USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 785 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 89 ASN : amide:sc= -1.59! C(o=-6.5!,f=-8.7!) USER MOD Set 1.2: A 108 SER OG : rot 43:sc= -4.88! USER MOD Set 2.1: A 97 THR OG1 : rot 180:sc= -0.626! USER MOD Set 2.2: A 99 SER OG : rot 180:sc= 0.0958 USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.0922 (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 46:sc= 1.15 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.0278 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 69:sc= 0.936 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.184 USER MOD Single : A 27 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot -57:sc= 1.19 USER MOD Single : A 38 GLN : amide:sc= -0.38 K(o=-0.38,f=-3.3!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.351 K(o=-0.35,f=-1.1) USER MOD Single : A 48 ASN : amide:sc= -0.458 K(o=-0.46,f=-5!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 55 ASN : amide:sc=-0.00841 X(o=-0.0084,f=-0.17) USER MOD Single : A 60 MET CE :methyl -143:sc= -0.115 (180deg=-2.37!) USER MOD Single : A 62 THR OG1 : rot -21:sc= 0.429 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 CYS SG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0.0554 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= -0.169 (180deg=-0.169) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 153:sc= 1.31 (180deg=1.15) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.904 K(o=-0.9,f=-1.8!) USER MOD Single : A 106 GLN : amide:sc= -0.424 K(o=-0.42,f=-3.1!) USER MOD Single : A 107 ASN : amide:sc= -0.0126 X(o=-0.013,f=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.111 USER MOD Single : A 115 SER OG : rot -150:sc= -1.27 USER MOD Single : A 117 MET CE :methyl 174:sc= -2.53 (180deg=-2.97!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -24.838 -14.080 26.278 1.00 0.00 N ATOM 2 CA GLY A 1 -23.775 -15.003 25.917 1.00 0.00 C ATOM 3 C GLY A 1 -22.713 -14.307 25.063 1.00 0.00 C ATOM 4 O GLY A 1 -22.943 -13.215 24.548 1.00 0.00 O ATOM 0 H1 GLY A 1 -24.861 -13.964 27.311 1.00 0.00 H new ATOM 0 H2 GLY A 1 -24.664 -13.158 25.830 1.00 0.00 H new ATOM 0 H3 GLY A 1 -25.751 -14.457 25.952 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -23.315 -15.405 26.820 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -24.192 -15.848 25.369 1.00 0.00 H new ATOM 8 N SER A 2 -21.572 -14.970 24.941 1.00 0.00 N ATOM 9 CA SER A 2 -20.473 -14.430 24.157 1.00 0.00 C ATOM 10 C SER A 2 -19.692 -15.567 23.497 1.00 0.00 C ATOM 11 O SER A 2 -18.880 -16.225 24.144 1.00 0.00 O ATOM 12 CB SER A 2 -19.543 -13.582 25.027 1.00 0.00 C ATOM 13 OG SER A 2 -19.117 -12.397 24.357 1.00 0.00 O ATOM 0 H SER A 2 -21.385 -15.876 25.371 1.00 0.00 H new ATOM 0 HA SER A 2 -20.889 -13.787 23.381 1.00 0.00 H new ATOM 0 HB2 SER A 2 -20.056 -13.312 25.950 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.671 -14.173 25.308 1.00 0.00 H new ATOM 0 HG SER A 2 -18.527 -11.882 24.946 1.00 0.00 H new ATOM 18 N SER A 3 -19.966 -15.763 22.215 1.00 0.00 N ATOM 19 CA SER A 3 -19.299 -16.810 21.459 1.00 0.00 C ATOM 20 C SER A 3 -18.123 -16.221 20.677 1.00 0.00 C ATOM 21 O SER A 3 -17.983 -15.003 20.580 1.00 0.00 O ATOM 22 CB SER A 3 -20.272 -17.509 20.508 1.00 0.00 C ATOM 23 OG SER A 3 -20.897 -18.635 21.117 1.00 0.00 O ATOM 0 H SER A 3 -20.640 -15.215 21.681 1.00 0.00 H new ATOM 0 HA SER A 3 -18.924 -17.554 22.162 1.00 0.00 H new ATOM 0 HB2 SER A 3 -21.035 -16.801 20.186 1.00 0.00 H new ATOM 0 HB3 SER A 3 -19.737 -17.830 19.614 1.00 0.00 H new ATOM 0 HG SER A 3 -21.512 -19.053 20.478 1.00 0.00 H new ATOM 28 N GLY A 4 -17.305 -17.115 20.139 1.00 0.00 N ATOM 29 CA GLY A 4 -16.144 -16.701 19.370 1.00 0.00 C ATOM 30 C GLY A 4 -16.014 -17.527 18.088 1.00 0.00 C ATOM 31 O GLY A 4 -16.568 -18.620 17.991 1.00 0.00 O ATOM 0 H GLY A 4 -17.424 -18.125 20.221 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.228 -15.644 19.119 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -15.244 -16.815 19.974 1.00 0.00 H new ATOM 35 N SER A 5 -15.278 -16.970 17.137 1.00 0.00 N ATOM 36 CA SER A 5 -15.066 -17.641 15.865 1.00 0.00 C ATOM 37 C SER A 5 -14.262 -16.741 14.925 1.00 0.00 C ATOM 38 O SER A 5 -13.909 -15.619 15.285 1.00 0.00 O ATOM 39 CB SER A 5 -16.398 -18.029 15.220 1.00 0.00 C ATOM 40 OG SER A 5 -16.758 -19.379 15.507 1.00 0.00 O ATOM 0 H SER A 5 -14.821 -16.062 17.222 1.00 0.00 H new ATOM 0 HA SER A 5 -14.502 -18.555 16.050 1.00 0.00 H new ATOM 0 HB2 SER A 5 -17.182 -17.361 15.577 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.331 -17.893 14.141 1.00 0.00 H new ATOM 0 HG SER A 5 -16.626 -19.557 16.462 1.00 0.00 H new ATOM 45 N SER A 6 -13.998 -17.267 13.737 1.00 0.00 N ATOM 46 CA SER A 6 -13.242 -16.524 12.742 1.00 0.00 C ATOM 47 C SER A 6 -13.837 -15.123 12.573 1.00 0.00 C ATOM 48 O SER A 6 -14.969 -14.871 12.982 1.00 0.00 O ATOM 49 CB SER A 6 -13.226 -17.259 11.402 1.00 0.00 C ATOM 50 OG SER A 6 -11.949 -17.193 10.771 1.00 0.00 O ATOM 0 H SER A 6 -14.294 -18.197 13.442 1.00 0.00 H new ATOM 0 HA SER A 6 -12.212 -16.436 13.089 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.500 -18.303 11.558 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.979 -16.827 10.743 1.00 0.00 H new ATOM 0 HG SER A 6 -11.980 -17.676 9.919 1.00 0.00 H new ATOM 55 N GLY A 7 -13.047 -14.250 11.967 1.00 0.00 N ATOM 56 CA GLY A 7 -13.480 -12.882 11.737 1.00 0.00 C ATOM 57 C GLY A 7 -13.411 -12.527 10.251 1.00 0.00 C ATOM 58 O GLY A 7 -12.672 -11.627 9.857 1.00 0.00 O ATOM 0 H GLY A 7 -12.109 -14.463 11.628 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.501 -12.754 12.098 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.852 -12.197 12.307 1.00 0.00 H new ATOM 62 N GLY A 8 -14.193 -13.254 9.466 1.00 0.00 N ATOM 63 CA GLY A 8 -14.232 -13.027 8.031 1.00 0.00 C ATOM 64 C GLY A 8 -12.819 -12.884 7.461 1.00 0.00 C ATOM 65 O GLY A 8 -12.103 -13.874 7.307 1.00 0.00 O ATOM 0 H GLY A 8 -14.804 -14.001 9.797 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -14.743 -13.856 7.542 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -14.807 -12.126 7.817 1.00 0.00 H new ATOM 69 N PRO A 9 -12.448 -11.612 7.155 1.00 0.00 N ATOM 70 CA PRO A 9 -11.134 -11.326 6.606 1.00 0.00 C ATOM 71 C PRO A 9 -10.055 -11.417 7.688 1.00 0.00 C ATOM 72 O PRO A 9 -10.363 -11.638 8.859 1.00 0.00 O ATOM 73 CB PRO A 9 -11.253 -9.936 6.002 1.00 0.00 C ATOM 74 CG PRO A 9 -12.482 -9.309 6.639 1.00 0.00 C ATOM 75 CD PRO A 9 -13.268 -10.415 7.324 1.00 0.00 C ATOM 0 HA PRO A 9 -10.828 -12.049 5.850 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -10.361 -9.343 6.207 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -11.359 -9.989 4.918 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -12.191 -8.545 7.360 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -13.095 -8.817 5.883 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -13.430 -10.191 8.378 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -14.251 -10.541 6.871 1.00 0.00 H new ATOM 80 N LYS A 10 -8.815 -11.242 7.258 1.00 0.00 N ATOM 81 CA LYS A 10 -7.689 -11.302 8.176 1.00 0.00 C ATOM 82 C LYS A 10 -7.440 -9.910 8.762 1.00 0.00 C ATOM 83 O LYS A 10 -7.670 -8.903 8.095 1.00 0.00 O ATOM 84 CB LYS A 10 -6.465 -11.906 7.484 1.00 0.00 C ATOM 85 CG LYS A 10 -5.197 -11.661 8.303 1.00 0.00 C ATOM 86 CD LYS A 10 -5.119 -12.621 9.492 1.00 0.00 C ATOM 87 CE LYS A 10 -3.700 -13.168 9.664 1.00 0.00 C ATOM 88 NZ LYS A 10 -3.689 -14.283 10.636 1.00 0.00 N ATOM 0 H LYS A 10 -8.564 -11.059 6.286 1.00 0.00 H new ATOM 0 HA LYS A 10 -7.913 -11.965 9.012 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -6.612 -12.977 7.346 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -6.351 -11.470 6.492 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -4.320 -11.789 7.669 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -5.184 -10.631 8.661 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -5.426 -12.105 10.401 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -5.815 -13.446 9.344 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -3.317 -13.512 8.703 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -3.037 -12.373 10.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -2.719 -14.643 10.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -4.034 -13.944 11.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -4.306 -15.047 10.295 1.00 0.00 H new ATOM 98 N THR A 11 -6.974 -9.901 10.001 1.00 0.00 N ATOM 99 CA THR A 11 -6.692 -8.650 10.684 1.00 0.00 C ATOM 100 C THR A 11 -5.293 -8.684 11.303 1.00 0.00 C ATOM 101 O THR A 11 -4.882 -9.700 11.863 1.00 0.00 O ATOM 102 CB THR A 11 -7.803 -8.408 11.710 1.00 0.00 C ATOM 103 OG1 THR A 11 -9.003 -8.664 10.984 1.00 0.00 O ATOM 104 CG2 THR A 11 -7.917 -6.938 12.114 1.00 0.00 C ATOM 0 H THR A 11 -6.784 -10.739 10.550 1.00 0.00 H new ATOM 0 HA THR A 11 -6.686 -7.813 9.986 1.00 0.00 H new ATOM 0 HB THR A 11 -7.618 -9.013 12.597 1.00 0.00 H new ATOM 0 HG1 THR A 11 -9.776 -8.533 11.572 1.00 0.00 H new ATOM 0 HG21 THR A 11 -8.719 -6.822 12.843 1.00 0.00 H new ATOM 0 HG22 THR A 11 -6.976 -6.608 12.554 1.00 0.00 H new ATOM 0 HG23 THR A 11 -8.137 -6.335 11.233 1.00 0.00 H new ATOM 112 N VAL A 12 -4.598 -7.562 11.180 1.00 0.00 N ATOM 113 CA VAL A 12 -3.254 -7.451 11.719 1.00 0.00 C ATOM 114 C VAL A 12 -3.025 -6.022 12.216 1.00 0.00 C ATOM 115 O VAL A 12 -3.282 -5.061 11.493 1.00 0.00 O ATOM 116 CB VAL A 12 -2.232 -7.891 10.671 1.00 0.00 C ATOM 117 CG1 VAL A 12 -1.903 -9.378 10.815 1.00 0.00 C ATOM 118 CG2 VAL A 12 -2.723 -7.571 9.257 1.00 0.00 C ATOM 0 H VAL A 12 -4.941 -6.722 10.715 1.00 0.00 H new ATOM 0 HA VAL A 12 -3.129 -8.116 12.574 1.00 0.00 H new ATOM 0 HB VAL A 12 -1.314 -7.328 10.842 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -1.174 -9.664 10.057 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -1.489 -9.565 11.806 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -2.812 -9.966 10.685 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -1.977 -7.894 8.531 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -3.661 -8.094 9.071 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -2.881 -6.497 9.161 1.00 0.00 H new ATOM 128 N THR A 13 -2.544 -5.926 13.447 1.00 0.00 N ATOM 129 CA THR A 13 -2.278 -4.632 14.048 1.00 0.00 C ATOM 130 C THR A 13 -0.772 -4.359 14.084 1.00 0.00 C ATOM 131 O THR A 13 0.029 -5.290 14.158 1.00 0.00 O ATOM 132 CB THR A 13 -2.932 -4.608 15.432 1.00 0.00 C ATOM 133 OG1 THR A 13 -4.317 -4.811 15.164 1.00 0.00 O ATOM 134 CG2 THR A 13 -2.877 -3.224 16.081 1.00 0.00 C ATOM 0 H THR A 13 -2.332 -6.725 14.044 1.00 0.00 H new ATOM 0 HA THR A 13 -2.709 -3.826 13.455 1.00 0.00 H new ATOM 0 HB THR A 13 -2.439 -5.332 16.080 1.00 0.00 H new ATOM 0 HG1 THR A 13 -4.817 -4.811 16.007 1.00 0.00 H new ATOM 0 HG21 THR A 13 -3.354 -3.262 17.060 1.00 0.00 H new ATOM 0 HG22 THR A 13 -1.837 -2.917 16.196 1.00 0.00 H new ATOM 0 HG23 THR A 13 -3.400 -2.505 15.450 1.00 0.00 H new ATOM 142 N LEU A 14 -0.434 -3.079 14.029 1.00 0.00 N ATOM 143 CA LEU A 14 0.962 -2.673 14.053 1.00 0.00 C ATOM 144 C LEU A 14 1.125 -1.488 15.006 1.00 0.00 C ATOM 145 O LEU A 14 0.189 -0.718 15.214 1.00 0.00 O ATOM 146 CB LEU A 14 1.463 -2.396 12.635 1.00 0.00 C ATOM 147 CG LEU A 14 1.496 -3.598 11.689 1.00 0.00 C ATOM 148 CD1 LEU A 14 0.163 -3.752 10.953 1.00 0.00 C ATOM 149 CD2 LEU A 14 2.677 -3.501 10.720 1.00 0.00 C ATOM 0 H LEU A 14 -1.101 -2.310 13.968 1.00 0.00 H new ATOM 0 HA LEU A 14 1.588 -3.479 14.435 1.00 0.00 H new ATOM 0 HB2 LEU A 14 0.831 -1.627 12.191 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.469 -1.983 12.701 1.00 0.00 H new ATOM 0 HG LEU A 14 1.642 -4.499 12.285 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.213 -4.613 10.287 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -0.638 -3.899 11.678 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.036 -2.853 10.369 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.677 -4.368 10.059 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.587 -2.591 10.126 1.00 0.00 H new ATOM 0 HD23 LEU A 14 3.609 -3.475 11.284 1.00 0.00 H new ATOM 160 N LYS A 15 2.324 -1.377 15.561 1.00 0.00 N ATOM 161 CA LYS A 15 2.623 -0.299 16.488 1.00 0.00 C ATOM 162 C LYS A 15 3.886 0.429 16.025 1.00 0.00 C ATOM 163 O LYS A 15 4.962 -0.166 15.958 1.00 0.00 O ATOM 164 CB LYS A 15 2.710 -0.832 17.920 1.00 0.00 C ATOM 165 CG LYS A 15 1.426 -1.563 18.312 1.00 0.00 C ATOM 166 CD LYS A 15 0.979 -1.169 19.722 1.00 0.00 C ATOM 167 CE LYS A 15 -0.202 -2.025 20.182 1.00 0.00 C ATOM 168 NZ LYS A 15 -0.349 -1.956 21.654 1.00 0.00 N ATOM 0 H LYS A 15 3.099 -2.016 15.386 1.00 0.00 H new ATOM 0 HA LYS A 15 1.816 0.434 16.494 1.00 0.00 H new ATOM 0 HB2 LYS A 15 3.560 -1.509 18.009 1.00 0.00 H new ATOM 0 HB3 LYS A 15 2.887 -0.006 18.609 1.00 0.00 H new ATOM 0 HG2 LYS A 15 0.637 -1.328 17.598 1.00 0.00 H new ATOM 0 HG3 LYS A 15 1.588 -2.640 18.266 1.00 0.00 H new ATOM 0 HD2 LYS A 15 1.810 -1.287 20.417 1.00 0.00 H new ATOM 0 HD3 LYS A 15 0.697 -0.116 19.737 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -1.118 -1.680 19.702 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -0.051 -3.060 19.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -1.155 -2.542 21.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 0.519 -2.307 22.