USER MOD reduce.3.24.130724 H: found=0, std=0, add=971, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 0 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 76 SER OG : rot -160:sc= 0.499 USER MOD Set 1.2: A 78 THR OG1 : rot 90:sc= 0.62 USER MOD Set 2.1: A 66 THR OG1 : rot -170:sc= -0.277 USER MOD Set 2.2: A 67 MET CE :methyl -167:sc= -0.0165 (180deg=-0.522) USER MOD Set 3.1: A 51 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 129 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-0.069) USER MOD Single : A 6 GLN : amide:sc= -0.0336 X(o=-0.034,f=-0.16) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.0838 K(o=-0.084,f=-1.2) USER MOD Single : A 15 ASN : amide:sc= -3.74! C(o=-3.7!,f=-3!) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= -0.103 X(o=-0.1,f=-0.39) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -1.02 K(o=-1,f=-4.1!) USER MOD Single : A 29 HIS : no HD1:sc= -0.113 X(o=-0.11,f=-0.18) USER MOD Single : A 32 ASN : amide:sc= -0.477 K(o=-0.48,f=-5.8!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ -164:sc= -0.0854 (180deg=-0.451) USER MOD Single : A 40 GLN : amide:sc= -0.69 K(o=-0.69,f=-0.14) USER MOD Single : A 41 HIS : no HD1:sc= -1.59 K(o=-1.6,f=-0.52) USER MOD Single : A 46 LYS NZ :NH3+ 159:sc= 0.0112 (180deg=0) USER MOD Single : A 47 SER OG : rot -66:sc= -0.363! USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 11:sc= 0.972! USER MOD Single : A 54 ASN : amide:sc= -1.82! C(o=-1.8!,f=-2.4!) USER MOD Single : A 56 HIS : no HE2:sc= -0.577 K(o=-0.58,f=-1.9) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 154:sc= -0.0207 (180deg=-0.263) USER MOD Single : A 63 SER OG : rot 180:sc= 0.0022 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -8.08! C(o=-8.1!,f=-8!) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 GLN : amide:sc= -0.652 K(o=-0.65,f=-2.4!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot -118:sc= 1.15 USER MOD Single : A 85 HIS : no HE2:sc= -29.1! C(o=-29!,f=-34!) USER MOD Single : A 87 HIS : no HD1:sc= -3.91! K(o=-3.9!,f=-2.1) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= -0.808 K(o=-0.81,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 HIS : no HE2:sc= -10.5! C(o=-10!,f=-16!) USER MOD Single : A 100 ASN : amide:sc= -0.129 K(o=-0.13,f=-4.8!) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -10.2! C(o=-10!,f=-12!) USER MOD Single : A 107 ASN : amide:sc= -0.64 K(o=-0.64,f=0) USER MOD Single : A 114 TYR OH : rot -130:sc= -1.6! USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= -8.37! C(o=-8.4!,f=-3.2!) USER MOD Single : A 127 MET CE :methyl 170:sc= 0 (180deg=-0.0965) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 FUC O2 : rot 36:sc= 0.00868 USER MOD Single : A 136 FUC O3 : rot -91:sc= 0.0161 USER MOD Single : A 136 FUC O4 : rot -88:sc= 0.0307 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 6 38.486 -12.953 -2.637 1.00 1.00 N ATOM 2 CA GLN A 6 38.564 -11.624 -1.968 1.00 1.00 C ATOM 3 C GLN A 6 38.318 -10.520 -2.998 1.00 1.00 C ATOM 4 O GLN A 6 38.028 -10.784 -4.148 1.00 1.00 O ATOM 5 CB GLN A 6 39.951 -11.445 -1.348 1.00 1.00 C ATOM 6 CG GLN A 6 39.904 -11.837 0.130 1.00 1.00 C ATOM 7 CD GLN A 6 40.485 -13.241 0.305 1.00 1.00 C ATOM 8 OE1 GLN A 6 41.600 -13.505 -0.098 1.00 1.00 O ATOM 9 NE2 GLN A 6 39.770 -14.161 0.893 1.00 1.00 N ATOM 0 HA GLN A 6 37.807 -11.566 -1.186 1.00 1.00 H new ATOM 0 HB2 GLN A 6 40.679 -12.061 -1.876 1.00 1.00 H new ATOM 0 HB3 GLN A 6 40.276 -10.410 -1.450 1.00 1.00 H new ATOM 0 HG2 GLN A 6 40.471 -11.121 0.725 1.00 1.00 H new ATOM 0 HG3 GLN A 6 38.876 -11.810 0.492 1.00 1.00 H new ATOM 0 HE21 GLN A 6 38.834 -13.940 1.232 1.00 1.00 H new ATOM 0 HE22 GLN A 6 40.148 -15.101 1.014 1.00 1.00 H new ATOM 10 N VAL A 7 38.431 -9.284 -2.595 1.00 1.00 N ATOM 11 CA VAL A 7 38.203 -8.165 -3.553 1.00 1.00 C ATOM 12 C VAL A 7 39.237 -7.062 -3.308 1.00 1.00 C ATOM 13 O VAL A 7 38.890 -5.969 -2.909 1.00 1.00 O ATOM 14 CB VAL A 7 36.797 -7.600 -3.348 1.00 1.00 C ATOM 15 CG1 VAL A 7 36.684 -7.012 -1.940 1.00 1.00 C ATOM 16 CG2 VAL A 7 36.535 -6.501 -4.380 1.00 1.00 C ATOM 0 H VAL A 7 38.671 -9.001 -1.645 1.00 1.00 H new ATOM 0 HA VAL A 7 38.303 -8.534 -4.574 1.00 1.00 H new ATOM 0 HB VAL A 7 36.064 -8.397 -3.470 1.00 1.00 H new ATOM 0 HG11 VAL A 7 35.682 -6.609 -1.793 1.00 1.00 H new ATOM 0 HG12 VAL A 7 36.873 -7.793 -1.203 1.00 1.00 H new ATOM 0 HG13 VAL A 7 37.417 -6.214 -1.819 1.00 1.00 H new ATOM 0 HG21 VAL A 7 35.533 -6.097 -4.235 1.00 1.00 H new ATOM 0 HG22 VAL A 7 37.269 -5.704 -4.257 1.00 1.00 H new ATOM 0 HG23 VAL A 7 36.617 -6.918 -5.384 1.00 1.00 H new ATOM 17 N PRO A 8 40.482 -7.386 -3.556 1.00 1.00 N ATOM 18 CA PRO A 8 41.577 -6.443 -3.370 1.00 1.00 C ATOM 19 C PRO A 8 41.264 -5.120 -4.076 1.00 1.00 C ATOM 20 O PRO A 8 41.652 -4.903 -5.207 1.00 1.00 O ATOM 21 CB PRO A 8 42.780 -7.126 -4.013 1.00 1.00 C ATOM 22 CG PRO A 8 42.425 -8.644 -3.932 1.00 1.00 C ATOM 23 CD PRO A 8 40.875 -8.719 -4.038 1.00 1.00 C ATOM 0 HA PRO A 8 41.751 -6.203 -2.321 1.00 1.00 H new ATOM 0 HB2 PRO A 8 42.922 -6.802 -5.044 1.00 1.00 H new ATOM 0 HB3 PRO A 8 43.703 -6.901 -3.478 1.00 1.00 H new ATOM 0 HG2 PRO A 8 42.900 -9.201 -4.739 1.00 1.00 H new ATOM 0 HG3 PRO A 8 42.775 -9.079 -2.996 1.00 1.00 H new ATOM 0 HD2 PRO A 8 40.542 -8.900 -5.060 1.00 1.00 H new ATOM 0 HD3 PRO A 8 40.460 -9.517 -3.422 1.00 1.00 H new ATOM 24 N SER A 9 40.567 -4.235 -3.417 1.00 1.00 N ATOM 25 CA SER A 9 40.232 -2.929 -4.051 1.00 1.00 C ATOM 26 C SER A 9 39.395 -3.171 -5.309 1.00 1.00 C ATOM 27 O SER A 9 39.850 -3.772 -6.263 1.00 1.00 O ATOM 28 CB SER A 9 41.521 -2.199 -4.429 1.00 1.00 C ATOM 29 OG SER A 9 41.505 -0.895 -3.863 1.00 1.00 O ATOM 0 H SER A 9 40.215 -4.360 -2.468 1.00 1.00 H new ATOM 0 HA SER A 9 39.663 -2.321 -3.348 1.00 1.00 H new ATOM 0 HB2 SER A 9 42.387 -2.754 -4.068 1.00 1.00 H new ATOM 0 HB3 SER A 9 41.613 -2.136 -5.513 1.00 1.00 H new ATOM 0 HG SER A 9 42.331 -0.425 -4.102 1.00 1.00 H new ATOM 30 N ASN A 10 38.175 -2.709 -5.319 1.00 1.00 N ATOM 31 CA ASN A 10 37.309 -2.913 -6.514 1.00 1.00 C ATOM 32 C ASN A 10 35.968 -2.210 -6.292 1.00 1.00 C ATOM 33 O ASN A 10 35.214 -2.558 -5.405 1.00 1.00 O ATOM 34 CB ASN A 10 37.074 -4.410 -6.722 1.00 1.00 C ATOM 35 CG ASN A 10 36.505 -4.649 -8.122 1.00 1.00 C ATOM 36 OD1 ASN A 10 35.407 -4.227 -8.424 1.00 1.00 O ATOM 37 ND2 ASN A 10 37.212 -5.313 -8.995 1.00 1.00 N ATOM 0 H ASN A 10 37.740 -2.199 -4.550 1.00 1.00 H new ATOM 0 HA ASN A 10 37.797 -2.497 -7.396 1.00 1.00 H new ATOM 0 HB2 ASN A 10 38.010 -4.956 -6.600 1.00 1.00 H new ATOM 0 HB3 ASN A 10 36.384 -4.789 -5.968 1.00 1.00 H new ATOM 0 HD21 ASN A 10 36.842 -5.478 -9.931 1.00 1.00 H new ATOM 0 HD22 ASN A 10 38.134 -5.667 -8.741 1.00 1.00 H new ATOM 38 N CYS A 11 35.665 -1.221 -7.089 1.00 1.00 N ATOM 39 CA CYS A 11 34.374 -0.498 -6.916 1.00 1.00 C ATOM 40 C CYS A 11 34.041 0.270 -8.198 1.00 1.00 C ATOM 41 O CYS A 11 34.883 0.468 -9.052 1.00 1.00 O ATOM 42 CB CYS A 11 34.497 0.482 -5.749 1.00 1.00 C ATOM 43 SG CYS A 11 35.861 -0.031 -4.676 1.00 1.00 S ATOM 0 H CYS A 11 36.254 -0.884 -7.850 1.00 1.00 H new ATOM 0 HA CYS A 11 33.579 -1.214 -6.709 1.00 1.00 H new ATOM 0 HB2 CYS A 11 34.673 1.490 -6.123 1.00 1.00 H new ATOM 0 HB3 CYS A 11 33.566 0.510 -5.184 1.00 1.00 H new ATOM 44 N ASP A 12 32.818 0.704 -8.340 1.00 1.00 N ATOM 45 CA ASP A 12 32.431 1.456 -9.568 1.00 1.00 C ATOM 46 C ASP A 12 32.038 2.887 -9.193 1.00 1.00 C ATOM 47 O ASP A 12 31.062 3.114 -8.506 1.00 1.00 O ATOM 48 CB ASP A 12 31.244 0.762 -10.239 1.00 1.00 C ATOM 49 CG ASP A 12 31.384 -0.753 -10.086 1.00 1.00 C ATOM 50 OD1 ASP A 12 32.417 -1.275 -10.472 1.00 1.00 O ATOM 51 OD2 ASP A 12 30.457 -1.367 -9.584 1.00 1.00 O ATOM 0 H ASP A 12 32.070 0.570 -7.659 1.00 1.00 H new ATOM 0 HA ASP A 12 33.276 1.481 -10.256 1.00 1.00 H new ATOM 0 HB2 ASP A 12 30.310 1.099 -9.788 1.00 1.00 H new ATOM 0 HB3 ASP A 12 31.203 1.029 -11.295 1.00 1.00 H new ATOM 52 N CYS A 13 32.790 3.854 -9.644 1.00 1.00 N ATOM 53 CA CYS A 13 32.463 5.272 -9.320 1.00 1.00 C ATOM 54 C CYS A 13 33.685 6.149 -9.598 1.00 1.00 C ATOM 55 O CYS A 13 34.811 5.720 -9.444 1.00 1.00 O ATOM 56 CB CYS A 13 32.078 5.384 -7.843 1.00 1.00 C ATOM 57 SG CYS A 13 32.839 4.031 -6.913 1.00 1.00 S ATOM 0 H CYS A 13 33.619 3.723 -10.224 1.00 1.00 H new ATOM 0 HA CYS A 13 31.628 5.604 -9.937 1.00 1.00 H new ATOM 0 HB2 CYS A 13 32.406 6.343 -7.443 1.00 1.00 H new ATOM 0 HB3 CYS A 13 30.994 5.348 -7.736 1.00 1.00 H new ATOM 58 N LEU A 14 33.481 7.373 -10.009 1.00 1.00 N ATOM 59 CA LEU A 14 34.649 8.255 -10.293 1.00 1.00 C ATOM 60 C LEU A 14 35.171 8.851 -8.987 1.00 1.00 C ATOM 61 O LEU A 14 34.718 8.514 -7.911 1.00 1.00 O ATOM 62 CB LEU A 14 34.236 9.396 -11.236 1.00 1.00 C ATOM 63 CG LEU A 14 34.260 8.933 -12.701 1.00 1.00 C ATOM 64 CD1 LEU A 14 34.365 10.155 -13.615 1.00 1.00 C ATOM 65 CD2 LEU A 14 35.467 8.028 -12.954 1.00 1.00 C ATOM 0 H LEU A 14 32.565 7.796 -10.159 1.00 1.00 H new ATOM 0 HA LEU A 14 35.430 7.660 -10.768 1.00 1.00 H new ATOM 0 HB2 LEU A 14 33.236 9.743 -10.977 1.00 1.00 H new ATOM 0 HB3 LEU A 14 34.911 10.242 -11.107 1.00 1.00 H new ATOM 0 HG LEU A 14 33.344 8.380 -12.908 1.00 1.00 H new ATOM 0 HD11 LEU A 14 34.382 9.831 -14.655 1.00 1.00 H new ATOM 0 HD12 LEU A 14 33.506 10.806 -13.452 1.00 1.00 H new ATOM 0 HD13 LEU A 14 35.282 10.700 -13.390 1.00 1.00 H new ATOM 0 HD21 LEU A 14 35.470 7.708 -13.996 1.00 1.00 H new ATOM 0 HD22 LEU A 14 36.384 8.577 -12.740 1.00 1.00 H new ATOM 0 HD23 LEU A 14 35.408 7.153 -12.306 1.00 1.00 H new ATOM 66 N ASN A 15 36.126 9.735 -9.080 1.00 1.00 N ATOM 67 CA ASN A 15 36.692 10.359 -7.854 1.00 1.00 C ATOM 68 C ASN A 15 36.893 9.287 -6.781 1.00 1.00 C ATOM 69 O ASN A 15 36.856 9.563 -5.599 1.00 1.00 O ATOM 70 CB ASN A 15 35.732 11.432 -7.335 1.00 1.00 C ATOM 71 CG ASN A 15 35.331 12.357 -8.485 1.00 1.00 C ATOM 72 OD1 ASN A 15 34.171 12.684 -8.640 1.00 1.00 O ATOM 73 ND2 ASN A 15 36.247 12.794 -9.305 1.00 1.00 N ATOM 0 H ASN A 15 36.539 10.052 -9.957 1.00 1.00 H new ATOM 0 HA ASN A 15 37.652 10.818 -8.091 1.00 1.00 H new ATOM 0 HB2 ASN A 15 34.846 10.965 -6.904 1.00 1.00 H new ATOM 0 HB3 ASN A 15 36.208 12.007 -6.541 1.00 1.00 H new ATOM 0 HD21 ASN A 15 35.989 13.410 -10.076 1.00 1.00 H new ATOM 0 HD22 ASN A 15 37.221 12.520 -9.175 1.00 1.00 H new ATOM 74 N GLY A 16 37.105 8.065 -7.187 1.00 1.00 N ATOM 75 CA GLY A 16 37.310 6.974 -6.193 1.00 1.00 C ATOM 76 C GLY A 16 36.079 6.865 -5.291 1.00 1.00 C ATOM 77 O GLY A 16 36.165 7.016 -4.088 1.00 1.00 O ATOM 0 H GLY A 16 37.145 7.775 -8.164 1.00 1.00 H new ATOM 0 HA2 GLY A 16 37.482 6.028 -6.706 1.00 1.00 H new ATOM 0 HA3 GLY A 16 38.197 7.177 -5.593 1.00 1.00 H new ATOM 78 N GLY A 17 34.934 6.602 -5.860 1.00 1.00 N ATOM 79 CA GLY A 17 33.702 6.482 -5.030 1.00 1.00 C ATOM 80 C GLY A 17 33.982 5.574 -3.832 1.00 1.00 C ATOM 81 O GLY A 17 35.047 5.002 -3.711 1.00 1.00 O ATOM 0 H GLY A 17 34.799 6.465 -6.862 1.00 1.00 H new ATOM 0 HA2 GLY A 17 33.384 7.467 -4.687 1.00 1.00 H new ATOM 0 HA3 GLY A 17 32.887 6.074 -5.627 1.00 1.00 H new ATOM 82 N THR A 18 33.036 5.436 -2.944 1.00 1.00 N ATOM 83 CA THR A 18 33.252 4.565 -1.756 1.00 1.00 C ATOM 84 C THR A 18 33.078 3.100 -2.159 1.00 1.00 C ATOM 85 O THR A 18 32.437 2.788 -3.143 1.00 1.00 O ATOM 86 CB THR A 18 32.236 4.915 -0.672 1.00 1.00 C ATOM 87 OG1 THR A 18 32.373 6.270 -0.290 1.00 1.00 O ATOM 88 CG2 THR A 18 32.475 3.995 0.524 1.00 1.00 C ATOM 0 H THR A 18 32.123 5.889 -2.990 1.00 1.00 H new ATOM 0 HA THR A 18 34.260 4.722 -1.373 1.00 1.00 H new ATOM 0 HB THR A 18 31.223 4.776 -1.050 1.00 1.00 H new ATOM 0 HG21 THR A 18 31.759 4.229 1.312 1.00 1.00 H new ATOM 0 HG22 THR A 18 32.350 2.957 0.215 1.00 1.00 H new ATOM 0 HG23 THR A 18 33.488 4.142 0.900 1.00 1.00 H new ATOM 89 N CYS A 19 33.642 2.198 -1.404 1.00 1.00 N ATOM 90 CA CYS A 19 33.510 0.754 -1.739 1.00 1.00 C ATOM 91 C CYS A 19 32.695 0.056 -0.648 1.00 1.00 C ATOM 92 O CYS A 19 33.136 -0.079 0.476 1.00 1.00 O ATOM 93 CB CYS A 19 34.901 0.125 -1.815 1.00 1.00 C ATOM 94 SG CYS A 19 34.959 -1.054 -3.186 1.00 1.00 S ATOM 0 H CYS A 19 34.190 2.400 -0.568 1.00 1.00 H new ATOM 0 HA CYS A 19 33.006 0.643 -2.699 1.00 1.00 H new ATOM 0 HB2 CYS A 19 35.654 0.900 -1.956 1.00 1.00 H new ATOM 0 HB3 CYS A 19 35.135 -0.380 -0.878 1.00 1.00 H new ATOM 95 N VAL A 20 31.509 -0.386 -0.964 1.00 1.00 N ATOM 96 CA VAL A 20 30.674 -1.071 0.064 1.00 1.00 C ATOM 97 C VAL A 20 30.268 -2.456 -0.442 1.00 1.00 C ATOM 98 O VAL A 20 30.669 -2.882 -1.507 1.00 1.00 O ATOM 99 CB VAL A 20 29.419 -0.240 0.341 1.00 1.00 C ATOM 100 CG1 VAL A 20 29.803 1.030 1.102 1.00 1.00 C ATOM 101 CG2 VAL A 20 28.756 0.142 -0.985 1.00 1.00 C ATOM 0 H VAL A 20 31.082 -0.303 -1.887 1.00 1.00 H new ATOM 0 HA VAL A 20 31.250 -1.177 0.983 1.00 1.00 H new ATOM 0 HB VAL A 20 28.723 -0.826 0.941 1.00 1.00 H new ATOM 0 HG11 VAL A 20 28.908 1.621 1.299 1.00 1.00 H new ATOM 0 HG12 VAL A 20 30.274 0.760 2.047 1.00 1.00 H new ATOM 0 HG13 VAL A 20 30.501 1.616 0.503 1.00 1.00 H new ATOM 0 HG21 VAL A 20 27.862 0.734 -0.788 1.00 1.00 H new ATOM 0 HG22 VAL A 20 29.453 0.727 -1.585 1.00 1.00 H new ATOM 0 HG23 VAL A 20 28.480 -0.762 -1.528 1.00 1.00 H new ATOM 102 N SER A 21 29.473 -3.162 0.315 1.00 1.00 N ATOM 103 CA SER A 21 29.040 -4.520 -0.118 1.00 1.00 C ATOM 104 C SER A 21 28.040 -5.079 0.896 1.00 1.00 C ATOM 105 O SER A 21 28.003 -4.667 2.038 1.00 1.00 O ATOM 106 CB SER A 21 30.257 -5.442 -0.198 1.00 1.00 C ATOM 107 OG SER A 21 30.411 -6.124 1.039 1.00 1.00 O ATOM 0 H SER A 21 29.105 -2.856 1.216 1.00 1.00 H new ATOM 0 HA SER A 21 28.569 -4.458 -1.099 1.00 1.00 H new ATOM 0 HB2 SER A 21 30.131 -6.159 -1.009 1.00 1.00 H new ATOM 0 HB3 SER A 21 31.153 -4.862 -0.421 1.00 1.00 H new ATOM 0 HG SER A 21 31.190 -6.717 0.991 1.00 1.00 H new ATOM 108 N ASN A 22 27.227 -6.015 0.488 1.00 1.00 N ATOM 109 CA ASN A 22 26.230 -6.598 1.430 1.00 1.00 C ATOM 110 C ASN A 22 26.892 -7.703 2.256 1.00 1.00 C ATOM 111 O ASN A 22 27.971 -8.164 1.943 1.00 1.00 O ATOM 112 CB ASN A 22 25.063 -7.187 0.636 1.00 1.00 C ATOM 113 CG ASN A 22 23.750 -6.891 1.363 1.00 1.00 C ATOM 114 OD1 ASN A 22 23.484 -5.763 1.729 1.00 1.00 O ATOM 115 ND2 ASN A 22 22.911 -7.864 1.590 1.00 1.00 N ATOM 0 H ASN A 22 27.210 -6.401 -0.456 1.00 1.00 H new ATOM 0 HA ASN A 22 25.861 -5.818 2.096 1.00 1.00 H new ATOM 0 HB2 ASN A 22 25.040 -6.761 -0.367 1.00 1.00 H new ATOM 0 HB3 ASN A 22 25.193 -8.263 0.522 1.00 1.00 H new ATOM 0 HD21 ASN A 22 22.033 -7.678 2.074 1.00 1.00 H new ATOM 0 HD22 ASN A 22 23.133 -8.811 1.283 1.00 1.00 H new ATOM 116 N LYS A 23 26.254 -8.129 3.311 1.00 1.00 N ATOM 117 CA LYS A 23 26.849 -9.203 4.158 1.00 1.00 C ATOM 118 C LYS A 23 25.842 -10.343 4.337 1.00 1.00 C ATOM 119 O LYS A 23 26.172 -11.401 4.833 1.00 1.00 O ATOM 120 CB LYS A 23 27.214 -8.628 5.528 1.00 1.00 C ATOM 121 CG LYS A 23 28.419 -9.382 6.092 1.00 1.00 C ATOM 122 CD LYS A 23 29.684 -8.543 5.899 1.00 1.00 C ATOM 123 CE LYS A 23 30.639 -9.267 4.948 1.00 1.00 C ATOM 124 NZ LYS A 23 30.996 -8.364 3.818 1.00 1.00 N ATOM 0 H LYS A 23 25.348 -7.781 3.624 1.00 1.00 H new ATOM 0 HA LYS A 23 27.745 -9.588 3.671 1.00 1.00 H new ATOM 0 HB2 LYS A 23 27.445 -7.566 5.439 1.00 1.00 H new ATOM 0 HB3 LYS A 23 26.367 -8.714 6.208 1.00 1.00 H new ATOM 0 HG2 LYS A 23 28.267 -9.591 7.151 1.00 1.00 H new ATOM 0 HG3 LYS A 23 28.527 -10.343 5.589 1.00 1.00 H new ATOM 0 HD2 LYS A 23 29.425 -7.564 5.495 1.00 1.00 H new ATOM 0 HD3 LYS A 23 30.170 -8.373 6.860 1.00 1.00 H new ATOM 0 HE2 LYS A 23 31.539 -9.572 5.482 1.00 1.00 H new ATOM 0 HE3 LYS A 23 30.171 -10.175 4.568 1.00 1.00 H new ATOM 0 HZ1 LYS A 23 31.645 -8.857 3.172 1.00 1.00 H new ATOM 0 HZ2 LYS A 23 30.133 -8.094 3.303 1.00 1.00 H new ATOM 0 HZ3 LYS A 23 31.459 -7.510 4.189 1.00 1.00 H new ATOM 125 N TYR A 24 24.617 -10.140 3.935 1.00 1.00 N ATOM 126 CA TYR A 24 23.598 -11.216 4.082 1.00 1.00 C ATOM 127 C TYR A 24 23.305 -11.818 2.708 1.00 1.00 C ATOM 128 O TYR A 24 22.168 -12.058 2.351 1.00 1.00 O ATOM 129 CB TYR A 24 22.311 -10.629 4.668 1.00 1.00 C ATOM 130 CG TYR A 24 22.658 -9.592 5.709 1.00 1.00 C ATOM 131 CD1 TYR A 24 23.099 -9.993 6.977 1.00 1.00 C ATOM 132 CD2 TYR A 24 22.537 -8.229 5.408 1.00 1.00 C ATOM 133 CE1 TYR A 24 23.420 -9.030 7.944 1.00 1.00 C ATOM 134 CE2 TYR A 24 22.858 -7.266 6.374 1.00 1.00 C ATOM 135 CZ TYR A 24 23.299 -7.667 7.642 1.00 1.00 C ATOM 136 OH TYR A 24 23.614 -6.720 8.595 1.00 1.00 O ATOM 0 H TYR A 24 24.279 -9.276 3.512 1.00 1.00 H new ATOM 0 HA TYR A 24 23.976 -11.990 4.750 1.00 1.00 H new ATOM 0 HB2 TYR A 24 21.711 -10.179 3.877 1.00 1.00 H new ATOM 0 HB3 TYR A 24 21.708 -11.420 5.114 1.00 1.00 H new ATOM 0 HD1 TYR A 24 23.192 -11.044 7.209 1.00 1.00 H new ATOM 0 HD2 TYR A 24 22.196 -7.920 4.431 1.00 1.00 H new ATOM 0 HE1 TYR A 24 23.760 -9.339 8.921 1.00 1.00 H new ATOM 0 HE2 TYR A 24 22.766 -6.215 6.141 1.00 1.00 H new ATOM 0 HH TYR A 24 23.476 -5.824 8.224 1.00 1.00 H new ATOM 137 N PHE A 25 24.324 -12.057 1.930 1.00 1.00 N ATOM 138 CA PHE A 25 24.114 -12.634 0.579 1.00 1.00 C ATOM 139 C PHE A 25 25.186 -13.694 0.313 1.00 1.00 C ATOM 140 O PHE A 25 25.617 -14.395 1.207 1.00 1.00 O ATOM 141 CB PHE A 25 24.223 -11.513 -0.459 1.00 1.00 C ATOM 142 CG PHE A 25 23.378 -11.846 -1.664 1.00 1.00 C ATOM 143 CD1 PHE A 25 22.055 -12.273 -1.496 1.00 1.00 C ATOM 144 CD2 PHE A 25 23.918 -11.722 -2.951 1.00 1.00 C ATOM 145 CE1 PHE A 25 21.271 -12.577 -2.617 1.00 1.00 C ATOM 146 CE2 PHE A 25 23.134 -12.026 -4.071 1.00 1.00 C ATOM 147 CZ PHE A 25 21.811 -12.454 -3.904 1.00 1.00 C ATOM 0 H PHE A 25 25.297 -11.875 2.176 1.00 1.00 H new ATOM 0 HA PHE A 25 23.129 -13.096 0.515 1.00 1.00 H new ATOM 0 HB2 PHE A 25 23.895 -10.569 -0.024 1.00 1.00 H new ATOM 0 HB3 PHE A 25 25.263 -11.382 -0.758 1.00 1.00 H new ATOM 0 HD1 PHE A 25 21.639 -12.368 -0.504 1.00 1.00 H new ATOM 0 HD2 PHE A 25 24.938 -11.392 -3.079 1.00 1.00 H new ATOM 0 HE1 PHE A 25 20.250 -12.906 -2.489 1.00 1.00 H new ATOM 0 HE2 PHE A 25 23.550 -11.930 -5.063 1.00 1.00 H new ATOM 0 HZ PHE A 25 21.207 -12.689 -4.768 1.00 1.00 H new ATOM 148 N SER A 26 25.619 -13.812 -0.908 1.00 1.00 N ATOM 149 CA SER A 26 26.665 -14.819 -1.243 1.00 1.00 C ATOM 150 C SER A 26 27.348 -14.407 -2.548 1.00 1.00 C ATOM 151 O SER A 26 27.905 -15.220 -3.258 1.00 1.00 O ATOM 152 CB SER A 26 26.016 -16.193 -1.416 1.00 1.00 C ATOM 153 OG SER A 26 26.959 -17.203 -1.082 1.00 1.00 O ATOM 0 H SER A 26 25.292 -13.251 -1.695 1.00 1.00 H new ATOM 0 HA SER A 26 27.401 -14.870 -0.440 1.00 1.00 H new ATOM 0 HB2 SER A 26 25.136 -16.275 -0.778 1.00 1.00 H new ATOM 0 HB3 SER A 26 25.677 -16.321 -2.444 1.00 1.00 H new ATOM 0 HG SER A 26 26.546 -18.085 -1.190 1.00 1.00 H new ATOM 154 N ASN A 27 27.299 -13.143 -2.865 1.00 1.00 N ATOM 155 CA ASN A 27 27.929 -12.650 -4.121 1.00 1.00 C ATOM 156 C ASN A 27 27.333 -11.282 -4.455 1.00 1.00 C ATOM 157 O ASN A 27 26.819 -11.061 -5.534 1.00 1.00 O ATOM 158 CB ASN A 27 27.637 -13.629 -5.261 1.00 1.00 C ATOM 159 CG ASN A 27 28.936 -14.309 -5.699 1.00 1.00 C ATOM 160 OD1 ASN A 27 29.958 -14.161 -5.059 1.00 1.00 O ATOM 161 ND2 ASN A 27 28.939 -15.053 -6.771 1.00 1.00 N ATOM 0 H ASN A 27 26.845 -12.424 -2.302 1.00 1.00 H new ATOM 0 HA ASN A 27 29.008 -12.568 -3.992 1.00 1.00 H new ATOM 0 HB2 ASN A 27 26.915 -14.378 -4.935 1.00 1.00 H new ATOM 0 HB3 ASN A 27 27.190 -13.100 -6.103 1.00 1.00 H new ATOM 0 HD21 ASN A 27 29.800 -15.511 -7.072 1.00 1.00 H new ATOM 0 HD22 ASN A 27 28.081 -15.177 -7.308 1.00 1.00 H new ATOM 162 N ILE A 28 27.384 -10.368 -3.525 1.00 1.00 N ATOM 163 CA ILE A 28 26.806 -9.017 -3.770 1.00 1.00 C ATOM 164 C ILE A 28 27.837 -7.942 -3.414 1.00 1.00 C ATOM 165 O ILE A 28 28.554 -8.053 -2.439 1.00 1.00 O ATOM 166 CB ILE A 28 25.563 -8.844 -2.893 1.00 1.00 C ATOM 167 CG1 ILE A 28 25.112 -7.384 -2.917 1.00 1.00 C ATOM 168 CG2 ILE A 28 25.896 -9.240 -1.456 1.00 1.00 C ATOM 169 CD1 ILE A 28 24.750 -6.982 -4.348 1.00 1.00 C ATOM 0 H ILE A 28 27.802 -10.499 -2.604 1.00 1.00 H new ATOM 0 HA ILE A 28 26.536 -8.917 -4.821 1.00 1.00 H new ATOM 0 HB ILE A 28 24.764 -9.478 -3.276 1.00 1.00 H new ATOM 0 HG12 ILE A 28 24.252 -7.248 -2.262 1.00 1.00 H new ATOM 0 HG13 ILE A 28 25.906 -6.741 -2.538 1.00 1.00 H new ATOM 0 HG21 ILE A 28 25.012 -9.117 -0.831 1.00 1.00 H new ATOM 0 HG22 ILE A 28 26.217 -10.281 -1.431 1.00 1.00 H new ATOM 0 HG23 ILE A 28 26.698 -8.604 -1.080 1.00 1.00 H new ATOM 0 HD11 ILE A 28 24.429 -5.941 -4.363 1.00 1.00 H new ATOM 0 HD12 ILE A 28 25.622 -7.102 -4.991 1.00 1.00 H new ATOM 0 HD13 ILE A 28 23.941 -7.617 -4.711 1.00 1.00 H new ATOM 170 N HIS A 29 27.913 -6.899 -4.195 1.00 1.00 N ATOM 171 CA HIS A 29 28.892 -5.813 -3.902 1.00 1.00 C ATOM 172 C HIS A 29 28.613 -4.617 -4.814 1.00 1.00 C ATOM 173 O HIS A 29 28.249 -4.772 -5.963 1.00 1.00 O ATOM 174 CB HIS A 29 30.315 -6.321 -4.146 1.00 1.00 C ATOM 175 CG HIS A 29 30.312 -7.311 -5.278 1.00 1.00 C ATOM 176 ND1 HIS A 29 30.614 -8.651 -5.089 1.00 1.00 N ATOM 177 CD2 HIS A 29 30.048 -7.172 -6.618 1.00 1.00 C ATOM 178 CE1 HIS A 29 30.525 -9.259 -6.286 1.00 1.00 C ATOM 179 NE2 HIS A 29 30.183 -8.403 -7.253 1.00 1.00 N ATOM 0 H HIS A 29 27.338 -6.752 -5.025 1.00 1.00 H new ATOM 0 HA HIS A 29 28.793 -5.508 -2.860 1.00 1.00 H new ATOM 0 HB2 HIS A 29 30.974 -5.486 -4.382 1.00 1.00 H new ATOM 0 HB3 HIS A 29 30.705 -6.789 -3.242 1.00 1.00 H new ATOM 0 HD2 HIS A 29 29.777 -6.247 -7.106 1.00 1.00 H new ATOM 0 HE1 HIS A 29 30.708 -10.311 -6.446 1.00 1.00 H new ATOM 0 HE2 HIS A 29 30.050 -8.608 -8.243 1.00 1.00 H new ATOM 180 N TRP A 30 28.777 -3.424 -4.311 1.00 1.00 N ATOM 181 CA TRP A 30 28.518 -2.219 -5.150 1.00 1.00 C ATOM 182 C TRP A 30 29.249 -1.015 -4.551 1.00 1.00 C ATOM 183 O TRP A 30 29.599 -1.006 -3.388 1.00 1.00 O ATOM 184 CB TRP A 30 27.014 -1.939 -5.185 1.00 1.00 C ATOM 185 CG TRP A 30 26.565 -1.465 -3.841 1.00 1.00 C ATOM 186 CD1 TRP A 30 26.755 -0.219 -3.350 1.00 1.00 C ATOM 187 CD2 TRP A 30 25.854 -2.207 -2.810 1.00 1.00 C ATOM 188 NE1 TRP A 30 26.207 -0.150 -2.082 1.00 1.00 N ATOM 189 CE2 TRP A 30 25.639 -1.351 -1.705 1.00 1.00 C ATOM 190 CE3 TRP A 30 25.381 -3.529 -2.731 1.00 1.00 C ATOM 191 CZ2 TRP A 30 24.977 -1.793 -0.558 1.00 1.00 C ATOM 192 CZ3 TRP A 30 24.713 -3.979 -1.579 1.00 1.00 C ATOM 193 CH2 TRP A 30 24.512 -3.111 -0.494 1.00 1.00 C ATOM 0 H TRP A 30 29.079 -3.231 -3.356 1.00 1.00 H new ATOM 0 HA TRP A 30 28.879 -2.395 -6.163 1.00 1.00 H new ATOM 0 HB2 TRP A 30 26.791 -1.186 -5.941 1.00 1.00 H new ATOM 0 HB3 TRP A 30 26.471 -2.842 -5.464 1.00 1.00 H new ATOM 0 HD1 TRP A 30 27.253 0.590 -3.864 1.00 1.00 H new ATOM 0 HE1 TRP A 30 26.221 0.685 -1.497 1.00 1.00 H new ATOM 0 HE3 TRP A 30 25.532 -4.203 -3.561 1.00 1.00 H new ATOM 0 HZ2 TRP A 30 24.825 -1.122 0.274 1.00 1.00 H new ATOM 0 HZ3 TRP A 30 24.353 -4.996 -1.528 1.00 1.00 H new ATOM 0 HH2 TRP A 30 23.999 -3.461 0.390 1.00 1.00 H new ATOM 194 N CYS A 31 29.482 0.001 -5.337 1.00 1.00 N ATOM 195 CA CYS A 31 30.190 1.202 -4.810 1.00 1.00 C ATOM 196 C CYS A 31 29.162 2.254 -4.388 1.00 1.00 C ATOM 197 O CYS A 31 28.092 2.351 -4.955 1.00 1.00 O ATOM 198 CB CYS A 31 31.098 1.777 -5.899 1.00 1.00 C ATOM 199 SG CYS A 31 31.438 3.519 -5.550 1.00 1.00 S ATOM 0 H CYS A 31 29.213 0.051 -6.320 1.00 1.00 H new ATOM 0 HA CYS A 31 30.794 0.921 -3.948 1.00 1.00 H new ATOM 0 HB2 CYS A 31 32.031 1.216 -5.942 1.00 1.00 H new ATOM 0 HB3 CYS A 31 30.621 1.678 -6.874 1.00 1.00 H new ATOM 200 N ASN A 32 29.476 3.039 -3.394 1.00 1.00 N ATOM 201 CA ASN A 32 28.513 4.079 -2.934 1.00 1.00 C ATOM 202 C ASN A 32 29.085 5.471 -3.214 1.00 1.00 C ATOM 203 O ASN A 32 29.956 5.947 -2.514 1.00 1.00 O ATOM 204 CB ASN A 32 28.274 3.920 -1.431 1.00 1.00 C ATOM 205 CG ASN A 32 26.804 3.581 -1.180 1.00 1.00 C ATOM 206 OD1 ASN A 32 26.493 2.543 -0.631 1.00 1.00 O ATOM 207 ND2 ASN A 32 25.879 4.419 -1.561 1.00 1.00 N ATOM 0 H ASN A 32 30.357 3.005 -2.881 1.00 1.00 H new ATOM 0 HA ASN A 32 27.571 3.962 -3.469 1.00 1.00 H new ATOM 0 HB2 ASN A 32 28.913 3.132 -1.032 1.00 1.00 H new ATOM 0 HB3 ASN A 32 28.540 4.840 -0.911 1.00 1.00 H new ATOM 0 HD21 ASN A 32 24.896 4.202 -1.398 1.00 1.00 H new ATOM 0 HD22 ASN A 32 26.139 5.291 -2.022 1.00 1.00 H new ATOM 208 N CYS A 33 28.597 6.129 -4.230 1.00 1.00 N ATOM 209 CA CYS A 33 29.109 7.491 -4.550 1.00 1.00 C ATOM 210 C CYS A 33 28.190 8.539 -3.913 1.00 1.00 C ATOM 211 O CYS A 33 27.014 8.297 -3.732 1.00 1.00 O ATOM 212 CB CYS A 33 29.129 7.688 -6.068 1.00 1.00 C ATOM 213 SG CYS A 33 29.137 6.073 -6.885 1.00 1.00 S ATOM 0 H CYS A 33 27.866 5.782 -4.852 1.00 1.00 H new ATOM 0 HA CYS A 33 30.120 7.601 -4.158 1.00 1.00 H new ATOM 0 HB2 CYS A 33 28.258 8.262 -6.383 1.00 1.00 H new ATOM 0 HB3 CYS A 33 30.010 8.260 -6.360 1.00 1.00 H new ATOM 214 N PRO A 34 28.757 9.675 -3.594 1.00 1.00 N ATOM 215 CA PRO A 34 28.007 10.761 -2.983 1.00 1.00 C ATOM 216 C PRO A 34 26.720 11.020 -3.771 1.00 1.00 C ATOM 217 O PRO A 34 26.661 10.816 -4.967 1.00 1.00 O ATOM 218 CB PRO A 34 28.947 11.960 -3.057 1.00 1.00 C ATOM 219 CG PRO A 34 30.365 11.306 -3.092 1.00 1.00 C ATOM 220 CD PRO A 34 30.184 9.946 -3.824 1.00 1.00 C ATOM 0 HA PRO A 34 27.704 10.544 -1.959 1.00 1.00 H new ATOM 0 HB2 PRO A 34 28.760 12.563 -3.946 1.00 1.00 H new ATOM 0 HB3 PRO A 34 28.829 12.617 -2.196 1.00 1.00 H new ATOM 0 HG2 PRO A 34 31.077 11.942 -3.618 1.00 1.00 H new ATOM 0 HG3 PRO A 34 30.753 11.159 -2.084 1.00 1.00 H new ATOM 0 HD2 PRO A 34 30.422 10.017 -4.885 1.00 1.00 H new ATOM 0 HD3 PRO A 34 30.822 9.167 -3.406 1.00 1.00 H new ATOM 221 N LYS A 35 25.686 11.459 -3.107 1.00 1.00 N ATOM 222 CA LYS A 35 24.401 11.723 -3.814 1.00 1.00 C ATOM 223 C LYS A 35 24.648 12.635 -5.018 1.00 1.00 C ATOM 224 O LYS A 35 23.894 12.637 -5.970 1.00 1.00 O ATOM 225 CB LYS A 35 23.424 12.404 -2.853 1.00 1.00 C ATOM 226 CG LYS A 35 22.091 12.643 -3.563 1.00 1.00 C ATOM 227 CD LYS A 35 20.987 11.854 -2.858 1.00 1.00 C ATOM 228 CE LYS A 35 21.336 10.364 -2.869 1.00 1.00 C ATOM 229 NZ LYS A 35 20.083 9.560 -2.940 1.00 1.00 N ATOM 0 H LYS A 35 25.676 11.646 -2.104 1.00 1.00 H new ATOM 0 HA LYS A 35 23.980 10.779 -4.159 1.00 1.00 H new ATOM 0 HB2 LYS A 35 23.272 11.782 -1.971 1.00 1.00 H new ATOM 0 HB3 LYS A 35 23.839 13.351 -2.507 1.00 1.00 H new ATOM 0 HG2 LYS A 35 21.851 13.706 -3.560 1.00 1.00 H new ATOM 0 HG3 LYS A 35 22.163 12.335 -4.606 1.00 1.00 H new ATOM 0 HD2 LYS A 35 20.874 12.204 -1.832 1.00 1.00 H new ATOM 0 HD3 LYS A 35 20.032 12.018 -3.358 1.00 1.00 H new ATOM 0 HE2 LYS A 35 21.976 10.136 -3.721 1.00 1.00 H new ATOM 0 HE3 LYS A 35 21.897 10.104 -1.971 1.00 1.00 H new ATOM 0 HZ1 LYS A 35 20.320 8.547 -2.947 1.00 1.00 H new ATOM 0 HZ2 LYS A 35 19.488 9.770 -2.113 1.00 1.00 H new ATOM 0 HZ3 LYS A 35 19.565 9.801 -3.809 1.00 1.00 H new ATOM 230 N LYS A 36 25.693 13.415 -4.983 1.00 1.00 N ATOM 231 CA LYS A 36 25.977 14.328 -6.126 1.00 1.00 C ATOM 232 C LYS A 36 26.838 13.606 -7.166 1.00 1.00 C ATOM 233 O LYS A 36 27.623 14.216 -7.864 1.00 1.00 O ATOM 234 CB LYS A 36 26.724 15.562 -5.620 1.00 1.00 C ATOM 235 CG LYS A 36 27.921 15.122 -4.778 1.00 1.00 C ATOM 236 CD LYS A 36 29.210 15.645 -5.411 1.00 1.00 C ATOM 237 CE LYS A 36 29.540 17.024 -4.835 1.00 1.00 C ATOM 238 NZ LYS A 36 28.688 18.054 -5.494 1.00 1.00 N ATOM 0 H LYS A 36 26.361 13.460 -4.214 1.00 1.00 H new ATOM 0 HA LYS A 36 25.036 14.631 -6.584 1.00 1.00 H new ATOM 0 HB2 LYS A 36 27.060 16.167 -6.462 1.00 1.00 H new ATOM 0 HB3 LYS A 36 26.057 16.186 -5.025 1.00 1.00 H new ATOM 0 HG2 LYS A 36 27.823 15.502 -3.761 1.00 1.00 H new ATOM 0 HG3 LYS A 36 27.952 14.035 -4.711 1.00 1.00 H new ATOM 0 HD2 LYS A 36 30.029 14.953 -5.217 1.00 1.00 H new ATOM 0 HD3 LYS A 36 29.096 15.709 -6.493 1.00 1.00 H new ATOM 0 HE2 LYS A 36 29.370 17.030 -3.758 1.00 1.00 H new ATOM 0 HE3 LYS A 36 30.594 17.253 -4.993 1.00 1.00 H new ATOM 0 HZ1 LYS A 36 29.084 18.999 -5.315 1.00 1.00 H new ATOM 0 HZ2 LYS A 36 28.661 17.879 -6.519 1.00 1.00 H new ATOM 0 HZ3 LYS A 36 27.723 18.004 -5.109 1.00 1.00 H new ATOM 239 N PHE A 37 26.702 12.313 -7.277 1.00 1.00 N ATOM 240 CA PHE A 37 27.519 11.566 -8.276 1.00 1.00 C ATOM 241 C PHE A 37 26.652 10.520 -8.981 1.00 1.00 C ATOM 242 O PHE A 37 25.807 9.889 -8.377 1.00 1.00 O ATOM 243 CB PHE A 37 28.683 10.870 -7.569 1.00 1.00 C ATOM 244 CG PHE A 37 29.847 11.825 -7.459 1.00 1.00 C ATOM 245 CD1 PHE A 37 30.459 12.321 -8.617 1.00 1.00 C ATOM 246 CD2 PHE A 37 30.314 12.216 -6.198 1.00 1.00 C ATOM 247 CE1 PHE A 37 31.538 13.208 -8.514 1.00 1.00 C ATOM 248 CE2 PHE A 37 31.394 13.103 -6.094 1.00 1.00 C ATOM 249 CZ PHE A 37 32.006 13.599 -7.252 1.00 1.00 C ATOM 0 H PHE A 37 26.064 11.743 -6.722 