USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1106 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 129 GLN : amide:sc= -5.66! C(o=-4.7!,f=-4.8!) USER MOD Set 1.2: A 131 TYR OH : rot -15:sc= 0.923 USER MOD Set 2.1: A 65 HIS : no HD1:sc= 0 X(o=-0.0098,f=0) USER MOD Set 2.2: A 77 GLN : amide:sc=-0.00984 X(o=-0.0098,f=0) USER MOD Set 3.1: A 8 SER OG : rot 50:sc= 0.873 USER MOD Set 3.2: A 12 GLN : amide:sc= -0.298 K(o=0.27,f=0.86) USER MOD Set 3.3: A 35 ASN : amide:sc= -0.308 K(o=0.27,f=0.8) USER MOD Set 4.1: A 16 THR OG1 : rot 140:sc= 0.554 USER MOD Set 4.2: A 31 HIS : no HD1:sc= 0.786 K(o=0.47,f=-7.2!) USER MOD Set 4.3: A 128 THR OG1 : rot 180:sc= -0.874 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 39:sc= 0.274 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -162:sc= 0.454 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= -2.83 K(o=-2.8,f=-4.2) USER MOD Single : A 19 HIS : no HD1:sc= 0.473 K(o=0.48,f=-5.3!) USER MOD Single : A 20 SER OG : rot 180:sc= 0.314 USER MOD Single : A 21 SER OG : rot 180:sc= -0.0107 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 24 ASN : amide:sc= -2.96 X(o=-3,f=-2.7!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 CYS SG : rot 170:sc= -2.78! USER MOD Single : A 40 SER OG : rot -74:sc= 0.0917 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 MET CE :methyl -137:sc= -3.31! (180deg=-5.31!) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 69:sc= 1.14 USER MOD Single : A 63 LYS NZ :NH3+ -135:sc= 0 (180deg=-0.0965) USER MOD Single : A 64 THR OG1 : rot 153:sc= 2.09 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 165:sc= 0.999 (180deg=0.849) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.636! C(o=-0.64!,f=-4.4!) USER MOD Single : A 78 SER OG : rot 180:sc= -0.0219 USER MOD Single : A 82 SER OG : rot 49:sc= 0.465 USER MOD Single : A 84 SER OG : rot 180:sc= 0.00607 USER MOD Single : A 89 GLN : amide:sc= -3.91! C(o=-3.9!,f=-5.5!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0427 USER MOD Single : A 98 LYS NZ :NH3+ 167:sc= -0.0045 (180deg=-0.104) USER MOD Single : A 99 ASN : amide:sc= -0.621 K(o=-0.62,f=-1.6) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot -72:sc= 0.459 USER MOD Single : A 106 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.0894) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 15.968 -3.358 12.324 1.00 0.00 N ATOM 2 CA GLY A 1 15.556 -1.968 12.374 1.00 0.00 C ATOM 3 C GLY A 1 15.296 -1.391 10.996 1.00 0.00 C ATOM 4 O GLY A 1 16.220 -0.944 10.318 1.00 0.00 O ATOM 0 H1 GLY A 1 16.133 -3.706 13.290 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.221 -3.925 11.875 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.845 -3.440 11.771 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.652 -1.881 12.977 1.00 0.00 H new ATOM 0 HA3 GLY A 1 16.328 -1.381 12.871 1.00 0.00 H new ATOM 8 N SER A 2 14.033 -1.402 10.581 1.00 0.00 N ATOM 9 CA SER A 2 13.654 -0.881 9.273 1.00 0.00 C ATOM 10 C SER A 2 14.331 0.459 9.005 1.00 0.00 C ATOM 11 O SER A 2 14.085 1.442 9.704 1.00 0.00 O ATOM 12 CB SER A 2 12.135 -0.725 9.183 1.00 0.00 C ATOM 13 OG SER A 2 11.633 0.022 10.278 1.00 0.00 O ATOM 0 H SER A 2 13.255 -1.766 11.132 1.00 0.00 H new ATOM 0 HA SER A 2 13.984 -1.593 8.516 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.872 -0.228 8.249 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.666 -1.709 9.164 1.00 0.00 H new ATOM 0 HG SER A 2 12.252 0.753 10.487 1.00 0.00 H new ATOM 19 N SER A 3 15.186 0.490 7.987 1.00 0.00 N ATOM 20 CA SER A 3 15.902 1.709 7.628 1.00 0.00 C ATOM 21 C SER A 3 15.027 2.623 6.776 1.00 0.00 C ATOM 22 O SER A 3 14.981 3.833 6.990 1.00 0.00 O ATOM 23 CB SER A 3 17.188 1.365 6.872 1.00 0.00 C ATOM 24 OG SER A 3 18.204 0.938 7.763 1.00 0.00 O ATOM 0 H SER A 3 15.399 -0.314 7.397 1.00 0.00 H new ATOM 0 HA SER A 3 16.158 2.235 8.548 1.00 0.00 H new ATOM 0 HB2 SER A 3 16.986 0.581 6.143 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.531 2.237 6.315 1.00 0.00 H new ATOM 0 HG SER A 3 19.014 0.723 7.256 1.00 0.00 H new ATOM 30 N GLY A 4 14.332 2.033 5.808 1.00 0.00 N ATOM 31 CA GLY A 4 13.468 2.808 4.937 1.00 0.00 C ATOM 32 C GLY A 4 14.245 3.724 4.014 1.00 0.00 C ATOM 33 O GLY A 4 15.387 3.433 3.656 1.00 0.00 O ATOM 0 H GLY A 4 14.352 1.032 5.612 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.857 2.131 4.341 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.785 3.403 5.544 1.00 0.00 H new ATOM 37 N SER A 5 13.626 4.834 3.625 1.00 0.00 N ATOM 38 CA SER A 5 14.266 5.794 2.733 1.00 0.00 C ATOM 39 C SER A 5 14.223 7.199 3.326 1.00 0.00 C ATOM 40 O SER A 5 13.396 7.496 4.188 1.00 0.00 O ATOM 41 CB SER A 5 13.582 5.785 1.365 1.00 0.00 C ATOM 42 OG SER A 5 14.466 6.225 0.349 1.00 0.00 O ATOM 0 H SER A 5 12.682 5.091 3.913 1.00 0.00 H new ATOM 0 HA SER A 5 15.309 5.501 2.612 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.233 4.778 1.136 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.703 6.429 1.390 1.00 0.00 H new ATOM 0 HG SER A 5 13.951 6.479 -0.445 1.00 0.00 H new ATOM 48 N SER A 6 15.120 8.060 2.857 1.00 0.00 N ATOM 49 CA SER A 6 15.188 9.433 3.342 1.00 0.00 C ATOM 50 C SER A 6 15.315 10.415 2.181 1.00 0.00 C ATOM 51 O SER A 6 16.377 10.539 1.572 1.00 0.00 O ATOM 52 CB SER A 6 16.372 9.601 4.298 1.00 0.00 C ATOM 53 OG SER A 6 16.005 9.271 5.626 1.00 0.00 O ATOM 0 H SER A 6 15.810 7.831 2.141 1.00 0.00 H new ATOM 0 HA SER A 6 14.263 9.648 3.878 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.196 8.965 3.976 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.730 10.630 4.261 1.00 0.00 H new ATOM 0 HG SER A 6 16.778 9.385 6.217 1.00 0.00 H new ATOM 59 N GLY A 7 14.223 11.110 1.879 1.00 0.00 N ATOM 60 CA GLY A 7 14.232 12.071 0.792 1.00 0.00 C ATOM 61 C GLY A 7 13.129 11.815 -0.217 1.00 0.00 C ATOM 62 O GLY A 7 13.395 11.405 -1.346 1.00 0.00 O ATOM 0 H GLY A 7 13.332 11.025 2.368 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.122 13.076 1.199 1.00 0.00 H new ATOM 0 HA3 GLY A 7 15.197 12.035 0.287 1.00 0.00 H new ATOM 66 N SER A 8 11.888 12.058 0.192 1.00 0.00 N ATOM 67 CA SER A 8 10.740 11.846 -0.683 1.00 0.00 C ATOM 68 C SER A 8 10.155 13.178 -1.143 1.00 0.00 C ATOM 69 O SER A 8 9.188 13.688 -0.578 1.00 0.00 O ATOM 70 CB SER A 8 9.668 11.026 0.037 1.00 0.00 C ATOM 71 OG SER A 8 9.094 11.762 1.103 1.00 0.00 O ATOM 0 H SER A 8 11.651 12.402 1.123 1.00 0.00 H new ATOM 0 HA SER A 8 11.079 11.296 -1.561 1.00 0.00 H new ATOM 0 HB2 SER A 8 8.890 10.737 -0.670 1.00 0.00 H new ATOM 0 HB3 SER A 8 10.107 10.105 0.421 1.00 0.00 H new ATOM 0 HG SER A 8 8.820 12.646 0.780 1.00 0.00 H new ATOM 77 N PRO A 9 10.755 13.755 -2.195 1.00 0.00 N ATOM 78 CA PRO A 9 10.311 15.034 -2.756 1.00 0.00 C ATOM 79 C PRO A 9 8.964 14.921 -3.461 1.00 0.00 C ATOM 80 O PRO A 9 8.260 15.916 -3.640 1.00 0.00 O ATOM 81 CB PRO A 9 11.413 15.383 -3.759 1.00 0.00 C ATOM 82 CG PRO A 9 12.007 14.071 -4.141 1.00 0.00 C ATOM 83 CD PRO A 9 11.913 13.202 -2.918 1.00 0.00 C ATOM 0 HA PRO A 9 10.164 15.789 -1.984 1.00 0.00 H new ATOM 0 HB2 PRO A 9 11.008 15.902 -4.628 1.00 0.00 H new ATOM 0 HB3 PRO A 9 12.159 16.041 -3.314 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.467 13.627 -4.978 1.00 0.00 H new ATOM 0 HG3 PRO A 9 13.043 14.189 -4.457 1.00 0.00 H new ATOM 0 HD2 PRO A 9 11.761 12.155 -3.180 1.00 0.00 H new ATOM 0 HD3 PRO A 9 12.822 13.252 -2.319 1.00 0.00 H new ATOM 91 N LEU A 10 8.611 13.705 -3.861 1.00 0.00 N ATOM 92 CA LEU A 10 7.347 13.462 -4.547 1.00 0.00 C ATOM 93 C LEU A 10 6.250 13.093 -3.554 1.00 0.00 C ATOM 94 O LEU A 10 5.070 13.347 -3.794 1.00 0.00 O ATOM 95 CB LEU A 10 7.511 12.345 -5.580 1.00 0.00 C ATOM 96 CG LEU A 10 8.527 12.605 -6.693 1.00 0.00 C ATOM 97 CD1 LEU A 10 8.621 11.404 -7.621 1.00 0.00 C ATOM 98 CD2 LEU A 10 8.155 13.857 -7.474 1.00 0.00 C ATOM 0 H LEU A 10 9.182 12.871 -3.722 1.00 0.00 H new ATOM 0 HA LEU A 10 7.057 14.381 -5.056 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.800 11.433 -5.057 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.540 12.156 -6.038 1.00 0.00 H new ATOM 0 HG LEU A 10 9.504 12.763 -6.237 1.00 0.00 H new ATOM 0 HD11 LEU A 10 9.349 11.607 -8.407 1.00 0.00 H new ATOM 0 HD12 LEU A 10 8.936 10.529 -7.053 1.00 0.00 H new ATOM 0 HD13 LEU A 10 7.646 11.214 -8.070 1.00 0.00 H new ATOM 0 HD21 LEU A 10 8.889 14.026 -8.262 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.168 13.728 -7.919 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.141 14.715 -6.801 1.00 0.00 H new ATOM 110 N GLY A 11 6.648 12.494 -2.435 1.00 0.00 N ATOM 111 CA GLY A 11 5.687 12.102 -1.421 1.00 0.00 C ATOM 112 C GLY A 11 5.828 10.647 -1.020 1.00 0.00 C ATOM 113 O GLY A 11 6.590 9.900 -1.632 1.00 0.00 O ATOM 0 H GLY A 11 7.619 12.273 -2.213 1.00 0.00 H new ATOM 0 HA2 GLY A 11 5.815 12.732 -0.541 1.00 0.00 H new ATOM 0 HA3 GLY A 11 4.678 12.277 -1.794 1.00 0.00 H new ATOM 117 N GLN A 12 5.093 10.246 0.012 1.00 0.00 N ATOM 118 CA GLN A 12 5.142 8.871 0.496 1.00 0.00 C ATOM 119 C GLN A 12 3.746 8.259 0.540 1.00 0.00 C ATOM 120 O GLN A 12 2.751 8.940 0.285 1.00 0.00 O ATOM 121 CB GLN A 12 5.779 8.819 1.885 1.00 0.00 C ATOM 122 CG GLN A 12 7.140 9.493 1.956 1.00 0.00 C ATOM 123 CD GLN A 12 7.479 9.977 3.352 1.00 0.00 C ATOM 124 OE1 GLN A 12 7.586 9.184 4.288 1.00 0.00 O ATOM 125 NE2 GLN A 12 7.652 11.285 3.501 1.00 0.00 N ATOM 0 H GLN A 12 4.457 10.853 0.529 1.00 0.00 H new ATOM 0 HA GLN A 12 5.751 8.290 -0.197 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.109 9.295 2.601 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.882 7.777 2.189 1.00 0.00 H new ATOM 0 HG2 GLN A 12 7.906 8.793 1.622 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.159 10.338 1.268 1.00 0.00 H new ATOM 0 HE21 GLN A 12 7.554 11.907 2.699 1.00 0.00 H new ATOM 0 HE22 GLN A 12 7.883 11.668 4.418 1.00 0.00 H new ATOM 134 N ILE A 13 3.679 6.973 0.865 1.00 0.00 N ATOM 135 CA ILE A 13 2.404 6.271 0.944 1.00 0.00 C ATOM 136 C ILE A 13 2.566 4.910 1.614 1.00 0.00 C ATOM 137 O ILE A 13 3.445 4.130 1.250 1.00 0.00 O ATOM 138 CB ILE A 13 1.784 6.072 -0.452 1.00 0.00 C ATOM 139 CG1 ILE A 13 0.563 5.154 -0.365 1.00 0.00 C ATOM 140 CG2 ILE A 13 2.815 5.501 -1.413 1.00 0.00 C ATOM 141 CD1 ILE A 13 -0.321 5.207 -1.591 1.00 0.00 C ATOM 0 H ILE A 13 4.492 6.396 1.078 1.00 0.00 H new ATOM 0 HA ILE A 13 1.739 6.892 1.544 1.00 0.00 H new ATOM 0 HB ILE A 13 1.460 7.041 -0.831 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.900 4.128 -0.214 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.026 5.428 0.510 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.362 5.366 -2.395 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.657 6.188 -1.493 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.166 4.539 -1.040 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.166 4.532 -1.459 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.687 6.224 -1.732 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.253 4.904 -2.467 1.00 0.00 H new ATOM 153 N GLN A 14 1.711 4.634 2.593 1.00 0.00 N ATOM 154 CA GLN A 14 1.759 3.367 3.313 1.00 0.00 C ATOM 155 C GLN A 14 0.673 2.418 2.819 1.00 0.00 C ATOM 156 O GLN A 14 -0.498 2.790 2.731 1.00 0.00 O ATOM 157 CB GLN A 14 1.600 3.604 4.816 1.00 0.00 C ATOM 158 CG GLN A 14 2.121 2.459 5.671 1.00 0.00 C ATOM 159 CD GLN A 14 2.515 2.905 7.065 1.00 0.00 C ATOM 160 OE1 GLN A 14 3.549 2.493 7.592 1.00 0.00 O ATOM 161 NE2 GLN A 14 1.692 3.752 7.672 1.00 0.00 N ATOM 0 H GLN A 14 0.977 5.270 2.906 1.00 0.00 H new ATOM 0 HA GLN A 14 2.730 2.908 3.125 1.00 0.00 H new ATOM 0 HB2 GLN A 14 2.126 4.519 5.089 1.00 0.00 H new ATOM 0 HB3 GLN A 14 0.545 3.764 5.041 1.00 0.00 H new ATOM 0 HG2 GLN A 14 1.355 1.687 5.743 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.983 2.007 5.181 1.00 0.00 H new ATOM 0 HE21 GLN A 14 0.846 4.068 7.199 1.00 0.00 H new ATOM 0 HE22 GLN A 14 1.906 4.086 8.611 1.00 0.00 H new ATOM 170 N LEU A 15 1.068 1.191 2.496 1.00 0.00 N ATOM 171 CA LEU A 15 0.127 0.188 2.009 1.00 0.00 C ATOM 172 C LEU A 15 0.355 -1.153 2.700 1.00 0.00 C ATOM 173 O LEU A 15 1.457 -1.702 2.668 1.00 0.00 O ATOM 174 CB LEU A 15 0.265 0.023 0.494 1.00 0.00 C ATOM 175 CG LEU A 15 0.002 1.275 -0.343 1.00 0.00 C ATOM 176 CD1 LEU A 15 0.521 1.088 -1.760 1.00 0.00 C ATOM 177 CD2 LEU A 15 -1.484 1.605 -0.357 1.00 0.00 C ATOM 0 H LEU A 15 2.033 0.867 2.563 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.882 0.529 2.241 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.273 -0.330 0.277 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.423 -0.758 0.169 1.00 0.00 H new ATOM 0 HG LEU A 15 0.535 2.111 0.110 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.325 1.989 -2.341 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.594 0.900 -1.733 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.016 0.240 -2.224 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.653 2.499 -0.957 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.038 0.770 -0.786 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.827 1.783 0.662 1.00 0.00 H new ATOM 189 N THR A 16 -0.695 -1.677 3.324 1.00 0.00 N ATOM 190 CA THR A 16 -0.611 -2.954 4.022 1.00 0.00 C ATOM 191 C THR A 16 -0.899 -4.116 3.079 1.00 0.00 C ATOM 192 O THR A 16 -2.052 -4.376 2.734 1.00 0.00 O ATOM 193 CB THR A 16 -1.593 -3.013 5.207 1.00 0.00 C ATOM 194 OG1 THR A 16 -1.637 -1.744 5.870 1.00 0.00 O ATOM 195 CG2 THR A 16 -1.185 -4.094 6.195 1.00 0.00 C ATOM 0 H THR A 16 -1.614 -1.236 3.360 1.00 0.00 H new ATOM 0 HA THR A 16 0.408 -3.041 4.400 1.00 0.00 H new ATOM 0 HB THR A 16 -2.583 -3.254 4.819 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.561 -1.539 6.123 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.894 -4.116 7.023 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.181 -5.062 5.694 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.187 -3.880 6.577 1.00 0.00 H new ATOM 203 N ILE A 17 0.155 -4.812 2.666 1.00 0.00 N ATOM 204 CA ILE A 17 0.013 -5.948 1.764 1.00 0.00 C ATOM 205 C ILE A 17 0.027 -7.265 2.532 1.00 0.00 C ATOM 206 O ILE A 17 1.000 -7.588 3.215 1.00 0.00 O ATOM 207 CB ILE A 17 1.133 -5.972 0.707 1.00 0.00 C ATOM 208 CG1 ILE A 17 1.247 -4.608 0.023 1.00 0.00 C ATOM 209 CG2 ILE A 17 0.872 -7.064 -0.318 1.00 0.00 C ATOM 210 CD1 ILE A 17 2.530 -4.429 -0.758 1.00 0.00 C ATOM 0 H ILE A 17 1.116 -4.609 2.942 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.947 -5.833 1.261 1.00 0.00 H new ATOM 0 HB ILE A 17 2.078 -6.188 1.206 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.400 -4.476 -0.650 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.179 -3.825 0.778 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.673 -7.068 -1.058 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.836 -8.032 0.182 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -0.080 -6.877 -0.815 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.542 -3.440 -1.216 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.382 -4.528 -0.086 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.591 -5.190 -1.536 1.00 0.00 H new ATOM 222 N ARG A 18 -1.058 -8.024 2.415 1.00 0.00 N ATOM 223 CA ARG A 18 -1.171 -9.307 3.099 1.00 0.00 C ATOM 224 C ARG A 18 -2.032 -10.277 2.295 1.00 0.00 C ATOM 225 O ARG A 18 -3.249 -10.114 2.204 1.00 0.00 O ATOM 226 CB ARG A 18 -1.766 -9.115 4.494 1.00 0.00 C ATOM 227 CG ARG A 18 -1.939 -10.413 5.267 1.00 0.00 C ATOM 228 CD ARG A 18 -2.991 -10.277 6.356 1.00 0.00 C ATOM 229 NE ARG A 18 -3.392 -11.574 6.895 1.00 0.00 N ATOM 230 CZ ARG A 18 -4.527 -11.777 7.554 1.00 0.00 C ATOM 231 NH1 ARG A 18 -5.370 -10.774 7.754 1.00 0.00 N ATOM 232 NH2 ARG A 18 -4.821 -12.987 8.014 1.00 0.00 N ATOM 0 H ARG A 18 -1.871 -7.773 1.853 1.00 0.00 H new ATOM 0 HA ARG A 18 -0.171 -9.729 3.194 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -1.123 -8.445 5.065 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -2.735 -8.625 4.402 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -2.225 -11.211 4.581 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -0.987 -10.702 5.713 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -2.601 -9.655 7.161 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -3.865 -9.766 5.953 1.00 0.00 H new ATOM 0 HE ARG A 18 -2.766 -12.367 6.758 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -5.148 -9.843 7.401 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -6.241 -10.933 8.260 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -4.175 -13.761 7.861 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -5.693 -13.142 8.520 1.00 0.00 H new ATOM 246 N HIS A 19 -1.392 -11.287 1.714 1.00 0.00 N ATOM 247 CA HIS A 19 -2.100 -12.283 0.918 1.00 0.00 C ATOM 248 C HIS A 19 -2.284 -13.577 1.705 1.00 0.00 C ATOM 249 O HIS A 19 -1.313 -14.264 2.025 1.00 0.00 O ATOM 250 CB HIS A 19 -1.340 -12.565 -0.378 1.00 0.00 C ATOM 251 CG HIS A 19 -1.929 -13.679 -1.188 1.00 0.00 C ATOM 252 ND1 HIS A 19 -1.778 -15.009 -0.861 1.00 0.00 N ATOM 253 CD2 HIS A 19 -2.675 -13.653 -2.318 1.00 0.00 C ATOM 254 CE1 HIS A 19 -2.404 -15.755 -1.754 1.00 0.00 C ATOM 255 NE2 HIS A 19 -2.957 -14.956 -2.649 1.00 0.00 N ATOM 0 H HIS A 19 -0.385 -11.437 1.780 1.00 0.00 H new ATOM 0 HA HIS A 19 -3.084 -11.884 0.674 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -1.320 -11.658 -0.983 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -0.306 -12.810 -0.137 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -2.989 -12.772 -2.858 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -2.455 -16.834 -1.752 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -3.505 -15.258 -3.455 1.00 0.00 H new ATOM 263 N SER A 20 -3.534 -13.902 2.016 1.00 0.00 N ATOM 264 CA SER A 20 -3.845 -15.111 2.770 1.00 0.00 C ATOM 265 C SER A 20 -3.827 -16.338 1.863 1.00 0.00 C ATOM 266 O SER A 20 -4.482 -16.362 0.821 1.00 0.00 O ATOM 267 CB SER A 20 -5.212 -14.981 3.443 1.00 0.00 C ATOM 268 OG SER A 20 -5.700 -16.245 3.857 1.00 0.00 O ATOM 0 H SER A 20 -4.349 -13.345 1.758 1.00 0.00 H new ATOM 0 HA SER A 20 -3.081 -15.237 3.537 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.135 -14.318 4.305 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.919 -14.524 2.751 1.00 0.00 H new ATOM 0 HG SER A 20 -6.574 -16.134 4.285 1.00 0.00 H new ATOM 274 N SER A 21 -3.071 -17.354 2.267 1.00 0.00 N ATOM 275 CA SER A 21 -2.964 -18.583 1.489 1.00 0.00 C ATOM 276 C SER A 21 -4.273 -19.365 1.525 1.00 0.00 C ATOM 277 O SER A 21 -4.751 -19.842 0.496 1.00 0.00 O ATOM 278 CB SER A 21 -1.823 -19.451 2.024 1.00 0.00 C ATOM 279 OG SER A 21 -2.026 -19.776 3.388 1.00 0.00 O ATOM 0 H SER A 21 -2.524 -17.351 3.128 1.00 0.00 H new ATOM 0 HA SER A 21 -2.752 -18.312 0.455 1.00 0.00 H new ATOM 0 HB2 SER A 21 -1.751 -20.366 1.436 1.00 0.00 H new ATOM 0 HB3 SER A 21 -0.876 -18.923 1.910 1.00 0.00 H new ATOM 0 HG SER A 21 -1.284 -20.332 3.706 1.00 0.00 H new ATOM 285 N GLN A 22 -4.847 -19.491 2.717 1.00 0.00 N ATOM 286 CA GLN A 22 -6.101 -20.216 2.888 1.00 0.00 C ATOM 287 C GLN A 22 -7.215 -19.576 2.066 1.00 0.00 C ATOM 288 O GLN A 22 -7.920 -20.258 1.322 1.00 0.00 O ATOM 289 CB GLN A 22 -6.496 -20.252 4.365 1.00 0.00 C ATOM 290 CG GLN A 22 -5.695 -21.250 5.185 1.00 0.00 C ATOM 291 CD GLN A 22 -6.117 -21.281 6.641 1.00 0.00 C ATOM 292 OE1 GLN A 22 -6.183 -20.246 7.303 1.00 0.00 O ATOM 293 NE2 GLN A 22 -6.407 -22.474 7.147 1.00 0.00 N ATOM 0 H GLN A 22 -4.464 -19.101 3.578 1.00 0.00 H new ATOM 0 HA GLN A 22 -5.954 -21.236 2.534 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -6.367 -19.257 4.791 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -7.555 -20.497 4.443 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -5.812 -22.245 4.755 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -4.636 -20.999 5.123 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -6.339 -23.307 6.562 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -6.698 -22.558 8.121 1.00 0.00 H new ATOM 302 N ARG A 23 -7.369 -18.264 2.207 1.00 0.00 N ATOM 303 CA ARG A 23 -8.399 -17.533 1.479 1.00 0.00 C ATOM 304 C ARG A 23 -7.979 -17.300 0.030 1.00 0.00 C ATOM 305 O ARG A 23 -8.820 -17.199 -0.862 1.00 0.00 O ATOM 306 CB ARG A 23 -8.682 -16.193 2.161 1.00 0.00 C ATOM 307 CG ARG A 23 -9.515 -16.317 3.426 1.00 0.00 C ATOM 308 CD ARG A 23 -10.214 -15.010 3.763 1.00 0.00 C ATOM 309 NE ARG A 23 -10.460 -14.875 5.196 1.00 0.00 N ATOM 310 CZ ARG A 23 -10.882 -13.752 5.767 1.00 0.00 C ATOM 311 NH1 ARG A 23 -11.105 -12.673 5.029 1.00 0.00 N ATOM 312 NH2 ARG A 23 -11.083 -13.707 7.078 1.00 0.00 N ATOM 0 H ARG A 23 -6.794 -17.685 2.819 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.308 -18.134 1.484 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -7.735 -15.712 2.406 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -9.199 -15.539 1.458 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -10.257 -17.105 3.299 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -8.875 -16.613 4.257 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -9.605 -14.174 3.419 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -11.161 -14.956 3.226 1.00 0.00 H new ATOM 0 HE ARG A 23 -10.299 -15.687 5.791 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -10.953 -12.704 4.021 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -11.429 -11.812 5.469 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -10.913 -14.535 7.649 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -11.407 -12.844 7.515 1.00 0.00 H new ATOM 326 N ASN A 24 -6.672 -17.214 -0.195 1.00 0.00 N ATOM 327 CA ASN A 24 -6.140 -16.991 -1.535 1.00 0.00 C ATOM 328 C ASN A 24 -6.640 -15.667 -2.105 1.00 0.00 C ATOM 329 O ASN A 24 -7.153 -15.614 -3.223 1.00 0.00 O ATOM 330 CB ASN A 24 -6.538 -18.142 -2.462 1.00 0.00 C ATOM 331 CG ASN A 24 -6.241 -19.500 -1.857 1.00 0.00 C ATOM 332 OD1 ASN A 24 -5.139 -20.029 -2.002 1.00 0.00 O ATOM 333 ND2 ASN A 24 -7.226 -20.073 -1.175 1.00 0.00 N ATOM 0 H ASN A 24 -5.962 -17.295 0.533 1.00 0.00 H new ATOM 0 HA ASN A 24 -5.053 -16.949 -1.466 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.602 -18.072 -2.687 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -6.005 -18.044 -3.408 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -7.085 -20.988 -0.746 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -8.124 -19.598 -1.080 1.00 0.00 H new ATOM 340 N LYS A 25 -6.485 -14.599 -1.330 1.00 0.00 N ATOM 341 CA LYS A 25 -6.918 -13.274 -1.757 1.00 0.00 C ATOM 342 C LYS A 25 -5.845 -12.231 -1.464 1.00 0.00 C ATOM 343 O LYS A 25 -5.018 -12.410 -0.569 1.00 0.00 O ATOM 344 CB LYS A 25 -8.223 -12.891 -1.055 1.00 0.00 C ATOM 345 CG LYS A 25 -9.399 -13.776 -1.432 1.00 0.00 C ATOM 346 CD LYS A 25 -10.717 -13.026 -1.327 1.00 0.00 C ATOM 347 CE LYS A 25 -11.866 -13.965 -0.995 1.00 0.00 C ATOM 348 NZ LYS A 25 -13.178 -13.413 -1.434 1.00 0.00 N ATOM 0 H LYS A 25 -6.062 -14.625 -0.402 1.00 0.00 H new ATOM 0 HA LYS A 25 -7.087 -13.303 -2.833 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.073 -12.940 0.024 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.466 -11.856 -1.297 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.268 -14.143 -2.450 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.423 -14.649 -0.779 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.640 -12.258 -0.558 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.923 -12.516 -2.268 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.698 -14.929 -1.476 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.889 -14.145 0.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.936 -14.082 -1.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.350 -12.506 -0.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.165 -13.265 -2.463 1.00 0.00 H new ATOM 362 N LEU A 26 -5.865 -11.140 -2.222 1.00 0.00 N ATOM 363 CA LEU A 26 -4.894 -10.066 -2.042 1.00 0.00 C ATOM 364 C LEU A 26 -5.557 -8.826 -1.450 1.00 0.00 C ATOM 365 O LEU A 26 -6.293 -8.116 -2.136 1.00 0.00 O ATOM 366 CB LEU A 26 -4.237 -9.717 -3.378 1.00 0.00 C ATOM 367 CG LEU A 26 -3.281 -8.523 -3.365 1.00 0.00 C ATOM 368 CD1 LEU A 26 -2.006 -8.868 -2.611 1.00 0.00 C ATOM 369 CD2 LEU A 26 -2.960 -8.081 -4.785 1.00 0.00 C ATOM 0 H LEU A 26 -6.542 -10.976 -2.967 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.129 -10.414 -1.347 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.690 -10.591 -3.730 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.024 -9.519 -4.106 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.770 -7.696 -2.850 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.338 -8.007 -2.612 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -2.252 -9.135 -1.583 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.513 -9.710 -3.096 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.279 -7.231 -4.756 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.491 -8.904 -5.325 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.880 -7.792 -5.293 1.00 0.00 H new ATOM 381 N ILE A 27 -5.290 -8.572 -0.173 1.00 0.00 N ATOM 382 CA ILE A 27 -5.858 -7.416 0.510 1.00 0.00 C ATOM 383 C ILE A 27 -4.844 -6.280 0.604 1.00 0.00 C ATOM 384 O ILE A 27 -3.690 -6.493 0.975 1.00 0.00 O ATOM 385 CB ILE A 27 -6.337 -7.780 1.928 1.00 0.00 C ATOM 386 CG1 ILE A 27 -7.411 -8.868 1.863 1.00 0.00 C ATOM 387 CG2 ILE A 27 -6.869 -6.545 2.640 1.00 0.00 C ATOM 388 CD1 ILE A 27 -6.850 -10.272 1.886 1.00 0.00 C ATOM 0 H ILE A 27 -4.684 -9.151 0.409 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.713 -7.088 -0.081 1.00 0.00 H new ATOM 0 HB ILE A 27 -5.489 -8.166 2.495 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -8.094 -8.744 2.704 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -7.998 -8.735 0.954 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -7.204 -6.818 3.641 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -6.078 -5.798 2.713 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -7.706 -6.133 2.077 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.668 -10.991 1.837 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.190 -10.414 1.030 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.288 -10.424 2.807 1.00 0.00 H new ATOM 400 N VAL A 28 -5.285 -5.072 0.267 1.00 0.00 N ATOM 401 CA VAL A 28 -4.418 -3.901 0.316 1.00 0.00 C ATOM 402 C VAL A 28 -5.121 -2.724 0.983 1.00 0.00 C ATOM 403 O VAL A 28 -6.074 -2.167 0.438 1.00 0.00 O ATOM 404 CB VAL A 28 -3.962 -3.481 -1.094 1.00 0.00 C ATOM 405 CG1 VAL A 28 -2.901 -2.394 -1.011 1.00 0.00 C ATOM 406 CG2 VAL A 28 -3.445 -4.684 -1.868 1.00 0.00 C ATOM 0 H VAL A 28 -6.237 -4.879 -0.043 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.544 -4.179 0.905 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.821 -3.076 -1.629 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.591 -2.110 -2.017 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.311 -1.524 -0.499 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.039 -2.768 -0.458 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.127 -4.368 -2.862 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.599 -5.121 -1.338 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.238 -5.426 -1.959 1.00 0.00 H new ATOM 416 N VAL A 29 -4.643 -2.350 2.165 1.00 0.00 N ATOM 417 CA VAL A 29 -5.224 -1.237 2.907 1.00 0.00 C ATOM 418 C VAL A 29 -4.443 0.050 2.669 1.00 0.00 C ATOM 419 O VAL A 29 -3.232 0.103 2.883 1.00 0.00 O ATOM 420 CB VAL A 29 -5.262 -1.530 4.419 1.00 0.00 C ATOM 421 CG1 VAL A 29 -6.024 -0.438 5.155 1.00 0.00 C ATOM 422 CG2 VAL A 29 -5.882 -2.894 4.682 1.00 0.00 C ATOM 0 H VAL A 29 -3.855 -2.801 2.630 1.00 0.00 H new ATOM 0 HA VAL A 29 -6.244 -1.112 2.543 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.239 -1.543 4.795 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.041 -0.662 6.222 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.532 0.521 4.993 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -7.046 -0.390 4.778 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.901 -3.084 5.755 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -6.900 -2.912 4.292 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.290 -3.664 4.187 1.00 0.00 H new ATOM 432 N VAL A 30 -5.145 1.088 2.225 1.00 0.00 N ATOM 433 CA VAL A 30 -4.518 2.377 1.959 1.00 0.00 C ATOM 434 C VAL A 30 -4.770 3.357 3.100 1.00 0.00 C ATOM 435 O VAL A 30 -5.708 4.153 3.053 1.00 0.00 O ATOM 436 CB VAL A 30 -5.035 2.992 0.645 1.00 0.00 C ATOM 437 CG1 VAL A 30 -4.370 4.335 0.385 1.00 0.00 C ATOM 438 CG2 VAL A 30 -4.802 2.039 -0.517 1.00 0.00 C ATOM 0 H VAL A 30 -6.148 1.061 2.042 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.447 2.196 1.870 1.00 0.00 H new ATOM 0 HB VAL A 30 -6.108 3.158 0.740 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.748 4.754 -0.548 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.593 5.017 1.206 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.291 4.198 0.310 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.173 2.490 -1.437 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.735 1.839 -0.616 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.330 1.104 -0.332 1.00 0.00 H new ATOM 448 N HIS A 31 -3.926 3.293 4.124 1.00 0.00 N ATOM 449 CA HIS A 31 -4.056 4.176 5.278 1.00 0.00 C ATOM 450 C HIS A 31 -4.227 5.626 4.836 1.00 0.00 C ATOM 451 O HIS A 31 -5.325 6.179 4.896 1.00 0.00 O ATOM 452 CB HIS A 31 -2.833 4.048 6.186 1.00 0.00 C ATOM 453 CG HIS A 31 -2.617 2.661 6.709 1.00 0.00 C ATOM 454 ND1 HIS A 31 -3.287 2.157 7.804 1.00 0.00 N ATOM 455 CD2 HIS A 31 -1.802 1.669 6.279 1.00 0.00 C ATOM 456 CE1 HIS A 31 -2.891 0.917 8.027 1.00 0.00 C ATOM 457 NE2 HIS A 31 -1.991 0.596 7.115 1.00 0.00 N ATOM 0 H HIS A 31 -3.145 2.639 4.179 1.00 0.00 H new ATOM 0 HA HIS A 31 -4.944 3.877 5.834 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -1.947 4.361 5.634 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -2.943 4.732 7.028 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -1.129 1.713 5.436 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -3.243 0.274 8.820 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -1.514 -0.303 7.043 1.00 0.00 H new ATOM 465 N ALA A 32 -3.133 6.237 4.393 1.00 0.00 N ATOM 466 CA ALA A 32 -3.162 7.622 3.940 1.00 0.00 C ATOM 467 C ALA A 32 -1.817 8.036 3.351 1.00 0.00 C ATOM 468 O ALA A 32 -0.795 7.398 3.606 1.00 0.00 O ATOM 469 CB ALA A 32 -3.544 8.545 5.088 1.00 0.00 C ATOM 0 H ALA A 32 -2.216 5.794 4.338 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.914 7.706 3.155 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.562 9.576 4.735 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.531 8.272 5.461 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.813 8.449 5.891 1.00 0.00 H new ATOM 475 N CYS A 33 -1.826 9.104 2.562 1.00 0.00 N ATOM 476 CA CYS A 33 -0.607 9.601 1.935 1.00 0.00 C ATOM 477 C CYS A 33 -0.174 10.923 2.560 1.00 0.00 C ATOM 478 O CYS A 33 -0.981 11.629 3.164 1.00 0.00 O ATOM 479 CB CYS A 33 -0.818 9.780 0.430 1.00 0.00 C ATOM 480 SG CYS A 33 -1.134 8.237 -0.459 1.00 0.00 S ATOM 0 H CYS A 33 -2.664 9.642 2.341 1.00 0.00 H new ATOM 0 HA CYS A 33 0.181 8.866 2.099 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -1.656 10.458 0.269 1.00 0.00 H new ATOM 0 HB3 CYS A 33 0.064 10.258 0.004 1.00 0.00 H new ATOM 0 HG CYS A 33 -1.509 8.505 -1.674 1.00 0.00 H new ATOM 486 N ARG A 34 1.106 11.251 2.412 1.00 0.00 N ATOM 487 CA ARG A 34 1.647 12.487 2.965 1.00 0.00 C ATOM 488 C ARG A 34 2.747 13.047 2.069 1.00 0.00 C ATOM 489 O ARG A 34 3.295 12.339 1.226 1.00 0.00 O ATOM 490 CB ARG A 34 2.194 12.244 4.373 1.00 0.00 C ATOM 491 CG ARG A 34 3.354 11.263 4.415 1.00 0.00 C ATOM 492 CD ARG A 34 3.738 10.914 5.844 1.00 0.00 C ATOM 493 NE ARG A 34 4.723 11.845 6.389 1.00 0.00 N ATOM 494 CZ ARG A 34 5.144 11.815 7.648 1.00 0.00 C ATOM 495 NH1 ARG A 34 4.669 10.906 8.488 1.00 0.00 N ATOM 496 NH2 ARG A 34 6.043 12.696 8.069 1.00 0.00 N ATOM 0 H ARG A 34 1.787 10.678 1.914 1.00 0.00 H new ATOM 0 HA ARG A 34 0.839 13.217 3.018 1.00 0.00 H new ATOM 0 HB2 ARG A 34 2.518 13.195 4.797 1.00 0.00 H new ATOM 0 HB3 ARG A 34 1.390 11.870 5.006 1.00 0.00 H new ATOM 0 HG2 ARG A 34 3.083 10.354 3.878 1.00 0.00 H new ATOM 0 HG3 ARG A 34 4.214 11.693 3.901 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.846 10.921 6.471 1.00 0.00 H new ATOM 0 HD3 ARG A 34 4.141 9.902 5.874 1.00 0.00 H new ATOM 0 HE ARG A 34 5.108 12.557 5.769 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.978 10.227 8.168 1.00 0.00 H new ATOM 0 HH12 ARG A 34 4.994 10.885 9.455 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.411 13.397 7.425 1.00 0.00 H new ATOM 0 HH22 ARG A 34 6.366 12.673 9.036 1.00 0.00 H new ATOM 510 N ASN A 35 3.065 14.324 2.260 1.00 0.00 N ATOM 511 CA ASN A 35 4.100 14.979 1.468 1.00 0.00 C ATOM 512 C ASN A 35 3.758 14.935 -0.018 1.00 0.00 C ATOM 513 O ASN A 35 4.621 14.671 -0.857 1.00 0.00 O ATOM 514 CB ASN A 35 5.456 14.314 1.711 1.00 0.00 C ATOM 515 CG ASN A 35 6.177 14.893 2.913 1.00 0.00 C ATOM 516 OD1 ASN A 35 6.501 16.080 2.944 1.00 0.00 O ATOM 517 ND2 ASN A 35 6.432 14.054 3.911 1.00 0.00 N ATOM 0 H ASN A 35 2.622 14.925 2.955 1.00 0.00 H new ATOM 0 HA ASN A 35 4.154 16.022 1.779 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.311 13.244 1.858 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.080 14.432 0.825 1.00 0.00 H new ATOM 0 HD21 ASN A 35 6.915 14.386 4.746 1.00 0.00 H new ATOM 0 HD22 ASN A 35 6.145 13.078 3.842 1.00 0.00 H new ATOM 524 N LEU A 36 2.495 15.195 -0.337 1.00 0.00 N ATOM 525 CA LEU A 36 2.038 15.185 -1.722 1.00 0.00 C ATOM 526 C LEU A 36 2.038 16.595 -2.305 1.00 0.00 C ATOM 527 O LEU A 36 1.032 17.302 -2.243 1.00 0.00 O ATOM 528 CB LEU A 36 0.635 14.583 -1.813 1.00 0.00 C ATOM 529 CG LEU A 36 0.512 13.109 -1.428 1.00 0.00 C ATOM 530 CD1 LEU A 36 -0.910 12.616 -1.652 1.00 0.00 C ATOM 531 CD2 LEU A 36 1.501 12.266 -2.219 1.00 0.00 C ATOM 0 H LEU A 36 1.769 15.415 0.345 1.00 0.00 H new ATOM 0 HA LEU A 36 2.728 14.572 -2.302 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.030 15.162 -1.172 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.276 14.702 -2.835 1.00 0.00 H new ATOM 0 HG LEU A 36 0.747 13.010 -0.368 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.979 11.565 -1.373 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.598 13.200 -1.041 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.173 12.730 -2.704 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.399 11.220 -1.931 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.298 12.371 -3.285 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.516 12.603 -2.008 1.00 0.00 H new ATOM 543 N ILE A 37 3.170 16.996 -2.873 1.00 0.00 N ATOM 544 CA ILE A 37 3.299 18.319 -3.470 1.00 0.00 C ATOM 545 C ILE A 37 2.061 18.677 -4.285 1.00 0.00 C ATOM 546 O ILE A 37 1.404 17.804 -4.852 1.00 0.00 O ATOM 547 CB ILE A 37 4.540 18.410 -4.376 1.00 0.00 C ATOM 548 CG1 ILE A 37 4.405 17.450 -5.560 1.00 0.00 C ATOM 549 CG2 ILE A 37 5.800 18.104 -3.581 1.00 0.00 C ATOM 550 CD1 ILE A 37 3.729 18.067 -6.764 1.00 0.00 C ATOM 0 H ILE A 37 4.012 16.423 -2.932 1.00 0.00 H new ATOM 0 HA ILE A 37 3.408 19.027 -2.648 1.00 0.00 H new ATOM 0 HB ILE A 37 4.616 19.426 -4.763 1.00 0.00 H new ATOM 0 HG12 ILE A 37 5.396 17.101 -5.849 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.838 16.574 -5.244 1.00 0.00 H new ATOM 0 HG21 ILE A 37 6.669 18.172 -4.236 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.901 18.823 -2.768 1.00 0.00 H new ATOM 0 HG23 ILE A 37 5.735 17.097 -3.169 1.00 0.00 H new ATOM 0 HD11 ILE A 37 3.668 17.330 -7.564 1.00 0.00 H new ATOM 0 HD12 ILE A 37 2.725 18.391 -6.491 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.307 18.926 -7.105 1.00 0.00 H new ATOM 562 N ALA A 38 1.748 19.967 -4.341 1.00 0.00 N ATOM 563 CA ALA A 38 0.592 20.442 -5.091 1.00 0.00 C ATOM 564 C ALA A 38 1.021 21.255 -6.307 1.00 0.00 C ATOM 565 O ALA A 38 1.577 22.345 -6.173 1.00 0.00 O ATOM 566 CB ALA A 38 -0.315 21.271 -4.193 1.00 0.00 C ATOM 0 H ALA A 38 2.279 20.703 -3.875 1.00 0.00 H new ATOM 0 HA ALA A 38 0.039 19.572 -5.446 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.174 21.619 -4.766 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.659 20.659 -3.359 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.238 22.129 -3.810 1.00 0.00 H new ATOM 572 N PHE A 39 0.761 20.717 -7.494 1.00 0.00 N ATOM 573 CA PHE A 39 1.122 21.393 -8.735 1.00 0.00 C ATOM 574 C PHE A 39 0.802 22.882 -8.657 1.00 0.00 C ATOM 575 O PHE A 39 1.498 23.710 -9.246 1.00 0.00 O ATOM 576 CB PHE A 39 0.383 20.762 -9.917 1.00 0.00 C ATOM 577 CG PHE A 39 1.144 20.841 -11.210 1.00 0.00 C ATOM 578 CD1 PHE A 39 1.315 22.054 -11.856 1.00 0.00 C ATOM 579 CD2 PHE A 39 1.688 19.701 -11.779 1.00 0.00 C ATOM 580 CE1 PHE A 39 2.013 22.129 -13.046 1.00 0.00 C ATOM 581 CE2 PHE A 39 2.388 19.769 -12.969 1.00 0.00 C ATOM 582 CZ PHE A 39 2.552 20.985 -13.603 1.00 0.00 C ATOM 0 H PHE A 39 0.302 19.815 -7.623 1.00 0.00 H new ATOM 0 HA PHE A 39 2.196 21.278 -8.883 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.176 19.716 -9.690 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.580 21.258 -10.040 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.898 22.952 -11.425 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.564 18.748 -11.287 1.00 0.00 H new ATOM 0 HE1 PHE A 39 2.137 23.081 -13.541 1.00 0.00 H new ATOM 0 HE2 PHE A 39 2.806 18.872 -13.402 1.00 0.00 H new ATOM 0 HZ PHE A 39 3.100 21.042 -14.532 1.00 0.00 H new ATOM 592 N SER A 40 -0.257 23.217 -7.925 1.00 0.00 N ATOM 593 CA SER A 40 -0.673 24.606 -7.773 1.00 0.00 C ATOM 594 C SER A 40 -1.177 24.870 -6.357 1.00 0.00 C ATOM 595 O SER A 40 -2.173 24.291 -5.925 1.00 0.00 O ATOM 596 CB SER A 40 -1.766 24.947 -8.788 1.00 0.00 C ATOM 597 OG SER A 40 -1.967 26.348 -8.869 1.00 0.00 O ATOM 0 H SER A 40 -0.842 22.545 -7.428 1.00 0.00 H new ATOM 0 HA SER A 40 0.193 25.242 -7.956 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.490 24.559 -9.768 1.00 0.00 H new ATOM 0 HB3 SER A 40 -2.698 24.459 -8.502 1.00 0.00 H new ATOM 0 HG SER A 40 -2.443 26.657 -8.070 1.00 0.00 H new ATOM 603 N GLU A 41 -0.480 25.747 -5.642 1.00 0.00 N ATOM 604 CA GLU A 41 -0.856 26.087 -4.275 1.00 0.00 C ATOM 605 C GLU A 41 -2.374 26.100 -4.115 1.00 0.00 C ATOM 606 O GLU A 41 -2.911 25.572 -3.141 1.00 0.00 O ATOM 607 CB GLU A 41 -0.280 27.451 -3.888 1.00 0.00 C ATOM 608 CG GLU A 41 -0.236 27.689 -2.388 1.00 0.00 C ATOM 609 CD GLU A 41 0.654 26.698 -1.665 1.00 0.00 C ATOM 610 OE1 GLU A 41 1.888 26.889 -1.677 1.00 0.00 O ATOM 611 OE2 GLU A 41 0.116 25.730 -1.087 1.00 0.00 O ATOM 0 H GLU A 41 0.347 26.235 -5.986 1.00 0.00 H new ATOM 0 HA GLU A 41 -0.445 25.325 -3.613 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.729 27.538 -4.291 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -0.878 28.234 -4.354 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.122 28.700 -2.195 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -1.246 27.626 -1.984 1.00 0.00 H new ATOM 618 N ASP A 42 -3.059 26.707 -5.078 1.00 0.00 N ATOM 619 CA ASP A 42 -4.514 26.789 -5.046 1.00 0.00 C ATOM 620 C ASP A 42 -5.117 25.525 -4.441 1.00 0.00 C ATOM 621 O ASP A 42 -5.961 25.593 -3.549 1.00 0.00 O ATOM 622 CB ASP A 42 -5.065 27.008 -6.456 1.00 0.00 C ATOM 623 CG ASP A 42 -4.491 28.245 -7.117 1.00 0.00 C ATOM 624 OD1 ASP A 42 -3.262 28.452 -7.023 1.00 0.00 O ATOM 625 OD2 ASP A 42 -5.269 29.007 -7.728 1.00 0.00 O ATOM 0 H ASP A 42 -2.630 27.149 -5.891 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.792 27.637 -4.420 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.842 26.135 -7.070 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -6.150 27.095 -6.409 1.00 0.00 H new ATOM 630 N GLY A 43 -4.677 24.371 -4.934 1.00 0.00 N ATOM 631 CA GLY A 43 -5.184 23.108 -4.432 1.00 0.00 C ATOM 632 C GLY A 43 -5.216 22.031 -5.498 1.00 0.00 C ATOM 633 O GLY A 43 -5.384 22.324 -6.681 1.00 0.00 O ATOM 0 H GLY A 43 -3.978 24.289 -5.672 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.562 22.775 -3.602 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -6.190 23.255 -4.038 1.00 0.00 H new ATOM 637 N SER A 44 -5.052 20.780 -5.078 1.00 0.00 N ATOM 638 CA SER A 44 -5.057 19.655 -6.006 1.00 0.00 C ATOM 639 C SER A 44 -5.960 18.536 -5.498 1.00 0.00 C ATOM 640 O SER A 44 -6.365 18.529 -4.336 1.00 0.00 O ATOM 641 CB SER A 44 -3.635 19.127 -6.209 1.00 0.00 C ATOM 642 OG SER A 44 -3.249 18.281 -5.139 1.00 0.00 O ATOM 0 H SER A 44 -4.914 20.520 -4.101 1.00 0.00 H new ATOM 0 HA SER A 44 -5.446 20.006 -6.962 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.578 18.579 -7.149 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.940 19.963 -6.285 1.00 0.00 H new ATOM 0 HG SER A 44 -2.338 17.955 -5.292 1.00 0.00 H new ATOM 648 N ASP A 45 -6.273 17.591 -6.379 1.00 0.00 N ATOM 649 CA ASP A 45 -7.127 16.465 -6.021 1.00 0.00 C ATOM 650 C ASP A 45 -6.354 15.152 -6.092 1.00 0.00 C ATOM 651 O ASP A 45 -6.424 14.415 -7.076 1.00 0.00 O ATOM 652 CB ASP A 45 -8.344 16.406 -6.946 1.00 0.00 C ATOM 653 CG ASP A 45 -8.922 17.779 -7.231 1.00 0.00 C ATOM 654 OD1 ASP A 45 -8.962 18.610 -6.300 1.00 0.00 O ATOM 655 OD2 ASP A 45 -9.333 18.021 -8.384 1.00 0.00 O ATOM 0 H ASP A 45 -5.948 17.583 -7.346 1.00 0.00 H new ATOM 0 HA ASP A 45 -7.467 16.610 -4.996 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -8.060 15.932 -7.886 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -9.111 15.779 -6.492 1.00 0.00 H new ATOM 660 N PRO A 46 -5.598 14.851 -5.026 1.00 0.00 N ATOM 661 CA PRO A 46 -4.797 13.627 -4.944 1.00 0.00 C ATOM 662 C PRO A 46 -5.660 12.377 -4.806 1.00 0.00 C ATOM 663 O PRO A 46 -6.661 12.378 -4.089 1.00 0.00 O ATOM 664 CB PRO A 46 -3.956 13.837 -3.682 1.00 0.00 C ATOM 665 CG PRO A 46 -4.751 14.783 -2.850 1.00 0.00 C ATOM 666 CD PRO A 46 -5.468 15.684 -3.818 1.00 0.00 C ATOM 0 HA PRO A 46 -4.206 13.466 -5.846 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.786 12.896 -3.159 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.976 14.249 -3.923 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -5.459 14.247 -2.218 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.104 15.358 -2.187 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.441 15.992 -3.435 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -4.901 16.594 -4.016 1.00 0.00 H new ATOM 674 N TYR A 47 -5.267 11.313 -5.498 1.00 0.00 N ATOM 675 CA TYR A 47 -6.006 10.057 -5.454 1.00 0.00 C ATOM 676 C TYR A 47 -5.075 8.869 -5.672 1.00 0.00 C ATOM 677 O TYR A 47 -4.202 8.900 -6.540 1.00 0.00 O ATOM 678 CB TYR A 47 -7.111 10.055 -6.512 1.00 0.00 C ATOM 679 CG TYR A 47 -6.594 9.905 -7.926 1.00 0.00 C ATOM 680 CD1 TYR A 47 -6.163 11.009 -8.650 1.00 0.00 C ATOM 681 CD2 TYR A 47 -6.538 8.658 -8.537 1.00 0.00 C ATOM 682 CE1 TYR A 47 -5.691 10.877 -9.941 1.00 0.00 C ATOM 683 CE2 TYR A 47 -6.066 8.516 -9.828 1.00 0.00 C ATOM 684 CZ TYR A 47 -5.645 9.628 -10.526 1.00 0.00 C ATOM 685 OH TYR A 47 -5.174 9.492 -11.812 1.00 0.00 O ATOM 0 H TYR A 47 -4.441 11.296 -6.096 1.00 0.00 H new ATOM 0 HA TYR A 47 -6.457 9.964 -4.466 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.805 9.242 -6.299 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -7.676 10.984 -6.437 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -6.198 11.988 -8.195 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -6.869 7.785 -7.994 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -5.360 11.746 -10.490 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -6.027 7.539 -10.288 1.00 0.00 H new ATOM 0 HH TYR A 47 -5.207 8.548 -12.074 1.00 0.00 H new ATOM 695 N VAL A 48 -5.267 7.821 -4.877 1.00 0.00 N ATOM 696 CA VAL A 48 -4.447 6.621 -4.982 1.00 0.00 C ATOM 697 C VAL A 48 -5.018 5.653 -6.012 1.00 0.00 C ATOM 698 O VAL A 48 -6.228 5.427 -6.062 1.00 0.00 O ATOM 699 CB VAL A 48 -4.330 5.900 -3.626 1.00 0.00 C ATOM 700 CG1 VAL A 48 -3.393 4.706 -3.734 1.00 0.00 C ATOM 701 CG2 VAL A 48 -3.855 6.864 -2.550 1.00 0.00 C ATOM 0 H VAL A 48 -5.984 7.779 -4.153 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.456 6.943 -5.301 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.317 5.533 -3.344 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.323 4.210 -2.766 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.780 4.006 -4.474 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.404 5.046 -4.039 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.778 6.338 -1.598 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.878 7.263 -2.824 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.568 7.683 -2.455 1.00 0.00 H new ATOM 711 N ARG A 49 -4.141 5.083 -6.832 1.00 0.00 N ATOM 712 CA ARG A 49 -4.559 4.140 -7.862 1.00 0.00 C ATOM 713 C ARG A 49 -3.860 2.795 -7.682 1.00 0.00 C ATOM 714 O ARG A 49 -2.699 2.737 -7.280 1.00 0.00 O ATOM 715 CB ARG A 49 -4.256 4.702 -9.252 1.00 0.00 C ATOM 716 CG ARG A 49 -4.340 3.665 -10.360 1.00 0.00 C ATOM 717 CD ARG A 49 -3.759 4.193 -11.662 1.00 0.00 C ATOM 718 NE ARG A 49 -2.299 4.173 -11.658 1.00 0.00 N ATOM 719 CZ ARG A 49 -1.555 4.574 -12.683 1.00 0.00 C ATOM 720 NH1 ARG A 49 -2.132 5.024 -13.789 1.00 0.00 N ATOM 721 NH2 ARG A 49 -0.231 4.525 -12.604 1.00 0.00 N ATOM 0 H ARG A 49 -3.137 5.258 -6.803 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.634 3.988 -7.766 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.955 5.510 -9.468 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -3.257 5.138 -9.249 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -3.803 2.765 -10.059 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.380 3.379 -10.514 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -4.127 3.592 -12.493 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -4.107 5.213 -11.827 1.00 0.00 H new ATOM 0 HE ARG A 49 -1.824 3.832 -10.822 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -3.149 5.063 -13.854 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -1.559 5.331 -14.575 1.00 0.00 H new ATOM 0 HH21 ARG A 49 0.217 4.179 -11.755 1.00 0.00 H new ATOM 0 HH22 ARG A 49 0.339 4.833 -13.392 1.00 0.00 H new ATOM 735 N MET A 50 -4.577 1.717 -7.983 1.00 0.00 N ATOM 736 CA MET A 50 -4.026 0.373 -7.855 1.00 0.00 C ATOM 737 C MET A 50 -4.241 -0.427 -9.136 1.00 0.00 C ATOM 738 O MET A 50 -5.366 -0.552 -9.620 1.00 0.00 O ATOM 739 CB MET A 50 -4.668 -0.355 -6.672 1.00 0.00 C ATOM 740 CG MET A 50 -4.082 0.040 -5.326 1.00 0.00 C ATOM 741 SD MET A 50 -4.598 -1.062 -3.995 1.00 0.00 S ATOM 742 CE MET A 50 -6.100 -0.254 -3.449 1.00 0.00 C ATOM 0 H MET A 50 -5.540 1.748 -8.317 1.00 0.00 H new ATOM 0 HA MET A 50 -2.954 0.463 -7.679 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.739 -0.150 -6.667 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.550 -1.430 -6.809 1.00 0.00 H new ATOM 0 HG2 MET A 50 -2.994 0.038 -5.393 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.385 1.059 -5.087 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.132 -0.243 -2.360 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.119 0.770 -3.823 1.00 0.00 H new ATOM 0 HE3 MET A 50 -6.965 -0.796 -3.832 1.00 0.00 H new ATOM 752 N TYR A 51 -3.155 -0.965 -9.681 1.00 0.00 N ATOM 753 CA TYR A 51 -3.225 -1.750 -10.908 1.00 0.00 C ATOM 754 C TYR A 51 -2.538 -3.101 -10.730 1.00 0.00 C ATOM 755 O TYR A 51 -1.428 -3.181 -10.202 1.00 0.00 O ATOM 756 CB TYR A 51 -2.581 -0.986 -12.065 1.00 0.00 C ATOM 757 CG TYR A 51 -3.554 -0.128 -12.841 1.00 0.00 C ATOM 758 CD1 TYR A 51 -4.401 0.760 -12.188 1.00 0.00 C ATOM 759 CD2 TYR A 51 -3.629 -0.206 -14.226 1.00 0.00 C ATOM 760 CE1 TYR A 51 -5.292 1.546 -12.893 1.00 0.00 C ATOM 761 CE2 TYR A 51 -4.516 0.577 -14.939 1.00 0.00 C ATOM 762 CZ TYR A 51 -5.346 1.451 -14.268 1.00 0.00 C ATOM 763 OH TYR A 51 -6.233 2.231 -14.974 1.00 0.00 O ATOM 0 H TYR A 51 -2.216 -0.872 -9.293 1.00 0.00 H new ATOM 0 HA TYR A 51 -4.276 -1.925 -11.138 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -1.785 -0.353 -11.673 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -2.116 -1.699 -12.746 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -4.362 0.837 -11.111 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -2.982 -0.891 -14.755 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -5.943 2.231 -12.370 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -4.559 0.505 -16.016 1.00 0.00 H new ATOM 0 HH TYR A 51 -6.143 2.043 -15.932 1.00 0.00 H new ATOM 773 N LEU A 52 -3.205 -4.160 -11.174 1.00 0.00 N ATOM 774 CA LEU A 52 -2.660 -5.508 -11.066 1.00 0.00 C ATOM 775 C LEU A 52 -1.839 -5.864 -12.301 1.00 0.00 C ATOM 776 O LEU A 52 -2.370 -6.376 -13.287 1.00 0.00 O ATOM 777 CB LEU A 52 -3.790 -6.523 -10.881 1.00 0.00 C ATOM 778 CG LEU A 52 -3.382 -7.886 -10.321 1.00 0.00 C ATOM 779 CD1 LEU A 52 -2.439 -7.718 -9.140 1.00 0.00 C ATOM 780 CD2 LEU A 52 -4.612 -8.684 -9.913 1.00 0.00 C ATOM 0 H LEU A 52 -4.125 -4.111 -11.612 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.005 -5.540 -10.195 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.537 -6.088 -10.217 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.273 -6.679 -11.846 1.00 0.00 H new ATOM 0 HG LEU A 52 -2.858 -8.436 -11.103 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.160 -8.699 -8.755 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.544 -7.186 -9.462 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.937 -7.148 -8.355 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.303 -9.651 -9.517 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.163 -8.137 -9.148 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.252 -8.836 -10.782 1.00 0.00 H new ATOM 792 N LEU A 53 -0.540 -5.592 -12.240 1.00 0.00 N ATOM 793 CA LEU A 53 0.357 -5.886 -13.353 1.00 0.00 C ATOM 794 C LEU A 53 0.733 -7.364 -13.374 1.00 0.00 C ATOM 795 O LEU A 53 0.723 -8.047 -12.349 1.00 0.00 O ATOM 796 CB LEU A 53 1.620 -5.028 -13.256 1.00 0.00 C ATOM 797 CG LEU A 53 1.443 -3.537 -13.547 1.00 0.00 C ATOM 798 CD1 LEU A 53 1.183 -3.310 -15.028 1.00 0.00 C ATOM 799 CD2 LEU A 53 0.309 -2.961 -12.710 1.00 0.00 C ATOM 0 H LEU A 53 -0.084 -5.168 -11.432 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.165 -5.650 -14.280 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.032 -5.135 -12.253 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.361 -5.428 -13.949 1.00 0.00 H new ATOM 0 HG LEU A 53 2.365 -3.022 -13.277 1.00 0.00 H new ATOM 0 HD11 LEU A 53 1.060 -2.244 -15.216 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.026 -3.686 -15.607 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.276 -3.838 -15.323 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.197 -1.899 -12.930 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.619 -3.480 -12.948 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.536 -3.090 -11.652 1.00 0.00 H new ATOM 811 N PRO A 54 1.074 -7.871 -14.568 1.00 0.00 N ATOM 812 CA PRO A 54 1.089 -7.068 -15.794 1.00 0.00 C ATOM 813 C PRO A 54 -0.314 -6.680 -16.250 1.00 0.00 C ATOM 814 O PRO A 54 -0.508 -5.637 -16.874 1.00 0.00 O ATOM 815 CB PRO A 54 1.747 -7.996 -16.818 1.00 0.00 C ATOM 816 CG PRO A 54 1.475 -9.371 -16.313 1.00 0.00 C ATOM 817 CD PRO A 54 1.472 -9.267 -14.812 1.00 0.00 C ATOM 0 HA PRO A 54 1.614 -6.123 -15.656 1.00 0.00 H new ATOM 0 HB2 PRO A 54 1.327 -7.849 -17.813 1.00 0.00 H new ATOM 0 HB3 PRO A 54 2.818 -7.807 -16.893 1.00 0.00 H new ATOM 0 HG2 PRO A 54 0.517 -9.740 -16.681 1.00 0.00 H new ATOM 0 HG3 PRO A 54 2.238 -10.070 -16.654 1.00 0.00 H new ATOM 0 HD2 PRO A 54 0.771 -9.969 -14.362 1.00 0.00 H new ATOM 0 HD3 PRO A 54 2.454 -9.484 -14.392 1.00 0.00 H new ATOM 825 N ASP A 55 -1.288 -7.527 -15.934 1.00 0.00 N ATOM 826 CA ASP A 55 -2.674 -7.272 -16.310 1.00 0.00 C ATOM 827 C ASP A 55 -2.978 -5.777 -16.284 1.00 0.00 C ATOM 828 O ASP A 55 -3.148 -5.185 -15.218 1.00 0.00 O ATOM 829 CB ASP A 55 -3.625 -8.015 -15.371 1.00 0.00 C ATOM 830 CG ASP A 55 -3.959 -9.407 -15.868 1.00 0.00 C ATOM 831 OD1 ASP A 55 -3.254 -9.899 -16.774 1.00 0.00 O ATOM 832 OD2 ASP A 55 -4.925 -10.006 -15.351 1.00 0.00 O ATOM 0 H ASP A 55 -1.143 -8.395 -15.419 1.00 0.00 H new ATOM 0 HA ASP A 55 -2.822 -7.637 -17.326 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.173 -8.084 -14.381 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -4.545 -7.441 -15.262 1.00 0.00 H new ATOM 837 N LYS A 56 -3.044 -5.171 -17.465 1.00 0.00 N ATOM 838 CA LYS A 56 -3.328 -3.746 -17.579 1.00 0.00 C ATOM 839 C LYS A 56 -4.579 -3.505 -18.418 1.00 0.00 C ATOM 840 O LYS A 56 -4.541 -2.779 -19.412 1.00 0.00 O ATOM 841 CB LYS A 56 -2.136 -3.016 -18.201 1.00 0.00 C ATOM 842 CG LYS A 56 -1.123 -2.526 -17.181 1.00 0.00 C ATOM 843 CD LYS A 56 -0.260 -1.409 -17.743 1.00 0.00 C ATOM 844 CE LYS A 56 -1.045 -0.114 -17.882 1.00 0.00 C ATOM 845 NZ LYS A 56 -0.194 0.999 -18.389 1.00 0.00 N ATOM 0 H LYS A 56 -2.904 -5.645 -18.357 1.00 0.00 H new ATOM 0 HA LYS A 56 -3.504 -3.355 -16.577 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -1.638 -3.684 -18.903 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -2.501 -2.165 -18.775 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -1.644 -2.172 -16.291 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.488 -3.356 -16.870 1.00 0.00 H new ATOM 0 HD2 LYS A 56 0.598 -1.247 -17.090 1.00 0.00 H new ATOM 0 HD3 LYS A 56 0.131 -1.705 -18.716 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -1.883 -0.269 -18.561 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -1.465 0.162 -16.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -0.766 1.864 -18.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 0.592 1.164 -17.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 0.187 0.747 -19.323 1.00 0.00 H new ATOM 859 N ARG A 57 -5.686 -4.118 -18.011 1.00 0.00 N ATOM 860 CA ARG A 57 -6.948 -3.970 -18.726 1.00 0.00 C ATOM 861 C ARG A 57 -7.545 -2.585 -18.494 1.00 0.00 C ATOM 862 O ARG A 57 -8.568 -2.233 -19.081 1.00 0.00 O ATOM 863 CB ARG A 57 -7.940 -5.045 -18.280 1.00 0.00 C ATOM 864 CG ARG A 57 -7.428 -6.464 -18.472 1.00 0.00 C ATOM 865 CD ARG A 57 -7.488 -6.885 -19.932 1.00 0.00 C ATOM 866 NE ARG A 57 -7.049 -8.265 -20.121 1.00 0.00 N ATOM 867 CZ ARG A 57 -7.399 -9.011 -21.163 1.00 0.00 C ATOM 868 NH1 ARG A 57 -8.189 -8.512 -22.105 1.00 0.00 N ATOM 869 NH2 ARG A 57 -6.958 -10.259 -21.265 1.00 0.00 N ATOM 0 H ARG A 57 -5.734 -4.722 -17.190 1.00 0.00 H new ATOM 0 HA ARG A 57 -6.749 -4.088 -19.791 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.178 -4.893 -17.227 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -8.869 -4.924 -18.838 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.401 -6.533 -18.114 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.022 -7.151 -17.869 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -8.508 -6.775 -20.299 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -6.862 -6.220 -20.527 1.00 0.00 H new ATOM 0 HE ARG A 57 -6.441 -8.679 -19.414 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -8.529 -7.553 -22.030 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -8.456 -9.087 -22.904 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -6.350 -10.646 -20.543 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -7.227 -10.831 -22.065 1.00 0.00 H new ATOM 883 N ARG A 58 -6.898 -1.804 -17.635 1.00 0.00 N ATOM 884 CA ARG A 58 -7.365 -0.458 -17.325 1.00 0.00 C ATOM 885 C ARG A 58 -8.890 -0.392 -17.354 1.00 0.00 C ATOM 886 O ARG A 58 -9.469 0.612 -17.768 1.00 0.00 O ATOM 887 CB ARG A 58 -6.781 0.550 -18.316 1.00 0.00 C ATOM 888 CG ARG A 58 -7.321 0.397 -19.729 1.00 0.00 C ATOM 889 CD ARG A 58 -6.459 -0.543 -20.556 1.00 0.00 C ATOM 890 NE ARG A 58 -5.273 0.125 -21.086 1.00 0.00 N ATOM 891 CZ ARG A 58 -4.507 -0.388 -22.042 1.00 0.00 C ATOM 892 NH1 ARG A 58 -4.800 -1.568 -22.571 1.00 0.00 N ATOM 893 NH2 ARG A 58 -3.444 0.280 -22.472 1.00 0.00 N ATOM 0 H ARG A 58 -6.049 -2.080 -17.141 1.00 0.00 H new ATOM 0 HA ARG A 58 -7.026 -0.206 -16.320 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -6.993 1.559 -17.962 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -5.697 0.440 -18.336 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -8.342 0.017 -19.690 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -7.363 1.374 -20.212 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -6.154 -1.390 -19.941 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -7.048 -0.944 -21.381 1.00 0.00 H new ATOM 0 HE ARG A 58 -5.019 1.035 -20.701 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -5.616 -2.085 -22.244 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -4.209 -1.959 -23.305 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -3.215 1.188 -22.068 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -2.856 -0.115 -23.206 1.00 0.00 H new ATOM 907 N SER A 59 -9.532 -1.468 -16.913 1.00 0.00 N ATOM 908 CA SER A 59 -10.989 -1.534 -16.894 1.00 0.00 C ATOM 909 C SER A 59 -11.513 -1.542 -15.461 1.00 0.00 C ATOM 910 O SER A 59 -12.113 -0.571 -15.002 1.00 0.00 O ATOM 911 CB SER A 59 -11.474 -2.783 -17.633 1.00 0.00 C ATOM 912 OG SER A 59 -10.992 -2.806 -18.965 1.00 0.00 O ATOM 0 H SER A 59 -9.067 -2.306 -16.564 1.00 0.00 H new ATOM 0 HA SER A 59 -11.375 -0.649 -17.399 1.00 0.00 H new ATOM 0 HB2 SER A 59 -11.137 -3.675 -17.105 1.00 0.00 H new ATOM 0 HB3 SER A 59 -12.564 -2.807 -17.637 1.00 0.00 H new ATOM 0 HG SER A 59 -10.022 -2.943 -18.959 1.00 0.00 H new ATOM 918 N GLY A 60 -11.281 -2.647 -14.758 1.00 0.00 N ATOM 919 CA GLY A 60 -11.736 -2.762 -13.385 1.00 0.00 C ATOM 920 C GLY A 60 -10.747 -2.178 -12.396 1.00 0.00 C ATOM 921 O GLY A 60 -10.646 -2.644 -11.261 1.00 0.00 O ATOM 0 H GLY A 60 -10.786 -3.464 -15.115 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.694 -2.253 -13.279 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -11.905 -3.812 -13.148 1.00 0.00 H new ATOM 925 N ARG A 61 -10.014 -1.157 -12.828 1.00 0.00 N ATOM 926 CA ARG A 61 -9.025 -0.511 -11.972 1.00 0.00 C ATOM 927 C ARG A 61 -9.620 -0.182 -10.606 1.00 0.00 C ATOM 928 O ARG A 61 -10.766 0.257 -10.507 1.00 0.00 O ATOM 929 CB ARG A 61 -8.504 0.766 -12.634 1.00 0.00 C ATOM 930 CG ARG A 61 -9.313 2.005 -12.288 1.00 0.00 C ATOM 931 CD ARG A 61 -10.672 1.992 -12.971 1.00 0.00 C ATOM 932 NE ARG A 61 -11.237 3.333 -13.093 1.00 0.00 N ATOM 933 CZ ARG A 61 -10.834 4.221 -13.995 1.00 0.00 C ATOM 934 NH1 ARG A 61 -9.870 3.911 -14.851 1.00 0.00 N ATOM 935 NH2 ARG A 61 -11.397 5.421 -14.044 1.00 0.00 N ATOM 0 H ARG A 61 -10.086 -0.759 -13.765 1.00 0.00 H new ATOM 0 HA ARG A 61 -8.196 -1.204 -11.830 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -7.468 0.924 -12.335 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -8.506 0.631 -13.716 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -9.448 2.063 -11.208 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -8.762 2.896 -12.589 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -10.575 1.548 -13.962 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -11.356 1.361 -12.404 1.00 0.00 H new ATOM 0 HE ARG A 61 -11.982 3.603 -12.450 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -9.436 2.989 -14.818 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -9.563 4.595 -15.543 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -12.140 5.663 -13.389 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -11.087 6.102 -14.737 1.00 0.00 H new ATOM 949 N ARG A 62 -8.835 -0.399 -9.557 1.00 0.00 N ATOM 950 CA ARG A 62 -9.284 -0.128 -8.197 1.00 0.00 C ATOM 951 C ARG A 62 -8.543 1.069 -7.608 1.00 0.00 C ATOM 952 O ARG A 62 -7.313 1.091 -7.563 1.00 0.00 O ATOM 953 CB ARG A 62 -9.072 -1.358 -7.312 1.00 0.00 C ATOM 954 CG ARG A 62 -10.073 -1.469 -6.173 1.00 0.00 C ATOM 955 CD ARG A 62 -11.426 -1.959 -6.667 1.00 0.00 C ATOM 956 NE ARG A 62 -12.514 -1.541 -5.786 1.00 0.00 N ATOM 957 CZ ARG A 62 -13.795 -1.788 -6.033 1.00 0.00 C ATOM 958 NH1 ARG A 62 -14.148 -2.447 -7.129 1.00 0.00 N ATOM 959 NH2 ARG A 62 -14.727 -1.375 -5.184 1.00 0.00 N ATOM 0 H ARG A 62 -7.884 -0.762 -9.623 1.00 0.00 H new ATOM 0 HA ARG A 62 -10.348 0.106 -8.233 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -9.136 -2.254 -7.929 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -8.064 -1.327 -6.897 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.691 -2.154 -5.416 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.190 -0.497 -5.693 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -11.606 -1.576 -7.672 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -11.414 -3.047 -6.738 1.00 0.00 H new ATOM 0 HE ARG A 62 -12.277 -1.032 -4.935 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -13.434 -2.765 -7.785 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -15.133 -2.635 -7.316 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -14.460 -0.867 -4.341 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -15.711 -1.565 -5.375 1.00 0.00 H new ATOM 973 N LYS A 63 -9.300 2.063 -7.157 1.00 0.00 N ATOM 974 CA LYS A 63 -8.717 3.264 -6.570 1.00 0.00 C ATOM 975 C LYS A 63 -9.577 3.781 -5.421 1.00 0.00 C ATOM 976 O LYS A 63 -10.700 3.318 -5.215 1.00 0.00 O ATOM 977 CB LYS A 63 -8.562 4.353 -7.634 1.00 0.00 C ATOM 978 CG LYS A 63 -9.876 4.774 -8.270 1.00 0.00 C ATOM 979 CD LYS A 63 -9.663 5.349 -9.660 1.00 0.00 C ATOM 980 CE LYS A 63 -10.747 6.355 -10.019 1.00 0.00 C ATOM 981 NZ LYS A 63 -11.969 5.688 -10.548 1.00 0.00 N ATOM 0 H LYS A 63 -10.320 2.061 -7.187 1.00 0.00 H new ATOM 0 HA LYS A 63 -7.734 3.005 -6.177 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -8.091 5.226 -7.182 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -7.889 3.995 -8.413 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -10.544 3.915 -8.329 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.365 5.516 -7.639 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.687 5.831 -9.710 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -9.658 4.541 -10.392 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -11.006 6.940 -9.137 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -10.363 7.053 -10.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -12.303 6.195 -11.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -11.746 4.704 -10.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -12.712 5.698 -9.821 1.00 0.00 H new ATOM 995 N THR A 64 -9.044 4.743 -4.675 1.00 0.00 N ATOM 996 CA THR A 64 -9.763 5.323 -3.547 1.00 0.00 C ATOM 997 C THR A 64 -10.435 6.634 -3.939 1.00 0.00 C ATOM 998 O THR A 64 -10.249 7.131 -5.050 1.00 0.00 O ATOM 999 CB THR A 64 -8.823 5.577 -2.354 1.00 0.00 C ATOM 1000 OG1 THR A 64 -7.809 6.519 -2.721 1.00 0.00 O ATOM 1001 CG2 THR A 64 -8.176 4.282 -1.889 1.00 0.00 C ATOM 0 H THR A 64 -8.116 5.137 -4.831 1.00 0.00 H new ATOM 0 HA THR A 64 -10.525 4.602 -3.252 1.00 0.00 H new ATOM 0 HB THR A 64 -9.415 5.983 -1.534 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.503 6.998 -1.923 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.517 4.487 -1.046 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.950 3.578 -1.582 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.597 3.851 -2.706 1.00 0.00 H new ATOM 1009 N HIS A 65 -11.218 7.190 -3.019 1.00 0.00 N ATOM 1010 CA HIS A 65 -11.917 8.445 -3.268 1.00 0.00 C ATOM 1011 C HIS A 65 -10.931 9.559 -3.608 1.00 0.00 C ATOM 1012 O HIS A 65 -9.758 9.497 -3.239 1.00 0.00 O ATOM 1013 CB HIS A 65 -12.750 8.840 -2.049 1.00 0.00 C ATOM 1014 CG HIS A 65 -14.026 8.066 -1.919 1.00 0.00 C ATOM 1015 ND1 HIS A 65 -15.260 8.667 -1.786 1.00 0.00 N ATOM 1016 CD2 HIS A 65 -14.255 6.732 -1.903 1.00 0.00 C ATOM 1017 CE1 HIS A 65 -16.193 7.735 -1.693 1.00 0.00 C ATOM 1018 NE2 HIS A 65 -15.609 6.553 -1.762 1.00 0.00 N ATOM 0 H HIS A 65 -11.384 6.791 -2.095 1.00 0.00 H new ATOM 0 HA HIS A 65 -12.581 8.299 -4.120 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -12.153 8.694 -1.149 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -12.984 9.903 -2.108 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -13.511 5.953 -1.986 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -17.253 7.911 -1.580 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -16.086 5.653 -1.718 1.00 0.00 H new ATOM 1026 N VAL A 66 -11.414 10.576 -4.314 1.00 0.00 N ATOM 1027 CA VAL A 66 -10.576 11.704 -4.702 1.00 0.00 C ATOM 1028 C VAL A 66 -10.779 12.889 -3.765 1.00 0.00 C ATOM 1029 O VAL A 66 -11.790 13.587 -3.841 1.00 0.00 O ATOM 1030 CB VAL A 66 -10.869 12.149 -6.147 1.00 0.00 C ATOM 1031 CG1 VAL A 66 -9.993 13.333 -6.529 1.00 0.00 C ATOM 1032 CG2 VAL A 66 -10.665 10.992 -7.113 1.00 0.00 C ATOM 0 H VAL A 66 -12.382 10.642 -4.629 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.542 11.367 -4.636 1.00 0.00 H new ATOM 0 HB VAL A 66 -11.911 12.463 -6.207 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -10.214 13.634 -7.553 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -10.193 14.166 -5.855 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.943 13.049 -6.453 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -10.877 11.325 -8.129 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.634 10.645 -7.052 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -11.339 10.176 -6.851 1.00 0.00 H new ATOM 1042 N SER A 67 -9.811 13.111 -2.882 1.00 0.00 N ATOM 1043 CA SER A 67 -9.885 14.211 -1.927 1.00 0.00 C ATOM 1044 C SER A 67 -9.514 15.533 -2.592 1.00 0.00 C ATOM 1045 O SER A 67 -8.658 15.579 -3.475 1.00 0.00 O ATOM 1046 CB SER A 67 -8.958 13.946 -0.739 1.00 0.00 C ATOM 1047 OG SER A 67 -9.264 12.709 -0.120 1.00 0.00 O ATOM 0 H SER A 67 -8.966 12.544 -2.808 1.00 0.00 H new ATOM 0 HA SER A 67 -10.912 14.280 -1.568 1.00 0.00 H new ATOM 0 HB2 SER A 67 -7.922 13.941 -1.076 1.00 0.00 H new ATOM 0 HB3 SER A 67 -9.053 14.753 -0.013 1.00 0.00 H new ATOM 0 HG SER A 67 -8.657 12.562 0.635 1.00 0.00 H new ATOM 1053 N LYS A 68 -10.165 16.608 -2.160 1.00 0.00 N ATOM 1054 CA LYS A 68 -9.905 17.933 -2.710 1.00 0.00 C ATOM 1055 C LYS A 68 -9.466 18.900 -1.615 1.00 0.00 C ATOM 1056 O LYS A 68 -9.737 18.682 -0.434 1.00 0.00 O ATOM 1057 CB LYS A 68 -11.155 18.472 -3.409 1.00 0.00 C ATOM 1058 CG LYS A 68 -11.632 17.601 -4.558 1.00 0.00 C ATOM 1059 CD LYS A 68 -12.564 18.363 -5.486 1.00 0.00 C ATOM 1060 CE LYS A 68 -12.500 17.823 -6.907 1.00 0.00 C ATOM 1061 NZ LYS A 68 -13.732 18.146 -7.679 1.00 0.00 N ATOM 0 H LYS A 68 -10.877 16.587 -1.430 1.00 0.00 H new ATOM 0 HA LYS A 68 -9.098 17.845 -3.438 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -11.958 18.566 -2.678 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.947 19.474 -3.785 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -10.773 17.238 -5.122 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -12.147 16.725 -4.163 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -13.586 18.293 -5.115 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -12.296 19.420 -5.485 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -11.632 18.242 -7.416 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -12.362 16.742 -6.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -13.649 17.761 -8.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -14.558 17.725 -7.