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -0.514 -0.970 21.941 1.00 0.00 H new ATOM 178 N ARG A 16 3.715 1.707 15.718 1.00 0.00 N ATOM 179 CA ARG A 16 4.829 2.522 15.263 1.00 0.00 C ATOM 180 C ARG A 16 6.030 2.347 16.194 1.00 0.00 C ATOM 181 O ARG A 16 5.982 2.741 17.358 1.00 0.00 O ATOM 182 CB ARG A 16 4.442 4.002 15.213 1.00 0.00 C ATOM 183 CG ARG A 16 5.514 4.824 14.494 1.00 0.00 C ATOM 184 CD ARG A 16 4.905 5.635 13.348 1.00 0.00 C ATOM 185 NE ARG A 16 5.848 6.693 12.922 1.00 0.00 N ATOM 186 CZ ARG A 16 6.105 7.802 13.630 1.00 0.00 C ATOM 187 NH1 ARG A 16 5.490 8.004 14.803 1.00 0.00 N ATOM 188 NH2 ARG A 16 6.974 8.709 13.164 1.00 0.00 N ATOM 0 H ARG A 16 2.823 2.198 15.775 1.00 0.00 H new ATOM 0 HA ARG A 16 5.094 2.192 14.258 1.00 0.00 H new ATOM 0 HB2 ARG A 16 3.487 4.115 14.700 1.00 0.00 H new ATOM 0 HB3 ARG A 16 4.306 4.381 16.226 1.00 0.00 H new ATOM 0 HG2 ARG A 16 5.999 5.496 15.203 1.00 0.00 H new ATOM 0 HG3 ARG A 16 6.286 4.160 14.105 1.00 0.00 H new ATOM 0 HD2 ARG A 16 4.677 4.979 12.508 1.00 0.00 H new ATOM 0 HD3 ARG A 16 3.964 6.082 13.668 1.00 0.00 H new ATOM 0 HE ARG A 16 6.333 6.571 12.033 1.00 0.00 H new ATOM 0 HH11 ARG A 16 4.827 7.314 15.157 1.00 0.00 H new ATOM 0 HH12 ARG A 16 5.685 8.847 15.342 1.00 0.00 H new ATOM 0 HH21 ARG A 16 7.441 8.556 12.270 1.00 0.00 H new ATOM 0 HH22 ARG A 16 7.169 9.553 13.703 1.00 0.00 H new ATOM 199 N THR A 17 7.081 1.755 15.645 1.00 0.00 N ATOM 200 CA THR A 17 8.293 1.523 16.411 1.00 0.00 C ATOM 201 C THR A 17 9.327 2.612 16.118 1.00 0.00 C ATOM 202 O THR A 17 10.457 2.312 15.732 1.00 0.00 O ATOM 203 CB THR A 17 8.790 0.111 16.094 1.00 0.00 C ATOM 204 OG1 THR A 17 9.383 0.233 14.804 1.00 0.00 O ATOM 205 CG2 THR A 17 7.644 -0.880 15.886 1.00 0.00 C ATOM 0 H THR A 17 7.118 1.429 14.679 1.00 0.00 H new ATOM 0 HA THR A 17 8.101 1.582 17.482 1.00 0.00 H new ATOM 0 HB THR A 17 9.429 -0.239 16.904 1.00 0.00 H new ATOM 0 HG1 THR A 17 10.204 0.765 14.870 1.00 0.00 H new ATOM 0 HG21 THR A 17 8.052 -1.866 15.664 1.00 0.00 H new ATOM 0 HG22 THR A 17 7.040 -0.933 16.792 1.00 0.00 H new ATOM 0 HG23 THR A 17 7.023 -0.548 15.054 1.00 0.00 H new ATOM 213 N SER A 18 8.904 3.852 16.309 1.00 0.00 N ATOM 214 CA SER A 18 9.779 4.987 16.068 1.00 0.00 C ATOM 215 C SER A 18 10.293 4.956 14.628 1.00 0.00 C ATOM 216 O SER A 18 11.460 5.251 14.375 1.00 0.00 O ATOM 217 CB SER A 18 10.952 4.995 17.051 1.00 0.00 C ATOM 218 OG SER A 18 10.714 5.858 18.159 1.00 0.00 O ATOM 0 H SER A 18 7.967 4.096 16.628 1.00 0.00 H new ATOM 0 HA SER A 18 9.205 5.901 16.221 1.00 0.00 H new ATOM 0 HB2 SER A 18 11.129 3.982 17.412 1.00 0.00 H new ATOM 0 HB3 SER A 18 11.857 5.312 16.533 1.00 0.00 H new ATOM 0 HG SER A 18 11.485 5.834 18.764 1.00 0.00 H new ATOM 223 N GLN A 19 9.396 4.595 13.721 1.00 0.00 N ATOM 224 CA GLN A 19 9.744 4.522 12.313 1.00 0.00 C ATOM 225 C GLN A 19 8.514 4.158 11.480 1.00 0.00 C ATOM 226 O GLN A 19 7.401 4.106 12.001 1.00 0.00 O ATOM 227 CB GLN A 19 10.879 3.521 12.080 1.00 0.00 C ATOM 228 CG GLN A 19 12.119 4.220 11.518 1.00 0.00 C ATOM 229 CD GLN A 19 13.317 3.267 11.485 1.00 0.00 C ATOM 230 OE1 GLN A 19 13.976 3.025 12.483 1.00 0.00 O ATOM 231 NE2 GLN A 19 13.559 2.742 10.288 1.00 0.00 N ATOM 0 H GLN A 19 8.429 4.350 13.935 1.00 0.00 H new ATOM 0 HA GLN A 19 10.097 5.503 11.995 1.00 0.00 H new ATOM 0 HB2 GLN A 19 11.130 3.025 13.018 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.549 2.746 11.388 1.00 0.00 H new ATOM 0 HG2 GLN A 19 11.911 4.584 10.512 1.00 0.00 H new ATOM 0 HG3 GLN A 19 12.359 5.090 12.129 1.00 0.00 H new ATOM 0 HE21 GLN A 19 12.967 2.988 9.494 1.00 0.00 H new ATOM 0 HE22 GLN A 19 14.336 2.093 10.163 1.00 0.00 H new ATOM 238 N GLY A 20 8.755 3.918 10.199 1.00 0.00 N ATOM 239 CA GLY A 20 7.680 3.561 9.290 1.00 0.00 C ATOM 240 C GLY A 20 7.346 2.071 9.391 1.00 0.00 C ATOM 241 O GLY A 20 7.270 1.378 8.379 1.00 0.00 O ATOM 0 H GLY A 20 9.679 3.964 9.770 1.00 0.00 H new ATOM 0 HA2 GLY A 20 6.794 4.152 9.520 1.00 0.00 H new ATOM 0 HA3 GLY A 20 7.968 3.804 8.267 1.00 0.00 H new ATOM 245 N PHE A 21 7.154 1.624 10.624 1.00 0.00 N ATOM 246 CA PHE A 21 6.830 0.230 10.872 1.00 0.00 C ATOM 247 C PHE A 21 7.877 -0.696 10.249 1.00 0.00 C ATOM 248 O PHE A 21 8.868 -0.230 9.688 1.00 0.00 O ATOM 249 CB PHE A 21 5.475 -0.039 10.215 1.00 0.00 C ATOM 250 CG PHE A 21 4.309 0.704 10.870 1.00 0.00 C ATOM 251 CD1 PHE A 21 3.991 0.458 12.170 1.00 0.00 C ATOM 252 CD2 PHE A 21 3.589 1.607 10.155 1.00 0.00 C ATOM 253 CE1 PHE A 21 2.908 1.147 12.779 1.00 0.00 C ATOM 254 CE2 PHE A 21 2.505 2.296 10.764 1.00 0.00 C ATOM 255 CZ PHE A 21 2.188 2.051 12.063 1.00 0.00 C ATOM 0 H PHE A 21 7.217 2.203 11.461 1.00 0.00 H new ATOM 0 HA PHE A 21 6.807 0.040 11.945 1.00 0.00 H new ATOM 0 HB2 PHE A 21 5.529 0.245 9.164 1.00 0.00 H new ATOM 0 HB3 PHE A 21 5.274 -1.110 10.246 1.00 0.00 H new ATOM 0 HD1 PHE A 21 4.562 -0.261 12.739 1.00 0.00 H new ATOM 0 HD2 PHE A 21 3.840 1.802 9.123 1.00 0.00 H new ATOM 0 HE1 PHE A 21 2.657 0.953 13.811 1.00 0.00 H new ATOM 0 HE2 PHE A 21 1.933 3.014 10.195 1.00 0.00 H new ATOM 0 HZ PHE A 21 1.365 2.574 12.526 1.00 0.00 H new ATOM 264 N GLY A 22 7.622 -1.991 10.369 1.00 0.00 N ATOM 265 CA GLY A 22 8.530 -2.985 9.825 1.00 0.00 C ATOM 266 C GLY A 22 8.228 -3.256 8.349 1.00 0.00 C ATOM 267 O GLY A 22 8.991 -2.857 7.472 1.00 0.00 O ATOM 0 H GLY A 22 6.800 -2.374 10.835 1.00 0.00 H new ATOM 0 HA2 GLY A 22 9.558 -2.640 9.932 1.00 0.00 H new ATOM 0 HA3 GLY A 22 8.444 -3.911 10.393 1.00 0.00 H new ATOM 271 N PHE A 23 7.111 -3.931 8.122 1.00 0.00 N ATOM 272 CA PHE A 23 6.697 -4.260 6.768 1.00 0.00 C ATOM 273 C PHE A 23 6.802 -3.039 5.852 1.00 0.00 C ATOM 274 O PHE A 23 7.002 -1.920 6.322 1.00 0.00 O ATOM 275 CB PHE A 23 5.235 -4.703 6.843 1.00 0.00 C ATOM 276 CG PHE A 23 4.238 -3.549 6.950 1.00 0.00 C ATOM 277 CD1 PHE A 23 4.216 -2.772 8.067 1.00 0.00 C ATOM 278 CD2 PHE A 23 3.374 -3.298 5.930 1.00 0.00 C ATOM 279 CE1 PHE A 23 3.291 -1.699 8.167 1.00 0.00 C ATOM 280 CE2 PHE A 23 2.450 -2.226 6.031 1.00 0.00 C ATOM 281 CZ PHE A 23 2.426 -1.449 7.146 1.00 0.00 C ATOM 0 H PHE A 23 6.480 -4.259 8.853 1.00 0.00 H new ATOM 0 HA PHE A 23 7.338 -5.042 6.362 1.00 0.00 H new ATOM 0 HB2 PHE A 23 4.999 -5.292 5.957 1.00 0.00 H new ATOM 0 HB3 PHE A 23 5.109 -5.359 7.704 1.00 0.00 H new ATOM 0 HD1 PHE A 23 4.902 -2.971 8.877 1.00 0.00 H new ATOM 0 HD2 PHE A 23 3.391 -3.915 5.043 1.00 0.00 H new ATOM 0 HE1 PHE A 23 3.274 -1.081 9.053 1.00 0.00 H new ATOM 0 HE2 PHE A 23 1.765 -2.027 5.220 1.00 0.00 H new ATOM 0 HZ PHE A 23 1.721 -0.634 7.222 1.00 0.00 H new ATOM 290 N THR A 24 6.658 -3.294 4.559 1.00 0.00 N ATOM 291 CA THR A 24 6.734 -2.231 3.574 1.00 0.00 C ATOM 292 C THR A 24 5.837 -2.549 2.376 1.00 0.00 C ATOM 293 O THR A 24 5.518 -3.710 2.126 1.00 0.00 O ATOM 294 CB THR A 24 8.204 -2.037 3.197 1.00 0.00 C ATOM 295 OG1 THR A 24 8.162 -1.175 2.064 1.00 0.00 O ATOM 296 CG2 THR A 24 8.846 -3.321 2.666 1.00 0.00 C ATOM 0 H THR A 24 6.489 -4.223 4.172 1.00 0.00 H new ATOM 0 HA THR A 24 6.361 -1.290 3.979 1.00 0.00 H new ATOM 0 HB THR A 24 8.759 -1.687 4.068 1.00 0.00 H new ATOM 0 HG1 THR A 24 9.075 -0.996 1.755 1.00 0.00 H new ATOM 0 HG21 THR A 24 9.889 -3.129 2.413 1.00 0.00 H new ATOM 0 HG22 THR A 24 8.795 -4.096 3.430 1.00 0.00 H new ATOM 0 HG23 THR A 24 8.312 -3.653 1.776 1.00 0.00 H new ATOM 304 N LEU A 25 5.455 -1.498 1.666 1.00 0.00 N ATOM 305 CA LEU A 25 4.602 -1.650 0.500 1.00 0.00 C ATOM 306 C LEU A 25 5.417 -1.375 -0.764 1.00 0.00 C ATOM 307 O LEU A 25 6.467 -0.738 -0.702 1.00 0.00 O ATOM 308 CB LEU A 25 3.355 -0.774 0.631 1.00 0.00 C ATOM 309 CG LEU A 25 2.581 -0.898 1.945 1.00 0.00 C ATOM 310 CD1 LEU A 25 2.279 -2.362 2.267 1.00 0.00 C ATOM 311 CD2 LEU A 25 3.327 -0.203 3.088 1.00 0.00 C ATOM 0 H LEU A 25 5.721 -0.536 1.876 1.00 0.00 H new ATOM 0 HA LEU A 25 4.237 -2.675 0.426 1.00 0.00 H new ATOM 0 HB2 LEU A 25 3.652 0.267 0.505 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.679 -1.014 -0.190 1.00 0.00 H new ATOM 0 HG LEU A 25 1.624 -0.390 1.827 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.728 -2.422 3.206 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.679 -2.794 1.466 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.214 -2.915 2.359 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.756 -0.306 4.011 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.307 -0.662 3.215 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.449 0.854 2.853 1.00 0.00 H new ATOM 322 N ARG A 26 4.903 -1.868 -1.881 1.00 0.00 N ATOM 323 CA ARG A 26 5.571 -1.682 -3.158 1.00 0.00 C ATOM 324 C ARG A 26 4.691 -2.200 -4.297 1.00 0.00 C ATOM 325 O ARG A 26 3.688 -2.869 -4.056 1.00 0.00 O ATOM 326 CB ARG A 26 6.915 -2.414 -3.189 1.00 0.00 C ATOM 327 CG ARG A 26 7.835 -1.826 -4.259 1.00 0.00 C ATOM 328 CD ARG A 26 9.305 -1.983 -3.866 1.00 0.00 C ATOM 329 NE ARG A 26 10.175 -1.395 -4.909 1.00 0.00 N ATOM 330 CZ ARG A 26 10.304 -0.079 -5.124 1.00 0.00 C ATOM 331 NH1 ARG A 26 9.623 0.793 -4.370 1.00 0.00 N ATOM 332 NH2 ARG A 26 11.116 0.365 -6.093 1.00 0.00 N ATOM 0 H ARG A 26 4.032 -2.396 -1.928 1.00 0.00 H new ATOM 0 HA ARG A 26 5.748 -0.614 -3.287 1.00 0.00 H new ATOM 0 HB2 ARG A 26 7.395 -2.342 -2.213 1.00 0.00 H new ATOM 0 HB3 ARG A 26 6.752 -3.473 -3.387 1.00 0.00 H new ATOM 0 HG2 ARG A 26 7.655 -2.324 -5.212 1.00 0.00 H new ATOM 0 HG3 ARG A 26 7.604 -0.770 -4.402 1.00 0.00 H new ATOM 0 HD2 ARG A 26 9.488 -1.493 -2.910 1.00 0.00 H new ATOM 0 HD3 ARG A 26 9.544 -3.038 -3.734 1.00 0.00 H new ATOM 0 HE ARG A 26 10.709 -2.031 -5.501 1.00 0.00 H new ATOM 0 HH11 ARG A 26 9.006 0.455 -3.632 1.00 0.00 H new ATOM 0 HH12 ARG A 26 9.722 1.795 -4.534 1.00 0.00 H new ATOM 0 HH21 ARG A 26 11.636 -0.299 -6.667 1.00 0.00 H new ATOM 0 HH22 ARG A 26 11.214 1.367 -6.257 1.00 0.00 H new ATOM 343 N HIS A 27 5.099 -1.870 -5.515 1.00 0.00 N ATOM 344 CA HIS A 27 4.360 -2.293 -6.692 1.00 0.00 C ATOM 345 C HIS A 27 2.944 -1.717 -6.643 1.00 0.00 C ATOM 346 O HIS A 27 2.412 -1.455 -5.565 1.00 0.00 O ATOM 347 CB HIS A 27 4.376 -3.818 -6.824 1.00 0.00 C ATOM 348 CG HIS A 27 5.414 -4.340 -7.788 1.00 0.00 C ATOM 349 ND1 HIS A 27 5.326 -4.158 -9.157 1.00 0.00 N ATOM 350 CD2 HIS A 27 6.564 -5.038 -7.566 1.00 0.00 C ATOM 351 CE1 HIS A 27 6.380 -4.726 -9.723 1.00 0.00 C ATOM 352 NE2 HIS A 27 7.145 -5.272 -8.735 1.00 0.00 N ATOM 0 H HIS A 27 5.932 -1.315 -5.711 1.00 0.00 H new ATOM 0 HA HIS A 27 4.842 -1.904 -7.589 1.00 0.00 H new ATOM 0 HB2 HIS A 27 4.555 -4.256 -5.842 1.00 0.00 H new ATOM 0 HB3 HIS A 27 3.391 -4.155 -7.149 1.00 0.00 H new ATOM 0 HD2 HIS A 27 6.938 -5.348 -6.602 1.00 0.00 H new ATOM 0 HE1 HIS A 27 6.596 -4.752 -10.781 1.00 0.00 H new ATOM 0 HE2 HIS A 27 8.020 -5.777 -8.872 1.00 0.00 H new ATOM 359 N PHE A 28 2.373 -1.534 -7.825 1.00 0.00 N ATOM 360 CA PHE A 28 1.028 -0.993 -7.931 1.00 0.00 C ATOM 361 C PHE A 28 0.483 -1.155 -9.351 1.00 0.00 C ATOM 362 O PHE A 28 1.214 -0.979 -10.325 1.00 0.00 O ATOM 363 CB PHE A 28 1.119 0.498 -7.599 1.00 0.00 C ATOM 364 CG PHE A 28 -0.237 1.167 -7.367 1.00 0.00 C ATOM 365 CD1 PHE A 28 -1.172 0.556 -6.591 1.00 0.00 C ATOM 366 CD2 PHE A 28 -0.508 2.371 -7.936 1.00 0.00 C ATOM 367 CE1 PHE A 28 -2.431 1.177 -6.375 1.00 0.00 C ATOM 368 CE2 PHE A 28 -1.766 2.993 -7.721 1.00 0.00 C ATOM 369 CZ PHE A 28 -2.702 2.382 -6.945 1.00 0.00 C ATOM 0 H PHE A 28 2.817 -1.751 -8.717 1.00 0.00 H new ATOM 0 HA PHE A 28 0.359 -1.521 -7.251 1.00 0.00 H new ATOM 0 HB2 PHE A 28 1.732 0.624 -6.707 1.00 0.00 H new ATOM 0 HB3 PHE A 28 1.631 1.011 -8.413 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -0.957 -0.401 -6.139 1.00 0.00 H new ATOM 0 HD2 PHE A 28 0.235 2.855 -8.553 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -3.173 0.692 -5.758 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -1.980 3.950 -8.173 1.00 0.00 H new ATOM 0 HZ PHE A 28 -3.660 2.854 -6.782 1.00 0.00 H new ATOM 378 N ILE A 29 -0.797 -1.490 -9.425 1.00 0.00 N ATOM 379 CA ILE A 29 -1.449 -1.677 -10.709 1.00 0.00 C ATOM 380 C ILE A 29 -1.571 -0.325 -11.417 1.00 0.00 C ATOM 381 O ILE A 29 -0.696 0.056 -12.190 1.00 0.00 O ATOM 382 CB ILE A 29 -2.784 -2.401 -10.531 1.00 0.00 C ATOM 383 CG1 ILE A 29 -2.590 -3.746 -9.826 1.00 0.00 C ATOM 384 CG2 ILE A 29 -3.507 -2.557 -11.872 1.00 0.00 C ATOM 385 CD1 ILE A 29 -3.905 -4.523 -9.757 1.00 0.00 C ATOM 0 H ILE A 29 -1.400 -1.637 -8.615 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.847 -2.320 -11.352 1.00 0.00 H new ATOM 0 HB ILE A 29 -3.420 -1.790 -9.890 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.843 -4.335 -10.358 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.208 -3.581 -8.819 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.453 -3.075 -11.717 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -3.698 -1.573 -12.299 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -2.885 -3.135 -12.556 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.739 -5.474 -9.252 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -4.642 -3.942 -9.204 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.272 -4.708 -10.767 1.00 0.00 H new ATOM 396 N VAL A 30 -2.667 0.362 -11.125 1.00 0.00 N ATOM 397 CA VAL A 30 -2.915 1.663 -11.723 1.00 0.00 C ATOM 398 C VAL A 30 -2.765 1.557 -13.242 1.00 0.00 C ATOM 399 O VAL A 30 -2.404 0.503 -13.763 1.00 0.00 O ATOM 400 CB VAL A 30 -1.988 2.710 -11.102 1.00 0.00 C ATOM 401 CG1 VAL A 30 -0.559 2.554 -11.622 1.00 0.00 C ATOM 402 CG2 VAL A 30 -2.513 4.125 -11.355 1.00 0.00 C ATOM 0 H VAL A 30 -3.392 0.042 -10.483 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.935 1.990 -11.519 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.971 2.546 -10.024 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.079 3.310 -11.165 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.186 1.562 -11.368 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.550 2.678 -12.705 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.836 4.850 -10.903 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -2.573 4.304 -12.428 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -3.504 4.230 -10.913 1.00 0.00 H new ATOM 412 N TYR A 31 -3.050 2.665 -13.911 1.00 0.00 N ATOM 413 CA TYR A 31 -2.951 2.711 -15.359 1.00 0.00 C ATOM 414 C TYR A 31 -2.783 4.150 -15.853 1.00 0.00 C ATOM 415 O TYR A 31 -3.767 4.860 -16.053 1.00 0.00 O ATOM 416 CB TYR A 31 -4.273 2.155 -15.890 1.00 0.00 C ATOM 417 CG TYR A 31 -4.393 0.632 -15.787 1.00 0.00 C ATOM 418 CD1 TYR A 31 -4.758 0.048 -14.591 1.00 0.00 C ATOM 419 CD2 TYR A 31 -4.138 -0.156 -16.890 1.00 0.00 C ATOM 420 CE1 TYR A 31 -4.870 -1.384 -14.494 1.00 0.00 C ATOM 421 CE2 TYR A 31 -4.251 -1.588 -16.794 1.00 0.00 C ATOM 422 CZ TYR A 31 -4.612 -2.131 -15.601 1.00 0.00 C ATOM 423 OH TYR A 31 -4.718 -3.485 -15.509 1.00 0.00 O ATOM 0 H TYR A 31 -3.350 3.538 -13.476 1.00 0.00 H new ATOM 0 HA TYR A 31 -2.088 2.140 -15.702 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -5.095 2.612 -15.339 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -4.386 2.449 -16.934 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -4.960 0.665 -13.728 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -3.853 