USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1047 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 40 THR OG1 : rot -68:sc= 1.52 USER MOD Set 1.2: A 128 TYR OH : rot -56:sc= 1.24 USER MOD Set 2.1: A 100 GLN :FLIP amide:sc= 0.0973 F(o=0.88,f=2.1) USER MOD Set 2.2: A 119 HIS : no HE2:sc= 2.01 K(o=2.1,f=-11!) USER MOD Set 3.1: A 19 TYR OH : rot -151:sc= 0.289 USER MOD Set 3.2: A 102 THR OG1 : rot 30:sc= 2.1 USER MOD Set 4.1: A 82 SER OG : rot 169:sc= 1.68 USER MOD Set 4.2: A 93 HIS : no HD1:sc= 0.0117 K(o=1.7,f=-13!) USER MOD Set 4.3: A 95 GLN : amide:sc= -0.0265! C(o=1.7!,f=-8.5!) USER MOD Set 5.1: A 53 THR OG1 : rot 67:sc= 0.388 USER MOD Set 5.2: A 59 ASN : amide:sc= -0.64! C(o=-0.25!,f=-5.5!) USER MOD Set 6.1: A 45 ASN : amide:sc= 0.488 K(o=1.9,f=-1.9!) USER MOD Set 6.2: A 48 THR OG1 : rot -84:sc= 1.37 USER MOD Set 7.1: A 29 THR OG1 : rot 110:sc= 1.16 USER MOD Set 7.2: A 58 LYS NZ :NH3+ 164:sc= 1.17 (180deg=0) USER MOD Set 8.1: A 14 LYS NZ :NH3+ -139:sc= 1.27 (180deg=-0.0139) USER MOD Set 8.2: A 15 ASN : amide:sc= 2.05 K(o=3.3,f=-7.5!) USER MOD Single : A 1 VAL N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -118:sc= 0.604 (180deg=0.382) USER MOD Single : A 13 SER OG : rot -37:sc= 1.04 USER MOD Single : A 20 MET CE :methyl 180:sc= -0.0542 (180deg=-0.0542) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 57:sc= 1.21 USER MOD Single : A 31 GLN : amide:sc= 0.677 K(o=0.68,f=-0.43) USER MOD Single : A 34 ASN : amide:sc= -0.0471 K(o=-0.047,f=-4.3!) USER MOD Single : A 35 MET CE :methyl 158:sc= 0 (180deg=-0.0616) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 170:sc= -0.0015 (180deg=-0.0944) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -167:sc= 0.771 (180deg=-0.0775!) USER MOD Single : A 54 GLN : amide:sc= -0.0554 K(o=-0.055,f=-2.5!) USER MOD Single : A 55 SER OG : rot -68:sc= 0.935 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.372 USER MOD Single : A 60 THR OG1 : rot 167:sc= 1.28 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 49:sc= 0.378 USER MOD Single : A 74 THR OG1 : rot -88:sc= 1.32 USER MOD Single : A 79 LYS NZ :NH3+ 133:sc= 0.979 (180deg=0.171) USER MOD Single : A 81 LYS NZ :NH3+ 152:sc= 1.26 (180deg=1.11) USER MOD Single : A 85 THR OG1 : rot 180:sc= -0.202 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -175:sc= 1.23 (180deg=1.18) USER MOD Single : A 98 ASN : amide:sc= -1.27 K(o=-1.3,f=-2.3) USER MOD Single : A 103 SER OG : rot 38:sc= 0.451 USER MOD Single : A 108 MET CE :methyl 168:sc= -0.197 (180deg=-0.295) USER MOD Single : A 112 LYS NZ :NH3+ 162:sc= 1.1 (180deg=0.812) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.0471 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 59:sc= 0.703 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.03 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.222) USER MOD Single : A 131 GLN : amide:sc= 0.255 K(o=0.26,f=-12!) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.722 -11.844 -3.625 1.00 0.00 N ATOM 2 CA VAL A 1 11.253 -11.270 -2.400 1.00 0.00 C ATOM 3 C VAL A 1 12.423 -10.336 -2.728 1.00 0.00 C ATOM 4 O VAL A 1 12.343 -9.134 -2.443 1.00 0.00 O ATOM 5 CB VAL A 1 11.545 -12.379 -1.368 1.00 0.00 C ATOM 6 CG1 VAL A 1 12.667 -13.350 -1.755 1.00 0.00 C ATOM 7 CG2 VAL A 1 11.855 -11.783 0.009 1.00 0.00 C ATOM 0 H1 VAL A 1 9.929 -12.477 -3.397 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.389 -11.082 -4.249 1.00 0.00 H new ATOM 0 H3 VAL A 1 11.468 -12.385 -4.107 1.00 0.00 H new ATOM 0 HA VAL A 1 10.514 -10.635 -1.912 1.00 0.00 H new ATOM 0 HB VAL A 1 10.626 -12.965 -1.340 1.00 0.00 H new ATOM 0 HG11 VAL A 1 12.795 -14.091 -0.966 1.00 0.00 H new ATOM 0 HG12 VAL A 1 12.408 -13.853 -2.686 1.00 0.00 H new ATOM 0 HG13 VAL A 1 13.597 -12.797 -1.888 1.00 0.00 H new ATOM 0 HG21 VAL A 1 12.057 -12.587 0.716 1.00 0.00 H new ATOM 0 HG22 VAL A 1 12.729 -11.135 -0.063 1.00 0.00 H new ATOM 0 HG23 VAL A 1 11.000 -11.202 0.355 1.00 0.00 H new ATOM 19 N ASP A 2 13.454 -10.857 -3.407 1.00 0.00 N ATOM 20 CA ASP A 2 14.637 -10.133 -3.874 1.00 0.00 C ATOM 21 C ASP A 2 14.282 -9.269 -5.086 1.00 0.00 C ATOM 22 O ASP A 2 14.820 -9.404 -6.181 1.00 0.00 O ATOM 23 CB ASP A 2 15.759 -11.122 -4.205 1.00 0.00 C ATOM 24 CG ASP A 2 16.245 -11.843 -2.961 1.00 0.00 C ATOM 25 OD1 ASP A 2 16.903 -11.164 -2.143 1.00 0.00 O ATOM 26 OD2 ASP A 2 15.917 -13.042 -2.842 1.00 0.00 O ATOM 0 H ASP A 2 13.484 -11.846 -3.656 1.00 0.00 H new ATOM 0 HA ASP A 2 14.991 -9.472 -3.083 1.00 0.00 H new ATOM 0 HB2 ASP A 2 15.402 -11.850 -4.933 1.00 0.00 H new ATOM 0 HB3 ASP A 2 16.590 -10.590 -4.668 1.00 0.00 H new ATOM 31 N ALA A 3 13.349 -8.352 -4.861 1.00 0.00 N ATOM 32 CA ALA A 3 12.600 -7.626 -5.866 1.00 0.00 C ATOM 33 C ALA A 3 11.797 -6.588 -5.100 1.00 0.00 C ATOM 34 O ALA A 3 11.928 -5.393 -5.343 1.00 0.00 O ATOM 35 CB ALA A 3 11.672 -8.589 -6.620 1.00 0.00 C ATOM 0 H ALA A 3 13.083 -8.083 -3.914 1.00 0.00 H new ATOM 0 HA ALA A 3 13.247 -7.158 -6.608 1.00 0.00 H new ATOM 0 HB1 ALA A 3 11.111 -8.038 -7.375 1.00 0.00 H new ATOM 0 HB2 ALA A 3 12.267 -9.363 -7.104 1.00 0.00 H new ATOM 0 HB3 ALA A 3 10.978 -9.051 -5.917 1.00 0.00 H new ATOM 41 N PHE A 4 11.042 -7.055 -4.106 1.00 0.00 N ATOM 42 CA PHE A 4 10.193 -6.218 -3.286 1.00 0.00 C ATOM 43 C PHE A 4 10.959 -5.640 -2.098 1.00 0.00 C ATOM 44 O PHE A 4 10.816 -4.454 -1.825 1.00 0.00 O ATOM 45 CB PHE A 4 8.977 -7.031 -2.838 1.00 0.00 C ATOM 46 CG PHE A 4 8.256 -7.721 -3.980 1.00 0.00 C ATOM 47 CD1 PHE A 4 7.672 -6.952 -5.004 1.00 0.00 C ATOM 48 CD2 PHE A 4 8.341 -9.117 -4.126 1.00 0.00 C ATOM 49 CE1 PHE A 4 7.152 -7.576 -6.149 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.867 -9.734 -5.294 1.00 0.00 C ATOM 51 CZ PHE A 4 7.260 -8.966 -6.301 1.00 0.00 C ATOM 0 H PHE A 4 11.009 -8.042 -3.851 1.00 0.00 H new ATOM 0 HA PHE A 4 9.851 -5.366 -3.873 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.298 -7.781 -2.115 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.278 -6.371 -2.324 1.00 0.00 H new ATOM 0 HD1 PHE A 4 7.624 -5.877 -4.908 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.772 -9.716 -3.337 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.669 -6.985 -6.913 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.969 -10.802 -5.419 1.00 0.00 H new ATOM 0 HZ PHE A 4 6.877 -9.445 -7.190 1.00 0.00 H new ATOM 61 N VAL A 5 11.746 -6.460 -1.391 1.00 0.00 N ATOM 62 CA VAL A 5 12.399 -6.068 -0.139 1.00 0.00 C ATOM 63 C VAL A 5 13.095 -4.705 -0.248 1.00 0.00 C ATOM 64 O VAL A 5 14.023 -4.560 -1.046 1.00 0.00 O ATOM 65 CB VAL A 5 13.407 -7.154 0.285 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.341 -6.678 1.410 1.00 0.00 C ATOM 67 CG2 VAL A 5 12.666 -8.396 0.787 1.00 0.00 C ATOM 0 H VAL A 5 11.948 -7.419 -1.674 1.00 0.00 H new ATOM 0 HA VAL A 5 11.624 -5.970 0.622 1.00 0.00 H new ATOM 0 HB VAL A 5 14.004 -7.382 -0.598 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.032 -7.479 1.673 1.00 0.00 H new ATOM 0 HG12 VAL A 5 14.905 -5.809 1.071 1.00 0.00 H new ATOM 0 HG13 VAL A 5 13.749 -6.408 2.285 1.00 0.00 H new ATOM 0 HG21 VAL A 5 13.389 -9.156 1.084 1.00 0.00 H new ATOM 0 HG22 VAL A 5 12.048 -8.129 1.644 1.00 0.00 H new ATOM 0 HG23 VAL A 5 12.033 -8.788 -0.009 1.00 0.00 H new ATOM 77 N GLY A 6 12.683 -3.748 0.590 1.00 0.00 N ATOM 78 CA GLY A 6 13.379 -2.493 0.822 1.00 0.00 C ATOM 79 C GLY A 6 12.592 -1.291 0.308 1.00 0.00 C ATOM 80 O GLY A 6 11.384 -1.368 0.071 1.00 0.00 O ATOM 0 H GLY A 6 11.828 -3.835 1.139 1.00 0.00 H new ATOM 0 HA2 GLY A 6 13.563 -2.374 1.890 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.352 -2.524 0.332 1.00 0.00 H new ATOM 84 N THR A 7 13.294 -0.166 0.161 1.00 0.00 N ATOM 85 CA THR A 7 12.741 1.100 -0.288 1.00 0.00 C ATOM 86 C THR A 7 12.710 1.158 -1.819 1.00 0.00 C ATOM 87 O THR A 7 13.650 0.701 -2.478 1.00 0.00 O ATOM 88 CB THR A 7 13.573 2.243 0.307 1.00 0.00 C ATOM 89 OG1 THR A 7 13.738 2.030 1.691 1.00 0.00 O ATOM 90 CG2 THR A 7 12.894 3.602 0.147 1.00 0.00 C ATOM 0 H THR A 7 14.293 -0.116 0.359 1.00 0.00 H new ATOM 0 HA THR A 7 11.712 1.201 0.056 1.00 0.00 H new ATOM 0 HB THR A 7 14.523 2.250 -0.227 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.271 2.758 2.073 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.523 4.377 0.584 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.744 3.811 -0.912 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.929 3.589 0.654 1.00 0.00 H new ATOM 98 N TRP A 8 11.625 1.713 -2.370 1.00 0.00 N ATOM 99 CA TRP A 8 11.469 2.066 -3.775 1.00 0.00 C ATOM 100 C TRP A 8 11.214 3.576 -3.868 1.00 0.00 C ATOM 101 O TRP A 8 10.664 4.153 -2.926 1.00 0.00 O ATOM 102 CB TRP A 8 10.272 1.333 -4.402 1.00 0.00 C ATOM 103 CG TRP A 8 9.939 -0.086 -4.035 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.743 -1.003 -3.451 1.00 0.00 C ATOM 105 CD2 TRP A 8 8.673 -0.775 -4.271 1.00 0.00 C ATOM 106 NE1 TRP A 8 10.051 -2.178 -3.262 1.00 0.00 N ATOM 107 CE2 TRP A 8 8.777 -2.108 -3.780 1.00 0.00 C ATOM 108 CE3 TRP A 8 7.448 -0.408 -4.867 1.00 0.00 C ATOM 109 CZ2 TRP A 8 7.728 -3.033 -3.888 1.00 0.00 C ATOM 110 CZ3 TRP A 8 6.392 -1.329 -4.992 1.00 0.00 C ATOM 111 CH2 TRP A 8 6.540 -2.645 -4.527 1.00 0.00 C ATOM 0 H TRP A 8 10.797 1.936 -1.818 1.00 0.00 H new ATOM 0 HA TRP A 8 12.374 1.780 -4.311 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.387 1.932 -4.188 1.00 0.00 H new ATOM 0 HB3 TRP A 8 10.418 1.355 -5.482 1.00 0.00 H new ATOM 0 HD1 TRP A 8 11.774 -0.838 -3.174 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.435 -3.000 -2.795 1.00 0.00 H new ATOM 0 HE3 TRP A 8 7.318 0.599 -5.234 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 7.833 -4.030 -3.485 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 5.463 -1.022 -5.448 1.00 0.00 H new ATOM 0 HH2 TRP A 8 5.740 -3.359 -4.661 1.00 0.00 H new ATOM 122 N LYS A 9 11.535 4.203 -5.008 1.00 0.00 N ATOM 123 CA LYS A 9 11.048 5.535 -5.361 1.00 0.00 C ATOM 124 C LYS A 9 10.267 5.469 -6.676 1.00 0.00 C ATOM 125 O LYS A 9 10.675 4.763 -7.598 1.00 0.00 O ATOM 126 CB LYS A 9 12.177 6.583 -5.401 1.00 0.00 C ATOM 127 CG LYS A 9 13.277 6.364 -6.455 1.00 0.00 C ATOM 128 CD LYS A 9 14.486 5.619 -5.870 1.00 0.00 C ATOM 129 CE LYS A 9 15.498 5.162 -6.930 1.00 0.00 C ATOM 130 NZ LYS A 9 15.887 6.228 -7.873 1.00 0.00 N ATOM 0 H LYS A 9 12.146 3.793 -5.714 1.00 0.00 H new ATOM 0 HA LYS A 9 10.370 5.870 -4.576 1.00 0.00 H new ATOM 0 HB2 LYS A 9 11.729 7.562 -5.573 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.647 6.616 -4.418 1.00 0.00 H new ATOM 0 HG2 LYS A 9 12.871 5.797 -7.292 1.00 0.00 H new ATOM 0 HG3 LYS A 9 13.600 7.328 -6.850 1.00 0.00 H new ATOM 0 HD2 LYS A 9 14.990 6.268 -5.154 1.00 0.00 H new ATOM 0 HD3 LYS A 9 14.133 4.748 -5.317 1.00 0.00 H new ATOM 0 HE2 LYS A 9 16.391 4.787 -6.430 1.00 0.00 H new ATOM 0 HE3 LYS A 9 15.073 4.329 -7.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 15.606 5.958 -8.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 15.412 7.115 -7.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 16.918 6.363 -7.838 1.00 0.00 H new ATOM 144 N LEU A 10 9.131 6.163 -6.754 1.00 0.00 N ATOM 145 CA LEU A 10 8.333 6.255 -7.971 1.00 0.00 C ATOM 146 C LEU A 10 9.102 7.018 -9.054 1.00 0.00 C ATOM 147 O LEU A 10 9.844 7.946 -8.733 1.00 0.00 O ATOM 148 CB LEU A 10 7.019 6.946 -7.599 1.00 0.00 C ATOM 149 CG LEU A 10 6.103 7.292 -8.783 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.642 7.126 -8.363 1.00 0.00 C ATOM 151 CD2 LEU A 10 6.327 8.751 -9.209 1.00 0.00 C ATOM 0 H LEU A 10 8.738 6.680 -5.967 1.00 0.00 H new ATOM 0 HA LEU A 10 8.121 5.269 -8.383 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.470 6.302 -6.912 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.250 7.864 -7.059 1.00 0.00 H new ATOM 0 HG LEU A 10 6.334 6.626 -9.614 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.992 7.371 -9.203 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.466 6.095 -8.057 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.425 7.794 -7.529 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.674 8.989 -10.049 1.00 0.00 H new ATOM 0 HD22 LEU A 10 6.099 9.413 -8.373 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.366 8.887 -9.507 1.00 0.00 H new ATOM 163 N VAL A 11 8.907 6.661 -10.331 1.00 0.00 N ATOM 164 CA VAL A 11 9.457 7.411 -11.460 1.00 0.00 C ATOM 165 C VAL A 11 8.544 7.293 -12.697 1.00 0.00 C ATOM 166 O VAL A 11 9.014 7.147 -13.823 1.00 0.00 O ATOM 167 CB VAL A 11 10.936 7.014 -11.670 1.00 0.00 C ATOM 168 CG1 VAL A 11 11.126 5.580 -12.177 1.00 0.00 C ATOM 169 CG2 VAL A 11 11.698 8.001 -12.565 1.00 0.00 C ATOM 0 H VAL A 11 8.363 5.843 -10.606 1.00 0.00 H new ATOM 0 HA VAL A 11 9.471 8.480 -11.250 1.00 0.00 H new ATOM 0 HB VAL A 11 11.368 7.060 -10.670 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.190 5.375 -12.300 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.703 4.880 -11.456 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.621 5.463 -13.136 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.730 7.669 -12.676 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.224 8.044 -13.545 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.682 8.992 -12.110 1.00 0.00 H new ATOM 179 N ASP A 12 7.228 7.394 -12.480 1.00 0.00 N ATOM 180 CA ASP A 12 6.175 7.442 -13.495 1.00 0.00 C ATOM 181 C ASP A 12 4.873 7.763 -12.765 1.00 0.00 C ATOM 182 O ASP A 12 4.765 7.513 -11.570 1.00 0.00 O ATOM 183 CB ASP A 12 6.093 6.120 -14.265 1.00 0.00 C ATOM 184 CG ASP A 12 4.693 5.763 -14.752 1.00 0.00 C ATOM 185 OD1 ASP A 12 4.007 6.609 -15.374 1.00 0.00 O ATOM 186 OD2 ASP A 12 4.298 4.616 -14.465 1.00 0.00 O ATOM 0 H ASP A 12 6.849 7.447 -11.534 1.00 0.00 H new ATOM 0 HA ASP A 12 6.384 8.208 -14.242 1.00 0.00 H new ATOM 0 HB2 ASP A 12 6.762 6.172 -15.124 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.458 5.317 -13.625 1.00 0.00 H new ATOM 191 N SER A 13 3.911 8.368 -13.459 1.00 0.00 N ATOM 192 CA SER A 13 2.716 8.931 -12.854 1.00 0.00 C ATOM 193 C SER A 13 1.584 9.091 -13.876 1.00 0.00 C ATOM 194 O SER A 13 0.715 9.945 -13.682 1.00 0.00 O ATOM 195 CB SER A 13 3.109 10.274 -12.203 1.00 0.00 C ATOM 196 OG SER A 13 2.015 10.937 -11.600 1.00 0.00 O ATOM 0 H SER A 13 3.945 8.480 -14.472 1.00 0.00 H new ATOM 0 HA SER A 13 2.326 8.255 -12.093 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.878 10.096 -11.451 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.548 10.924 -12.960 1.00 0.00 H new ATOM 0 HG SER A 13 1.210 10.799 -12.142 1.00 0.00 H new ATOM 202 N LYS A 14 1.554 8.303 -14.958 1.00 0.00 N ATOM 203 CA LYS A 14 0.501 8.483 -15.954 1.00 0.00 C ATOM 204 C LYS A 14 -0.871 8.171 -15.333 1.00 0.00 C ATOM 205 O LYS A 14 -1.081 7.068 -14.832 1.00 0.00 O ATOM 206 CB LYS A 14 0.774 7.615 -17.190 1.00 0.00 C ATOM 207 CG LYS A 14 -0.097 7.955 -18.415 1.00 0.00 C ATOM 208 CD LYS A 14 0.300 9.269 -19.116 1.00 0.00 C ATOM 209 CE LYS A 14 -0.617 10.477 -18.851 1.00 0.00 C ATOM 210 NZ LYS A 14 -1.980 10.308 -19.400 1.00 0.00 N ATOM 0 H LYS A 14 2.224 7.560 -15.159 1.00 0.00 H new ATOM 0 HA LYS A 14 0.493 9.523 -16.281 1.00 0.00 H new ATOM 0 HB2 LYS A 14 1.823 7.718 -17.466 1.00 0.00 H new ATOM 0 HB3 LYS A 14 0.615 6.569 -16.926 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -0.033 7.137 -19.133 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -1.139 8.022 -18.101 1.00 0.00 H new ATOM 0 HD2 LYS A 14 1.312 9.531 -18.807 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.331 9.090 -20.191 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -0.684 10.645 -17.776 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -0.166 11.369 -19.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -2.296 11.203 -19.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -1.972 9.563 -20.