USER MOD reduce.3.24.130724 H: found=0, std=0, add=1171, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1169 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 93 TYR OH : rot -152:sc= 0.835 USER MOD Set 1.2: A 106 SER OG : rot -103:sc= 0.403 USER MOD Set 2.1: A 51 ASN : amide:sc= -3.76 K(o=-7.1,f=-13!) USER MOD Set 2.2: A 57 CYS SG : rot -156:sc= -3.38 USER MOD Set 3.1: A 48 ASN : amide:sc= -2.55! C(o=-4.7!,f=-2.3!) USER MOD Set 3.2: A 50 GLN : amide:sc= -2.16! K(o=-4.7!,f=-1) USER MOD Set 4.1: A 39 GLN : amide:sc= 1.18 K(o=1.2,f=-0.2) USER MOD Set 4.2: A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 27 HIS : no HD1:sc= -0.0265 X(o=-0.027,f=0) USER MOD Set 5.2: A 37 CYS SG : rot -160:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 132:sc= 0.0203 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000178) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 38:sc= 0.206 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 MET CE :methyl -118:sc= -0.0251 (180deg=-2.52!) USER MOD Single : A 28 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.0767) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.146 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc=-0.00779 K(o=-0.0078,f=-3.8!) USER MOD Single : A 42 ASN : amide:sc= -0.29 X(o=-0.29,f=-0.17) USER MOD Single : A 43 LYS NZ :NH3+ -112:sc= 0.874 (180deg=-2.15) USER MOD Single : A 46 MET CE :methyl -140:sc= -2.71 (180deg=-5.52!) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 CYS SG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -2! C(o=-2!,f=-2.2!) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -1.83! C(o=-1.8!,f=-4.8!) USER MOD Single : A 71 LYS NZ :NH3+ -113:sc= -0.943 (180deg=-1.48) USER MOD Single : A 72 ASN : amide:sc= -2.39! C(o=-2.4!,f=-2.7!) USER MOD Single : A 77 HIS : no HD1:sc= -1.65 K(o=-1.6,f=-0.4) USER MOD Single : A 82 GLN : amide:sc= -0.478 X(o=-0.48,f=-0.061) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc= -3.13 K(o=-3.1,f=-0.93) USER MOD Single : A 87 SER OG : rot -43:sc= 0.57 USER MOD Single : A 91 GLN : amide:sc= 0.015 X(o=0.015,f=0) USER MOD Single : A 95 GLN : amide:sc= -0.249 X(o=-0.25,f=-0.25) USER MOD Single : A 97 TYR OH : rot -101:sc= -1.52! USER MOD Single : A 98 LYS NZ :NH3+ 161:sc= -0.0351 (180deg=-0.242) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.814 USER MOD Single : A 114 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 115 LYS NZ :NH3+ -124:sc= -0.337 (180deg=-2.99) USER MOD Single : A 120 HIS : no HD1:sc= -0.593 X(o=-0.59,f=-0.37) USER MOD Single : A 121 GLN : amide:sc= -2.79! C(o=-2.8!,f=-3!) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=-0.0022) USER MOD Single : A 132 THR OG1 : rot -55:sc= 1.1 USER MOD Single : A 138 HIS : no HD1:sc= -1.35 K(o=-1.4,f=0.26) USER MOD Single : A 140 GLN : amide:sc= 0.0697 X(o=0.07,f=-0.19) USER MOD Single : A 145 SER OG : rot -31:sc= 0.556 USER MOD Single : A 146 SER OG : rot 180:sc= -0.389 USER MOD Single : A 147 SER OG : rot 150:sc= -0.812 USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 37.148 32.317 -43.893 1.00 0.00 N ATOM 2 CA GLY A 1 36.604 31.311 -42.999 1.00 0.00 C ATOM 3 C GLY A 1 35.400 31.812 -42.227 1.00 0.00 C ATOM 4 O GLY A 1 35.317 32.994 -41.892 1.00 0.00 O ATOM 0 H1 GLY A 1 38.179 32.370 -43.769 1.00 0.00 H new ATOM 0 H2 GLY A 1 36.930 32.061 -44.877 1.00 0.00 H new ATOM 0 H3 GLY A 1 36.725 33.241 -43.674 1.00 0.00 H new ATOM 0 HA2 GLY A 1 36.321 30.431 -43.577 1.00 0.00 H new ATOM 0 HA3 GLY A 1 37.377 30.997 -42.297 1.00 0.00 H new ATOM 8 N SER A 2 34.464 30.912 -41.944 1.00 0.00 N ATOM 9 CA SER A 2 33.256 31.271 -41.211 1.00 0.00 C ATOM 10 C SER A 2 32.540 30.024 -40.701 1.00 0.00 C ATOM 11 O SER A 2 32.819 28.910 -41.143 1.00 0.00 O ATOM 12 CB SER A 2 32.315 32.084 -42.102 1.00 0.00 C ATOM 13 OG SER A 2 31.820 31.298 -43.172 1.00 0.00 O ATOM 0 H SER A 2 34.519 29.929 -42.211 1.00 0.00 H new ATOM 0 HA SER A 2 33.548 31.878 -40.354 1.00 0.00 H new ATOM 0 HB2 SER A 2 31.482 32.461 -41.508 1.00 0.00 H new ATOM 0 HB3 SER A 2 32.843 32.952 -42.498 1.00 0.00 H new ATOM 0 HG SER A 2 31.220 31.840 -43.726 1.00 0.00 H new ATOM 19 N SER A 3 31.614 30.221 -39.767 1.00 0.00 N ATOM 20 CA SER A 3 30.860 29.113 -39.193 1.00 0.00 C ATOM 21 C SER A 3 29.654 29.624 -38.411 1.00 0.00 C ATOM 22 O SER A 3 29.533 30.820 -38.145 1.00 0.00 O ATOM 23 CB SER A 3 31.757 28.277 -38.279 1.00 0.00 C ATOM 24 OG SER A 3 31.176 27.012 -38.011 1.00 0.00 O ATOM 0 H SER A 3 31.368 31.137 -39.392 1.00 0.00 H new ATOM 0 HA SER A 3 30.503 28.487 -40.011 1.00 0.00 H new ATOM 0 HB2 SER A 3 32.732 28.141 -38.747 1.00 0.00 H new ATOM 0 HB3 SER A 3 31.924 28.809 -37.343 1.00 0.00 H new ATOM 0 HG SER A 3 31.770 26.497 -37.426 1.00 0.00 H new ATOM 30 N GLY A 4 28.762 28.709 -38.044 1.00 0.00 N ATOM 31 CA GLY A 4 27.577 29.085 -37.297 1.00 0.00 C ATOM 32 C GLY A 4 26.432 28.112 -37.496 1.00 0.00 C ATOM 33 O GLY A 4 26.271 27.545 -38.577 1.00 0.00 O ATOM 0 H GLY A 4 28.839 27.713 -38.251 1.00 0.00 H new ATOM 0 HA2 GLY A 4 27.822 29.140 -36.236 1.00 0.00 H new ATOM 0 HA3 GLY A 4 27.260 30.082 -37.603 1.00 0.00 H new ATOM 37 N SER A 5 25.635 27.916 -36.451 1.00 0.00 N ATOM 38 CA SER A 5 24.502 27.000 -36.514 1.00 0.00 C ATOM 39 C SER A 5 23.582 27.188 -35.312 1.00 0.00 C ATOM 40 O SER A 5 24.003 27.684 -34.266 1.00 0.00 O ATOM 41 CB SER A 5 24.993 25.552 -36.573 1.00 0.00 C ATOM 42 OG SER A 5 25.604 25.171 -35.353 1.00 0.00 O ATOM 0 H SER A 5 25.753 28.379 -35.550 1.00 0.00 H new ATOM 0 HA SER A 5 23.937 27.223 -37.419 1.00 0.00 H new ATOM 0 HB2 SER A 5 24.155 24.889 -36.786 1.00 0.00 H new ATOM 0 HB3 SER A 5 25.705 25.439 -37.391 1.00 0.00 H new ATOM 0 HG SER A 5 25.908 24.241 -35.416 1.00 0.00 H new ATOM 48 N SER A 6 22.324 26.790 -35.469 1.00 0.00 N ATOM 49 CA SER A 6 21.342 26.919 -34.398 1.00 0.00 C ATOM 50 C SER A 6 20.245 25.868 -34.538 1.00 0.00 C ATOM 51 O SER A 6 19.790 25.572 -35.642 1.00 0.00 O ATOM 52 CB SER A 6 20.726 28.319 -34.408 1.00 0.00 C ATOM 53 OG SER A 6 20.212 28.659 -33.131 1.00 0.00 O ATOM 0 H SER A 6 21.960 26.376 -36.327 1.00 0.00 H new ATOM 0 HA SER A 6 21.854 26.762 -33.449 1.00 0.00 H new ATOM 0 HB2 SER A 6 21.479 29.049 -34.707 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.927 28.363 -35.149 1.00 0.00 H new ATOM 0 HG SER A 6 19.825 29.559 -33.163 1.00 0.00 H new ATOM 59 N GLY A 7 19.825 25.306 -33.409 1.00 0.00 N ATOM 60 CA GLY A 7 18.786 24.293 -33.426 1.00 0.00 C ATOM 61 C GLY A 7 19.289 22.937 -32.974 1.00 0.00 C ATOM 62 O GLY A 7 19.896 22.202 -33.754 1.00 0.00 O ATOM 0 H GLY A 7 20.186 25.534 -32.483 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.967 24.607 -32.779 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.382 24.209 -34.435 1.00 0.00 H new ATOM 66 N ILE A 8 19.040 22.605 -31.712 1.00 0.00 N ATOM 67 CA ILE A 8 19.474 21.328 -31.159 1.00 0.00 C ATOM 68 C ILE A 8 18.432 20.761 -30.201 1.00 0.00 C ATOM 69 O ILE A 8 18.186 21.321 -29.132 1.00 0.00 O ATOM 70 CB ILE A 8 20.817 21.463 -30.417 1.00 0.00 C ATOM 71 CG1 ILE A 8 21.903 21.964 -31.371 1.00 0.00 C ATOM 72 CG2 ILE A 8 21.218 20.131 -29.802 1.00 0.00 C ATOM 73 CD1 ILE A 8 22.018 23.472 -31.417 1.00 0.00 C ATOM 0 H ILE A 8 18.540 23.202 -31.053 1.00 0.00 H new ATOM 0 HA ILE A 8 19.600 20.647 -32.000 1.00 0.00 H new ATOM 0 HB ILE A 8 20.701 22.191 -29.614 1.00 0.00 H new ATOM 0 HG12 ILE A 8 22.862 21.544 -31.069 1.00 0.00 H new ATOM 0 HG13 ILE A 8 21.693 21.593 -32.374 1.00 0.00 H new ATOM 0 HG21 ILE A 8 22.169 20.242 -29.281 1.00 0.00 H new ATOM 0 HG22 ILE A 8 20.452 19.811 -29.095 1.00 0.00 H new ATOM 0 HG23 ILE A 8 21.320 19.383 -30.588 1.00 0.00 H new ATOM 0 HD11 ILE A 8 22.807 23.756 -32.113 1.00 0.00 H new ATOM 0 HD12 ILE A 8 21.071 23.899 -31.748 1.00 0.00 H new ATOM 0 HD13 ILE A 8 22.258 23.849 -30.423 1.00 0.00 H new ATOM 85 N ASP A 9 17.822 19.647 -30.590 1.00 0.00 N ATOM 86 CA ASP A 9 16.808 19.002 -29.765 1.00 0.00 C ATOM 87 C ASP A 9 17.094 17.511 -29.618 1.00 0.00 C ATOM 88 O ASP A 9 17.125 16.773 -30.603 1.00 0.00 O ATOM 89 CB ASP A 9 15.419 19.210 -30.371 1.00 0.00 C ATOM 90 CG ASP A 9 15.375 18.872 -31.848 1.00 0.00 C ATOM 91 OD1 ASP A 9 15.517 17.679 -32.188 1.00 0.00 O ATOM 92 OD2 ASP A 9 15.200 19.801 -32.665 1.00 0.00 O ATOM 0 H ASP A 9 18.012 19.172 -31.472 1.00 0.00 H new ATOM 0 HA ASP A 9 16.836 19.458 -28.775 1.00 0.00 H new ATOM 0 HB2 ASP A 9 14.697 18.591 -29.838 1.00 0.00 H new ATOM 0 HB3 ASP A 9 15.116 20.247 -30.230 1.00 0.00 H new ATOM 97 N LYS A 10 17.305 17.073 -28.381 1.00 0.00 N ATOM 98 CA LYS A 10 17.589 15.670 -28.104 1.00 0.00 C ATOM 99 C LYS A 10 16.892 15.217 -26.825 1.00 0.00 C ATOM 100 O LYS A 10 17.085 15.802 -25.759 1.00 0.00 O ATOM 101 CB LYS A 10 19.098 15.449 -27.981 1.00 0.00 C ATOM 102 CG LYS A 10 19.471 14.065 -27.477 1.00 0.00 C ATOM 103 CD LYS A 10 20.930 13.999 -27.057 1.00 0.00 C ATOM 104 CE LYS A 10 21.295 12.621 -26.526 1.00 0.00 C ATOM 105 NZ LYS A 10 21.379 11.611 -27.617 1.00 0.00 N ATOM 0 H LYS A 10 17.285 17.670 -27.554 1.00 0.00 H new ATOM 0 HA LYS A 10 17.208 15.076 -28.935 1.00 0.00 H new ATOM 0 HB2 LYS A 10 19.561 15.609 -28.955 1.00 0.00 H new ATOM 0 HB3 LYS A 10 19.512 16.197 -27.305 1.00 0.00 H new ATOM 0 HG2 LYS A 10 18.836 13.801 -26.631 1.00 0.00 H new ATOM 0 HG3 LYS A 10 19.283 13.329 -28.259 1.00 0.00 H new ATOM 0 HD2 LYS A 10 21.566 14.242 -27.908 1.00 0.00 H new ATOM 0 HD3 LYS A 10 21.123 14.749 -26.290 1.00 0.00 H new ATOM 0 HE2 LYS A 10 22.251 12.674 -26.006 1.00 0.00 H new ATOM 0 HE3 LYS A 10 20.551 12.305 -25.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 21.646 10.689 -27.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 20.455 11.530 -28.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 22.095 11.908 -28.311 1.00 0.00 H new ATOM 119 N LYS A 11 16.082 14.169 -26.937 1.00 0.00 N ATOM 120 CA LYS A 11 15.358 13.634 -25.790 1.00 0.00 C ATOM 121 C LYS A 11 15.761 12.189 -25.518 1.00 0.00 C ATOM 122 O LYS A 11 15.751 11.350 -26.421 1.00 0.00 O ATOM 123 CB LYS A 11 13.849 13.718 -26.029 1.00 0.00 C ATOM 124 CG LYS A 11 13.037 13.850 -24.752 1.00 0.00 C ATOM 125 CD LYS A 11 13.053 15.276 -24.227 1.00 0.00 C ATOM 126 CE LYS A 11 11.935 16.107 -24.836 1.00 0.00 C ATOM 127 NZ LYS A 11 12.087 17.555 -24.524 1.00 0.00 N ATOM 0 H LYS A 11 15.911 13.673 -27.812 1.00 0.00 H new ATOM 0 HA LYS A 11 15.615 14.234 -24.917 1.00 0.00 H new ATOM 0 HB2 LYS A 11 13.639 14.572 -26.673 1.00 0.00 H new ATOM 0 HB3 LYS A 11 13.524 12.826 -26.565 1.00 0.00 H new ATOM 0 HG2 LYS A 11 12.009 13.542 -24.940 1.00 0.00 H new ATOM 0 HG3 LYS A 11 13.438 13.177 -23.994 1.00 0.00 H new ATOM 0 HD2 LYS A 11 12.951 15.266 -23.142 1.00 0.00 H new ATOM 0 HD3 LYS A 11 14.015 15.737 -24.453 1.00 0.00 H new ATOM 0 HE2 LYS A 11 11.926 15.967 -25.917 1.00 0.00 H new ATOM 0 HE3 LYS A 11 10.974 15.754 -24.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 11.305 18.087 -24.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 12.070 17.692 -23.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 12.992 17.899 -24.904 1.00 0.00 H new ATOM 141 N LEU A 12 16.114 11.902 -24.270 1.00 0.00 N ATOM 142 CA LEU A 12 16.519 10.557 -23.879 1.00 0.00 C ATOM 143 C LEU A 12 15.361 9.807 -23.228 1.00 0.00 C ATOM 144 O LEU A 12 15.514 8.668 -22.785 1.00 0.00 O ATOM 145 CB LEU A 12 17.706 10.620 -22.916 1.00 0.00 C ATOM 146 CG LEU A 12 17.361 10.678 -21.428 1.00 0.00 C ATOM 147 CD1 LEU A 12 18.562 10.279 -20.585 1.00 0.00 C ATOM 148 CD2 LEU A 12 16.878 12.070 -21.046 1.00 0.00 C ATOM 0 H LEU A 12 16.128 12.583 -23.511 1.00 0.00 H new ATOM 0 HA LEU A 12 16.817 10.018 -24.779 1.00 0.00 H new ATOM 0 HB2 LEU A 12 18.335 9.747 -23.089 1.00 0.00 H new ATOM 0 HB3 LEU A 12 18.303 11.497 -23.164 1.00 0.00 H new ATOM 0 HG LEU A 12 16.556 9.970 -21.234 1.00 0.00 H new ATOM 0 HD11 LEU A 12 18.297 10.326 -19.529 1.00 0.00 H new ATOM 0 HD12 LEU A 12 18.863 9.262 -20.838 1.00 0.00 H new ATOM 0 HD13 LEU A 12 19.388 10.962 -20.783 1.00 0.00 H new ATOM 0 HD21 LEU A 12 16.637 12.093 -19.983 1.00 0.00 H new ATOM 0 HD22 LEU A 12 17.662 12.798 -21.256 1.00 0.00 H new ATOM 0 HD23 LEU A 12 15.989 12.318 -21.625 1.00 0.00 H new ATOM 160 N THR A 13 14.200 10.453 -23.175 1.00 0.00 N ATOM 161 CA THR A 13 13.015 9.848 -22.579 1.00 0.00 C ATOM 162 C THR A 13 12.494 8.700 -23.437 1.00 0.00 C ATOM 163 O THR A 13 12.042 8.908 -24.564 1.00 0.00 O ATOM 164 CB THR A 13 11.891 10.883 -22.389 1.00 0.00 C ATOM 165 OG1 THR A 13 11.578 11.502 -23.641 1.00 0.00 O ATOM 166 CG2 THR A 13 12.299 11.946 -21.380 1.00 0.00 C ATOM 0 H THR A 13 14.055 11.395 -23.538 1.00 0.00 H new ATOM 0 HA THR A 13 13.313 9.463 -21.604 1.00 0.00 H new ATOM 0 HB THR A 13 11.010 10.364 -22.011 1.00 0.00 H new ATOM 0 HG1 THR A 13 11.633 10.836 -24.358 1.00 0.00 H new ATOM 0 HG21 THR A 13 11.489 12.666 -21.262 1.00 0.00 H new ATOM 0 HG22 THR A 13 12.508 11.475 -20.420 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.193 12.460 -21.734 1.00 0.00 H new ATOM 174 N THR A 14 12.558 7.487 -22.897 1.00 0.00 N ATOM 175 CA THR A 14 12.093 6.306 -23.613 1.00 0.00 C ATOM 176 C THR A 14 11.320 5.372 -22.689 1.00 0.00 C ATOM 177 O THR A 14 11.750 5.094 -21.569 1.00 0.00 O ATOM 178 CB THR A 14 13.267 5.532 -24.242 1.00 0.00 C ATOM 179 OG1 THR A 14 14.017 6.395 -25.104 1.00 0.00 O ATOM 180 CG2 THR A 14 12.763 4.332 -25.030 1.00 0.00 C ATOM 0 H THR A 14 12.928 7.297 -21.966 1.00 0.00 H new ATOM 0 HA THR A 14 11.432 6.657 -24.406 1.00 0.00 H new ATOM 0 HB THR A 14 13.910 5.174 -23.438 1.00 0.00 H new ATOM 0 HG1 THR A 14 14.762 5.896 -25.499 1.00 0.00 H new ATOM 0 HG21 THR A 14 13.610 3.801 -25.465 1.00 0.00 H new ATOM 0 HG22 THR A 14 12.218 3.663 -24.365 1.00 0.00 H new ATOM 0 HG23 THR A 14 12.100 4.672 -25.826 1.00 0.00 H new ATOM 188 N LEU A 15 10.177 4.890 -23.165 1.00 0.00 N ATOM 189 CA LEU A 15 9.343 3.985 -22.381 1.00 0.00 C ATOM 190 C LEU A 15 8.639 2.976 -23.282 1.00 0.00 C ATOM 191 O LEU A 15 8.279 3.287 -24.417 1.00 0.00 O ATOM 192 CB LEU A 15 8.310 4.778 -21.579 1.00 0.00 C ATOM 193 CG LEU A 15 7.142 3.973 -21.008 1.00 0.00 C ATOM 194 CD1 LEU A 15 7.600 3.132 -19.827 1.00 0.00 C ATOM 195 CD2 LEU A 15 6.007 4.900 -20.596 1.00 0.00 C ATOM 0 H LEU A 15 9.807 5.110 -24.089 1.00 0.00 H new ATOM 0 HA LEU A 15 9.989 3.440 -21.692 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.822 5.273 -20.754 1.00 0.00 H new ATOM 0 HB3 LEU A 15 7.906 5.562 -22.219 1.00 0.00 H new ATOM 0 HG LEU A 15 6.774 3.302 -21.784 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.755 2.566 -19.434 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.379 2.442 -20.152 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.994 3.784 -19.047 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.184 4.310 -20.192 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.363 5.595 -19.836 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.660 5.459 -21.465 1.00 0.00 H new ATOM 207 N ALA A 16 8.442 1.766 -22.767 1.00 0.00 N ATOM 208 CA ALA A 16 7.777 0.713 -23.523 1.00 0.00 C ATOM 209 C ALA A 16 6.327 1.082 -23.819 1.00 0.00 C ATOM 210 O ALA A 16 5.561 1.402 -22.910 1.00 0.00 O ATOM 211 CB ALA A 16 7.845 -0.604 -22.765 1.00 0.00 C ATOM 0 H ALA A 16 8.734 1.492 -21.829 1.00 0.00 H new ATOM 0 HA ALA A 16 8.297 0.599 -24.474 1.00 0.00 H new ATOM 0 HB1 ALA A 16 7.344 -1.382 -23.341 1.00 0.00 H new ATOM 0 HB2 ALA A 16 8.888 -0.881 -22.610 1.00 0.00 H new ATOM 0 HB3 ALA A 16 7.352 -0.494 -21.799 1.00 0.00 H new ATOM 217 N ASP A 17 5.958 1.034 -25.094 1.00 0.00 N ATOM 218 CA ASP A 17 4.599 1.363 -25.509 1.00 0.00 C ATOM 219 C ASP A 17 3.701 0.131 -25.456 1.00 0.00 C ATOM 220 O ASP A 17 2.581 0.187 -24.948 1.00 0.00 O ATOM 221 CB ASP A 17 4.602 1.947 -26.923 1.00 0.00 C ATOM 222 CG ASP A 17 5.716 2.954 -27.131 1.00 0.00 C ATOM 223 OD1 ASP A 17 5.809 3.909 -26.332 1.00 0.00 O ATOM 224 OD2 ASP A 17 6.494 2.788 -28.094 1.00 0.00 O ATOM 0 H ASP A 17 6.580 0.771 -25.858 1.00 0.00 H new ATOM 0 HA ASP A 17 4.205 2.108 -24.818 1.00 0.00 H new ATOM 0 HB2 ASP A 17 4.707 1.139 -27.647 1.00 0.00 H new ATOM 0 HB3 ASP A 17 3.642 2.426 -27.117 1.00 0.00 H new ATOM 229 N LEU A 18 4.200 -0.981 -25.985 1.00 0.00 N ATOM 230 CA LEU A 18 3.443 -2.228 -26.000 1.00 0.00 C ATOM 231 C LEU A 18 4.003 -3.216 -24.981 1.00 0.00 C ATOM 232 O LEU A 18 5.002 -2.941 -24.317 1.00 0.00 O ATOM 233 CB LEU A 18 3.470 -2.848 -27.398 1.00 0.00 C ATOM 234 CG LEU A 18 3.012 -1.944 -28.542 1.00 0.00 C ATOM 235 CD1 LEU A 18 4.172 -1.107 -29.059 1.00 0.00 C ATOM 236 CD2 LEU A 18 2.407 -2.772 -29.666 1.00 0.00 C ATOM 0 H LEU A 18 5.125 -1.045 -26.409 1.00 0.00 H new ATOM 0 HA LEU A 18 2.411 -2.002 -25.731 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.487 -3.178 -27.608 1.00 0.00 H new ATOM 0 HB3 LEU A 18 2.841 -3.738 -27.391 1.00 0.00 H new ATOM 0 HG LEU A 18 2.246 -1.269 -28.161 1.00 0.00 H new ATOM 0 HD11 LEU A 18 3.827 -0.470 -29.873 1.00 0.00 H new ATOM 0 HD12 LEU A 18 4.561 -0.486 -28.252 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.961 -1.765 -29.423 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.086 -2.112 -30.472 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.152 -3.471 -30.044 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.548 -3.327 -29.288 1.00 0.00 H new ATOM 248 N PHE A 19 3.353 -4.370 -24.865 1.00 0.00 N ATOM 249 CA PHE A 19 3.786 -5.400 -23.928 1.00 0.00 C ATOM 250 C PHE A 19 4.083 -4.800 -22.558 1.00 0.00 C ATOM 251 O PHE A 19 4.957 -5.278 -21.834 1.00 0.00 O ATOM 252 CB PHE A 19 5.028 -6.116 -24.464 1.00 0.00 C ATOM 253 CG PHE A 19 6.169 -5.189 -24.770 1.00 0.00 C ATOM 254 CD1 PHE A 19 6.287 -4.602 -26.019 1.00 0.00 C ATOM 255 CD2 PHE A 19 7.125 -4.904 -23.808 1.00 