6.777 3.802 1.00 0.00 O ATOM 974 CB CYS A 73 9.077 -8.024 4.565 1.00 0.00 C ATOM 975 SG CYS A 73 7.651 -8.842 5.336 1.00 0.00 S ATOM 0 H CYS A 73 8.543 -5.998 6.245 1.00 0.00 H new ATOM 0 HA CYS A 73 10.653 -8.046 6.049 1.00 0.00 H new ATOM 0 HB2 CYS A 73 8.711 -7.293 3.844 1.00 0.00 H new ATOM 0 HB3 CYS A 73 9.644 -8.768 4.005 1.00 0.00 H new ATOM 980 N LYS A 74 10.770 -5.091 5.047 1.00 0.00 N ATOM 981 CA LYS A 74 11.456 -4.107 4.253 1.00 0.00 C ATOM 982 C LYS A 74 12.963 -4.173 4.310 1.00 0.00 C ATOM 983 O LYS A 74 13.577 -5.221 4.113 1.00 0.00 O ATOM 984 CB LYS A 74 10.986 -2.691 4.543 1.00 0.00 C ATOM 985 CG LYS A 74 11.230 -1.773 3.355 1.00 0.00 C ATOM 986 CD LYS A 74 12.348 -0.769 3.597 1.00 0.00 C ATOM 987 CE LYS A 74 12.644 0.086 2.378 1.00 0.00 C ATOM 988 NZ LYS A 74 13.322 1.361 2.741 1.00 0.00 N ATOM 0 H LYS A 74 10.250 -4.723 5.844 1.00 0.00 H new ATOM 0 HA LYS A 74 11.179 -4.373 3.233 1.00 0.00 H new ATOM 0 HB2 LYS A 74 9.923 -2.701 4.785 1.00 0.00 H new ATOM 0 HB3 LYS A 74 11.509 -2.304 5.418 1.00 0.00 H new ATOM 0 HG2 LYS A 74 11.475 -2.377 2.481 1.00 0.00 H new ATOM 0 HG3 LYS A 74 10.310 -1.235 3.124 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.075 -0.123 4.431 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.252 -1.302 3.889 1.00 0.00 H new ATOM 0 HE2 LYS A 74 13.273 -0.475 1.686 1.00 0.00 H new ATOM 0 HE3 LYS A 74 11.713 0.307 1.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 13.079 2.094 2.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 13.009 1.664 3.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.352 1.217 2.747 1.00 0.00 H new ATOM 1002 N GLY A 75 13.540 -3.024 4.584 1.00 0.00 N ATOM 1003 CA GLY A 75 14.956 -2.879 4.539 1.00 0.00 C ATOM 1004 C GLY A 75 15.333 -2.926 3.082 1.00 0.00 C ATOM 1005 O GLY A 75 16.477 -3.204 2.722 1.00 0.00 O ATOM 0 H GLY A 75 13.034 -2.176 4.841 1.00 0.00 H new ATOM 0 HA2 GLY A 75 15.266 -1.937 4.992 1.00 0.00 H new ATOM 0 HA3 GLY A 75 15.448 -3.677 5.095 1.00 0.00 H new ATOM 1009 N CYS A 76 14.323 -2.641 2.229 1.00 0.00 N ATOM 1010 CA CYS A 76 14.497 -2.706 0.797 1.00 0.00 C ATOM 1011 C CYS A 76 13.420 -1.964 -0.022 1.00 0.00 C ATOM 1012 O CYS A 76 13.713 -0.974 -0.689 1.00 0.00 O ATOM 1013 CB CYS A 76 14.437 -4.176 0.383 1.00 0.00 C ATOM 1014 SG CYS A 76 16.033 -5.050 0.351 1.00 0.00 S ATOM 0 H CYS A 76 13.387 -2.366 2.527 1.00 0.00 H new ATOM 0 HA CYS A 76 15.450 -2.221 0.586 1.00 0.00 H new ATOM 0 HB2 CYS A 76 13.770 -4.700 1.067 1.00 0.00 H new ATOM 0 HB3 CYS A 76 13.990 -4.238 -0.609 1.00 0.00 H new ATOM 1019 N LEU A 77 12.168 -2.432 0.071 1.00 0.00 N ATOM 1020 CA LEU A 77 11.078 -1.950 -0.806 1.00 0.00 C ATOM 1021 C LEU A 77 10.133 -0.838 -0.307 1.00 0.00 C ATOM 1022 O LEU A 77 9.551 -0.169 -1.155 1.00 0.00 O ATOM 1023 CB LEU A 77 10.220 -3.161 -1.165 1.00 0.00 C ATOM 1024 CG LEU A 77 9.050 -2.899 -2.113 1.00 0.00 C ATOM 1025 CD1 LEU A 77 9.548 -2.373 -3.437 1.00 0.00 C ATOM 1026 CD2 LEU A 77 8.240 -4.161 -2.328 1.00 0.00 C ATOM 0 H LEU A 77 11.879 -3.143 0.742 1.00 0.00 H new ATOM 0 HA LEU A 77 11.607 -1.469 -1.629 1.00 0.00 H new ATOM 0 HB2 LEU A 77 10.864 -3.916 -1.615 1.00 0.00 H new ATOM 0 HB3 LEU A 77 9.825 -3.587 -0.243 1.00 0.00 H new ATOM 0 HG LEU A 77 8.407 -2.147 -1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 77 8.701 -2.192 -4.099 1.00 0.00 H new ATOM 0 HD12 LEU A 77 10.089 -1.440 -3.278 1.00 0.00 H new ATOM 0 HD13 LEU A 77 10.214 -3.106 -3.892 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.413 -3.951 -3.006 1.00 0.00 H new ATOM 0 HD22 LEU A 77 8.877 -4.933 -2.761 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.847 -4.508 -1.372 1.00 0.00 H new ATOM 1038 N TRP A 78 9.964 -0.631 1.004 1.00 0.00 N ATOM 1039 CA TRP A 78 8.993 0.380 1.516 1.00 0.00 C ATOM 1040 C TRP A 78 8.344 1.198 0.403 1.00 0.00 C ATOM 1041 O TRP A 78 9.016 2.090 -0.149 1.00 0.00 O ATOM 1042 CB TRP A 78 9.602 1.339 2.551 1.00 0.00 C ATOM 1043 CG TRP A 78 9.489 0.844 3.956 1.00 0.00 C ATOM 1044 CD1 TRP A 78 8.611 -0.080 4.433 1.00 0.00 C ATOM 1045 CD2 TRP A 78 10.297 1.235 5.059 1.00 0.00 C ATOM 1046 NE1 TRP A 78 8.851 -0.319 5.757 1.00 0.00 N ATOM 1047 CE2 TRP A 78 9.880 0.484 6.166 1.00 0.00 C ATOM 1048 CE3 TRP A 78 11.342 2.140 5.212 1.00 0.00 C ATOM 1049 CZ2 TRP A 78 10.477 0.607 7.408 1.00 0.00 C ATOM 1050 CZ3 TRP A 78 11.936 2.270 6.452 1.00 0.00 C ATOM 1051 CH2 TRP A 78 11.503 1.502 7.538 1.00 0.00 C ATOM 1052 OXT TRP A 78 7.162 0.937 0.096 1.00 0.00 O ATOM 0 H TRP A 78 10.472 -1.135 1.731 1.00 0.00 H new ATOM 0 HA TRP A 78 8.225 -0.216 2.009 1.00 0.00 H new ATOM 0 HB2 TRP A 78 10.654 1.498 2.313 1.00 0.00 H new ATOM 0 HB3 TRP A 78 9.107 2.307 2.474 1.00 0.00 H new ATOM 0 HD1 TRP A 78 7.837 -0.556 3.850 1.00 0.00 H new ATOM 0 HE1 TRP A 78 8.347 -0.985 6.342 1.00 0.00 H new ATOM 0 HE3 TRP A 78 11.683 2.731 4.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 10.144 0.015 8.248 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 12.745 2.973 6.585 1.00 0.00 H new ATOM 0 HH2 TRP A 78 11.988 1.618 8.496 1.00 0.00 H new TER 1063 TRP A 78 ATOM 1064 N ASP B 1 1.339 15.014 -0.673 1.00 0.00 N ATOM 1065 CA ASP B 1 1.825 14.488 -1.975 1.00 0.00 C ATOM 1066 C ASP B 1 2.563 13.169 -1.788 1.00 0.00 C ATOM 1067 O ASP B 1 3.228 12.683 -2.703 1.00 0.00 O ATOM 1068 CB ASP B 1 2.752 15.506 -2.643 1.00 0.00 C ATOM 1069 CG ASP B 1 4.024 15.735 -1.852 1.00 0.00 C ATOM 1070 OD1 ASP B 1 4.027 16.626 -0.976 1.00 0.00 O ATOM 1071 OD2 ASP B 1 5.018 15.022 -2.106 1.00 0.00 O ATOM 0 H1 ASP B 1 0.884 15.938 -0.820 1.00 0.00 H new ATOM 0 H2 ASP B 1 0.650 14.350 -0.266 1.00 0.00 H new ATOM 0 H3 ASP B 1 2.142 15.123 -0.021 1.00 0.00 H new ATOM 0 HA ASP B 1 0.959 14.314 -2.613 1.00 0.00 H new ATOM 0 HB2 ASP B 1 3.007 15.159 -3.644 1.00 0.00 H new ATOM 0 HB3 ASP B 1 2.224 16.453 -2.759 1.00 0.00 H new ATOM 1078 N GLN B 2 2.438 12.599 -0.592 1.00 0.00 N ATOM 1079 CA GLN B 2 3.088 11.332 -0.268 1.00 0.00 C ATOM 1080 C GLN B 2 4.605 11.445 -0.422 1.00 0.00 C ATOM 1081 O GLN B 2 5.195 10.818 -1.300 1.00 0.00 O ATOM 1082 CB GLN B 2 2.549 10.212 -1.163 1.00 0.00 C ATOM 1083 CG GLN B 2 1.103 9.832 -0.868 1.00 0.00 C ATOM 1084 CD GLN B 2 0.141 10.993 -1.039 1.00 0.00 C ATOM 1085 OE1 GLN B 2 -0.407 11.211 -2.118 1.00 0.00 O ATOM 1086 NE2 GLN B 2 -0.068 11.746 0.034 1.00 0.00 N ATOM 0 H GLN B 2 1.890 12.996 0.171 1.00 0.00 H new ATOM 0 HA GLN B 2 2.864 11.091 0.771 1.00 0.00 H new ATOM 0 HB2 GLN B 2 2.628 10.522 -2.205 1.00 0.00 H new ATOM 0 HB3 GLN B 2 3.178 9.330 -1.044 1.00 0.00 H new ATOM 0 HG2 GLN B 2 0.804 9.019 -1.529 1.00 0.00 H new ATOM 0 HG3 GLN B 2 1.032 9.455 0.152 1.00 0.00 H new ATOM 0 HE21 GLN B 2 0.408 11.529 0.910 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -0.704 12.541 -0.017 1.00 0.00 H new ATOM 1095 N PRO B 3 5.258 12.248 0.441 1.00 0.00 N ATOM 1096 CA PRO B 3 6.711 12.442 0.390 1.00 0.00 C ATOM 1097 C PRO B 3 7.485 11.187 0.780 1.00 0.00 C ATOM 1098 O PRO B 3 8.682 11.079 0.511 1.00 0.00 O ATOM 1099 CB PRO B 3 6.960 13.561 1.404 1.00 0.00 C ATOM 1100 CG PRO B 3 5.811 13.482 2.348 1.00 0.00 C ATOM 1101 CD PRO B 3 4.635 13.024 1.531 1.00 0.00 C ATOM 0 HA PRO B 3 7.050 12.679 -0.618 1.00 0.00 H new ATOM 0 HB2 PRO B 3 7.908 13.421 1.923 1.00 0.00 H new ATOM 0 HB3 PRO B 3 7.005 14.535 0.916 1.00 0.00 H new ATOM 0 HG2 PRO B 3 6.019 12.783 3.158 1.00 0.00 H new ATOM 0 HG3 PRO B 3 5.614 14.452 2.806 1.00 0.00 H new ATOM 0 HD2 PRO B 3 3.951 12.413 2.119 1.00 0.00 H new ATOM 0 HD3 PRO B 3 4.060 13.867 1.147 1.00 0.00 H new ATOM 1109 N SER B 4 6.801 10.238 1.415 1.00 0.00 N ATOM 1110 CA SER B 4 7.439 8.994 1.833 1.00 0.00 C ATOM 1111 C SER B 4 6.502 7.821 1.605 1.00 0.00 C ATOM 1112 O SER B 4 5.367 8.011 1.186 1.00 0.00 O ATOM 1113 CB SER B 4 7.831 9.064 3.308 1.00 0.00 C ATOM 1114 OG SER B 4 8.571 7.920 3.697 1.00 0.00 O ATOM 0 H SER B 4 5.811 10.306 1.650 1.00 0.00 H new ATOM 0 HA SER B 4 8.340 8.852 1.236 1.00 0.00 H new ATOM 0 HB2 SER B 4 8.423 9.961 3.487 1.00 0.00 H new ATOM 0 HB3 SER B 4 6.934 9.146 3.922 1.00 0.00 H new ATOM 0 HG SER B 4 8.810 7.992 4.645 1.00 0.00 H new ATOM 1120 N VAL B 5 6.977 6.611 1.866 1.00 0.00 N ATOM 1121 CA VAL B 5 6.145 5.429 1.687 1.00 0.00 C ATOM 1122 C VAL B 5 5.185 5.270 2.865 1.00 0.00 C ATOM 1123 O