USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 838 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 162 GLN : amide:sc= 0.0555 K(o=0.12,f=-1.1) USER MOD Set 1.2: B 163 LYS NZ :NH3+ -115:sc= 0.0665 (180deg=-0.0296) USER MOD Set 2.1: B 107 THR OG1 : rot 121:sc= -1.28 USER MOD Set 2.2: B 109 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 25 MET CE :methyl 139:sc= -6.36! (180deg=-9.88!) USER MOD Set 3.2: B 149 GLN :FLIP amide:sc= -3.39 F(o=-17!,f=-9.7) USER MOD Set 4.1: A 6 MET CE :methyl 155:sc= -3.15 (180deg=-5.67!) USER MOD Set 4.2: A 15 MET CE :methyl 171:sc= -12! (180deg=-13!) USER MOD Set 5.1: A 13 THR OG1 : rot -170:sc= -0.879 USER MOD Set 5.2: B 168 HIS : no HD1:sc= -0.458 X(o=-1.3,f=-0.9) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 52:sc= 0.513 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -0.903 K(o=-0.9,f=-3.2!) USER MOD Single : A 11 HIS :FLIP no HD1:sc= -5.54! C(o=-7.5!,f=-5.5!) USER MOD Single : A 16 ASN :FLIP amide:sc= -8.51! C(o=-10!,f=-8.5!) USER MOD Single : A 17 GLN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 20 THR OG1 : rot -121:sc= -1.5 USER MOD Single : A 22 HIS : no HD1:sc= -3.94 K(o=-3.9,f=-6.4!) USER MOD Single : A 27 SER OG : rot -46:sc= 0.242 USER MOD Single : A 31 THR OG1 : rot -46:sc= 0.99 USER MOD Single : B 101 MET CE :methyl 175:sc= -0.199 (180deg=-0.237) USER MOD Single : B 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 THR OG1 : rot 180:sc= -0.0971 USER MOD Single : B 114 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 122 THR OG1 : rot 180:sc= 0 USER MOD Single : B 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 127 LYS NZ :NH3+ -143:sc= 0.182 (180deg=0) USER MOD Single : B 129 LYS NZ :NH3+ 165:sc= 0.449 (180deg=0.202) USER MOD Single : B 131 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : B 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 140 GLN : amide:sc= -5.87! C(o=-5.9!,f=-11!) USER MOD Single : B 141 GLN : amide:sc= -4.35 K(o=-4.4,f=-12!) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 155 THR OG1 : rot 180:sc= -1.84 USER MOD Single : B 157 SER OG : rot 180:sc= 0 USER MOD Single : B 159 TYR OH : rot -86:sc= 1.15 USER MOD Single : B 160 ASN : amide:sc= -0.675 K(o=-0.67,f=-1.3) USER MOD Single : B 165 SER OG : rot -150:sc= -0.669 USER MOD Single : B 166 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.433 -22.660 23.186 1.00 0.00 N ATOM 2 CA GLY A 1 3.295 -24.000 22.557 1.00 0.00 C ATOM 3 C GLY A 1 3.080 -23.920 21.058 1.00 0.00 C ATOM 4 O GLY A 1 3.932 -24.350 20.278 1.00 0.00 O ATOM 0 H1 GLY A 1 3.578 -22.770 24.210 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.249 -22.165 22.772 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.569 -22.106 23.016 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.190 -24.587 22.761 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.457 -24.527 23.013 1.00 0.00 H new ATOM 10 N SER A 2 1.936 -23.380 20.656 1.00 0.00 N ATOM 11 CA SER A 2 1.610 -23.240 19.241 1.00 0.00 C ATOM 12 C SER A 2 1.133 -21.830 18.925 1.00 0.00 C ATOM 13 O SER A 2 -0.068 -21.580 18.818 1.00 0.00 O ATOM 14 CB SER A 2 0.536 -24.260 18.844 1.00 0.00 C ATOM 15 OG SER A 2 -0.621 -24.120 19.651 1.00 0.00 O ATOM 0 H SER A 2 1.217 -23.031 21.290 1.00 0.00 H new ATOM 0 HA SER A 2 2.515 -23.430 18.664 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.271 -24.125 17.795 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.934 -25.270 18.944 1.00 0.00 H new ATOM 0 HG SER A 2 -0.914 -23.185 19.643 1.00 0.00 H new ATOM 21 N THR A 3 2.081 -20.910 18.777 1.00 0.00 N ATOM 22 CA THR A 3 1.757 -19.520 18.473 1.00 0.00 C ATOM 23 C THR A 3 1.495 -19.340 16.982 1.00 0.00 C ATOM 24 O THR A 3 2.246 -19.830 16.144 1.00 0.00 O ATOM 25 CB THR A 3 2.894 -18.600 18.921 1.00 0.00 C ATOM 26 OG1 THR A 3 2.553 -17.240 18.708 1.00 0.00 O ATOM 27 CG2 THR A 3 4.197 -18.870 18.198 1.00 0.00 C ATOM 0 H THR A 3 3.079 -21.101 18.863 1.00 0.00 H new ATOM 0 HA THR A 3 0.851 -19.254 19.017 1.00 0.00 H new ATOM 0 HB THR A 3 3.036 -18.807 19.982 1.00 0.00 H new ATOM 0 HG1 THR A 3 3.292 -16.668 19.002 1.00 0.00 H new ATOM 0 HG21 THR A 3 4.963 -18.185 18.561 1.00 0.00 H new ATOM 0 HG22 THR A 3 4.511 -19.897 18.385 1.00 0.00 H new ATOM 0 HG23 THR A 3 4.056 -18.723 17.127 1.00 0.00 H new ATOM 35 N SER A 4 0.424 -18.620 16.659 1.00 0.00 N ATOM 36 CA SER A 4 0.063 -18.370 15.268 1.00 0.00 C ATOM 37 C SER A 4 1.120 -17.510 14.576 1.00 0.00 C ATOM 38 O SER A 4 2.199 -17.280 15.122 1.00 0.00 O ATOM 39 CB SER A 4 -1.299 -17.680 15.190 1.00 0.00 C ATOM 40 OG SER A 4 -2.259 -18.350 15.988 1.00 0.00 O ATOM 0 H SER A 4 -0.208 -18.200 17.341 1.00 0.00 H new ATOM 0 HA SER A 4 0.008 -19.330 14.755 1.00 0.00 H new ATOM 0 HB2 SER A 4 -1.205 -16.646 15.521 1.00 0.00 H new ATOM 0 HB3 SER A 4 -1.638 -17.654 14.154 1.00 0.00 H new ATOM 0 HG SER A 4 -3.120 -17.887 15.921 1.00 0.00 H new ATOM 46 N ALA A 5 0.804 -17.050 13.372 1.00 0.00 N ATOM 47 CA ALA A 5 1.727 -16.220 12.605 1.00 0.00 C ATOM 48 C ALA A 5 0.974 -15.300 11.654 1.00 0.00 C ATOM 49 O ALA A 5 -0.235 -15.430 11.477 1.00 0.00 O ATOM 50 CB ALA A 5 2.703 -17.100 11.833 1.00 0.00 C ATOM 0 H ALA A 5 -0.083 -17.237 12.905 1.00 0.00 H new ATOM 0 HA ALA A 5 2.287 -15.596 13.302 1.00 0.00 H new ATOM 0 HB1 ALA A 5 3.388 -16.471 11.264 1.00 0.00 H new ATOM 0 HB2 ALA A 5 3.271 -17.714 12.532 1.00 0.00 H new ATOM 0 HB3 ALA A 5 2.150 -17.745 11.150 1.00 0.00 H new ATOM 56 N MET A 6 1.700 -14.370 11.039 1.00 0.00 N ATOM 57 CA MET A 6 1.100 -13.430 10.103 1.00 0.00 C ATOM 58 C MET A 6 0.843 -14.100 8.763 1.00 0.00 C ATOM 59 O MET A 6 1.270 -15.240 8.544 1.00 0.00 O ATOM 60 CB MET A 6 2.014 -12.220 9.890 1.00 0.00 C ATOM 61 CG MET A 6 2.772 -11.770 11.133 1.00 0.00 C ATOM 62 SD MET A 6 4.542 -11.560 10.836 1.00 0.00 S ATOM 63 CE MET A 6 4.548 -10.970 9.143 1.00 0.00 C ATOM 0 H MET A 6 2.704 -14.249 11.173 1.00 0.00 H new ATOM 0 HA MET A 6 0.154 -13.096 10.529 1.00 0.00 H new ATOM 0 HB2 MET A 6 2.735 -12.459 9.108 1.00 0.00 H new ATOM 0 HB3 MET A 6 1.413 -11.387 9.526 1.00 0.00 H new ATOM 0 HG2 MET A 6 2.353 -10.828 11.487 1.00 0.00 H new ATOM 0 HG3 MET A 6 2.626 -12.502 11.927 1.00 0.00 H new ATOM 0 HE1 MET A 6 5.454 -10.392 8.962 1.00 0.00 H new ATOM 0 HE2 MET A 6 4.518 -11.820 8.461 1.00 0.00 H new ATOM 0 HE3 MET A 6 3.675 -10.339 8.975 1.00 0.00 H new ATOM 73 N TRP A 7 0.161 -13.410 7.858 1.00 0.00 N ATOM 74 CA TRP A 7 -0.114 -13.970 6.543 1.00 0.00 C ATOM 75 C TRP A 7 -0.197 -12.890 5.488 1.00 0.00 C ATOM 76 O TRP A 7 -1.049 -12.000 5.539 1.00 0.00 O ATOM 77 CB TRP A 7 -1.390 -14.800 6.536 1.00 0.00 C ATOM 78 CG TRP A 7 -2.629 -14.050 6.923 1.00 0.00 C ATOM 79 CD1 TRP A 7 -3.125 -13.860 8.185 1.00 0.00 C ATOM 80 CD2 TRP A 7 -3.539 -13.380 6.033 1.00 0.00 C ATOM 81 NE1 TRP A 7 -4.286 -13.120 8.126 1.00 0.00 N ATOM 82 CE2 TRP A 7 -4.553 -12.810 6.824 1.00 0.00 C ATOM 83 CE3 TRP A 7 -3.593 -13.210 4.646 1.00 0.00 C ATOM 84 CZ2 TRP A 7 -5.603 -12.080 6.281 1.00 0.00 C ATOM 85 CZ3 TRP A 7 -4.641 -12.480 4.105 1.00 0.00 C ATOM 86 CH2 TRP A 7 -5.632 -11.920 4.921 1.00 0.00 C ATOM 0 H TRP A 7 -0.208 -12.471 8.009 1.00 0.00 H new ATOM 0 HA TRP A 7 0.722 -14.627 6.304 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -1.531 -15.216 5.538 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -1.263 -15.641 7.217 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -2.673 -14.234 9.092 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -4.855 -12.847 8.927 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -2.834 -13.639 4.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -6.370 -11.653 6.910 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -4.694 -12.341 3.035 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -6.433 -11.352 4.470 1.00 0.00 H new ATOM 97 N ALA A 8 0.701 -12.990 4.530 1.00 0.00 N ATOM 98 CA ALA A 8 0.758 -12.040 3.431 1.00 0.00 C ATOM 99 C ALA A 8 -0.464 -12.180 2.534 1.00 0.00 C ATOM 100 O ALA A 8 -0.719 -13.260 1.994 1.00 0.00 O ATOM 101 CB ALA A 8 2.035 -12.230 2.628 1.00 0.00 C ATOM 0 H ALA A 8 1.408 -13.724 4.488 1.00 0.00 H new ATOM 0 HA ALA A 8 0.760 -11.033 3.849 1.00 0.00 H new ATOM 0 HB1 ALA A 8 2.061 -11.511 1.810 1.00 0.00 H new ATOM 0 HB2 ALA A 8 2.898 -12.074 3.275 1.00 0.00 H new ATOM 0 HB3 ALA A 8 2.063 -13.242 2.223 1.00 0.00 H new ATOM 107 N CYS A 9 -1.223 -11.100 2.381 1.00 0.00 N ATOM 108 CA CYS A 9 -2.423 -11.120 1.551 1.00 0.00 C ATOM 109 C CYS A 9 -2.152 -11.790 0.207 1.00 0.00 C ATOM 110 O CYS A 9 -1.008 -11.860 -0.243 1.00 0.00 O ATOM 111 CB CYS A 9 -2.926 -9.703 1.311 1.00 0.00 C ATOM 112 SG CYS A 9 -4.633 -9.623 0.728 1.00 0.00 S ATOM 0 H CYS A 9 -1.029 -10.200 2.820 1.00 0.00 H new ATOM 0 HA CYS A 9 -3.182 -11.693 2.083 1.00 0.00 H new ATOM 0 HB2 CYS A 9 -2.842 -9.136 2.238 1.00 0.00 H new ATOM 0 HB3 CYS A 9 -2.279 -9.217 0.580 1.00 0.00 H new ATOM 117 N GLN A 10 -3.206 -12.280 -0.433 1.00 0.00 N ATOM 118 CA GLN A 10 -3.071 -12.940 -1.728 1.00 0.00 C ATOM 119 C GLN A 10 -3.768 -12.140 -2.828 1.00 0.00 C ATOM 120 O GLN A 10 -4.031 -12.660 -3.912 1.00 0.00 O ATOM 121 CB GLN A 10 -3.645 -14.360 -1.670 1.00 0.00 C ATOM 122 CG GLN A 10 -5.076 -14.410 -1.164 1.00 0.00 C ATOM 123 CD GLN A 10 -5.155 -14.590 0.339 1.00 0.00 C ATOM 124 OE1 GLN A 10 -4.779 -15.630 0.879 1.00 0.00 O ATOM 125 NE2 GLN A 10 -5.646 -13.560 1.024 1.00 0.00 N ATOM 0 H GLN A 10 -4.162 -12.234 -0.079 1.00 0.00 H new ATOM 0 HA GLN A 10 -2.008 -12.997 -1.964 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -3.603 -14.802 -2.665 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -3.017 -14.972 -1.023 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -5.589 -13.490 -1.444 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -5.602 -15.230 -1.653 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -5.945 -12.717 0.533 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -5.723 -13.613 2.040 1.00 0.00 H new ATOM 134 N HIS A 11 -4.066 -10.880 -2.546 1.00 0.00 N ATOM 135 CA HIS A 11 -4.732 -10.010 -3.516 1.00 0.00 C ATOM 136 C HIS A 11 -4.028 -8.668 -3.624 1.00 0.00 C ATOM 137 O HIS A 11 -3.596 -8.267 -4.704 1.00 0.00 O ATOM 138 CB HIS A 11 -6.194 -9.801 -3.125 1.00 0.00 C ATOM 139 CG HIS A 11 -6.873 -11.030 -2.622 1.00 0.00 C ATOM 140 ND1 HIS A 11 -7.441 -11.280 -1.427 1.00 0.00 N flip ATOM 141 CD2 HIS A 11 -7.034 -12.170 -3.379 1.00 0.00 C flip ATOM 142 CE1 HIS A 11 -7.933 -12.570 -1.476 1.00 0.00 C flip ATOM 143 NE2 HIS A 11 -7.676 -13.080 -2.665 1.00 0.00 N flip ATOM 0 H HIS A 11 -3.858 -10.433 -1.653 1.00 0.00 H new ATOM 0 HA HIS A 11 -4.688 -10.499 -4.489 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -6.246 -9.030 -2.356 1.00 0.00 H new ATOM 0 HB3 HIS A 11 -6.740 -9.426 -3.991 1.00 0.00 H new ATOM 0 HD2 HIS A 11 -6.690 -12.300 -4.395 1.00 0.00 H new ATOM 0 HE1 HIS A 11 -8.445 -13.078 -0.672 1.00 0.00 H new ATOM 0 HE2 HIS A 11 -7.929 -14.016 -2.980 1.00 0.00 H new ATOM 152 N CYS A 12 -3.921 -7.969 -2.497 1.00 0.00 N ATOM 153 CA CYS A 12 -3.275 -6.663 -2.469 1.00 0.00 C ATOM 154 C CYS A 12 -1.818 -6.777 -2.017 1.00 0.00 C ATOM 155 O CYS A 12 -1.024 -5.857 -2.217 1.00 0.00 O ATOM 156 CB CYS A 12 -4.059 -5.707 -1.565 1.00 0.00 C ATOM 157 SG CYS A 12 -3.814 -5.967 0.206 1.00 0.00 S ATOM 0 H CYS A 12 -4.273 -8.286 -1.594 1.00 0.00 H new ATOM 0 HA CYS A 12 -3.272 -6.258 -3.481 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -3.776 -4.683 -1.810 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -5.121 -5.806 -1.789 1.00 0.00 H new ATOM 162 N THR A 13 -1.472 -7.922 -1.425 1.00 0.00 N ATOM 163 CA THR A 13 -0.109 -8.185 -0.960 1.00 0.00 C ATOM 164 C THR A 13 0.176 -7.545 0.397 1.00 0.00 C ATOM 165 O THR A 13 1.332 -7.302 0.742 1.00 0.00 O ATOM 166 CB THR A 13 0.920 -7.703 -1.986 1.00 0.00 C ATOM 167 OG1 THR A 13 0.391 -7.769 -3.298 1.00 0.00 O ATOM 168 CG2 THR A 13 2.204 -8.505 -1.969 1.00 0.00 C ATOM 0 H THR A 13 -2.124 -8.688 -1.255 1.00 0.00 H new ATOM 0 HA THR A 13 -0.024 -9.265 -0.843 1.00 0.00 H new ATOM 0 HB THR A 13 1.148 -6.675 -1.703 1.00 0.00 H new ATOM 0 HG1 THR A 13 1.107 -7.610 -3.948 1.00 0.00 H new ATOM 0 HG21 THR A 13 2.889 -8.111 -2.720 1.00 0.00 H new ATOM 0 HG22 