0.00 C ATOM 256 CE1 PHE A 19 7.335 -3.748 -26.304 1.00 0.00 C ATOM 257 CE2 PHE A 19 8.175 -4.051 -24.086 1.00 0.00 C ATOM 258 CZ PHE A 19 8.282 -3.473 -25.337 1.00 0.00 C ATOM 0 H PHE A 19 2.525 -4.615 -25.408 1.00 0.00 H new ATOM 0 HA PHE A 19 2.976 -6.122 -23.820 1.00 0.00 H new ATOM 0 HB2 PHE A 19 5.356 -6.854 -23.732 1.00 0.00 H new ATOM 0 HB3 PHE A 19 4.761 -6.662 -25.369 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.550 -4.815 -26.780 1.00 0.00 H new ATOM 0 HD2 PHE A 19 7.048 -5.354 -22.829 1.00 0.00 H new ATOM 0 HE1 PHE A 19 7.414 -3.296 -27.282 1.00 0.00 H new ATOM 0 HE2 PHE A 19 8.912 -3.836 -23.326 1.00 0.00 H new ATOM 0 HZ PHE A 19 9.104 -2.808 -25.558 1.00 0.00 H new ATOM 268 N ARG A 20 3.349 -3.748 -22.208 1.00 0.00 N ATOM 269 CA ARG A 20 3.535 -3.080 -20.925 1.00 0.00 C ATOM 270 C ARG A 20 2.835 -3.847 -19.807 1.00 0.00 C ATOM 271 O ARG A 20 1.761 -4.419 -19.990 1.00 0.00 O ATOM 272 CB ARG A 20 2.998 -1.649 -20.989 1.00 0.00 C ATOM 273 CG ARG A 20 1.528 -1.566 -21.367 1.00 0.00 C ATOM 274 CD ARG A 20 1.213 -0.270 -22.098 1.00 0.00 C ATOM 275 NE ARG A 20 0.893 0.815 -21.174 1.00 0.00 N ATOM 276 CZ ARG A 20 -0.205 0.846 -20.428 1.00 0.00 C ATOM 277 NH1 ARG A 20 -1.085 -0.144 -20.497 1.00 0.00 N ATOM 278 NH2 ARG A 20 -0.426 1.868 -19.611 1.00 0.00 N ATOM 0 H ARG A 20 2.621 -3.340 -22.794 1.00 0.00 H new ATOM 0 HA ARG A 20 4.603 -3.051 -20.710 1.00 0.00 H new ATOM 0 HB2 ARG A 20 3.143 -1.172 -20.020 1.00 0.00 H new ATOM 0 HB3 ARG A 20 3.583 -1.082 -21.713 1.00 0.00 H new ATOM 0 HG2 ARG A 20 1.265 -2.414 -21.999 1.00 0.00 H new ATOM 0 HG3 ARG A 20 0.916 -1.636 -20.468 1.00 0.00 H new ATOM 0 HD2 ARG A 20 2.067 0.017 -22.712 1.00 0.00 H new ATOM 0 HD3 ARG A 20 0.373 -0.430 -22.774 1.00 0.00 H new ATOM 0 HE ARG A 20 1.549 1.592 -21.098 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -0.919 -0.931 -21.124 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -1.928 -0.118 -19.923 1.00 0.00 H new ATOM 0 HH21 ARG A 20 0.248 2.631 -19.555 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -1.270 1.890 -19.039 1.00 0.00 H new ATOM 292 N PRO A 21 3.459 -3.861 -18.619 1.00 0.00 N ATOM 293 CA PRO A 21 2.914 -4.555 -17.448 1.00 0.00 C ATOM 294 C PRO A 21 1.669 -3.870 -16.896 1.00 0.00 C ATOM 295 O PRO A 21 1.526 -2.649 -16.951 1.00 0.00 O ATOM 296 CB PRO A 21 4.057 -4.485 -16.432 1.00 0.00 C ATOM 297 CG PRO A 21 4.846 -3.286 -16.830 1.00 0.00 C ATOM 298 CD PRO A 21 4.742 -3.201 -18.328 1.00 0.00 C ATOM 0 HA PRO A 21 2.598 -5.571 -17.686 1.00 0.00 H new ATOM 0 HB2 PRO A 21 3.677 -4.389 -15.415 1.00 0.00 H new ATOM 0 HB3 PRO A 21 4.667 -5.388 -16.460 1.00 0.00 H new ATOM 0 HG2 PRO A 21 4.451 -2.385 -16.360 1.00 0.00 H new ATOM 0 HG3 PRO A 21 5.885 -3.381 -16.516 1.00 0.00 H new ATOM 0 HD2 PRO A 21 4.749 -2.167 -18.673 1.00 0.00 H new ATOM 0 HD3 PRO A 21 5.574 -3.707 -18.818 1.00 0.00 H new ATOM 306 N PRO A 22 0.743 -4.674 -16.350 1.00 0.00 N ATOM 307 CA PRO A 22 -0.507 -4.167 -15.777 1.00 0.00 C ATOM 308 C PRO A 22 -0.279 -3.389 -14.485 1.00 0.00 C ATOM 309 O PRO A 22 -1.229 -2.936 -13.847 1.00 0.00 O ATOM 310 CB PRO A 22 -1.312 -5.439 -15.500 1.00 0.00 C ATOM 311 CG PRO A 22 -0.287 -6.507 -15.334 1.00 0.00 C ATOM 312 CD PRO A 22 0.847 -6.139 -16.251 1.00 0.00 C ATOM 0 HA PRO A 22 -1.007 -3.467 -16.446 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -1.923 -5.334 -14.603 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -1.990 -5.665 -16.323 1.00 0.00 H new ATOM 0 HG2 PRO A 22 0.051 -6.566 -14.299 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -0.696 -7.484 -15.592 1.00 0.00 H new ATOM 0 HD2 PRO A 22 1.810 -6.447 -15.843 1.00 0.00 H new ATOM 0 HD3 PRO A 22 0.747 -6.616 -17.226 1.00 0.00 H new ATOM 320 N ILE A 23 0.986 -3.239 -14.106 1.00 0.00 N ATOM 321 CA ILE A 23 1.338 -2.514 -12.891 1.00 0.00 C ATOM 322 C ILE A 23 0.346 -2.807 -11.770 1.00 0.00 C ATOM 323 O ILE A 23 0.079 -1.953 -10.925 1.00 0.00 O ATOM 324 CB ILE A 23 1.385 -0.994 -13.135 1.00 0.00 C ATOM 325 CG1 ILE A 23 0.257 -0.572 -14.078 1.00 0.00 C ATOM 326 CG2 ILE A 23 2.737 -0.591 -13.705 1.00 0.00 C ATOM 327 CD1 ILE A 23 0.327 0.881 -14.492 1.00 0.00 C ATOM 0 H ILE A 23 1.784 -3.610 -14.622 1.00 0.00 H new ATOM 0 HA ILE A 23 2.330 -2.857 -12.595 1.00 0.00 H new ATOM 0 HB ILE A 23 1.247 -0.483 -12.182 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.287 -1.197 -14.970 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -0.701 -0.757 -13.591 1.00 0.00 H new ATOM 0 HG21 ILE A 23 2.755 0.486 -13.872 1.00 0.00 H new ATOM 0 HG22 ILE A 23 3.524 -0.862 -13.001 1.00 0.00 H new ATOM 0 HG23 ILE A 23 2.902 -1.108 -14.650 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -0.503 1.109 -15.160 1.00 0.00 H new ATOM 0 HD12 ILE A 23 0.266 1.515 -13.607 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.269 1.067 -15.008 1.00 0.00 H new ATOM 339 N ASP A 24 -0.195 -4.020 -11.768 1.00 0.00 N ATOM 340 CA ASP A 24 -1.155 -4.428 -10.749 1.00 0.00 C ATOM 341 C ASP A 24 -0.757 -3.886 -9.380 1.00 0.00 C ATOM 342 O ASP A 24 -1.538 -3.197 -8.722 1.00 0.00 O ATOM 343 CB ASP A 24 -1.259 -5.953 -10.697 1.00 0.00 C ATOM 344 CG ASP A 24 -1.621 -6.555 -12.040 1.00 0.00 C ATOM 345 OD1 ASP A 24 -2.596 -6.080 -12.660 1.00 0.00 O ATOM 346 OD2 ASP A 24 -0.930 -7.500 -12.473 1.00 0.00 O ATOM 0 H ASP A 24 0.015 -4.738 -12.461 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.128 -4.014 -11.015 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.309 -6.368 -10.361 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.010 -6.238 -9.960 1.00 0.00 H new ATOM 351 N LEU A 25 0.462 -4.202 -8.956 1.00 0.00 N ATOM 352 CA LEU A 25 0.964 -3.747 -7.663 1.00 0.00 C ATOM 353 C LEU A 25 1.477 -2.314 -7.752 1.00 0.00 C ATOM 354 O LEU A 25 1.023 -1.435 -7.020 1.00 0.00 O ATOM 355 CB LEU A 25 2.080 -4.672 -7.174 1.00 0.00 C ATOM 356 CG LEU A 25 1.636 -5.886 -6.358 1.00 0.00 C ATOM 357 CD1 LEU A 25 2.679 -6.991 -6.434 1.00 0.00 C ATOM 358 CD2 LEU A 25 1.379 -5.492 -4.911 1.00 0.00 C ATOM 0 H LEU A 25 1.121 -4.771 -9.488 1.00 0.00 H new ATOM 0 HA LEU A 25 0.140 -3.774 -6.950 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.637 -5.026 -8.041 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.771 -4.086 -6.569 1.00 0.00 H new ATOM 0 HG LEU A 25 0.705 -6.263 -6.782 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.346 -7.847 -5.847 1.00 0.00 H new ATOM 0 HD12 LEU A 25 2.814 -7.293 -7.473 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.626 -6.625 -6.037 1.00 0.00 H new ATOM 0 HD21 LEU A 25 1.064 -6.369 -4.346 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.293 -5.089 -4.476 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.595 -4.735 -4.874 1.00 0.00 H new ATOM 370 N MET A 26 2.425 -2.085 -8.656 1.00 0.00 N ATOM 371 CA MET A 26 2.997 -0.757 -8.843 1.00 0.00 C ATOM 372 C MET A 26 1.903 0.279 -9.075 1.00 0.00 C ATOM 373 O MET A 26 1.300 0.330 -10.148 1.00 0.00 O ATOM 374 CB MET A 26 3.972 -0.760 -10.022 1.00 0.00 C ATOM 375 CG MET A 26 5.165 -1.680 -9.822 1.00 0.00 C ATOM 376 SD MET A 26 6.463 -1.410 -11.045 1.00 0.00 S ATOM 377 CE MET A 26 5.835 -2.370 -12.421 1.00 0.00 C ATOM 0 H MET A 26 2.813 -2.802 -9.270 1.00 0.00 H new ATOM 0 HA MET A 26 3.537 -0.490 -7.935 1.00 0.00 H new ATOM 0 HB2 MET A 26 3.438 -1.061 -10.923 1.00 0.00 H new ATOM 0 HB3 MET A 26 4.331 0.256 -10.189 1.00 0.00 H new ATOM 0 HG2 MET A 26 5.574 -1.526 -8.824 1.00 0.00 H new ATOM 0 HG3 MET A 26 4.832 -2.717 -9.874 1.00 0.00 H new ATOM 0 HE1 MET A 26 6.535 -3.172 -12.655 1.00 0.00 H new ATOM 0 HE2 MET A 26 4.868 -2.798 -12.155 1.00 0.00 H new ATOM 0 HE3 MET A 26 5.719 -1.725 -13.292 1.00 0.00 H new ATOM 387 N HIS A 27 1.650 1.104 -8.064 1.00 0.00 N ATOM 388 CA HIS A 27 0.627 2.139 -8.159 1.00 0.00 C ATOM 389 C HIS A 27 1.256 3.529 -8.119 1.00 0.00 C ATOM 390 O HIS A 27 1.740 3.974 -7.078 1.00 0.00 O ATOM 391 CB HIS A 27 -0.385 1.992 -7.022 1.00 0.00 C ATOM 392 CG HIS A 27 -1.620 2.818 -7.209 1.00 0.00 C ATOM 393 ND1 HIS A 27 -2.252 3.472 -6.173 1.00 0.00 N ATOM 394 CD2 HIS A 27 -2.339 3.096 -8.321 1.00 0.00 C ATOM 395 CE1 HIS A 27 -3.308 4.115 -6.639 1.00 0.00 C ATOM 396 NE2 HIS A 27 -3.383 3.904 -7.941 1.00 0.00 N ATOM 0 H HIS A 27 2.139 1.076 -7.170 1.00 0.00 H new ATOM 0 HA HIS A 27 0.111 2.019 -9.112 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -0.669 0.943 -6.933 1.00 0.00 H new ATOM 0 HB3 HIS A 27 0.092 2.274 -6.083 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -2.131 2.747 -9.322 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -3.993 4.712 -6.055 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -4.099 4.280 -8.563 1.00 0.00 H new ATOM 405 N LYS A 28 1.245 4.210 -9.260 1.00 0.00 N ATOM 406 CA LYS A 28 1.814 5.550 -9.357 1.00 0.00 C ATOM 407 C LYS A 28 1.123 6.505 -8.389 1.00 0.00 C ATOM 408 O LYS A 28 1.760 7.378 -7.802 1.00 0.00 O ATOM 409 CB LYS A 28 1.688 6.077 -10.788 1.00 0.00 C ATOM 410 CG LYS A 28 0.258 6.120 -11.297 1.00 0.00 C ATOM 411 CD LYS A 28 0.073 7.197 -12.352 1.00 0.00 C ATOM 412 CE LYS A 28 0.333 6.658 -13.750 1.00 0.00 C ATOM 413 NZ LYS A 28 1.782 6.685 -14.095 1.00 0.00 N ATOM 0 H LYS A 28 0.848 3.856 -10.131 1.00 0.00 H new ATOM 0 HA LYS A 28 2.869 5.491 -9.090 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.112 7.080 -10.835 1.00 0.00 H new ATOM 0 HB3 LYS A 28 2.282 5.448 -11.451 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.009 5.150 -11.716 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.420 6.305 -10.464 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -0.941 7.592 -12.296 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.750 8.027 -12.149 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -0.038 5.635 -13.820 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -0.224 7.249 -14.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 1.907 7.107 -15.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.296 7.252 -13.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 2.156 5.715 -14.098 1.00 0.00 H new ATOM 427 N GLY A 29 -0.186 6.333 -8.227 1.00 0.00 N ATOM 428 CA GLY A 29 -0.941 7.186 -7.328 1.00 0.00 C ATOM 429 C GLY A 29 -0.383 8.594 -7.261 1.00 0.00 C ATOM 430 O GLY A 29 -0.104 9.209 -8.290 1.00 0.00 O ATOM 0 H GLY A 29 -0.737 5.618 -8.703 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -1.980 7.225 -7.656 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -0.938 6.749 -6.329 1.00 0.00 H new ATOM 434 N SER A 30 -0.221 9.107 -6.045 1.00 0.00 N ATOM 435 CA SER A 30 0.302 10.454 -5.847 1.00 0.00 C ATOM 436 C SER A 30 0.663 10.686 -4.383 1.00 0.00 C ATOM 437 O SER A 30 0.145 10.016 -3.490 1.00 0.00 O ATOM 438 CB SER A 30 -0.723 11.494 -6.303 1.00 0.00 C ATOM 439 OG SER A 30 -0.084 12.666 -6.778 1.00 0.00 O ATOM 0 H SER A 30 -0.444 8.610 -5.183 1.00 0.00 H new ATOM 0 HA SER A 30 1.206 10.559 -6.447 1.00 0.00 H new ATOM 0 HB2 SER A 30 -1.348 11.072 -7.090 1.00 0.00 H new ATOM 0 HB3 SER A 30 -1.383 11.747 -5.473 1.00 0.00 H new ATOM 0 HG SER A 30 -0.761 13.314 -7.065 1.00 0.00 H new ATOM 445 N PHE A 31 1.555 11.642 -4.145 1.00 0.00 N ATOM 446 CA PHE A 31 1.987 11.964 -2.790 1.00 0.00 C ATOM 447 C PHE A 31 0.787 12.149 -1.866 1.00 0.00 C ATOM 448 O PHE A 31 0.736 11.577 -0.777 1.00 0.00 O ATOM 449 CB PHE A 31 2.844 13.232 -2.793 1.00 0.00 C ATOM 450 CG PHE A 31 2.830 13.967 -1.483 1.00 0.00 C ATOM 451 CD1 PHE A 31 3.581 13.514 -0.411 1.00 0.00 C ATOM 452 CD2 PHE A 31 2.066 15.112 -1.325 1.00 0.00 C ATOM 453 CE1 PHE A 31 3.571 14.188 0.795 1.00 0.00 C ATOM 454 CE2 PHE A 31 2.052 15.791 -0.121 1.00 0.00 C ATOM 455 CZ PHE A 31 2.804 15.328 0.941 1.00 0.00 C ATOM 0 H PHE A 31 1.993 12.207 -4.873 1.00 0.00 H new ATOM 0 HA PHE A 31 2.584 11.131 -2.418 1.00 0.00 H new ATOM 0 HB2 PHE A 31 3.872 12.966 -3.040 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.489 13.899 -3.579 1.00 0.00 H new ATOM 0 HD1 PHE A 31 4.182 12.623 -0.519 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.475 15.478 -2.152 1.00 0.00 H new ATOM 0 HE1 PHE A 31 4.162 13.824 1.623 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.453 16.683 -0.011 1.00 0.00 H new ATOM 0 HZ PHE A 31 2.793 15.856 1.883 1.00 0.00 H new ATOM 465 N GLU A 32 -0.175 12.953 -2.309 1.00 0.00 N ATOM 466 CA GLU A 32 -1.373 13.215 -1.521 1.00 0.00 C ATOM 467 C GLU A 32 -2.451 12.174 -1.808 1.00 0.00 C ATOM 468 O GLU A 32 -3.054 11.617 -0.890 1.00 0.00 O ATOM 469 CB GLU A 32 -1.910 14.616 -1.818 1.00 0.00 C ATOM 470 CG GLU A 32 -2.274 14.832 -3.277 1.00 0.00 C ATOM 471 CD GLU A 32 -2.107 16.274 -3.714 1.00 0.00 C ATOM 472 OE1 GLU A 32 -2.745 17.157 -3.103 1.00 0.00 O ATOM 473 OE2 GLU A 32 -1.338 16.520 -4.666 1.00 0.00 O ATOM 0 H GLU A 32 -0.148 13.433 -3.208 1.00 0.00 H new ATOM 0 HA GLU A 32 -1.104 13.153 -0.467 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -2.791 14.796 -1.202 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -1.161 15.352 -1.526 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -1.650 14.193 -3.901 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -3.307 14.525 -3.439 1.00 0.00 H new ATOM 480 N THR A 33 -2.690 11.916 -3.090 1.00 0.00 N ATOM 481 CA THR A 33 -3.696 10.945 -3.500 1.00 0.00 C ATOM 482 C THR A 33 -3.543 9.637 -2.732 1.00 0.00 C ATOM 483 O THR A 33 -4.507 9.124 -2.164 1.00 0.00 O ATOM 484 CB THR A 33 -3.612 10.652 -5.010 1.00 0.00 C ATOM 485 OG1 THR A 33 -3.784 11.863 -5.755 1.00 0.00 O ATOM 486 CG2 THR A 33 -4.670 9.641 -5.425 1.00 0.00 C ATOM 0 H THR A 33 -2.200 12.367 -3.863 1.00 0.00 H new ATOM 0 HA THR A 33 -4.668 11.384 -3.276 1.00 0.00 H new ATOM 0 HB THR A 33 -2.628 10.233 -5.222 1.00 0.00 H new ATOM 0 HG1 THR A 33 -3.727 11.668 -6.714 1.00 0.00 H new ATOM 0 HG21 THR A 33 -4.591 9.450 -6.495 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.518 8.710 -4.878 1.00 0.00 H new ATOM 0 HG23 THR A 33 -5.660 10.037 -5.199 1.00 0.00 H new ATOM 494 N ALA A 34 -2.326 9.104 -2.717 1.00 0.00 N ATOM 495 CA ALA A 34 -2.047 7.857 -2.015 1.00 0.00 C ATOM 496 C ALA A 34 -2.889 7.739 -0.749 1.00 0.00 C ATOM 497 O ALA A 34 -3.470 6.690 -0.472 1.00 0.00 O ATOM 498 CB ALA A 34 -0.567 7.762 -1.677 1.00 0.00 C ATOM 0 H ALA A 34 -1.517 9.516 -3.183 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.312 7.031 -2.674 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.373 6.826 -1.153 1.00 0.00 H new ATOM 0 HB2 ALA A 34 0.019 7.792 -2.596 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.285 8.600 -1.040 1.00 0.00 H new ATOM 504 N LYS A 35 -2.951 8.823 0.018 1.00 0.00 N ATOM 505 CA LYS A 35 -3.723 8.842 1.255 1.00 0.00 C ATOM 506 C LYS A 35 -5.219 8.890 0.962 1.00 0.00 C ATOM 507 O LYS A 35 -6.011 8.218 1.622 1.00 0.00 O ATOM 508 CB LYS A 35 -3.322 10.045 2.111 1.00 0.00 C ATOM 509 CG LYS A 35 -2.145 9.771 3.032 1.00 0.00 C ATOM 510 CD LYS A 35 -1.399 11.048 3.379 1.00 0.00 C ATOM 511 CE LYS A 35 -0.302 11.345 2.369 1.00 0.00 C ATOM 512 NZ LYS A 35 0.962 10.629 2.696 1.00 0.00 N ATOM 0 H LYS A 35 -2.476 9.700 -0.196 1.00 0.00 H new ATOM 0 HA LYS A 35 -3.507 7.925 1.803 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -3.073 10.880 1.456 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.178 10.355 2.711 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -2.500 9.296 3.947 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -1.463 9.069 2.553 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -2.100 11.882 3.412 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -0.964 10.957 4.374 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -0.637 11.054 1.373 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -0.115 12.418 2.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 1.685 10.858 1.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 1.296 10.925 3.