1.00 1.00 H new ATOM 0 HA PHE A 37 27.908 12.267 -9.015 1.00 1.00 H new ATOM 0 HB2 PHE A 37 28.375 10.539 -6.577 1.00 1.00 H new ATOM 0 HB3 PHE A 37 28.980 9.980 -8.124 1.00 1.00 H new ATOM 0 HD1 PHE A 37 30.099 12.019 -9.590 1.00 1.00 H new ATOM 0 HD2 PHE A 37 29.842 11.834 -5.305 1.00 1.00 H new ATOM 0 HE1 PHE A 37 32.009 13.591 -9.407 1.00 1.00 H new ATOM 0 HE2 PHE A 37 31.754 13.404 -5.121 1.00 1.00 H new ATOM 0 HZ PHE A 37 32.838 14.283 -7.173 1.00 1.00 H new ATOM 250 N GLY A 38 26.858 10.330 -10.256 1.00 1.00 N ATOM 251 CA GLY A 38 26.050 9.324 -11.004 1.00 1.00 C ATOM 252 C GLY A 38 26.701 9.051 -12.361 1.00 1.00 C ATOM 253 O GLY A 38 27.825 9.435 -12.608 1.00 1.00 O ATOM 0 H GLY A 38 27.552 10.829 -10.813 1.00 1.00 H new ATOM 0 HA2 GLY A 38 25.980 8.400 -10.430 1.00 1.00 H new ATOM 0 HA3 GLY A 38 25.033 9.691 -11.144 1.00 1.00 H new ATOM 254 N GLY A 39 26.004 8.392 -13.245 1.00 1.00 N ATOM 255 CA GLY A 39 26.587 8.101 -14.585 1.00 1.00 C ATOM 256 C GLY A 39 27.420 6.822 -14.527 1.00 1.00 C ATOM 257 O GLY A 39 28.567 6.842 -14.134 1.00 1.00 O ATOM 0 H GLY A 39 25.057 8.043 -13.098 1.00 1.00 H new ATOM 0 HA2 GLY A 39 25.791 7.993 -15.321 1.00 1.00 H new ATOM 0 HA3 GLY A 39 27.209 8.935 -14.909 1.00 1.00 H new ATOM 258 N GLN A 40 26.844 5.717 -14.934 1.00 1.00 N ATOM 259 CA GLN A 40 27.577 4.413 -14.934 1.00 1.00 C ATOM 260 C GLN A 40 28.539 4.324 -13.746 1.00 1.00 C ATOM 261 O GLN A 40 28.199 3.824 -12.693 1.00 1.00 O ATOM 262 CB GLN A 40 28.371 4.283 -16.235 1.00 1.00 C ATOM 263 CG GLN A 40 29.258 3.037 -16.173 1.00 1.00 C ATOM 264 CD GLN A 40 28.776 2.017 -17.206 1.00 1.00 C ATOM 265 OE1 GLN A 40 29.570 1.308 -17.793 1.00 1.00 O ATOM 266 NE2 GLN A 40 27.500 1.911 -17.454 1.00 1.00 N ATOM 0 H GLN A 40 25.883 5.663 -15.271 1.00 1.00 H new ATOM 0 HA GLN A 40 26.849 3.606 -14.851 1.00 1.00 H new ATOM 0 HB2 GLN A 40 27.690 4.215 -17.083 1.00 1.00 H new ATOM 0 HB3 GLN A 40 28.984 5.171 -16.389 1.00 1.00 H new ATOM 0 HG2 GLN A 40 30.296 3.306 -16.369 1.00 1.00 H new ATOM 0 HG3 GLN A 40 29.224 2.603 -15.174 1.00 1.00 H new ATOM 0 HE21 GLN A 40 26.834 2.506 -16.962 1.00 1.00 H new ATOM 0 HE22 GLN A 40 27.168 1.233 -18.140 1.00 1.00 H new ATOM 267 N HIS A 41 29.741 4.801 -13.915 1.00 1.00 N ATOM 268 CA HIS A 41 30.733 4.743 -12.806 1.00 1.00 C ATOM 269 C HIS A 41 30.695 6.056 -12.028 1.00 1.00 C ATOM 270 O HIS A 41 31.715 6.646 -11.735 1.00 1.00 O ATOM 271 CB HIS A 41 32.133 4.536 -13.386 1.00 1.00 C ATOM 272 CG HIS A 41 32.278 3.112 -13.849 1.00 1.00 C ATOM 273 ND1 HIS A 41 33.274 2.718 -14.728 1.00 1.00 N ATOM 274 CD2 HIS A 41 31.557 1.978 -13.566 1.00 1.00 C ATOM 275 CE1 HIS A 41 33.127 1.398 -14.941 1.00 1.00 C ATOM 276 NE2 HIS A 41 32.095 0.897 -14.257 1.00 1.00 N ATOM 0 H HIS A 41 30.080 5.230 -14.776 1.00 1.00 H new ATOM 0 HA HIS A 41 30.490 3.915 -12.140 1.00 1.00 H new ATOM 0 HB2 HIS A 41 32.298 5.219 -14.219 1.00 1.00 H new ATOM 0 HB3 HIS A 41 32.888 4.764 -12.633 1.00 1.00 H new ATOM 0 HD2 HIS A 41 30.702 1.932 -12.907 1.00 1.00 H new ATOM 0 HE1 HIS A 41 33.766 0.814 -15.587 1.00 1.00 H new ATOM 0 HE2 HIS A 41 31.771 -0.070 -14.244 1.00 1.00 H new ATOM 277 N CYS A 42 29.521 6.517 -11.698 1.00 1.00 N ATOM 278 CA CYS A 42 29.403 7.794 -10.943 1.00 1.00 C ATOM 279 C CYS A 42 30.376 8.819 -11.524 1.00 1.00 C ATOM 280 O CYS A 42 31.137 9.445 -10.812 1.00 1.00 O ATOM 281 CB CYS A 42 29.723 7.552 -9.465 1.00 1.00 C ATOM 282 SG CYS A 42 28.469 6.457 -8.753 1.00 1.00 S ATOM 0 H CYS A 42 28.635 6.062 -11.920 1.00 1.00 H new ATOM 0 HA CYS A 42 28.385 8.174 -11.028 1.00 1.00 H new ATOM 0 HB2 CYS A 42 30.712 7.105 -9.364 1.00 1.00 H new ATOM 0 HB3 CYS A 42 29.744 8.499 -8.926 1.00 1.00 H new ATOM 283 N GLU A 43 30.356 8.992 -12.819 1.00 1.00 N ATOM 284 CA GLU A 43 31.270 9.974 -13.460 1.00 1.00 C ATOM 285 C GLU A 43 30.497 11.261 -13.761 1.00 1.00 C ATOM 286 O GLU A 43 30.820 11.992 -14.676 1.00 1.00 O ATOM 287 CB GLU A 43 31.808 9.389 -14.768 1.00 1.00 C ATOM 288 CG GLU A 43 30.639 8.918 -15.635 1.00 1.00 C ATOM 289 CD GLU A 43 30.990 9.107 -17.112 1.00 1.00 C ATOM 290 OE1 GLU A 43 31.435 10.188 -17.460 1.00 1.00 O ATOM 291 OE2 GLU A 43 30.808 8.168 -17.869 1.00 1.00 O ATOM 0 H GLU A 43 29.742 8.491 -13.461 1.00 1.00 H new ATOM 0 HA GLU A 43 32.101 10.193 -12.789 1.00 1.00 H new ATOM 0 HB2 GLU A 43 32.391 10.139 -15.302 1.00 1.00 H new ATOM 0 HB3 GLU A 43 32.478 8.555 -14.558 1.00 1.00 H new ATOM 0 HG2 GLU A 43 30.422 7.869 -15.433 1.00 1.00 H new ATOM 0 HG3 GLU A 43 29.739 9.482 -15.389 1.00 1.00 H new ATOM 292 N ILE A 44 29.477 11.539 -12.998 1.00 1.00 N ATOM 293 CA ILE A 44 28.677 12.774 -13.237 1.00 1.00 C ATOM 294 C ILE A 44 28.448 13.491 -11.907 1.00 1.00 C ATOM 295 O ILE A 44 28.598 12.914 -10.850 1.00 1.00 O ATOM 296 CB ILE A 44 27.325 12.395 -13.844 1.00 1.00 C ATOM 297 CG1 ILE A 44 27.512 11.246 -14.840 1.00 1.00 C ATOM 298 CG2 ILE A 44 26.728 13.606 -14.563 1.00 1.00 C ATOM 299 CD1 ILE A 44 28.175 11.771 -16.114 1.00 1.00 C ATOM 0 H ILE A 44 29.162 10.963 -12.217 1.00 1.00 H new ATOM 0 HA ILE A 44 29.214 13.430 -13.922 1.00 1.00 H new ATOM 0 HB ILE A 44 26.649 12.077 -13.050 1.00 1.00 H new ATOM 0 HG12 ILE A 44 28.126 10.463 -14.395 1.00 1.00 H new ATOM 0 HG13 ILE A 44 26.547 10.798 -15.079 1.00 1.00 H new ATOM 0 HG21 ILE A 44 25.765 13.334 -14.995 1.00 1.00 H new ATOM 0 HG22 ILE A 44 26.590 14.420 -13.851 1.00 1.00 H new ATOM 0 HG23 ILE A 44 27.403 13.928 -15.356 1.00 1.00 H new ATOM 0 HD11 ILE A 44 28.306 10.951 -16.820 1.00 1.00 H new ATOM 0 HD12 ILE A 44 27.544 12.539 -16.563 1.00 1.00 H new ATOM 0 HD13 ILE A 44 29.147 12.198 -15.869 1.00 1.00 H new ATOM 300 N ASP A 45 28.080 14.743 -11.948 1.00 1.00 N ATOM 301 CA ASP A 45 27.837 15.485 -10.679 1.00 1.00 C ATOM 302 C ASP A 45 26.335 15.686 -10.489 1.00 1.00 C ATOM 303 O ASP A 45 25.901 16.499 -9.697 1.00 1.00 O ATOM 304 CB ASP A 45 28.533 16.846 -10.736 1.00 1.00 C ATOM 305 CG ASP A 45 28.231 17.519 -12.076 1.00 1.00 C ATOM 306 OD1 ASP A 45 27.124 17.358 -12.561 1.00 1.00 O ATOM 307 OD2 ASP A 45 29.113 18.184 -12.595 1.00 1.00 O ATOM 0 H ASP A 45 27.938 15.282 -12.802 1.00 1.00 H new ATOM 0 HA ASP A 45 28.237 14.912 -9.842 1.00 1.00 H new ATOM 0 HB2 ASP A 45 28.190 17.476 -9.915 1.00 1.00 H new ATOM 0 HB3 ASP A 45 29.609 16.721 -10.614 1.00 1.00 H new ATOM 308 N LYS A 46 25.545 14.939 -11.209 1.00 1.00 N ATOM 309 CA LYS A 46 24.062 15.059 -11.088 1.00 1.00 C ATOM 310 C LYS A 46 23.667 16.528 -10.910 1.00 1.00 C ATOM 311 O LYS A 46 23.501 17.255 -11.868 1.00 1.00 O ATOM 312 CB LYS A 46 23.585 14.247 -9.882 1.00 1.00 C ATOM 313 CG LYS A 46 23.419 12.783 -10.291 1.00 1.00 C ATOM 314 CD LYS A 46 22.968 11.961 -9.083 1.00 1.00 C ATOM 315 CE LYS A 46 22.755 10.508 -9.511 1.00 1.00 C ATOM 316 NZ LYS A 46 22.613 9.650 -8.301 1.00 1.00 N ATOM 0 H LYS A 46 25.865 14.243 -11.883 1.00 1.00 H new ATOM 0 HA LYS A 46 23.595 14.675 -11.995 1.00 1.00 H new ATOM 0 HB2 LYS A 46 24.304 14.329 -9.067 1.00 1.00 H new ATOM 0 HB3 LYS A 46 22.639 14.643 -9.514 1.00 1.00 H new ATOM 0 HG2 LYS A 46 22.687 12.700 -11.094 1.00 1.00 H new ATOM 0 HG3 LYS A 46 24.361 12.394 -10.677 1.00 1.00 H new ATOM 0 HD2 LYS A 46 23.717 12.013 -8.293 1.00 1.00 H new ATOM 0 HD3 LYS A 46 22.044 12.371 -8.674 1.00 1.00 H new ATOM 0 HE2 LYS A 46 21.864 10.428 -10.133 1.00 1.00 H new ATOM 0 HE3 LYS A 46 23.597 10.168 -10.114 1.00 1.00 H new ATOM 0 HZ1 LYS A 46 22.128 8.766 -8.557 1.00 1.00 H new ATOM 0 HZ2 LYS A 46 23.555 9.430 -7.919 1.00 1.00 H new ATOM 0 HZ3 LYS A 46 22.057 10.154 -7.581 1.00 1.00 H new ATOM 317 N SER A 47 23.515 16.968 -9.689 1.00 1.00 N ATOM 318 CA SER A 47 23.130 18.387 -9.449 1.00 1.00 C ATOM 319 C SER A 47 22.952 18.613 -7.946 1.00 1.00 C ATOM 320 O SER A 47 22.267 17.867 -7.276 1.00 1.00 O ATOM 321 CB SER A 47 21.814 18.689 -10.168 1.00 1.00 C ATOM 322 OG SER A 47 21.496 20.065 -10.006 1.00 1.00 O ATOM 0 H SER A 47 23.641 16.405 -8.848 1.00 1.00 H new ATOM 0 HA SER A 47 23.910 19.046 -9.830 1.00 1.00 H new ATOM 0 HB2 SER A 47 21.901 18.446 -11.227 1.00 1.00 H new ATOM 0 HB3 SER A 47 21.014 18.069 -9.763 1.00 1.00 H new ATOM 0 HG SER A 47 21.311 20.249 -9.061 1.00 1.00 H new ATOM 323 N LYS A 48 23.563 19.635 -7.412 1.00 1.00 N ATOM 324 CA LYS A 48 23.428 19.904 -5.952 1.00 1.00 C ATOM 325 C LYS A 48 21.958 19.782 -5.544 1.00 1.00 C ATOM 326 O LYS A 48 21.196 20.723 -5.644 1.00 1.00 O ATOM 327 CB LYS A 48 23.926 21.319 -5.646 1.00 1.00 C ATOM 328 CG LYS A 48 23.922 21.547 -4.133 1.00 1.00 C ATOM 329 CD LYS A 48 25.118 20.830 -3.504 1.00 1.00 C ATOM 330 CE LYS A 48 24.663 20.079 -2.251 1.00 1.00 C ATOM 331 NZ LYS A 48 25.155 20.791 -1.038 1.00 1.00 N ATOM 0 H LYS A 48 24.149 20.295 -7.923 1.00 1.00 H new ATOM 0 HA LYS A 48 24.021 19.180 -5.393 1.00 1.00 H new ATOM 0 HB2 LYS A 48 24.932 21.455 -6.042 1.00 1.00 H new ATOM 0 HB3 LYS A 48 23.288 22.054 -6.137 1.00 1.00 H new ATOM 0 HG2 LYS A 48 23.969 22.614 -3.916 1.00 1.00 H new ATOM 0 HG3 LYS A 48 22.993 21.174 -3.701 1.00 1.00 H new ATOM 0 HD2 LYS A 48 25.555 20.133 -4.219 1.00 1.00 H new ATOM 0 HD3 LYS A 48 25.894 21.551 -3.247 1.00 1.00 H new ATOM 0 HE2 LYS A 48 23.575 20.011 -2.230 1.00 1.00 H new ATOM 0 HE3 LYS A 48 25.046 19.058 -2.267 1.00 1.00 H new ATOM 0 HZ1 LYS A 48 24.846 20.280 -0.186 1.00 1.00 H new ATOM 0 HZ2 LYS A 48 26.194 20.834 -1.058 1.00 1.00 H new ATOM 0 HZ3 LYS A 48 24.769 21.757 -1.022 1.00 1.00 H new ATOM 332 N THR A 49 21.553 18.628 -5.086 1.00 1.00 N ATOM 333 CA THR A 49 20.133 18.446 -4.673 1.00 1.00 C ATOM 334 C THR A 49 19.209 18.955 -5.782 1.00 1.00 C ATOM 335 O THR A 49 18.609 20.005 -5.670 1.00 1.00 O ATOM 336 CB THR A 49 19.870 19.234 -3.388 1.00 1.00 C ATOM 337 OG1 THR A 49 19.851 20.624 -3.682 1.00 1.00 O ATOM 338 CG2 THR A 49 20.976 18.939 -2.373 1.00 1.00 C ATOM 0 H THR A 49 22.145 17.804 -4.980 1.00 1.00 H new ATOM 0 HA THR A 49 19.939 17.388 -4.496 1.00 1.00 H new ATOM 0 HB THR A 49 18.908 18.939 -2.970 1.00 1.00 H new ATOM 0 HG1 THR A 49 19.832 20.753 -4.653 1.00 1.00 H new ATOM 0 HG21 THR A 49 20.789 19.500 -1.458 1.00 1.00 H new ATOM 0 HG22 THR A 49 20.989 17.872 -2.149 1.00 1.00 H new ATOM 0 HG23 THR A 49 21.939 19.234 -2.789 1.00 1.00 H new ATOM 339 N CYS A 50 19.091 18.218 -6.853 1.00 1.00 N ATOM 340 CA CYS A 50 18.205 18.660 -7.968 1.00 1.00 C ATOM 341 C CYS A 50 17.923 17.477 -8.896 1.00 1.00 C ATOM 342 O CYS A 50 18.558 16.445 -8.812 1.00 1.00 O ATOM 343 CB CYS A 50 18.896 19.772 -8.760 1.00 1.00 C ATOM 344 SG CYS A 50 19.789 20.859 -7.622 1.00 1.00 S ATOM 0 H CYS A 50 19.569 17.330 -7.004 1.00 1.00 H new ATOM 0 HA CYS A 50 17.267 19.034 -7.558 1.00 1.00 H new ATOM 0 HB2 CYS A 50 19.586 19.341 -9.485 1.00 1.00 H new ATOM 0 HB3 CYS A 50 18.159 20.344 -9.323 1.00 1.00 H new ATOM 345 N TYR A 51 16.976 17.619 -9.783 1.00 1.00 N ATOM 346 CA TYR A 51 16.657 16.503 -10.716 1.00 1.00 C ATOM 347 C TYR A 51 17.307 16.774 -12.075 1.00 1.00 C ATOM 348 O TYR A 51 17.970 17.773 -12.269 1.00 1.00 O ATOM 349 CB TYR A 51 15.140 16.397 -10.887 1.00 1.00 C ATOM 350 CG TYR A 51 14.638 17.573 -11.690 1.00 1.00 C ATOM 351 CD1 TYR A 51 14.601 17.501 -13.089 1.00 1.00 C ATOM 352 CD2 TYR A 51 14.206 18.735 -11.036 1.00 1.00 C ATOM 353 CE1 TYR A 51 14.134 18.592 -13.834 1.00 1.00 C ATOM 354 CE2 TYR A 51 13.739 19.825 -11.781 1.00 1.00 C ATOM 355 CZ TYR A 51 13.702 19.754 -13.180 1.00 1.00 C ATOM 356 OH TYR A 51 13.241 20.828 -13.914 1.00 1.00 O ATOM 0 H TYR A 51 16.410 18.459 -9.901 1.00 1.00 H new ATOM 0 HA TYR A 51 17.042 15.568 -10.309 1.00 1.00 H new ATOM 0 HB2 TYR A 51 14.885 15.464 -11.390 1.00 1.00 H new ATOM 0 HB3 TYR A 51 14.654 16.376 -9.911 1.00 1.00 H new ATOM 0 HD1 TYR A 51 14.932 16.605 -13.593 1.00 1.00 H new ATOM 0 HD2 TYR A 51 14.233 18.790 -9.958 1.00 1.00 H new ATOM 0 HE1 TYR A 51 14.107 18.538 -14.912 1.00 1.00 H new ATOM 0 HE2 TYR A 51 13.407 20.721 -11.277 1.00 1.00 H new ATOM 0 HH TYR A 51 12.980 21.552 -13.307 1.00 1.00 H new ATOM 357 N GLU A 52 17.122 15.891 -13.018 1.00 1.00 N ATOM 358 CA GLU A 52 17.731 16.098 -14.362 1.00 1.00 C ATOM 359 C GLU A 52 16.656 15.937 -15.439 1.00 1.00 C ATOM 360 O GLU A 52 16.533 16.750 -16.334 1.00 1.00 O ATOM 361 CB GLU A 52 18.836 15.063 -14.585 1.00 1.00 C ATOM 362 CG GLU A 52 19.826 15.114 -13.420 1.00 1.00 C ATOM 363 CD GLU A 52 20.639 13.819 -13.383 1.00 1.00 C ATOM 364 OE1 GLU A 52 20.224 12.863 -14.017 1.00 1.00 O ATOM 365 OE2 GLU A 52 21.664 13.805 -12.721 1.00 1.00 O ATOM 0 H GLU A 52 16.576 15.036 -12.916 1.00 1.00 H new ATOM 0 HA GLU A 52 18.155 17.101 -14.419 1.00 1.00 H new ATOM 0 HB2 GLU A 52 18.404 14.066 -14.665 1.00 1.00 H new ATOM 0 HB3 GLU A 52 19.352 15.263 -15.524 1.00 1.00 H new ATOM 0 HG2 GLU A 52 20.491 15.970 -13.532 1.00 1.00 H new ATOM 0 HG3 GLU A 52 19.291 15.247 -12.480 1.00 1.00 H new ATOM 366 N GLY A 53 15.875 14.895 -15.359 1.00 1.00 N ATOM 367 CA GLY A 53 14.809 14.683 -16.378 1.00 1.00 C ATOM 368 C GLY A 53 13.437 14.792 -15.710 1.00 1.00 C ATOM 369 O GLY A 53 13.275 15.460 -14.708 1.00 1.00 O ATOM 0 H GLY A 53 15.929 14.181 -14.632 1.00 1.00 H new ATOM 0 HA2 GLY A 53 14.898 15.423 -17.173 1.00 1.00 H new ATOM 0 HA3 GLY A 53 14.923 13.703 -16.841 1.00 1.00 H new ATOM 370 N ASN A 54 12.447 14.141 -16.255 1.00 1.00 N ATOM 371 CA ASN A 54 11.088 14.209 -15.648 1.00 1.00 C ATOM 372 C ASN A 54 11.165 13.797 -14.177 1.00 1.00 C ATOM 373 O ASN A 54 10.613 14.446 -13.311 1.00 1.00 O ATOM 374 CB ASN A 54 10.145 13.262 -16.395 1.00 1.00 C ATOM 375 CG ASN A 54 10.570 11.813 -16.147 1.00 1.00 C ATOM 376 OD1 ASN A 54 11.565 11.360 -16.677 1.00 1.00 O ATOM 377 ND2 ASN A 54 9.853 11.062 -15.356 1.00 1.00 N ATOM 0 H ASN A 54 12.520 13.565 -17.094 1.00 1.00 H new ATOM 0 HA ASN A 54 10.710 15.229 -15.721 1.00 1.00 H new ATOM 0 HB2 ASN A 54 9.119 13.413 -16.058 1.00 1.00 H new ATOM 0 HB3 ASN A 54 10.165 13.480 -17.463 1.00 1.00 H new ATOM 0 HD21 ASN A 54 10.128 10.095 -15.183 1.00 1.00 H new ATOM 0 HD22 ASN A 54 9.018 11.442 -14.911 1.00 1.00 H new ATOM 378 N GLY A 55 11.847 12.722 -13.887 1.00 1.00 N ATOM 379 CA GLY A 55 11.961 12.271 -12.471 1.00 1.00 C ATOM 380 C GLY A 55 10.907 11.197 -12.191 1.00 1.00 C ATOM 381 O GLY A 55 9.841 11.479 -11.682 1.00 1.00 O ATOM 0 H GLY A 55 12.330 12.137 -14.569 1.00 1.00 H new ATOM 0 HA2 GLY A 55 12.959 11.874 -12.284 1.00 1.00 H