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -2.632 10.040 -18.635 1.00 0.00 H new ATOM 224 N ASN A 15 -1.799 9.138 -15.369 1.00 0.00 N ATOM 225 CA ASN A 15 -3.194 9.015 -14.928 1.00 0.00 C ATOM 226 C ASN A 15 -3.276 8.844 -13.409 1.00 0.00 C ATOM 227 O ASN A 15 -3.706 7.803 -12.913 1.00 0.00 O ATOM 228 CB ASN A 15 -3.931 7.860 -15.630 1.00 0.00 C ATOM 229 CG ASN A 15 -3.954 7.930 -17.152 1.00 0.00 C ATOM 230 OD1 ASN A 15 -3.570 8.929 -17.759 1.00 0.00 O ATOM 231 ND2 ASN A 15 -4.367 6.844 -17.792 1.00 0.00 N ATOM 0 H ASN A 15 -1.586 10.071 -15.723 1.00 0.00 H new ATOM 0 HA ASN A 15 -3.692 9.943 -15.209 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.465 6.920 -15.333 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -4.959 7.834 -15.269 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -4.371 6.824 -18.812 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.680 6.029 -17.264 1.00 0.00 H new ATOM 238 N PHE A 16 -2.824 9.842 -12.646 1.00 0.00 N ATOM 239 CA PHE A 16 -2.790 9.726 -11.192 1.00 0.00 C ATOM 240 C PHE A 16 -4.150 10.057 -10.571 1.00 0.00 C ATOM 241 O PHE A 16 -4.762 9.200 -9.937 1.00 0.00 O ATOM 242 CB PHE A 16 -1.653 10.564 -10.596 1.00 0.00 C ATOM 243 CG PHE A 16 -0.962 9.881 -9.427 1.00 0.00 C ATOM 244 CD1 PHE A 16 -1.502 9.948 -8.129 1.00 0.00 C ATOM 245 CD2 PHE A 16 0.247 9.197 -9.639 1.00 0.00 C ATOM 246 CE1 PHE A 16 -0.800 9.383 -7.048 1.00 0.00 C ATOM 247 CE2 PHE A 16 0.984 8.708 -8.550 1.00 0.00 C ATOM 248 CZ PHE A 16 0.460 8.796 -7.252 1.00 0.00 C ATOM 0 H PHE A 16 -2.480 10.731 -13.010 1.00 0.00 H new ATOM 0 HA PHE A 16 -2.580 8.686 -10.942 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.918 10.774 -11.373 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -2.051 11.524 -10.266 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -2.453 10.432 -7.963 1.00 0.00 H new ATOM 0 HD2 PHE A 16 0.611 9.047 -10.645 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -1.231 9.401 -6.058 1.00 0.00 H new ATOM 0 HE2 PHE A 16 1.955 8.264 -8.711 1.00 0.00 H new ATOM 0 HZ PHE A 16 1.023 8.414 -6.413 1.00 0.00 H new ATOM 258 N ASP A 17 -4.612 11.304 -10.720 1.00 0.00 N ATOM 259 CA ASP A 17 -5.833 11.733 -10.048 1.00 0.00 C ATOM 260 C ASP A 17 -7.074 11.156 -10.724 1.00 0.00 C ATOM 261 O ASP A 17 -8.021 10.786 -10.035 1.00 0.00 O ATOM 262 CB ASP A 17 -5.930 13.250 -9.918 1.00 0.00 C ATOM 263 CG ASP A 17 -7.074 13.566 -8.961 1.00 0.00 C ATOM 264 OD1 ASP A 17 -6.850 13.459 -7.735 1.00 0.00 O ATOM 265 OD2 ASP A 17 -8.195 13.818 -9.449 1.00 0.00 O ATOM 0 H ASP A 17 -4.164 12.020 -11.292 1.00 0.00 H new ATOM 0 HA ASP A 17 -5.784 11.334 -9.035 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.993 13.661 -9.542 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.110 13.706 -10.892 1.00 0.00 H new ATOM 270 N ASP A 18 -7.030 11.011 -12.055 1.00 0.00 N ATOM 271 CA ASP A 18 -7.968 10.205 -12.838 1.00 0.00 C ATOM 272 C ASP A 18 -8.353 8.946 -12.062 1.00 0.00 C ATOM 273 O ASP A 18 -9.523 8.694 -11.785 1.00 0.00 O ATOM 274 CB ASP A 18 -7.304 9.822 -14.169 1.00 0.00 C ATOM 275 CG ASP A 18 -8.041 8.667 -14.841 1.00 0.00 C ATOM 276 OD1 ASP A 18 -9.179 8.908 -15.290 1.00 0.00 O ATOM 277 OD2 ASP A 18 -7.454 7.563 -14.866 1.00 0.00 O ATOM 0 H ASP A 18 -6.320 11.465 -12.630 1.00 0.00 H new ATOM 0 HA ASP A 18 -8.873 10.781 -13.032 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.292 10.685 -14.834 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -6.266 9.541 -13.993 1.00 0.00 H new ATOM 282 N TYR A 19 -7.334 8.196 -11.646 1.00 0.00 N ATOM 283 CA TYR A 19 -7.517 6.995 -10.859 1.00 0.00 C ATOM 284 C TYR A 19 -8.353 7.244 -9.599 1.00 0.00 C ATOM 285 O TYR A 19 -9.321 6.537 -9.322 1.00 0.00 O ATOM 286 CB TYR A 19 -6.137 6.426 -10.527 1.00 0.00 C ATOM 287 CG TYR A 19 -6.160 4.926 -10.471 1.00 0.00 C ATOM 288 CD1 TYR A 19 -6.284 4.213 -11.675 1.00 0.00 C ATOM 289 CD2 TYR A 19 -6.280 4.261 -9.239 1.00 0.00 C ATOM 290 CE1 TYR A 19 -6.453 2.826 -11.644 1.00 0.00 C ATOM 291 CE2 TYR A 19 -6.439 2.869 -9.213 1.00 0.00 C ATOM 292 CZ TYR A 19 -6.482 2.156 -10.417 1.00 0.00 C ATOM 293 OH TYR A 19 -6.409 0.807 -10.407 1.00 0.00 O ATOM 0 H TYR A 19 -6.358 8.412 -11.850 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.084 6.268 -11.440 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -5.417 6.752 -11.278 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -5.800 6.822 -9.569 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -6.249 4.734 -12.620 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -6.250 4.821 -8.316 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -6.561 2.273 -12.565 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.528 2.350 -8.270 1.00 0.00 H new ATOM 0 HH TYR A 19 -6.882 0.460 -9.622 1.00 0.00 H new ATOM 303 N MET A 20 -7.966 8.259 -8.827 1.00 0.00 N ATOM 304 CA MET A 20 -8.687 8.688 -7.639 1.00 0.00 C ATOM 305 C MET A 20 -10.136 9.078 -7.972 1.00 0.00 C ATOM 306 O MET A 20 -11.034 8.830 -7.165 1.00 0.00 O ATOM 307 CB MET A 20 -7.867 9.794 -6.941 1.00 0.00 C ATOM 308 CG MET A 20 -8.680 10.826 -6.154 1.00 0.00 C ATOM 309 SD MET A 20 -9.444 12.143 -7.152 1.00 0.00 S ATOM 310 CE MET A 20 -11.026 12.263 -6.271 1.00 0.00 C ATOM 0 H MET A 20 -7.130 8.812 -9.016 1.00 0.00 H new ATOM 0 HA MET A 20 -8.790 7.866 -6.931 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.159 9.321 -6.261 1.00 0.00 H new ATOM 0 HB3 MET A 20 -7.282 10.319 -7.696 1.00 0.00 H new ATOM 0 HG2 MET A 20 -9.466 10.305 -5.608 1.00 0.00 H new ATOM 0 HG3 MET A 20 -8.029 11.287 -5.412 1.00 0.00 H new ATOM 0 HE1 MET A 20 -11.646 13.028 -6.738 1.00 0.00 H new ATOM 0 HE2 MET A 20 -11.541 11.303 -6.315 1.00 0.00 H new ATOM 0 HE3 MET A 20 -10.843 12.530 -5.230 1.00 0.00 H new ATOM 320 N LYS A 21 -10.365 9.727 -9.117 1.00 0.00 N ATOM 321 CA LYS A 21 -11.633 10.310 -9.545 1.00 0.00 C ATOM 322 C LYS A 21 -12.642 9.224 -9.960 1.00 0.00 C ATOM 323 O LYS A 21 -13.098 9.185 -11.099 1.00 0.00 O ATOM 324 CB LYS A 21 -11.344 11.328 -10.667 1.00 0.00 C ATOM 325 CG LYS A 21 -12.584 12.123 -11.115 1.00 0.00 C ATOM 326 CD LYS A 21 -12.841 11.914 -12.616 1.00 0.00 C ATOM 327 CE LYS A 21 -14.233 12.424 -13.013 1.00 0.00 C ATOM 328 NZ LYS A 21 -14.556 12.094 -14.416 1.00 0.00 N ATOM 0 H LYS A 21 -9.627 9.866 -9.807 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.106 10.835 -8.715 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.580 12.026 -10.324 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.931 10.800 -11.527 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.455 11.804 -10.543 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.438 13.183 -10.909 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -12.080 12.437 -13.195 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -12.755 10.855 -12.859 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -14.983 11.986 -12.354 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -14.278 13.504 -12.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -15.504 12.454 -14.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -13.855 12.533 -15.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -14.537 11.062 -14.543 1.00 0.00 H new ATOM 342 N SER A 22 -13.020 8.383 -8.994 1.00 0.00 N ATOM 343 CA SER A 22 -13.984 7.284 -9.027 1.00 0.00 C ATOM 344 C SER A 22 -13.642 6.342 -7.872 1.00 0.00 C ATOM 345 O SER A 22 -14.527 5.881 -7.159 1.00 0.00 O ATOM 346 CB SER A 22 -13.986 6.497 -10.349 1.00 0.00 C ATOM 347 OG SER A 22 -14.763 7.139 -11.340 1.00 0.00 O ATOM 0 H SER A 22 -12.609 8.467 -8.064 1.00 0.00 H new ATOM 0 HA SER A 22 -14.983 7.710 -8.935 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.962 6.384 -10.706 1.00 0.00 H new ATOM 0 HB3 SER A 22 -14.376 5.494 -10.175 1.00 0.00 H new ATOM 0 HG SER A 22 -14.431 8.051 -11.476 1.00 0.00 H new ATOM 353 N LEU A 23 -12.348 6.067 -7.677 1.00 0.00 N ATOM 354 CA LEU A 23 -11.879 5.226 -6.584 1.00 0.00 C ATOM 355 C LEU A 23 -12.176 5.858 -5.218 1.00 0.00 C ATOM 356 O LEU A 23 -12.322 5.149 -4.219 1.00 0.00 O ATOM 357 CB LEU A 23 -10.386 4.961 -6.786 1.00 0.00 C ATOM 358 CG LEU A 23 -9.844 3.809 -5.934 1.00 0.00 C ATOM 359 CD1 LEU A 23 -10.481 2.479 -6.357 1.00 0.00 C ATOM 360 CD2 LEU A 23 -8.333 3.718 -6.143 1.00 0.00 C ATOM 0 H LEU A 23 -11.602 6.423 -8.274 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.415 4.277 -6.593 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.204 4.740 -7.838 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.830 5.868 -6.550 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.082 3.998 -4.887 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.083 1.673 -5.740 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -11.562 2.536 -6.227 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.251 2.282 -7.404 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.931 2.902 -5.543 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.122 3.532 -7.196 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.867 4.655 -5.840 1.00 0.00 H new ATOM 372 N GLY A 24 -12.259 7.193 -5.182 1.00 0.00 N ATOM 373 CA GLY A 24 -12.739 7.966 -4.046 1.00 0.00 C ATOM 374 C GLY A 24 -11.576 8.654 -3.346 1.00 0.00 C ATOM 375 O GLY A 24 -11.596 9.871 -3.178 1.00 0.00 O ATOM 0 H GLY A 24 -11.984 7.777 -5.971 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -13.461 8.710 -4.383 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.258 7.312 -3.346 1.00 0.00 H new ATOM 379 N VAL A 25 -10.575 7.846 -2.978 1.00 0.00 N ATOM 380 CA VAL A 25 -9.412 8.143 -2.141 1.00 0.00 C ATOM 381 C VAL A 25 -9.349 9.575 -1.590 1.00 0.00 C ATOM 382 O VAL A 25 -9.610 9.790 -0.409 1.00 0.00 O ATOM 383 CB VAL A 25 -8.110 7.711 -2.845 1.00 0.00 C ATOM 384 CG1 VAL A 25 -6.902 8.073 -1.967 1.00 0.00 C ATOM 385 CG2 VAL A 25 -8.085 6.200 -3.131 1.00 0.00 C ATOM 0 H VAL A 25 -10.560 6.875 -3.290 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.534 7.539 -1.242 1.00 0.00 H new ATOM 0 HB VAL A 25 -8.062 8.239 -3.797 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.984 7.766 -2.467 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.883 9.150 -1.801 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.982 7.560 -1.009 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -7.150 5.939 -3.627 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.163 5.651 -2.193 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.924 5.938 -3.776 1.00 0.00 H new ATOM 395 N GLY A 26 -8.955 10.550 -2.413 1.00 0.00 N ATOM 396 CA GLY A 26 -8.807 11.918 -1.941 1.00 0.00 C ATOM 397 C GLY A 26 -8.281 12.844 -3.031 1.00 0.00 C ATOM 398 O GLY A 26 -7.122 12.739 -3.429 1.00 0.00 O ATOM 0 H GLY A 26 -8.736 10.414 -3.400 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.770 12.285 -1.587 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -8.126 11.936 -1.090 1.00 0.00 H new ATOM 402 N PHE A 27 -9.128 13.756 -3.517 1.00 0.00 N ATOM 403 CA PHE A 27 -8.689 14.845 -4.383 1.00 0.00 C ATOM 404 C PHE A 27 -7.764 15.799 -3.611 1.00 0.00 C ATOM 405 O PHE A 27 -7.607 15.673 -2.394 1.00 0.00 O ATOM 406 CB PHE A 27 -9.914 15.595 -4.939 1.00 0.00 C ATOM 407 CG PHE A 27 -9.592 16.598 -6.032 1.00 0.00 C ATOM 408 CD1 PHE A 27 -9.017 16.150 -7.235 1.00 0.00 C ATOM 409 CD2 PHE A 27 -9.702 17.980 -5.790 1.00 0.00 C ATOM 410 CE1 PHE A 27 -8.550 17.069 -8.186 1.00 0.00 C ATOM 411 CE2 PHE A 27 -9.223 18.903 -6.738 1.00 0.00 C ATOM 412 CZ PHE A 27 -8.643 18.448 -7.934 1.00 0.00 C ATOM 0 H PHE A 27 -10.129 13.758 -3.321 1.00 0.00 H new ATOM 0 HA PHE A 27 -8.126 14.433 -5.220 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -10.625 14.866 -5.329 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -10.409 16.116 -4.119 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -8.935 15.091 -7.428 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -10.155 18.333 -4.875 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -8.119 16.717 -9.112 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -9.301 19.963 -6.546 1.00 0.00 H new ATOM 0 HZ PHE A 27 -8.269 19.157 -8.658 1.00 0.00 H new ATOM 422 N ALA A 28 -7.174 16.768 -4.316 1.00 0.00 N ATOM 423 CA ALA A 28 -6.386 17.869 -3.773 1.00 0.00 C ATOM 424 C ALA A 28 -5.066 17.384 -3.173 1.00 0.00 C ATOM 425 O ALA A 28 -4.007 17.652 -3.735 1.00 0.00 O ATOM 426 CB ALA A 28 -7.203 18.719 -2.793 1.00 0.00 C ATOM 0 H ALA A 28 -7.239 16.804 -5.333 1.00 0.00 H new ATOM 0 HA ALA A 28 -6.121 18.522 -4.605 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -6.583 19.529 -2.409 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.068 19.137 -3.308 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.540 18.096 -1.964 1.00 0.00 H new ATOM 432 N THR A 29 -5.118 16.658 -2.054 1.00 0.00 N ATOM 433 CA THR A 29 -3.924 16.135 -1.405 1.00 0.00 C ATOM 434 C THR A 29 -3.127 15.294 -2.400 1.00 0.00 C ATOM 435 O THR A 29 -1.940 15.532 -2.602 1.00 0.00 O ATOM 436 CB THR A 29 -4.296 15.315 -0.157 1.00 0.00 C ATOM 437 OG1 THR A 29 -5.019 16.106 0.771 1.00 0.00 O ATOM 438 CG2 THR A 29 -3.044 14.798 0.555 1.00 0.00 C ATOM 0 H THR A 29 -5.988 16.419 -1.577 1.00 0.00 H new ATOM 0 HA THR A 29 -3.303 16.968 -1.076 1.00 0.00 H new ATOM 0 HB THR A 29 -4.906 14.479 -0.500 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.951 15.805 0.801 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.336 14.222 1.433 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.476 14.162 -0.124 1.00 0.00 H new ATOM 0 HG23 THR A 29 -2.426 15.642 0.864 1.00 0.00 H new ATOM 446 N ARG A 30 -3.764 14.294 -3.013 1.00 0.00 N ATOM 447 CA ARG A 30 -3.027 13.322 -3.804 1.00 0.00 C ATOM 448 C ARG A 30 -2.392 13.980 -5.031 1.00 0.00 C ATOM 449 O ARG A 30 -1.235 13.709 -5.336 1.00 0.00 O ATOM 450 CB ARG A 30 -3.917 12.121 -4.156 1.00 0.00 C ATOM 451 CG ARG A 30 -3.110 10.821 -4.066 1.00 0.00 C ATOM 452 CD ARG A 30 -3.958 9.597 -4.443 1.00 0.00 C ATOM 453 NE ARG A 30 -3.454 8.378 -3.784 1.00 0.00 N ATOM 454 CZ ARG A 30 -4.033 7.169 -3.864 1.00 0.00 C ATOM 455 NH1 ARG A 30 -4.988 6.952 -4.776 1.00 0.00 N ATOM 456 NH2 ARG A 30 -3.662 6.188 -3.031 1.00 0.00 N ATOM 0 H ARG A 30 -4.772 14.142 -2.975 1.00 0.00 H new ATOM 0 HA ARG A 30 -2.203 12.933 -3.206 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -4.768 12.078 -3.476 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -4.319 12.239 -5.162 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -2.246 10.883 -4.728 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -2.727 10.700 -3.053 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -4.995 9.767 -4.155 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -3.945 9.461 -5.524 1.00 0.00 H new ATOM 0 HE ARG A 30 -2.604 8.459 -3.227 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -5.272 7.703 -5.405 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -5.432 6.036 -4.842 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -2.938 6.358 -2.333 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -4.104 5.271 -3.094 1.00 0.00 H new ATOM 470 N GLN A 31 -3.130 14.861 -5.712 1.00 0.00 N ATOM 471 CA GLN A 31 -2.688 15.456 -6.969 1.00 0.00 C ATOM 472 C GLN A 31 -1.536 16.463 -6.822 1.00 0.00 C ATOM 473 O GLN A 31 -0.993 16.891 -7.837 1.00 0.00 O ATOM 474 CB GLN A 31 -3.892 15.998 -7.757 1.00 0.00 C ATOM 475 CG GLN A 31 -4.682 17.140 -7.105 1.00 0.00 C ATOM 476 CD GLN A 31 -3.983 18.491 -7.219 1.00 0.00 C ATOM 477 OE1 GLN A 31 -3.941 19.083 -8.291 1.00 0.00 O ATOM 478 NE2 GLN A 31 -3.444 19.003 -6.118 1.00 0.00 N ATOM 0 H GLN A 31 -4.049 15.179 -5.405 1.00 0.00 H new ATOM 0 HA GLN A 31 -2.240 14.658 -7.561 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -3.537 16.341 -8.729 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.578 15.171 -7.942 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -5.665 17.206 -7.570 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -4.843 16.908 -6.052 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -3.494 18.488 -5.239 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -2.980 19.911 -6.152 1.00 0.00 H new ATOM 487 N VAL A 32 -1.154 16.828 -5.590 1.00 0.00 N ATOM 488 CA VAL A 32 0.101 17.532 -5.319 1.00 0.00 C ATOM 489 C VAL A 32 1.088 16.586 -4.628 1.00 0.00 C ATOM 490 O VAL A 32 2.273 16.541 -4.958 1.00 0.00 O ATOM 491 CB VAL A 32 -0.152 18.834 -4.532 1.00 0.00 C ATOM 492 CG1 VAL A 32 -0.666 18.623 -3.103 1.00 0.00 C ATOM 493 CG2 VAL A 32 1.118 19.691 -4.473 1.00 0.00 C ATOM 0 H VAL A 32 -1.709 16.642 -4.755 1.00 0.00 H new ATOM 0 HA VAL A 32 0.558 17.840 -6.260 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.942 19.342 -5.085 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -0.816 19.590 -2.624 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -1.612 18.082 -3.133 1.00 0.00 H new ATOM 0 HG13 VAL A 32 0.064 18.046 -2.535 1.00 0.00 H new ATOM 0 HG21 VAL A 32 0.915 20.604 -3.913 1.00 0.00 H new ATOM 0 HG22 VAL A 32 1.912 19.131 -3.979 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.431 19.948 -5.485 1.00 0.00 H new ATOM 503 N GLY A 33 0.600 15.809 -3.662 1.00 0.00 N ATOM 504 CA GLY A 33 1.405 14.912 -2.857 1.00 0.00 C ATOM 505 C GLY A 33 2.080 13.820 -3.682 1.00 0.00 C ATOM 506 O GLY A 33 3.122 13.302 -3.284 1.00 0.00 O ATOM 0 H GLY A 33 -0.390 15.791 -3.417 1.00 0.00 H new ATOM 0 HA2 GLY A 33 2.167 15.488 -2.332 1.00 0.00 H new ATOM 0 HA3 GLY A 33 0.775 14.450 -2.097 1.00 0.00 H new ATOM 510 N ASN A 34 1.494 13.475 -4.828 1.00 0.00 N ATOM 511 CA ASN A 34 2.089 12.585 -5.812 1.00 0.00 C ATOM 512 C ASN A 34 3.326 13.196 -6.472 1.00 0.00 C ATOM 513 O ASN A 34 4.163 12.469 -6.997 1.00 0.00 O ATOM 514 CB ASN A 34 1.055 12.213 -6.881 1.00 0.00 C ATOM 515 CG ASN A 34 0.594 13.394 -7.735 1.00 0.00 C ATOM 516 OD1 ASN A 34 0.773 14.553 -7.375 1.00 0.00 O ATOM 517 ND2 ASN A 34 -0.016 13.110 -8.880 1.00 0.00 N ATOM 0 H ASN A 34 0.572 13.817 -5.100 1.00 0.00 H new ATOM 0 HA ASN A 34 2.410 11.687 -5.284 1.00 0.00 H new ATOM 0 HB2 ASN A 34 1.480 11.450 -7.533 1.00 0.00 H new ATOM 0 HB3 ASN A 34 0.187 11.769 -6.394 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -0.347 13.864 -9.482 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -0.153 12.138 -9.157 1.00 0.00 H new ATOM 524 N MET A 35 3.432 14.526 -6.504 1.00 0.00 N ATOM 525 CA MET A 35 4.479 15.204 -7.240 1.00 0.00 C ATOM 526 C MET A 35 5.757 15.285 -6.408 1.00 0.00 C ATOM 527 O MET A 35 6.846 15.166 -6.960 1.00 0.00 O ATOM 528 CB MET A 35 3.988 16.595 -7.668 1.00 0.00 C ATOM 529 CG MET A 35 4.781 17.169 -8.849 1.00 0.00 C ATOM 530 SD MET A 35 4.499 16.338 -10.443 1.00 0.00 S ATOM 531 CE MET A 35 6.067 15.452 -10.653 1.00 0.00 C ATOM 0 H MET A 35 2.792 15.154 -6.019 1.00 0.00 H new ATOM 0 HA MET A 35 4.718 14.635 -8.138 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.934 16.535 -7.939 1.00 0.00 H new ATOM 0 HB3 MET A 35 4.061 17.277 -6.821 1.00 0.00 H new ATOM 0 HG2 MET A 35 4.530 18.224 -8.957 1.00 0.00 H new ATOM 0 HG3 MET A 35 5.844 17.117 -8.613 1.00 0.00 H new ATOM 0 HE1 MET A 35 5.924 14.617 -11.339 1.00 0.00 H new ATOM 0 HE2 MET A 35 6.817 16.131 -11.059 1.00 0.00 H new ATOM 0 HE3 MET A 35 6.404 15.074 -9.688 1.00 0.00 H new ATOM 541 N THR A 36 5.624 15.535 -5.100 1.00 0.00 N ATOM 542 CA THR A 36 6.770 15.857 -4.256 1.00 0.00 C ATOM 543 C THR A 36 7.773 14.697 -4.176 1.00 0.00 C ATOM 544 O THR A 36 8.940 14.873 -4.527 1.00 0.00 O ATOM 545 CB THR A 36 6.318 16.421 -2.894 1.00 0.00 C ATOM 546 OG1 THR A 36 7.436 16.880 -2.167 1.00 0.00 O ATOM 547 CG2 THR A 36 5.547 15.444 -2.003 1.00 0.00 C ATOM 0 H THR A 36 4.731 15.519 -4.607 1.00 0.00 H new ATOM 0 HA THR A 36 7.332 16.663 -4.728 1.00 0.00 H new ATOM 0 HB THR A 36 5.628 17.226 -3.148 1.00 0.00 H new ATOM 0 HG1 THR A 36 7.140 17.238 -1.304 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.276 15.939 -1.070 1.00 0.00 H new ATOM 0 HG22 THR A 36 4.643 15.118 -2.517 1.00 0.00 H new ATOM 0 HG23 THR A 36 6.173 14.578 -1.786 1.00 0.00 H new ATOM 555 N LYS A 37 7.331 13.512 -3.734 1.00 0.00 N ATOM 556 CA LYS A 37 8.170 12.322 -3.596 1.00 0.00 C ATOM 557 C LYS A 37 7.330 11.124 -3.129 1.00 0.00 C ATOM 558 O LYS A 37 7.226 10.883 -1.929 1.00 0.00 O ATOM 559 CB LYS A 37 9.355 12.580 -2.633 1.00 0.00 C ATOM 560 CG LYS A 37 10.702 12.549 -3.367 1.00 0.00 C ATOM 561 CD LYS A 37 11.832 12.877 -2.380 1.00 0.00 C ATOM 562 CE LYS A 37 13.200 12.957 -3.070 1.00 0.00 C ATOM 563 NZ LYS A 37 13.278 14.082 -4.027 1.00 0.00 N ATOM 0 H LYS A 37 6.362 13.354 -3.458 1.00 0.00 H new ATOM 0 HA LYS A 37 8.588 12.086 -4.575 1.00 0.00 H new ATOM 0 HB2 LYS A 37 9.227 13.548 -2.150 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.353 11.827 -1.844 1.00 0.00 H new ATOM 0 HG2 LYS A 37 10.865 11.566 -3.809 1.00 0.00 H new ATOM 0 HG3 LYS A 37 10.699 13.269 -4.185 1.00 0.00 H new ATOM 0 HD2 LYS A 37 11.619 13.826 -1.889 1.00 0.00 H new ATOM 0 HD3 LYS A 37 11.864 12.115 -1.601 1.00 0.00 H new ATOM 0 HE2 LYS A 37 13.979 13.069 -2.316 1.00 0.00 H new ATOM 0 HE3 LYS A 37 13.396 12.022 -3.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 14.262 14.203 -4.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 12.674 13.881 -4.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 12.953 14.955 -3.564 1.00 0.00 H new ATOM 577 N PRO A 38 6.736 10.354 -4.052 1.00 0.00 N ATOM 578 CA PRO A 38 6.154 9.063 -3.735 1.00 0.00 C ATOM 579 C PRO A 38 7.280 8.047 -3.547 1.00 0.00 C ATOM 580 O PRO A 38 7.763 7.426 -4.499 1.00 0.00 O ATOM 581 CB PRO A 38 5.194 8.722 -4.882 1.00 0.00 C ATOM 582 CG PRO A 38 5.081 10.036 -5.653 1.00 0.00 C ATOM 583 CD PRO A 38 6.428 10.713 -5.420 1.00 0.00 C ATOM 0 HA PRO A 38 5.588 9.060 -2.803 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.586 7.921 -5.509 1.00 0.00 H new ATOM 0 HB3 PRO A 38 4.225 8.390 -4.509 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.899 9.863 -6.714 1.00 0.00 H new ATOM 0 HG3 PRO A 38 4.257 10.647 -5.284 1.00 0.00 H new ATOM 0 HD2 PRO A 38 7.187 10.352 -6.114 1.00 0.00 H new ATOM 0 HD3 PRO A 38 6.365 11.793 -5.550 1.00 0.00 H new ATOM 591 N THR A 39 7.713 7.895 -2.300 1.00 0.00 N ATOM 592 CA THR A 39 8.588 6.816 -1.897 1.00 0.00 C ATOM 593 C THR A 39 7.692 5.634 -1.519 1.00 0.00 C ATOM 594 O THR A 39 6.492 5.794 -1.295 1.00 0.00 O ATOM 595 CB THR A 39 9.479 7.317 -0.748 1.00 0.00 C ATOM 596 OG1 THR A 39 10.127 8.506 -1.150 1.00 0.00 O ATOM 597 CG2 THR A 39 10.598 6.340 -0.388 1.00 0.00 C ATOM 0 H THR A 39 7.461 8.526 -1.539 1.00 0.00 H new ATOM 0 HA THR A 39 9.262 6.485 -2.687 1.00 0.00 H new ATOM 0 HB THR A 39 8.820 7.450 0.110 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.695 8.831 -0.421 1.00 0.00 H new ATOM 0 HG21 THR A 39 11.191 6.751 0.429 1.00 0.00 H new ATOM 0 HG22 THR A 39 10.165 5.389 -0.079 1.00 0.00 H new ATOM 0 HG23 THR A 39 11.237 6.183 -1.257 1.00 0.00 H new ATOM 605 N THR A 40 8.259 4.434 -1.446 1.00 0.00 N ATOM 606 CA THR A 40 7.566 3.284 -0.897 1.00 0.00 C ATOM 607 C THR A 40 8.579 2.455 -0.125 1.00 0.00 C ATOM 608 O THR A 40 9.766 2.503 -0.436 1.00 0.00 O ATOM 609 CB THR A 40 6.853 2.523 -2.031 1.00 0.00 C ATOM 610 OG1 THR A 40 5.562 3.069 -2.190 1.00 0.00 O ATOM 611 CG2 THR A 40 6.691 1.022 -1.800 1.00 0.00 C ATOM 0 H THR A 40 9.207 4.236 -1.765 1.00 0.00 H new ATOM 0 HA THR A 40 6.780 3.569 -0.197 1.00 0.00 H new ATOM 0 HB THR A 40 7.487 2.639 -2.910 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.018 2.857 -1.403 1.00 0.00 H new ATOM 0 HG21 THR A 40 6.178 0.576 -2.652 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.673 0.563 -1.687 1.00 0.00 H new ATOM 0 HG23 THR A 40 6.106 0.854 -0.896 1.00 0.00 H new ATOM 619 N ILE A 41 8.117 1.719 0.887 1.00 0.00 N ATOM 620 CA ILE A 41 8.926 0.753 1.612 1.00 0.00 C ATOM 621 C ILE A 41 8.119 -0.535 1.655 1.00 0.00 C ATOM 622 O ILE A 41 6.940 -0.493 2.018 1.00 0.00 O ATOM 623 CB ILE A 41 9.273 1.247 3.030 1.00 0.00 C ATOM 624 CG1 ILE A 41 9.854 2.671 3.006 1.00 0.00 C ATOM 625 CG2 ILE A 41 10.291 0.282 3.657 1.00 0.00 C ATOM 626 CD1 ILE A 41 10.185 3.212 4.400 1.00 0.00 C ATOM 0 H ILE A 41 7.157 1.782 1.226 1.00 0.00 H new ATOM 0 HA ILE A 41 9.883 0.600 1.113 1.00 0.00 H new ATOM 0 HB ILE A 41 8.358 1.273 3.622 1.00 0.00 H new ATOM 0 HG12 ILE A 41 10.758 2.677 2.397 1.00 0.00 H new ATOM 0 HG13 ILE A 41 9.140 3.339 2.524 1.00 0.00 H new ATOM 0 HG21 ILE A 41 10.544 0.622 4.661 1.00 0.00 H new ATOM 0 HG22 ILE A 41 9.860 -0.718 3.710 1.00 0.00 H new ATOM 0 HG23 ILE A 41 11.193 0.256 3.045 1.00 0.00 H new ATOM 0 HD11 ILE A 41 10.591 4.220 4.312 1.00 0.00 H new ATOM 0 HD12 ILE A 41 9.279 3.237 5.005 1.00 0.00 H new ATOM 0 HD13 ILE A 41 10.921 2.565 4.876 1.00 0.00 H new ATOM 638 N ILE A 42 8.736 -1.649 1.250 1.00 0.00 N ATOM 639 CA ILE A 42 8.215 -2.980 1.507 1.00 0.00 C ATOM 640 C ILE A 42 9.160 -3.655 2.493 1.00 0.00 C ATOM 641 O ILE A 42 10.355 -3.776 2.217 1.00 0.00 O ATOM 642 CB ILE A 42 8.082 -3.805 0.212 1.00 0.00 C ATOM 643 CG1 ILE A 42 6.798 -3.492 -0.569 1.00 0.00 C ATOM 644 CG2 ILE A 42 8.078 -5.309 0.529 1.00 0.00 C ATOM 645 CD1 ILE A 42 6.722 -2.036 -1.018 1.00 0.00 C ATOM 0 H ILE A 42 9.615 -1.645 0.733 1.00 0.00 H new ATOM 0 HA ILE A 42 7.210 -2.910 1.923 1.00 0.00 H new ATOM 0 HB ILE A 42 8.941 -3.532 -0.401 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.742 -4.141 -1.443 1.00 0.00 H new ATOM 0 HG13 ILE A 42 5.934 -3.721 0.054 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.983 -5.876 -0.397 1.00 0.00 H new ATOM 0 HG22 ILE A 42 9.010 -5.579 1.026 1.00 0.00 H new ATOM 0 HG23 ILE A 42 7.238 -5.541 1.184 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.794 -1.872 -1.565 1.00 0.00 H new ATOM 0 HD12 ILE A 42 6.749 -1.384 -0.145 1.00 0.00 H new ATOM 0 HD13 ILE A 42 7.569 -1.810 -1.665 1.00 0.00 H new ATOM 657 N GLU A 43 8.603 -4.143 3.602 1.00 0.00 N ATOM 658 CA GLU A 43 9.296 -5.003 4.543 1.00 0.00 C ATOM 659 C GLU A 43 8.726 -6.414 4.420 1.00 0.00 C ATOM 660 O GLU A 43 7.508 -6.602 4.489 1.00 0.00 O ATOM 661 CB GLU A 43 9.136 -4.454 5.964 1.00 0.00 C ATOM 662 CG GLU A 43 9.772 -3.060 6.091 1.00 0.00 C ATOM 663 CD GLU A 43 8.736 -1.991 6.392 1.00 0.00 C ATOM 664 OE1 GLU A 43 8.367 -1.833 7.577 1.00 0.00 O ATOM 665 OE2 GLU A 43 8.299 -1.285 5.454 1.00 0.00 O ATOM 0 H GLU A 43 7.639 -3.944 3.870 1.00 0.00 H new ATOM 0 HA GLU A 43 10.363 -5.033 4.321 1.00 0.00 H new ATOM 0 HB2 GLU A 43 8.078 -4.399 6.220 1.00 0.00 H new ATOM 0 HB3 GLU A 43 9.601 -5.136 6.676 1.00 0.00 H new ATOM 0 HG2 GLU A 43 10.521 -3.073 6.883 1.00 0.00 H new ATOM 0 HG3 GLU A 43 10.291 -2.812 5.165 1.00 0.00 H new ATOM 672 N VAL A 44 9.607 -7.403 4.241 1.00 0.00 N ATOM 673 CA VAL A 44 9.254 -8.814 4.289 1.00 0.00 C ATOM 674 C VAL A 44 8.948 -9.186 5.744 1.00 0.00 C ATOM 675 O VAL A 44 9.762 -9.777 6.448 1.00 0.00 O ATOM 676 CB VAL A 44 10.343 -9.665 3.600 1.00 0.00 C ATOM 677 CG1 VAL A 44 11.760 -9.531 4.185 1.00 0.00 C ATOM 678 CG2 VAL A 44 9.952 -11.147 3.550 1.00 0.00 C ATOM 0 H VAL A 44 10.597 -7.238 4.057 1.00 0.00 H new ATOM 0 HA VAL A 44 8.349 -9.027 3.720 1.00 0.00 H new ATOM 0 HB VAL A 44 10.393 -9.249 2.594 1.00 0.00 H new ATOM 0 HG11 VAL A 44 12.445 -10.170 3.628 1.00 0.00 H new ATOM 0 HG12 VAL A 44 12.088 -8.494 4.110 1.00 0.00 H new ATOM 0 HG13 VAL A 44 11.751 -9.834 5.232 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.742 -11.715 3.058 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.813 -11.521 4.564 1.00 0.00 H new ATOM 0 HG23 VAL A 44 9.023 -11.259 2.992 1.00 0.00 H new ATOM 688 N ASN A 45 7.774 -8.766 6.214 1.00 0.00 N ATOM 689 CA ASN A 45 7.326 -9.043 7.569 1.00 0.00 C ATOM 690 C ASN A 45 7.265 -10.556 7.816 1.00 0.00 C ATOM 691 O ASN A 45 7.096 -11.329 6.878 1.00 0.00 O ATOM 692 CB ASN A 45 5.972 -8.374 7.808 1.00 0.00 C ATOM 693 CG ASN A 45 5.529 -8.528 9.260 1.00 0.00 C ATOM 694 OD1 ASN A 45 6.359 -8.579 10.165 1.00 0.00 O ATOM 695 ND2 ASN A 45 4.228 -8.624 9.499 1.00 0.00 N ATOM 0 H ASN A 45 7.110 -8.224 5.662 1.00 0.00 H new ATOM 0 HA ASN A 45 8.040 -8.629 8.280 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.037 -7.316 7.555 1.00 0.00 H new ATOM 0 HB3 ASN A 45 5.224 -8.814 7.148 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.893 -8.744 10.455 1.00 0.00 H new ATOM 0 HD22 ASN A 45 3.563 -8.578 8.727 1.00 0.00 H new ATOM 702 N GLY A 46 7.415 -10.983 9.072 1.00 0.00 N ATOM 703 CA GLY A 46 7.653 -12.375 9.447 1.00 0.00 C ATOM 704 C GLY A 46 6.853 -13.391 8.631 1.00 0.00 C ATOM 705 O GLY A 46 7.417 -14.340 8.086 1.00 0.00 O ATOM 0 H GLY A 46 7.373 -10.354 9.874 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.715 -12.593 9.336 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.410 -12.502 10.502 1.00 0.00 H new ATOM 709 N ASP A 47 5.537 -13.191 8.555 1.00 0.00 N ATOM 710 CA ASP A 47 4.592 -14.051 7.868 1.00 0.00 C ATOM 711 C ASP A 47 3.990 -13.372 6.634 1.00 0.00 C ATOM 712 O ASP A 47 3.161 -13.987 5.969 1.00 0.00 O ATOM 713 CB ASP A 47 3.470 -14.395 8.860 1.00 0.00 C ATOM 714 CG ASP A 47 2.651 -13.166 9.245 1.00 0.00 C ATOM 715 OD1 ASP A 47 3.242 -12.060 9.230 1.00 0.00 O ATOM 716 OD2 ASP A 47 1.449 -13.347 9.523 1.00 0.00 O ATOM 0 H ASP A 47 5.087 -12.387 8.993 1.00 0.00 H new ATOM 0 HA ASP A 47 5.111 -14.945 7.523 1.00 0.00 H new ATOM 0 HB2 ASP A 47 2.813 -15.145 8.419 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.902 -14.838 9.757 1.00 0.00 H new ATOM 721 N THR A 48 4.368 -12.135 6.307 1.00 0.00 N ATOM 722 CA THR A 48 3.610 -11.266 5.413 1.00 0.00 C ATOM 723 C THR A 48 4.571 -10.361 4.628 1.00 0.00 C ATOM 724 O THR A 48 5.785 -10.531 4.657 1.00 0.00 O ATOM 725 CB THR A 48 2.573 -10.459 6.237 1.00 0.00 C ATOM 726 OG1 THR A 48 3.100 -10.069 7.492 1.00 0.00 O ATOM 727 CG2 THR A 48 1.255 -11.216 6.445 1.00 0.00 C ATOM 0 H THR A 48 5.222 -11.705 6.662 1.00 0.00 H new ATOM 0 HA THR A 48 3.060 -11.859 4.683 1.00 0.00 H new ATOM 0 HB THR A 48 2.354 -9.570 5.646 1.00 0.00 H new ATOM 0 HG1 THR A 48 2.995 -10.803 8.133 1.00 0.00 H new ATOM 0 HG21 THR A 48 0.570 -10.600 7.028 1.00 0.00 H new ATOM 0 HG22 THR A 48 0.807 -11.440 5.477 1.00 0.00 H new ATOM 0 HG23 THR A 48 1.450 -12.146 6.978 1.00 0.00 H new ATOM 735 N VAL A 49 4.026 -9.394 3.901 1.00 0.00 N ATOM 736 CA VAL A 49 4.730 -8.278 3.311 1.00 0.00 C ATOM 737 C VAL A 49 3.977 -7.045 3.801 1.00 0.00 C ATOM 738 O VAL A 49 2.748 -7.025 3.719 1.00 0.00 O ATOM 739 CB VAL A 49 4.715 -8.448 1.779 1.00 0.00 C ATOM 740 CG1 VAL A 49 4.658 -7.121 1.013 1.00 0.00 C ATOM 741 CG2 VAL A 49 5.958 -9.228 1.337 1.00 0.00 C ATOM 0 H VAL A 49 3.026 -9.372 3.700 1.00 0.00 H new ATOM 0 HA VAL A 49 5.780 -8.199 3.591 1.00 0.00 H new ATOM 0 HB VAL A 49 3.802 -8.992 1.539 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.650 -7.320 -0.059 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.752 -6.581 1.288 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.531 -6.518 1.264 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.946 -9.348 0.254 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.854 -8.682 1.632 1.00 0.00 H new ATOM 0 HG23 VAL A 49 5.959 -10.210 1.810 1.00 0.00 H new ATOM 751 N ILE A 50 4.698 -6.051 4.328 1.00 0.00 N ATOM 752 CA ILE A 50 4.172 -4.708 4.547 1.00 0.00 C ATOM 753 C ILE A 50 4.381 -3.924 3.251 1.00 0.00 C ATOM 754 O ILE A 50 5.329 -4.204 2.519 1.00 0.00 O ATOM 755 CB ILE A 50 4.833 -4.054 5.787 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.803 -4.000 6.929 1.00 0.00 C ATOM 757 CG2 ILE A 50 5.392 -2.648 5.521 1.00 0.00 C ATOM 758 CD1 ILE A 50 4.357 -3.445 8.245 1.00 0.00 C ATOM 0 H ILE A 50 5.670 -6.161 4.616 1.00 0.00 H new ATOM 0 HA ILE A 50 3.106 -4.724 4.775 1.00 0.00 H new ATOM 0 HB ILE A 50 5.689 -4.672 6.057 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.960 -3.385 6.614 1.00 0.00 H new ATOM 0 HG13 ILE A 50 3.418 -5.004 7.104 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.839 -2.255 6.434 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.150 -2.700 4.740 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.584 -1.990 5.200 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.569 -3.440 8.998 1.00 0.00 H new ATOM 0 HD12 ILE A 50 5.181 -4.072 8.586 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.716 -2.428 8.089 1.00 0.00 H new ATOM 770 N ILE A 51 3.510 -2.956 2.965 1.00 0.00 N ATOM 771 CA ILE A 51 3.622 -2.044 1.836 1.00 0.00 C ATOM 772 C ILE A 51 3.266 -0.644 2.354 1.00 0.00 C ATOM 773 O ILE A 51 2.162 -0.441 2.860 1.00 0.00 O ATOM 774 CB ILE A 51 2.735 -2.563 0.678 1.00 0.00 C ATOM 775 CG1 ILE A 51 3.043 -1.954 -0.700 1.00 0.00 C ATOM 776 CG2 ILE A 51 1.230 -2.493 0.959 1.00 0.00 C ATOM 777 CD1 ILE A 51 2.991 -0.428 -0.786 1.00 0.00 C ATOM 0 H ILE A 51 2.681 -2.783 3.534 1.00 0.00 H new ATOM 0 HA ILE A 51 4.628 -1.988 1.419 1.00 0.00 H new ATOM 0 HB ILE A 51 3.018 -3.615 0.630 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.037 -2.282 -1.006 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.336 -2.363 -1.422 1.00 0.00 H new ATOM 0 HG21 ILE A 51 0.681 -2.875 0.098 1.00 0.00 H new ATOM 0 HG22 ILE A 51 0.995 -3.096 1.836 1.00 0.00 H new ATOM 0 HG23 ILE A 51 0.942 -1.458 1.143 1.00 0.00 H new ATOM 0 HD11 ILE A 51 3.225 -0.113 -1.803 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.992 -0.082 -0.519 1.00 0.00 H new ATOM 0 HD13 ILE A 51 3.719 0.000 -0.097 1.00 0.00 H new ATOM 789 N LYS A 52 4.208 0.304 2.279 1.00 0.00 N ATOM 790 CA LYS A 52 3.979 1.705 2.620 1.00 0.00 C ATOM 791 C LYS A 52 3.964 2.552 1.345 1.00 0.00 C ATOM 792 O LYS A 52 4.876 2.447 0.524 1.00 0.00 O ATOM 793 CB LYS A 52 5.056 2.200 3.595 1.00 0.00 C ATOM 794 CG LYS A 52 5.254 1.221 4.761 1.00 0.00 C ATOM 795 CD LYS A 52 5.631 1.969 6.046 1.00 0.00 C ATOM 796 CE LYS A 52 5.895 0.985 7.193 1.00 0.00 C ATOM 797 NZ LYS A 52 7.243 0.398 7.103 1.00 0.00 N ATOM 0 H LYS A 52 5.163 0.112 1.975 1.00 0.00 H new ATOM 0 HA LYS A 52 3.011 1.801 3.112 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.998 2.328 3.063 1.00 0.00 H new ATOM 0 HB3 LYS A 52 4.774 3.178 3.984 1.00 0.00 H new ATOM 0 HG2 LYS A 52 4.339 0.651 4.922 1.00 0.00 H new ATOM 0 HG3 LYS A 52 6.036 0.504 4.510 1.00 0.00 H new ATOM 0 HD2 LYS A 52 6.519 2.577 5.871 1.00 0.00 H new ATOM 0 HD3 LYS A 52 4.827 2.651 6.324 1.00 0.00 H new ATOM 0 HE2 LYS A 52 5.784 1.500 8.148 1.00 0.00 H new ATOM 0 HE3 LYS A 52 5.149 0.190 7.