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 0.790 9.603 2.697 1.00 0.00 H new ATOM 526 N GLU A 36 -5.598 9.687 -0.032 1.00 0.00 N ATOM 527 CA GLU A 36 -7.000 9.821 -0.411 1.00 0.00 C ATOM 528 C GLU A 36 -7.613 8.457 -0.718 1.00 0.00 C ATOM 529 O GLU A 36 -8.580 8.041 -0.079 1.00 0.00 O ATOM 530 CB GLU A 36 -7.137 10.739 -1.628 1.00 0.00 C ATOM 531 CG GLU A 36 -7.265 12.210 -1.268 1.00 0.00 C ATOM 532 CD GLU A 36 -8.238 12.450 -0.131 1.00 0.00 C ATOM 533 OE1 GLU A 36 -9.405 12.024 -0.247 1.00 0.00 O ATOM 534 OE2 GLU A 36 -7.830 13.065 0.877 1.00 0.00 O ATOM 0 H GLU A 36 -4.955 10.249 -0.589 1.00 0.00 H new ATOM 0 HA GLU A 36 -7.537 10.261 0.429 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -6.269 10.605 -2.273 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -8.012 10.437 -2.204 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -6.285 12.599 -0.991 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -7.593 12.768 -2.145 1.00 0.00 H new ATOM 541 N CYS A 37 -7.043 7.767 -1.700 1.00 0.00 N ATOM 542 CA CYS A 37 -7.534 6.451 -2.094 1.00 0.00 C ATOM 543 C CYS A 37 -7.926 5.629 -0.870 1.00 0.00 C ATOM 544 O CYS A 37 -9.041 5.116 -0.785 1.00 0.00 O ATOM 545 CB CYS A 37 -6.470 5.708 -2.903 1.00 0.00 C ATOM 546 SG CYS A 37 -6.410 6.176 -4.648 1.00 0.00 S ATOM 0 H CYS A 37 -6.241 8.097 -2.237 1.00 0.00 H new ATOM 0 HA CYS A 37 -8.419 6.591 -2.714 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -5.494 5.892 -2.455 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -6.657 4.637 -2.831 1.00 0.00 H new ATOM 0 HG CYS A 37 -5.811 5.243 -5.327 1.00 0.00 H new ATOM 552 N GLY A 38 -6.999 5.506 0.076 1.00 0.00 N ATOM 553 CA GLY A 38 -7.266 4.743 1.281 1.00 0.00 C ATOM 554 C GLY A 38 -8.695 4.900 1.762 1.00 0.00 C ATOM 555 O GLY A 38 -9.319 3.934 2.200 1.00 0.00 O ATOM 0 H GLY A 38 -6.068 5.921 0.029 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -7.063 3.689 1.092 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.584 5.063 2.069 1.00 0.00 H new ATOM 559 N GLN A 39 -9.214 6.121 1.682 1.00 0.00 N ATOM 560 CA GLN A 39 -10.578 6.401 2.115 1.00 0.00 C ATOM 561 C GLN A 39 -11.588 5.660 1.247 1.00 0.00 C ATOM 562 O GLN A 39 -12.277 4.754 1.715 1.00 0.00 O ATOM 563 CB GLN A 39 -10.852 7.905 2.067 1.00 0.00 C ATOM 564 CG GLN A 39 -10.392 8.649 3.310 1.00 0.00 C ATOM 565 CD GLN A 39 -10.163 10.125 3.057 1.00 0.00 C ATOM 566 OE1 GLN A 39 -10.957 10.781 2.381 1.00 0.00 O ATOM 567 NE2 GLN A 39 -9.074 10.658 3.598 1.00 0.00 N ATOM 0 H GLN A 39 -8.711 6.932 1.322 1.00 0.00 H new ATOM 0 HA GLN A 39 -10.685 6.052 3.142 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -10.353 8.329 1.195 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -11.922 8.067 1.932 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -11.138 8.531 4.096 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -9.469 8.200 3.676 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -8.443 10.078 4.151 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -8.868 11.648 3.461 1.00 0.00 H new ATOM 576 N MET A 40 -11.670 6.050 -0.021 1.00 0.00 N ATOM 577 CA MET A 40 -12.596 5.421 -0.956 1.00 0.00 C ATOM 578 C MET A 40 -12.504 3.901 -0.872 1.00 0.00 C ATOM 579 O MET A 40 -13.490 3.226 -0.576 1.00 0.00 O ATOM 580 CB MET A 40 -12.305 5.883 -2.385 1.00 0.00 C ATOM 581 CG MET A 40 -12.788 7.295 -2.677 1.00 0.00 C ATOM 582 SD MET A 40 -11.669 8.557 -2.041 1.00 0.00 S ATOM 583 CE MET A 40 -12.755 9.439 -0.922 1.00 0.00 C ATOM 0 H MET A 40 -11.107 6.798 -0.425 1.00 0.00 H new ATOM 0 HA MET A 40 -13.608 5.722 -0.684 1.00 0.00 H new ATOM 0 HB2 MET A 40 -11.231 5.831 -2.563 1.00 0.00 H new ATOM 0 HB3 MET A 40 -12.778 5.194 -3.085 1.00 0.00 H new ATOM 0 HG2 MET A 40 -12.898 7.422 -3.754 1.00 0.00 H new ATOM 0 HG3 MET A 40 -13.775 7.435 -2.237 1.00 0.00 H new ATOM 0 HE1 MET A 40 -12.206 10.253 -0.449 1.00 0.00 H new ATOM 0 HE2 MET A 40 -13.599 9.846 -1.479 1.00 0.00 H new ATOM 0 HE3 MET A 40 -13.121 8.755 -0.156 1.00 0.00 H new ATOM 593 N GLN A 41 -11.315 3.369 -1.135 1.00 0.00 N ATOM 594 CA GLN A 41 -11.095 1.928 -1.090 1.00 0.00 C ATOM 595 C GLN A 41 -11.251 1.398 0.332 1.00 0.00 C ATOM 596 O GLN A 41 -11.491 0.209 0.538 1.00 0.00 O ATOM 597 CB GLN A 41 -9.704 1.586 -1.625 1.00 0.00 C ATOM 598 CG GLN A 41 -9.372 2.272 -2.940 1.00 0.00 C ATOM 599 CD GLN A 41 -8.226 1.604 -3.674 1.00 0.00 C ATOM 600 OE1 GLN A 41 -7.675 0.605 -3.210 1.00 0.00 O ATOM 601 NE2 GLN A 41 -7.859 2.154 -4.826 1.00 0.00 N ATOM 0 H GLN A 41 -10.489 3.914 -1.382 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.846 1.451 -1.720 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -8.959 1.866 -0.881 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.631 0.507 -1.759 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -10.256 2.273 -3.578 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.117 3.314 -2.747 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -8.343 2.982 -5.173 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -7.093 1.749 -5.363 1.00 0.00 H new ATOM 610 N ASN A 42 -11.113 2.289 1.309 1.00 0.00 N ATOM 611 CA ASN A 42 -11.238 1.910 2.711 1.00 0.00 C ATOM 612 C ASN A 42 -10.144 0.922 3.107 1.00 0.00 C ATOM 613 O ASN A 42 -10.414 -0.102 3.735 1.00 0.00 O ATOM 614 CB ASN A 42 -12.614 1.296 2.975 1.00 0.00 C ATOM 615 CG ASN A 42 -13.742 2.279 2.728 1.00 0.00 C ATOM 616 OD1 ASN A 42 -14.542 2.105 1.808 1.00 0.00 O ATOM 617 ND2 ASN A 42 -13.811 3.319 3.551 1.00 0.00 N ATOM 0 H ASN A 42 -10.915 3.278 1.155 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.127 2.810 3.316 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -12.749 0.424 2.335 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.661 0.945 4.006 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -14.549 4.014 3.434 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -13.126 3.423 4.300 1.00 0.00 H new ATOM 624 N LYS A 43 -8.908 1.238 2.736 1.00 0.00 N ATOM 625 CA LYS A 43 -7.771 0.381 3.054 1.00 0.00 C ATOM 626 C LYS A 43 -6.640 1.188 3.682 1.00 0.00 C ATOM 627 O LYS A 43 -6.691 2.417 3.724 1.00 0.00 O ATOM 628 CB LYS A 43 -7.270 -0.324 1.791 1.00 0.00 C ATOM 629 CG LYS A 43 -8.290 -1.264 1.173 1.00 0.00 C ATOM 630 CD LYS A 43 -8.081 -1.407 -0.325 1.00 0.00 C ATOM 631 CE LYS A 43 -9.115 -2.333 -0.947 1.00 0.00 C ATOM 632 NZ LYS A 43 -10.501 -1.820 -0.763 1.00 0.00 N ATOM 0 H LYS A 43 -8.668 2.081 2.215 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.102 -0.368 3.774 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.988 0.427 1.054 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.369 -0.888 2.033 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -8.217 -2.243 1.646 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.295 -0.890 1.367 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -8.139 -0.426 -0.797 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -7.081 -1.795 -0.518 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -8.908 -2.446 -2.011 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.032 -3.323 -0.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -11.020 -2.447 -0.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -10.466 -0.861 -0.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -10.986 -1.793 -1.683 1.00 0.00 H new ATOM 646 N TRP A 44 -5.619 0.490 4.166 1.00 0.00 N ATOM 647 CA TRP A 44 -4.474 1.142 4.790 1.00 0.00 C ATOM 648 C TRP A 44 -3.432 1.529 3.746 1.00 0.00 C ATOM 649 O TRP A 44 -3.389 0.957 2.656 1.00 0.00 O ATOM 650 CB TRP A 44 -3.847 0.224 5.840 1.00 0.00 C ATOM 651 CG TRP A 44 -4.701 0.043 7.058 1.00 0.00 C ATOM 652 CD1 TRP A 44 -5.362 -1.091 7.435 1.00 0.00 C ATOM 653 CD2 TRP A 44 -4.987 1.028 8.057 1.00 0.00 C ATOM 654 NE1 TRP A 44 -6.042 -0.870 8.608 1.00 0.00 N ATOM 655 CE2 TRP A 44 -5.828 0.421 9.011 1.00 0.00 C ATOM 656 CE3 TRP A 44 -4.614 2.362 8.240 1.00 0.00 C ATOM 657 CZ2 TRP A 44 -6.300 1.105 10.128 1.00 0.00 C ATOM 658 CZ3 TRP A 44 -5.084 3.039 9.349 1.00 0.00 C ATOM 659 CH2 TRP A 44 -5.919 2.410 10.282 1.00 0.00 C ATOM 0 H TRP A 44 -5.561 -0.528 4.138 1.00 0.00 H new ATOM 0 HA TRP A 44 -4.827 2.051 5.278 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -3.655 -0.751 5.392 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -2.882 0.633 6.139 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -5.352 -2.024 6.891 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -6.614 -1.557 9.099 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -3.970 2.855 7.527 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -6.944 0.622 10.848 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -4.803 4.071 9.499 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -6.269 2.966 11.139 1.00 0.00 H new ATOM 670 N LEU A 45 -2.593 2.501 4.086 1.00 0.00 N ATOM 671 CA LEU A 45 -1.549 2.963 3.177 1.00 0.00 C ATOM 672 C LEU A 45 -0.191 2.394 3.573 1.00 0.00 C ATOM 673 O LEU A 45 0.243 2.536 4.716 1.00 0.00 O ATOM 674 CB LEU A 45 -1.492 4.492 3.170 1.00 0.00 C ATOM 675 CG LEU A 45 -0.363 5.117 2.351 1.00 0.00 C ATOM 676 CD1 LEU A 45 -0.483 4.723 0.887 1.00 0.00 C ATOM 677 CD2 LEU A 45 -0.372 6.632 2.500 1.00 0.00 C ATOM 0 H LEU A 45 -2.615 2.985 4.984 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.792 2.610 2.175 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.441 4.869 2.790 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.401 4.837 4.200 1.00 0.00 H new ATOM 0 HG LEU A 45 0.587 4.740 2.730 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.329 5.178 0.320 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.426 3.638 0.796 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -1.438 5.070 0.494 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.438 7.060 1.910 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -1.325 7.027 2.148 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.236 6.895 3.549 1.00 0.00 H new ATOM 689 N MET A 46 0.476 1.751 2.620 1.00 0.00 N ATOM 690 CA MET A 46 1.787 1.163 2.869 1.00 0.00 C ATOM 691 C MET A 46 2.868 1.886 2.071 1.00 0.00 C ATOM 692 O MET A 46 2.869 1.853 0.840 1.00 0.00 O ATOM 693 CB MET A 46 1.780 -0.324 2.510 1.00 0.00 C ATOM 694 CG MET A 46 3.027 -1.065 2.965 1.00 0.00 C ATOM 695 SD MET A 46 3.115 -1.241 4.758 1.00 0.00 S ATOM 696 CE MET A 46 1.882 -2.511 5.034 1.00 0.00 C ATOM 0 H MET A 46 0.130 1.624 1.669 1.00 0.00 H new ATOM 0 HA MET A 46 2.010 1.272 3.930 1.00 0.00 H new ATOM 0 HB2 MET A 46 0.904 -0.793 2.958 1.00 0.00 H new ATOM 0 HB3 MET A 46 1.679 -0.428 1.430 1.00 0.00 H new ATOM 0 HG2 MET A 46 3.046 -2.053 2.505 1.00 0.00 H new ATOM 0 HG3 MET A 46 3.910 -0.533 2.612 1.00 0.00 H new ATOM 0 HE1 MET A 46 1.311 -2.275 5.932 1.00 0.00 H new ATOM 0 HE2 MET A 46 1.209 -2.557 4.178 1.00 0.00 H new ATOM 0 HE3 MET A 46 2.375 -3.475 5.161 1.00 0.00 H new ATOM 706 N ILE A 47 3.784 2.538 2.779 1.00 0.00 N ATOM 707 CA ILE A 47 4.869 3.268 2.135 1.00 0.00 C ATOM 708 C ILE A 47 6.064 2.358 1.873 1.00 0.00 C ATOM 709 O ILE A 47 6.393 1.498 2.689 1.00 0.00 O ATOM 710 CB ILE A 47 5.327 4.464 2.990 1.00 0.00 C ATOM 711 CG1 ILE A 47 4.152 5.406 3.260 1.00 0.00 C ATOM 712 CG2 ILE A 47 6.460 5.207 2.297 1.00 0.00 C ATOM 713 CD1 ILE A 47 3.548 5.994 2.004 1.00 0.00 C ATOM 0 H ILE A 47 3.796 2.576 3.798 1.00 0.00 H new ATOM 0 HA ILE A 47 4.481 3.637 1.186 1.00 0.00 H new ATOM 0 HB ILE A 47 5.695 4.089 3.945 1.00 0.00 H new ATOM 0 HG12 ILE A 47 3.380 4.863 3.805 1.00 0.00 H new ATOM 0 HG13 ILE A 47 4.488 6.217 3.906 1.00 0.00 H new ATOM 0 HG21 ILE A 47 6.773 6.050 2.913 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.303 4.531 2.151 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.117 5.573 1.329 1.00 0.00 H new ATOM 0 HD11 ILE A 47 2.721 6.651 2.271 1.00 0.00 H new ATOM 0 HD12 ILE A 47 4.307 6.565 1.468 1.00 0.00 H new ATOM 0 HD13 ILE A 47 3.181 5.190 1.366 1.00 0.00 H new ATOM 725 N ASN A 48 6.710 2.554 0.728 1.00 0.00 N ATOM 726 CA ASN A 48 7.870 1.751 0.358 1.00 0.00 C ATOM 727 C ASN A 48 8.895 2.592 -0.396 1.00 0.00 C ATOM 728 O ASN A 48 8.650 3.025 -1.523 1.00 0.00 O ATOM 729 CB ASN A 48 7.439 0.561 -0.501 1.00 0.00 C ATOM 730 CG ASN A 48 8.613 -0.298 -0.931 1.00 0.00 C ATOM 731 OD1 ASN A 48 9.136 -0.147 -2.035 1.00 0.00 O ATOM 732 ND2 ASN A 48 9.034 -1.204 -0.057 1.00 0.00 N ATOM 0 H ASN A 48 6.450 3.261 0.041 1.00 0.00 H new ATOM 0 HA ASN A 48 8.332 1.381 1.273 1.00 0.00 H new ATOM 0 HB2 ASN A 48 6.731 -0.050 0.059 1.00 0.00 H new ATOM 0 HB3 ASN A 48 6.916 0.925 -1.385 1.00 0.00 H new ATOM 0 HD21 ASN A 48 9.821 -1.810 -0.289 1.00 0.00 H new ATOM 0 HD22 ASN A 48 8.570 -1.294 0.847 1.00 0.00 H new ATOM 739 N ILE A 49 10.043 2.819 0.232 1.00 0.00 N ATOM 740 CA ILE A 49 11.106 3.607 -0.380 1.00 0.00 C ATOM 741 C ILE A 49 12.254 2.716 -0.843 1.00 0.00 C ATOM 742 O ILE A 49 13.031 2.217 -0.029 1.00 0.00 O ATOM 743 CB ILE A 49 11.654 4.666 0.594 1.00 0.00 C ATOM 744 CG1 ILE A 49 10.533 5.605 1.044 1.00 0.00 C ATOM 745 CG2 ILE A 49 12.781 5.453 -0.059 1.00 0.00 C ATOM 746 CD1 ILE A 49 9.887 6.364 -0.093 1.00 0.00 C ATOM 0 H ILE A 49 10.261 2.468 1.165 1.00 0.00 H new ATOM 0 HA ILE A 49 10.669 4.110 -1.242 1.00 0.00 H new ATOM 0 HB ILE A 49 12.052 4.159 1.473 1.00 0.00 H new ATOM 0 HG12 ILE A 49 9.770 5.024 1.562 1.00 0.00 H new ATOM 0 HG13 ILE A 49 10.935 6.318 1.764 1.00 0.00 H new ATOM 0 HG21 ILE A 49 13.158 6.198 0.642 1.00 0.00 H new ATOM 0 HG22 ILE A 49 13.587 4.773 -0.335 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.406 5.952 -0.952 1.00 0.00 H new ATOM 0 HD11 ILE A 49 9.102 7.010 0.300 1.00 0.00 H new ATOM 0 HD12 ILE A 49 10.638 6.972 -0.598 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.455 5.658 -0.803 1.00 0.00 H new ATOM 758 N GLN A 50 12.354 2.522 -2.154 1.00 0.00 N ATOM 759 CA GLN A 50 13.408 1.691 -2.724 1.00 0.00 C ATOM 760 C GLN A 50 14.617 2.537 -3.113 1.00 0.00 C ATOM 761 O GLN A 50 14.483 3.552 -3.794 1.00 0.00 O ATOM 762 CB GLN A 50 12.885 0.936 -3.947 1.00 0.00 C ATOM 763 CG GLN A 50 11.781 -0.057 -3.622 1.00 0.00 C ATOM 764 CD GLN A 50 12.239 -1.152 -2.679 1.00 0.00 C ATOM 765 OE1 GLN A 50 13.206 -1.862 -2.957 1.00 0.00 O ATOM 766 NE2 GLN A 50 11.546 -1.295 -1.555 1.00 0.00 N ATOM 0 H GLN A 50 11.719 2.928 -2.841 1.00 0.00 H new ATOM 0 HA GLN A 50 13.719 0.971 -1.967 1.00 0.00 H new ATOM 0 HB2 GLN A 50 12.512 1.656 -4.676 1.00 0.00 H new ATOM 0 HB3 GLN A 50 13.713 0.405 -4.418 1.00 0.00 H new ATOM 0 HG2 GLN A 50 10.940 0.474 -3.175 1.00 0.00 H new ATOM 0 HG3 GLN A 50 11.419 -0.507 -4.546 1.00 0.00 H new ATOM 0 HE21 GLN A 50 10.751 -0.685 -1.365 1.00 0.00 H new ATOM 0 HE22 GLN A 50 11.809 -2.015 -0.882 1.00 0.00 H new ATOM 775 N ASN A 51 15.797 2.110 -2.675 1.00 0.00 N ATOM 776 CA ASN A 51 17.029 2.829 -2.976 1.00 0.00 C ATOM 777 C ASN A 51 17.410 2.664 -4.444 1.00 0.00 C ATOM 778 O ASN A 51 16.907 1.775 -5.131 1.00 0.00 O ATOM 779 CB ASN A 51 18.167 2.329 -2.084 1.00 0.00 C ATOM 780 CG ASN A 51 18.091 0.835 -1.832 1.00 0.00 C ATOM 781 OD1 ASN A 51 17.859 0.050 -2.752 1.00 0.00 O ATOM 782 ND2 ASN A 51 18.285 0.435 -0.581 1.00 0.00 N ATOM 0 H ASN A 51 15.926 1.270 -2.111 1.00 0.00 H new ATOM 0 HA ASN A 51 16.860 3.888 -2.779 1.00 0.00 H new ATOM 0 HB2 ASN A 51 19.123 2.568 -2.551 1.00 0.00 H new ATOM 0 HB3 ASN A 51 18.137 2.857 -1.131 1.00 0.00 H new ATOM 0 HD21 ASN A 51 18.245 -0.558 -0.351 1.00 0.00 H new ATOM 0 HD22 ASN A 51 18.474 1.121 0.150 1.00 0.00 H new ATOM 789 N VAL A 52 18.302 3.528 -4.919 1.00 0.00 N ATOM 790 CA VAL A 52 18.752 3.478 -6.305 1.00 0.00 C ATOM 791 C VAL A 52 19.670 2.285 -6.542 1.00 0.00 C ATOM 792 O VAL A 52 19.635 1.664 -7.604 1.00 0.00 O ATOM 793 CB VAL A 52 19.492 4.769 -6.702 1.00 0.00 C ATOM 794 CG1 VAL A 52 18.501 5.885 -6.994 1.00 0.00 C ATOM 795 CG2 VAL A 52 20.465 5.182 -5.608 1.00 0.00 C ATOM 0 H VAL A 52 18.727 4.271 -4.364 1.00 0.00 H new ATOM 0 HA VAL A 52 17.860 3.375 -6.924 1.00 0.00 H new ATOM 0 HB VAL A 52 20.062 4.576 -7.611 1.00 0.00 H new ATOM 0 HG11 VAL A 52 19.043 6.789 -7.273 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.848 5.586 -7.814 1.00 0.00 H new ATOM 0 HG13 VAL A 52 17.901 6.081 -6.105 1.00 0.00 H new ATOM 0 HG21 VAL A 52 20.979 6.096 -5.905 1.00 0.00 H new ATOM 0 HG22 VAL A 52 19.918 5.358 -4.682 1.00 0.00 H new ATOM 0 HG23 VAL A 52 21.196 4.388 -5.452 1.00 0.00 H new ATOM 805 N GLN A 53 20.492 1.970 -5.545 1.00 0.00 N ATOM 806 CA GLN A 53 21.420 0.851 -5.646 1.00 0.00 C ATOM 807 C GLN A 53 21.781 0.317 -4.263 1.00 0.00 C ATOM 808 O GLN A 53 22.366 1.027 -3.446 1.00 0.00 O ATOM 809 CB GLN A 53 22.688 1.278 -6.387 1.00 0.00 C ATOM 810 CG GLN A 53 23.252 2.608 -5.913 1.00 0.00 C ATOM 811 CD GLN A 53 24.678 2.835 -6.375 1.00 0.00 C ATOM 812 OE1 GLN A 53 25.036 2.508 -7.507 1.00 0.00 O ATOM 813 NE2 GLN A 53 25.501 3.399 -5.499 1.00 0.00 N ATOM 0 H GLN A 53 20.533 2.474 -4.659 1.00 0.00 H new ATOM 0 HA GLN A 53 20.930 0.055 -6.207 1.00 0.00 H new ATOM 0 HB2 GLN A 53 23.448 0.506 -6.264 1.00 0.00 H new ATOM 0 HB3 GLN A 53 22.471 1.344 -7.453 1.00 0.00 H new ATOM 0 HG2 GLN A 53 22.622 3.417 -6.281 1.00 0.00 H new ATOM 0 HG3 GLN A 53 23.216 2.646 -4.824 1.00 0.00 H new ATOM 0 HE21 GLN A 53 25.162 3.654 -4.571 1.00 0.00 H new ATOM 0 HE22 GLN A 53 26.472 3.577 -5.754 1.00 0.00 H new ATOM 822 N ASP A 54 21.428 -0.938 -4.009 1.00 0.00 N ATOM 823 CA ASP A 54 21.715 -1.568 -2.725 1.00 0.00 C ATOM 824 C ASP A 54 21.558 -3.083 -2.816 1.00 0.00 C ATOM 825 O ASP A 54 21.090 -3.610 -3.826 1.00 0.00 O ATOM 826 CB ASP A 54 20.791 -1.011 -1.642 1.00 0.00 C ATOM 827 CG ASP A 54 21.388 -1.130 -0.254 1.00 0.00 C ATOM 828 OD1 ASP A 54 22.245 -0.292 0.098 1.00 0.00 O ATOM 829 OD2 ASP A 54 20.999 -2.062 0.481 1.00 0.00 O ATOM 0 H ASP A 54 20.943 -1.539 -4.675 1.00 0.00 H new ATOM 0 HA ASP A 54 22.748 -1.343 -2.461 1.00 0.00 H new ATOM 0 HB2 ASP A 54 20.578 0.037 -1.854 1.00 0.00 H new ATOM 0 HB3 ASP A 54 19.840 -1.542 -1.672 1.00 0.00 H new ATOM 834 N PHE A 55 21.952 -3.778 -1.754 1.00 0.00 N ATOM 835 CA PHE A 55 21.857 -5.233 -1.715 1.00 0.00 C ATOM 836 C PHE A 55 20.600 -5.675 -0.972 1.00 0.00 C ATOM 837 O PHE A 55 19.873 -6.557 -1.429 1.00 0.00 O ATOM 838 CB PHE A 55 23.096 -5.828 -1.043 1.00 0.00 C ATOM 839 CG PHE A 55 24.389 -5.292 -1.589 1.00 0.00 C ATOM 840 CD1 PHE A 55 24.664 -5.357 -2.945 1.00 0.00 C ATOM 841 CD2 PHE A 55 25.330 -4.725 -0.745 1.00 0.00 C ATOM 842 CE1 PHE A 55 25.852 -4.865 -3.451 1.00 0.00 C ATOM 843 CE2 PHE A 55 26.520 -4.231 -1.244 1.00 0.00 C ATOM 844 CZ PHE A 55 26.782 -4.302 -2.599 1.00 0.00 C ATOM 0 H PHE A 55 22.340 -3.358 -0.909 1.00 0.00 H new ATOM 0 HA PHE A 55 21.799 -5.597 -2.741 1.00 0.00 H new ATOM 0 HB2 PHE A 55 23.051 -5.626 0.027 1.00 0.00 H new ATOM 0 HB3 PHE A 55 23.081 -6.911 -1.164 1.00 0.00 H new ATOM 0 HD1 PHE A 55 23.941 -5.798 -3.615 1.00 0.00 H new ATOM 0 HD2 PHE A 55 25.131 -4.668 0.315 1.00 0.00 H new ATOM 0 HE1 PHE A 55 26.053 -4.921 -4.511 1.00 0.00 H new ATOM 0 HE2 PHE A 55 27.245 -3.790 -0.576 1.00 0.00 H new ATOM 0 HZ PHE A 55 27.712 -3.918 -2.991 1.00 0.00 H new ATOM 854 N ALA A 56 20.351 -5.057 0.178 1.00 0.00 N ATOM 855 CA ALA A 56 19.182 -5.385 0.984 1.00 0.00 C ATOM 856 C ALA A 56 17.894 -5.182 0.193 1.00 0.00 C ATOM 857 O ALA A 56 16.936 -5.942 0.342 1.00 0.00 O ATOM 858 CB ALA A 56 19.162 -4.545 2.253 1.00 0.00 C ATOM 0 H ALA A 56 20.944 -4.326 0.572 1.00 0.00 H new ATOM 0 HA ALA A 56 19.246 -6.438 1.259 1.00 0.00 H new ATOM 0 HB1 ALA A 56 18.283 -4.801 2.845 1.00 0.00 H new ATOM 0 HB2 ALA A 56 20.062 -4.744 2.835 1.00 0.00 H new ATOM 0 HB3 ALA A 56 19.126 -3.488 1.989 1.00 0.00 H new ATOM 864 N CYS A 57 17.878 -4.154 -0.648 1.00 0.00 N ATOM 865 CA CYS A 57 16.707 -3.850 -1.462 1.00 