VAL B 5 3.975 5.163 2.678 1.00 0.00 O ATOM 1124 CB VAL B 5 6.985 4.139 1.487 1.00 0.00 C ATOM 1125 CG1 VAL B 5 8.451 4.473 1.244 1.00 0.00 C ATOM 1126 CG2 VAL B 5 6.822 3.171 2.658 1.00 0.00 C ATOM 0 H VAL B 5 7.923 6.423 2.199 1.00 0.00 H new ATOM 0 HA VAL B 5 5.568 5.576 0.774 1.00 0.00 H new ATOM 0 HB VAL B 5 6.605 3.635 0.598 1.00 0.00 H new ATOM 0 HG11 VAL B 5 9.016 3.551 1.107 1.00 0.00 H new ATOM 0 HG12 VAL B 5 8.540 5.090 0.350 1.00 0.00 H new ATOM 0 HG13 VAL B 5 8.847 5.018 2.101 1.00 0.00 H new ATOM 0 HG21 VAL B 5 7.425 2.281 2.481 1.00 0.00 H new ATOM 0 HG22 VAL B 5 7.150 3.654 3.578 1.00 0.00 H new ATOM 0 HG23 VAL B 5 5.774 2.886 2.752 1.00 0.00 H new ATOM 1136 N GLY B 6 5.734 5.267 4.081 1.00 0.00 N ATOM 1137 CA GLY B 6 4.907 5.124 5.265 1.00 0.00 C ATOM 1138 C GLY B 6 4.001 6.320 5.463 1.00 0.00 C ATOM 1139 O GLY B 6 2.814 6.171 5.765 1.00 0.00 O ATOM 0 H GLY B 6 6.733 5.361 4.264 1.00 0.00 H new ATOM 0 HA2 GLY B 6 4.303 4.220 5.180 1.00 0.00 H new ATOM 0 HA3 GLY B 6 5.544 5.001 6.141 1.00 0.00 H new ATOM 1143 N ASP B 7 4.564 7.511 5.288 1.00 0.00 N ATOM 1144 CA ASP B 7 3.800 8.742 5.428 1.00 0.00 C ATOM 1145 C ASP B 7 2.717 8.794 4.372 1.00 0.00 C ATOM 1146 O ASP B 7 1.613 9.280 4.618 1.00 0.00 O ATOM 1147 CB ASP B 7 4.715 9.957 5.286 1.00 0.00 C ATOM 1148 CG ASP B 7 5.694 10.086 6.437 1.00 0.00 C ATOM 1149 OD1 ASP B 7 5.284 10.567 7.515 1.00 0.00 O ATOM 1150 OD2 ASP B 7 6.870 9.706 6.261 1.00 0.00 O ATOM 0 H ASP B 7 5.546 7.648 5.049 1.00 0.00 H new ATOM 0 HA ASP B 7 3.344 8.760 6.418 1.00 0.00 H new ATOM 0 HB2 ASP B 7 5.268 9.883 4.350 1.00 0.00 H new ATOM 0 HB3 ASP B 7 4.108 10.860 5.227 1.00 0.00 H new ATOM 1155 N ALA B 8 3.049 8.293 3.188 1.00 0.00 N ATOM 1156 CA ALA B 8 2.104 8.262 2.090 1.00 0.00 C ATOM 1157 C ALA B 8 0.818 7.603 2.529 1.00 0.00 C ATOM 1158 O ALA B 8 -0.272 8.129 2.319 1.00 0.00 O ATOM 1159 CB ALA B 8 2.669 7.491 0.923 1.00 0.00 C ATOM 0 H ALA B 8 3.966 7.904 2.969 1.00 0.00 H new ATOM 0 HA ALA B 8 1.909 9.290 1.785 1.00 0.00 H new ATOM 0 HB1 ALA B 8 1.944 7.480 0.109 1.00 0.00 H new ATOM 0 HB2 ALA B 8 3.589 7.967 0.583 1.00 0.00 H new ATOM 0 HB3 ALA B 8 2.883 6.468 1.232 1.00 0.00 H new ATOM 1165 N PHE B 9 0.970 6.433 3.141 1.00 0.00 N ATOM 1166 CA PHE B 9 -0.156 5.671 3.618 1.00 0.00 C ATOM 1167 C PHE B 9 -1.061 6.534 4.479 1.00 0.00 C ATOM 1168 O PHE B 9 -2.229 6.679 4.174 1.00 0.00 O ATOM 1169 CB PHE B 9 0.324 4.442 4.373 1.00 0.00 C ATOM 1170 CG PHE B 9 0.478 3.269 3.465 1.00 0.00 C ATOM 1171 CD1 PHE B 9 -0.577 2.406 3.236 1.00 0.00 C ATOM 1172 CD2 PHE B 9 1.674 3.048 2.814 1.00 0.00 C ATOM 1173 CE1 PHE B 9 -0.437 1.344 2.368 1.00 0.00 C ATOM 1174 CE2 PHE B 9 1.820 1.987 1.952 1.00 0.00 C ATOM 1175 CZ PHE B 9 0.765 1.137 1.725 1.00 0.00 C ATOM 0 H PHE B 9 1.876 5.997 3.315 1.00 0.00 H new ATOM 0 HA PHE B 9 -0.741 5.334 2.762 1.00 0.00 H new ATOM 0 HB2 PHE B 9 1.278 4.659 4.854 1.00 0.00 H new ATOM 0 HB3 PHE B 9 -0.385 4.200 5.165 1.00 0.00 H new ATOM 0 HD1 PHE B 9 -1.518 2.565 3.741 1.00 0.00 H new ATOM 0 HD2 PHE B 9 2.505 3.716 2.983 1.00 0.00 H new ATOM 0 HE1 PHE B 9 -1.267 0.676 2.192 1.00 0.00 H new ATOM 0 HE2 PHE B 9 2.764 1.822 1.454 1.00 0.00 H new ATOM 0 HZ PHE B 9 0.877 0.307 1.043 1.00 0.00 H new ATOM 1185 N ASP B 10 -0.502 7.190 5.493 1.00 0.00 N ATOM 1186 CA ASP B 10 -1.309 8.018 6.385 1.00 0.00 C ATOM 1187 C ASP B 10 -2.293 8.850 5.574 1.00 0.00 C ATOM 1188 O ASP B 10 -3.504 8.859 5.835 1.00 0.00 O ATOM 1189 CB ASP B 10 -0.403 8.930 7.208 1.00 0.00 C ATOM 1190 CG ASP B 10 -0.369 8.548 8.674 1.00 0.00 C ATOM 1191 OD1 ASP B 10 -1.281 8.964 9.418 1.00 0.00 O ATOM 1192 OD2 ASP B 10 0.571 7.831 9.078 1.00 0.00 O ATOM 0 H ASP B 10 0.493 7.166 5.716 1.00 0.00 H new ATOM 0 HA ASP B 10 -1.869 7.372 7.062 1.00 0.00 H new ATOM 0 HB2 ASP B 10 0.608 8.893 6.803 1.00 0.00 H new ATOM 0 HB3 ASP B 10 -0.747 9.960 7.113 1.00 0.00 H new ATOM 1197 N LYS B 11 -1.758 9.513 4.563 1.00 0.00 N ATOM 1198 CA LYS B 11 -2.557 10.337 3.668 1.00 0.00 C ATOM 1199 C LYS B 11 -3.575 9.474 2.935 1.00 0.00 C ATOM 1200 O LYS B 11 -4.758 9.806 2.857 1.00 0.00 O ATOM 1201 CB LYS B 11 -1.659 11.031 2.658 1.00 0.00 C ATOM 1202 CG LYS B 11 -2.278 12.255 2.053 1.00 0.00 C ATOM 1203 CD LYS B 11 -1.601 13.431 2.650 1.00 0.00 C ATOM 1204 CE LYS B 11 -2.422 14.704 2.517 1.00 0.00 C ATOM 1205 NZ LYS B 11 -1.760 15.864 3.175 1.00 0.00 N ATOM 0 H LYS B 11 -0.763 9.497 4.339 1.00 0.00 H new ATOM 0 HA LYS B 11 -3.081 11.089 4.259 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -0.724 11.308 3.145 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -1.408 10.329 1.863 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -2.158 12.251 0.970 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -3.349 12.284 2.255 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -1.405 13.237 3.705 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -0.634 13.574 2.167 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -2.578 14.926 1.461 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -3.406 14.549 2.959 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -2.352 16.712 3.062 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -1.634 15.663 4.188 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -0.832 16.029 2.736 1.00 0.00 H new ATOM 1219 N TYR B 12 -3.086 8.361 2.399 1.00 0.00 N ATOM 1220 CA TYR B 12 -3.909 7.416 1.663 1.00 0.00 C ATOM 1221 C TYR B 12 -5.065 6.920 2.484 1.00 0.00 C ATOM 1222 O TYR B 12 -6.212 7.108 2.128 1.00 0.00 O ATOM 1223 CB TYR B 12 -3.110 6.179 1.268 1.00 0.00 C ATOM 1224 CG TYR B 12 -3.831 5.327 0.243 1.00 0.00 C ATOM 1225 CD1 TYR B 12 -4.658 5.911 -0.714 1.00 0.00 C ATOM 1226 CD2 TYR B 12 -3.702 3.941 0.235 1.00 0.00 C ATOM 1227 CE1 TYR B 12 -5.331 5.144 -1.643 1.00 0.00 C ATOM 1228 CE2 TYR B 12 -4.375 3.173 -0.692 1.00 0.00 C ATOM 1229 CZ TYR B 12 -5.188 3.776 -1.627 1.00 0.00 C ATOM 1230 OH TYR B 12 -5.858 3.006 -2.550 1.00 0.00 O ATOM 0 H TYR B 12 -2.105 8.091 2.464 1.00 0.00 H new ATOM 0 HA TYR B 12 -4.263 7.958 0.786 1.00 0.00 H new ATOM 0 HB2 TYR B 12 -2.145 6.487 0.866 1.00 0.00 H new ATOM 0 HB3 TYR B 12 -2.909 5.581 2.157 1.00 0.00 H new ATOM 0 HD1 TYR B 12 -4.775 6.985 -0.729 1.00 0.00 H new ATOM 0 HD2 TYR B 12 -3.067 3.461 0.964 1.00 0.00 H new ATOM 0 HE1 TYR B 12 -5.966 5.615 -2.378 1.00 0.00 H new ATOM 0 HE2 TYR B 12 -4.265 2.099 -0.685 1.00 0.00 H new ATOM 0 HH TYR B 12 -6.809 3.244 -2.546 1.00 0.00 H new ATOM 1240 N ASN B 13 -4.724 6.309 3.602 1.00 0.00 N ATOM 1241 CA ASN B 13 -5.690 5.692 4.493 1.00 0.00 C ATOM 1242 C ASN B 13 -6.954 6.512 4.612 1.00 0.00 C ATOM 1243 O ASN B 13 -8.041 6.034 4.295 1.00 0.00 O ATOM 1244 CB ASN B 13 -5.092 5.530 5.882 1.00 0.00 C ATOM 1245 CG ASN B 13 -3.604 5.208 5.887 1.00 0.00 C ATOM 1246 OD1 ASN B 13 -3.096 4.621 4.805 1.00 0.00 O flip ATOM 1247 ND2 ASN B 13 -2.911 5.486 6.865 1.00 0.00 N flip ATOM 0 H ASN B 13 -3.759 6.226 3.921 1.00 0.00 H new ATOM 0 HA ASN B 13 -5.941 4.721 4.066 1.00 0.00 H new ATOM 0 HB2 ASN B 13 -5.255 6.449 6.445 1.00 0.00 H new ATOM 0 HB3 ASN B 13 -5.626 4.736 6.405 1.00 0.00 H new ATOM 0 HD21 ASN B 13 -3.333 5.936 7.678 1.00 0.00 H new ATOM 0 HD22 ASN B 13 -1.915 5.267 6.863 1.00 0.00 H new ATOM 1254 N GLU B 14 -6.816 7.737 5.071 1.00 0.00 N ATOM 1255 CA GLU B 14 -7.973 8.602 5.213 1.00 0.00 C ATOM 1256 C GLU B 14 -8.727 8.676 3.879 1.00 0.00 C ATOM 1257 O GLU B 14 -9.957 8.614 3.823 1.00 0.00 O ATOM 1258 CB GLU B 14 -7.512 9.997 5.655 1.00 0.00 C ATOM 1259 CG GLU B 14 -7.195 10.923 4.497 1.00 0.00 C ATOM 1260 CD GLU B 14 -6.258 12.050 4.887 1.00 0.00 C ATOM 1261 OE1 GLU B 14 -6.672 12.915 5.688 1.00 0.00 O ATOM 1262 OE2 GLU B 14 -5.112 12.067 4.392 1.00 0.00 O ATOM 0 H GLU B 14 -5.928 8.155 5.350 1.00 0.00 H new ATOM 0 HA GLU B 14 -8.647 8.200 5.969 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -8.289 10.450 6.270 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -6.627 9.897 6.283 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -6.746 10.346 3.689 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -8.123 11.345 4.110 1.00 0.00 H new ATOM 1269 N ALA B 15 -7.948 8.729 2.808 1.00 0.00 N ATOM 1270 CA ALA B 15 -8.451 8.851 1.448 1.00 0.00 C ATOM 1271 C ALA B 15 -9.058 7.568 0.892 1.00 0.00 C