new ATOM 0 HA3 GLY A 55 11.823 13.116 -11.797 1.00 1.00 H new ATOM 382 N HIS A 56 11.198 9.968 -12.518 1.00 1.00 N ATOM 383 CA HIS A 56 10.212 8.878 -12.270 1.00 1.00 C ATOM 384 C HIS A 56 10.655 8.055 -11.058 1.00 1.00 C ATOM 385 O HIS A 56 9.879 7.784 -10.163 1.00 1.00 O ATOM 386 CB HIS A 56 10.133 7.972 -13.501 1.00 1.00 C ATOM 387 CG HIS A 56 8.692 7.715 -13.845 1.00 1.00 C ATOM 388 ND1 HIS A 56 7.929 6.771 -13.177 1.00 1.00 N ATOM 389 CD2 HIS A 56 7.861 8.270 -14.786 1.00 1.00 C ATOM 390 CE1 HIS A 56 6.698 6.785 -13.720 1.00 1.00 C ATOM 391 NE2 HIS A 56 6.602 7.681 -14.706 1.00 1.00 N ATOM 0 H HIS A 56 12.075 9.671 -12.946 1.00 1.00 H new ATOM 0 HA HIS A 56 9.231 9.312 -12.075 1.00 1.00 H new ATOM 0 HB2 HIS A 56 10.641 8.441 -14.344 1.00 1.00 H new ATOM 0 HB3 HIS A 56 10.645 7.030 -13.305 1.00 1.00 H new ATOM 0 HD1 HIS A 56 8.243 6.174 -12.412 1.00 1.00 H new ATOM 0 HD2 HIS A 56 8.141 9.046 -15.483 1.00 1.00 H new ATOM 0 HE1 HIS A 56 5.886 6.149 -13.398 1.00 1.00 H new ATOM 392 N PHE A 57 11.897 7.655 -11.022 1.00 1.00 N ATOM 393 CA PHE A 57 12.387 6.850 -9.865 1.00 1.00 C ATOM 394 C PHE A 57 13.562 7.574 -9.209 1.00 1.00 C ATOM 395 O PHE A 57 14.700 7.168 -9.334 1.00 1.00 O ATOM 396 CB PHE A 57 12.855 5.467 -10.340 1.00 1.00 C ATOM 397 CG PHE A 57 12.245 5.143 -11.682 1.00 1.00 C ATOM 398 CD1 PHE A 57 10.854 5.027 -11.810 1.00 1.00 C ATOM 399 CD2 PHE A 57 13.069 4.955 -12.800 1.00 1.00 C ATOM 400 CE1 PHE A 57 10.288 4.725 -13.055 1.00 1.00 C ATOM 401 CE2 PHE A 57 12.503 4.653 -14.045 1.00 1.00 C ATOM 402 CZ PHE A 57 11.112 4.538 -14.173 1.00 1.00 C ATOM 0 H PHE A 57 12.593 7.850 -11.742 1.00 1.00 H new ATOM 0 HA PHE A 57 11.574 6.727 -9.150 1.00 1.00 H new ATOM 0 HB2 PHE A 57 13.942 5.448 -10.413 1.00 1.00 H new ATOM 0 HB3 PHE A 57 12.571 4.709 -9.611 1.00 1.00 H new ATOM 0 HD1 PHE A 57 10.219 5.171 -10.949 1.00 1.00 H new ATOM 0 HD2 PHE A 57 14.141 5.043 -12.701 1.00 1.00 H new ATOM 0 HE1 PHE A 57 9.216 4.636 -13.153 1.00 1.00 H new ATOM 0 HE2 PHE A 57 13.138 4.509 -14.906 1.00 1.00 H new ATOM 0 HZ PHE A 57 10.675 4.305 -15.133 1.00 1.00 H new ATOM 403 N TYR A 58 13.300 8.643 -8.511 1.00 1.00 N ATOM 404 CA TYR A 58 14.410 9.384 -7.853 1.00 1.00 C ATOM 405 C TYR A 58 14.433 9.050 -6.360 1.00 1.00 C ATOM 406 O TYR A 58 15.481 8.874 -5.770 1.00 1.00 O ATOM 407 CB TYR A 58 14.202 10.889 -8.039 1.00 1.00 C ATOM 408 CG TYR A 58 15.335 11.638 -7.380 1.00 1.00 C ATOM 409 CD1 TYR A 58 16.646 11.154 -7.478 1.00 1.00 C ATOM 410 CD2 TYR A 58 15.074 12.817 -6.670 1.00 1.00 C ATOM 411 CE1 TYR A 58 17.697 11.849 -6.865 1.00 1.00 C ATOM 412 CE2 TYR A 58 16.125 13.513 -6.057 1.00 1.00 C ATOM 413 CZ TYR A 58 17.436 13.029 -6.155 1.00 1.00 C ATOM 414 OH TYR A 58 18.471 13.714 -5.552 1.00 1.00 O ATOM 0 H TYR A 58 12.369 9.034 -8.368 1.00 1.00 H new ATOM 0 HA TYR A 58 15.358 9.092 -8.304 1.00 1.00 H new ATOM 0 HB2 TYR A 58 14.159 11.133 -9.101 1.00 1.00 H new ATOM 0 HB3 TYR A 58 13.250 11.192 -7.604 1.00 1.00 H new ATOM 0 HD1 TYR A 58 16.847 10.245 -8.026 1.00 1.00 H new ATOM 0 HD2 TYR A 58 14.063 13.190 -6.595 1.00 1.00 H new ATOM 0 HE1 TYR A 58 18.708 11.476 -6.940 1.00 1.00 H new ATOM 0 HE2 TYR A 58 15.924 14.422 -5.509 1.00 1.00 H new ATOM 0 HH TYR A 58 18.118 14.510 -5.103 1.00 1.00 H new ATOM 415 N ARG A 59 13.286 8.959 -5.745 1.00 1.00 N ATOM 416 CA ARG A 59 13.242 8.634 -4.290 1.00 1.00 C ATOM 417 C ARG A 59 13.728 9.836 -3.477 1.00 1.00 C ATOM 418 O ARG A 59 13.869 9.764 -2.272 1.00 1.00 O ATOM 419 CB ARG A 59 14.143 7.429 -4.008 1.00 1.00 C ATOM 420 CG ARG A 59 13.911 6.354 -5.073 1.00 1.00 C ATOM 421 CD ARG A 59 12.689 5.516 -4.694 1.00 1.00 C ATOM 422 NE ARG A 59 13.131 4.303 -3.950 1.00 1.00 N ATOM 423 CZ ARG A 59 13.718 3.326 -4.586 1.00 1.00 C ATOM 424 NH1 ARG A 59 13.003 2.390 -5.148 1.00 1.00 N ATOM 425 NH2 ARG A 59 15.020 3.285 -4.659 1.00 1.00 N ATOM 0 H ARG A 59 12.377 9.096 -6.187 1.00 1.00 H new ATOM 0 HA ARG A 59 12.217 8.397 -4.005 1.00 1.00 H new ATOM 0 HB2 ARG A 59 15.189 7.736 -4.009 1.00 1.00 H new ATOM 0 HB3 ARG A 59 13.930 7.026 -3.018 1.00 1.00 H new ATOM 0 HG2 ARG A 59 13.759 6.819 -6.047 1.00 1.00 H new ATOM 0 HG3 ARG A 59 14.791 5.716 -5.159 1.00 1.00 H new ATOM 0 HD2 ARG A 59 12.007 6.104 -4.080 1.00 1.00 H new ATOM 0 HD3 ARG A 59 12.141 5.226 -5.591 1.00 1.00 H new ATOM 0 HE ARG A 59 12.975 4.236 -2.944 1.00 1.00 H new ATOM 0 HH11 ARG A 59 11.985 2.422 -5.090 1.00 1.00 H new ATOM 0 HH12 ARG A 59 13.462 1.627 -5.645 1.00 1.00 H new ATOM 0 HH21 ARG A 59 15.579 4.016 -4.219 1.00 1.00 H new ATOM 0 HH22 ARG A 59 15.479 2.522 -5.156 1.00 1.00 H new ATOM 426 N GLY A 60 13.985 10.941 -4.122 1.00 1.00 N ATOM 427 CA GLY A 60 14.459 12.143 -3.378 1.00 1.00 C ATOM 428 C GLY A 60 13.300 12.731 -2.571 1.00 1.00 C ATOM 429 O GLY A 60 12.313 12.071 -2.315 1.00 1.00 O ATOM 0 H GLY A 60 13.888 11.064 -5.130 1.00 1.00 H new ATOM 0 HA2 GLY A 60 15.279 11.873 -2.713 1.00 1.00 H new ATOM 0 HA3 GLY A 60 14.846 12.887 -4.075 1.00 1.00 H new ATOM 430 N LYS A 61 13.408 13.969 -2.170 1.00 1.00 N ATOM 431 CA LYS A 61 12.308 14.593 -1.381 1.00 1.00 C ATOM 432 C LYS A 61 11.438 15.453 -2.311 1.00 1.00 C ATOM 433 O LYS A 61 10.745 14.937 -3.165 1.00 1.00 O ATOM 434 CB LYS A 61 12.906 15.454 -0.265 1.00 1.00 C ATOM 435 CG LYS A 61 13.350 14.556 0.891 1.00 1.00 C ATOM 436 CD LYS A 61 12.470 14.825 2.113 1.00 1.00 C ATOM 437 CE LYS A 61 13.353 15.179 3.311 1.00 1.00 C ATOM 438 NZ LYS A 61 14.033 16.481 3.060 1.00 1.00 N ATOM 0 H LYS A 61 14.208 14.574 -2.354 1.00 1.00 H new ATOM 0 HA LYS A 61 11.687 13.817 -0.933 1.00 1.00 H new ATOM 0 HB2 LYS A 61 13.755 16.022 -0.645 1.00 1.00 H new ATOM 0 HB3 LYS A 61 12.170 16.177 0.085 1.00 1.00 H new ATOM 0 HG2 LYS A 61 13.277 13.508 0.600 1.00 1.00 H new ATOM 0 HG3 LYS A 61 14.395 14.747 1.133 1.00 1.00 H new ATOM 0 HD2 LYS A 61 11.779 15.641 1.904 1.00 1.00 H new ATOM 0 HD3 LYS A 61 11.866 13.946 2.340 1.00 1.00 H new ATOM 0 HE2 LYS A 61 12.749 15.241 4.216 1.00 1.00 H new ATOM 0 HE3 LYS A 61 14.093 14.396 3.475 1.00 1.00 H new ATOM 0 HZ1 LYS A 61 14.259 16.935 3.968 1.00 1.00 H new ATOM 0 HZ2 LYS A 61 14.911 16.317 2.527 1.00 1.00 H new ATOM 0 HZ3 LYS A 61 13.404 17.101 2.510 1.00 1.00 H new ATOM 439 N ALA A 62 11.465 16.756 -2.160 1.00 1.00 N ATOM 440 CA ALA A 62 10.635 17.627 -3.042 1.00 1.00 C ATOM 441 C ALA A 62 9.248 17.005 -3.217 1.00 1.00 C ATOM 442 O ALA A 62 8.711 16.957 -4.306 1.00 1.00 O ATOM 443 CB ALA A 62 11.310 17.761 -4.408 1.00 1.00 C ATOM 0 H ALA A 62 12.025 17.250 -1.465 1.00 1.00 H new ATOM 0 HA ALA A 62 10.535 18.613 -2.588 1.00 1.00 H new ATOM 0 HB1 ALA A 62 10.704 18.397 -5.053 1.00 1.00 H new ATOM 0 HB2 ALA A 62 12.297 18.206 -4.284 1.00 1.00 H new ATOM 0 HB3 ALA A 62 11.411 16.775 -4.862 1.00 1.00 H new ATOM 444 N SER A 63 8.666 16.523 -2.153 1.00 1.00 N ATOM 445 CA SER A 63 7.318 15.898 -2.261 1.00 1.00 C ATOM 446 C SER A 63 6.238 16.980 -2.228 1.00 1.00 C ATOM 447 O SER A 63 5.081 16.718 -2.488 1.00 1.00 O ATOM 448 CB SER A 63 7.108 14.938 -1.090 1.00 1.00 C ATOM 449 OG SER A 63 8.355 14.366 -0.722 1.00 1.00 O ATOM 0 H SER A 63 9.066 16.535 -1.215 1.00 1.00 H new ATOM 0 HA SER A 63 7.251 15.352 -3.202 1.00 1.00 H new ATOM 0 HB2 SER A 63 6.674 15.469 -0.243 1.00 1.00 H new ATOM 0 HB3 SER A 63 6.404 14.154 -1.369 1.00 1.00 H new ATOM 0 HG SER A 63 8.224 13.751 0.030 1.00 1.00 H new ATOM 450 N THR A 64 6.598 18.194 -1.910 1.00 1.00 N ATOM 451 CA THR A 64 5.574 19.274 -1.864 1.00 1.00 C ATOM 452 C THR A 64 4.974 19.464 -3.259 1.00 1.00 C ATOM 453 O THR A 64 5.335 18.783 -4.198 1.00 1.00 O ATOM 454 CB THR A 64 6.218 20.589 -1.408 1.00 1.00 C ATOM 455 OG1 THR A 64 7.410 20.812 -2.148 1.00 1.00 O ATOM 456 CG2 THR A 64 6.546 20.521 0.083 1.00 1.00 C ATOM 0 H THR A 64 7.549 18.482 -1.682 1.00 1.00 H new ATOM 0 HA THR A 64 4.792 18.994 -1.159 1.00 1.00 H new ATOM 0 HB THR A 64 5.521 21.409 -1.581 1.00 1.00 H new ATOM 0 HG1 THR A 64 7.822 21.653 -1.859 1.00 1.00 H new ATOM 0 HG21 THR A 64 7.003 21.459 0.398 1.00 1.00 H new ATOM 0 HG22 THR A 64 5.630 20.355 0.650 1.00 1.00 H new ATOM 0 HG23 THR A 64 7.239 19.700 0.266 1.00 1.00 H new ATOM 457 N ASP A 65 4.062 20.386 -3.403 1.00 1.00 N ATOM 458 CA ASP A 65 3.440 20.624 -4.740 1.00 1.00 C ATOM 459 C ASP A 65 4.077 21.864 -5.376 1.00 1.00 C ATOM 460 O ASP A 65 5.180 22.245 -5.038 1.00 1.00 O ATOM 461 CB ASP A 65 1.927 20.849 -4.595 1.00 1.00 C ATOM 462 CG ASP A 65 1.508 20.784 -3.122 1.00 1.00 C ATOM 463 OD1 ASP A 65 1.477 19.690 -2.583 1.00 1.00 O ATOM 464 OD2 ASP A 65 1.226 21.830 -2.562 1.00 1.00 O ATOM 0 H ASP A 65 3.719 20.986 -2.653 1.00 1.00 H new ATOM 0 HA ASP A 65 3.607 19.750 -5.370 1.00 1.00 H new ATOM 0 HB2 ASP A 65 1.657 21.819 -5.013 1.00 1.00 H new ATOM 0 HB3 ASP A 65 1.386 20.094 -5.166 1.00 1.00 H new ATOM 465 N THR A 66 3.392 22.504 -6.289 1.00 1.00 N ATOM 466 CA THR A 66 3.958 23.719 -6.936 1.00 1.00 C ATOM 467 C THR A 66 3.651 24.939 -6.066 1.00 1.00 C ATOM 468 O THR A 66 3.724 26.067 -6.513 1.00 1.00 O ATOM 469 CB THR A 66 3.325 23.906 -8.317 1.00 1.00 C ATOM 470 OG1 THR A 66 2.186 23.065 -8.432 1.00 1.00 O ATOM 471 CG2 THR A 66 4.340 23.543 -9.402 1.00 1.00 C ATOM 0 H THR A 66 2.463 22.234 -6.613 1.00 1.00 H new ATOM 0 HA THR A 66 5.037 23.607 -7.046 1.00 1.00 H new ATOM 0 HB THR A 66 3.024 24.946 -8.439 1.00 1.00 H new ATOM 0 HG1 THR A 66 1.873 23.063 -9.361 1.00 1.00 H new ATOM 0 HG21 THR A 66 3.886 23.677 -10.384 1.00 1.00 H new ATOM 0 HG22 THR A 66 5.213 24.189 -9.314 1.00 1.00 H new ATOM 0 HG23 THR A 66 4.645 22.503 -9.282 1.00 1.00 H new ATOM 472 N MET A 67 3.315 24.723 -4.824 1.00 1.00 N ATOM 473 CA MET A 67 3.012 25.862 -3.926 1.00 1.00 C ATOM 474 C MET A 67 3.899 25.744 -2.690 1.00 1.00 C ATOM 475 O MET A 67 4.424 26.717 -2.187 1.00 1.00 O ATOM 476 CB MET A 67 1.539 25.819 -3.515 1.00 1.00 C ATOM 477 CG MET A 67 0.748 26.827 -4.350 1.00 1.00 C ATOM 478 SD MET A 67 -0.703 26.014 -5.064 1.00 1.00 S ATOM 479 CE MET A 67 0.148 25.202 -6.439 1.00 1.00 C ATOM 0 H MET A 67 3.238 23.801 -4.395 1.00 1.00 H new ATOM 0 HA MET A 67 3.203 26.806 -4.436 1.00 1.00 H new ATOM 0 HB2 MET A 67 1.139 24.816 -3.661 1.00 1.00 H new ATOM 0 HB3 MET A 67 1.439 26.051 -2.455 1.00 1.00 H new ATOM 0 HG2 MET A 67 0.438 27.667 -3.728 1.00 1.00 H new ATOM 0 HG3 MET A 67 1.377 27.232 -5.142 1.00 1.00 H new ATOM 0 HE1 MET A 67 -0.587 24.827 -7.151 1.00 1.00 H new ATOM 0 HE2 MET A 67 0.802 25.918 -6.936 1.00 1.00 H new ATOM 0 HE3 MET A 67 0.742 24.371 -6.059 1.00 1.00 H new ATOM 480 N GLY A 68 4.082 24.544 -2.212 1.00 1.00 N ATOM 481 CA GLY A 68 4.948 24.334 -1.023 1.00 1.00 C ATOM 482 C GLY A 68 4.338 23.267 -0.117 1.00 1.00 C ATOM 483 O GLY A 68 5.042 22.541 0.554 1.00 1.00 O ATOM 0 H GLY A 68 3.665 23.697 -2.598 1.00 1.00 H new ATOM 0 HA2 GLY A 68 5.946 24.028 -1.338 1.00 1.00 H new ATOM 0 HA3 GLY A 68 5.060 25.269 -0.474 1.00 1.00 H new ATOM 484 N ARG A 69 3.039 23.155 -0.091 1.00 1.00 N ATOM 485 CA ARG A 69 2.422 22.115 0.777 1.00 1.00 C ATOM 486 C ARG A 69 3.138 20.794 0.513 1.00 1.00 C ATOM 487 O ARG A 69 3.645 20.583 -0.567 1.00 1.00 O ATOM 488 CB ARG A 69 0.938 21.940 0.442 1.00 1.00 C ATOM 489 CG ARG A 69 0.225 23.292 0.438 1.00 1.00 C ATOM 490 CD ARG A 69 -0.811 23.302 -0.686 1.00 1.00 C ATOM 491 NE ARG A 69 -1.364 24.677 -0.840 1.00 1.00 N ATOM 492 CZ ARG A 69 -2.286 24.915 -1.732 1.00 1.00 C ATOM 493 NH1 ARG A 69 -3.486 24.429 -1.577 1.00 1.00 N ATOM 494 NH2 ARG A 69 -2.006 25.641 -2.780 1.00 1.00 N ATOM 0 H ARG A 69 2.387 23.729 -0.625 1.00 1.00 H new ATOM 0 HA ARG A 69 2.513 22.416 1.821 1.00 1.00 H new ATOM 0 HB2 ARG A 69 0.833 21.465 -0.533 1.00 1.00 H new ATOM 0 HB3 ARG A 69 0.470 21.278 1.171 1.00 1.00 H new ATOM 0 HG2 ARG A 69 -0.260 23.465 1.399 1.00 1.00 H new ATOM 0 HG3 ARG A 69 0.945 24.098 0.294 1.00 1.00 H new ATOM 0 HD2 ARG A 69 -0.353 22.976 -1.620 1.00 1.00 H new ATOM 0 HD3 ARG A 69 -1.613 22.599 -0.462 1.00 1.00 H new ATOM 0 HE ARG A 69 -1.021 25.433 -0.247 1.00 1.00 H new ATOM 0 HH11 ARG A 69 -3.705 23.862 -0.758 1.00 1.00 H new ATOM 0 HH12 ARG A 69 -4.206 24.616 -2.275 1.00 1.00 H new ATOM 0 HH21 ARG A 69 -1.067 26.021 -2.901 1.00 1.00 H new ATOM 0 HH22 ARG A 69 -2.726 25.828 -3.478 1.00 1.00 H new ATOM 495 N PRO A 70 3.150 19.939 1.499 1.00 1.00 N ATOM 496 CA PRO A 70 3.787 18.639 1.373 1.00 1.00 C ATOM 497 C PRO A 70 2.933 17.719 0.492 1.00 1.00 C ATOM 498 O PRO A 70 3.271 16.575 0.262 1.00 1.00 O ATOM 499 CB PRO A 70 3.854 18.111 2.799 1.00 1.00 C ATOM 500 CG PRO A 70 2.673 18.840 3.515 1.00 1.00 C ATOM 501 CD PRO A 70 2.532 20.217 2.803 1.00 1.00 C ATOM 0 HA PRO A 70 4.771 18.693 0.908 1.00 1.00 H new ATOM 0 HB2 PRO A 70 3.736 17.028 2.832 1.00 1.00 H new ATOM 0 HB3 PRO A 70 4.811 18.341 3.268 1.00 1.00 H new ATOM 0 HG2 PRO A 70 1.752 18.263 3.436 1.00 1.00 H new ATOM 0 HG3 PRO A 70 2.879 18.968 4.578 1.00 1.00 H new ATOM 0 HD2 PRO A 70 1.491 20.524 2.706 1.00 1.00 H new ATOM 0 HD3 PRO A 70 3.049 21.011 3.341 1.00 1.00 H new ATOM 502 N CYS A 71 1.827 18.211 -0.001 1.00 1.00 N ATOM 503 CA CYS A 71 0.951 17.369 -0.861 1.00 1.00 C ATOM 504 C CYS A 71 0.311 16.274 -0.001 1.00 1.00 C ATOM 505 O CYS A 71 0.884 15.824 0.970 1.00 1.00 O ATOM 506 CB CYS A 71 1.788 16.738 -1.979 1.00 1.00 C ATOM 507 SG CYS A 71 1.758 14.935 -1.828 1.00 1.00 S ATOM 0 H CYS A 71 1.494 19.162 0.156 1.00 1.00 H new ATOM 0 HA CYS A 71 0.168 17.981 -1.308 1.00 1.00 H new ATOM 0 HB2 CYS A 71 1.396 17.037 -2.951 1.00 1.00 H new ATOM 0 HB3 CYS A 71 2.815 17.099 -1.924 1.00 1.00 H new ATOM 508 N LEU A 72 -0.876 15.848 -0.342 1.00 1.00 N ATOM 509 CA LEU A 72 -1.547 14.792 0.469 1.00 1.00 C ATOM 510 C LEU A 72 -0.888 13.437 0.196 1.00 1.00 C ATOM 511 O LEU A 72 -0.497 13.157 -0.920 1.00 1.00 O ATOM 512 CB LEU A 72 -3.027 14.706 0.084 1.00 1.00 C ATOM 513 CG LEU A 72 -3.688 16.075 0.245 1.00 1.00 C ATOM 514 CD1 LEU A 72 -4.762 16.252 -0.830 1.00 1.00 C ATOM 515 CD2 LEU A 72 -4.340 16.164 1.626 1.00 1.00 C ATOM 0 H LEU A 72 -1.408 16.185 -1.144 1.00 1.00 H new ATOM 0 HA LEU A 72 -1.454 15.045 1.525 1.00 1.00 H new ATOM 0 HB2 LEU A 72 -3.124 14.365 -0.947 1.00 1.00 H new ATOM 0 HB3 LEU A 72 -3.533 13.972 0.712 1.00 1.00 H new ATOM 0 HG LEU A 72 -2.935 16.856 0.142 1.00 1.00 H new ATOM 0 HD11 LEU A 72 -5.234 17.228 -0.716 1.00 1.00 H new ATOM 0 HD12 LEU A 72 -4.304 