THR A 13 2.665 -8.433 -0.984 1.00 0.00 H new ATOM 0 HG23 THR A 13 1.984 -9.549 -2.191 1.00 0.00 H new ATOM 176 N PHE A 14 -0.871 -7.287 1.173 1.00 0.00 N ATOM 177 CA PHE A 14 -0.704 -6.694 2.495 1.00 0.00 C ATOM 178 C PHE A 14 -0.467 -7.779 3.537 1.00 0.00 C ATOM 179 O PHE A 14 -1.138 -8.809 3.540 1.00 0.00 O ATOM 180 CB PHE A 14 -1.934 -5.863 2.877 1.00 0.00 C ATOM 181 CG PHE A 14 -2.032 -5.561 4.350 1.00 0.00 C ATOM 182 CD1 PHE A 14 -1.379 -4.469 4.899 1.00 0.00 C ATOM 183 CD2 PHE A 14 -2.781 -6.377 5.183 1.00 0.00 C ATOM 184 CE1 PHE A 14 -1.474 -4.198 6.252 1.00 0.00 C ATOM 185 CE2 PHE A 14 -2.878 -6.111 6.535 1.00 0.00 C ATOM 186 CZ PHE A 14 -2.224 -5.020 7.070 1.00 0.00 C ATOM 0 H PHE A 14 -1.838 -7.478 0.912 1.00 0.00 H new ATOM 0 HA PHE A 14 0.164 -6.036 2.464 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -1.912 -4.924 2.324 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -2.832 -6.396 2.565 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -0.790 -3.823 4.264 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -3.295 -7.232 4.770 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -0.962 -3.344 6.669 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -3.465 -6.756 7.172 1.00 0.00 H new ATOM 0 HZ PHE A 14 -2.299 -4.809 8.127 1.00 0.00 H new ATOM 196 N MET A 15 0.482 -7.536 4.428 1.00 0.00 N ATOM 197 CA MET A 15 0.798 -8.476 5.472 1.00 0.00 C ATOM 198 C MET A 15 -0.208 -8.346 6.605 1.00 0.00 C ATOM 199 O MET A 15 -0.219 -7.359 7.340 1.00 0.00 O ATOM 200 CB MET A 15 2.212 -8.223 5.967 1.00 0.00 C ATOM 201 CG MET A 15 3.246 -9.179 5.392 1.00 0.00 C ATOM 202 SD MET A 15 3.354 -10.740 6.279 1.00 0.00 S ATOM 203 CE MET A 15 1.725 -10.860 7.010 1.00 0.00 C ATOM 0 H MET A 15 1.046 -6.686 4.441 1.00 0.00 H new ATOM 0 HA MET A 15 0.742 -9.493 5.083 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.497 -7.201 5.716 1.00 0.00 H new ATOM 0 HB3 MET A 15 2.225 -8.300 7.054 1.00 0.00 H new ATOM 0 HG2 MET A 15 3.003 -9.380 4.349 1.00 0.00 H new ATOM 0 HG3 MET A 15 4.223 -8.695 5.404 1.00 0.00 H new ATOM 0 HE1 MET A 15 1.597 -11.848 7.453 1.00 0.00 H new ATOM 0 HE2 MET A 15 1.616 -10.099 7.783 1.00 0.00 H new ATOM 0 HE3 MET A 15 0.969 -10.706 6.240 1.00 0.00 H new ATOM 213 N ASN A 16 -1.067 -9.342 6.711 1.00 0.00 N ATOM 214 CA ASN A 16 -2.116 -9.361 7.720 1.00 0.00 C ATOM 215 C ASN A 16 -1.629 -9.991 9.019 1.00 0.00 C ATOM 216 O ASN A 16 -0.496 -10.460 9.106 1.00 0.00 O ATOM 217 CB ASN A 16 -3.318 -10.130 7.187 1.00 0.00 C ATOM 218 CG ASN A 16 -3.671 -9.747 5.766 1.00 0.00 C ATOM 219 OD1 ASN A 16 -2.996 -10.350 4.799 1.00 0.00 O flip ATOM 220 ND2 ASN A 16 -4.543 -8.911 5.539 1.00 0.00 N flip ATOM 0 H ASN A 16 -1.060 -10.161 6.103 1.00 0.00 H new ATOM 0 HA ASN A 16 -2.402 -8.332 7.937 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -3.109 -11.199 7.230 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -4.177 -9.947 7.833 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -5.040 -8.469 6.313 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -4.770 -8.659 4.577 1.00 0.00 H new ATOM 227 N GLN A 17 -2.495 -9.995 10.028 1.00 0.00 N ATOM 228 CA GLN A 17 -2.155 -10.560 11.329 1.00 0.00 C ATOM 229 C GLN A 17 -2.586 -12.020 11.392 1.00 0.00 C ATOM 230 O GLN A 17 -3.302 -12.500 10.524 1.00 0.00 O ATOM 231 CB GLN A 17 -2.816 -9.781 12.464 1.00 0.00 C ATOM 232 CG GLN A 17 -2.925 -8.286 12.201 1.00 0.00 C ATOM 233 CD GLN A 17 -1.607 -7.562 12.397 1.00 0.00 C ATOM 234 OE1 GLN A 17 -0.636 -7.858 11.541 1.00 0.00 O flip ATOM 235 NE2 GLN A 17 -1.464 -6.746 13.307 1.00 0.00 N flip ATOM 0 H GLN A 17 -3.439 -9.613 9.969 1.00 0.00 H new ATOM 0 HA GLN A 17 -1.074 -10.491 11.451 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -3.814 -10.184 12.636 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -2.247 -9.939 13.380 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -3.276 -8.125 11.182 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -3.674 -7.857 12.867 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -2.238 -6.549 13.942 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -0.572 -6.266 13.426 1.00 0.00 H new ATOM 244 N PRO A 18 -2.153 -12.760 12.418 1.00 0.00 N ATOM 245 CA PRO A 18 -2.508 -14.170 12.565 1.00 0.00 C ATOM 246 C PRO A 18 -3.982 -14.370 12.907 1.00 0.00 C ATOM 247 O PRO A 18 -4.550 -15.430 12.642 1.00 0.00 O ATOM 248 CB PRO A 18 -1.625 -14.660 13.717 1.00 0.00 C ATOM 249 CG PRO A 18 -0.648 -13.560 13.989 1.00 0.00 C ATOM 250 CD PRO A 18 -1.287 -12.290 13.503 1.00 0.00 C ATOM 0 HA PRO A 18 -2.352 -14.716 11.635 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -2.224 -14.877 14.602 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -1.109 -15.582 13.448 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -0.421 -13.497 15.053 1.00 0.00 H new ATOM 0 HG3 PRO A 18 0.294 -13.742 13.473 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -1.856 -11.796 14.290 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -0.546 -11.574 13.148 1.00 0.00 H new ATOM 258 N GLY A 19 -4.597 -13.350 13.497 1.00 0.00 N ATOM 259 CA GLY A 19 -5.999 -13.450 13.862 1.00 0.00 C ATOM 260 C GLY A 19 -6.910 -12.720 12.888 1.00 0.00 C ATOM 261 O GLY A 19 -8.101 -12.560 13.150 1.00 0.00 O ATOM 0 H GLY A 19 -4.153 -12.461 13.728 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -6.286 -14.501 13.904 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -6.140 -13.041 14.862 1.00 0.00 H new ATOM 265 N THR A 20 -6.352 -12.290 11.763 1.00 0.00 N ATOM 266 CA THR A 20 -7.129 -11.570 10.756 1.00 0.00 C ATOM 267 C THR A 20 -7.674 -12.530 9.702 1.00 0.00 C ATOM 268 O THR A 20 -7.024 -12.780 8.688 1.00 0.00 O ATOM 269 CB THR A 20 -6.270 -10.500 10.079 1.00 0.00 C ATOM 270 OG1 THR A 20 -5.044 -10.330 10.766 1.00 0.00 O ATOM 271 CG2 THR A 20 -6.946 -9.154 10.003 1.00 0.00 C ATOM 0 H THR A 20 -5.370 -12.425 11.524 1.00 0.00 H new ATOM 0 HA THR A 20 -7.967 -11.089 11.261 1.00 0.00 H new ATOM 0 HB THR A 20 -6.104 -10.862 9.064 1.00 0.00 H new ATOM 0 HG1 THR A 20 -4.963 -9.401 11.066 1.00 0.00 H new ATOM 0 HG21 THR A 20 -6.283 -8.441 9.512 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.870 -9.243 9.432 1.00 0.00 H new ATOM 0 HG23 THR A 20 -7.174 -8.804 11.010 1.00 0.00 H new ATOM 279 N GLY A 21 -8.875 -13.050 9.936 1.00 0.00 N ATOM 280 CA GLY A 21 -9.479 -13.960 8.976 1.00 0.00 C ATOM 281 C GLY A 21 -9.463 -13.380 7.576 1.00 0.00 C ATOM 282 O GLY A 21 -9.199 -14.080 6.601 1.00 0.00 O ATOM 0 H GLY A 21 -9.438 -12.861 10.765 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -8.942 -14.908 8.984 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -10.506 -14.173 9.271 1.00 0.00 H new ATOM 286 N HIS A 22 -9.734 -12.080 7.491 1.00 0.00 N ATOM 287 CA HIS A 22 -9.741 -11.370 6.231 1.00 0.00 C ATOM 288 C HIS A 22 -8.662 -10.300 6.249 1.00 0.00 C ATOM 289 O HIS A 22 -7.955 -10.140 7.244 1.00 0.00 O ATOM 290 CB HIS A 22 -11.100 -10.720 5.992 1.00 0.00 C ATOM 291 CG HIS A 22 -12.250 -11.670 5.960 1.00 0.00 C ATOM 292 ND1 HIS A 22 -12.420 -12.700 6.866 1.00 0.00 N ATOM 293 CD2 HIS A 22 -13.300 -11.740 5.118 1.00 0.00 C ATOM 294 CE1 HIS A 22 -13.530 -13.360 6.575 1.00 0.00 C ATOM 295 NE2 HIS A 22 -14.080 -12.790 5.519 1.00 0.00 N ATOM 0 H HIS A 22 -9.954 -11.496 8.298 1.00 0.00 H new ATOM 0 HA HIS A 22 -9.546 -12.079 5.426 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -11.277 -9.983 6.775 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.067 -10.179 5.046 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -13.491 -11.086 4.280 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -13.918 -14.215 7.108 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -14.948 -13.085 5.073 1.00 0.00 H new ATOM 304 N CYS A 23 -8.546 -9.558 5.159 1.00 0.00 N ATOM 305 CA CYS A 23 -7.558 -8.491 5.078 1.00 0.00 C ATOM 306 C CYS A 23 -8.174 -7.168 5.518 1.00 0.00 C ATOM 307 O CYS A 23 -9.232 -6.773 5.030 1.00 0.00 O ATOM 308 CB CYS A 23 -7.015 -8.374 3.655 1.00 0.00 C ATOM 309 SG CYS A 23 -5.625 -7.229 3.475 1.00 0.00 S ATOM 0 H CYS A 23 -9.119 -9.673 4.323 1.00 0.00 H new ATOM 0 HA CYS A 23 -6.731 -8.732 5.746 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -6.702 -9.362 3.317 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -7.822 -8.052 2.997 1.00 0.00 H new ATOM 314 N GLU A 24 -7.509 -6.489 6.446 1.00 0.00 N ATOM 315 CA GLU A 24 -7.998 -5.211 6.955 1.00 0.00 C ATOM 316 C GLU A 24 -7.768 -4.080 5.953 1.00 0.00 C ATOM 317 O GLU A 24 -8.093 -2.925 6.227 1.00 0.00 O ATOM 318 CB GLU A 24 -7.314 -4.872 8.280 1.00 0.00 C ATOM 319 CG GLU A 24 -5.805 -5.052 8.251 1.00 0.00 C ATOM 320 CD GLU A 24 -5.081 -4.050 9.128 1.00 0.00 C ATOM 321 OE1 GLU A 24 -5.493 -2.871 9.146 1.00 0.00 O ATOM 322 OE2 GLU A 24 -4.102 -4.443 9.796 1.00 0.00 O ATOM 0 H GLU A 24 -6.631 -6.801 6.861 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.072 -5.310 7.114 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -7.543 -3.839 8.543 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -7.731 -5.502 9.066 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -5.557 -6.062 8.578 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -5.451 -4.954 7.225 1.00 0.00 H new ATOM 329 N MET A 25 -7.203 -4.412 4.796 1.00 0.00 N ATOM 330 CA MET A 25 -6.929 -3.417 3.770 1.00 0.00 C ATOM 331 C MET A 25 -7.888 -3.549 2.590 1.00 0.00 C ATOM 332 O MET A 25 -8.616 -2.609 2.271 1.00 0.00 O ATOM 333 CB MET A 25 -5.485 -3.542 3.282 1.00 0.00 C ATOM 334 CG MET A 25 -4.464 -3.600 4.407 1.00 0.00 C ATOM 335 SD MET A 25 -4.635 -2.238 5.578 1.00 0.00 S ATOM 336 CE MET A 25 -2.946 -1.648 5.658 1.00 0.00 C ATOM 0 H MET A 25 -6.927 -5.362 4.548 1.00 0.00 H new ATOM 0 HA MET A 25 -7.076 -2.434 4.217 1.00 0.00 H new ATOM 0 HB2 MET A 25 -5.393 -4.441 2.673 1.00 0.00 H new ATOM 0 HB3 MET A 25 -5.254 -2.695 2.637 1.00 0.00 H new ATOM 0 HG2 MET A 25 -4.570 -4.546 4.939 1.00 0.00 H new ATOM 0 HG3 MET A 25 -3.460 -3.584 3.982 1.00 0.00 H new ATOM 0 HE1 MET A 25 -2.942 -0.558 5.670 1.00 0.00 H new ATOM 0 HE2 MET A 25 -2.472 -2.023 6.565 1.00 0.00 H new ATOM 0 HE3 MET A 25 -2.395 -2.004 4.787 1.00 0.00 H new ATOM 346 N CYS A 26 -7.892 -4.713 1.942 1.00 0.00 N ATOM 347 CA CYS A 26 -8.778 -4.931 0.803 1.00 0.00 C ATOM 348 C CYS A 26 -10.120 -5.481 1.261 1.00 0.00 C ATOM 349 O CYS A 26 -11.100 -5.443 0.521 1.00 0.00 O ATOM 350 CB CYS A 26 -8.126 -5.857 -0.231 1.00 0.00 C ATOM 351 SG CYS A 26 -7.684 -7.489 0.394 1.00 0.00 S ATOM 0 H CYS A 26 -7.300 -5.508 2.183 1.00 0.00 H new ATOM 0 HA CYS A 26 -8.955 -3.969 0.323 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -8.808 -5.977 -1.072 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -7.228 -5.374 -0.616 1.00 0.00 H new ATOM 356 N SER A 27 -10.160 -5.984 2.494 1.00 0.00 N ATOM 357 CA SER A 27 -11.380 -6.535 3.074 1.00 0.00 C ATOM 358 C SER A 27 -11.680 -7.928 2.525 1.00 0.00 C ATOM 359 O SER A 27 -12.770 -8.468 2.760 1.00 0.00 O ATOM 360 CB SER A 27 -12.560 -5.601 2.830 1.00 0.00 C ATOM 361 OG SER A 27 -13.630 -5.893 3.713 1.00 0.00 O ATOM 0 H SER A 27 -9.351 -6.020 3.115 1.00 0.00 H new ATOM 0 HA SER A 27 -11.223 -6.627 4.149 1.00 0.00 H new ATOM 0 HB2 SER A 27 -12.244 -4.567 2.966 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.898 -5.698 1.798 1.00 0.00 H new ATOM 0 HG SER A 27 -13.781 -6.861 3.735 1.00 0.00 H new ATOM 367 N LEU A 28 -10.730 -8.508 1.801 1.00 0.00 N ATOM 368 CA LEU A 28 -10.910 -9.837 1.232 1.00 0.00 C ATOM 369 C LEU A 28 -10.570 -10.900 2.264 1.00 0.00 C ATOM 370 O LEU A 28 -9.695 -10.710 3.105 1.00 0.00 O ATOM 371 CB LEU A 28 -10.030 -10.000 -0.009 1.00 0.00 C ATOM 372 CG LEU A 28 -10.460 -9.214 -1.250 1.00 0.00 C ATOM 373 CD1 LEU A 28 -10.980 -7.832 -0.874 1.00 0.00 C ATOM 374 CD2 LEU A 28 -9.316 -9.103 -2.238 1.00 0.00 C ATOM 0 H LEU A 28 -9.828 -8.079 1.595 1.00 0.00 H new ATOM 0 HA LEU A 28 -11.953 -9.957 0.940 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.014 -9.702 0.250 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.996 -11.058 -0.268 1.00 0.00 H new ATOM 0 HG LEU A 28 -11.274 -9.761 -1.726 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -11.278 -7.297 -1.776 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -11.840 -7.934 -0.212 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.195 -7.274 -0.364 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -9.644 -8.541 -3.112 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -8.478 -8.588 -1.768 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.002 -10.101 -2.545 1.00 0.00 H new ATOM 386 N PRO A 29 -11.260 -12.050 2.218 1.00 0.00 N ATOM 387 CA PRO A 29 -11.020 -13.150 3.158 1.00 0.00 C ATOM 388 C PRO A 29 -9.744 -13.910 2.857 1.00 0.00 C ATOM 389 O PRO A 29 -9.451 -14.230 1.705 1.00 0.00 O ATOM 390 CB PRO A 29 -12.240 -14.050 2.964 1.00 0.00 C ATOM 391 CG PRO A 29 -12.670 -13.810 1.556 1.00 0.00 C ATOM 392 CD PRO A 29 -12.320 -12.380 1.250 1.00 0.00 C ATOM 0 HA PRO A 29 -10.893 -12.790 4.179 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -11.989 -15.098 3.128 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -13.033 -13.799 3.668 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -12.162 -14.490 0.872 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -13.740 -13.982 1.441 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -11.971 -12.267 0.224 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -13.184 -11.725 1.367 1.00 0.00 H new ATOM 400 N ARG A 30 -8.977 -14.180 3.905 1.00 0.00 N ATOM 401 CA ARG A 30 -7.721 -14.890 3.755 1.00 0.00 C ATOM 402 C ARG A 30 -7.949 -16.280 3.165 1.00 0.00 C ATOM 403 O ARG A 30 -8.964 -16.920 3.436 1.00 0.00 O ATOM 404 CB ARG A 30 -7.004 -15.000 5.102 1.00 0.00 C ATOM 405 CG ARG A 30 -5.736 -15.840 5.063 1.00 0.00 C ATOM 406 CD ARG A 30 -5.247 -16.170 6.462 1.00 0.00 C ATOM 407 NE ARG A 30 -4.021 -16.970 6.438 1.00 0.00 N ATOM 408 CZ ARG A 30 -3.973 -18.250 6.068 1.00 0.00 C ATOM 409 NH1 ARG A 30 -5.078 -18.880 5.692 1.00 0.00 N ATOM 410 NH2 ARG A 30 -2.816 -18.890 6.075 1.00 0.00 N ATOM 0 H ARG A 30 -9.205 -13.918 4.864 1.00 0.00 H new ATOM 0 HA ARG A 30 -7.093 -14.323 3.068 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -6.753 -13.998 5.451 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -7.689 -15.430 5.833 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -5.926 -16.763 4.515 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -4.958 -15.302 4.521 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -5.066 -15.246 7.011 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -6.024 -16.713 6.999 1.00 0.00 H new ATOM 0 HE ARG A 30 -3.150 -16.521 6.722 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -5.970 -18.385 5.685 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -5.036 -19.859 5.410 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -1.966 -18.404 6.362 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -2.773 -19.869 5.793 1.00 0.00 H new ATOM 424 N THR A 31 -6.994 -16.740 2.357 1.00 0.00 N ATOM 425 CA THR A 31 -7.079 -18.050 1.721 1.00 0.00 C ATOM 426 C THR A 31 -8.470 -18.300 1.141 1.00 0.00 C ATOM 427 O THR A 31 -8.795 -19.480 0.870 1.00 0.00 O ATOM 428 CB THR A 31 -6.723 -19.150 2.723 1.00 0.00 C ATOM 429 OG1 THR A 31 -6.633 -20.410 2.075 1.00 0.00 O ATOM 430 CG2 THR A 31 -7.723 -19.290 3.851 1.00 0.00 C ATOM 431 OXT THR A 31 -9.222 -17.320 0.965 1.00 0.00 O ATOM 0 H THR A 31 -6.148 -16.219 2.128 1.00 0.00 H new ATOM 0 HA THR A 31 -6.363 -18.068 0.899 1.00 0.00 H new ATOM 0 HB THR A 31 -5.765 -18.849 3.146 1.00 0.00 H new ATOM 0 HG1 THR A 31 -7.403 -20.528 1.481 1.00 0.00 H new ATOM 0 HG21 THR A 31 -7.406 -20.088 4.522 1.00 0.00 H new ATOM 0 HG22 THR A 31 -7.781 -18.353 4.404 1.00 0.00 H new ATOM 0 HG23 THR A 31 -8.704 -19.530 3.440 1.00 0.00 H new TER 439 THR A 31 ATOM 440 N MET B 101 13.270 9.798 -7.693 1.00 0.00 N ATOM 441 CA MET B 101 12.957 8.464 -8.272 1.00 0.00 C ATOM 442 C MET B 101 11.475 8.338 -8.604 1.00 0.00 C ATOM 443 O MET B 101 10.697 9.266 -8.386 1.00 0.00 O ATOM 444 CB MET B 101 13.364 7.375 -7.274 1.00 0.00 C ATOM 445 CG MET B 101 13.309 7.814 -5.819 1.00 0.00 C ATOM 446 SD MET B 101 13.575 6.449 -4.673 1.00 0.00 S ATOM 447 CE MET B 101 11.886 5.935 -4.381 1.00 0.00 C ATOM 0 HA MET B 101 13.517 8.347 -9.200 1.00 0.00 H new ATOM 0 HB2 MET B 101 12.711 6.513 -7.407 1.00 0.00 H new ATOM 0 HB3 MET B 101 14.377 7.046 -7.505 1.00 0.00 H new ATOM 0 HG2 MET B 101 14.064 8.581 -5.646 1.00 0.00 H new ATOM 0 HG3 MET B 101 12.339 8.269 -5.617 1.00 0.00 H new ATOM 0 HE1 MET B 101 11.880 5.040 -3.760 1.00 0.00 H new ATOM 0 HE2 MET B 101 11.346 6.733 -3.872 1.00 0.00 H new ATOM 0 HE3 MET B 101 11.402 5.719 -5.333 1.00 0.00 H new ATOM 459 N GLN B 102 11.094 7.180 -9.132 1.00 0.00 N ATOM 460 CA GLN B 102 9.705 6.924 -9.495 1.00 0.00 C ATOM 461 C GLN B 102 9.207 5.631 -8.859 1.00 0.00 C ATOM 462 O GLN B 102 9.931 4.640 -8.797 1.00 0.00 O ATOM 463 CB GLN B 102 9.555 6.846 -11.010 1.00 0.00 C ATOM 464 CG GLN B 102 10.375 7.885 -11.760 1.00 0.00 C ATOM 465 CD GLN B 102 10.001 7.974 -13.230 1.00 0.00 C ATOM 466 OE1 GLN B 102 10.611 7.323 -14.080 1.00 0.00 O ATOM 467 NE2 GLN B 102 8.995 8.785 -13.530 1.00 0.00 N ATOM 0 H GLN B 102 11.728 6.403 -9.318 1.00 0.00 H new ATOM 0 HA GLN B 102 9.102 7.751 -9.120 1.00 0.00 H new ATOM 0 HB2 GLN B 102 9.851 5.852 -11.345 1.00 0.00 H new ATOM 0 HB3 GLN B 102 8.503 6.970 -11.269 1.00 0.00 H new ATOM 0 HG2 GLN B 102 10.234 8.860 -11.293 1.00 0.00 H new ATOM 0 HG3 GLN B 102 11.433 7.640 -11.672 1.00 0.00 H new ATOM 0 HE21 GLN B 102 8.520 9.304 -12.791 1.00 0.00 H new ATOM 0 HE22 GLN B 102 8.696 8.890 -14.500 1.00 0.00 H new ATOM 476 N ILE B 103 7.967 5.649 -8.391 1.00 0.00 N ATOM 477 CA ILE B 103 7.369 4.479 -7.761 1.00 0.00 C ATOM 478 C ILE B 103 6.080 4.076 -8.468 1.00 0.00 C ATOM 479 O ILE B 103 5.278 4.929 -8.850 1.00 0.00 O ATOM 480 CB ILE B 103 7.071 4.733 -6.270 1.00 0.00 C ATOM 481 CG1 ILE B 103 6.005 5.821 -6.112 1.00 0.00 C ATOM 482 CG2 ILE B 103 8.343 5.125 -5.535 1.00 0.00 C ATOM 483 CD1 ILE B 103 5.559 6.027 -4.682 1.00 0.00 C ATOM 0 H ILE B 103 7.354 6.463 -8.436 1.00 0.00 H new ATOM 0 HA ILE B 103 8.093 3.669 -7.843 1.00 0.00 H new ATOM 0 HB ILE B 103 6.688 3.811 -5.833 1.00 0.00 H new ATOM 0 HG12 ILE B 103 6.397 6.761 -6.501 1.00 0.00 H new ATOM 0 HG13 ILE B 103 5.139 5.561 -6.720 1.00 0.00 H new ATOM 0 HG21 ILE B 103 8.116 5.301 -4.484 1.00 0.00 H new ATOM 0 HG22 ILE B 103 9.074 4.321 -5.619 1.00 0.00 H new ATOM 0 HG23 ILE B 103 8.752 6.035 -5.975 1.00 0.00 H new ATOM 0 HD11 ILE B 103 4.804 6.812 -4.646 1.00 0.00 H new ATOM 0 HD12 ILE B 103 5.137 5.099 -4.295 1.00 0.00 H new ATOM 0 HD13 ILE B 103 6.414 6.318 -4.072 1.00 0.00 H new ATOM 495 N PHE B 104 5.884 2.774 -8.638 1.00 0.00 N ATOM 496 CA PHE B 104 4.688 2.265 -9.298 1.00 0.00 C ATOM 497 C PHE B 104 3.601 1.944 -8.279 1.00 0.00 C ATOM 498 O PHE B 104 3.888 1.472 -7.179 1.00 0.00 O ATOM 499 CB PHE B 104 5.019 1.017 -10.110 1.00 0.00 C ATOM 500 CG PHE B 104 5.939 1.282 -11.270 1.00 0.00 C ATOM 501 CD1 PHE B 104 7.221 1.764 -11.060 1.00 0.00 C ATOM 502 CD2 PHE B 104 5.521 1.050 -12.570 1.00 0.00 C ATOM 503 CE1 PHE B 104 8.069 2.010 -12.120 1.00 0.00 C ATOM 504 CE2 PHE B 104 6.364 1.293 -13.640 1.00 0.00 C ATOM 505 CZ PHE B 104 7.640 1.774 -13.410 1.00 0.00 C ATOM 0 H PHE B 104 6.536 2.053 -8.329 1.00 0.00 H new ATOM 0 HA PHE B 104 4.318 3.040 -9.969 1.00 0.00 H new ATOM 0 HB2 PHE B 104 5.478 0.278 -9.454 1.00 0.00 H new ATOM 0 HB3 PHE B 104 4.093 0.580 -10.484 1.00 0.00 H new ATOM 0 HD1 PHE B 104 7.561 1.950 -10.052 1.00 0.00 H new ATOM 0 HD2 PHE B 104 4.525 0.675 -12.751 1.00 0.00 H new ATOM 0 HE1 PHE B 104 9.065 2.386 -11.941 1.00 0.00 H new ATOM 0 HE2 PHE B 104 6.027 1.108 -14.649 1.00 0.00 H new ATOM 0 HZ PHE B 104 8.302 1.965 -14.242 1.00 0.00 H new ATOM 515 N VAL B 105 2.354 2.203 -8.653 1.00 0.00 N ATOM 516 CA VAL B 105 1.222 1.943 -7.772 1.00 0.00 C ATOM 517 C VAL B 105 0.222 0.998 -8.428 1.00 0.00 C ATOM 518 O VAL B 105 -0.564 1.406 -9.283 1.00 0.00 O ATOM 519 CB VAL B 105 0.500 3.247 -7.383 1.00 0.00 C ATOM 520 CG1 VAL B 105 -0.556 2.979 -6.322 1.00 0.00 C ATOM 521 CG2 VAL B 105 1.499 4.287 -6.900 1.00 0.00 C ATOM 0 H VAL B 105 2.101 2.593 -9.561 1.00 0.00 H new ATOM 0 HA VAL B 105 1.623 1.477 -6.872 1.00 0.00 H new ATOM 0 HB VAL B 105 -0.000 3.640 -8.268 1.00 0.00 H new ATOM 0 HG11 VAL B 105 -1.055 3.912 -6.061 1.00 0.00 H new ATOM 0 HG12 VAL B 105 -1.290 2.272 -6.709 1.00 0.00 H new ATOM 0 HG13 VAL B 105 -0.082 2.560 -5.434 1.00 0.00 H new ATOM 0 HG21 VAL B 105 0.971 5.201 -6.630 1.00 0.00 H new ATOM 0 HG22 VAL B 105 2.030 3.904 -6.029 1.00 0.00 H new ATOM 0 HG23 VAL B 105 2.213 4.502 -7.695 1.00 0.00 H new ATOM 531 N LYS B 106 0.258 -0.268 -8.024 1.00 0.00 N ATOM 532 CA LYS B 106 -0.645 -1.272 -8.576 1.00 0.00 C ATOM 533 C LYS B 106 -1.933 -1.360 -7.763 1.00 0.00 C ATOM 534 O LYS B 106 -1.912 -1.696 -6.579 1.00 0.00 O ATOM 535 CB LYS B 106 0.042 -2.638 -8.612 1.00 0.00 C ATOM 536 CG LYS B 106 -0.411 -3.517 -9.766 1.00 0.00 C ATOM 537 CD LYS B 106 0.478 -4.740 -9.918 1.00 0.00 C ATOM 538 CE LYS B 106 -0.075 -5.707 -10.950 1.00 0.00 C ATOM 539 NZ LYS B 106 0.956 -6.677 -11.410 1.00 0.00 N ATOM 0 H LYS B 106 0.902 -0.623 -7.317 1.00 0.00 H new ATOM 0 HA LYS B 106 -0.901 -0.972 -9.592 1.00 0.00 H new ATOM 0 HB2 LYS B 106 1.120 -2.491 -8.679 1.00 0.00 H new ATOM 0 HB3 LYS B 106 -0.151 -3.157 -7.673 1.00 0.00 H new ATOM 0 HG2 LYS B 106 -1.441 -3.833 -9.601 1.00 0.00 H new ATOM 0 HG3 LYS B 106 -0.399 -2.940 -10.691 1.00 0.00 H new ATOM 0 HD2 LYS B 106 1.480 -4.428 -10.211 1.00 0.00 H new ATOM 0 HD3 LYS B 106 0.570 -5.246 -8.957 1.00 0.00 H new ATOM 0 HE2 LYS B 106 -0.919 -6.249 -10.524 1.00 0.00 H new ATOM 0 HE3 LYS B 106 -0.454 -5.148 -11.805 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 0.539 -7.319 -12.114 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 1.750 -6.161 -11.840 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 1.300 -7.229 -10.598 1.00 0.00 H new ATOM 553 N THR B 107 -3.054 -1.061 -8.410 1.00 0.00 N ATOM 554 CA THR B 107 -4.355 -1.111 -7.753 1.00 0.00 C ATOM 555 C THR B 107 -4.996 -2.483 -7.931 1.00 0.00 C ATOM 556 O THR B 107 -4.774 -3.154 -8.939 1.00 0.00 O ATOM 557 CB THR B 107 -5.275 -0.027 -8.317 1.00 0.00 C ATOM 558 OG1 THR B 107 -5.030 0.169 -9.698 1.00 0.00 O ATOM 559 CG2 THR B 107 -5.117 1.312 -7.628 1.00 0.00 C ATOM 0 H THR B 107 -3.088 -0.781 -9.390 1.00 0.00 H new ATOM 0 HA THR B 107 -4.207 -0.933 -6.688 1.00 0.00 H new ATOM 0 HB THR B 107 -6.288 -0.389 -8.142 1.00 0.00 H new ATOM 0 HG1 THR B 107 -5.852 -0.002 -10.204 1.00 0.00 H new ATOM 0 HG21 THR B 107 -5.798 2.035 -8.077 1.00 0.00 H new ATOM 0 HG22 THR B 107 -5.348 1.205 -6.568 1.00 0.00 H new ATOM 0 HG23 THR B 107 -4.091 1.661 -7.742 1.00 0.00 H new ATOM 567 N LEU B 108 -5.793 -2.894 -6.950 1.00 0.00 N ATOM 568 CA LEU B 108 -6.465 -4.188 -7.009 1.00 0.00 C ATOM 569 C LEU B 108 -7.456 -4.242 -8.170 1.00 0.00 C ATOM 570 O LEU B 108 -7.924 -5.317 -8.546 1.00 0.00 O ATOM 571 CB LEU B 108 -7.193 -4.477 -5.692 1.00 0.00 C ATOM 572 CG LEU B 108 -6.345 -4.341 -4.421 1.00 0.00 C ATOM 573 CD1 LEU B 108 -6.965 -5.139 -3.283 1.00 0.00 C ATOM 574 CD2 LEU B 108 -4.912 -4.797 -4.668 1.00 0.00 C ATOM 0 H LEU B 108 -5.989 -2.353 -6.108 1.00 0.00 H new ATOM 0 HA LEU B 108 -5.702 -4.950 -7.170 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -8.045 -3.801 -5.613 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -7.593 -5.490 -5.734 1.00 0.00 H new ATOM 0 HG LEU B 108 -6.322 -3.288 -4.141 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -6.352 -5.033 -2.388 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -7.969 -4.766 -3.082 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -7.019 -6.191 -3.563 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -4.333 -4.690 -3.751 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -4.911 -5.842 -4.978 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -4.466 -4.186 -5.452 1.00 0.00 H new ATOM 586 N THR B 109 -7.774 -3.080 -8.737 1.00 0.00 N ATOM 587 CA THR B 109 -8.710 -3.008 -9.853 1.00 0.00 C ATOM 588 C THR B 109 -8.034 -3.403 -11.160 1.00 0.00 C ATOM 589 O THR B 109 -8.706 -3.726 -12.140 1.00 0.00 O ATOM 590 CB THR B 109 -9.289 -1.597 -9.970 1.00 0.00 C ATOM 591 OG1 THR B 109 -8.287 -0.674 -10.350 1.00 0.00 O ATOM 592 CG2 THR B 109 -9.904 -1.094 -8.682 1.00 0.00 C ATOM 0 H THR B 109 -7.398 -2.179 -8.442 1.00 0.00 H new ATOM 0 HA THR B 109 -9.520 -3.711 -9.659 1.00 0.00 H new ATOM 0 HB THR B 109 -10.070 -1.669 -10.727 1.00 0.00 H new ATOM 0 HG1 THR B 109 -8.678 0.222 -10.421 1.00 0.00 H new ATOM 0 HG21 THR B 109 -10.296 -0.088 -8.834 1.00 0.00 H new ATOM 0 HG22 THR B 109 -10.715 -1.758 -8.383 1.00 0.00 H new ATOM 0 HG23 THR B 109 -9.145 -1.073 -7.900 1.00 0.00 H new ATOM 600 N GLY B 110 -6.704 -3.378 -11.180 1.00 0.00 N ATOM 601 CA GLY B 110 -5.970 -3.738 -12.370 1.00 0.00 C ATOM 602 C GLY B 110 -5.340 -2.538 -13.050 1.00 0.00 C ATOM 603 O GLY B 110 -5.171 -2.525 -14.270 1.00 0.00 O ATOM 0 H GLY B 110 -6.123 -3.112 -10.385 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -5.191 -4.454 -12.109 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -6.641 -4.237 -13.069 1.00 0.00 H new ATOM 607 N LYS B 111 -4.992 -1.528 -12.260 1.00 0.00 N ATOM 608 CA LYS B 111 -4.378 -0.319 -12.800 1.00 0.00 C ATOM 609 C LYS B 111 -3.044 -0.042 -12.120 1.00 0.00 C ATOM 610 O LYS B 111 -2.880 -0.276 -10.920 1.00 0.00 O ATOM 611 CB LYS B 111 -5.315 0.878 -12.620 1.00 0.00 C ATOM 612 CG LYS B 111 -5.265 1.866 -13.770 1.00 0.00 C ATOM 613 CD LYS B 111 -6.222 1.472 -14.880 1.00 0.00 C ATOM 614 CE LYS B 111 -7.543 2.217 -14.770 1.00 0.00 C ATOM 615 NZ LYS B 111 -8.481 1.852 -15.870 1.00 0.00 N ATOM 0 H LYS B 111 -5.123 -1.521 -11.249 1.00 0.00 H new ATOM 0 HA LYS B 111 -4.199 -0.473 -13.864 1.00 0.00 H new ATOM 0 HB2 LYS B 111 -6.337 0.515 -12.508 1.00 0.00 H new ATOM 0 HB3 LYS B 111 -5.057 1.395 -11.696 1.00 0.00 H new ATOM 0 HG2 LYS B 111 -5.517 2.862 -13.407 1.00 0.00 H new ATOM 0 HG3 LYS B 111 -4.250 1.917 -14.164 1.00 0.00 H new ATOM 0 HD2 LYS B 111 -5.765 1.682 -15.847 1.00 0.00 H new ATOM 0 HD3 LYS B 111 -6.405 0.398 -14.840 1.00 0.00 H new ATOM 0 HE2 LYS B 111 -8.006 1.994 -13.809 1.00 0.00 H new ATOM 0 HE3 LYS B 111 -7.357 3.291 -14.793 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 -9.369 2.381 -15.759 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 -8.050 2.088 -16.787 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 -8.679 0.832 -15.833 1.00 0.00 H new ATOM 629 N THR B 112 -2.095 0.457 -12.890 1.00 0.00 N ATOM 630 CA THR B 112 -0.767 0.769 -12.390 1.00 0.00 C ATOM 631 C THR B 112 -0.442 2.244 -12.610 1.00 0.00 C ATOM 632 O THR B 112 -0.455 2.725 -13.750 1.00 0.00 O ATOM 633 CB THR B 112 0.269 -0.124 -13.080 1.00 0.00 C ATOM 634 OG1 THR B 112 0.231 -1.435 -12.540 1.00 0.00 O ATOM 635 CG2 THR B 112 1.694 0.378 -12.950 1.00 0.00 C ATOM 0 H THR B 112 -2.223 0.658 -13.882 1.00 0.00 H new ATOM 0 HA THR B 112 -0.739 0.576 -11.318 1.00 0.00 H new ATOM 0 HB THR B 112 -0.003 -0.112 -14.135 1.00 0.00 H new ATOM 0 HG1 THR B 112 0.897 -1.994 -12.992 1.00 0.00 H new ATOM 0 HG21 THR B 112 2.369 -0.306 -13.464 1.00 0.00 H new ATOM 0 HG22 THR B 112 1.773 1.369 -13.397 1.00 0.00 H new ATOM 0 HG23 THR B 112 1.966 0.433 -11.896 1.00 0.00 H new ATOM 643 N ILE B 113 -0.157 2.958 -11.530 1.00 0.00 N ATOM 644 CA ILE B 113 0.164 4.379 -11.620 1.00 0.00 C ATOM 645 C ILE B 113 1.624 4.641 -11.270 1.00 0.00 C ATOM 646 O ILE B 113 2.112 4.218 -10.220 1.00 0.00 O ATOM 647 CB ILE B 113 -0.723 5.233 -10.680 1.00 0.00 C ATOM 648 CG1 ILE B 113 -2.048 4.525 -10.390 1.00 0.00 C ATOM 649 CG2 ILE B 113 -0.977 6.599 -11.300 1.00 0.00 C ATOM 650 CD1 ILE B 113 -2.975 5.324 -9.499 1.00 0.00 C ATOM 0 H ILE B 113 -0.141 2.580 -10.583 1.00 0.00 H new ATOM 0 HA ILE B 113 -0.026 4.667 -12.654 1.00 0.00 H new ATOM 0 HB ILE B 113 -0.196 5.366 -9.735 1.00 0.00 H new ATOM 0 HG12 ILE B 113 -2.553 4.316 -11.333 1.00 0.00 H new ATOM 0 HG13 ILE B 113 -1.842 3.564 -9.919 1.00 0.00 H new ATOM 0 HG21 ILE B 113 -1.601 7.192 -10.631 1.00 0.00 H new ATOM 0 HG22 ILE B 113 -0.027 7.110 -11.457 1.00 0.00 H new ATOM 0 HG23 ILE B 113 -1.485 6.476 -12.257 1.00 0.00 H new ATOM 0 HD11 ILE B 113 -3.895 4.763 -9.335 1.00 0.00 H new ATOM 0 HD12 ILE B 113 -2.488 5.511 -8.542 1.00 0.00 H new ATOM 0 HD13 ILE B 113 -3.210 6.274 -9.978 1.00 0.00 H new ATOM 662 N THR B 114 2.311 5.358 -12.150 1.00 0.00 N ATOM 663 CA THR B 114 3.710 5.699 -11.940 1.00 0.00 C ATOM 664 C THR B 114 3.832 7.150 -11.490 1.00 0.00 C ATOM 665 O THR B 114 3.301 8.054 -12.130 1.00 0.00 O ATOM 666 CB THR B 114 4.519 5.473 -13.210 1.00 0.00 C ATOM 667 OG1 THR B 114 4.055 4.328 -13.910 1.00 0.00 O ATOM 668 CG2 THR B 114 5.999 5.287 -12.960 1.00 0.00 C ATOM 0 H THR B 114 1.918 5.716 -13.021 1.00 0.00 H new ATOM 0 HA THR B 114 4.109 5.050 -11.161 1.00 0.00 H new ATOM 0 HB THR B 114 4.379 6.380 -13.798 1.00 0.00 H new ATOM 0 HG1 THR B 114 4.588 4.203 -14.723 1.00 0.00 H new ATOM 0 HG21 THR B 114 6.512 5.131 -13.909 1.00 0.00 H new ATOM 0 HG22 THR B 114 6.400 6.176 -12.473 1.00 0.00 H new ATOM 0 HG23 THR B 114 6.153 4.420 -12.318 1.00 0.00 H new ATOM 676 N LEU B 115 4.521 7.366 -10.380 1.00 0.00 N ATOM 677 CA LEU B 115 4.695 8.707 -9.844 1.00 0.00 C ATOM 678 C LEU B 115 6.166 9.004 -9.580 1.00 0.00 C ATOM 679 O LEU B 115 7.023 8.135 -9.733 1.00 0.00 O ATOM 680 CB LEU B 115 3.886 8.859 -8.555 1.00 0.00 C ATOM 681 CG LEU B 115 2.370 8.747 -8.734 1.00 0.00 C ATOM 682 CD1 LEU B 115 1.735 8.065 -7.532 1.00 0.00 C ATOM 683 CD2 LEU B 115 1.758 10.123 -8.953 1.00 0.00 C ATOM 0 H LEU B 115 4.968 6.630 -9.833 1.00 0.00 H new ATOM 0 HA LEU B 115 4.334 9.423 -10.582 1.00 0.00 H new ATOM 0 HB2 LEU B 115 4.212 8.098 -7.846 1.00 0.00 H new ATOM 0 HB3 LEU B 115 4.115 9.828 -8.110 1.00 0.00 H new ATOM 0 HG LEU B 115 2.173 8.136 -9.615 1.00 0.00 H new ATOM 0 HD11 LEU B 115 0.657 7.996 -7.680 1.00 0.00 H new ATOM 0 HD12 LEU B 115 2.151 7.064 -7.420 1.00 0.00 H new ATOM 0 HD13 LEU B 115 1.941 8.646 -6.633 1.00 0.00 H new ATOM 0 HD21 LEU B 115 0.680 10.026 -9.079 1.00 0.00 H new ATOM 0 HD22 LEU B 115 1.967 10.756 -8.091 1.00 0.00 H new ATOM 0 HD23 LEU B 115 2.188 10.574 -9.847 1.00 0.00 H new ATOM 695 N GLU B 116 6.446 10.239 -9.184 1.00 0.00 N ATOM 696 CA GLU B 116 7.810 10.661 -8.897 1.00 0.00 C ATOM 697 C GLU B 116 7.958 11.042 -7.430 1.00 0.00 C ATOM 698 O GLU B 116 7.338 11.994 -6.955 1.00 0.00 O ATOM 699 CB GLU B 116 8.202 11.841 -9.785 1.00 0.00 C ATOM 700 CG GLU B 116 9.696 12.124 -9.796 1.00 0.00 C ATOM 701 CD GLU B 116 10.142 12.853 -11.040 1.00 0.00 C ATOM 702 OE1 GLU B 116 9.807 14.048 -11.190 1.00 0.00 O ATOM 703 OE2 GLU B 116 10.826 12.230 -11.880 1.00 0.00 O ATOM 0 H GLU B 116 5.744 10.968 -9.054 1.00 0.00 H new ATOM 0 HA GLU B 116 8.476 9.824 -9.108 1.00 0.00 H new ATOM 0 HB2 GLU B 116 7.870 11.644 -10.804 1.00 0.00 H new ATOM 0 HB3 GLU B 116 7.674 12.732 -9.445 1.00 0.00 H new ATOM 0 HG2 GLU B 116 9.956 12.718 -8.919 1.00 0.00 H new ATOM 0 HG3 GLU B 116 10.240 11.183 -9.716 1.00 0.00 H new ATOM 710 N VAL B 117 8.785 10.289 -6.721 1.00 0.00 N ATOM 711 CA VAL B 117 9.030 10.528 -5.311 1.00 0.00 C ATOM 712 C VAL B 117 10.509 10.365 -5.002 1.00 0.00 C ATOM 713 O VAL B 117 11.310 10.114 -5.901 1.00 0.00 O ATOM 714 CB VAL B 117 8.222 9.560 -4.429 1.00 0.00 C ATOM 715 CG1 VAL B 117 6.735 9.867 -4.519 1.00 0.00 C ATOM 716 CG2 VAL B 117 8.503 8.119 -4.825 1.00 0.00 C ATOM 0 H VAL B 117 9.302 9.499 -7.107 1.00 0.00 H new ATOM 0 HA VAL B 117 8.714 11.548 -5.090 1.00 0.00 H new ATOM 0 HB VAL B 117 8.533 9.695 -3.393 1.00 0.00 H new ATOM 0 HG11 VAL B 117 6.181 9.172 -3.888 1.00 0.00 H new ATOM 0 HG12 VAL B 117 6.553 10.887 -4.181 1.00 0.00 H new ATOM 0 HG13 VAL B 117 6.404 9.762 -5.552 1.00 0.00 H new ATOM 0 HG21 VAL B 117 7.923 7.448 -4.191 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.222 7.967 -5.867 1.00 0.00 H new ATOM 0 HG23 VAL B 117 9.565 7.908 -4.701 1.00 0.00 H new ATOM 726 N GLU B 118 10.873 10.507 -3.736 1.00 0.00 N ATOM 727 CA GLU B 118 12.261 10.368 -3.334 1.00 0.00 C ATOM 728 C GLU B 118 12.388 9.421 -2.145 1.00 0.00 C ATOM 729 O GLU B 118 11.419 9.185 -1.423 1.00 0.00 O ATOM 730 CB GLU B 118 12.848 11.732 -2.975 1.00 0.00 C ATOM 731 CG GLU B 118 13.850 12.253 -3.994 1.00 0.00 C ATOM 732 CD GLU B 118 13.695 13.738 -4.257 1.00 0.00 C ATOM 733 OE1 GLU B 118 12.557 14.178 -4.525 1.00 0.00 O ATOM 734 OE2 GLU B 118 14.712 14.461 -4.194 1.00 0.00 O ATOM 0 H GLU B 118 10.228 10.717 -2.974 1.00 0.00 H new ATOM 0 HA GLU B 118 12.817 9.950 -4.173 1.00 0.00 H new ATOM 0 HB2 GLU B 118 12.036 12.452 -2.876 1.00 0.00 H new ATOM 0 HB3 GLU B 118 13.335 11.664 -2.002 1.00 0.00 H new ATOM 0 HG2 GLU B 118 14.861 12.054 -3.638 1.00 0.00 H new ATOM 0 HG3 GLU B 118 13.728 11.707 -4.930 1.00 0.00 H new ATOM 741 N PRO B 119 13.591 8.871 -1.917 1.00 0.00 N ATOM 742 CA PRO B 119 13.840 7.956 -0.801 1.00 0.00 C ATOM 743 C PRO B 119 13.914 8.684 0.538 1.00 0.00 C ATOM 744 O PRO B 119 14.034 8.056 1.590 1.00 0.00 O ATOM 745 CB PRO B 119 15.192 7.341 -1.152 1.00 0.00 C ATOM 746 CG PRO B 119 15.884 8.391 -1.951 1.00 0.00 C ATOM 747 CD PRO B 119 14.807 9.106 -2.722 1.00 0.00 C ATOM 0 HA PRO B 119 13.040 7.225 -0.681 1.00 0.00 H new ATOM 0 HB2 PRO B 119 15.757 7.088 -0.255 1.00 0.00 H new ATOM 0 HB3 PRO B 119 15.073 6.421 -1.724 1.00 0.00 H new ATOM 0 HG2 PRO B 119 16.423 9.082 -1.303 1.00 0.00 H new ATOM 0 HG3 PRO B 119 16.617 7.948 -2.625 1.00 0.00 H new ATOM 0 HD2 PRO B 119 15.023 10.170 -2.821 1.00 0.00 H new ATOM 0 HD3 PRO B 119 14.704 8.707 -3.731 1.00 0.00 H new ATOM 755 N SER B 120 13.841 10.011 0.494 1.00 0.00 N ATOM 756 CA SER B 120 13.900 10.821 1.705 1.00 0.00 C ATOM 757 C SER B 120 12.535 11.426 2.030 1.00 0.00 C ATOM 758 O SER B 120 12.312 11.912 3.138 1.00 0.00 O ATOM 759 CB SER B 120 14.940 11.932 1.550 1.00 0.00 C ATOM 760 OG SER B 120 15.770 12.017 2.695 1.00 0.00 O ATOM 0 H SER B 120 13.741 10.548 -0.368 1.00 0.00 H new ATOM 0 HA SER B 120 14.191 10.171 2.530 1.00 0.00 H new ATOM 0 HB2 SER B 120 15.551 11.742 0.668 1.00 0.00 H new ATOM 0 HB3 SER B 120 14.437 12.886 1.390 1.00 0.00 H new ATOM 0 HG SER B 120 16.427 12.733 2.570 1.00 0.00 H new ATOM 766 N ASP B 121 11.626 11.396 1.058 1.00 0.00 N ATOM 767 CA ASP B 121 10.290 11.943 1.249 1.00 0.00 C ATOM 768 C ASP B 121 9.533 11.167 2.322 1.00 0.00 C ATOM 769 O ASP B 121 10.118 10.369 3.053 1.00 0.00 O ATOM 770 CB ASP B 121 9.511 11.913 -0.068 1.00 0.00 C ATOM 771 CG ASP B 121 8.673 13.159 -0.273 1.00 0.00 C ATOM 772 OD1 ASP B 121 8.141 13.688 0.726 1.00 0.00 O ATOM 773 OD2 ASP B 121 8.547 13.606 -1.433 1.00 0.00 O ATOM 0 H ASP B 121 11.792 10.999 0.133 1.00 0.00 H new ATOM 0 HA ASP B 121 10.391 12.977 1.579 1.00 0.00 H new ATOM 0 HB2 ASP B 121 10.210 11.808 -0.898 1.00 0.00 H new ATOM 0 HB3 ASP B 121 8.863 11.036 -0.084 1.00 0.00 H new ATOM 778 N THR B 122 8.228 11.404 2.407 1.00 0.00 N ATOM 779 CA THR B 122 7.389 10.727 3.385 1.00 0.00 C ATOM 780 C THR B 122 6.185 10.090 2.705 1.00 0.00 C ATOM 781 O THR B 122 5.739 10.546 1.652 1.00 0.00 O ATOM 782 CB THR B 122 6.924 11.712 4.459 1.00 0.00 C ATOM 783 OG1 THR B 122 6.004 12.644 3.920 1.00 0.00 O ATOM 784 CG2 THR B 122 8.058 12.494 5.085 1.00 0.00 C ATOM 0 H THR B 122 7.729 12.062 1.808 1.00 0.00 H new ATOM 0 HA THR B 122 7.978 9.942 3.858 1.00 0.00 H new ATOM 0 HB THR B 122 6.458 11.099 5.231 1.00 0.00 H new ATOM 0 HG1 THR B 122 5.717 13.264 4.623 1.00 0.00 H new ATOM 0 HG21 THR B 122 7.659 13.174 5.838 1.00 0.00 H new ATOM 0 HG22 THR B 122 8.760 11.805 5.554 1.00 0.00 H new ATOM 0 HG23 THR B 122 8.573 13.068 4.315 1.00 0.00 H new ATOM 792 N ILE B 123 5.661 9.033 3.313 1.00 0.00 N ATOM 793 CA ILE B 123 4.506 8.331 2.764 1.00 0.00 C ATOM 794 C ILE B 123 3.340 9.288 2.532 1.00 0.00 C ATOM 795 O ILE B 123 2.519 9.078 1.639 1.00 0.00 O ATOM 796 CB ILE B 123 4.041 7.190 3.690 1.00 0.00 C ATOM 797 CG1 ILE B 123 5.226 6.312 4.100 1.00 0.00 C ATOM 798 CG2 ILE B 123 2.970 6.355 3.003 1.00 0.00 C ATOM 799 CD1 ILE B 123 6.002 5.754 2.926 1.00 0.00 C ATOM 0 H ILE B 123 6.017 8.643 4.186 1.00 0.00 H new ATOM 0 HA ILE B 123 4.822 7.906 1.811 1.00 0.00 H new ATOM 0 HB ILE B 123 3.613 7.629 4.591 1.00 0.00 H new ATOM 0 HG12 ILE B 123 5.901 6.896 4.726 1.00 0.00 H new ATOM 0 HG13 ILE B 123 4.861 5.485 4.709 1.00 0.00 H new ATOM 0 HG21 ILE B 123 2.651 5.553 3.669 1.00 0.00 H new ATOM 0 HG22 ILE B 123 2.116 6.987 2.761 1.00 0.00 H new ATOM 0 HG23 ILE B 123 3.375 5.926 2.086 1.00 0.00 H new ATOM 0 HD11 ILE B 