USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1128 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 71 ASN : amide:sc= 0.268 K(o=2.8,f=2.2) USER MOD Set 1.2: A 73 SER OG : rot 175:sc= 0.786 USER MOD Set 1.3: A 79 SER OG : rot -41:sc= 1.76 USER MOD Set 2.1: A 47 LYS NZ :NH3+ -143:sc= 1.21 (180deg=0) USER MOD Set 2.2: A 114 SER OG : rot 160:sc= 1.04 USER MOD Set 3.1: A 42 SER OG : rot 6:sc= 0.34 USER MOD Set 3.2: A 77 LYS NZ :NH3+ -156:sc= 2.42 (180deg=-0.53) USER MOD Set 4.1: A 38 CYS SG : rot -100:sc= 0.328 USER MOD Set 4.2: A 81 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 16 ASN : amide:sc= 0.401 K(o=0.85,f=0.35) USER MOD Set 5.2: A 145 THR OG1 : rot 67:sc= 0.451 USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 2 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.025) USER MOD Single : A 3 ASN : amide:sc= -0.0142 K(o=-0.014,f=-0.73) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -3 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 170:sc= -0.0619 USER MOD Single : A 14 SER OG : rot 180:sc= -0.482 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -1.4 X(o=-1.4,f=-1.1) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot -96:sc= 1.28 USER MOD Single : A 39 MET CE :methyl -142:sc= -0.0865 (180deg=-1.6) USER MOD Single : A 43 TYR OH : rot -140:sc= -0.122 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -132:sc= 2.38 (180deg=-0.402) USER MOD Single : A 56 ASN : amide:sc= 0.115 K(o=0.12,f=-1.7) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0.118 USER MOD Single : A 61 LYS NZ :NH3+ -130:sc= 1.64 (180deg=0.634) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.0165 USER MOD Single : A 65 ASN : amide:sc= 1.09 K(o=1.1,f=-0.12) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -164:sc= -1.54! USER MOD Single : A 72 THR OG1 : rot 50:sc= 0.0628 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 36:sc= 1.2 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.263 X(o=-0.26,f=0) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 170:sc= -1.03 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= 0.0832 K(o=0.083,f=-9.2!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= 0.129 X(o=0.13,f=-0.13) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 75:sc= 1.11 USER MOD Single : A 129 ASN : amide:sc= -0.218 X(o=-0.22,f=-0.53) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 1.86 (180deg=1.86) USER MOD Single : A 134 LYS NZ :NH3+ -143:sc= 0.973 (180deg=-0.48!) USER MOD Single : A 138 SER OG : rot -160:sc= -0.0407 USER MOD Single : A 139 ASN :FLIP amide:sc= -0.0972 F(o=-1.2,f=-0.097) USER MOD Single : A 141 LYS NZ :NH3+ -149:sc= 0.177 (180deg=0.0592) USER MOD Single : A 143 THR OG1 : rot -48:sc= 1.21 USER MOD Single : A 147 SER OG : rot 140:sc= 0.856 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 48:sc= 0.249 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 -9.187 29.566 16.193 1.00 0.00 N ATOM 2 CA GLY A -3 -8.439 28.364 15.843 1.00 0.00 C ATOM 3 C GLY A -3 -8.888 27.819 14.521 1.00 0.00 C ATOM 4 O GLY A -3 -9.780 26.979 14.464 1.00 0.00 O ATOM 0 H1 GLY A -3 -8.858 29.924 17.112 1.00 0.00 H new ATOM 0 H2 GLY A -3 -9.037 30.293 15.464 1.00 0.00 H new ATOM 0 H3 GLY A -3 -10.200 29.339 16.252 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -7.374 28.593 15.804 1.00 0.00 H new ATOM 0 HA3 GLY A -3 -8.574 27.609 16.617 1.00 0.00 H new ATOM 10 N SER A -2 -8.311 28.316 13.457 1.00 0.00 N ATOM 11 CA SER A -2 -8.642 27.863 12.138 1.00 0.00 C ATOM 12 C SER A -2 -7.650 26.795 11.706 1.00 0.00 C ATOM 13 O SER A -2 -6.536 27.111 11.245 1.00 0.00 O ATOM 14 CB SER A -2 -8.670 29.042 11.173 1.00 0.00 C ATOM 15 OG SER A -2 -9.612 30.018 11.621 1.00 0.00 O ATOM 0 H SER A -2 -7.599 29.046 13.485 1.00 0.00 H new ATOM 0 HA SER A -2 -9.637 27.418 12.135 1.00 0.00 H new ATOM 0 HB2 SER A -2 -7.678 29.488 11.102 1.00 0.00 H new ATOM 0 HB3 SER A -2 -8.937 28.698 10.174 1.00 0.00 H new ATOM 0 HG SER A -2 -9.623 30.773 10.996 1.00 0.00 H new ATOM 21 N ALA A -1 -8.047 25.544 11.934 1.00 0.00 N ATOM 22 CA ALA A -1 -7.264 24.339 11.674 1.00 0.00 C ATOM 23 C ALA A -1 -6.102 24.215 12.662 1.00 0.00 C ATOM 24 O ALA A -1 -6.225 23.513 13.674 1.00 0.00 O ATOM 25 CB ALA A -1 -6.809 24.217 10.207 1.00 0.00 C ATOM 0 H ALA A -1 -8.966 25.334 12.323 1.00 0.00 H new ATOM 0 HA ALA A -1 -7.927 23.489 11.838 1.00 0.00 H new ATOM 0 HB1 ALA A -1 -6.232 23.301 10.080 1.00 0.00 H new ATOM 0 HB2 ALA A -1 -7.683 24.189 9.556 1.00 0.00 H new ATOM 0 HB3 ALA A -1 -6.190 25.075 9.946 1.00 0.00 H new ATOM 31 N SER A 0 -5.001 24.940 12.392 1.00 0.00 N ATOM 32 CA SER A 0 -3.778 24.937 13.220 1.00 0.00 C ATOM 33 C SER A 0 -3.166 23.530 13.352 1.00 0.00 C ATOM 34 O SER A 0 -2.377 23.260 14.255 1.00 0.00 O ATOM 35 CB SER A 0 -4.056 25.572 14.595 1.00 0.00 C ATOM 36 OG SER A 0 -4.461 26.931 14.438 1.00 0.00 O ATOM 0 H SER A 0 -4.934 25.554 11.580 1.00 0.00 H new ATOM 0 HA SER A 0 -3.032 25.546 12.710 1.00 0.00 H new ATOM 0 HB2 SER A 0 -4.834 25.011 15.112 1.00 0.00 H new ATOM 0 HB3 SER A 0 -3.161 25.521 15.215 1.00 0.00 H new ATOM 0 HG SER A 0 -4.637 27.324 15.318 1.00 0.00 H new ATOM 42 N VAL A 1 -3.466 22.683 12.387 1.00 0.00 N ATOM 43 CA VAL A 1 -3.029 21.300 12.404 1.00 0.00 C ATOM 44 C VAL A 1 -1.738 21.140 11.588 1.00 0.00 C ATOM 45 O VAL A 1 -0.961 20.196 11.810 1.00 0.00 O ATOM 46 CB VAL A 1 -4.165 20.346 11.867 1.00 0.00 C ATOM 47 CG1 VAL A 1 -4.510 20.615 10.403 1.00 0.00 C ATOM 48 CG2 VAL A 1 -3.830 18.873 12.093 1.00 0.00 C ATOM 0 H VAL A 1 -4.020 22.934 11.568 1.00 0.00 H new ATOM 0 HA VAL A 1 -2.818 21.015 13.435 1.00 0.00 H new ATOM 0 HB VAL A 1 -5.055 20.575 12.453 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -5.297 19.932 10.083 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -4.855 21.643 10.294 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -3.624 20.462 9.786 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -4.639 18.253 11.708 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -2.905 18.626 11.572 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -3.707 18.687 13.160 1.00 0.00 H new ATOM 58 N LYS A 2 -1.507 22.109 10.674 1.00 0.00 N ATOM 59 CA LYS A 2 -0.377 22.114 9.733 1.00 0.00 C ATOM 60 C LYS A 2 -0.472 20.966 8.741 1.00 0.00 C ATOM 61 O LYS A 2 -1.457 20.216 8.699 1.00 0.00 O ATOM 62 CB LYS A 2 0.995 22.039 10.441 1.00 0.00 C ATOM 63 CG LYS A 2 1.454 23.281 11.158 1.00 0.00 C ATOM 64 CD LYS A 2 2.818 23.029 11.777 1.00 0.00 C ATOM 65 CE LYS A 2 3.392 24.257 12.449 1.00 0.00 C ATOM 66 NZ LYS A 2 2.567 24.729 13.574 1.00 0.00 N ATOM 0 H LYS A 2 -2.115 22.922 10.572 1.00 0.00 H new ATOM 0 HA LYS A 2 -0.444 23.067 9.207 1.00 0.00 H new ATOM 0 HB2 LYS A 2 0.962 21.222 11.162 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.748 21.777 9.698 1.00 0.00 H new ATOM 0 HG2 LYS A 2 1.507 24.118 10.462 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.736 23.555 11.931 1.00 0.00 H new ATOM 0 HD2 LYS A 2 2.737 22.225 12.508 1.00 0.00 H new ATOM 0 HD3 LYS A 2 3.506 22.689 11.003 1.00 0.00 H new ATOM 0 HE2 LYS A 2 4.396 24.033 12.809 1.00 0.00 H new ATOM 0 HE3 LYS A 2 3.488 25.056 11.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 3.048 25.519 14.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 1.644 25.050 13.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 2.425 23.952 14.250 1.00 0.00 H new ATOM 80 N ASN A 3 0.532 20.871 7.924 1.00 0.00 N ATOM 81 CA ASN A 3 0.712 19.763 7.049 1.00 0.00 C ATOM 82 C ASN A 3 1.735 18.903 7.697 1.00 0.00 C ATOM 83 O ASN A 3 2.843 19.358 7.977 1.00 0.00 O ATOM 84 CB ASN A 3 1.185 20.171 5.652 1.00 0.00 C ATOM 85 CG ASN A 3 0.127 20.829 4.794 1.00 0.00 C ATOM 86 OD1 ASN A 3 -0.729 21.568 5.273 1.00 0.00 O ATOM 87 ND2 ASN A 3 0.156 20.543 3.518 1.00 0.00 N ATOM 0 H ASN A 3 1.262 21.579 7.849 1.00 0.00 H new ATOM 0 HA ASN A 3 -0.240 19.254 6.898 1.00 0.00 H new ATOM 0 HB2 ASN A 3 2.028 20.855 5.754 1.00 0.00 H new ATOM 0 HB3 ASN A 3 1.554 19.285 5.135 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -0.545 20.937 2.891 1.00 0.00 H new ATOM 0 HD22 ASN A 3 0.880 19.926 3.150 1.00 0.00 H new ATOM 94 N GLU A 4 1.379 17.700 7.961 1.00 0.00 N ATOM 95 CA GLU A 4 2.205 16.810 8.705 1.00 0.00 C ATOM 96 C GLU A 4 2.982 15.902 7.820 1.00 0.00 C ATOM 97 O GLU A 4 2.569 15.609 6.709 1.00 0.00 O ATOM 98 CB GLU A 4 1.351 16.033 9.682 1.00 0.00 C ATOM 99 CG GLU A 4 0.876 16.875 10.850 1.00 0.00 C ATOM 100 CD GLU A 4 1.991 17.212 11.818 1.00 0.00 C ATOM 101 OE1 GLU A 4 2.980 17.886 11.435 1.00 0.00 O ATOM 102 OE2 GLU A 4 1.900 16.811 12.990 1.00 0.00 O ATOM 0 H GLU A 4 0.492 17.295 7.663 1.00 0.00 H new ATOM 0 HA GLU A 4 2.937 17.397 9.260 1.00 0.00 H new ATOM 0 HB2 GLU A 4 0.486 15.627 9.158 1.00 0.00 H new ATOM 0 HB3 GLU A 4 1.921 15.185 10.060 1.00 0.00 H new ATOM 0 HG2 GLU A 4 0.437 17.798 10.472 1.00 0.00 H new ATOM 0 HG3 GLU A 4 0.088 16.341 11.381 1.00 0.00 H new ATOM 109 N THR A 5 4.105 15.475 8.311 1.00 0.00 N ATOM 110 CA THR A 5 4.956 14.594 7.591 1.00 0.00 C ATOM 111 C THR A 5 4.406 13.169 7.722 1.00 0.00 C ATOM 112 O THR A 5 4.499 12.541 8.784 1.00 0.00 O ATOM 113 CB THR A 5 6.382 14.678 8.156 1.00 0.00 C ATOM 114 OG1 THR A 5 6.755 16.073 8.280 1.00 0.00 O ATOM 115 CG2 THR A 5 7.369 13.981 7.230 1.00 0.00 C ATOM 0 H THR A 5 4.455 15.734 9.233 1.00 0.00 H new ATOM 0 HA THR A 5 4.988 14.873 6.538 1.00 0.00 H new ATOM 0 HB THR A 5 6.407 14.187 9.129 1.00 0.00 H new ATOM 0 HG1 THR A 5 7.664 16.138 8.642 1.00 0.00 H new ATOM 0 HG21 THR A 5 8.373 14.052 7.648 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.092 12.932 7.127 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.349 14.459 6.251 1.00 0.00 H new ATOM 123 N VAL A 6 3.817 12.703 6.660 1.00 0.00 N ATOM 124 CA VAL A 6 3.197 11.417 6.604 1.00 0.00 C ATOM 125 C VAL A 6 4.246 10.380 6.293 1.00 0.00 C ATOM 126 O VAL A 6 4.811 10.361 5.201 1.00 0.00 O ATOM 127 CB VAL A 6 2.089 11.381 5.517 1.00 0.00 C ATOM 128 CG1 VAL A 6 1.420 10.021 5.464 1.00 0.00 C ATOM 129 CG2 VAL A 6 1.056 12.467 5.763 1.00 0.00 C ATOM 0 H VAL A 6 3.754 13.224 5.785 1.00 0.00 H new ATOM 0 HA VAL A 6 2.734 11.207 7.568 1.00 0.00 H new ATOM 0 HB VAL A 6 2.564 11.566 4.553 1.00 0.00 H new ATOM 0 HG11 VAL A 6 0.648 10.025 4.694 1.00 0.00 H new ATOM 0 HG12 VAL A 6 2.163 9.259 5.229 1.00 0.00 H new ATOM 0 HG13 VAL A 6 0.967 9.800 6.431 1.00 0.00 H new ATOM 0 HG21 VAL A 6 0.290 12.422 4.989 1.00 0.00 H new ATOM 0 HG22 VAL A 6 0.595 12.316 6.739 1.00 0.00 H new ATOM 0 HG23 VAL A 6 1.541 13.443 5.738 1.00 0.00 H new ATOM 139 N LYS A 7 4.539 9.565 7.255 1.00 0.00 N ATOM 140 CA LYS A 7 5.507 8.533 7.079 1.00 0.00 C ATOM 141 C LYS A 7 4.841 7.293 6.545 1.00 0.00 C ATOM 142 O LYS A 7 3.813 6.851 7.077 1.00 0.00 O ATOM 143 CB LYS A 7 6.217 8.181 8.381 1.00 0.00 C ATOM 144 CG LYS A 7 6.887 9.341 9.100 1.00 0.00 C ATOM 145 CD LYS A 7 7.772 8.845 10.244 1.00 0.00 C ATOM 146 CE LYS A 7 7.003 8.006 11.253 1.00 0.00 C ATOM 147 NZ LYS A 7 7.873 7.500 12.326 1.00 0.00 N ATOM 0 H LYS A 7 4.115 9.596 8.182 1.00 0.00 H new ATOM 0 HA LYS A 7 6.249 8.908 6.374 1.00 0.00 H new ATOM 0 HB2 LYS A 7 5.493 7.728 9.058 1.00 0.00 H new ATOM 0 HB3 LYS A 7 6.972 7.424 8.169 1.00 0.00 H new ATOM 0 HG2 LYS A 7 7.488 9.912 8.393 1.00 0.00 H new ATOM 0 HG3 LYS A 7 6.127 10.017 9.491 1.00 0.00 H new ATOM 0 HD2 LYS A 7 8.592 8.255 9.835 1.00 0.00 H new ATOM 0 HD3 LYS A 7 8.217 9.700 10.752 1.00 0.00 H new ATOM 0 HE2 LYS A 7 6.203 8.605 11.687 1.00 0.00 H new ATOM 0 HE3 LYS A 7 6.532 7.166 10.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 7.309 6.934 12.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 8.622 6.907 11.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 8.303 8.301 12.831 1.00 0.00 H new ATOM 161 N LEU A 8 5.387 6.760 5.503 1.00 0.00 N ATOM 162 CA LEU A 8 4.942 5.499 4.984 1.00 0.00 C ATOM 163 C LEU A 8 5.842 4.455 5.568 1.00 0.00 C ATOM 164 O LEU A 8 7.068 4.617 5.553 1.00 0.00 O ATOM 165 CB LEU A 8 4.966 5.428 3.434 1.00 0.00 C ATOM 166 CG LEU A 8 3.941 6.282 2.646 1.00 0.00 C ATOM 167 CD1 LEU A 8 2.514 6.006 3.099 1.00 0.00 C ATOM 168 CD2 LEU A 8 4.263 7.763 2.712 1.00 0.00 C ATOM 0 H LEU A 8 6.156 7.183 4.983 1.00 0.00 H new ATOM 0 HA LEU A 8 3.899 5.346 5.262 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.964 5.716 3.103 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.823 4.386 3.146 1.00 0.00 H new ATOM 0 HG LEU A 8 4.019 5.982 1.601 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.824 6.623 2.524 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.279 4.954 2.940 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.416 6.243 4.158 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.519 8.323 2.146 1.00 0.00 H new ATOM 0 HD22 LEU A 8 4.251 8.092 3.751 1.00 0.00 H new ATOM 0 HD23 LEU A 8 5.251 7.940 2.286 1.00 0.00 H new ATOM 180 N SER A 9 5.262 3.436 6.112 1.00 0.00 N ATOM 181 CA SER A 9 5.994 2.416 6.762 1.00 0.00 C ATOM 182 C SER A 9 5.565 1.060 6.227 1.00 0.00 C ATOM 183 O SER A 9 4.408 0.846 5.840 1.00 0.00 O ATOM 184 CB SER A 9 5.786 2.518 8.287 1.00 0.00 C ATOM 185 OG SER A 9 6.582 1.580 9.013 1.00 0.00 O ATOM 0 H SER A 9 4.252 3.293 6.114 1.00 0.00 H new ATOM 0 HA SER A 9 7.059 2.535 6.561 1.00 0.00 H new ATOM 0 HB2 SER A 9 6.030 3.528 8.617 1.00 0.00 H new ATOM 0 HB3 SER A 9 4.734 2.352 8.519 1.00 0.00 H new ATOM 0 HG SER A 9 6.417 1.685 9.973 1.00 0.00 H new ATOM 191 N VAL A 10 6.499 0.180 6.173 1.00 0.00 N ATOM 192 CA VAL A 10 6.311 -1.162 5.709 1.00 0.00 C ATOM 193 C VAL A 10 6.840 -2.116 6.746 1.00 0.00 C ATOM 194 O VAL A 10 7.598 -1.705 7.641 1.00 0.00 O ATOM 195 CB VAL A 10 7.002 -1.425 4.347 1.00 0.00 C ATOM 196 CG1 VAL A 10 6.289 -0.673 3.228 1.00 0.00 C ATOM 197 CG2 VAL A 10 8.468 -1.014 4.413 1.00 0.00 C ATOM 0 H VAL A 10 7.458 0.376 6.461 1.00 0.00 H new ATOM 0 HA VAL A 10 5.243 -1.315 5.555 1.00 0.00 H new ATOM 0 HB VAL A 10 6.946 -2.492 4.131 1.00 0.00 H new ATOM 0 HG11 VAL A 10 6.790 -0.871 2.280 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.253 -1.007 3.168 1.00 0.00 H new ATOM 0 HG13 VAL A 10 6.314 0.397 3.435 1.00 0.00 H new ATOM 0 HG21 VAL A 10 8.943 -1.204 3.450 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.538 0.048 4.649 1.00 0.00 H new ATOM 0 HG23 VAL A 10 8.973 -1.592 5.187 1.00 0.00 H new ATOM 207 N GLY A 11 6.440 -3.343 6.665 1.00 0.00 N ATOM 208 CA GLY A 11 6.894 -4.301 7.609 1.00 0.00 C ATOM 209 C GLY A 11 7.281 -5.565 6.928 1.00 0.00 C ATOM 210 O GLY A 11 7.057 -5.727 5.716 1.00 0.00 O ATOM 0 H GLY A 11 5.801 -3.702 5.955 1.00 0.00 H new ATOM 0 HA2 GLY A 11 7.747 -3.902 8.159 1.00 0.00 H new ATOM 0 HA3 GLY A 11 6.109 -4.500 8.339 1.00 0.00 H new ATOM 214 N THR A 12 7.868 -6.449 7.664 1.00 0.00 N ATOM 215 CA THR A 12 8.306 -7.685 7.126 1.00 0.00 C ATOM 216 C THR A 12 7.464 -8.825 7.673 1.00 0.00 C ATOM 217 O THR A 12 7.412 -9.065 8.890 1.00 0.00 O ATOM 218 CB THR A 12 9.792 -7.912 7.429 1.00 0.00 C ATOM 219 OG1 THR A 12 10.543 -6.777 6.949 1.00 0.00 O ATOM 220 CG2 THR A 12 10.294 -9.172 6.739 1.00 0.00 C ATOM 0 H THR A 12 8.056 -6.330 8.659 1.00 0.00 H new ATOM 0 HA THR A 12 8.184 -7.654 6.043 1.00 0.00 H new ATOM 0 HB THR A 12 9.922 -8.029 8.505 1.00 0.00 H new ATOM 0 HG1 THR A 12 11.465 -6.833 7.277 1.00 0.00 H new ATOM 0 HG21 THR A 12 11.350 -9.315 6.967 1.00 0.00 H new ATOM 0 HG22 THR A 12 9.726 -10.032 7.094 1.00 0.00 H new ATOM 0 HG23 THR A 12 10.165 -9.072 5.661 1.00 0.00 H new ATOM 228 N VAL A 13 6.813 -9.491 6.782 1.00 0.00 N ATOM 229 CA VAL A 13 5.968 -10.603 7.088 1.00 0.00 C ATOM 230 C VAL A 13 6.630 -11.852 6.544 1.00 0.00 C ATOM 231 O VAL A 13 7.524 -11.756 5.715 1.00 0.00 O ATOM 232 CB VAL A 13 4.547 -10.429 6.464 1.00 0.00 C ATOM 233 CG1 VAL A 13 3.823 -9.245 7.094 1.00 0.00 C ATOM 234 CG2 VAL A 13 4.635 -10.231 4.955 1.00 0.00 C ATOM 0 H VAL A 13 6.853 -9.272 5.787 1.00 0.00 H new ATOM 0 HA VAL A 13 5.837 -10.675 8.168 1.00 0.00 H new ATOM 0 HB VAL A 13 3.983 -11.340 6.667 1.00 0.00 H new ATOM 0 HG11 VAL A 13 2.835 -9.142 6.645 1.00 0.00 H new ATOM 0 HG12 VAL A 13 3.719 -9.411 8.166 1.00 0.00 H new ATOM 0 HG13 VAL A 13 4.397 -8.334 6.922 1.00 0.00 H new ATOM 0 HG21 VAL A 13 3.632 -10.112 4.545 1.00 0.00 H new ATOM 0 HG22 VAL A 13 5.224 -9.339 4.739 1.00 0.00 H new ATOM 0 HG23 VAL A 13 5.112 -11.100 4.501 1.00 0.00 H new ATOM 244 N SER A 14 6.241 -12.987 7.018 1.00 0.00 N ATOM 245 CA SER A 14 6.788 -14.223 6.531 1.00 0.00 C ATOM 246 C SER A 14 5.658 -15.106 6.039 1.00 0.00 C ATOM 247 O SER A 14 4.515 -14.963 6.500 1.00 0.00 O ATOM 248 CB SER A 14 7.597 -14.914 7.632 1.00 0.00 C ATOM 249 OG SER A 14 8.627 -14.057 8.114 1.00 0.00 O ATOM 0 H SER A 14 5.539 -13.092 7.750 1.00 0.00 H new ATOM 0 HA SER A 14 7.465 -14.027 5.700 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.937 -15.195 8.453 1.00 0.00 H new ATOM 0 HB3 SER A 14 8.034 -15.834 