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 7.312 -0.414 7.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 7.419 0.080 6.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 7.951 1.112 7.367 1.00 0.00 H new ATOM 811 N THR A 53 2.956 3.407 1.176 1.00 0.00 N ATOM 812 CA THR A 53 2.757 4.253 0.002 1.00 0.00 C ATOM 813 C THR A 53 3.268 5.685 0.252 1.00 0.00 C ATOM 814 O THR A 53 2.764 6.636 -0.350 1.00 0.00 O ATOM 815 CB THR A 53 1.254 4.198 -0.339 1.00 0.00 C ATOM 816 OG1 THR A 53 0.512 3.882 0.824 1.00 0.00 O ATOM 817 CG2 THR A 53 0.980 3.086 -1.351 1.00 0.00 C ATOM 0 H THR A 53 2.229 3.533 1.880 1.00 0.00 H new ATOM 0 HA THR A 53 3.336 3.894 -0.849 1.00 0.00 H new ATOM 0 HB THR A 53 0.967 5.169 -0.743 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.577 4.621 1.465 1.00 0.00 H new ATOM 0 HG21 THR A 53 -0.085 3.059 -1.582 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.545 3.277 -2.263 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.284 2.128 -0.930 1.00 0.00 H new ATOM 825 N GLN A 54 4.257 5.827 1.147 1.00 0.00 N ATOM 826 CA GLN A 54 4.733 7.091 1.702 1.00 0.00 C ATOM 827 C GLN A 54 5.039 8.167 0.646 1.00 0.00 C ATOM 828 O GLN A 54 6.125 8.241 0.071 1.00 0.00 O ATOM 829 CB GLN A 54 5.885 6.855 2.688 1.00 0.00 C ATOM 830 CG GLN A 54 6.978 5.916 2.166 1.00 0.00 C ATOM 831 CD GLN A 54 8.232 5.991 3.025 1.00 0.00 C ATOM 832 OE1 GLN A 54 9.337 6.110 2.508 1.00 0.00 O ATOM 833 NE2 GLN A 54 8.079 5.925 4.343 1.00 0.00 N ATOM 0 H GLN A 54 4.766 5.024 1.517 1.00 0.00 H new ATOM 0 HA GLN A 54 3.903 7.517 2.266 1.00 0.00 H new ATOM 0 HB2 GLN A 54 6.336 7.815 2.938 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.479 6.443 3.612 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.605 4.892 2.154 1.00 0.00 H new ATOM 0 HG3 GLN A 54 7.224 6.178 1.137 1.00 0.00 H new ATOM 0 HE21 GLN A 54 7.146 5.826 4.744 1.00 0.00 H new ATOM 0 HE22 GLN A 54 8.894 5.973 4.954 1.00 0.00 H new ATOM 842 N SER A 55 4.058 9.048 0.466 1.00 0.00 N ATOM 843 CA SER A 55 4.030 10.184 -0.425 1.00 0.00 C ATOM 844 C SER A 55 3.378 11.292 0.392 1.00 0.00 C ATOM 845 O SER A 55 2.296 11.073 0.938 1.00 0.00 O ATOM 846 CB SER A 55 3.186 9.832 -1.660 1.00 0.00 C ATOM 847 OG SER A 55 3.500 10.649 -2.772 1.00 0.00 O ATOM 0 H SER A 55 3.188 8.969 0.992 1.00 0.00 H new ATOM 0 HA SER A 55 5.015 10.481 -0.785 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.347 8.786 -1.922 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.129 9.941 -1.418 1.00 0.00 H new ATOM 0 HG SER A 55 3.208 11.568 -2.596 1.00 0.00 H new ATOM 853 N THR A 56 4.047 12.443 0.473 1.00 0.00 N ATOM 854 CA THR A 56 3.638 13.635 1.206 1.00 0.00 C ATOM 855 C THR A 56 3.349 13.405 2.696 1.00 0.00 C ATOM 856 O THR A 56 3.629 12.348 3.256 1.00 0.00 O ATOM 857 CB THR A 56 2.531 14.397 0.454 1.00 0.00 C ATOM 858 OG1 THR A 56 2.504 15.741 0.892 1.00 0.00 O ATOM 859 CG2 THR A 56 1.109 13.833 0.582 1.00 0.00 C ATOM 0 H THR A 56 4.941 12.572 -0.000 1.00 0.00 H new ATOM 0 HA THR A 56 4.508 14.291 1.234 1.00 0.00 H new ATOM 0 HB THR A 56 2.801 14.292 -0.597 1.00 0.00 H new ATOM 0 HG1 THR A 56 1.801 16.227 0.413 1.00 0.00 H new ATOM 0 HG21 THR A 56 0.419 14.453 0.010 1.00 0.00 H new ATOM 0 HG22 THR A 56 1.086 12.814 0.196 1.00 0.00 H new ATOM 0 HG23 THR A 56 0.811 13.831 1.631 1.00 0.00 H new ATOM 867 N PHE A 57 2.809 14.440 3.344 1.00 0.00 N ATOM 868 CA PHE A 57 2.636 14.535 4.791 1.00 0.00 C ATOM 869 C PHE A 57 1.361 13.841 5.283 1.00 0.00 C ATOM 870 O PHE A 57 0.881 14.137 6.376 1.00 0.00 O ATOM 871 CB PHE A 57 2.649 16.019 5.195 1.00 0.00 C ATOM 872 CG PHE A 57 1.573 16.873 4.544 1.00 0.00 C ATOM 873 CD1 PHE A 57 0.312 17.014 5.155 1.00 0.00 C ATOM 874 CD2 PHE A 57 1.838 17.553 3.343 1.00 0.00 C ATOM 875 CE1 PHE A 57 -0.687 17.788 4.545 1.00 0.00 C ATOM 876 CE2 PHE A 57 0.828 18.302 2.715 1.00 0.00 C ATOM 877 CZ PHE A 57 -0.435 18.421 3.315 1.00 0.00 C ATOM 0 H PHE A 57 2.468 15.266 2.853 1.00 0.00 H new ATOM 0 HA PHE A 57 3.463 14.010 5.269 1.00 0.00 H new ATOM 0 HB2 PHE A 57 2.539 16.086 6.277 1.00 0.00 H new ATOM 0 HB3 PHE A 57 3.624 16.439 4.947 1.00 0.00 H new ATOM 0 HD1 PHE A 57 0.113 16.524 6.097 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.822 17.500 2.901 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -1.650 17.898 5.021 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.024 18.786 1.770 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.211 18.997 2.833 1.00 0.00 H new ATOM 887 N LYS A 58 0.787 12.940 4.484 1.00 0.00 N ATOM 888 CA LYS A 58 -0.501 12.326 4.757 1.00 0.00 C ATOM 889 C LYS A 58 -0.537 11.040 3.937 1.00 0.00 C ATOM 890 O LYS A 58 -0.451 11.106 2.712 1.00 0.00 O ATOM 891 CB LYS A 58 -1.610 13.307 4.340 1.00 0.00 C ATOM 892 CG LYS A 58 -2.969 12.974 4.968 1.00 0.00 C ATOM 893 CD LYS A 58 -4.125 13.707 4.267 1.00 0.00 C ATOM 894 CE LYS A 58 -3.912 15.231 4.193 1.00 0.00 C ATOM 895 NZ LYS A 58 -4.986 15.921 3.447 1.00 0.00 N ATOM 0 H LYS A 58 1.216 12.615 3.617 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.651 12.096 5.812 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -1.321 14.318 4.627 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -1.706 13.299 3.254 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -3.138 11.898 4.916 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.956 13.244 6.024 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.240 13.312 3.258 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -5.054 13.501 4.798 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.859 15.636 5.204 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.954 15.437 3.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.951 16.940 3.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.854 15.767 2.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.910 15.542 3.738 1.00 0.00 H new ATOM 909 N ASN A 59 -0.588 9.875 4.589 1.00 0.00 N ATOM 910 CA ASN A 59 -0.395 8.608 3.901 1.00 0.00 C ATOM 911 C ASN A 59 -0.854 7.440 4.775 1.00 0.00 C ATOM 912 O ASN A 59 -1.367 7.674 5.869 1.00 0.00 O ATOM 913 CB ASN A 59 1.078 8.466 3.502 1.00 0.00 C ATOM 914 CG ASN A 59 1.166 7.713 2.190 1.00 0.00 C ATOM 915 OD1 ASN A 59 1.185 6.491 2.182 1.00 0.00 O ATOM 916 ND2 ASN A 59 1.219 8.428 1.073 1.00 0.00 N ATOM 0 H ASN A 59 -0.761 9.789 5.591 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.004 8.591 2.997 1.00 0.00 H new ATOM 0 HB2 ASN A 59 1.537 9.450 3.403 1.00 0.00 H new ATOM 0 HB3 ASN A 59 1.628 7.934 4.278 1.00 0.00 H new ATOM 0 HD21 ASN A 59 1.278 7.959 0.169 1.00 0.00 H new ATOM 0 HD22 ASN A 59 1.201 9.447 1.118 1.00 0.00 H new ATOM 923 N THR A 60 -0.675 6.205 4.300 1.00 0.00 N ATOM 924 CA THR A 60 -1.132 4.981 4.942 1.00 0.00 C ATOM 925 C THR A 60 -0.077 3.889 4.725 1.00 0.00 C ATOM 926 O THR A 60 0.877 4.074 3.967 1.00 0.00 O ATOM 927 CB THR A 60 -2.503 4.580 4.356 1.00 0.00 C ATOM 928 OG1 THR A 60 -2.490 4.684 2.944 1.00 0.00 O ATOM 929 CG2 THR A 60 -3.622 5.471 4.910 1.00 0.00 C ATOM 0 H THR A 60 -0.187 6.029 3.422 1.00 0.00 H new ATOM 0 HA THR A 60 -1.259 5.127 6.015 1.00 0.00 H new ATOM 0 HB THR A 60 -2.693 3.547 4.646 1.00 0.00 H new ATOM 0 HG1 THR A 60 -3.280 4.236 2.576 1.00 0.00 H new ATOM 0 HG21 THR A 60 -4.576 5.166 4.480 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.664 5.371 5.995 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.422 6.510 4.649 1.00 0.00 H new ATOM 937 N GLU A 61 -0.240 2.748 5.399 1.00 0.00 N ATOM 938 CA GLU A 61 0.535 1.550 5.150 1.00 0.00 C ATOM 939 C GLU A 61 -0.390 0.353 5.338 1.00 0.00 C ATOM 940 O GLU A 61 -1.369 0.439 6.081 1.00 0.00 O ATOM 941 CB GLU A 61 1.779 1.498 6.044 1.00 0.00 C ATOM 942 CG GLU A 61 1.513 1.724 7.538 1.00 0.00 C ATOM 943 CD GLU A 61 2.818 1.619 8.315 1.00 0.00 C ATOM 944 OE1 GLU A 61 3.183 0.482 8.670 1.00 0.00 O ATOM 945 OE2 GLU A 61 3.473 2.675 8.474 1.00 0.00 O ATOM 0 H GLU A 61 -0.928 2.638 6.144 1.00 0.00 H new ATOM 0 HA GLU A 61 0.919 1.541 4.130 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.258 0.527 5.918 1.00 0.00 H new ATOM 0 HB3 GLU A 61 2.488 2.250 5.699 1.00 0.00 H new ATOM 0 HG2 GLU A 61 1.065 2.705 7.693 1.00 0.00 H new ATOM 0 HG3 GLU A 61 0.800 0.986 7.906 1.00 0.00 H new ATOM 952 N ILE A 62 -0.110 -0.724 4.608 1.00 0.00 N ATOM 953 CA ILE A 62 -0.950 -1.905 4.476 1.00 0.00 C ATOM 954 C ILE A 62 -0.028 -3.117 4.632 1.00 0.00 C ATOM 955 O ILE A 62 1.193 -2.980 4.534 1.00 0.00 O ATOM 956 CB ILE A 62 -1.642 -1.829 3.095 1.00 0.00 C ATOM 957 CG1 ILE A 62 -2.791 -0.803 3.126 1.00 0.00 C ATOM 958 CG2 ILE A 62 -2.160 -3.179 2.580 1.00 0.00 C ATOM 959 CD1 ILE A 62 -3.170 -0.302 1.729 1.00 0.00 C ATOM 0 H ILE A 62 0.752 -0.797 4.067 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.736 -1.979 5.228 1.00 0.00 H new ATOM 0 HB ILE A 62 -0.870 -1.510 2.394 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.665 -1.255 3.595 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -2.499 0.045 3.746 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -2.632 -3.041 1.607 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -1.327 -3.876 2.484 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -2.890 -3.581 3.283 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.984 0.418 1.809 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.306 0.177 1.267 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.490 -1.144 1.115 1.00 0.00 H new ATOM 971 N SER A 63 -0.586 -4.307 4.866 1.00 0.00 N ATOM 972 CA SER A 63 0.161 -5.552 4.843 1.00 0.00 C ATOM 973 C SER A 63 -0.671 -6.631 4.157 1.00 0.00 C ATOM 974 O SER A 63 -1.879 -6.464 4.006 1.00 0.00 O ATOM 975 CB SER A 63 0.555 -5.942 6.270 1.00 0.00 C ATOM 976 OG SER A 63 -0.597 -6.102 7.077 1.00 0.00 O ATOM 0 H SER A 63 -1.577 -4.427 5.078 1.00 0.00 H new ATOM 0 HA SER A 63 1.081 -5.432 4.272 1.00 0.00 H new ATOM 0 HB2 SER A 63 1.127 -6.870 6.255 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.202 -5.176 6.697 1.00 0.00 H new ATOM 0 HG SER A 63 -0.328 -6.353 7.985 1.00 0.00 H new ATOM 982 N PHE A 64 -0.031 -7.718 3.715 1.00 0.00 N ATOM 983 CA PHE A 64 -0.707 -8.844 3.084 1.00 0.00 C ATOM 984 C PHE A 64 0.202 -10.068 3.085 1.00 0.00 C ATOM 985 O PHE A 64 1.402 -9.939 3.316 1.00 0.00 O ATOM 986 CB PHE A 64 -1.124 -8.474 1.653 1.00 0.00 C ATOM 987 CG PHE A 64 -0.067 -7.813 0.784 1.00 0.00 C ATOM 988 CD1 PHE A 64 1.028 -8.555 0.305 1.00 0.00 C ATOM 989 CD2 PHE A 64 -0.281 -6.505 0.308 1.00 0.00 C ATOM 990 CE1 PHE A 64 1.870 -8.014 -0.679 1.00 0.00 C ATOM 991 CE2 PHE A 64 0.545 -5.976 -0.696 1.00 0.00 C ATOM 992 CZ PHE A 64 1.605 -6.741 -1.208 1.00 0.00 C ATOM 0 H PHE A 64 0.979 -7.837 3.788 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.606 -9.084 3.652 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.459 -9.382 1.151 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.983 -7.806 1.711 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.221 -9.543 0.695 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -1.083 -5.908 0.716 1.00 0.00 H new ATOM 0 HE1 PHE A 64 2.722 -8.577 -1.029 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.365 -4.981 -1.075 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.216 -6.350 -2.008 1.00 0.00 H new ATOM 1002 N LYS A 65 -0.352 -11.245 2.778 1.00 0.00 N ATOM 1003 CA LYS A 65 0.411 -12.442 2.453 1.00 0.00 C ATOM 1004 C LYS A 65 0.229 -12.712 0.962 1.00 0.00 C ATOM 1005 O LYS A 65 -0.896 -12.750 0.469 1.00 0.00 O ATOM 1006 CB LYS A 65 -0.085 -13.637 3.287 1.00 0.00 C ATOM 1007 CG LYS A 65 0.580 -14.981 2.926 1.00 0.00 C ATOM 1008 CD LYS A 65 1.973 -15.083 3.545 1.00 0.00 C ATOM 1009 CE LYS A 65 2.815 -16.224 2.965 1.00 0.00 C ATOM 1010 NZ LYS A 65 4.130 -16.296 3.636 1.00 0.00 N ATOM 0 H LYS A 65 -1.361 -11.389 2.749 1.00 0.00 H new ATOM 0 HA LYS A 65 1.466 -12.299 2.685 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.093 -13.428 4.342 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.163 -13.732 3.159 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -0.040 -15.805 3.279 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.651 -15.077 1.843 1.00 0.00 H new ATOM 0 HD2 LYS A 65 2.499 -14.140 3.394 1.00 0.00 H new ATOM 0 HD3 LYS A 65 1.875 -15.225 4.621 1.00 0.00 H new ATOM 0 HE2 LYS A 65 2.287 -17.170 3.086 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.955 -16.072 1.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.685 -17.075 3.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 4.639 -15.400 3.