0.301 -17.826 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -5.152 -1.854 -13.564 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -4.054 -2.216 -17.650 1.00 0.00 H new ATOM 0 HH TYR A 31 -4.506 -3.889 -16.376 1.00 0.00 H new ATOM 432 N PRO A 32 -1.495 4.547 -16.037 1.00 0.00 N ATOM 433 CA PRO A 32 -1.186 5.888 -16.503 1.00 0.00 C ATOM 434 C PRO A 32 -1.481 6.032 -17.998 1.00 0.00 C ATOM 435 O PRO A 32 -1.666 5.036 -18.696 1.00 0.00 O ATOM 436 CB PRO A 32 0.283 6.092 -16.165 1.00 0.00 C ATOM 437 CG PRO A 32 0.858 4.702 -15.950 1.00 0.00 C ATOM 438 CD PRO A 32 -0.306 3.734 -15.809 1.00 0.00 C ATOM 0 HA PRO A 32 -1.801 6.651 -16.027 1.00 0.00 H new ATOM 0 HB2 PRO A 32 0.802 6.608 -16.973 1.00 0.00 H new ATOM 0 HB3 PRO A 32 0.397 6.704 -15.270 1.00 0.00 H new ATOM 0 HG2 PRO A 32 1.492 4.417 -16.789 1.00 0.00 H new ATOM 0 HG3 PRO A 32 1.483 4.681 -15.057 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -0.236 2.923 -16.534 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -0.323 3.277 -14.820 1.00 0.00 H new ATOM 443 N PRO A 33 -1.519 7.312 -18.456 1.00 0.00 N ATOM 444 CA PRO A 33 -1.789 7.599 -19.854 1.00 0.00 C ATOM 445 C PRO A 33 -0.570 7.286 -20.724 1.00 0.00 C ATOM 446 O PRO A 33 -0.611 6.383 -21.557 1.00 0.00 O ATOM 447 CB PRO A 33 -2.181 9.067 -19.886 1.00 0.00 C ATOM 448 CG PRO A 33 -1.669 9.663 -18.585 1.00 0.00 C ATOM 449 CD PRO A 33 -1.306 8.515 -17.658 1.00 0.00 C ATOM 0 HA PRO A 33 -2.586 6.979 -20.264 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -1.740 9.570 -20.746 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -3.262 9.181 -19.969 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -0.800 10.294 -18.770 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -2.431 10.296 -18.129 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.272 8.589 -17.322 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -1.932 8.514 -16.765 1.00 0.00 H new ATOM 454 N GLU A 34 0.489 8.053 -20.500 1.00 0.00 N ATOM 455 CA GLU A 34 1.718 7.869 -21.252 1.00 0.00 C ATOM 456 C GLU A 34 2.931 8.120 -20.355 1.00 0.00 C ATOM 457 O GLU A 34 3.516 7.180 -19.820 1.00 0.00 O ATOM 458 CB GLU A 34 1.748 8.777 -22.483 1.00 0.00 C ATOM 459 CG GLU A 34 1.054 10.111 -22.197 1.00 0.00 C ATOM 460 CD GLU A 34 -0.231 10.246 -23.016 1.00 0.00 C ATOM 461 OE1 GLU A 34 -0.218 9.776 -24.175 1.00 0.00 O ATOM 462 OE2 GLU A 34 -1.197 10.817 -22.467 1.00 0.00 O ATOM 0 H GLU A 34 0.520 8.802 -19.809 1.00 0.00 H new ATOM 0 HA GLU A 34 1.757 6.837 -21.602 1.00 0.00 H new ATOM 0 HB2 GLU A 34 2.781 8.957 -22.782 1.00 0.00 H new ATOM 0 HB3 GLU A 34 1.257 8.279 -23.319 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.822 10.184 -21.135 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.728 10.934 -22.433 1.00 0.00 H new ATOM 467 N SER A 35 3.274 9.392 -20.219 1.00 0.00 N ATOM 468 CA SER A 35 4.407 9.779 -19.396 1.00 0.00 C ATOM 469 C SER A 35 3.973 10.821 -18.364 1.00 0.00 C ATOM 470 O SER A 35 4.744 11.715 -18.016 1.00 0.00 O ATOM 471 CB SER A 35 5.549 10.326 -20.254 1.00 0.00 C ATOM 472 OG SER A 35 6.577 10.915 -19.463 1.00 0.00 O ATOM 0 H SER A 35 2.787 10.169 -20.665 1.00 0.00 H new ATOM 0 HA SER A 35 4.771 8.892 -18.877 1.00 0.00 H new ATOM 0 HB2 SER A 35 5.970 9.519 -20.853 1.00 0.00 H new ATOM 0 HB3 SER A 35 5.157 11.068 -20.949 1.00 0.00 H new ATOM 0 HG SER A 35 6.195 11.625 -18.906 1.00 0.00 H new ATOM 477 N ALA A 36 2.741 10.672 -17.902 1.00 0.00 N ATOM 478 CA ALA A 36 2.195 11.589 -16.916 1.00 0.00 C ATOM 479 C ALA A 36 3.032 11.516 -15.638 1.00 0.00 C ATOM 480 O ALA A 36 4.041 12.209 -15.513 1.00 0.00 O ATOM 481 CB ALA A 36 0.722 11.255 -16.667 1.00 0.00 C ATOM 0 H ALA A 36 2.105 9.930 -18.192 1.00 0.00 H new ATOM 0 HA ALA A 36 2.240 12.615 -17.282 1.00 0.00 H new ATOM 0 HB1 ALA A 36 0.313 11.943 -15.927 1.00 0.00 H new ATOM 0 HB2 ALA A 36 0.165 11.351 -17.599 1.00 0.00 H new ATOM 0 HB3 ALA A 36 0.638 10.233 -16.297 1.00 0.00 H new ATOM 487 N ILE A 37 2.586 10.669 -14.723 1.00 0.00 N ATOM 488 CA ILE A 37 3.282 10.497 -13.460 1.00 0.00 C ATOM 489 C ILE A 37 3.239 11.809 -12.674 1.00 0.00 C ATOM 490 O ILE A 37 4.222 12.545 -12.634 1.00 0.00 O ATOM 491 CB ILE A 37 4.699 9.969 -13.696 1.00 0.00 C ATOM 492 CG1 ILE A 37 4.675 8.707 -14.561 1.00 0.00 C ATOM 493 CG2 ILE A 37 5.428 9.742 -12.371 1.00 0.00 C ATOM 494 CD1 ILE A 37 6.042 8.459 -15.205 1.00 0.00 C ATOM 0 H ILE A 37 1.751 10.094 -14.831 1.00 0.00 H new ATOM 0 HA ILE A 37 2.782 9.744 -12.851 1.00 0.00 H new ATOM 0 HB ILE A 37 5.259 10.726 -14.245 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.395 7.848 -13.951 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.916 8.808 -15.337 1.00 0.00 H new ATOM 0 HG21 ILE A 37 6.432 9.367 -12.568 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.493 10.683 -11.825 1.00 0.00 H new ATOM 0 HG23 ILE A 37 4.879 9.014 -11.774 1.00 0.00 H new ATOM 0 HD11 ILE A 37 5.999 7.556 -15.815 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.308 9.309 -15.834 1.00 0.00 H new ATOM 0 HD13 ILE A 37 6.794 8.335 -14.426 1.00 0.00 H new ATOM 505 N GLN A 38 2.087 12.061 -12.068 1.00 0.00 N ATOM 506 CA GLN A 38 1.901 13.271 -11.286 1.00 0.00 C ATOM 507 C GLN A 38 1.859 12.937 -9.794 1.00 0.00 C ATOM 508 O GLN A 38 2.186 13.779 -8.957 1.00 0.00 O ATOM 509 CB GLN A 38 0.637 14.014 -11.717 1.00 0.00 C ATOM 510 CG GLN A 38 -0.591 13.104 -11.632 1.00 0.00 C ATOM 511 CD GLN A 38 -1.703 13.758 -10.810 1.00 0.00 C ATOM 512 OE1 GLN A 38 -1.569 14.860 -10.303 1.00 0.00 O ATOM 513 NE2 GLN A 38 -2.805 13.021 -10.707 1.00 0.00 N ATOM 0 H GLN A 38 1.273 11.447 -12.103 1.00 0.00 H new ATOM 0 HA GLN A 38 2.749 13.931 -11.467 1.00 0.00 H new ATOM 0 HB2 GLN A 38 0.491 14.888 -11.083 1.00 0.00 H new ATOM 0 HB3 GLN A 38 0.755 14.377 -12.738 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -0.956 12.886 -12.636 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -0.312 12.152 -11.180 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -2.851 12.106 -11.156 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -3.605 13.370 -10.179 1.00 0.00 H new ATOM 520 N PHE A 39 1.456 11.709 -9.505 1.00 0.00 N ATOM 521 CA PHE A 39 1.366 11.255 -8.129 1.00 0.00 C ATOM 522 C PHE A 39 0.554 12.234 -7.278 1.00 0.00 C ATOM 523 O PHE A 39 0.163 13.298 -7.755 1.00 0.00 O ATOM 524 CB PHE A 39 2.797 11.189 -7.585 1.00 0.00 C ATOM 525 CG PHE A 39 3.240 9.786 -7.166 1.00 0.00 C ATOM 526 CD1 PHE A 39 3.021 8.729 -7.993 1.00 0.00 C ATOM 527 CD2 PHE A 39 3.851 9.596 -5.967 1.00 0.00 C ATOM 528 CE1 PHE A 39 3.432 7.426 -7.604 1.00 0.00 C ATOM 529 CE2 PHE A 39 4.263 8.294 -5.577 1.00 0.00 C ATOM 530 CZ PHE A 39 4.045 7.237 -6.405 1.00 0.00 C ATOM 0 H PHE A 39 1.188 11.014 -10.202 1.00 0.00 H new ATOM 0 HA PHE A 39 0.870 10.285 -8.090 1.00 0.00 H new ATOM 0 HB2 PHE A 39 3.482 11.563 -8.346 1.00 0.00 H new ATOM 0 HB3 PHE A 39 2.880 11.856 -6.727 1.00 0.00 H new ATOM 0 HD1 PHE A 39 2.535 8.880 -8.945 1.00 0.00 H new ATOM 0 HD2 PHE A 39 4.023 10.436 -5.310 1.00 0.00 H new ATOM 0 HE1 PHE A 39 3.258 6.586 -8.260 1.00 0.00 H new ATOM 0 HE2 PHE A 39 4.749 8.143 -4.624 1.00 0.00 H new ATOM 0 HZ PHE A 39 4.359 6.247 -6.110 1.00 0.00 H new ATOM 539 N SER A 40 0.327 11.839 -6.035 1.00 0.00 N ATOM 540 CA SER A 40 -0.432 12.669 -5.114 1.00 0.00 C ATOM 541 C SER A 40 -1.905 12.698 -5.527 1.00 0.00 C ATOM 542 O SER A 40 -2.231 12.468 -6.690 1.00 0.00 O ATOM 543 CB SER A 40 0.133 14.090 -5.060 1.00 0.00 C ATOM 544 OG SER A 40 0.412 14.504 -3.725 1.00 0.00 O ATOM 0 H SER A 40 0.655 10.956 -5.643 1.00 0.00 H new ATOM 0 HA SER A 40 -0.350 12.236 -4.117 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.046 14.140 -5.653 1.00 0.00 H new ATOM 0 HB3 SER A 40 -0.579 14.780 -5.512 1.00 0.00 H new ATOM 0 HG SER A 40 0.772 15.415 -3.734 1.00 0.00 H new ATOM 549 N TYR A 41 -2.754 12.985 -4.551 1.00 0.00 N ATOM 550 CA TYR A 41 -4.185 13.046 -4.799 1.00 0.00 C ATOM 551 C TYR A 41 -4.909 13.761 -3.656 1.00 0.00 C ATOM 552 O TYR A 41 -4.834 13.332 -2.505 1.00 0.00 O ATOM 553 CB TYR A 41 -4.665 11.595 -4.863 1.00 0.00 C ATOM 554 CG TYR A 41 -5.842 11.371 -5.815 1.00 0.00 C ATOM 555 CD1 TYR A 41 -7.035 12.035 -5.605 1.00 0.00 C ATOM 556 CD2 TYR A 41 -5.712 10.506 -6.881 1.00 0.00 C ATOM 557 CE1 TYR A 41 -8.143 11.824 -6.501 1.00 0.00 C ATOM 558 CE2 TYR A 41 -6.820 10.295 -7.777 1.00 0.00 C ATOM 559 CZ TYR A 41 -7.981 10.965 -7.542 1.00 0.00 C ATOM 560 OH TYR A 41 -9.027 10.765 -8.387 1.00 0.00 O ATOM 0 H TYR A 41 -2.479 13.178 -3.588 1.00 0.00 H new ATOM 0 HA TYR A 41 -4.392 13.595 -5.718 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -3.834 10.961 -5.173 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -4.954 11.274 -3.862 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -7.137 12.712 -4.770 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -4.779 9.987 -7.044 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -9.081 12.337 -6.349 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -6.731 9.621 -8.616 1.00 0.00 H new ATOM 0 HH TYR A 41 -8.767 10.127 -9.084 1.00 0.00 H new ATOM 569 N LYS A 42 -5.593 14.839 -4.013 1.00 0.00 N ATOM 570 CA LYS A 42 -6.329 15.616 -3.032 1.00 0.00 C ATOM 571 C LYS A 42 -7.052 14.668 -2.073 1.00 0.00 C ATOM 572 O LYS A 42 -7.653 13.685 -2.504 1.00 0.00 O ATOM 573 CB LYS A 42 -7.257 16.614 -3.727 1.00 0.00 C ATOM 574 CG LYS A 42 -7.293 17.945 -2.974 1.00 0.00 C ATOM 575 CD LYS A 42 -6.005 18.740 -3.201 1.00 0.00 C ATOM 576 CE LYS A 42 -5.210 18.880 -1.902 1.00 0.00 C ATOM 577 NZ LYS A 42 -4.069 19.804 -2.090 1.00 0.00 N ATOM 0 H LYS A 42 -5.652 15.192 -4.968 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.646 16.216 -2.431 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -6.918 16.780 -4.750 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -8.263 16.199 -3.788 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -8.150 18.531 -3.306 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -7.427 17.760 -1.908 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.394 18.242 -3.953 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -6.248 19.728 -3.591 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -5.860 19.251 -1.109 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -4.846 17.903 -1.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -3.540 19.888 -1.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -3.441 19.434 -2.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -4.423 20.740 -2.372 1.00 0.00 H new ATOM 587 N ASP A 43 -6.969 14.995 -0.791 1.00 0.00 N ATOM 588 CA ASP A 43 -7.608 14.185 0.230 1.00 0.00 C ATOM 589 C ASP A 43 -8.941 14.823 0.623 1.00 0.00 C ATOM 590 O ASP A 43 -8.965 15.869 1.271 1.00 0.00 O ATOM 591 CB ASP A 43 -6.738 14.095 1.486 1.00 0.00 C ATOM 592 CG ASP A 43 -5.244 13.892 1.225 1.00 0.00 C ATOM 593 OD1 ASP A 43 -4.917 12.896 0.547 1.00 0.00 O ATOM 594 OD2 ASP A 43 -4.463 14.740 1.710 1.00 0.00 O ATOM 0 H ASP A 43 -6.468 15.810 -0.437 1.00 0.00 H new ATOM 0 HA ASP A 43 -7.757 13.185 -0.178 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -6.869 15.008 2.067 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -7.099 13.271 2.102 1.00 0.00 H new ATOM 598 N GLU A 44 -10.018 14.169 0.215 1.00 0.00 N ATOM 599 CA GLU A 44 -11.352 14.660 0.516 1.00 0.00 C ATOM 600 C GLU A 44 -12.266 13.501 0.916 1.00 0.00 C ATOM 601 O GLU A 44 -11.922 12.337 0.720 1.00 0.00 O ATOM 602 CB GLU A 44 -11.933 15.433 -0.670 1.00 0.00 C ATOM 603 CG GLU A 44 -11.798 16.942 -0.460 1.00 0.00 C ATOM 604 CD GLU A 44 -13.004 17.500 0.299 1.00 0.00 C ATOM 605 OE1 GLU A 44 -13.176 17.092 1.468 1.00 0.00 O ATOM 606 OE2 GLU A 44 -13.726 18.320 -0.308 1.00 0.00 O ATOM 0 H GLU A 44 -9.994 13.302 -0.322 1.00 0.00 H new ATOM 0 HA GLU A 44 -11.283 15.350 1.357 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -11.418 15.142 -1.586 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -12.984 15.173 -0.799 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -10.884 17.155 0.095 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -11.709 17.441 -1.425 1.00 0.00 H new ATOM 611 N GLU A 45 -13.415 13.861 1.470 1.00 0.00 N ATOM 612 CA GLU A 45 -14.383 12.865 1.900 1.00 0.00 C ATOM 613 C GLU A 45 -14.626 11.846 0.785 1.00 0.00 C ATOM 614 O GLU A 45 -14.794 12.219 -0.376 1.00 0.00 O ATOM 615 CB GLU A 45 -15.693 13.524 2.335 1.00 0.00 C ATOM 616 CG GLU A 45 -16.003 13.213 3.801 1.00 0.00 C ATOM 617 CD GLU A 45 -16.751 14.373 4.462 1.00 0.00 C ATOM 618 OE1 GLU A 45 -17.996 14.378 4.356 1.00 0.00 O ATOM 619 OE2 GLU A 45 -16.060 15.229 5.056 1.00 0.00 O ATOM 0 H GLU A 45 -13.697 14.828 1.631 1.00 0.00 H new ATOM 0 HA GLU A 45 -13.975 12.340 2.764 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.626 14.603 2.195 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -16.509 13.171 1.704 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.603 12.305 3.865 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.075 13.020 4.340 1.00 0.00 H new ATOM 624 N ASN A 46 -14.639 10.580 1.176 1.00 0.00 N ATOM 625 CA ASN A 46 -14.861 9.505 0.223 1.00 0.00 C ATOM 626 C ASN A 46 -16.249 9.659 -0.400 1.00 0.00 C ATOM 627 O ASN A 46 -17.230 9.879 0.308 1.00 0.00 O ATOM 628 CB ASN A 46 -14.799 8.140 0.910 1.00 0.00 C ATOM 629 CG ASN A 46 -15.089 7.012 -0.083 1.00 0.00 C ATOM 630 OD1 ASN A 46 -16.179 6.466 -0.141 1.00 0.00 O ATOM 631 ND2 ASN A 46 -14.056 6.695 -0.858 1.00 0.00 N ATOM 0 H ASN A 46 -14.500 10.274 2.139 1.00 0.00 H new ATOM 0 HA ASN A 46 -14.082 9.562 -0.537 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -13.813 7.996 1.352 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -15.522 8.106 1.725 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -14.148 5.955 -1.553 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -13.171 7.192 -0.757 1.00 0.00 H new ATOM 637 N GLY A 47 -16.287 9.538 -1.719 1.00 0.00 N ATOM 638 CA GLY A 47 -17.539 9.660 -2.446 1.00 0.00 C ATOM 639 C GLY A 47 -18.261 8.313 -2.527 1.00 0.00 C ATOM 640 O GLY A 47 -18.046 7.440 -1.689 1.00 0.00 O ATOM 0 H GLY A 47 -15.471 9.357 -2.303 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -18.180 10.391 -1.953 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -17.345 10.033 -3.451 1.00 0.00 