7.245 1.00 0.00 H new ATOM 0 HG SER A 14 9.132 -14.516 8.818 1.00 0.00 H new ATOM 255 N GLY A 15 5.953 -15.972 5.101 1.00 0.00 N ATOM 256 CA GLY A 15 4.952 -16.844 4.566 1.00 0.00 C ATOM 257 C GLY A 15 5.567 -18.060 3.932 1.00 0.00 C ATOM 258 O GLY A 15 6.786 -18.115 3.737 1.00 0.00 O ATOM 0 H GLY A 15 6.882 -16.087 4.695 1.00 0.00 H new ATOM 0 HA2 GLY A 15 4.272 -17.151 5.361 1.00 0.00 H new ATOM 0 HA3 GLY A 15 4.357 -16.308 3.827 1.00 0.00 H new ATOM 262 N ASN A 16 4.743 -19.015 3.611 1.00 0.00 N ATOM 263 CA ASN A 16 5.173 -20.271 3.009 1.00 0.00 C ATOM 264 C ASN A 16 4.769 -20.297 1.535 1.00 0.00 C ATOM 265 O ASN A 16 3.815 -19.618 1.157 1.00 0.00 O ATOM 266 CB ASN A 16 4.475 -21.419 3.742 1.00 0.00 C ATOM 267 CG ASN A 16 4.862 -21.530 5.206 1.00 0.00 C ATOM 268 OD1 ASN A 16 6.021 -21.333 5.588 1.00 0.00 O ATOM 269 ND2 ASN A 16 3.885 -21.741 6.044 1.00 0.00 N ATOM 0 H ASN A 16 3.735 -18.955 3.757 1.00 0.00 H new ATOM 0 HA ASN A 16 6.256 -20.372 3.086 1.00 0.00 H new ATOM 0 HB2 ASN A 16 3.396 -21.283 3.669 1.00 0.00 H new ATOM 0 HB3 ASN A 16 4.712 -22.357 3.240 1.00 0.00 H new ATOM 0 HD21 ASN A 16 4.066 -21.747 7.048 1.00 0.00 H new ATOM 0 HD22 ASN A 16 2.940 -21.900 5.696 1.00 0.00 H new ATOM 276 N PRO A 17 5.482 -21.053 0.665 1.00 0.00 N ATOM 277 CA PRO A 17 5.106 -21.187 -0.754 1.00 0.00 C ATOM 278 C PRO A 17 3.755 -21.894 -0.894 1.00 0.00 C ATOM 279 O PRO A 17 3.599 -23.051 -0.481 1.00 0.00 O ATOM 280 CB PRO A 17 6.223 -22.053 -1.359 1.00 0.00 C ATOM 281 CG PRO A 17 7.338 -21.987 -0.381 1.00 0.00 C ATOM 282 CD PRO A 17 6.707 -21.814 0.970 1.00 0.00 C ATOM 0 HA PRO A 17 5.003 -20.221 -1.248 1.00 0.00 H new ATOM 0 HB2 PRO A 17 5.889 -23.080 -1.507 1.00 0.00 H new ATOM 0 HB3 PRO A 17 6.531 -21.674 -2.334 1.00 0.00 H new ATOM 0 HG2 PRO A 17 7.939 -22.896 -0.415 1.00 0.00 H new ATOM 0 HG3 PRO A 17 8.005 -21.155 -0.608 1.00 0.00 H new ATOM 0 HD2 PRO A 17 6.481 -22.773 1.437 1.00 0.00 H new ATOM 0 HD3 PRO A 17 7.360 -21.272 1.655 1.00 0.00 H new ATOM 290 N GLY A 18 2.791 -21.199 -1.446 1.00 0.00 N ATOM 291 CA GLY A 18 1.454 -21.728 -1.575 1.00 0.00 C ATOM 292 C GLY A 18 0.501 -21.023 -0.635 1.00 0.00 C ATOM 293 O GLY A 18 -0.721 -21.088 -0.792 1.00 0.00 O ATOM 0 H GLY A 18 2.909 -20.256 -1.817 1.00 0.00 H new ATOM 0 HA2 GLY A 18 1.110 -21.611 -2.603 1.00 0.00 H new ATOM 0 HA3 GLY A 18 1.459 -22.797 -1.360 1.00 0.00 H new ATOM 297 N ASP A 19 1.056 -20.336 0.331 1.00 0.00 N ATOM 298 CA ASP A 19 0.278 -19.630 1.329 1.00 0.00 C ATOM 299 C ASP A 19 -0.006 -18.220 0.843 1.00 0.00 C ATOM 300 O ASP A 19 0.779 -17.650 0.075 1.00 0.00 O ATOM 301 CB ASP A 19 1.037 -19.612 2.667 1.00 0.00 C ATOM 302 CG ASP A 19 0.279 -18.962 3.796 1.00 0.00 C ATOM 303 OD1 ASP A 19 0.667 -17.882 4.240 1.00 0.00 O ATOM 304 OD2 ASP A 19 -0.716 -19.560 4.273 1.00 0.00 O ATOM 0 H ASP A 19 2.065 -20.247 0.452 1.00 0.00 H new ATOM 0 HA ASP A 19 -0.672 -20.141 1.486 1.00 0.00 H new ATOM 0 HB2 ASP A 19 1.279 -20.637 2.949 1.00 0.00 H new ATOM 0 HB3 ASP A 19 1.982 -19.087 2.529 1.00 0.00 H new ATOM 309 N THR A 20 -1.127 -17.681 1.227 1.00 0.00 N ATOM 310 CA THR A 20 -1.481 -16.357 0.838 1.00 0.00 C ATOM 311 C THR A 20 -1.060 -15.387 1.952 1.00 0.00 C ATOM 312 O THR A 20 -1.485 -15.522 3.108 1.00 0.00 O ATOM 313 CB THR A 20 -2.989 -16.272 0.567 1.00 0.00 C ATOM 314 OG1 THR A 20 -3.360 -17.386 -0.272 1.00 0.00 O ATOM 315 CG2 THR A 20 -3.316 -14.995 -0.168 1.00 0.00 C ATOM 0 H THR A 20 -1.816 -18.149 1.816 1.00 0.00 H new ATOM 0 HA THR A 20 -0.965 -16.085 -0.083 1.00 0.00 H new ATOM 0 HB THR A 20 -3.529 -16.292 1.514 1.00 0.00 H new ATOM 0 HG1 THR A 20 -4.322 -17.351 -0.456 1.00 0.00 H new ATOM 0 HG21 THR A 20 -4.389 -14.947 -0.354 1.00 0.00 H new ATOM 0 HG22 THR A 20 -3.014 -14.140 0.436 1.00 0.00 H new ATOM 0 HG23 THR A 20 -2.782 -14.975 -1.118 1.00 0.00 H new ATOM 323 N VAL A 21 -0.235 -14.442 1.609 1.00 0.00 N ATOM 324 CA VAL A 21 0.321 -13.535 2.563 1.00 0.00 C ATOM 325 C VAL A 21 -0.229 -12.124 2.352 1.00 0.00 C ATOM 326 O VAL A 21 -0.352 -11.636 1.220 1.00 0.00 O ATOM 327 CB VAL A 21 1.888 -13.563 2.534 1.00 0.00 C ATOM 328 CG1 VAL A 21 2.451 -13.091 1.199 1.00 0.00 C ATOM 329 CG2 VAL A 21 2.481 -12.777 3.686 1.00 0.00 C ATOM 0 H VAL A 21 0.072 -14.280 0.650 1.00 0.00 H new ATOM 0 HA VAL A 21 0.018 -13.861 3.558 1.00 0.00 H new ATOM 0 HB VAL A 21 2.182 -14.606 2.654 1.00 0.00 H new ATOM 0 HG11 VAL A 21 3.540 -13.129 1.230 1.00 0.00 H new ATOM 0 HG12 VAL A 21 2.088 -13.739 0.401 1.00 0.00 H new ATOM 0 HG13 VAL A 21 2.129 -12.067 1.010 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.569 -12.819 3.633 1.00 0.00 H new ATOM 0 HG22 VAL A 21 2.154 -11.739 3.624 1.00 0.00 H new ATOM 0 HG23 VAL A 21 2.147 -13.207 4.630 1.00 0.00 H new ATOM 339 N LYS A 22 -0.611 -11.513 3.431 1.00 0.00 N ATOM 340 CA LYS A 22 -1.133 -10.185 3.421 1.00 0.00 C ATOM 341 C LYS A 22 -0.074 -9.221 3.951 1.00 0.00 C ATOM 342 O LYS A 22 0.385 -9.355 5.093 1.00 0.00 O ATOM 343 CB LYS A 22 -2.388 -10.143 4.284 1.00 0.00 C ATOM 344 CG LYS A 22 -3.066 -8.787 4.387 1.00 0.00 C ATOM 345 CD LYS A 22 -4.333 -8.870 5.231 1.00 0.00 C ATOM 346 CE LYS A 22 -4.046 -9.304 6.664 1.00 0.00 C ATOM 347 NZ LYS A 22 -5.281 -9.477 7.441 1.00 0.00 N ATOM 0 H LYS A 22 -0.567 -11.933 4.360 1.00 0.00 H new ATOM 0 HA LYS A 22 -1.393 -9.885 2.406 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -3.106 -10.859 3.885 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -2.128 -10.477 5.289 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -2.378 -8.066 4.828 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -3.313 -8.424 3.389 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -4.825 -7.898 5.240 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -5.027 -9.574 4.772 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -3.488 -10.241 6.655 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -3.413 -8.561 7.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -5.043 -9.772 8.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -5.801 -8.577 7.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -5.874 -10.205 6.993 1.00 0.00 H new ATOM 361 N VAL A 23 0.323 -8.293 3.123 1.00 0.00 N ATOM 362 CA VAL A 23 1.315 -7.298 3.480 1.00 0.00 C ATOM 363 C VAL A 23 0.603 -5.976 3.774 1.00 0.00 C ATOM 364 O VAL A 23 0.006 -5.383 2.875 1.00 0.00 O ATOM 365 CB VAL A 23 2.347 -7.074 2.333 1.00 0.00 C ATOM 366 CG1 VAL A 23 3.455 -6.109 2.759 1.00 0.00 C ATOM 367 CG2 VAL A 23 2.939 -8.392 1.868 1.00 0.00 C ATOM 0 H VAL A 23 -0.032 -8.200 2.171 1.00 0.00 H new ATOM 0 HA VAL A 23 1.856 -7.655 4.356 1.00 0.00 H new ATOM 0 HB VAL A 23 1.812 -6.624 1.497 1.00 0.00 H new ATOM 0 HG11 VAL A 23 4.157 -5.975 1.936 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.017 -5.146 3.023 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.981 -6.517 3.622 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.655 -8.207 1.068 1.00 0.00 H new ATOM 0 HG22 VAL A 23 3.445 -8.878 2.702 1.00 0.00 H new ATOM 0 HG23 VAL A 23 2.143 -9.039 1.500 1.00 0.00 H new ATOM 377 N PRO A 24 0.603 -5.525 5.026 1.00 0.00 N ATOM 378 CA PRO A 24 -0.034 -4.281 5.389 1.00 0.00 C ATOM 379 C PRO A 24 0.859 -3.055 5.118 1.00 0.00 C ATOM 380 O PRO A 24 2.009 -2.978 5.575 1.00 0.00 O ATOM 381 CB PRO A 24 -0.311 -4.449 6.890 1.00 0.00 C ATOM 382 CG PRO A 24 0.741 -5.393 7.387 1.00 0.00 C ATOM 383 CD PRO A 24 1.215 -6.200 6.197 1.00 0.00 C ATOM 0 HA PRO A 24 -0.932 -4.094 4.801 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -0.256 -3.492 7.409 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -1.310 -4.849 7.063 1.00 0.00 H new ATOM 0 HG2 PRO A 24 1.570 -4.845 7.835 1.00 0.00 H new ATOM 0 HG3 PRO A 24 0.337 -6.047 8.160 1.00 0.00 H new ATOM 0 HD2 PRO A 24 2.303 -6.206 6.129 1.00 0.00 H new ATOM 0 HD3 PRO A 24 0.895 -7.239 6.269 1.00 0.00 H new ATOM 391 N VAL A 25 0.328 -2.110 4.381 1.00 0.00 N ATOM 392 CA VAL A 25 1.027 -0.873 4.116 1.00 0.00 C ATOM 393 C VAL A 25 0.641 0.073 5.222 1.00 0.00 C ATOM 394 O VAL A 25 -0.516 0.450 5.346 1.00 0.00 O ATOM 395 CB VAL A 25 0.622 -0.252 2.746 1.00 0.00 C ATOM 396 CG1 VAL A 25 1.373 1.052 2.491 1.00 0.00 C ATOM 397 CG2 VAL A 25 0.872 -1.235 1.611 1.00 0.00 C ATOM 0 H VAL A 25 -0.594 -2.174 3.950 1.00 0.00 H new ATOM 0 HA VAL A 25 2.101 -1.057 4.075 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.445 -0.031 2.785 1.00 0.00 H new ATOM 0 HG11 VAL A 25 1.071 1.464 1.528 1.00 0.00 H new ATOM 0 HG12 VAL A 25 1.140 1.767 3.280 1.00 0.00 H new ATOM 0 HG13 VAL A 25 2.446 0.858 2.482 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.582 -0.779 0.664 1.00 0.00 H new ATOM 0 HG22 VAL A 25 1.931 -1.493 1.580 1.00 0.00 H new ATOM 0 HG23 VAL A 25 0.283 -2.137 1.775 1.00 0.00 H new ATOM 407 N THR A 26 1.580 0.421 6.027 1.00 0.00 N ATOM 408 CA THR A 26 1.315 1.181 7.201 1.00 0.00 C ATOM 409 C THR A 26 1.558 2.669 6.935 1.00 0.00 C ATOM 410 O THR A 26 2.536 3.052 6.311 1.00 0.00 O ATOM 411 CB THR A 26 2.219 0.654 8.329 1.00 0.00 C ATOM 412 OG1 THR A 26 2.091 -0.784 8.358 1.00 0.00 O ATOM 413 CG2 THR A 26 1.811 1.218 9.682 1.00 0.00 C ATOM 0 H THR A 26 2.563 0.186 5.891 1.00 0.00 H new ATOM 0 HA THR A 26 0.272 1.074 7.498 1.00 0.00 H new ATOM 0 HB THR A 26 3.247 0.962 8.137 1.00 0.00 H new ATOM 0 HG1 THR A 26 2.659 -1.149 9.068 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.471 0.824 10.455 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.886 2.305 9.661 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.783 0.929 9.902 1.00 0.00 H new ATOM 421 N ILE A 27 0.647 3.481 7.371 1.00 0.00 N ATOM 422 CA ILE A 27 0.739 4.900 7.196 1.00 0.00 C ATOM 423 C ILE A 27 0.746 5.529 8.589 1.00 0.00 C ATOM 424 O ILE A 27 0.008 5.091 9.469 1.00 0.00 O ATOM 425 CB ILE A 27 -0.435 5.425 6.283 1.00 0.00 C ATOM 426 CG1 ILE A 27 -0.317 6.929 6.010 1.00 0.00 C ATOM 427 CG2 ILE A 27 -1.813 5.079 6.860 1.00 0.00 C ATOM 428 CD1 ILE A 27 -1.347 7.460 5.019 1.00 0.00 C ATOM 0 H ILE A 27 -0.192 3.176 7.864 1.00 0.00 H new ATOM 0 HA ILE A 27 1.656 5.181 6.678 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.340 4.906 5.329 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.421 7.468 6.951 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.682 7.142 5.630 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.591 5.460 6.198 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -1.909 3.997 6.948 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -1.920 5.534 7.845 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.199 8.531 4.879 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.230 6.949 4.063 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.350 7.281 5.406 1.00 0.00 H new ATOM 440 N SER A 28 1.630 6.464 8.828 1.00 0.00 N ATOM 441 CA SER A 28 1.762 7.053 10.143 1.00 0.00 C ATOM 442 C SER A 28 1.902 8.572 10.074 1.00 0.00 C ATOM 443 O SER A 28 2.386 9.108 9.079 1.00 0.00 O ATOM 444 CB SER A 28 2.978 6.442 10.844 1.00 0.00 C ATOM 445 OG SER A 28 2.872 5.021 10.891 1.00 0.00 O ATOM 0 H SER A 28 2.272 6.837 8.129 1.00 0.00 H new ATOM 0 HA SER A 28 0.856 6.838 10.709 1.00 0.00 H new ATOM 0 HB2 SER A 28 3.889 6.726 10.317 1.00 0.00 H new ATOM 0 HB3 SER A 28 3.058 6.839 11.856 1.00 0.00 H new ATOM 0 HG SER A 28 3.659 4.649 11.341 1.00 0.00 H new ATOM 451 N GLN A 29 1.435 9.246 11.138 1.00 0.00 N ATOM 452 CA GLN A 29 1.543 10.714 11.330 1.00 0.00 C ATOM 453 C GLN A 29 0.706 11.529 10.362 1.00 0.00 C ATOM 454 O GLN A 29 0.909 12.735 10.208 1.00 0.00 O ATOM 455 CB GLN A 29 2.991 11.197 11.355 1.00 0.00 C ATOM 456 CG GLN A 29 3.795 10.674 12.533 1.00 0.00 C ATOM 457 CD GLN A 29 5.213 11.209 12.572 1.00 0.00 C ATOM 458 OE1 GLN A 29 6.115 10.537 13.053 1.00 0.00 O ATOM 459 NE2 GLN A 29 5.423 12.401 12.073 1.00 0.00 N ATOM 0 H GLN A 29 0.959 8.780 11.911 1.00 0.00 H new ATOM 0 HA GLN A 29 1.117 10.892 12.317 1.00 0.00 H new ATOM 0 HB2 GLN A 29 3.481 10.893 10.430 1.00 0.00 H new ATOM 0 HB3 GLN A 29 3.000 12.287 11.377 1.00 0.00 H new ATOM 0 HG2 GLN A 29 3.287 10.942 13.459 1.00 0.00 H new ATOM 0 HG3 GLN A 29 3.825 9.585 12.489 1.00 0.00 H new ATOM 0 HE21 GLN A 29 4.647 12.933 11.680 1.00 0.00 H new ATOM 0 HE22 GLN A 29 6.363 12.797 12.077 1.00 0.00 H new ATOM 468 N VAL A 30 -0.247 10.896 9.746 1.00 0.00 N ATOM 469 CA VAL A 30 -1.153 11.594 8.898 1.00 0.00 C ATOM 470 C VAL A 30 -2.285 12.178 9.752 1.00 0.00 C ATOM 471 O VAL A 30 -3.098 11.455 10.315 1.00 0.00 O ATOM 472 CB VAL A 30 -1.663 10.709 7.709 1.00 0.00 C ATOM 473 CG1 VAL A 30 -2.249 9.391 8.170 1.00 0.00 C ATOM 474 CG2 VAL A 30 -2.645 11.462 6.819 1.00 0.00 C ATOM 0 H VAL A 30 -0.414 9.892 9.818 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.630 12.420 8.415 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.782 10.474 7.111 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.586 8.820 7.305 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.489 8.823 8.706 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.095 9.580 8.831 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.973 10.812 6.008 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.508 11.770 7.409 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.157 12.343 6.403 1.00 0.00 H new ATOM 484 N SER A 31 -2.228 13.469 9.949 1.00 0.00 N ATOM 485 CA SER A 31 -3.225 14.177 10.724 1.00 0.00 C ATOM 486 C SER A 31 -3.982 15.130 9.796 1.00 0.00 C ATOM 487 O SER A 31 -5.183 15.382 9.961 1.00 0.00 O ATOM 488 CB SER A 31 -2.530 14.939 11.862 1.00 0.00 C ATOM 489 OG SER A 31 -3.447 15.450 12.813 1.00 0.00 O ATOM 0 H SER A 31 -1.488 14.065 9.577 1.00 0.00 H new ATOM 0 HA SER A 31 -3.939 13.482 11.166 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.825 14.275 12.362 1.00 0.00 H new ATOM 0 HB3 SER A 31 -1.950 15.761 11.443 1.00 0.00 H new ATOM 0 HG SER A 31 -2.958 15.925 13.517 1.00 0.00 H new ATOM 495 N THR A 32 -3.263 15.649 8.827 1.00 0.00 N ATOM 496 CA THR A 32 -3.809 16.483 7.804 1.00 0.00 C ATOM 497 C THR A 32 -4.540 15.560 6.824 1.00 0.00 C ATOM 498 O THR A 32 -4.007 14.491 6.507 1.00 0.00 O ATOM 499 CB THR A 32 -2.631 17.145 7.065 1.00 0.00 C ATOM 500 OG1 THR A 32 -1.650 17.566 8.038 1.00 0.00 O ATOM 501 CG2 THR A 32 -3.090 18.351 6.253 1.00 0.00 C ATOM 0 H THR A 32 -2.259 15.494 8.734 1.00 0.00 H new ATOM 0 HA THR A 32 -4.480 17.241 8.208 1.00 0.00 H new ATOM 0 HB THR A 32 -2.201 16.419 6.375 1.00 0.00 H new ATOM 0 HG1 THR A 32 -1.790 18.511 8.256 1.00 0.00 H new ATOM 0 HG21 THR A 32 -2.234 18.794 5.744 1.00 0.00 H new ATOM 0 HG22 THR A 32 -3.826 18.034 5.515 1.00 0.00 H new ATOM 0 HG23 THR A 32 -3.538 19.089 6.919 1.00 0.00 H new ATOM 509 N PRO A 33 -5.782 15.890 6.394 1.00 0.00 N ATOM 510 CA PRO A 33 -6.486 15.079 5.405 1.00 0.00 C ATOM 511 C PRO A 33 -5.680 14.985 4.118 1.00 0.00 C ATOM 512 O PRO A 33 -5.288 16.002 3.525 1.00 0.00 O ATOM 513 CB PRO A 33 -7.797 15.838 5.175 1.00 0.00 C ATOM 514 CG PRO A 33 -7.978 16.632 6.419 1.00 0.00 C ATOM 515 CD PRO A 33 -6.595 17.028 6.846 1.00 0.00 C ATOM 0 HA PRO A 33 -6.648 14.053 5.735 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -7.737 16.481 4.297 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -8.631 15.154 5.013 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -8.599 17.509 6.238 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.474 16.044 7.191 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -6.279 17.962 6.381 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.529 17.170 7.925 1.00 0.00 H new ATOM 523 N VAL A 34 -5.418 13.777 3.714 1.00 0.00 N ATOM 524 CA VAL A 34 -4.629 13.528 2.554 1.00 0.00 C ATOM 525 C VAL A 34 -5.526 13.508 1.312 1.00 0.00 C ATOM 526 O VAL A 34 -6.705 13.159 1.400 1.00 0.00 O ATOM 527 CB VAL A 34 -3.779 12.225 2.711 1.00 0.00 C ATOM 528 CG1 VAL A 34 -4.640 10.992 2.851 1.00 0.00 C ATOM 529 CG2 VAL A 34 -2.766 12.066 1.593 1.00 0.00 C ATOM 0 H VAL A 34 -5.749 12.935 4.186 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.911 14.338 2.429 1.00 0.00 H new ATOM 0 HB VAL A 34 -3.222 12.335 3.641 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -4.003 10.114 2.957 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -5.274 11.089 3.732 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -5.265 10.882 1.965 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -2.199 11.147 1.744 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -3.285 12.019 0.636 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -2.085 12.917 1.595 1.00 0.00 H new ATOM 539 N GLY A 35 -4.985 13.910 0.187 1.00 0.00 N ATOM 540 CA GLY A 35 -5.766 13.997 -1.001 1.00 0.00 C ATOM 541 C GLY A 35 -5.439 12.931 -2.000 1.00 0.00 C ATOM 542 O GLY A 35 -6.320 12.202 -2.424 1.00 0.00 O ATOM 0 H GLY A 35 -4.007 14.180 0.080 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -6.822 13.930 -0.740 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -5.612 