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -13.850 19.178 -7.728 1.00 0.00 H new ATOM 1075 N LYS A 69 -8.787 19.970 -2.015 1.00 0.00 N ATOM 1076 CA LYS A 69 -8.312 20.973 -1.069 1.00 0.00 C ATOM 1077 C LYS A 69 -7.602 20.315 0.111 1.00 0.00 C ATOM 1078 O LYS A 69 -7.896 20.611 1.270 1.00 0.00 O ATOM 1079 CB LYS A 69 -9.481 21.822 -0.565 1.00 0.00 C ATOM 1080 CG LYS A 69 -9.885 22.930 -1.522 1.00 0.00 C ATOM 1081 CD LYS A 69 -9.061 24.187 -1.301 1.00 0.00 C ATOM 1082 CE LYS A 69 -9.407 25.266 -2.315 1.00 0.00 C ATOM 1083 NZ LYS A 69 -8.783 25.002 -3.641 1.00 0.00 N ATOM 0 H LYS A 69 -8.553 20.165 -2.989 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.600 21.616 -1.586 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -10.340 21.174 -0.389 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -9.212 22.263 0.395 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -9.760 22.588 -2.549 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -10.942 23.159 -1.389 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -9.234 24.564 -0.293 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -8.001 23.945 -1.373 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -10.490 25.324 -2.428 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -9.073 26.235 -1.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -9.234 25.600 -4.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -7.767 25.220 -3.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -8.911 24.001 -3.892 1.00 0.00 H new ATOM 1097 N THR A 70 -6.666 19.421 -0.192 1.00 0.00 N ATOM 1098 CA THR A 70 -5.914 18.722 0.843 1.00 0.00 C ATOM 1099 C THR A 70 -4.680 18.042 0.261 1.00 0.00 C ATOM 1100 O THR A 70 -4.728 17.472 -0.829 1.00 0.00 O ATOM 1101 CB THR A 70 -6.782 17.665 1.551 1.00 0.00 C ATOM 1102 OG1 THR A 70 -6.016 16.997 2.559 1.00 0.00 O ATOM 1103 CG2 THR A 70 -7.316 16.648 0.554 1.00 0.00 C ATOM 0 H THR A 70 -6.411 19.164 -1.145 1.00 0.00 H new ATOM 0 HA THR A 70 -5.604 19.473 1.570 1.00 0.00 H new ATOM 0 HB THR A 70 -7.627 18.173 2.016 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.576 16.328 3.005 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.926 15.912 1.077 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.923 17.157 -0.195 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.482 16.146 0.064 1.00 0.00 H new ATOM 1111 N LEU A 71 -3.574 18.106 0.995 1.00 0.00 N ATOM 1112 CA LEU A 71 -2.325 17.496 0.552 1.00 0.00 C ATOM 1113 C LEU A 71 -2.149 16.110 1.166 1.00 0.00 C ATOM 1114 O LEU A 71 -1.541 15.227 0.563 1.00 0.00 O ATOM 1115 CB LEU A 71 -1.139 18.386 0.925 1.00 0.00 C ATOM 1116 CG LEU A 71 -1.077 19.747 0.231 1.00 0.00 C ATOM 1117 CD1 LEU A 71 0.213 20.470 0.586 1.00 0.00 C ATOM 1118 CD2 LEU A 71 -1.201 19.584 -1.277 1.00 0.00 C ATOM 0 H LEU A 71 -3.517 18.574 1.899 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.365 17.391 -0.532 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -1.159 18.550 2.002 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -0.220 17.845 0.702 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.915 20.349 0.581 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.239 21.436 0.083 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.260 20.621 1.664 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.066 19.871 0.266 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -1.155 20.563 -1.754 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -0.384 18.963 -1.644 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -2.153 19.109 -1.515 1.00 0.00 H new ATOM 1130 N ASN A 72 -2.687 15.929 2.368 1.00 0.00 N ATOM 1131 CA ASN A 72 -2.590 14.650 3.063 1.00 0.00 C ATOM 1132 C ASN A 72 -3.950 13.962 3.127 1.00 0.00 C ATOM 1133 O ASN A 72 -4.660 14.028 4.131 1.00 0.00 O ATOM 1134 CB ASN A 72 -2.041 14.854 4.476 1.00 0.00 C ATOM 1135 CG ASN A 72 -2.954 15.711 5.332 1.00 0.00 C ATOM 1136 OD1 ASN A 72 -3.333 16.815 4.943 1.00 0.00 O ATOM 1137 ND2 ASN A 72 -3.312 15.203 6.506 1.00 0.00 N ATOM 0 H ASN A 72 -3.194 16.651 2.880 1.00 0.00 H new ATOM 0 HA ASN A 72 -1.906 14.012 2.504 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -1.905 13.884 4.954 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -1.058 15.321 4.417 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -3.925 15.733 7.125 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -2.974 14.283 6.788 1.00 0.00 H new ATOM 1144 N PRO A 73 -4.323 13.284 2.032 1.00 0.00 N ATOM 1145 CA PRO A 73 -5.599 12.569 1.939 1.00 0.00 C ATOM 1146 C PRO A 73 -5.640 11.336 2.836 1.00 0.00 C ATOM 1147 O PRO A 73 -4.657 10.603 2.945 1.00 0.00 O ATOM 1148 CB PRO A 73 -5.672 12.161 0.466 1.00 0.00 C ATOM 1149 CG PRO A 73 -4.252 12.100 0.019 1.00 0.00 C ATOM 1150 CD PRO A 73 -3.527 13.162 0.799 1.00 0.00 C ATOM 0 HA PRO A 73 -6.436 13.186 2.266 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -6.166 11.197 0.346 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.240 12.885 -0.118 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.825 11.116 0.210 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.172 12.280 -1.053 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -2.498 12.872 1.012 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -3.486 14.104 0.253 1.00 0.00 H new ATOM 1158 N VAL A 74 -6.783 11.112 3.476 1.00 0.00 N ATOM 1159 CA VAL A 74 -6.952 9.967 4.362 1.00 0.00 C ATOM 1160 C VAL A 74 -8.093 9.072 3.892 1.00 0.00 C ATOM 1161 O VAL A 74 -9.267 9.412 4.044 1.00 0.00 O ATOM 1162 CB VAL A 74 -7.227 10.413 5.810 1.00 0.00 C ATOM 1163 CG1 VAL A 74 -7.362 9.205 6.725 1.00 0.00 C ATOM 1164 CG2 VAL A 74 -6.126 11.342 6.299 1.00 0.00 C ATOM 0 H VAL A 74 -7.606 11.709 3.397 1.00 0.00 H new ATOM 0 HA VAL A 74 -6.018 9.405 4.334 1.00 0.00 H new ATOM 0 HB VAL A 74 -8.169 10.961 5.830 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -7.556 9.540 7.744 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -8.189 8.581 6.385 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -6.438 8.627 6.703 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -6.336 11.648 7.324 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.169 10.822 6.265 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -6.083 12.223 5.659 1.00 0.00 H new ATOM 1174 N PHE A 75 -7.742 7.925 3.319 1.00 0.00 N ATOM 1175 CA PHE A 75 -8.737 6.981 2.826 1.00 0.00 C ATOM 1176 C PHE A 75 -9.014 5.893 3.860 1.00 0.00 C ATOM 1177 O PHE A 75 -10.166 5.623 4.200 1.00 0.00 O ATOM 1178 CB PHE A 75 -8.264 6.347 1.516 1.00 0.00 C ATOM 1179 CG PHE A 75 -7.432 7.268 0.670 1.00 0.00 C ATOM 1180 CD1 PHE A 75 -6.056 7.319 0.826 1.00 0.00 C ATOM 1181 CD2 PHE A 75 -8.025 8.083 -0.280 1.00 0.00 C ATOM 1182 CE1 PHE A 75 -5.288 8.166 0.049 1.00 0.00 C ATOM 1183 CE2 PHE A 75 -7.263 8.932 -1.060 1.00 0.00 C ATOM 1184 CZ PHE A 75 -5.892 8.973 -0.895 1.00 0.00 C ATOM 0 H PHE A 75 -6.776 7.627 3.185 1.00 0.00 H new ATOM 0 HA PHE A 75 -9.662 7.528 2.644 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -7.684 5.452 1.743 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -9.133 6.026 0.942 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -5.578 6.690 1.563 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -9.096 8.055 -0.413 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -4.216 8.197 0.180 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -7.738 9.562 -1.797 1.00 0.00 H new ATOM 0 HZ PHE A 75 -5.294 9.635 -1.503 1.00 0.00 H new ATOM 1194 N ASP A 76 -7.949 5.271 4.355 1.00 0.00 N ATOM 1195 CA ASP A 76 -8.076 4.213 5.350 1.00 0.00 C ATOM 1196 C ASP A 76 -9.019 3.118 4.862 1.00 0.00 C ATOM 1197 O ASP A 76 -9.677 2.452 5.660 1.00 0.00 O ATOM 1198 CB ASP A 76 -8.582 4.787 6.674 1.00 0.00 C ATOM 1199 CG ASP A 76 -8.201 3.926 7.862 1.00 0.00 C ATOM 1200 OD1 ASP A 76 -7.053 4.048 8.340 1.00 0.00 O ATOM 1201 OD2 ASP A 76 -9.050 3.130 8.314 1.00 0.00 O ATOM 0 H ASP A 76 -6.989 5.481 4.083 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.090 3.775 5.506 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.176 5.789 6.811 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.667 4.885 6.633 1.00 0.00 H new ATOM 1206 N GLN A 77 -9.079 2.939 3.546 1.00 0.00 N ATOM 1207 CA GLN A 77 -9.944 1.926 2.952 1.00 0.00 C ATOM 1208 C GLN A 77 -9.190 0.615 2.757 1.00 0.00 C ATOM 1209 O GLN A 77 -7.960 0.593 2.724 1.00 0.00 O ATOM 1210 CB GLN A 77 -10.494 2.417 1.612 1.00 0.00 C ATOM 1211 CG GLN A 77 -11.674 3.366 1.749 1.00 0.00 C ATOM 1212 CD GLN A 77 -11.969 4.119 0.467 1.00 0.00 C ATOM 1213 OE1 GLN A 77 -12.117 5.341 0.471 1.00 0.00 O ATOM 1214 NE2 GLN A 77 -12.057 3.391 -0.640 1.00 0.00 N ATOM 0 H GLN A 77 -8.540 3.482 2.872 1.00 0.00 H new ATOM 0 HA GLN A 77 -10.776 1.748 3.634 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -9.697 2.919 1.064 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -10.798 1.556 1.016 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -12.558 2.801 2.045 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -11.470 4.080 2.547 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -11.927 2.380 -0.597 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.254 3.843 -1.533 1.00 0.00 H new ATOM 1223 N SER A 78 -9.937 -0.477 2.628 1.00 0.00 N ATOM 1224 CA SER A 78 -9.340 -1.794 2.440 1.00 0.00 C ATOM 1225 C SER A 78 -9.959 -2.505 1.240 1.00 0.00 C ATOM 1226 O SER A 78 -11.173 -2.701 1.178 1.00 0.00 O ATOM 1227 CB SER A 78 -9.519 -2.644 3.699 1.00 0.00 C ATOM 1228 OG SER A 78 -9.049 -3.965 3.494 1.00 0.00 O ATOM 0 H SER A 78 -10.957 -0.476 2.650 1.00 0.00 H new ATOM 0 HA SER A 78 -8.275 -1.659 2.251 1.00 0.00 H new ATOM 0 HB2 SER A 78 -8.980 -2.188 4.529 1.00 0.00 H new ATOM 0 HB3 SER A 78 -10.572 -2.669 3.978 1.00 0.00 H new ATOM 0 HG SER A 78 -9.173 -4.487 4.314 1.00 0.00 H new ATOM 1234 N PHE A 79 -9.115 -2.890 0.288 1.00 0.00 N ATOM 1235 CA PHE A 79 -9.577 -3.579 -0.911 1.00 0.00 C ATOM 1236 C PHE A 79 -9.233 -5.064 -0.852 1.00 0.00 C ATOM 1237 O PHE A 79 -8.562 -5.520 0.073 1.00 0.00 O ATOM 1238 CB PHE A 79 -8.956 -2.948 -2.159 1.00 0.00 C ATOM 1239 CG PHE A 79 -9.157 -1.462 -2.243 1.00 0.00 C ATOM 1240 CD1 PHE A 79 -8.400 -0.602 -1.463 1.00 0.00 C ATOM 1241 CD2 PHE A 79 -10.102 -0.925 -3.102 1.00 0.00 C ATOM 1242 CE1 PHE A 79 -8.584 0.766 -1.538 1.00 0.00 C ATOM 1243 CE2 PHE A 79 -10.290 0.442 -3.181 1.00 0.00 C ATOM 1244 CZ PHE A 79 -9.529 1.288 -2.399 1.00 0.00 C ATOM 0 H PHE A 79 -8.107 -2.736 0.324 1.00 0.00 H new ATOM 0 HA PHE A 79 -10.661 -3.478 -0.963 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -7.888 -3.163 -2.172 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.386 -3.415 -3.045 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -7.658 -1.005 -0.789 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -10.699 -1.582 -3.717 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -7.989 1.426 -0.924 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -11.031 0.848 -3.854 1.00 0.00 H new ATOM 0 HZ PHE A 79 -9.673 2.357 -2.461 1.00 0.00 H new ATOM 1254 N ASP A 80 -9.697 -5.812 -1.847 1.00 0.00 N ATOM 1255 CA ASP A 80 -9.438 -7.246 -1.910 1.00 0.00 C ATOM 1256 C ASP A 80 -9.498 -7.747 -3.350 1.00 0.00 C ATOM 1257 O ASP A 80 -10.179 -7.162 -4.193 1.00 0.00 O ATOM 1258 CB ASP A 80 -10.448 -8.007 -1.050 1.00 0.00 C ATOM 1259 CG ASP A 80 -11.797 -7.318 -0.996 1.00 0.00 C ATOM 1260 OD1 ASP A 80 -11.853 -6.160 -0.533 1.00 0.00 O ATOM 1261 OD2 ASP A 80 -12.797 -7.938 -1.415 1.00 0.00 O ATOM 0 H ASP A 80 -10.254 -5.450 -2.621 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.435 -7.426 -1.523 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -10.573 -9.014 -1.447 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -10.055 -8.110 -0.039 1.00 0.00 H new ATOM 1266 N PHE A 81 -8.781 -8.831 -3.625 1.00 0.00 N ATOM 1267 CA PHE A 81 -8.752 -9.409 -4.963 1.00 0.00 C ATOM 1268 C PHE A 81 -8.516 -10.915 -4.900 1.00 0.00 C ATOM 1269 O PHE A 81 -7.475 -11.372 -4.428 1.00 0.00 O ATOM 1270 CB PHE A 81 -7.661 -8.745 -5.805 1.00 0.00 C ATOM 1271 CG PHE A 81 -7.546 -7.265 -5.577 1.00 0.00 C ATOM 1272 CD1 PHE A 81 -8.399 -6.383 -6.221 1.00 0.00 C ATOM 1273 CD2 PHE A 81 -6.583 -6.755 -4.720 1.00 0.00 C ATOM 1274 CE1 PHE A 81 -8.296 -5.020 -6.013 1.00 0.00 C ATOM 1275 CE2 PHE A 81 -6.476 -5.393 -4.509 1.00 0.00 C ATOM 1276 CZ PHE A 81 -7.333 -4.525 -5.157 1.00 0.00 C ATOM 0 H PHE A 81 -8.212 -9.327 -2.939 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.721 -9.230 -5.430 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.703 -9.215 -5.580 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -7.866 -8.927 -6.860 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.153 -6.765 -6.893 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.909 -7.429 -4.212 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -8.968 -4.343 -6.520 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -5.723 -5.008 -3.838 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.250 -3.461 -4.994 1.00 0.00 H new ATOM 1286 N SER A 82 -9.490 -11.682 -5.380 1.00 0.00 N ATOM 1287 CA SER A 82 -9.390 -13.137 -5.375 1.00 0.00 C ATOM 1288 C SER A 82 -8.310 -13.611 -6.341 1.00 0.00 C ATOM 1289 O SER A 82 -8.571 -13.828 -7.525 1.00 0.00 O ATOM 1290 CB SER A 82 -10.736 -13.762 -5.749 1.00 0.00 C ATOM 1291 OG SER A 82 -11.224 -13.230 -6.968 1.00 0.00 O ATOM 0 H SER A 82 -10.357 -11.320 -5.777 1.00 0.00 H new ATOM 0 HA SER A 82 -9.116 -13.455 -4.369 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.626 -14.843 -5.838 1.00 0.00 H new ATOM 0 HB3 SER A 82 -11.459 -13.580 -4.954 1.00 0.00 H new ATOM 0 HG SER A 82 -10.514 -13.255 -7.643 1.00 0.00 H new ATOM 1297 N VAL A 83 -7.094 -13.770 -5.828 1.00 0.00 N ATOM 1298 CA VAL A 83 -5.972 -14.219 -6.644 1.00 0.00 C ATOM 1299 C VAL A 83 -5.045 -15.132 -5.849 1.00 0.00 C ATOM 1300 O VAL A 83 -4.704 -14.841 -4.703 1.00 0.00 O ATOM 1301 CB VAL A 83 -5.160 -13.028 -7.187 1.00 0.00 C ATOM 1302 CG1 VAL A 83 -4.784 -12.080 -6.059 1.00 0.00 C ATOM 1303 CG2 VAL A 83 -3.919 -13.519 -7.918 1.00 0.00 C ATOM 0 H VAL A 83 -6.861 -13.594 -4.851 1.00 0.00 H new ATOM 0 HA VAL A 83 -6.393 -14.774 -7.482 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.780 -12.481 -7.897 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.211 -11.245 -6.461 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.689 -11.703 -5.584 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.182 -12.612 -5.322 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.357 -12.665 -8.295 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -3.294 -14.090 -7.231 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.216 -14.155 -8.752 1.00 0.00 H new ATOM 1313 N SER A 84 -4.641 -16.238 -6.466 1.00 0.00 N ATOM 1314 CA SER A 84 -3.756 -17.196 -5.815 1.00 0.00 C ATOM 1315 C SER A 84 -2.331 -16.655 -5.738 1.00 0.00 C ATOM 1316 O SER A 84 -1.884 -15.924 -6.623 1.00 0.00 O ATOM 1317 CB SER A 84 -3.768 -18.528 -6.569 1.00 0.00 C ATOM 1318 OG SER A 84 -5.052 -18.801 -7.101 1.00 0.00 O ATOM 0 H SER A 84 -4.913 -16.492 -7.416 1.00 0.00 H new ATOM 0 HA SER A 84 -4.120 -17.358 -4.800 1.00 0.00 H new ATOM 0 HB2 SER A 84 -3.035 -18.500 -7.375 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.471 -19.333 -5.897 1.00 0.00 H new ATOM 0 HG SER A 84 -5.033 -19.656 -7.579 1.00 0.00 H new ATOM 1324 N LEU A 85 -1.624 -17.018 -4.674 1.00 0.00 N ATOM 1325 CA LEU A 85 -0.249 -16.570 -4.480 1.00 0.00 C ATOM 1326 C LEU A 85 0.593 -16.844 -5.722 1.00 0.00 C ATOM 1327 O LEU A 85 1.358 -15.996 -6.182 1.00 0.00 O ATOM 1328 CB LEU A 85 0.369 -17.266 -3.267 1.00 0.00 C ATOM 1329 CG LEU A 85 1.894 -17.379 -3.262 1.00 0.00 C ATOM 1330 CD1 LEU A 85 2.525 -16.063 -2.835 1.00 0.00 C ATOM 1331 CD2 LEU A 85 2.342 -18.509 -2.346 1.00 0.00 C ATOM 0 H LEU A 85 -1.980 -17.621 -3.932 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.265 -15.494 -4.304 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.062 -16.729 -2.370 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.050 -18.270 -3.197 1.00 0.00 H new ATOM 0 HG LEU A 85 2.226 -17.606 -4.275 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.610 -16.162 -2.837 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.231 -15.276 -3.530 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.186 -15.806 -1.831 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.430 -18.575 -2.355 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.999 -18.312 -1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.919 -19.451 -2.696 1.00 0.00 H new ATOM 1343 N PRO A 86 0.450 -18.055 -6.279 1.00 0.00 N ATOM 1344 CA PRO A 86 1.188 -18.468 -7.477 1.00 0.00 C ATOM 1345 C PRO A 86 1.131 -17.419 -8.582 1.00 0.00 C ATOM 1346 O PRO A 86 2.121 -17.179 -9.273 1.00 0.00 O ATOM 1347 CB PRO A 86 0.467 -19.746 -7.914 1.00 0.00 C ATOM 1348 CG PRO A 86 -0.137 -20.287 -6.665 1.00 0.00 C ATOM 1349 CD PRO A 86 -0.444 -19.115 -5.784 1.00 0.00 C ATOM 0 HA PRO A 86 2.250 -18.610 -7.274 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -0.296 -19.534 -8.663 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.161 -20.459 -8.359 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.043 -20.850 -6.887 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.551 -20.972 -6.169 