0.00 C ATOM 866 C CYS A 57 16.396 -4.998 -2.417 1.00 0.00 C ATOM 867 O CYS A 57 15.241 -5.391 -2.574 1.00 0.00 O ATOM 868 CB CYS A 57 16.930 -2.559 -2.251 1.00 0.00 C ATOM 869 SG CYS A 57 18.297 -2.643 -3.432 1.00 0.00 S ATOM 0 H CYS A 57 18.663 -3.517 -0.784 1.00 0.00 H new ATOM 0 HA CYS A 57 15.856 -3.716 -0.795 1.00 0.00 H new ATOM 0 HB2 CYS A 57 16.014 -2.311 -2.788 1.00 0.00 H new ATOM 0 HB3 CYS A 57 17.119 -1.746 -1.550 1.00 0.00 H new ATOM 0 HG CYS A 57 18.736 -1.443 -3.674 1.00 0.00 H new ATOM 875 N GLN A 58 17.435 -5.529 -3.053 1.00 0.00 N ATOM 876 CA GLN A 58 17.272 -6.630 -3.995 1.00 0.00 C ATOM 877 C GLN A 58 16.983 -7.935 -3.262 1.00 0.00 C ATOM 878 O GLN A 58 16.285 -8.808 -3.779 1.00 0.00 O ATOM 879 CB GLN A 58 18.527 -6.782 -4.857 1.00 0.00 C ATOM 880 CG GLN A 58 19.706 -7.388 -4.113 1.00 0.00 C ATOM 881 CD GLN A 58 20.677 -8.096 -5.036 1.00 0.00 C ATOM 882 OE1 GLN A 58 21.724 -7.554 -5.389 1.00 0.00 O ATOM 883 NE2 GLN A 58 20.334 -9.316 -5.433 1.00 0.00 N ATOM 0 H GLN A 58 18.398 -5.215 -2.933 1.00 0.00 H new ATOM 0 HA GLN A 58 16.423 -6.401 -4.639 1.00 0.00 H new ATOM 0 HB2 GLN A 58 18.292 -7.406 -5.719 1.00 0.00 H new ATOM 0 HB3 GLN A 58 18.815 -5.803 -5.241 1.00 0.00 H new ATOM 0 HG2 GLN A 58 20.232 -6.602 -3.572 1.00 0.00 H new ATOM 0 HG3 GLN A 58 19.337 -8.094 -3.369 1.00 0.00 H new ATOM 0 HE21 GLN A 58 19.456 -9.728 -5.116 1.00 0.00 H new ATOM 0 HE22 GLN A 58 20.948 -9.841 -6.055 1.00 0.00 H new ATOM 892 N CYS A 59 17.525 -8.063 -2.056 1.00 0.00 N ATOM 893 CA CYS A 59 17.326 -9.263 -1.251 1.00 0.00 C ATOM 894 C CYS A 59 15.894 -9.338 -0.731 1.00 0.00 C ATOM 895 O CYS A 59 15.309 -10.419 -0.645 1.00 0.00 O ATOM 896 CB CYS A 59 18.308 -9.285 -0.079 1.00 0.00 C ATOM 897 SG CYS A 59 18.610 -10.934 0.600 1.00 0.00 S ATOM 0 H CYS A 59 18.106 -7.350 -1.614 1.00 0.00 H new ATOM 0 HA CYS A 59 17.509 -10.130 -1.886 1.00 0.00 H new ATOM 0 HB2 CYS A 59 19.257 -8.859 -0.406 1.00 0.00 H new ATOM 0 HB3 CYS A 59 17.926 -8.642 0.714 1.00 0.00 H new ATOM 0 HG CYS A 59 19.455 -10.850 1.585 1.00 0.00 H new ATOM 903 N LEU A 60 15.335 -8.184 -0.385 1.00 0.00 N ATOM 904 CA LEU A 60 13.971 -8.119 0.129 1.00 0.00 C ATOM 905 C LEU A 60 12.972 -8.611 -0.914 1.00 0.00 C ATOM 906 O LEU A 60 12.346 -9.656 -0.742 1.00 0.00 O ATOM 907 CB LEU A 60 13.629 -6.686 0.542 1.00 0.00 C ATOM 908 CG LEU A 60 13.964 -6.305 1.984 1.00 0.00 C ATOM 909 CD1 LEU A 60 14.326 -4.831 2.077 1.00 0.00 C ATOM 910 CD2 LEU A 60 12.797 -6.629 2.906 1.00 0.00 C ATOM 0 H LEU A 60 15.805 -7.281 -0.451 1.00 0.00 H new ATOM 0 HA LEU A 60 13.907 -8.768 1.002 1.00 0.00 H new ATOM 0 HB2 LEU A 60 14.154 -6.002 -0.125 1.00 0.00 H new ATOM 0 HB3 LEU A 60 12.562 -6.529 0.384 1.00 0.00 H new ATOM 0 HG LEU A 60 14.827 -6.890 2.303 1.00 0.00 H new ATOM 0 HD11 LEU A 60 14.561 -4.579 3.111 1.00 0.00 H new ATOM 0 HD12 LEU A 60 15.193 -4.629 1.448 1.00 0.00 H new ATOM 0 HD13 LEU A 60 13.484 -4.227 1.739 1.00 0.00 H new ATOM 0 HD21 LEU A 60 13.053 -6.351 3.928 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.916 -6.071 2.588 1.00 0.00 H new ATOM 0 HD23 LEU A 60 12.585 -7.697 2.863 1.00 0.00 H new ATOM 922 N ASN A 61 12.831 -7.852 -1.995 1.00 0.00 N ATOM 923 CA ASN A 61 11.909 -8.213 -3.067 1.00 0.00 C ATOM 924 C ASN A 61 12.054 -9.686 -3.436 1.00 0.00 C ATOM 925 O ASN A 61 11.117 -10.305 -3.941 1.00 0.00 O ATOM 926 CB ASN A 61 12.160 -7.340 -4.298 1.00 0.00 C ATOM 927 CG ASN A 61 10.945 -7.253 -5.202 1.00 0.00 C ATOM 928 OD1 ASN A 61 10.252 -6.236 -5.233 1.00 0.00 O ATOM 929 ND2 ASN A 61 10.682 -8.323 -5.943 1.00 0.00 N ATOM 0 H ASN A 61 13.342 -6.984 -2.153 1.00 0.00 H new ATOM 0 HA ASN A 61 10.893 -8.045 -2.711 1.00 0.00 H new ATOM 0 HB2 ASN A 61 12.444 -6.338 -3.978 1.00 0.00 H new ATOM 0 HB3 ASN A 61 13.001 -7.744 -4.862 1.00 0.00 H new ATOM 0 HD21 ASN A 61 9.878 -8.324 -6.570 1.00 0.00 H new ATOM 0 HD22 ASN A 61 11.284 -9.144 -5.885 1.00 0.00 H new ATOM 936 N ARG A 62 13.234 -10.241 -3.180 1.00 0.00 N ATOM 937 CA ARG A 62 13.502 -11.641 -3.486 1.00 0.00 C ATOM 938 C ARG A 62 12.325 -12.522 -3.076 1.00 0.00 C ATOM 939 O ARG A 62 11.707 -13.179 -3.914 1.00 0.00 O ATOM 940 CB ARG A 62 14.773 -12.107 -2.773 1.00 0.00 C ATOM 941 CG ARG A 62 15.365 -13.381 -3.354 1.00 0.00 C ATOM 942 CD ARG A 62 16.287 -13.083 -4.526 1.00 0.00 C ATOM 943 NE ARG A 62 15.543 -12.733 -5.733 1.00 0.00 N ATOM 944 CZ ARG A 62 14.773 -13.589 -6.395 1.00 0.00 C ATOM 945 NH1 ARG A 62 14.646 -14.838 -5.970 1.00 0.00 N ATOM 946 NH2 ARG A 62 14.127 -13.195 -7.485 1.00 0.00 N ATOM 0 H ARG A 62 14.020 -9.743 -2.762 1.00 0.00 H new ATOM 0 HA ARG A 62 13.644 -11.731 -4.563 1.00 0.00 H new ATOM 0 HB2 ARG A 62 15.519 -11.314 -2.823 1.00 0.00 H new ATOM 0 HB3 ARG A 62 14.550 -12.268 -1.718 1.00 0.00 H new ATOM 0 HG2 ARG A 62 15.919 -13.912 -2.580 1.00 0.00 H new ATOM 0 HG3 ARG A 62 14.561 -14.041 -3.681 1.00 0.00 H new ATOM 0 HD2 ARG A 62 16.955 -12.264 -4.262 1.00 0.00 H new ATOM 0 HD3 ARG A 62 16.913 -13.953 -4.725 1.00 0.00 H new ATOM 0 HE ARG A 62 15.619 -11.779 -6.087 1.00 0.00 H new ATOM 0 HH11 ARG A 62 15.140 -15.144 -5.132 1.00 0.00 H new ATOM 0 HH12 ARG A 62 14.054 -15.493 -6.481 1.00 0.00 H new ATOM 0 HH21 ARG A 62 14.222 -12.234 -7.815 1.00 0.00 H new ATOM 0 HH22 ARG A 62 13.536 -13.853 -7.993 1.00 0.00 H new ATOM 960 N ASP A 63 12.022 -12.531 -1.783 1.00 0.00 N ATOM 961 CA ASP A 63 10.919 -13.331 -1.262 1.00 0.00 C ATOM 962 C ASP A 63 9.855 -12.441 -0.627 1.00 0.00 C ATOM 963 O ASP A 63 8.660 -12.720 -0.723 1.00 0.00 O ATOM 964 CB ASP A 63 11.434 -14.341 -0.236 1.00 0.00 C ATOM 965 CG ASP A 63 12.270 -15.436 -0.871 1.00 0.00 C ATOM 966 OD1 ASP A 63 13.491 -15.231 -1.033 1.00 0.00 O ATOM 967 OD2 ASP A 63 11.702 -16.497 -1.205 1.00 0.00 O ATOM 0 H ASP A 63 12.524 -11.994 -1.076 1.00 0.00 H new ATOM 0 HA ASP A 63 10.467 -13.869 -2.096 1.00 0.00 H new ATOM 0 HB2 ASP A 63 12.030 -13.821 0.514 1.00 0.00 H new ATOM 0 HB3 ASP A 63 10.588 -14.789 0.285 1.00 0.00 H new ATOM 972 N VAL A 64 10.298 -11.368 0.021 1.00 0.00 N ATOM 973 CA VAL A 64 9.384 -10.437 0.672 1.00 0.00 C ATOM 974 C VAL A 64 8.310 -9.954 -0.297 1.00 0.00 C ATOM 975 O VAL A 64 7.133 -10.283 -0.150 1.00 0.00 O ATOM 976 CB VAL A 64 10.134 -9.217 1.239 1.00 0.00 C ATOM 977 CG1 VAL A 64 9.159 -8.234 1.866 1.00 0.00 C ATOM 978 CG2 VAL A 64 11.182 -9.660 2.250 1.00 0.00 C ATOM 0 H VAL A 64 11.284 -11.122 0.109 1.00 0.00 H new ATOM 0 HA VAL A 64 8.913 -10.978 1.493 1.00 0.00 H new ATOM 0 HB VAL A 64 10.643 -8.712 0.418 1.00 0.00 H new ATOM 0 HG11 VAL A 64 9.708 -7.379 2.261 1.00 0.00 H new ATOM 0 HG12 VAL A 64 8.450 -7.893 1.111 1.00 0.00 H new ATOM 0 HG13 VAL A 64 8.619 -8.724 2.676 1.00 0.00 H new ATOM 0 HG21 VAL A 64 11.703 -8.786 2.641 1.00 0.00 H new ATOM 0 HG22 VAL A 64 10.696 -10.189 3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 64 11.899 -10.322 1.765 1.00 0.00 H new ATOM 988 N TRP A 65 8.724 -9.171 -1.287 1.00 0.00 N ATOM 989 CA TRP A 65 7.797 -8.642 -2.281 1.00 0.00 C ATOM 990 C TRP A 65 7.513 -9.677 -3.365 1.00 0.00 C ATOM 991 O TRP A 65 7.000 -9.344 -4.434 1.00 0.00 O ATOM 992 CB TRP A 65 8.364 -7.369 -2.911 1.00 0.00 C ATOM 993 CG TRP A 65 8.933 -6.413 -1.906 1.00 0.00 C ATOM 994 CD1 TRP A 65 10.179 -5.854 -1.921 1.00 0.00 C ATOM 995 CD2 TRP A 65 8.277 -5.905 -0.739 1.00 0.00 C ATOM 996 NE1 TRP A 65 10.337 -5.029 -0.834 1.00 0.00 N ATOM 997 CE2 TRP A 65 9.185 -5.043 -0.093 1.00 0.00 C ATOM 998 CE3 TRP A 65 7.012 -6.094 -0.177 1.00 0.00 C ATOM 999 CZ2 TRP A 65 8.866 -4.374 1.085 1.00 0.00 C ATOM 1000 CZ3 TRP A 65 6.696 -5.429 0.992 1.00 0.00 C ATOM 1001 CH2 TRP A 65 7.620 -4.577 1.613 1.00 0.00 C ATOM 0 H TRP A 65 9.695 -8.889 -1.423 1.00 0.00 H new ATOM 0 HA TRP A 65 6.860 -8.403 -1.777 1.00 0.00 H new ATOM 0 HB2 TRP A 65 9.142 -7.640 -3.625 1.00 0.00 H new ATOM 0 HB3 TRP A 65 7.576 -6.868 -3.473 1.00 0.00 H new ATOM 0 HD1 TRP A 65 10.930 -6.034 -2.676 1.00 0.00 H new ATOM 0 HE1 TRP A 65 11.176 -4.493 -0.614 1.00 0.00 H new ATOM 0 HE3 TRP A 65 6.294 -6.749 -0.648 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 9.577 -3.718 1.565 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 5.721 -5.568 1.435 1.00 0.00 H new ATOM 0 HH2 TRP A 65 7.343 -4.071 2.526 1.00 0.00 H new ATOM 1012 N SER A 66 7.848 -10.931 -3.082 1.00 0.00 N ATOM 1013 CA SER A 66 7.631 -12.014 -4.035 1.00 0.00 C ATOM 1014 C SER A 66 6.485 -12.913 -3.584 1.00 0.00 C ATOM 1015 O SER A 66 5.747 -13.456 -4.405 1.00 0.00 O ATOM 1016 CB SER A 66 8.909 -12.840 -4.199 1.00 0.00 C ATOM 1017 OG SER A 66 8.899 -13.557 -5.422 1.00 0.00 O ATOM 0 H SER A 66 8.271 -11.223 -2.201 1.00 0.00 H new ATOM 0 HA SER A 66 7.366 -11.572 -4.996 1.00 0.00 H new ATOM 0 HB2 SER A 66 9.778 -12.182 -4.166 1.00 0.00 H new ATOM 0 HB3 SER A 66 9.005 -13.537 -3.366 1.00 0.00 H new ATOM 0 HG SER A 66 9.727 -14.076 -5.504 1.00 0.00 H new ATOM 1023 N ASN A 67 6.343 -13.067 -2.271 1.00 0.00 N ATOM 1024 CA ASN A 67 5.287 -13.901 -1.709 1.00 0.00 C ATOM 1025 C ASN A 67 3.917 -13.462 -2.219 1.00 0.00 C ATOM 1026 O ASN A 67 3.498 -12.326 -2.000 1.00 0.00 O ATOM 1027 CB ASN A 67 5.318 -13.840 -0.181 1.00 0.00 C ATOM 1028 CG ASN A 67 4.609 -15.017 0.460 1.00 0.00 C ATOM 1029 OD1 ASN A 67 3.421 -14.944 0.773 1.00 0.00 O ATOM 1030 ND2 ASN A 67 5.337 -16.110 0.658 1.00 0.00 N ATOM 0 H ASN A 67 6.946 -12.625 -1.577 1.00 0.00 H new ATOM 0 HA ASN A 67 5.462 -14.928 -2.028 1.00 0.00 H new ATOM 0 HB2 ASN A 67 6.354 -13.815 0.158 1.00 0.00 H new ATOM 0 HB3 ASN A 67 4.851 -12.913 0.152 1.00 0.00 H new ATOM 0 HD21 ASN A 67 4.914 -16.934 1.085 1.00 0.00 H new ATOM 0 HD22 ASN A 67 6.319 -16.126 0.383 1.00 0.00 H new ATOM 1037 N GLU A 68 3.225 -14.371 -2.899 1.00 0.00 N ATOM 1038 CA GLU A 68 1.903 -14.076 -3.439 1.00 0.00 C ATOM 1039 C GLU A 68 0.995 -13.488 -2.364 1.00 0.00 C ATOM 1040 O GLU A 68 0.261 -12.532 -2.612 1.00 0.00 O ATOM 1041 CB GLU A 68 1.271 -15.344 -4.019 1.00 0.00 C ATOM 1042 CG GLU A 68 0.203 -15.068 -5.064 1.00 0.00 C ATOM 1043 CD GLU A 68 -0.869 -16.139 -5.099 1.00 0.00 C ATOM 1044 OE1 GLU A 68 -0.982 -16.898 -4.113 1.00 0.00 O ATOM 1045 OE2 GLU A 68 -1.595 -16.220 -6.112 1.00 0.00 O ATOM 0 H GLU A 68 3.557 -15.316 -3.089 1.00 0.00 H new ATOM 0 HA GLU A 68 2.019 -13.339 -4.234 1.00 0.00 H new ATOM 0 HB2 GLU A 68 2.053 -15.959 -4.465 1.00 0.00 H new ATOM 0 HB3 GLU A 68 0.832 -15.925 -3.208 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.260 -14.103 -4.859 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.671 -14.995 -6.046 1.00 0.00 H new ATOM 1052 N ALA A 69 1.050 -14.066 -1.169 1.00 0.00 N ATOM 1053 CA ALA A 69 0.234 -13.599 -0.055 1.00 0.00 C ATOM 1054 C ALA A 69 0.559 -12.151 0.294 1.00 0.00 C ATOM 1055 O ALA A 69 -0.282 -11.263 0.153 1.00 0.00 O ATOM 1056 CB ALA A 69 0.435 -14.494 1.159 1.00 0.00 C ATOM 0 H ALA A 69 1.652 -14.859 -0.947 1.00 0.00 H new ATOM 0 HA ALA A 69 -0.812 -13.647 -0.358 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.181 -14.133 1.983 1.00 0.00 H new ATOM 0 HB2 ALA A 69 0.146 -15.515 0.910 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.484 -14.476 1.455 1.00 0.00 H new ATOM 1062 N VAL A 70 1.786 -11.918 0.752 1.00 0.00 N ATOM 1063 CA VAL A 70 2.222 -10.577 1.121 1.00 0.00 C ATOM 1064 C VAL A 70 1.764 -9.548 0.094 1.00 0.00 C ATOM 1065 O VAL A 70 1.279 -8.473 0.449 1.00 0.00 O ATOM 1066 CB VAL A 70 3.755 -10.503 1.257 1.00 0.00 C ATOM 1067 CG1 VAL A 70 4.199 -9.073 1.521 1.00 0.00 C ATOM 1068 CG2 VAL A 70 4.237 -11.433 2.361 1.00 0.00 C ATOM 0 H VAL A 70 2.495 -12.641 0.876 1.00 0.00 H new ATOM 0 HA VAL A 70 1.767 -10.351 2.085 1.00 0.00 H new ATOM 0 HB VAL A 70 4.202 -10.829 0.318 1.00 0.00 H new ATOM 0 HG11 VAL A 70 5.285 -9.040 1.614 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.887 -8.436 0.693 1.00 0.00 H new ATOM 0 HG13 VAL A 70 3.745 -8.716 2.445 1.00 0.00 H new ATOM 0 HG21 VAL A 70 5.322 -11.368 2.443 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.783 -11.140 3.308 1.00 0.00 H new ATOM 0 HG23 VAL A 70 3.952 -12.458 2.124 1.00 0.00 H new ATOM 1078 N LYS A 71 1.920 -9.883 -1.182 1.00 0.00 N ATOM 1079 CA LYS A 71 1.521 -8.990 -2.263 1.00 0.00 C ATOM 1080 C LYS A 71 0.009 -8.785 -2.269 1.00 0.00 C ATOM 1081 O LYS A 71 -0.473 -7.654 -2.238 1.00 0.00 O ATOM 1082 CB LYS A 71 1.975 -9.553 -3.612 1.00 0.00 C ATOM 1083 CG LYS A 71 3.485 -9.655 -3.750 1.00 0.00 C ATOM 1084 CD LYS A 71 3.885 -10.809 -4.654 1.00 0.00 C ATOM 1085 CE LYS A 71 3.857 -10.405 -6.120 1.00 0.00 C ATOM 1086 NZ LYS A 71 2.468 -10.351 -6.654 1.00 0.00 N ATOM 0 H LYS A 71 2.321 -10.768 -1.493 1.00 0.00 H new ATOM 0 HA LYS A 71 2.001 -8.025 -2.099 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.538 -10.542 -3.749 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.587 -8.920 -4.410 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.878 -8.722 -4.154 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.933 -9.790 -2.766 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.886 -11.150 -4.389 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.209 -11.649 -4.494 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.329 -9.430 -6.237 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.443 -11.115 -6.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.339 -11.102 -7.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.791 -10.488 -5.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.303 -9.425 -7.098 1.00 0.00 H new ATOM 1100 N ASN A 72 -0.733 -9.887 -2.309 1.00 0.00 N ATOM 1101 CA ASN A 72 -2.190 -9.827 -2.318 1.00 0.00 C ATOM 1102 C ASN A 72 -2.710 -9.049 -1.113 1.00 0.00 C ATOM 1103 O ASN A 72 -3.774 -8.431 -1.173 1.00 0.00 O ATOM 1104 CB ASN A 72 -2.779 -11.239 -2.320 1.00 0.00 C ATOM 1105 CG ASN A 72 -2.244 -12.087 -3.458 1.00 0.00 C ATOM 1106 OD1 ASN A 72 -1.727 -11.565 -4.446 1.00 0.00 O ATOM 1107 ND2 ASN A 72 -2.367 -13.402 -3.324 1.00 0.00 N ATOM 0 H ASN A 72 -0.349 -10.832 -2.336 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.502 -9.309 -3.225 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.553 -11.725 -1.371 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -3.865 -11.177 -2.396 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -2.026 -14.023 -4.057 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -2.802 -13.791 -2.488 1.00 0.00 H new ATOM 1114 N ILE A 73 -1.953 -9.083 -0.022 1.00 0.00 N ATOM 1115 CA ILE A 73 -2.337 -8.380 1.196 1.00 0.00 C ATOM 1116 C ILE A 73 -2.002 -6.895 1.102 1.00 0.00 C ATOM 1117 O ILE A 73 -2.876 -6.041 1.250 1.00 0.00 O ATOM 1118 CB ILE A 73 -1.639 -8.975 2.433 1.00 0.00 C ATOM 1119 CG1 ILE A 73 -1.996 -10.455 2.585 1.00 0.00 C ATOM 1120 CG2 ILE A 73 -2.026 -8.199 3.684 1.00 0.00 C ATOM 1121 CD1 ILE A 73 -1.060 -11.211 3.502 1.00 0.00 C ATOM 0 H ILE A 73 -1.070 -9.590 0.044 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.415 -8.501 1.304 1.00 0.00 H new ATOM 0 HB ILE A 73 -0.560 -8.893 2.298 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.013 -10.538 2.969 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -1.987 -10.925 1.602 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.525 -8.631 4.550 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.725 -7.157 3.573 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.105 -8.252 3.826 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -1.373 -12.253 3.563 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.045 -11.159 3.108 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -1.087 -10.766 4.497 1.00 0.00 H new ATOM 1133 N ILE A 74 -0.732 -6.595 0.853 1.00 0.00 N ATOM 1134 CA ILE A 74 -0.282 -5.214 0.736 1.00 0.00 C ATOM 1135 C ILE A 74 -1.057 -4.473 -0.349 1.00 0.00 C ATOM 1136 O ILE A 74 -1.167 -3.247 -0.321 1.00 0.00 O ATOM 1137 CB ILE A 74 1.223 -5.136 0.419 1.00 0.00 C ATOM 1138 CG1 ILE A 74 2.037 -5.779 1.544 1.00 0.00 C ATOM 1139 CG2 ILE A 74 1.647 -3.690 0.210 1.00 0.00 C ATOM 1140 CD1 ILE A 74 3.430 -6.190 1.123 1.00 0.00 C ATOM 0 H ILE A 74 0.004 -7.290 0.728 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.467 -4.740 1.700 1.00 0.00 H new ATOM 0 HB ILE A 74 1.414 -5.686 -0.502 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.110 -5.078 2.375 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.504 -6.656 1.912 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.713 -3.652 -0.013 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.087 -3.263 -0.622 1.00 0.00 H new ATOM 0 HG23 ILE A 74 1.445 -3.117 1.115 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.949 -6.638 1.970 1.00 0.00 H new ATOM 0 HD12 ILE A 74 3.366 -6.915 0.312 1.00 0.00 H new ATOM 0 HD13 ILE A 74 3.981 -5.313 0.783 1.00 0.00 H new ATOM 1152 N ARG A 75 -1.595 -5.226 -1.303 1.00 0.00 N ATOM 1153 CA ARG A 75 -2.361 -4.642 -2.397 1.00 0.00 C ATOM 1154 C ARG A 75 -3.833 -4.506 -2.018 1.00 0.00 C ATOM 1155 O ARG A 75 -4.472 -3.500 -2.326 1.00 0.00 O ATOM 1156 CB ARG A 75 -2.225 -5.498 -3.658 1.00 0.00 C ATOM 1157 CG ARG A 75 -3.093 -6.745 -3.643 1.00 0.00 C ATOM 1158 CD ARG A 75 -2.975 -7.521 -4.946 1.00 0.00 C ATOM 1159 NE ARG A 75 -3.660 -6.849 -6.047 1.00 0.00 N ATOM 1160 CZ ARG A 75 -4.946 -7.024 -6.328 1.00 0.00 C ATOM 1161 NH1 ARG A 75 -5.683 -7.845 -5.593 1.00 0.00 N ATOM 1162 NH2 ARG A 75 -5.498 -6.377 -7.347 1.00 0.00 N ATOM 0 H ARG A 75 -1.514 -6.242 -1.340 1.00 0.00 H new ATOM 0 HA ARG A 75 -1.961 -3.648 -2.597 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -2.486 -4.894 -4.527 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -1.182 -5.793 -3.776 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -2.800 -7.384 -2.810 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -4.133 -6.464 -3.478 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -1.922 -7.648 -5.198 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -3.394 -8.518 -4.813 1.00 0.00 H new ATOM 0 HE ARG A 75 -3.121 -6.210 -6.632 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -5.263 -8.344 -4.809 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -6.671 -7.977 -5.811 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -4.934 -5.745 -7.915 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -6.486 -6.512 -7.562 1.00 0.00 H new ATOM 1176 N GLU A 76 -4.364 -5.525 -1.350 1.00 0.00 N ATOM 1177 CA GLU A 76 -5.760 -5.519 -0.931 1.00 0.00 C ATOM 1178 C GLU A 76 -5.928 -4.780 0.393 1.00 0.00 C ATOM 1179 O GLU A 76 -6.543 -3.715 0.449 1.00 0.00 O ATOM 1180 CB GLU A 76 -6.282 -6.951 -0.798 1.00 0.00 C ATOM 1181 CG GLU A 76 -7.761 -7.031 -0.459 1.00 0.00 C ATOM 1182 CD GLU A 76 -8.395 -8.332 -0.915 1.00 0.00 C ATOM 1183 OE1 GLU A 76 -7.662 -9.334 -1.044 1.00 0.00 O ATOM 1184 OE2 GLU A 76 -9.622 -8.347 -1.142 1.00 0.00 O ATOM 0 H GLU A 76 -3.848 -6.365 -1.088 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.339 -4.998 -1.694 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -6.103 -7.482 -1.733 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -5.712 -7.466 -0.025 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -7.889 -6.927 0.618 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -8.282 -6.194 -0.924 1.00 0.00 H new ATOM 1191 N HIS A 77 -5.377 -5.354 1.458 1.00 0.00 N ATOM 1192 CA HIS A 77 -5.465 -4.751 2.783 1.00 0.00 C ATOM 1193 C HIS A 77 -4.810 -3.373 2.797 1.00 0.00 C ATOM 1194 O HIS A 77 -5.282 -2.456 3.469 1.00 0.00 O ATOM 1195 CB HIS A 77 -4.802 -5.654 3.824 1.00 0.00 C ATOM 1196 CG HIS A 77 -5.683 -6.769 4.297 1.00 0.00 C ATOM 1197 ND1 HIS A 77 -6.807 -6.565 5.068 1.00 0.00 N ATOM 1198 CD2 HIS A 77 -5.600 -8.106 4.102 1.00 0.00 C ATOM 1199 CE1 HIS A 77 -7.377 -7.728 5.329 1.00 0.00 C ATOM 1200 NE2 HIS A 77 -6.665 -8.679 4.753 1.00 0.00 N ATOM 0 H HIS A 77 -4.865 -6.236 1.429 1.00 0.00 H new ATOM 0 HA HIS A 77 -6.520 -4.636 3.033 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -3.891 -6.077 3.399 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -4.504 -5.049 4.680 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -4.838 -8.625 3.539 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -8.273 -7.876 5.914 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -6.872 -9.677 4.786 1.00 0.00 H new ATOM 1209 N PHE A 78 -3.718 -3.235 2.052 1.00 0.00 N ATOM 1210 CA PHE A 78 -2.997 -1.969 1.980 1.00 0.00 C ATOM 1211 C PHE A 78 -2.878 -1.492 0.536 1.00 0.00 C ATOM 1212 O PHE A 78 -3.318 -2.172 -0.392 1.00 0.00 O ATOM 1213 CB PHE A 78 -1.604 -2.116 2.597 1.00 0.00 C ATOM 1214 CG PHE A 78 -1.622 -2.670 3.993 1.00 0.00 C ATOM 1215 CD1 PHE A 78 -2.033 -3.971 4.232 1.00 0.00 C ATOM 1216 CD2 PHE A 78 -1.229 -1.888 5.067 1.00 0.00 C ATOM 1217 CE1 PHE A 78 -2.051 -4.483 5.515 1.00 0.00 C ATOM 1218 CE2 PHE A 78 -1.244 -2.395 6.353 1.00 0.00 C ATOM 1219 CZ PHE A 78 -1.656 -3.694 6.577 1.00 0.00 C ATOM 0 H PHE A 78 -3.313 -3.984 1.490 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.561 -1.226 2.544 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -1.002 -2.768 1.964 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -1.115 -1.142 2.608 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.343 -4.593 3.405 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -0.907 -0.871 4.898 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -2.374 -5.499 5.687 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.934 -1.776 7.182 1.00 0.00 H new ATOM 0 HZ PHE A 78 -1.669 -4.092 7.581 1.00 0.00 H new ATOM 1229 N ILE A 79 -2.280 -0.320 0.354 1.00 0.00 N ATOM 1230 CA ILE A 79 -2.103 0.248 -0.977 1.00 0.00 C ATOM 1231 C ILE A 79 -0.633 0.246 -1.384 1.00 0.00 C ATOM 1232 O ILE A 79 0.176 0.990 -0.830 1.00 0.00 O ATOM 1233 CB ILE A 79 -2.643 1.689 -1.051 1.00 0.00 C ATOM 1234 CG1 ILE A 79 -4.119 1.724 -0.652 1.00 0.00 C ATOM 1235 CG2 ILE A 79 -2.453 2.254 -2.451 1.00 0.00 C ATOM 1236 CD1 ILE A 79 -5.023 0.987 -1.615 1.00 0.00 C ATOM 0 H ILE A 79 -1.910 0.255 1.111 1.00 0.00 H new ATOM 0 HA ILE A 79 -2.669 -0.379 -1.666 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.082 2.309 -0.351 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.229 1.289 0.342 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -4.444 2.762 -0.584 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -2.839 3.273 -2.488 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -1.392 2.259 -2.700 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -2.992 1.636 -3.169 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -6.055 1.054 -1.269 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.943 1.436 -2.605 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.724 -0.060 -1.666 1.00 0.00 H new ATOM 1248 N PHE A 80 -0.296 -0.593 -2.357 1.00 0.00 N ATOM 1249 CA PHE A 80 1.077 -0.691 -2.840 1.00 0.00 C ATOM 1250 C PHE A 80 1.518 0.614 -3.496 1.00 0.00 C ATOM 1251 O PHE A 80 1.035 0.975 -4.570 1.00 0.00 O ATOM 1252 CB PHE A 80 1.208 -1.846 -3.836 1.00 0.00 C ATOM 1253 CG PHE A 80 2.625 -2.298 -4.045 1.00 0.00 C ATOM 1254 CD1 PHE A 80 3.217 -3.193 -3.168 1.00 0.00 C ATOM 1255 CD2 PHE A 80 3.364 -1.830 -5.119 1.00 0.00 C ATOM 1256 CE1 PHE A 80 4.521 -3.610 -3.358 1.00 0.00 C ATOM 1257 CE2 PHE A 80 4.668 -2.244 -5.315 1.00 0.00 C ATOM 1258 CZ PHE A 80 5.247 -3.137 -4.434 1.00 0.00 C ATOM 0 H PHE A 80 -0.954 -1.215 -2.827 1.00 0.00 H new ATOM 0 HA PHE A 80 1.724 -0.883 -1.984 1.00 0.00 H new ATOM 0 HB2 PHE A 80 0.614 -2.689 -3.483 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.788 -1.539 -4.794 1.00 0.00 H new ATOM 0 HD1 PHE A 80 2.653 -3.569 -2.327 1.00 0.00 H new ATOM 0 HD2 PHE A 80 2.916 -1.133 -5.812 1.00 0.00 H new ATOM 0 HE1 PHE A 80 4.972 -4.305 -2.666 1.00 0.00 H new ATOM 0 HE2 PHE A 80 5.234 -1.870 -6.156 1.00 0.00 H new ATOM 0 HZ PHE A 80 6.265 -3.465 -4.586 1.00 0.00 H new ATOM 1268 N TRP A 81 2.436 1.316 -2.843 1.00 0.00 N ATOM 1269 CA TRP A 81 2.942 2.582 -3.362 1.00 0.00 C ATOM 1270 C TRP A 81 4.466 2.601 -3.361 1.00 0.00 C ATOM 1271 O TRP A 81 5.092 2.728 -2.309 1.00 0.00 O ATOM 1272 CB TRP A 81 2.404 3.749 -2.532 1.00 0.00 C ATOM 1273 CG TRP A 81 2.540 5.076 -3.214 1.00 0.00 C ATOM 1274 CD1 TRP A 81 2.016 5.433 -4.424 1.00 0.00 C ATOM 1275 CD2 TRP A 81 3.246 6.222 -2.727 1.00 0.00 C ATOM 1276 NE1 TRP A 81 2.355 6.731 -4.719 1.00 0.00 N ATOM 1277 CE2 TRP A 81 3.109 7.238 -3.693 1.00 0.00 C ATOM 1278 CE3 TRP A 81 3.980 6.490 -1.568 1.00 0.00 C ATOM 1279 CZ2 TRP A 81 3.679 8.498 -3.534 1.00 0.00 C ATOM 1280 CZ3 TRP A 81 4.546 7.741 -1.412 1.00 0.00 C ATOM 1281 CH2 TRP A 81 4.392 8.732 -2.390 1.00 0.00 C ATOM 0 H TRP A 81 2.846 1.031 -1.953 1.00 0.00 H new ATOM 0 HA TRP A 81 2.597 2.688 -4.391 1.00 0.00 H new ATOM 0 HB2 TRP A 81 1.353 3.571 -2.307 1.00 0.00 H new ATOM 0 HB3 TRP A 81 2.933 3.782 -1.580 1.00 0.00 H new ATOM 0 HD1 TRP A 81 1.422 4.789 -5.056 1.00 0.00 H new ATOM 0 HE1 TRP A 81 2.089 7.236 -5.564 1.00 0.00 H new ATOM 0 HE3 TRP A 81 4.103 5.733 -0.808 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 3.563 9.264 -4.287 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 5.117 7.958 -0.521 1.00 0.00 H new ATOM 0 HH2 TRP A 81 4.845 9.700 -2.238 1.00 0.00 H new ATOM 1292 N GLN A 82 5.056 2.474 -4.545 1.00 0.00 N ATOM 1293 CA GLN A 82 6.508 2.476 -4.678 1.00 0.00 C ATOM 1294 C GLN A 82 7.001 3.802 -5.248 1.00 0.00 C ATOM 1295 O GLN A 82 6.545 4.244 -6.303 1.00 0.00 O ATOM 1296 CB GLN A 82 6.961 1.322 -5.575 1.00 0.00 C ATOM 1297 CG GLN A 82 8.442 1.362 -5.916 1.00 0.00 C ATOM 1298 CD GLN A 82 8.943 0.052 -6.492 1.00 0.00 C ATOM 1299 OE1 GLN A 82 9.088 -0.091 -7.706 1.00 0.00 O ATOM 1300 NE2 GLN A 82 9.212 -0.914 -5.621 1.00 0.00 N ATOM 0 H GLN A 82 4.552 2.369 -5.425 1.00 0.00 H new ATOM 0 HA GLN A 82 6.938 2.346 -3.685 1.00 0.00 H new ATOM 0 HB2 GLN A 82 6.736 0.378 -5.079 1.00 0.00 H new ATOM 0 HB3 GLN A 82 6.383 1.343 -6.499 1.00 0.00 H new ATOM 0 HG2 GLN A 82 8.625 2.163 -6.632 1.00 0.00 H new ATOM 0 HG3 GLN A 82 9.012 1.601 -5.018 1.00 0.00 H new ATOM 0 HE21 GLN A 82 9.078 -0.753 -4.623 1.00 0.00 H new ATOM 0 HE22 GLN A 82 9.553 -1.817 -5.950 1.00 0.00 H new ATOM 1309 N VAL A 83 7.934 4.433 -4.543 1.00 0.00 N ATOM 1310 CA VAL A 83 8.489 5.709 -4.980 1.00 0.00 C ATOM 1311 C VAL A 83 9.908 5.899 -4.455 1.00 0.00 C ATOM 1312 O VAL A 83 10.160 5.772 -3.256 1.00 0.00 O ATOM 1313 CB VAL A 83 7.618 6.890 -4.511 1.00 0.00 C ATOM 1314 CG1 VAL A 83 6.231 6.808 -5.130 1.00 0.00 C ATOM 1315 CG2 VAL A 83 7.533 6.919 -2.993 1.00 0.00 C ATOM 0 H VAL A 83 8.322 4.082 -3.667 1.00 0.00 H new ATOM 0 HA VAL A 83 8.507 5.690 -6.070 1.00 0.00 H new ATOM 0 HB VAL A 83 8.084 7.818 -4.843 1.00 0.00 H new ATOM 0 HG11 VAL A 83 5.629 7.650 -4.788 1.00 0.00 H new ATOM 0 HG12 VAL A 83 6.315 6.840 -6.216 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.753 5.875 -4.830 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.914 7.760 -2.679 1.00 0.00 H new ATOM 0 HG22 VAL A 83 7.091 5.989 -2.636 1.00 0.00 H new ATOM 0 HG23 VAL A 83 8.533 7.029 -2.575 1.00 0.00 H new ATOM 1325 N TYR A 84 10.831 6.205 -5.359 1.00 0.00 N ATOM 1326 CA TYR A 84 12.226 6.411 -4.988 1.00 0.00 C ATOM 1327 C TYR A 84 12.402 7.728 -4.238 1.00 0.00 C ATOM 1328 O TYR A 84 11.540 8.606 -4.291 1.00 0.00 O ATOM 1329 CB TYR A 84 13.114 6.399 -6.234 1.00 0.00 C ATOM 1330 CG TYR A 84 13.430 5.009 -6.738 1.00 0.00 C ATOM 1331 CD1 TYR A 84 12.422 4.073 -6.932 1.00 0.00 C ATOM 1332 CD2 TYR A 84 14.737 4.632 -7.022 1.00 0.00 C ATOM 1333 CE1 TYR A 84 12.706 2.801 -7.391 1.00 0.00 C ATOM 1334 CE2 TYR A 84 15.031 3.363 -7.483 1.00 0.00 C ATOM 1335 CZ TYR A 84 14.012 2.451 -7.666 1.00 0.00 C ATOM 1336 OH TYR A 84 14.299 1.187 -8.126 1.00 0.00 O ATOM 0 H TYR A 84 10.639 6.316 -6.355 1.00 0.00 H new ATOM 0 HA TYR A 84 12.524 5.596 -4.329 1.00 0.00 H new ATOM 0 HB2 TYR A 84 12.621 6.961 -7.027 1.00 0.00 H new ATOM 0 HB3 TYR A 84 14.047 6.916 -6.010 1.00 0.00 H new ATOM 0 HD1 TYR A 84 11.398 4.344 -6.720 1.00 0.00 H new ATOM 0 HD2 TYR A 84 15.537 5.343 -6.880 1.00 0.00 H new ATOM 0 HE1 TYR A 84 11.910 2.085 -7.534 1.00 0.00 H new ATOM 0 HE2 TYR A 84 16.052 3.087 -7.699 1.00 0.00 H new ATOM 0 HH TYR A 84 15.264 1.103 -8.272 1.00 0.00 H new ATOM 1346 N HIS A 85 13.525 7.859 -3.540 1.00 0.00 N ATOM 1347 CA HIS A 85 13.816 9.069 -2.780 1.00 0.00 C ATOM 1348 C HIS A 85 14.250 10.201 -3.705 1.00 0.00 C ATOM 1349 O HIS A 85 13.929 11.366 -3.470 1.00 0.00 O ATOM 1350 CB HIS A 85 14.906 8.796 -1.743 1.00 0.00 C ATOM 1351 CG HIS A 85 16.081 8.047 -2.293 1.00 0.00 C ATOM 1352 ND1 HIS A 85 16.463 6.804 -1.835 1.00 0.00 N ATOM 1353 CD2 HIS A 85 16.960 8.373 -3.270 1.00 0.00 C ATOM 1354 CE1 HIS A 85 17.527 6.398 -2.505 1.00 0.00 C ATOM 1355 NE2 HIS A 85 17.848 7.332 -3.382 1.00 0.00 N ATOM 0 H HIS A 85 14.249 7.142 -3.485 1.00 0.00 H new ATOM 0 HA HIS A 85 12.904 9.373 -2.266 1.00 0.00 H new ATOM 0 HB2 HIS A 85 15.250 9.745 -1.331 1.00 0.00 H new ATOM 0 HB3 HIS A 85 14.477 8.228 -0.918 1.00 0.00 H new ATOM 0 HD2 HIS A 85 16.962 9.282 -3.853 1.00 0.00 H new ATOM 0 HE1 HIS A 85 18.046 5.462 -2.360 1.00 0.00 H new ATOM 0 HE2 HIS A 85 18.629 7.287 -4.036 1.00 0.00 H new ATOM 1364 N ASP A 86 14.982 9.851 -4.757 1.00 0.00 N ATOM 1365 CA ASP A 86 15.461 10.838 -5.719 1.00 0.00 C ATOM 1366 C ASP A 86 14.297 11.624 -6.315 1.00 0.00 C ATOM 1367 O ASP A 86 14.349 12.849 -6.416 1.00 0.00 O ATOM 1368 CB ASP A 86 16.254 10.153 -6.832 1.00 0.00 C ATOM 1369 CG ASP A 86 16.837 11.144 -7.821 1.00 0.00 C ATOM 1370 OD1 ASP A 86 17.836 11.810 -7.476 1.00 0.00 O ATOM 1371 OD2 ASP A 86 16.294 11.253 -8.940 1.00 0.00 O ATOM 0 H ASP A 86 15.257 8.891 -4.966 1.00 0.00 H new ATOM 0 HA ASP A 86 16.115 11.534 -5.194 1.00 0.00 H new ATOM 0 HB2 ASP A 86 17.060 9.566 -6.392 1.00 0.00 H new ATOM 0 HB3 ASP A 86 15.604 9.456 -7.361 1.00 0.00 H new ATOM 1376 N SER A 87 13.249 10.909 -6.711 1.00 0.00 N ATOM 1377 CA SER A 87 12.074 11.539 -7.303 1.00 0.00 C ATOM 1378 C SER A 87 11.423 12.507 -6.320 1.00 0.00 C ATOM 1379 O SER A 87 11.618 12.403 -5.110 1.00 0.00 O ATOM 1380 CB SER A 87 11.062 10.475 -7.734 1.00 0.00 C ATOM 1381 OG SER A 87 10.586 9.742 -6.619 1.00 0.00 O ATOM 0 H SER A 87 13.189 9.894 -6.633 1.00 0.00 H new ATOM 0 HA SER A 87 12.396 12.101 -8.180 1.00 0.00 H new ATOM 0 HB2 SER A 87 10.225 10.951 -8.245 1.00 0.00 H new ATOM 0 HB3 SER A 87 11.526 9.795 -8.448 1.00 0.00 H new ATOM 0 HG SER A 87 11.337 9.518 -6.030 1.00 0.00 H new ATOM 1387 N GLU A 88 10.650 13.449 -6.851 1.00 0.00 N ATOM 1388 CA GLU A 88 9.971 14.437 -6.020 1.00 0.00 C ATOM 1389 C GLU A 88 9.154 13.758 -4.925 1.00 0.00 C ATOM 1390 O GLU A 88 9.300 14.071 -3.744 1.00 0.00 O ATOM 1391 CB GLU A 88 9.061 15.318 -6.878 1.00 0.00 C ATOM 1392 CG GLU A 88 7.984 14.543 -7.618 1.00 0.00 C ATOM 1393 CD GLU A 88 7.297 15.372 -8.686 1.00 0.00 C ATOM 1394 OE1 GLU A 88 6.938 16.532 -8.395 1.00 0.00 O ATOM 1395 OE2 GLU A 88 7.118 14.861 -9.811 1.00 0.00 O ATOM 0 H GLU A 88 10.478 13.549 -7.851 1.00 0.00 H new ATOM 0 HA GLU A 88 10.730 15.061 -5.549 1.00 0.00 H new ATOM 0 HB2 GLU A 88 8.587 16.064 -6.241 1.00 0.00 H new ATOM 0 HB3 GLU A 88 9.671 15.858 -7.602 1.00 0.00 H new ATOM 0 HG2 GLU A 88 8.428 13.661 -8.078 1.00 0.00 H new ATOM 0 HG3 GLU A 88 7.240 14.190 -6.904 1.00 0.00 H new ATOM 1402 N GLU A 89 8.294 12.827 -5.327 1.00 0.00 N ATOM 1403 CA GLU A 89 7.453 12.104 -4.380 1.00 0.00 C ATOM 1404 C GLU A 89 8.250 11.700 -3.143 1.00 0.00 C ATOM 1405 O GLU A 89 7.821 11.928 -2.013 1.00 0.00 O ATOM 1406 CB GLU A 89 6.852 10.863 -5.041 1.00 0.00 C ATOM 1407 CG GLU A 89 5.839 11.182 -6.128 1.00 0.00 C ATOM 1408 CD GLU A 89 5.764 10.103 -7.191 1.00 0.00 C ATOM 1409 OE1 GLU A 89 6.826 9.557 -7.558 1.00 0.00 O ATOM 1410 OE2 GLU A 89 4.644 9.806 -7.656 1.00 0.00 O ATOM 0 H GLU A 89 8.162 12.556 -6.301 1.00 0.00 H new ATOM 0 HA GLU A 89 6.646 12.768 -4.070 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.656 10.265 -5.470 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.372 10.251 -4.277 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.855 11.311 -5.676 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.101 12.131 -6.596 1.00 0.00 H new ATOM 1417 N GLY A 90 9.414 11.097 -3.367 1.00 0.00 N ATOM 1418 CA GLY A 90 10.252 10.669 -2.263 1.00 0.00 C ATOM 1419 C GLY A 90 10.930 11.832 -1.565 1.00 0.00 C ATOM 1420 O GLY A 90 11.005 11.868 -0.337 1.00 0.00 O ATOM 0 H GLY A 90 9.791 10.898 -4.294 1.00 0.00 H new ATOM 0 HA2 GLY A 90 9.646 10.120 -1.542 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.010 9.979 -2.633 1.00 0.00 H new ATOM 1424 N GLN A 91 11.427 12.782 -2.350 1.00 0.00 N ATOM 1425 CA GLN A 91 12.104 13.950 -1.800 1.00 0.00 C ATOM 1426 C GLN A 91 11.300 14.557 -0.655 1.00 0.00 C ATOM 1427 O GLN A 91 11.860 14.963 0.364 1.00 0.00 O ATOM 1428 CB GLN A 91 12.329 14.998 -2.892 1.00 0.00 C ATOM 1429 CG GLN A 91 13.361 14.584 -3.928 1.00 0.00 C ATOM 1430 CD GLN A 91 14.776 14.942 -3.517 1.00 0.00 C ATOM 1431 OE1 GLN A 91 15.296 15.993 -3.891 1.00 0.00 O ATOM 1432 NE2 GLN A 91 15.407 14.067 -2.743 1.00 0.00 N ATOM 0 H GLN A 91 11.374 12.766 -3.368 1.00 0.00 H new ATOM 0 HA GLN A 91 13.070 13.628 -1.411 1.00 0.00 H new ATOM 0 HB2 GLN A 91 11.382 15.197 -3.394 1.00 0.00 H new ATOM 0 HB3 GLN A 91 12.646 15.932 -2.428 1.00 0.00 H new ATOM 0 HG2 GLN A 91 13.295 13.508 -4.091 1.00 0.00 H new ATOM 0 HG3 GLN A 91 13.130 15.065 -4.878 1.00 0.00 H new ATOM 0 HE21 GLN A 91 14.938 13.208 -2.457 1.00 0.00 H new ATOM 0 HE22 GLN A 91 16.361 14.254 -2.435 1.00 0.00 H new ATOM 1441 N ARG A 92 9.983 14.615 -0.828 1.00 0.00 N ATOM 1442 CA ARG A 92 9.102 15.173 0.190 1.00 0.00 C ATOM 1443 C ARG A 92 8.996 14.237 1.390 1.00 0.00 C ATOM 1444 O ARG A 92 9.039 14.676 2.539 1.00 0.00 O ATOM 1445 CB ARG A 92 7.712 15.431 -0.394 1.00 0.00 C ATOM 1446 CG ARG A 92 7.701 16.471 -1.503 1.00 0.00 C ATOM 1447 CD ARG A 92 6.511 16.283 -2.431 1.00 0.00 C ATOM 1448 NE ARG A 92 6.297 17.445 -3.290 1.00 0.00 N ATOM 1449 CZ ARG A 92 5.601 18.514 -2.919 1.00 0.00 C ATOM 1450 NH1 ARG A 92 5.055 18.568 -1.713 1.00 0.00 N ATOM 1451 NH2 ARG A 92 5.451 19.532 -3.757 1.00 0.00 N ATOM 0 H ARG A 92 9.503 14.282 -1.664 1.00 0.00 H new ATOM 0 HA ARG A 92 9.529 16.118 0.525 1.00 0.00 H new ATOM 0 HB2 ARG A 92 7.310 14.495 -0.781 1.00 0.00 H new ATOM 0 HB3 ARG A 92 7.046 15.757 0.405 1.00 0.00 H new ATOM 0 HG2 ARG A 92 7.669 17.469 -1.067 1.00 0.00 H new ATOM 0 HG3 ARG A 92 8.625 16.403 -2.076 1.00 0.00 H new ATOM 0 HD2 ARG A 92 6.670 15.400 -3.049 1.00 0.00 H new ATOM 0 HD3 ARG A 92 5.615 16.100 -1.838 1.00 0.00 H new ATOM 0 HE ARG A 92 6.704 17.435 -4.225 1.00 0.00 H new ATOM 0 HH11 ARG A 92 5.168 17.787 -1.066 1.00 0.00 H new ATOM 0 HH12 ARG A 92 4.521 19.390 -1.431 1.00 0.00 H new ATOM 0 HH21 ARG A 92 5.870 19.494 -4.686 1.00 0.00 H new ATOM 0 HH22 ARG A 92 4.917 20.353 -3.472 1.00 0.00 H new ATOM 1465 N TYR A 93 8.855 12.945 1.114 1.00 0.00 N ATOM 1466 CA TYR A 93 8.740 11.946 2.171 1.00 0.00 C ATOM 1467 C TYR A 93 9.885 12.075 3.170 1.00 0.00 C ATOM 1468 O TYR A 93 9.672 12.049 4.382 1.00 0.00 O ATOM 1469 CB TYR A 93 8.726 10.539 1.572 1.00 0.00 C ATOM 1470 CG TYR A 93 8.445 9.452 2.585 1.00 0.00 C ATOM 1471 CD1 TYR A 93 7.207 9.360 3.208 1.00 0.00 C ATOM 1472 CD2 TYR A 93 9.417 8.518 2.918 1.00 0.00 C ATOM 1473 CE1 TYR A 93 6.946 8.369 4.135 1.00 0.00 C ATOM 1474 CE2 TYR A 93 9.165 7.523 3.843 1.00 0.00 C ATOM 1475 CZ TYR A 93 7.928 7.453 4.449 1.00 0.00 C ATOM 1476 OH TYR A 93 7.672 6.464 5.370 1.00 0.00 O ATOM 0 H TYR A 93 8.818 12.565 0.168 1.00 0.00 H new ATOM 0 HA TYR A 93 7.802 12.118 2.698 1.00 0.00 H new ATOM 0 HB2 TYR A 93 7.972 10.495 