ATOM 1272 O ALA B 15 -10.052 7.613 0.167 1.00 0.00 O ATOM 1273 CB ALA B 15 -7.302 9.277 0.549 1.00 0.00 C ATOM 0 H ALA B 15 -6.930 8.688 2.861 1.00 0.00 H new ATOM 0 HA ALA B 15 -9.254 9.588 1.473 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -7.659 9.374 -0.476 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -6.910 10.236 0.889 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -6.512 8.527 0.589 1.00 0.00 H new ATOM 1279 N VAL B 16 -8.471 6.427 1.225 1.00 0.00 N ATOM 1280 CA VAL B 16 -8.937 5.175 0.679 1.00 0.00 C ATOM 1281 C VAL B 16 -10.042 4.589 1.490 1.00 0.00 C ATOM 1282 O VAL B 16 -11.052 4.132 0.955 1.00 0.00 O ATOM 1283 CB VAL B 16 -7.797 4.162 0.508 1.00 0.00 C ATOM 1284 CG1 VAL B 16 -6.827 4.245 1.664 1.00 0.00 C ATOM 1285 CG2 VAL B 16 -8.338 2.752 0.335 1.00 0.00 C ATOM 0 H VAL B 16 -7.680 6.349 1.864 1.00 0.00 H new ATOM 0 HA VAL B 16 -9.333 5.402 -0.311 1.00 0.00 H new ATOM 0 HB VAL B 16 -7.252 4.415 -0.401 1.00 0.00 H new ATOM 0 HG11 VAL B 16 -6.028 3.518 1.521 1.00 0.00 H new ATOM 0 HG12 VAL B 16 -6.402 5.247 1.711 1.00 0.00 H new ATOM 0 HG13 VAL B 16 -7.351 4.030 2.595 1.00 0.00 H new ATOM 0 HG21 VAL B 16 -7.508 2.056 0.216 1.00 0.00 H new ATOM 0 HG22 VAL B 16 -8.920 2.475 1.214 1.00 0.00 H new ATOM 0 HG23 VAL B 16 -8.974 2.712 -0.549 1.00 0.00 H new ATOM 1295 N ARG B 17 -9.846 4.595 2.775 1.00 0.00 N ATOM 1296 CA ARG B 17 -10.828 4.055 3.656 1.00 0.00 C ATOM 1297 C ARG B 17 -12.172 4.674 3.419 1.00 0.00 C ATOM 1298 O ARG B 17 -13.205 4.000 3.455 1.00 0.00 O ATOM 1299 CB ARG B 17 -10.359 4.182 5.098 1.00 0.00 C ATOM 1300 CG ARG B 17 -9.099 3.388 5.385 1.00 0.00 C ATOM 1301 CD ARG B 17 -8.930 2.210 4.441 1.00 0.00 C ATOM 1302 NE ARG B 17 -7.629 2.171 3.856 1.00 0.00 N ATOM 1303 CZ ARG B 17 -7.349 1.411 2.844 1.00 0.00 C ATOM 1304 NH1 ARG B 17 -8.157 0.429 2.494 1.00 0.00 N ATOM 1305 NH2 ARG B 17 -6.243 1.598 2.205 1.00 0.00 N ATOM 0 H ARG B 17 -9.014 4.968 3.233 1.00 0.00 H new ATOM 0 HA ARG B 17 -10.950 2.992 3.448 1.00 0.00 H new ATOM 0 HB2 ARG B 17 -10.179 5.233 5.324 1.00 0.00 H new ATOM 0 HB3 ARG B 17 -11.154 3.845 5.763 1.00 0.00 H new ATOM 0 HG2 ARG B 17 -8.232 4.044 5.302 1.00 0.00 H new ATOM 0 HG3 ARG B 17 -9.127 3.026 6.413 1.00 0.00 H new ATOM 0 HD2 ARG B 17 -9.110 1.282 4.984 1.00 0.00 H new ATOM 0 HD3 ARG B 17 -9.680 2.268 3.652 1.00 0.00 H new ATOM 0 HE ARG B 17 -6.895 2.761 4.247 1.00 0.00 H new ATOM 0 HH11 ARG B 17 -9.013 0.261 3.022 1.00 0.00 H new ATOM 0 HH12 ARG B 17 -7.925 -0.162 1.696 1.00 0.00 H new ATOM 0 HH21 ARG B 17 -5.603 2.336 2.498 1.00 0.00 H new ATOM 0 HH22 ARG B 17 -6.009 1.008 1.407 1.00 0.00 H new ATOM 1319 N VAL B 18 -12.177 5.940 3.128 1.00 0.00 N ATOM 1320 CA VAL B 18 -13.422 6.583 2.871 1.00 0.00 C ATOM 1321 C VAL B 18 -13.937 6.190 1.496 1.00 0.00 C ATOM 1322 O VAL B 18 -15.093 5.842 1.347 1.00 0.00 O ATOM 1323 CB VAL B 18 -13.285 8.110 2.960 1.00 0.00 C ATOM 1324 CG1 VAL B 18 -12.773 8.502 4.336 1.00 0.00 C ATOM 1325 CG2 VAL B 18 -12.358 8.624 1.863 1.00 0.00 C ATOM 0 H VAL B 18 -11.350 6.534 3.064 1.00 0.00 H new ATOM 0 HA VAL B 18 -14.134 6.259 3.630 1.00 0.00 H new ATOM 0 HB VAL B 18 -14.264 8.567 2.813 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -12.678 9.586 4.393 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -13.474 8.159 5.097 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -11.799 8.043 4.506 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -12.271 9.708 1.939 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -11.373 8.172 1.978 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -12.767 8.360 0.888 1.00 0.00 H new ATOM 1335 N PHE B 19 -13.041 6.126 0.518 1.00 0.00 N ATOM 1336 CA PHE B 19 -13.444 5.861 -0.855 1.00 0.00 C ATOM 1337 C PHE B 19 -14.086 4.480 -1.070 1.00 0.00 C ATOM 1338 O PHE B 19 -15.146 4.377 -1.716 1.00 0.00 O ATOM 1339 CB PHE B 19 -12.262 6.185 -1.820 1.00 0.00 C ATOM 1340 CG PHE B 19 -11.270 5.095 -2.191 1.00 0.00 C ATOM 1341 CD1 PHE B 19 -11.651 3.803 -2.479 1.00 0.00 C ATOM 1342 CD2 PHE B 19 -9.927 5.406 -2.271 1.00 0.00 C ATOM 1343 CE1 PHE B 19 -10.719 2.844 -2.816 1.00 0.00 C ATOM 1344 CE2 PHE B 19 -8.987 4.454 -2.609 1.00 0.00 C ATOM 1345 CZ PHE B 19 -9.385 3.167 -2.877 1.00 0.00 C ATOM 0 H PHE B 19 -12.038 6.253 0.650 1.00 0.00 H new ATOM 0 HA PHE B 19 -14.264 6.536 -1.101 1.00 0.00 H new ATOM 0 HB2 PHE B 19 -12.693 6.562 -2.747 1.00 0.00 H new ATOM 0 HB3 PHE B 19 -11.695 7.004 -1.377 1.00 0.00 H new ATOM 0 HD1 PHE B 19 -12.697 3.537 -2.440 1.00 0.00 H new ATOM 0 HD2 PHE B 19 -9.605 6.416 -2.065 1.00 0.00 H new ATOM 0 HE1 PHE B 19 -11.039 1.835 -3.033 1.00 0.00 H new ATOM 0 HE2 PHE B 19 -7.942 4.720 -2.663 1.00 0.00 H new ATOM 0 HZ PHE B 19 -8.654 2.414 -3.134 1.00 0.00 H new ATOM 1355 N THR B 20 -13.532 3.417 -0.497 1.00 0.00 N ATOM 1356 CA THR B 20 -14.111 2.111 -0.763 1.00 0.00 C ATOM 1357 C THR B 20 -15.348 1.846 0.067 1.00 0.00 C ATOM 1358 O THR B 20 -16.379 1.459 -0.486 1.00 0.00 O ATOM 1359 CB THR B 20 -13.121 0.958 -0.610 1.00 0.00 C ATOM 1360 OG1 THR B 20 -12.241 0.931 -1.724 1.00 0.00 O ATOM 1361 CG2 THR B 20 -13.854 -0.360 -0.507 1.00 0.00 C ATOM 0 H THR B 20 -12.723 3.430 0.124 1.00 0.00 H new ATOM 0 HA THR B 20 -14.400 2.151 -1.813 1.00 0.00 H new ATOM 0 HB THR B 20 -12.547 1.110 0.304 1.00 0.00 H new ATOM 0 HG1 THR B 20 -11.758 1.782 -1.780 1.00 0.00 H new ATOM 0 HG21 THR B 20 -13.133 -1.170 -0.399 1.00 0.00 H new ATOM 0 HG22 THR B 20 -14.513 -0.343 0.361 1.00 0.00 H new ATOM 0 HG23 THR B 20 -14.445 -0.519 -1.409 1.00 0.00 H new ATOM 1369 N GLN B 21 -15.284 2.039 1.381 1.00 0.00 N ATOM 1370 CA GLN B 21 -16.470 1.793 2.168 1.00 0.00 C ATOM 1371 C GLN B 21 -17.544 2.776 1.756 1.00 0.00 C ATOM 1372 O GLN B 21 -18.704 2.620 2.105 1.00 0.00 O ATOM 1373 CB GLN B 21 -16.204 1.827 3.670 1.00 0.00 C ATOM 1374 CG GLN B 21 -15.796 0.462 4.239 1.00 0.00 C ATOM 1375 CD GLN B 21 -16.519 -0.694 3.590 1.00 0.00 C ATOM 1376 OE1 GLN B 21 -15.926 -1.224 2.523 1.00 0.00 O flip ATOM 1377 NE2 GLN B 21 -17.589 -1.109 4.036 1.00 0.00 N flip ATOM 0 H GLN B 21 -14.461 2.350 1.897 1.00 0.00 H new ATOM 0 HA GLN B 21 -16.814 0.779 1.966 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -15.416 2.551 3.877 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -17.100 2.175 4.184 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -14.722 0.328 4.110 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -15.993 0.449 5.311 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -18.004 -0.669 4.857 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -18.060 -1.893 3.584 1.00 0.00 H new ATOM 1386 N LEU B 22 -17.154 3.801 1.002 1.00 0.00 N ATOM 1387 CA LEU B 22 -18.135 4.736 0.494 1.00 0.00 C ATOM 1388 C LEU B 22 -19.089 3.940 -0.364 1.00 0.00 C ATOM 1389 O LEU B 22 -20.306 4.090 -0.270 1.00 0.00 O ATOM 1390 CB LEU B 22 -17.497 5.854 -0.347 1.00 0.00 C ATOM 1391 CG LEU B 22 -17.154 7.169 0.383 1.00 0.00 C ATOM 1392 CD1 LEU B 22 -17.874 8.330 -0.271 1.00 0.00 C ATOM 1393 CD2 LEU B 22 -17.481 7.114 1.876 1.00 0.00 C ATOM 0 H LEU B 22 -16.188 3.997 0.738 1.00 0.00 H new ATOM 0 HA LEU B 22 -18.639 5.223 1.329 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -16.581 5.464 -0.791 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -18.174 6.089 -1.168 1.00 0.00 H new ATOM 0 HG LEU B 22 -16.077 7.313 0.299 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -17.625 9.253 0.252 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -17.566 8.409 -1.313 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -18.950 8.164 -0.223 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -17.220 8.065 2.341 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -18.546 6.926 2.008 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -16.910 6.312 2.344 1.00 0.00 H new ATOM 1405 N SER B 23 -18.516 3.067 -1.194 1.00 0.00 N ATOM 1406 CA SER B 23 -19.330 2.212 -2.055 1.00 0.00 C ATOM 1407 C SER B 23 -20.033 1.101 -1.253 1.00 0.00 C ATOM 1408 O SER B 23 -21.230 0.870 -1.430 1.00 0.00 O ATOM 1409 CB SER B 23 -18.486 1.609 -3.186 1.00 0.00 C ATOM 1410 OG SER B 23 -18.305 2.544 -4.235 1.00 0.00 O ATOM 0 H SER B 23 -17.509 2.935 -1.287 1.00 0.00 H new ATOM 0 HA SER B 23 -20.103 2.840 -2.498 1.00 0.00 H new ATOM 0 HB2 SER B 23 -17.516 1.301 -2.797 1.00 0.00 H new ATOM 0 HB3 SER B 23 -18.974 0.714 -3.572 1.00 0.00 H new ATOM 0 HG SER B 23 -17.651 3.221 -3.961 1.00 0.00 H new ATOM 1416 N SER B 24 -19.298 0.414 -0.375 1.00 0.00 N ATOM 1417 CA SER B 24 -19.884 -0.664 0.429 1.00 0.00 C ATOM 1418 C SER B 24 -20.894 -0.142 1.431 1.00 0.00 C ATOM 1419 O SER B 24 -22.058 -0.545 1.412 1.00 0.00 O ATOM 1420 CB SER B 24 -18.809 -1.443 1.171 1.00 0.00 C ATOM 1421 OG SER B 24 -19.348 -2.102 2.305 1.00 0.00 O ATOM 0 H SER B 24 -18.307 0.581 -0.203 1.00 0.00 H new ATOM 0 HA SER B 24 -20.396 -1.324 -0.271 1.00 0.00 H new ATOM 0 HB2 SER B 24 -18.358 -2.175 0.501 1.00 0.00 H new ATOM 0 HB3 SER B 24 -18.015 -0.765 1.484 1.00 0.00 H new ATOM 0 HG SER B 24 -19.383 -3.067 2.137 1.00 0.00 H new ATOM 1427 N ALA B 25 -20.440 0.734 2.320 1.00 0.00 N ATOM 1428 CA ALA B 25 -21.314 1.311 3.325 1.00 0.00 C ATOM 1429 C ALA B 25 -22.578 1.802 2.648 1.00 0.00 C ATOM 1430 O ALA B 25 -23.668 1.748 3.212 1.00 0.00 O ATOM 1431 CB ALA B 25 -20.610 2.449 4.063 1.00 0.00 C ATOM 0 H ALA B 25 -19.474 1.057 2.362 1.00 0.00 H new ATOM 0 HA ALA B 25 -21.572 0.554 4.065 1.00 0.00 H new ATOM 0 HB1 ALA B 25 -21.282 2.868 4.812 1.00 0.00 H new ATOM 0 HB2 ALA B 25 -19.715 2.066 4.553 1.00 0.00 H new ATOM 0 HB3 ALA B 25 -20.330 3.226 3.352 1.00 0.00 H new ATOM 1437 N ALA B 26 -22.415 2.244 1.404 1.00 0.00 N ATOM 1438 CA ALA B 26 -23.529 2.740 0.612 1.00 0.00 C ATOM 1439 C ALA B 26 -24.588 1.664 0.394 1.00 0.00 C ATOM 1440 O ALA B 26 -25.783 1.950 0.468 1.00 0.00 O ATOM 1441 CB ALA B 26 -23.042 3.279 -0.725 1.00 0.00 C ATOM 0 H ALA B 26 -21.516 2.267 0.923 1.00 0.00 H new ATOM 0 HA ALA B 26 -23.990 3.554 1.172 1.00 0.00 H new ATOM 0 HB1 ALA B 26 -23.892 3.645 -1.301 1.00 0.00 H new ATOM 0 HB2 ALA B 26 -22.341 4.096 -0.554 1.00 0.00 H new ATOM 0 HB3 ALA B 26 -22.544 2.483 -1.279 1.00 0.00 H new ATOM 1447 N ASN B 27 -24.167 0.423 0.124 1.00 0.00 N ATOM 1448 CA ASN B 27 -25.142 -0.642 -0.105 1.00 0.00 C ATOM 1449 C ASN B 27 -24.587 -2.069 0.034 1.00 0.00 C ATOM 1450 O ASN B 27 -25.283 -2.941 0.554 1.00 0.00 O ATOM 1451 CB ASN B 27 -25.779 -0.479 -1.489 1.00 0.00 C ATOM 1452 CG ASN B 27 -24.801 0.006 -2.547 1.00 0.00 C ATOM 1453 OD1 ASN B 27 -23.510 -0.217 -2.326 1.00 0.00 O flip ATOM 1454 ND2 ASN B 27 -25.205 0.588 -3.554 1.00 0.00 N flip ATOM 0 H ASN B 27 -23.189 0.139 0.061 1.00 0.00 H new ATOM 0 HA ASN B 27 -25.882 -0.529 0.688 1.00 0.00 H new ATOM 0 HB2 ASN B 27 -26.199 -1.435 -1.803 1.00 0.00 H new ATOM 0 HB3 ASN B 27 -26.608 0.226 -1.419 1.00 0.00 H new ATOM 0 HD21 ASN B 27 -26.205 0.741 -3.688 1.00 0.00 H new ATOM 0 HD22 ASN B 27 -24.540 0.918 -4.254 1.00 0.00 H new ATOM 1461 N CYS B 28 -23.353 -2.322 -0.410 1.00 0.00 N ATOM 1462 CA CYS B 28 -22.809 -3.683 -0.351 1.00 0.00 C ATOM 1463 C CYS B 28 -21.348 -3.746 -0.784 1.00 0.00 C ATOM 1464 O CYS B 28 -20.835 -2.821 -1.385 1.00 0.00 O ATOM 1465 CB CYS B 28 -23.650 -4.582 -1.265 1.00 0.00 C ATOM 1466 SG CYS B 28 -22.732 -5.886 -2.137 1.00 0.00 S ATOM 0 H CYS B 28 -22.724 -1.623 -0.805 1.00 0.00 H new ATOM 0 HA CYS B 28 -22.852 -4.021 0.684 1.00 0.00 H new ATOM 0 HB2 CYS B 28 -24.432 -5.050 -0.666 1.00 0.00 H new ATOM 0 HB3 CYS B 28 -24.148 -3.955 -2.005 1.00 0.00 H new ATOM 1471 N ASP B 29 -20.687 -4.851 -0.457 1.00 0.00 N ATOM 1472 CA ASP B 29 -19.291 -5.070 -0.842 1.00 0.00 C ATOM 1473 C ASP B 29 -19.180 -6.255 -1.802 1.00 0.00 C ATOM 1474 O ASP B 29 -19.983 -7.185 -1.724 1.00 0.00 O ATOM 1475 CB ASP B 29 -18.434 -5.337 0.399 1.00 0.00 C ATOM 1476 CG ASP B 29 -19.234 -5.942 1.535 1.00 0.00 C ATOM 1477 OD1 ASP B 29 -19.340 -7.185 1.591 1.00 0.00 O ATOM 1478 OD2 ASP B 29 -19.755 -5.173 2.370 1.00 0.00 O ATOM 0 H ASP B 29 -21.097 -5.617 0.078 1.00 0.00 H new ATOM 0 HA ASP B 29 -18.930 -4.171 -1.342 1.00 0.00 H new ATOM 0 HB2 ASP B 29 -17.617 -6.009 0.135 1.00 0.00 H new ATOM 0 HB3 ASP B 29 -17.983 -4.403 0.733 1.00 0.00 H new ATOM 1483 N TRP B 30 -18.193 -6.238 -2.711 1.00 0.00 N ATOM 1484 CA TRP B 30 -18.040 -7.357 -3.639 1.00 0.00 C ATOM 1485 C TRP B 30 -17.615 -8.587 -2.842 1.00 0.00 C ATOM 1486 O TRP B 30 -18.176 -9.670 -3.007 1.00 0.00 O ATOM 1487 CB TRP B 30 -17.048 -7.054 -4.794 1.00 0.00 C ATOM 1488 CG TRP B 30 -15.725 -6.520 -4.382 1.00 0.00 C ATOM 1489 CD1 TRP B 30 -14.748 -7.128 -3.655 1.00 0.00 C ATOM 1490 CD2 TRP B 30 -15.232 -5.241 -4.732 1.00 0.00 C ATOM 1491 NE1 TRP B 30 -13.694 -6.267 -3.488 1.00 0.00 N ATOM 1492 CE2 TRP B 30 -13.978 -5.100 -4.147 1.00 0.00 C ATOM 1493 CE3 TRP B 30 -15.755 -4.190 -5.474 1.00 0.00 C ATOM 1494 CZ2 TRP B 30 -13.239 -3.942 -4.278 1.00 0.00 C ATOM 1495 CZ3 TRP B 30 -15.021 -3.042 -5.612 1.00 0.00 C ATOM 1496 CH2 TRP B 30 -13.776 -2.921 -5.013 1.00 0.00 C ATOM 0 H TRP B 30 -17.512 -5.486 -2.819 1.00 0.00 H new ATOM 0 HA TRP B 30 -18.998 -7.539 -4.126 1.00 0.00 H new ATOM 0 HB2 TRP B 30 -16.889 -7.971 -5.362 1.00 0.00 H new ATOM 0 HB3 TRP B 30 -17.514 -6.337 -5.470 1.00 0.00 H new ATOM 0 HD1 TRP B 30 -14.796 -8.135 -3.268 1.00 0.00 H new ATOM 0 HE1 TRP B 30 -12.842 -6.462 -2.962 1.00 0.00 H new ATOM 0 HE3 TRP B 30 -16.727 -4.277 -5.936 1.00 0.00 H new ATOM 0 HZ2 TRP B 30 -12.268 -3.845 -3.815 1.00 0.00 H new ATOM 0 HZ3 TRP B 30 -15.416 -2.222 -6.194 1.00 0.00 H new ATOM 0 HH2 TRP B 30 -13.220 -2.003 -5.129 1.00 0.00 H new ATOM 1507 N ALA B 31 -16.640 -8.374 -1.951 1.00 0.00 N ATOM 1508 CA ALA B 31 -16.115 -9.409 -1.062 1.00 0.00 C ATOM 1509 C ALA B 31 -15.310 -10.466 -1.817 1.00 0.00 C ATOM 1510 O ALA B 31 -14.234 -10.881 -1.385 1.00 0.00 O ATOM 1511 CB ALA B 31 -17.253 -10.052 -0.293 1.00 0.00 C ATOM 0 H ALA B 31 -16.190 -7.467 -1.828 1.00 0.00 H new ATOM 0 HA ALA B 31 -15.430 -8.930 -0.363 1.00 0.00 H new ATOM 0 HB1 ALA B 31 -16.856 -10.823 0.368 1.00 0.00 H new ATOM 0 HB2 ALA B 31 -17.765 -9.294 0.300 1.00 0.00 H new ATOM 0 HB3 ALA B 31 -17.957 -10.502 -0.993 1.00 0.00 H new ATOM 1517 N ALA B 32 -15.838 -10.892 -2.945 1.00 0.00 N ATOM 1518 CA ALA B 32 -15.185 -11.904 -3.761 1.00 0.00 C ATOM 1519 C ALA B 32 -13.910 -11.363 -4.397 1.00 0.00 C ATOM 1520 O ALA B 32 -12.880 -12.042 -4.432 1.00 0.00 O ATOM 1521 CB ALA B 32 -16.136 -12.410 -4.834 1.00 0.00 C ATOM 0 H ALA B 32 -16.723 -10.553 -3.323 1.00 0.00 H new ATOM 0 HA ALA B 32 -14.910 -12.734 -3.111 1.00 0.00 H new ATOM 0 HB1 ALA B 32 -15.634 -13.167 -5.437 1.00 0.00 H new ATOM 0 HB2 ALA B 32 -17.017 -12.847 -4.363 1.00 0.00 H new ATOM 0 HB3 ALA B 32 -16.440 -11.580 -5.472 1.00 0.00 H new ATOM 1527 N CYS B 33 -13.977 -10.130 -4.885 1.00 0.00 N ATOM 1528 CA CYS B 33 -12.831 -9.515 -5.534 1.00 0.00 C ATOM 1529 C CYS B 33 -11.704 -9.234 -4.559 1.00 0.00 C ATOM 1530 O CYS B 33 -10.562 -9.563 -4.828 1.00 0.00 O ATOM 1531 CB CYS B 33 -13.228 -8.226 -6.236 1.00 0.00 C ATOM 1532 SG CYS B 33 -12.674 -8.145 -7.974 1.00 0.00 S ATOM 0 H CYS B 33 -14.809 -9.541 -4.843 1.00 0.00 H new ATOM 0 HA CYS B 33 -12.471 -10.232 -6.272 1.00 0.00 H new ATOM 0 HB2 CYS B 33 -14.313 -8.123 -6.203 1.00 0.00 H new ATOM 0 HB3 CYS B 33 -12.810 -7.380 -5.690 1.00 0.00 H new ATOM 1537 N LEU B 34 -12.005 -8.626 -3.429 1.00 0.00 N ATOM 1538 CA LEU B 34 -10.958 -8.320 -2.472 1.00 0.00 C ATOM 1539 C LEU B 34 -10.143 -9.557 -2.150 1.00 0.00 C ATOM 1540 O LEU B 34 -8.930 -9.477 -1.963 1.00 0.00 O ATOM 1541 CB LEU B 34 -11.531 -7.685 -1.222 1.00 0.00 C ATOM 1542 CG LEU B 34 -12.895 -8.217 -0.813 1.00 0.00 C ATOM 1543 CD1 LEU B 34 -12.747 -9.242 0.296 1.00 0.00 C ATOM 1544 CD2 LEU B 34 -13.798 -7.078 -0.390 1.00 0.00 C ATOM 0 H LEU B 34 -12.944 -8.339 -3.153 1.00 0.00 H new ATOM 0 HA LEU B 34 -10.285 -7.592 -2.925 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -10.833 -7.839 -0.399 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -11.607 -6.609 -1.378 1.00 0.00 H new ATOM 0 HG LEU B 34 -13.355 -8.710 -1.669 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -13.731 -9.615 0.580 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -12.132 -10.071 -0.054 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -12.272 -8.777 1.160 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -14.771 -7.474 -0.100 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -13.352 -6.555 0.456 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -13.922 -6.384 -1.221 1.00 0.00 H new ATOM 1556 