16.184 -1.817 1.00 1.00 H new ATOM 0 HD13 LEU A 72 -5.515 15.471 -0.725 1.00 1.00 H new ATOM 0 HD21 LEU A 72 -4.812 17.139 1.743 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -5.093 15.382 1.724 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -3.580 16.034 2.396 1.00 1.00 H new ATOM 516 N PRO A 73 -0.798 12.627 1.222 1.00 1.00 N ATOM 517 CA PRO A 73 -0.212 11.305 1.100 1.00 1.00 C ATOM 518 C PRO A 73 -1.175 10.391 0.344 1.00 1.00 C ATOM 519 O PRO A 73 -2.362 10.405 0.581 1.00 1.00 O ATOM 520 CB PRO A 73 -0.034 10.826 2.534 1.00 1.00 C ATOM 521 CG PRO A 73 -1.117 11.629 3.322 1.00 1.00 C ATOM 522 CD PRO A 73 -1.273 12.982 2.568 1.00 1.00 C ATOM 0 HA PRO A 73 0.731 11.307 0.554 1.00 1.00 H new ATOM 0 HB2 PRO A 73 -0.189 9.751 2.620 1.00 1.00 H new ATOM 0 HB3 PRO A 73 0.969 11.034 2.905 1.00 1.00 H new ATOM 0 HG2 PRO A 73 -2.062 11.086 3.351 1.00 1.00 H new ATOM 0 HG3 PRO A 73 -0.810 11.790 4.355 1.00 1.00 H new ATOM 0 HD2 PRO A 73 -2.306 13.330 2.560 1.00 1.00 H new ATOM 0 HD3 PRO A 73 -0.674 13.774 3.018 1.00 1.00 H new ATOM 523 N TRP A 74 -0.680 9.604 -0.565 1.00 1.00 N ATOM 524 CA TRP A 74 -1.579 8.699 -1.336 1.00 1.00 C ATOM 525 C TRP A 74 -2.539 7.976 -0.382 1.00 1.00 C ATOM 526 O TRP A 74 -3.597 7.531 -0.779 1.00 1.00 O ATOM 527 CB TRP A 74 -0.735 7.677 -2.107 1.00 1.00 C ATOM 528 CG TRP A 74 0.440 8.371 -2.722 1.00 1.00 C ATOM 529 CD1 TRP A 74 1.676 8.449 -2.174 1.00 1.00 C ATOM 530 CD2 TRP A 74 0.510 9.087 -3.989 1.00 1.00 C ATOM 531 NE1 TRP A 74 2.495 9.178 -3.018 1.00 1.00 N ATOM 532 CE2 TRP A 74 1.823 9.591 -4.151 1.00 1.00 C ATOM 533 CE3 TRP A 74 -0.431 9.347 -5.003 1.00 1.00 C ATOM 534 CZ2 TRP A 74 2.186 10.331 -5.279 1.00 1.00 C ATOM 535 CZ3 TRP A 74 -0.069 10.088 -6.140 1.00 1.00 C ATOM 536 CH2 TRP A 74 1.238 10.581 -6.276 1.00 1.00 C ATOM 0 H TRP A 74 0.309 9.546 -0.810 1.00 1.00 H new ATOM 0 HA TRP A 74 -2.165 9.288 -2.042 1.00 1.00 H new ATOM 0 HB2 TRP A 74 -0.396 6.888 -1.436 1.00 1.00 H new ATOM 0 HB3 TRP A 74 -1.337 7.201 -2.881 1.00 1.00 H new ATOM 0 HD1 TRP A 74 1.974 8.013 -1.232 1.00 1.00 H new ATOM 0 HE1 TRP A 74 3.475 9.385 -2.826 1.00 1.00 H new ATOM 0 HE3 TRP A 74 -1.440 8.974 -4.906 1.00 1.00 H new ATOM 0 HZ2 TRP A 74 3.193 10.708 -5.380 1.00 1.00 H new ATOM 0 HZ3 TRP A 74 -0.799 10.279 -6.912 1.00 1.00 H new ATOM 0 HH2 TRP A 74 1.511 11.153 -7.150 1.00 1.00 H new ATOM 537 N ASN A 75 -2.189 7.854 0.872 1.00 1.00 N ATOM 538 CA ASN A 75 -3.099 7.153 1.828 1.00 1.00 C ATOM 539 C ASN A 75 -4.288 8.055 2.185 1.00 1.00 C ATOM 540 O ASN A 75 -5.408 7.595 2.281 1.00 1.00 O ATOM 541 CB ASN A 75 -2.327 6.782 3.098 1.00 1.00 C ATOM 542 CG ASN A 75 -2.137 8.023 3.975 1.00 1.00 C ATOM 543 OD1 ASN A 75 -1.044 8.541 4.086 1.00 1.00 O ATOM 544 ND2 ASN A 75 -3.162 8.520 4.610 1.00 1.00 N ATOM 0 H ASN A 75 -1.320 8.206 1.274 1.00 1.00 H new ATOM 0 HA ASN A 75 -3.476 6.245 1.358 1.00 1.00 H new ATOM 0 HB2 ASN A 75 -2.868 6.014 3.651 1.00 1.00 H new ATOM 0 HB3 ASN A 75 -1.357 6.361 2.834 1.00 1.00 H new ATOM 0 HD21 ASN A 75 -3.046 9.344 5.200 1.00 1.00 H new ATOM 0 HD22 ASN A 75 -4.080 8.085 4.517 1.00 1.00 H new ATOM 545 N SER A 76 -4.046 9.328 2.384 1.00 1.00 N ATOM 546 CA SER A 76 -5.141 10.278 2.733 1.00 1.00 C ATOM 547 C SER A 76 -6.419 9.865 2.015 1.00 1.00 C ATOM 548 O SER A 76 -6.570 10.059 0.830 1.00 1.00 O ATOM 549 CB SER A 76 -4.748 11.691 2.302 1.00 1.00 C ATOM 550 OG SER A 76 -5.925 12.458 2.080 1.00 1.00 O ATOM 0 H SER A 76 -3.121 9.752 2.318 1.00 1.00 H new ATOM 0 HA SER A 76 -5.307 10.261 3.810 1.00 1.00 H new ATOM 0 HB2 SER A 76 -4.133 12.160 3.070 1.00 1.00 H new ATOM 0 HB3 SER A 76 -4.148 11.653 1.393 1.00 1.00 H new ATOM 0 HG SER A 76 -5.711 13.230 1.516 1.00 1.00 H new ATOM 551 N ALA A 77 -7.317 9.274 2.743 1.00 1.00 N ATOM 552 CA ALA A 77 -8.606 8.787 2.154 1.00 1.00 C ATOM 553 C ALA A 77 -9.063 9.688 1.000 1.00 1.00 C ATOM 554 O ALA A 77 -9.642 9.222 0.038 1.00 1.00 O ATOM 555 CB ALA A 77 -9.681 8.784 3.242 1.00 1.00 C ATOM 0 H ALA A 77 -7.217 9.101 3.743 1.00 1.00 H new ATOM 0 HA ALA A 77 -8.451 7.781 1.765 1.00 1.00 H new ATOM 0 HB1 ALA A 77 -10.623 8.431 2.822 1.00 1.00 H new ATOM 0 HB2 ALA A 77 -9.375 8.124 4.054 1.00 1.00 H new ATOM 0 HB3 ALA A 77 -9.812 9.795 3.627 1.00 1.00 H new ATOM 556 N THR A 78 -8.807 10.964 1.072 1.00 1.00 N ATOM 557 CA THR A 78 -9.232 11.862 -0.041 1.00 1.00 C ATOM 558 C THR A 78 -8.583 11.391 -1.342 1.00 1.00 C ATOM 559 O THR A 78 -9.255 11.031 -2.289 1.00 1.00 O ATOM 560 CB THR A 78 -8.781 13.293 0.254 1.00 1.00 C ATOM 561 OG1 THR A 78 -8.664 13.470 1.659 1.00 1.00 O ATOM 562 CG2 THR A 78 -9.806 14.280 -0.305 1.00 1.00 C ATOM 0 H THR A 78 -8.326 11.423 1.846 1.00 1.00 H new ATOM 0 HA THR A 78 -10.318 11.834 -0.136 1.00 1.00 H new ATOM 0 HB THR A 78 -7.815 13.474 -0.217 1.00 1.00 H new ATOM 0 HG1 THR A 78 -7.754 13.242 1.943 1.00 1.00 H new ATOM 0 HG21 THR A 78 -9.483 15.299 -0.094 1.00 1.00 H new ATOM 0 HG22 THR A 78 -9.893 14.143 -1.383 1.00 1.00 H new ATOM 0 HG23 THR A 78 -10.775 14.102 0.162 1.00 1.00 H new ATOM 563 N VAL A 79 -7.281 11.386 -1.395 1.00 1.00 N ATOM 564 CA VAL A 79 -6.592 10.935 -2.619 1.00 1.00 C ATOM 565 C VAL A 79 -6.909 9.452 -2.837 1.00 1.00 C ATOM 566 O VAL A 79 -7.178 9.022 -3.941 1.00 1.00 O ATOM 567 CB VAL A 79 -5.087 11.159 -2.445 1.00 1.00 C ATOM 568 CG1 VAL A 79 -4.653 10.821 -1.019 1.00 1.00 C ATOM 569 CG2 VAL A 79 -4.326 10.273 -3.408 1.00 1.00 C ATOM 0 H VAL A 79 -6.667 11.678 -0.635 1.00 1.00 H new ATOM 0 HA VAL A 79 -6.928 11.497 -3.491 1.00 1.00 H new ATOM 0 HB VAL A 79 -4.871 12.208 -2.647 1.00 1.00 H new ATOM 0 HG11 VAL A 79 -3.581 10.987 -0.916 1.00 1.00 H new ATOM 0 HG12 VAL A 79 -5.188 11.459 -0.315 1.00 1.00 H new ATOM 0 HG13 VAL A 79 -4.881 9.776 -0.807 1.00 1.00 H new ATOM 0 HG21 VAL A 79 -3.255 10.434 -3.282 1.00 1.00 H new ATOM 0 HG22 VAL A 79 -4.562 9.228 -3.205 1.00 1.00 H new ATOM 0 HG23 VAL A 79 -4.612 10.518 -4.431 1.00 1.00 H new ATOM 570 N LEU A 80 -6.913 8.674 -1.788 1.00 1.00 N ATOM 571 CA LEU A 80 -7.250 7.234 -1.936 1.00 1.00 C ATOM 572 C LEU A 80 -8.536 7.142 -2.753 1.00 1.00 C ATOM 573 O LEU A 80 -8.804 6.162 -3.418 1.00 1.00 O ATOM 574 CB LEU A 80 -7.468 6.610 -0.556 1.00 1.00 C ATOM 575 CG LEU A 80 -6.225 5.815 -0.151 1.00 1.00 C ATOM 576 CD1 LEU A 80 -6.507 5.050 1.143 1.00 1.00 C ATOM 577 CD2 LEU A 80 -5.869 4.823 -1.262 1.00 1.00 C ATOM 0 H LEU A 80 -6.697 8.975 -0.838 1.00 1.00 H new ATOM 0 HA LEU A 80 -6.441 6.700 -2.434 1.00 1.00 H new ATOM 0 HB2 LEU A 80 -7.669 7.389 0.179 1.00 1.00 H new ATOM 0 HB3 LEU A 80 -8.340 5.956 -0.575 1.00 1.00 H new ATOM 0 HG LEU A 80 -5.392 6.500 0.006 1.00 1.00 H new ATOM 0 HD11 LEU A 80 -5.621 4.484 1.431 1.00 1.00 H new ATOM 0 HD12 LEU A 80 -6.760 5.755 1.935 1.00 1.00 H new ATOM 0 HD13 LEU A 80 -7.340 4.365 0.987 1.00 1.00 H new ATOM 0 HD21 LEU A 80 -4.984 4.256 -0.974 1.00 1.00 H new ATOM 0 HD22 LEU A 80 -6.702 4.138 -1.419 1.00 1.00 H new ATOM 0 HD23 LEU A 80 -5.667 5.367 -2.185 1.00 1.00 H new ATOM 578 N GLN A 81 -9.325 8.180 -2.705 1.00 1.00 N ATOM 579 CA GLN A 81 -10.598 8.208 -3.472 1.00 1.00 C ATOM 580 C GLN A 81 -10.299 8.599 -4.922 1.00 1.00 C ATOM 581 O GLN A 81 -10.849 8.049 -5.855 1.00 1.00 O ATOM 582 CB GLN A 81 -11.528 9.248 -2.845 1.00 1.00 C ATOM 583 CG GLN A 81 -12.883 8.608 -2.551 1.00 1.00 C ATOM 584 CD GLN A 81 -13.998 9.476 -3.136 1.00 1.00 C ATOM 585 OE1 GLN A 81 -14.494 9.204 -4.212 1.00 1.00 O ATOM 586 NE2 GLN A 81 -14.417 10.517 -2.470 1.00 1.00 N ATOM 0 H GLN A 81 -9.137 9.021 -2.159 1.00 1.00 H new ATOM 0 HA GLN A 81 -11.073 7.227 -3.449 1.00 1.00 H new ATOM 0 HB2 GLN A 81 -11.090 9.636 -1.925 1.00 1.00 H new ATOM 0 HB3 GLN A 81 -11.652 10.094 -3.520 1.00 1.00 H new ATOM 0 HG2 GLN A 81 -12.924 7.607 -2.980 1.00 1.00 H new ATOM 0 HG3 GLN A 81 -13.019 8.499 -1.475 1.00 1.00 H new ATOM 0 HE21 GLN A 81 -14.001 10.746 -1.567 1.00 1.00 H new ATOM 0 HE22 GLN A 81 -15.160 11.102 -2.852 1.00 1.00 H new ATOM 587 N GLN A 82 -9.427 9.554 -5.111 1.00 1.00 N ATOM 588 CA GLN A 82 -9.077 10.001 -6.491 1.00 1.00 C ATOM 589 C GLN A 82 -8.491 8.830 -7.289 1.00 1.00 C ATOM 590 O GLN A 82 -8.884 7.693 -7.119 1.00 1.00 O ATOM 591 CB GLN A 82 -8.046 11.129 -6.400 1.00 1.00 C ATOM 592 CG GLN A 82 -8.572 12.224 -5.470 1.00 1.00 C ATOM 593 CD GLN A 82 -9.067 13.408 -6.303 1.00 1.00 C ATOM 594 OE1 GLN A 82 -8.278 14.151 -6.852 1.00 1.00 O ATOM 595 NE2 GLN A 82 -10.350 13.615 -6.421 1.00 1.00 N ATOM 0 H GLN A 82 -8.939 10.047 -4.363 1.00 1.00 H new ATOM 0 HA GLN A 82 -9.974 10.357 -6.998 1.00 1.00 H new ATOM 0 HB2 GLN A 82 -7.099 10.742 -6.025 1.00 1.00 H new ATOM 0 HB3 GLN A 82 -7.852 11.540 -7.391 1.00 1.00 H new ATOM 0 HG2 GLN A 82 -9.383 11.834 -4.855 1.00 1.00 H new ATOM 0 HG3 GLN A 82 -7.784 12.548 -4.791 1.00 1.00 H new ATOM 0 HE21 GLN A 82 -11.012 12.991 -5.960 1.00 1.00 H new ATOM 0 HE22 GLN A 82 -10.691 14.401 -6.974 1.00 1.00 H new ATOM 596 N THR A 83 -7.556 9.101 -8.163 1.00 1.00 N ATOM 597 CA THR A 83 -6.947 8.006 -8.974 1.00 1.00 C ATOM 598 C THR A 83 -5.617 7.578 -8.334 1.00 1.00 C ATOM 599 O THR A 83 -5.602 6.978 -7.278 1.00 1.00 O ATOM 600 CB THR A 83 -6.708 8.503 -10.403 1.00 1.00 C ATOM 601 OG1 THR A 83 -7.943 8.918 -10.970 1.00 1.00 O ATOM 602 CG2 THR A 83 -6.111 7.375 -11.245 1.00 1.00 C ATOM 0 H THR A 83 -7.188 10.034 -8.350 1.00 1.00 H new ATOM 0 HA THR A 83 -7.621 7.150 -9.004 1.00 1.00 H new ATOM 0 HB THR A 83 -6.015 9.344 -10.385 1.00 1.00 H new ATOM 0 HG1 THR A 83 -7.792 9.238 -11.884 1.00 1.00 H new ATOM 0 HG21 THR A 83 -5.942 7.730 -12.261 1.00 1.00 H new ATOM 0 HG22 THR A 83 -5.164 7.058 -10.809 1.00 1.00 H new ATOM 0 HG23 THR A 83 -6.801 6.532 -11.266 1.00 1.00 H new ATOM 603 N TYR A 84 -4.500 7.883 -8.950 1.00 1.00 N ATOM 604 CA TYR A 84 -3.194 7.489 -8.348 1.00 1.00 C ATOM 605 C TYR A 84 -3.204 7.870 -6.870 1.00 1.00 C ATOM 606 O TYR A 84 -2.952 9.001 -6.505 1.00 1.00 O ATOM 607 CB TYR A 84 -2.058 8.214 -9.072 1.00 1.00 C ATOM 608 CG TYR A 84 -1.863 7.594 -10.435 1.00 1.00 C ATOM 609 CD1 TYR A 84 -1.636 6.217 -10.553 1.00 1.00 C ATOM 610 CD2 TYR A 84 -1.911 8.397 -11.583 1.00 1.00 C ATOM 611 CE1 TYR A 84 -1.457 5.642 -11.819 1.00 1.00 C ATOM 612 CE2 TYR A 84 -1.732 7.822 -12.848 1.00 1.00 C ATOM 613 CZ TYR A 84 -1.504 6.445 -12.966 1.00 1.00 C ATOM 614 OH TYR A 84 -1.327 5.879 -14.212 1.00 1.00 O ATOM 0 H TYR A 84 -4.439 8.384 -9.836 1.00 1.00 H new ATOM 0 HA TYR A 84 -3.042 6.414 -8.447 1.00 1.00 H new ATOM 0 HB2 TYR A 84 -2.292 9.274 -9.171 1.00 1.00 H new ATOM 0 HB3 TYR A 84 -1.138 8.144 -8.492 1.00 1.00 H new ATOM 0 HD1 TYR A 84 -1.599 5.598 -9.669 1.00 1.00 H new ATOM 0 HD2 TYR A 84 -2.086 9.459 -11.492 1.00 1.00 H new ATOM 0 HE1 TYR A 84 -1.283 4.580 -11.910 1.00 1.00 H new ATOM 0 HE2 TYR A 84 -1.770 8.441 -13.732 1.00 1.00 H new ATOM 0 HH TYR A 84 -0.535 6.268 -14.638 1.00 1.00 H new ATOM 615 N HIS A 85 -3.530 6.937 -6.020 1.00 1.00 N ATOM 616 CA HIS A 85 -3.600 7.247 -4.566 1.00 1.00 C ATOM 617 C HIS A 85 -3.140 6.046 -3.737 1.00 1.00 C ATOM 618 O HIS A 85 -3.224 6.064 -2.527 1.00 1.00 O ATOM 619 CB HIS A 85 -5.051 7.552 -4.227 1.00 1.00 C ATOM 620 CG HIS A 85 -5.882 6.348 -4.573 1.00 1.00 C ATOM 621 ND1 HIS A 85 -7.049 6.434 -5.312 1.00 1.00 N ATOM 622 CD2 HIS A 85 -5.725 5.020 -4.277 1.00 1.00 C ATOM 623 CE1 HIS A 85 -7.543 5.186 -5.431 1.00 1.00 C ATOM 624 NE2 HIS A 85 -6.773 4.288 -4.820 1.00 1.00 N ATOM 0 H HIS A 85 -3.751 5.973 -6.270 1.00 1.00 H new ATOM 0 HA HIS A 85 -2.952 8.094 -4.339 1.00 1.00 H new ATOM 0 HB2 HIS A 85 -5.151 7.790 -3.168 1.00 1.00 H new ATOM 0 HB3 HIS A 85 -5.396 8.423 -4.784 1.00 1.00 H new ATOM 0 HD1 HIS A 85 -7.459 7.285 -5.696 1.00 1.00 H new ATOM 0 HD2 HIS A 85 -4.908 4.604 -3.706 1.00 1.00 H new ATOM 0 HE1 HIS A 85 -8.454 4.943 -5.958 1.00 1.00 H new ATOM 625 N ALA A 86 -2.668 5.007 -4.378 1.00 1.00 N ATOM 626 CA ALA A 86 -2.199 3.790 -3.641 1.00 1.00 C ATOM 627 C ALA A 86 -3.355 2.795 -3.472 1.00 1.00 C ATOM 628 O ALA A 86 -3.457 2.120 -2.468 1.00 1.00 O ATOM 629 CB ALA A 86 -1.650 4.180 -2.264 1.00 1.00 C ATOM 0 H ALA A 86 -2.586 4.948 -5.393 1.00 1.00 H new ATOM 0 HA ALA A 86 -1.404 3.320 -4.221 1.00 1.00 H new ATOM 0 HB1 ALA A 86 -1.313 3.286 -1.740 1.00 1.00 H new ATOM 0 HB2 ALA A 86 -0.812 4.866 -2.387 1.00 1.00 H new ATOM 0 HB3 ALA A 86 -2.434 4.666 -1.684 1.00 1.00 H new ATOM 630 N HIS A 87 -4.215 2.688 -4.452 1.00 1.00 N ATOM 631 CA HIS A 87 -5.354 1.721 -4.356 1.00 1.00 C ATOM 632 C HIS A 87 -6.092 1.666 -5.696 1.00 1.00 C ATOM 633 O HIS A 87 -7.275 1.395 -5.750 1.00 1.00 O ATOM 634 CB HIS A 87 -6.337 2.154 -3.262 1.00 1.00 C ATOM 635 CG HIS A 87 -6.137 1.303 -2.038 1.00 1.00 C ATOM 636 ND1 HIS A 87 -7.014 1.336 -0.964 1.00 1.00 N ATOM 637 CD2 HIS A 87 -5.170 0.388 -1.703 1.00 1.00 C ATOM 638 CE1 HIS A 87 -6.561 0.466 -0.044 1.00 1.00 C ATOM 639 NE2 HIS A 87 -5.439 -0.139 -0.443 1.00 1.00 N ATOM 0 H HIS A 87 -4.179 3.228 -5.316 1.00 1.00 H new ATOM 0 HA HIS A 87 -4.955 0.738 -4.107 1.00 1.00 H new ATOM 0 HB2 HIS A 87 -6.183 3.205 -3.016 1.00 1.00 H new ATOM 0 HB3 HIS A 87 -7.362 2.058 -3.621 1.00 1.00 H new ATOM 0 HD2 HIS A 87 -4.328 0.118 -2.323 1.00 1.00 H new ATOM 0 HE1 HIS A 87 -7.046 0.279 0.903 1.00 1.00 H new ATOM 0 HE2 HIS A 87 -4.896 -0.837 0.066 1.00 1.00 H new ATOM 640 N ARG A 88 -5.407 1.920 -6.778 1.00 1.00 N ATOM 641 CA ARG A 88 -6.078 1.878 -8.108 1.00 1.00 C ATOM 642 C ARG A 88 -5.532 0.696 -8.915 1.00 1.00 C ATOM 643 O ARG A 88 -4.919 -0.203 -8.375 1.00 1.00 O ATOM 644 CB ARG A 88 -5.810 3.187 -8.856 1.00 1.00 C ATOM 645 CG ARG A 88 -4.304 3.453 -8.900 1.00 1.00 C ATOM 646 CD ARG A 88 -3.969 4.327 -10.111 1.00 1.00 C ATOM 647 NE ARG A 88 -4.726 3.846 -11.301 1.00 1.00 N ATOM 648 CZ ARG A 88 -5.463 4.676 -11.987 1.00 1.00 C ATOM 649 NH1 ARG A 88 -4.909 5.470 -12.861 1.00 1.00 N ATOM 650 NH2 ARG A 88 -6.753 4.713 -11.796 1.00 1.00 N ATOM 0 H ARG A 88 -4.414 2.154 -6.798 1.00 1.00 H new ATOM 0 HA ARG A 88 -7.153 1.756 -7.974 1.00 1.00 H new ATOM 0 HB2 ARG A 88 -6.209 3.127 -9.869 1.00 1.00 H new ATOM 0 HB3 ARG A 88 -6.321 4.012 -8.360 1.00 1.00 H new ATOM 0 HG2 ARG A 88 -3.986 3.948 -7.983 1.00 1.00 H new ATOM 0 HG3 ARG A 88 -3.760 2.510 -8.958 1.00 1.00 H new ATOM 0 HD2 ARG A 88 -4.222 5.367 -9.903 1.00 1.00 H new ATOM 0 HD3 ARG A 88 -2.898 4.293 -10.311 1.00 1.00 H new ATOM 0 HE