H new ATOM 644 N ASN A 48 -19.102 8.188 -3.543 1.00 0.00 N ATOM 645 CA ASN A 48 -19.856 6.963 -3.744 1.00 0.00 C ATOM 646 C ASN A 48 -19.426 6.315 -5.062 1.00 0.00 C ATOM 647 O ASN A 48 -19.315 6.992 -6.083 1.00 0.00 O ATOM 648 CB ASN A 48 -21.357 7.247 -3.824 1.00 0.00 C ATOM 649 CG ASN A 48 -22.168 5.963 -3.641 1.00 0.00 C ATOM 650 OD1 ASN A 48 -21.874 4.924 -4.208 1.00 0.00 O ATOM 651 ND2 ASN A 48 -23.205 6.091 -2.818 1.00 0.00 N ATOM 0 H ASN A 48 -19.278 8.915 -4.236 1.00 0.00 H new ATOM 0 HA ASN A 48 -19.659 6.303 -2.899 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -21.635 7.970 -3.057 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -21.595 7.697 -4.788 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -23.809 5.291 -2.630 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -23.397 6.990 -2.375 1.00 0.00 H new ATOM 657 N ARG A 49 -19.196 5.013 -4.996 1.00 0.00 N ATOM 658 CA ARG A 49 -18.781 4.266 -6.171 1.00 0.00 C ATOM 659 C ARG A 49 -19.101 2.779 -5.997 1.00 0.00 C ATOM 660 O ARG A 49 -19.419 2.334 -4.895 1.00 0.00 O ATOM 661 CB ARG A 49 -17.281 4.430 -6.428 1.00 0.00 C ATOM 662 CG ARG A 49 -17.020 5.513 -7.477 1.00 0.00 C ATOM 663 CD ARG A 49 -16.225 6.675 -6.879 1.00 0.00 C ATOM 664 NE ARG A 49 -16.954 7.947 -7.088 1.00 0.00 N ATOM 665 CZ ARG A 49 -16.486 9.148 -6.723 1.00 0.00 C ATOM 666 NH1 ARG A 49 -15.289 9.249 -6.128 1.00 0.00 N ATOM 667 NH2 ARG A 49 -17.215 10.249 -6.951 1.00 0.00 N ATOM 0 H ARG A 49 -19.289 4.455 -4.147 1.00 0.00 H new ATOM 0 HA ARG A 49 -19.330 4.662 -7.025 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -16.775 4.690 -5.498 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -16.860 3.483 -6.766 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -16.471 5.086 -8.317 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -17.968 5.880 -7.869 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -16.066 6.508 -5.814 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -15.240 6.730 -7.343 1.00 0.00 H new ATOM 0 HE ARG A 49 -17.869 7.906 -7.538 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -14.734 8.411 -5.953 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -14.933 10.164 -5.850 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -18.126 10.173 -7.403 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -16.858 11.163 -6.673 1.00 0.00 H new ATOM 678 N GLY A 50 -19.007 2.052 -7.101 1.00 0.00 N ATOM 679 CA GLY A 50 -19.282 0.626 -7.083 1.00 0.00 C ATOM 680 C GLY A 50 -18.343 -0.126 -8.028 1.00 0.00 C ATOM 681 O GLY A 50 -17.412 0.460 -8.580 1.00 0.00 O ATOM 0 H GLY A 50 -18.744 2.424 -8.014 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -19.167 0.243 -6.069 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -20.317 0.448 -7.375 1.00 0.00 H new ATOM 685 N GLY A 51 -18.619 -1.412 -8.187 1.00 0.00 N ATOM 686 CA GLY A 51 -17.810 -2.249 -9.055 1.00 0.00 C ATOM 687 C GLY A 51 -17.361 -3.520 -8.330 1.00 0.00 C ATOM 688 O GLY A 51 -16.510 -3.467 -7.444 1.00 0.00 O ATOM 0 H GLY A 51 -19.392 -1.895 -7.729 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -18.381 -2.516 -9.944 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -16.937 -1.691 -9.393 1.00 0.00 H new ATOM 692 N LYS A 52 -17.956 -4.634 -8.734 1.00 0.00 N ATOM 693 CA LYS A 52 -17.630 -5.916 -8.133 1.00 0.00 C ATOM 694 C LYS A 52 -16.161 -6.242 -8.405 1.00 0.00 C ATOM 695 O LYS A 52 -15.345 -6.269 -7.483 1.00 0.00 O ATOM 696 CB LYS A 52 -18.599 -6.996 -8.617 1.00 0.00 C ATOM 697 CG LYS A 52 -19.597 -7.370 -7.519 1.00 0.00 C ATOM 698 CD LYS A 52 -20.905 -6.593 -7.679 1.00 0.00 C ATOM 699 CE LYS A 52 -22.066 -7.536 -8.004 1.00 0.00 C ATOM 700 NZ LYS A 52 -22.313 -7.568 -9.463 1.00 0.00 N ATOM 0 H LYS A 52 -18.661 -4.675 -9.470 1.00 0.00 H new ATOM 0 HA LYS A 52 -17.753 -5.872 -7.051 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -19.136 -6.640 -9.496 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -18.040 -7.881 -8.922 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -19.799 -8.440 -7.556 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -19.163 -7.161 -6.541 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -21.122 -6.046 -6.762 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -20.799 -5.854 -8.473 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -21.839 -8.540 -7.645 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -22.966 -7.208 -7.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -23.104 -8.212 -9.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -22.551 -6.612 -9.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -21.459 -7.903 -9.952 1.00 0.00 H new ATOM 710 N GLN A 53 -15.865 -6.482 -9.674 1.00 0.00 N ATOM 711 CA GLN A 53 -14.508 -6.805 -10.078 1.00 0.00 C ATOM 712 C GLN A 53 -14.071 -5.907 -11.238 1.00 0.00 C ATOM 713 O GLN A 53 -14.111 -6.317 -12.396 1.00 0.00 O ATOM 714 CB GLN A 53 -14.386 -8.284 -10.457 1.00 0.00 C ATOM 715 CG GLN A 53 -13.246 -8.954 -9.685 1.00 0.00 C ATOM 716 CD GLN A 53 -12.869 -10.293 -10.320 1.00 0.00 C ATOM 717 OE1 GLN A 53 -13.553 -10.815 -11.184 1.00 0.00 O ATOM 718 NE2 GLN A 53 -11.741 -10.817 -9.848 1.00 0.00 N ATOM 0 H GLN A 53 -16.543 -6.459 -10.436 1.00 0.00 H new ATOM 0 HA GLN A 53 -13.845 -6.623 -9.232 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -15.324 -8.796 -10.245 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -14.208 -8.375 -11.528 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -12.377 -8.297 -9.670 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -13.546 -9.110 -8.649 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -11.215 -10.328 -9.124 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -11.402 -11.708 -10.211 1.00 0.00 H new ATOM 725 N ARG A 54 -13.664 -4.696 -10.885 1.00 0.00 N ATOM 726 CA ARG A 54 -13.221 -3.735 -11.880 1.00 0.00 C ATOM 727 C ARG A 54 -12.938 -2.382 -11.222 1.00 0.00 C ATOM 728 O ARG A 54 -11.872 -1.802 -11.423 1.00 0.00 O ATOM 729 CB ARG A 54 -14.272 -3.552 -12.975 1.00 0.00 C ATOM 730 CG ARG A 54 -13.759 -4.073 -14.320 1.00 0.00 C ATOM 731 CD ARG A 54 -14.597 -3.524 -15.475 1.00 0.00 C ATOM 732 NE ARG A 54 -15.004 -4.627 -16.374 1.00 0.00 N ATOM 733 CZ ARG A 54 -15.944 -4.517 -17.322 1.00 0.00 C ATOM 734 NH1 ARG A 54 -16.582 -3.352 -17.501 1.00 0.00 N ATOM 735 NH2 ARG A 54 -16.247 -5.571 -18.092 1.00 0.00 N ATOM 0 H ARG A 54 -13.632 -4.359 -9.923 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.307 -4.122 -12.331 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -15.185 -4.081 -12.700 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -14.530 -2.497 -13.064 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -12.716 -3.784 -14.453 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -13.791 -5.162 -14.328 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -15.480 -3.017 -15.086 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -14.023 -2.783 -16.032 1.00 0.00 H new ATOM 0 HE ARG A 54 -14.539 -5.528 -16.265 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -16.352 -2.549 -16.915 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -17.298 -3.268 -18.223 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -15.762 -6.458 -17.956 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -16.963 -5.486 -18.814 1.00 0.00 H new ATOM 746 N ASN A 55 -13.910 -1.921 -10.450 1.00 0.00 N ATOM 747 CA ASN A 55 -13.780 -0.647 -9.762 1.00 0.00 C ATOM 748 C ASN A 55 -13.670 0.476 -10.796 1.00 0.00 C ATOM 749 O ASN A 55 -12.570 0.897 -11.146 1.00 0.00 O ATOM 750 CB ASN A 55 -12.520 -0.617 -8.896 1.00 0.00 C ATOM 751 CG ASN A 55 -12.875 -0.690 -7.410 1.00 0.00 C ATOM 752 OD1 ASN A 55 -13.463 0.215 -6.839 1.00 0.00 O ATOM 753 ND2 ASN A 55 -12.484 -1.813 -6.815 1.00 0.00 N ATOM 0 H ASN A 55 -14.792 -2.407 -10.285 1.00 0.00 H new ATOM 0 HA ASN A 55 -14.657 -0.513 -9.129 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -11.873 -1.453 -9.160 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -11.959 0.296 -9.095 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -12.672 -1.957 -5.823 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -11.996 -2.531 -7.351 1.00 0.00 H new ATOM 759 N ARG A 56 -14.828 0.930 -11.254 1.00 0.00 N ATOM 760 CA ARG A 56 -14.877 1.996 -12.239 1.00 0.00 C ATOM 761 C ARG A 56 -13.889 3.106 -11.870 1.00 0.00 C ATOM 762 O ARG A 56 -13.639 3.351 -10.692 1.00 0.00 O ATOM 763 CB ARG A 56 -16.284 2.589 -12.342 1.00 0.00 C ATOM 764 CG ARG A 56 -16.513 3.226 -13.714 1.00 0.00 C ATOM 765 CD ARG A 56 -16.649 2.155 -14.799 1.00 0.00 C ATOM 766 NE ARG A 56 -15.312 1.780 -15.310 1.00 0.00 N ATOM 767 CZ ARG A 56 -14.554 2.571 -16.081 1.00 0.00 C ATOM 768 NH1 ARG A 56 -14.997 3.785 -16.436 1.00 0.00 N ATOM 769 NH2 ARG A 56 -13.355 2.147 -16.500 1.00 0.00 N ATOM 0 H ARG A 56 -15.739 0.578 -10.961 1.00 0.00 H new ATOM 0 HA ARG A 56 -14.605 1.568 -13.204 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -17.025 1.808 -12.172 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -16.425 3.337 -11.562 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -17.414 3.840 -13.688 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -15.682 3.889 -13.954 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -17.152 1.277 -14.394 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -17.268 2.529 -15.615 1.00 0.00 H new ATOM 0 HE ARG A 56 -14.945 0.862 -15.060 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -15.912 4.107 -16.119 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -14.420 4.387 -17.023 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.019 1.222 -16.232 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -12.778 2.749 -17.087 1.00 0.00 H new ATOM 780 N LEU A 57 -13.355 3.746 -12.900 1.00 0.00 N ATOM 781 CA LEU A 57 -12.401 4.822 -12.700 1.00 0.00 C ATOM 782 C LEU A 57 -11.129 4.259 -12.063 1.00 0.00 C ATOM 783 O LEU A 57 -10.893 4.445 -10.871 1.00 0.00 O ATOM 784 CB LEU A 57 -13.038 5.959 -11.897 1.00 0.00 C ATOM 785 CG LEU A 57 -13.888 6.950 -12.696 1.00 0.00 C ATOM 786 CD1 LEU A 57 -14.109 6.454 -14.127 1.00 0.00 C ATOM 787 CD2 LEU A 57 -15.208 7.242 -11.980 1.00 0.00 C ATOM 0 H LEU A 57 -13.566 3.539 -13.876 1.00 0.00 H new ATOM 0 HA LEU A 57 -12.113 5.258 -13.656 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -13.662 5.522 -11.118 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -12.244 6.513 -11.396 1.00 0.00 H new ATOM 0 HG LEU A 57 -13.343 7.892 -12.762 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -14.716 7.176 -14.673 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -13.146 6.339 -14.625 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -14.623 5.493 -14.104 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -15.793 7.949 -12.569 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -15.770 6.316 -11.862 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -15.003 7.670 -10.999 1.00 0.00 H new ATOM 798 N GLU A 58 -10.345 3.580 -12.887 1.00 0.00 N ATOM 799 CA GLU A 58 -9.103 2.988 -12.420 1.00 0.00 C ATOM 800 C GLU A 58 -9.379 2.014 -11.273 1.00 0.00 C ATOM 801 O GLU A 58 -10.400 2.119 -10.596 1.00 0.00 O ATOM 802 CB GLU A 58 -8.106 4.068 -11.995 1.00 0.00 C ATOM 803 CG GLU A 58 -7.963 5.138 -13.079 1.00 0.00 C ATOM 804 CD GLU A 58 -7.384 6.431 -12.499 1.00 0.00 C ATOM 805 OE1 GLU A 58 -6.138 6.523 -12.452 1.00 0.00 O ATOM 806 OE2 GLU A 58 -8.199 7.297 -12.117 1.00 0.00 O ATOM 0 H GLU A 58 -10.546 3.427 -13.875 1.00 0.00 H new ATOM 0 HA GLU A 58 -8.655 2.432 -13.244 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -8.438 4.529 -11.065 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.135 3.614 -11.796 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.316 4.770 -13.875 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.936 5.340 -13.527 1.00 0.00 H new ATOM 811 N PRO A 59 -8.423 1.063 -11.083 1.00 0.00 N ATOM 812 CA PRO A 59 -8.552 0.072 -10.028 1.00 0.00 C ATOM 813 C PRO A 59 -8.261 0.686 -8.659 1.00 0.00 C ATOM 814 O PRO A 59 -9.126 0.700 -7.784 1.00 0.00 O ATOM 815 CB PRO A 59 -7.577 -1.031 -10.405 1.00 0.00 C ATOM 816 CG PRO A 59 -6.606 -0.408 -11.397 1.00 0.00 C ATOM 817 CD PRO A 59 -7.201 0.910 -11.865 1.00 0.00 C ATOM 0 HA PRO A 59 -9.565 -0.322 -9.942 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -7.051 -1.405 -9.526 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -8.099 -1.879 -10.849 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -5.635 -0.244 -10.929 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -6.444 -1.076 -12.243 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -6.514 1.738 -11.692 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -7.415 0.891 -12.934 1.00 0.00 H new ATOM 822 N MET A 60 -7.040 1.181 -8.515 1.00 0.00 N ATOM 823 CA MET A 60 -6.624 1.796 -7.266 1.00 0.00 C ATOM 824 C MET A 60 -7.240 1.073 -6.067 1.00 0.00 C ATOM 825 O MET A 60 -8.269 1.497 -5.543 1.00 0.00 O ATOM 826 CB MET A 60 -7.053 3.265 -7.252 1.00 0.00 C ATOM 827 CG MET A 60 -8.399 3.450 -7.954 1.00 0.00 C ATOM 828 SD MET A 60 -8.852 5.177 -7.964 1.00 0.00 S ATOM 829 CE MET A 60 -10.630 5.031 -7.939 1.00 0.00 C ATOM 0 H MET A 60 -6.326 1.169 -9.243 1.00 0.00 H new ATOM 0 HA MET A 60 -5.539 1.724 -7.191 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.124 3.617 -6.223 1.00 0.00 H new ATOM 0 HB3 MET A 60 -6.295 3.874 -7.745 1.00 0.00 H new ATOM 0 HG2 MET A 60 -8.340 3.075 -8.976 1.00 0.00 H new ATOM 0 HG3 MET A 60 -9.167 2.867 -7.445 1.00 0.00 H new ATOM 0 HE1 MET A 60 -11.068 5.813 -8.559 1.00 0.00 H new ATOM 0 HE2 MET A 60 -10.920 4.055 -8.327 1.00 0.00 H new ATOM 0 HE3 MET A 60 -10.989 5.136 -6.915 1.00 0.00 H new ATOM 837 N ASP A 61 -6.584 -0.007 -5.667 1.00 0.00 N ATOM 838 CA ASP A 61 -7.055 -0.793 -4.540 1.00 0.00 C ATOM 839 C ASP A 61 -6.345 -2.149 -4.537 1.00 0.00 C ATOM 840 O ASP A 61 -6.903 -3.146 -4.993 1.00 0.00 O ATOM 841 CB ASP A 61 -8.561 -1.048 -4.636 1.00 0.00 C ATOM 842 CG ASP A 61 -9.069 -2.235 -3.815 1.00 0.00 C ATOM 843 OD1 ASP A 61 -8.385 -2.577 -2.827 1.00 0.00 O ATOM 844 OD2 ASP A 61 -10.131 -2.775 -4.195 1.00 0.00 O ATOM 0 H ASP A 61 -5.731 -0.356 -6.103 1.00 0.00 H new ATOM 0 HA ASP A 61 -6.841 -0.236 -3.628 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -9.088 -0.150 -4.313 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.821 -1.211 -5.682 1.00 0.00 H new ATOM 848 N THR A 62 -5.127 -2.141 -4.018 1.00 0.00 N ATOM 849 CA THR A 62 -4.334 -3.358 -3.950 1.00 0.00 C ATOM 850 C THR A 62 -3.260 -3.236 -2.868 1.00 0.00 C ATOM 851 O THR A 62 -3.523 -3.495 -1.695 1.00 0.00 O ATOM 852 CB THR A 62 -3.765 -3.630 -5.345 1.00 0.00 C ATOM 853 OG1 THR A 62 -4.914 -3.891 -6.144 1.00 0.00 O ATOM 854 CG2 THR A 62 -2.963 -4.932 -5.405 1.00 0.00 C ATOM 0 H THR A 62 -4.669 -1.312 -3.640 1.00 0.00 H new ATOM 0 HA THR A 62 -4.945 -4.213 -3.660 1.00 0.00 H new ATOM 0 HB THR A 62 -3.129 -2.798 -5.647 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.659 -4.162 -5.567 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.582 -5.078 -6.416 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.128 -4.878 -4.706 1.00 0.00 H new ATOM 0 HG23 THR A 62 -3.607 -5.769 -5.136 1.00 0.00 H new ATOM 862 N ILE A 63 -2.071 -2.839 -3.301 1.00 0.00 N ATOM 863 CA ILE A 63 -0.957 -2.678 -2.383 1.00 0.00 C ATOM 864 C ILE A 63 -0.557 -4.047 -1.829 1.00 0.00 C ATOM 865 O ILE A 63 -1.343 -4.694 -1.138 1.00 0.00 O ATOM 866 CB ILE A 63 -1.297 -1.651 -1.300 1.00 0.00 C ATOM 867 CG1 ILE A 63 -1.400 -0.245 -1.893 1.00 0.00 C ATOM 868 CG2 ILE A 63 -0.292 -1.716 -0.149 1.00 0.00 C ATOM 869 CD1 ILE A 63 -2.823 0.304 -1.760 1.00 0.00 C ATOM 0 H ILE A 63 -1.856 -2.625 -4.275 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.088 -2.278 -2.906 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.275 -1.899 -0.887 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.701 0.420 -1.385 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.112 -0.268 -2.944 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -0.556 -0.976 0.607 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.311 -2.711 0.295 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.709 -1.507 -0.527 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -2.868 1.305 -2.189 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -3.516 -0.350 -2.289 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -3.099 0.348 -0.706 1.00 0.00 H new ATOM 880 N PHE A 64 0.663 -4.448 -2.152 1.00 0.00 N ATOM 881 CA PHE A 64 1.178 -5.728 -1.693 1.00 0.00 C ATOM 882 C PHE A 64 2.328 -5.535 -0.704 1.00 0.00 C ATOM 883 O PHE A 64 2.871 -4.437 -0.583 1.00 0.00 O ATOM 884 CB PHE A 64 1.699 -6.467 -2.927 1.00 0.00 C ATOM 885 CG PHE A 64 0.638 -6.707 -4.004 1.00 0.00 C ATOM 886 CD1 PHE A 64 -0.142 -7.820 -3.953 1.00 0.00 C ATOM 887 CD2 PHE A 64 0.476 -5.807 -5.010 1.00 0.00 C ATOM 888 CE1 PHE A 64 -1.127 -8.042 -4.953 1.00 0.00 C ATOM 889 CE2 PHE A 64 -0.508 -6.030 -6.009 1.00 0.00 C ATOM 890 CZ PHE A 64 -1.289 -7.142 -5.959 1.00 0.00 C ATOM 0 H PHE A 64 1.311 -3.909 -2.727 1.00 0.00 H new ATOM 0 HA PHE A 64 0.391 -6.286 -1.186 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.519 -5.895 -3.361 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.110 -7.428 -2.616 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.013 -8.534 -3.153 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.095 -4.923 -5.049 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.747 -8.926 -4.914 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.636 -5.316 -6.809 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.038 -7.310 -6.719 1.00 0.00 H new ATOM 899 N VAL A 65 2.668 -6.618 -0.022 1.00 0.00 N ATOM 900 CA VAL A 65 3.745 -6.583 0.953 1.00 0.00 C ATOM 901 C VAL A 65 5.041 -7.052 0.290 1.00 0.00 C ATOM 902 O VAL A 65 5.145 -8.200 -0.136 1.00 0.00 O ATOM 903 CB VAL A 65 3.366 -7.413 2.182 1.00 0.00 C ATOM 904 CG1 VAL A 65 4.574 -7.616 3.098 1.00 0.00 C ATOM 905 CG2 VAL A 65 2.203 -6.770 2.940 1.00 0.00 C ATOM 0 H VAL A 65 2.216 -7.527 -0.125 1.00 0.00 H new ATOM 0 HA VAL A 65 3.910 -5.565 1.305 1.00 0.00 H new ATOM 0 HB VAL A 65 3.038 -8.394 1.838 1.00 0.00 H new ATOM 0 HG11 VAL A 65 4.279 -8.209 3.964 1.00 0.00 H new ATOM 0 HG12 VAL A 65 5.361 -8.137 2.553 1.00 0.00 H new ATOM 0 HG13 VAL A 65 4.945 -6.647 3.431 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.954 -7.379 3.809 1.00 0.00 H new ATOM 0 HG22 VAL A 65 2.490 -5.771 3.268 1.00 0.00 H new ATOM 0 HG23 VAL A 65 1.335 -6.701 2.284 1.00 0.00 H new ATOM 915 N LYS A 66 6.000 -6.138 0.226 1.00 0.00 N ATOM 916 CA LYS A 66 7.286 -6.443 -0.377 1.00 0.00 C ATOM 917 C LYS A 66 8.091 -7.331 0.574 1.00 0.00 C ATOM 918 O LYS A 66 8.545 -8.408 0.188 1.00 0.00 O ATOM 919 CB LYS A 66 8.008 -5.156 -0.777 1.00 0.00 C ATOM 920 CG LYS A 66 9.039 -5.426 -1.876 1.00 0.00 C ATOM 921 CD LYS A 66 10.459 -5.440 -1.304 1.00 0.00 C ATOM 922 CE LYS A 66 11.362 -4.462 -2.057 1.00 0.00 C ATOM 923 NZ LYS A 66 12.776 -4.895 -1.975 1.00 0.00 N ATOM 0 H LYS A 66 5.911 -5.186 0.582 1.00 0.00 H new ATOM 0 HA LYS A 66 7.151 -7.005 -1.301 1.00 0.00 H new ATOM 0 HB2 LYS A 66 7.283 -4.421 -1.126 1.00 0.00 H new ATOM 0 HB3 LYS A 66 8.503 -4.726 0.094 1.00 0.00 H new ATOM 0 HG2 LYS A 66 8.826 -6.383 -2.353 1.00 0.00 H new ATOM 0 HG3 LYS A 66 8.962 -4.661 -2.648 1.00 0.00 H new ATOM 0 HD2 LYS A 66 10.432 -5.175 -0.247 1.00 0.00 H new ATOM 0 HD3 LYS A 66 10.872 -6.447 -1.370 1.00 0.00 H new ATOM 0 HE2 LYS A 66 11.053 -4.403 -3.101 1.00 0.00 H new ATOM 0 HE3 LYS A 66 11.256 -3.462 -1.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 13.376 -4.220 -2.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 13.071 -4.929 -0.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 12.875 -5.840 -2.398 1.00 0.00 H new ATOM 933 N GLN A 67 8.245 -6.847 1.798 1.00 0.00 N ATOM 934 CA GLN A 67 8.987 -7.583 2.806 1.00 0.00 C ATOM 935 C GLN A 67 8.422 -7.295 4.198 1.00 0.00 C ATOM 936 O GLN A 67 7.580 -6.414 4.360 1.00 0.00 O ATOM 937 CB GLN A 67 10.478 -7.249 2.741 1.00 0.00 C ATOM 938 CG GLN A 67 11.116 -7.829 1.477 1.00 0.00 C ATOM 939 CD GLN A 67 12.643 -7.767 1.555 1.00 0.00 C ATOM 940 OE1 GLN A 67 13.225 -6.877 2.153 1.00 0.00 O ATOM 941 NE2 GLN A 67 13.258 -8.760 0.917 1.00 0.00 N ATOM 0 H GLN A 67 7.868 -5.953 2.114 1.00 0.00 H new ATOM 0 HA GLN A 67 8.877 -8.648 2.604 1.00 0.00 H new ATOM 0 HB2 GLN A 67 10.613 -6.168 2.757 1.00 0.00 H new ATOM 0 HB3 GLN A 67 10.982 -7.646 3.622 1.00 0.00 H new ATOM 0 HG2 GLN A 67 10.797 -8.863 1.346 1.00 0.00 H new ATOM 0 HG3 GLN A 67 10.770 -7.275 0.604 1.00 0.00 H new ATOM 0 HE21 GLN A 67 12.710 -9.473 0.436 1.00 0.00 H new ATOM 0 HE22 GLN A 67 14.277 -8.808 0.909 1.00 0.00 H new ATOM 948 N VAL A 68 8.908 -8.055 5.169 1.00 0.00 N ATOM 949 CA VAL A 68 8.461 -7.893 6.541 1.00 0.00 C ATOM 950 C VAL A 68 9.678 -7.809 7.463 1.00 0.00 C ATOM 951 O VAL A 68 10.386 -8.797 7.654 1.00 0.00 O ATOM 952 CB VAL A 68 7.503 -9.027 6.917 1.00 0.00 C ATOM 953 CG1 VAL A 68 7.339 -9.124 8.436 1.00 0.00 C ATOM 954 CG2 VAL A 68 6.148 -8.850 6.230 1.00 0.00 C ATOM 0 H VAL A 68 9.607 -8.785 5.032 1.00 0.00 H new ATOM 0 HA VAL A 68 7.903 -6.963 6.653 1.00 0.00 H new ATOM 0 HB VAL A 68 7.937 -9.963 6.566 1.00 0.00 H new ATOM 0 HG11 VAL A 68 6.654 -9.937 8.677 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.308 -9.318 8.895 1.00 0.00 H new ATOM 0 HG13 VAL A 68 6.938 -8.186 8.819 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.486 -9.668 6.514 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.705 -7.902 6.537 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.285 -8.853 5.149 1.00 0.00 H new ATOM 964 N LYS A 69 9.885 -6.620 8.010 1.00 0.00 N ATOM 965 CA LYS A 69 11.006 -6.394 8.906 1.00 0.00 C ATOM 966 C LYS A 69 11.115 -7.566 9.885 1.00 0.00 C ATOM 967 O LYS A 69 10.139 -7.920 10.544 1.00 0.00 O ATOM 968 CB LYS A 69 10.878 -5.031 9.590 1.00 0.00 C ATOM 969 CG LYS A 69 12.256 -4.422 9.861 1.00 0.00 C ATOM 970 CD LYS A 69 12.152 -2.914 10.101 1.00 0.00 C ATOM 971 CE LYS A 69 13.477 -2.348 10.612 1.00 0.00 C ATOM 972 NZ LYS A 69 14.058 -1.416 9.620 1.00 0.00 N ATOM 0 H LYS A 69 9.295 -5.803 7.850 1.00 0.00 H new ATOM 0 HA LYS A 69 11.941 -6.358 8.346 1.00 0.00 H new ATOM 0 HB2 LYS A 69 10.296 -4.358 8.961 1.00 0.00 H new ATOM 0 HB3 LYS A 69 10.334 -5.140 10.528 1.00 0.00 H new ATOM 0 HG2 LYS A 69 12.705 -4.902 10.731 1.00 0.00 H new ATOM 0 HG3 LYS A 69 12.915 -4.614 9.015 1.00 0.00 H new ATOM 0 HD2 LYS A 69 11.872 -2.413 9.174 1.00 0.00 H new ATOM 0 HD3 LYS A 69 11.362 -2.711 10.825 1.00 0.00 H new ATOM 0 HE2 LYS A 69 13.318 -1.829 11.557 1.00 0.00 H new ATOM 0 HE3 LYS A 69 14.175 -3.161 10.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 14.958 -1.040 9.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 14.228 -1.921 8.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 13.397 -0.631 9.453 1.00 0.00 H new ATOM 982 N GLU A 70 12.311 -8.133 9.949 1.00 0.00 N ATOM 983 CA GLU A 70 12.560 -9.256 10.837 1.00 0.00 C ATOM 984 C GLU A 70 12.793 -8.762 12.265 1.00 0.00 C ATOM 985 O GLU A 70 13.925 -8.476 12.650 1.00 0.00 O ATOM 986 CB GLU A 70 13.743 -10.090 10.344 1.00 0.00 C ATOM 987 CG GLU A 70 13.434 -11.586 10.431 1.00 0.00 C ATOM 988 CD GLU A 70 13.106 -12.160 9.051 1.00 0.00 C ATOM 989 OE1 GLU A 70 13.859 -11.837 8.109 1.00 0.00 O ATOM 990 OE2 GLU A 70 12.109 -12.910 8.971 1.00 0.00 O ATOM 0 H GLU A 70 13.118 -7.836 9.400 1.00 0.00 H new ATOM 0 HA GLU A 70 11.679 -9.898 10.836 1.00 0.00 H new ATOM 0 HB2 GLU A 70 13.976 -9.823 9.313 1.00 0.00 H new ATOM 0 HB3 GLU A 70 14.627 -9.862 10.940 1.00 0.00 H new ATOM 0 HG2 GLU A 70 14.289 -12.113 10.854 1.00 0.00 H new ATOM 0 HG3 GLU A 70 12.593 -11.749 11.106 1.00 0.00 H new ATOM 995 N GLY A 71 11.703 -8.677 13.014 1.00 0.00 N ATOM 996 CA GLY A 71 11.775 -8.223 14.392 1.00 0.00 C ATOM 997 C GLY A 71 11.094 -6.863 14.557 1.00 0.00 C ATOM 998 O GLY A 71 11.589 -6.001 15.283 1.00 0.00 O ATOM 0 H GLY A 71 10.765 -8.915 12.692 1.00 0.00 H new ATOM 0 HA2 GLY A 71 11.298 -8.954 15.045 1.00 0.00 H new ATOM 0 HA3 GLY A 71 12.818 -8.152 14.701 1.00 0.00 H new ATOM 1002 N GLY A 72 9.969 -6.713 13.872 1.00 0.00 N ATOM 1003 CA GLY A 72 9.217 -5.471 13.934 1.00 0.00 C ATOM 1004 C GLY A 72 7.779 -5.724 14.392 1.00 0.00 C ATOM 1005 O GLY A 72 7.500 -6.728 15.046 1.00 0.00 O ATOM 0 H GLY A 72 9.561 -7.430 13.272 1.00 0.00 H new ATOM 0 HA2 GLY A 72 9.705 -4.780 14.621 1.00 0.00 H new ATOM 0 HA3 GLY A 72 9.212 -4.995 12.953 1.00 0.00 H new ATOM 1009 N PRO A 73 6.881 -4.772 14.020 1.00 0.00 N ATOM 1010 CA PRO A 73 5.479 -4.884 14.385 1.00 0.00 C ATOM 1011 C PRO A 73 4.771 -5.936 13.531 1.00 0.00 C ATOM 1012 O PRO A 73 4.200 -6.888 14.058 1.00 0.00 O ATOM 1013 CB PRO A 73 4.912 -3.485 14.200 1.00 0.00 C ATOM 1014 CG PRO A 73 5.895 -2.755 13.298 1.00 0.00 C ATOM 1015 CD PRO A 73 7.176 -3.571 13.246 1.00 0.00 C ATOM 0 HA PRO A 73 5.337 -5.224 15.411 1.00 0.00 H new ATOM 0 HB2 PRO A 73 3.920 -3.522 13.749 1.00 0.00 H new ATOM 0 HB3 PRO A 73 4.808 -2.976 15.158 1.00 0.00 H new ATOM 0 HG2 PRO A 73 5.478 -2.635 12.298 1.00 0.00 H new ATOM 0 HG3 PRO A 73 6.095 -1.755 13.682 1.00 0.00 H new ATOM 0 HD2 PRO A 73 7.447 -3.818 12.219 1.00 0.00 H new ATOM 0 HD3 PRO A 73 8.014 -3.020 13.673 1.00 0.00 H new ATOM 1020 N ALA A 74 4.829 -5.725 12.223 1.00 0.00 N ATOM 1021 CA ALA A 74 4.200 -6.643 11.289 1.00 0.00 C ATOM 1022 C ALA A 74 4.618 -8.075 11.627 1.00 0.00 C ATOM 1023 O ALA A 74 3.776 -8.914 11.942 1.00 0.00 O ATOM 1024 CB ALA A 74 4.572 -6.250 9.858 1.00 0.00 C ATOM 0 H ALA A 74 5.302 -4.932 11.789 1.00 0.00 H new ATOM 0 HA ALA A 74 3.114 -6.589 11.371 1.00 0.00 H new ATOM 0 HB1 ALA A 74 4.100 -6.939 9.157 1.00 0.00 H new ATOM 0 HB2 ALA A 74 4.227 -5.236 9.658 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.654 -6.295 9.738 1.00 0.00 H new ATOM 1030 N PHE A 75 5.920 -8.311 11.553 1.00 0.00 N ATOM 1031 CA PHE A 75 6.461 -9.628 11.848 1.00 0.00 C ATOM 1032 C PHE A 75 5.727 -10.269 13.027 1.00 0.00 C ATOM 1033 O PHE A 75 5.540 -11.484 13.059 1.00 0.00 O ATOM 1034 CB PHE A 75 7.932 -9.433 12.222 1.00 0.00 C ATOM 1035 CG PHE A 75 8.521 -10.582 13.043 1.00 0.00 C ATOM 1036 CD1 PHE A 75 8.736 -11.792 12.462 1.00 0.00 C ATOM 1037 CD2 PHE A 75 8.830 -10.391 14.354 1.00 0.00 C ATOM 1038 CE1 PHE A 75 9.283 -12.858 13.225 1.00 0.00 C ATOM 1039 CE2 PHE A 75 9.378 -11.458 15.117 1.00 0.00 C ATOM 1040 CZ PHE A 75 9.592 -12.669 14.535 1.00 0.00 C ATOM 0 H PHE A 75 6.616 -7.613 11.293 1.00 0.00 H new ATOM 0 HA PHE A 75 6.345 -10.282 10.983 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.516 -9.315 11.309 1.00 0.00 H new ATOM 0 HB3 PHE A 75 8.033 -8.507 12.787 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.491 -11.943 11.421 1.00 0.00 H new ATOM 0 HD2 PHE A 75 8.659 -9.429 14.815 1.00 0.00 H new ATOM 0 HE1 PHE A 75 9.454 -13.820 12.764 1.00 0.00 H new ATOM 0 HE2 PHE A 75 9.624 -11.307 16.158 1.00 0.00 H new ATOM 0 HZ PHE A 75 10.008 -13.480 15.114 1.00 0.00 H new ATOM 1049 N GLU A 76 5.331 -9.425 13.967 1.00 0.00 N ATOM 1050 CA GLU A 76 4.622 -9.895 15.145 1.00 0.00 C ATOM 1051 C GLU A 76 3.156 -10.171 14.808 1.00 0.00 C ATOM 1052 O GLU A 76 2.686 -11.299 14.946 1.00 0.00 O ATOM 1053 CB GLU A 76 4.740 -8.890 16.293 1.00 0.00 C ATOM 1054 CG GLU A 76 6.206 -8.649 16.664 1.00 0.00 C ATOM 1055 CD GLU A 76 6.563 -9.353 17.975 1.00 0.00 C ATOM 1056 OE1 GLU A 76 6.026 -8.919 19.015 1.00 0.00 O ATOM 1057 OE2 GLU A 76 7.364 -10.309 17.905 1.00 0.00 O ATOM 0 H GLU A 76 5.488 -8.418 13.937 1.00 0.00 H new ATOM 0 HA GLU A 76 5.081 -10.828 15.473 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.275 -7.947 16.005 1.00 0.00 H new ATOM 0 HB3 GLU A 76 4.197 -9.261 17.163 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.852 -9.012 15.864 1.00 0.00 H new ATOM 0 HG3 GLU A 76 6.389 -7.579 16.760 1.00 0.00 H new ATOM 1062 N ALA A 77 2.475 -9.122 14.371 1.00 0.00 N ATOM 1063 CA ALA A 77 1.072 -9.239 14.011 1.00 0.00 C ATOM 1064 C ALA A 77 0.847 -10.558 13.270 1.00 0.00 C ATOM 1065 O ALA A 77 -0.216 -11.165 13.386 1.00 0.00 O ATOM 1066 CB ALA A 77 0.655 -8.023 13.179 1.00 0.00 C ATOM 0 H ALA A 77 2.868 -8.188 14.258 1.00 0.00 H new ATOM 0 HA ALA A 77 0.447 -9.253 14.904 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.397 -8.111 12.909 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.806 -7.114 13.762 1.00 0.00 H new ATOM 0 HB3 ALA A 77 1.260 -7.977 12.273 1.00 0.00 H new ATOM 1072 N GLY A 78 1.865 -10.961 12.524 1.00 0.00 N ATOM 1073 CA