N SER B 35 -10.805 -10.703 -2.085 1.00 0.00 N ATOM 1557 CA SER B 35 -10.098 -11.949 -1.847 1.00 0.00 C ATOM 1558 C SER B 35 -9.080 -12.144 -2.964 1.00 0.00 C ATOM 1559 O SER B 35 -7.977 -12.639 -2.747 1.00 0.00 O ATOM 1560 CB SER B 35 -11.077 -13.118 -1.828 1.00 0.00 C ATOM 1561 OG SER B 35 -12.084 -12.927 -0.849 1.00 0.00 O ATOM 0 H SER B 35 -11.815 -10.795 -2.192 1.00 0.00 H new ATOM 0 HA SER B 35 -9.595 -11.909 -0.881 1.00 0.00 H new ATOM 0 HB2 SER B 35 -11.537 -13.227 -2.810 1.00 0.00 H new ATOM 0 HB3 SER B 35 -10.539 -14.044 -1.624 1.00 0.00 H new ATOM 0 HG SER B 35 -12.709 -12.237 -1.153 1.00 0.00 H new ATOM 1567 N SER B 36 -9.489 -11.730 -4.161 1.00 0.00 N ATOM 1568 CA SER B 36 -8.663 -11.819 -5.372 1.00 0.00 C ATOM 1569 C SER B 36 -7.262 -11.210 -5.178 1.00 0.00 C ATOM 1570 O SER B 36 -6.260 -11.830 -5.540 1.00 0.00 O ATOM 1571 CB SER B 36 -9.380 -11.124 -6.537 1.00 0.00 C ATOM 1572 OG SER B 36 -9.023 -11.703 -7.781 1.00 0.00 O ATOM 0 H SER B 36 -10.409 -11.320 -4.324 1.00 0.00 H new ATOM 0 HA SER B 36 -8.523 -12.877 -5.595 1.00 0.00 H new ATOM 0 HB2 SER B 36 -10.459 -11.195 -6.397 1.00 0.00 H new ATOM 0 HB3 SER B 36 -9.128 -10.064 -6.541 1.00 0.00 H new ATOM 0 HG SER B 36 -9.496 -11.241 -8.504 1.00 0.00 H new ATOM 1578 N LEU B 37 -7.185 -9.997 -4.620 1.00 0.00 N ATOM 1579 CA LEU B 37 -5.881 -9.354 -4.393 1.00 0.00 C ATOM 1580 C LEU B 37 -5.093 -10.229 -3.460 1.00 0.00 C ATOM 1581 O LEU B 37 -3.961 -10.611 -3.739 1.00 0.00 O ATOM 1582 CB LEU B 37 -6.008 -7.947 -3.782 1.00 0.00 C ATOM 1583 CG LEU B 37 -4.780 -7.451 -3.011 1.00 0.00 C ATOM 1584 CD1 LEU B 37 -3.623 -7.187 -3.955 1.00 0.00 C ATOM 1585 CD2 LEU B 37 -5.107 -6.212 -2.203 1.00 0.00 C ATOM 0 H LEU B 37 -7.991 -9.448 -4.322 1.00 0.00 H new ATOM 0 HA LEU B 37 -5.385 -9.237 -5.357 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -6.223 -7.240 -4.583 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -6.866 -7.938 -3.110 1.00 0.00 H new ATOM 0 HG LEU B 37 -4.482 -8.236 -2.316 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -2.762 -6.836 -3.386 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -3.362 -8.108 -4.477 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -3.912 -6.428 -4.681 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -4.217 -5.882 -1.666 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -5.442 -5.419 -2.872 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -5.897 -6.442 -1.488 1.00 0.00 H new ATOM 1597 N SER B 38 -5.732 -10.546 -2.347 1.00 0.00 N ATOM 1598 CA SER B 38 -5.146 -11.401 -1.342 1.00 0.00 C ATOM 1599 C SER B 38 -5.048 -12.836 -1.858 1.00 0.00 C ATOM 1600 O SER B 38 -4.606 -13.739 -1.150 1.00 0.00 O ATOM 1601 CB SER B 38 -5.990 -11.337 -0.067 1.00 0.00 C ATOM 1602 OG SER B 38 -6.629 -12.576 0.188 1.00 0.00 O ATOM 0 H SER B 38 -6.670 -10.216 -2.119 1.00 0.00 H new ATOM 0 HA SER B 38 -4.137 -11.056 -1.115 1.00 0.00 H new ATOM 0 HB2 SER B 38 -5.356 -11.071 0.779 1.00 0.00 H new ATOM 0 HB3 SER B 38 -6.739 -10.551 -0.163 1.00 0.00 H new ATOM 0 HG SER B 38 -7.257 -12.776 -0.537 1.00 0.00 H new ATOM 1608 N ALA B 39 -5.468 -13.024 -3.109 1.00 0.00 N ATOM 1609 CA ALA B 39 -5.434 -14.332 -3.756 1.00 0.00 C ATOM 1610 C ALA B 39 -4.244 -14.419 -4.701 1.00 0.00 C ATOM 1611 O ALA B 39 -3.922 -15.494 -5.210 1.00 0.00 O ATOM 1612 CB ALA B 39 -6.732 -14.594 -4.507 1.00 0.00 C ATOM 0 H ALA B 39 -5.839 -12.278 -3.698 1.00 0.00 H new ATOM 0 HA ALA B 39 -5.326 -15.097 -2.987 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -6.686 -15.574 -4.982 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -7.568 -14.568 -3.808 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -6.872 -13.828 -5.269 1.00 0.00 H new ATOM 1618 N SER B 40 -3.625 -13.258 -4.941 1.00 0.00 N ATOM 1619 CA SER B 40 -2.435 -13.132 -5.791 1.00 0.00 C ATOM 1620 C SER B 40 -2.767 -12.872 -7.255 1.00 0.00 C ATOM 1621 O SER B 40 -3.440 -13.666 -7.912 1.00 0.00 O ATOM 1622 CB SER B 40 -1.527 -14.361 -5.677 1.00 0.00 C ATOM 1623 OG SER B 40 -0.276 -14.129 -6.301 1.00 0.00 O ATOM 0 H SER B 40 -3.939 -12.371 -4.547 1.00 0.00 H new ATOM 0 HA SER B 40 -1.903 -12.257 -5.416 1.00 0.00 H new ATOM 0 HB2 SER B 40 -1.373 -14.607 -4.626 1.00 0.00 H new ATOM 0 HB3 SER B 40 -2.013 -15.221 -6.138 1.00 0.00 H new ATOM 0 HG SER B 40 0.265 -13.537 -5.738 1.00 0.00 H new ATOM 1629 N SER B 41 -2.276 -11.737 -7.748 1.00 0.00 N ATOM 1630 CA SER B 41 -2.447 -11.350 -9.141 1.00 0.00 C ATOM 1631 C SER B 41 -1.074 -11.212 -9.767 1.00 0.00 C ATOM 1632 O SER B 41 -0.153 -10.696 -9.140 1.00 0.00 O ATOM 1633 CB SER B 41 -3.197 -10.024 -9.281 1.00 0.00 C ATOM 1634 OG SER B 41 -3.967 -9.998 -10.469 1.00 0.00 O ATOM 0 H SER B 41 -1.750 -11.063 -7.192 1.00 0.00 H new ATOM 0 HA SER B 41 -3.038 -12.117 -9.642 1.00 0.00 H new ATOM 0 HB2 SER B 41 -3.848 -9.878 -8.419 1.00 0.00 H new ATOM 0 HB3 SER B 41 -2.485 -9.199 -9.287 1.00 0.00 H new ATOM 0 HG SER B 41 -4.438 -9.141 -10.535 1.00 0.00 H new ATOM 1640 N ALA B 42 -0.944 -11.660 -11.000 1.00 0.00 N ATOM 1641 CA ALA B 42 0.334 -11.597 -11.705 1.00 0.00 C ATOM 1642 C ALA B 42 0.826 -10.160 -11.818 1.00 0.00 C ATOM 1643 O ALA B 42 1.963 -9.906 -12.221 1.00 0.00 O ATOM 1644 CB ALA B 42 0.198 -12.215 -13.085 1.00 0.00 C ATOM 0 H ALA B 42 -1.704 -12.073 -11.540 1.00 0.00 H new ATOM 0 HA ALA B 42 1.069 -12.162 -11.131 1.00 0.00 H new ATOM 0 HB1 ALA B 42 1.156 -12.163 -13.603 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -0.107 -13.257 -12.989 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -0.553 -11.669 -13.656 1.00 0.00 H new ATOM 1650 N ALA B 43 -0.037 -9.228 -11.445 1.00 0.00 N ATOM 1651 CA ALA B 43 0.273 -7.814 -11.534 1.00 0.00 C ATOM 1652 C ALA B 43 0.979 -7.279 -10.302 1.00 0.00 C ATOM 1653 O ALA B 43 2.101 -6.802 -10.400 1.00 0.00 O ATOM 1654 CB ALA B 43 -1.009 -7.037 -11.794 1.00 0.00 C ATOM 0 H ALA B 43 -0.966 -9.431 -11.075 1.00 0.00 H new ATOM 0 HA ALA B 43 0.970 -7.682 -12.362 1.00 0.00 H new ATOM 0 HB1 ALA B 43 -0.782 -5.973 -11.862 1.00 0.00 H new ATOM 0 HB2 ALA B 43 -1.455 -7.373 -12.730 1.00 0.00 H new ATOM 0 HB3 ALA B 43 -1.710 -7.207 -10.977 1.00 0.00 H new ATOM 1660 N CYS B 44 0.328 -7.361 -9.152 1.00 0.00 N ATOM 1661 CA CYS B 44 0.901 -6.853 -7.908 1.00 0.00 C ATOM 1662 C CYS B 44 2.390 -7.161 -7.784 1.00 0.00 C ATOM 1663 O CYS B 44 3.151 -6.386 -7.203 1.00 0.00 O ATOM 1664 CB CYS B 44 0.133 -7.399 -6.709 1.00 0.00 C ATOM 1665 SG CYS B 44 -0.975 -8.797 -7.089 1.00 0.00 S ATOM 0 H CYS B 44 -0.599 -7.774 -9.051 1.00 0.00 H new ATOM 0 HA CYS B 44 0.805 -5.767 -7.927 1.00 0.00 H new ATOM 0 HB2 CYS B 44 0.848 -7.715 -5.950 1.00 0.00 H new ATOM 0 HB3 CYS B 44 -0.457 -6.592 -6.274 1.00 0.00 H new ATOM 1670 N ILE B 45 2.802 -8.290 -8.326 1.00 0.00 N ATOM 1671 CA ILE B 45 4.201 -8.678 -8.285 1.00 0.00 C ATOM 1672 C ILE B 45 4.974 -8.015 -9.423 1.00 0.00 C ATOM 1673 O ILE B 45 6.045 -7.391 -9.223 1.00 0.00 O ATOM 1674 CB ILE B 45 4.373 -10.205 -8.338 1.00 0.00 C ATOM 1675 CG1 ILE B 45 3.088 -10.904 -7.887 1.00 0.00 C ATOM 1676 CG2 ILE B 45 5.539 -10.632 -7.458 1.00 0.00 C ATOM 1677 CD1 ILE B 45 2.441 -11.741 -8.968 1.00 0.00 C ATOM 0 H ILE B 45 2.190 -8.955 -8.800 1.00 0.00 H new ATOM 0 HA ILE B 45 4.607 -8.334 -7.334 1.00 0.00 H new ATOM 0 HB ILE B 45 4.583 -10.495 -9.367 1.00 0.00 H new ATOM 0 HG12 ILE B 45 3.312 -11.541 -7.032 1.00 0.00 H new ATOM 0 HG13 ILE B 45 2.376 -10.152 -7.547 1.00 0.00 H new ATOM 0 HG21 ILE B 45 5.651 -11.715 -7.503 1.00 0.00 H new ATOM 0 HG22 ILE B 45 6.454 -10.157 -7.811 1.00 0.00 H new ATOM 0 HG23 ILE B 45 5.347 -10.330 -6.428 1.00 0.00 H new ATOM 0 HD11 ILE B 45 1.536 -12.206 -8.576 1.00 0.00 H new ATOM 0 HD12 ILE B 45 2.185 -11.106 -9.816 1.00 0.00 H new ATOM 0 HD13 ILE B 45 3.135 -12.516 -9.293 1.00 0.00 H new ATOM 1689 N ALA B 46 4.404 -8.097 -10.622 1.00 0.00 N ATOM 1690 CA ALA B 46 5.045 -7.478 -11.776 1.00 0.00 C ATOM 1691 C ALA B 46 5.177 -6.005 -11.452 1.00 0.00 C ATOM 1692 O ALA B 46 5.988 -5.252 -12.007 1.00 0.00 O ATOM 1693 CB ALA B 46 4.229 -7.699 -13.041 1.00 0.00 C ATOM 0 H ALA B 46 3.523 -8.573 -10.817 1.00 0.00 H new ATOM 0 HA ALA B 46 6.022 -7.921 -11.967 1.00 0.00 H new ATOM 0 HB1 ALA B 46 4.731 -7.226 -13.885 1.00 0.00 H new ATOM 0 HB2 ALA B 46 4.132 -8.768 -13.229 1.00 0.00 H