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.491 -18.822 -5.860 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.252 -19.342 -4.735 1.00 0.00 H new ATOM 1357 N GLU A 87 -0.033 -16.798 -8.744 1.00 0.00 N ATOM 1358 CA GLU A 87 -0.217 -15.775 -9.767 1.00 0.00 C ATOM 1359 C GLU A 87 0.308 -14.425 -9.287 1.00 0.00 C ATOM 1360 O GLU A 87 1.194 -13.835 -9.905 1.00 0.00 O ATOM 1361 CB GLU A 87 -1.696 -15.656 -10.141 1.00 0.00 C ATOM 1362 CG GLU A 87 -2.185 -16.770 -11.051 1.00 0.00 C ATOM 1363 CD GLU A 87 -2.232 -18.115 -10.352 1.00 0.00 C ATOM 1364 OE1 GLU A 87 -3.180 -18.347 -9.573 1.00 0.00 O ATOM 1365 OE2 GLU A 87 -1.320 -18.936 -10.586 1.00 0.00 O ATOM 0 H GLU A 87 -0.862 -16.985 -8.180 1.00 0.00 H new ATOM 0 HA GLU A 87 0.350 -16.073 -10.649 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -2.294 -15.654 -9.229 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.862 -14.697 -10.633 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.180 -16.522 -11.421 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.530 -16.839 -11.920 1.00 0.00 H new ATOM 1372 N VAL A 88 -0.246 -13.941 -8.179 1.00 0.00 N ATOM 1373 CA VAL A 88 0.166 -12.661 -7.615 1.00 0.00 C ATOM 1374 C VAL A 88 1.681 -12.592 -7.457 1.00 0.00 C ATOM 1375 O VAL A 88 2.265 -11.509 -7.455 1.00 0.00 O ATOM 1376 CB VAL A 88 -0.494 -12.414 -6.246 1.00 0.00 C ATOM 1377 CG1 VAL A 88 0.308 -13.079 -5.138 1.00 0.00 C ATOM 1378 CG2 VAL A 88 -0.640 -10.922 -5.987 1.00 0.00 C ATOM 0 H VAL A 88 -0.981 -14.416 -7.655 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.159 -11.888 -8.312 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.490 -12.857 -6.257 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -0.174 -12.893 -4.178 1.00 0.00 H new ATOM 0 HG12 VAL A 88 0.356 -14.153 -5.318 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.317 -12.668 -5.123 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.108 -10.766 -5.015 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.344 -10.453 -5.995 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.261 -10.477 -6.765 1.00 0.00 H new ATOM 1388 N GLN A 89 2.310 -13.755 -7.325 1.00 0.00 N ATOM 1389 CA GLN A 89 3.758 -13.826 -7.165 1.00 0.00 C ATOM 1390 C GLN A 89 4.468 -13.208 -8.365 1.00 0.00 C ATOM 1391 O GLN A 89 5.393 -12.411 -8.207 1.00 0.00 O ATOM 1392 CB GLN A 89 4.202 -15.279 -6.988 1.00 0.00 C ATOM 1393 CG GLN A 89 4.175 -15.752 -5.544 1.00 0.00 C ATOM 1394 CD GLN A 89 4.398 -17.246 -5.414 1.00 0.00 C ATOM 1395 OE1 GLN A 89 4.092 -18.012 -6.328 1.00 0.00 O ATOM 1396 NE2 GLN A 89 4.933 -17.668 -4.275 1.00 0.00 N ATOM 0 H GLN A 89 1.840 -14.661 -7.326 1.00 0.00 H new ATOM 0 HA GLN A 89 4.028 -13.260 -6.274 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.556 -15.923 -7.585 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.213 -15.391 -7.380 1.00 0.00 H new ATOM 0 HG2 GLN A 89 4.942 -15.224 -4.978 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.215 -15.492 -5.099 1.00 0.00 H new ATOM 0 HE21 GLN A 89 5.171 -16.998 -3.544 1.00 0.00 H new ATOM 0 HE22 GLN A 89 5.106 -18.663 -4.131 1.00 0.00 H new ATOM 1405 N ARG A 90 4.030 -13.581 -9.563 1.00 0.00 N ATOM 1406 CA ARG A 90 4.625 -13.064 -10.789 1.00 0.00 C ATOM 1407 C ARG A 90 4.056 -11.690 -11.132 1.00 0.00 C ATOM 1408 O ARG A 90 4.606 -10.970 -11.967 1.00 0.00 O ATOM 1409 CB ARG A 90 4.381 -14.032 -11.948 1.00 0.00 C ATOM 1410 CG ARG A 90 2.912 -14.216 -12.289 1.00 0.00 C ATOM 1411 CD ARG A 90 2.731 -14.761 -13.697 1.00 0.00 C ATOM 1412 NE ARG A 90 2.802 -16.219 -13.733 1.00 0.00 N ATOM 1413 CZ ARG A 90 2.713 -16.932 -14.850 1.00 0.00 C ATOM 1414 NH1 ARG A 90 2.551 -16.325 -16.017 1.00 0.00 N ATOM 1415 NH2 ARG A 90 2.787 -18.256 -14.801 1.00 0.00 N ATOM 0 H ARG A 90 3.265 -14.239 -9.710 1.00 0.00 H new ATOM 0 HA ARG A 90 5.698 -12.964 -10.628 1.00 0.00 H new ATOM 0 HB2 ARG A 90 4.907 -13.669 -12.831 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.811 -15.002 -11.697 1.00 0.00 H new ATOM 0 HG2 ARG A 90 2.454 -14.897 -11.572 1.00 0.00 H new ATOM 0 HG3 ARG A 90 2.394 -13.261 -12.198 1.00 0.00 H new ATOM 0 HD2 ARG A 90 1.768 -14.435 -14.091 1.00 0.00 H new ATOM 0 HD3 ARG A 90 3.499 -14.345 -14.348 1.00 0.00 H new ATOM 0 HE ARG A 90 2.927 -16.717 -12.852 1.00 0.00 H new ATOM 0 HH11 ARG A 90 2.494 -15.307 -16.059 1.00 0.00 H new ATOM 0 HH12 ARG A 90 2.483 -16.875 -16.873 1.00 0.00 H new ATOM 0 HH21 ARG A 90 2.912 -18.727 -13.905 1.00 0.00 H new ATOM 0 HH22 ARG A 90 2.719 -18.803 -15.659 1.00 0.00 H new ATOM 1429 N ARG A 91 2.952 -11.333 -10.484 1.00 0.00 N ATOM 1430 CA ARG A 91 2.308 -10.047 -10.721 1.00 0.00 C ATOM 1431 C ARG A 91 2.987 -8.942 -9.918 1.00 0.00 C ATOM 1432 O ARG A 91 3.925 -9.196 -9.160 1.00 0.00 O ATOM 1433 CB ARG A 91 0.825 -10.121 -10.356 1.00 0.00 C ATOM 1434 CG ARG A 91 0.034 -11.096 -11.212 1.00 0.00 C ATOM 1435 CD ARG A 91 -1.428 -11.144 -10.796 1.00 0.00 C ATOM 1436 NE ARG A 91 -2.170 -12.173 -11.519 1.00 0.00 N ATOM 1437 CZ ARG A 91 -2.458 -12.099 -12.814 1.00 0.00 C ATOM 1438 NH1 ARG A 91 -2.068 -11.049 -13.524 1.00 0.00 N ATOM 1439 NH2 ARG A 91 -3.136 -13.076 -13.401 1.00 0.00 N ATOM 0 H ARG A 91 2.485 -11.917 -9.790 1.00 0.00 H new ATOM 0 HA ARG A 91 2.403 -9.811 -11.781 1.00 0.00 H new ATOM 0 HB2 ARG A 91 0.731 -10.411 -9.309 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.386 -9.128 -10.452 1.00 0.00 H new ATOM 0 HG2 ARG A 91 0.106 -10.803 -12.259 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.470 -12.092 -11.129 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -1.494 -11.335 -9.725 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -1.888 -10.172 -10.975 1.00 0.00 H new ATOM 0 HE ARG A 91 -2.485 -12.994 -11.001 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -1.546 -10.296 -13.076 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -2.290 -10.994 -14.518 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -3.437 -13.885 -12.858 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -3.356 -13.018 -14.395 1.00 0.00 H new ATOM 1453 N THR A 92 2.508 -7.714 -10.088 1.00 0.00 N ATOM 1454 CA THR A 92 3.069 -6.570 -9.381 1.00 0.00 C ATOM 1455 C THR A 92 1.991 -5.543 -9.053 1.00 0.00 C ATOM 1456 O THR A 92 1.072 -5.319 -9.842 1.00 0.00 O ATOM 1457 CB THR A 92 4.177 -5.888 -10.205 1.00 0.00 C ATOM 1458 OG1 THR A 92 5.011 -6.877 -10.819 1.00 0.00 O ATOM 1459 CG2 THR A 92 5.024 -4.979 -9.327 1.00 0.00 C ATOM 0 H THR A 92 1.732 -7.486 -10.710 1.00 0.00 H new ATOM 0 HA THR A 92 3.498 -6.951 -8.454 1.00 0.00 H new ATOM 0 HB THR A 92 3.703 -5.282 -10.977 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.712 -6.435 -11.342 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.800 -4.509 -9.932 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.392 -4.209 -8.884 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.488 -5.567 -8.535 1.00 0.00 H new ATOM 1467 N LEU A 93 2.109 -4.921 -7.885 1.00 0.00 N ATOM 1468 CA LEU A 93 1.143 -3.917 -7.452 1.00 0.00 C ATOM 1469 C LEU A 93 1.605 -2.516 -7.840 1.00 0.00 C ATOM 1470 O LEU A 93 2.373 -1.882 -7.117 1.00 0.00 O ATOM 1471 CB LEU A 93 0.938 -3.997 -5.938 1.00 0.00 C ATOM 1472 CG LEU A 93 -0.444 -3.588 -5.426 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -1.435 -4.729 -5.593 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -0.366 -3.156 -3.969 1.00 0.00 C ATOM 0 H LEU A 93 2.864 -5.094 -7.221 1.00 0.00 H new ATOM 0 HA LEU A 93 0.196 -4.120 -7.952 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.134 -5.021 -5.618 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.684 -3.365 -5.456 1.00 0.00 H new ATOM 0 HG LEU A 93 -0.793 -2.742 -6.017 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.412 -4.419 -5.223 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.513 -4.992 -6.648 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.091 -5.595 -5.028 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.358 -2.868 -3.621 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.005 -3.983 -3.364 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.311 -2.307 -3.877 1.00 0.00 H new ATOM 1486 N ASP A 94 1.129 -2.038 -8.985 1.00 0.00 N ATOM 1487 CA ASP A 94 1.490 -0.710 -9.468 1.00 0.00 C ATOM 1488 C ASP A 94 0.736 0.371 -8.699 1.00 0.00 C ATOM 1489 O ASP A 94 -0.441 0.625 -8.957 1.00 0.00 O ATOM 1490 CB ASP A 94 1.194 -0.590 -10.964 1.00 0.00 C ATOM 1491 CG ASP A 94 1.655 0.734 -11.541 1.00 0.00 C ATOM 1492 OD1 ASP A 94 2.079 1.608 -10.756 1.00 0.00 O ATOM 1493 OD2 ASP A 94 1.592 0.895 -12.777 1.00 0.00 O ATOM 0 H ASP A 94 0.493 -2.550 -9.596 1.00 0.00 H new ATOM 0 HA ASP A 94 2.558 -0.569 -9.305 1.00 0.00 H new ATOM 0 HB2 ASP A 94 1.685 -1.405 -11.495 1.00 0.00 H new ATOM 0 HB3 ASP A 94 0.122 -0.702 -11.130 1.00 0.00 H new ATOM 1498 N VAL A 95 1.422 1.005 -7.753 1.00 0.00 N ATOM 1499 CA VAL A 95 0.818 2.059 -6.947 1.00 0.00 C ATOM 1500 C VAL A 95 1.337 3.432 -7.359 1.00 0.00 C ATOM 1501 O VAL A 95 2.531 3.710 -7.260 1.00 0.00 O ATOM 1502 CB VAL A 95 1.094 1.846 -5.447 1.00 0.00 C ATOM 1503 CG1 VAL A 95 0.181 2.724 -4.606 1.00 0.00 C ATOM 1504 CG2 VAL A 95 0.927 0.380 -5.077 1.00 0.00 C ATOM 0 H VAL A 95 2.397 0.807 -7.526 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.257 2.014 -7.121 1.00 0.00 H new ATOM 0 HB VAL A 95 2.125 2.133 -5.241 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.391 2.560 -3.549 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.356 3.771 -4.852 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.859 2.471 -4.813 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.126 0.248 -4.013 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.092 0.063 -5.298 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.628 -0.223 -5.655 1.00 0.00 H new ATOM 1514 N ALA A 96 0.430 4.287 -7.821 1.00 0.00 N ATOM 1515 CA ALA A 96 0.796 5.632 -8.245 1.00 0.00 C ATOM 1516 C ALA A 96 -0.196 6.663 -7.718 1.00 0.00 C ATOM 1517 O ALA A 96 -1.402 6.548 -7.938 1.00 0.00 O ATOM 1518 CB ALA A 96 0.877 5.703 -9.763 1.00 0.00 C ATOM 0 H ALA A 96 -0.563 4.072 -7.911 1.00 0.00 H new ATOM 0 HA ALA A 96 1.776 5.863 -7.828 1.00 0.00 H new ATOM 0 HB1 ALA A 96 1.151 6.714 -10.066 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.630 5.000 -10.120 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.092 5.446 -10.191 1.00 0.00 H new ATOM 1524 N VAL A 97 0.318 7.671 -7.020 1.00 0.00 N ATOM 1525 CA VAL A 97 -0.523 8.722 -6.461 1.00 0.00 C ATOM 1526 C VAL A 97 -0.420 10.003 -7.283 1.00 0.00 C ATOM 1527 O VAL A 97 0.603 10.687 -7.261 1.00 0.00 O ATOM 1528 CB VAL A 97 -0.141 9.030 -5.001 1.00 0.00 C ATOM 1529 CG1 VAL A 97 -1.111 10.033 -4.396 1.00 0.00 C ATOM 1530 CG2 VAL A 97 -0.104 7.750 -4.180 1.00 0.00 C ATOM 0 H VAL A 97 1.314 7.782 -6.828 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.549 8.356 -6.490 1.00 0.00 H new ATOM 0 HB VAL A 97 0.855 9.472 -4.989 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.825 10.239 -3.364 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -1.083 10.958 -4.971 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -2.120 9.622 -4.418 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.168 7.985 -3.151 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.086 7.278 -4.197 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.634 7.068 -4.603 1.00 0.00 H new ATOM 1540 N LYS A 98 -1.488 10.322 -8.006 1.00 0.00 N ATOM 1541 CA LYS A 98 -1.520 11.522 -8.834 1.00 0.00 C ATOM 1542 C LYS A 98 -2.738 12.379 -8.503 1.00 0.00 C ATOM 1543 O LYS A 98 -3.526 12.039 -7.621 1.00 0.00 O ATOM 1544 CB LYS A 98 -1.538 11.142 -10.317 1.00 0.00 C ATOM 1545 CG LYS A 98 -0.397 10.226 -10.725 1.00 0.00 C ATOM 1546 CD LYS A 98 -0.750 8.765 -10.504 1.00 0.00 C ATOM 1547 CE LYS A 98 -1.647 8.234 -11.612 1.00 0.00 C ATOM 1548 NZ LYS A 98 -0.899 8.037 -12.884 1.00 0.00 N ATOM 0 H LYS A 98 -2.343 9.766 -8.035 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.622 12.103 -8.624 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -2.485 10.653 -10.547 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -1.495 12.051 -10.917 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -0.156 10.388 -11.776 1.00 0.00 H new ATOM 0 HG3 LYS A 98 0.495 10.477 -10.151 1.00 0.00 H new ATOM 0 HD2 LYS A 98 0.163 8.172 -10.458 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -1.252 8.652 -9.543 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -2.088 7.287 -11.300 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -2.469 8.930 -11.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -1.476 7.476 -13.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -0.689 8.962 -13.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -0.009 7.535 -12.689 1.00 0.00 H new ATOM 1562 N ASN A 99 -2.886 13.490 -9.217 1.00 0.00 N ATOM 1563 CA ASN A 99 -4.008 14.395 -8.999 1.00 0.00 C ATOM 1564 C ASN A 99 -5.022 14.287 -10.134 1.00 0.00 C ATOM 1565 O ASN A 99 -4.672 14.411 -11.307 1.00 0.00 O ATOM 1566 CB ASN A 99 -3.512 15.837 -8.879 1.00 0.00 C ATOM 1567 CG ASN A 99 -3.356 16.509 -10.230 1.00 0.00 C ATOM 1568 OD1 ASN A 99 -4.329 16.986 -10.814 1.00 0.00 O ATOM 1569 ND2 ASN A 99 -2.127 16.549 -10.732 1.00 0.00 N ATOM 0 H ASN A 99 -2.243 13.785 -9.952 1.00 0.00 H new ATOM 0 HA ASN A 99 -4.498 14.108 -8.069 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.212 16.410 -8.270 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.554 15.847 -8.359 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -1.960 16.988 -11.637 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -1.350 16.140 -10.212 1.00 0.00 H new ATOM 1576 N SER A 100 -6.281 14.056 -9.775 1.00 0.00 N ATOM 1577 CA SER A 100 -7.346 13.928 -10.763 1.00 0.00 C ATOM 1578 C SER A 100 -7.960 15.288 -11.079 1.00 0.00 C ATOM 1579 O SER A 100 -7.658 16.285 -10.425 1.00 0.00 O ATOM 1580 CB SER A 100 -8.429 12.973 -10.256 1.00 0.00 C ATOM 1581 OG SER A 100 -9.198 12.459 -11.329 1.00 0.00 O ATOM 0 H SER A 100 -6.588 13.954 -8.808 1.00 0.00 H new ATOM 0 HA SER A 100 -6.913 13.523 -11.677 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.967 12.151 -9.709 1.00 0.00 H new ATOM 0 HB3 SER A 100 -9.080 13.496 -9.555 1.00 0.00 H new ATOM 0 HG SER A 100 -9.882 11.850 -10.979 1.00 0.00 H new ATOM 1587 N GLY A 101 -8.824 15.321 -12.089 1.00 0.00 N ATOM 1588 CA GLY A 101 -9.467 16.563 -12.476 1.00 0.00 C ATOM 1589 C GLY A 101 -10.244 16.434 -13.771 1.00 0.00 C ATOM 1590 O GLY A 101 -11.464 16.592 -13.789 1.00 0.00 O ATOM 0 H GLY A 101 -9.090 14.509 -12.646 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -10.141 16.882 -11.681 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -8.712 17.341 -12.585 1.00 0.00 H new ATOM 1594 N GLY A 102 -9.536 16.148 -14.859 1.00 0.00 N ATOM 1595 CA GLY A 102 -10.185 16.005 -16.150 1.00 0.00 C ATOM 1596 C GLY A 102 -10.573 14.570 -16.448 1.00 0.00 C ATOM 1597 O GLY A 102 -9.711 13.721 -16.675 1.00 0.00 O ATOM 0 H GLY A 102 -8.525 16.013 -14.870 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -11.076 16.632 -16.177 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -9.517 16.367 -16.931 1.00 0.00 H new ATOM 1601 N PHE A 103 -11.874 14.298 -16.446 1.00 0.00 N ATOM 1602 CA PHE A 103 -12.374 12.956 -16.715 1.00 0.00 C ATOM 1603 C PHE A 103 -11.930 12.476 -18.094 1.00 0.00 C ATOM 1604 O PHE A 103 -11.296 11.428 -18.225 1.00 0.00 O ATOM 1605 CB PHE A 103 -13.901 12.929 -16.621 1.00 0.00 C ATOM 1606 CG PHE A 103 -14.564 14.089 -17.308 1.00 0.00 C ATOM 1607 CD1 PHE A 103 -14.709 15.304 -16.660 1.00 0.00 C ATOM 1608 CD2 PHE A 103 -15.043 13.963 -18.603 1.00 0.00 C ATOM 1609 CE1 PHE A 103 -15.319 16.374 -17.289 1.00 0.00 C ATOM 1610 CE2 PHE A 103 -15.652 15.029 -19.237 1.00 0.00 C ATOM 1611 CZ PHE A 103 -15.792 16.235 -18.579 1.00 0.00 C ATOM 0 H PHE A 103 -12.601 14.990 -16.261 1.00 0.00 H new ATOM 0 HA PHE A 103 -11.959 12.284 -15.964 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -14.268 12.000 -17.058 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -14.192 12.924 -15.571 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -14.341 15.418 -15.651 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -14.939 13.021 -19.122 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -15.425 17.316 -16.772 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -16.018 14.919 -20.247 1.00 0.00 H new ATOM 0 HZ PHE A 103 -16.271 17.068 -19.072 1.00 0.00 H new ATOM 1621 N LEU A 104 -12.267 13.250 -19.120 1.00 0.00 N ATOM 1622 CA LEU A 104 -11.904 12.906 -20.490 1.00 0.00 C ATOM 1623 C LEU A 104 -10.606 13.594 -20.899 1.00 0.00 C ATOM 1624 O LEU A 104 -10.622 14.696 -21.447 1.00 0.00 O ATOM 1625 CB LEU A 104 -13.028 13.299 -21.451 1.00 0.00 C ATOM 1626 CG LEU A 104 -13.168 12.440 -22.707 1.00 0.00 C ATOM 1627 CD1 LEU A 104 -11.911 12.531 -23.559 1.00 0.00 C ATOM 1628 CD2 LEU A 104 -13.458 10.993 -22.335 1.00 0.00 C ATOM 0 H LEU A 104 -12.791 14.120 -19.029 