123 6.826 5.142 3.292 1.00 0.00 H new ATOM 0 HD12 ILE B 123 5.342 5.142 2.311 1.00 0.00 H new ATOM 0 HD13 ILE B 123 6.397 6.575 2.328 1.00 0.00 H new ATOM 811 N GLU B 124 3.275 10.342 3.341 1.00 0.00 N ATOM 812 CA GLU B 124 2.212 11.333 3.222 1.00 0.00 C ATOM 813 C GLU B 124 2.278 12.040 1.872 1.00 0.00 C ATOM 814 O GLU B 124 1.257 12.463 1.331 1.00 0.00 O ATOM 815 CB GLU B 124 2.313 12.358 4.353 1.00 0.00 C ATOM 816 CG GLU B 124 0.979 12.985 4.726 1.00 0.00 C ATOM 817 CD GLU B 124 1.092 14.470 5.008 1.00 0.00 C ATOM 818 OE1 GLU B 124 2.118 14.890 5.583 1.00 0.00 O ATOM 819 OE2 GLU B 124 0.153 15.214 4.652 1.00 0.00 O ATOM 0 H GLU B 124 3.946 10.531 4.086 1.00 0.00 H new ATOM 0 HA GLU B 124 1.256 10.815 3.295 1.00 0.00 H new ATOM 0 HB2 GLU B 124 2.737 11.875 5.233 1.00 0.00 H new ATOM 0 HB3 GLU B 124 3.006 13.146 4.057 1.00 0.00 H new ATOM 0 HG2 GLU B 124 0.268 12.826 3.916 1.00 0.00 H new ATOM 0 HG3 GLU B 124 0.578 12.481 5.606 1.00 0.00 H new ATOM 826 N ASN B 125 3.487 12.161 1.333 1.00 0.00 N ATOM 827 CA ASN B 125 3.686 12.813 0.045 1.00 0.00 C ATOM 828 C ASN B 125 3.301 11.879 -1.096 1.00 0.00 C ATOM 829 O ASN B 125 2.749 12.311 -2.107 1.00 0.00 O ATOM 830 CB ASN B 125 5.143 13.254 -0.109 1.00 0.00 C ATOM 831 CG ASN B 125 5.273 14.579 -0.834 1.00 0.00 C ATOM 832 OD1 ASN B 125 5.071 14.659 -2.046 1.00 0.00 O ATOM 833 ND2 ASN B 125 5.613 15.628 -0.094 1.00 0.00 N ATOM 0 H ASN B 125 4.343 11.816 1.768 1.00 0.00 H new ATOM 0 HA ASN B 125 3.044 13.693 0.006 1.00 0.00 H new ATOM 0 HB2 ASN B 125 5.601 13.336 0.877 1.00 0.00 H new ATOM 0 HB3 ASN B 125 5.695 12.489 -0.654 1.00 0.00 H new ATOM 0 HD21 ASN B 125 5.716 16.546 -0.527 1.00 0.00 H new ATOM 0 HD22 ASN B 125 5.771 15.516 0.907 1.00 0.00 H new ATOM 840 N VAL B 126 3.592 10.594 -0.921 1.00 0.00 N ATOM 841 CA VAL B 126 3.272 9.595 -1.932 1.00 0.00 C ATOM 842 C VAL B 126 1.763 9.440 -2.080 1.00 0.00 C ATOM 843 O VAL B 126 1.248 9.308 -3.190 1.00 0.00 O ATOM 844 CB VAL B 126 3.889 8.227 -1.585 1.00 0.00 C ATOM 845 CG1 VAL B 126 3.644 7.230 -2.707 1.00 0.00 C ATOM 846 CG2 VAL B 126 5.378 8.369 -1.303 1.00 0.00 C ATOM 0 H VAL B 126 4.049 10.221 -0.089 1.00 0.00 H new ATOM 0 HA VAL B 126 3.696 9.943 -2.874 1.00 0.00 H new ATOM 0 HB VAL B 126 3.406 7.849 -0.684 1.00 0.00 H new ATOM 0 HG11 VAL B 126 4.087 6.270 -2.444 1.00 0.00 H new ATOM 0 HG12 VAL B 126 2.571 7.106 -2.856 1.00 0.00 H new ATOM 0 HG13 VAL B 126 4.098 7.599 -3.627 1.00 0.00 H new ATOM 0 HG21 VAL B 126 5.797 7.393 -1.060 1.00 0.00 H new ATOM 0 HG22 VAL B 126 5.879 8.769 -2.185 1.00 0.00 H new ATOM 0 HG23 VAL B 126 5.526 9.047 -0.462 1.00 0.00 H new ATOM 856 N LYS B 127 1.058 9.464 -0.953 1.00 0.00 N ATOM 857 CA LYS B 127 -0.394 9.333 -0.958 1.00 0.00 C ATOM 858 C LYS B 127 -1.040 10.597 -1.507 1.00 0.00 C ATOM 859 O LYS B 127 -2.034 10.536 -2.232 1.00 0.00 O ATOM 860 CB LYS B 127 -0.909 9.050 0.454 1.00 0.00 C ATOM 861 CG LYS B 127 -2.169 8.200 0.485 1.00 0.00 C ATOM 862 CD LYS B 127 -2.392 7.588 1.858 1.00 0.00 C ATOM 863 CE LYS B 127 -1.826 6.179 1.940 1.00 0.00 C ATOM 864 NZ LYS B 127 -1.698 5.712 3.348 1.00 0.00 N ATOM 0 H LYS B 127 1.469 9.573 -0.026 1.00 0.00 H new ATOM 0 HA LYS B 127 -0.661 8.496 -1.603 1.00 0.00 H new ATOM 0 HB2 LYS B 127 -0.127 8.546 1.022 1.00 0.00 H new ATOM 0 HB3 LYS B 127 -1.108 9.997 0.956 1.00 0.00 H new ATOM 0 HG2 LYS B 127 -3.029 8.812 0.214 1.00 0.00 H new ATOM 0 HG3 LYS B 127 -2.094 7.408 -0.260 1.00 0.00 H new ATOM 0 HD2 LYS B 127 -1.923 8.214 2.617 1.00 0.00 H new ATOM 0 HD3 LYS B 127 -3.459 7.566 2.078 1.00 0.00 H new ATOM 0 HE2 LYS B 127 -2.472 5.496 1.388 1.00 0.00 H new ATOM 0 HE3 LYS B 127 -0.848 6.152 1.459 1.00 0.00 H new ATOM 0 HZ1 LYS B 127 -0.834 5.141 3.447 1.00 0.00 H new ATOM 0 HZ2 LYS B 127 -1.644 6.534 3.983 1.00 0.00 H new ATOM 0 HZ3 LYS B 127 -2.526 5.134 3.599 1.00 0.00 H new ATOM 878 N ALA B 128 -0.460 11.742 -1.167 1.00 0.00 N ATOM 879 CA ALA B 128 -0.970 13.022 -1.636 1.00 0.00 C ATOM 880 C ALA B 128 -0.799 13.143 -3.145 1.00 0.00 C ATOM 881 O ALA B 128 -1.572 13.823 -3.819 1.00 0.00 O ATOM 882 CB ALA B 128 -0.259 14.164 -0.928 1.00 0.00 C ATOM 0 H ALA B 128 0.363 11.809 -0.569 1.00 0.00 H new ATOM 0 HA ALA B 128 -2.034 13.078 -1.404 1.00 0.00 H new ATOM 0 HB1 ALA B 128 -0.650 15.115 -1.288 1.00 0.00 H new ATOM 0 HB2 ALA B 128 -0.426 14.086 0.146 1.00 0.00 H new ATOM 0 HB3 ALA B 128 0.810 14.110 -1.134 1.00 0.00 H new ATOM 888 N LYS B 129 0.220 12.468 -3.668 1.00 0.00 N ATOM 889 CA LYS B 129 0.500 12.484 -5.096 1.00 0.00 C ATOM 890 C LYS B 129 -0.546 11.679 -5.854 1.00 0.00 C ATOM 891 O LYS B 129 -1.154 12.169 -6.806 1.00 0.00 O ATOM 892 CB LYS B 129 1.890 11.912 -5.364 1.00 0.00 C ATOM 893 CG LYS B 129 2.614 12.592 -6.510 1.00 0.00 C ATOM 894 CD LYS B 129 4.110 12.331 -6.450 1.00 0.00 C ATOM 895 CE LYS B 129 4.910 13.569 -6.824 1.00 0.00 C ATOM 896 NZ LYS B 129 5.543 13.437 -8.165 1.00 0.00 N ATOM 0 H LYS B 129 0.867 11.901 -3.120 1.00 0.00 H new ATOM 0 HA LYS B 129 0.465 13.517 -5.443 1.00 0.00 H new ATOM 0 HB2 LYS B 129 2.492 12.003 -4.460 1.00 0.00 H new ATOM 0 HB3 LYS B 129 1.800 10.848 -5.582 1.00 0.00 H new ATOM 0 HG2 LYS B 129 2.217 12.231 -7.459 1.00 0.00 H new ATOM 0 HG3 LYS B 129 2.428 13.665 -6.475 1.00 0.00 H new ATOM 0 HD2 LYS B 129 4.384 12.010 -5.445 1.00 0.00 H new ATOM 0 HD3 LYS B 129 4.365 11.515 -7.126 1.00 0.00 H new ATOM 0 HE2 LYS B 129 4.255 14.440 -6.816 1.00 0.00 H new ATOM 0 HE3 LYS B 129 5.682 13.743 -6.074 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 5.859 14.372 -8.493 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 6.361 12.798 -8.101 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 4.852 13.049 -8.838 1.00 0.00 H new ATOM 910 N ILE B 130 -0.755 10.442 -5.418 1.00 0.00 N ATOM 911 CA ILE B 130 -1.736 9.566 -6.047 1.00 0.00 C ATOM 912 C ILE B 130 -3.111 10.225 -6.059 1.00 0.00 C ATOM 913 O ILE B 130 -3.932 9.961 -6.937 1.00 0.00 O ATOM 914 CB ILE B 130 -1.828 8.209 -5.319 1.00 0.00 C ATOM 915 CG1 ILE B 130 -0.448 7.554 -5.235 1.00 0.00 C ATOM 916 CG2 ILE B 130 -2.811 7.290 -6.028 1.00 0.00 C ATOM 917 CD1 ILE B 130 -0.268 6.678 -4.015 1.00 0.00 C ATOM 0 H ILE B 130 -0.258 10.023 -4.632 1.00 0.00 H new ATOM 0 HA ILE B 130 -1.406 9.391 -7.071 1.00 0.00 H new ATOM 0 HB ILE B 130 -2.190 8.384 -4.306 1.00 0.00 H new ATOM 0 HG12 ILE B 130 -0.284 6.954 -6.130 1.00 0.00 H new ATOM 0 HG13 ILE B 130 0.315 8.332 -5.229 1.00 0.00 H new ATOM 0 HG21 ILE B 130 -2.863 6.337 -5.501 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -3.798 7.753 -6.040 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -2.477 7.120 -7.052 1.00 0.00 H new ATOM 0 HD11 ILE B 130 0.733 6.247 -4.021 1.00 0.00 H new ATOM 0 HD12 ILE B 130 -0.399 7.277 -3.114 1.00 0.00 H new ATOM 0 HD13 ILE B 130 -1.008 5.878 -4.029 1.00 0.00 H new ATOM 929 N GLN B 131 -3.346 11.093 -5.080 1.00 0.00 N ATOM 930 CA GLN B 131 -4.614 11.805 -4.977 1.00 0.00 C ATOM 931 C GLN B 131 -4.732 12.842 -6.086 1.00 0.00 C ATOM 932 O GLN B 131 -5.756 12.936 -6.761 1.00 0.00 O ATOM 933 CB GLN B 131 -4.728 12.490 -3.615 1.00 0.00 C ATOM 934 CG GLN B 131 -6.149 12.548 -3.078 1.00 0.00 C ATOM 935 CD GLN B 131 -6.763 13.928 -3.203 1.00 0.00 C ATOM 936 OE1 GLN B 131 -6.724 14.544 -4.268 1.00 0.00 O ATOM 937 NE2 GLN B 131 -7.335 14.423 -2.111 1.00 0.00 N ATOM 0 H GLN B 131 -2.674 11.320 -4.347 1.00 0.00 H new ATOM 0 HA GLN B 131 -5.423 11.082 -5.081 1.00 0.00 H new ATOM 0 HB2 GLN B 131 -4.099 11.961 -2.898 1.00 0.00 H new ATOM 0 HB3 GLN B 131 -4.337 13.504 -3.694 1.00 0.00 H new ATOM 0 HG2 GLN B 131 -6.767 11.829 -3.617 1.00 0.00 H new ATOM 0 HG3 GLN B 131 -6.150 12.247 -2.030 1.00 0.00 H new ATOM 0 HE21 GLN B 131 -7.345 13.878 -1.249 1.00 0.00 H new ATOM 0 HE22 GLN B 131 -7.764 15.348 -2.135 1.00 0.00 H new ATOM 946 N ASP B 132 -3.670 13.617 -6.267 1.00 0.00 N ATOM 947 CA ASP B 132 -3.643 14.650 -7.295 1.00 0.00 C ATOM 948 C ASP B 132 -3.726 14.039 -8.692 1.00 0.00 C ATOM 949 O ASP B 132 -4.062 14.723 -9.659 1.00 0.00 O ATOM 950 CB ASP B 132 -2.369 15.487 -7.168 1.00 0.00 C ATOM 951 CG ASP B 132 -2.614 16.958 -7.441 1.00 0.00 C ATOM 952 OD1 ASP B 132 -2.977 17.297 -8.587 1.00 0.00 O ATOM 953 OD2 ASP B 132 -2.442 17.772 -6.509 1.00 0.00 O ATOM 0 H ASP B 132 -2.815 13.550 -5.715 1.00 0.00 H new ATOM 0 HA ASP B 132 -4.512 15.292 -7.150 1.00 0.00 H new ATOM 0 HB2 ASP B 132 -1.959 15.370 -6.165 1.00 0.00 H new ATOM 0 HB3 ASP B 132 -1.620 15.111 -7.864 1.00 0.00 H new ATOM 958 N LYS B 133 -3.412 12.749 -8.794 1.00 0.00 N ATOM 959 CA LYS B 133 -3.448 12.054 -10.070 1.00 0.00 C ATOM 960 C LYS B 133 -4.772 11.320 -10.270 1.00 0.00 C ATOM 961 O LYS B 133 -5.388 11.406 -11.330 1.00 0.00 O ATOM 962 CB LYS B 133 -2.282 11.066 -10.170 1.00 0.00 C ATOM 963 CG LYS B 133 -1.353 11.337 -11.340 1.00 0.00 C ATOM 964 CD LYS B 133 -1.710 10.479 -12.540 1.00 0.00 C ATOM 965 CE LYS B 133 -0.714 10.667 -13.680 1.00 0.00 C ATOM 966 NZ LYS B 133 -0.544 9.424 -14.480 1.00 0.00 N ATOM 0 H LYS B 133 -3.130 12.167 -8.005 1.00 0.00 H new ATOM 0 HA LYS B 133 -3.354 12.802 -10.857 1.00 0.00 H new ATOM 0 HB2 LYS B 133 -1.707 11.101 -9.245 1.00 0.00 H new ATOM 0 HB3 LYS B 133 -2.680 10.055 -10.260 1.00 0.00 H new ATOM 0 HG2 LYS B 133 -1.409 12.390 -11.614 1.00 0.00 H new ATOM 0 HG3 LYS B 133 -0.323 11.139 -11.043 1.00 0.00 H new ATOM 0 HD2 LYS B 133 -1.732 9.430 -12.245 1.00 0.00 H new ATOM 0 HD3 LYS B 133 -2.712 10.734 -12.885 1.00 0.00 H new ATOM 0 HE2 LYS B 133 -1.054 11.473 -14.330 1.00 0.00 H new ATOM 0 HE3 LYS B 133 0.250 10.971 -13.273 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 0.141 9.594 -15.244 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 -0.195 8.661 -13.866 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 -1.459 9.147 -14.890 1.00 0.00 H new ATOM 980 N GLU B 134 -5.203 10.593 -9.244 1.00 0.00 N ATOM 981 CA GLU B 134 -6.451 9.841 -9.313 1.00 0.00 C ATOM 982 C GLU B 134 -7.568 10.557 -8.558 1.00 0.00 C ATOM 983 O GLU B 134 -8.663 10.749 -9.086 1.00 0.00 O ATOM 984 CB GLU B 134 -6.252 8.434 -8.745 1.00 0.00 C ATOM 985 CG GLU B 134 -6.141 7.358 -9.812 1.00 0.00 C ATOM 986 CD GLU B 134 -6.815 6.062 -9.406 1.00 0.00 C ATOM 987 OE1 GLU B 134 -6.159 5.236 -8.736 1.00 0.00 O ATOM 988 OE2 GLU B 134 -7.998 5.872 -9.758 1.00 0.00 O ATOM 0 H GLU B 134 -4.708 10.509 -8.356 1.00 0.00 H new ATOM 0 HA GLU B 134 -6.742 9.766 -10.361 1.00 0.00 H new ATOM 0 HB2 GLU B 134 -5.350 8.422 -8.134 1.00 0.00 H new ATOM 0 HB3 GLU B 134 -7.087 8.196 -8.086 1.00 0.00 H new ATOM 0 HG2 GLU B 134 -6.588 7.721 -10.737 1.00 0.00 H new ATOM 0 HG3 GLU B 134 -5.089 7.166 -10.021 1.00 0.00 H new ATOM 995 N GLY B 135 -7.284 10.945 -7.319 1.00 0.00 N ATOM 996 CA GLY B 135 -8.277 11.631 -6.512 1.00 0.00 C ATOM 997 C GLY B 135 -8.798 10.768 -5.381 1.00 0.00 C ATOM 998 O GLY B 135 -9.929 10.943 -4.927 1.00 0.00 O ATOM 0 H GLY B 135 -6.385 10.797 -6.860 1.00 0.00 H new ATOM 0 HA2 GLY B 135 -7.841 12.541 -6.100 1.00 0.00 H new ATOM 0 HA3 GLY B 135 -9.109 11.936 -7.146 1.00 0.00 H new ATOM 1002 N ILE B 136 -7.971 9.833 -4.925 1.00 0.00 N ATOM 1003 CA ILE B 136 -8.353 8.937 -3.841 1.00 0.00 C ATOM 1004 C ILE B 136 -7.957 9.516 -2.484 1.00 0.00 C ATOM 1005 O ILE B 136 -6.851 10.029 -2.321 1.00 0.00 O ATOM 1006 CB ILE B 136 -7.699 7.551 -4.006 1.00 0.00 C ATOM 1007 CG1 ILE B 136 -7.943 7.014 -5.418 1.00 0.00 C ATOM 1008 CG2 ILE B 136 -8.238 6.582 -2.964 1.00 0.00 C ATOM 1009 CD1 ILE B 136 -7.329 5.653 -5.661 1.00 0.00 C ATOM 0 H ILE B 136 -7.031 9.676 -5.290 1.00 0.00 H new ATOM 0 HA ILE B 136 -9.437 8.828 -3.884 1.00 0.00 H new ATOM 0 HB ILE B 136 -6.624 7.653 -3.856 1.00 0.00 H new ATOM 0 HG12 ILE B 136 -9.017 6.956 -5.595 1.00 0.00 H new ATOM 0 HG13 ILE B 136 -7.538 7.721 -6.142 1.00 0.00 H new ATOM 0 HG21 ILE B 136 -7.766 5.608 -3.094 1.00 0.00 H new ATOM 0 HG22 ILE B 136 -8.018 6.961 -1.966 1.00 0.00 H new ATOM 0 HG23 ILE B 136 -9.317 6.481 -3.084 1.00 0.00 H new ATOM 0 HD11 ILE B 136 -7.542 5.335 -6.682 1.00 0.00 H new ATOM 0 HD12 ILE B 136 -6.250 5.709 -5.516 1.00 0.00 H new ATOM 0 HD13 ILE B 136 -7.752 4.933 -4.961 1.00 0.00 H new ATOM 1021 N PRO B 137 -8.857 9.443 -1.486 1.00 0.00 N ATOM 1022 CA PRO B 137 -8.587 9.967 -0.142 1.00 0.00 C ATOM 