14.974 -1.459 1.00 0.00 H new ATOM 546 N LEU A 36 -4.179 12.813 -2.358 1.00 0.00 N ATOM 547 CA LEU A 36 -3.776 11.897 -3.402 1.00 0.00 C ATOM 548 C LEU A 36 -2.585 11.075 -2.930 1.00 0.00 C ATOM 549 O LEU A 36 -1.513 11.616 -2.690 1.00 0.00 O ATOM 550 CB LEU A 36 -3.430 12.721 -4.690 1.00 0.00 C ATOM 551 CG LEU A 36 -3.267 11.987 -6.061 1.00 0.00 C ATOM 552 CD1 LEU A 36 -3.138 13.007 -7.172 1.00 0.00 C ATOM 553 CD2 LEU A 36 -2.049 11.075 -6.102 1.00 0.00 C ATOM 0 H LEU A 36 -3.414 13.342 -1.940 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.585 11.206 -3.637 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -4.209 13.473 -4.814 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.500 13.255 -4.494 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.155 11.369 -6.193 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.024 12.493 -8.126 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -4.032 13.630 -7.199 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -2.265 13.633 -6.991 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -1.988 10.593 -7.078 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.148 11.664 -5.931 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.138 10.314 -5.326 1.00 0.00 H new ATOM 565 N ILE A 37 -2.800 9.797 -2.753 1.00 0.00 N ATOM 566 CA ILE A 37 -1.744 8.862 -2.446 1.00 0.00 C ATOM 567 C ILE A 37 -1.512 8.003 -3.678 1.00 0.00 C ATOM 568 O ILE A 37 -2.411 7.320 -4.129 1.00 0.00 O ATOM 569 CB ILE A 37 -2.152 7.925 -1.291 1.00 0.00 C ATOM 570 CG1 ILE A 37 -2.540 8.731 -0.057 1.00 0.00 C ATOM 571 CG2 ILE A 37 -1.007 6.956 -0.968 1.00 0.00 C ATOM 572 CD1 ILE A 37 -3.195 7.911 1.017 1.00 0.00 C ATOM 0 H ILE A 37 -3.724 9.369 -2.818 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.852 9.417 -2.156 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.021 7.345 -1.603 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.648 9.204 0.353 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.217 9.532 -0.355 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.306 6.299 -0.151 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.777 6.357 -1.850 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -0.123 7.522 -0.674 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.443 8.551 1.863 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -4.106 7.459 0.625 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.512 7.127 1.343 1.00 0.00 H new ATOM 584 N CYS A 38 -0.361 8.065 -4.219 1.00 0.00 N ATOM 585 CA CYS A 38 -0.011 7.277 -5.357 1.00 0.00 C ATOM 586 C CYS A 38 1.179 6.432 -4.988 1.00 0.00 C ATOM 587 O CYS A 38 2.100 6.919 -4.335 1.00 0.00 O ATOM 588 CB CYS A 38 0.314 8.183 -6.547 1.00 0.00 C ATOM 589 SG CYS A 38 0.726 7.303 -8.067 1.00 0.00 S ATOM 0 H CYS A 38 0.388 8.673 -3.886 1.00 0.00 H new ATOM 0 HA CYS A 38 -0.844 6.637 -5.648 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -0.541 8.831 -6.738 1.00 0.00 H new ATOM 0 HB3 CYS A 38 1.150 8.829 -6.278 1.00 0.00 H new ATOM 0 HG CYS A 38 2.017 7.269 -8.212 1.00 0.00 H new ATOM 595 N MET A 39 1.146 5.175 -5.357 1.00 0.00 N ATOM 596 CA MET A 39 2.217 4.253 -5.071 1.00 0.00 C ATOM 597 C MET A 39 2.174 3.101 -6.061 1.00 0.00 C ATOM 598 O MET A 39 1.107 2.593 -6.390 1.00 0.00 O ATOM 599 CB MET A 39 2.140 3.743 -3.607 1.00 0.00 C ATOM 600 CG MET A 39 0.838 3.017 -3.239 1.00 0.00 C ATOM 601 SD MET A 39 0.731 2.571 -1.485 1.00 0.00 S ATOM 602 CE MET A 39 2.184 1.540 -1.278 1.00 0.00 C ATOM 0 H MET A 39 0.368 4.760 -5.869 1.00 0.00 H new ATOM 0 HA MET A 39 3.169 4.772 -5.179 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.977 3.068 -3.429 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.267 4.592 -2.935 1.00 0.00 H new ATOM 0 HG2 MET A 39 -0.009 3.653 -3.496 1.00 0.00 H new ATOM 0 HG3 MET A 39 0.752 2.113 -3.842 1.00 0.00 H new ATOM 0 HE1 MET A 39 1.951 0.714 -0.606 1.00 0.00 H new ATOM 0 HE2 MET A 39 2.491 1.145 -2.246 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.994 2.134 -0.856 1.00 0.00 H new ATOM 612 N ASP A 40 3.308 2.719 -6.554 1.00 0.00 N ATOM 613 CA ASP A 40 3.397 1.633 -7.509 1.00 0.00 C ATOM 614 C ASP A 40 4.166 0.521 -6.867 1.00 0.00 C ATOM 615 O ASP A 40 5.278 0.728 -6.398 1.00 0.00 O ATOM 616 CB ASP A 40 4.080 2.099 -8.797 1.00 0.00 C ATOM 617 CG ASP A 40 4.244 1.008 -9.836 1.00 0.00 C ATOM 618 OD1 ASP A 40 3.368 0.882 -10.727 1.00 0.00 O ATOM 619 OD2 ASP A 40 5.273 0.302 -9.809 1.00 0.00 O ATOM 0 H ASP A 40 4.204 3.143 -6.314 1.00 0.00 H new ATOM 0 HA ASP A 40 2.400 1.288 -7.783 1.00 0.00 H new ATOM 0 HB2 ASP A 40 3.500 2.914 -9.229 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.062 2.502 -8.550 1.00 0.00 H new ATOM 624 N ILE A 41 3.576 -0.625 -6.799 1.00 0.00 N ATOM 625 CA ILE A 41 4.192 -1.729 -6.130 1.00 0.00 C ATOM 626 C ILE A 41 4.813 -2.645 -7.152 1.00 0.00 C ATOM 627 O ILE A 41 4.128 -3.312 -7.914 1.00 0.00 O ATOM 628 CB ILE A 41 3.199 -2.546 -5.200 1.00 0.00 C ATOM 629 CG1 ILE A 41 2.585 -1.678 -4.063 1.00 0.00 C ATOM 630 CG2 ILE A 41 3.898 -3.762 -4.582 1.00 0.00 C ATOM 631 CD1 ILE A 41 1.543 -0.666 -4.496 1.00 0.00 C ATOM 0 H ILE A 41 2.660 -0.826 -7.201 1.00 0.00 H new ATOM 0 HA ILE A 41 4.953 -1.314 -5.469 1.00 0.00 H new ATOM 0 HB ILE A 41 2.386 -2.876 -5.847 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.134 -2.343 -3.327 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.393 -1.147 -3.560 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.195 -4.304 -3.950 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.253 -4.420 -5.375 1.00 0.00 H new ATOM 0 HG23 ILE A 41 4.744 -3.429 -3.981 1.00 0.00 H new ATOM 0 HD11 ILE A 41 1.184 -0.118 -3.625 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.987 0.032 -5.206 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.708 -1.183 -4.969 1.00 0.00 H new ATOM 643 N SER A 42 6.092 -2.633 -7.186 1.00 0.00 N ATOM 644 CA SER A 42 6.843 -3.468 -8.039 1.00 0.00 C ATOM 645 C SER A 42 7.271 -4.680 -7.225 1.00 0.00 C ATOM 646 O SER A 42 7.705 -4.536 -6.082 1.00 0.00 O ATOM 647 CB SER A 42 8.045 -2.683 -8.546 1.00 0.00 C ATOM 648 OG SER A 42 7.620 -1.469 -9.169 1.00 0.00 O ATOM 0 H SER A 42 6.662 -2.022 -6.602 1.00 0.00 H new ATOM 0 HA SER A 42 6.267 -3.801 -8.902 1.00 0.00 H new ATOM 0 HB2 SER A 42 8.717 -2.458 -7.717 1.00 0.00 H new ATOM 0 HB3 SER A 42 8.608 -3.287 -9.258 1.00 0.00 H new ATOM 0 HG SER A 42 6.654 -1.359 -9.046 1.00 0.00 H new ATOM 654 N TYR A 43 7.131 -5.852 -7.765 1.00 0.00 N ATOM 655 CA TYR A 43 7.442 -7.034 -7.005 1.00 0.00 C ATOM 656 C TYR A 43 7.900 -8.136 -7.915 1.00 0.00 C ATOM 657 O TYR A 43 7.772 -8.023 -9.138 1.00 0.00 O ATOM 658 CB TYR A 43 6.223 -7.486 -6.158 1.00 0.00 C ATOM 659 CG TYR A 43 5.046 -8.103 -6.912 1.00 0.00 C ATOM 660 CD1 TYR A 43 4.825 -9.465 -6.839 1.00 0.00 C ATOM 661 CD2 TYR A 43 4.157 -7.338 -7.662 1.00 0.00 C ATOM 662 CE1 TYR A 43 3.764 -10.058 -7.478 1.00 0.00 C ATOM 663 CE2 TYR A 43 3.086 -7.935 -8.318 1.00 0.00 C ATOM 664 CZ TYR A 43 2.899 -9.301 -8.213 1.00 0.00 C ATOM 665 OH TYR A 43 1.826 -9.910 -8.840 1.00 0.00 O ATOM 0 H TYR A 43 6.808 -6.020 -8.718 1.00 0.00 H new ATOM 0 HA TYR A 43 8.254 -6.796 -6.319 1.00 0.00 H new ATOM 0 HB2 TYR A 43 6.572 -8.211 -5.422 1.00 0.00 H new ATOM 0 HB3 TYR A 43 5.856 -6.622 -5.605 1.00 0.00 H new ATOM 0 HD1 TYR A 43 5.504 -10.079 -6.265 1.00 0.00 H new ATOM 0 HD2 TYR A 43 4.301 -6.270 -7.735 1.00 0.00 H new ATOM 0 HE1 TYR A 43 3.614 -11.125 -7.399 1.00 0.00 H new ATOM 0 HE2 TYR A 43 2.405 -7.336 -8.905 1.00 0.00 H new ATOM 0 HH TYR A 43 1.699 -9.516 -9.728 1.00 0.00 H new ATOM 675 N ASP A 44 8.420 -9.195 -7.322 1.00 0.00 N ATOM 676 CA ASP A 44 8.873 -10.352 -8.068 1.00 0.00 C ATOM 677 C ASP A 44 7.643 -11.125 -8.530 1.00 0.00 C ATOM 678 O ASP A 44 7.015 -11.857 -7.752 1.00 0.00 O ATOM 679 CB ASP A 44 9.778 -11.248 -7.202 1.00 0.00 C ATOM 680 CG ASP A 44 10.545 -12.289 -8.009 1.00 0.00 C ATOM 681 OD1 ASP A 44 9.968 -12.927 -8.915 1.00 0.00 O ATOM 682 OD2 ASP A 44 11.747 -12.507 -7.726 1.00 0.00 O ATOM 0 H ASP A 44 8.540 -9.276 -6.312 1.00 0.00 H new ATOM 0 HA ASP A 44 9.463 -10.030 -8.926 1.00 0.00 H new ATOM 0 HB2 ASP A 44 10.488 -10.622 -6.662 1.00 0.00 H new ATOM 0 HB3 ASP A 44 9.168 -11.755 -6.455 1.00 0.00 H new ATOM 687 N ALA A 45 7.292 -10.938 -9.782 1.00 0.00 N ATOM 688 CA ALA A 45 6.076 -11.504 -10.360 1.00 0.00 C ATOM 689 C ALA A 45 6.189 -12.994 -10.639 1.00 0.00 C ATOM 690 O ALA A 45 5.202 -13.644 -10.970 1.00 0.00 O ATOM 691 CB ALA A 45 5.711 -10.762 -11.628 1.00 0.00 C ATOM 0 H ALA A 45 7.841 -10.385 -10.440 1.00 0.00 H new ATOM 0 HA ALA A 45 5.286 -11.382 -9.618 1.00 0.00 H new ATOM 0 HB1 ALA A 45 4.803 -11.191 -12.052 1.00 0.00 H new ATOM 0 HB2 ALA A 45 5.542 -9.710 -11.398 1.00 0.00 H new ATOM 0 HB3 ALA A 45 6.524 -10.850 -12.348 1.00 0.00 H new ATOM 697 N SER A 46 7.373 -13.526 -10.519 1.00 0.00 N ATOM 698 CA SER A 46 7.584 -14.929 -10.747 1.00 0.00 C ATOM 699 C SER A 46 7.486 -15.684 -9.415 1.00 0.00 C ATOM 700 O SER A 46 7.284 -16.908 -9.383 1.00 0.00 O ATOM 701 CB SER A 46 8.967 -15.130 -11.372 1.00 0.00 C ATOM 702 OG SER A 46 9.141 -14.294 -12.528 1.00 0.00 O ATOM 0 H SER A 46 8.212 -13.006 -10.263 1.00 0.00 H new ATOM 0 HA SER A 46 6.824 -15.316 -11.426 1.00 0.00 H new ATOM 0 HB2 SER A 46 9.738 -14.903 -10.636 1.00 0.00 H new ATOM 0 HB3 SER A 46 9.093 -16.175 -11.654 1.00 0.00 H new ATOM 0 HG SER A 46 10.033 -14.441 -12.907 1.00 0.00 H new ATOM 708 N LYS A 47 7.588 -14.937 -8.330 1.00 0.00 N ATOM 709 CA LYS A 47 7.648 -15.499 -7.006 1.00 0.00 C ATOM 710 C LYS A 47 6.339 -15.268 -6.243 1.00 0.00 C ATOM 711 O LYS A 47 5.933 -16.086 -5.413 1.00 0.00 O ATOM 712 CB LYS A 47 8.822 -14.847 -6.292 1.00 0.00 C ATOM 713 CG LYS A 47 9.312 -15.539 -5.054 1.00 0.00 C ATOM 714 CD LYS A 47 10.567 -14.873 -4.565 1.00 0.00 C ATOM 715 CE LYS A 47 11.290 -15.707 -3.537 1.00 0.00 C ATOM 716 NZ LYS A 47 12.568 -15.085 -3.156 1.00 0.00 N ATOM 0 H LYS A 47 7.631 -13.918 -8.350 1.00 0.00 H new ATOM 0 HA LYS A 47 7.786 -16.579 -7.059 1.00 0.00 H new ATOM 0 HB2 LYS A 47 9.652 -14.773 -6.995 1.00 0.00 H new ATOM 0 HB3 LYS A 47 8.538 -13.829 -6.026 1.00 0.00 H new ATOM 0 HG2 LYS A 47 8.546 -15.506 -4.280 1.00 0.00 H new ATOM 0 HG3 LYS A 47 9.506 -16.591 -5.266 1.00 0.00 H new ATOM 0 HD2 LYS A 47 11.230 -14.685 -5.410 1.00 0.00 H new ATOM 0 HD3 LYS A 47 10.318 -13.903 -4.134 1.00 0.00 H new ATOM 0 HE2 LYS A 47 10.662 -15.826 -2.654 1.00 0.00 H new ATOM 0 HE3 LYS A 47 11.472 -16.705 -3.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 13.283 -15.825 -3.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 12.884 -14.449 -3.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 12.441 -14.541 -2.279 1.00 0.00 H new ATOM 730 N PHE A 48 5.679 -14.168 -6.515 1.00 0.00 N ATOM 731 CA PHE A 48 4.426 -13.861 -5.858 1.00 0.00 C ATOM 732 C PHE A 48 3.395 -13.539 -6.903 1.00 0.00 C ATOM 733 O PHE A 48 3.742 -13.206 -8.036 1.00 0.00 O ATOM 734 CB PHE A 48 4.568 -12.662 -4.910 1.00 0.00 C ATOM 735 CG PHE A 48 5.646 -12.805 -3.882 1.00 0.00 C ATOM 736 CD1 PHE A 48 5.467 -13.622 -2.786 1.00 0.00 C ATOM 737 CD2 PHE A 48 6.845 -12.123 -4.021 1.00 0.00 C ATOM 738 CE1 PHE A 48 6.459 -13.759 -1.843 1.00 0.00 C ATOM 739 CE2 PHE A 48 7.839 -12.255 -3.081 1.00 0.00 C ATOM 740 CZ PHE A 48 7.646 -13.077 -1.991 1.00 0.00 C ATOM 0 H PHE A 48 5.988 -13.467 -7.189 1.00 0.00 H new ATOM 0 HA PHE A 48 4.125 -14.728 -5.270 1.00 0.00 H new ATOM 0 HB2 PHE A 48 4.765 -11.769 -5.502 1.00 0.00 H new ATOM 0 HB3 PHE A 48 3.617 -12.503 -4.401 1.00 0.00 H new ATOM 0 HD1 PHE A 48 4.538 -14.160 -2.667 1.00 0.00 H new ATOM 0 HD2 PHE A 48 6.999 -11.482 -4.876 1.00 0.00 H new ATOM 0 HE1 PHE A 48 6.307 -14.401 -0.988 1.00 0.00 H new ATOM 0 HE2 PHE A 48 8.768 -11.717 -3.196 1.00 0.00 H new ATOM 0 HZ PHE A 48 8.427 -13.186 -1.253 1.00 0.00 H new ATOM 750 N THR A 49 2.152 -13.675 -6.559 1.00 0.00 N ATOM 751 CA THR A 49 1.087 -13.330 -7.450 1.00 0.00 C ATOM 752 C THR A 49 -0.013 -12.610 -6.663 1.00 0.00 C ATOM 753 O THR A 49 -0.652 -13.208 -5.791 1.00 0.00 O ATOM 754 CB THR A 49 0.512 -14.601 -8.124 1.00 0.00 C ATOM 755 OG1 THR A 49 1.595 -15.405 -8.627 1.00 0.00 O ATOM 756 CG2 THR A 49 -0.383 -14.216 -9.295 1.00 0.00 C ATOM 0 H THR A 49 1.846 -14.028 -5.652 1.00 0.00 H new ATOM 0 HA THR A 49 1.470 -12.672 -8.230 1.00 0.00 H new ATOM 0 HB THR A 49 -0.067 -15.157 -7.386 1.00 0.00 H new ATOM 0 HG1 THR A 49 1.234 -16.211 -9.053 1.00 0.00 H new ATOM 0 HG21 THR A 49 -0.781 -15.118 -9.761 1.00 0.00 H new ATOM 0 HG22 THR A 49 -1.207 -13.599 -8.936 1.00 0.00 H new ATOM 0 HG23 THR A 49 0.198 -13.655 -10.028 1.00 0.00 H new ATOM 764 N VAL A 50 -0.188 -11.328 -6.926 1.00 0.00 N ATOM 765 CA VAL A 50 -1.223 -10.540 -6.258 1.00 0.00 C ATOM 766 C VAL A 50 -2.604 -10.950 -6.769 1.00 0.00 C ATOM 767 O VAL A 50 -2.776 -11.245 -7.967 1.00 0.00 O ATOM 768 CB VAL A 50 -0.999 -8.992 -6.461 1.00 0.00 C ATOM 769 CG1 VAL A 50 -1.118 -8.573 -7.931 1.00 0.00 C ATOM 770 CG2 VAL A 50 -1.936 -8.161 -5.584 1.00 0.00 C ATOM 0 H VAL A 50 0.372 -10.804 -7.598 1.00 0.00 H new ATOM 0 HA VAL A 50 -1.161 -10.743 -5.189 1.00 0.00 H new ATOM 0 HB VAL A 50 0.025 -8.790 -6.146 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.956 -7.499 -8.017 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.370 -9.102 -8.522 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.113 -8.820 -8.300 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -1.749 -7.101 -5.754 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.971 -8.392 -5.836 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -1.757 -8.397 -4.535 1.00 0.00 H new ATOM 780 N LYS A 51 -3.560 -11.048 -5.880 1.00 0.00 N ATOM 781 CA LYS A 51 -4.904 -11.327 -6.319 1.00 0.00 C ATOM 782 C LYS A 51 -5.609 -10.012 -6.446 1.00 0.00 C ATOM 783 O LYS A 51 -6.120 -9.656 -7.506 1.00 0.00 O ATOM 784 CB LYS A 51 -5.708 -12.169 -5.333 1.00 0.00 C ATOM 785 CG LYS A 51 -4.944 -13.189 -4.536 1.00 0.00 C ATOM 786 CD LYS A 51 -5.862 -14.257 -3.906 1.00 0.00 C ATOM 787 CE LYS A 51 -7.186 -13.737 -3.325 1.00 0.00 C ATOM 788 NZ LYS A 51 -7.047 -12.610 -2.376 1.00 0.00 N ATOM 0 H LYS A 51 -3.439 -10.942 -4.873 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.834 -11.887 -7.252 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.204 -11.494 -4.635 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -6.491 -12.687 -5.887 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.214 -13.677 -5.182 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.385 -12.685 -3.748 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -6.088 -15.008 -4.663 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -5.311 -14.761 -3.112 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -7.829 -13.424 -4.147 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -7.692 -14.559 -2.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.608 -12.804 -1.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -6.047 -12.498 -2.