1.00 0.00 H new ATOM 0 HA LEU A 104 -11.753 11.828 -20.539 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -13.972 13.268 -20.907 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -12.871 14.333 -21.758 1.00 0.00 H new ATOM 0 HG LEU A 104 -14.007 12.819 -23.291 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -12.029 11.913 -24.449 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -11.747 13.567 -23.856 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -11.055 12.179 -22.983 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -13.554 10.396 -23.242 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -12.641 10.602 -21.729 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -14.387 10.943 -21.767 1.00 0.00 H new ATOM 1640 N SER A 105 -9.483 12.936 -20.630 1.00 0.00 N ATOM 1641 CA SER A 105 -8.175 13.486 -20.969 1.00 0.00 C ATOM 1642 C SER A 105 -7.084 12.431 -20.808 1.00 0.00 C ATOM 1643 O SER A 105 -7.360 11.285 -20.450 1.00 0.00 O ATOM 1644 CB SER A 105 -7.863 14.696 -20.087 1.00 0.00 C ATOM 1645 OG SER A 105 -7.882 14.346 -18.714 1.00 0.00 O ATOM 0 H SER A 105 -9.452 12.022 -20.179 1.00 0.00 H new ATOM 0 HA SER A 105 -8.200 13.802 -22.012 1.00 0.00 H new ATOM 0 HB2 SER A 105 -6.884 15.098 -20.349 1.00 0.00 H new ATOM 0 HB3 SER A 105 -8.592 15.484 -20.275 1.00 0.00 H new ATOM 0 HG SER A 105 -8.806 14.188 -18.429 1.00 0.00 H new ATOM 1651 N LYS A 106 -5.844 12.826 -21.076 1.00 0.00 N ATOM 1652 CA LYS A 106 -4.710 11.917 -20.961 1.00 0.00 C ATOM 1653 C LYS A 106 -3.885 12.231 -19.717 1.00 0.00 C ATOM 1654 O LYS A 106 -2.981 13.065 -19.754 1.00 0.00 O ATOM 1655 CB LYS A 106 -3.827 12.010 -22.208 1.00 0.00 C ATOM 1656 CG LYS A 106 -3.239 13.392 -22.435 1.00 0.00 C ATOM 1657 CD LYS A 106 -3.021 13.669 -23.913 1.00 0.00 C ATOM 1658 CE LYS A 106 -4.247 14.309 -24.546 1.00 0.00 C ATOM 1659 NZ LYS A 106 -4.401 15.734 -24.142 1.00 0.00 N ATOM 0 H LYS A 106 -5.599 13.770 -21.374 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.097 10.902 -20.872 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.015 11.288 -22.122 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -4.415 11.726 -23.081 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -3.907 14.146 -22.017 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -2.291 13.477 -21.904 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -2.160 14.326 -24.038 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -2.788 12.737 -24.429 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -4.170 14.246 -25.631 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -5.138 13.751 -24.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -5.093 16.198 -24.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -4.734 15.782 -23.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -3.484 16.218 -24.221 1.00 0.00 H new ATOM 1673 N ASP A 107 -4.203 11.557 -18.617 1.00 0.00 N ATOM 1674 CA ASP A 107 -3.489 11.762 -17.362 1.00 0.00 C ATOM 1675 C ASP A 107 -1.983 11.620 -17.563 1.00 0.00 C ATOM 1676 O ASP A 107 -1.473 10.515 -17.748 1.00 0.00 O ATOM 1677 CB ASP A 107 -3.972 10.765 -16.307 1.00 0.00 C ATOM 1678 CG ASP A 107 -5.458 10.485 -16.413 1.00 0.00 C ATOM 1679 OD1 ASP A 107 -5.839 9.600 -17.206 1.00 0.00 O ATOM 1680 OD2 ASP A 107 -6.240 11.152 -15.702 1.00 0.00 O ATOM 0 H ASP A 107 -4.950 10.864 -18.569 1.00 0.00 H new ATOM 0 HA ASP A 107 -3.697 12.775 -17.016 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -3.421 9.831 -16.415 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -3.748 11.155 -15.314 1.00 0.00 H new ATOM 1685 N LYS A 108 -1.278 12.745 -17.527 1.00 0.00 N ATOM 1686 CA LYS A 108 0.169 12.747 -17.705 1.00 0.00 C ATOM 1687 C LYS A 108 0.869 13.296 -16.466 1.00 0.00 C ATOM 1688 O LYS A 108 1.949 12.836 -16.096 1.00 0.00 O ATOM 1689 CB LYS A 108 0.552 13.580 -18.930 1.00 0.00 C ATOM 1690 CG LYS A 108 0.375 12.843 -20.246 1.00 0.00 C ATOM 1691 CD LYS A 108 1.526 11.887 -20.509 1.00 0.00 C ATOM 1692 CE LYS A 108 2.794 12.634 -20.895 1.00 0.00 C ATOM 1693 NZ LYS A 108 3.838 11.716 -21.429 1.00 0.00 N ATOM 0 H LYS A 108 -1.685 13.668 -17.376 1.00 0.00 H new ATOM 0 HA LYS A 108 0.492 11.717 -17.858 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.053 14.486 -18.946 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.592 13.893 -18.835 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.563 12.288 -20.230 1.00 0.00 H new ATOM 0 HG3 LYS A 108 0.306 13.563 -21.061 1.00 0.00 H new ATOM 0 HD2 LYS A 108 1.713 11.287 -19.618 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.252 11.197 -21.307 1.00 0.00 H new ATOM 0 HE2 LYS A 108 2.557 13.389 -21.644 1.00 0.00 H new ATOM 0 HE3 LYS A 108 3.185 13.161 -20.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 4.686 12.263 -21.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 4.083 11.011 -20.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 3.475 11.232 -22.275 1.00 0.00 H new ATOM 1707 N GLY A 109 0.246 14.281 -15.827 1.00 0.00 N ATOM 1708 CA GLY A 109 0.823 14.875 -14.635 1.00 0.00 C ATOM 1709 C GLY A 109 0.961 13.880 -13.500 1.00 0.00 C ATOM 1710 O GLY A 109 0.032 13.690 -12.714 1.00 0.00 O ATOM 0 H GLY A 109 -0.649 14.679 -16.114 1.00 0.00 H new ATOM 0 HA2 GLY A 109 1.804 15.285 -14.876 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.200 15.708 -14.310 1.00 0.00 H new ATOM 1714 N LEU A 110 2.123 13.241 -13.414 1.00 0.00 N ATOM 1715 CA LEU A 110 2.379 12.257 -12.367 1.00 0.00 C ATOM 1716 C LEU A 110 3.174 12.876 -11.222 1.00 0.00 C ATOM 1717 O LEU A 110 4.259 13.421 -11.429 1.00 0.00 O ATOM 1718 CB LEU A 110 3.137 11.059 -12.941 1.00 0.00 C ATOM 1719 CG LEU A 110 3.853 10.169 -11.925 1.00 0.00 C ATOM 1720 CD1 LEU A 110 2.868 9.227 -11.251 1.00 0.00 C ATOM 1721 CD2 LEU A 110 4.970 9.384 -12.597 1.00 0.00 C ATOM 0 H LEU A 110 2.902 13.386 -14.056 1.00 0.00 H new ATOM 0 HA LEU A 110 1.419 11.918 -11.977 1.00 0.00 H new ATOM 0 HB2 LEU A 110 2.433 10.443 -13.501 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.874 11.428 -13.654 1.00 0.00 H new ATOM 0 HG LEU A 110 4.294 10.808 -11.160 1.00 0.00 H new ATOM 0 HD11 LEU A 110 3.397 8.602 -10.531 1.00 0.00 H new ATOM 0 HD12 LEU A 110 2.104 9.808 -10.735 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.396 8.595 -12.003 1.00 0.00 H new ATOM 0 HD21 LEU A 110 5.469 8.756 -11.859 1.00 0.00 H new ATOM 0 HD22 LEU A 110 4.551 8.756 -13.384 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.691 10.077 -13.031 1.00 0.00 H new ATOM 1733 N LEU A 111 2.629 12.786 -10.014 1.00 0.00 N ATOM 1734 CA LEU A 111 3.289 13.335 -8.834 1.00 0.00 C ATOM 1735 C LEU A 111 4.321 12.356 -8.283 1.00 0.00 C ATOM 1736 O LEU A 111 5.438 12.742 -7.944 1.00 0.00 O ATOM 1737 CB LEU A 111 2.256 13.666 -7.756 1.00 0.00 C ATOM 1738 CG LEU A 111 1.187 14.689 -8.142 1.00 0.00 C ATOM 1739 CD1 LEU A 111 0.177 14.856 -7.017 1.00 0.00 C ATOM 1740 CD2 LEU A 111 1.828 16.025 -8.488 1.00 0.00 C ATOM 0 H LEU A 111 1.732 12.338 -9.826 1.00 0.00 H new ATOM 0 HA LEU A 111 3.804 14.250 -9.128 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.757 12.742 -7.463 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.784 14.036 -6.877 1.00 0.00 H new ATOM 0 HG LEU A 111 0.661 14.322 -9.023 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.576 15.588 -7.310 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.305 13.899 -6.816 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.688 15.201 -6.118 1.00 0.00 H new ATOM 0 HD21 LEU A 111 1.053 16.741 -8.760 1.00 0.00 H new ATOM 0 HD22 LEU A 111 2.380 16.398 -7.625 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.512 15.894 -9.327 1.00 0.00 H new ATOM 1752 N GLY A 112 3.938 11.086 -8.198 1.00 0.00 N ATOM 1753 CA GLY A 112 4.842 10.071 -7.689 1.00 0.00 C ATOM 1754 C GLY A 112 4.243 8.680 -7.745 1.00 0.00 C ATOM 1755 O GLY A 112 3.032 8.510 -7.601 1.00 0.00 O ATOM 0 H GLY A 112 3.018 10.742 -8.472 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.766 10.089 -8.267 1.00 0.00 H new ATOM 0 HA3 GLY A 112 5.106 10.308 -6.658 1.00 0.00 H new ATOM 1759 N LYS A 113 5.092 7.680 -7.957 1.00 0.00 N ATOM 1760 CA LYS A 113 4.640 6.295 -8.033 1.00 0.00 C ATOM 1761 C LYS A 113 5.692 5.348 -7.464 1.00 0.00 C ATOM 1762 O LYS A 113 6.887 5.642 -7.494 1.00 0.00 O ATOM 1763 CB LYS A 113 4.329 5.917 -9.483 1.00 0.00 C ATOM 1764 CG LYS A 113 5.560 5.851 -10.372 1.00 0.00 C ATOM 1765 CD LYS A 113 5.192 5.522 -11.809 1.00 0.00 C ATOM 1766 CE LYS A 113 5.071 4.022 -12.024 1.00 0.00 C ATOM 1767 NZ LYS A 113 4.543 3.696 -13.378 1.00 0.00 N ATOM 0 H LYS A 113 6.097 7.803 -8.079 1.00 0.00 H new ATOM 0 HA LYS A 113 3.732 6.202 -7.437 1.00 0.00 H new ATOM 0 HB2 LYS A 113 3.828 4.949 -9.498 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.630 6.644 -9.897 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.085 6.805 -10.339 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.247 5.096 -9.989 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.248 6.004 -12.063 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.948 5.927 -12.481 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.048 3.557 -11.894 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.412 3.598 -11.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 4.475 2.664 -13.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 3.600 4.119 -13.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 5.185 4.078 -14.102 1.00 0.00 H new ATOM 1781 N VAL A 114 5.240 4.210 -6.948 1.00 0.00 N ATOM 1782 CA VAL A 114 6.142 3.219 -6.375 1.00 0.00 C ATOM 1783 C VAL A 114 5.645 1.803 -6.643 1.00 0.00 C ATOM 1784 O VAL A 114 4.494 1.472 -6.355 1.00 0.00 O ATOM 1785 CB VAL A 114 6.301 3.416 -4.855 1.00 0.00 C ATOM 1786 CG1 VAL A 114 4.953 3.302 -4.158 1.00 0.00 C ATOM 1787 CG2 VAL A 114 7.290 2.409 -4.288 1.00 0.00 C ATOM 0 H VAL A 114 4.254 3.951 -6.915 1.00 0.00 H new ATOM 0 HA VAL A 114 7.111 3.358 -6.855 1.00 0.00 H new ATOM 0 HB VAL A 114 6.693 4.417 -4.675 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.085 3.444 -3.085 1.00 0.00 H new ATOM 0 HG12 VAL A 114 4.278 4.065 -4.545 1.00 0.00 H new ATOM 0 HG13 VAL A 114 4.529 2.315 -4.344 1.00 0.00 H new ATOM 0 HG21 VAL A 114 7.390 2.563 -3.214 1.00 0.00 H new ATOM 0 HG22 VAL A 114 6.929 1.398 -4.478 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.260 2.544 -4.766 1.00 0.00 H new ATOM 1797 N LEU A 115 6.519 0.969 -7.196 1.00 0.00 N ATOM 1798 CA LEU A 115 6.170 -0.413 -7.503 1.00 0.00 C ATOM 1799 C LEU A 115 6.471 -1.327 -6.320 1.00 0.00 C ATOM 1800 O LEU A 115 7.347 -1.037 -5.505 1.00 0.00 O ATOM 1801 CB LEU A 115 6.935 -0.891 -8.738 1.00 0.00 C ATOM 1802 CG LEU A 115 6.552 -0.229 -10.063 1.00 0.00 C ATOM 1803 CD1 LEU A 115 5.066 -0.399 -10.334 1.00 0.00 C ATOM 1804 CD2 LEU A 115 6.929 1.245 -10.050 1.00 0.00 C ATOM 0 H LEU A 115 7.475 1.226 -7.441 1.00 0.00 H new ATOM 0 HA LEU A 115 5.100 -0.454 -7.707 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.999 -0.727 -8.567 1.00 0.00 H new ATOM 0 HB3 LEU A 115 6.790 -1.967 -8.837 1.00 0.00 H new ATOM 0 HG LEU A 115 7.105 -0.718 -10.865 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.812 0.078 -11.280 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.825 -1.461 -10.387 1.00 0.00 H new ATOM 0 HD13 LEU A 115 4.494 0.064 -9.529 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.650 1.700 -11.000 1.00 0.00 H new ATOM 0 HD22 LEU A 115 6.404 1.748 -9.238 1.00 0.00 H new ATOM 0 HD23 LEU A 115 8.004 1.344 -9.903 1.00 0.00 H new ATOM 1816 N VAL A 116 5.740 -2.434 -6.232 1.00 0.00 N ATOM 1817 CA VAL A 116 5.931 -3.392 -5.150 1.00 0.00 C ATOM 1818 C VAL A 116 5.905 -4.824 -5.673 1.00 0.00 C ATOM 1819 O VAL A 116 5.015 -5.202 -6.434 1.00 0.00 O ATOM 1820 CB VAL A 116 4.850 -3.235 -4.064 1.00 0.00 C ATOM 1821 CG1 VAL A 116 5.096 -4.208 -2.920 1.00 0.00 C ATOM 1822 CG2 VAL A 116 4.810 -1.802 -3.556 1.00 0.00 C ATOM 0 H VAL A 116 5.010 -2.689 -6.897 1.00 0.00 H new ATOM 0 HA VAL A 116 6.908 -3.185 -4.713 1.00 0.00 H new ATOM 0 HB VAL A 116 3.881 -3.468 -4.505 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.322 -4.082 -2.163 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.070 -5.230 -3.299 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.072 -4.010 -2.478 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.041 -1.709 -2.789 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.779 -1.539 -3.132 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.582 -1.129 -4.383 1.00 0.00 H new ATOM 1832 N ALA A 117 6.889 -5.617 -5.261 1.00 0.00 N ATOM 1833 CA ALA A 117 6.978 -7.008 -5.686 1.00 0.00 C ATOM 1834 C ALA A 117 6.266 -7.930 -4.702 1.00 0.00 C ATOM 1835 O ALA A 117 6.662 -8.041 -3.541 1.00 0.00 O ATOM 1836 CB ALA A 117 8.435 -7.421 -5.839 1.00 0.00 C ATOM 0 H ALA A 117 7.636 -5.319 -4.633 1.00 0.00 H new ATOM 0 HA ALA A 117 6.482 -7.099 -6.652 1.00 0.00 H new ATOM 0 HB1 ALA A 117 8.487 -8.462 -6.157 1.00 0.00 H new ATOM 0 HB2 ALA A 117 8.916 -6.789 -6.586 1.00 0.00 H new ATOM 0 HB3 ALA A 117 8.948 -7.307 -4.884 1.00 0.00 H new ATOM 1842 N LEU A 118 5.213 -8.588 -5.172 1.00 0.00 N ATOM 1843 CA LEU A 118 4.444 -9.501 -4.332 1.00 0.00 C ATOM 1844 C LEU A 118 4.948 -10.932 -4.480 1.00 0.00 C ATOM 1845 O LEU A 118 4.222 -11.888 -4.210 1.00 0.00 O ATOM 1846 CB LEU A 118 2.959 -9.431 -4.696 1.00 0.00 C ATOM 1847 CG LEU A 118 2.422 -8.047 -5.059 1.00 0.00 C ATOM 1848 CD1 LEU A 118 0.926 -8.109 -5.328 1.00 0.00 C ATOM 1849 CD2 LEU A 118 2.726 -7.048 -3.952 1.00 0.00 C ATOM 0 H LEU A 118 4.871 -8.507 -6.130 1.00 0.00 H new ATOM 0 HA LEU A 118 4.573 -9.196 -3.294 1.00 0.00 H new ATOM 0 HB2 LEU A 118 2.780 -10.100 -5.537 1.00 0.00 H new ATOM 0 HB3 LEU A 118 2.381 -9.814 -3.855 1.00 0.00 H new ATOM 0 HG LEU A 118 2.921 -7.712 -5.969 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.561 -7.115 -5.585 1.00 0.00 H new ATOM 0 HD12 LEU A 118 0.733 -8.791 -6.156 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.410 -8.466 -4.436 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.336 -6.068 -4.229 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.256 -7.377 -3.025 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.804 -6.982 -3.808 1.00 0.00 H new ATOM 1861 N ALA A 119 6.199 -11.072 -4.907 1.00 0.00 N ATOM 1862 CA ALA A 119 6.803 -12.387 -5.086 1.00 0.00 C ATOM 1863 C ALA A 119 7.510 -12.844 -3.815 1.00 0.00 C ATOM 1864 O ALA A 119 8.439 -13.650 -3.865 1.00 0.00 O ATOM 1865 CB ALA A 119 7.776 -12.366 -6.255 1.00 0.00 C ATOM 0 H ALA A 119 6.814 -10.291 -5.135 1.00 0.00 H new ATOM 0 HA ALA A 119 6.007 -13.099 -5.303 1.00 0.00 H new ATOM 0 HB1 ALA A 119 8.219 -13.354 -6.377 1.00 0.00 H new ATOM 0 HB2 ALA A 119 7.244 -12.092 -7.166 1.00 0.00 H new ATOM 0 HB3 ALA A 119 8.563 -11.637 -6.061 1.00 0.00 H new ATOM 1871 N SER A 120 7.066 -12.323 -2.676 1.00 0.00 N ATOM 1872 CA SER A 120 7.660 -12.674 -1.391 1.00 0.00 C ATOM 1873 C SER A 120 6.994 -13.915 -0.805 1.00 0.00 C ATOM 1874 O SER A 120 6.091 -14.491 -1.411 1.00 0.00 O ATOM 1875 CB SER A 120 7.537 -11.505 -0.412 1.00 0.00 C ATOM 1876 OG SER A 120 8.524 -10.520 -0.666 1.00 0.00 O ATOM 0 H SER A 120 6.297 -11.656 -2.617 1.00 0.00 H new ATOM 0 HA SER A 120 8.715 -12.892 -1.554 1.00 0.00 H new ATOM 0 HB2 SER A 120 6.545 -11.060 -0.495 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.638 -11.870 0.610 1.00 0.00 H new ATOM 0 HG SER A 120 8.423 -9.783 -0.028 1.00 0.00 H new ATOM 1882 N GLU A 121 7.447 -14.321 0.377 1.00 0.00 N ATOM 1883 CA GLU A 121 6.896 -15.494 1.044 1.00 0.00 C ATOM 1884 C GLU A 121 6.282 -15.117 2.389 1.00 0.00 C ATOM 1885 O GLU A 121 5.602 -15.925 3.020 1.00 0.00 O ATOM 1886 CB GLU A 121 7.983 -16.551 1.246 1.00 0.00 C ATOM 1887 CG GLU A 121 8.290 -17.355 -0.006 1.00 0.00 C ATOM 1888 CD GLU A 121 9.495 -18.261 0.163 1.00 0.00 C ATOM 1889 OE1 GLU A 121 9.407 -19.221 0.958 1.00 0.00 O ATOM 1890 OE2 GLU A 121 10.524 -18.011 -0.498 1.00 0.00 O ATOM 0 H GLU A 121 8.194 -13.855 0.892 1.00 0.00 H new ATOM 0 HA GLU A 121 6.112 -15.906 0.409 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.896 -16.061 1.586 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.673 -17.232 2.038 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.421 -17.958 -0.268 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.467 -16.673 -0.837 1.00 0.00 H new ATOM 1897 N GLU A 122 6.528 -13.883 2.820 1.00 0.00 N ATOM 1898 CA GLU A 122 6.000 -13.399 4.090 1.00 0.00 C ATOM 1899 C GLU A 122 4.728 -12.584 3.876 1.00 0.00 C ATOM 1900 O GLU A 122 4.579 -11.490 4.422 1.00 0.00 O ATOM 1901 CB GLU A 122 7.048 -12.550 4.813 1.00 0.00 C ATOM 1902 CG GLU A 122 8.184 -13.362 5.411 1.00 0.00 C ATOM 1903 CD GLU A 122 8.881 -12.642 6.548 1.00 0.00 C ATOM 1904 OE1 GLU A 122 8.331 -12.631 7.669 1.00 0.00 O ATOM 1905 OE2 GLU A 122 9.976 -12.088 6.317 1.00 0.00 O ATOM 0 H GLU A 122 7.089 -13.202 2.309 1.00 0.00 H new ATOM 0 HA GLU A 