new ATOM 0 HB3 ALA B 46 3.239 -7.261 -12.916 1.00 0.00 H new ATOM 1699 N ALA B 47 4.360 -5.638 -10.488 1.00 0.00 N ATOM 1700 CA ALA B 47 4.285 -4.305 -9.974 1.00 0.00 C ATOM 1701 C ALA B 47 5.535 -3.970 -9.194 1.00 0.00 C ATOM 1702 O ALA B 47 6.130 -2.913 -9.391 1.00 0.00 O ATOM 1703 CB ALA B 47 3.076 -4.204 -9.076 1.00 0.00 C ATOM 0 H ALA B 47 3.715 -6.284 -10.033 1.00 0.00 H new ATOM 0 HA ALA B 47 4.199 -3.599 -10.800 1.00 0.00 H new ATOM 0 HB1 ALA B 47 3.004 -3.193 -8.675 1.00 0.00 H new ATOM 0 HB2 ALA B 47 2.177 -4.432 -9.649 1.00 0.00 H new ATOM 0 HB3 ALA B 47 3.173 -4.914 -8.254 1.00 0.00 H new ATOM 1709 N VAL B 48 5.941 -4.890 -8.319 1.00 0.00 N ATOM 1710 CA VAL B 48 7.120 -4.679 -7.491 1.00 0.00 C ATOM 1711 C VAL B 48 8.212 -4.037 -8.299 1.00 0.00 C ATOM 1712 O VAL B 48 8.953 -3.186 -7.811 1.00 0.00 O ATOM 1713 CB VAL B 48 7.672 -6.000 -6.926 1.00 0.00 C ATOM 1714 CG1 VAL B 48 8.773 -5.732 -5.910 1.00 0.00 C ATOM 1715 CG2 VAL B 48 6.565 -6.835 -6.318 1.00 0.00 C ATOM 0 H VAL B 48 5.471 -5.783 -8.168 1.00 0.00 H new ATOM 0 HA VAL B 48 6.812 -4.036 -6.666 1.00 0.00 H new ATOM 0 HB VAL B 48 8.103 -6.567 -7.751 1.00 0.00 H new ATOM 0 HG11 VAL B 48 9.149 -6.679 -5.523 1.00 0.00 H new ATOM 0 HG12 VAL B 48 9.586 -5.187 -6.390 1.00 0.00 H new ATOM 0 HG13 VAL B 48 8.373 -5.138 -5.088 1.00 0.00 H new ATOM 0 HG21 VAL B 48 6.982 -7.763 -5.926 1.00 0.00 H new ATOM 0 HG22 VAL B 48 6.093 -6.279 -5.508 1.00 0.00 H new ATOM 0 HG23 VAL B 48 5.822 -7.065 -7.081 1.00 0.00 H new ATOM 1725 N GLY B 49 8.307 -4.458 -9.536 1.00 0.00 N ATOM 1726 CA GLY B 49 9.331 -3.909 -10.407 1.00 0.00 C ATOM 1727 C GLY B 49 8.950 -2.633 -11.156 1.00 0.00 C ATOM 1728 O GLY B 49 9.828 -1.866 -11.545 1.00 0.00 O ATOM 0 H GLY B 49 7.705 -5.163 -9.961 1.00 0.00 H new ATOM 0 HA2 GLY B 49 10.220 -3.706 -9.809 1.00 0.00 H new ATOM 0 HA3 GLY B 49 9.606 -4.669 -11.138 1.00 0.00 H new ATOM 1732 N GLU B 50 7.661 -2.372 -11.333 1.00 0.00 N ATOM 1733 CA GLU B 50 7.231 -1.240 -12.164 1.00 0.00 C ATOM 1734 C GLU B 50 6.792 0.081 -11.501 1.00 0.00 C ATOM 1735 O GLU B 50 5.955 0.769 -12.073 1.00 0.00 O ATOM 1736 CB GLU B 50 6.229 -1.721 -13.188 1.00 0.00 C ATOM 1737 CG GLU B 50 6.927 -2.508 -14.264 1.00 0.00 C ATOM 1738 CD GLU B 50 6.681 -1.955 -15.655 1.00 0.00 C ATOM 1739 OE1 GLU B 50 7.452 -1.074 -16.089 1.00 0.00 O ATOM 1740 OE2 GLU B 50 5.717 -2.406 -16.310 1.00 0.00 O ATOM 0 H GLU B 50 6.901 -2.915 -10.923 1.00 0.00 H new ATOM 0 HA GLU B 50 8.165 -0.909 -12.618 1.00 0.00 H new ATOM 0 HB2 GLU B 50 5.473 -2.341 -12.706 1.00 0.00 H new ATOM 0 HB3 GLU B 50 5.710 -0.870 -13.628 1.00 0.00 H new ATOM 0 HG2 GLU B 50 7.999 -2.514 -14.065 1.00 0.00 H new ATOM 0 HG3 GLU B 50 6.590 -3.544 -14.226 1.00 0.00 H new ATOM 1747 N LEU B 51 7.224 0.376 -10.272 1.00 0.00 N ATOM 1748 CA LEU B 51 6.940 1.692 -9.630 1.00 0.00 C ATOM 1749 C LEU B 51 5.905 1.598 -8.546 1.00 0.00 C ATOM 1750 O LEU B 51 4.691 1.476 -8.809 1.00 0.00 O ATOM 1751 CB LEU B 51 6.569 2.782 -10.624 1.00 0.00 C ATOM 1752 CG LEU B 51 6.741 4.208 -10.104 1.00 0.00 C ATOM 1753 CD1 LEU B 51 8.214 4.558 -9.927 1.00 0.00 C ATOM 1754 CD2 LEU B 51 6.049 5.206 -11.022 1.00 0.00 C ATOM 0 H LEU B 51 7.769 -0.264 -9.694 1.00 0.00 H new ATOM 0 HA LEU B 51 7.884 1.982 -9.170 1.00 0.00 H new ATOM 0 HB2 LEU B 51 7.179 2.661 -11.519 1.00 0.00 H new ATOM 0 HB3 LEU B 51 5.530 2.642 -10.924 1.00 0.00 H new ATOM 0 HG LEU B 51 6.268 4.265 -9.124 1.00 0.00 H new ATOM 0 HD11 LEU B 51 8.303 5.579 -9.556 1.00 0.00 H new ATOM 0 HD12 LEU B 51 8.668 3.871 -9.213 1.00 0.00 H new ATOM 0 HD13 LEU B 51 8.726 4.474 -10.886 1.00 0.00 H new ATOM 0 HD21 LEU B 51 6.185 6.215 -10.632 1.00 0.00 H new ATOM 0 HD22 LEU B 51 6.481 5.142 -12.021 1.00 0.00 H new ATOM 0 HD23 LEU B 51 4.985 4.977 -11.072 1.00 0.00 H new ATOM 1766 N GLY B 52 6.435 1.676 -7.319 1.00 0.00 N ATOM 1767 CA GLY B 52 5.660 1.558 -6.111 1.00 0.00 C ATOM 1768 C GLY B 52 4.764 0.388 -6.216 1.00 0.00 C ATOM 1769 O GLY B 52 3.839 0.212 -5.425 1.00 0.00 O ATOM 0 H GLY B 52 7.430 1.825 -7.152 1.00 0.00 H new ATOM 0 HA2 GLY B 52 6.321 1.448 -5.251 1.00 0.00 H new ATOM 0 HA3 GLY B 52 5.076 2.464 -5.950 1.00 0.00 H new ATOM 1773 N LEU B 53 5.092 -0.408 -7.220 1.00 0.00 N ATOM 1774 CA LEU B 53 4.388 -1.597 -7.571 1.00 0.00 C ATOM 1775 C LEU B 53 3.399 -1.246 -8.668 1.00 0.00 C ATOM 1776 O LEU B 53 2.205 -1.511 -8.539 1.00 0.00 O ATOM 1777 CB LEU B 53 3.692 -2.263 -6.378 1.00 0.00 C ATOM 1778 CG LEU B 53 4.573 -2.637 -5.163 1.00 0.00 C ATOM 1779 CD1 LEU B 53 4.429 -4.108 -4.827 1.00 0.00 C ATOM 1780 CD2 LEU B 53 6.040 -2.288 -5.394 1.00 0.00 C ATOM 0 H LEU B 53 5.890 -0.223 -7.827 1.00 0.00 H new ATOM 0 HA LEU B 53 5.106 -2.337 -7.925 1.00 0.00 H new ATOM 0 HB2 LEU B 53 2.904 -1.595 -6.031 1.00 0.00 H new ATOM 0 HB3 LEU B 53 3.206 -3.171 -6.735 1.00 0.00 H new ATOM 0 HG LEU B 53 4.222 -2.046 -4.317 1.00 0.00 H new ATOM 0 HD11 LEU B 53 5.057 -4.349 -3.970 1.00 0.00 H new ATOM 0 HD12 LEU B 53 3.388 -4.326 -4.587 1.00 0.00 H new ATOM 0 HD13 LEU B 53 4.737 -4.709 -5.683 1.00 0.00 H new ATOM 0 HD21 LEU B 53 6.623 -2.567 -4.516 1.00 0.00 H new ATOM 0 HD22 LEU B 53 6.411 -2.831 -6.264 1.00 0.00 H new ATOM 0 HD23 LEU B 53 6.136 -1.216 -5.567 1.00 0.00 H new ATOM 1792 N ASP B 54 3.922 -0.633 -9.754 1.00 0.00 N ATOM 1793 CA ASP B 54 3.095 -0.222 -10.885 1.00 0.00 C ATOM 1794 C ASP B 54 1.648 -0.240 -10.497 1.00 0.00 C ATOM 1795 O ASP B 54 1.044 -1.304 -10.461 1.00 0.00 O ATOM 1796 CB ASP B 54 3.287 -1.165 -12.057 1.00 0.00 C ATOM 1797 CG ASP B 54 3.240 -0.456 -13.397 1.00 0.00 C ATOM 1798 OD1 ASP B 54 3.519 0.761 -13.437 1.00 0.00 O ATOM 1799 OD2 ASP B 54 2.928 -1.120 -14.408 1.00 0.00 O ATOM 0 H ASP B 54 4.913 -0.417 -9.860 1.00 0.00 H new ATOM 0 HA ASP B 54 3.395 0.786 -11.172 1.00 0.00 H new ATOM 0 HB2 ASP B 54 4.245 -1.674 -11.954 1.00 0.00 H new ATOM 0 HB3 ASP B 54 2.514 -1.933 -12.030 1.00 0.00 H new ATOM 1804 N VAL B 55 1.087 0.908 -10.181 1.00 0.00 N ATOM 1805 CA VAL B 55 -0.320 0.927 -9.783 1.00 0.00 C ATOM 1806 C VAL B 55 -1.168 0.035 -10.676 1.00 0.00 C ATOM 1807 O VAL B 55 -1.937 -0.766 -10.146 1.00 0.00 O ATOM 1808 CB VAL B 55 -0.954 2.336 -9.700 1.00 0.00 C ATOM 1809 CG1 VAL B 55 -1.811 2.661 -10.925 1.00 0.00 C ATOM 1810 CG2 VAL B 55 -1.789 2.434 -8.431 1.00 0.00 C ATOM 0 H VAL B 55 1.556 1.814 -10.188 1.00 0.00 H new ATOM 0 HA VAL B 55 -0.313 0.535 -8.766 1.00 0.00 H new ATOM 0 HB VAL B 55 -0.147 3.068 -9.676 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -2.234 3.660 -10.819 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -1.193 2.622 -11.822 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -2.618 1.933 -11.008 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -2.238 3.425 -8.367 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -2.575 1.680 -8.454 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -1.152 2.268 -7.562 1.00 0.00 H new ATOM 1820 N PRO B 56 -1.026 0.115 -12.035 1.00 0.00 N ATOM 1821 CA PRO B 56 -1.824 -0.712 -12.936 1.00 0.00 C ATOM 1822 C PRO B 56 -1.653 -2.175 -12.597 1.00 0.00 C ATOM 1823 O PRO B 56 -2.439 -3.024 -13.019 1.00 0.00 O ATOM 1824 CB PRO B 56 -1.264 -0.410 -14.333 1.00 0.00 C ATOM 1825 CG PRO B 56 0.060 0.226 -14.092 1.00 0.00 C ATOM 1826 CD PRO B 56 -0.073 0.959 -12.791 1.00 0.00 C ATOM 0 HA PRO B 56 -2.891 -0.499 -12.864 1.00 0.00 H new ATOM 0 HB2 PRO B 56 -1.162 -1.321 -14.922 1.00 0.00 H new ATOM 0 HB3 PRO B 56 -1.926 0.255 -14.887 1.00 0.00 H new ATOM 0 HG2 PRO B 56 0.850 -0.523 -14.041 1.00 0.00 H new ATOM 0 HG3 PRO B 56 0.320 0.909 -14.901 1.00 0.00 H new ATOM 0 HD2 PRO B 56 0.884 1.048 -12.277 1.00 0.00 H new ATOM 0 HD3 PRO B 56 -0.453 1.970 -12.934 1.00 0.00 H new ATOM 1834 N LEU B 57 -0.575 -2.470 -11.889 1.00 0.00 N ATOM 1835 CA LEU B 57 -0.308 -3.817 -11.461 1.00 0.00 C ATOM 1836 C LEU B 57 -0.744 -4.087 -10.014 1.00 0.00 C ATOM 1837 O LEU B 57 -1.683 -4.834 -9.789 1.00 0.00 O ATOM 1838 CB LEU B 57 1.160 -4.165 -11.655 1.00 0.00 C ATOM 1839 CG LEU B 57 1.693 -3.996 -13.083 1.00 0.00 C ATOM 1840 CD1 LEU B 57 3.152 -4.405 -13.161 1.00 0.00 C ATOM 1841 CD2 LEU B 57 0.867 -4.808 -14.070 1.00 0.00 C ATOM 0 H LEU B 57 0.126 -1.787 -11.602 1.00 0.00 H new ATOM 0 HA LEU B 57 -0.913 -4.467 -12.093 1.00 0.00 H new ATOM 0 HB2 LEU B 