ARG A 88 -4.668 2.867 -11.580 1.00 1.00 H new ATOM 0 HH11 ARG A 88 -3.900 5.442 -13.008 1.00 1.00 H new ATOM 0 HH12 ARG A 88 -5.485 6.119 -13.397 1.00 1.00 H new ATOM 0 HH21 ARG A 88 -7.185 4.093 -11.111 1.00 1.00 H new ATOM 0 HH22 ARG A 88 -7.330 5.362 -12.332 1.00 1.00 H new ATOM 651 N SER A 89 -5.754 0.683 -10.202 1.00 1.00 N ATOM 652 CA SER A 89 -5.252 -0.449 -11.031 1.00 1.00 C ATOM 653 C SER A 89 -3.945 -0.050 -11.723 1.00 1.00 C ATOM 654 O SER A 89 -3.468 -0.732 -12.608 1.00 1.00 O ATOM 655 CB SER A 89 -6.297 -0.808 -12.088 1.00 1.00 C ATOM 656 OG SER A 89 -7.584 -0.421 -11.624 1.00 1.00 O ATOM 0 H SER A 89 -6.260 1.406 -10.714 1.00 1.00 H new ATOM 0 HA SER A 89 -5.069 -1.310 -10.388 1.00 1.00 H new ATOM 0 HB2 SER A 89 -6.069 -0.304 -13.027 1.00 1.00 H new ATOM 0 HB3 SER A 89 -6.276 -1.879 -12.288 1.00 1.00 H new ATOM 0 HG SER A 89 -8.257 -0.648 -12.299 1.00 1.00 H new ATOM 657 N ASP A 90 -3.360 1.048 -11.328 1.00 1.00 N ATOM 658 CA ASP A 90 -2.084 1.480 -11.968 1.00 1.00 C ATOM 659 C ASP A 90 -1.080 1.897 -10.891 1.00 1.00 C ATOM 660 O ASP A 90 0.022 2.315 -11.186 1.00 1.00 O ATOM 661 CB ASP A 90 -2.351 2.666 -12.895 1.00 1.00 C ATOM 662 CG ASP A 90 -3.379 2.267 -13.954 1.00 1.00 C ATOM 663 OD1 ASP A 90 -4.410 1.732 -13.579 1.00 1.00 O ATOM 664 OD2 ASP A 90 -3.120 2.503 -15.123 1.00 1.00 O ATOM 0 H ASP A 90 -3.709 1.663 -10.593 1.00 1.00 H new ATOM 0 HA ASP A 90 -1.675 0.650 -12.544 1.00 1.00 H new ATOM 0 HB2 ASP A 90 -2.718 3.515 -12.319 1.00 1.00 H new ATOM 0 HB3 ASP A 90 -1.424 2.982 -13.374 1.00 1.00 H new ATOM 665 N ALA A 91 -1.449 1.786 -9.645 1.00 1.00 N ATOM 666 CA ALA A 91 -0.511 2.175 -8.556 1.00 1.00 C ATOM 667 C ALA A 91 0.504 1.054 -8.346 1.00 1.00 C ATOM 668 O ALA A 91 1.483 1.215 -7.646 1.00 1.00 O ATOM 669 CB ALA A 91 -1.295 2.405 -7.263 1.00 1.00 C ATOM 0 H ALA A 91 -2.358 1.443 -9.334 1.00 1.00 H new ATOM 0 HA ALA A 91 0.008 3.094 -8.829 1.00 1.00 H new ATOM 0 HB1 ALA A 91 -0.608 2.690 -6.466 1.00 1.00 H new ATOM 0 HB2 ALA A 91 -2.023 3.202 -7.416 1.00 1.00 H new ATOM 0 HB3 ALA A 91 -1.814 1.488 -6.984 1.00 1.00 H new ATOM 670 N LEU A 92 0.283 -0.083 -8.951 1.00 1.00 N ATOM 671 CA LEU A 92 1.250 -1.201 -8.780 1.00 1.00 C ATOM 672 C LEU A 92 2.399 -1.046 -9.775 1.00 1.00 C ATOM 673 O LEU A 92 3.431 -1.675 -9.648 1.00 1.00 O ATOM 674 CB LEU A 92 0.574 -2.566 -8.955 1.00 1.00 C ATOM 675 CG LEU A 92 -0.395 -2.601 -10.143 1.00 1.00 C ATOM 676 CD1 LEU A 92 -1.763 -2.059 -9.722 1.00 1.00 C ATOM 677 CD2 LEU A 92 0.143 -1.790 -11.326 1.00 1.00 C ATOM 0 H LEU A 92 -0.518 -0.283 -9.550 1.00 1.00 H new ATOM 0 HA LEU A 92 1.641 -1.158 -7.764 1.00 1.00 H new ATOM 0 HB2 LEU A 92 1.339 -3.330 -9.093 1.00 1.00 H new ATOM 0 HB3 LEU A 92 0.033 -2.818 -8.043 1.00 1.00 H new ATOM 0 HG LEU A 92 -0.497 -3.639 -10.461 1.00 1.00 H new ATOM 0 HD11 LEU A 92 -2.444 -2.088 -10.573 1.00 1.00 H new ATOM 0 HD12 LEU A 92 -2.165 -2.672 -8.915 1.00 1.00 H new ATOM 0 HD13 LEU A 92 -1.657 -1.030 -9.378 1.00 1.00 H new ATOM 0 HD21 LEU A 92 -0.568 -1.835 -12.151 1.00 1.00 H new ATOM 0 HD22 LEU A 92 0.281 -0.752 -11.023 1.00 1.00 H new ATOM 0 HD23 LEU A 92 1.099 -2.205 -11.647 1.00 1.00 H new ATOM 678 N GLN A 93 2.239 -0.198 -10.754 1.00 1.00 N ATOM 679 CA GLN A 93 3.326 0.016 -11.739 1.00 1.00 C ATOM 680 C GLN A 93 4.269 1.076 -11.171 1.00 1.00 C ATOM 681 O GLN A 93 5.445 1.113 -11.476 1.00 1.00 O ATOM 682 CB GLN A 93 2.714 0.492 -13.062 1.00 1.00 C ATOM 683 CG GLN A 93 3.762 1.239 -13.886 1.00 1.00 C ATOM 684 CD GLN A 93 3.184 1.584 -15.260 1.00 1.00 C ATOM 685 OE1 GLN A 93 3.908 1.680 -16.230 1.00 1.00 O ATOM 686 NE2 GLN A 93 1.899 1.775 -15.383 1.00 1.00 N ATOM 0 H GLN A 93 1.397 0.356 -10.911 1.00 1.00 H new ATOM 0 HA GLN A 93 3.878 -0.905 -11.925 1.00 1.00 H new ATOM 0 HB2 GLN A 93 2.338 -0.362 -13.626 1.00 1.00 H new ATOM 0 HB3 GLN A 93 1.863 1.144 -12.864 1.00 1.00 H new ATOM 0 HG2 GLN A 93 4.065 2.149 -13.369 1.00 1.00 H new ATOM 0 HG3 GLN A 93 4.655 0.625 -14.000 1.00 1.00 H new ATOM 0 HE21 GLN A 93 1.291 1.694 -14.568 1.00 1.00 H new ATOM 0 HE22 GLN A 93 1.503 2.005 -16.294 1.00 1.00 H new ATOM 687 N LEU A 94 3.749 1.935 -10.338 1.00 1.00 N ATOM 688 CA LEU A 94 4.588 2.999 -9.727 1.00 1.00 C ATOM 689 C LEU A 94 4.777 2.697 -8.239 1.00 1.00 C ATOM 690 O LEU A 94 5.545 3.345 -7.557 1.00 1.00 O ATOM 691 CB LEU A 94 3.887 4.351 -9.886 1.00 1.00 C ATOM 692 CG LEU A 94 3.482 4.561 -11.349 1.00 1.00 C ATOM 693 CD1 LEU A 94 4.625 4.143 -12.276 1.00 1.00 C ATOM 694 CD2 LEU A 94 2.242 3.720 -11.659 1.00 1.00 C ATOM 0 H LEU A 94 2.770 1.943 -10.053 1.00 1.00 H new ATOM 0 HA LEU A 94 5.559 3.032 -10.221 1.00 1.00 H new ATOM 0 HB2 LEU A 94 3.005 4.390 -9.246 1.00 1.00 H new ATOM 0 HB3 LEU A 94 4.550 5.154 -9.564 1.00 1.00 H new ATOM 0 HG LEU A 94 3.261 5.616 -11.510 1.00 1.00 H new ATOM 0 HD11 LEU A 94 4.327 4.296 -13.313 1.00 1.00 H new ATOM 0 HD12 LEU A 94 5.508 4.745 -12.059 1.00 1.00 H new ATOM 0 HD13 LEU A 94 4.856 3.090 -12.117 1.00 1.00 H new ATOM 0 HD21 LEU A 94 1.953 3.868 -12.699 1.00 1.00 H new ATOM 0 HD22 LEU A 94 2.466 2.666 -11.491 1.00 1.00 H new ATOM 0 HD23 LEU A 94 1.423 4.025 -11.008 1.00 1.00 H new ATOM 695 N GLY A 95 4.081 1.714 -7.730 1.00 1.00 N ATOM 696 CA GLY A 95 4.219 1.366 -6.287 1.00 1.00 C ATOM 697 C GLY A 95 4.199 2.640 -5.438 1.00 1.00 C ATOM 698 O GLY A 95 5.209 3.292 -5.257 1.00 1.00 O ATOM 0 H GLY A 95 3.422 1.137 -8.253 1.00 1.00 H new ATOM 0 HA2 GLY A 95 3.407 0.705 -5.985 1.00 1.00 H new ATOM 0 HA3 GLY A 95 5.150 0.824 -6.122 1.00 1.00 H new ATOM 699 N LEU A 96 3.061 2.997 -4.905 1.00 1.00 N ATOM 700 CA LEU A 96 2.988 4.223 -4.059 1.00 1.00 C ATOM 701 C LEU A 96 3.156 3.821 -2.589 1.00 1.00 C ATOM 702 O LEU A 96 4.256 3.588 -2.128 1.00 1.00 O ATOM 703 CB LEU A 96 1.635 4.915 -4.267 1.00 1.00 C ATOM 704 CG LEU A 96 1.501 5.352 -5.730 1.00 1.00 C ATOM 705 CD1 LEU A 96 0.331 4.613 -6.377 1.00 1.00 C ATOM 706 CD2 LEU A 96 1.239 6.859 -5.799 1.00 1.00 C ATOM 0 H LEU A 96 2.181 2.494 -5.019 1.00 1.00 H new ATOM 0 HA LEU A 96 3.781 4.917 -4.339 1.00 1.00 H new ATOM 0 HB2 LEU A 96 0.824 4.236 -4.004 1.00 1.00 H new ATOM 0 HB3 LEU A 96 1.553 5.780 -3.609 1.00 1.00 H new ATOM 0 HG LEU A 96 2.425 5.118 -6.259 1.00 1.00 H new ATOM 0 HD11 LEU A 96 0.235 4.923 -7.417 1.00 1.00 H new ATOM 0 HD12 LEU A 96 0.511 3.539 -6.334 1.00 1.00 H new ATOM 0 HD13 LEU A 96 -0.589 4.849 -5.842 1.00 1.00 H new ATOM 0 HD21 LEU A 96 1.145 7.165 -6.841 1.00 1.00 H new ATOM 0 HD22 LEU A 96 0.317 7.093 -5.267 1.00 1.00 H new ATOM 0 HD23 LEU A 96 2.069 7.394 -5.338 1.00 1.00 H new ATOM 707 N GLY A 97 2.084 3.724 -1.846 1.00 1.00 N ATOM 708 CA GLY A 97 2.214 3.323 -0.415 1.00 1.00 C ATOM 709 C GLY A 97 1.480 4.323 0.480 1.00 1.00 C ATOM 710 O GLY A 97 0.597 5.035 0.043 1.00 1.00 O ATOM 0 H GLY A 97 1.132 3.904 -2.165 1.00 1.00 H new ATOM 0 HA2 GLY A 97 1.803 2.324 -0.270 1.00 1.00 H new ATOM 0 HA3 GLY A 97 3.267 3.278 -0.136 1.00 1.00 H new ATOM 711 N LYS A 98 1.842 4.379 1.733 1.00 1.00 N ATOM 712 CA LYS A 98 1.173 5.327 2.667 1.00 1.00 C ATOM 713 C LYS A 98 2.099 6.515 2.931 1.00 1.00 C ATOM 714 O LYS A 98 2.463 6.794 4.056 1.00 1.00 O ATOM 715 CB LYS A 98 0.870 4.611 3.986 1.00 1.00 C ATOM 716 CG LYS A 98 0.133 5.563 4.932 1.00 1.00 C ATOM 717 CD LYS A 98 -0.965 4.797 5.673 1.00 1.00 C ATOM 718 CE LYS A 98 -0.327 3.804 6.647 1.00 1.00 C ATOM 719 NZ LYS A 98 -0.910 2.450 6.430 1.00 1.00 N ATOM 0 H LYS A 98 2.575 3.806 2.151 1.00 1.00 H new ATOM 0 HA LYS A 98 0.242 5.682 2.225 1.00 1.00 H new ATOM 0 HB2 LYS A 98 0.262 3.726 3.799 1.00 1.00 H new ATOM 0 HB3 LYS A 98 1.797 4.270 4.447 1.00 1.00 H new ATOM 0 HG2 LYS A 98 0.833 5.998 5.646 1.00 1.00 H new ATOM 0 HG3 LYS A 98 -0.302 6.389 4.368 1.00 1.00 H new ATOM 0 HD2 LYS A 98 -1.606 5.493 6.214 1.00 1.00 H new ATOM 0 HD3 LYS A 98 -1.598 4.268 4.961 1.00 1.00 H new ATOM 0 HE2 LYS A 98 0.752 3.775 6.498 1.00 1.00 H new ATOM 0 HE3 LYS A 98 -0.499 4.125 7.674 1.00 1.00 H new ATOM 0 HZ1 LYS A 98 -0.476 1.775 7.092 1.00 1.00 H new ATOM 0 HZ2 LYS A 98 -1.937 2.484 6.593 1.00 1.00 H new ATOM 0 HZ3 LYS A 98 -0.724 2.145 5.453 1.00 1.00 H new ATOM 720 N HIS A 99 2.481 7.217 1.900 1.00 1.00 N ATOM 721 CA HIS A 99 3.383 8.388 2.087 1.00 1.00 C ATOM 722 C HIS A 99 2.874 9.554 1.237 1.00 1.00 C ATOM 723 O HIS A 99 1.764 9.533 0.745 1.00 1.00 O ATOM 724 CB HIS A 99 4.801 8.015 1.649 1.00 1.00 C ATOM 725 CG HIS A 99 4.739 7.293 0.334 1.00 1.00 C ATOM 726 ND1 HIS A 99 5.402 7.750 -0.793 1.00 1.00 N ATOM 727 CD2 HIS A 99 4.088 6.150 -0.051 1.00 1.00 C ATOM 728 CE1 HIS A 99 5.137 6.891 -1.795 1.00 1.00 C ATOM 729 NE2 HIS A 99 4.340 5.897 -1.396 1.00 1.00 N ATOM 0 H HIS A 99 2.207 7.030 0.935 1.00 1.00 H new ATOM 0 HA HIS A 99 3.395 8.679 3.137 1.00 1.00 H new ATOM 0 HB2 HIS A 99 5.413 8.912 1.556 1.00 1.00 H new ATOM 0 HB3 HIS A 99 5.273 7.384 2.402 1.00 1.00 H new ATOM 0 HD1 HIS A 99 5.985 8.585 -0.853 1.00 1.00 H new ATOM 0 HD2 HIS A 99 3.473 5.538 0.592 1.00 1.00 H new ATOM 0 HE1 HIS A 99 5.522 6.993 -2.799 1.00 1.00 H new ATOM 730 N ASN A 100 3.671 10.573 1.061 1.00 1.00 N ATOM 731 CA ASN A 100 3.220 11.733 0.244 1.00 1.00 C ATOM 732 C ASN A 100 4.337 12.159 -0.711 1.00 1.00 C ATOM 733 O ASN A 100 4.530 13.330 -0.970 1.00 1.00 O ATOM 734 CB ASN A 100 2.866 12.900 1.169 1.00 1.00 C ATOM 735 CG ASN A 100 3.901 12.996 2.290 1.00 1.00 C ATOM 736 OD1 ASN A 100 5.019 12.543 2.142 1.00 1.00 O ATOM 737 ND2 ASN A 100 3.575 13.570 3.416 1.00 1.00 N ATOM 0 H ASN A 100 4.612 10.651 1.447 1.00 1.00 H new ATOM 0 HA ASN A 100 2.342 11.446 -0.335 1.00 1.00 H new ATOM 0 HB2 ASN A 100 2.840 13.831 0.603 1.00 1.00 H new ATOM 0 HB3 ASN A 100 1.871 12.755 1.590 1.00 1.00 H new ATOM 0 HD21 ASN A 100 4.258 13.638 4.170 1.00 1.00 H new ATOM 0 HD22 ASN A 100 2.637 13.951 3.542 1.00 1.00 H new ATOM 738 N TYR A 101 5.070 11.219 -1.244 1.00 1.00 N ATOM 739 CA TYR A 101 6.167 11.580 -2.186 1.00 1.00 C ATOM 740 C TYR A 101 5.561 12.068 -3.502 1.00 1.00 C ATOM 741 O TYR A 101 4.441 11.740 -3.839 1.00 1.00 O ATOM 742 CB TYR A 101 7.041 10.353 -2.456 1.00 1.00 C ATOM 743 CG TYR A 101 8.148 10.287 -1.431 1.00 1.00 C ATOM 744 CD1 TYR A 101 7.912 10.706 -0.116 1.00 1.00 C ATOM 745 CD2 TYR A 101 9.413 9.805 -1.796 1.00 1.00 C ATOM 746 CE1 TYR A 101 8.939 10.645 0.835 1.00 1.00 C ATOM 747 CE2 TYR A 101 10.440 9.744 -0.846 1.00 1.00 C ATOM 748 CZ TYR A 101 10.204 10.163 0.470 1.00 1.00 C ATOM 749 OH TYR A 101 11.215 10.102 1.407 1.00 1.00 O ATOM 0 H TYR A 101 4.957 10.221 -1.069 1.00 1.00 H new ATOM 0 HA TYR A 101 6.778 12.368 -1.745 1.00 1.00 H new ATOM 0 HB2 TYR A 101 6.437 9.447 -2.413 1.00 1.00 H new ATOM 0 HB3 TYR A 101 7.463 10.408 -3.459 1.00 1.00 H new ATOM 0 HD1 TYR A 101 6.937 11.077 0.165 1.00 1.00 H new ATOM 0 HD2 TYR A 101 9.595 9.481 -2.810 1.00 1.00 H new ATOM 0 HE1 TYR A 101 8.756 10.969 1.849 1.00 1.00 H new ATOM 0 HE2 TYR A 101 11.415 9.374 -1.128 1.00 1.00 H new ATOM 0 HH TYR A 101 12.026 9.743 0.990 1.00 1.00 H new ATOM 750 N CYS A 102 6.291 12.848 -4.248 1.00 1.00 N ATOM 751 CA CYS A 102 5.755 13.354 -5.541 1.00 1.00 C ATOM 752 C CYS A 102 6.067 12.346 -6.648 1.00 1.00 C ATOM 753 O CYS A 102 7.176 12.269 -7.137 1.00 1.00 O ATOM 754 CB CYS A 102 6.405 14.698 -5.869 1.00 1.00 C ATOM 755 SG CYS A 102 5.730 15.971 -4.776 1.00 1.00 S ATOM 0 H CYS A 102 7.236 13.157 -4.018 1.00 1.00 H new ATOM 0 HA CYS A 102 4.676 13.485 -5.465 1.00 1.00 H new ATOM 0 HB2 CYS A 102 7.486 14.632 -5.745 1.00 1.00 H new ATOM 0 HB3 CYS A 102 6.219 14.961 -6.910 1.00 1.00 H new ATOM 756 N ARG A 103 5.095 11.571 -7.046 1.00 1.00 N ATOM 757 CA ARG A 103 5.334 10.566 -8.118 1.00 1.00 C ATOM 758 C ARG A 103 4.749 11.075 -9.436 1.00 1.00 C ATOM 759 O ARG A 103 4.036 12.058 -9.473 1.00 1.00 O ATOM 760 CB ARG A 103 4.660 9.246 -7.740 1.00 1.00 C ATOM 761 CG ARG A 103 5.173 8.781 -6.376 1.00 1.00 C ATOM 762 CD ARG A 103 6.223 7.686 -6.571 1.00 1.00 C ATOM 763 NE ARG A 103 7.028 7.545 -5.326 1.00 1.00 N ATOM 764 CZ ARG A 103 7.989 6.665 -5.266 1.00 1.00 C ATOM 765 NH1 ARG A 103 8.918 6.648 -6.183 1.00 1.00 N ATOM 766 NH2 ARG A 103 8.021 5.800 -4.289 1.00 1.00 N ATOM 0 H ARG A 103 4.145 11.591 -6.674 1.00 1.00 H new ATOM 0 HA ARG A 103 6.406 10.408 -8.233 1.00 1.00 H new ATOM 0 HB2 ARG A 103 3.578 9.374 -7.709 1.00 1.00 H new ATOM 0 HB3 ARG A 103 4.869 8.489 -8.496 1.00 1.00 H new ATOM 0 HG2 ARG A 103 5.605 9.621 -5.833 1.00 1.00 H new ATOM 0 HG3 ARG A 103 4.346 8.404 -5.774 1.00 1.00 H new ATOM 0 HD2 ARG A 103 5.738 6.740 -6.812 1.00 1.00 H new ATOM 0 HD3 ARG A 103 6.872 7.935 -7.411 1.00 1.00 H new ATOM 0 HE ARG A 103 6.828 8.137 -4.520 1.00 1.00 H new ATOM 0 HH11 ARG A 103 8.893 7.323 -6.947 1.00 1.00 H new ATOM 0 HH12 ARG A 103 9.669 5.960 -6.135 1.00 1.00 H new ATOM 0 HH21 ARG A 103 7.295 5.812 -3.573 1.00 1.00 H new ATOM 0 HH22 ARG A 103 8.772 5.112 -4.242 1.00 1.00 H new ATOM 767 N ASN A 104 5.046 10.412 -10.518 1.00 1.00 N ATOM 768 CA ASN A 104 4.510 10.850 -11.836 1.00 1.00 C ATOM 769 C ASN A 104 3.922 9.637 -12.567 1.00 1.00 C ATOM 770 O ASN A 104 4.394 9.262 -13.621 1.00 1.00 O ATOM 771 CB ASN A 104 5.643 11.453 -12.668 1.00 1.00 C ATOM 772 CG ASN A 104 5.203 12.808 -13.221 1.00 1.00 C ATOM 773 OD1 ASN A 104 5.961 13.757 -13.208 1.00 1.00 O ATOM 774 ND2 ASN A 104 4.003 12.938 -13.713 1.00 1.00 N ATOM 0 H ASN A 104 5.639 9.583 -10.546 1.00 1.00 H new ATOM 0 HA ASN A 104 3.732 11.599 -11.689 1.00 1.00 H new ATOM 0 HB2 ASN A 104 6.536 11.571 -12.054 1.00 1.00 H new ATOM 0 HB3 ASN A 104 5.905 10.782 -13.486 1.00 1.00 H new ATOM 0 HD21 ASN A 104 3.700 13.837 -14.087 1.00 1.00 H new ATOM 0 HD22 ASN A 104 3.367 12.141 -13.724 1.00 1.00 H new ATOM 775 N PRO A 105 2.910 9.054 -11.972 1.00 1.00 N ATOM 776 CA PRO A 105 2.248 7.882 -12.531 1.00 1.00 C ATOM 777 C PRO A 105 1.373 8.260 -13.735 1.00 1.00 C ATOM 778 O PRO A 105 0.674 7.430 -14.282 1.00 1.00 O ATOM 779 CB PRO A 105 1.379 7.363 -11.392 1.00 1.00 C ATOM 780 CG PRO A 105 1.096 8.639 -10.542 1.00 1.00 C ATOM 781 CD PRO A 105 2.362 9.530 -10.690 1.00 1.00 C ATOM 0 HA PRO A 105 2.963 7.143 -12.893 1.00 1.00 H new ATOM 0 HB2 PRO A 105 0.457 6.914 -11.762 1.00 1.00 H new ATOM 0 HB3 PRO A 105 1.894 6.599 -10.810 1.00 1.00 H new ATOM 0 HG2 PRO A 105 0.207 9.159 -10.899 1.00 1.00 H new ATOM 0 HG3 PRO A 105 0.917 8.383 -9.498 1.00 1.00 