USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1668 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: B 84 LYS NZ :NH3+ -134:sc= -4.42! (180deg=0) USER MOD Set 1.2: B 88 ASN : amide:sc= -4.16! C(o=-8.6!,f=-9.7!) USER MOD Set 2.1: A 79 ASN : amide:sc= -0.286 X(o=-0.29,f=-0.53) USER MOD Set 2.2: B 76 MET CE :methyl 178:sc= 0 (180deg=0) USER MOD Set 3.1: B 33 SER OG : rot 120:sc= 0.97 USER MOD Set 3.2: B 37 THR OG1 : rot 174:sc= -1.33! USER MOD Set 4.1: A 84 LYS NZ :NH3+ -140:sc= -4.74! (180deg=0) USER MOD Set 4.2: A 88 ASN : amide:sc= -5.07! C(o=-9.8!,f=-9.4!) USER MOD Set 5.1: A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.2: B 79 ASN : amide:sc= -0.682 K(o=-0.68,f=-1.6) USER MOD Set 6.1: A 33 SER OG : rot 108:sc= 0.971 USER MOD Set 6.2: A 37 THR OG1 : rot -168:sc= -1.14 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 66:sc= 0.00367 USER MOD Single : A 6 LYS NZ :NH3+ -126:sc= -3.74! (180deg=-5.03!) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 17 CYS SG : rot -9:sc= -3.35! USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 101:sc= 0.578 USER MOD Single : A 23 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.0885) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.154 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot -150:sc= 0.456 USER MOD Single : A 42 LYS NZ :NH3+ -157:sc= -0.0169 (180deg=-0.753) USER MOD Single : A 43 MET CE :methyl -168:sc= -0.251 (180deg=-0.368) USER MOD Single : A 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN : amide:sc= -7.34! C(o=-7.3!,f=-3.8!) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.0168 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00836) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl -120:sc= 0 (180deg=-0.0776) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= -0.45 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 SER OG : rot 180:sc= 0 USER MOD Single : B 6 LYS NZ :NH3+ 162:sc= -0.135 (180deg=-0.968) USER MOD Single : B 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 17 CYS SG : rot -33:sc= -1.16 USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 21 SER OG : rot 104:sc= 0.756 USER MOD Single : B 23 LYS NZ :NH3+ 148:sc= -0.203 (180deg=-0.913) USER MOD Single : B 24 THR OG1 : rot 180:sc= -0.133 USER MOD Single : B 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= 0.176 K(o=0.18,f=-3.1!) USER MOD Single : B 34 TYR OH : rot 180:sc= 0 USER MOD Single : B 40 TYR OH : rot -158:sc= 0.366 USER MOD Single : B 42 LYS NZ :NH3+ -160:sc= -0.107 (180deg=-1.02) USER MOD Single : B 