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.992 -16.464 4.653 1.00 0.00 H new ATOM 1024 N LEU A 66 1.337 -12.943 0.257 1.00 0.00 N ATOM 1025 CA LEU A 66 1.332 -13.507 -1.084 1.00 0.00 C ATOM 1026 C LEU A 66 0.735 -14.922 -1.055 1.00 0.00 C ATOM 1027 O LEU A 66 1.468 -15.904 -0.976 1.00 0.00 O ATOM 1028 CB LEU A 66 2.754 -13.478 -1.675 1.00 0.00 C ATOM 1029 CG LEU A 66 3.841 -13.995 -0.707 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.778 -14.991 -1.389 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.694 -12.836 -0.185 1.00 0.00 C ATOM 0 H LEU A 66 2.272 -12.740 0.610 1.00 0.00 H new ATOM 0 HA LEU A 66 0.701 -12.904 -1.737 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.773 -14.081 -2.583 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.996 -12.456 -1.966 1.00 0.00 H new ATOM 0 HG LEU A 66 3.318 -14.488 0.113 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.529 -15.332 -0.676 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.203 -15.845 -1.747 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.272 -14.508 -2.232 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.454 -13.221 0.495 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.178 -12.334 -1.023 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.059 -12.126 0.345 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.594 -15.013 -1.118 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.353 -16.243 -1.312 1.00 0.00 C ATOM 1045 C GLY A 67 -2.536 -16.336 -0.348 1.00 0.00 C ATOM 1046 O GLY A 67 -2.764 -17.400 0.220 1.00 0.00 O ATOM 0 H GLY A 67 -1.195 -14.193 -1.031 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.716 -16.288 -2.339 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.697 -17.102 -1.167 1.00 0.00 H new ATOM 1050 N VAL A 68 -3.268 -15.234 -0.136 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.327 -15.136 0.871 1.00 0.00 C ATOM 1052 C VAL A 68 -5.343 -14.081 0.427 1.00 0.00 C ATOM 1053 O VAL A 68 -4.972 -13.133 -0.269 1.00 0.00 O ATOM 1054 CB VAL A 68 -3.710 -14.767 2.242 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -4.724 -14.416 3.341 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -2.855 -15.918 2.788 1.00 0.00 C ATOM 0 H VAL A 68 -3.137 -14.374 -0.669 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.837 -16.094 0.973 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.122 -13.876 2.024 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.193 -14.173 4.261 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -5.318 -13.558 3.027 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.381 -15.268 3.516 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.433 -15.633 3.752 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.476 -16.805 2.912 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.048 -16.135 2.089 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.601 -14.233 0.864 1.00 0.00 N ATOM 1067 CA GLU A 69 -7.604 -13.180 0.851 1.00 0.00 C ATOM 1068 C GLU A 69 -7.942 -12.765 2.285 1.00 0.00 C ATOM 1069 O GLU A 69 -8.000 -13.616 3.172 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.852 -13.613 0.074 1.00 0.00 C ATOM 1071 CG GLU A 69 -9.512 -14.909 0.557 1.00 0.00 C ATOM 1072 CD GLU A 69 -10.914 -15.009 -0.023 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -11.794 -14.313 0.530 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -11.081 -15.734 -1.025 1.00 0.00 O ATOM 0 H GLU A 69 -6.949 -15.114 1.243 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.196 -12.312 0.333 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.587 -12.810 0.125 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.582 -13.732 -0.975 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -8.917 -15.769 0.250 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.555 -14.924 1.646 1.00 0.00 H new ATOM 1081 N PHE A 70 -8.140 -11.467 2.529 1.00 0.00 N ATOM 1082 CA PHE A 70 -8.501 -10.941 3.842 1.00 0.00 C ATOM 1083 C PHE A 70 -9.099 -9.541 3.669 1.00 0.00 C ATOM 1084 O PHE A 70 -8.873 -8.913 2.635 1.00 0.00 O ATOM 1085 CB PHE A 70 -7.271 -10.924 4.765 1.00 0.00 C ATOM 1086 CG PHE A 70 -6.166 -9.984 4.319 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -5.372 -10.297 3.200 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -6.021 -8.732 4.944 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -4.512 -9.333 2.654 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -5.170 -7.763 4.391 1.00 0.00 C ATOM 1091 CZ PHE A 70 -4.440 -8.054 3.229 1.00 0.00 C ATOM 0 H PHE A 70 -8.053 -10.747 1.812 1.00 0.00 H new ATOM 0 HA PHE A 70 -9.247 -11.582 4.310 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -7.589 -10.641 5.769 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.867 -11.934 4.831 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -5.425 -11.282 2.761 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.566 -8.516 5.851 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.906 -9.574 1.793 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -5.077 -6.794 4.859 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.822 -7.293 2.776 1.00 0.00 H new ATOM 1101 N ASP A 71 -9.884 -9.066 4.647 1.00 0.00 N ATOM 1102 CA ASP A 71 -10.427 -7.709 4.626 1.00 0.00 C ATOM 1103 C ASP A 71 -9.290 -6.707 4.803 1.00 0.00 C ATOM 1104 O ASP A 71 -8.444 -6.891 5.676 1.00 0.00 O ATOM 1105 CB ASP A 71 -11.476 -7.499 5.726 1.00 0.00 C ATOM 1106 CG ASP A 71 -12.120 -6.115 5.620 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -11.468 -5.115 5.999 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -13.284 -6.080 5.157 1.00 0.00 O ATOM 0 H ASP A 71 -10.156 -9.610 5.466 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.918 -7.556 3.665 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -12.245 -8.268 5.650 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -11.008 -7.611 6.704 1.00 0.00 H new ATOM 1113 N GLU A 72 -9.283 -5.658 3.985 1.00 0.00 N ATOM 1114 CA GLU A 72 -8.424 -4.506 4.160 1.00 0.00 C ATOM 1115 C GLU A 72 -9.348 -3.306 4.355 1.00 0.00 C ATOM 1116 O GLU A 72 -10.291 -3.107 3.591 1.00 0.00 O ATOM 1117 CB GLU A 72 -7.481 -4.398 2.956 1.00 0.00 C ATOM 1118 CG GLU A 72 -6.704 -3.078 2.872 1.00 0.00 C ATOM 1119 CD GLU A 72 -5.779 -3.087 1.663 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -4.926 -4.001 1.620 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -5.964 -2.226 0.776 1.00 0.00 O ATOM 0 H GLU A 72 -9.889 -5.590 3.167 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.772 -4.574 5.031 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.769 -5.222 2.993 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -8.063 -4.521 2.043 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -7.400 -2.242 2.800 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -6.123 -2.931 3.782 1.00 0.00 H new ATOM 1128 N THR A 73 -9.086 -2.528 5.404 1.00 0.00 N ATOM 1129 CA THR A 73 -9.806 -1.317 5.748 1.00 0.00 C ATOM 1130 C THR A 73 -8.754 -0.209 5.831 1.00 0.00 C ATOM 1131 O THR A 73 -8.067 -0.127 6.848 1.00 0.00 O ATOM 1132 CB THR A 73 -10.528 -1.542 7.091 1.00 0.00 C ATOM 1133 OG1 THR A 73 -11.452 -2.619 7.050 1.00 0.00 O ATOM 1134 CG2 THR A 73 -11.330 -0.299 7.488 1.00 0.00 C ATOM 0 H THR A 73 -8.334 -2.739 6.060 1.00 0.00 H new ATOM 0 HA THR A 73 -10.566 -1.044 5.016 1.00 0.00 H new ATOM 0 HB THR A 73 -9.738 -1.765 7.808 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.021 -3.405 6.653 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.832 -0.478 8.439 1.00 0.00 H new ATOM 0 HG22 THR A 73 -10.656 0.552 7.588 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.073 -0.085 6.720 1.00 0.00 H new ATOM 1142 N THR A 74 -8.585 0.605 4.780 1.00 0.00 N ATOM 1143 CA THR A 74 -7.530 1.616 4.722 1.00 0.00 C ATOM 1144 C THR A 74 -8.118 3.010 4.496 1.00 0.00 C ATOM 1145 O THR A 74 -9.110 3.177 3.783 1.00 0.00 O ATOM 1146 CB THR A 74 -6.477 1.236 3.668 1.00 0.00 C ATOM 1147 OG1 THR A 74 -5.342 2.070 3.817 1.00 0.00 O ATOM 1148 CG2 THR A 74 -7.004 1.288 2.231 1.00 0.00 C ATOM 0 H THR A 74 -9.177 0.578 3.950 1.00 0.00 H new ATOM 0 HA THR A 74 -7.019 1.649 5.684 1.00 0.00 H new ATOM 0 HB THR A 74 -6.205 0.195 3.845 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.464 2.886 3.288 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.208 1.008 1.541 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.838 0.594 2.124 1.00 0.00 H new ATOM 0 HG23 THR A 74 -7.342 2.299 2.004 1.00 0.00 H new ATOM 1156 N ALA A 75 -7.490 4.031 5.088 1.00 0.00 N ATOM 1157 CA ALA A 75 -7.924 5.422 5.011 1.00 0.00 C ATOM 1158 C ALA A 75 -7.502 6.056 3.682 1.00 0.00 C ATOM 1159 O ALA A 75 -6.959 7.160 3.656 1.00 0.00 O ATOM 1160 CB ALA A 75 -7.374 6.193 6.217 1.00 0.00 C ATOM 0 H ALA A 75 -6.646 3.906 5.647 1.00 0.00 H new ATOM 0 HA ALA A 75 -9.013 5.465 5.044 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.697 7.233 6.162 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.749 5.745 7.137 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.285 6.150 6.210 1.00 0.00 H new ATOM 1166 N ASP A 76 -7.785 5.354 2.585 1.00 0.00 N ATOM 1167 CA ASP A 76 -7.551 5.780 1.218 1.00 0.00 C ATOM 1168 C ASP A 76 -8.494 4.964 0.329 1.00 0.00 C ATOM 1169 O ASP A 76 -9.599 5.422 0.048 1.00 0.00 O ATOM 1170 CB ASP A 76 -6.054 5.726 0.846 1.00 0.00 C ATOM 1171 CG ASP A 76 -5.410 4.360 1.006 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -4.934 4.051 2.119 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -5.446 3.622 0.001 1.00 0.00 O ATOM 0 H ASP A 76 -8.205 4.426 2.636 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.787 6.834 1.070 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -5.939 6.048 -0.189 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -5.514 6.442 1.465 1.00 0.00 H new ATOM 1178 N ASP A 77 -8.134 3.739 -0.060 1.00 0.00 N ATOM 1179 CA ASP A 77 -8.954 2.884 -0.906 1.00 0.00 C ATOM 1180 C ASP A 77 -10.142 2.238 -0.171 1.00 0.00 C ATOM 1181 O ASP A 77 -10.770 1.320 -0.696 1.00 0.00 O ATOM 1182 CB ASP A 77 -8.045 1.841 -1.570 1.00 0.00 C ATOM 1183 CG ASP A 77 -8.708 1.173 -2.761 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -9.457 1.877 -3.475 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -8.442 -0.031 -2.959 1.00 0.00 O ATOM 0 H ASP A 77 -7.249 3.311 0.211 1.00 0.00 H new ATOM 0 HA ASP A 77 -9.421 3.507 -1.668 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.121 2.321 -1.893 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -7.771 1.082 -0.837 1.00 0.00 H new ATOM 1190 N ARG A 78 -10.509 2.748 1.012 1.00 0.00 N ATOM 1191 CA ARG A 78 -11.764 2.456 1.697 1.00 0.00 C ATOM 1192 C ARG A 78 -11.687 1.062 2.336 1.00 0.00 C ATOM 1193 O ARG A 78 -10.611 0.642 2.763 1.00 0.00 O ATOM 1194 CB ARG A 78 -12.975 2.627 0.752 1.00 0.00 C ATOM 1195 CG ARG A 78 -12.976 3.929 -0.074 1.00 0.00 C ATOM 1196 CD ARG A 78 -13.738 3.780 -1.404 1.00 0.00 C ATOM 1197 NE ARG A 78 -12.933 3.075 -2.425 1.00 0.00 N ATOM 1198 CZ ARG A 78 -12.913 1.751 -2.677 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -13.842 0.940 -2.155 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -11.971 1.230 -3.460 1.00 0.00 N ATOM 0 H ARG A 78 -9.917 3.396 1.531 1.00 0.00 H new ATOM 0 HA ARG A 78 -11.917 3.177 2.500 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -13.005 1.780 0.067 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.888 2.590 1.346 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -13.428 4.728 0.513 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -11.948 4.227 -0.279 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -14.665 3.233 -1.232 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -14.014 4.766 -1.777 1.00 0.00 H new ATOM 0 HE ARG A 78 -12.325 3.655 -3.003 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -14.576 1.322 -1.559 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -13.816 -0.060 -2.354 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -11.260 1.833 -3.873 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -11.961 0.227 -3.647 1.00 0.00 H new ATOM 1214 N LYS A 79 -12.819 0.348 2.409 1.00 0.00 N ATOM 1215 CA LYS A 79 -12.842 -1.054 2.794 1.00 0.00 C ATOM 1216 C LYS A 79 -12.975 -1.922 1.549 1.00 0.00 C ATOM 1217 O LYS A 79 -13.767 -1.615 0.657 1.00 0.00 O ATOM 1218 CB LYS A 79 -13.956 -1.356 3.806 1.00 0.00 C ATOM 1219 CG LYS A 79 -13.573 -2.643 4.550 1.00 0.00 C ATOM 1220 CD LYS A 79 -14.572 -3.047 5.641 1.00 0.00 C ATOM 1221 CE LYS A 79 -15.820 -3.746 5.087 1.00 0.00 C ATOM 1222 NZ LYS A 79 -15.464 -4.970 4.343 1.00 0.00 N ATOM 0 H LYS A 79 -13.740 0.734 2.201 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.901 -1.287 3.293 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -14.071 -0.529 4.507 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -14.912 -1.478 3.297 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.487 -3.456 3.830 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.590 -2.512 5.001 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -14.077 -3.710 6.351 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.876 -2.158 6.194 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -16.492 -3.999 5.907 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -16.361 -3.064 4.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -16.081 -5.751 4.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -15.587 -4.805 3.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -14.473 -5.218 4.536 1.00 0.00 H new ATOM 1236 N VAL A 80 -12.196 -3.001 1.509 1.00 0.00 N ATOM 1237 CA VAL A 80 -12.051 -3.913 0.391 1.00 0.00 C ATOM 1238 C VAL A 80 -11.690 -5.288 0.969 1.00 0.00 C ATOM 1239 O VAL A 80 -11.457 -5.409 2.171 1.00 0.00 O ATOM 1240 CB VAL A 80 -10.936 -3.389 -0.540 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -11.101 -1.915 -0.936 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -9.574 -3.503 0.146 1.00 0.00 C ATOM 0 H VAL A 80 -11.619 -3.272 2.305 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.969 -3.990 -0.192 1.00 0.00 H new ATOM 0 HB VAL A 80 -11.005 -4.006 -1.436 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -10.280 -1.620 -1.590 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.048 -1.783 -1.460 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -11.092 -1.294 -0.040 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -8.798 -3.130 -0.522 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -9.578 -2.913 1.063 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -9.374 -4.547 0.387 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.590 -6.313 0.123 1.00 0.00 N ATOM 1253 CA LYS A 81 -10.791 -7.496 0.386 1.00 0.00 C ATOM 1254 C LYS A 81 -9.515 -7.385 -0.437 1.00 0.00 C ATOM 1255 O LYS A 81 -9.571 -7.124 -1.638 1.00 0.00 O ATOM 1256 CB LYS A 81 -11.528 -8.791 0.013 1.00 0.00 C ATOM 1257 CG LYS A 81 -12.314 -9.377 1.190 1.00 0.00 C ATOM 1258 CD LYS A 81 -12.729 -10.818 0.857 1.00 0.00 C ATOM 1259 CE LYS A 81 -13.324 -11.526 2.080 1.00 0.00 C ATOM 1260 NZ LYS A 81 -13.595 -12.952 1.800 1.00 0.00 N ATOM 0 H LYS A 81 -12.071 -6.339 -0.776 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.578 -7.546 1.454 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.211 -8.592 -0.813 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -10.806 -9.527 -0.341 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -11.704 -9.362 2.093 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.196 -8.770 1.391 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -13.460 -10.810 0.048 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.863 -11.374 0.499 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.635 -11.443 2.921 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -14.248 -11.030 2.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.534 -13.497 2.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.549 -13.052 1.