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -7.388 -11.735 -2.823 1.00 0.00 H new ATOM 802 N ASP A 52 -5.573 -9.282 -5.363 1.00 0.00 N ATOM 803 CA ASP A 52 -6.251 -8.034 -5.209 1.00 0.00 C ATOM 804 C ASP A 52 -5.643 -7.352 -4.022 1.00 0.00 C ATOM 805 O ASP A 52 -4.760 -7.922 -3.365 1.00 0.00 O ATOM 806 CB ASP A 52 -7.759 -8.268 -4.947 1.00 0.00 C ATOM 807 CG ASP A 52 -8.045 -8.974 -3.618 1.00 0.00 C ATOM 808 OD1 ASP A 52 -7.753 -10.190 -3.488 1.00 0.00 O ATOM 809 OD2 ASP A 52 -8.597 -8.341 -2.704 1.00 0.00 O ATOM 0 H ASP A 52 -5.047 -9.557 -4.533 1.00 0.00 H new ATOM 0 HA ASP A 52 -6.152 -7.432 -6.112 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -8.275 -7.308 -4.958 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -8.174 -8.862 -5.762 1.00 0.00 H new ATOM 814 N VAL A 53 -6.071 -6.159 -3.756 1.00 0.00 N ATOM 815 CA VAL A 53 -5.608 -5.434 -2.611 1.00 0.00 C ATOM 816 C VAL A 53 -6.817 -4.963 -1.831 1.00 0.00 C ATOM 817 O VAL A 53 -7.831 -4.566 -2.423 1.00 0.00 O ATOM 818 CB VAL A 53 -4.670 -4.229 -2.986 1.00 0.00 C ATOM 819 CG1 VAL A 53 -3.419 -4.717 -3.704 1.00 0.00 C ATOM 820 CG2 VAL A 53 -5.388 -3.194 -3.842 1.00 0.00 C ATOM 0 H VAL A 53 -6.752 -5.657 -4.326 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.996 -6.099 -2.002 1.00 0.00 H new ATOM 0 HB VAL A 53 -4.380 -3.750 -2.051 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -2.787 -3.865 -3.953 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.870 -5.399 -3.055 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -3.704 -5.237 -4.619 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.704 -2.379 -4.078 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.730 -3.660 -4.766 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.245 -2.801 -3.295 1.00 0.00 H new ATOM 830 N LEU A 54 -6.749 -5.061 -0.544 1.00 0.00 N ATOM 831 CA LEU A 54 -7.842 -4.654 0.299 1.00 0.00 C ATOM 832 C LEU A 54 -7.587 -3.256 0.802 1.00 0.00 C ATOM 833 O LEU A 54 -6.597 -3.022 1.494 1.00 0.00 O ATOM 834 CB LEU A 54 -8.002 -5.603 1.493 1.00 0.00 C ATOM 835 CG LEU A 54 -8.331 -7.063 1.181 1.00 0.00 C ATOM 836 CD1 LEU A 54 -8.314 -7.884 2.458 1.00 0.00 C ATOM 837 CD2 LEU A 54 -9.690 -7.168 0.513 1.00 0.00 C ATOM 0 H LEU A 54 -5.939 -5.424 -0.041 1.00 0.00 H new ATOM 0 HA LEU A 54 -8.760 -4.683 -0.287 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.077 -5.580 2.070 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -8.789 -5.209 2.136 1.00 0.00 H new ATOM 0 HG LEU A 54 -7.576 -7.452 0.498 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -8.549 -8.923 2.226 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.325 -7.829 2.913 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -9.055 -7.491 3.153 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -9.910 -8.214 0.297 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -10.454 -6.766 1.178 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -9.683 -6.599 -0.417 1.00 0.00 H new ATOM 849 N PRO A 55 -8.425 -2.295 0.439 1.00 0.00 N ATOM 850 CA PRO A 55 -8.281 -0.948 0.929 1.00 0.00 C ATOM 851 C PRO A 55 -8.822 -0.859 2.347 1.00 0.00 C ATOM 852 O PRO A 55 -9.860 -1.468 2.668 1.00 0.00 O ATOM 853 CB PRO A 55 -9.146 -0.124 -0.029 1.00 0.00 C ATOM 854 CG PRO A 55 -10.213 -1.065 -0.488 1.00 0.00 C ATOM 855 CD PRO A 55 -9.595 -2.441 -0.470 1.00 0.00 C ATOM 0 HA PRO A 55 -7.247 -0.605 0.962 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -9.574 0.744 0.472 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.560 0.249 -0.869 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -11.081 -1.019 0.169 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -10.557 -0.806 -1.489 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -10.297 -3.189 -0.101 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -9.289 -2.755 -1.468 1.00 0.00 H new ATOM 863 N ASN A 56 -8.128 -0.171 3.209 1.00 0.00 N ATOM 864 CA ASN A 56 -8.648 0.015 4.536 1.00 0.00 C ATOM 865 C ASN A 56 -9.744 1.049 4.480 1.00 0.00 C ATOM 866 O ASN A 56 -9.491 2.239 4.279 1.00 0.00 O ATOM 867 CB ASN A 56 -7.566 0.390 5.549 1.00 0.00 C ATOM 868 CG ASN A 56 -8.130 0.651 6.942 1.00 0.00 C ATOM 869 OD1 ASN A 56 -9.163 0.107 7.325 1.00 0.00 O ATOM 870 ND2 ASN A 56 -7.455 1.452 7.705 1.00 0.00 N ATOM 0 H ASN A 56 -7.223 0.261 3.025 1.00 0.00 H new ATOM 0 HA ASN A 56 -9.053 -0.933 4.888 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -6.831 -0.413 5.604 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -7.041 1.280 5.201 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -7.778 1.646 8.653 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -6.601 1.888 7.358 1.00 0.00 H new ATOM 877 N THR A 57 -10.953 0.573 4.648 1.00 0.00 N ATOM 878 CA THR A 57 -12.155 1.345 4.538 1.00 0.00 C ATOM 879 C THR A 57 -12.346 2.322 5.701 1.00 0.00 C ATOM 880 O THR A 57 -13.238 3.183 5.674 1.00 0.00 O ATOM 881 CB THR A 57 -13.337 0.386 4.398 1.00 0.00 C ATOM 882 OG1 THR A 57 -13.086 -0.771 5.233 1.00 0.00 O ATOM 883 CG2 THR A 57 -13.497 -0.057 2.949 1.00 0.00 C ATOM 0 H THR A 57 -11.128 -0.406 4.875 1.00 0.00 H new ATOM 0 HA THR A 57 -12.085 1.974 3.651 1.00 0.00 H new ATOM 0 HB THR A 57 -14.253 0.889 4.706 1.00 0.00 H new ATOM 0 HG1 THR A 57 -13.836 -1.398 5.157 1.00 0.00 H new ATOM 0 HG21 THR A 57 -14.343 -0.739 2.868 1.00 0.00 H new ATOM 0 HG22 THR A 57 -13.673 0.815 2.319 1.00 0.00 H new ATOM 0 HG23 THR A 57 -12.590 -0.564 2.621 1.00 0.00 H new ATOM 891 N ASP A 58 -11.504 2.186 6.720 1.00 0.00 N ATOM 892 CA ASP A 58 -11.488 3.121 7.831 1.00 0.00 C ATOM 893 C ASP A 58 -10.900 4.427 7.344 1.00 0.00 C ATOM 894 O ASP A 58 -11.308 5.513 7.754 1.00 0.00 O ATOM 895 CB ASP A 58 -10.661 2.577 8.996 1.00 0.00 C ATOM 896 CG ASP A 58 -10.702 3.475 10.213 1.00 0.00 C ATOM 897 OD1 ASP A 58 -9.665 4.077 10.587 1.00 0.00 O ATOM 898 OD2 ASP A 58 -11.778 3.581 10.832 1.00 0.00 O ATOM 0 H ASP A 58 -10.822 1.432 6.796 1.00 0.00 H new ATOM 0 HA ASP A 58 -12.506 3.272 8.191 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.030 1.588 9.267 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -9.627 2.454 8.675 1.00 0.00 H new ATOM 903 N LEU A 59 -9.976 4.311 6.412 1.00 0.00 N ATOM 904 CA LEU A 59 -9.352 5.456 5.826 1.00 0.00 C ATOM 905 C LEU A 59 -10.068 5.811 4.546 1.00 0.00 C ATOM 906 O LEU A 59 -10.778 6.813 4.496 1.00 0.00 O ATOM 907 CB LEU A 59 -7.865 5.207 5.549 1.00 0.00 C ATOM 908 CG LEU A 59 -6.997 4.843 6.750 1.00 0.00 C ATOM 909 CD1 LEU A 59 -5.541 4.821 6.361 1.00 0.00 C ATOM 910 CD2 LEU A 59 -7.223 5.788 7.907 1.00 0.00 C ATOM 0 H LEU A 59 -9.644 3.418 6.047 1.00 0.00 H new ATOM 0 HA LEU A 59 -9.419 6.285 6.531 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -7.785 4.405 4.815 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.450 6.103 5.088 1.00 0.00 H new ATOM 0 HG LEU A 59 -7.288 3.845 7.078 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.936 4.560 7.229 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.386 4.082 5.575 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.247 5.805 5.997 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.588 5.497 8.744 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.976 6.804 7.600 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -8.268 5.745 8.213 1.00 0.00 H new ATOM 922 N VAL A 60 -9.939 4.938 3.560 1.00 0.00 N ATOM 923 CA VAL A 60 -10.501 5.126 2.228 1.00 0.00 C ATOM 924 C VAL A 60 -12.002 4.897 2.305 1.00 0.00 C ATOM 925 O VAL A 60 -12.455 3.790 2.631 1.00 0.00 O ATOM 926 CB VAL A 60 -9.860 4.113 1.224 1.00 0.00 C ATOM 927 CG1 VAL A 60 -10.337 4.355 -0.196 1.00 0.00 C ATOM 928 CG2 VAL A 60 -8.336 4.167 1.289 1.00 0.00 C ATOM 0 H VAL A 60 -9.430 4.060 3.663 1.00 0.00 H new ATOM 0 HA VAL A 60 -10.292 6.137 1.877 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.184 3.116 1.521 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.870 3.632 -0.865 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.420 4.243 -0.240 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -10.064 5.364 -0.505 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.916 3.453 0.581 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.996 5.171 1.036 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -8.006 3.916 2.297 1.00 0.00 H new ATOM 938 N LYS A 61 -12.772 5.919 2.046 1.00 0.00 N ATOM 939 CA LYS A 61 -14.190 5.819 2.212 1.00 0.00 C ATOM 940 C LYS A 61 -14.900 5.889 0.882 1.00 0.00 C ATOM 941 O LYS A 61 -14.477 6.606 -0.014 1.00 0.00 O ATOM 942 CB LYS A 61 -14.682 6.882 3.193 1.00 0.00 C ATOM 943 CG LYS A 61 -14.012 6.770 4.563 1.00 0.00 C ATOM 944 CD LYS A 61 -14.448 7.850 5.541 1.00 0.00 C ATOM 945 CE LYS A 61 -13.701 7.738 6.840 1.00 0.00 C ATOM 946 NZ LYS A 61 -12.240 7.979 6.684 1.00 0.00 N ATOM 0 H LYS A 61 -12.439 6.827 1.720 1.00 0.00 H new ATOM 0 HA LYS A 61 -14.428 4.844 2.638 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -14.490 7.871 2.778 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -15.762 6.790 3.312 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -14.236 5.792 4.990 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -12.931 6.821 4.435 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -14.276 8.833 5.103 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -15.519 7.767 5.726 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -14.109 8.455 7.552 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -13.859 6.745 7.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -11.710 7.209 7.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -12.000 8.012 5.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -11.988 8.884 7.130 1.00 0.00 H new ATOM 960 N ASP A 62 -15.960 5.085 0.775 1.00 0.00 N ATOM 961 CA ASP A 62 -16.801 4.920 -0.425 1.00 0.00 C ATOM 962 C ASP A 62 -15.970 4.732 -1.678 1.00 0.00 C ATOM 963 O ASP A 62 -15.753 5.670 -2.447 1.00 0.00 O ATOM 964 CB ASP A 62 -17.815 6.044 -0.622 1.00 0.00 C ATOM 965 CG ASP A 62 -18.949 5.605 -1.526 1.00 0.00 C ATOM 966 OD1 ASP A 62 -19.952 5.060 -1.003 1.00 0.00 O ATOM 967 OD2 ASP A 62 -18.878 5.783 -2.747 1.00 0.00 O ATOM 0 H ASP A 62 -16.274 4.504 1.552 1.00 0.00 H new ATOM 0 HA ASP A 62 -17.373 4.009 -0.246 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -18.215 6.351 0.345 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -17.319 6.914 -1.052 1.00 0.00 H new ATOM 972 N THR A 63 -15.501 3.524 -1.881 1.00 0.00 N ATOM 973 CA THR A 63 -14.597 3.217 -2.974 1.00 0.00 C ATOM 974 C THR A 63 -15.264 3.343 -4.355 1.00 0.00 C ATOM 975 O THR A 63 -14.582 3.475 -5.379 1.00 0.00 O ATOM 976 CB THR A 63 -13.960 1.837 -2.763 1.00 0.00 C ATOM 977 OG1 THR A 63 -14.993 0.876 -2.476 1.00 0.00 O ATOM 978 CG2 THR A 63 -12.978 1.883 -1.595 1.00 0.00 C ATOM 0 H THR A 63 -15.733 2.722 -1.295 1.00 0.00 H new ATOM 0 HA THR A 63 -13.805 3.966 -2.966 1.00 0.00 H new ATOM 0 HB THR A 63 -13.424 1.550 -3.668 1.00 0.00 H new ATOM 0 HG1 THR A 63 -14.590 -0.007 -2.342 1.00 0.00 H new ATOM 0 HG21 THR A 63 -12.533 0.898 -1.455 1.00 0.00 H new ATOM 0 HG22 THR A 63 -12.193 2.609 -1.808 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.506 2.175 -0.687 1.00 0.00 H new ATOM 986 N ASP A 64 -16.600 3.338 -4.352 1.00 0.00 N ATOM 987 CA ASP A 64 -17.424 3.531 -5.551 1.00 0.00 C ATOM 988 C ASP A 64 -17.258 4.957 -6.085 1.00 0.00 C ATOM 989 O ASP A 64 -17.375 5.213 -7.278 1.00 0.00 O ATOM 990 CB ASP A 64 -18.891 3.252 -5.220 1.00 0.00 C ATOM 991 CG ASP A 64 -19.830 3.479 -6.382 1.00 0.00 C ATOM 992 OD1 ASP A 64 -20.483 4.542 -6.440 1.00 0.00 O ATOM 993 OD2 ASP A 64 -19.950 2.592 -7.249 1.00 0.00 O ATOM 0 H ASP A 64 -17.149 3.198 -3.504 1.00 0.00 H new ATOM 0 HA ASP A 64 -17.098 2.835 -6.324 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -18.988 2.220 -4.882 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -19.194 3.889 -4.389 1.00 0.00 H new ATOM 998 N ASN A 65 -16.912 5.869 -5.193 1.00 0.00 N ATOM 999 CA ASN A 65 -16.624 7.263 -5.542 1.00 0.00 C ATOM 1000 C ASN A 65 -15.187 7.439 -5.991 1.00 0.00 C ATOM 1001 O ASN A 65 -14.631 8.513 -5.876 1.00 0.00 O ATOM 1002 CB ASN A 65 -16.925 8.202 -4.373 1.00 0.00 C ATOM 1003 CG ASN A 65 -18.296 8.820 -4.464 1.00 0.00 C ATOM 1004 OD1 ASN A 65 -18.462 9.901 -5.026 1.00 0.00 O ATOM 1005 ND2 ASN A 65 -19.275 8.175 -3.927 1.00 0.00 N ATOM 0 H ASN A 65 -16.820 5.669 -4.197 1.00 0.00 H new ATOM 0 HA ASN A 65 -17.278 7.524 -6.374 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -16.841 7.649 -3.437 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -16.175 8.993 -4.345 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -20.219 8.560 -3.961 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -19.105 7.280 -3.468 1.00 0.00 H new ATOM 1012 N TYR A 66 -14.627 6.369 -6.550 1.00 0.00 N ATOM 1013 CA TYR A 66 -13.275 6.294 -7.096 1.00 0.00 C ATOM 1014 C TYR A 66 -12.185 6.774 -6.139 1.00 0.00 C ATOM 1015 O TYR A 66 -11.275 7.485 -6.514 1.00 0.00 O ATOM 1016 CB TYR A 66 -13.133 6.857 -8.560 1.00 0.00 C ATOM 1017 CG TYR A 66 -13.396 8.349 -8.788 1.00 0.00 C ATOM 1018 CD1 TYR A 66 -14.679 8.828 -9.007 1.00 0.00 C ATOM 1019 CD2 TYR A 66 -12.349 9.266 -8.808 1.00 0.00 C ATOM 1020 CE1 TYR A 66 -14.912 10.168 -9.232 1.00 0.00 C ATOM 1021 CE2 TYR A 66 -12.574 10.607 -9.029 1.00 0.00 C ATOM 1022 CZ TYR A 66 -13.861 11.053 -9.241 1.00 0.00 C ATOM 1023 OH TYR A 66 -14.099 12.394 -9.486 1.00 0.00 O ATOM 0 H TYR A 66 -15.130 5.486 -6.639 1.00 0.00 H new ATOM 0 HA TYR A 66 -13.094 5.224 -7.201 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -12.122 6.640 -8.904 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -13.814 6.297 -9.200 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -15.511 8.139 -9.001 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -11.339 8.919 -8.647 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -15.918 10.521 -9.401 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -11.749 11.303 -9.036 1.00 0.00 H new ATOM 0 HH TYR A 66 -13.253 12.887 -9.457 1.00 0.00 H new ATOM 1033 N SER A 67 -12.296 6.367 -4.898 1.00 0.00 N ATOM 1034 CA SER A 67 -11.258 6.614 -3.927 1.00 0.00 C ATOM 1035 C SER A 67 -10.218 5.483 -4.008 1.00 0.00 C ATOM 1036 O SER A 67 -9.083 5.590 -3.524 1.00 0.00 O ATOM 1037 CB SER A 67 -11.896 6.722 -2.544 1.00 0.00 C ATOM 1038 OG SER A 67 -12.866 5.710 -2.365 1.00 0.00 O ATOM 0 H SER A 67 -13.102 5.859 -4.534 1.00 0.00 H new ATOM 0 HA SER A 67 -10.740 7.552 -4.129 1.00 0.00 H new ATOM 0 HB2 SER A 67 -11.128 6.637 -1.775 1.00 0.00 H new ATOM 0 HB3 SER A 67 -12.358 7.702 -2.426 1.00 0.00 H new ATOM 0 HG SER A 67 -13.438 5.936 -1.602 1.00 0.00 H new ATOM 1044 N PHE A 68 -10.633 4.428 -4.680 1.00 0.00 N ATOM 1045 CA PHE A 68 -9.868 3.238 -4.907 1.00 0.00 C ATOM 1046 C PHE A 68 -9.519 3.169 -6.387 1.00 0.00 C ATOM 1047 O PHE A 68 -10.400 2.976 -7.217 1.00 0.00 O ATOM 1048 CB PHE A 68 -10.750 2.033 -4.506 1.00 0.00 C ATOM 1049 CG PHE A 68 -10.190 0.646 -4.737 1.00 0.00 C ATOM 1050 CD1 PHE A 68 -9.343 0.068 -3.820 1.00 0.00 C ATOM 1051 CD2 PHE A 68 -10.560 -0.091 -5.857 1.00 0.00 C ATOM 1052 CE1 PHE A 68 -8.866 -1.216 -4.003 1.00 0.00 C ATOM 1053 CE2 PHE A 68 -10.083 -1.372 -6.052 1.00 0.00 C ATOM 1054 CZ PHE A 68 -9.236 -1.936 -5.122 1.00 0.00 C ATOM 0 H PHE A 68 -11.561 4.385 -5.100 1.00 0.00 H new ATOM 0 HA PHE A 68 -8.947 3.232 -4.324 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -10.986 2.128 -3.446 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -11.691 2.110 -5.050 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -9.046 0.626 -2.944 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.229 0.345 -6.584 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -8.204 -1.656 -3.272 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -10.372 -1.930 -6.930 1.00 0.00 H new ATOM 0 HZ PHE A 68 -8.863 -2.939 -5.268 1.00 0.00 H new ATOM 1064 N ILE A 69 -8.273 3.423 -6.721 1.00 0.00 N ATOM 1065 CA ILE A 69 -7.811 3.274 -8.090 1.00 0.00 C ATOM 1066 C ILE A 69 -6.674 2.277 -8.097 1.00 0.00 C ATOM 1067 O ILE A 69 -5.587 2.558 -7.596 1.00 0.00 O ATOM 1068 CB ILE A 69 -7.295 4.609 -8.776 1.00 0.00 C ATOM 1069 CG1 ILE A 69 -8.344 5.727 -8.821 1.00 0.00 C ATOM 1070 CG2 ILE A 69 -6.781 4.346 -10.193 1.00 0.00 C ATOM 1071 CD1 ILE A 69 -8.510 6.487 -7.533 1.00 0.00 C ATOM 0 H ILE A 69 -7.557 3.735 -6.064 1.00 0.00 H new ATOM 0 HA ILE A 69 -8.677 2.949 -8.667 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.479 4.954 -8.141 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -8.073 6.430 -9.609 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -9.305 5.294 -9.098 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -6.435 5.281 -10.634 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -5.955 3.636 -10.154 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -7.586 3.934 -10.801 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -9.272 7.256 -7.660 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.815 5.801 -6.743 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -7.564 6.955 -7.262 1.00 0.00 H new ATOM 1083 N VAL A 70 -6.927 1.119 -8.610 1.00 0.00 N ATOM 1084 CA VAL A 70 -5.917 0.109 -8.734 1.00 0.00 C ATOM 1085 C VAL A 70 -5.850 -0.339 -10.169 1.00 0.00 C ATOM 1086 O VAL A 70 -6.819 -0.887 -10.714 1.00 0.00 O ATOM 1087 CB VAL A 70 -6.162 -1.112 -7.792 1.00 0.00 C ATOM 1088 CG1 VAL A 70 -5.096 -2.190 -7.998 1.00 0.00 C ATOM 1089 CG2 VAL A 70 -6.159 -0.667 -6.345 1.00 0.00 C ATOM 0 H VAL A 70 -7.844 0.840 -8.958 1.00 0.00 H new ATOM 0 HA VAL A 70 -4.967 0.546 -8.427 1.00 0.00 H new ATOM 0 HB VAL A 70 -7.136 -1.535 -8.040 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -5.292 -3.028 -7.329 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -5.124 -2.536 -9.031 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -4.112 -1.775 -7.781 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -6.331 -1.528 -5.699 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.195 -0.219 -6.104 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -6.949 0.067 -6.189 1.00 0.00 H new ATOM 1099 N ASN A 71 -4.751 -0.057 -10.791 1.00 0.00 N ATOM 1100 CA ASN A 71 -4.529 -0.461 -12.142 1.00 0.00 C ATOM 1101 C ASN A 71 -3.607 -1.642 -12.137 1.00 0.00 C ATOM 1102 O ASN A 71 -2.475 -1.556 -11.630 1.00 0.00 O ATOM 1103 CB ASN A 71 -3.916 0.679 -12.976 1.00 0.00 C ATOM 1104 CG ASN A 71 -3.695 0.293 -14.442 1.00 0.00 C ATOM 1105 OD1 ASN A 71 -4.585 0.457 -15.276 1.00 0.00 O ATOM 1106 ND2 ASN A 71 -2.521 -0.195 -14.770 1.00 0.00 N ATOM 0 H ASN A 71 -3.978 0.462 -10.374 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.484 -0.723 -12.597 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -4.571 1.549 -12.929 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -2.963 