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 45 MET CE :methyl -111:sc= 0 (180deg=-0.0496) USER MOD Single : B 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 GLN : amide:sc= -0.821 X(o=-0.82,f=-0.83) USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 THR OG1 : rot 180:sc= -0.51 USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0837) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : B 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 MET CE :methyl -171:sc= 0 (180deg=-0.0391) USER MOD Single : B 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 89 SER OG : rot 180:sc= 0 USER MOD Single : B 92 SER OG : rot 180:sc= 0 USER MOD Single : B 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -8.965 15.063 -3.569 1.00 5.35 N ATOM 2 CA ALA A 1 -9.151 14.848 -2.106 1.00 4.76 C ATOM 3 C ALA A 1 -10.135 13.699 -1.879 1.00 4.12 C ATOM 4 O ALA A 1 -11.211 13.889 -1.346 1.00 3.94 O ATOM 5 CB ALA A 1 -9.701 16.126 -1.468 1.00 4.81 C ATOM 0 H1 ALA A 1 -8.296 15.844 -3.723 1.00 5.35 H new ATOM 0 H2 ALA A 1 -8.590 14.195 -4.002 1.00 5.35 H new ATOM 0 H3 ALA A 1 -9.879 15.300 -4.004 1.00 5.35 H new ATOM 0 HA ALA A 1 -8.192 14.599 -1.651 1.00 4.76 H new ATOM 0 HB1 ALA A 1 -9.837 15.969 -0.398 1.00 4.81 H new ATOM 0 HB2 ALA A 1 -8.999 16.944 -1.628 1.00 4.81 H new ATOM 0 HB3 ALA A 1 -10.659 16.376 -1.923 1.00 4.81 H new ATOM 13 N LYS A 2 -9.777 12.509 -2.274 1.00 4.22 N ATOM 14 CA LYS A 2 -10.695 11.352 -2.075 1.00 4.07 C ATOM 15 C LYS A 2 -10.803 11.048 -0.581 1.00 3.66 C ATOM 16 O LYS A 2 -9.831 11.093 0.143 1.00 4.35 O ATOM 17 CB LYS A 2 -10.142 10.121 -2.797 1.00 4.82 C ATOM 18 CG LYS A 2 -10.474 10.202 -4.290 1.00 5.66 C ATOM 19 CD LYS A 2 -9.799 11.430 -4.906 1.00 6.60 C ATOM 20 CE LYS A 2 -9.442 11.135 -6.363 1.00 7.50 C ATOM 21 NZ LYS A 2 -8.143 10.406 -6.419 1.00 7.90 N ATOM 0 H LYS A 2 -8.890 12.287 -2.726 1.00 4.22 H new ATOM 0 HA LYS A 2 -11.677 11.598 -2.478 1.00 4.07 H new ATOM 0 HB2 LYS A 2 -9.063 10.061 -2.658 1.00 4.82 H new ATOM 0 HB3 LYS A 2 -10.569 9.214 -2.369 1.00 4.82 H new ATOM 0 HG2 LYS A 2 -10.136 9.298 -4.796 1.00 5.66 H new ATOM 0 HG3 LYS A 2 -11.553 10.261 -4.429 1.00 5.66 H new ATOM 0 HD2 LYS A 2 -10.465 12.291 -4.850 1.00 6.60 H new ATOM 0 HD3 LYS A 2 -8.900 11.685 -4.344 1.00 6.60 H new ATOM 0 HE2 LYS A 2 -10.227 10.537 -6.827 1.00 7.50 H new ATOM 0 HE3 LYS A 2 -9.374 12.065 -6.927 1.00 7.50 H new ATOM 0 HZ1 LYS A 2 -7.900 10.205 -7.410 1.00 7.90 H new ATOM 0 HZ2 LYS A 2 -7.397 10.992 -5.992 1.00 7.90 H new ATOM 0 HZ3 LYS A 2 -8.224 9.512 -5.894 1.00 7.90 H