122 5.756 -14.265 4.706 1.00 0.00 H new ATOM 0 HB2 GLU A 122 7.461 -11.824 4.112 1.00 0.00 H new ATOM 0 HB3 GLU A 122 6.560 -11.985 5.607 1.00 0.00 H new ATOM 0 HG2 GLU A 122 7.794 -14.313 5.773 1.00 0.00 H new ATOM 0 HG3 GLU A 122 8.911 -13.592 4.632 1.00 0.00 H new ATOM 1912 N LEU A 123 3.814 -13.125 3.079 1.00 0.00 N ATOM 1913 CA LEU A 123 2.553 -12.449 2.791 1.00 0.00 C ATOM 1914 C LEU A 123 1.471 -12.871 3.779 1.00 0.00 C ATOM 1915 O LEU A 123 0.888 -12.036 4.471 1.00 0.00 O ATOM 1916 CB LEU A 123 2.102 -12.755 1.362 1.00 0.00 C ATOM 1917 CG LEU A 123 2.659 -11.839 0.271 1.00 0.00 C ATOM 1918 CD1 LEU A 123 2.346 -12.399 -1.108 1.00 0.00 C ATOM 1919 CD2 LEU A 123 2.098 -10.433 0.418 1.00 0.00 C ATOM 0 H LEU A 123 3.922 -14.030 2.620 1.00 0.00 H new ATOM 0 HA LEU A 123 2.713 -11.376 2.893 1.00 0.00 H new ATOM 0 HB2 LEU A 123 2.384 -13.781 1.125 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.014 -12.707 1.328 1.00 0.00 H new ATOM 0 HG LEU A 123 3.742 -11.790 0.383 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.750 -11.734 -1.871 1.00 0.00 H new ATOM 0 HD12 LEU A 123 2.797 -13.386 -1.211 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.266 -12.479 -1.232 1.00 0.00 H new ATOM 0 HD21 LEU A 123 2.505 -9.795 -0.366 1.00 0.00 H new ATOM 0 HD22 LEU A 123 1.012 -10.464 0.333 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.375 -10.031 1.393 1.00 0.00 H new ATOM 1931 N ALA A 124 1.209 -14.172 3.842 1.00 0.00 N ATOM 1932 CA ALA A 124 0.200 -14.706 4.749 1.00 0.00 C ATOM 1933 C ALA A 124 0.145 -13.901 6.043 1.00 0.00 C ATOM 1934 O ALA A 124 -0.928 -13.686 6.608 1.00 0.00 O ATOM 1935 CB ALA A 124 0.481 -16.171 5.048 1.00 0.00 C ATOM 0 H ALA A 124 1.682 -14.876 3.275 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.771 -14.627 4.260 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -0.280 -16.556 5.726 1.00 0.00 H new ATOM 0 HB2 ALA A 124 0.462 -16.742 4.120 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.462 -16.266 5.513 1.00 0.00 H new ATOM 1941 N LYS A 125 1.307 -13.457 6.509 1.00 0.00 N ATOM 1942 CA LYS A 125 1.392 -12.675 7.736 1.00 0.00 C ATOM 1943 C LYS A 125 1.037 -11.214 7.476 1.00 0.00 C ATOM 1944 O LYS A 125 0.213 -10.631 8.179 1.00 0.00 O ATOM 1945 CB LYS A 125 2.799 -12.771 8.330 1.00 0.00 C ATOM 1946 CG LYS A 125 3.121 -14.136 8.914 1.00 0.00 C ATOM 1947 CD LYS A 125 3.741 -15.054 7.874 1.00 0.00 C ATOM 1948 CE LYS A 125 4.419 -16.252 8.522 1.00 0.00 C ATOM 1949 NZ LYS A 125 5.791 -15.922 8.999 1.00 0.00 N ATOM 0 H LYS A 125 2.204 -13.626 6.054 1.00 0.00 H new ATOM 0 HA LYS A 125 0.675 -13.084 8.448 1.00 0.00 H new ATOM 0 HB2 LYS A 125 3.528 -12.536 7.555 1.00 0.00 H new ATOM 0 HB3 LYS A 125 2.907 -12.017 9.109 1.00 0.00 H new ATOM 0 HG2 LYS A 125 3.806 -14.021 9.754 1.00 0.00 H new ATOM 0 HG3 LYS A 125 2.210 -14.590 9.305 1.00 0.00 H new ATOM 0 HD2 LYS A 125 2.970 -15.399 7.186 1.00 0.00 H new ATOM 0 HD3 LYS A 125 4.469 -14.498 7.284 1.00 0.00 H new ATOM 0 HE2 LYS A 125 3.817 -16.600 9.361 1.00 0.00 H new ATOM 0 HE3 LYS A 125 4.471 -17.072 7.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 6.219 -16.764 9.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 6.374 -15.614 8.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 5.740 -15.157 9.702 1.00 0.00 H new ATOM 1963 N GLY A 126 1.665 -10.629 6.461 1.00 0.00 N ATOM 1964 CA GLY A 126 1.401 -9.242 6.126 1.00 0.00 C ATOM 1965 C GLY A 126 2.424 -8.296 6.724 1.00 0.00 C ATOM 1966 O GLY A 126 2.994 -8.574 7.779 1.00 0.00 O ATOM 0 H GLY A 126 2.352 -11.091 5.865 1.00 0.00 H new ATOM 0 HA2 GLY A 126 1.395 -9.128 5.042 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.407 -8.969 6.480 1.00 0.00 H new ATOM 1970 N TRP A 127 2.658 -7.177 6.048 1.00 0.00 N ATOM 1971 CA TRP A 127 3.621 -6.187 6.518 1.00 0.00 C ATOM 1972 C TRP A 127 3.143 -4.773 6.210 1.00 0.00 C ATOM 1973 O TRP A 127 2.227 -4.576 5.410 1.00 0.00 O ATOM 1974 CB TRP A 127 4.987 -6.429 5.875 1.00 0.00 C ATOM 1975 CG TRP A 127 5.015 -6.123 4.408 1.00 0.00 C ATOM 1976 CD1 TRP A 127 5.178 -4.896 3.830 1.00 0.00 C ATOM 1977 CD2 TRP A 127 4.874 -7.059 3.334 1.00 0.00 C ATOM 1978 NE1 TRP A 127 5.147 -5.013 2.461 1.00 0.00 N ATOM 1979 CE2 TRP A 127 4.963 -6.330 2.132 1.00 0.00 C ATOM 1980 CE3 TRP A 127 4.684 -8.442 3.271 1.00 0.00 C ATOM 1981 CZ2 TRP A 127 4.866 -6.940 0.883 1.00 0.00 C ATOM 1982 CZ3 TRP A 127 4.588 -9.045 2.031 1.00 0.00 C ATOM 1983 CH2 TRP A 127 4.680 -8.295 0.851 1.00 0.00 C ATOM 0 H TRP A 127 2.194 -6.932 5.173 1.00 0.00 H new ATOM 0 HA TRP A 127 3.713 -6.291 7.599 1.00 0.00 H new ATOM 0 HB2 TRP A 127 5.733 -5.816 6.381 1.00 0.00 H new ATOM 0 HB3 TRP A 127 5.273 -7.470 6.027 1.00 0.00 H new ATOM 0 HD1 TRP A 127 5.312 -3.970 4.370 1.00 0.00 H new ATOM 0 HE1 TRP A 127 5.245 -4.244 1.798 1.00 0.00 H new ATOM 0 HE3 TRP A 127 4.613 -9.029 4.175 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 4.935 -6.364 -0.028 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 4.439 -10.113 1.971 1.00 0.00 H new ATOM 0 HH2 TRP A 127 4.603 -8.796 -0.102 1.00 0.00 H new ATOM 1994 N THR A 128 3.767 -3.789 6.849 1.00 0.00 N ATOM 1995 CA THR A 128 3.405 -2.392 6.643 1.00 0.00 C ATOM 1996 C THR A 128 4.643 -1.505 6.593 1.00 0.00 C ATOM 1997 O THR A 128 5.450 -1.496 7.522 1.00 0.00 O ATOM 1998 CB THR A 128 2.469 -1.885 7.757 1.00 0.00 C ATOM 1999 OG1 THR A 128 1.282 -2.685 7.801 1.00 0.00 O ATOM 2000 CG2 THR A 128 2.096 -0.428 7.528 1.00 0.00 C ATOM 0 H THR A 128 4.526 -3.934 7.514 1.00 0.00 H new ATOM 0 HA THR A 128 2.884 -2.338 5.687 1.00 0.00 H new ATOM 0 HB THR A 128 2.996 -1.964 8.708 1.00 0.00 H new ATOM 0 HG1 THR A 128 0.693 -2.358 8.513 1.00 0.00 H new ATOM 0 HG21 THR A 128 1.435 -0.092 8.327 1.00 0.00 H new ATOM 0 HG22 THR A 128 2.999 0.182 7.523 1.00 0.00 H new ATOM 0 HG23 THR A 128 1.586 -0.329 6.569 1.00 0.00 H new ATOM 2008 N GLN A 129 4.786 -0.759 5.502 1.00 0.00 N ATOM 2009 CA GLN A 129 5.927 0.133 5.331 1.00 0.00 C ATOM 2010 C GLN A 129 5.561 1.323 4.450 1.00 0.00 C ATOM 2011 O GLN A 129 4.614 1.258 3.666 1.00 0.00 O ATOM 2012 CB GLN A 129 7.107 -0.625 4.721 1.00 0.00 C ATOM 2013 CG GLN A 129 6.953 -0.894 3.232 1.00 0.00 C ATOM 2014 CD GLN A 129 8.253 -1.318 2.578 1.00 0.00 C ATOM 2015 OE1 GLN A 129 9.072 -0.481 2.198 1.00 0.00 O ATOM 2016 NE2 GLN A 129 8.450 -2.625 2.444 1.00 0.00 N ATOM 0 H GLN A 129 4.127 -0.755 4.724 1.00 0.00 H new ATOM 0 HA GLN A 129 6.214 0.507 6.314 1.00 0.00 H new ATOM 0 HB2 GLN A 129 8.020 -0.053 4.886 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.227 -1.574 5.243 1.00 0.00 H new ATOM 0 HG2 GLN A 129 6.205 -1.673 3.083 1.00 0.00 H new ATOM 0 HG3 GLN A 129 6.580 0.005 2.741 1.00 0.00 H new ATOM 0 HE21 GLN A 129 7.744 -3.284 2.773 1.00 0.00 H new ATOM 0 HE22 GLN A 129 9.307 -2.970 2.012 1.00 0.00 H new ATOM 2025 N TRP A 130 6.317 2.406 4.584 1.00 0.00 N ATOM 2026 CA TRP A 130 6.071 3.611 3.799 1.00 0.00 C ATOM 2027 C TRP A 130 6.890 3.600 2.513 1.00 0.00 C ATOM 2028 O TRP A 130 8.115 3.717 2.545 1.00 0.00 O ATOM 2029 CB TRP A 130 6.407 4.857 4.621 1.00 0.00 C ATOM 2030 CG TRP A 130 5.324 5.243 5.583 1.00 0.00 C ATOM 2031 CD1 TRP A 130 5.169 4.798 6.865 1.00 0.00 C ATOM 2032 CD2 TRP A 130 4.246 6.153 5.339 1.00 0.00 C ATOM 2033 NE1 TRP A 130 4.059 5.375 7.432 1.00 0.00 N ATOM 2034 CE2 TRP A 130 3.475 6.211 6.517 1.00 0.00 C ATOM 2035 CE3 TRP A 130 3.857 6.925 4.241 1.00 0.00 C ATOM 2036 CZ2 TRP A 130 2.340 7.010 6.624 1.00 0.00 C ATOM 2037 CZ3 TRP A 130 2.730 7.717 4.349 1.00 0.00 C ATOM 2038 CH2 TRP A 130 1.982 7.755 5.534 1.00 0.00 C ATOM 0 H TRP A 130 7.105 2.475 5.228 1.00 0.00 H new ATOM 0 HA TRP A 130 5.014 3.632 3.534 1.00 0.00 H new ATOM 0 HB2 TRP A 130 7.329 4.681 5.175 1.00 0.00 H new ATOM 0 HB3 TRP A 130 6.596 5.690 3.944 1.00 0.00 H new ATOM 0 HD1 TRP A 130 5.823 4.096 7.360 1.00 0.00 H new ATOM 0 HE1 TRP A 130 3.724 5.208 8.381 1.00 0.00 H new ATOM 0 HE3 TRP A 130 4.427 6.903 3.324 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 1.762 7.041 7.536 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 2.420 8.317 3.506 1.00 0.00 H new ATOM 0 HH2 TRP A 130 1.106 8.385 5.587 1.00 0.00 H new ATOM 2049 N TYR A 131 6.207 3.458 1.383 1.00 0.00 N ATOM 2050 CA TYR A 131 6.872 3.429 0.086 1.00 0.00 C ATOM 2051 C TYR A 131 7.020 4.837 -0.482 1.00 0.00 C ATOM 2052 O TYR A 131 6.047 5.442 -0.932 1.00 0.00 O ATOM 2053 CB TYR A 131 6.089 2.552 -0.892 1.00 0.00 C ATOM 2054 CG TYR A 131 6.001 1.103 -0.470 1.00 0.00 C ATOM 2055 CD1 TYR A 131 7.148 0.342 -0.282 1.00 0.00 C ATOM 2056 CD2 TYR A 131 4.770 0.495 -0.257 1.00 0.00 C ATOM 2057 CE1 TYR A 131 7.072 -0.982 0.104 1.00 0.00 C ATOM 2058 CE2 TYR A 131 4.684 -0.829 0.130 1.00 0.00 C ATOM 2059 CZ TYR A 131 5.838 -1.563 0.309 1.00 0.00 C ATOM 2060 OH TYR A 131 5.757 -2.882 0.695 1.00 0.00 O ATOM 0 H TYR A 131 5.193 3.361 1.339 1.00 0.00 H new ATOM 0 HA TYR A 131 7.867 3.007 0.226 1.00 0.00 H new ATOM 0 HB2 TYR A 131 5.081 2.952 -0.999 1.00 0.00 H new ATOM 0 HB3 TYR A 131 6.560 2.608 -1.874 1.00 0.00 H new ATOM 0 HD1 TYR A 131 8.116 0.794 -0.440 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.865 1.067 -0.396 1.00 0.00 H new ATOM 0 HE1 TYR A 131 7.974 -1.559 0.245 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.719 -1.286 0.291 1.00 0.00 H new ATOM 0 HH TYR A 131 6.621 -3.320 0.547 1.00 0.00 H new ATOM 2070 N ASP A 132 8.244 5.352 -0.458 1.00 0.00 N ATOM 2071 CA ASP A 132 8.522 6.688 -0.972 1.00 0.00 C ATOM 2072 C ASP A 132 8.336 6.738 -2.485 1.00 0.00 C ATOM 2073 O ASP A 132 9.025 6.040 -3.229 1.00 0.00 O ATOM 2074 CB ASP A 132 9.945 7.112 -0.606 1.00 0.00 C ATOM 2075 CG ASP A 132 10.994 6.189 -1.195 1.00 0.00 C ATOM 2076 OD1 ASP A 132 10.661 5.021 -1.482 1.00 0.00 O ATOM 2077 OD2 ASP A 132 12.148 6.635 -1.368 1.00 0.00 O ATOM 0 H ASP A 132 9.060 4.864 -0.088 1.00 0.00 H new ATOM 0 HA ASP A 132 7.816 7.381 -0.515 1.00 0.00 H new ATOM 0 HB2 ASP A 132 10.120 8.128 -0.959 1.00 0.00 H new ATOM 0 HB3 ASP A 132 10.048 7.129 0.479 1.00 0.00 H new ATOM 2082 N LEU A 133 7.399 7.566 -2.933 1.00 0.00 N ATOM 2083 CA LEU A 133 7.121 7.707 -4.358 1.00 0.00 C ATOM 2084 C LEU A 133 8.339 8.247 -5.100 1.00 0.00 C ATOM 2085 O LEU A 133 8.971 9.209 -4.662 1.00 0.00 O ATOM 2086 CB LEU A 133 5.924 8.635 -4.575 1.00 0.00 C ATOM 2087 CG LEU A 133 4.608 8.194 -3.933 1.00 0.00 C ATOM 2088 CD1 LEU A 133 3.677 9.383 -3.754 1.00 0.00 C ATOM 2089 CD2 LEU A 133 3.941 7.114 -4.772 1.00 0.00 C ATOM 0 H LEU A 133 6.819 8.150 -2.330 1.00 0.00 H new ATOM 0 HA LEU A 133 6.885 6.720 -4.756 1.00 0.00 H new ATOM 0 HB2 LEU A 133 6.180 9.622 -4.190 1.00 0.00 H new ATOM 0 HB3 LEU A 133 5.763 8.743 -5.648 1.00 0.00 H new ATOM 0 HG LEU A 133 4.827 7.779 -2.949 1.00 0.00 H new ATOM 0 HD11 LEU A 133 2.746 9.050 -3.296 1.00 0.00 H new ATOM 0 HD12 LEU A 133 4.153 10.124 -3.112 1.00 0.00 H new ATOM 0 HD13 LEU A 133 3.464 9.828 -4.726 1.00 0.00 H new ATOM 0 HD21 LEU A 133 3.006 6.812 -4.300 1.00 0.00 H new ATOM 0 HD22 LEU A 133 3.735 7.503 -5.769 1.00 0.00 H new ATOM 0 HD23 LEU A 133 4.603 6.252 -4.849 1.00 0.00 H new ATOM 2101 N THR A 134 8.662 7.624 -6.229 1.00 0.00 N ATOM 2102 CA THR A 134 9.804 8.043 -7.033 1.00 0.00 C ATOM 2103 C THR A 134 9.377 8.389 -8.455 1.00 0.00 C ATOM 2104 O THR A 134 8.210 8.239 -8.816 1.00 0.00 O ATOM 2105 CB THR A 134 10.885 6.947 -7.086 1.00 0.00 C ATOM 2106 OG1 THR A 134 10.362 5.772 -7.715 1.00 0.00 O ATOM 2107 CG2 THR A 134 11.377 6.604 -5.688 1.00 0.00 C ATOM 0 H THR A 134 8.149 6.828 -6.607 1.00 0.00 H new ATOM 0 HA THR A 134 10.219 8.930 -6.555 1.00 0.00 H new ATOM 0 HB THR A 134 11.726 7.325 -7.667 1.00 0.00 H new ATOM 0 HG1 THR A 134 11.056 5.081 -7.746 1.00 0.00 H new ATOM 0 HG21 THR A 134 12.140 5.828 -5.751 1.00 0.00 H new ATOM 0 HG22 THR A 134 11.802 7.494 -5.223 1.00 0.00 H new ATOM 0 HG23 THR A 134 10.542 6.244 -5.087 1.00 0.00 H new ATOM 2115 N GLU A 135 10.330 8.852 -9.258 1.00 0.00 N ATOM 2116 CA GLU A 135 10.051 9.220 -10.641 1.00 0.00 C ATOM 2117 C GLU A 135 9.793 7.980 -11.492 1.00 0.00 C ATOM 2118 O GLU A 135 10.125 6.862 -11.096 1.00 0.00 O ATOM 2119 CB GLU A 135 11.218 10.019 -11.225 1.00 0.00 C ATOM 2120 CG GLU A 135 11.456 11.348 -10.527 1.00 0.00 C ATOM 2121 CD GLU A 135 12.312 12.292 -11.347 1.00 0.00 C ATOM 2122 OE1 GLU A 135 12.126 12.344 -12.581 1.00 0.00 O ATOM 2123 OE2 GLU A 135 13.169 12.981 -10.754 1.00 0.00 O ATOM 0 H GLU A 135 11.301 8.981 -8.975 1.00 0.00 H new ATOM 0 HA GLU A 135 9.155 9.840 -10.651 1.00 0.00 H new ATOM 0 HB2 GLU A 135 12.125 9.418 -11.163 1.00 0.00 H new ATOM 0 HB3 GLU A 135 11.028 10.203 -12.283 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.497 11.822 -10.319 1.00 0.00 H new ATOM 0 HG3 GLU A 135 11.938 11.168 -9.566 1.00 0.00 H new ATOM 2130 N ASP A 136 9.199 8.186 -12.662 1.00 0.00 N ATOM 2131 CA ASP A 136 8.896 7.086 -13.570 1.00 0.00 C ATOM 2132 C ASP A 136 10.176 6.407 -14.047 1.00 0.00 C ATOM 2133 O ASP A 136 10.296 5.183 -14.001 1.00 0.00 O ATOM 2134 CB ASP A 136 8.095 7.593 -14.770 1.00 0.00 C ATOM 2135 CG ASP A 136 8.927 8.453 -15.700 1.00 0.00 C ATOM 2136 OD1 ASP A 136 9.585 9.394 -15.207 1.00 0.00 O ATOM 2137 OD2 ASP A 136 8.921 8.188 -16.920 1.00 0.00 O ATOM 0 H ASP A 136 8.918 9.105 -13.004 1.00 0.00 H new ATOM 0 HA ASP A 136 8.298 6.354 -13.027 1.00 0.00 H new ATOM 0 HB2 ASP A 136 7.699 6.742 -15.324 1.00 0.00 H new ATOM 0 HB3 ASP A 136 7.240 8.169 -14.415 1.00 0.00 H new ATOM 2142 N SER A 137 11.130 7.210 -14.506 1.00 0.00 N ATOM 2143 CA SER A 137 12.400 6.687 -14.997 1.00 0.00 C ATOM 2144 C SER A 137 13.229 6.113 -13.852 1.00 0.00 C ATOM 2145 O SER A 137 13.726 4.991 -13.932 1.00 0.00 O ATOM 2146 CB SER A 137 13.187 7.787 -15.711 1.00 0.00 C ATOM 2147 OG SER A 137 12.657 8.039 -17.001 1.00 0.00 O ATOM 0 H SER A 137 11.048 8.226 -14.548 1.00 0.00 H new ATOM 0 HA SER A 137 12.186 5.886 -15.705 1.00 0.00 H new ATOM 0 HB2 SER A 137 13.159 8.701 -15.118 1.00 0.00 H new ATOM 0 HB3 SER A 137 14.233 7.493 -15.795 1.00 0.00 H new ATOM 0 HG SER A 137 13.177 8.747 -17.436 1.00 0.00 H new ATOM 2153 N GLY A 138 13.375 6.894 -12.785 1.00 0.00 N ATOM 2154 CA GLY A 138 14.145 6.448 -11.639 1.00 0.00 C ATOM 2155 C GLY A 138 15.325 7.352 -11.346 1.00 0.00 C ATOM 2156 O GLY A 138 15.204 8.363 -10.653 1.00 0.00 O ATOM 0 H GLY A 138 12.974 7.827 -12.695 1.00 0.00 H new ATOM 0 HA2 GLY A 138 13.497 6.407 -10.764 1.00 0.00 H new ATOM 0 HA3 GLY A 138 14.504 5.434 -11.818 1.00 0.00 H new ATOM 2160 N PRO A 139 16.501 6.989 -11.879 1.00 0.00 N ATOM 2161 CA PRO A 139 17.732 7.761 -11.684 1.00 0.00 C ATOM 2162 C PRO A 139 17.701 9.097 -12.418 1.00 0.00 C ATOM 2163 O PRO A 139 16.715 9.433 -13.075 1.00 0.00 O ATOM 2164 CB PRO A 139 18.817 6.854 -12.270 1.00 0.00 C ATOM 2165 CG PRO A 139 18.104 6.005 -13.265 1.00 0.00 C ATOM 2166 CD PRO A 139 16.720 5.796 -12.715 1.00 0.00 C ATOM 0 HA PRO A 139 17.891 8.016 -10.636 1.00 0.00 H new ATOM 0 HB2 PRO A 139 19.608 7.437 -12.742 1.00 0.00 H new ATOM 0 HB3 PRO A 139 19.286 6.247 -11.496 1.00 0.00 H new ATOM 0 HG2 PRO A 139 18.067 6.493 -14.239 1.00 0.00 H new ATOM 0 HG3 PRO A 139 18.616 5.053 -13.404 1.00 0.00 H new ATOM 0 HD2 PRO A 139 15.979 5.721 -13.510 1.00 0.00 H new ATOM 0 HD3 PRO A 139 16.654 4.878 -12.131 1.00 0.00 H new ATOM 2174 N SER A 140 18.786 9.856 -12.302 1.00 0.00 N ATOM 2175 CA SER A 140 18.881 11.158 -12.952 1.00 0.00 C ATOM 2176 C SER A 140 19.766 11.083 -14.192 1.00 0.00 C ATOM 2177 O SER A 140 19.328 11.393 -15.300 1.00 0.00 O ATOM 2178 CB SER A 140 19.436 12.199 -11.978 1.00 0.00 C ATOM 2179 OG SER A 140 19.600 13.455 -12.613 1.00 0.00 O ATOM 0 H SER A 140 19.611 9.592 -11.764 1.00 0.00 H new ATOM 0 HA SER A 140 17.879 11.457 -13.260 1.00 0.00 H new ATOM 0 HB2 SER A 140 18.761 12.303 -11.128 1.00 0.00 H new ATOM 0 HB3 SER A 140 20.394 11.859 -11.584 1.00 0.00 H new ATOM 0 HG SER A 140 19.954 14.103 -11.969 1.00 0.00 H new ATOM 2185 N SER A 141 21.013 10.668 -13.997 1.00 0.00 N ATOM 2186 CA SER A 141 21.963 10.555 -15.098 1.00 0.00 C ATOM 2187 C SER A 141 21.859 9.187 -15.766 1.00 0.00 C ATOM 2188 O SER A 141 21.612 9.087 -16.967 1.00 0.00 O ATOM 2189 CB SER A 141 23.389 10.783 -14.595 1.00 0.00 C ATOM 2190 OG SER A 141 24.332 10.610 -15.638 1.00 0.00 O ATOM 0 H SER A 141 21.390 10.404 -13.087 1.00 0.00 H new ATOM 0 HA SER A 141 21.720 11.320 -15.836 1.00 0.00 H new ATOM 0 HB2 SER A 141 23.477 11.789 -14.185 1.00 0.00 H new ATOM 0 HB3 SER A 141 23.607 10.088 -13.784 1.00 0.00 H new ATOM 0 HG SER A 141 25.236 10.763 -15.291 1.00 0.00 H new ATOM 2196 N GLY A 142 22.051 8.134 -14.977 1.00 0.00 N ATOM 2197 CA GLY A 142 21.976 6.785 -15.508 1.00 0.00 C ATOM 2198 C GLY A 142 22.221 5.730 -14.447 1.00 0.00 C ATOM 2199 O GLY A 142 23.342 5.577 -13.961 1.00 0.00 O ATOM 0 H GLY A 142 22.257 8.191 -13.980 1.00 0.00 H new ATOM 0 HA2 GLY A 142 20.994 6.627 -15.953 1.00 0.00 H new ATOM 0 HA3 GLY A 142 22.710 6.671 -16.306 1.00 0.00 H new TER 2203 GLY A 142