57 1.755 -3.542 -10.987 1.00 0.00 H new ATOM 0 HB3 LEU B 57 1.314 -5.199 -11.348 1.00 0.00 H new ATOM 0 HG LEU B 57 1.611 -2.942 -13.350 1.00 0.00 H new ATOM 0 HD11 LEU B 57 3.511 -4.278 -14.182 1.00 0.00 H new ATOM 0 HD12 LEU B 57 3.741 -3.781 -12.489 1.00 0.00 H new ATOM 0 HD13 LEU B 57 3.253 -5.450 -12.868 1.00 0.00 H new ATOM 0 HD21 LEU B 57 1.265 -4.672 -15.076 1.00 0.00 H new ATOM 0 HD22 LEU B 57 0.913 -5.863 -13.801 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -0.169 -4.471 -14.041 1.00 0.00 H new ATOM 1853 N ASP B 58 -0.056 -3.467 -9.041 1.00 0.00 N ATOM 1854 CA ASP B 58 -0.328 -3.701 -7.610 1.00 0.00 C ATOM 1855 C ASP B 58 -1.615 -3.126 -7.076 1.00 0.00 C ATOM 1856 O ASP B 58 -2.454 -3.871 -6.588 1.00 0.00 O ATOM 1857 CB ASP B 58 0.800 -3.164 -6.765 1.00 0.00 C ATOM 1858 CG ASP B 58 0.539 -3.313 -5.280 1.00 0.00 C ATOM 1859 OD1 ASP B 58 -0.058 -4.333 -4.881 1.00 0.00 O ATOM 1860 OD2 ASP B 58 0.935 -2.408 -4.516 1.00 0.00 O ATOM 0 H ASP B 58 0.694 -2.799 -9.218 1.00 0.00 H new ATOM 0 HA ASP B 58 -0.423 -4.785 -7.543 1.00 0.00 H new ATOM 0 HB2 ASP B 58 1.722 -3.686 -7.022 1.00 0.00 H new ATOM 0 HB3 ASP B 58 0.954 -2.111 -6.999 1.00 0.00 H new ATOM 1865 N LEU B 59 -1.770 -1.820 -7.117 1.00 0.00 N ATOM 1866 CA LEU B 59 -2.971 -1.232 -6.575 1.00 0.00 C ATOM 1867 C LEU B 59 -4.108 -1.529 -7.480 1.00 0.00 C ATOM 1868 O LEU B 59 -5.247 -1.260 -7.163 1.00 0.00 O ATOM 1869 CB LEU B 59 -2.830 0.238 -6.274 1.00 0.00 C ATOM 1870 CG LEU B 59 -2.591 0.527 -4.796 1.00 0.00 C ATOM 1871 CD1 LEU B 59 -3.873 0.439 -3.996 1.00 0.00 C ATOM 1872 CD2 LEU B 59 -1.542 -0.421 -4.217 1.00 0.00 C ATOM 0 H LEU B 59 -1.097 -1.161 -7.510 1.00 0.00 H new ATOM 0 HA LEU B 59 -3.168 -1.686 -5.604 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -2.002 0.644 -6.856 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -3.732 0.757 -6.598 1.00 0.00 H new ATOM 0 HG LEU B 59 -2.218 1.549 -4.723 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -3.663 0.651 -2.948 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -4.590 1.166 -4.377 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -4.290 -0.564 -4.087 1.00 0.00 H new ATOM 0 HD21 LEU B 59 -1.390 -0.194 -3.162 1.00 0.00 H new ATOM 0 HD22 LEU B 59 -1.885 -1.450 -4.321 1.00 0.00 H new ATOM 0 HD23 LEU B 59 -0.602 -0.296 -4.754 1.00 0.00 H new ATOM 1884 N ALA B 60 -3.753 -1.984 -8.657 1.00 0.00 N ATOM 1885 CA ALA B 60 -4.723 -2.404 -9.629 1.00 0.00 C ATOM 1886 C ALA B 60 -5.031 -3.859 -9.342 1.00 0.00 C ATOM 1887 O ALA B 60 -6.120 -4.340 -9.611 1.00 0.00 O ATOM 1888 CB ALA B 60 -4.191 -2.215 -11.021 1.00 0.00 C ATOM 0 H ALA B 60 -2.784 -2.072 -8.964 1.00 0.00 H new ATOM 0 HA ALA B 60 -5.633 -1.807 -9.563 1.00 0.00 H new ATOM 0 HB1 ALA B 60 -4.940 -2.539 -11.744 1.00 0.00 H new ATOM 0 HB2 ALA B 60 -3.962 -1.162 -11.183 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -3.285 -2.807 -11.148 1.00 0.00 H new ATOM 1894 N CYS B 61 -4.022 -4.554 -8.806 1.00 0.00 N ATOM 1895 CA CYS B 61 -4.168 -5.939 -8.377 1.00 0.00 C ATOM 1896 C CYS B 61 -5.031 -5.888 -7.133 1.00 0.00 C ATOM 1897 O CYS B 61 -5.897 -6.729 -6.872 1.00 0.00 O ATOM 1898 CB CYS B 61 -2.797 -6.548 -8.042 1.00 0.00 C ATOM 1899 SG CYS B 61 -2.849 -8.000 -6.942 1.00 0.00 S ATOM 0 H CYS B 61 -3.088 -4.170 -8.660 1.00 0.00 H new ATOM 0 HA CYS B 61 -4.611 -6.556 -9.159 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -2.305 -6.833 -8.972 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -2.179 -5.780 -7.577 1.00 0.00 H new ATOM 1904 N ALA B 62 -4.791 -4.822 -6.396 1.00 0.00 N ATOM 1905 CA ALA B 62 -5.492 -4.547 -5.174 1.00 0.00 C ATOM 1906 C ALA B 62 -6.844 -3.915 -5.474 1.00 0.00 C ATOM 1907 O ALA B 62 -7.851 -4.278 -4.870 1.00 0.00 O ATOM 1908 CB ALA B 62 -4.642 -3.645 -4.296 1.00 0.00 C ATOM 0 H ALA B 62 -4.094 -4.118 -6.639 1.00 0.00 H new ATOM 0 HA ALA B 62 -5.674 -5.478 -4.638 1.00 0.00 H new ATOM 0 HB1 ALA B 62 -5.173 -3.435 -3.368 1.00 0.00 H new ATOM 0 HB2 ALA B 62 -3.698 -4.142 -4.070 1.00 0.00 H new ATOM 0 HB3 ALA B 62 -4.443 -2.710 -4.820 1.00 0.00 H new ATOM 1914 N ALA B 63 -6.853 -2.951 -6.407 1.00 0.00 N ATOM 1915 CA ALA B 63 -8.091 -2.282 -6.796 1.00 0.00 C ATOM 1916 C ALA B 63 -8.970 -3.284 -7.472 1.00 0.00 C ATOM 1917 O ALA B 63 -10.191 -3.231 -7.373 1.00 0.00 O ATOM 1918 CB ALA B 63 -7.846 -1.097 -7.712 1.00 0.00 C ATOM 0 H ALA B 63 -6.022 -2.624 -6.899 1.00 0.00 H new ATOM 0 HA ALA B 63 -8.569 -1.887 -5.900 1.00 0.00 H new ATOM 0 HB1 ALA B 63 -8.798 -0.635 -7.972 1.00 0.00 H new ATOM 0 HB2 ALA B 63 -7.216 -0.368 -7.203 1.00 0.00 H new ATOM 0 HB3 ALA B 63 -7.348 -1.436 -8.620 1.00 0.00 H new ATOM 1924 N THR B 64 -8.328 -4.218 -8.155 1.00 0.00 N ATOM 1925 CA THR B 64 -9.062 -5.284 -8.804 1.00 0.00 C ATOM 1926 C THR B 64 -9.492 -6.252 -7.724 1.00 0.00 C ATOM 1927 O THR B 64 -9.903 -7.378 -8.004 1.00 0.00 O ATOM 1928 CB THR B 64 -8.271 -6.037 -9.919 1.00 0.00 C ATOM 1929 OG1 THR B 64 -9.189 -6.733 -10.769 1.00 0.00 O ATOM 1930 CG2 THR B 64 -7.261 -7.040 -9.357 1.00 0.00 C ATOM 0 H THR B 64 -7.315 -4.258 -8.272 1.00 0.00 H new ATOM 0 HA THR B 64 -9.909 -4.836 -9.324 1.00 0.00 H new ATOM 0 HB THR B 64 -7.714 -5.284 -10.476 1.00 0.00 H new ATOM 0 HG1 THR B 64 -9.818 -7.246 -10.220 1.00 0.00 H new ATOM 0 HG21 THR B 64 -6.742 -7.533 -10.179 1.00 0.00 H new ATOM 0 HG22 THR B 64 -6.537 -6.516 -8.732 1.00 0.00 H new ATOM 0 HG23 THR B 64 -7.784 -7.786 -8.759 1.00 0.00 H new ATOM 1938 N ALA B 65 -9.386 -5.794 -6.465 1.00 0.00 N ATOM 1939 CA ALA B 65 -9.732 -6.632 -5.341 1.00 0.00 C ATOM 1940 C ALA B 65 -9.900 -5.888 -3.999 1.00 0.00 C ATOM 1941 O ALA B 65 -10.929 -5.280 -3.753 1.00 0.00 O ATOM 1942 CB ALA B 65 -8.685 -7.700 -5.216 1.00 0.00 C ATOM 0 H ALA B 65 -9.066 -4.858 -6.218 1.00 0.00 H new ATOM 0 HA ALA B 65 -10.717 -7.049 -5.548 1.00 0.00 H new ATOM 0 HB1 ALA B 65 -8.924 -8.347 -4.372 1.00 0.00 H new ATOM 0 HB2 ALA B 65 -8.658 -8.292 -6.131 1.00 0.00 H new ATOM 0 HB3 ALA B 65 -7.711 -7.238 -5.054 1.00 0.00 H new ATOM 1948 N THR B 66 -8.886 -5.961 -3.124 1.00 0.00 N ATOM 1949 CA THR B 66 -8.973 -5.387 -1.768 1.00 0.00 C ATOM 1950 C THR B 66 -8.715 -3.887 -1.667 1.00 0.00 C ATOM 1951 O THR B 66 -9.462 -3.211 -0.963 1.00 0.00 O ATOM 1952 CB THR B 66 -8.051 -6.128 -0.786 1.00 0.00 C ATOM 1953 OG1 THR B 66 -7.649 -7.381 -1.342 1.00 0.00 O ATOM 1954 CG2 THR B 66 -8.753 -6.379 0.535 1.00 0.00 C ATOM 0 H THR B 66 -7.994 -6.412 -3.329 1.00 0.00 H new ATOM 0 HA THR B 66 -10.019 -5.529 -1.497 1.00 0.00 H new ATOM 0 HB THR B 66 -7.177 -5.501 -0.610 1.00 0.00 H new ATOM 0 HG1 THR B 66 -8.414 -7.993 -1.355 1.00 0.00 H new ATOM 0 HG21 THR B 66 -8.079 -6.904 1.211 1.00 0.00 H new ATOM 0 HG22 THR B 66 -9.043 -5.427 0.979 1.00 0.00 H new ATOM 0 HG23 THR B 66 -9.642 -6.986 0.365 1.00 0.00 H new ATOM 1962 N SER B 67 -7.680 -3.335 -2.314 1.00 0.00 N ATOM 1963 CA SER B 67 -7.493 -1.872 -2.206 1.00 0.00 C ATOM 1964 C SER B 67 -8.821 -1.261 -2.545 1.00 0.00 C ATOM 1965 O SER B 67 -9.141 -0.123 -2.197 1.00 0.00 O ATOM 1966 CB SER B 67 -6.417 -1.305 -3.108 1.00 0.00 C ATOM 1967 OG SER B 67 -6.656 -1.607 -4.454 1.00 0.00 O ATOM 0 H SER B 67 -6.997 -3.835 -2.883 1.00 0.00 H new ATOM 0 HA SER B 67 -7.154 -1.638 -1.197 1.00 0.00 H new ATOM 0 HB2 SER B 67 -6.369 -0.224 -2.981 1.00 0.00 H new ATOM 0 HB3 SER B 67 -5.447 -1.704 -2.812 1.00 0.00 H new ATOM 0 HG SER B 67 -6.457 -0.822 -5.006 1.00 0.00 H new ATOM 1973 N SER B 68 -9.553 -2.069 -3.291 1.00 0.00 N ATOM 1974 CA SER B 68 -10.906 -1.844 -3.661 1.00 0.00 C ATOM 1975 C SER B 68 -11.156 -0.760 -4.670 1.00 0.00 C ATOM 1976 O SER B 68 -11.068 0.430 -4.398 1.00 0.00 O ATOM 1977 CB SER B 68 -11.793 -1.668 -2.438 1.00 0.00 C ATOM 1978 OG SER B 68 -11.072 -1.210 -1.310 1.00 0.00 O ATOM 0 H SER B 68 -9.183 -2.942 -3.666 1.00 0.00 H new ATOM 0 HA SER B 68 -11.179 -2.758 -4.189 1.00 0.00 H new ATOM 0 HB2 SER B 68 -12.589 -0.960 -2.669 1.00 0.00 H new ATOM 0 HB3 SER B 68 -12.271 -2.618 -2.199 1.00 0.00 H new ATOM 0 HG SER B 68 -10.859 -0.260 -1.422 1.00 0.00 H new ATOM 1984 N ALA B 69 -11.483 -1.243 -5.847 1.00 0.00 N ATOM 1985 CA ALA B 69 -11.866 -0.419 -6.980 1.00 0.00 C ATOM 1986 C ALA B 69 -11.917 -1.268 -8.238 1.00 0.00 C ATOM 1987 O ALA B 69 -11.404 -0.886 -9.290 1.00 0.00 O ATOM 1988 CB