0.973 -12.535 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.327 -0.450 -15.738 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -1.803 -0.320 -14.056 1.00 0.00 H new ATOM 1113 N THR A 72 -4.087 -2.743 -12.634 1.00 0.00 N ATOM 1114 CA THR A 72 -3.288 -3.906 -12.783 1.00 0.00 C ATOM 1115 C THR A 72 -2.363 -3.727 -13.970 1.00 0.00 C ATOM 1116 O THR A 72 -2.754 -3.901 -15.131 1.00 0.00 O ATOM 1117 CB THR A 72 -4.160 -5.173 -12.916 1.00 0.00 C ATOM 1118 OG1 THR A 72 -5.307 -4.887 -13.751 1.00 0.00 O ATOM 1119 CG2 THR A 72 -4.619 -5.655 -11.544 1.00 0.00 C ATOM 0 H THR A 72 -5.051 -2.852 -12.947 1.00 0.00 H new ATOM 0 HA THR A 72 -2.682 -4.043 -11.888 1.00 0.00 H new ATOM 0 HB THR A 72 -3.566 -5.963 -13.376 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.010 -4.454 -14.578 1.00 0.00 H new ATOM 0 HG21 THR A 72 -5.232 -6.549 -11.659 1.00 0.00 H new ATOM 0 HG22 THR A 72 -3.749 -5.888 -10.930 1.00 0.00 H new ATOM 0 HG23 THR A 72 -5.204 -4.873 -11.061 1.00 0.00 H new ATOM 1127 N SER A 73 -1.175 -3.282 -13.673 1.00 0.00 N ATOM 1128 CA SER A 73 -0.175 -3.037 -14.651 1.00 0.00 C ATOM 1129 C SER A 73 0.478 -4.362 -15.053 1.00 0.00 C ATOM 1130 O SER A 73 0.134 -5.431 -14.493 1.00 0.00 O ATOM 1131 CB SER A 73 0.839 -2.050 -14.066 1.00 0.00 C ATOM 1132 OG SER A 73 0.161 -0.898 -13.547 1.00 0.00 O ATOM 0 H SER A 73 -0.876 -3.077 -12.719 1.00 0.00 H new ATOM 0 HA SER A 73 -0.604 -2.598 -15.552 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.412 -2.532 -13.274 1.00 0.00 H new ATOM 0 HB3 SER A 73 1.550 -1.748 -14.835 1.00 0.00 H new ATOM 0 HG SER A 73 0.807 -0.312 -13.099 1.00 0.00 H new ATOM 1138 N THR A 74 1.341 -4.320 -16.050 1.00 0.00 N ATOM 1139 CA THR A 74 2.055 -5.490 -16.510 1.00 0.00 C ATOM 1140 C THR A 74 2.860 -6.088 -15.332 1.00 0.00 C ATOM 1141 O THR A 74 3.520 -5.321 -14.603 1.00 0.00 O ATOM 1142 CB THR A 74 2.995 -5.090 -17.668 1.00 0.00 C ATOM 1143 OG1 THR A 74 2.217 -4.413 -18.677 1.00 0.00 O ATOM 1144 CG2 THR A 74 3.665 -6.309 -18.295 1.00 0.00 C ATOM 0 H THR A 74 1.566 -3.468 -16.564 1.00 0.00 H new ATOM 0 HA THR A 74 1.354 -6.242 -16.874 1.00 0.00 H new ATOM 0 HB THR A 74 3.776 -4.441 -17.271 1.00 0.00 H new ATOM 0 HG1 THR A 74 2.801 -4.151 -19.419 1.00 0.00 H new ATOM 0 HG21 THR A 74 4.319 -5.988 -19.106 1.00 0.00 H new ATOM 0 HG22 THR A 74 4.253 -6.830 -17.539 1.00 0.00 H new ATOM 0 HG23 THR A 74 2.902 -6.981 -18.688 1.00 0.00 H new ATOM 1152 N PRO A 75 2.758 -7.456 -15.110 1.00 0.00 N ATOM 1153 CA PRO A 75 3.391 -8.176 -13.999 1.00 0.00 C ATOM 1154 C PRO A 75 4.746 -7.621 -13.593 1.00 0.00 C ATOM 1155 O PRO A 75 5.621 -7.379 -14.429 1.00 0.00 O ATOM 1156 CB PRO A 75 3.539 -9.607 -14.527 1.00 0.00 C ATOM 1157 CG PRO A 75 2.617 -9.726 -15.704 1.00 0.00 C ATOM 1158 CD PRO A 75 1.964 -8.387 -15.923 1.00 0.00 C ATOM 0 HA PRO A 75 2.788 -8.092 -13.095 1.00 0.00 H new ATOM 0 HB2 PRO A 75 4.570 -9.807 -14.820 1.00 0.00 H new ATOM 0 HB3 PRO A 75 3.280 -10.333 -13.757 1.00 0.00 H new ATOM 0 HG2 PRO A 75 3.171 -10.029 -16.592 1.00 0.00 H new ATOM 0 HG3 PRO A 75 1.863 -10.492 -15.521 1.00 0.00 H new ATOM 0 HD2 PRO A 75 1.977 -8.106 -16.976 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.920 -8.398 -15.609 1.00 0.00 H new ATOM 1166 N GLY A 76 4.899 -7.407 -12.313 1.00 0.00 N ATOM 1167 CA GLY A 76 6.086 -6.797 -11.799 1.00 0.00 C ATOM 1168 C GLY A 76 5.822 -5.378 -11.351 1.00 0.00 C ATOM 1169 O GLY A 76 6.659 -4.783 -10.704 1.00 0.00 O ATOM 0 H GLY A 76 4.206 -7.651 -11.605 1.00 0.00 H new ATOM 0 HA2 GLY A 76 6.464 -7.381 -10.960 1.00 0.00 H new ATOM 0 HA3 GLY A 76 6.861 -6.801 -12.565 1.00 0.00 H new ATOM 1173 N LYS A 77 4.659 -4.835 -11.721 1.00 0.00 N ATOM 1174 CA LYS A 77 4.199 -3.518 -11.259 1.00 0.00 C ATOM 1175 C LYS A 77 2.696 -3.509 -11.026 1.00 0.00 C ATOM 1176 O LYS A 77 1.947 -4.198 -11.724 1.00 0.00 O ATOM 1177 CB LYS A 77 4.568 -2.375 -12.222 1.00 0.00 C ATOM 1178 CG LYS A 77 6.002 -1.895 -12.117 1.00 0.00 C ATOM 1179 CD LYS A 77 6.226 -0.653 -12.958 1.00 0.00 C ATOM 1180 CE LYS A 77 7.545 0.040 -12.621 1.00 0.00 C ATOM 1181 NZ LYS A 77 7.604 0.473 -11.198 1.00 0.00 N ATOM 0 H LYS A 77 4.005 -5.297 -12.353 1.00 0.00 H new ATOM 0 HA LYS A 77 4.720 -3.341 -10.318 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.384 -2.706 -13.244 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.903 -1.532 -12.035 1.00 0.00 H new ATOM 0 HG2 LYS A 77 6.241 -1.681 -11.075 1.00 0.00 H new ATOM 0 HG3 LYS A 77 6.678 -2.685 -12.443 1.00 0.00 H new ATOM 0 HD2 LYS A 77 6.219 -0.925 -14.014 1.00 0.00 H new ATOM 0 HD3 LYS A 77 5.402 0.043 -12.803 1.00 0.00 H new ATOM 0 HE2 LYS A 77 8.373 -0.638 -12.827 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.674 0.907 -13.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 8.279 1.258 -11.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 6.661 0.787 -10.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 7.913 -0.324 -10.605 1.00 0.00 H new ATOM 1195 N ILE A 78 2.281 -2.762 -10.025 1.00 0.00 N ATOM 1196 CA ILE A 78 0.882 -2.551 -9.683 1.00 0.00 C ATOM 1197 C ILE A 78 0.740 -1.068 -9.367 1.00 0.00 C ATOM 1198 O ILE A 78 1.263 -0.607 -8.350 1.00 0.00 O ATOM 1199 CB ILE A 78 0.456 -3.314 -8.382 1.00 0.00 C ATOM 1200 CG1 ILE A 78 0.894 -4.785 -8.394 1.00 0.00 C ATOM 1201 CG2 ILE A 78 -1.065 -3.230 -8.210 1.00 0.00 C ATOM 1202 CD1 ILE A 78 0.678 -5.486 -7.062 1.00 0.00 C ATOM 0 H ILE A 78 2.924 -2.268 -9.406 1.00 0.00 H new ATOM 0 HA ILE A 78 0.267 -2.904 -10.511 1.00 0.00 H new ATOM 0 HB ILE A 78 0.959 -2.832 -7.543 1.00 0.00 H new ATOM 0 HG12 ILE A 78 0.342 -5.315 -9.170 1.00 0.00 H new ATOM 0 HG13 ILE A 78 1.950 -4.841 -8.659 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -1.359 -3.761 -7.305 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.365 -2.185 -8.131 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -1.554 -3.684 -9.072 1.00 0.00 H new ATOM 0 HD11 ILE A 78 1.008 -6.522 -7.138 1.00 0.00 H new ATOM 0 HD12 ILE A 78 1.252 -4.979 -6.287 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -0.381 -5.461 -6.805 1.00 0.00 H new ATOM 1214 N SER A 79 0.075 -0.330 -10.200 1.00 0.00 N ATOM 1215 CA SER A 79 -0.058 1.083 -9.978 1.00 0.00 C ATOM 1216 C SER A 79 -1.334 1.374 -9.178 1.00 0.00 C ATOM 1217 O SER A 79 -2.454 1.167 -9.667 1.00 0.00 O ATOM 1218 CB SER A 79 -0.056 1.800 -11.318 1.00 0.00 C ATOM 1219 OG SER A 79 1.085 1.399 -12.094 1.00 0.00 O ATOM 0 H SER A 79 -0.385 -0.678 -11.041 1.00 0.00 H new ATOM 0 HA SER A 79 0.784 1.450 -9.391 1.00 0.00 H new ATOM 0 HB2 SER A 79 -0.973 1.572 -11.862 1.00 0.00 H new ATOM 0 HB3 SER A 79 -0.038 2.879 -11.162 1.00 0.00 H new ATOM 0 HG SER A 79 1.870 1.334 -11.512 1.00 0.00 H new ATOM 1225 N ILE A 80 -1.161 1.811 -7.948 1.00 0.00 N ATOM 1226 CA ILE A 80 -2.269 2.084 -7.063 1.00 0.00 C ATOM 1227 C ILE A 80 -2.328 3.585 -6.731 1.00 0.00 C ATOM 1228 O ILE A 80 -1.294 4.255 -6.615 1.00 0.00 O ATOM 1229 CB ILE A 80 -2.151 1.243 -5.740 1.00 0.00 C ATOM 1230 CG1 ILE A 80 -2.123 -0.262 -6.066 1.00 0.00 C ATOM 1231 CG2 ILE A 80 -3.290 1.562 -4.773 1.00 0.00 C ATOM 1232 CD1 ILE A 80 -2.059 -1.180 -4.855 1.00 0.00 C ATOM 0 H ILE A 80 -0.245 1.987 -7.535 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.189 1.796 -7.572 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.216 1.515 -5.250 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -3.013 -0.510 -6.645 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.262 -0.465 -6.703 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -3.178 0.963 -3.869 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -3.261 2.620 -4.513 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -4.244 1.330 -5.246 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -2.043 -2.218 -5.186 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.155 -0.967 -4.285 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -2.933 -1.013 -4.225 1.00 0.00 H new ATOM 1244 N THR A 81 -3.515 4.112 -6.655 1.00 0.00 N ATOM 1245 CA THR A 81 -3.744 5.463 -6.270 1.00 0.00 C ATOM 1246 C THR A 81 -4.986 5.525 -5.366 1.00 0.00 C ATOM 1247 O THR A 81 -6.045 5.019 -5.716 1.00 0.00 O ATOM 1248 CB THR A 81 -3.935 6.380 -7.514 1.00 0.00 C ATOM 1249 OG1 THR A 81 -2.797 6.247 -8.390 1.00 0.00 O ATOM 1250 CG2 THR A 81 -4.078 7.846 -7.104 1.00 0.00 C ATOM 0 H THR A 81 -4.369 3.596 -6.866 1.00 0.00 H new ATOM 0 HA THR A 81 -2.872 5.825 -5.725 1.00 0.00 H new ATOM 0 HB THR A 81 -4.846 6.071 -8.026 1.00 0.00 H new ATOM 0 HG1 THR A 81 -2.918 6.823 -9.173 1.00 0.00 H new ATOM 0 HG21 THR A 81 -4.210 8.461 -7.994 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.945 7.959 -6.453 1.00 0.00 H new ATOM 0 HG23 THR A 81 -3.181 8.164 -6.572 1.00 0.00 H new ATOM 1258 N PHE A 82 -4.821 6.076 -4.200 1.00 0.00 N ATOM 1259 CA PHE A 82 -5.908 6.300 -3.292 1.00 0.00 C ATOM 1260 C PHE A 82 -6.108 7.779 -3.187 1.00 0.00 C ATOM 1261 O PHE A 82 -5.258 8.495 -2.654 1.00 0.00 O ATOM 1262 CB PHE A 82 -5.645 5.721 -1.894 1.00 0.00 C ATOM 1263 CG PHE A 82 -5.517 4.232 -1.839 1.00 0.00 C ATOM 1264 CD1 PHE A 82 -4.310 3.643 -1.527 1.00 0.00 C ATOM 1265 CD2 PHE A 82 -6.611 3.423 -2.089 1.00 0.00 C ATOM 1266 CE1 PHE A 82 -4.193 2.272 -1.461 1.00 0.00 C ATOM 1267 CE2 PHE A 82 -6.499 2.054 -2.028 1.00 0.00 C ATOM 1268 CZ PHE A 82 -5.291 1.476 -1.714 1.00 0.00 C ATOM 0 H PHE A 82 -3.916 6.387 -3.848 1.00 0.00 H new ATOM 0 HA PHE A 82 -6.793 5.794 -3.678 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -4.730 6.164 -1.500 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -6.456 6.025 -1.233 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -3.447 4.263 -1.332 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -7.562 3.871 -2.335 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -3.244 1.821 -1.212 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -7.360 1.432 -2.227 1.00 0.00 H new ATOM 0 HZ PHE A 82 -5.202 0.401 -1.666 1.00 0.00 H new ATOM 1278 N THR A 83 -7.165 8.246 -3.728 1.00 0.00 N ATOM 1279 CA THR A 83 -7.460 9.628 -3.680 1.00 0.00 C ATOM 1280 C THR A 83 -8.935 9.777 -3.383 1.00 0.00 C ATOM 1281 O THR A 83 -9.769 9.246 -4.101 1.00 0.00 O ATOM 1282 CB THR A 83 -7.007 10.374 -5.011 1.00 0.00 C ATOM 1283 OG1 THR A 83 -7.262 11.787 -4.941 1.00 0.00 O ATOM 1284 CG2 THR A 83 -7.658 9.801 -6.267 1.00 0.00 C ATOM 0 H THR A 83 -7.856 7.680 -4.220 1.00 0.00 H new ATOM 0 HA THR A 83 -6.891 10.112 -2.886 1.00 0.00 H new ATOM 0 HB THR A 83 -5.933 10.206 -5.086 1.00 0.00 H new ATOM 0 HG1 THR A 83 -7.113 12.101 -4.025 1.00 0.00 H new ATOM 0 HG21 THR A 83 -7.309 10.351 -7.141 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.389 8.750 -6.369 1.00 0.00 H new ATOM 0 HG23 THR A 83 -8.741 9.892 -6.189 1.00 0.00 H new ATOM 1292 N ASP A 84 -9.255 10.423 -2.291 1.00 0.00 N ATOM 1293 CA ASP A 84 -10.641 10.574 -1.930 1.00 0.00 C ATOM 1294 C ASP A 84 -11.112 11.925 -2.425 1.00 0.00 C ATOM 1295 O ASP A 84 -10.597 12.974 -1.999 1.00 0.00 O ATOM 1296 CB ASP A 84 -10.867 10.446 -0.411 1.00 0.00 C ATOM 1297 CG ASP A 84 -12.338 10.184 -0.054 1.00 0.00 C ATOM 1298 OD1 ASP A 84 -13.227 10.964 -0.498 1.00 0.00 O ATOM 1299 OD2 ASP A 84 -12.607 9.202 0.678 1.00 0.00 O ATOM 0 H ASP A 84 -8.588 10.846 -1.646 1.00 0.00 H new ATOM 0 HA ASP A 84 -11.215 9.772 -2.394 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -10.252 9.634 -0.023 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -10.535 11.360 0.081 1.00 0.00 H new ATOM 1304 N PRO A 85 -12.066 11.945 -3.362 1.00 0.00 N ATOM 1305 CA PRO A 85 -12.585 13.178 -3.925 1.00 0.00 C ATOM 1306 C PRO A 85 -13.590 13.864 -2.990 1.00 0.00 C ATOM 1307 O PRO A 85 -14.086 14.949 -3.279 1.00 0.00 O ATOM 1308 CB PRO A 85 -13.266 12.707 -5.207 1.00 0.00 C ATOM 1309 CG PRO A 85 -13.743 11.339 -4.892 1.00 0.00 C ATOM 1310 CD PRO A 85 -12.723 10.746 -3.959 1.00 0.00 C ATOM 0 HA PRO A 85 -11.806 13.923 -4.090 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -14.093 13.362 -5.481 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -12.571 12.702 -6.047 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -14.728 11.367 -4.426 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -13.837 10.741 -5.798 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -13.190 10.122 -3.197 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -12.008 10.119 -4.491 1.00 0.00 H new ATOM 1318 N THR A 86 -13.872 13.229 -1.885 1.00 0.00 N ATOM 1319 CA THR A 86 -14.837 13.693 -0.945 1.00 0.00 C ATOM 1320 C THR A 86 -14.125 13.944 0.406 1.00 0.00 C ATOM 1321 O THR A 86 -14.770 13.952 1.439 1.00 0.00 O ATOM 1322 CB THR A 86 -15.877 12.571 -0.737 1.00 0.00 C ATOM 1323 OG1 THR A 86 -16.001 11.788 -1.946 1.00 0.00 O ATOM 1324 CG2 THR A 86 -17.248 13.126 -0.386 1.00 0.00 C ATOM 0 H THR A 86 -13.423 12.355 -1.613 1.00 0.00 H new ATOM 0 HA THR A 86 -15.313 14.606 -1.302 1.00 0.00 H new ATOM 0 HB THR A 86 -15.526 11.955 0.091 1.00 0.00 H new ATOM 0 HG1 THR A 86 -16.661 11.076 -1.809 1.00 0.00 H new ATOM 0 HG21 THR A 86 -17.949 12.303 -0.248 1.00 0.00 H new ATOM 0 HG22 THR A 86 -17.181 13.704 0.536 1.00 0.00 H new ATOM 0 HG23 THR A 86 -17.598 13.769 -1.193 1.00 0.00 H new ATOM 1332 N LEU A 87 -12.805 14.215 0.352 1.00 0.00 N ATOM 1333 CA LEU A 87 -11.902 14.363 1.544 1.00 0.00 C ATOM 1334 C LEU A 87 -12.383 15.330 2.664 1.00 0.00 C ATOM 1335 O LEU A 87 -11.910 15.259 3.813 1.00 0.00 O ATOM 1336 CB LEU A 87 -10.435 14.659 1.109 1.00 0.00 C ATOM 1337 CG LEU A 87 -10.171 15.867 0.167 1.00 0.00 C ATOM 1338 CD1 LEU A 87 -10.391 17.207 0.849 1.00 0.00 C ATOM 1339 CD2 LEU A 87 -8.770 15.798 -0.396 1.00 0.00 C ATOM 0 H LEU A 87 -12.313 14.342 -0.533 1.00 0.00 H new ATOM 0 HA LEU A 87 -11.945 13.387 2.027 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.845 14.808 2.013 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -10.048 13.766 0.619 1.00 0.00 H new ATOM 0 HG LEU A 87 -10.897 15.797 -0.643 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -10.191 18.012 0.142 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -11.423 17.275 1.194 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -9.717 17.297 1.701 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.600 16.650 -1.054 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.048 15.820 0.421 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.650 14.874 -0.961 1.00 0.00 H new ATOM 1351 N ALA A 88 -13.282 16.232 2.333 1.00 0.00 N ATOM 1352 CA ALA A 88 -13.830 17.158 3.305 1.00 0.00 C ATOM 1353 C ALA A 88 -14.937 16.500 4.118 1.00 0.00 C ATOM 1354 O ALA A 88 -15.225 16.903 5.230 1.00 0.00 O ATOM 1355 CB ALA A 88 -14.366 18.376 2.605 1.00 0.00 C ATOM 0 H ALA A 88 -13.653 16.345 1.389 1.00 0.00 H new ATOM 0 HA ALA A 88 -13.032 17.453 3.986 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -14.776 19.068 3.341 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -13.560 18.865 2.057 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -15.151 18.080 1.909 1.00 0.00 H new ATOM 1361 N ASN A 89 -15.536 15.485 3.558 1.00 0.00 N ATOM 1362 CA ASN A 89 -16.641 14.773 4.199 1.00 0.00 C ATOM 1363 C ASN A 89 -16.139 13.430 4.684 1.00 0.00 C ATOM 1364 O ASN A 89 -16.464 12.986 5.790 1.00 0.00 O ATOM 1365 CB ASN A 89 -17.807 14.560 3.216 1.00 0.00 C ATOM 1366 CG ASN A 89 -18.299 15.852 2.577 1.00 0.00 C ATOM 1367 OD1 ASN A 89 -19.177 16.524 3.106 1.00 0.00 O ATOM 1368 ND2 ASN A 89 -17.744 16.204 1.439 1.00 0.00 N ATOM 0 H ASN A 89 -15.281 15.116 2.642 1.00 0.00 H new ATOM 0 HA ASN A 89 -17.006 15.369 5.035 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -17.491 13.872 2.432 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -18.635 14.085 3.742 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -18.042 17.059 0.969 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -17.016 15.622 1.025 1.00 0.00 H new ATOM 1375 N TYR A 90 -15.330 12.795 3.855 1.00 0.00 N ATOM 1376 CA TYR A 90 -14.668 11.568 4.203 1.00 0.00 C ATOM 1377 C TYR A 90 -13.228 11.924 4.466 1.00 0.00 C ATOM 1378 O TYR A 90 -12.467 12.146 3.540 1.00 0.00 O ATOM 1379 CB TYR A 90 -14.716 10.553 3.051 1.00 0.00 C ATOM 1380 CG TYR A 90 -16.095 10.137 2.583 1.00 0.00 C ATOM 1381 CD1 TYR A 90 -17.152 9.969 3.469 1.00 0.00 C ATOM 1382 CD2 TYR A 90 -16.331 9.904 1.242 1.00 0.00 C ATOM 1383 CE1 TYR A 90 -18.401 9.591 3.022 1.00 0.00 C ATOM 1384 CE2 TYR A 90 -17.572 9.528 0.787 1.00 0.00 C ATOM 1385 CZ TYR A 90 -18.603 9.376 1.676 1.00 0.00 C ATOM 1386 OH TYR A 90 -19.848 8.998 1.219 1.00 0.00 O ATOM 0 H TYR A 90 -15.117 13.127 2.914 1.00 0.00 H new ATOM 0 HA TYR A 90 -15.157 11.115 5.065 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -14.178 10.974 2.201 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -14.175 9.659 3.360 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -16.993 10.137 4.524 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -15.522 