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.894 -13.312 1.122 1.00 0.00 H new ATOM 1274 N SER A 82 -8.380 -7.627 0.208 1.00 0.00 N ATOM 1275 CA SER A 82 -7.102 -7.795 -0.447 1.00 0.00 C ATOM 1276 C SER A 82 -6.903 -9.278 -0.701 1.00 0.00 C ATOM 1277 O SER A 82 -6.698 -10.037 0.243 1.00 0.00 O ATOM 1278 CB SER A 82 -6.005 -7.222 0.446 1.00 0.00 C ATOM 1279 OG SER A 82 -5.886 -5.864 0.110 1.00 0.00 O ATOM 0 H SER A 82 -8.329 -7.713 1.223 1.00 0.00 H new ATOM 0 HA SER A 82 -7.065 -7.265 -1.398 1.00 0.00 H new ATOM 0 HB2 SER A 82 -6.261 -7.340 1.499 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.062 -7.745 0.286 1.00 0.00 H new ATOM 0 HG SER A 82 -5.324 -5.411 0.773 1.00 0.00 H new ATOM 1285 N ILE A 83 -6.973 -9.668 -1.974 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.704 -11.003 -2.471 1.00 0.00 C ATOM 1287 C ILE A 83 -5.331 -10.930 -3.133 1.00 0.00 C ATOM 1288 O ILE A 83 -5.200 -10.351 -4.211 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.816 -11.419 -3.454 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -9.205 -11.217 -2.817 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -7.580 -12.863 -3.922 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -10.354 -11.767 -3.665 1.00 0.00 C ATOM 0 H ILE A 83 -7.233 -9.022 -2.719 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.696 -11.757 -1.684 1.00 0.00 H new ATOM 0 HB ILE A 83 -7.785 -10.781 -4.337 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.221 -11.701 -1.840 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -9.367 -10.152 -2.648 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -8.368 -13.154 -4.617 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -6.613 -12.930 -4.421 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.591 -13.531 -3.061 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -11.300 -11.589 -3.154 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -10.364 -11.266 -4.633 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -10.217 -12.838 -3.813 1.00 0.00 H new ATOM 1304 N VAL A 84 -4.294 -11.445 -2.467 1.00 0.00 N ATOM 1305 CA VAL A 84 -2.920 -11.281 -2.921 1.00 0.00 C ATOM 1306 C VAL A 84 -2.276 -12.634 -3.192 1.00 0.00 C ATOM 1307 O VAL A 84 -2.461 -13.575 -2.417 1.00 0.00 O ATOM 1308 CB VAL A 84 -2.106 -10.446 -1.921 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -0.775 -10.033 -2.557 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -2.875 -9.186 -1.511 1.00 0.00 C ATOM 0 H VAL A 84 -4.387 -11.982 -1.605 1.00 0.00 H new ATOM 0 HA VAL A 84 -2.931 -10.732 -3.863 1.00 0.00 H new ATOM 0 HB VAL A 84 -1.925 -11.055 -1.035 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.200 -9.441 -1.845 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.209 -10.924 -2.828 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.967 -9.440 -3.451 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.279 -8.610 -0.803 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -3.076 -8.579 -2.394 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -3.818 -9.471 -1.045 1.00 0.00 H new ATOM 1320 N THR A 85 -1.502 -12.721 -4.280 1.00 0.00 N ATOM 1321 CA THR A 85 -0.721 -13.894 -4.646 1.00 0.00 C ATOM 1322 C THR A 85 0.496 -13.431 -5.452 1.00 0.00 C ATOM 1323 O THR A 85 0.459 -12.349 -6.038 1.00 0.00 O ATOM 1324 CB THR A 85 -1.601 -14.873 -5.444 1.00 0.00 C ATOM 1325 OG1 THR A 85 -2.854 -15.016 -4.815 1.00 0.00 O ATOM 1326 CG2 THR A 85 -0.992 -16.271 -5.509 1.00 0.00 C ATOM 0 H THR A 85 -1.403 -11.953 -4.944 1.00 0.00 H new ATOM 0 HA THR A 85 -0.371 -14.422 -3.759 1.00 0.00 H new ATOM 0 HB THR A 85 -1.690 -14.458 -6.448 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.409 -15.639 -5.329 1.00 0.00 H new ATOM 0 HG21 THR A 85 -1.647 -16.927 -6.082 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.016 -16.221 -5.993 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.877 -16.665 -4.499 1.00 0.00 H new ATOM 1334 N LEU A 86 1.570 -14.226 -5.478 1.00 0.00 N ATOM 1335 CA LEU A 86 2.659 -14.067 -6.427 1.00 0.00 C ATOM 1336 C LEU A 86 3.122 -15.463 -6.818 1.00 0.00 C ATOM 1337 O LEU A 86 3.098 -16.360 -5.974 1.00 0.00 O ATOM 1338 CB LEU A 86 3.784 -13.189 -5.847 1.00 0.00 C ATOM 1339 CG LEU A 86 4.974 -13.903 -5.182 1.00 0.00 C ATOM 1340 CD1 LEU A 86 5.941 -14.499 -6.222 1.00 0.00 C ATOM 1341 CD2 LEU A 86 5.743 -12.886 -4.330 1.00 0.00 C ATOM 0 H LEU A 86 1.702 -15.004 -4.831 1.00 0.00 H new ATOM 0 HA LEU A 86 2.329 -13.538 -7.321 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.173 -12.566 -6.653 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.341 -12.518 -5.111 1.00 0.00 H new ATOM 0 HG LEU A 86 4.582 -14.718 -4.574 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.766 -14.994 -5.710 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.410 -15.224 -6.839 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.332 -13.702 -6.854 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.590 -13.378 -3.852 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.104 -12.078 -4.966 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.082 -12.478 -3.565 1.00 0.00 H new ATOM 1353 N ASP A 87 3.530 -15.626 -8.075 1.00 0.00 N ATOM 1354 CA ASP A 87 4.093 -16.843 -8.637 1.00 0.00 C ATOM 1355 C ASP A 87 4.762 -16.450 -9.956 1.00 0.00 C ATOM 1356 O ASP A 87 5.223 -15.313 -10.077 1.00 0.00 O ATOM 1357 CB ASP A 87 3.023 -17.940 -8.774 1.00 0.00 C ATOM 1358 CG ASP A 87 2.030 -17.668 -9.892 1.00 0.00 C ATOM 1359 OD1 ASP A 87 1.092 -16.878 -9.659 1.00 0.00 O ATOM 1360 OD2 ASP A 87 2.279 -18.240 -10.976 1.00 0.00 O ATOM 0 H ASP A 87 3.472 -14.872 -8.760 1.00 0.00 H new ATOM 0 HA ASP A 87 4.843 -17.285 -7.981 1.00 0.00 H new ATOM 0 HB2 ASP A 87 3.513 -18.896 -8.956 1.00 0.00 H new ATOM 0 HB3 ASP A 87 2.483 -18.033 -7.831 1.00 0.00 H new ATOM 1365 N GLY A 88 4.767 -17.317 -10.970 1.00 0.00 N ATOM 1366 CA GLY A 88 5.300 -17.005 -12.288 1.00 0.00 C ATOM 1367 C GLY A 88 4.314 -16.150 -13.086 1.00 0.00 C ATOM 1368 O GLY A 88 4.038 -16.437 -14.249 1.00 0.00 O ATOM 0 H GLY A 88 4.396 -18.264 -10.894 1.00 0.00 H new ATOM 0 HA2 GLY A 88 6.247 -16.475 -12.186 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.508 -17.928 -12.829 1.00 0.00 H new ATOM 1372 N GLY A 89 3.800 -15.085 -12.467 1.00 0.00 N ATOM 1373 CA GLY A 89 2.809 -14.201 -13.051 1.00 0.00 C ATOM 1374 C GLY A 89 2.692 -12.892 -12.272 1.00 0.00 C ATOM 1375 O GLY A 89 1.643 -12.255 -12.326 1.00 0.00 O ATOM 0 H GLY A 89 4.073 -14.813 -11.523 1.00 0.00 H new ATOM 0 HA2 GLY A 89 3.077 -13.986 -14.085 1.00 0.00 H new ATOM 0 HA3 GLY A 89 1.841 -14.701 -13.070 1.00 0.00 H new ATOM 1379 N LYS A 90 3.778 -12.471 -11.606 1.00 0.00 N ATOM 1380 CA LYS A 90 3.896 -11.207 -10.881 1.00 0.00 C ATOM 1381 C LYS A 90 3.128 -11.246 -9.559 1.00 0.00 C ATOM 1382 O LYS A 90 2.303 -12.129 -9.338 1.00 0.00 O ATOM 1383 CB LYS A 90 3.505 -10.004 -11.763 1.00 0.00 C ATOM 1384 CG LYS A 90 4.388 -9.954 -13.017 1.00 0.00 C ATOM 1385 CD LYS A 90 3.631 -9.966 -14.345 1.00 0.00 C ATOM 1386 CE LYS A 90 4.695 -10.022 -15.453 1.00 0.00 C ATOM 1387 NZ LYS A 90 4.107 -10.006 -16.805 1.00 0.00 N ATOM 0 H LYS A 90 4.631 -13.029 -11.559 1.00 0.00 H new ATOM 0 HA LYS A 90 4.947 -11.069 -10.625 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.457 -10.081 -12.051 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.613 -9.079 -11.197 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.001 -9.054 -12.975 1.00 0.00 H new ATOM 0 HG3 LYS A 90 5.069 -10.805 -12.997 1.00 0.00 H new ATOM 0 HD2 LYS A 90 2.964 -10.826 -14.404 1.00 0.00 H new ATOM 0 HD3 LYS A 90 3.012 -9.075 -14.447 1.00 0.00 H new ATOM 0 HE2 LYS A 90 5.372 -9.174 -15.345 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.293 -10.925 -15.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 4.867 -10.045 -17.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.482 -10.829 -16.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.558 -9.133 -16.934 1.00 0.00 H new ATOM 1401 N LEU A 91 3.415 -10.302 -8.655 1.00 0.00 N ATOM 1402 CA LEU A 91 2.662 -10.190 -7.419 1.00 0.00 C ATOM 1403 C LEU A 91 1.362 -9.479 -7.751 1.00 0.00 C ATOM 1404 O LEU A 91 1.351 -8.259 -7.919 1.00 0.00 O ATOM 1405 CB LEU A 91 3.489 -9.495 -6.329 1.00 0.00 C ATOM 1406 CG LEU A 91 2.850 -9.614 -4.930 1.00 0.00 C ATOM 1407 CD1 LEU A 91 3.936 -9.501 -3.861 1.00 0.00 C ATOM 1408 CD2 LEU A 91 1.818 -8.524 -4.637 1.00 0.00 C ATOM 0 H LEU A 91 4.160 -9.613 -8.763 1.00 0.00 H new ATOM 0 HA LEU A 91 2.428 -11.169 -7.001 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.489 -9.929 -6.305 1.00 0.00 H new ATOM 0 HB3 LEU A 91 3.604 -8.441 -6.583 1.00 0.00 H new ATOM 0 HG LEU A 91 2.346 -10.580 -4.912 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.484 -9.585 -2.873 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.664 -10.301 -3.996 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.436 -8.536 -3.950 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.410 -8.669 -3.637 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.295 -7.546 -4.696 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.013 -8.579 -5.369 1.00 0.00 H new ATOM 1420 N VAL A 92 0.284 -10.251 -7.867 1.00 0.00 N ATOM 1421 CA VAL A 92 -1.052 -9.756 -8.122 1.00 0.00 C ATOM 1422 C VAL A 92 -1.715 -9.483 -6.772 1.00 0.00 C ATOM 1423 O VAL A 92 -2.073 -10.416 -6.056 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.845 -10.733 -9.023 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -1.210 -10.818 -10.419 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -1.987 -12.163 -8.473 1.00 0.00 C ATOM 0 H VAL A 92 0.325 -11.267 -7.783 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.025 -8.822 -8.683 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.848 -10.308 -9.060 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.782 -11.510 -11.037 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.213 -9.831 -10.881 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.184 -11.174 -10.331 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.558 -12.769 -9.177 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.998 -12.600 -8.337 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.506 -12.134 -7.515 1.00 0.00 H new ATOM 1436 N HIS A 93 -1.858 -8.203 -6.409 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.770 -7.766 -5.361 1.00 0.00 C ATOM 1438 C HIS A 93 -4.070 -7.382 -6.064 1.00 0.00 C ATOM 1439 O HIS A 93 -4.208 -6.264 -6.561 1.00 0.00 O ATOM 1440 CB HIS A 93 -2.144 -6.621 -4.543 1.00 0.00 C ATOM 1441 CG HIS A 93 -3.045 -5.895 -3.559 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -2.738 -4.689 -2.949 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -4.261 -6.305 -3.077 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -3.742 -4.377 -2.108 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -4.668 -5.345 -2.172 1.00 0.00 N ATOM 0 H HIS A 93 -1.337 -7.440 -6.842 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.974 -8.549 -4.630 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.297 -7.026 -3.989 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.746 -5.885 -5.242 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.796 -7.202 -3.351 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -3.793 -3.495 -1.486 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -5.536 -5.368 -1.637 1.00 0.00 H new ATOM 1454 N VAL A 94 -5.010 -8.325 -6.110 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.369 -8.074 -6.548 1.00 0.00 C ATOM 1456 C VAL A 94 -7.105 -7.483 -5.343 1.00 0.00 C ATOM 1457 O VAL A 94 -7.094 -8.052 -4.253 1.00 0.00 O ATOM 1458 CB VAL A 94 -6.992 -9.374 -7.083 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -8.412 -9.163 -7.625 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -6.103 -9.956 -8.193 1.00 0.00 C ATOM 0 H VAL A 94 -4.840 -9.294 -5.840 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.426 -7.368 -7.376 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.059 -10.069 -6.246 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.807 -10.111 -7.990 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -9.053 -8.786 -6.828 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.386 -8.442 -8.442 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.548 -10.877 -8.570 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.018 -9.235 -9.006 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -5.112 -10.169 -7.792 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.654 -6.287 -5.519 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.180 -5.439 -4.467 1.00 0.00 C ATOM 1472 C GLN A 95 -9.675 -5.284 -4.747 1.00 0.00 C ATOM 1473 O GLN A 95 -10.057 -4.525 -5.637 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.402 -4.126 -4.577 1.00 0.00 C ATOM 1475 CG GLN A 95 -7.889 -2.991 -3.673 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.237 -3.050 -2.305 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -6.965 -4.137 -1.809 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -6.972 -1.901 -1.705 1.00 0.00 N ATOM 0 H GLN A 95 -7.747 -5.867 -6.444 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.070 -5.826 -3.454 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.355 -4.325 -4.348 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.443 -3.786 -5.612 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -7.668 -2.032 -4.141 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.972 -3.051 -3.564 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -7.217 -1.021 -2.158 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -6.522 -1.896 -0.790 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.509 -6.056 -4.048 1.00 0.00 N ATOM 1488 CA LYS A 96 -11.888 -6.328 -4.421 1.00 0.00 C ATOM 1489 C LYS A 96 -12.858 -5.851 -3.351 1.00 0.00 C ATOM 1490 O LYS A 96 -12.878 -6.417 -2.264 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.023 -7.841 -4.649 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.469 -8.276 -4.930 1.00 0.00 C ATOM 1493 CD LYS A 96 -13.471 -9.708 -5.479 1.00 0.00 C ATOM 1494 CE LYS A 96 -14.831 -10.073 -6.093 1.00 0.00 C ATOM 1495 NZ LYS A 96 -14.664 -10.866 -7.327 1.00 0.00 N ATOM 0 H LYS A 96 -10.231 -6.520 -3.183 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.138 -5.784 -5.332 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.391 -8.135 -5.487 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -11.654 -8.370 -3.770 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.060 -8.224 -4.016 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.932 -7.599 -5.648 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -12.691 -9.811 -6.233 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -13.233 -10.407 -4.677 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -15.419 -10.639 -5.371 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -15.389 -9.163 -6.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -15.593 -11.026 -7.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -14.052 -10.350 -7.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -14.229 -11.782 -7.095 1.00 0.00 H new ATOM 1509 N TRP A 97 -13.704 -4.864 -3.657 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.760 -4.448 -2.742 1.00 0.00 C ATOM 1511 C TRP A 97 -16.070 -5.132 -3.118 1.00 0.00 C ATOM 1512 O TRP A 97 -16.569 -5.954 -2.353 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.869 -2.923 -2.686 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.677 -2.194 -3.976 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.655 -1.713 -4.770 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.423 -1.830 -4.622 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -15.095 -1.069 -5.849 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.722 -1.104 -5.809 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -12.062 -2.021 -4.314 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.726 -0.589 -6.645 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -11.058 -1.431 -5.097 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.383 -0.755 -6.283 1.00 0.00 C ATOM 0 H TRP A 97 -13.675 -4.341 -4.532 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.511 -4.766 -1.730 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.852 -2.665 -2.291 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -14.132 -2.554 -1.972 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.714 -1.817 -4.587 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.634 -0.620 -6.589 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.788 -2.629 -3.465 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -12.988 -0.071 -7.556 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -10.026 -1.498 -4.784 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.600 -0.364 -6.915 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.626 -4.810 -4.289 1.00 0.00 N ATOM 1534 CA ASN A 98 -17.921 -5.340 -4.705 1.00 0.00 C ATOM 1535 C ASN A 98 -18.206 -5.041 -6.173 1.00 0.00 C ATOM 1536 O ASN A 98 -18.065 -5.924 -7.012 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.072 -4.902 -3.774 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.183 -3.396 -3.546 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -18.356 -2.795 -2.871 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -20.192 -2.755 -4.131 1.00 0.00 N ATOM 0 H ASN A 98 -16.195 -4.181 -4.967 1.00 0.00 H new ATOM 0 HA ASN A 98 -17.863 -6.424 -4.609 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.013 -5.261 -4.191 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -18.944 -5.392 -2.809 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -20.287 -1.745 -4.021 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -20.870 -3.273 -4.689 1.00 0.00 H new ATOM 1547 N GLY A 99 -18.617 -3.813 -6.501 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.063 -3.487 -7.845 1.00 0.00 C ATOM 1549 C GLY A 99 -17.909 -3.551 -8.838 1.00 0.00 C ATOM 1550 O GLY A 99 -18.120 -3.811 -10.018 1.00 0.00 O ATOM 0 H GLY A 99 -18.648 -3.031 -5.847 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -19.847 -4.180 -8.149 