new ATOM 35 N LYS A 3 -11.977 10.733 -0.113 1.00 2.85 N ATOM 36 CA LYS A 3 -12.146 10.421 1.331 1.00 2.88 C ATOM 37 C LYS A 3 -13.565 9.901 1.558 1.00 2.35 C ATOM 38 O LYS A 3 -13.777 8.935 2.261 1.00 2.83 O ATOM 39 CB LYS A 3 -11.918 11.683 2.168 1.00 3.31 C ATOM 40 CG LYS A 3 -11.452 11.280 3.569 1.00 3.76 C ATOM 41 CD LYS A 3 -11.349 12.517 4.467 1.00 4.46 C ATOM 42 CE LYS A 3 -10.391 13.534 3.845 1.00 5.18 C ATOM 43 NZ LYS A 3 -9.788 14.369 4.923 1.00 5.69 N ATOM 0 H LYS A 3 -12.829 10.678 -0.671 1.00 2.85 H new ATOM 0 HA LYS A 3 -11.420 9.665 1.632 1.00 2.88 H new ATOM 0 HB2 LYS A 3 -11.172 12.319 1.692 1.00 3.31 H new ATOM 0 HB3 LYS A 3 -12.838 12.263 2.231 1.00 3.31 H new ATOM 0 HG2 LYS A 3 -12.152 10.565 4.001 1.00 3.76 H new ATOM 0 HG3 LYS A 3 -10.484 10.783 3.509 1.00 3.76 H new ATOM 0 HD2 LYS A 3 -12.334 12.965 4.598 1.00 4.46 H new ATOM 0 HD3 LYS A 3 -10.995 12.230 5.457 1.00 4.46 H new ATOM 0 HE2 LYS A 3 -9.608 13.019 3.288 1.00 5.18 H new ATOM 0 HE3 LYS A 3 -10.925 14.166 3.135 1.00 5.18 H new ATOM 0 HZ1 LYS A 3 -9.136 15.061 4.502 1.00 5.69 H new ATOM 0 HZ2 LYS A 3 -10.541 14.870 5.436 1.00 5.69 H new ATOM 0 HZ3 LYS A 3 -9.266 13.759 5.584 1.00 5.69 H new ATOM 57 N LYS A 4 -14.537 10.534 0.956 1.00 1.83 N ATOM 58 CA LYS A 4 -15.948 10.080 1.118 1.00 1.71 C ATOM 59 C LYS A 4 -16.732 10.414 -0.152 1.00 1.52 C ATOM 60 O LYS A 4 -17.300 11.478 -0.279 1.00 2.02 O ATOM 61 CB LYS A 4 -16.591 10.800 2.302 1.00 2.12 C ATOM 62 CG LYS A 4 -15.789 10.524 3.573 1.00 2.54 C ATOM 63 CD LYS A 4 -16.596 10.983 4.786 1.00 3.17 C ATOM 64 CE LYS A 4 -15.689 11.751 5.748 1.00 3.65 C ATOM 65 NZ LYS A 4 -16.483 12.192 6.928 1.00 4.24 N ATOM 0 H LYS A 4 -14.413 11.350 0.356 1.00 1.83 H new ATOM 0 HA LYS A 4 -15.962 9.005 1.295 1.00 1.71 H new ATOM 0 HB2 LYS A 4 -16.629 11.872 2.110 1.00 2.12 H new ATOM 0 HB3 LYS A 4 -17.620 10.463 2.430 1.00 2.12 H new ATOM 0 HG2 LYS A 4 -15.565 9.460 3.652 1.00 2.54 H new ATOM 0 HG3 LYS A 4 -14.835 11.049 3.536 1.00 2.54 H new ATOM 0 HD2 LYS A 4 -17.423 11.617 4.466 1.00 3.17 H new ATOM 0 HD3 LYS A 4 -17.032 10.122 5.292 1.00 3.17 H new ATOM 0 HE2 LYS A 4 -14.861 11.118 6.068 1.00 3.65 H new ATOM 0 HE3 LYS A 4 -15.254 12.615 5.245 1.00 3.65 H new ATOM 0 HZ1 LYS A 4 -15.868 12.715 7.584 1.00 4.24 H new ATOM 0 HZ2 LYS A 4 -17.258 12.810 6.613 1.00 4.24 H new ATOM 0 HZ3 LYS A 4 -16.877 11.360 7.412 1.00 4.24 H new ATOM 79 N SER A 5 -16.771 9.513 -1.090 1.00 1.49 N ATOM 80 CA SER A 5 -17.521 9.773 -2.349 1.00 1.72 C ATOM 81 C SER A 5 -17.405 8.556 -3.255 1.00 1.51 C ATOM 82 O SER A 