10.020 0.536 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -19.214 9.465 3.721 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -17.734 9.353 -0.266 1.00 0.00 H new ATOM 0 HH TYR A 90 -19.820 8.889 0.246 1.00 0.00 H new ATOM 1396 N PRO A 91 -12.827 12.020 5.714 1.00 0.00 N ATOM 1397 CA PRO A 91 -11.506 12.442 6.030 1.00 0.00 C ATOM 1398 C PRO A 91 -10.519 11.300 6.189 1.00 0.00 C ATOM 1399 O PRO A 91 -10.721 10.372 6.998 1.00 0.00 O ATOM 1400 CB PRO A 91 -11.698 13.188 7.348 1.00 0.00 C ATOM 1401 CG PRO A 91 -12.899 12.560 7.993 1.00 0.00 C ATOM 1402 CD PRO A 91 -13.628 11.781 6.922 1.00 0.00 C ATOM 0 HA PRO A 91 -11.073 13.043 5.230 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -10.817 13.095 7.984 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -11.856 14.253 7.177 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -12.598 11.903 8.809 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -13.548 13.323 8.422 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -13.681 10.720 7.164 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -14.653 12.131 6.799 1.00 0.00 H new ATOM 1410 N ILE A 92 -9.501 11.300 5.374 1.00 0.00 N ATOM 1411 CA ILE A 92 -8.400 10.435 5.629 1.00 0.00 C ATOM 1412 C ILE A 92 -7.377 11.317 6.303 1.00 0.00 C ATOM 1413 O ILE A 92 -6.589 11.994 5.650 1.00 0.00 O ATOM 1414 CB ILE A 92 -7.785 9.806 4.351 1.00 0.00 C ATOM 1415 CG1 ILE A 92 -8.877 9.162 3.477 1.00 0.00 C ATOM 1416 CG2 ILE A 92 -6.737 8.760 4.756 1.00 0.00 C ATOM 1417 CD1 ILE A 92 -8.358 8.485 2.218 1.00 0.00 C ATOM 0 H ILE A 92 -9.417 11.883 4.541 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.724 9.585 6.230 1.00 0.00 H new ATOM 0 HB ILE A 92 -7.307 10.590 3.764 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.416 8.427 4.074 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -9.596 9.930 3.192 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -6.302 8.315 3.861 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -5.952 9.239 5.341 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.212 7.982 5.354 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -9.194 8.059 1.663 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -7.845 9.218 1.596 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.662 7.692 2.492 1.00 0.00 H new ATOM 1429 N SER A 93 -7.465 11.365 7.590 1.00 0.00 N ATOM 1430 CA SER A 93 -6.657 12.235 8.395 1.00 0.00 C ATOM 1431 C SER A 93 -6.234 11.525 9.659 1.00 0.00 C ATOM 1432 O SER A 93 -5.903 12.142 10.663 1.00 0.00 O ATOM 1433 CB SER A 93 -7.498 13.475 8.703 1.00 0.00 C ATOM 1434 OG SER A 93 -8.840 13.097 9.005 1.00 0.00 O ATOM 0 H SER A 93 -8.113 10.790 8.128 1.00 0.00 H new ATOM 0 HA SER A 93 -5.746 12.526 7.873 1.00 0.00 H new ATOM 0 HB2 SER A 93 -7.067 14.016 9.545 1.00 0.00 H new ATOM 0 HB3 SER A 93 -7.487 14.153 7.849 1.00 0.00 H new ATOM 0 HG SER A 93 -9.327 13.872 9.355 1.00 0.00 H new ATOM 1440 N VAL A 94 -6.230 10.221 9.583 1.00 0.00 N ATOM 1441 CA VAL A 94 -5.862 9.362 10.682 1.00 0.00 C ATOM 1442 C VAL A 94 -4.980 8.261 10.152 1.00 0.00 C ATOM 1443 O VAL A 94 -5.067 7.913 8.972 1.00 0.00 O ATOM 1444 CB VAL A 94 -7.096 8.759 11.432 1.00 0.00 C ATOM 1445 CG1 VAL A 94 -7.777 9.808 12.293 1.00 0.00 C ATOM 1446 CG2 VAL A 94 -8.098 8.177 10.446 1.00 0.00 C ATOM 0 H VAL A 94 -6.488 9.713 8.737 1.00 0.00 H new ATOM 0 HA VAL A 94 -5.330 9.966 11.418 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.729 7.960 12.077 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.631 9.362 12.803 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -7.071 10.187 13.032 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.119 10.629 11.663 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.947 7.764 10.991 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -8.445 8.962 9.774 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.621 7.388 9.865 1.00 0.00 H new ATOM 1456 N ASP A 95 -4.123 7.743 10.985 1.00 0.00 N ATOM 1457 CA ASP A 95 -3.177 6.727 10.563 1.00 0.00 C ATOM 1458 C ASP A 95 -3.666 5.321 10.865 1.00 0.00 C ATOM 1459 O ASP A 95 -4.744 5.131 11.458 1.00 0.00 O ATOM 1460 CB ASP A 95 -1.776 6.961 11.159 1.00 0.00 C ATOM 1461 CG ASP A 95 -1.716 6.892 12.660 1.00 0.00 C ATOM 1462 OD1 ASP A 95 -1.604 5.792 13.220 1.00 0.00 O ATOM 1463 OD2 ASP A 95 -1.758 7.942 13.309 1.00 0.00 O ATOM 0 H ASP A 95 -4.053 8.004 11.969 1.00 0.00 H new ATOM 0 HA ASP A 95 -3.097 6.818 9.480 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.091 6.220 10.746 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -1.418 7.939 10.839 1.00 0.00 H new ATOM 1468 N GLY A 96 -2.875 4.357 10.453 1.00 0.00 N ATOM 1469 CA GLY A 96 -3.184 2.965 10.594 1.00 0.00 C ATOM 1470 C GLY A 96 -2.614 2.233 9.412 1.00 0.00 C ATOM 1471 O GLY A 96 -1.495 2.531 8.981 1.00 0.00 O ATOM 0 H GLY A 96 -1.978 4.531 10.000 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -2.764 2.575 11.521 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -4.263 2.819 10.647 1.00 0.00 H new ATOM 1475 N ILE A 97 -3.344 1.304 8.870 1.00 0.00 N ATOM 1476 CA ILE A 97 -2.922 0.648 7.659 1.00 0.00 C ATOM 1477 C ILE A 97 -3.699 1.270 6.504 1.00 0.00 C ATOM 1478 O ILE A 97 -4.872 1.568 6.645 1.00 0.00 O ATOM 1479 CB ILE A 97 -3.091 -0.936 7.689 1.00 0.00 C ATOM 1480 CG1 ILE A 97 -2.083 -1.631 8.643 1.00 0.00 C ATOM 1481 CG2 ILE A 97 -2.955 -1.546 6.301 1.00 0.00 C ATOM 1482 CD1 ILE A 97 -2.292 -1.411 10.126 1.00 0.00 C ATOM 0 H ILE A 97 -4.236 0.980 9.244 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.850 0.802 7.539 1.00 0.00 H new ATOM 0 HB ILE A 97 -4.099 -1.110 8.066 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -2.115 -2.703 8.450 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -1.080 -1.290 8.386 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.077 -2.627 6.365 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -3.722 -1.133 5.645 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -1.969 -1.315 5.897 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -1.525 -1.947 10.685 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -2.225 -0.346 10.349 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.276 -1.781 10.414 1.00 0.00 H new ATOM 1494 N LEU A 98 -3.031 1.514 5.408 1.00 0.00 N ATOM 1495 CA LEU A 98 -3.644 2.111 4.245 1.00 0.00 C ATOM 1496 C LEU A 98 -4.318 1.045 3.389 1.00 0.00 C ATOM 1497 O LEU A 98 -5.509 1.142 3.057 1.00 0.00 O ATOM 1498 CB LEU A 98 -2.588 2.867 3.434 1.00 0.00 C ATOM 1499 CG LEU A 98 -3.072 3.547 2.155 1.00 0.00 C ATOM 1500 CD1 LEU A 98 -4.120 4.613 2.458 1.00 0.00 C ATOM 1501 CD2 LEU A 98 -1.899 4.142 1.405 1.00 0.00 C ATOM 0 H LEU A 98 -2.039 1.304 5.293 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.409 2.816 4.570 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.143 3.626 4.077 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.795 2.168 3.170 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.544 2.793 1.525 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.445 5.079 1.528 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.976 4.152 2.951 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -3.689 5.371 3.112 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.256 4.624 0.495 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.401 4.879 2.035 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.195 3.352 1.145 1.00 0.00 H new ATOM 1513 N ALA A 99 -3.567 0.027 3.053 1.00 0.00 N ATOM 1514 CA ALA A 99 -4.057 -1.042 2.241 1.00 0.00 C ATOM 1515 C ALA A 99 -3.354 -2.311 2.608 1.00 0.00 C ATOM 1516 O ALA A 99 -2.213 -2.286 3.093 1.00 0.00 O ATOM 1517 CB ALA A 99 -3.856 -0.736 0.766 1.00 0.00 C ATOM 0 H ALA A 99 -2.594 -0.078 3.340 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.126 -1.157 2.419 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -4.236 -1.564 0.168 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -4.394 0.176 0.507 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -2.793 -0.601 0.564 1.00 0.00 H new ATOM 1523 N TYR A 100 -4.029 -3.390 2.421 1.00 0.00 N ATOM 1524 CA TYR A 100 -3.503 -4.686 2.690 1.00 0.00 C ATOM 1525 C TYR A 100 -3.280 -5.352 1.346 1.00 0.00 C ATOM 1526 O TYR A 100 -4.236 -5.582 0.600 1.00 0.00 O ATOM 1527 CB TYR A 100 -4.502 -5.509 3.524 1.00 0.00 C ATOM 1528 CG TYR A 100 -5.006 -4.834 4.802 1.00 0.00 C ATOM 1529 CD1 TYR A 100 -4.345 -5.001 6.013 1.00 0.00 C ATOM 1530 CD2 TYR A 100 -6.155 -4.037 4.789 1.00 0.00 C ATOM 1531 CE1 TYR A 100 -4.811 -4.396 7.171 1.00 0.00 C ATOM 1532 CE2 TYR A 100 -6.624 -3.429 5.940 1.00 0.00 C ATOM 1533 CZ TYR A 100 -5.952 -3.609 7.127 1.00 0.00 C ATOM 1534 OH TYR A 100 -6.417 -2.999 8.284 1.00 0.00 O ATOM 0 H TYR A 100 -4.986 -3.398 2.068 1.00 0.00 H new ATOM 0 HA TYR A 100 -2.575 -4.618 3.258 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -5.361 -5.749 2.897 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -4.031 -6.454 3.794 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -3.455 -5.611 6.053 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -6.688 -3.893 3.861 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -4.287 -4.537 8.104 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -7.513 -2.816 5.907 1.00 0.00 H new ATOM 0 HH TYR A 100 -7.225 -2.483 8.080 1.00 0.00 H new ATOM 1544 N LEU A 101 -2.050 -5.602 1.015 1.00 0.00 N ATOM 1545 CA LEU A 101 -1.707 -6.205 -0.256 1.00 0.00 C ATOM 1546 C LEU A 101 -1.800 -7.709 -0.105 1.00 0.00 C ATOM 1547 O LEU A 101 -1.169 -8.276 0.787 1.00 0.00 O ATOM 1548 CB LEU A 101 -0.278 -5.824 -0.653 1.00 0.00 C ATOM 1549 CG LEU A 101 0.092 -4.330 -0.629 1.00 0.00 C ATOM 1550 CD1 LEU A 101 1.548 -4.150 -1.004 1.00 0.00 C ATOM 1551 CD2 LEU A 101 -0.793 -3.517 -1.561 1.00 0.00 C ATOM 0 H LEU A 101 -1.249 -5.397 1.612 1.00 0.00 H new ATOM 0 HA LEU A 101 -2.390 -5.852 -1.029 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.407 -6.351 0.011 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -0.097 -6.199 -1.660 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.069 -3.963 0.385 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.800 -3.090 -0.984 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.176 -4.686 -0.292 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.717 -4.545 -2.006 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -0.501 -2.468 -1.516 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -0.679 -3.882 -2.582 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.834 -3.618 -1.254 1.00 0.00 H new ATOM 1563 N ASP A 102 -2.568 -8.349 -0.944 1.00 0.00 N ATOM 1564 CA ASP A 102 -2.780 -9.777 -0.802 1.00 0.00 C ATOM 1565 C ASP A 102 -2.070 -10.538 -1.919 1.00 0.00 C ATOM 1566 O ASP A 102 -2.483 -10.496 -3.098 1.00 0.00 O ATOM 1567 CB ASP A 102 -4.278 -10.086 -0.780 1.00 0.00 C ATOM 1568 CG ASP A 102 -4.582 -11.507 -0.392 1.00 0.00 C ATOM 1569 OD1 ASP A 102 -4.677 -12.358 -1.276 1.00 0.00 O ATOM 1570 OD2 ASP A 102 -4.804 -11.782 0.817 1.00 0.00 O ATOM 0 H ASP A 102 -3.056 -7.916 -1.728 1.00 0.00 H new ATOM 0 HA ASP A 102 -2.352 -10.107 0.145 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -4.772 -9.411 -0.081 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -4.698 -9.887 -1.766 1.00 0.00 H new ATOM 1575 N PHE A 103 -0.982 -11.184 -1.562 1.00 0.00 N ATOM 1576 CA PHE A 103 -0.167 -11.919 -2.507 1.00 0.00 C ATOM 1577 C PHE A 103 -0.197 -13.389 -2.196 1.00 0.00 C ATOM 1578 O PHE A 103 -0.058 -13.788 -1.050 1.00 0.00 O ATOM 1579 CB PHE A 103 1.310 -11.483 -2.448 1.00 0.00 C ATOM 1580 CG PHE A 103 1.615 -10.066 -2.832 1.00 0.00 C ATOM 1581 CD1 PHE A 103 1.762 -9.713 -4.160 1.00 0.00 C ATOM 1582 CD2 PHE A 103 1.793 -9.097 -1.863 1.00 0.00 C ATOM 1583 CE1 PHE A 103 2.082 -8.420 -4.516 1.00 0.00 C ATOM 1584 CE2 PHE A 103 2.108 -7.804 -2.215 1.00 0.00 C ATOM 1585 CZ PHE A 103 2.253 -7.463 -3.542 1.00 0.00 C ATOM 0 H PHE A 103 -0.635 -11.215 -0.603 1.00 0.00 H new ATOM 0 HA PHE A 103 -0.580 -11.713 -3.494 1.00 0.00 H new ATOM 0 HB2 PHE A 103 1.671 -11.644 -1.432 1.00 0.00 H new ATOM 0 HB3 PHE A 103 1.884 -12.142 -3.099 1.00 0.00 H new ATOM 0 HD1 PHE A 103 1.625 -10.459 -4.929 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.684 -9.356 -0.820 1.00 0.00 H new ATOM 0 HE1 PHE A 103 2.198 -8.159 -5.557 1.00 0.00 H new ATOM 0 HE2 PHE A 103 2.242 -7.055 -1.449 1.00 0.00 H new ATOM 0 HZ PHE A 103 2.500 -6.448 -3.817 1.00 0.00 H new ATOM 1595 N ILE A 104 -0.368 -14.184 -3.195 1.00 0.00 N ATOM 1596 CA ILE A 104 -0.228 -15.601 -3.040 1.00 0.00 C ATOM 1597 C ILE A 104 1.222 -15.907 -3.320 1.00 0.00 C ATOM 1598 O ILE A 104 1.760 -15.453 -4.344 1.00 0.00 O ATOM 1599 CB ILE A 104 -1.112 -16.406 -4.044 1.00 0.00 C ATOM 1600 CG1 ILE A 104 -2.587 -16.029 -3.886 1.00 0.00 C ATOM 1601 CG2 ILE A 104 -0.925 -17.918 -3.836 1.00 0.00 C ATOM 1602 CD1 ILE A 104 -3.507 -16.677 -4.904 1.00 0.00 C ATOM 0 H ILE A 104 -0.607 -13.879 -4.138 1.00 0.00 H new ATOM 0 HA ILE A 104 -0.546 -15.890 -2.038 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.795 -16.152 -5.056 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.917 -16.308 -2.885 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.684 -14.946 -3.963 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.549 -18.463 -4.545 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.121 -18.181 -3.997 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.214 -18.184 -2.819 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.533 -16.358 -4.722 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.207 -16.378 -5.908 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.443 -17.761 -4.814 1.00 0.00 H new ATOM 1614 N ILE A 105 1.877 -16.587 -2.419 1.00 0.00 N ATOM 1615 CA ILE A 105 3.233 -16.984 -2.660 1.00 0.00 C ATOM 1616 C ILE A 105 3.174 -18.175 -3.587 1.00 0.00 C ATOM 1617 O ILE A 105 2.476 -19.144 -3.306 1.00 0.00 O ATOM 1618 CB ILE A 105 3.991 -17.328 -1.350 1.00 0.00 C ATOM 1619 CG1 ILE A 105 3.885 -16.143 -0.373 1.00 0.00 C ATOM 1620 CG2 ILE A 105 5.462 -17.635 -1.656 1.00 0.00 C ATOM 1621 CD1 ILE A 105 4.593 -16.342 0.947 1.00 0.00 C ATOM 0 H ILE A 105 1.495 -16.875 -1.518 1.00 0.00 H new ATOM 0 HA ILE A 105 3.791 -16.161 -3.107 1.00 0.00 H new ATOM 0 HB ILE A 105 3.543 -18.211 -0.894 1.00 0.00 H new ATOM 0 HG12 ILE A 105 4.292 -15.255 -0.857 1.00 0.00 H new ATOM 0 HG13 ILE A 105 2.831 -15.945 -0.177 1.00 0.00 H new ATOM 0 HG21 ILE A 105 5.984 -17.875 -0.730 1.00 0.00 H new ATOM 0 HG22 ILE A 105 5.522 -18.484 -2.337 1.00 0.00 H new ATOM 0 HG23 ILE A 105 5.927 -16.765 -2.119 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.462 -15.455 1.567 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.173 -17.208 1.458 1.00 0.00 H new ATOM 0 HD13 ILE A 105 5.656 -16.507 0.769 1.00 0.00 H new ATOM 1633 N ASN A 106 3.856 -18.073 -4.688 1.00 0.00 N ATOM 1634 CA ASN A 106 3.800 -19.060 -5.755 1.00 0.00 C ATOM 1635 C ASN A 106 4.475 -20.369 -5.310 1.00 0.00 C ATOM 1636 O ASN A 106 5.324 -20.365 -4.426 1.00 0.00 O ATOM 1637 CB ASN A 106 4.539 -18.465 -6.976 1.00 0.00 C ATOM 1638 CG ASN A 106 4.292 -19.146 -8.314 1.00 0.00 C ATOM 1639 OD1 ASN A 106 4.018 -20.334 -8.413 1.00 0.00 O ATOM 1640 ND2 ASN A 106 4.436 -18.395 -9.349 1.00 0.00 N ATOM 0 H ASN A 106 4.482 -17.292 -4.886 1.00 0.00 H new ATOM 0 HA ASN A 106 2.765 -19.290 -6.008 1.00 0.00 H new ATOM 0 HB2 ASN A 106 4.256 -17.416 -7.069 1.00 0.00 H new ATOM 0 HB3 ASN A 106 5.610 -18.489 -6.773 1.00 0.00 H new ATOM 0 HD21 ASN A 106 4.322 -18.787 -10.284 1.00 0.00 H new ATOM 0 HD22 ASN A 106 4.665 -17.408 -9.235 1.00 0.00 H new ATOM 1647 N SER A 107 4.091 -21.472 -5.909 1.00 0.00 N ATOM 1648 CA SER A 107 4.741 -22.749 -5.674 1.00 0.00 C ATOM 1649 C SER A 107 6.118 -22.759 -6.356 1.00 0.00 C ATOM 1650 O SER A 107 7.009 -23.507 -5.978 1.00 0.00 O ATOM 1651 CB SER A 107 3.860 -23.881 -6.189 1.00 0.00 C ATOM 1652 OG SER A 107 2.604 -23.857 -5.532 1.00 0.00 O ATOM 0 H SER A 107 3.319 -21.514 -6.574 1.00 0.00 H new ATOM 0 HA SER A 107 4.888 -22.897 -4.604 1.00 0.00 H new ATOM 0 HB2 SER A 107 3.718 -23.781 -7.265 1.00 0.00 H new ATOM 0 HB3 SER A 107 4.350 -24.840 -6.019 1.00 0.00 H new ATOM 0 HG SER A 107 2.044 -24.587 -5.870 1.00 0.00 H new ATOM 1658 N ASN A 108 6.279 -21.863 -7.332 1.00 0.00 N ATOM 1659 CA ASN A 108 7.543 -21.665 -8.055 1.00 0.00 C ATOM 1660 C ASN A 108 8.527 -20.898 -7.163 1.00 0.00 C ATOM 1661 O ASN A 108 9.741 -20.916 -7.380 1.00 0.00 O ATOM 1662 CB ASN A 108 7.259 -20.813 -9.314 1.00 0.00 C ATOM 1663 CG ASN A 108 8.474 -20.548 -10.190 1.00 0.00 C ATOM 1664 OD1 ASN A 108 9.352 -21.390 -10.338 1.00 0.00 O ATOM 1665 ND2 ASN A 108 8.551 -19.357 -10.732 1.00 0.00 N ATOM 0 H ASN A 108 5.530 -21.247 -7.648 1.00 0.00 H new ATOM 0 HA ASN A 108 7.967 -22.631 -8.329 1.00 0.00 H new ATOM 0 HB2 ASN A 108 6.499 -21.316 -9.912 