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -19.499 -2.488 -7.854 1.00 0.00 H new ATOM 1554 N GLN A 100 -16.694 -3.261 -8.362 1.00 0.00 N ATOM 1555 CA GLN A 100 -15.475 -3.439 -9.120 1.00 0.00 C ATOM 1556 C GLN A 100 -14.419 -4.022 -8.185 1.00 0.00 C ATOM 1557 O GLN A 100 -14.621 -4.097 -6.966 1.00 0.00 O ATOM 1558 CB GLN A 100 -14.965 -2.124 -9.742 1.00 0.00 C ATOM 1559 CG GLN A 100 -16.015 -1.038 -10.017 1.00 0.00 C ATOM 1560 CD GLN A 100 -16.214 -0.146 -8.796 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -17.276 -0.355 -8.020 1.00 0.00 O flip ATOM 1562 NE2 GLN A 100 -15.373 0.709 -8.524 1.00 0.00 N flip ATOM 0 H GLN A 100 -16.539 -2.891 -7.424 1.00 0.00 H new ATOM 0 HA GLN A 100 -15.679 -4.113 -9.952 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -14.208 -1.705 -9.079 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -14.468 -2.363 -10.682 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -15.702 -0.432 -10.867 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -16.962 -1.504 -10.289 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -14.569 0.847 -9.137 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -15.479 1.280 -7.685 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.282 -4.367 -8.782 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.060 -4.765 -8.124 1.00 0.00 C ATOM 1573 C GLU A 101 -10.918 -4.209 -8.970 1.00 0.00 C ATOM 1574 O GLU A 101 -11.050 -4.136 -10.191 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.034 -6.291 -7.955 1.00 0.00 C ATOM 1576 CG GLU A 101 -12.301 -7.122 -9.216 1.00 0.00 C ATOM 1577 CD GLU A 101 -12.552 -8.574 -8.831 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -11.601 -9.225 -8.355 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -13.720 -9.014 -8.924 1.00 0.00 O ATOM 0 H GLU A 101 -13.193 -4.374 -9.798 1.00 0.00 H new ATOM 0 HA GLU A 101 -11.969 -4.368 -7.113 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -11.059 -6.574 -7.560 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -12.774 -6.564 -7.203 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -13.163 -6.723 -9.750 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.449 -7.057 -9.893 1.00 0.00 H new ATOM 1586 N THR A 102 -9.847 -3.742 -8.328 1.00 0.00 N ATOM 1587 CA THR A 102 -8.692 -3.154 -8.996 1.00 0.00 C ATOM 1588 C THR A 102 -7.503 -4.106 -8.894 1.00 0.00 C ATOM 1589 O THR A 102 -7.387 -4.853 -7.923 1.00 0.00 O ATOM 1590 CB THR A 102 -8.411 -1.747 -8.441 1.00 0.00 C ATOM 1591 OG1 THR A 102 -7.311 -1.168 -9.090 1.00 0.00 O ATOM 1592 CG2 THR A 102 -8.081 -1.680 -6.956 1.00 0.00 C ATOM 0 H THR A 102 -9.759 -3.763 -7.312 1.00 0.00 H new ATOM 0 HA THR A 102 -8.895 -3.019 -10.058 1.00 0.00 H new ATOM 0 HB THR A 102 -9.350 -1.222 -8.615 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.257 -1.507 -10.008 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.901 -0.644 -6.670 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.917 -2.076 -6.379 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.189 -2.273 -6.754 1.00 0.00 H new ATOM 1600 N SER A 103 -6.629 -4.099 -9.904 1.00 0.00 N ATOM 1601 CA SER A 103 -5.422 -4.905 -9.912 1.00 0.00 C ATOM 1602 C SER A 103 -4.227 -4.005 -9.614 1.00 0.00 C ATOM 1603 O SER A 103 -3.877 -3.168 -10.450 1.00 0.00 O ATOM 1604 CB SER A 103 -5.271 -5.589 -11.273 1.00 0.00 C ATOM 1605 OG SER A 103 -5.251 -4.622 -12.301 1.00 0.00 O ATOM 0 H SER A 103 -6.747 -3.528 -10.741 1.00 0.00 H new ATOM 0 HA SER A 103 -5.478 -5.680 -9.148 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.351 -6.174 -11.295 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.095 -6.284 -11.433 1.00 0.00 H new ATOM 0 HG SER A 103 -4.750 -3.835 -12.001 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.602 -4.213 -8.454 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.280 -3.717 -8.113 1.00 0.00 C ATOM 1613 C LEU A 104 -1.321 -4.861 -8.433 1.00 0.00 C ATOM 1614 O LEU A 104 -1.117 -5.734 -7.589 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.247 -3.381 -6.611 1.00 0.00 C ATOM 1616 CG LEU A 104 -2.825 -1.995 -6.301 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -3.536 -1.970 -4.948 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -1.702 -0.957 -6.248 1.00 0.00 C ATOM 0 H LEU A 104 -4.025 -4.754 -7.700 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.011 -2.815 -8.662 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.810 -4.136 -6.062 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.218 -3.429 -6.255 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.538 -1.764 -7.093 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.932 -0.971 -4.764 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.355 -2.690 -4.954 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.829 -2.231 -4.161 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -2.123 0.024 -6.027 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -0.991 -1.230 -5.469 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.191 -0.924 -7.210 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.766 -4.895 -9.647 1.00 0.00 N ATOM 1631 CA VAL A 105 0.185 -5.935 -10.033 1.00 0.00 C ATOM 1632 C VAL A 105 1.595 -5.351 -9.999 1.00 0.00 C ATOM 1633 O VAL A 105 1.826 -4.302 -10.599 1.00 0.00 O ATOM 1634 CB VAL A 105 -0.196 -6.599 -11.367 1.00 0.00 C ATOM 1635 CG1 VAL A 105 -0.312 -5.625 -12.540 1.00 0.00 C ATOM 1636 CG2 VAL A 105 0.815 -7.696 -11.716 1.00 0.00 C ATOM 0 H VAL A 105 -0.961 -4.212 -10.379 1.00 0.00 H new ATOM 0 HA VAL A 105 0.154 -6.754 -9.315 1.00 0.00 H new ATOM 0 HB VAL A 105 -1.190 -7.020 -11.215 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.584 -6.173 -13.442 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.079 -4.882 -12.322 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.644 -5.125 -12.693 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.536 -8.160 -12.662 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.810 -7.259 -11.805 1.00 0.00 H new ATOM 0 HG23 VAL A 105 0.819 -8.450 -10.929 1.00 0.00 H new ATOM 1646 N ARG A 106 2.506 -6.001 -9.263 1.00 0.00 N ATOM 1647 CA ARG A 106 3.872 -5.538 -9.029 1.00 0.00 C ATOM 1648 C ARG A 106 4.875 -6.662 -9.295 1.00 0.00 C ATOM 1649 O ARG A 106 4.671 -7.791 -8.852 1.00 0.00 O ATOM 1650 CB ARG A 106 4.052 -4.984 -7.599 1.00 0.00 C ATOM 1651 CG ARG A 106 2.897 -5.300 -6.636 1.00 0.00 C ATOM 1652 CD ARG A 106 3.208 -4.855 -5.199 1.00 0.00 C ATOM 1653 NE ARG A 106 4.265 -5.679 -4.580 1.00 0.00 N ATOM 1654 CZ ARG A 106 4.663 -5.574 -3.300 1.00 0.00 C ATOM 1655 NH1 ARG A 106 4.171 -4.599 -2.530 1.00 0.00 N ATOM 1656 NH2 ARG A 106 5.540 -6.442 -2.787 1.00 0.00 N ATOM 0 H ARG A 106 2.303 -6.888 -8.803 1.00 0.00 H new ATOM 0 HA ARG A 106 4.063 -4.722 -9.726 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.975 -5.387 -7.182 1.00 0.00 H new ATOM 0 HB3 ARG A 106 4.173 -3.902 -7.656 1.00 0.00 H new ATOM 0 HG2 ARG A 106 1.991 -4.803 -6.981 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.697 -6.371 -6.649 1.00 0.00 H new ATOM 0 HD2 ARG A 106 3.519 -3.810 -5.203 1.00 0.00 H new ATOM 0 HD3 ARG A 106 2.302 -4.916 -4.597 1.00 0.00 H new ATOM 0 HE ARG A 106 4.726 -6.377 -5.164 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.496 -3.938 -2.914 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.471 -4.516 -1.558 1.00 0.00 H new ATOM 0 HH21 ARG A 106 5.914 -7.193 -3.368 1.00 0.00 H new ATOM 0 HH22 ARG A 106 5.836 -6.354 -1.815 1.00 0.00 H new ATOM 1670 N GLU A 107 5.985 -6.337 -9.964 1.00 0.00 N ATOM 1671 CA GLU A 107 7.142 -7.207 -10.135 1.00 0.00 C ATOM 1672 C GLU A 107 8.324 -6.333 -10.538 1.00 0.00 C ATOM 1673 O GLU A 107 8.113 -5.283 -11.148 1.00 0.00 O ATOM 1674 CB GLU A 107 6.848 -8.251 -11.213 1.00 0.00 C ATOM 1675 CG GLU A 107 7.980 -9.259 -11.446 1.00 0.00 C ATOM 1676 CD GLU A 107 7.575 -10.258 -12.521 1.00 0.00 C ATOM 1677 OE1 GLU A 107 7.425 -9.812 -13.680 1.00 0.00 O ATOM 1678 OE2 GLU A 107 7.337 -11.426 -12.152 1.00 0.00 O ATOM 0 H GLU A 107 6.102 -5.430 -10.415 1.00 0.00 H new ATOM 0 HA GLU A 107 7.371 -7.736 -9.210 1.00 0.00 H new ATOM 0 HB2 GLU A 107 5.945 -8.795 -10.937 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.637 -7.737 -12.151 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.887 -8.736 -11.748 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.208 -9.783 -10.518 1.00 0.00 H new ATOM 1685 N MET A 108 9.545 -6.759 -10.193 1.00 0.00 N ATOM 1686 CA MET A 108 10.775 -6.159 -10.676 1.00 0.00 C ATOM 1687 C MET A 108 11.425 -7.091 -11.684 1.00 0.00 C ATOM 1688 O MET A 108 11.851 -8.187 -11.330 1.00 0.00 O ATOM 1689 CB MET A 108 11.719 -5.809 -9.514 1.00 0.00 C ATOM 1690 CG MET A 108 13.095 -5.308 -9.976 1.00 0.00 C ATOM 1691 SD MET A 108 14.307 -6.601 -10.395 1.00 0.00 S ATOM 1692 CE MET A 108 15.630 -5.559 -11.042 1.00 0.00 C ATOM 0 H MET A 108 9.699 -7.544 -9.560 1.00 0.00 H new ATOM 0 HA MET A 108 10.546 -5.218 -11.176 1.00 0.00 H new ATOM 0 HB2 MET A 108 11.252 -5.044 -8.894 1.00 0.00 H new ATOM 0 HB3 MET A 108 11.853 -6.690 -8.887 1.00 0.00 H new ATOM 0 HG2 MET A 108 12.955 -4.671 -10.849 1.00 0.00 H new ATOM 0 HG3 MET A 108 13.516 -4.682 -9.189 1.00 0.00 H new ATOM 0 HE1 MET A 108 16.539 -6.151 -11.152 1.00 0.00 H new ATOM 0 HE2 MET A 108 15.337 -5.160 -12.013 1.00 0.00 H new ATOM 0 HE3 MET A 108 15.815 -4.736 -10.352 1.00 0.00 H new ATOM 1702 N VAL A 109 11.603 -6.587 -12.901 1.00 0.00 N ATOM 1703 CA VAL A 109 12.494 -7.132 -13.911 1.00 0.00 C ATOM 1704 C VAL A 109 13.379 -5.968 -14.354 1.00 0.00 C ATOM 1705 O VAL A 109 13.337 -4.913 -13.716 1.00 0.00 O ATOM 1706 CB VAL A 109 11.685 -7.783 -15.048 1.00 0.00 C ATOM 1707 CG1 VAL A 109 10.955 -9.029 -14.530 1.00 0.00 C ATOM 1708 CG2 VAL A 109 10.670 -6.819 -15.674 1.00 0.00 C ATOM 0 H VAL A 109 11.109 -5.754 -13.220 1.00 0.00 H new ATOM 0 HA VAL A 109 13.125 -7.937 -13.535 1.00 0.00 H new ATOM 0 HB VAL A 109 12.397 -8.061 -15.825 1.00 0.00 H new ATOM 0 HG11 VAL A 109 10.386 -9.481 -15.342 1.00 0.00 H new ATOM 0 HG12 VAL A 109 11.683 -9.747 -14.153 1.00 0.00 H new ATOM 0 HG13 VAL A 109 10.276 -8.745 -13.726 1.00 0.00 H new ATOM 0 HG21 VAL A 109 10.127 -7.329 -16.470 1.00 0.00 H new ATOM 0 HG22 VAL A 109 9.967 -6.485 -14.911 1.00 0.00 H new ATOM 0 HG23 VAL A 109 11.194 -5.957 -16.087 1.00 0.00 H new ATOM 1718 N ASP A 110 14.186 -6.152 -15.405 1.00 0.00 N ATOM 1719 CA ASP A 110 15.064 -5.107 -15.919 1.00 0.00 C ATOM 1720 C ASP A 110 15.887 -4.531 -14.752 1.00 0.00 C ATOM 1721 O ASP A 110 16.679 -5.259 -14.154 1.00 0.00 O ATOM 1722 CB ASP A 110 14.199 -4.098 -16.698 1.00 0.00 C ATOM 1723 CG ASP A 110 14.979 -2.886 -17.178 1.00 0.00 C ATOM 1724 OD1 ASP A 110 15.700 -3.022 -18.186 1.00 0.00 O ATOM 1725 OD2 ASP A 110 14.853 -1.858 -16.475 1.00 0.00 O ATOM 0 H ASP A 110 14.245 -7.031 -15.920 1.00 0.00 H new ATOM 0 HA ASP A 110 15.804 -5.475 -16.630 1.00 0.00 H new ATOM 0 HB2 ASP A 110 13.753 -4.599 -17.557 1.00 0.00 H new ATOM 0 HB3 ASP A 110 13.379 -3.765 -16.062 1.00 0.00 H new ATOM 1730 N GLY A 111 15.635 -3.284 -14.360 1.00 0.00 N ATOM 1731 CA GLY A 111 16.162 -2.640 -13.173 1.00 0.00 C ATOM 1732 C GLY A 111 15.049 -1.870 -12.465 1.00 0.00 C ATOM 1733 O GLY A 111 15.340 -0.937 -11.718 1.00 0.00 O ATOM 0 H GLY A 111 15.024 -2.668 -14.896 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.585 -3.386 -12.501 1.00 0.00 H new ATOM 0 HA3 GLY A 111 16.970 -1.961 -13.445 1.00 0.00 H new ATOM 1737 N LYS A 112 13.776 -2.214 -12.717 1.00 0.00 N ATOM 1738 CA LYS A 112 12.638 -1.388 -12.333 1.00 0.00 C ATOM 1739 C LYS A 112 11.449 -2.246 -11.933 1.00 0.00 C ATOM 1740 O LYS A 112 11.272 -3.353 -12.438 1.00 0.00 O ATOM 1741 CB LYS A 112 12.272 -0.409 -13.462 1.00 0.00 C ATOM 1742 CG LYS A 112 13.407 0.607 -13.613 1.00 0.00 C ATOM 1743 CD LYS A 112 13.032 1.903 -14.347 1.00 0.00 C ATOM 1744 CE LYS A 112 13.851 2.983 -13.632 1.00 0.00 C ATOM 1745 NZ LYS A 112 13.814 4.334 -14.214 1.00 0.00 N ATOM 0 H LYS A 112 13.514 -3.077 -13.194 1.00 0.00 H new ATOM 0 HA LYS A 112 12.923 -0.800 -11.461 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.120 -0.949 -14.397 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.336 0.100 -13.233 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.777 0.865 -12.621 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.230 0.131 -14.146 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.282 1.848 -15.407 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.963 2.104 -14.282 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.503 3.047 -12.601 1.00 0.00 H new ATOM 0 HE3 LYS A 112 14.890 2.655 -13.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.135 5.026 -13.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 14.440 4.372 -15.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 12.841 4.561 -14.503 1.00 0.00 H new ATOM 1759 N LEU A 113 10.669 -1.729 -10.982 1.00 0.00 N ATOM 1760 CA LEU A 113 9.540 -2.406 -10.384 1.00 0.00 C ATOM 1761 C LEU A 113 8.270 -1.838 -10.996 1.00 0.00 C ATOM 1762 O LEU A 113 7.887 -0.702 -10.727 1.00 0.00 O ATOM 1763 CB LEU A 113 9.616 -2.292 -8.861 1.00 0.00 C ATOM 1764 CG LEU A 113 8.727 -3.329 -8.156 1.00 0.00 C ATOM 1765 CD1 LEU A 113 9.299 -3.564 -6.760 1.00 0.00 C ATOM 1766 CD2 LEU A 113 7.264 -2.882 -8.062 1.00 0.00 C ATOM 0 H LEU A 113 10.820 -0.795 -10.601 1.00 0.00 H new ATOM 0 HA LEU A 113 9.546 -3.476 -10.594 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.649 -2.423 -8.540 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.313 -1.290 -8.558 1.00 0.00 H new ATOM 0 HG LEU A 113 8.729 -4.249 -8.741 1.00 0.00 H new ATOM 0 HD11 LEU A 113 8.687 -4.297 -6.235 1.00 0.00 H new ATOM 0 HD12 LEU A 113 10.320 -3.936 -6.843 1.00 0.00 H new ATOM 0 HD13 LEU A 113 9.299 -2.626 -6.204 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.680 -3.651 -7.556 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.204 -1.951 -7.499 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.866 -2.726 -9.065 1.00 0.00 H new ATOM 1778 N ILE A 114 7.635 -2.624 -11.857 1.00 0.00 N ATOM 1779 CA ILE A 114 6.492 -2.179 -12.623 1.00 0.00 C ATOM 1780 C ILE A 114 5.251 -2.390 -11.758 1.00 0.00 C ATOM 1781 O ILE A 114 4.724 -3.499 -11.721 1.00 0.00 O ATOM 1782 CB ILE A 114 6.424 -2.952 -13.956 1.00 0.00 C ATOM 1783 CG1 ILE A 114 7.776 -3.016 -14.695 1.00 0.00 C ATOM 1784 CG2 ILE A 114 5.336 -2.351 -14.856 1.00 0.00 C ATOM 1785 CD1 ILE A 114 8.412 -1.652 -14.983 1.00 0.00 C ATOM 0 H ILE A 114 7.904 -3.591 -12.040 1.00 0.00 H new ATOM 0 HA ILE A 114 6.566 -1.123 -12.882 1.00 0.00 H new ATOM 0 HB ILE A 114 6.167 -3.983 -13.712 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.472 -3.608 -14.101 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.634 -3.543 -15.639 1.00 0.00 H new ATOM 0 HG21 ILE A 114 5.295 -2.903 -15.795 1.00 0.00 H new ATOM 0 HG22 ILE A 114 4.371 -2.417 -14.354 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.568 -1.306 -15.059 1.00 0.00 H new ATOM 0 HD11 ILE A 114 9.358 -1.795 -15.504 1.00 0.00 H new ATOM 0 HD12 ILE A 114 7.740 -1.061 -15.606 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.591 -1.128 -14.044 1.00 0.00 H new ATOM 1797 N LEU A 115 4.791 -1.349 -11.052 1.00 0.00 N ATOM 1798 CA LEU A 115 3.472 -1.372 -10.434 1.00 0.00 C ATOM 1799 C LEU A 115 2.467 -0.903 -11.487 1.00 0.00 C ATOM 1800 O LEU A 115 2.426 0.286 -11.809 1.00 0.00 O ATOM 1801 CB LEU A 115 3.431 -0.504 -9.165 1.00 0.00 C ATOM 1802 CG LEU A 115 2.059 -0.513 -8.468 1.00 0.00 C ATOM 1803 CD1 LEU A 115 1.688 -1.894 -7.932 1.00 0.00 C ATOM 1804 CD2 LEU A 115 2.052 0.456 -7.291 1.00 0.00 C ATOM 0 H LEU A 115 5.315 -0.487 -10.899 1.00 0.00 H new ATOM 0 HA LEU A 115 3.220 -2.381 -10.107 1.00 0.00 H new ATOM 0 HB2 LEU A 115 4.189 -0.858 -8.466 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.692 0.522 -9.426 1.00 0.00 H new ATOM 0 HG LEU A 115 1.332 -0.216 -9.224 1.00 0.00 H new ATOM 0 HD11 LEU A 115 0.712 -1.847 -7.450 1.00 0.00 H new ATOM 0 HD12 LEU A 115 1.651 -2.606 -8.756 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.436 -2.216 -7.207 