GLY A 78 1.791 -12.198 11.765 1.00 0.00 C ATOM 1074 C GLY A 78 1.920 -11.927 10.264 1.00 0.00 C ATOM 1075 O GLY A 78 1.799 -12.843 9.452 1.00 0.00 O ATOM 0 H GLY A 78 2.745 -10.454 12.429 1.00 0.00 H new ATOM 0 HA2 GLY A 78 2.584 -12.874 12.086 1.00 0.00 H new ATOM 0 HA3 GLY A 78 0.844 -12.698 11.968 1.00 0.00 H new ATOM 1079 N LEU A 79 2.162 -10.665 9.941 1.00 0.00 N ATOM 1080 CA LEU A 79 2.308 -10.263 8.553 1.00 0.00 C ATOM 1081 C LEU A 79 3.398 -11.108 7.893 1.00 0.00 C ATOM 1082 O LEU A 79 4.380 -11.474 8.536 1.00 0.00 O ATOM 1083 CB LEU A 79 2.555 -8.755 8.456 1.00 0.00 C ATOM 1084 CG LEU A 79 1.737 -8.009 7.400 1.00 0.00 C ATOM 1085 CD1 LEU A 79 0.247 -8.026 7.747 1.00 0.00 C ATOM 1086 CD2 LEU A 79 2.263 -6.586 7.203 1.00 0.00 C ATOM 0 H LEU A 79 2.261 -9.908 10.617 1.00 0.00 H new ATOM 0 HA LEU A 79 1.385 -10.448 8.004 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.348 -8.309 9.429 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.613 -8.592 8.249 1.00 0.00 H new ATOM 0 HG LEU A 79 1.852 -8.529 6.449 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.311 -7.489 6.980 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.103 -9.057 7.796 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.093 -7.544 8.713 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.664 -6.078 6.447 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.198 -6.041 8.144 1.00 0.00 H new ATOM 0 HD23 LEU A 79 3.302 -6.624 6.877 1.00 0.00 H new ATOM 1097 N CYS A 80 3.188 -11.395 6.617 1.00 0.00 N ATOM 1098 CA CYS A 80 4.141 -12.192 5.862 1.00 0.00 C ATOM 1099 C CYS A 80 4.434 -11.470 4.544 1.00 0.00 C ATOM 1100 O CYS A 80 4.073 -10.305 4.377 1.00 0.00 O ATOM 1101 CB CYS A 80 3.631 -13.615 5.631 1.00 0.00 C ATOM 1102 SG CYS A 80 4.908 -14.826 6.130 1.00 0.00 S ATOM 0 H CYS A 80 2.372 -11.090 6.086 1.00 0.00 H new ATOM 0 HA CYS A 80 5.064 -12.295 6.432 1.00 0.00 H new ATOM 0 HB2 CYS A 80 2.718 -13.780 6.203 1.00 0.00 H new ATOM 0 HB3 CYS A 80 3.378 -13.753 4.580 1.00 0.00 H new ATOM 0 HG CYS A 80 4.464 -16.032 5.932 1.00 0.00 H new ATOM 1107 N THR A 81 5.086 -12.191 3.644 1.00 0.00 N ATOM 1108 CA THR A 81 5.431 -11.633 2.347 1.00 0.00 C ATOM 1109 C THR A 81 4.488 -12.169 1.268 1.00 0.00 C ATOM 1110 O THR A 81 4.234 -13.370 1.201 1.00 0.00 O ATOM 1111 CB THR A 81 6.905 -11.945 2.075 1.00 0.00 C ATOM 1112 OG1 THR A 81 7.034 -13.325 2.410 1.00 0.00 O ATOM 1113 CG2 THR A 81 7.843 -11.236 3.055 1.00 0.00 C ATOM 0 H THR A 81 5.384 -13.156 3.787 1.00 0.00 H new ATOM 0 HA THR A 81 5.305 -10.550 2.336 1.00 0.00 H new ATOM 0 HB THR A 81 7.156 -11.654 1.055 1.00 0.00 H new ATOM 0 HG1 THR A 81 7.959 -13.613 2.262 1.00 0.00 H new ATOM 0 HG21 THR A 81 8.876 -11.491 2.819 1.00 0.00 H new ATOM 0 HG22 THR A 81 7.707 -10.158 2.973 1.00 0.00 H new ATOM 0 HG23 THR A 81 7.614 -11.554 4.072 1.00 0.00 H new ATOM 1121 N GLY A 82 3.995 -11.251 0.450 1.00 0.00 N ATOM 1122 CA GLY A 82 3.086 -11.615 -0.622 1.00 0.00 C ATOM 1123 C GLY A 82 1.663 -11.139 -0.321 1.00 0.00 C ATOM 1124 O GLY A 82 0.862 -10.950 -1.234 1.00 0.00 O ATOM 0 H GLY A 82 4.208 -10.255 0.509 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.429 -11.176 -1.559 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.091 -12.697 -0.756 1.00 0.00 H new ATOM 1128 N ASP A 83 1.394 -10.958 0.963 1.00 0.00 N ATOM 1129 CA ASP A 83 0.081 -10.507 1.396 1.00 0.00 C ATOM 1130 C ASP A 83 -0.187 -9.112 0.828 1.00 0.00 C ATOM 1131 O ASP A 83 0.742 -8.409 0.433 1.00 0.00 O ATOM 1132 CB ASP A 83 0.006 -10.418 2.922 1.00 0.00 C ATOM 1133 CG ASP A 83 -0.483 -11.690 3.619 1.00 0.00 C ATOM 1134 OD1 ASP A 83 -1.499 -12.241 3.145 1.00 0.00 O ATOM 1135 OD2 ASP A 83 0.170 -12.079 4.612 1.00 0.00 O ATOM 0 H ASP A 83 2.062 -11.115 1.718 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.657 -11.225 1.039 1.00 0.00 H new ATOM 0 HB2 ASP A 83 0.995 -10.168 3.306 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -0.657 -9.596 3.191 1.00 0.00 H new ATOM 1139 N ARG A 84 -1.462 -8.753 0.805 1.00 0.00 N ATOM 1140 CA ARG A 84 -1.865 -7.455 0.292 1.00 0.00 C ATOM 1141 C ARG A 84 -2.858 -6.791 1.248 1.00 0.00 C ATOM 1142 O ARG A 84 -3.715 -7.460 1.820 1.00 0.00 O ATOM 1143 CB ARG A 84 -2.507 -7.584 -1.091 1.00 0.00 C ATOM 1144 CG ARG A 84 -3.878 -8.257 -0.998 1.00 0.00 C ATOM 1145 CD ARG A 84 -4.424 -8.583 -2.390 1.00 0.00 C ATOM 1146 NE ARG A 84 -4.995 -9.949 -2.403 1.00 0.00 N ATOM 1147 CZ ARG A 84 -5.200 -10.666 -3.516 1.00 0.00 C ATOM 1148 NH1 ARG A 84 -4.884 -10.151 -4.712 1.00 0.00 N ATOM 1149 NH2 ARG A 84 -5.723 -11.897 -3.432 1.00 0.00 N ATOM 0 H ARG A 84 -2.230 -9.339 1.134 1.00 0.00 H new ATOM 0 HA ARG A 84 -0.969 -6.839 0.208 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -2.612 -6.597 -1.541 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.857 -8.164 -1.745 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -3.799 -9.172 -0.411 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -4.574 -7.602 -0.475 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -5.188 -7.858 -2.669 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -3.627 -8.506 -3.129 1.00 0.00 H new ATOM 0 HE ARG A 84 -5.248 -10.370 -1.509 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -4.487 -9.213 -4.775 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -5.040 -10.697 -5.560 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -5.965 -12.287 -2.521 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -5.879 -12.444 -4.279 1.00 0.00 H new ATOM 1160 N ILE A 85 -2.709 -5.482 1.389 1.00 0.00 N ATOM 1161 CA ILE A 85 -3.582 -4.719 2.266 1.00 0.00 C ATOM 1162 C ILE A 85 -4.888 -4.408 1.532 1.00 0.00 C ATOM 1163 O ILE A 85 -4.878 -3.761 0.487 1.00 0.00 O ATOM 1164 CB ILE A 85 -2.860 -3.477 2.792 1.00 0.00 C ATOM 1165 CG1 ILE A 85 -1.943 -3.831 3.964 1.00 0.00 C ATOM 1166 CG2 ILE A 85 -3.859 -2.377 3.157 1.00 0.00 C ATOM 1167 CD1 ILE A 85 -1.245 -5.170 3.728 1.00 0.00 C ATOM 0 H ILE A 85 -1.997 -4.930 0.911 1.00 0.00 H new ATOM 0 HA ILE A 85 -3.843 -5.304 3.148 1.00 0.00 H new ATOM 0 HB ILE A 85 -2.227 -3.086 1.995 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -1.198 -3.047 4.097 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -2.525 -3.877 4.885 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -3.321 -1.505 3.528 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -4.434 -2.100 2.273 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -4.536 -2.742 3.930 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -0.599 -5.398 4.576 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -1.993 -5.956 3.620 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.645 -5.112 2.820 1.00 0.00 H new ATOM 1178 N ILE A 86 -5.981 -4.884 2.110 1.00 0.00 N ATOM 1179 CA ILE A 86 -7.293 -4.665 1.523 1.00 0.00 C ATOM 1180 C ILE A 86 -8.005 -3.546 2.286 1.00 0.00 C ATOM 1181 O ILE A 86 -8.838 -2.838 1.720 1.00 0.00 O ATOM 1182 CB ILE A 86 -8.082 -5.974 1.473 1.00 0.00 C ATOM 1183 CG1 ILE A 86 -8.268 -6.558 2.874 1.00 0.00 C ATOM 1184 CG2 ILE A 86 -7.427 -6.974 0.518 1.00 0.00 C ATOM 1185 CD1 ILE A 86 -9.394 -7.594 2.894 1.00 0.00 C ATOM 0 H ILE A 86 -5.986 -5.420 2.978 1.00 0.00 H new ATOM 0 HA ILE A 86 -7.199 -4.337 0.488 1.00 0.00 H new ATOM 0 HB ILE A 86 -9.076 -5.757 1.081 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -7.338 -7.021 3.205 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -8.494 -5.757 3.578 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -8.008 -7.896 0.502 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -7.392 -6.549 -0.485 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.414 -7.190 0.856 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -9.504 -7.992 3.903 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -10.327 -7.123 2.586 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -9.154 -8.406 2.207 1.00 0.00 H new ATOM 1196 N LYS A 87 -7.655 -3.423 3.557 1.00 0.00 N ATOM 1197 CA LYS A 87 -8.251 -2.401 4.403 1.00 0.00 C ATOM 1198 C LYS A 87 -7.154 -1.721 5.225 1.00 0.00 C ATOM 1199 O LYS A 87 -6.079 -2.286 5.421 1.00 0.00 O ATOM 1200 CB LYS A 87 -9.375 -2.999 5.251 1.00 0.00 C ATOM 1201 CG LYS A 87 -10.563 -3.410 4.379 1.00 0.00 C ATOM 1202 CD LYS A 87 -11.093 -4.786 4.788 1.00 0.00 C ATOM 1203 CE LYS A 87 -11.698 -5.519 3.589 1.00 0.00 C ATOM 1204 NZ LYS A 87 -12.319 -6.792 4.020 1.00 0.00 N ATOM 0 H LYS A 87 -6.966 -4.014 4.023 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.718 -1.627 3.795 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.002 -3.867 5.795 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.700 -2.272 5.995 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -11.358 -2.669 4.468 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.261 -3.429 3.332 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -10.283 -5.380 5.211 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -11.846 -4.673 5.567 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.445 -4.887 3.108 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -10.924 -5.718 2.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.725 -7.277 3.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.597 -7.399 4.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.071 -6.595 4.710 1.00 0.00 H new ATOM 1214 N VAL A 88 -7.464 -0.519 5.684 1.00 0.00 N ATOM 1215 CA VAL A 88 -6.519 0.245 6.481 1.00 0.00 C ATOM 1216 C VAL A 88 -7.277 1.026 7.556 1.00 0.00 C ATOM 1217 O VAL A 88 -7.927 2.027 7.259 1.00 0.00 O ATOM 1218 CB VAL A 88 -5.675 1.142 5.572 1.00 0.00 C ATOM 1219 CG1 VAL A 88 -4.830 2.116 6.398 1.00 0.00 C ATOM 1220 CG2 VAL A 88 -4.795 0.308 4.641 1.00 0.00 C ATOM 0 H VAL A 88 -8.357 -0.054 5.520 1.00 0.00 H new ATOM 0 HA VAL A 88 -5.825 -0.421 6.994 1.00 0.00 H new ATOM 0 HB VAL A 88 -6.355 1.727 4.953 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -4.239 2.742 5.730 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -5.485 2.745 7.001 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -4.163 1.555 7.053 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.206 0.971 4.007 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -4.126 -0.315 5.234 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -5.424 -0.327 4.017 1.00 0.00 H new ATOM 1230 N ASN A 89 -7.169 0.539 8.783 1.00 0.00 N ATOM 1231 CA ASN A 89 -7.836 1.177 9.904 1.00 0.00 C ATOM 1232 C ASN A 89 -9.338 1.253 9.623 1.00 0.00 C ATOM 1233 O ASN A 89 -10.011 2.181 10.068 1.00 0.00 O ATOM 1234 CB ASN A 89 -7.321 2.604 10.111 1.00 0.00 C ATOM 1235 CG ASN A 89 -6.052 2.609 10.965 1.00 0.00 C ATOM 1236 OD1 ASN A 89 -5.745 1.664 11.673 1.00 0.00 O ATOM 1237 ND2 ASN A 89 -5.334 3.724 10.859 1.00 0.00 N ATOM 0 H ASN A 89 -6.629 -0.291 9.025 1.00 0.00 H new ATOM 0 HA ASN A 89 -7.633 0.586 10.797 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -7.115 3.064 9.145 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -8.091 3.206 10.593 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -4.469 3.826 11.389 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -5.649 4.477 10.247 1.00 0.00 H new ATOM 1243 N GLY A 90 -9.820 0.264 8.883 1.00 0.00 N ATOM 1244 CA GLY A 90 -11.230 0.207 8.537 1.00 0.00 C ATOM 1245 C GLY A 90 -11.676 1.495 7.844 1.00 0.00 C ATOM 1246 O GLY A 90 -12.839 1.885 7.938 1.00 0.00 O ATOM 0 H GLY A 90 -9.259 -0.504 8.514 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -11.413 -0.645 7.882 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -11.823 0.050 9.438 1.00 0.00 H new ATOM 1250 N GLU A 91 -10.728 2.124 7.163 1.00 0.00 N ATOM 1251 CA GLU A 91 -11.009 3.360 6.455 1.00 0.00 C ATOM 1252 C GLU A 91 -11.473 3.061 5.028 1.00 0.00 C ATOM 1253 O GLU A 91 -11.843 3.971 4.288 1.00 0.00 O ATOM 1254 CB GLU A 91 -9.787 4.280 6.452 1.00 0.00 C ATOM 1255 CG GLU A 91 -10.185 5.723 6.776 1.00 0.00 C ATOM 1256 CD GLU A 91 -11.460 6.120 6.029 1.00 0.00 C ATOM 1257 OE1 GLU A 91 -11.321 6.579 4.875 1.00 0.00 O ATOM 1258 OE2 GLU A 91 -12.544 5.957 6.628 1.00 0.00 O ATOM 0 H GLU A 91 -9.764 1.799 7.087 1.00 0.00 H new ATOM 0 HA GLU A 91 -11.813 3.879 6.976 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -9.060 3.927 7.183 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -9.302 4.243 5.477 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -10.340 5.829 7.850 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -9.374 6.398 6.503 1.00 0.00 H new ATOM 1263 N SER A 92 -11.439 1.781 4.685 1.00 0.00 N ATOM 1264 CA SER A 92 -11.851 1.351 3.360 1.00 0.00 C ATOM 1265 C SER A 92 -10.999 2.045 2.295 1.00 0.00 C ATOM 1266 O SER A 92 -11.234 3.208 1.968 1.00 0.00 O ATOM 1267 CB SER A 92 -13.335 1.640 3.124 1.00 0.00 C ATOM 1268 OG SER A 92 -14.153 1.121 4.168 1.00 0.00 O ATOM 0 H SER A 92 -11.133 1.029 5.302 1.00 0.00 H new ATOM 0 HA SER A 92 -11.702 0.274 3.289 1.00 0.00 H new ATOM 0 HB2 SER A 92 -13.487 2.717 3.046 1.00 0.00 H new ATOM 0 HB3 SER A 92 -13.642 1.205 2.173 1.00 0.00 H new ATOM 0 HG SER A 92 -15.092 1.328 3.981 1.00 0.00 H new ATOM 1273 N VAL A 93 -10.029 1.302 1.784 1.00 0.00 N ATOM 1274 CA VAL A 93 -9.141 1.832 0.762 1.00 0.00 C ATOM 1275 C VAL A 93 -9.608 1.351 -0.613 1.00 0.00 C ATOM 1276 O VAL A 93 -8.812 0.832 -1.396 1.00 0.00 O ATOM 1277 CB VAL A 93 -7.695 1.443 1.073 1.00 0.00 C ATOM 1278 CG1 VAL A 93 -7.274 1.951 2.453 1.00 0.00 C ATOM 1279 CG2 VAL A 93 -7.498 -0.071 0.964 1.00 0.00 C ATOM 0 H VAL A 93 -9.838 0.338 2.058 1.00 0.00 H new ATOM 0 HA VAL A 93 -9.175 2.921 0.753 1.00 0.00 H new ATOM 0 HB VAL A 93 -7.054 1.919 0.331 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -6.242 1.660 2.648 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.357 3.037 2.482 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -7.923 1.518 3.214 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -6.461 -0.320 1.190 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -8.155 -0.575 1.672 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -7.737 -0.397 -0.048 1.00 0.00 H new ATOM 1289 N ILE A 94 -10.895 1.539 -0.865 1.00 0.00 N ATOM 1290 CA ILE A 94 -11.476 1.130 -2.133 1.00 0.00 C ATOM 1291 C ILE A 94 -11.192 2.201 -3.189 1.00 0.00 C ATOM 1292 O ILE A 94 -10.535 1.928 -4.191 1.00 0.00 O ATOM 1293 CB ILE A 94 -12.964 0.814 -1.962 