5 -18.056 8.462 -4.274 1.00 1.76 O ATOM 83 CB SER A 5 -16.944 10.985 -3.057 1.00 2.08 C ATOM 84 OG SER A 5 -17.954 11.978 -3.191 1.00 2.67 O ATOM 0 H SER A 5 -16.314 8.603 -1.039 1.00 1.49 H new ATOM 0 HA SER A 5 -18.568 9.965 -2.114 1.00 1.72 H new ATOM 0 HB2 SER A 5 -16.100 11.382 -2.493 1.00 2.08 H new ATOM 0 HB3 SER A 5 -16.565 10.701 -4.039 1.00 2.08 H new ATOM 0 HG SER A 5 -18.203 12.313 -2.304 1.00 2.67 H new ATOM 90 N LYS A 6 -16.563 7.630 -2.899 1.00 1.38 N ATOM 91 CA LYS A 6 -16.384 6.424 -3.746 1.00 1.30 C ATOM 92 C LYS A 6 -15.613 5.368 -2.954 1.00 1.16 C ATOM 93 O LYS A 6 -15.714 4.186 -3.210 1.00 1.17 O ATOM 94 CB LYS A 6 -15.590 6.817 -4.994 1.00 1.59 C ATOM 95 CG LYS A 6 -15.467 5.623 -5.941 1.00 2.31 C ATOM 96 CD LYS A 6 -15.318 6.128 -7.378 1.00 2.60 C ATOM 97 CE LYS A 6 -14.494 5.130 -8.192 1.00 3.41 C ATOM 98 NZ LYS A 6 -14.754 3.749 -7.698 1.00 3.78 N ATOM 0 H LYS A 6 -15.990 7.657 -2.056 1.00 1.38 H new ATOM 0 HA LYS A 6 -17.352 6.018 -4.039 1.00 1.30 H new ATOM 0 HB2 LYS A 6 -16.085 7.644 -5.503 1.00 1.59 H new ATOM 0 HB3 LYS A 6 -14.598 7.167 -4.707 1.00 1.59 H new ATOM 0 HG2 LYS A 6 -14.606 5.014 -5.667 1.00 2.31 H new ATOM 0 HG3 LYS A 6 -16.347 4.986 -5.857 1.00 2.31 H new ATOM 0 HD2 LYS A 6 -16.301 6.259 -7.832 1.00 2.60 H new ATOM 0 HD3 LYS A 6 -14.833 7.104 -7.382 1.00 2.60 H new ATOM 0 HE2 LYS A 6 -14.753 5.204 -9.248 1.00 3.41 H new ATOM 0 HE3 LYS A 6 -13.433 5.364 -8.107 1.00 3.41 H new ATOM 0 HZ1 LYS A 6 -13.852 3.290 -7.460 1.00 3.78 H new ATOM 0 HZ2 LYS A 6 -15.356 3.791 -6.851 1.00 3.78 H new ATOM 0 HZ3 LYS A 6 -15.237 3.201 -8.438 1.00 3.78 H new ATOM 112 N LEU A 7 -14.837 5.789 -1.995 1.00 1.10 N ATOM 113 CA LEU A 7 -14.057 4.813 -1.184 1.00 1.09 C ATOM 114 C LEU A 7 -14.793 4.502 0.126 1.00 1.01 C ATOM 115 O LEU A 7 -15.210 3.385 0.371 1.00 0.97 O ATOM 116 CB LEU A 7 -12.685 5.407 -0.861 1.00 1.23 C ATOM 117 CG LEU A 7 -11.702 4.278 -0.548 1.00 1.37 C ATOM 118 CD1 LEU A 7 -10.964 3.873 -1.826 1.00 2.05 C ATOM 119 CD2 LEU A 7 -10.691 4.758 0.495 1.00 1.67 C ATOM 0 H LEU A 7 -14.709 6.768 -1.737 1.00 1.10 H new ATOM 0 HA LEU A 7 -13.940 3.891 -1.754 1.00 1.09 H new ATOM 0 HB2 LEU A 7 -12.324 5.995 -1.705 1.00 1.23 H new ATOM 0 HB3 LEU A 7 -12.761 6.084 -0.010 1.00 1.23 H new ATOM 0 HG LEU A 7 -12.248 3.419 -0.157 1.00 1.37 H new ATOM 0 HD11 LEU A 7 -10.264 3.068 -1.602 1.00 2.05 H new ATOM 0 HD12 LEU A 7 -11.684 3.531 -2.569 1.00 2.05 H new ATOM 0 HD13 LEU A 7 -10.418 4.731 -2.218 1.00 2.05 H new ATOM 0 HD21 LEU A 7 -9.990 3.954 0.719 1.00 1.67 H new ATOM 0 HD22 LEU A 