0.786 1.00 0.00 H new ATOM 0 HB3 TYR A 93 9.689 10.344 1.101 1.00 0.00 H new ATOM 0 HD1 TYR A 93 6.435 10.075 2.964 1.00 0.00 H new ATOM 0 HD2 TYR A 93 10.387 8.570 2.446 1.00 0.00 H new ATOM 0 HE1 TYR A 93 5.978 8.312 4.611 1.00 0.00 H new ATOM 0 HE2 TYR A 93 9.932 6.804 4.090 1.00 0.00 H new ATOM 0 HH TYR A 93 8.507 6.205 5.812 1.00 0.00 H new ATOM 1486 N ILE A 94 11.101 12.215 2.651 1.00 0.00 N ATOM 1487 CA ILE A 94 12.280 12.349 3.497 1.00 0.00 C ATOM 1488 C ILE A 94 12.073 13.419 4.563 1.00 0.00 C ATOM 1489 O ILE A 94 12.265 13.168 5.753 1.00 0.00 O ATOM 1490 CB ILE A 94 13.530 12.702 2.668 1.00 0.00 C ATOM 1491 CG1 ILE A 94 13.797 11.618 1.621 1.00 0.00 C ATOM 1492 CG2 ILE A 94 14.737 12.876 3.577 1.00 0.00 C ATOM 1493 CD1 ILE A 94 14.652 12.090 0.467 1.00 0.00 C ATOM 0 H ILE A 94 11.295 12.238 1.650 1.00 0.00 H new ATOM 0 HA ILE A 94 12.434 11.384 3.979 1.00 0.00 H new ATOM 0 HB ILE A 94 13.350 13.645 2.151 1.00 0.00 H new ATOM 0 HG12 ILE A 94 14.287 10.772 2.103 1.00 0.00 H new ATOM 0 HG13 ILE A 94 12.845 11.257 1.233 1.00 0.00 H new ATOM 0 HG21 ILE A 94 15.612 13.125 2.976 1.00 0.00 H new ATOM 0 HG22 ILE A 94 14.544 13.679 4.288 1.00 0.00 H new ATOM 0 HG23 ILE A 94 14.921 11.948 4.119 1.00 0.00 H new ATOM 0 HD11 ILE A 94 14.800 11.270 -0.236 1.00 0.00 H new ATOM 0 HD12 ILE A 94 14.155 12.917 -0.040 1.00 0.00 H new ATOM 0 HD13 ILE A 94 15.619 12.424 0.843 1.00 0.00 H new ATOM 1505 N GLN A 95 11.680 14.612 4.129 1.00 0.00 N ATOM 1506 CA GLN A 95 11.445 15.720 5.047 1.00 0.00 C ATOM 1507 C GLN A 95 10.327 15.386 6.028 1.00 0.00 C ATOM 1508 O GLN A 95 10.409 15.712 7.213 1.00 0.00 O ATOM 1509 CB GLN A 95 11.095 16.990 4.269 1.00 0.00 C ATOM 1510 CG GLN A 95 12.228 17.497 3.391 1.00 0.00 C ATOM 1511 CD GLN A 95 13.570 17.466 4.096 1.00 0.00 C ATOM 1512 OE1 GLN A 95 13.769 18.138 5.109 1.00 0.00 O ATOM 1513 NE2 GLN A 95 14.501 16.684 3.562 1.00 0.00 N ATOM 0 H GLN A 95 11.518 14.836 3.147 1.00 0.00 H new ATOM 0 HA GLN A 95 12.361 15.890 5.613 1.00 0.00 H new ATOM 0 HB2 GLN A 95 10.222 16.795 3.645 1.00 0.00 H new ATOM 0 HB3 GLN A 95 10.815 17.773 4.974 1.00 0.00 H new ATOM 0 HG2 GLN A 95 12.282 16.890 2.487 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.010 18.518 3.077 1.00 0.00 H new ATOM 0 HE21 GLN A 95 14.293 16.144 2.722 1.00 0.00 H new ATOM 0 HE22 GLN A 95 15.424 16.623 3.992 1.00 0.00 H new ATOM 1522 N PHE A 96 9.282 14.736 5.528 1.00 0.00 N ATOM 1523 CA PHE A 96 8.145 14.359 6.360 1.00 0.00 C ATOM 1524 C PHE A 96 8.600 14.002 7.772 1.00 0.00 C ATOM 1525 O PHE A 96 8.299 14.712 8.732 1.00 0.00 O ATOM 1526 CB PHE A 96 7.400 13.177 5.738 1.00 0.00 C ATOM 1527 CG PHE A 96 6.012 12.989 6.282 1.00 0.00 C ATOM 1528 CD1 PHE A 96 5.808 12.781 7.637 1.00 0.00 C ATOM 1529 CD2 PHE A 96 4.913 13.021 5.439 1.00 0.00 C ATOM 1530 CE1 PHE A 96 4.532 12.608 8.141 1.00 0.00 C ATOM 1531 CE2 PHE A 96 3.636 12.849 5.938 1.00 0.00 C ATOM 1532 CZ PHE A 96 3.445 12.641 7.290 1.00 0.00 C ATOM 0 H PHE A 96 9.199 14.459 4.550 1.00 0.00 H new ATOM 0 HA PHE A 96 7.471 15.213 6.419 1.00 0.00 H new ATOM 0 HB2 PHE A 96 7.342 13.321 4.659 1.00 0.00 H new ATOM 0 HB3 PHE A 96 7.974 12.266 5.907 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.655 12.754 8.307 1.00 0.00 H new ATOM 0 HD2 PHE A 96 5.056 13.182 4.381 1.00 0.00 H new ATOM 0 HE1 PHE A 96 4.386 12.447 9.199 1.00 0.00 H new ATOM 0 HE2 PHE A 96 2.787 12.877 5.271 1.00 0.00 H new ATOM 0 HZ PHE A 96 2.448 12.504 7.681 1.00 0.00 H new ATOM 1542 N TYR A 97 9.326 12.896 7.891 1.00 0.00 N ATOM 1543 CA TYR A 97 9.821 12.441 9.185 1.00 0.00 C ATOM 1544 C TYR A 97 11.340 12.557 9.259 1.00 0.00 C ATOM 1545 O TYR A 97 11.981 11.943 10.112 1.00 0.00 O ATOM 1546 CB TYR A 97 9.396 10.994 9.438 1.00 0.00 C ATOM 1547 CG TYR A 97 8.067 10.635 8.812 1.00 0.00 C ATOM 1548 CD1 TYR A 97 7.946 10.471 7.437 1.00 0.00 C ATOM 1549 CD2 TYR A 97 6.932 10.461 9.594 1.00 0.00 C ATOM 1550 CE1 TYR A 97 6.734 10.144 6.860 1.00 0.00 C ATOM 1551 CE2 TYR A 97 5.716 10.133 9.026 1.00 0.00 C ATOM 1552 CZ TYR A 97 5.622 9.975 7.659 1.00 0.00 C ATOM 1553 OH TYR A 97 4.413 9.649 7.089 1.00 0.00 O ATOM 0 H TYR A 97 9.585 12.298 7.107 1.00 0.00 H new ATOM 0 HA TYR A 97 9.388 13.079 9.955 1.00 0.00 H new ATOM 0 HB2 TYR A 97 10.164 10.325 9.049 1.00 0.00 H new ATOM 0 HB3 TYR A 97 9.340 10.823 10.513 1.00 0.00 H new ATOM 0 HD1 TYR A 97 8.815 10.601 6.809 1.00 0.00 H new ATOM 0 HD2 TYR A 97 7.001 10.584 10.665 1.00 0.00 H new ATOM 0 HE1 TYR A 97 6.657 10.021 5.790 1.00 0.00 H new ATOM 0 HE2 TYR A 97 4.844 10.001 9.649 1.00 0.00 H new ATOM 0 HH TYR A 97 3.857 10.453 7.020 1.00 0.00 H new ATOM 1563 N LYS A 98 11.911 13.351 8.359 1.00 0.00 N ATOM 1564 CA LYS A 98 13.355 13.551 8.321 1.00 0.00 C ATOM 1565 C LYS A 98 14.085 12.221 8.166 1.00 0.00 C ATOM 1566 O LYS A 98 15.117 11.990 8.797 1.00 0.00 O ATOM 1567 CB LYS A 98 13.826 14.258 9.594 1.00 0.00 C ATOM 1568 CG LYS A 98 13.292 15.673 9.736 1.00 0.00 C ATOM 1569 CD LYS A 98 13.905 16.607 8.706 1.00 0.00 C ATOM 1570 CE LYS A 98 13.836 18.058 9.157 1.00 0.00 C ATOM 1571 NZ LYS A 98 14.759 18.330 10.293 1.00 0.00 N ATOM 0 H LYS A 98 11.395 13.867 7.646 1.00 0.00 H new ATOM 0 HA LYS A 98 13.587 14.175 7.458 1.00 0.00 H new ATOM 0 HB2 LYS A 98 13.517 13.673 10.460 1.00 0.00 H new ATOM 0 HB3 LYS A 98 14.916 14.287 9.602 1.00 0.00 H new ATOM 0 HG2 LYS A 98 12.208 15.667 9.623 1.00 0.00 H new ATOM 0 HG3 LYS A 98 13.506 16.045 10.738 1.00 0.00 H new ATOM 0 HD2 LYS A 98 14.944 16.328 8.533 1.00 0.00 H new ATOM 0 HD3 LYS A 98 13.383 16.495 7.756 1.00 0.00 H new ATOM 0 HE2 LYS A 98 14.087 18.711 8.321 1.00 0.00 H new ATOM 0 HE3 LYS A 98 12.815 18.298 9.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 14.930 19.353 10.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 14.331 17.988 11.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 15.661 17.839 10.132 1.00 0.00 H new ATOM 1585 N LEU A 99 13.543 11.349 7.322 1.00 0.00 N ATOM 1586 CA LEU A 99 14.144 10.042 7.083 1.00 0.00 C ATOM 1587 C LEU A 99 15.591 10.184 6.621 1.00 0.00 C ATOM 1588 O LEU A 99 15.976 11.208 6.058 1.00 0.00 O ATOM 1589 CB LEU A 99 13.336 9.270 6.038 1.00 0.00 C ATOM 1590 CG LEU A 99 14.048 8.089 5.377 1.00 0.00 C ATOM 1591 CD1 LEU A 99 13.036 7.097 4.826 1.00 0.00 C ATOM 1592 CD2 LEU A 99 14.977 8.575 4.274 1.00 0.00 C ATOM 0 H LEU A 99 12.689 11.524 6.792 1.00 0.00 H new ATOM 0 HA LEU A 99 14.135 9.488 8.022 1.00 0.00 H new ATOM 0 HB2 LEU A 99 12.426 8.901 6.511 1.00 0.00 H new ATOM 0 HB3 LEU A 99 13.029 9.967 5.258 1.00 0.00 H new ATOM 0 HG LEU A 99 14.649 7.582 6.132 1.00 0.00 H new ATOM 0 HD11 LEU A 99 13.561 6.263 4.359 1.00 0.00 H new ATOM 0 HD12 LEU A 99 12.412 6.724 5.639 1.00 0.00 H new ATOM 0 HD13 LEU A 99 12.408 7.591 4.085 1.00 0.00 H new ATOM 0 HD21 LEU A 99 15.475 7.721 3.815 1.00 0.00 H new ATOM 0 HD22 LEU A 99 14.398 9.106 3.519 1.00 0.00 H new ATOM 0 HD23 LEU A 99 15.724 9.246 4.697 1.00 0.00 H new ATOM 1604 N GLY A 100 16.388 9.147 6.861 1.00 0.00 N ATOM 1605 CA GLY A 100 17.783 9.175 6.461 1.00 0.00 C ATOM 1606 C GLY A 100 18.433 7.808 6.527 1.00 0.00 C ATOM 1607 O GLY A 100 19.605 7.687 6.883 1.00 0.00 O ATOM 0 H GLY A 100 16.093 8.288 7.325 1.00 0.00 H new ATOM 0 HA2 GLY A 100 17.858 9.561 5.444 1.00 0.00 H new ATOM 0 HA3 GLY A 100 18.329 9.865 7.105 1.00 0.00 H new ATOM 1611 N ASP A 101 17.671 6.775 6.184 1.00 0.00 N ATOM 1612 CA ASP A 101 18.180 5.409 6.206 1.00 0.00 C ATOM 1613 C ASP A 101 17.322 4.495 5.337 1.00 0.00 C ATOM 1614 O ASP A 101 16.238 4.878 4.896 1.00 0.00 O ATOM 1615 CB ASP A 101 18.218 4.879 7.641 1.00 0.00 C ATOM 1616 CG ASP A 101 17.006 5.302 8.447 1.00 0.00 C ATOM 1617 OD1 ASP A 101 15.922 4.719 8.237 1.00 0.00 O ATOM 1618 OD2 ASP A 101 17.140 6.217 9.286 1.00 0.00 O ATOM 0 H ASP A 101 16.699 6.858 5.887 1.00 0.00 H new ATOM 0 HA ASP A 101 19.193 5.419 5.803 1.00 0.00 H new ATOM 0 HB2 ASP A 101 18.276 3.791 7.622 1.00 0.00 H new ATOM 0 HB3 ASP A 101 19.122 5.238 8.134 1.00 0.00 H new ATOM 1623 N PHE A 102 17.814 3.285 5.093 1.00 0.00 N ATOM 1624 CA PHE A 102 17.094 2.317 4.274 1.00 0.00 C ATOM 1625 C PHE A 102 17.585 0.899 4.550 1.00 0.00 C ATOM 1626 O PHE A 102 18.732 0.676 4.937 1.00 0.00 O ATOM 1627 CB PHE A 102 17.262 2.647 2.790 1.00 0.00 C ATOM 1628 CG PHE A 102 17.294 4.121 2.503 1.00 0.00 C ATOM 1629 CD1 PHE A 102 16.119 4.826 2.295 1.00 0.00 C ATOM 1630 CD2 PHE A 102 18.499 4.803 2.442 1.00 0.00 C ATOM 1631 CE1 PHE A 102 16.145 6.183 2.032 1.00 0.00 C ATOM 1632 CE2 PHE A 102 18.531 6.159 2.179 1.00 0.00 C ATOM 1633 CZ PHE A 102 17.353 6.850 1.973 1.00 0.00 C ATOM 0 H PHE A 102 18.709 2.951 5.451 1.00 0.00 H new ATOM 0 HA PHE A 102 16.037 2.374 4.534 1.00 0.00 H new ATOM 0 HB2 PHE A 102 18.185 2.194 2.428 1.00 0.00 H new ATOM 0 HB3 PHE A 102 16.444 2.194 2.230 1.00 0.00 H new ATOM 0 HD1 PHE A 102 15.172 4.309 2.339 1.00 0.00 H new ATOM 0 HD2 PHE A 102 19.424 4.268 2.602 1.00 0.00 H new ATOM 0 HE1 PHE A 102 15.222 6.721 1.873 1.00 0.00 H new ATOM 0 HE2 PHE A 102 19.477 6.678 2.135 1.00 0.00 H new ATOM 0 HZ PHE A 102 17.376 7.910 1.766 1.00 0.00 H new ATOM 1643 N PRO A 103 16.695 -0.084 4.347 1.00 0.00 N ATOM 1644 CA PRO A 103 15.327 0.169 3.887 1.00 0.00 C ATOM 1645 C PRO A 103 14.475 0.853 4.950 1.00 0.00 C ATOM 1646 O PRO A 103 14.795 0.809 6.139 1.00 0.00 O ATOM 1647 CB PRO A 103 14.788 -1.233 3.590 1.00 0.00 C ATOM 1648 CG PRO A 103 15.591 -2.139 4.457 1.00 0.00 C ATOM 1649 CD PRO A 103 16.957 -1.519 4.551 1.00 0.00 C ATOM 0 HA PRO A 103 15.303 0.841 3.029 1.00 0.00 H new ATOM 0 HB2 PRO A 103 13.725 -1.305 3.819 1.00 0.00 H new ATOM 0 HB3 PRO A 103 14.905 -1.487 2.536 1.00 0.00 H new ATOM 0 HG2 PRO A 103 15.138 -2.237 5.444 1.00 0.00 H new ATOM 0 HG3 PRO A 103 15.646 -3.140 4.030 1.00 0.00 H new ATOM 0 HD2 PRO A 103 17.419 -1.709 5.520 1.00 0.00 H new ATOM 0 HD3 PRO A 103 17.632 -1.916 3.793 1.00 0.00 H new ATOM 1657 N TYR A 104 13.389 1.483 4.517 1.00 0.00 N ATOM 1658 CA TYR A 104 12.491 2.178 5.432 1.00 0.00 C ATOM 1659 C TYR A 104 11.034 1.860 5.112 1.00 0.00 C ATOM 1660 O TYR A 104 10.615 1.909 3.955 1.00 0.00 O ATOM 1661 CB TYR A 104 12.724 3.688 5.359 1.00 0.00 C ATOM 1662 CG TYR A 104 12.015 4.463 6.447 1.00 0.00 C ATOM 1663 CD1 TYR A 104 10.637 4.639 6.415 1.00 0.00 C ATOM 1664 CD2 TYR A 104 12.723 5.019 7.505 1.00 0.00 C ATOM 1665 CE1 TYR A 104 9.985 5.347 7.406 1.00 0.00 C ATOM 1666 CE2 TYR A 104 12.078 5.728 8.501 1.00 0.00 C ATOM 1667 CZ TYR A 104 10.710 5.889 8.447 1.00 0.00 C ATOM 1668 OH TYR A 104 10.065 6.595 9.436 1.00 0.00 O ATOM 0 H TYR A 104 13.109 1.527 3.537 1.00 0.00 H new ATOM 0 HA TYR A 104 12.705 1.833 6.443 1.00 0.00 H new ATOM 0 HB2 TYR A 104 13.794 3.886 5.422 1.00 0.00 H new ATOM 0 HB3 TYR A 104 12.389 4.052 4.388 1.00 0.00 H new ATOM 0 HD1 TYR A 104 10.066 4.215 5.602 1.00 0.00 H new ATOM 0 HD2 TYR A 104 13.795 4.895 7.550 1.00 0.00 H new ATOM 0 HE1 TYR A 104 8.913 5.475 7.366 1.00 0.00 H new ATOM 0 HE2 TYR A 104 12.643 6.154 9.317 1.00 0.00 H new ATOM 0 HH TYR A 104 10.720 6.908 10.094 1.00 0.00 H new ATOM 1678 N VAL A 105 10.265 1.536 6.147 1.00 0.00 N ATOM 1679 CA VAL A 105 8.853 1.212 5.978 1.00 0.00 C ATOM 1680 C VAL A 105 8.031 1.704 7.164 1.00 0.00 C ATOM 1681 O VAL A 105 8.463 1.611 8.313 1.00 0.00 O ATOM 1682 CB VAL A 105 8.641 -0.305 5.813 1.00 0.00 C ATOM 1683 CG1 VAL A 105 7.163 -0.622 5.650 1.00 0.00 C ATOM 1684 CG2 VAL A 105 9.442 -0.829 4.631 1.00 0.00 C ATOM 0 H VAL A 105 10.596 1.491 7.111 1.00 0.00 H new ATOM 0 HA VAL A 105 8.518 1.718 5.073 1.00 0.00 H new ATOM 0 HB VAL A 105 8.998 -0.805 6.713 1.00 0.00 H new ATOM 0 HG11 VAL A 105 7.032 -1.698 5.535 1.00 0.00 H new ATOM 0 HG12 VAL A 105 6.619 -0.283 6.531 1.00 0.00 H new ATOM 0 HG13 VAL A 105 6.777 -0.113 4.767 1.00 0.00 H new ATOM 0 HG21 VAL A 105 9.281 -1.902 4.529 1.00 0.00 H new ATOM 0 HG22 VAL A 105 9.118 -0.325 3.720 1.00 0.00 H new ATOM 0 HG23 VAL A 105 10.502 -0.636 4.795 1.00 0.00 H new ATOM 1694 N SER A 106 6.843 2.226 6.878 1.00 0.00 N ATOM 1695 CA SER A 106 5.961 2.736 7.921 1.00 0.00 C ATOM 1696 C SER A 106 4.512 2.761 7.442 1.00 0.00 C ATOM 1697 O SER A 106 4.240 2.989 6.263 1.00 0.00 O ATOM 1698 CB SER A 106 6.394 4.141 8.344 1.00 0.00 C ATOM 1699 OG SER A 106 5.989 5.108 7.391 1.00 0.00 O ATOM 0 H SER A 106 6.469 2.307 5.933 1.00 0.00 H new ATOM 0 HA SER A 106 6.031 2.068 8.780 1.00 0.00 H new ATOM 0 HB2 SER A 106 5.963 4.381 9.316 1.00 0.00 H new ATOM 0 HB3 SER A 106 7.477 4.172 8.460 1.00 0.00 H new ATOM 0 HG SER A 106 6.758 5.370 6.843 1.00 0.00 H new ATOM 1705 N ILE A 107 3.587 2.524 8.366 1.00 0.00 N ATOM 1706 CA ILE A 107 2.166 2.521 8.040 1.00 0.00 C ATOM 1707 C ILE A 107 1.500 3.823 8.472 1.00 0.00 C ATOM 1708 O ILE A 107 1.575 4.215 9.637 1.00 0.00 O ATOM 1709 CB ILE A 107 1.438 1.339 8.707 1.00 0.00 C ATOM 1710 CG1 ILE A 107 2.036 0.012 8.236 1.00 0.00 C ATOM 1711 CG2 ILE A 107 -0.051 1.393 8.402 1.00 0.00 C ATOM 1712 CD1 ILE A 107 1.544 -1.185 9.020 1.00 0.00 C ATOM 0 H ILE A 107 3.796 2.332 9.346 1.00 0.00 H new ATOM 0 HA ILE A 107 2.091 2.419 6.957 1.00 0.00 H new ATOM 0 HB ILE A 107 1.570 1.413 9.786 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.797 -0.131 7.182 1.00 0.00 H new ATOM 0 HG13 ILE A 107 3.122 0.065 8.312 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.551 0.551 8.880 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -0.467 2.326 8.783 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -0.204 1.341 7.324 1.00 0.00 H new ATOM 0 HD11 ILE A 107 2.009 -2.091 8.631 1.00 0.00 H new ATOM 0 HD12 ILE A 107 1.806 -1.064 10.071 1.00 0.00 H new ATOM 0 HD13 ILE A 107 0.461 -1.263 8.923 1.00 0.00 H new ATOM 1724 N LEU A 108 0.846 4.487 7.526 1.00 0.00 N ATOM 1725 CA LEU A 108 0.163 5.745 7.808 1.00 0.00 C ATOM 1726 C LEU A 108 -1.347 5.592 7.656 1.00 0.00 C ATOM 1727 O LEU A 108 -1.827 4.606 7.095 1.00 0.00 O ATOM 1728 CB LEU A 108 0.671 6.845 6.874 1.00 0.00 C ATOM 1729 CG LEU A 108 2.188 7.036 6.825 1.00 0.00 C ATOM 1730 CD1 LEU A 108 2.565 8.040 5.746 1.00 0.00 C ATOM 1731 CD2 LEU A 108 2.713 7.485 8.181 1.00 0.00 C ATOM 0 H LEU A 108 0.774 4.176 6.557 1.00 0.00 H new ATOM 0 HA LEU A 108 0.380 6.023 8.839 1.00 0.00 H new ATOM 0 HB2 LEU A 108 0.319 6.629 5.865 1.00 0.00 H new ATOM 0 HB3 LEU A 108 0.216 7.788 7.175 1.00 0.00 H new ATOM 0 HG LEU A 108 2.648 6.079 6.579 1.00 0.00 H new ATOM 0 HD11 LEU A 108 3.648 8.163 5.726 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.223 7.678 4.777 1.00 0.00 H new ATOM 0 HD13 LEU A 108 2.095 8.999 5.961 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.794 7.616 8.128 1.00 0.00 H new ATOM 0 HD22 LEU A 108 2.246 8.431 8.457 1.00 0.00 H new ATOM 0 HD23 LEU A 108 2.476 6.731 8.931 1.00 0.00 H new ATOM 1743 N ASP A 109 -2.090 6.573 8.156 1.00 0.00 N ATOM 1744 CA ASP A 109 -3.546 6.548 8.073 1.00 0.00 C ATOM 1745 C ASP A 109 -4.052 7.605 7.096 1.00 0.00 C ATOM 1746 O ASP A 109 -3.737 8.790 7.208 1.00 0.00 O ATOM 1747 CB ASP A 109 -4.160 6.776 9.455 1.00 0.00 C ATOM 1748 CG ASP A 109 -5.675 6.725 9.430 1.00 0.00 C ATOM 1749 OD1 ASP A 109 -6.226 5.724 8.927 1.00 0.00 O ATOM 1750 OD2 ASP A 109 -6.310 7.686 9.913 1.00 0.00 O ATOM 0 H ASP A 109 -1.708 7.396 8.623 1.00 0.00 H new ATOM 0 HA ASP A 109 -3.849 5.567 7.707 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -3.785 6.020 10.145 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.838 7.745 9.837 1.00 0.00 H new ATOM 1755 N PRO A 110 -4.855 7.168 6.115 1.00 0.00 N ATOM 1756 CA PRO A 110 -5.421 8.060 5.099 1.00 0.00 C ATOM 1757 C PRO A 110 -6.475 9.000 5.676 1.00 0.00 C ATOM 1758 O PRO A 110 -6.923 9.930 5.006 1.00 0.00 O ATOM 1759 CB PRO A 110 -6.057 7.096 4.095 1.00 0.00 C ATOM 1760 CG PRO A 110 -6.356 5.869 4.885 1.00 0.00 C ATOM 1761 CD PRO A 110 -5.272 5.769 5.921 1.00 0.00 C ATOM 0 HA PRO A 110 -4.665 8.713 4.663 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.963 7.518 3.661 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -5.379 6.880 3.270 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -7.338 5.936 5.353 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -6.367 4.986 4.246 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -5.641 5.328 6.847 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -4.445 5.147 5.578 1.00 0.00 H new ATOM 1769 N ARG A 111 -6.865 8.750 6.921 1.00 0.00 N ATOM 1770 CA ARG A 111 -7.867 9.574 7.587 1.00 0.00 C ATOM 1771 C ARG A 111 -7.205 10.654 8.438 1.00 0.00 C ATOM 1772 O ARG A 111 -7.587 11.823 8.386 1.00 0.00 O ATOM 1773 CB ARG A 111 -8.774 8.706 8.461 1.00 0.00 C ATOM 1774 CG ARG A 111 -10.003 8.185 7.734 1.00 0.00 C ATOM 1775 CD ARG A 111 -11.181 9.135 7.880 1.00 0.00 C ATOM 1776 NE ARG A 111 -11.131 10.222 6.906 1.00 0.00 N ATOM 1777 CZ ARG A 111 -12.155 11.029 6.652 1.00 0.00 C ATOM 1778 NH1 ARG A 111 -13.302 10.872 7.298 1.00 0.00 N ATOM 1779 NH2 ARG A 111 -12.032 11.995 5.751 1.00 0.00 N ATOM 0 H ARG A 111 -6.503 7.984 7.489 1.00 0.00 H new ATOM 0 HA ARG A 111 -8.470 10.059 6.819 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -8.199 7.860 8.838 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -9.093 9.286 9.327 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -9.772 8.050 6.677 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -10.273 7.206 8.129 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -12.111 8.581 7.757 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -11.189 9.551 8.887 1.00 0.00 H new ATOM 0 HE ARG A 111 -10.262 10.370 6.393 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -13.399 10.130 7.992 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -14.087 11.493 7.101 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -11.151 12.118 5.253 