1023 C PRO B 137 -7.412 9.261 0.530 1.00 0.00 C ATOM 1024 O PRO B 137 -7.227 8.055 0.366 1.00 0.00 O ATOM 1025 CB PRO B 137 -9.882 9.691 0.630 1.00 0.00 C ATOM 1026 CG PRO B 137 -10.580 8.632 -0.149 1.00 0.00 C ATOM 1027 CD PRO B 137 -10.200 8.850 -1.584 1.00 0.00 C ATOM 0 HA PRO B 137 -8.313 11.022 -0.172 1.00 0.00 H new ATOM 0 HB2 PRO B 137 -9.672 9.359 1.647 1.00 0.00 H new ATOM 0 HB3 PRO B 137 -10.493 10.590 0.709 1.00 0.00 H new ATOM 0 HG2 PRO B 137 -10.280 7.640 0.187 1.00 0.00 H new ATOM 0 HG3 PRO B 137 -11.660 8.700 -0.018 1.00 0.00 H new ATOM 0 HD2 PRO B 137 -10.188 7.915 -2.145 1.00 0.00 H new ATOM 0 HD3 PRO B 137 -10.899 9.516 -2.090 1.00 0.00 H new ATOM 1035 N PRO B 138 -6.606 10.003 1.308 1.00 0.00 N ATOM 1036 CA PRO B 138 -5.452 9.437 2.013 1.00 0.00 C ATOM 1037 C PRO B 138 -5.877 8.544 3.169 1.00 0.00 C ATOM 1038 O PRO B 138 -5.224 7.547 3.476 1.00 0.00 O ATOM 1039 CB PRO B 138 -4.721 10.671 2.540 1.00 0.00 C ATOM 1040 CG PRO B 138 -5.784 11.703 2.686 1.00 0.00 C ATOM 1041 CD PRO B 138 -6.759 11.447 1.571 1.00 0.00 C ATOM 0 HA PRO B 138 -4.842 8.807 1.366 1.00 0.00 H new ATOM 0 HB2 PRO B 138 -4.234 10.466 3.493 1.00 0.00 H new ATOM 0 HB3 PRO B 138 -3.944 10.997 1.848 1.00 0.00 H new ATOM 0 HG2 PRO B 138 -6.272 11.627 3.658 1.00 0.00 H new ATOM 0 HG3 PRO B 138 -5.366 12.707 2.617 1.00 0.00 H new ATOM 0 HD2 PRO B 138 -7.779 11.696 1.864 1.00 0.00 H new ATOM 0 HD3 PRO B 138 -6.526 12.043 0.689 1.00 0.00 H new ATOM 1049 N ASP B 139 -6.979 8.917 3.803 1.00 0.00 N ATOM 1050 CA ASP B 139 -7.510 8.160 4.931 1.00 0.00 C ATOM 1051 C ASP B 139 -7.977 6.780 4.485 1.00 0.00 C ATOM 1052 O ASP B 139 -7.905 5.813 5.243 1.00 0.00 O ATOM 1053 CB ASP B 139 -8.667 8.918 5.582 1.00 0.00 C ATOM 1054 CG ASP B 139 -8.189 10.001 6.530 1.00 0.00 C ATOM 1055 OD1 ASP B 139 -7.419 9.679 7.459 1.00 0.00 O ATOM 1056 OD2 ASP B 139 -8.585 11.171 6.343 1.00 0.00 O ATOM 0 H ASP B 139 -7.526 9.742 3.556 1.00 0.00 H new ATOM 0 HA ASP B 139 -6.711 8.035 5.662 1.00 0.00 H new ATOM 0 HB2 ASP B 139 -9.286 9.366 4.805 1.00 0.00 H new ATOM 0 HB3 ASP B 139 -9.298 8.215 6.126 1.00 0.00 H new ATOM 1061 N GLN B 140 -8.455 6.696 3.248 1.00 0.00 N ATOM 1062 CA GLN B 140 -8.934 5.435 2.696 1.00 0.00 C ATOM 1063 C GLN B 140 -7.825 4.718 1.931 1.00 0.00 C ATOM 1064 O GLN B 140 -7.862 3.499 1.763 1.00 0.00 O ATOM 1065 CB GLN B 140 -10.130 5.680 1.774 1.00 0.00 C ATOM 1066 CG GLN B 140 -11.220 4.630 1.899 1.00 0.00 C ATOM 1067 CD GLN B 140 -12.270 4.758 0.821 1.00 0.00 C ATOM 1068 OE1 GLN B 140 -12.250 4.042 -0.180 1.00 0.00 O ATOM 1069 NE2 GLN B 140 -13.220 5.674 1.020 1.00 0.00 N ATOM 0 H GLN B 140 -8.521 7.488 2.608 1.00 0.00 H new ATOM 0 HA GLN B 140 -9.247 4.800 3.525 1.00 0.00 H new ATOM 0 HB2 GLN B 140 -10.554 6.660 1.995 1.00 0.00 H new ATOM 0 HB3 GLN B 140 -9.782 5.709 0.741 1.00 0.00 H new ATOM 0 HG2 GLN B 140 -10.772 3.638 1.850 1.00 0.00 H new ATOM 0 HG3 GLN B 140 -11.694 4.717 2.876 1.00 0.00 H new ATOM 0 HE21 GLN B 140 -13.205 6.250 1.862 1.00 0.00 H new ATOM 0 HE22 GLN B 140 -13.961 5.798 0.330 1.00 0.00 H new ATOM 1078 N GLN B 141 -6.840 5.482 1.468 1.00 0.00 N ATOM 1079 CA GLN B 141 -5.722 4.919 0.719 1.00 0.00 C ATOM 1080 C GLN B 141 -4.854 4.036 1.610 1.00 0.00 C ATOM 1081 O GLN B 141 -4.362 4.478 2.648 1.00 0.00 O ATOM 1082 CB GLN B 141 -4.870 6.039 0.119 1.00 0.00 C ATOM 1083 CG GLN B 141 -5.386 6.554 -1.214 1.00 0.00 C ATOM 1084 CD GLN B 141 -4.808 7.909 -1.574 1.00 0.00 C ATOM 1085 OE1 GLN B 141 -5.126 8.919 -0.948 1.00 0.00 O ATOM 1086 NE2 GLN B 141 -3.949 7.936 -2.587 1.00 0.00 N ATOM 0 H GLN B 141 -6.794 6.493 1.598 1.00 0.00 H new ATOM 0 HA GLN B 141 -6.131 4.305 -0.084 1.00 0.00 H new ATOM 0 HB2 GLN B 141 -4.826 6.868 0.826 1.00 0.00 H new ATOM 0 HB3 GLN B 141 -3.850 5.677 -0.012 1.00 0.00 H new ATOM 0 HG2 GLN B 141 -5.139 5.837 -1.997 1.00 0.00 H new ATOM 0 HG3 GLN B 141 -6.473 6.624 -1.177 1.00 0.00 H new ATOM 0 HE21 GLN B 141 -3.713 7.074 -3.079 1.00 0.00 H new ATOM 0 HE22 GLN B 141 -3.525 8.819 -2.873 1.00 0.00 H new ATOM 1095 N ARG B 142 -4.657 2.791 1.189 1.00 0.00 N ATOM 1096 CA ARG B 142 -3.835 1.852 1.942 1.00 0.00 C ATOM 1097 C ARG B 142 -2.616 1.444 1.123 1.00 0.00 C ATOM 1098 O ARG B 142 -2.712 0.628 0.207 1.00 0.00 O ATOM 1099 CB ARG B 142 -4.648 0.614 2.329 1.00 0.00 C ATOM 1100 CG ARG B 142 -5.084 0.604 3.785 1.00 0.00 C ATOM 1101 CD ARG B 142 -6.003 1.772 4.099 1.00 0.00 C ATOM 1102 NE ARG B 142 -5.980 2.119 5.518 1.00 0.00 N ATOM 1103 CZ ARG B 142 -6.939 2.812 6.128 1.00 0.00 C ATOM 1104 NH1 ARG B 142 -7.998 3.235 5.448 1.00 0.00 N ATOM 1105 NH2 ARG B 142 -6.840 3.083 7.423 1.00 0.00 N ATOM 0 H ARG B 142 -5.055 2.410 0.331 1.00 0.00 H new ATOM 0 HA ARG B 142 -3.499 2.344 2.855 1.00 0.00 H new ATOM 0 HB2 ARG B 142 -5.532 0.556 1.693 1.00 0.00 H new ATOM 0 HB3 ARG B 142 -4.054 -0.278 2.130 1.00 0.00 H new ATOM 0 HG2 ARG B 142 -5.596 -0.333 4.006 1.00 0.00 H new ATOM 0 HG3 ARG B 142 -4.206 0.647 4.429 1.00 0.00 H new ATOM 0 HD2 ARG B 142 -5.703 2.638 3.509 1.00 0.00 H new ATOM 0 HD3 ARG B 142 -7.022 1.522 3.803 1.00 0.00 H new ATOM 0 HE ARG B 142 -5.182 1.812 6.074 1.00 0.00 H new ATOM 0 HH11 ARG B 142 -8.080 3.029 4.452 1.00 0.00 H new ATOM 0 HH12 ARG B 142 -8.729 3.766 5.921 1.00 0.00 H new ATOM 0 HH21 ARG B 142 -6.029 2.760 7.951 1.00 0.00 H new ATOM 0 HH22 ARG B 142 -7.575 3.614 7.891 1.00 0.00 H new ATOM 1119 N LEU B 143 -1.472 2.026 1.458 1.00 0.00 N ATOM 1120 CA LEU B 143 -0.228 1.737 0.757 1.00 0.00 C ATOM 1121 C LEU B 143 0.398 0.440 1.256 1.00 0.00 C ATOM 1122 O LEU B 143 0.791 0.333 2.418 1.00 0.00 O ATOM 1123 CB LEU B 143 0.760 2.893 0.930 1.00 0.00 C ATOM 1124 CG LEU B 143 0.440 4.146 0.114 1.00 0.00 C ATOM 1125 CD1 LEU B 143 1.458 5.240 0.396 1.00 0.00 C ATOM 1126 CD2 LEU B 143 0.403 3.818 -1.371 1.00 0.00 C ATOM 0 H LEU B 143 -1.380 2.704 2.214 1.00 0.00 H new ATOM 0 HA LEU B 143 -0.460 1.619 -0.301 1.00 0.00 H new ATOM 0 HB2 LEU B 143 0.797 3.165 1.985 1.00 0.00 H new ATOM 0 HB3 LEU B 143 1.756 2.544 0.656 1.00 0.00 H new ATOM 0 HG LEU B 143 -0.544 4.510 0.410 1.00 0.00 H new ATOM 0 HD11 LEU B 143 1.215 6.124 -0.193 1.00 0.00 H new ATOM 0 HD12 LEU B 143 1.436 5.493 1.456 1.00 0.00 H new ATOM 0 HD13 LEU B 143 2.454 4.888 0.128 1.00 0.00 H new ATOM 0 HD21 LEU B 143 0.174 4.721 -1.937 1.00 0.00 H new ATOM 0 HD22 LEU B 143 1.373 3.431 -1.682 1.00 0.00 H new ATOM 0 HD23 LEU B 143 -0.365 3.067 -1.559 1.00 0.00 H new ATOM 1138 N ILE B 144 0.489 -0.541 0.367 1.00 0.00 N ATOM 1139 CA ILE B 144 1.070 -1.835 0.705 1.00 0.00 C ATOM 1140 C ILE B 144 2.433 -2.008 0.046 1.00 0.00 C ATOM 1141 O ILE B 144 2.650 -1.552 -1.076 1.00 0.00 O ATOM 1142 CB ILE B 144 0.154 -2.993 0.264 1.00 0.00 C ATOM 1143 CG1 ILE B 144 -1.298 -2.716 0.662 1.00 0.00 C ATOM 1144 CG2 ILE B 144 0.635 -4.304 0.866 1.00 0.00 C ATOM 1145 CD1 ILE B 144 -1.472 -2.339 2.117 1.00 0.00 C ATOM 0 H ILE B 144 0.167 -0.465 -0.598 1.00 0.00 H new ATOM 0 HA ILE B 144 1.182 -1.861 1.789 1.00 0.00 H new ATOM 0 HB ILE B 144 0.198 -3.074 -0.822 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -1.688 -1.911 0.039 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -1.898 -3.602 0.452 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -0.021 -5.114 0.546 1.00 0.00 H new ATOM 0 HG22 ILE B 144 1.652 -4.507 0.530 1.00 0.00 H new ATOM 0 HG23 ILE B 144 0.619 -4.232 1.954 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -2.527 -2.158 2.322 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -1.113 -3.152 2.749 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -0.901 -1.435 2.329 1.00 0.00 H new ATOM 1157 N PHE B 145 3.352 -2.669 0.745 1.00 0.00 N ATOM 1158 CA PHE B 145 4.689 -2.891 0.208 1.00 0.00 C ATOM 1159 C PHE B 145 5.263 -4.232 0.658 1.00 0.00 C ATOM 1160 O PHE B 145 5.792 -4.357 1.763 1.00 0.00 O ATOM 1161 CB PHE B 145 5.624 -1.754 0.625 1.00 0.00 C ATOM 1162 CG PHE B 145 7.018 -1.889 0.079 1.00 0.00 C ATOM 1163 CD1 PHE B 145 7.297 -1.548 -1.234 1.00 0.00 C ATOM 1164 CD2 PHE B 145 8.047 -2.358 0.880 1.00 0.00 C ATOM 1165 CE1 PHE B 145 8.578 -1.672 -1.739 1.00 0.00 C ATOM 1166 CE2 PHE B 145 9.329 -2.484 0.381 1.00 0.00 C ATOM 1167 CZ PHE B 145 9.595 -2.140 -0.930 1.00 0.00 C ATOM 0 H PHE B 145 3.197 -3.057 1.676 1.00 0.00 H new ATOM 0 HA PHE B 145 4.608 -2.911 -0.879 1.00 0.00 H new ATOM 0 HB2 PHE B 145 5.202 -0.807 0.290 1.00 0.00 H new ATOM 0 HB3 PHE B 145 5.671 -1.715 1.713 1.00 0.00 H new ATOM 0 HD1 PHE B 145 6.505 -1.181 -1.870 1.00 0.00 H new ATOM 0 HD2 PHE B 145 7.844 -2.628 1.906 1.00 0.00 H new ATOM 0 HE1 PHE B 145 8.783 -1.403 -2.765 1.00 0.00 H new ATOM 0 HE2 PHE B 145 10.122 -2.851 1.015 1.00 0.00 H new ATOM 0 HZ PHE B 145 10.597 -2.237 -1.322 1.00 0.00 H new ATOM 1177 N ALA B 146 5.164 -5.227 -0.222 1.00 0.00 N ATOM 1178 CA ALA B 146 5.680 -6.569 0.046 1.00 0.00 C ATOM 1179 C ALA B 146 5.413 -7.023 1.480 1.00 0.00 C ATOM 1180 O ALA B 146 6.281 -7.618 2.120 1.00 0.00 O ATOM 1181 CB ALA B 146 7.171 -6.621 -0.252 1.00 0.00 C ATOM 0 H ALA B 146 4.726 -5.127 -1.138 1.00 0.00 H new ATOM 0 HA ALA B 146 5.149 -7.257 -0.611 1.00 0.00 H new ATOM 0 HB1 ALA B 146 7.548 -7.624 -0.050 1.00 0.00 H new ATOM 0 HB2 ALA B 146 7.341 -6.374 -1.300 1.00 0.00 H new ATOM 0 HB3 ALA B 146 7.694 -5.903 0.380 1.00 0.00 H new ATOM 1187 N GLY B 147 4.212 -6.751 1.981 1.00 0.00 N ATOM 1188 CA GLY B 147 3.873 -7.155 3.328 1.00 0.00 C ATOM 1189 C GLY B 147 4.170 -6.082 4.354 1.00 0.00 C ATOM 1190 O GLY B 147 4.482 -6.387 5.505 1.00 0.00 O ATOM 0 H GLY B 147 3.472 -6.260 1.479 1.00 0.00 H new ATOM 0 HA2 GLY B 147 2.814 -7.409 3.371 1.00 0.00 H new ATOM 0 HA3 GLY B 147 4.428 -8.058 3.582 1.00 0.00 H new ATOM 1194 N LYS B 148 4.075 -4.824 3.943 1.00 0.00 N ATOM 1195 CA LYS B 148 4.335 -3.716 4.842 1.00 0.00 C ATOM 1196 C LYS B 148 3.359 -2.574 4.601 1.00 0.00 C ATOM 1197 O LYS B 148 3.067 -2.217 3.460 1.00 0.00 O ATOM 1198 CB LYS B 148 5.758 -3.209 4.664 1.00 0.00 C ATOM 1199 CG LYS B 148 6.826 -4.248 4.966 1.00 0.00 C ATOM 1200 CD LYS B 148 7.291 -4.165 6.411 1.00 0.00 C ATOM 1201 CE LYS B 148 8.146 -5.363 6.790 1.00 0.00 C ATOM 1202 NZ LYS B 148 8.664 -5.258 8.182 1.00 0.00 N ATOM 0 H LYS B 148 3.820 -4.550 2.994 1.00 0.00 H new ATOM 0 HA LYS B 148 4.204 -4.080 5.861 1.00 0.00 H new ATOM 0 HB2 LYS B 148 5.883 -2.861 3.639 1.00 0.00 H new ATOM 0 HB3 LYS B 148 5.910 -2.347 5.314 1.00 0.00 H new ATOM 0 HG2 LYS B 148 6.432 -5.245 4.766 1.00 0.00 H new ATOM 0 HG3 LYS B 148 7.676 -4.101 4.300 1.00 0.00 H new ATOM 0 HD2 LYS B 148 7.862 -3.248 6.559 1.00 0.00 H new ATOM 0 HD3 LYS B 148 6.425 -4.111 7.071 1.00 0.00 H new ATOM 0 HE2 LYS B 148 7.558 -6.275 6.690 1.00 0.00 H new ATOM 0 HE3 LYS B 148 8.983 -5.446 6.097 1.00 0.00 H new ATOM 0 HZ1 LYS B 148 9.242 -6.094 8.401 1.00 0.00 H new ATOM 0 HZ2 LYS B 148 9.247 -4.401 8.272 1.00 0.00 H new ATOM 0 HZ3 LYS B 148 7.866 -5.205 8.846 1.00 0.00 H new ATOM 1216 N GLN B 149 2.868 -2.005 5.689 1.00 0.00 N ATOM 1217 CA GLN B 149 1.930 -0.893 5.618 1.00 0.00 C ATOM 1218 C GLN B 149 2.644 0.434 5.858 1.00 0.00 C ATOM 1219 O GLN B 149 3.032 0.746 6.983 1.00 0.00 O ATOM 1220 CB GLN B 149 0.812 -1.077 6.648 1.00 0.00 C ATOM 1221 CG GLN B 149 -0.179 0.077 6.697 1.00 0.00 C ATOM 1222 CD GLN B 149 -0.590 0.559 5.319 1.00 0.00 C ATOM 1223 OE1 GLN B 149 -0.738 -0.374 4.385 1.00 0.00 O flip ATOM 1224 NE2 GLN B 149 -0.773 1.756 5.096 1.00 0.00 N flip ATOM 0 H GLN B 149 3.104 -2.296 6.638 1.00 0.00 H new ATOM 0 HA GLN B 149 1.496 -0.877 4.618 1.00 0.00 H new ATOM 0 HB2 GLN B 149 0.272 -1.997 6.423 1.00 0.00 H new ATOM 0 HB3 GLN B 149 1.258 -1.202 7.635 1.00 0.00 H new ATOM 0 HG2 GLN B 149 -1.067 -0.236 7.247 1.00 0.00 H new ATOM 0 HG3 GLN B 149 0.263 0.906 7.250 1.00 0.00 H new ATOM 0 HE21 GLN B 149 -0.648 2.439 5.843 1.00 0.00 H new ATOM 0 HE22 GLN B 149 -1.050 2.065 4.164 1.00 0.00 H new ATOM 1233 N LEU B 150 2.815 1.210 4.793 1.00 0.00 N ATOM 1234 CA LEU B 150 3.483 2.503 4.890 1.00 0.00 C ATOM 1235 C LEU B 150 2.618 3.509 5.642 1.00 0.00 C ATOM 1236 O LEU B 150 1.393 3.500 5.523 1.00 0.00 O ATOM 1237 CB LEU B 150 3.812 3.036 3.494 1.00 0.00 C ATOM 1238 CG LEU B 150 4.456 2.022 2.548 1.00 0.00 C ATOM 1239 CD1 LEU B 150 4.841 2.688 1.236 1.00 0.00 C ATOM 1240 CD2 