ALA B 69 -10.932 0.763 -7.165 1.00 0.00 C ATOM 0 H ALA B 69 -11.491 -2.242 -6.052 1.00 0.00 H new ATOM 0 HA ALA B 69 -12.857 -0.011 -6.780 1.00 0.00 H new ATOM 0 HB1 ALA B 69 -11.256 1.352 -8.023 1.00 0.00 H new ATOM 0 HB2 ALA B 69 -10.951 1.385 -6.270 1.00 0.00 H new ATOM 0 HB3 ALA B 69 -9.918 0.402 -7.335 1.00 0.00 H new ATOM 1994 N THR B 70 -12.546 -2.426 -8.108 1.00 0.00 N ATOM 1995 CA THR B 70 -12.667 -3.365 -9.210 1.00 0.00 C ATOM 1996 C THR B 70 -14.021 -3.246 -9.891 1.00 0.00 C ATOM 1997 O THR B 70 -15.022 -3.782 -9.417 1.00 0.00 O ATOM 1998 CB THR B 70 -12.453 -4.817 -8.738 1.00 0.00 C ATOM 1999 OG1 THR B 70 -13.383 -5.692 -9.385 1.00 0.00 O ATOM 2000 CG2 THR B 70 -12.599 -4.932 -7.228 1.00 0.00 C ATOM 0 H THR B 70 -12.984 -2.739 -7.242 1.00 0.00 H new ATOM 0 HA THR B 70 -11.888 -3.112 -9.929 1.00 0.00 H new ATOM 0 HB THR B 70 -11.438 -5.110 -9.007 1.00 0.00 H new ATOM 0 HG1 THR B 70 -13.519 -6.490 -8.833 1.00 0.00 H new ATOM 0 HG21 THR B 70 -12.443 -5.967 -6.925 1.00 0.00 H new ATOM 0 HG22 THR B 70 -11.859 -4.296 -6.741 1.00 0.00 H new ATOM 0 HG23 THR B 70 -13.600 -4.615 -6.934 1.00 0.00 H new ATOM 2008 N GLU B 71 -14.035 -2.537 -11.009 1.00 0.00 N ATOM 2009 CA GLU B 71 -15.252 -2.337 -11.785 1.00 0.00 C ATOM 2010 C GLU B 71 -15.756 -3.661 -12.342 1.00 0.00 C ATOM 2011 O GLU B 71 -16.815 -3.729 -12.966 1.00 0.00 O ATOM 2012 CB GLU B 71 -14.969 -1.333 -12.907 1.00 0.00 C ATOM 2013 CG GLU B 71 -16.084 -1.205 -13.938 1.00 0.00 C ATOM 2014 CD GLU B 71 -15.772 -0.180 -15.011 1.00 0.00 C ATOM 2015 OE1 GLU B 71 -15.961 1.027 -14.751 1.00 0.00 O ATOM 2016 OE2 GLU B 71 -15.340 -0.584 -16.111 1.00 0.00 O ATOM 0 H GLU B 71 -13.209 -2.086 -11.403 1.00 0.00 H new ATOM 0 HA GLU B 71 -16.036 -1.937 -11.141 1.00 0.00 H new ATOM 0 HB2 GLU B 71 -14.787 -0.354 -12.464 1.00 0.00 H new ATOM 0 HB3 GLU B 71 -14.052 -1.627 -13.417 1.00 0.00 H new ATOM 0 HG2 GLU B 71 -16.254 -2.175 -14.406 1.00 0.00 H new ATOM 0 HG3 GLU B 71 -17.010 -0.927 -13.434 1.00 0.00 H new ATOM 2023 N ALA B 72 -15.001 -4.722 -12.089 1.00 0.00 N ATOM 2024 CA ALA B 72 -15.369 -6.038 -12.578 1.00 0.00 C ATOM 2025 C ALA B 72 -16.189 -6.826 -11.557 1.00 0.00 C ATOM 2026 O ALA B 72 -17.089 -7.578 -11.933 1.00 0.00 O ATOM 2027 CB ALA B 72 -14.129 -6.819 -12.984 1.00 0.00 C ATOM 0 H ALA B 72 -14.135 -4.695 -11.551 1.00 0.00 H new ATOM 0 HA ALA B 72 -16.001 -5.893 -13.454 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -14.422 -7.804 -13.348 1.00 0.00 H new ATOM 0 HB2 ALA B 72 -13.603 -6.282 -13.773 1.00 0.00 H new ATOM 0 HB3 ALA B 72 -13.472 -6.932 -12.122 1.00 0.00 H new ATOM 2033 N CYS B 73 -15.884 -6.661 -10.270 1.00 0.00 N ATOM 2034 CA CYS B 73 -16.617 -7.378 -9.225 1.00 0.00 C ATOM 2035 C CYS B 73 -17.446 -6.429 -8.404 1.00 0.00 C ATOM 2036 O CYS B 73 -18.153 -6.850 -7.489 1.00 0.00 O ATOM 2037 CB CYS B 73 -15.669 -8.079 -8.256 1.00 0.00 C ATOM 2038 SG CYS B 73 -14.237 -8.886 -9.031 1.00 0.00 S ATOM 0 H CYS B 73 -15.145 -6.046 -9.928 1.00 0.00 H new ATOM 0 HA CYS B 73 -17.245 -8.106 -9.739 1.00 0.00 H new ATOM 0 HB2 CYS B 73 -15.308 -7.348 -7.532 1.00 0.00 H new ATOM 0 HB3 CYS B 73 -16.232 -8.828 -7.699 1.00 0.00 H new ATOM 2043 N LYS B 74 -17.378 -5.155 -8.729 1.00 0.00 N ATOM 2044 CA LYS B 74 -18.070 -4.178 -7.931 1.00 0.00 C ATOM 2045 C LYS B 74 -19.577 -4.252 -7.989 1.00 0.00 C ATOM 2046 O LYS B 74 -20.185 -5.305 -7.795 1.00 0.00 O ATOM 2047 CB LYS B 74 -17.609 -2.757 -8.217 1.00 0.00 C ATOM 2048 CG LYS B 74 -17.858 -1.845 -7.027 1.00 0.00 C ATOM 2049 CD LYS B 74 -18.983 -0.848 -7.264 1.00 0.00 C ATOM 2050 CE LYS B 74 -19.285 0.000 -6.043 1.00 0.00 C ATOM 2051 NZ LYS B 74 -19.969 1.274 -6.402 1.00 0.00 N ATOM 0 H LYS B 74 -16.860 -4.782 -9.525 1.00 0.00 H new ATOM 0 HA LYS B 74 -17.791 -4.447 -6.912 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -16.546 -2.759 -8.460 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -18.135 -2.371 -9.090 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -18.097 -2.453 -6.155 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -16.942 -1.302 -6.795 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -18.715 -0.196 -8.096 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -19.884 -1.387 -7.558 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -19.912 -0.566 -5.355 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -18.356 0.223 -5.518 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -19.691 2.018 -5.731 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -19.695 1.556 -7.365 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -20.999 1.138 -6.361 1.00 0.00 H new ATOM 2065 N GLY B 75 -20.161 -3.107 -8.259 1.00 0.00 N ATOM 2066 CA GLY B 75 -21.577 -2.970 -8.212 1.00 0.00 C ATOM 2067 C GLY B 75 -21.954 -3.023 -6.757 1.00 0.00 C ATOM 2068 O GLY B 75 -23.098 -3.308 -6.398 1.00 0.00 O ATOM 0 H GLY B 75 -19.661 -2.256 -8.515 1.00 0.00 H new ATOM 0 HA2 GLY B 75 -21.892 -2.029 -8.662 1.00 0.00 H new ATOM 0 HA3 GLY B 75 -22.064 -3.769 -8.770 1.00 0.00 H new ATOM 2072 N CYS B 76 -20.947 -2.735 -5.903 1.00 0.00 N ATOM 2073 CA CYS B 76 -21.120 -2.806 -4.471 1.00 0.00 C ATOM 2074 C CYS B 76 -20.047 -2.060 -3.650 1.00 0.00 C ATOM 2075 O CYS B 76 -20.347 -1.074 -2.979 1.00 0.00 O ATOM 2076 CB CYS B 76 -21.052 -4.276 -4.062 1.00 0.00 C ATOM 2077 SG CYS B 76 -22.641 -5.160 -4.034 1.00 0.00 S ATOM 0 H CYS B 76 -20.013 -2.453 -6.200 1.00 0.00 H new ATOM 0 HA CYS B 76 -22.076 -2.328 -4.258 1.00 0.00 H new ATOM 0 HB2 CYS B 76 -20.381 -4.794 -4.747 1.00 0.00 H new ATOM 0 HB3 CYS B 76 -20.605 -4.338 -3.070 1.00 0.00 H new ATOM 2082 N LEU B 77 -18.793 -2.520 -3.743 1.00 0.00 N ATOM 2083 CA LEU B 77 -17.706 -2.034 -2.866 1.00 0.00 C ATOM 2084 C LEU B 77 -16.768 -0.915 -3.361 1.00 0.00 C ATOM 2085 O LEU B 77 -16.190 -0.244 -2.511 1.00 0.00 O ATOM 2086 CB LEU B 77 -16.841 -3.240 -2.511 1.00 0.00 C ATOM 2087 CG LEU B 77 -15.672 -2.974 -1.562 1.00 0.00 C ATOM 2088 CD1 LEU B 77 -16.174 -2.456 -0.236 1.00 0.00 C ATOM 2089 CD2 LEU B 77 -14.855 -4.232 -1.351 1.00 0.00 C ATOM 0 H LEU B 77 -18.500 -3.229 -4.416 1.00 0.00 H new ATOM 0 HA LEU B 77 -18.238 -1.559 -2.042 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -17.480 -4.001 -2.063 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -16.444 -3.661 -3.435 1.00 0.00 H new ATOM 0 HG LEU B 77 -15.033 -2.217 -2.017 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -15.328 -2.272 0.427 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -16.721 -1.526 -0.392 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -16.836 -3.195 0.216 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -14.029 -4.020 -0.673 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -15.487 -5.009 -0.921 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -14.460 -4.574 -2.308 1.00 0.00 H new ATOM 2101 N TRP B 78 -16.600 -0.703 -4.671 1.00 0.00 N ATOM 2102 CA TRP B 78 -15.635 0.317 -5.179 1.00 0.00 C ATOM 2103 C TRP B 78 -14.991 1.134 -4.064 1.00 0.00 C ATOM 2104 O TRP B 78 -15.668 2.020 -3.509 1.00 0.00 O ATOM 2105 CB TRP B 78 -16.249 1.275 -6.213 1.00 0.00 C ATOM 2106 CG TRP B 78 -16.134 0.785 -7.618 1.00 0.00 C ATOM 2107 CD1 TRP B 78 -15.250 -0.132 -8.097 1.00 0.00 C ATOM 2108 CD2 TRP B 78 -16.944 1.175 -8.720 1.00 0.00 C ATOM 2109 NE1 TRP B 78 -15.488 -0.368 -9.423 1.00 0.00 N ATOM 2110 CE2 TRP B 78 -16.522 0.430 -9.830 1.00 0.00 C ATOM 2111 CE3 TRP B 78 -17.995 2.073 -8.869 1.00 0.00 C ATOM 2112 CZ2 TRP B 78 -17.120 0.552 -11.070 1.00 0.00 C ATOM 2113 CZ3 TRP B 78 -18.588 2.203 -10.108 1.00 0.00 C ATOM 2114 CH2 TRP B 78 -18.152 1.442 -11.198 1.00 0.00 C ATOM 2115 OXT TRP B 78 -13.809 0.879 -3.759 1.00 0.00 O ATOM 0 H TRP B 78 -17.104 -1.208 -5.400 1.00 0.00 H new ATOM 0 HA TRP B 78 -14.863 -0.272 -5.673 1.00 0.00 H new ATOM 0 HB2 TRP B 78 -17.302 1.428 -5.975 1.00 0.00 H new ATOM 0 HB3 TRP B 78 -15.759 2.246 -6.134 1.00 0.00 H new ATOM 0 HD1 TRP B 78 -14.473 -0.605 -7.515 1.00 0.00 H new ATOM 0 HE1 TRP B 78 -14.979 -1.029 -10.010 1.00 0.00 H new ATOM 0 HE3 TRP B 78 -18.341 2.658 -8.030 1.00 0.00 H new ATOM 0 HZ2 TRP B 78 -16.784 -0.036 -11.911 1.00 0.00 H new ATOM 0 HZ3 TRP B 78 -19.401 2.902 -10.238 1.00 0.00 H new ATOM 0 HH2 TRP B 78 -18.637 1.559 -12.156 1.00 0.00 H new TER 2126 TRP B 78