1.00 0.00 H new ATOM 0 HB3 ASN A 108 6.838 -19.857 -9.002 1.00 0.00 H new ATOM 0 HD21 ASN A 108 9.361 -19.106 -11.299 1.00 0.00 H new ATOM 0 HD22 ASN A 108 7.801 -18.681 -10.587 1.00 0.00 H new ATOM 1672 N ALA A 109 7.997 -20.312 -6.111 1.00 0.00 N ATOM 1673 CA ALA A 109 8.757 -19.486 -5.224 1.00 0.00 C ATOM 1674 C ALA A 109 9.577 -20.326 -4.283 1.00 0.00 C ATOM 1675 O ALA A 109 9.108 -21.335 -3.744 1.00 0.00 O ATOM 1676 CB ALA A 109 7.844 -18.568 -4.454 1.00 0.00 C ATOM 0 H ALA A 109 7.014 -20.402 -5.853 1.00 0.00 H new ATOM 0 HA ALA A 109 9.440 -18.880 -5.819 1.00 0.00 H new ATOM 0 HB1 ALA A 109 8.436 -17.945 -3.783 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.296 -17.933 -5.150 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.139 -19.161 -3.871 1.00 0.00 H new ATOM 1682 N THR A 110 10.791 -19.935 -4.116 1.00 0.00 N ATOM 1683 CA THR A 110 11.701 -20.608 -3.257 1.00 0.00 C ATOM 1684 C THR A 110 11.931 -19.707 -2.031 1.00 0.00 C ATOM 1685 O THR A 110 11.702 -18.491 -2.103 1.00 0.00 O ATOM 1686 CB THR A 110 13.015 -20.871 -4.030 1.00 0.00 C ATOM 1687 OG1 THR A 110 12.673 -21.381 -5.338 1.00 0.00 O ATOM 1688 CG2 THR A 110 13.873 -21.919 -3.331 1.00 0.00 C ATOM 0 H THR A 110 11.188 -19.120 -4.583 1.00 0.00 H new ATOM 0 HA THR A 110 11.313 -21.571 -2.924 1.00 0.00 H new ATOM 0 HB THR A 110 13.576 -19.938 -4.087 1.00 0.00 H new ATOM 0 HG1 THR A 110 13.493 -21.553 -5.847 1.00 0.00 H new ATOM 0 HG21 THR A 110 14.788 -22.079 -3.901 1.00 0.00 H new ATOM 0 HG22 THR A 110 14.126 -21.573 -2.329 1.00 0.00 H new ATOM 0 HG23 THR A 110 13.320 -22.856 -3.263 1.00 0.00 H new ATOM 1696 N ALA A 111 12.348 -20.302 -0.934 1.00 0.00 N ATOM 1697 CA ALA A 111 12.547 -19.623 0.335 1.00 0.00 C ATOM 1698 C ALA A 111 13.608 -18.550 0.237 1.00 0.00 C ATOM 1699 O ALA A 111 14.572 -18.662 -0.545 1.00 0.00 O ATOM 1700 CB ALA A 111 12.904 -20.619 1.437 1.00 0.00 C ATOM 0 H ALA A 111 12.565 -21.298 -0.896 1.00 0.00 H new ATOM 0 HA ALA A 111 11.604 -19.139 0.591 1.00 0.00 H new ATOM 0 HB1 ALA A 111 13.048 -20.086 2.377 1.00 0.00 H new ATOM 0 HB2 ALA A 111 12.096 -21.342 1.550 1.00 0.00 H new ATOM 0 HB3 ALA A 111 13.823 -21.141 1.172 1.00 0.00 H new ATOM 1706 N GLY A 112 13.441 -17.540 1.021 1.00 0.00 N ATOM 1707 CA GLY A 112 14.330 -16.439 1.019 1.00 0.00 C ATOM 1708 C GLY A 112 13.606 -15.180 1.356 1.00 0.00 C ATOM 1709 O GLY A 112 12.377 -15.072 1.147 1.00 0.00 O ATOM 0 H GLY A 112 12.673 -17.459 1.687 1.00 0.00 H new ATOM 0 HA2 GLY A 112 15.130 -16.609 1.740 1.00 0.00 H new ATOM 0 HA3 GLY A 112 14.798 -16.345 0.039 1.00 0.00 H new ATOM 1713 N ASP A 113 14.325 -14.242 1.873 1.00 0.00 N ATOM 1714 CA ASP A 113 13.779 -12.973 2.246 1.00 0.00 C ATOM 1715 C ASP A 113 13.594 -12.158 0.991 1.00 0.00 C ATOM 1716 O ASP A 113 14.553 -11.868 0.284 1.00 0.00 O ATOM 1717 CB ASP A 113 14.718 -12.292 3.220 1.00 0.00 C ATOM 1718 CG ASP A 113 14.176 -11.009 3.744 1.00 0.00 C ATOM 1719 OD1 ASP A 113 13.165 -11.030 4.477 1.00 0.00 O ATOM 1720 OD2 ASP A 113 14.792 -9.961 3.519 1.00 0.00 O ATOM 0 H ASP A 113 15.325 -14.333 2.053 1.00 0.00 H new ATOM 0 HA ASP A 113 12.814 -13.086 2.740 1.00 0.00 H new ATOM 0 HB2 ASP A 113 14.918 -12.964 4.054 1.00 0.00 H new ATOM 0 HB3 ASP A 113 15.672 -12.104 2.727 1.00 0.00 H new ATOM 1725 N SER A 114 12.377 -11.840 0.683 1.00 0.00 N ATOM 1726 CA SER A 114 12.068 -11.212 -0.569 1.00 0.00 C ATOM 1727 C SER A 114 11.499 -9.829 -0.352 1.00 0.00 C ATOM 1728 O SER A 114 10.482 -9.667 0.320 1.00 0.00 O ATOM 1729 CB SER A 114 11.061 -12.085 -1.288 1.00 0.00 C ATOM 1730 OG SER A 114 11.479 -13.446 -1.249 1.00 0.00 O ATOM 0 H SER A 114 11.571 -12.006 1.286 1.00 0.00 H new ATOM 0 HA SER A 114 12.975 -11.103 -1.164 1.00 0.00 H new ATOM 0 HB2 SER A 114 10.081 -11.984 -0.821 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.957 -11.758 -2.322 1.00 0.00 H new ATOM 0 HG SER A 114 10.709 -14.029 -1.415 1.00 0.00 H new ATOM 1736 N ALA A 115 12.153 -8.846 -0.891 1.00 0.00 N ATOM 1737 CA ALA A 115 11.701 -7.495 -0.774 1.00 0.00 C ATOM 1738 C ALA A 115 10.838 -7.116 -1.963 1.00 0.00 C ATOM 1739 O ALA A 115 11.052 -7.593 -3.091 1.00 0.00 O ATOM 1740 CB ALA A 115 12.882 -6.545 -0.648 1.00 0.00 C ATOM 0 H ALA A 115 13.015 -8.959 -1.424 1.00 0.00 H new ATOM 0 HA ALA A 115 11.096 -7.413 0.129 1.00 0.00 H new ATOM 0 HB1 ALA A 115 12.518 -5.521 -0.560 1.00 0.00 H new ATOM 0 HB2 ALA A 115 13.462 -6.801 0.239 1.00 0.00 H new ATOM 0 HB3 ALA A 115 13.514 -6.631 -1.532 1.00 0.00 H new ATOM 1746 N LEU A 116 9.847 -6.324 -1.697 1.00 0.00 N ATOM 1747 CA LEU A 116 9.000 -5.743 -2.702 1.00 0.00 C ATOM 1748 C LEU A 116 9.522 -4.326 -2.893 1.00 0.00 C ATOM 1749 O LEU A 116 10.173 -3.795 -2.006 1.00 0.00 O ATOM 1750 CB LEU A 116 7.539 -5.693 -2.207 1.00 0.00 C ATOM 1751 CG LEU A 116 6.940 -6.999 -1.639 1.00 0.00 C ATOM 1752 CD1 LEU A 116 5.551 -6.742 -1.082 1.00 0.00 C ATOM 1753 CD2 LEU A 116 6.883 -8.090 -2.692 1.00 0.00 C ATOM 0 H LEU A 116 9.594 -6.053 -0.747 1.00 0.00 H new ATOM 0 HA LEU A 116 9.015 -6.321 -3.626 1.00 0.00 H new ATOM 0 HB2 LEU A 116 7.470 -4.926 -1.435 1.00 0.00 H new ATOM 0 HB3 LEU A 116 6.912 -5.367 -3.037 1.00 0.00 H new ATOM 0 HG LEU A 116 7.593 -7.341 -0.836 1.00 0.00 H new ATOM 0 HD11 LEU A 116 5.141 -7.671 -0.685 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.610 -6.001 -0.285 1.00 0.00 H new ATOM 0 HD13 LEU A 116 4.904 -6.369 -1.876 1.00 0.00 H new ATOM 0 HD21 LEU A 116 6.456 -8.994 -2.257 1.00 0.00 H new ATOM 0 HD22 LEU A 116 6.262 -7.760 -3.525 1.00 0.00 H new ATOM 0 HD23 LEU A 116 7.890 -8.301 -3.052 1.00 0.00 H new ATOM 1765 N THR A 117 9.284 -3.735 -4.002 1.00 0.00 N ATOM 1766 CA THR A 117 9.785 -2.417 -4.254 1.00 0.00 C ATOM 1767 C THR A 117 8.653 -1.453 -4.576 1.00 0.00 C ATOM 1768 O THR A 117 8.028 -1.554 -5.609 1.00 0.00 O ATOM 1769 CB THR A 117 10.827 -2.444 -5.405 1.00 0.00 C ATOM 1770 OG1 THR A 117 11.971 -3.218 -5.004 1.00 0.00 O ATOM 1771 CG2 THR A 117 11.283 -1.046 -5.785 1.00 0.00 C ATOM 0 H THR A 117 8.740 -4.139 -4.765 1.00 0.00 H new ATOM 0 HA THR A 117 10.278 -2.063 -3.349 1.00 0.00 H new ATOM 0 HB THR A 117 10.348 -2.895 -6.274 1.00 0.00 H new ATOM 0 HG1 THR A 117 12.626 -3.235 -5.733 1.00 0.00 H new ATOM 0 HG21 THR A 117 12.011 -1.108 -6.593 1.00 0.00 H new ATOM 0 HG22 THR A 117 10.425 -0.460 -6.114 1.00 0.00 H new ATOM 0 HG23 THR A 117 11.741 -0.565 -4.920 1.00 0.00 H new ATOM 1779 N VAL A 118 8.360 -0.550 -3.683 1.00 0.00 N ATOM 1780 CA VAL A 118 7.389 0.453 -3.998 1.00 0.00 C ATOM 1781 C VAL A 118 8.124 1.583 -4.687 1.00 0.00 C ATOM 1782 O VAL A 118 9.000 2.206 -4.091 1.00 0.00 O ATOM 1783 CB VAL A 118 6.616 0.960 -2.764 1.00 0.00 C ATOM 1784 CG1 VAL A 118 5.580 2.000 -3.171 1.00 0.00 C ATOM 1785 CG2 VAL A 118 5.941 -0.205 -2.043 1.00 0.00 C ATOM 0 H VAL A 118 8.771 -0.489 -2.751 1.00 0.00 H new ATOM 0 HA VAL A 118 6.627 0.023 -4.648 1.00 0.00 H new ATOM 0 HB VAL A 118 7.326 1.428 -2.083 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.045 2.346 -2.287 1.00 0.00 H new ATOM 0 HG12 VAL A 118 6.079 2.844 -3.646 1.00 0.00 H new ATOM 0 HG13 VAL A 118 4.874 1.555 -3.872 1.00 0.00 H new ATOM 0 HG21 VAL A 118 5.400 0.169 -1.174 1.00 0.00 H new ATOM 0 HG22 VAL A 118 5.244 -0.697 -2.721 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.697 -0.920 -1.719 1.00 0.00 H new ATOM 1795 N ASP A 119 7.786 1.786 -5.945 1.00 0.00 N ATOM 1796 CA ASP A 119 8.450 2.733 -6.845 1.00 0.00 C ATOM 1797 C ASP A 119 8.386 4.158 -6.284 1.00 0.00 C ATOM 1798 O ASP A 119 7.305 4.757 -6.241 1.00 0.00 O ATOM 1799 CB ASP A 119 7.770 2.689 -8.213 1.00 0.00 C ATOM 1800 CG ASP A 119 8.550 3.387 -9.299 1.00 0.00 C ATOM 1801 OD1 ASP A 119 8.454 4.628 -9.420 1.00 0.00 O ATOM 1802 OD2 ASP A 119 9.236 2.685 -10.081 1.00 0.00 O ATOM 0 H ASP A 119 7.018 1.285 -6.392 1.00 0.00 H new ATOM 0 HA ASP A 119 9.498 2.449 -6.940 1.00 0.00 H new ATOM 0 HB2 ASP A 119 7.616 1.649 -8.499 1.00 0.00 H new ATOM 0 HB3 ASP A 119 6.784 3.147 -8.134 1.00 0.00 H new ATOM 1807 N PRO A 120 9.544 4.718 -5.848 1.00 0.00 N ATOM 1808 CA PRO A 120 9.609 6.042 -5.214 1.00 0.00 C ATOM 1809 C PRO A 120 9.230 7.171 -6.160 1.00 0.00 C ATOM 1810 O PRO A 120 8.688 8.188 -5.730 1.00 0.00 O ATOM 1811 CB PRO A 120 11.080 6.191 -4.794 1.00 0.00 C ATOM 1812 CG PRO A 120 11.656 4.821 -4.867 1.00 0.00 C ATOM 1813 CD PRO A 120 10.880 4.096 -5.922 1.00 0.00 C ATOM 0 HA PRO A 120 8.904 6.108 -4.385 1.00 0.00 H new ATOM 0 HB2 PRO A 120 11.610 6.875 -5.457 1.00 0.00 H new ATOM 0 HB3 PRO A 120 11.161 6.597 -3.786 1.00 0.00 H new ATOM 0 HG2 PRO A 120 12.716 4.857 -5.120 1.00 0.00 H new ATOM 0 HG3 PRO A 120 11.575 4.313 -3.906 1.00 0.00 H new ATOM 0 HD2 PRO A 120 11.328 4.221 -6.908 1.00 0.00 H new ATOM 0 HD3 PRO A 120 10.837 3.025 -5.725 1.00 0.00 H new ATOM 1821 N ALA A 121 9.469 6.973 -7.447 1.00 0.00 N ATOM 1822 CA ALA A 121 9.189 7.995 -8.438 1.00 0.00 C ATOM 1823 C ALA A 121 7.691 8.130 -8.662 1.00 0.00 C ATOM 1824 O ALA A 121 7.187 9.213 -8.951 1.00 0.00 O ATOM 1825 CB ALA A 121 9.906 7.689 -9.744 1.00 0.00 C ATOM 0 H ALA A 121 9.857 6.110 -7.829 1.00 0.00 H new ATOM 0 HA ALA A 121 9.563 8.947 -8.062 1.00 0.00 H new ATOM 0 HB1 ALA A 121 9.682 8.468 -10.473 1.00 0.00 H new ATOM 0 HB2 ALA A 121 10.981 7.654 -9.569 1.00 0.00 H new ATOM 0 HB3 ALA A 121 9.569 6.726 -10.127 1.00 0.00 H new ATOM 1831 N THR A 122 6.984 7.037 -8.520 1.00 0.00 N ATOM 1832 CA THR A 122 5.573 7.023 -8.691 1.00 0.00 C ATOM 1833 C THR A 122 4.854 7.229 -7.329 1.00 0.00 C ATOM 1834 O THR A 122 3.644 7.452 -7.277 1.00 0.00 O ATOM 1835 CB THR A 122 5.187 5.679 -9.321 1.00 0.00 C ATOM 1836 OG1 THR A 122 6.100 5.415 -10.397 1.00 0.00 O ATOM 1837 CG2 THR A 122 3.802 5.738 -9.897 1.00 0.00 C ATOM 0 H THR A 122 7.385 6.130 -8.280 1.00 0.00 H new ATOM 0 HA THR A 122 5.263 7.840 -9.343 1.00 0.00 H new ATOM 0 HB THR A 122 5.224 4.904 -8.556 1.00 0.00 H new ATOM 0 HG1 THR A 122 6.968 5.144 -10.031 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.550 4.774 -10.338 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.089 5.973 -9.107 1.00 0.00 H new ATOM 0 HG23 THR A 122 3.760 6.510 -10.665 1.00 0.00 H new ATOM 1845 N LEU A 123 5.613 7.181 -6.246 1.00 0.00 N ATOM 1846 CA LEU A 123 5.057 7.345 -4.920 1.00 0.00 C ATOM 1847 C LEU A 123 4.943 8.843 -4.630 1.00 0.00 C ATOM 1848 O LEU A 123 5.946 9.538 -4.458 1.00 0.00 O ATOM 1849 CB LEU A 123 5.940 6.605 -3.872 1.00 0.00 C ATOM 1850 CG LEU A 123 5.332 6.263 -2.480 1.00 0.00 C ATOM 1851 CD1 LEU A 123 6.319 5.440 -1.681 1.00 0.00 C ATOM 1852 CD2 LEU A 123 4.946 7.498 -1.678 1.00 0.00 C ATOM 0 H LEU A 123 6.621 7.029 -6.264 1.00 0.00 H new ATOM 0 HA LEU A 123 4.063 6.902 -4.859 1.00 0.00 H new ATOM 0 HB2 LEU A 123 6.274 5.671 -4.324 1.00 0.00 H new ATOM 0 HB3 LEU A 123 6.829 7.213 -3.703 1.00 0.00 H new ATOM 0 HG LEU A 123 4.418 5.699 -2.666 1.00 0.00 H new ATOM 0 HD11 LEU A 123 5.890 5.202 -0.707 1.00 0.00 H new ATOM 0 HD12 LEU A 123 6.539 4.516 -2.216 1.00 0.00 H new ATOM 0 HD13 LEU A 123 7.239 6.008 -1.544 1.00 0.00 H new ATOM 0 HD21 LEU A 123 4.529 7.193 -0.718 1.00 0.00 H new ATOM 0 HD22 LEU A 123 5.830 8.114 -1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 123 4.203 8.073 -2.231 1.00 0.00 H new ATOM 1864 N ILE A 124 3.728 9.320 -4.611 1.00 0.00 N ATOM 1865 CA ILE A 124 3.406 10.724 -4.399 1.00 0.00 C ATOM 1866 C ILE A 124 2.288 10.781 -3.377 1.00 0.00 C ATOM 1867 O ILE A 124 1.309 10.067 -3.519 1.00 0.00 O ATOM 1868 CB ILE A 124 2.888 11.386 -5.726 1.00 0.00 C ATOM 1869 CG1 ILE A 124 3.924 11.245 -6.859 1.00 0.00 C ATOM 1870 CG2 ILE A 124 2.529 12.864 -5.503 1.00 0.00 C ATOM 1871 CD1 ILE A 124 3.436 11.718 -8.212 1.00 0.00 C ATOM 0 H ILE A 124 2.904 8.734 -4.745 1.00 0.00 H new ATOM 0 HA ILE A 124 4.297 11.256 -4.066 1.00 0.00 H new ATOM 0 HB ILE A 124 1.983 10.858 -6.026 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.817 11.809 -6.591 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.219 10.199 -6.938 1.00 0.00 H new ATOM 0 HG21 ILE A 124 2.173 13.297 -6.438 1.00 0.00 H new ATOM 0 HG22 ILE A 124 1.747 12.938 -4.748 1.00 0.00 H new ATOM 0 HG23 ILE A 124 3.412 13.406 -5.165 1.00 0.00 H new ATOM 0 HD11 ILE A 124 4.226 11.584 -8.951 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.561 11.138 -8.506 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.169 12.773 -8.154 1.00 0.00 H new ATOM 1883 N VAL A 125 2.432 11.581 -2.347 1.00 0.00 N ATOM 1884 CA VAL A 125 1.390 11.704 -1.335 1.00 0.00 C ATOM 1885 C VAL A 125 1.138 13.173 -1.052 1.00 0.00 C ATOM 1886 O VAL A 125 1.874 13.815 -0.300 1.00 0.00 O ATOM 1887 CB VAL A 125 1.724 10.946 -0.010 1.00 0.00 C ATOM 1888 CG1 VAL A 125 0.633 11.127 1.039 1.00 0.00 C ATOM 1889 CG2 VAL A 125 1.967 9.464 -0.253 1.00 0.00 C ATOM 0 H VAL A 125 3.256 12.159 -2.181 1.00 0.00 H new ATOM 0 HA VAL A 125 0.492 11.234 -1.736 1.00 0.00 H new ATOM 0 HB VAL A 125 2.644 11.389 0.372 1.00 0.00 H new ATOM 0 HG11 VAL A 125 0.905 10.584 1.944 1.00 0.00 H new ATOM 0 HG12 VAL A 125 0.523 12.186 1.271 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -0.310 10.740 0.653 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.196 8.973 0.693 1.00 0.00 H new ATOM 0 HG22 VAL A 125 1.074 9.015 -0.688 1.00 0.00 H new ATOM 0 HG23 VAL A 125 2.806 9.340 -0.938 1.00 0.00 H new ATOM 1899 N ALA A 126 0.124 13.689 -1.679 1.00 0.00 N ATOM 1900 CA ALA A 126 -0.241 15.076 -1.577 1.00 0.00 C ATOM 1901 C ALA A 126 -1.479 15.214 -0.709 1.00 0.00 C ATOM 1902 O ALA A 126 -2.388 14.383 -0.794 1.00 0.00 O ATOM 1903 CB ALA A 126 -0.498 15.625 -2.968 1.00 0.00 C ATOM 0 H ALA A 126 -0.488 13.148 -2.290 1.00 0.00 H new ATOM 0 HA ALA A 126 0.568 15.643 -1.116 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -0.775 16.677 -2.899 1.00 0.00 H new ATOM 0 HB2 ALA A 126 0.405 15.527 -3.570 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -1.309 15.066 -3.436 1.00 0.00 H new ATOM 1909 N ASP A 127 -1.522 16.240 0.122 1.00 0.00 N ATOM 1910 CA ASP A 127 -2.644 16.459 1.050 1.00 0.00 C ATOM 1911 C ASP A 127 -3.832 17.151 0.344 1.00 0.00 C ATOM 1912 O ASP A 127 -3.891 17.189 -0.894 1.00 0.00 O ATOM 1913 CB ASP A 127 -2.186 17.294 2.267 1.00 0.00 C ATOM 1914 CG ASP A 127 -2.049 18.777 1.978 1.00 0.00 C ATOM 1915 OD1 ASP A 127 -1.226 19.168 1.143 1.00 0.00 O ATOM 1916 OD2 ASP A 127 -2.804 19.565 2.576 1.00 0.00 O ATOM 0 H ASP A 127 -0.790 16.948 0.181 1.00 0.00 H new ATOM 0 HA ASP A 127 -2.981 15.483 1.398 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -2.900 17.156 3.079 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -1.227 16.912 2.617 1.00 0.00 H new ATOM 1921 N GLU A 128 -4.794 17.652 1.135 1.00 0.00 N ATOM 1922 CA GLU A 128 -5.944 18.403 0.624 1.00 0.00 C ATOM 1923 C GLU A 128 -5.498 19.696 -0.082 1.00 0.00 C ATOM 1924 O GLU A 128 -6.160 20.173 -0.998 1.00 0.00 O ATOM 1925 CB GLU A 128 -6.942 18.735 1.749 1.00 0.00 C ATOM 1926 CG GLU A 128 -6.345 19.494 2.934 1.00 0.00 C ATOM 1927 CD GLU A 128 -7.402 20.042 3.854 1.00 0.00 C ATOM 1928 OE1 GLU A 128 -7.931 19.311 4.689 1.00 0.00 O ATOM 1929 OE2 GLU A 128 -7.745 21.236 3.737 1.00 0.00 O ATOM 0 H GLU A 128 -4.793 17.545 2.149 1.00 0.00 H new ATOM 0 HA GLU A 128 -6.445 17.765 -0.105 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -7.756 19.326 1.330 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -7.378 17.805 2.114 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -5.688 18.829 3.495 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -5.728 20.313 2.564 1.00 0.00 H new ATOM 1936 N ASN A 129 -4.367 20.232 0.334 1.00 0.00 N ATOM 1937 CA ASN A 129 -3.778 21.432 -0.252 1.00 0.00 C ATOM 1938 C ASN A 129 -2.739 21.018 -1.325 1.00 0.00 C ATOM 1939 O ASN A 129 -1.899 21.801 -1.734 1.00 0.00 O ATOM 1940 CB ASN A 129 -3.105 22.263 0.866 1.00 0.00 C ATOM 1941 CG ASN A 129 -2.582 23.620 0.416 1.00 0.00 C ATOM 1942 OD1 ASN A 129 -3.157 24.276 -0.444 1.00 0.00 O ATOM 1943 ND2 ASN A 129 -1.466 24.016 0.958 1.00 0.00 N ATOM 0 H ASN A 129 -3.818 19.843 1.101 1.00 0.00 H new ATOM 0 HA ASN A 129 -4.549 22.039 -0.727 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -3.823 22.414 1.672 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -2.277 21.688 1.280 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -1.043 24.898 0.669 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -1.015 23.444 1.672 1.00 0.00 H new ATOM 1950 N ASP A 130 -2.815 19.746 -1.746 1.00 0.00 N ATOM 1951 CA ASP A 130 -1.988 19.113 -2.827 1.00 0.00 C ATOM 1952 C ASP A 130 -0.478 19.151 -2.595 1.00 0.00 C ATOM 1953 O ASP A 130 0.305 18.909 -3.524 1.00 0.00 O ATOM 1954 CB ASP A 130 -2.329 19.596 -4.274 1.00 0.00 C ATOM 1955 CG ASP A 130 -1.993 21.050 -4.600 1.00 0.00 C ATOM 1956 OD1 ASP A 130 -0.798 21.405 -4.771 1.00 0.00 O ATOM 1957 OD2 ASP A 130 -2.921 21.853 -4.768 1.00 0.00 O ATOM 0 H ASP A 130 -3.478 19.088 -1.335 1.00 0.00 H new ATOM 0 HA ASP A 130 -2.291 18.069 -2.753 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -1.801 18.956 -4.981 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -3.395 19.445 -4.442 1.00 0.00 H new ATOM 1962 N LYS A 131 -0.061 19.348 -1.382 1.00 0.00 N ATOM 1963 CA LYS A 131 1.342 19.413 -1.095 1.00 0.00 C ATOM 1964 C LYS A 131 1.830 18.062 -0.644 1.00 0.00 C ATOM 1965 O LYS A 131 1.232 17.436 0.236 1.00 0.00 O ATOM 1966 CB LYS A 131 1.637 20.507 -0.062 1.00 0.00 C ATOM 1967 CG LYS A 131 1.192 21.894 -0.518 1.00 0.00 C ATOM 1968 CD LYS A 131 1.949 22.351 -1.761 1.00 0.00 C ATOM 1969 CE LYS A 131 1.341 23.605 -2.358 1.00 0.00 C ATOM 1970 NZ LYS A 131 -0.011 23.359 -2.922 1.00 0.00 N ATOM 0 H LYS A 131 -0.671 19.467 -0.573 1.00 0.00 H new ATOM 0 HA LYS A 131 1.884 19.682 -2.002 1.00 0.00 H new ATOM 0 HB2 LYS A 131 1.135 20.260 0.874 1.00 0.00 H new ATOM 0 HB3 LYS A 131 2.707 20.525 0.145 1.00 0.00 H new ATOM 0 HG2 LYS A 131 0.122 21.882 -0.728 1.00 0.00 H new ATOM 0 HG3 LYS A 131 1.351 22.610 0.288 1.00 0.00 H new ATOM 0 HD2 LYS A 131 2.991 22.539 -1.504 1.00 0.00 H new ATOM 0 HD3 LYS A 131 1.943 21.554 -2.505 1.00 0.00 H new ATOM 0 HE2 LYS A 131 1.278 24.377 -1.591 1.00 0.00 H new ATOM 0 HE3 LYS A 131 1.996 23.987 -3.