LEU B 150 5.673 1.382 3.199 1.00 0.00 C ATOM 0 H LEU B 150 2.501 0.967 3.854 1.00 0.00 H new ATOM 0 HA LEU B 150 4.410 2.364 5.446 1.00 0.00 H new ATOM 0 HB2 LEU B 150 2.894 3.404 3.037 1.00 0.00 H new ATOM 0 HB3 LEU B 150 4.481 3.890 3.597 1.00 0.00 H new ATOM 0 HG LEU B 150 3.728 1.239 2.336 1.00 0.00 H new ATOM 0 HD11 LEU B 150 5.298 1.952 0.575 1.00 0.00 H new ATOM 0 HD12 LEU B 150 3.950 3.099 0.761 1.00 0.00 H new ATOM 0 HD13 LEU B 150 5.551 3.491 1.431 1.00 0.00 H new ATOM 0 HD21 LEU B 150 6.118 0.663 2.511 1.00 0.00 H new ATOM 0 HD22 LEU B 150 6.404 2.153 3.441 1.00 0.00 H new ATOM 0 HD23 LEU B 150 5.370 0.870 4.112 1.00 0.00 H new ATOM 1252 N GLU B 151 3.264 4.377 6.416 1.00 0.00 N ATOM 1253 CA GLU B 151 2.555 5.390 7.186 1.00 0.00 C ATOM 1254 C GLU B 151 3.066 6.784 6.846 1.00 0.00 C ATOM 1255 O GLU B 151 4.252 6.977 6.575 1.00 0.00 O ATOM 1256 CB GLU B 151 2.711 5.126 8.684 1.00 0.00 C ATOM 1257 CG GLU B 151 1.432 4.652 9.354 1.00 0.00 C ATOM 1258 CD GLU B 151 0.858 3.410 8.703 1.00 0.00 C ATOM 1259 OE1 GLU B 151 0.123 3.549 7.702 1.00 0.00 O ATOM 1260 OE2 GLU B 151 1.142 2.297 9.193 1.00 0.00 O ATOM 0 H GLU B 151 4.278 4.398 6.525 1.00 0.00 H new ATOM 0 HA GLU B 151 1.498 5.336 6.925 1.00 0.00 H new ATOM 0 HB2 GLU B 151 3.489 4.377 8.834 1.00 0.00 H new ATOM 0 HB3 GLU B 151 3.050 6.040 9.172 1.00 0.00 H new ATOM 0 HG2 GLU B 151 1.632 4.447 10.406 1.00 0.00 H new ATOM 0 HG3 GLU B 151 0.691 5.451 9.320 1.00 0.00 H new ATOM 1267 N ASP B 152 2.160 7.750 6.864 1.00 0.00 N ATOM 1268 CA ASP B 152 2.501 9.136 6.559 1.00 0.00 C ATOM 1269 C ASP B 152 3.563 9.669 7.516 1.00 0.00 C ATOM 1270 O ASP B 152 4.285 10.613 7.192 1.00 0.00 O ATOM 1271 CB ASP B 152 1.251 10.016 6.628 1.00 0.00 C ATOM 1272 CG ASP B 152 0.435 9.765 7.881 1.00 0.00 C ATOM 1273 OD1 ASP B 152 0.043 8.602 8.111 1.00 0.00 O ATOM 1274 OD2 ASP B 152 0.188 10.732 8.631 1.00 0.00 O ATOM 0 H ASP B 152 1.176 7.600 7.088 1.00 0.00 H new ATOM 0 HA ASP B 152 2.908 9.165 5.548 1.00 0.00 H new ATOM 0 HB2 ASP B 152 1.546 11.065 6.594 1.00 0.00 H new ATOM 0 HB3 ASP B 152 0.631 9.831 5.751 1.00 0.00 H new ATOM 1279 N GLY B 153 3.651 9.066 8.697 1.00 0.00 N ATOM 1280 CA GLY B 153 4.625 9.503 9.680 1.00 0.00 C ATOM 1281 C GLY B 153 6.017 8.953 9.425 1.00 0.00 C ATOM 1282 O GLY B 153 6.976 9.358 10.082 1.00 0.00 O ATOM 0 H GLY B 153 3.066 8.284 8.991 1.00 0.00 H new ATOM 0 HA2 GLY B 153 4.666 10.592 9.683 1.00 0.00 H new ATOM 0 HA3 GLY B 153 4.295 9.194 10.672 1.00 0.00 H new ATOM 1286 N ARG B 154 6.134 8.026 8.477 1.00 0.00 N ATOM 1287 CA ARG B 154 7.414 7.427 8.155 1.00 0.00 C ATOM 1288 C ARG B 154 7.969 7.986 6.854 1.00 0.00 C ATOM 1289 O ARG B 154 7.433 8.938 6.287 1.00 0.00 O ATOM 1290 CB ARG B 154 7.273 5.914 8.046 1.00 0.00 C ATOM 1291 CG ARG B 154 7.905 5.157 9.201 1.00 0.00 C ATOM 1292 CD ARG B 154 8.489 3.827 8.751 1.00 0.00 C ATOM 1293 NE ARG B 154 7.831 2.694 9.399 1.00 0.00 N ATOM 1294 CZ ARG B 154 8.096 2.295 10.641 1.00 0.00 C ATOM 1295 NH1 ARG B 154 9.001 2.933 11.372 1.00 0.00 N ATOM 1296 NH2 ARG B 154 7.452 1.255 11.153 1.00 0.00 N ATOM 0 H ARG B 154 5.353 7.677 7.921 1.00 0.00 H new ATOM 0 HA ARG B 154 8.110 7.669 8.958 1.00 0.00 H new ATOM 0 HB2 ARG B 154 6.214 5.660 7.992 1.00 0.00 H new ATOM 0 HB3 ARG B 154 7.728 5.582 7.113 1.00 0.00 H new ATOM 0 HG2 ARG B 154 8.690 5.766 9.649 1.00 0.00 H new ATOM 0 HG3 ARG B 154 7.157 4.983 9.974 1.00 0.00 H new ATOM 0 HD2 ARG B 154 8.389 3.734 7.670 1.00 0.00 H new ATOM 0 HD3 ARG B 154 9.555 3.804 8.976 1.00 0.00 H new ATOM 0 HE ARG B 154 7.128 2.179 8.869 1.00 0.00 H new ATOM 0 HH11 ARG B 154 9.498 3.734 10.983 1.00 0.00 H new ATOM 0 HH12 ARG B 154 9.199 2.622 12.323 1.00 0.00 H new ATOM 0 HH21 ARG B 154 6.755 0.762 10.595 1.00 0.00 H new ATOM 0 HH22 ARG B 154 7.654 0.948 12.105 1.00 0.00 H new ATOM 1310 N THR B 155 9.050 7.378 6.394 1.00 0.00 N ATOM 1311 CA THR B 155 9.702 7.793 5.159 1.00 0.00 C ATOM 1312 C THR B 155 9.835 6.620 4.193 1.00 0.00 C ATOM 1313 O THR B 155 9.733 5.459 4.592 1.00 0.00 O ATOM 1314 CB THR B 155 11.082 8.384 5.459 1.00 0.00 C ATOM 1315 OG1 THR B 155 11.597 7.864 6.672 1.00 0.00 O ATOM 1316 CG2 THR B 155 11.074 9.893 5.574 1.00 0.00 C ATOM 0 H THR B 155 9.499 6.589 6.860 1.00 0.00 H new ATOM 0 HA THR B 155 9.083 8.557 4.689 1.00 0.00 H new ATOM 0 HB THR B 155 11.707 8.103 4.611 1.00 0.00 H new ATOM 0 HG1 THR B 155 12.480 8.252 6.846 1.00 0.00 H new ATOM 0 HG21 THR B 155 12.083 10.247 5.787 1.00 0.00 H new ATOM 0 HG22 THR B 155 10.728 10.328 4.636 1.00 0.00 H new ATOM 0 HG23 THR B 155 10.406 10.193 6.381 1.00 0.00 H new ATOM 1324 N LEU B 156 10.062 6.931 2.921 1.00 0.00 N ATOM 1325 CA LEU B 156 10.209 5.907 1.895 1.00 0.00 C ATOM 1326 C LEU B 156 11.423 5.027 2.179 1.00 0.00 C ATOM 1327 O LEU B 156 11.376 3.810 2.002 1.00 0.00 O ATOM 1328 CB LEU B 156 10.340 6.562 0.519 1.00 0.00 C ATOM 1329 CG LEU B 156 9.041 6.643 -0.285 1.00 0.00 C ATOM 1330 CD1 LEU B 156 9.052 7.859 -1.198 1.00 0.00 C ATOM 1331 CD2 LEU B 156 8.835 5.371 -1.093 1.00 0.00 C ATOM 0 H LEU B 156 10.148 7.887 2.576 1.00 0.00 H new ATOM 0 HA LEU B 156 9.320 5.276 1.906 1.00 0.00 H new ATOM 0 HB2 LEU B 156 10.732 7.571 0.649 1.00 0.00 H new ATOM 0 HB3 LEU B 156 11.076 6.006 -0.063 1.00 0.00 H new ATOM 0 HG LEU B 156 8.210 6.746 0.413 1.00 0.00 H new ATOM 0 HD11 LEU B 156 8.120 7.899 -1.762 1.00 0.00 H new ATOM 0 HD12 LEU B 156 9.153 8.763 -0.598 1.00 0.00 H new ATOM 0 HD13 LEU B 156 9.891 7.787 -1.890 1.00 0.00 H new ATOM 0 HD21 LEU B 156 7.906 5.446 -1.659 1.00 0.00 H new ATOM 0 HD22 LEU B 156 9.670 5.238 -1.781 1.00 0.00 H new ATOM 0 HD23 LEU B 156 8.781 4.516 -0.419 1.00 0.00 H new ATOM 1343 N SER B 157 12.504 5.652 2.631 1.00 0.00 N ATOM 1344 CA SER B 157 13.728 4.932 2.954 1.00 0.00 C ATOM 1345 C SER B 157 13.583 4.207 4.287 1.00 0.00 C ATOM 1346 O SER B 157 14.274 3.222 4.546 1.00 0.00 O ATOM 1347 CB SER B 157 14.917 5.895 3.002 1.00 0.00 C ATOM 1348 OG SER B 157 15.981 5.359 3.770 1.00 0.00 O ATOM 0 H SER B 157 12.557 6.659 2.782 1.00 0.00 H new ATOM 0 HA SER B 157 13.909 4.193 2.174 1.00 0.00 H new ATOM 0 HB2 SER B 157 15.264 6.100 1.989 1.00 0.00 H new ATOM 0 HB3 SER B 157 14.600 6.847 3.429 1.00 0.00 H new ATOM 0 HG SER B 157 16.728 5.994 3.783 1.00 0.00 H new ATOM 1354 N ASP B 158 12.670 4.693 5.126 1.00 0.00 N ATOM 1355 CA ASP B 158 12.429 4.078 6.425 1.00 0.00 C ATOM 1356 C ASP B 158 12.025 2.620 6.247 1.00 0.00 C ATOM 1357 O ASP B 158 12.351 1.765 7.071 1.00 0.00 O ATOM 1358 CB ASP B 158 11.335 4.837 7.179 1.00 0.00 C ATOM 1359 CG ASP B 158 11.786 5.286 8.555 1.00 0.00 C ATOM 1360 OD1 ASP B 158 11.899 4.425 9.453 1.00 0.00 O ATOM 1361 OD2 ASP B 158 12.026 6.499 8.735 1.00 0.00 O ATOM 0 H ASP B 158 12.088 5.507 4.929 1.00 0.00 H new ATOM 0 HA ASP B 158 13.349 4.122 7.007 1.00 0.00 H new ATOM 0 HB2 ASP B 158 11.033 5.708 6.597 1.00 0.00 H new ATOM 0 HB3 ASP B 158 10.456 4.199 7.278 1.00 0.00 H new ATOM 1366 N TYR B 159 11.317 2.346 5.156 1.00 0.00 N ATOM 1367 CA TYR B 159 10.870 0.997 4.850 1.00 0.00 C ATOM 1368 C TYR B 159 11.861 0.292 3.925 1.00 0.00 C ATOM 1369 O TYR B 159 11.787 -0.922 3.744 1.00 0.00 O ATOM 1370 CB TYR B 159 9.484 1.039 4.210 1.00 0.00 C ATOM 1371 CG TYR B 159 8.360 0.834 5.199 1.00 0.00 C ATOM 1372 CD1 TYR B 159 8.095 -0.422 5.729 1.00 0.00 C ATOM 1373 CD2 TYR B 159 7.566 1.899 5.608 1.00 0.00 C ATOM 1374 CE1 TYR B 159 7.071 -0.612 6.638 1.00 0.00 C ATOM 1375 CE2 TYR B 159 6.540 1.717 6.515 1.00 0.00 C ATOM 1376 CZ TYR B 159 6.297 0.460 7.027 1.00 0.00 C ATOM 1377 OH TYR B 159 5.277 0.275 7.932 1.00 0.00 O ATOM 0 H TYR B 159 11.041 3.046 4.468 1.00 0.00 H new ATOM 0 HA TYR B 159 10.815 0.432 5.781 1.00 0.00 H new ATOM 0 HB2 TYR B 159 9.350 2.000 3.713 1.00 0.00 H new ATOM 0 HB3 TYR B 159 9.424 0.271 3.439 1.00 0.00 H new ATOM 0 HD1 TYR B 159 8.699 -1.264 5.426 1.00 0.00 H new ATOM 0 HD2 TYR B 159 7.754 2.885 5.210 1.00 0.00 H new ATOM 0 HE1 TYR B 159 6.879 -1.595 7.041 1.00 0.00 H new ATOM 0 HE2 TYR B 159 5.931 2.555 6.821 1.00 0.00 H new ATOM 0 HH TYR B 159 4.464 0.001 7.458 1.00 0.00 H new ATOM 1387 N ASN B 160 12.785 1.070 3.344 1.00 0.00 N ATOM 1388 CA ASN B 160 13.806 0.549 2.436 1.00 0.00 C ATOM 1389 C ASN B 160 13.285 0.490 1.007 1.00 0.00 C ATOM 1390 O ASN B 160 13.497 -0.490 0.292 1.00 0.00 O ATOM 1391 CB ASN B 160 14.292 -0.831 2.880 1.00 0.00 C ATOM 1392 CG ASN B 160 15.435 -1.347 2.028 1.00 0.00 C ATOM 1393 OD1 ASN B 160 16.294 -0.581 1.593 1.00 0.00 O ATOM 1394 ND2 ASN B 160 15.449 -2.652 1.785 1.00 0.00 N ATOM 0 H ASN B 160 12.842 2.077 3.493 1.00 0.00 H new ATOM 0 HA ASN B 160 14.653 1.235 2.468 1.00 0.00 H new ATOM 0 HB2 ASN B 160 14.612 -0.782 3.921 1.00 0.00 H new ATOM 0 HB3 ASN B 160 13.462 -1.537 2.835 1.00 0.00 H new ATOM 0 HD21 ASN B 160 16.193 -3.057 1.217 1.00 0.00 H new ATOM 0 HD22 ASN B 160 14.716 -3.250 2.166 1.00 0.00 H new ATOM 1401 N ILE B 161 12.609 1.555 0.596 1.00 0.00 N ATOM 1402 CA ILE B 161 12.062 1.645 -0.748 1.00 0.00 C ATOM 1403 C ILE B 161 13.067 2.311 -1.685 1.00 0.00 C ATOM 1404 O ILE B 161 13.640 3.350 -1.357 1.00 0.00 O ATOM 1405 CB ILE B 161 10.737 2.437 -0.751 1.00 0.00 C ATOM 1406 CG1 ILE B 161 9.661 1.667 0.018 1.00 0.00 C ATOM 1407 CG2 ILE B 161 10.275 2.719 -2.176 1.00 0.00 C ATOM 1408 CD1 ILE B 161 8.824 2.542 0.926 1.00 0.00 C ATOM 0 H ILE B 161 12.427 2.372 1.179 1.00 0.00 H new ATOM 0 HA ILE B 161 11.861 0.633 -1.100 1.00 0.00 H new ATOM 0 HB ILE B 161 10.907 3.393 -0.256 1.00 0.00 H new ATOM 0 HG12 ILE B 161 9.006 1.165 -0.694 1.00 0.00 H new ATOM 0 HG13 ILE B 161 10.138 0.890 0.615 1.00 0.00 H new ATOM 0 HG21 ILE B 161 9.340 3.278 -2.151 1.00 0.00 H new ATOM 0 HG22 ILE B 161 11.034 3.304 -2.695 1.00 0.00 H new ATOM 0 HG23 ILE B 161 10.121 1.777 -2.702 1.00 0.00 H new ATOM 0 HD11 ILE B 161 8.082 1.930 1.439 1.00 0.00 H new ATOM 0 HD12 ILE B 161 9.468 3.024 1.662 1.00 0.00 H new ATOM 0 HD13 ILE B 161 8.318 3.303 0.332 1.00 0.00 H new ATOM 1420 N GLN B 162 13.287 1.702 -2.845 1.00 0.00 N ATOM 1421 CA GLN B 162 14.236 2.235 -3.816 1.00 0.00 C ATOM 1422 C GLN B 162 13.521 2.845 -5.018 1.00 0.00 C ATOM 1423 O GLN B 162 12.293 2.924 -5.053 1.00 0.00 O ATOM 1424 CB GLN B 162 15.189 1.134 -4.283 1.00 0.00 C ATOM 1425 CG GLN B 162 15.808 0.342 -3.143 1.00 0.00 C ATOM 1426 CD GLN B 162 16.501 1.228 -2.127 1.00 0.00 C ATOM 1427 OE1 GLN B 162 17.385 2.012 -2.470 1.00 0.00 O ATOM 1428 NE2 GLN B 162 16.101 1.106 -0.866 1.00 0.00 N ATOM 0 H GLN B 162 12.823 0.841 -3.135 1.00 0.00 H new ATOM 0 HA GLN B 162 14.806 3.023 -3.325 1.00 0.00 H new ATOM 0 HB2 GLN B 162 14.648 0.451 -4.938 1.00 0.00 H new ATOM 0 HB3 GLN B 162 15.985 1.582 -4.878 1.00 0.00 H new ATOM 0 HG2 GLN B 162 15.031 -0.238 -2.644 1.00 0.00 H new ATOM 0 HG3 GLN B 162 16.526 -0.370 -3.548 1.00 0.00 H new ATOM 0 HE21 GLN B 162 15.364 0.443 -0.627 1.00 0.00 H new ATOM 0 HE22 GLN B 162 16.531 1.676 -0.137 1.00 0.00 H new ATOM 1437 N LYS B 163 14.306 3.275 -6.000 1.00 0.00 N ATOM 1438 CA LYS B 163 13.762 3.883 -7.209 1.00 0.00 C ATOM 1439 C LYS B 163 13.073 2.839 -8.081 1.00 0.00 C ATOM 1440 O LYS B 163 13.507 1.689 -8.151 1.00 0.00 O ATOM 1441 CB LYS B 163 14.872 4.574 -8.009 1.00 0.00 C ATOM 1442 CG LYS B 163 15.949 5.212 -7.144 1.00 0.00 C ATOM 1443 CD LYS B 163 17.182 4.329 -7.046 1.00 0.00 C ATOM 1444 CE LYS B 163 17.890 4.506 -5.713 1.00 0.00 C ATOM 1445 NZ LYS B 163 18.569 3.256 -5.274 1.00 0.00 N ATOM 0 H LYS B 163 15.324 3.213 -5.982 1.00 0.00 H new ATOM 0 HA LYS B 163 13.025 4.627 -6.906 1.00 0.00 H new ATOM 0 HB2 LYS B 163 15.337 3.844 -8.672 1.00 0.00 H new ATOM 0 HB3 LYS B 163 14.426 5.341 -8.642 1.00 0.00 H new ATOM 0 HG2 LYS B 163 16.226 6.180 -7.561 1.00 0.00 H new ATOM 0 HG3 LYS B 163 15.553 5.397 -6.146 1.00 0.00 H new ATOM 0 HD2 LYS B 163 16.894 3.285 -7.170 1.00 0.00 H new ATOM 0 HD3 LYS B 163 17.868 4.569 -7.858 1.00 0.00 H new ATOM 0 HE2 LYS B 163 18.624 5.308 -5.795 1.00 0.00 H new ATOM 0 HE3 LYS B 163 17.168 4.812 -4.956 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 18.121 2.905 -4.404 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 18.487 2.536 -6.020 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 19.574 3.453 -5.091 1.00 0.00 H new ATOM 1459 N GLU B 164 11.997 