H new ATOM 0 HD2 PRO A 105 2.115 10.591 -10.719 1.00 1.00 H new ATOM 0 HD3 PRO A 105 3.062 9.388 -9.867 1.00 1.00 H new ATOM 782 N ASP A 106 1.399 9.496 -14.153 1.00 1.00 N ATOM 783 CA ASP A 106 0.562 9.899 -15.316 1.00 1.00 C ATOM 784 C ASP A 106 1.464 10.446 -16.420 1.00 1.00 C ATOM 785 O ASP A 106 1.022 11.164 -17.291 1.00 1.00 O ATOM 786 CB ASP A 106 -0.429 10.981 -14.881 1.00 1.00 C ATOM 787 CG ASP A 106 -1.401 11.276 -16.025 1.00 1.00 C ATOM 788 OD1 ASP A 106 -1.339 10.578 -17.024 1.00 1.00 O ATOM 789 OD2 ASP A 106 -2.192 12.194 -15.883 1.00 1.00 O ATOM 0 H ASP A 106 1.961 10.241 -13.741 1.00 1.00 H new ATOM 0 HA ASP A 106 0.012 9.035 -15.689 1.00 1.00 H new ATOM 0 HB2 ASP A 106 -0.979 10.652 -13.999 1.00 1.00 H new ATOM 0 HB3 ASP A 106 0.107 11.888 -14.602 1.00 1.00 H new ATOM 790 N ASN A 107 2.728 10.110 -16.380 1.00 1.00 N ATOM 791 CA ASN A 107 3.682 10.603 -17.415 1.00 1.00 C ATOM 792 C ASN A 107 3.917 12.104 -17.224 1.00 1.00 C ATOM 793 O ASN A 107 4.902 12.514 -16.643 1.00 1.00 O ATOM 794 CB ASN A 107 3.118 10.337 -18.816 1.00 1.00 C ATOM 795 CG ASN A 107 4.143 10.765 -19.867 1.00 1.00 C ATOM 796 OD1 ASN A 107 3.790 11.346 -20.875 1.00 1.00 O ATOM 797 ND2 ASN A 107 5.407 10.502 -19.675 1.00 1.00 N ATOM 0 H ASN A 107 3.142 9.509 -15.667 1.00 1.00 H new ATOM 0 HA ASN A 107 4.630 10.075 -17.310 1.00 1.00 H new ATOM 0 HB2 ASN A 107 2.884 9.279 -18.931 1.00 1.00 H new ATOM 0 HB3 ASN A 107 2.187 10.886 -18.955 1.00 1.00 H new ATOM 0 HD21 ASN A 107 6.098 10.784 -20.370 1.00 1.00 H new ATOM 0 HD22 ASN A 107 5.704 10.015 -18.830 1.00 1.00 H new ATOM 798 N ARG A 108 3.022 12.923 -17.705 1.00 1.00 N ATOM 799 CA ARG A 108 3.190 14.398 -17.553 1.00 1.00 C ATOM 800 C ARG A 108 4.650 14.780 -17.804 1.00 1.00 C ATOM 801 O ARG A 108 5.418 14.012 -18.350 1.00 1.00 O ATOM 802 CB ARG A 108 2.784 14.814 -16.139 1.00 1.00 C ATOM 803 CG ARG A 108 1.521 15.675 -16.206 1.00 1.00 C ATOM 804 CD ARG A 108 1.628 16.817 -15.195 1.00 1.00 C ATOM 805 NE ARG A 108 0.541 16.687 -14.184 1.00 1.00 N ATOM 806 CZ ARG A 108 -0.663 17.110 -14.461 1.00 1.00 C ATOM 807 NH1 ARG A 108 -1.521 16.308 -15.028 1.00 1.00 N ATOM 808 NH2 ARG A 108 -1.007 18.335 -14.172 1.00 1.00 N ATOM 0 H ARG A 108 2.178 12.634 -18.199 1.00 1.00 H new ATOM 0 HA ARG A 108 2.557 14.911 -18.277 1.00 1.00 H new ATOM 0 HB2 ARG A 108 2.603 13.931 -15.526 1.00 1.00 H new ATOM 0 HB3 ARG A 108 3.593 15.371 -15.666 1.00 1.00 H new ATOM 0 HG2 ARG A 108 1.394 16.076 -17.212 1.00 1.00 H new ATOM 0 HG3 ARG A 108 0.642 15.067 -15.992 1.00 1.00 H new ATOM 0 HD2 ARG A 108 2.601 16.793 -14.704 1.00 1.00 H new ATOM 0 HD3 ARG A 108 1.552 17.777 -15.705 1.00 1.00 H new ATOM 0 HE ARG A 108 0.737 16.267 -13.275 1.00 1.00 H new ATOM 0 HH11 ARG A 108 -1.252 15.351 -15.255 1.00 1.00 H new ATOM 0 HH12 ARG A 108 -2.462 16.638 -15.245 1.00 1.00 H new ATOM 0 HH21 ARG A 108 -0.335 18.962 -13.730 1.00 1.00 H new ATOM 0 HH22 ARG A 108 -1.947 18.665 -14.388 1.00 1.00 H new ATOM 809 N ARG A 109 5.042 15.963 -17.414 1.00 1.00 N ATOM 810 CA ARG A 109 6.452 16.391 -17.634 1.00 1.00 C ATOM 811 C ARG A 109 7.106 16.715 -16.289 1.00 1.00 C ATOM 812 O ARG A 109 8.297 16.940 -16.206 1.00 1.00 O ATOM 813 CB ARG A 109 6.475 17.635 -18.526 1.00 1.00 C ATOM 814 CG ARG A 109 6.259 17.224 -19.984 1.00 1.00 C ATOM 815 CD ARG A 109 5.689 18.408 -20.769 1.00 1.00 C ATOM 816 NE ARG A 109 4.204 18.300 -20.821 1.00 1.00 N ATOM 817 CZ ARG A 109 3.492 18.577 -19.764 1.00 1.00 C ATOM 818 NH1 ARG A 109 3.235 17.644 -18.888 1.00 1.00 N ATOM 819 NH2 ARG A 109 3.038 19.787 -19.581 1.00 1.00 N ATOM 0 H ARG A 109 4.446 16.651 -16.953 1.00 1.00 H new ATOM 0 HA ARG A 109 7.003 15.585 -18.119 1.00 1.00 H new ATOM 0 HB2 ARG A 109 5.697 18.332 -18.215 1.00 1.00 H new ATOM 0 HB3 ARG A 109 7.428 18.153 -18.421 1.00 1.00 H new ATOM 0 HG2 ARG A 109 7.202 16.901 -20.426 1.00 1.00 H new ATOM 0 HG3 ARG A 109 5.576 16.376 -20.037 1.00 1.00 H new ATOM 0 HD2 ARG A 109 5.980 19.346 -20.296 1.00 1.00 H new ATOM 0 HD3 ARG A 109 6.099 18.420 -21.779 1.00 1.00 H new ATOM 0 HE ARG A 109 3.744 18.009 -21.684 1.00 1.00 H new ATOM 0 HH11 ARG A 109 3.591 16.699 -19.030 1.00 1.00 H new ATOM 0 HH12 ARG A 109 2.678 17.860 -18.061 1.00 1.00 H new ATOM 0 HH21 ARG A 109 3.240 20.516 -20.265 1.00 1.00 H new ATOM 0 HH22 ARG A 109 2.481 20.003 -18.754 1.00 1.00 H new ATOM 820 N ARG A 110 6.337 16.743 -15.235 1.00 1.00 N ATOM 821 CA ARG A 110 6.918 17.054 -13.898 1.00 1.00 C ATOM 822 C ARG A 110 6.149 16.283 -12.818 1.00 1.00 C ATOM 823 O ARG A 110 4.942 16.168 -12.890 1.00 1.00 O ATOM 824 CB ARG A 110 6.802 18.557 -13.635 1.00 1.00 C ATOM 825 CG ARG A 110 7.581 18.919 -12.369 1.00 1.00 C ATOM 826 CD ARG A 110 7.308 20.379 -12.006 1.00 1.00 C ATOM 827 NE ARG A 110 8.557 21.175 -12.177 1.00 1.00 N ATOM 828 CZ ARG A 110 8.488 22.462 -12.378 1.00 1.00 C ATOM 829 NH1 ARG A 110 7.831 22.929 -13.404 1.00 1.00 N ATOM 830 NH2 ARG A 110 9.078 23.284 -11.553 1.00 1.00 N ATOM 0 H ARG A 110 5.333 16.564 -15.242 1.00 1.00 H new ATOM 0 HA ARG A 110 7.967 16.760 -13.875 1.00 1.00 H new ATOM 0 HB2 ARG A 110 7.191 19.116 -14.486 1.00 1.00 H new ATOM 0 HB3 ARG A 110 5.755 18.837 -13.522 1.00 1.00 H new ATOM 0 HG2 ARG A 110 7.285 18.267 -11.547 1.00 1.00 H new ATOM 0 HG3 ARG A 110 8.648 18.766 -12.529 1.00 1.00 H new ATOM 0 HD2 ARG A 110 6.518 20.781 -12.640 1.00 1.00 H new ATOM 0 HD3 ARG A 110 6.957 20.450 -10.976 1.00 1.00 H new ATOM 0 HE ARG A 110 9.466 20.713 -12.137 1.00 1.00 H new ATOM 0 HH11 ARG A 110 7.371 22.288 -14.050 1.00 1.00 H new ATOM 0 HH12 ARG A 110 7.778 23.936 -13.560 1.00 1.00 H new ATOM 0 HH21 ARG A 110 9.593 22.920 -10.751 1.00 1.00 H new ATOM 0 HH22 ARG A 110 9.024 24.290 -11.710 1.00 1.00 H new ATOM 831 N PRO A 111 6.869 15.775 -11.846 1.00 1.00 N ATOM 832 CA PRO A 111 6.266 15.018 -10.757 1.00 1.00 C ATOM 833 C PRO A 111 5.091 15.797 -10.156 1.00 1.00 C ATOM 834 O PRO A 111 5.136 17.004 -10.025 1.00 1.00 O ATOM 835 CB PRO A 111 7.387 14.860 -9.736 1.00 1.00 C ATOM 836 CG PRO A 111 8.684 14.966 -10.598 1.00 1.00 C ATOM 837 CD PRO A 111 8.332 15.924 -11.771 1.00 1.00 C ATOM 0 HA PRO A 111 5.868 14.057 -11.084 1.00 1.00 H new ATOM 0 HB2 PRO A 111 7.348 15.638 -8.973 1.00 1.00 H new ATOM 0 HB3 PRO A 111 7.326 13.903 -9.218 1.00 1.00 H new ATOM 0 HG2 PRO A 111 9.514 15.356 -10.010 1.00 1.00 H new ATOM 0 HG3 PRO A 111 8.988 13.987 -10.969 1.00 1.00 H new ATOM 0 HD2 PRO A 111 8.629 16.952 -11.564 1.00 1.00 H new ATOM 0 HD3 PRO A 111 8.822 15.632 -12.700 1.00 1.00 H new ATOM 838 N TRP A 112 4.039 15.115 -9.792 1.00 1.00 N ATOM 839 CA TRP A 112 2.862 15.815 -9.203 1.00 1.00 C ATOM 840 C TRP A 112 2.219 14.924 -8.137 1.00 1.00 C ATOM 841 O TRP A 112 2.323 13.714 -8.183 1.00 1.00 O ATOM 842 CB TRP A 112 1.841 16.101 -10.305 1.00 1.00 C ATOM 843 CG TRP A 112 1.544 14.835 -11.040 1.00 1.00 C ATOM 844 CD1 TRP A 112 1.969 14.544 -12.290 1.00 1.00 C ATOM 845 CD2 TRP A 112 0.772 13.686 -10.590 1.00 1.00 C ATOM 846 NE1 TRP A 112 1.504 13.287 -12.637 1.00 1.00 N ATOM 847 CE2 TRP A 112 0.762 12.718 -11.621 1.00 1.00 C ATOM 848 CE3 TRP A 112 0.084 13.395 -9.397 1.00 1.00 C ATOM 849 CZ2 TRP A 112 0.093 11.502 -11.472 1.00 1.00 C ATOM 850 CZ3 TRP A 112 -0.589 12.173 -9.243 1.00 1.00 C ATOM 851 CH2 TRP A 112 -0.584 11.229 -10.279 1.00 1.00 C ATOM 0 H TRP A 112 3.944 14.103 -9.877 1.00 1.00 H new ATOM 0 HA TRP A 112 3.185 16.752 -8.749 1.00 1.00 H new ATOM 0 HB2 TRP A 112 0.927 16.508 -9.873 1.00 1.00 H new ATOM 0 HB3 TRP A 112 2.231 16.852 -10.992 1.00 1.00 H new ATOM 0 HD1 TRP A 112 2.572 15.186 -12.915 1.00 1.00 H new ATOM 0 HE1 TRP A 112 1.687 12.836 -13.534 1.00 1.00 H new ATOM 0 HE3 TRP A 112 0.074 14.117 -8.594 1.00 1.00 H new ATOM 0 HZ2 TRP A 112 0.098 10.777 -12.272 1.00 1.00 H new ATOM 0 HZ3 TRP A 112 -1.113 11.959 -8.323 1.00 1.00 H new ATOM 0 HH2 TRP A 112 -1.103 10.290 -10.156 1.00 1.00 H new ATOM 852 N CYS A 113 1.548 15.509 -7.182 1.00 1.00 N ATOM 853 CA CYS A 113 0.890 14.685 -6.124 1.00 1.00 C ATOM 854 C CYS A 113 -0.482 15.277 -5.797 1.00 1.00 C ATOM 855 O CYS A 113 -0.706 16.464 -5.926 1.00 1.00 O ATOM 856 CB CYS A 113 1.749 14.666 -4.856 1.00 1.00 C ATOM 857 SG CYS A 113 0.688 14.319 -3.428 1.00 1.00 S ATOM 0 H CYS A 113 1.426 16.517 -7.087 1.00 1.00 H new ATOM 0 HA CYS A 113 0.775 13.665 -6.491 1.00 1.00 H new ATOM 0 HB2 CYS A 113 2.527 13.907 -4.940 1.00 1.00 H new ATOM 0 HB3 CYS A 113 2.251 15.625 -4.727 1.00 1.00 H new ATOM 858 N TYR A 114 -1.403 14.454 -5.376 1.00 1.00 N ATOM 859 CA TYR A 114 -2.765 14.957 -5.040 1.00 1.00 C ATOM 860 C TYR A 114 -2.689 15.900 -3.837 1.00 1.00 C ATOM 861 O TYR A 114 -2.842 15.486 -2.706 1.00 1.00 O ATOM 862 CB TYR A 114 -3.672 13.773 -4.696 1.00 1.00 C ATOM 863 CG TYR A 114 -3.945 12.963 -5.942 1.00 1.00 C ATOM 864 CD1 TYR A 114 -2.981 12.068 -6.422 1.00 1.00 C ATOM 865 CD2 TYR A 114 -5.164 13.109 -6.617 1.00 1.00 C ATOM 866 CE1 TYR A 114 -3.236 11.318 -7.577 1.00 1.00 C ATOM 867 CE2 TYR A 114 -5.419 12.359 -7.772 1.00 1.00 C ATOM 868 CZ TYR A 114 -4.455 11.463 -8.252 1.00 1.00 C ATOM 869 OH TYR A 114 -4.706 10.723 -9.390 1.00 1.00 O ATOM 0 H TYR A 114 -1.270 13.451 -5.250 1.00 1.00 H new ATOM 0 HA TYR A 114 -3.170 15.497 -5.896 1.00 1.00 H new ATOM 0 HB2 TYR A 114 -3.198 13.147 -3.940 1.00 1.00 H new ATOM 0 HB3 TYR A 114 -4.609 14.132 -4.271 1.00 1.00 H new ATOM 0 HD1 TYR A 114 -2.041 11.956 -5.902 1.00 1.00 H new ATOM 0 HD2 TYR A 114 -5.907 13.800 -6.247 1.00 1.00 H new ATOM 0 HE1 TYR A 114 -2.493 10.628 -7.947 1.00 1.00 H new ATOM 0 HE2 TYR A 114 -6.359 12.471 -8.292 1.00 1.00 H new ATOM 0 HH TYR A 114 -5.020 11.317 -10.104 1.00 1.00 H new ATOM 870 N VAL A 115 -2.466 17.167 -4.066 1.00 1.00 N ATOM 871 CA VAL A 115 -2.400 18.123 -2.926 1.00 1.00 C ATOM 872 C VAL A 115 -3.755 18.819 -2.782 1.00 1.00 C ATOM 873 O VAL A 115 -4.305 19.335 -3.735 1.00 1.00 O ATOM 874 CB VAL A 115 -1.302 19.160 -3.178 1.00 1.00 C ATOM 875 CG1 VAL A 115 -1.393 19.663 -4.616 1.00 1.00 C ATOM 876 CG2 VAL A 115 -1.476 20.337 -2.214 1.00 1.00 C ATOM 0 H VAL A 115 -2.327 17.578 -4.989 1.00 1.00 H new ATOM 0 HA VAL A 115 -2.166 17.584 -2.008 1.00 1.00 H new ATOM 0 HB VAL A 115 -0.328 18.699 -3.016 1.00 1.00 H new ATOM 0 HG11 VAL A 115 -0.611 20.401 -4.793 1.00 1.00 H new ATOM 0 HG12 VAL A 115 -1.265 18.826 -5.303 1.00 1.00 H new ATOM 0 HG13 VAL A 115 -2.368 20.121 -4.780 1.00 1.00 H new ATOM 0 HG21 VAL A 115 -0.694 21.074 -2.395 1.00 1.00 H new ATOM 0 HG22 VAL A 115 -2.451 20.797 -2.373 1.00 1.00 H new ATOM 0 HG23 VAL A 115 -1.407 19.979 -1.187 1.00 1.00 H new ATOM 877 N GLN A 116 -4.300 18.827 -1.598 1.00 1.00 N ATOM 878 CA GLN A 116 -5.624 19.476 -1.387 1.00 1.00 C ATOM 879 C GLN A 116 -5.638 20.858 -2.045 1.00 1.00 C ATOM 880 O GLN A 116 -4.833 21.714 -1.733 1.00 1.00 O ATOM 881 CB GLN A 116 -5.881 19.621 0.115 1.00 1.00 C ATOM 882 CG GLN A 116 -6.895 18.567 0.563 1.00 1.00 C ATOM 883 CD GLN A 116 -7.892 19.199 1.536 1.00 1.00 C ATOM 884 OE1 GLN A 116 -8.649 20.074 1.165 1.00 1.00 O ATOM 885 NE2 GLN A 116 -7.923 18.791 2.775 1.00 1.00 N ATOM 0 H GLN A 116 -3.884 18.411 -0.765 1.00 1.00 H new ATOM 0 HA GLN A 116 -6.404 18.861 -1.836 1.00 1.00 H new ATOM 0 HB2 GLN A 116 -4.949 19.502 0.667 1.00 1.00 H new ATOM 0 HB3 GLN A 116 -6.257 20.620 0.336 1.00 1.00 H new ATOM 0 HG2 GLN A 116 -7.421 18.163 -0.302 1.00 1.00 H new ATOM 0 HG3 GLN A 116 -6.381 17.734 1.042 1.00 1.00 H new ATOM 0 HE21 GLN A 116 -7.287 18.056 3.086 1.00 1.00 H new ATOM 0 HE22 GLN A 116 -8.583 19.207 3.432 1.00 1.00 H new ATOM 886 N VAL A 117 -6.552 21.085 -2.951 1.00 1.00 N ATOM 887 CA VAL A 117 -6.623 22.413 -3.623 1.00 1.00 C ATOM 888 C VAL A 117 -7.658 23.280 -2.909 1.00 1.00 C ATOM 889 O VAL A 117 -8.198 24.213 -3.468 1.00 1.00 O ATOM 890 CB VAL A 117 -7.034 22.232 -5.087 1.00 1.00 C ATOM 891 CG1 VAL A 117 -8.516 21.861 -5.167 1.00 1.00 C ATOM 892 CG2 VAL A 117 -6.796 23.539 -5.847 1.00 1.00 C ATOM 0 H VAL A 117 -7.252 20.408 -3.254 1.00 1.00 H new ATOM 0 HA VAL A 117 -5.646 22.894 -3.582 1.00 1.00 H new ATOM 0 HB VAL A 117 -6.439 21.435 -5.532 1.00 1.00 H new ATOM 0 HG11 VAL A 117 -8.803 21.733 -6.211 1.00 1.00 H new ATOM 0 HG12 VAL A 117 -8.688 20.930 -4.627 1.00 1.00 H new ATOM 0 HG13 VAL A 117 -9.114 22.655 -4.720 1.00 1.00 H new ATOM 0 HG21 VAL A 117 -7.088 23.412 -6.889 1.00 1.00 H new ATOM 0 HG22 VAL A 117 -7.391 24.335 -5.398 1.00 1.00 H new ATOM 0 HG23 VAL A 117 -5.740 23.803 -5.796 1.00 1.00 H new ATOM 893 N GLY A 118 -7.936 22.972 -1.675 1.00 1.00 N ATOM 894 CA GLY A 118 -8.936 23.769 -0.915 1.00 1.00 C ATOM 895 C GLY A 118 -10.203 22.941 -0.718 1.00 1.00 C ATOM 896 O GLY A 118 -10.901 23.079 0.267 1.00 1.00 O ATOM 0 H GLY A 118 -7.513 22.201 -1.159 1.00 1.00 H new ATOM 0 HA2 GLY A 118 -8.526 24.061 0.052 1.00 1.00 H new ATOM 0 HA3 GLY A 118 -9.169 24.688 -1.453 1.00 1.00 H new ATOM 897 N LEU A 119 -10.506 22.082 -1.648 1.00 1.00 N ATOM 898 CA LEU A 119 -11.731 21.246 -1.510 1.00 1.00 C ATOM 899 C LEU A 119 -11.505 19.842 -2.096 1.00 1.00 C ATOM 900 O LEU A 119 -12.177 18.901 -1.725 1.00 1.00 O ATOM 901 CB LEU A 119 -12.929 21.951 -2.179 1.00 1.00 C ATOM 902 CG LEU A 119 -12.758 22.066 -3.701 1.00 1.00 C ATOM 903 CD1 LEU A 119 -11.407 22.694 -4.056 1.00 1.00 C ATOM 904 CD2 LEU A 119 -12.862 20.681 -4.325 1.00 1.00 C ATOM 0 H LEU A 119 -9.961 21.922 -2.495 1.00 1.00 H new ATOM 0 HA LEU A 119 -11.956 21.123 -0.451 1.00 1.00 H new ATOM 0 HB2 LEU A 119 -13.843 21.399 -1.958 1.00 1.00 H new ATOM 0 HB3 LEU A 119 -13.047 22.947 -1.752 1.00 1.00 H new ATOM 0 HG LEU A 119 -13.545 22.710 -4.093 1.00 1.00 H new ATOM 0 HD11 LEU A 119 -11.312 22.764 -5.140 1.00 1.00 H new ATOM 0 HD12 LEU A 119 -11.344 23.692 -3.621 1.00 1.00 H new ATOM 0 HD13 LEU A 119 -10.602 22.074 -3.660 1.00 1.00 H new ATOM 0 HD21 LEU A 119 -12.741 20.759 -5.405 1.00 1.00 H new ATOM 0 HD22 LEU A 119 -12.081 20.039 -3.918 1.00 1.00 H new ATOM 0 HD23 LEU A 119 -13.838 20.253 -4.099 1.00 1.00 H new ATOM 905 N LYS A 120 -10.565 19.680 -2.990 1.00 1.00 N ATOM 906 CA LYS A 120 -10.316 18.321 -3.561 1.00 1.00 C ATOM 907 C LYS A 120 -8.821 18.156 -3.871 1.00 1.00 C ATOM 908 O LYS A 120 -8.213 19.044 -4.434 1.00 1.00 O ATOM 909 CB LYS A 120 -11.130 18.133 -4.846 1.00 1.00 C ATOM 910 CG LYS A 120 -10.474 18.896 -6.001 1.00 1.00 C ATOM 911 CD LYS A 120 -11.197 