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.074 0.437 -6.810 1.00 0.00 H new ATOM 0 HD22 LEU A 115 2.816 0.161 -6.572 1.00 0.00 H new ATOM 0 HD23 LEU A 115 2.261 1.464 -7.649 1.00 0.00 H new ATOM 1816 N THR A 116 1.665 -1.822 -12.031 1.00 0.00 N ATOM 1817 CA THR A 116 0.529 -1.466 -12.872 1.00 0.00 C ATOM 1818 C THR A 116 -0.717 -1.461 -11.989 1.00 0.00 C ATOM 1819 O THR A 116 -0.893 -2.353 -11.153 1.00 0.00 O ATOM 1820 CB THR A 116 0.397 -2.414 -14.073 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.673 -2.774 -14.557 1.00 0.00 O ATOM 1822 CG2 THR A 116 -0.374 -1.747 -15.214 1.00 0.00 C ATOM 0 H THR A 116 1.787 -2.826 -11.900 1.00 0.00 H new ATOM 0 HA THR A 116 0.670 -0.475 -13.303 1.00 0.00 H new ATOM 0 HB THR A 116 -0.142 -3.299 -13.733 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.574 -3.380 -15.321 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.454 -2.439 -16.052 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.372 -1.477 -14.870 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.154 -0.849 -15.534 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.535 -0.418 -12.141 1.00 0.00 N ATOM 1831 CA LEU A 117 -2.619 -0.071 -11.243 1.00 0.00 C ATOM 1832 C LEU A 117 -3.863 0.177 -12.105 1.00 0.00 C ATOM 1833 O LEU A 117 -4.033 1.276 -12.631 1.00 0.00 O ATOM 1834 CB LEU A 117 -2.133 1.151 -10.442 1.00 0.00 C ATOM 1835 CG LEU A 117 -3.177 1.833 -9.556 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -3.794 0.848 -8.562 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -2.514 2.984 -8.794 1.00 0.00 C ATOM 0 H LEU A 117 -1.451 0.228 -12.926 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.892 -0.846 -10.527 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.300 0.839 -9.812 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.744 1.889 -11.144 1.00 0.00 H new ATOM 0 HG LEU A 117 -3.976 2.212 -10.193 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -4.532 1.365 -7.948 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -4.279 0.038 -9.106 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -3.012 0.439 -7.922 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -3.253 3.474 -8.160 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.707 2.593 -8.174 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.109 3.705 -9.504 1.00 0.00 H new ATOM 1849 N THR A 118 -4.702 -0.849 -12.293 1.00 0.00 N ATOM 1850 CA THR A 118 -5.841 -0.803 -13.217 1.00 0.00 C ATOM 1851 C THR A 118 -7.160 -0.979 -12.463 1.00 0.00 C ATOM 1852 O THR A 118 -7.307 -1.950 -11.719 1.00 0.00 O ATOM 1853 CB THR A 118 -5.668 -1.878 -14.298 1.00 0.00 C ATOM 1854 OG1 THR A 118 -4.385 -1.761 -14.878 1.00 0.00 O ATOM 1855 CG2 THR A 118 -6.703 -1.744 -15.416 1.00 0.00 C ATOM 0 H THR A 118 -4.609 -1.740 -11.805 1.00 0.00 H new ATOM 0 HA THR A 118 -5.872 0.174 -13.699 1.00 0.00 H new ATOM 0 HB THR A 118 -5.800 -2.845 -13.813 1.00 0.00 H new ATOM 0 HG1 THR A 118 -4.274 -2.449 -15.567 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.541 -2.526 -16.158 1.00 0.00 H new ATOM 0 HG22 THR A 118 -7.705 -1.842 -14.998 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.602 -0.768 -15.890 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.102 -0.033 -12.622 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.382 -0.019 -11.914 1.00 0.00 C ATOM 1865 C HIS A 119 -10.505 -0.478 -12.834 1.00 0.00 C ATOM 1866 O HIS A 119 -11.353 -1.264 -12.423 1.00 0.00 O ATOM 1867 CB HIS A 119 -9.694 1.391 -11.378 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.142 1.599 -10.986 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -12.132 2.138 -11.790 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -11.727 1.188 -9.821 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.294 2.067 -11.116 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.073 1.498 -9.915 1.00 0.00 N ATOM 0 H HIS A 119 -7.987 0.755 -13.259 1.00 0.00 H new ATOM 0 HA HIS A 119 -9.308 -0.707 -11.072 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.063 1.586 -10.511 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.426 2.124 -12.139 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -12.003 2.521 -12.727 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -11.233 0.712 -8.986 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.251 2.411 -11.480 1.00 0.00 H new ATOM 1881 N GLY A 120 -10.567 0.104 -14.032 1.00 0.00 N ATOM 1882 CA GLY A 120 -11.725 -0.011 -14.904 1.00 0.00 C ATOM 1883 C GLY A 120 -12.072 1.393 -15.366 1.00 0.00 C ATOM 1884 O GLY A 120 -12.268 2.273 -14.522 1.00 0.00 O ATOM 0 H GLY A 120 -9.812 0.668 -14.421 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -11.504 -0.654 -15.756 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -12.564 -0.461 -14.374 1.00 0.00 H new ATOM 1888 N THR A 121 -12.051 1.615 -16.683 1.00 0.00 N ATOM 1889 CA THR A 121 -12.057 2.931 -17.308 1.00 0.00 C ATOM 1890 C THR A 121 -10.755 3.662 -16.963 1.00 0.00 C ATOM 1891 O THR A 121 -9.895 3.833 -17.822 1.00 0.00 O ATOM 1892 CB THR A 121 -13.328 3.725 -16.952 1.00 0.00 C ATOM 1893 OG1 THR A 121 -14.459 2.885 -17.054 1.00 0.00 O ATOM 1894 CG2 THR A 121 -13.518 4.908 -17.905 1.00 0.00 C ATOM 0 H THR A 121 -12.029 0.855 -17.362 1.00 0.00 H new ATOM 0 HA THR A 121 -12.092 2.822 -18.392 1.00 0.00 H new ATOM 0 HB THR A 121 -13.218 4.096 -15.933 1.00 0.00 H new ATOM 0 HG1 THR A 121 -15.265 3.393 -16.825 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.422 5.453 -17.633 1.00 0.00 H new ATOM 0 HG22 THR A 121 -12.658 5.574 -17.834 1.00 0.00 H new ATOM 0 HG23 THR A 121 -13.609 4.541 -18.927 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.584 4.035 -15.693 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.330 4.550 -15.186 1.00 0.00 C ATOM 1904 C ALA A 122 -8.313 3.409 -15.092 1.00 0.00 C ATOM 1905 O ALA A 122 -8.623 2.312 -14.601 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.549 5.217 -13.829 1.00 0.00 C ATOM 0 H ALA A 122 -11.322 3.984 -14.991 1.00 0.00 H new ATOM 0 HA ALA A 122 -8.937 5.305 -15.867 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.600 5.602 -13.455 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.256 6.039 -13.938 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.947 4.487 -13.125 1.00 0.00 H new ATOM 1912 N VAL A 123 -7.099 3.687 -15.570 1.00 0.00 N ATOM 1913 CA VAL A 123 -5.959 2.790 -15.598 1.00 0.00 C ATOM 1914 C VAL A 123 -4.717 3.656 -15.412 1.00 0.00 C ATOM 1915 O VAL A 123 -4.661 4.757 -15.957 1.00 0.00 O ATOM 1916 CB VAL A 123 -5.943 1.980 -16.907 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -5.976 2.859 -18.162 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -4.710 1.073 -16.977 1.00 0.00 C ATOM 0 H VAL A 123 -6.880 4.600 -15.970 1.00 0.00 H new ATOM 0 HA VAL A 123 -6.003 2.048 -14.801 1.00 0.00 H new ATOM 0 HB VAL A 123 -6.854 1.381 -16.890 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -5.963 2.227 -19.050 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -6.884 3.462 -18.160 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -5.105 3.514 -18.170 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -4.723 0.512 -17.912 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -3.807 1.682 -16.932 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -4.721 0.379 -16.137 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.753 3.201 -14.609 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.599 3.988 -14.212 1.00 0.00 C ATOM 1930 C CYS A 124 -1.353 3.107 -14.166 1.00 0.00 C ATOM 1931 O CYS A 124 -1.384 2.004 -13.625 1.00 0.00 O ATOM 1932 CB CYS A 124 -2.889 4.587 -12.831 1.00 0.00 C ATOM 1933 SG CYS A 124 -1.543 5.674 -12.305 1.00 0.00 S ATOM 0 H CYS A 124 -3.759 2.261 -14.214 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.415 4.785 -14.932 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -3.824 5.147 -12.862 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -3.021 3.786 -12.103 1.00 0.00 H new ATOM 0 HG CYS A 124 -1.391 6.628 -13.175 1.00 0.00 H new ATOM 1939 N THR A 125 -0.238 3.617 -14.682 1.00 0.00 N ATOM 1940 CA THR A 125 1.072 3.048 -14.430 1.00 0.00 C ATOM 1941 C THR A 125 1.644 3.733 -13.183 1.00 0.00 C ATOM 1942 O THR A 125 1.294 4.884 -12.899 1.00 0.00 O ATOM 1943 CB THR A 125 1.952 3.314 -15.654 1.00 0.00 C ATOM 1944 OG1 THR A 125 1.929 4.685 -15.957 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.470 2.630 -16.921 1.00 0.00 C ATOM 0 H THR A 125 -0.223 4.438 -15.287 1.00 0.00 H new ATOM 0 HA THR A 125 1.025 1.972 -14.260 1.00 0.00 H new ATOM 0 HB THR A 125 2.936 2.933 -15.383 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.494 4.857 -16.739 1.00 0.00 H new ATOM 0 HG21 THR A 125 2.146 2.867 -17.742 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.451 1.551 -16.767 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.467 2.980 -17.164 1.00 0.00 H new ATOM 1953 N ARG A 126 2.469 3.026 -12.408 1.00 0.00 N ATOM 1954 CA ARG A 126 3.377 3.635 -11.449 1.00 0.00 C ATOM 1955 C ARG A 126 4.693 2.862 -11.502 1.00 0.00 C ATOM 1956 O ARG A 126 5.006 2.095 -10.597 1.00 0.00 O ATOM 1957 CB ARG A 126 2.781 3.628 -10.033 1.00 0.00 C ATOM 1958 CG ARG A 126 1.625 4.622 -9.893 1.00 0.00 C ATOM 1959 CD ARG A 126 1.147 4.704 -8.441 1.00 0.00 C ATOM 1960 NE ARG A 126 0.085 5.714 -8.306 1.00 0.00 N ATOM 1961 CZ ARG A 126 -0.940 5.674 -7.442 1.00 0.00 C ATOM 1962 NH1 ARG A 126 -0.989 4.724 -6.501 1.00 0.00 N ATOM 1963 NH2 ARG A 126 -1.916 6.584 -7.534 1.00 0.00 N ATOM 0 H ARG A 126 2.522 2.008 -12.433 1.00 0.00 H new ATOM 0 HA ARG A 126 3.546 4.681 -11.705 1.00 0.00 H new ATOM 0 HB2 ARG A 126 2.428 2.625 -9.793 1.00 0.00 H new ATOM 0 HB3 ARG A 126 3.560 3.873 -9.311 1.00 0.00 H new ATOM 0 HG2 ARG A 126 1.945 5.608 -10.231 1.00 0.00 H new ATOM 0 HG3 ARG A 126 0.799 4.318 -10.535 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.776 3.731 -8.118 1.00 0.00 H new ATOM 0 HD3 ARG A 126 1.984 4.958 -7.790 1.00 0.00 H new ATOM 0 HE ARG A 126 0.133 6.521 -8.928 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -0.246 4.028 -6.440 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -1.770 4.696 -5.845 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -1.877 7.302 -8.258 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -2.699 6.560 -6.881 1.00 0.00 H new ATOM 1977 N THR A 127 5.475 3.046 -12.562 1.00 0.00 N ATOM 1978 CA THR A 127 6.821 2.489 -12.602 1.00 0.00 C ATOM 1979 C THR A 127 7.630 3.010 -11.398 1.00 0.00 C ATOM 1980 O THR A 127 7.746 4.220 -11.186 1.00 0.00 O ATOM 1981 CB THR A 127 7.465 2.717 -13.988 1.00 0.00 C ATOM 1982 OG1 THR A 127 7.548 1.475 -14.661 1.00 0.00 O ATOM 1983 CG2 THR A 127 8.859 3.354 -13.954 1.00 0.00 C ATOM 0 H THR A 127 5.204 3.570 -13.394 1.00 0.00 H new ATOM 0 HA THR A 127 6.799 1.405 -12.492 1.00 0.00 H new ATOM 0 HB THR A 127 6.822 3.429 -14.506 1.00 0.00 H new ATOM 0 HG1 THR A 127 7.954 1.607 -15.543 1.00 0.00 H new ATOM 0 HG21 THR A 127 9.229 3.474 -14.972 1.00 0.00 H new ATOM 0 HG22 THR A 127 8.802 4.329 -13.471 1.00 0.00 H new ATOM 0 HG23 THR A 127 9.539 2.712 -13.395 1.00 0.00 H new ATOM 1991 N TYR A 128 8.155 2.084 -10.589 1.00 0.00 N ATOM 1992 CA TYR A 128 8.996 2.338 -9.429 1.00 0.00 C ATOM 1993 C TYR A 128 10.427 1.888 -9.731 1.00 0.00 C ATOM 1994 O TYR A 128 10.662 1.040 -10.591 1.00 0.00 O ATOM 1995 CB TYR A 128 8.443 1.592 -8.202 1.00 0.00 C ATOM 1996 CG TYR A 128 7.441 2.369 -7.366 1.00 0.00 C ATOM 1997 CD1 TYR A 128 7.897 3.152 -6.291 1.00 0.00 C ATOM 1998 CD2 TYR A 128 6.061 2.172 -7.539 1.00 0.00 C ATOM 1999 CE1 TYR A 128 6.984 3.749 -5.404 1.00 0.00 C ATOM 2000 CE2 TYR A 128 5.145 2.775 -6.657 1.00 0.00 C ATOM 2001 CZ TYR A 128 5.608 3.532 -5.571 1.00 0.00 C ATOM 2002 OH TYR A 128 4.720 3.955 -4.626 1.00 0.00 O ATOM 0 H TYR A 128 7.993 1.088 -10.739 1.00 0.00 H new ATOM 0 HA TYR A 128 8.998 3.405 -9.208 1.00 0.00 H new ATOM 0 HB2 TYR A 128 7.971 0.670 -8.541 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.279 1.306 -7.564 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.957 3.296 -6.145 1.00 0.00 H new ATOM 0 HD2 TYR A 128 5.702 1.556 -8.351 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.341 4.372 -4.597 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.084 2.655 -6.817 1.00 0.00 H new ATOM 0 HH TYR A 128 4.955 3.564 -3.758 1.00 0.00 H new ATOM 2012 N GLU A 129 11.384 2.459 -9.002 1.00 0.00 N ATOM 2013 CA GLU A 129 12.807 2.201 -9.119 1.00 0.00 C ATOM 2014 C GLU A 129 13.304 1.853 -7.711 1.00 0.00 C ATOM 2015 O GLU A 129 13.137 2.643 -6.780 1.00 0.00 O ATOM 2016 CB GLU A 129 13.447 3.460 -9.720 1.00 0.00 C ATOM 2017 CG GLU A 129 14.887 3.283 -10.218 1.00 0.00 C ATOM 2018 CD GLU A 129 15.408 4.575 -10.844 1.00 0.00 C ATOM 2019 OE1 GLU A 129 14.929 4.931 -11.945 1.00 0.00 O ATOM 2020 OE2 GLU A 129 16.241 5.222 -10.174 1.00 0.00 O ATOM 0 H GLU A 129 11.171 3.147 -8.280 1.00 0.00 H new ATOM 0 HA GLU A 129 13.065 1.369 -9.774 1.00 0.00 H new ATOM 0 HB2 GLU A 129 12.830 3.800 -10.552 1.00 0.00 H new ATOM 0 HB3 GLU A 129 13.433 4.250 -8.969 1.00 0.00 H new ATOM 0 HG2 GLU A 129 15.530 2.991 -9.388 1.00 0.00 H new ATOM 0 HG3 GLU A 129 14.927 2.477 -10.951 1.00 0.00 H new ATOM 2027 N LYS A 130 13.834 0.639 -7.542 1.00 0.00 N ATOM 2028 CA LYS A 130 14.164 0.046 -6.252 1.00 0.00 C ATOM 2029 C LYS A 130 15.562 0.485 -5.800 1.00 0.00 C ATOM 2030 O LYS A 130 16.542 -0.069 -6.290 1.00 0.00 O ATOM 2031 CB LYS A 130 14.081 -1.486 -6.395 1.00 0.00 C ATOM 2032 CG LYS A 130 14.206 -2.207 -5.046 1.00 0.00 C ATOM 2033 CD LYS A 130 14.658 -3.661 -5.234 1.00 0.00 C ATOM 2034 CE LYS A 130 14.582 -4.375 -3.878 1.00 0.00 C ATOM 2035 NZ LYS A 130 15.121 -5.749 -3.900 1.00 0.00 N ATOM 0 H LYS A 130 14.051 0.025 -8.327 1.00 0.00 H new ATOM 0 HA LYS A 130 13.460 0.382 -5.491 1.00 0.00 H new ATOM 0 HB2 LYS A 130 13.133 -1.754 -6.861 1.00 0.00 H new ATOM 0 HB3 LYS A 130 14.872 -1.829 -7.062 1.00 0.00 H new ATOM 0 HG2 LYS A 130 14.921 -1.680 -4.414 1.00 0.00 H new ATOM 0 HG3 LYS A 130 13.247 -2.186 -4.529 1.00 0.00 H new ATOM 0 HD2 LYS A 130 14.022 -4.164 -5.963 1.00 0.00 H new ATOM 0 HD3 LYS A 130 15.676 -3.694 -5.623 1.00 0.00 H new ATOM 0 HE2 LYS A 130 15.130 -3.791 -3.139 1.00 0.00 H new ATOM 0 HE3 LYS A 130 13.542 -4.407 -3.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 14.801 -6.261 -3.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 14.782 -6.241 -4.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 16.160 -5.714 -3.911 1.00 0.00 H new ATOM 2049 N GLN A 131 15.684 1.411 -4.837 1.00 0.00 N ATOM 2050 CA GLN A 131 16.985 1.653 -4.205 1.00 0.00 C ATOM 2051 C GLN A 131 17.324 0.564 -3.182 1.00 0.00 C ATOM 2052 O GLN A 131 18.484 0.400 -2.818 1.00 0.00 O ATOM 2053 CB GLN A 131 17.139 3.068 -3.624 1.00 0.00 C ATOM 2054 CG GLN A 131 16.311 3.394 -2.374 1.00 0.00 C ATOM 2055 CD GLN A 131 14.936 3.936 -2.737 1.00 0.00 C ATOM 2056 OE1 GLN A 131 14.182 3.292 -3.453 1.00 0.00 O ATOM 2057 NE2 GLN A 131 14.597 5.135 -2.274 1.00 0.00 N ATOM 0 H GLN A 131 14.920 1.989 -4.488 1.00 0.00 H new ATOM 0 HA GLN A 131 17.722 1.595 -5.006 1.00 0.00 H new ATOM 0 HB2 GLN A 131 18.191 3.225 -3.386 1.00 0.00 H new ATOM 0 HB3 GLN A 131 16.878 3.785 -4.402 1.00 0.00 H new ATOM 0 HG2 GLN A 131 16.200 2.496 -1.766 1.00 0.00 H new ATOM 0 HG3 GLN A 131 16.842 4.126 -1.766 1.00 0.00 H new ATOM 0 HE21 GLN A 131 15.243 5.653 -1.678 1.00 0.00 H new ATOM 0 HE22 GLN A 131 13.691 5.537 -2.514 1.00 0.00 H new ATOM 2066 N ALA A 132 16.315 -0.168 -2.696 1.00 0.00 N ATOM 2067 CA ALA A 132 16.473 -1.240 -1.723 1.00 0.00 C ATOM 2068 C ALA A 132 16.939 -0.671 -0.386 1.00 0.00 C ATOM 2069 O ALA A 132 16.102 -0.303 0.437 1.00 0.00 O ATOM 2070 CB ALA A 132 17.416 -2.340 -2.231 1.00 0.00 C ATOM 2071 OXT ALA A 132 18.286 -0.570 -0.103 1.00 0.00 O ATOM 0 H ALA A 132 15.346 -0.023 -2.979 1.00 0.00 H new ATOM 0 HA ALA A 132 15.501 -1.710 -1.576 1.00 0.00 H new ATOM 0 HB1 ALA A 132 17.506 -3.120 -1.475 1.00 0.00 H new ATOM 0 HB2 ALA A 132 17.014 -2.769 -3.149 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.399 -1.913 -2.431 1.00 0.00 H new TER 2077 ALA A 132