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -0.388 24.243 -3.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 0.051 22.642 -3.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -0.644 23.020 -2.170 1.00 0.00 H new ATOM 1984 N ASP A 132 2.868 17.587 -1.301 1.00 0.00 N ATOM 1985 CA ASP A 132 3.462 16.302 -0.981 1.00 0.00 C ATOM 1986 C ASP A 132 4.149 16.372 0.364 1.00 0.00 C ATOM 1987 O ASP A 132 5.079 17.161 0.566 1.00 0.00 O ATOM 1988 CB ASP A 132 4.430 15.859 -2.069 1.00 0.00 C ATOM 1989 CG ASP A 132 5.099 14.541 -1.763 1.00 0.00 C ATOM 1990 OD1 ASP A 132 4.617 13.484 -2.216 1.00 0.00 O ATOM 1991 OD2 ASP A 132 6.164 14.532 -1.111 1.00 0.00 O ATOM 0 H ASP A 132 3.324 18.078 -2.070 1.00 0.00 H new ATOM 0 HA ASP A 132 2.669 15.556 -0.928 1.00 0.00 H new ATOM 0 HB2 ASP A 132 3.893 15.777 -3.014 1.00 0.00 H new ATOM 0 HB3 ASP A 132 5.194 16.625 -2.202 1.00 0.00 H new ATOM 1996 N ILE A 133 3.689 15.567 1.265 1.00 0.00 N ATOM 1997 CA ILE A 133 4.138 15.590 2.646 1.00 0.00 C ATOM 1998 C ILE A 133 4.598 14.228 3.113 1.00 0.00 C ATOM 1999 O ILE A 133 4.494 13.911 4.290 1.00 0.00 O ATOM 2000 CB ILE A 133 2.989 16.072 3.575 1.00 0.00 C ATOM 2001 CG1 ILE A 133 1.653 15.351 3.251 1.00 0.00 C ATOM 2002 CG2 ILE A 133 2.831 17.575 3.548 1.00 0.00 C ATOM 2003 CD1 ILE A 133 0.477 15.798 4.103 1.00 0.00 C ATOM 0 H ILE A 133 2.980 14.859 1.074 1.00 0.00 H new ATOM 0 HA ILE A 133 4.982 16.278 2.696 1.00 0.00 H new ATOM 0 HB ILE A 133 3.268 15.801 4.593 1.00 0.00 H new ATOM 0 HG12 ILE A 133 1.410 15.517 2.202 1.00 0.00 H new ATOM 0 HG13 ILE A 133 1.793 14.278 3.380 1.00 0.00 H new ATOM 0 HG21 ILE A 133 2.017 17.867 4.211 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.757 18.044 3.881 1.00 0.00 H new ATOM 0 HG23 ILE A 133 2.605 17.899 2.532 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -0.415 15.244 3.811 1.00 0.00 H new ATOM 0 HD12 ILE A 133 0.695 15.606 5.154 1.00 0.00 H new ATOM 0 HD13 ILE A 133 0.306 16.865 3.957 1.00 0.00 H new ATOM 2015 N LYS A 134 5.187 13.454 2.239 1.00 0.00 N ATOM 2016 CA LYS A 134 5.512 12.104 2.623 1.00 0.00 C ATOM 2017 C LYS A 134 6.977 11.836 2.907 1.00 0.00 C ATOM 2018 O LYS A 134 7.871 12.224 2.157 1.00 0.00 O ATOM 2019 CB LYS A 134 4.931 11.094 1.615 1.00 0.00 C ATOM 2020 CG LYS A 134 5.314 11.288 0.123 1.00 0.00 C ATOM 2021 CD LYS A 134 6.656 10.655 -0.233 1.00 0.00 C ATOM 2022 CE LYS A 134 7.038 10.857 -1.698 1.00 0.00 C ATOM 2023 NZ LYS A 134 7.377 12.255 -2.021 1.00 0.00 N ATOM 0 H LYS A 134 5.444 13.721 1.289 1.00 0.00 H new ATOM 0 HA LYS A 134 5.032 11.966 3.592 1.00 0.00 H new ATOM 0 HB2 LYS A 134 5.244 10.095 1.918 1.00 0.00 H new ATOM 0 HB3 LYS A 134 3.844 11.125 1.693 1.00 0.00 H new ATOM 0 HG2 LYS A 134 4.536 10.855 -0.506 1.00 0.00 H new ATOM 0 HG3 LYS A 134 5.350 12.354 -0.102 1.00 0.00 H new ATOM 0 HD2 LYS A 134 7.433 11.081 0.402 1.00 0.00 H new ATOM 0 HD3 LYS A 134 6.617 9.587 -0.017 1.00 0.00 H new ATOM 0 HE2 LYS A 134 7.889 10.219 -1.936 1.00 0.00 H new ATOM 0 HE3 LYS A 134 6.211 10.535 -2.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 7.028 12.486 -2.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 6.933 12.889 -1.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 8.409 12.378 -1.992 1.00 0.00 H new ATOM 2037 N ASP A 135 7.203 11.230 4.035 1.00 0.00 N ATOM 2038 CA ASP A 135 8.471 10.648 4.369 1.00 0.00 C ATOM 2039 C ASP A 135 8.329 9.189 4.035 1.00 0.00 C ATOM 2040 O ASP A 135 7.629 8.457 4.739 1.00 0.00 O ATOM 2041 CB ASP A 135 8.816 10.837 5.842 1.00 0.00 C ATOM 2042 CG ASP A 135 10.209 10.363 6.161 1.00 0.00 C ATOM 2043 OD1 ASP A 135 11.175 11.030 5.753 1.00 0.00 O ATOM 2044 OD2 ASP A 135 10.374 9.340 6.854 1.00 0.00 O ATOM 0 H ASP A 135 6.497 11.124 4.764 1.00 0.00 H new ATOM 0 HA ASP A 135 9.282 11.123 3.818 1.00 0.00 H new ATOM 0 HB2 ASP A 135 8.723 11.891 6.104 1.00 0.00 H new ATOM 0 HB3 ASP A 135 8.098 10.292 6.455 1.00 0.00 H new ATOM 2049 N ALA A 136 8.913 8.751 2.976 1.00 0.00 N ATOM 2050 CA ALA A 136 8.607 7.425 2.527 1.00 0.00 C ATOM 2051 C ALA A 136 9.713 6.438 2.709 1.00 0.00 C ATOM 2052 O ALA A 136 10.887 6.722 2.457 1.00 0.00 O ATOM 2053 CB ALA A 136 8.157 7.441 1.082 1.00 0.00 C ATOM 0 H ALA A 136 9.588 9.268 2.413 1.00 0.00 H new ATOM 0 HA ALA A 136 7.795 7.085 3.169 1.00 0.00 H new ATOM 0 HB1 ALA A 136 7.930 6.425 0.760 1.00 0.00 H new ATOM 0 HB2 ALA A 136 7.265 8.060 0.985 1.00 0.00 H new ATOM 0 HB3 ALA A 136 8.952 7.850 0.458 1.00 0.00 H new ATOM 2059 N ALA A 137 9.329 5.317 3.236 1.00 0.00 N ATOM 2060 CA ALA A 137 10.116 4.134 3.246 1.00 0.00 C ATOM 2061 C ALA A 137 9.142 3.075 2.832 1.00 0.00 C ATOM 2062 O ALA A 137 8.181 2.791 3.549 1.00 0.00 O ATOM 2063 CB ALA A 137 10.659 3.853 4.641 1.00 0.00 C ATOM 0 H ALA A 137 8.422 5.202 3.688 1.00 0.00 H new ATOM 0 HA ALA A 137 10.988 4.195 2.595 1.00 0.00 H new ATOM 0 HB1 ALA A 137 11.258 2.942 4.622 1.00 0.00 H new ATOM 0 HB2 ALA A 137 11.279 4.689 4.965 1.00 0.00 H new ATOM 0 HB3 ALA A 137 9.829 3.727 5.336 1.00 0.00 H new ATOM 2069 N SER A 138 9.322 2.520 1.679 1.00 0.00 N ATOM 2070 CA SER A 138 8.360 1.604 1.177 1.00 0.00 C ATOM 2071 C SER A 138 8.982 0.504 0.351 1.00 0.00 C ATOM 2072 O SER A 138 9.456 0.708 -0.772 1.00 0.00 O ATOM 2073 CB SER A 138 7.269 2.347 0.389 1.00 0.00 C ATOM 2074 OG SER A 138 6.579 3.272 1.219 1.00 0.00 O ATOM 0 H SER A 138 10.124 2.686 1.071 1.00 0.00 H new ATOM 0 HA SER A 138 7.898 1.118 2.036 1.00 0.00 H new ATOM 0 HB2 SER A 138 7.719 2.874 -0.453 1.00 0.00 H new ATOM 0 HB3 SER A 138 6.562 1.628 -0.026 1.00 0.00 H new ATOM 0 HG SER A 138 5.715 3.493 0.814 1.00 0.00 H new ATOM 2080 N ASN A 139 8.999 -0.635 0.934 1.00 0.00 N ATOM 2081 CA ASN A 139 9.416 -1.834 0.315 1.00 0.00 C ATOM 2082 C ASN A 139 8.354 -2.866 0.536 1.00 0.00 C ATOM 2083 O ASN A 139 7.515 -3.087 -0.326 1.00 0.00 O ATOM 2084 CB ASN A 139 10.766 -2.322 0.871 1.00 0.00 C ATOM 2085 CG ASN A 139 11.995 -1.788 0.148 1.00 0.00 C ATOM 2086 OD1 ASN A 139 11.956 -1.740 -1.154 1.00 0.00 O flip ATOM 2087 ND2 ASN A 139 13.020 -1.528 0.774 1.00 0.00 N flip ATOM 0 H ASN A 139 8.708 -0.762 1.903 1.00 0.00 H new ATOM 0 HA ASN A 139 9.560 -1.657 -0.751 1.00 0.00 H new ATOM 0 HB2 ASN A 139 10.831 -2.040 1.922 1.00 0.00 H new ATOM 0 HB3 ASN A 139 10.785 -3.411 0.831 1.00 0.00 H new ATOM 0 HD21 ASN A 139 13.021 -1.574 1.793 1.00 0.00 H new ATOM 0 HD22 ASN A 139 13.870 -1.266 0.275 1.00 0.00 H new ATOM 2094 N GLY A 140 8.322 -3.406 1.735 1.00 0.00 N ATOM 2095 CA GLY A 140 7.440 -4.488 2.032 1.00 0.00 C ATOM 2096 C GLY A 140 8.234 -5.723 1.862 1.00 0.00 C ATOM 2097 O GLY A 140 8.817 -5.933 0.809 1.00 0.00 O ATOM 0 H GLY A 140 8.904 -3.104 2.516 1.00 0.00 H new ATOM 0 HA2 GLY A 140 7.055 -4.409 3.049 1.00 0.00 H new ATOM 0 HA3 GLY A 140 6.579 -4.483 1.364 1.00 0.00 H new ATOM 2101 N LYS A 141 8.338 -6.522 2.857 1.00 0.00 N ATOM 2102 CA LYS A 141 9.224 -7.617 2.725 1.00 0.00 C ATOM 2103 C LYS A 141 8.584 -8.878 3.210 1.00 0.00 C ATOM 2104 O LYS A 141 7.963 -8.904 4.266 1.00 0.00 O ATOM 2105 CB LYS A 141 10.538 -7.266 3.426 1.00 0.00 C ATOM 2106 CG LYS A 141 11.717 -8.138 3.069 1.00 0.00 C ATOM 2107 CD LYS A 141 13.025 -7.406 3.355 1.00 0.00 C ATOM 2108 CE LYS A 141 13.268 -7.167 4.836 1.00 0.00 C ATOM 2109 NZ LYS A 141 13.501 -8.431 5.557 1.00 0.00 N ATOM 0 H LYS A 141 7.840 -6.446 3.744 1.00 0.00 H new ATOM 0 HA LYS A 141 9.458 -7.808 1.678 1.00 0.00 H new ATOM 0 HB2 LYS A 141 10.789 -6.231 3.192 1.00 0.00 H new ATOM 0 HB3 LYS A 141 10.381 -7.320 4.503 1.00 0.00 H new ATOM 0 HG2 LYS A 141 11.679 -9.065 3.641 1.00 0.00 H new ATOM 0 HG3 LYS A 141 11.669 -8.412 2.015 1.00 0.00 H new ATOM 0 HD2 LYS A 141 13.854 -7.984 2.946 1.00 0.00 H new ATOM 0 HD3 LYS A 141 13.018 -6.448 2.836 1.00 0.00 H new ATOM 0 HE2 LYS A 141 14.129 -6.511 4.963 1.00 0.00 H new ATOM 0 HE3 LYS A 141 12.409 -6.654 5.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 13.152 -8.343 6.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 12.996 -9.203 5.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 14.520 -8.640 5.571 1.00 0.00 H new ATOM 2123 N ILE A 142 8.683 -9.893 2.405 1.00 0.00 N ATOM 2124 CA ILE A 142 8.089 -11.166 2.672 1.00 0.00 C ATOM 2125 C ILE A 142 9.191 -12.199 2.781 1.00 0.00 C ATOM 2126 O ILE A 142 9.891 -12.485 1.807 1.00 0.00 O ATOM 2127 CB ILE A 142 7.123 -11.593 1.526 1.00 0.00 C ATOM 2128 CG1 ILE A 142 6.098 -10.481 1.233 1.00 0.00 C ATOM 2129 CG2 ILE A 142 6.403 -12.897 1.903 1.00 0.00 C ATOM 2130 CD1 ILE A 142 5.222 -10.741 0.023 1.00 0.00 C ATOM 0 H ILE A 142 9.192 -9.856 1.522 1.00 0.00 H new ATOM 0 HA ILE A 142 7.519 -11.094 3.598 1.00 0.00 H new ATOM 0 HB ILE A 142 7.710 -11.761 0.623 1.00 0.00 H new ATOM 0 HG12 ILE A 142 5.460 -10.352 2.107 1.00 0.00 H new ATOM 0 HG13 ILE A 142 6.631 -9.542 1.086 1.00 0.00 H new ATOM 0 HG21 ILE A 142 5.730 -13.187 1.096 1.00 0.00 H new ATOM 0 HG22 ILE A 142 7.138 -13.685 2.064 1.00 0.00 H new ATOM 0 HG23 ILE A 142 5.829 -12.745 2.817 1.00 0.00 H new ATOM 0 HD11 ILE A 142 4.530 -9.909 -0.111 1.00 0.00 H new ATOM 0 HD12 ILE A 142 5.847 -10.839 -0.864 1.00 0.00 H new ATOM 0 HD13 ILE A 142 4.658 -11.662 0.173 1.00 0.00 H new ATOM 2142 N THR A 143 9.381 -12.711 3.942 1.00 0.00 N ATOM 2143 CA THR A 143 10.334 -13.739 4.145 1.00 0.00 C ATOM 2144 C THR A 143 9.668 -15.086 3.829 1.00 0.00 C ATOM 2145 O THR A 143 8.787 -15.540 4.560 1.00 0.00 O ATOM 2146 CB THR A 143 10.867 -13.717 5.596 1.00 0.00 C ATOM 2147 OG1 THR A 143 11.341 -12.382 5.927 1.00 0.00 O ATOM 2148 CG2 THR A 143 12.012 -14.706 5.762 1.00 0.00 C ATOM 0 H THR A 143 8.877 -12.427 4.782 1.00 0.00 H new ATOM 0 HA THR A 143 11.187 -13.585 3.485 1.00 0.00 H new ATOM 0 HB THR A 143 10.053 -13.999 6.264 1.00 0.00 H new ATOM 0 HG1 THR A 143 11.926 -12.056 5.212 1.00 0.00 H new ATOM 0 HG21 THR A 143 12.373 -14.675 6.790 1.00 0.00 H new ATOM 0 HG22 THR A 143 11.661 -15.712 5.531 1.00 0.00 H new ATOM 0 HG23 THR A 143 12.823 -14.440 5.084 1.00 0.00 H new ATOM 2156 N VAL A 144 10.032 -15.671 2.712 1.00 0.00 N ATOM 2157 CA VAL A 144 9.484 -16.949 2.326 1.00 0.00 C ATOM 2158 C VAL A 144 10.229 -18.016 3.092 1.00 0.00 C ATOM 2159 O VAL A 144 11.447 -18.127 2.977 1.00 0.00 O ATOM 2160 CB VAL A 144 9.621 -17.221 0.798 1.00 0.00 C ATOM 2161 CG1 VAL A 144 8.931 -18.526 0.410 1.00 0.00 C ATOM 2162 CG2 VAL A 144 9.061 -16.072 -0.017 1.00 0.00 C ATOM 0 H VAL A 144 10.707 -15.281 2.054 1.00 0.00 H new ATOM 0 HA VAL A 144 8.418 -16.954 2.554 1.00 0.00 H new ATOM 0 HB VAL A 144 10.685 -17.312 0.577 1.00 0.00 H new ATOM 0 HG11 VAL A 144 9.042 -18.692 -0.662 1.00 0.00 H new ATOM 0 HG12 VAL A 144 9.386 -19.354 0.954 1.00 0.00 H new ATOM 0 HG13 VAL A 144 7.872 -18.466 0.660 1.00 0.00 H new ATOM 0 HG21 VAL A 144 9.171 -16.292 -1.079 1.00 0.00 H new ATOM 0 HG22 VAL A 144 8.005 -15.940 0.219 1.00 0.00 H new ATOM 0 HG23 VAL A 144 9.604 -15.158 0.223 1.00 0.00 H new ATOM 2172 N THR A 145 9.528 -18.729 3.903 1.00 0.00 N ATOM 2173 CA THR A 145 10.099 -19.765 4.688 1.00 0.00 C ATOM 2174 C THR A 145 9.748 -21.131 4.116 1.00 0.00 C ATOM 2175 O THR A 145 8.566 -21.501 4.050 1.00 0.00 O ATOM 2176 CB THR A 145 9.626 -19.651 6.148 1.00 0.00 C ATOM 2177 OG1 THR A 145 8.192 -19.472 6.183 1.00 0.00 O ATOM 2178 CG2 THR A 145 10.297 -18.477 6.852 1.00 0.00 C ATOM 0 H THR A 145 8.525 -18.606 4.041 1.00 0.00 H new ATOM 0 HA THR A 145 11.183 -19.657 4.665 1.00 0.00 H new ATOM 0 HB THR A 145 9.900 -20.570 6.667 1.00 0.00 H new ATOM 0 HG1 THR A 145 7.753 -20.287 5.861 1.00 0.00 H new ATOM 0 HG21 THR A 145 9.944 -18.420 7.882 1.00 0.00 H new ATOM 0 HG22 THR A 145 11.378 -18.619 6.846 1.00 0.00 H new ATOM 0 HG23 THR A 145 10.049 -17.551 6.332 1.00 0.00 H new ATOM 2186 N GLY A 146 10.753 -21.855 3.689 1.00 0.00 N ATOM 2187 CA GLY A 146 10.538 -23.178 3.165 1.00 0.00 C ATOM 2188 C GLY A 146 10.420 -23.224 1.667 1.00 0.00 C ATOM 2189 O GLY A 146 10.209 -22.200 1.020 1.00 0.00 O ATOM 0 H GLY A 146 11.726 -21.550 3.695 1.00 0.00 H new ATOM 0 HA2 GLY A 146 11.362 -23.820 3.475 1.00 0.00 H new ATOM 0 HA3 GLY A 146 9.630 -23.590 3.605 1.00 0.00 H new ATOM 2193 N SER A 147 10.589 -24.399 1.105 1.00 0.00 N ATOM 2194 CA SER A 147 10.517 -24.624 -0.327 1.00 0.00 C ATOM 2195 C SER A 147 10.234 -26.079 -0.590 1.00 0.00 C ATOM 2196 O SER A 147 10.089 -26.877 0.351 1.00 0.00 O ATOM 2197 CB SER A 147 11.872 -24.298 -0.978 1.00 0.00 C ATOM 2198 OG SER A 147 12.244 -22.984 -0.717 1.00 0.00 O ATOM 0 H SER A 147 10.785 -25.246 1.639 1.00 0.00 H new ATOM 0 HA SER A 147 9.732 -23.990 -0.738 1.00 0.00 H new ATOM 0 HB2 SER A 147 12.635 -24.978 -0.600 1.00 0.00 H new ATOM 0 HB3 SER A 147 11.810 -24.456 -2.055 1.00 0.00 H new ATOM 0 HG SER A 147 13.206 -22.947 -0.532 1.00 0.00 H new ATOM 2204 N ALA A 148 10.121 -26.413 -1.854 1.00 0.00 N ATOM 2205 CA ALA A 148 10.098 -27.777 -2.278 1.00 0.00 C ATOM 2206 C ALA A 148 11.545 -28.114 -2.639 1.00 0.00 C ATOM 2207 O ALA A 148 12.050 -27.667 -3.675 1.00 0.00 O ATOM 2208 CB ALA A 148 9.181 -27.949 -3.475 1.00 0.00 C ATOM 0 H ALA A 148 10.043 -25.737 -2.614 1.00 0.00 H new ATOM 0 HA ALA A 148 9.716 -28.440 -1.501 1.00 0.00 H new ATOM 0 HB1 ALA A 148 9.177 -28.995 -3.783 1.00 0.00 H new ATOM 0 HB2 ALA A 148 8.169 -27.646 -3.205 1.00 0.00 H new ATOM 0 HB3 ALA A 148 9.537 -27.330 -4.298 1.00 0.00 H new ATOM 2214 N PRO A 149 12.257 -28.864 -1.774 1.00 0.00 N ATOM 2215 CA PRO A 149 13.709 -29.109 -1.919 1.00 0.00 C ATOM 2216 C PRO A 149 14.082 -30.022 -3.085 1.00 0.00 C ATOM 2217 O PRO A 149 15.272 -30.258 -3.331 1.00 0.00 O ATOM 2218 CB PRO A 149 14.075 -29.774 -0.598 1.00 0.00 C ATOM 2219 CG PRO A 149 12.833 -30.476 -0.194 1.00 0.00 C ATOM 2220 CD PRO A 149 11.716 -29.559 -0.581 1.00 0.00 C ATOM 0 HA PRO A 149 14.239 -28.181 -2.134 1.00 0.00 H new ATOM 0 HB2 PRO A 149 14.906 -30.469 -0.718 1.00 0.00 H new ATOM 0 HB3 PRO A 149 14.379 -29.040 0.148 1.00 0.00 H new ATOM 0 HG2 PRO A 149 12.744 -31.438 -0.698 1.00 0.00 H new ATOM 0 HG3 PRO A 149 12.825 -30.675 0.878 1.00 0.00 H new ATOM 0 HD2 PRO A 149 10.804 -30.109 -0.813 1.00 0.00 H new ATOM 0 HD3 PRO A 149 11.472 -28.859 0.218 1.00 0.00 H new ATOM 2228 N THR A 150 13.062 -30.548 -3.776 1.00 0.00 N ATOM 2229 CA THR A 150 13.230 -31.426 -4.919 1.00 0.00 C ATOM 2230 C THR A 150 13.955 -32.703 -4.447 1.00 0.00 C ATOM 2231 O THR A 150 14.943 -33.162 -5.034 1.00 0.00 O ATOM 2232 CB THR A 150 14.008 -30.685 -6.043 1.00 0.00 C ATOM 2233 OG1 THR A 150 13.447 -29.362 -6.162 1.00 0.00 O ATOM 2234 CG2 THR A 150 13.843 -31.390 -7.383 1.00 0.00 C ATOM 0 H THR A 150 12.085 -30.366 -3.545 1.00 0.00 H new ATOM 0 HA THR A 150 12.265 -31.712 -5.338 1.00 0.00 H new ATOM 0 HB THR A 150 15.068 -30.662 -5.789 1.00 0.00 H new ATOM 0 HG1 THR A 150 13.920 -28.868 -6.864 1.00 0.00 H new ATOM 0 HG21 THR A 150 14.398 -30.849 -8.149 1.00 0.00 H new ATOM 0 HG22 THR A 150 14.226 -32.408 -7.308 1.00 0.00 H new ATOM 0 HG23 THR A 150 12.787 -31.418 -7.652 1.00 0.00 H new ATOM 2242 N SER A 151 13.449 -33.241 -3.355 1.00 0.00 N ATOM 2243 CA SER A 151 13.991 -34.402 -2.726 1.00 0.00 C ATOM 2244 C SER A 151 13.672 -35.652 -3.550 1.00 0.00 C ATOM 2245 O SER A 151 12.591 -36.241 -3.364 1.00 0.00 O ATOM 2246 CB SER A 151 13.425 -34.486 -1.304 1.00 0.00 C ATOM 2247 OG SER A 151 12.009 -34.297 -1.322 1.00 0.00 O ATOM 2248 OXT SER A 151 14.495 -36.039 -4.417 1.00 0.00 O ATOM 0 H SER A 151 12.630 -32.864 -2.878 1.00 0.00 H new ATOM 0 HA SER A 151 15.077 -34.336 -2.668 1.00 0.00 H new ATOM 0 HB2 SER A 151 13.664 -35.456 -0.867 1.00 0.00 H new ATOM 0 HB3 SER A 151 13.892 -33.729 -0.674 1.00 0.00 H new ATOM 0 HG SER A 151 11.612 -34.867 -2.013 1.00 0.00 H new TER 2254 SER A 151