18.558 -7.305 1.00 1.00 C ATOM 912 CE LYS A 120 -11.620 19.852 -8.006 1.00 1.00 C ATOM 913 NZ LYS A 120 -12.772 19.575 -8.911 1.00 1.00 N ATOM 0 H LYS A 120 -9.963 20.422 -3.348 1.00 1.00 H new ATOM 0 HA LYS A 120 -10.621 17.570 -2.833 1.00 1.00 H new ATOM 0 HB2 LYS A 120 -11.197 17.073 -5.092 1.00 1.00 H new ATOM 0 HB3 LYS A 120 -12.149 18.490 -4.696 1.00 1.00 H new ATOM 0 HG2 LYS A 120 -10.518 19.969 -5.815 1.00 1.00 H new ATOM 0 HG3 LYS A 120 -9.420 18.629 -6.076 1.00 1.00 H new ATOM 0 HD2 LYS A 120 -10.543 17.977 -7.955 1.00 1.00 H new ATOM 0 HD3 LYS A 120 -12.072 17.941 -7.099 1.00 1.00 H new ATOM 0 HE2 LYS A 120 -11.897 20.604 -7.267 1.00 1.00 H new ATOM 0 HE3 LYS A 120 -10.785 20.258 -8.577 1.00 1.00 H new ATOM 0 HZ1 LYS A 120 -13.059 20.454 -9.387 1.00 1.00 H new ATOM 0 HZ2 LYS A 120 -12.492 18.871 -9.624 1.00 1.00 H new ATOM 0 HZ3 LYS A 120 -13.570 19.206 -8.355 1.00 1.00 H new ATOM 914 N PRO A 121 -8.270 17.024 -3.504 1.00 1.00 N ATOM 915 CA PRO A 121 -6.862 16.744 -3.750 1.00 1.00 C ATOM 916 C PRO A 121 -6.545 16.904 -5.239 1.00 1.00 C ATOM 917 O PRO A 121 -6.734 15.995 -6.022 1.00 1.00 O ATOM 918 CB PRO A 121 -6.675 15.291 -3.329 1.00 1.00 C ATOM 919 CG PRO A 121 -7.850 15.041 -2.332 1.00 1.00 C ATOM 920 CD PRO A 121 -9.010 15.956 -2.816 1.00 1.00 C ATOM 0 HA PRO A 121 -6.205 17.422 -3.205 1.00 1.00 H new ATOM 0 HB2 PRO A 121 -6.725 14.617 -4.184 1.00 1.00 H new ATOM 0 HB3 PRO A 121 -5.707 15.133 -2.854 1.00 1.00 H new ATOM 0 HG2 PRO A 121 -8.150 13.993 -2.334 1.00 1.00 H new ATOM 0 HG3 PRO A 121 -7.557 15.286 -1.311 1.00 1.00 H new ATOM 0 HD2 PRO A 121 -9.693 15.433 -3.485 1.00 1.00 H new ATOM 0 HD3 PRO A 121 -9.605 16.338 -1.987 1.00 1.00 H new ATOM 921 N LEU A 122 -6.056 18.045 -5.637 1.00 1.00 N ATOM 922 CA LEU A 122 -5.721 18.246 -7.074 1.00 1.00 C ATOM 923 C LEU A 122 -4.239 17.934 -7.283 1.00 1.00 C ATOM 924 O LEU A 122 -3.392 18.404 -6.551 1.00 1.00 O ATOM 925 CB LEU A 122 -6.002 19.697 -7.468 1.00 1.00 C ATOM 926 CG LEU A 122 -6.537 19.742 -8.900 1.00 1.00 C ATOM 927 CD1 LEU A 122 -5.639 18.898 -9.807 1.00 1.00 C ATOM 928 CD2 LEU A 122 -7.959 19.180 -8.927 1.00 1.00 C ATOM 0 H LEU A 122 -5.874 18.845 -5.031 1.00 1.00 H new ATOM 0 HA LEU A 122 -6.329 17.585 -7.692 1.00 1.00 H new ATOM 0 HB2 LEU A 122 -6.727 20.137 -6.783 1.00 1.00 H new ATOM 0 HB3 LEU A 122 -5.090 20.289 -7.390 1.00 1.00 H new ATOM 0 HG LEU A 122 -6.544 20.773 -9.254 1.00 1.00 H new ATOM 0 HD11 LEU A 122 -6.020 18.930 -10.828 1.00 1.00 H new ATOM 0 HD12 LEU A 122 -4.624 19.295 -9.786 1.00 1.00 H new ATOM 0 HD13 LEU A 122 -5.632 17.867 -9.454 1.00 1.00 H new ATOM 0 HD21 LEU A 122 -8.343 19.211 -9.947 1.00 1.00 H new ATOM 0 HD22 LEU A 122 -7.949 18.149 -8.574 1.00 1.00 H new ATOM 0 HD23 LEU A 122 -8.599 19.779 -8.280 1.00 1.00 H new ATOM 929 N VAL A 123 -3.916 17.138 -8.265 1.00 1.00 N ATOM 930 CA VAL A 123 -2.483 16.799 -8.496 1.00 1.00 C ATOM 931 C VAL A 123 -1.727 18.047 -8.962 1.00 1.00 C ATOM 932 O VAL A 123 -2.051 18.640 -9.972 1.00 1.00 O ATOM 933 CB VAL A 123 -2.375 15.683 -9.549 1.00 1.00 C ATOM 934 CG1 VAL A 123 -3.589 14.758 -9.441 1.00 1.00 C ATOM 935 CG2 VAL A 123 -2.318 16.280 -10.961 1.00 1.00 C ATOM 0 H VAL A 123 -4.577 16.710 -8.913 1.00 1.00 H new ATOM 0 HA VAL A 123 -2.039 16.446 -7.565 1.00 1.00 H new ATOM 0 HB VAL A 123 -1.461 15.119 -9.366 1.00 1.00 H new ATOM 0 HG11 VAL A 123 -3.512 13.968 -10.188 1.00 1.00 H new ATOM 0 HG12 VAL A 123 -3.622 14.315 -8.446 1.00 1.00 H new ATOM 0 HG13 VAL A 123 -4.500 15.332 -9.613 1.00 1.00 H new ATOM 0 HG21 VAL A 123 -2.242 15.476 -11.693 1.00 1.00 H new ATOM 0 HG22 VAL A 123 -3.223 16.857 -11.149 1.00 1.00 H new ATOM 0 HG23 VAL A 123 -1.448 16.932 -11.046 1.00 1.00 H new ATOM 936 N GLN A 124 -0.722 18.446 -8.236 1.00 1.00 N ATOM 937 CA GLN A 124 0.054 19.650 -8.639 1.00 1.00 C ATOM 938 C GLN A 124 1.485 19.236 -8.976 1.00 1.00 C ATOM 939 O GLN A 124 2.109 18.482 -8.253 1.00 1.00 O ATOM 940 CB GLN A 124 0.075 20.656 -7.487 1.00 1.00 C ATOM 941 CG GLN A 124 -0.696 21.917 -7.883 1.00 1.00 C ATOM 942 CD GLN A 124 -2.028 21.527 -8.524 1.00 1.00 C ATOM 943 OE1 GLN A 124 -2.538 22.233 -9.372 1.00 1.00 O ATOM 944 NE2 GLN A 124 -2.619 20.426 -8.151 1.00 1.00 N ATOM 0 H GLN A 124 -0.404 17.990 -7.381 1.00 1.00 H new ATOM 0 HA GLN A 124 -0.412 20.109 -9.511 1.00 1.00 H new ATOM 0 HB2 GLN A 124 -0.370 20.212 -6.597 1.00 1.00 H new ATOM 0 HB3 GLN A 124 1.104 20.912 -7.235 1.00 1.00 H new ATOM 0 HG2 GLN A 124 -0.872 22.538 -7.005 1.00 1.00 H new ATOM 0 HG3 GLN A 124 -0.106 22.512 -8.581 1.00 1.00 H new ATOM 0 HE21 GLN A 124 -2.191 19.833 -7.439 1.00 1.00 H new ATOM 0 HE22 GLN A 124 -3.509 20.157 -8.571 1.00 1.00 H new ATOM 945 N GLU A 125 2.010 19.724 -10.066 1.00 1.00 N ATOM 946 CA GLU A 125 3.403 19.364 -10.446 1.00 1.00 C ATOM 947 C GLU A 125 4.362 19.895 -9.381 1.00 1.00 C ATOM 948 O GLU A 125 4.810 21.022 -9.447 1.00 1.00 O ATOM 949 CB GLU A 125 3.741 19.995 -11.798 1.00 1.00 C ATOM 950 CG GLU A 125 2.612 19.708 -12.789 1.00 1.00 C ATOM 951 CD GLU A 125 3.181 19.638 -14.207 1.00 1.00 C ATOM 952 OE1 GLU A 125 3.688 18.589 -14.569 1.00 1.00 O ATOM 953 OE2 GLU A 125 3.100 20.634 -14.907 1.00 1.00 O ATOM 0 H GLU A 125 1.534 20.356 -10.709 1.00 1.00 H new ATOM 0 HA GLU A 125 3.498 18.281 -10.520 1.00 1.00 H new ATOM 0 HB2 GLU A 125 3.877 21.071 -11.686 1.00 1.00 H new ATOM 0 HB3 GLU A 125 4.681 19.593 -12.175 1.00 1.00 H new ATOM 0 HG2 GLU A 125 2.122 18.768 -12.536 1.00 1.00 H new ATOM 0 HG3 GLU A 125 1.854 20.489 -12.728 1.00 1.00 H new ATOM 954 N CYS A 126 4.672 19.096 -8.396 1.00 1.00 N ATOM 955 CA CYS A 126 5.595 19.555 -7.318 1.00 1.00 C ATOM 956 C CYS A 126 6.740 20.369 -7.927 1.00 1.00 C ATOM 957 O CYS A 126 7.406 19.931 -8.843 1.00 1.00 O ATOM 958 CB CYS A 126 6.174 18.340 -6.593 1.00 1.00 C ATOM 959 SG CYS A 126 4.827 17.271 -6.030 1.00 1.00 S ATOM 0 H CYS A 126 4.325 18.143 -8.291 1.00 1.00 H new ATOM 0 HA CYS A 126 5.042 20.177 -6.614 1.00 1.00 H new ATOM 0 HB2 CYS A 126 6.836 17.787 -7.260 1.00 1.00 H new ATOM 0 HB3 CYS A 126 6.775 18.663 -5.743 1.00 1.00 H new ATOM 960 N MET A 127 6.975 21.550 -7.424 1.00 1.00 N ATOM 961 CA MET A 127 8.078 22.387 -7.974 1.00 1.00 C ATOM 962 C MET A 127 9.389 22.026 -7.273 1.00 1.00 C ATOM 963 O MET A 127 9.474 22.016 -6.061 1.00 1.00 O ATOM 964 CB MET A 127 7.766 23.867 -7.741 1.00 1.00 C ATOM 965 CG MET A 127 7.525 24.110 -6.251 1.00 1.00 C ATOM 966 SD MET A 127 8.545 25.498 -5.693 1.00 1.00 S ATOM 967 CE MET A 127 7.635 26.809 -6.545 1.00 1.00 C ATOM 0 H MET A 127 6.451 21.971 -6.657 1.00 1.00 H new ATOM 0 HA MET A 127 8.173 22.202 -9.044 1.00 1.00 H new ATOM 0 HB2 MET A 127 8.594 24.483 -8.091 1.00 1.00 H new ATOM 0 HB3 MET A 127 6.886 24.159 -8.315 1.00 1.00 H new ATOM 0 HG2 MET A 127 6.471 24.324 -6.072 1.00 1.00 H new ATOM 0 HG3 MET A 127 7.769 23.213 -5.681 1.00 1.00 H new ATOM 0 HE1 MET A 127 7.987 27.781 -6.198 1.00 1.00 H new ATOM 0 HE2 MET A 127 7.799 26.726 -7.619 1.00 1.00 H new ATOM 0 HE3 MET A 127 6.571 26.711 -6.331 1.00 1.00 H new ATOM 968 N VAL A 128 10.412 21.729 -8.026 1.00 1.00 N ATOM 969 CA VAL A 128 11.716 21.368 -7.402 1.00 1.00 C ATOM 970 C VAL A 128 12.859 21.936 -8.247 1.00 1.00 C ATOM 971 O VAL A 128 13.867 21.291 -8.457 1.00 1.00 O ATOM 972 CB VAL A 128 11.843 19.846 -7.330 1.00 1.00 C ATOM 973 CG1 VAL A 128 12.979 19.473 -6.375 1.00 1.00 C ATOM 974 CG2 VAL A 128 10.531 19.248 -6.817 1.00 1.00 C ATOM 0 H VAL A 128 10.401 21.721 -9.046 1.00 1.00 H new ATOM 0 HA VAL A 128 11.765 21.784 -6.396 1.00 1.00 H new ATOM 0 HB VAL A 128 12.059 19.453 -8.324 1.00 1.00 H new ATOM 0 HG11 VAL A 128 13.070 18.388 -6.324 1.00 1.00 H new ATOM 0 HG12 VAL A 128 13.914 19.898 -6.739 1.00 1.00 H new ATOM 0 HG13 VAL A 128 12.763 19.867 -5.382 1.00 1.00 H new ATOM 0 HG21 VAL A 128 10.621 18.163 -6.766 1.00 1.00 H new ATOM 0 HG22 VAL A 128 10.316 19.642 -5.824 1.00 1.00 H new ATOM 0 HG23 VAL A 128 9.720 19.513 -7.496 1.00 1.00 H new ATOM 975 N HIS A 129 12.709 23.137 -8.733 1.00 1.00 N ATOM 976 CA HIS A 129 13.787 23.744 -9.563 1.00 1.00 C ATOM 977 C HIS A 129 14.537 24.790 -8.736 1.00 1.00 C ATOM 978 O HIS A 129 14.300 24.947 -7.555 1.00 1.00 O ATOM 979 CB HIS A 129 13.168 24.414 -10.791 1.00 1.00 C ATOM 980 CG HIS A 129 14.050 24.181 -11.988 1.00 1.00 C ATOM 981 ND1 HIS A 129 13.585 24.320 -13.286 1.00 1.00 N ATOM 982 CD2 HIS A 129 15.369 23.819 -12.098 1.00 1.00 C ATOM 983 CE1 HIS A 129 14.610 24.045 -14.114 1.00 1.00 C ATOM 984 NE2 HIS A 129 15.721 23.734 -13.442 1.00 1.00 N ATOM 0 H HIS A 129 11.887 23.724 -8.591 1.00 1.00 H new ATOM 0 HA HIS A 129 14.481 22.967 -9.884 1.00 1.00 H new ATOM 0 HB2 HIS A 129 12.172 24.010 -10.976 1.00 1.00 H new ATOM 0 HB3 HIS A 129 13.051 25.483 -10.615 1.00 1.00 H new ATOM 0 HD2 HIS A 129 16.033 23.629 -11.268 1.00 1.00 H new ATOM 0 HE1 HIS A 129 14.542 24.073 -15.192 1.00 1.00 H new ATOM 0 HE2 HIS A 129 16.632 23.487 -13.830 1.00 1.00 H new ATOM 985 N ASP A 130 15.440 25.507 -9.347 1.00 1.00 N ATOM 986 CA ASP A 130 16.205 26.543 -8.597 1.00 1.00 C ATOM 987 C ASP A 130 16.629 25.983 -7.238 1.00 1.00 C ATOM 988 O ASP A 130 16.218 26.466 -6.202 1.00 1.00 O ATOM 989 CB ASP A 130 15.322 27.774 -8.387 1.00 1.00 C ATOM 990 CG ASP A 130 15.800 28.907 -9.297 1.00 1.00 C ATOM 991 OD1 ASP A 130 16.307 28.608 -10.365 1.00 1.00 O ATOM 992 OD2 ASP A 130 15.652 30.054 -8.909 1.00 1.00 O ATOM 0 H ASP A 130 15.681 25.420 -10.334 1.00 1.00 H new ATOM 0 HA ASP A 130 17.092 26.822 -9.166 1.00 1.00 H new ATOM 0 HB2 ASP A 130 14.283 27.531 -8.607 1.00 1.00 H new ATOM 0 HB3 ASP A 130 15.362 28.089 -7.344 1.00 1.00 H new ATOM 993 N CYS A 131 17.449 24.968 -7.232 1.00 1.00 N ATOM 994 CA CYS A 131 17.897 24.381 -5.938 1.00 1.00 C ATOM 995 C CYS A 131 18.356 25.502 -5.003 1.00 1.00 C ATOM 996 O CYS A 131 18.572 26.622 -5.420 1.00 1.00 O ATOM 997 CB CYS A 131 19.059 23.418 -6.188 1.00 1.00 C ATOM 998 SG CYS A 131 18.859 22.641 -7.810 1.00 1.00 S ATOM 0 H CYS A 131 17.828 24.520 -8.067 1.00 1.00 H new ATOM 0 HA CYS A 131 17.070 23.839 -5.479 1.00 1.00 H new ATOM 0 HB2 CYS A 131 20.006 23.955 -6.144 1.00 1.00 H new ATOM 0 HB3 CYS A 131 19.088 22.656 -5.409 1.00 1.00 H new ATOM 999 N ALA A 132 18.506 25.210 -3.739 1.00 1.00 N ATOM 1000 CA ALA A 132 18.950 26.260 -2.781 1.00 1.00 C ATOM 1001 C ALA A 132 19.735 25.611 -1.639 1.00 1.00 C ATOM 1002 O ALA A 132 19.448 25.822 -0.478 1.00 1.00 O ATOM 1003 CB ALA A 132 17.726 26.981 -2.212 1.00 1.00 C ATOM 0 H ALA A 132 18.340 24.290 -3.330 1.00 1.00 H new ATOM 0 HA ALA A 132 19.587 26.977 -3.298 1.00 1.00 H new ATOM 0 HB1 ALA A 132 18.050 27.750 -1.511 1.00 1.00 H new ATOM 0 HB2 ALA A 132 17.166 27.444 -3.025 1.00 1.00 H new ATOM 0 HB3 ALA A 132 17.089 26.264 -1.695 1.00 1.00 H new ATOM 1004 N ASP A 133 20.725 24.822 -1.960 1.00 1.00 N ATOM 1005 CA ASP A 133 21.526 24.161 -0.892 1.00 1.00 C ATOM 1006 C ASP A 133 20.595 23.365 0.025 1.00 1.00 C ATOM 1007 O ASP A 133 20.753 23.357 1.230 1.00 1.00 O ATOM 1008 CB ASP A 133 22.260 25.225 -0.072 1.00 1.00 C ATOM 1009 CG ASP A 133 23.770 25.021 -0.205 1.00 1.00 C ATOM 1010 OD1 ASP A 133 24.184 24.435 -1.191 1.00 1.00 O ATOM 1011 OD2 ASP A 133 24.486 25.455 0.683 1.00 1.00 O ATOM 0 H ASP A 133 21.013 24.607 -2.915 1.00 1.00 H new ATOM 0 HA ASP A 133 22.252 23.487 -1.347 1.00 1.00 H new ATOM 0 HB2 ASP A 133 21.985 26.221 -0.420 1.00 1.00 H new ATOM 0 HB3 ASP A 133 21.965 25.160 0.975 1.00 1.00 H new ATOM 1012 N GLY A 134 19.625 22.696 -0.535 1.00 1.00 N ATOM 1013 CA GLY A 134 18.685 21.903 0.305 1.00 1.00 C ATOM 1014 C GLY A 134 17.441 22.740 0.609 1.00 1.00 C ATOM 1015 O GLY A 134 16.424 22.618 -0.044 1.00 1.00 O ATOM 0 H GLY A 134 19.443 22.664 -1.538 1.00 1.00 H new ATOM 0 HA2 GLY A 134 18.402 20.987 -0.213 1.00 1.00 H new ATOM 0 HA3 GLY A 134 19.172 21.606 1.234 1.00 1.00 H new ATOM 1016 N LYS A 135 17.513 23.590 1.597 1.00 1.00 N ATOM 1017 CA LYS A 135 16.335 24.434 1.940 1.00 1.00 C ATOM 1018 C LYS A 135 16.631 25.893 1.584 1.00 1.00 C ATOM 1019 O LYS A 135 16.472 26.243 0.427 1.00 1.00 O ATOM 1020 CB LYS A 135 16.046 24.323 3.439 1.00 1.00 C ATOM 1021 CG LYS A 135 15.187 23.085 3.702 1.00 1.00 C ATOM 1022 CD LYS A 135 14.915 22.962 5.202 1.00 1.00 C ATOM 1023 CE LYS A 135 13.433 22.654 5.428 1.00 1.00 C ATOM 1024 NZ LYS A 135 12.670 23.930 5.522 1.00 1.00 N ATOM 1025 OXT LYS A 135 17.012 26.633 2.476 1.00 1.00 O ATOM 0 H LYS A 135 18.337 23.736 2.181 1.00 1.00 H new ATOM 0 HA LYS A 135 15.467 24.092 1.377 1.00 1.00 H new ATOM 0 HB2 LYS A 135 16.980 24.256 3.996 1.00 1.00 H new ATOM 0 HB3 LYS A 135 15.530 25.218 3.788 1.00 1.00 H new ATOM 0 HG2 LYS A 135 14.247 23.159 3.156 1.00 1.00 H new ATOM 0 HG3 LYS A 135 15.696 22.192 3.340 1.00 1.00 H new ATOM 0 HD2 LYS A 135 15.531 22.172 5.631 1.00 1.00 H new ATOM 0 HD3 LYS A 135 15.186 23.888 5.709 1.00 1.00 H new ATOM 0 HE2 LYS A 135 13.048 22.047 4.609 1.00 1.00 H new ATOM 0 HE3 LYS A 135 13.306 22.074 6.342 1.00 1.00 H new ATOM 0 HZ1 LYS A 135 11.663 23.722 5.676 1.00 1.00 H new ATOM 0 HZ2 LYS A 135 13.032 24.493 6.318 1.00 1.00 H new ATOM 0 HZ3 LYS A 135 12.782 24.467 4.638 1.00 1.00 H new TER 1026 LYS A 135 HETATM 1027 C1 FUC A 136 33.562 6.492 0.472 1.00 1.00 C HETATM 1028 C2 FUC A 136 34.082 7.908 0.232 1.00 1.00 C HETATM 1029 C3 FUC A 136 33.044 8.915 0.710 1.00 1.00 C HETATM 1030 C4 FUC A 136 32.746 8.646 2.178 1.00 1.00 C HETATM 1031 C5 FUC A 136 32.264 7.208 2.333 1.00 1.00 C HETATM 1032 C6 FUC A 136 31.957 6.842 3.771 1.00 1.00 C HETATM 1033 O2 FUC A 136 34.350 8.099 -1.149 1.00 1.00 O HETATM 1034 O3 FUC A 136 33.542 10.235 0.548 1.00 1.00 O HETATM 1035 O4 FUC A 136 33.927 8.835 2.943 1.00 1.00 O HETATM 1036 O5 FUC A 136 33.277 6.300 1.861 1.00 1.00 O HETATM 0 HO4 FUC A 136 34.430 7.995 2.981 1.00 1.00 H new HETATM 0 HO3 FUC A 136 33.998 10.516 1.369 1.00 1.00 H new HETATM 0 HO2 FUC A 136 33.682 7.619 -1.681 1.00 1.00 H new HETATM 0 H63 FUC A 136 32.856 6.958 4.376 1.00 1.00 H new HETATM 0 H62 FUC A 136 31.175 7.498 4.154 1.00 1.00 H new HETATM 0 H61 FUC A 136 31.618 5.807 3.819 1.00 1.00 H new HETATM 0 H5 FUC A 136 31.347 7.128 1.750 1.00 1.00 H new HETATM 0 H4 FUC A 136 31.975 9.332 2.529 1.00 1.00 H new HETATM 0 H3 FUC A 136 32.131 8.815 0.124 1.00 1.00 H new HETATM 0 H2 FUC A 136 35.007 8.054 0.789 1.00 1.00 H new