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -12.819 12.614 5.557 1.00 0.00 H new ATOM 1793 N THR A 112 -6.209 10.254 9.223 1.00 0.00 N ATOM 1794 CA THR A 112 -5.494 11.186 10.086 1.00 0.00 C ATOM 1795 C THR A 112 -4.194 11.647 9.439 1.00 0.00 C ATOM 1796 O THR A 112 -3.860 12.831 9.469 1.00 0.00 O ATOM 1797 CB THR A 112 -5.178 10.553 11.455 1.00 0.00 C ATOM 1798 OG1 THR A 112 -4.302 9.434 11.286 1.00 0.00 O ATOM 1799 CG2 THR A 112 -6.454 10.105 12.152 1.00 0.00 C ATOM 0 H THR A 112 -5.879 9.290 9.279 1.00 0.00 H new ATOM 0 HA THR A 112 -6.147 12.046 10.234 1.00 0.00 H new ATOM 0 HB THR A 112 -4.690 11.305 12.075 1.00 0.00 H new ATOM 0 HG1 THR A 112 -4.105 9.038 12.160 1.00 0.00 H new ATOM 0 HG21 THR A 112 -6.205 9.661 13.116 1.00 0.00 H new ATOM 0 HG22 THR A 112 -7.106 10.965 12.305 1.00 0.00 H new ATOM 0 HG23 THR A 112 -6.966 9.367 11.534 1.00 0.00 H new ATOM 1807 N GLY A 113 -3.462 10.704 8.853 1.00 0.00 N ATOM 1808 CA GLY A 113 -2.205 11.035 8.207 1.00 0.00 C ATOM 1809 C GLY A 113 -1.046 11.081 9.182 1.00 0.00 C ATOM 1810 O GLY A 113 -0.145 11.908 9.045 1.00 0.00 O ATOM 0 H GLY A 113 -3.717 9.717 8.814 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -1.994 10.299 7.431 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -2.298 12.002 7.712 1.00 0.00 H new ATOM 1814 N GLN A 114 -1.069 10.191 10.169 1.00 0.00 N ATOM 1815 CA GLN A 114 -0.012 10.135 11.172 1.00 0.00 C ATOM 1816 C GLN A 114 0.714 8.795 11.123 1.00 0.00 C ATOM 1817 O GLN A 114 0.265 7.856 10.464 1.00 0.00 O ATOM 1818 CB GLN A 114 -0.593 10.363 12.568 1.00 0.00 C ATOM 1819 CG GLN A 114 -1.316 9.150 13.132 1.00 0.00 C ATOM 1820 CD GLN A 114 -2.150 9.483 14.354 1.00 0.00 C ATOM 1821 OE1 GLN A 114 -2.197 10.633 14.792 1.00 0.00 O ATOM 1822 NE2 GLN A 114 -2.813 8.476 14.910 1.00 0.00 N ATOM 0 H GLN A 114 -1.808 9.499 10.295 1.00 0.00 H new ATOM 0 HA GLN A 114 0.706 10.925 10.952 1.00 0.00 H new ATOM 0 HB2 GLN A 114 0.213 10.643 13.246 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -1.286 11.204 12.531 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -1.960 8.725 12.362 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -0.585 8.385 13.393 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -2.744 7.539 14.513 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -3.391 8.639 15.734 1.00 0.00 H new ATOM 1831 N LYS A 115 1.840 8.712 11.823 1.00 0.00 N ATOM 1832 CA LYS A 115 2.630 7.487 11.861 1.00 0.00 C ATOM 1833 C LYS A 115 2.026 6.480 12.835 1.00 0.00 C ATOM 1834 O LYS A 115 1.855 6.772 14.019 1.00 0.00 O ATOM 1835 CB LYS A 115 4.073 7.799 12.264 1.00 0.00 C ATOM 1836 CG LYS A 115 5.038 6.655 12.003 1.00 0.00 C ATOM 1837 CD LYS A 115 6.199 6.670 12.983 1.00 0.00 C ATOM 1838 CE LYS A 115 5.800 6.083 14.328 1.00 0.00 C ATOM 1839 NZ LYS A 115 5.514 4.624 14.234 1.00 0.00 N ATOM 0 H LYS A 115 2.227 9.480 12.372 1.00 0.00 H new ATOM 0 HA LYS A 115 2.624 7.049 10.863 1.00 0.00 H new ATOM 0 HB2 LYS A 115 4.411 8.680 11.719 1.00 0.00 H new ATOM 0 HB3 LYS A 115 4.099 8.051 13.324 1.00 0.00 H new ATOM 0 HG2 LYS A 115 4.508 5.706 12.080 1.00 0.00 H new ATOM 0 HG3 LYS A 115 5.420 6.725 10.984 1.00 0.00 H new ATOM 0 HD2 LYS A 115 7.033 6.102 12.570 1.00 0.00 H new ATOM 0 HD3 LYS A 115 6.547 7.694 13.120 1.00 0.00 H new ATOM 0 HE2 LYS A 115 6.600 6.250 15.049 1.00 0.00 H new ATOM 0 HE3 LYS A 115 4.918 6.602 14.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 4.555 4.435 14.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 5.583 4.320 13.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 6.204 4.097 14.806 1.00 0.00 H new ATOM 1853 N LEU A 116 1.705 5.294 12.329 1.00 0.00 N ATOM 1854 CA LEU A 116 1.121 4.243 13.155 1.00 0.00 C ATOM 1855 C LEU A 116 2.206 3.346 13.743 1.00 0.00 C ATOM 1856 O LEU A 116 2.336 3.228 14.961 1.00 0.00 O ATOM 1857 CB LEU A 116 0.142 3.405 12.331 1.00 0.00 C ATOM 1858 CG LEU A 116 -1.025 4.164 11.700 1.00 0.00 C ATOM 1859 CD1 LEU A 116 -1.710 3.309 10.644 1.00 0.00 C ATOM 1860 CD2 LEU A 116 -2.021 4.595 12.767 1.00 0.00 C ATOM 0 H LEU A 116 1.839 5.036 11.351 1.00 0.00 H new ATOM 0 HA LEU A 116 0.583 4.717 13.976 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.699 2.909 11.536 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -0.264 2.622 12.972 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.632 5.058 11.216 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -2.538 3.866 10.206 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.994 3.051 9.864 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -2.090 2.397 11.104 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -2.845 5.134 12.299 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -2.408 3.715 13.280 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -1.524 5.246 13.487 1.00 0.00 H new ATOM 1872 N VAL A 117 2.985 2.717 12.868 1.00 0.00 N ATOM 1873 CA VAL A 117 4.062 1.834 13.300 1.00 0.00 C ATOM 1874 C VAL A 117 5.354 2.135 12.550 1.00 0.00 C ATOM 1875 O VAL A 117 5.358 2.893 11.581 1.00 0.00 O ATOM 1876 CB VAL A 117 3.692 0.354 13.089 1.00 0.00 C ATOM 1877 CG1 VAL A 117 2.407 0.014 13.828 1.00 0.00 C ATOM 1878 CG2 VAL A 117 3.561 0.044 11.606 1.00 0.00 C ATOM 0 H VAL A 117 2.890 2.803 11.856 1.00 0.00 H new ATOM 0 HA VAL A 117 4.213 2.016 14.364 1.00 0.00 H new ATOM 0 HB VAL A 117 4.492 -0.264 13.497 1.00 0.00 H new ATOM 0 HG11 VAL A 117 2.162 -1.036 13.667 1.00 0.00 H new ATOM 0 HG12 VAL A 117 2.541 0.196 14.894 1.00 0.00 H new ATOM 0 HG13 VAL A 117 1.596 0.638 13.453 1.00 0.00 H new ATOM 0 HG21 VAL A 117 3.299 -1.006 11.476 1.00 0.00 H new ATOM 0 HG22 VAL A 117 2.781 0.669 11.171 1.00 0.00 H new ATOM 0 HG23 VAL A 117 4.509 0.246 11.107 1.00 0.00 H new ATOM 1888 N GLU A 118 6.450 1.536 13.006 1.00 0.00 N ATOM 1889 CA GLU A 118 7.750 1.742 12.378 1.00 0.00 C ATOM 1890 C GLU A 118 8.554 0.445 12.355 1.00 0.00 C ATOM 1891 O GLU A 118 8.676 -0.240 13.371 1.00 0.00 O ATOM 1892 CB GLU A 118 8.533 2.828 13.117 1.00 0.00 C ATOM 1893 CG GLU A 118 8.973 2.418 14.512 1.00 0.00 C ATOM 1894 CD GLU A 118 7.803 2.161 15.442 1.00 0.00 C ATOM 1895 OE1 GLU A 118 7.101 3.132 15.793 1.00 0.00 O ATOM 1896 OE2 GLU A 118 7.589 0.990 15.818 1.00 0.00 O ATOM 0 H GLU A 118 6.463 0.905 13.807 1.00 0.00 H new ATOM 0 HA GLU A 118 7.581 2.063 11.350 1.00 0.00 H new ATOM 0 HB2 GLU A 118 9.413 3.092 12.531 1.00 0.00 H new ATOM 0 HB3 GLU A 118 7.916 3.724 13.188 1.00 0.00 H new ATOM 0 HG2 GLU A 118 9.584 1.518 14.446 1.00 0.00 H new ATOM 0 HG3 GLU A 118 9.603 3.201 14.935 1.00 0.00 H new ATOM 1903 N TRP A 119 9.100 0.115 11.191 1.00 0.00 N ATOM 1904 CA TRP A 119 9.893 -1.100 11.036 1.00 0.00 C ATOM 1905 C TRP A 119 11.096 -0.853 10.132 1.00 0.00 C ATOM 1906 O TRP A 119 10.945 -0.462 8.974 1.00 0.00 O ATOM 1907 CB TRP A 119 9.031 -2.226 10.462 1.00 0.00 C ATOM 1908 CG TRP A 119 7.810 -2.515 11.281 1.00 0.00 C ATOM 1909 CD1 TRP A 119 7.746 -2.647 12.639 1.00 0.00 C ATOM 1910 CD2 TRP A 119 6.478 -2.710 10.794 1.00 0.00 C ATOM 1911 NE1 TRP A 119 6.454 -2.913 13.025 1.00 0.00 N ATOM 1912 CE2 TRP A 119 5.657 -2.956 11.912 1.00 0.00 C ATOM 1913 CE3 TRP A 119 5.898 -2.700 9.523 1.00 0.00 C ATOM 1914 CZ2 TRP A 119 4.289 -3.189 11.795 1.00 0.00 C ATOM 1915 CZ3 TRP A 119 4.540 -2.932 9.408 1.00 0.00 C ATOM 1916 CH2 TRP A 119 3.748 -3.173 10.538 1.00 0.00 C ATOM 0 H TRP A 119 9.009 0.671 10.341 1.00 0.00 H new ATOM 0 HA TRP A 119 10.256 -1.395 12.020 1.00 0.00 H new ATOM 0 HB2 TRP A 119 8.726 -1.961 9.450 1.00 0.00 H new ATOM 0 HB3 TRP A 119 9.632 -3.132 10.387 1.00 0.00 H new ATOM 0 HD1 TRP A 119 8.587 -2.556 13.311 1.00 0.00 H new ATOM 0 HE1 TRP A 119 6.140 -3.055 13.985 1.00 0.00 H new ATOM 0 HE3 TRP A 119 6.500 -2.514 8.646 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 3.677 -3.376 12.665 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 4.082 -2.927 8.430 1.00 0.00 H new ATOM 0 HH2 TRP A 119 2.690 -3.350 10.415 1.00 0.00 H new ATOM 1927 N HIS A 120 12.290 -1.084 10.668 1.00 0.00 N ATOM 1928 CA HIS A 120 13.520 -0.887 9.908 1.00 0.00 C ATOM 1929 C HIS A 120 13.777 -2.067 8.975 1.00 0.00 C ATOM 1930 O HIS A 120 13.964 -1.889 7.772 1.00 0.00 O ATOM 1931 CB HIS A 120 14.706 -0.704 10.856 1.00 0.00 C ATOM 1932 CG HIS A 120 15.804 0.139 10.284 1.00 0.00 C ATOM 1933 ND1 HIS A 120 15.570 1.275 9.538 1.00 0.00 N ATOM 1934 CD2 HIS A 120 17.149 0.007 10.355 1.00 0.00 C ATOM 1935 CE1 HIS A 120 16.724 1.804 9.173 1.00 0.00 C ATOM 1936 NE2 HIS A 120 17.698 1.054 9.656 1.00 0.00 N ATOM 0 H HIS A 120 12.432 -1.408 11.625 1.00 0.00 H new ATOM 0 HA HIS A 120 13.405 0.013 9.304 1.00 0.00 H new ATOM 0 HB2 HIS A 120 14.354 -0.249 11.782 1.00 0.00 H new ATOM 0 HB3 HIS A 120 15.108 -1.683 11.115 1.00 0.00 H new ATOM 0 HD2 HIS A 120 17.690 -0.776 10.866 1.00 0.00 H new ATOM 0 HE1 HIS A 120 16.850 2.698 8.580 1.00 0.00 H new ATOM 0 HE2 HIS A 120 18.696 1.225 9.530 1.00 0.00 H new ATOM 1945 N GLN A 121 13.785 -3.271 9.540 1.00 0.00 N ATOM 1946 CA GLN A 121 14.021 -4.479 8.758 1.00 0.00 C ATOM 1947 C GLN A 121 12.812 -5.407 8.813 1.00 0.00 C ATOM 1948 O GLN A 121 12.142 -5.511 9.842 1.00 0.00 O ATOM 1949 CB GLN A 121 15.264 -5.208 9.269 1.00 0.00 C ATOM 1950 CG GLN A 121 15.105 -5.769 10.674 1.00 0.00 C ATOM 1951 CD GLN A 121 14.328 -7.070 10.698 1.00 0.00 C ATOM 1952 OE1 GLN A 121 14.566 -7.964 9.886 1.00 0.00 O ATOM 1953 NE2 GLN A 121 13.392 -7.183 11.633 1.00 0.00 N ATOM 0 H GLN A 121 13.631 -3.435 10.535 1.00 0.00 H new ATOM 0 HA GLN A 121 14.183 -4.185 7.721 1.00 0.00 H new ATOM 0 HB2 GLN A 121 15.504 -6.023 8.586 1.00 0.00 H new ATOM 0 HB3 GLN A 121 16.110 -4.521 9.255 1.00 0.00 H new ATOM 0 HG2 GLN A 121 16.091 -5.931 11.110 1.00 0.00 H new ATOM 0 HG3 GLN A 121 14.596 -5.035 11.299 1.00 0.00 H new ATOM 0 HE21 GLN A 121 13.228 -6.417 12.286 1.00 0.00 H new ATOM 0 HE22 GLN A 121 12.837 -8.036 11.698 1.00 0.00 H new ATOM 1962 N LEU A 122 12.539 -6.081 7.701 1.00 0.00 N ATOM 1963 CA LEU A 122 11.410 -7.002 7.623 1.00 0.00 C ATOM 1964 C LEU A 122 11.751 -8.208 6.753 1.00 0.00 C ATOM 1965 O LEU A 122 12.771 -8.220 6.064 1.00 0.00 O ATOM 1966 CB LEU A 122 10.180 -6.286 7.062 1.00 0.00 C ATOM 1967 CG LEU A 122 9.644 -5.121 7.895 1.00 0.00 C ATOM 1968 CD1 LEU A 122 10.077 -3.792 7.295 1.00 0.00 C ATOM 1969 CD2 LEU A 122 8.128 -5.192 7.999 1.00 0.00 C ATOM 0 H LEU A 122 13.083 -6.007 6.842 1.00 0.00 H new ATOM 0 HA LEU A 122 11.190 -7.354 8.631 1.00 0.00 H new ATOM 0 HB2 LEU A 122 10.424 -5.913 6.067 1.00 0.00 H new ATOM 0 HB3 LEU A 122 9.382 -7.018 6.942 1.00 0.00 H new ATOM 0 HG LEU A 122 10.061 -5.196 8.899 1.00 0.00 H new ATOM 0 HD11 LEU A 122 9.686 -2.975 7.901 1.00 0.00 H new ATOM 0 HD12 LEU A 122 11.166 -3.740 7.274 1.00 0.00 H new ATOM 0 HD13 LEU A 122 9.690 -3.708 6.280 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.765 -4.355 8.595 1.00 0.00 H new ATOM 0 HD22 LEU A 122 7.692 -5.143 7.001 1.00 0.00 H new ATOM 0 HD23 LEU A 122 7.839 -6.129 8.475 1.00 0.00 H new ATOM 1981 N ASP A 123 10.889 -9.219 6.789 1.00 0.00 N ATOM 1982 CA ASP A 123 11.097 -10.429 6.002 1.00 0.00 C ATOM 1983 C ASP A 123 9.765 -11.088 5.657 1.00 0.00 C ATOM 1984 O ASP A 123 8.711 -10.670 6.137 1.00 0.00 O ATOM 1985 CB ASP A 123 11.985 -11.413 6.765 1.00 0.00 C ATOM 1986 CG ASP A 123 12.419 -12.585 5.907 1.00 0.00 C ATOM 1987 OD1 ASP A 123 12.812 -12.356 4.744 1.00 0.00 O ATOM 1988 OD2 ASP A 123 12.368 -13.731 6.400 1.00 0.00 O ATOM 0 H ASP A 123 10.040 -9.224 7.355 1.00 0.00 H new ATOM 0 HA ASP A 123 11.594 -10.148 5.074 1.00 0.00 H new ATOM 0 HB2 ASP A 123 12.867 -10.891 7.135 1.00 0.00 H new ATOM 0 HB3 ASP A 123 11.446 -11.784 7.637 1.00 0.00 H new ATOM 1993 N VAL A 124 9.820 -12.119 4.821 1.00 0.00 N ATOM 1994 CA VAL A 124 8.619 -12.836 4.411 1.00 0.00 C ATOM 1995 C VAL A 124 7.782 -13.241 5.619 1.00 0.00 C ATOM 1996 O VAL A 124 6.566 -13.049 5.638 1.00 0.00 O ATOM 1997 CB VAL A 124 8.967 -14.096 3.596 1.00 0.00 C ATOM 1998 CG1 VAL A 124 7.703 -14.846 3.205 1.00 0.00 C ATOM 1999 CG2 VAL A 124 9.781 -13.726 2.365 1.00 0.00 C ATOM 0 H VAL A 124 10.684 -12.477 4.414 1.00 0.00 H new ATOM 0 HA VAL A 124 8.043 -12.155 3.784 1.00 0.00 H new ATOM 0 HB VAL A 124 9.572 -14.755 4.219 1.00 0.00 H new ATOM 0 HG11 VAL A 124 7.969 -15.733 2.630 1.00 0.00 H new ATOM 0 HG12 VAL A 124 7.164 -15.145 4.104 1.00 0.00 H new ATOM 0 HG13 VAL A 124 7.068 -14.199 2.600 1.00 0.00 H new ATOM 0 HG21 VAL A 124 10.018 -14.628 1.801 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.204 -13.047 1.738 1.00 0.00 H new ATOM 0 HG23 VAL A 124 10.705 -13.238 2.673 1.00 0.00 H new ATOM 2009 N SER A 125 8.441 -13.803 6.628 1.00 0.00 N ATOM 2010 CA SER A 125 7.757 -14.238 7.840 1.00 0.00 C ATOM 2011 C SER A 125 7.496 -13.058 8.770 1.00 0.00 C ATOM 2012 O SER A 125 6.366 -12.833 9.203 1.00 0.00 O ATOM 2013 CB SER A 125 8.587 -15.300 8.565 1.00 0.00 C ATOM 2014 OG SER A 125 8.052 -15.577 9.848 1.00 0.00 O ATOM 0 H SER A 125 9.448 -13.968 6.630 1.00 0.00 H new ATOM 0 HA SER A 125 6.798 -14.670 7.552 1.00 0.00 H new ATOM 0 HB2 SER A 125 8.611 -16.214 7.972 1.00 0.00 H new ATOM 0 HB3 SER A 125 9.617 -14.957 8.663 1.00 0.00 H new ATOM 0 HG SER A 125 8.599 -16.259 10.290 1.00 0.00 H new ATOM 2020 N SER A 126 8.550 -12.307 9.073 1.00 0.00 N ATOM 2021 CA SER A 126 8.437 -11.151 9.955 1.00 0.00 C ATOM 2022 C SER A 126 7.307 -10.232 9.503 1.00 0.00 C ATOM 2023 O SER A 126 6.369 -9.966 10.255 1.00 0.00 O ATOM 2024 CB SER A 126 9.756 -10.378 9.989 1.00 0.00 C ATOM 2025 OG SER A 126 9.601 -9.133 10.649 1.00 0.00 O ATOM 0 H SER A 126 9.492 -12.478 8.721 1.00 0.00 H new ATOM 0 HA SER A 126 8.210 -11.511 10.958 1.00 0.00 H new ATOM 0 HB2 SER A 126 10.516 -10.971 10.498 1.00 0.00 H new ATOM 0 HB3 SER A 126 10.110 -10.212 8.972 1.00 0.00 H new ATOM 0 HG SER A 126 10.459 -8.659 10.659 1.00 0.00 H new ATOM 2031 N PHE A 127 7.403 -9.748 8.269 1.00 0.00 N ATOM 2032 CA PHE A 127 6.390 -8.857 7.716 1.00 0.00 C ATOM 2033 C PHE A 127 4.988 -9.343 8.068 1.00 0.00 C ATOM 2034 O PHE A 127 4.247 -8.670 8.787 1.00 0.00 O ATOM 2035 CB PHE A 127 6.542 -8.759 6.197 1.00 0.00 C ATOM 2036 CG PHE A 127 5.696 -7.683 5.578 1.00 0.00 C ATOM 2037 CD1 PHE A 127 4.366 -7.921 5.270 1.00 0.00 C ATOM 2038 CD2 PHE A 127 6.230 -6.434 5.305 1.00 0.00 C ATOM 2039 CE1 PHE A 127 3.586 -6.933 4.699 1.00 0.00 C ATOM 2040 CE2 PHE A 127 5.454 -5.442 4.735 1.00 0.00 C ATOM 2041 CZ PHE A 127 4.130 -5.692 4.433 1.00 0.00 C ATOM 0 H PHE A 127 8.172 -9.958 7.633 1.00 0.00 H new ATOM 0 HA PHE A 127 6.533 -7.869 8.153 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.588 -8.571 5.956 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.279 -9.718 5.751 1.00 0.00 H new ATOM 0 HD1 PHE A 127 3.934 -8.889 5.478 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.265 -6.233 5.540 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.551 -7.132 4.461 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.883 -4.473 4.526 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.521 -4.918 3.989 1.00 0.00 H new ATOM 2051 N LEU A 128 4.628 -10.515 7.556 1.00 0.00 N ATOM 2052 CA LEU A 128 3.314 -11.092 7.815 1.00 0.00 C ATOM 2053 C LEU A 128 3.046 -11.186 9.314 1.00 0.00 C ATOM 2054 O LEU A 128 2.068 -10.633 9.816 1.00 0.00 O ATOM 2055 CB LEU A 128 3.210 -12.479 7.179 1.00 0.00 C ATOM 2056 CG LEU A 128 3.290 -12.526 5.653 1.00 0.00 C ATOM 2057 CD1 LEU A 128 3.474 -13.956 5.171 1.00 0.00 C ATOM 2058 CD2 LEU A 128 2.043 -11.909 5.035 1.00 0.00 C ATOM 0 H LEU A 128 5.228 -11.084 6.959 1.00 0.00 H new ATOM 0 HA LEU A 128 2.564 -10.438 7.371 1.00 0.00 H new ATOM 0 HB2 LEU A 128 4.007 -13.103 7.584 1.00 0.00 H new ATOM 0 HB3 LEU A 128 2.266 -12.928 7.487 1.00 0.00 H new ATOM 0 HG LEU A 128 4.155 -11.944 5.336 1.00 0.00 H new ATOM 0 HD11 LEU A 128 3.529 -13.969 4.082 1.00 0.00 H new ATOM 0 HD12 LEU A 128 4.396 -14.364 5.586 1.00 0.00 H new ATOM 0 HD13 LEU A 128 2.629 -14.562 5.499 1.00 0.00 H new ATOM 0 HD21 LEU A 128 2.117 -11.951 3.948 1.00 0.00 H new ATOM 0 HD22 LEU A 128 1.163 -12.464 5.361 1.00 0.00 H new ATOM 0 HD23 LEU A 128 1.955 -10.870 5.353 1.00 0.00 H new ATOM 2070 N ASP A 129 3.923 -11.889 10.023 1.00 0.00 N ATOM 2071 CA ASP A 129 3.783 -12.052 11.465 1.00 0.00 C ATOM 2072 C ASP A 129 3.270 -10.769 12.111 1.00 0.00 C ATOM 2073 O ASP A 129 2.378 -10.803 12.958 1.00 0.00 O ATOM 2074 CB ASP A 129 5.123 -12.451 12.087 1.00 0.00 C ATOM 2075 CG ASP A 129 4.954 -13.210 13.388 1.00 0.00 C ATOM 2076 OD1 ASP A 129 3.953 -13.946 13.521 1.00 0.00 O ATOM 2077 OD2 ASP A 129 5.823 -13.070 14.274 1.00 0.00 O ATOM 0 H ASP A 129 4.738 -12.355 9.623 1.00 0.00 H new ATOM 0 HA ASP A 129 3.056 -12.844 11.647 1.00 0.00 H new ATOM 0 HB2 ASP A 129 5.679 -13.067 11.380 1.00 0.00 H new ATOM 0 HB3 ASP A 129 5.718 -11.555 12.267 1.00 0.00 H new ATOM 2082 N GLN A 130 3.842 -9.639 11.705 1.00 0.00 N ATOM 2083 CA GLN A 130 3.443 -8.345 12.246 1.00 0.00 C ATOM 2084 C GLN A 130 2.170 -7.843 11.573 1.00 0.00 C ATOM 2085 O GLN A 130 1.127 -7.714 12.213 1.00 0.00 O ATOM 2086 CB GLN A 130 4.568 -7.324 12.064 1.00 0.00 C ATOM 2087 CG GLN A 130 5.824 -7.655 12.854 1.00 0.00 C ATOM 2088 CD GLN A 130 6.776 -6.480 12.956 1.00 0.00 C ATOM 2089 OE1 GLN A 130 6.855 -5.817 13.991 1.00 0.00 O ATOM 2090 NE2 GLN A 130 7.506 -6.214 11.878 1.00 0.00 N ATOM 0 H GLN A 130 4.582 -9.594 11.004 1.00 0.00 H new ATOM 0 HA GLN A 130 3.244 -8.470 13.310 1.00 0.00 H new ATOM 0 HB2 GLN A 130 4.821 -7.259 11.006 1.00 0.00 H new ATOM 0 HB3 GLN A 130 4.207 -6.341 12.366 1.00 0.00 H new ATOM 0 HG2 GLN A 130 5.543 -7.978 13.856 1.00 0.00 H new ATOM 0 HG3 GLN A 130 6.336 -8.493 12.381 1.00 0.00 H new ATOM 0 HE21 GLN A 130 7.409 -6.789 11.041 1.00 0.00 H new ATOM 0 HE22 GLN A 130 8.164 -5.434 11.887 1.00 0.00 H new ATOM 2099 N VAL