3.249 -8.748 1.00 0.00 N ATOM 1460 CA GLU B 164 11.246 2.351 -9.619 1.00 0.00 C ATOM 1461 C GLU B 164 10.542 1.261 -8.816 1.00 0.00 C ATOM 1462 O GLU B 164 10.172 0.221 -9.360 1.00 0.00 O ATOM 1463 CB GLU B 164 12.173 1.719 -10.660 1.00 0.00 C ATOM 1464 CG GLU B 164 11.682 1.880 -12.090 1.00 0.00 C ATOM 1465 CD GLU B 164 10.932 0.661 -12.590 1.00 0.00 C ATOM 1466 OE1 GLU B 164 10.069 0.149 -11.840 1.00 0.00 O ATOM 1467 OE2 GLU B 164 11.209 0.218 -13.720 1.00 0.00 O ATOM 0 H GLU B 164 11.626 4.198 -8.701 1.00 0.00 H new ATOM 0 HA GLU B 164 10.486 2.942 -10.130 1.00 0.00 H new ATOM 0 HB2 GLU B 164 13.163 2.167 -10.572 1.00 0.00 H new ATOM 0 HB3 GLU B 164 12.283 0.657 -10.440 1.00 0.00 H new ATOM 0 HG2 GLU B 164 11.031 2.752 -12.151 1.00 0.00 H new ATOM 0 HG3 GLU B 164 12.533 2.071 -12.743 1.00 0.00 H new ATOM 1474 N SER B 165 10.351 1.505 -7.522 1.00 0.00 N ATOM 1475 CA SER B 165 9.684 0.538 -6.659 1.00 0.00 C ATOM 1476 C SER B 165 8.263 0.278 -7.149 1.00 0.00 C ATOM 1477 O SER B 165 7.782 0.942 -8.067 1.00 0.00 O ATOM 1478 CB SER B 165 9.660 1.040 -5.214 1.00 0.00 C ATOM 1479 OG SER B 165 8.708 0.329 -4.441 1.00 0.00 O ATOM 0 H SER B 165 10.647 2.360 -7.051 1.00 0.00 H new ATOM 0 HA SER B 165 10.242 -0.398 -6.695 1.00 0.00 H new ATOM 0 HB2 SER B 165 10.649 0.928 -4.771 1.00 0.00 H new ATOM 0 HB3 SER B 165 9.423 2.104 -5.200 1.00 0.00 H new ATOM 0 HG SER B 165 8.361 0.911 -3.733 1.00 0.00 H new ATOM 1485 N THR B 166 7.596 -0.693 -6.537 1.00 0.00 N ATOM 1486 CA THR B 166 6.232 -1.038 -6.919 1.00 0.00 C ATOM 1487 C THR B 166 5.370 -1.309 -5.691 1.00 0.00 C ATOM 1488 O THR B 166 5.543 -2.318 -5.007 1.00 0.00 O ATOM 1489 CB THR B 166 6.232 -2.262 -7.835 1.00 0.00 C ATOM 1490 OG1 THR B 166 7.042 -2.035 -8.975 1.00 0.00 O ATOM 1491 CG2 THR B 166 4.851 -2.645 -8.323 1.00 0.00 C ATOM 0 H THR B 166 7.977 -1.255 -5.775 1.00 0.00 H new ATOM 0 HA THR B 166 5.808 -0.189 -7.455 1.00 0.00 H new ATOM 0 HB THR B 166 6.624 -3.077 -7.227 1.00 0.00 H new ATOM 0 HG1 THR B 166 7.030 -2.830 -9.548 1.00 0.00 H new ATOM 0 HG21 THR B 166 4.923 -3.521 -8.968 1.00 0.00 H new ATOM 0 HG22 THR B 166 4.214 -2.875 -7.469 1.00 0.00 H new ATOM 0 HG23 THR B 166 4.420 -1.816 -8.884 1.00 0.00 H new ATOM 1499 N LEU B 167 4.439 -0.401 -5.420 1.00 0.00 N ATOM 1500 CA LEU B 167 3.545 -0.541 -4.278 1.00 0.00 C ATOM 1501 C LEU B 167 2.149 -0.953 -4.733 1.00 0.00 C ATOM 1502 O LEU B 167 1.863 -0.993 -5.930 1.00 0.00 O ATOM 1503 CB LEU B 167 3.471 0.774 -3.499 1.00 0.00 C ATOM 1504 CG LEU B 167 4.791 1.235 -2.880 1.00 0.00 C ATOM 1505 CD1 LEU B 167 5.645 1.952 -3.914 1.00 0.00 C ATOM 1506 CD2 LEU B 167 4.530 2.137 -1.685 1.00 0.00 C ATOM 0 H LEU B 167 4.284 0.440 -5.976 1.00 0.00 H new ATOM 0 HA LEU B 167 3.943 -1.319 -3.627 1.00 0.00 H new ATOM 0 HB2 LEU B 167 3.109 1.555 -4.168 1.00 0.00 H new ATOM 0 HB3 LEU B 167 2.733 0.667 -2.704 1.00 0.00 H new ATOM 0 HG LEU B 167 5.336 0.356 -2.536 1.00 0.00 H new ATOM 0 HD11 LEU B 167 6.580 2.272 -3.455 1.00 0.00 H new ATOM 0 HD12 LEU B 167 5.860 1.275 -4.741 1.00 0.00 H new ATOM 0 HD13 LEU B 167 5.108 2.823 -4.289 1.00 0.00 H new ATOM 0 HD21 LEU B 167 5.480 2.456 -1.256 1.00 0.00 H new ATOM 0 HD22 LEU B 167 3.964 3.012 -2.006 1.00 0.00 H new ATOM 0 HD23 LEU B 167 3.958 1.591 -0.935 1.00 0.00 H new ATOM 1518 N HIS B 168 1.284 -1.258 -3.773 1.00 0.00 N ATOM 1519 CA HIS B 168 -0.082 -1.665 -4.079 1.00 0.00 C ATOM 1520 C HIS B 168 -1.085 -0.833 -3.289 1.00 0.00 C ATOM 1521 O HIS B 168 -1.089 -0.852 -2.058 1.00 0.00 O ATOM 1522 CB HIS B 168 -0.276 -3.151 -3.770 1.00 0.00 C ATOM 1523 CG HIS B 168 0.825 -4.020 -4.293 1.00 0.00 C ATOM 1524 ND1 HIS B 168 0.665 -4.877 -5.362 1.00 0.00 N ATOM 1525 CD2 HIS B 168 2.110 -4.161 -3.890 1.00 0.00 C ATOM 1526 CE1 HIS B 168 1.803 -5.508 -5.593 1.00 0.00 C ATOM 1527 NE2 HIS B 168 2.695 -5.091 -4.714 1.00 0.00 N ATOM 0 H HIS B 168 1.504 -1.231 -2.777 1.00 0.00 H new ATOM 0 HA HIS B 168 -0.256 -1.498 -5.142 1.00 0.00 H new ATOM 0 HB2 HIS B 168 -0.350 -3.283 -2.690 1.00 0.00 H new ATOM 0 HB3 HIS B 168 -1.223 -3.482 -4.197 1.00 0.00 H new ATOM 0 HD2 HIS B 168 2.586 -3.639 -3.073 1.00 0.00 H new ATOM 0 HE1 HIS B 168 1.974 -6.240 -6.369 1.00 0.00 H new ATOM 0 HE2 HIS B 168 3.663 -5.408 -4.656 1.00 0.00 H new ATOM 1536 N LEU B 169 -1.932 -0.100 -4.004 1.00 0.00 N ATOM 1537 CA LEU B 169 -2.936 0.741 -3.372 1.00 0.00 C ATOM 1538 C LEU B 169 -4.202 -0.050 -3.086 1.00 0.00 C ATOM 1539 O LEU B 169 -4.588 -0.934 -3.851 1.00 0.00 O ATOM 1540 CB LEU B 169 -3.248 1.939 -4.268 1.00 0.00 C ATOM 1541 CG LEU B 169 -4.431 2.799 -3.829 1.00 0.00 C ATOM 1542 CD1 LEU B 169 -4.017 3.759 -2.724 1.00 0.00 C ATOM 1543 CD2 LEU B 169 -4.992 3.558 -5.019 1.00 0.00 C ATOM 0 H LEU B 169 -1.941 -0.073 -5.024 1.00 0.00 H new ATOM 0 HA LEU B 169 -2.540 1.100 -2.422 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.362 2.571 -4.321 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.441 1.575 -5.277 1.00 0.00 H new ATOM 0 HG LEU B 169 -5.209 2.147 -3.433 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -4.875 4.362 -2.426 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -3.656 3.192 -1.866 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -3.223 4.412 -3.087 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -5.835 4.169 -4.696 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -4.218 4.201 -5.438 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -5.326 2.850 -5.778 1.00 0.00 H new ATOM 1555 N VAL B 170 -4.833 0.269 -1.966 1.00 0.00 N ATOM 1556 CA VAL B 170 -6.046 -0.411 -1.552 1.00 0.00 C ATOM 1557 C VAL B 170 -7.019 0.560 -0.888 1.00 0.00 C ATOM 1558 O VAL B 170 -6.637 1.333 -0.009 1.00 0.00 O ATOM 1559 CB VAL B 170 -5.705 -1.556 -0.581 1.00 0.00 C ATOM 1560 CG1 VAL B 170 -6.956 -2.124 0.074 1.00 0.00 C ATOM 1561 CG2 VAL B 170 -4.940 -2.648 -1.306 1.00 0.00 C ATOM 0 H VAL B 170 -4.521 0.999 -1.326 1.00 0.00 H new ATOM 0 HA VAL B 170 -6.525 -0.822 -2.441 1.00 0.00 H new ATOM 0 HB VAL B 170 -5.076 -1.149 0.210 1.00 0.00 H new ATOM 0 HG11 VAL B 170 -6.677 -2.930 0.753 1.00 0.00 H new ATOM 0 HG12 VAL B 170 -7.463 -1.338 0.633 1.00 0.00 H new ATOM 0 HG13 VAL B 170 -7.625 -2.512 -0.694 1.00 0.00 H new ATOM 0 HG21 VAL B 170 -4.705 -3.452 -0.609 1.00 0.00 H new ATOM 0 HG22 VAL B 170 -5.550 -3.040 -2.120 1.00 0.00 H new ATOM 0 HG23 VAL B 170 -4.015 -2.237 -1.711 1.00 0.00 H new ATOM 1571 N LEU B 171 -8.276 0.517 -1.313 1.00 0.00 N ATOM 1572 CA LEU B 171 -9.297 1.388 -0.763 1.00 0.00 C ATOM 1573 C LEU B 171 -10.040 0.696 0.374 1.00 0.00 C ATOM 1574 O LEU B 171 -10.650 -0.358 0.180 1.00 0.00 O ATOM 1575 CB LEU B 171 -10.270 1.792 -1.862 1.00 0.00 C ATOM 1576 CG LEU B 171 -9.890 3.049 -2.640 1.00 0.00 C ATOM 1577 CD1 LEU B 171 -10.920 3.356 -3.708 1.00 0.00 C ATOM 1578 CD2 LEU B 171 -9.723 4.232 -1.695 1.00 0.00 C ATOM 0 H LEU B 171 -8.610 -0.116 -2.040 1.00 0.00 H new ATOM 0 HA LEU B 171 -8.819 2.281 -0.361 1.00 0.00 H new ATOM 0 HB2 LEU B 171 -10.363 0.964 -2.565 1.00 0.00 H new ATOM 0 HB3 LEU B 171 -11.253 1.944 -1.416 1.00 0.00 H new ATOM 0 HG LEU B 171 -8.936 2.868 -3.135 1.00 0.00 H new ATOM 0 HD11 LEU B 171 -10.627 4.256 -4.248 1.00 0.00 H new ATOM 0 HD12 LEU B 171 -10.983 2.519 -4.404 1.00 0.00 H new ATOM 0 HD13 LEU B 171 -11.892 3.514 -3.241 1.00 0.00 H new ATOM 0 HD21 LEU B 171 -9.452 5.119 -2.267 1.00 0.00 H new ATOM 0 HD22 LEU B 171 -10.660 4.412 -1.168 1.00 0.00 H new ATOM 0 HD23 LEU B 171 -8.937 4.012 -0.972 1.00 0.00 H new ATOM 1590 N ARG B 172 -9.994 1.294 1.559 1.00 0.00 N ATOM 1591 CA ARG B 172 -10.660 0.734 2.727 1.00 0.00 C ATOM 1592 C ARG B 172 -12.020 1.397 2.943 1.00 0.00 C ATOM 1593 O ARG B 172 -12.120 2.426 3.612 1.00 0.00 O ATOM 1594 CB ARG B 172 -9.797 0.903 3.974 1.00 0.00 C ATOM 1595 CG ARG B 172 -10.260 0.078 5.160 1.00 0.00 C ATOM 1596 CD ARG B 172 -9.745 0.638 6.472 1.00 0.00 C ATOM 1597 NE ARG B 172 -10.720 1.503 7.128 1.00 0.00 N ATOM 1598 CZ ARG B 172 -10.670 1.833 8.416 1.00 0.00 C ATOM 1599 NH1 ARG B 172 -9.701 1.374 9.190 1.00 0.00 N ATOM 1600 NH2 ARG B 172 -11.600 2.624 8.932 1.00 0.00 N ATOM 0 H ARG B 172 -9.501 2.169 1.736 1.00 0.00 H new ATOM 0 HA ARG B 172 -10.812 -0.330 2.548 1.00 0.00 H new ATOM 0 HB2 ARG B 172 -8.770 0.629 3.733 1.00 0.00 H new ATOM 0 HB3 ARG B 172 -9.788 1.955 4.258 1.00 0.00 H new ATOM 0 HG2 ARG B 172 -11.349 0.050 5.180 1.00 0.00 H new ATOM 0 HG3 ARG B 172 -9.916 -0.950 5.044 1.00 0.00 H new ATOM 0 HD2 ARG B 172 -9.487 -0.185 7.139 1.00 0.00 H new ATOM 0 HD3 ARG B 172 -8.829 1.200 6.290 1.00 0.00 H new ATOM 0 HE ARG B 172 -11.485 1.877 6.566 1.00 0.00 H new ATOM 0 HH11 ARG B 172 -8.984 0.762 8.801 1.00 0.00 H new ATOM 0 HH12 ARG B 172 -9.671 1.632 10.176 1.00 0.00 H new ATOM 0 HH21 ARG B 172 -12.353 2.979 8.342 1.00 0.00 H new ATOM 0 HH22 ARG B 172 -11.563 2.878 9.919 1.00 0.00 H new ATOM 1614 N LEU B 173 -13.060 0.804 2.370 1.00 0.00 N ATOM 1615 CA LEU B 173 -14.400 1.331 2.492 1.00 0.00 C ATOM 1616 C LEU B 173 -15.420 0.204 2.601 1.00 0.00 C ATOM 1617 O LEU B 173 -15.100 -0.964 2.387 1.00 0.00 O ATOM 1618 CB LEU B 173 -14.730 2.221 1.294 1.00 0.00 C ATOM 1619 CG LEU B 173 -14.710 1.520 -0.067 1.00 0.00 C ATOM 1620 CD1 LEU B 173 -15.210 2.460 -1.154 1.00 0.00 C ATOM 1621 CD2 LEU B 173 -13.310 1.018 -0.395 1.00 0.00 C ATOM 0 H LEU B 173 -12.993 -0.048 1.814 1.00 0.00 H new ATOM 0 HA LEU B 173 -14.448 1.928 3.403 1.00 0.00 H new ATOM 0 HB2 LEU B 173 -15.718 2.655 1.446 1.00 0.00 H new ATOM 0 HB3 LEU B 173 -14.019 3.047 1.269 1.00 0.00 H new ATOM 0 HG LEU B 173 -15.377 0.659 -0.020 1.00 0.00 H new ATOM 0 HD11 LEU B 173 -15.190 1.947 -2.116 1.00 0.00 H new ATOM 0 HD12 LEU B 173 -16.231 2.767 -0.928 1.00 0.00 H new ATOM 0 HD13 LEU B 173 -14.568 3.340 -1.198 1.00 0.00 H new ATOM 0 HD21 LEU B 173 -13.319 0.523 -1.366 1.00 0.00 H new ATOM 0 HD22 LEU B 173 -12.619 1.860 -0.423 1.00 0.00 H new ATOM 0 HD23 LEU B 173 -12.989 0.311 0.369 1.00 0.00 H new ATOM 1633 N ARG B 174 -16.660 0.563 2.933 1.00 0.00 N ATOM 1634 CA ARG B 174 -17.730 -0.418 3.070 1.00 0.00 C ATOM 1635 C ARG B 174 -17.960 -1.157 1.756 1.00 0.00 C ATOM 1636 O ARG B 174 -17.870 -0.570 0.678 1.00 0.00 O ATOM 1637 CB ARG B 174 -19.020 0.266 3.519 1.00 0.00 C ATOM 1638 CG ARG B 174 -19.440 1.425 2.628 1.00 0.00 C ATOM 1639 CD ARG B 174 -20.490 1.001 1.620 1.00 0.00 C ATOM 1640 NE ARG B 174 -20.360 1.722 0.356 1.00 0.00 N ATOM 1641 CZ ARG B 174 -21.250 1.654 -0.632 1.00 0.00 C ATOM 1642 NH1 ARG B 174 -22.340 0.899 -0.506 1.00 0.00 N ATOM 1643 NH2 ARG B 174 -21.060 2.342 -1.748 1.00 0.00 N ATOM 0 H ARG B 174 -16.946 1.526 3.111 1.00 0.00 H new ATOM 0 HA ARG B 174 -17.431 -1.144 3.826 1.00 0.00 H new ATOM 0 HB2 ARG B 174 -19.822 -0.471 3.543 1.00 0.00 H new ATOM 0 HB3 ARG B 174 -18.892 0.631 4.538 1.00 0.00 H new ATOM 0 HG2 ARG B 174 -19.832 2.235 3.244 1.00 0.00 H new ATOM 0 HG3 ARG B 174 -18.568 1.816 2.104 1.00 0.00 H new ATOM 0 HD2 ARG B 174 -20.404 -0.070 1.437 1.00 0.00 H new ATOM 0 HD3 ARG B 174 -21.482 1.175 2.036 1.00 0.00 H new ATOM 0 HE ARG B 174 -19.539 2.312 0.223 1.00 0.00 H new ATOM 0 HH11 ARG B 174 -22.497 0.369 0.351 1.00 0.00 H new ATOM 0 HH12 ARG B 174 -23.018 0.851 -1.267 1.00 0.00 H new ATOM 0 HH21 ARG B 174 -20.230 2.926 -1.852 1.00 0.00 H new ATOM 0 HH22 ARG B 174 -21.744 2.288 -2.503 1.00 0.00 H new ATOM 1657 N GLY B 175 -18.260 -2.448 1.854 1.00 0.00 N ATOM 1658 CA GLY B 175 -18.500 -3.245 0.665 1.00 0.00 C ATOM 1659 C GLY B 175 -19.030 -4.628 0.992 1.00 0.00 C ATOM 1660 O GLY B 175 -20.190 -4.934 0.728 1.00 0.00 O ATOM 0 H GLY B 175 -18.341 -2.956 2.735 1.00 0.00 H new ATOM 0 HA2 GLY B 175 -19.213 -2.728 0.023 1.00 0.00 H new ATOM 0 HA3 GLY B 175 -17.572 -3.339 0.101 1.00 0.00 H new ATOM 1664 N GLY B 176 -18.170 -5.466 1.567 1.00 0.00 N ATOM 1665 CA GLY B 176 -18.580 -6.814 1.920 1.00 0.00 C ATOM 1666 C GLY B 176 -17.520 -7.845 1.581 1.00 0.00 C ATOM 1667 O GLY B 176 -17.890 -9.016 1.346 1.00 0.00 O ATOM 1668 OXT GLY B 176 -16.330 -7.482 1.549 1.00 0.00 O ATOM 0 H GLY B 176 -17.202 -5.237 1.793 1.00 0.00 H new ATOM 0 HA2 GLY B 176 -18.798 -6.857 2.987 1.00 0.00 H new ATOM 0 HA3 GLY B 176 -19.504 -7.060 1.396 1.00 0.00 H new TER 1672 GLY B 176 HETATM 1673 ZN ZN A 32 -5.408 -7.405 1.080 1.00 0.00 ZN