1.00 0.00 C ATOM 1294 CG1 ILE A 94 -13.168 -0.359 -1.001 1.00 0.00 C ATOM 1295 CG2 ILE A 94 -13.631 0.568 -3.317 1.00 0.00 C ATOM 1296 CD1 ILE A 94 -12.885 -1.694 -1.695 1.00 0.00 C ATOM 0 H ILE A 94 -11.552 1.969 -0.213 1.00 0.00 H new ATOM 0 HA ILE A 94 -11.015 0.207 -2.484 1.00 0.00 H new ATOM 0 HB ILE A 94 -13.449 1.683 -1.517 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -12.510 -0.246 -0.140 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -14.191 -0.351 -0.624 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -14.688 0.346 -3.167 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -13.532 1.458 -3.938 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -13.149 -0.275 -3.812 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -13.038 -2.511 -0.989 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -13.561 -1.815 -2.541 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -11.854 -1.709 -2.049 1.00 0.00 H new ATOM 1307 N GLY A 95 -11.702 3.395 -2.925 1.00 0.00 N ATOM 1308 CA GLY A 95 -11.510 4.507 -3.840 1.00 0.00 C ATOM 1309 C GLY A 95 -10.341 5.388 -3.396 1.00 0.00 C ATOM 1310 O GLY A 95 -10.418 6.613 -3.474 1.00 0.00 O ATOM 0 H GLY A 95 -12.247 3.616 -2.092 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -11.323 4.128 -4.845 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -12.421 5.103 -3.889 1.00 0.00 H new ATOM 1314 N LYS A 96 -9.286 4.729 -2.941 1.00 0.00 N ATOM 1315 CA LYS A 96 -8.102 5.437 -2.483 1.00 0.00 C ATOM 1316 C LYS A 96 -6.884 4.945 -3.267 1.00 0.00 C ATOM 1317 O LYS A 96 -6.922 3.875 -3.874 1.00 0.00 O ATOM 1318 CB LYS A 96 -7.951 5.306 -0.967 1.00 0.00 C ATOM 1319 CG LYS A 96 -9.018 6.124 -0.236 1.00 0.00 C ATOM 1320 CD LYS A 96 -8.957 5.883 1.273 1.00 0.00 C ATOM 1321 CE LYS A 96 -10.090 6.617 1.993 1.00 0.00 C ATOM 1322 NZ LYS A 96 -11.383 5.944 1.743 1.00 0.00 N ATOM 0 H LYS A 96 -9.226 3.713 -2.879 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.198 6.505 -2.679 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -8.031 4.258 -0.679 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -6.959 5.644 -0.666 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -8.874 7.184 -0.444 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -10.006 5.857 -0.611 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -9.024 4.814 1.477 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -7.996 6.222 1.660 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -9.890 6.646 3.064 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -10.138 7.650 1.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.029 6.127 2.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -11.802 6.312 0.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -11.229 4.920 1.651 1.00 0.00 H new ATOM 1332 N THR A 97 -5.832 5.750 -3.231 1.00 0.00 N ATOM 1333 CA THR A 97 -4.605 5.409 -3.932 1.00 0.00 C ATOM 1334 C THR A 97 -3.495 5.075 -2.932 1.00 0.00 C ATOM 1335 O THR A 97 -3.677 5.225 -1.724 1.00 0.00 O ATOM 1336 CB THR A 97 -4.254 6.570 -4.863 1.00 0.00 C ATOM 1337 OG1 THR A 97 -2.905 6.314 -5.244 1.00 0.00 O ATOM 1338 CG2 THR A 97 -4.185 7.910 -4.127 1.00 0.00 C ATOM 0 H THR A 97 -5.804 6.637 -2.728 1.00 0.00 H new ATOM 0 HA THR A 97 -4.733 4.513 -4.540 1.00 0.00 H new ATOM 0 HB THR A 97 -4.994 6.631 -5.661 1.00 0.00 H new ATOM 0 HG1 THR A 97 -2.597 7.019 -5.851 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.932 8.701 -4.834 1.00 0.00 H new ATOM 0 HG22 THR A 97 -5.152 8.125 -3.672 1.00 0.00 H new ATOM 0 HG23 THR A 97 -3.422 7.860 -3.351 1.00 0.00 H new ATOM 1346 N TYR A 98 -2.372 4.628 -3.471 1.00 0.00 N ATOM 1347 CA TYR A 98 -1.234 4.272 -2.642 1.00 0.00 C ATOM 1348 C TYR A 98 -0.906 5.389 -1.650 1.00 0.00 C ATOM 1349 O TYR A 98 -0.857 5.158 -0.443 1.00 0.00 O ATOM 1350 CB TYR A 98 -0.052 4.094 -3.599 1.00 0.00 C ATOM 1351 CG TYR A 98 1.256 3.708 -2.908 1.00 0.00 C ATOM 1352 CD1 TYR A 98 1.288 2.634 -2.041 1.00 0.00 C ATOM 1353 CD2 TYR A 98 2.405 4.434 -3.151 1.00 0.00 C ATOM 1354 CE1 TYR A 98 2.521 2.272 -1.391 1.00 0.00 C ATOM 1355 CE2 TYR A 98 3.637 4.071 -2.500 1.00 0.00 C ATOM 1356 CZ TYR A 98 3.634 3.008 -1.653 1.00 0.00 C ATOM 1357 OH TYR A 98 4.798 2.664 -1.038 1.00 0.00 O ATOM 0 H TYR A 98 -2.225 4.504 -4.473 1.00 0.00 H new ATOM 0 HA TYR A 98 -1.447 3.370 -2.068 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -0.304 3.327 -4.332 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.100 5.023 -4.149 1.00 0.00 H new ATOM 0 HD1 TYR A 98 0.389 2.066 -1.850 1.00 0.00 H new ATOM 0 HD2 TYR A 98 2.380 5.274 -3.829 1.00 0.00 H new ATOM 0 HE1 TYR A 98 2.561 1.434 -0.710 1.00 0.00 H new ATOM 0 HE2 TYR A 98 4.543 4.631 -2.681 1.00 0.00 H new ATOM 0 HH TYR A 98 5.510 3.276 -1.320 1.00 0.00 H new ATOM 1366 N SER A 99 -0.692 6.578 -2.196 1.00 0.00 N ATOM 1367 CA SER A 99 -0.371 7.732 -1.373 1.00 0.00 C ATOM 1368 C SER A 99 -1.366 7.844 -0.218 1.00 0.00 C ATOM 1369 O SER A 99 -0.970 8.014 0.934 1.00 0.00 O ATOM 1370 CB SER A 99 -0.375 9.017 -2.203 1.00 0.00 C ATOM 1371 OG SER A 99 -0.801 8.786 -3.544 1.00 0.00 O ATOM 0 H SER A 99 -0.735 6.767 -3.197 1.00 0.00 H new ATOM 0 HA SER A 99 0.632 7.595 -0.968 1.00 0.00 H new ATOM 0 HB2 SER A 99 -1.033 9.749 -1.735 1.00 0.00 H new ATOM 0 HB3 SER A 99 0.627 9.447 -2.210 1.00 0.00 H new ATOM 0 HG SER A 99 -0.791 9.631 -4.040 1.00 0.00 H new ATOM 1376 N GLN A 100 -2.641 7.743 -0.565 1.00 0.00 N ATOM 1377 CA GLN A 100 -3.697 7.831 0.429 1.00 0.00 C ATOM 1378 C GLN A 100 -3.445 6.834 1.563 1.00 0.00 C ATOM 1379 O GLN A 100 -3.132 7.230 2.685 1.00 0.00 O ATOM 1380 CB GLN A 100 -5.070 7.601 -0.206 1.00 0.00 C ATOM 1381 CG GLN A 100 -5.580 8.875 -0.883 1.00 0.00 C ATOM 1382 CD GLN A 100 -7.022 9.178 -0.469 1.00 0.00 C ATOM 1383 OE1 GLN A 100 -7.952 9.093 -1.253 1.00 0.00 O ATOM 1384 NE2 GLN A 100 -7.154 9.532 0.807 1.00 0.00 N ATOM 0 H GLN A 100 -2.966 7.601 -1.521 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.690 8.837 0.847 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -5.006 6.796 -0.938 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -5.779 7.282 0.558 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -4.938 9.714 -0.617 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -5.525 8.762 -1.966 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -6.333 9.583 1.410 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -8.077 9.752 1.182 1.00 0.00 H new ATOM 1391 N VAL A 101 -3.588 5.560 1.229 1.00 0.00 N ATOM 1392 CA VAL A 101 -3.378 4.503 2.204 1.00 0.00 C ATOM 1393 C VAL A 101 -2.025 4.707 2.889 1.00 0.00 C ATOM 1394 O VAL A 101 -1.888 4.464 4.087 1.00 0.00 O ATOM 1395 CB VAL A 101 -3.508 3.135 1.530 1.00 0.00 C ATOM 1396 CG1 VAL A 101 -4.916 2.934 0.965 1.00 0.00 C ATOM 1397 CG2 VAL A 101 -2.449 2.960 0.441 1.00 0.00 C ATOM 0 H VAL A 101 -3.847 5.236 0.297 1.00 0.00 H new ATOM 0 HA VAL A 101 -4.143 4.542 2.979 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.340 2.369 2.287 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.982 1.954 0.492 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.645 2.996 1.773 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.126 3.708 0.227 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.562 1.980 -0.023 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -2.573 3.736 -0.315 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.456 3.039 0.883 1.00 0.00 H new ATOM 1407 N ILE A 102 -1.059 5.151 2.097 1.00 0.00 N ATOM 1408 CA ILE A 102 0.279 5.390 2.612 1.00 0.00 C ATOM 1409 C ILE A 102 0.204 6.385 3.771 1.00 0.00 C ATOM 1410 O ILE A 102 0.592 6.067 4.894 1.00 0.00 O ATOM 1411 CB ILE A 102 1.216 5.828 1.484 1.00 0.00 C ATOM 1412 CG1 ILE A 102 1.642 4.632 0.630 1.00 0.00 C ATOM 1413 CG2 ILE A 102 2.418 6.596 2.038 1.00 0.00 C ATOM 1414 CD1 ILE A 102 2.768 3.849 1.307 1.00 0.00 C ATOM 0 H ILE A 102 -1.176 5.351 1.104 1.00 0.00 H new ATOM 0 HA ILE A 102 0.705 4.469 3.010 1.00 0.00 H new ATOM 0 HB ILE A 102 0.671 6.511 0.832 1.00 0.00 H new ATOM 0 HG12 ILE A 102 0.787 3.976 0.464 1.00 0.00 H new ATOM 0 HG13 ILE A 102 1.973 4.979 -0.349 1.00 0.00 H new ATOM 0 HG21 ILE A 102 3.068 6.896 1.216 1.00 0.00 H new ATOM 0 HG22 ILE A 102 2.070 7.483 2.568 1.00 0.00 H new ATOM 0 HG23 ILE A 102 2.973 5.957 2.725 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.052 3.004 0.679 1.00 0.00 H new ATOM 0 HD12 ILE A 102 3.630 4.501 1.450 1.00 0.00 H new ATOM 0 HD13 ILE A 102 2.426 3.483 2.275 1.00 0.00 H new ATOM 1425 N ALA A 103 -0.297 7.572 3.459 1.00 0.00 N ATOM 1426 CA ALA A 103 -0.428 8.616 4.462 1.00 0.00 C ATOM 1427 C ALA A 103 -1.234 8.082 5.647 1.00 0.00 C ATOM 1428 O ALA A 103 -0.958 8.423 6.796 1.00 0.00 O ATOM 1429 CB ALA A 103 -1.068 9.852 3.830 1.00 0.00 C ATOM 0 H ALA A 103 -0.617 7.834 2.526 1.00 0.00 H new ATOM 0 HA ALA A 103 0.551 8.912 4.838 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.167 10.635 4.582 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -0.441 10.209 3.014 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -2.054 9.594 3.444 1.00 0.00 H new ATOM 1435 N LEU A 104 -2.216 7.252 5.327 1.00 0.00 N ATOM 1436 CA LEU A 104 -3.064 6.666 6.350 1.00 0.00 C ATOM 1437 C LEU A 104 -2.202 5.864 7.326 1.00 0.00 C ATOM 1438 O LEU A 104 -2.458 5.860 8.529 1.00 0.00 O ATOM 1439 CB LEU A 104 -4.191 5.852 5.712 1.00 0.00 C ATOM 1440 CG LEU A 104 -5.276 6.654 4.992 1.00 0.00 C ATOM 1441 CD1 LEU A 104 -6.382 5.736 4.466 1.00 0.00 C ATOM 1442 CD2 LEU A 104 -5.829 7.760 5.894 1.00 0.00 C ATOM 0 H LEU A 104 -2.443 6.972 4.373 1.00 0.00 H new ATOM 0 HA LEU A 104 -3.556 7.448 6.929 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.750 5.155 4.999 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.666 5.254 6.490 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.824 7.139 4.127 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -7.140 6.333 3.959 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.956 5.018 3.765 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.839 5.202 5.299 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -6.599 8.315 5.358 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.260 7.316 6.791 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.023 8.437 6.175 1.00 0.00 H new ATOM 1453 N ILE A 105 -1.196 5.204 6.770 1.00 0.00 N ATOM 1454 CA ILE A 105 -0.294 4.398 7.576 1.00 0.00 C ATOM 1455 C ILE A 105 0.648 5.321 8.354 1.00 0.00 C ATOM 1456 O ILE A 105 0.909 5.092 9.534 1.00 0.00 O ATOM 1457 CB ILE A 105 0.434 3.374 6.703 1.00 0.00 C ATOM 1458 CG1 ILE A 105 -0.531 2.296 6.204 1.00 0.00 C ATOM 1459 CG2 ILE A 105 1.630 2.772 7.444 1.00 0.00 C ATOM 1460 CD1 ILE A 105 -0.085 1.746 4.848 1.00 0.00 C ATOM 0 H ILE A 105 -0.986 5.211 5.772 1.00 0.00 H new ATOM 0 HA ILE A 105 -0.853 3.818 8.310 1.00 0.00 H new ATOM 0 HB ILE A 105 0.825 3.890 5.826 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -0.583 1.485 6.930 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -1.535 2.712 6.119 1.00 0.00 H new ATOM 0 HG21 ILE A 105 2.129 2.047 6.801 1.00 0.00 H new ATOM 0 HG22 ILE A 105 2.330 3.564 7.710 1.00 0.00 H new ATOM 0 HG23 ILE A 105 1.284 2.275 8.350 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.788 0.982 4.516 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.058 2.555 4.118 1.00 0.00 H new ATOM 0 HD13 ILE A 105 0.909 1.309 4.942 1.00 0.00 H new ATOM 1471 N GLN A 106 1.130 6.342 7.662 1.00 0.00 N ATOM 1472 CA GLN A 106 2.036 7.299 8.274 1.00 0.00 C ATOM 1473 C GLN A 106 1.290 8.155 9.301 1.00 0.00 C ATOM 1474 O GLN A 106 1.894 8.669 10.241 1.00 0.00 O ATOM 1475 CB GLN A 106 2.707 8.175 7.214 1.00 0.00 C ATOM 1476 CG GLN A 106 3.524 7.327 6.239 1.00 0.00 C ATOM 1477 CD GLN A 106 4.908 7.936 6.011 1.00 0.00 C ATOM 1478 OE1 GLN A 106 5.279 8.940 6.598 1.00 0.00 O ATOM 1479 NE2 GLN A 106 5.652 7.276 5.126 1.00 0.00 N ATOM 0 H GLN A 106 0.910 6.528 6.683 1.00 0.00 H new ATOM 0 HA GLN A 106 2.821 6.747 8.791 1.00 0.00 H new ATOM 0 HB2 GLN A 106 1.949 8.735 6.667 1.00 0.00 H new ATOM 0 HB3 GLN A 106 3.356 8.905 7.698 1.00 0.00 H new ATOM 0 HG2 GLN A 106 3.628 6.315 6.630 1.00 0.00 H new ATOM 0 HG3 GLN A 106 2.996 7.249 5.289 1.00 0.00 H new ATOM 0 HE21 GLN A 106 5.282 6.442 4.670 1.00 0.00 H new ATOM 0 HE22 GLN A 106 6.592 7.604 4.904 1.00 0.00 H new ATOM 1486 N ASN A 107 -0.011 8.280 9.085 1.00 0.00 N ATOM 1487 CA ASN A 107 -0.845 9.065 9.981 1.00 0.00 C ATOM 1488 C ASN A 107 -1.880 8.149 10.637 1.00 0.00 C ATOM 1489 O ASN A 107 -2.932 8.611 11.078 1.00 0.00 O ATOM 1490 CB ASN A 107 -1.597 10.156 9.217 1.00 0.00 C ATOM 1491 CG ASN A 107 -0.726 11.404 9.047 1.00 0.00 C ATOM 1492 OD1 ASN A 107 -0.436 12.122 9.989 1.00 0.00 O ATOM 1493 ND2 ASN A 107 -0.329 11.620 7.796 1.00 0.00 N ATOM 0 H ASN A 107 -0.508 7.852 8.304 1.00 0.00 H new ATOM 0 HA ASN A 107 -0.199 9.527 10.727 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -1.896 9.780 8.238 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.511 10.416 9.751 1.00 0.00 H new ATOM 0 HD21 ASN A 107 0.255 12.428 7.578 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -0.608 10.978 7.054 1.00 0.00 H new ATOM 1499 N SER A 108 -1.546 6.868 10.683 1.00 0.00 N ATOM 1500 CA SER A 108 -2.435 5.884 11.280 1.00 0.00 C ATOM 1501 C SER A 108 -2.351 5.961 12.805 1.00 0.00 C ATOM 1502 O SER A 108 -3.024 5.206 13.507 1.00 0.00 O ATOM 1503 CB SER A 108 -2.095 4.472 10.798 1.00 0.00 C ATOM 1504 OG SER A 108 -3.058 3.976 9.873 1.00 0.00 O ATOM 0 H SER A 108 -0.673 6.488 10.317 1.00 0.00 H new ATOM 0 HA SER A 108 -3.455 6.109 10.968 1.00 0.00 H new ATOM 0 HB2 SER A 108 -1.111 4.476 10.329 1.00 0.00 H new ATOM 0 HB3 SER A 108 -2.037 3.801 11.655 1.00 0.00 H new ATOM 0 HG SER A 108 -3.296 4.683 9.238 1.00 0.00 H new ATOM 1509 N ASP A 109 -1.517 6.876 13.276 1.00 0.00 N ATOM 1510 CA ASP A 109 -1.336 7.061 14.705 1.00 0.00 C ATOM 1511 C ASP A 109 -0.328 6.034 15.223 1.00 0.00 C ATOM 1512 O ASP A 109 0.169 5.206 14.460 1.00 0.00 O ATOM 1513 CB ASP A 109 -2.652 6.853 15.459 1.00 0.00 C ATOM 1514 CG ASP A 109 -2.734 7.546 16.819 1.00 0.00 C ATOM 1515 OD1 ASP A 109 -2.396 8.749 16.865 1.00 0.00 O ATOM 1516 OD2 ASP A 109 -3.135 6.859 17.784 1.00 0.00 O ATOM 0 H ASP A 109 -0.958 7.498 12.692 1.00 0.00 H new ATOM 0 HA ASP