A 131 2.264 -7.559 10.278 1.00 0.00 N ATOM 2100 CA VAL A 131 1.120 -7.071 9.518 1.00 0.00 C ATOM 2101 C VAL A 131 -0.156 -7.807 9.911 1.00 0.00 C ATOM 2102 O VAL A 131 -1.137 -7.193 10.332 1.00 0.00 O ATOM 2103 CB VAL A 131 1.344 -7.230 8.002 1.00 0.00 C ATOM 2104 CG1 VAL A 131 0.104 -6.802 7.231 1.00 0.00 C ATOM 2105 CG2 VAL A 131 2.560 -6.432 7.558 1.00 0.00 C ATOM 0 H VAL A 131 3.121 -7.659 9.733 1.00 0.00 H new ATOM 0 HA VAL A 131 1.013 -6.012 9.753 1.00 0.00 H new ATOM 0 HB VAL A 131 1.530 -8.282 7.788 1.00 0.00 H new ATOM 0 HG11 VAL A 131 0.281 -6.921 6.162 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -0.742 -7.421 7.530 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -0.117 -5.757 7.448 1.00 0.00 H new ATOM 0 HG21 VAL A 131 2.704 -6.555 6.485 1.00 0.00 H new ATOM 0 HG22 VAL A 131 2.405 -5.377 7.785 1.00 0.00 H new ATOM 0 HG23 VAL A 131 3.443 -6.791 8.086 1.00 0.00 H new ATOM 2115 N THR A 132 -0.137 -9.129 9.773 1.00 0.00 N ATOM 2116 CA THR A 132 -1.292 -9.951 10.113 1.00 0.00 C ATOM 2117 C THR A 132 -1.853 -9.571 11.478 1.00 0.00 C ATOM 2118 O THR A 132 -3.068 -9.527 11.671 1.00 0.00 O ATOM 2119 CB THR A 132 -0.934 -11.449 10.117 1.00 0.00 C ATOM 2120 OG1 THR A 132 0.144 -11.693 11.027 1.00 0.00 O ATOM 2121 CG2 THR A 132 -0.543 -11.915 8.722 1.00 0.00 C ATOM 0 H THR A 132 0.667 -9.654 9.428 1.00 0.00 H new ATOM 0 HA THR A 132 -2.047 -9.768 9.348 1.00 0.00 H new ATOM 0 HB THR A 132 -1.812 -12.009 10.437 1.00 0.00 H new ATOM 0 HG1 THR A 132 0.902 -11.115 10.799 1.00 0.00 H new ATOM 0 HG21 THR A 132 -0.294 -12.976 8.749 1.00 0.00 H new ATOM 0 HG22 THR A 132 -1.376 -11.755 8.038 1.00 0.00 H new ATOM 0 HG23 THR A 132 0.322 -11.348 8.378 1.00 0.00 H new ATOM 2129 N GLY A 133 -0.961 -9.295 12.425 1.00 0.00 N ATOM 2130 CA GLY A 133 -1.388 -8.921 13.760 1.00 0.00 C ATOM 2131 C GLY A 133 -1.968 -7.522 13.814 1.00 0.00 C ATOM 2132 O GLY A 133 -3.052 -7.312 14.358 1.00 0.00 O ATOM 0 H GLY A 133 0.050 -9.324 12.291 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -2.134 -9.634 14.112 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -0.539 -8.985 14.441 1.00 0.00 H new ATOM 2136 N PHE A 134 -1.244 -6.561 13.249 1.00 0.00 N ATOM 2137 CA PHE A 134 -1.691 -5.174 13.237 1.00 0.00 C ATOM 2138 C PHE A 134 -3.131 -5.071 12.740 1.00 0.00 C ATOM 2139 O PHE A 134 -3.932 -4.306 13.278 1.00 0.00 O ATOM 2140 CB PHE A 134 -0.773 -4.327 12.352 1.00 0.00 C ATOM 2141 CG PHE A 134 -1.435 -3.093 11.809 1.00 0.00 C ATOM 2142 CD1 PHE A 134 -2.258 -3.166 10.696 1.00 0.00 C ATOM 2143 CD2 PHE A 134 -1.235 -1.861 12.410 1.00 0.00 C ATOM 2144 CE1 PHE A 134 -2.868 -2.032 10.194 1.00 0.00 C ATOM 2145 CE2 PHE A 134 -1.843 -0.724 11.912 1.00 0.00 C ATOM 2146 CZ PHE A 134 -2.661 -0.810 10.803 1.00 0.00 C ATOM 0 H PHE A 134 -0.345 -6.718 12.793 1.00 0.00 H new ATOM 0 HA PHE A 134 -1.649 -4.796 14.259 1.00 0.00 H new ATOM 0 HB2 PHE A 134 0.105 -4.035 12.928 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -0.420 -4.936 11.520 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -2.424 -4.119 10.216 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -0.596 -1.788 13.278 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -3.506 -2.102 9.326 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -1.678 0.231 12.390 1.00 0.00 H new ATOM 0 HZ PHE A 134 -3.138 0.077 10.413 1.00 0.00 H new ATOM 2156 N LEU A 135 -3.451 -5.846 11.710 1.00 0.00 N ATOM 2157 CA LEU A 135 -4.794 -5.843 11.139 1.00 0.00 C ATOM 2158 C LEU A 135 -5.842 -6.120 12.212 1.00 0.00 C ATOM 2159 O LEU A 135 -6.734 -5.306 12.447 1.00 0.00 O ATOM 2160 CB LEU A 135 -4.898 -6.888 10.026 1.00 0.00 C ATOM 2161 CG LEU A 135 -3.980 -6.678 8.821 1.00 0.00 C ATOM 2162 CD1 LEU A 135 -4.071 -7.861 7.869 1.00 0.00 C ATOM 2163 CD2 LEU A 135 -4.330 -5.384 8.102 1.00 0.00 C ATOM 0 H LEU A 135 -2.800 -6.484 11.253 1.00 0.00 H new ATOM 0 HA LEU A 135 -4.982 -4.855 10.720 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -4.685 -7.868 10.454 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -5.929 -6.912 9.673 1.00 0.00 H new ATOM 0 HG LEU A 135 -2.953 -6.604 9.179 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -3.411 -7.694 7.017 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -3.770 -8.770 8.389 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -5.097 -7.967 7.518 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -3.666 -5.252 7.248 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -5.363 -5.428 7.756 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -4.212 -4.544 8.787 1.00 0.00 H new ATOM 2175 N GLY A 136 -5.727 -7.275 12.861 1.00 0.00 N ATOM 2176 CA GLY A 136 -6.671 -7.638 13.902 1.00 0.00 C ATOM 2177 C GLY A 136 -6.608 -6.702 15.093 1.00 0.00 C ATOM 2178 O GLY A 136 -7.640 -6.275 15.609 1.00 0.00 O ATOM 0 H GLY A 136 -4.997 -7.965 12.684 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -7.681 -7.631 13.491 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -6.468 -8.657 14.233 1.00 0.00 H new ATOM 2182 N GLU A 137 -5.394 -6.383 15.530 1.00 0.00 N ATOM 2183 CA GLU A 137 -5.202 -5.493 16.669 1.00 0.00 C ATOM 2184 C GLU A 137 -5.993 -4.200 16.489 1.00 0.00 C ATOM 2185 O GLU A 137 -6.822 -3.845 17.327 1.00 0.00 O ATOM 2186 CB GLU A 137 -3.716 -5.174 16.851 1.00 0.00 C ATOM 2187 CG GLU A 137 -2.883 -6.374 17.268 1.00 0.00 C ATOM 2188 CD GLU A 137 -1.400 -6.063 17.323 1.00 0.00 C ATOM 2189 OE1 GLU A 137 -0.970 -5.097 16.659 1.00 0.00 O ATOM 2190 OE2 GLU A 137 -0.669 -6.786 18.032 1.00 0.00 O ATOM 0 H GLU A 137 -4.529 -6.727 15.113 1.00 0.00 H new ATOM 0 HA GLU A 137 -5.569 -6.002 17.561 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -3.321 -4.775 15.916 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -3.610 -4.391 17.601 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -3.215 -6.719 18.247 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -3.053 -7.191 16.567 1.00 0.00 H new ATOM 2197 N HIS A 138 -5.729 -3.500 15.390 1.00 0.00 N ATOM 2198 CA HIS A 138 -6.416 -2.247 15.099 1.00 0.00 C ATOM 2199 C HIS A 138 -7.699 -2.500 14.314 1.00 0.00 C ATOM 2200 O HIS A 138 -8.795 -2.196 14.783 1.00 0.00 O ATOM 2201 CB HIS A 138 -5.499 -1.310 14.312 1.00 0.00 C ATOM 2202 CG HIS A 138 -4.287 -0.875 15.077 1.00 0.00 C ATOM 2203 ND1 HIS A 138 -4.315 0.123 16.028 1.00 0.00 N ATOM 2204 CD2 HIS A 138 -3.006 -1.310 15.029 1.00 0.00 C ATOM 2205 CE1 HIS A 138 -3.104 0.284 16.530 1.00 0.00 C ATOM 2206 NE2 HIS A 138 -2.291 -0.574 15.941 1.00 0.00 N ATOM 0 H HIS A 138 -5.045 -3.779 14.687 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.678 -1.776 16.046 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -5.181 -1.810 13.397 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -6.065 -0.428 14.013 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -2.618 -2.091 14.392 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -2.826 0.996 17.293 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -1.294 -0.674 16.133 1.00 0.00 H new ATOM 2215 N GLY A 139 -7.554 -3.057 13.116 1.00 0.00 N ATOM 2216 CA GLY A 139 -8.710 -3.341 12.285 1.00 0.00 C ATOM 2217 C GLY A 139 -8.745 -2.490 11.031 1.00 0.00 C ATOM 2218 O GLY A 139 -8.349 -1.325 11.053 1.00 0.00 O ATOM 0 H GLY A 139 -6.657 -3.317 12.706 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -8.703 -4.395 12.005 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -9.619 -3.170 12.862 1.00 0.00 H new ATOM 2222 N GLN A 140 -9.219 -3.073 9.935 1.00 0.00 N ATOM 2223 CA GLN A 140 -9.302 -2.360 8.666 1.00 0.00 C ATOM 2224 C GLN A 140 -10.244 -1.166 8.772 1.00 0.00 C ATOM 2225 O GLN A 140 -11.088 -1.105 9.668 1.00 0.00 O ATOM 2226 CB GLN A 140 -9.777 -3.302 7.558 1.00 0.00 C ATOM 2227 CG GLN A 140 -9.376 -2.851 6.162 1.00 0.00 C ATOM 2228 CD GLN A 140 -9.771 -3.848 5.091 1.00 0.00 C ATOM 2229 OE1 GLN A 140 -9.549 -5.051 5.233 1.00 0.00 O ATOM 2230 NE2 GLN A 140 -10.361 -3.352 4.009 1.00 0.00 N ATOM 0 H GLN A 140 -9.551 -4.037 9.900 1.00 0.00 H new ATOM 0 HA GLN A 140 -8.306 -1.992 8.419 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -9.371 -4.297 7.740 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -10.863 -3.387 7.605 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -9.842 -1.889 5.947 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -8.297 -2.697 6.130 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -10.526 -2.348 3.933 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -10.649 -3.975 3.255 1.00 0.00 H new ATOM 2239 N LEU A 141 -10.095 -0.217 7.854 1.00 0.00 N ATOM 2240 CA LEU A 141 -10.933 0.977 7.845 1.00 0.00 C ATOM 2241 C LEU A 141 -12.409 0.606 7.745 1.00 0.00 C ATOM 2242 O LEU A 141 -13.259 1.224 8.385 1.00 0.00 O ATOM 2243 CB LEU A 141 -10.544 1.887 6.679 1.00 0.00 C ATOM 2244 CG LEU A 141 -9.389 2.855 6.939 1.00 0.00 C ATOM 2245 CD1 LEU A 141 -8.053 2.165 6.709 1.00 0.00 C ATOM 2246 CD2 LEU A 141 -9.514 4.086 6.054 1.00 0.00 C ATOM 0 H LEU A 141 -9.402 -0.251 7.106 1.00 0.00 H new ATOM 0 HA LEU A 141 -10.774 1.510 8.783 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -10.281 1.260 5.827 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -11.420 2.468 6.389 1.00 0.00 H new ATOM 0 HG LEU A 141 -9.436 3.175 7.980 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -7.243 2.869 6.899 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -7.961 1.315 7.385 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -7.997 1.816 5.678 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -8.683 4.763 6.253 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -9.493 3.785 5.007 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -10.455 4.593 6.267 1.00 0.00 H new ATOM 2258 N ASP A 142 -12.705 -0.408 6.939 1.00 0.00 N ATOM 2259 CA ASP A 142 -14.078 -0.865 6.758 1.00 0.00 C ATOM 2260 C ASP A 142 -14.450 -1.903 7.812 1.00 0.00 C ATOM 2261 O ASP A 142 -15.482 -1.791 8.471 1.00 0.00 O ATOM 2262 CB ASP A 142 -14.262 -1.453 5.358 1.00 0.00 C ATOM 2263 CG ASP A 142 -15.468 -2.367 5.268 1.00 0.00 C ATOM 2264 OD1 ASP A 142 -16.466 -2.105 5.971 1.00 0.00 O ATOM 2265 OD2 ASP A 142 -15.414 -3.345 4.493 1.00 0.00 O ATOM 0 H ASP A 142 -12.013 -0.929 6.401 1.00 0.00 H new ATOM 0 HA ASP A 142 -14.738 -0.005 6.873 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -14.370 -0.642 4.638 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -13.367 -2.009 5.080 1.00 0.00 H new ATOM 2270 N GLY A 143 -13.600 -2.915 7.964 1.00 0.00 N ATOM 2271 CA GLY A 143 -13.857 -3.959 8.938 1.00 0.00 C ATOM 2272 C GLY A 143 -15.293 -4.444 8.903 1.00 0.00 C ATOM 2273 O GLY A 143 -16.137 -3.963 9.661 1.00 0.00 O ATOM 0 H GLY A 143 -12.739 -3.030 7.430 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -13.188 -4.799 8.750 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -13.627 -3.585 9.936 1.00 0.00 H new ATOM 2277 N LEU A 144 -15.573 -5.396 8.021 1.00 0.00 N ATOM 2278 CA LEU A 144 -16.918 -5.946 7.889 1.00 0.00 C ATOM 2279 C LEU A 144 -17.237 -6.890 9.044 1.00 0.00 C ATOM 2280 O LEU A 144 -18.359 -6.911 9.550 1.00 0.00 O ATOM 2281 CB LEU A 144 -17.060 -6.685 6.557 1.00 0.00 C ATOM 2282 CG LEU A 144 -16.113 -7.865 6.341 1.00 0.00 C ATOM 2283 CD1 LEU A 144 -16.829 -9.001 5.627 1.00 0.00 C ATOM 2284 CD2 LEU A 144 -14.886 -7.427 5.553 1.00 0.00 C ATOM 0 H LEU A 144 -14.887 -5.804 7.386 1.00 0.00 H new ATOM 0 HA LEU A 144 -17.626 -5.118 7.915 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -18.085 -7.047 6.473 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -16.907 -5.969 5.749 1.00 0.00 H new ATOM 0 HG LEU A 144 -15.785 -8.226 7.316 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -16.139 -9.832 5.482 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -17.675 -9.333 6.229 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -17.187 -8.653 4.658 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -14.223 -8.280 5.409 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -15.196 -7.040 4.582 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -14.360 -6.647 6.103 1.00 0.00 H new ATOM 2296 N SER A 145 -16.242 -7.667 9.458 1.00 0.00 N ATOM 2297 CA SER A 145 -16.416 -8.614 10.553 1.00 0.00 C ATOM 2298 C SER A 145 -17.751 -9.345 10.432 1.00 0.00 C ATOM 2299 O SER A 145 -18.402 -9.640 11.433 1.00 0.00 O ATOM 2300 CB SER A 145 -16.338 -7.891 11.898 1.00 0.00 C ATOM 2301 OG SER A 145 -17.561 -7.242 12.200 1.00 0.00 O ATOM 0 H SER A 145 -15.306 -7.660 9.052 1.00 0.00 H new ATOM 0 HA SER A 145 -15.613 -9.348 10.497 1.00 0.00 H new ATOM 0 HB2 SER A 145 -16.098 -8.606 12.685 1.00 0.00 H new ATOM 0 HB3 SER A 145 -15.530 -7.159 11.875 1.00 0.00 H new ATOM 0 HG SER A 145 -17.999 -6.966 11.368 1.00 0.00 H new ATOM 2307 N SER A 146 -18.151 -9.633 9.197 1.00 0.00 N ATOM 2308 CA SER A 146 -19.409 -10.325 8.943 1.00 0.00 C ATOM 2309 C SER A 146 -19.476 -11.633 9.725 1.00 0.00 C ATOM 2310 O SER A 146 -20.451 -11.899 10.428 1.00 0.00 O ATOM 2311 CB SER A 146 -19.570 -10.602 7.447 1.00 0.00 C ATOM 2312 OG SER A 146 -18.803 -11.725 7.051 1.00 0.00 O ATOM 0 H SER A 146 -17.622 -9.398 8.357 1.00 0.00 H new ATOM 0 HA SER A 146 -20.224 -9.681 9.275 1.00 0.00 H new ATOM 0 HB2 SER A 146 -20.621 -10.776 7.217 1.00 0.00 H new ATOM 0 HB3 SER A 146 -19.260 -9.727 6.876 1.00 0.00 H new ATOM 0 HG SER A 146 -18.924 -11.882 6.091 1.00 0.00 H new ATOM 2318 N SER A 147 -18.433 -12.447 9.595 1.00 0.00 N ATOM 2319 CA SER A 147 -18.374 -13.730 10.285 1.00 0.00 C ATOM 2320 C SER A 147 -17.030 -13.910 10.983 1.00 0.00 C ATOM 2321 O SER A 147 -15.983 -13.949 10.338 1.00 0.00 O ATOM 2322 CB SER A 147 -18.606 -14.876 9.297 1.00 0.00 C ATOM 2323 OG SER A 147 -18.696 -16.119 9.971 1.00 0.00 O ATOM 0 H SER A 147 -17.618 -12.241 9.018 1.00 0.00 H new ATOM 0 HA SER A 147 -19.161 -13.745 11.039 1.00 0.00 H new ATOM 0 HB2 SER A 147 -19.523 -14.696 8.735 1.00 0.00 H new ATOM 0 HB3 SER A 147 -17.790 -14.908 8.575 1.00 0.00 H new ATOM 0 HG SER A 147 -19.285 -16.721 9.470 1.00 0.00 H new ATOM 2329 N SER A 148 -17.068 -14.020 12.308 1.00 0.00 N ATOM 2330 CA SER A 148 -15.854 -14.192 13.096 1.00 0.00 C ATOM 2331 C SER A 148 -15.031 -15.367 12.577 1.00 0.00 C ATOM 2332 O SER A 148 -13.825 -15.248 12.361 1.00 0.00 O ATOM 2333 CB SER A 148 -16.203 -14.410 14.569 1.00 0.00 C ATOM 2334 OG SER A 148 -15.036 -14.622 15.344 1.00 0.00 O ATOM 0 H SER A 148 -17.927 -13.993 12.857 1.00 0.00 H new ATOM 0 HA SER A 148 -15.258 -13.284 13.002 1.00 0.00 H new ATOM 0 HB2 SER A 148 -16.744 -13.544 14.950 1.00 0.00 H new ATOM 0 HB3 SER A 148 -16.868 -15.268 14.665 1.00 0.00 H new ATOM 0 HG SER A 148 -15.286 -14.757 16.282 1.00 0.00 H new ATOM 2340 N GLY A 149 -15.693 -16.503 12.377 1.00 0.00 N ATOM 2341 CA GLY A 149 -15.009 -17.684 11.885 1.00 0.00 C ATOM 2342 C GLY A 149 -15.967 -18.801 11.523 1.00 0.00 C ATOM 2343 O GLY A 149 -16.271 -19.675 12.335 1.00 0.00 O ATOM 0 H GLY A 149 -16.691 -16.626 12.547 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -14.418 -17.419 11.009 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -14.312 -18.039 12.644 1.00 0.00 H new ATOM 2347 N PRO A 150 -16.463 -18.780 10.277 1.00 0.00 N ATOM 2348 CA PRO A 150 -17.401 -19.791 9.781 1.00 0.00 C ATOM 2349 C PRO A 150 -16.743 -21.155 9.602 1.00 0.00 C ATOM 2350 O PRO A 150 -17.365 -22.191 9.835 1.00 0.00 O ATOM 2351 CB PRO A 150 -17.846 -19.230 8.429 1.00 0.00 C ATOM 2352 CG PRO A 150 -16.724 -18.350 7.996 1.00 0.00 C ATOM 2353 CD PRO A 150 -16.145 -17.768 9.256 1.00 0.00 C ATOM 0 HA PRO A 150 -18.222 -19.961 10.478 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -18.024 -20.028 7.708 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -18.776 -18.669 8.520 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -15.973 -18.917 7.447 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -17.079 -17.564 7.330 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -15.070 -17.610 9.168 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -16.591 -16.803 9.495 1.00 0.00 H new ATOM 2361 N SER A 151 -15.480 -21.147 9.186 1.00 0.00 N ATOM 2362 CA SER A 151 -14.738 -22.384 8.971 1.00 0.00 C ATOM 2363 C SER A 151 -15.383 -23.220 7.871 1.00 0.00 C ATOM 2364 O SER A 151 -15.514 -24.438 7.997 1.00 0.00 O ATOM 2365 CB SER A 151 -14.668 -23.192 10.268 1.00 0.00 C ATOM 2366 OG SER A 151 -14.079 -22.434 11.310 1.00 0.00 O ATOM 0 H SER A 151 -14.950 -20.298 8.991 1.00 0.00 H new ATOM 0 HA SER A 151 -13.727 -22.123 8.658 1.00 0.00 H new ATOM 0 HB2 SER A 151 -15.671 -23.502 10.562 1.00 0.00 H new ATOM 0 HB3 SER A 151 -14.089 -24.101 10.103 1.00 0.00 H new ATOM 0 HG SER A 151 -14.047 -22.972 12.128 1.00 0.00 H new ATOM 2372 N SER A 152 -15.785 -22.558 6.791 1.00 0.00 N ATOM 2373 CA SER A 152 -16.421 -23.239 5.669 1.00 0.00 C ATOM 2374 C SER A 152 -15.955 -22.649 4.341 1.00 0.00 C ATOM 2375 O SER A 152 -15.827 -21.434 4.200 1.00 0.00 O ATOM 2376 CB SER A 152 -17.943 -23.137 5.779 1.00 0.00 C ATOM 2377 OG SER A 152 -18.568 -23.503 4.561 1.00 0.00 O ATOM 0 H SER A 152 -15.682 -21.551 6.669 1.00 0.00 H new ATOM 0 HA SER A 152 -16.131 -24.289 5.702 1.00 0.00 H new ATOM 0 HB2 SER A 152 -18.297 -23.784 6.582 1.00 0.00 H new ATOM 0 HB3 SER A 152 -18.224 -22.118 6.044 1.00 0.00 H new ATOM 0 HG SER A 152 -19.541 -23.431 4.658 1.00 0.00 H new ATOM 2383 N GLY A 153 -15.703 -23.521 3.369 1.00 0.00 N ATOM 2384 CA GLY A 153 -15.254 -23.069 2.065 1.00 0.00 C ATOM 2385 C GLY A 153 -14.539 -24.157 1.289 1.00 0.00 C ATOM 2386 O GLY A 153 -14.891 -24.447 0.146 1.00 0.00 O ATOM 0 H GLY A 153 -15.802 -24.532 3.462 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -16.112 -22.720 1.490 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -14.586 -22.217 2.189 1.00 0.00 H new TER 2390 GLY A 153