A 109 -0.982 8.078 14.871 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -3.471 7.211 14.835 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -2.806 5.784 15.603 1.00 0.00 H new ATOM 1520 N THR A 110 -0.053 6.122 16.517 1.00 0.00 N ATOM 1521 CA THR A 110 0.887 5.211 17.146 1.00 0.00 C ATOM 1522 C THR A 110 0.753 3.809 16.549 1.00 0.00 C ATOM 1523 O THR A 110 1.748 3.192 16.173 1.00 0.00 O ATOM 1524 CB THR A 110 0.649 5.254 18.657 1.00 0.00 C ATOM 1525 OG1 THR A 110 1.169 6.519 19.055 1.00 0.00 O ATOM 1526 CG2 THR A 110 1.510 4.242 19.414 1.00 0.00 C ATOM 0 H THR A 110 -0.465 6.811 17.146 1.00 0.00 H new ATOM 0 HA THR A 110 1.917 5.513 16.956 1.00 0.00 H new ATOM 0 HB THR A 110 -0.404 5.061 18.864 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.054 6.631 20.022 1.00 0.00 H new ATOM 0 HG21 THR A 110 1.302 4.314 20.482 1.00 0.00 H new ATOM 0 HG22 THR A 110 1.278 3.235 19.066 1.00 0.00 H new ATOM 0 HG23 THR A 110 2.564 4.454 19.234 1.00 0.00 H new ATOM 1534 N THR A 111 -0.487 3.347 16.480 1.00 0.00 N ATOM 1535 CA THR A 111 -0.765 2.029 15.935 1.00 0.00 C ATOM 1536 C THR A 111 -1.235 2.140 14.483 1.00 0.00 C ATOM 1537 O THR A 111 -1.464 3.241 13.984 1.00 0.00 O ATOM 1538 CB THR A 111 -1.781 1.343 16.851 1.00 0.00 C ATOM 1539 OG1 THR A 111 -2.498 2.423 17.443 1.00 0.00 O ATOM 1540 CG2 THR A 111 -1.119 0.642 18.038 1.00 0.00 C ATOM 0 H THR A 111 -1.310 3.862 16.792 1.00 0.00 H new ATOM 0 HA THR A 111 0.135 1.415 15.906 1.00 0.00 H new ATOM 0 HB THR A 111 -2.357 0.618 16.276 1.00 0.00 H new ATOM 0 HG1 THR A 111 -3.180 2.069 18.051 1.00 0.00 H new ATOM 0 HG21 THR A 111 -1.884 0.172 18.656 1.00 0.00 H new ATOM 0 HG22 THR A 111 -0.429 -0.119 17.673 1.00 0.00 H new ATOM 0 HG23 THR A 111 -0.571 1.373 18.633 1.00 0.00 H new ATOM 1548 N LEU A 112 -1.365 0.986 13.847 1.00 0.00 N ATOM 1549 CA LEU A 112 -1.803 0.940 12.461 1.00 0.00 C ATOM 1550 C LEU A 112 -2.367 -0.449 12.156 1.00 0.00 C ATOM 1551 O LEU A 112 -1.618 -1.421 12.064 1.00 0.00 O ATOM 1552 CB LEU A 112 -0.668 1.364 11.526 1.00 0.00 C ATOM 1553 CG LEU A 112 -0.926 1.169 10.030 1.00 0.00 C ATOM 1554 CD1 LEU A 112 -0.263 -0.114 9.523 1.00 0.00 C ATOM 1555 CD2 LEU A 112 -2.424 1.201 9.723 1.00 0.00 C ATOM 0 H LEU A 112 -1.175 0.075 14.265 1.00 0.00 H new ATOM 0 HA LEU A 112 -2.608 1.655 12.291 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.452 2.417 11.703 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.228 0.805 11.796 1.00 0.00 H new ATOM 0 HG LEU A 112 -0.471 2.001 9.493 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.461 -0.229 8.457 1.00 0.00 H new ATOM 0 HD12 LEU A 112 0.813 -0.057 9.688 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.668 -0.970 10.062 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -2.579 1.060 8.653 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -2.925 0.403 10.271 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -2.837 2.163 10.026 1.00 0.00 H new ATOM 1566 N GLU A 113 -3.683 -0.499 12.006 1.00 0.00 N ATOM 1567 CA GLU A 113 -4.356 -1.753 11.713 1.00 0.00 C ATOM 1568 C GLU A 113 -4.437 -1.970 10.200 1.00 0.00 C ATOM 1569 O GLU A 113 -4.694 -1.032 9.448 1.00 0.00 O ATOM 1570 CB GLU A 113 -5.748 -1.789 12.348 1.00 0.00 C ATOM 1571 CG GLU A 113 -6.391 -3.168 12.177 1.00 0.00 C ATOM 1572 CD GLU A 113 -7.780 -3.206 12.819 1.00 0.00 C ATOM 1573 OE1 GLU A 113 -7.828 -3.319 14.063 1.00 0.00 O ATOM 1574 OE2 GLU A 113 -8.762 -3.124 12.049 1.00 0.00 O ATOM 0 H GLU A 113 -4.301 0.309 12.082 1.00 0.00 H new ATOM 0 HA GLU A 113 -3.774 -2.566 12.147 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -5.675 -1.546 13.408 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -6.381 -1.029 11.890 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -6.469 -3.408 11.117 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -5.755 -3.929 12.630 1.00 0.00 H new ATOM 1579 N LEU A 114 -4.211 -3.213 9.802 1.00 0.00 N ATOM 1580 CA LEU A 114 -4.256 -3.565 8.392 1.00 0.00 C ATOM 1581 C LEU A 114 -5.170 -4.777 8.202 1.00 0.00 C ATOM 1582 O LEU A 114 -5.698 -5.319 9.172 1.00 0.00 O ATOM 1583 CB LEU A 114 -2.841 -3.772 7.846 1.00 0.00 C ATOM 1584 CG LEU A 114 -1.913 -2.557 7.912 1.00 0.00 C ATOM 1585 CD1 LEU A 114 -0.446 -2.988 7.930 1.00 0.00 C ATOM 1586 CD2 LEU A 114 -2.209 -1.579 6.775 1.00 0.00 C ATOM 0 H LEU A 114 -3.997 -3.988 10.429 1.00 0.00 H new ATOM 0 HA LEU A 114 -4.682 -2.748 7.809 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.376 -4.590 8.397 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -2.917 -4.090 6.806 1.00 0.00 H new ATOM 0 HG LEU A 114 -2.105 -2.031 8.847 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.192 -2.105 7.977 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -0.262 -3.616 8.802 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -0.221 -3.550 7.024 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -1.536 -0.725 6.845 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -2.062 -2.079 5.818 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -3.241 -1.235 6.850 1.00 0.00 H new ATOM 1597 N SER A 115 -5.330 -5.168 6.947 1.00 0.00 N ATOM 1598 CA SER A 115 -6.172 -6.304 6.617 1.00 0.00 C ATOM 1599 C SER A 115 -5.694 -6.949 5.313 1.00 0.00 C ATOM 1600 O SER A 115 -5.580 -6.276 4.291 1.00 0.00 O ATOM 1601 CB SER A 115 -7.640 -5.887 6.497 1.00 0.00 C ATOM 1602 OG SER A 115 -7.988 -4.884 7.447 1.00 0.00 O ATOM 0 H SER A 115 -4.890 -4.717 6.145 1.00 0.00 H new ATOM 0 HA SER A 115 -6.095 -7.032 7.425 1.00 0.00 H new ATOM 0 HB2 SER A 115 -7.830 -5.515 5.490 1.00 0.00 H new ATOM 0 HB3 SER A 115 -8.278 -6.759 6.640 1.00 0.00 H new ATOM 0 HG SER A 115 -8.935 -4.973 7.684 1.00 0.00 H new ATOM 1607 N VAL A 116 -5.430 -8.244 5.394 1.00 0.00 N ATOM 1608 CA VAL A 116 -4.969 -8.986 4.233 1.00 0.00 C ATOM 1609 C VAL A 116 -5.928 -10.147 3.961 1.00 0.00 C ATOM 1610 O VAL A 116 -6.899 -10.338 4.690 1.00 0.00 O ATOM 1611 CB VAL A 116 -3.523 -9.443 4.445 1.00 0.00 C ATOM 1612 CG1 VAL A 116 -2.605 -8.248 4.709 1.00 0.00 C ATOM 1613 CG2 VAL A 116 -3.432 -10.467 5.578 1.00 0.00 C ATOM 0 H VAL A 116 -5.526 -8.798 6.245 1.00 0.00 H new ATOM 0 HA VAL A 116 -4.969 -8.350 3.348 1.00 0.00 H new ATOM 0 HB VAL A 116 -3.186 -9.928 3.529 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -1.584 -8.599 4.856 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -2.636 -7.570 3.856 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -2.940 -7.722 5.603 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -2.394 -10.775 5.708 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -3.796 -10.020 6.503 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -4.041 -11.337 5.332 1.00 0.00 H new ATOM 1623 N MET A 117 -5.622 -10.892 2.908 1.00 0.00 N ATOM 1624 CA MET A 117 -6.445 -12.028 2.530 1.00 0.00 C ATOM 1625 C MET A 117 -5.582 -13.261 2.252 1.00 0.00 C ATOM 1626 O MET A 117 -5.080 -13.434 1.142 1.00 0.00 O ATOM 1627 CB MET A 117 -7.255 -11.679 1.280 1.00 0.00 C ATOM 1628 CG MET A 117 -8.071 -10.402 1.495 1.00 0.00 C ATOM 1629 SD MET A 117 -9.776 -10.816 1.821 1.00 0.00 S ATOM 1630 CE MET A 117 -9.600 -11.637 3.396 1.00 0.00 C ATOM 0 H MET A 117 -4.815 -10.731 2.305 1.00 0.00 H new ATOM 0 HA MET A 117 -7.118 -12.257 3.357 1.00 0.00 H new ATOM 0 HB2 MET A 117 -6.583 -11.547 0.432 1.00 0.00 H new ATOM 0 HB3 MET A 117 -7.923 -12.504 1.033 1.00 0.00 H new ATOM 0 HG2 MET A 117 -7.660 -9.834 2.330 1.00 0.00 H new ATOM 0 HG3 MET A 117 -8.005 -9.765 0.613 1.00 0.00 H new ATOM 0 HE1 MET A 117 -10.586 -11.868 3.798 1.00 0.00 H new ATOM 0 HE2 MET A 117 -9.036 -12.561 3.264 1.00 0.00 H new ATOM 0 HE3 MET A 117 -9.070 -10.984 4.089 1.00 0.00 H new ATOM 1638 N PRO A 118 -5.432 -14.107 3.305 1.00 0.00 N ATOM 1639 CA PRO A 118 -4.640 -15.319 3.186 1.00 0.00 C ATOM 1640 C PRO A 118 -5.389 -16.388 2.388 1.00 0.00 C ATOM 1641 O PRO A 118 -6.505 -16.155 1.928 1.00 0.00 O ATOM 1642 CB PRO A 118 -4.347 -15.741 4.616 1.00 0.00 C ATOM 1643 CG PRO A 118 -5.368 -15.020 5.480 1.00 0.00 C ATOM 1644 CD PRO A 118 -6.013 -13.935 4.634 1.00 0.00 C ATOM 0 HA PRO A 118 -3.713 -15.163 2.634 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -4.433 -16.822 4.730 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -3.331 -15.470 4.903 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -6.121 -15.719 5.844 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.887 -14.585 6.356 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -7.097 -14.044 4.609 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -5.801 -12.943 5.033 1.00 0.00 H new ATOM 1649 N LYS A 119 -4.746 -17.537 2.249 1.00 0.00 N ATOM 1650 CA LYS A 119 -5.337 -18.643 1.516 1.00 0.00 C ATOM 1651 C LYS A 119 -4.816 -19.964 2.086 1.00 0.00 C ATOM 1652 O LYS A 119 -5.538 -20.668 2.791 1.00 0.00 O ATOM 1653 CB LYS A 119 -5.093 -18.482 0.015 1.00 0.00 C ATOM 1654 CG LYS A 119 -5.240 -19.821 -0.711 1.00 0.00 C ATOM 1655 CD LYS A 119 -4.999 -19.660 -2.214 1.00 0.00 C ATOM 1656 CE LYS A 119 -4.945 -21.021 -2.910 1.00 0.00 C ATOM 1657 NZ LYS A 119 -4.205 -20.921 -4.188 1.00 0.00 N ATOM 0 H LYS A 119 -3.820 -17.726 2.632 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.420 -18.647 1.641 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -5.800 -17.761 -0.397 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -4.094 -18.081 -0.154 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -4.532 -20.541 -0.301 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -6.238 -20.223 -0.540 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.794 -19.056 -2.651 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.064 -19.125 -2.381 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.462 -21.750 -2.259 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -5.957 -21.381 -3.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -4.178 -21.854 -4.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -4.682 -20.241 -4.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -3.234 -20.598 -4.003 1.00 0.00 H new ATOM 1667 N ASP A 120 -3.567 -20.261 1.760 1.00 0.00 N ATOM 1668 CA ASP A 120 -2.942 -21.485 2.231 1.00 0.00 C ATOM 1669 C ASP A 120 -1.568 -21.157 2.819 1.00 0.00 C ATOM 1670 O ASP A 120 -0.597 -20.988 2.082 1.00 0.00 O ATOM 1671 CB ASP A 120 -2.739 -22.477 1.083 1.00 0.00 C ATOM 1672 CG ASP A 120 -1.866 -23.687 1.420 1.00 0.00 C ATOM 1673 OD1 ASP A 120 -2.408 -24.622 2.047 1.00 0.00 O ATOM 1674 OD2 ASP A 120 -0.674 -23.649 1.042 1.00 0.00 O ATOM 0 H ASP A 120 -2.971 -19.675 1.175 1.00 0.00 H new ATOM 0 HA ASP A 120 -3.595 -21.930 2.982 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -3.715 -22.833 0.754 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -2.292 -21.949 0.241 1.00 0.00 H new ATOM 1678 N SER A 121 -1.529 -21.076 4.140 1.00 0.00 N ATOM 1679 CA SER A 121 -0.291 -20.772 4.837 1.00 0.00 C ATOM 1680 C SER A 121 -0.185 -21.615 6.109 1.00 0.00 C ATOM 1681 O SER A 121 -1.196 -22.054 6.654 1.00 0.00 O ATOM 1682 CB SER A 121 -0.203 -19.283 5.179 1.00 0.00 C ATOM 1683 OG SER A 121 0.697 -18.590 4.317 1.00 0.00 O ATOM 0 H SER A 121 -2.336 -21.216 4.748 1.00 0.00 H new ATOM 0 HA SER A 121 0.541 -21.016 4.177 1.00 0.00 H new ATOM 0 HB2 SER A 121 -1.194 -18.835 5.105 1.00 0.00 H new ATOM 0 HB3 SER A 121 0.123 -19.167 6.213 1.00 0.00 H new ATOM 0 HG SER A 121 0.724 -17.643 4.566 1.00 0.00 H new ATOM 1688 N GLY A 122 1.050 -21.816 6.546 1.00 0.00 N ATOM 1689 CA GLY A 122 1.302 -22.599 7.744 1.00 0.00 C ATOM 1690 C GLY A 122 2.438 -21.990 8.568 1.00 0.00 C ATOM 1691 O GLY A 122 3.583 -21.950 8.121 1.00 0.00 O ATOM 0 H GLY A 122 1.887 -21.450 6.092 1.00 0.00 H new ATOM 0 HA2 GLY A 122 0.396 -22.648 8.348 1.00 0.00 H new ATOM 0 HA3 GLY A 122 1.557 -23.622 7.467 1.00 0.00 H new ATOM 1695 N PRO A 123 2.072 -21.517 9.790 1.00 0.00 N ATOM 1696 CA PRO A 123 3.046 -20.911 10.681 1.00 0.00 C ATOM 1697 C PRO A 123 3.938 -21.975 11.322 1.00 0.00 C ATOM 1698 O PRO A 123 3.521 -23.119 11.492 1.00 0.00 O ATOM 1699 CB PRO A 123 2.223 -20.136 11.696 1.00 0.00 C ATOM 1700 CG PRO A 123 0.817 -20.710 11.619 1.00 0.00 C ATOM 1701 CD PRO A 123 0.725 -21.547 10.353 1.00 0.00 C ATOM 0 HA PRO A 123 3.737 -20.248 10.160 1.00 0.00 H new ATOM 0 HB2 PRO A 123 2.635 -20.246 12.699 1.00 0.00 H new ATOM 0 HB3 PRO A 123 2.223 -19.070 11.467 1.00 0.00 H new ATOM 0 HG2 PRO A 123 0.605 -21.321 12.497 1.00 0.00 H new ATOM 0 HG3 PRO A 123 0.078 -19.909 11.602 1.00 0.00 H new ATOM 0 HD2 PRO A 123 0.411 -22.567 10.575 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -0.004 -21.133 9.657 1.00 0.00 H new ATOM 1706 N SER A 124 5.151 -21.560 11.661 1.00 0.00 N ATOM 1707 CA SER A 124 6.105 -22.463 12.279 1.00 0.00 C ATOM 1708 C SER A 124 7.399 -21.714 12.606 1.00 0.00 C ATOM 1709 O SER A 124 7.831 -21.687 13.757 1.00 0.00 O ATOM 1710 CB SER A 124 6.399 -23.660 11.372 1.00 0.00 C ATOM 1711 OG SER A 124 6.959 -24.752 12.094 1.00 0.00 O ATOM 0 H SER A 124 5.494 -20.610 11.519 1.00 0.00 H new ATOM 0 HA SER A 124 5.668 -22.841 13.203 1.00 0.00 H new ATOM 0 HB2 SER A 124 5.478 -23.981 10.886 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.087 -23.356 10.583 1.00 0.00 H new ATOM 0 HG SER A 124 7.131 -25.496 11.480 1.00 0.00 H new ATOM 1716 N SER A 125 7.981 -21.124 11.572 1.00 0.00 N ATOM 1717 CA SER A 125 9.215 -20.377 11.734 1.00 0.00 C ATOM 1718 C SER A 125 10.293 -21.273 12.348 1.00 0.00 C ATOM 1719 O SER A 125 10.259 -21.559 13.544 1.00 0.00 O ATOM 1720 CB SER A 125 8.999 -19.136 12.602 1.00 0.00 C ATOM 1721 OG SER A 125 9.276 -17.932 11.893 1.00 0.00 O ATOM 0 H SER A 125 7.620 -21.149 10.618 1.00 0.00 H new ATOM 0 HA SER A 125 9.545 -20.045 10.749 1.00 0.00 H new ATOM 0 HB2 SER A 125 7.969 -19.118 12.958 1.00 0.00 H new ATOM 0 HB3 SER A 125 9.639 -19.194 13.482 1.00 0.00 H new ATOM 0 HG SER A 125 9.124 -17.163 12.482 1.00 0.00 H new ATOM 1726 N GLY A 126 11.223 -21.691 11.502 1.00 0.00 N ATOM 1727 CA GLY A 126 12.308 -22.549 11.947 1.00 0.00 C ATOM 1728 C GLY A 126 13.208 -22.946 10.774 1.00 0.00 C ATOM 1729 O GLY A 126 12.723 -23.419 9.747 1.00 0.00 O ATOM 0 H GLY A 126 11.248 -21.452 10.511 1.00 0.00 H new ATOM 0 HA2 GLY A 126 12.898 -22.033 12.704 1.00 0.00 H new ATOM 0 HA3 GLY A 126 11.900 -23.444 12.416 1.00 0.00 H new TER 1733 GLY A 126