7 -10.145 5.617 0.105 1.00 1.67 H new ATOM 0 HD23 LEU A 7 -11.216 5.045 1.406 1.00 1.67 H new ATOM 131 N GLU A 8 -14.921 5.478 0.983 1.00 1.07 N ATOM 132 CA GLU A 8 -15.587 5.232 2.295 1.00 1.16 C ATOM 133 C GLU A 8 -17.109 5.177 2.146 1.00 1.10 C ATOM 134 O GLU A 8 -17.700 4.141 2.317 1.00 1.03 O ATOM 135 CB GLU A 8 -15.221 6.356 3.263 1.00 1.37 C ATOM 136 CG GLU A 8 -16.109 6.271 4.505 1.00 1.46 C ATOM 137 CD GLU A 8 -15.456 7.040 5.654 1.00 1.74 C ATOM 138 OE1 GLU A 8 -15.653 8.242 5.724 1.00 2.13 O ATOM 139 OE2 GLU A 8 -14.767 6.415 6.444 1.00 2.33 O ATOM 0 H GLU A 8 -14.595 6.433 0.833 1.00 1.07 H new ATOM 0 HA GLU A 8 -15.244 4.270 2.677 1.00 1.16 H new ATOM 0 HB2 GLU A 8 -14.172 6.278 3.547 1.00 1.37 H new ATOM 0 HB3 GLU A 8 -15.348 7.324 2.778 1.00 1.37 H new ATOM 0 HG2 GLU A 8 -17.094 6.685 4.290 1.00 1.46 H new ATOM 0 HG3 GLU A 8 -16.257 5.229 4.789 1.00 1.46 H new ATOM 146 N ILE A 9 -17.732 6.281 1.824 1.00 1.18 N ATOM 147 CA ILE A 9 -19.229 6.278 1.684 1.00 1.23 C ATOM 148 C ILE A 9 -19.638 4.904 1.146 1.00 1.11 C ATOM 149 O ILE A 9 -20.580 4.284 1.594 1.00 1.20 O ATOM 150 CB ILE A 9 -19.670 7.400 0.727 1.00 1.31 C ATOM 151 CG1 ILE A 9 -21.122 7.778 1.029 1.00 1.91 C ATOM 152 CG2 ILE A 9 -19.555 6.961 -0.738 1.00 1.86 C ATOM 153 CD1 ILE A 9 -21.154 8.869 2.099 1.00 2.19 C ATOM 0 H ILE A 9 -17.279 7.179 1.652 1.00 1.18 H new ATOM 0 HA ILE A 9 -19.711 6.460 2.644 1.00 1.23 H new ATOM 0 HB ILE A 9 -19.015 8.258 0.879 1.00 1.31 H new ATOM 0 HG12 ILE A 9 -21.613 8.129 0.122 1.00 1.91 H new ATOM 0 HG13 ILE A 9 -21.673 6.902 1.371 1.00 1.91 H new ATOM 0 HG21 ILE A 9 -19.874 7.776 -1.388 1.00 1.86 H new ATOM 0 HG22 ILE A 9 -18.520 6.703 -0.960 1.00 1.86 H new ATOM 0 HG23 ILE A 9 -20.190 6.091 -0.908 1.00 1.86 H new ATOM 0 HD11 ILE A 9 -22.188 9.138 2.314 1.00 2.19 H new ATOM 0 HD12 ILE A 9 -20.679 8.501 3.008 1.00 2.19 H new ATOM 0 HD13 ILE A 9 -20.618 9.747 1.739 1.00 2.19 H new ATOM 165 N ILE A 10 -18.892 4.439 0.194 1.00 0.96 N ATOM 166 CA ILE A 10 -19.141 3.105 -0.423 1.00 0.91 C ATOM 167 C ILE A 10 -19.028 2.024 0.654 1.00 0.82 C ATOM 168 O ILE A 10 -19.941 1.251 0.872 1.00 0.85 O ATOM 169 CB ILE A 10 -18.101 2.882 -1.543 1.00 0.92 C ATOM 170 CG1 ILE A 10 -18.707 3.273 -2.913 1.00 1.11 C ATOM 171 CG2 ILE A 10 -17.624 1.417 -1.569 1.00 0.92 C ATOM 172 CD1 ILE A 10 -19.232 2.036 -3.641 1.00 1.39 C ATOM 0 H ILE A 10 -18.094 4.940 -0.198 1.00 0.96 H new ATOM 0 HA ILE A 10 -20.142 3.057 -0.853 1.00 0.91 H new ATOM 0 HB ILE A 10 -17.237 3.515 -1.341 1.00 0.92 H new ATOM 0 HG12 ILE A 10 -19.517 3.988 -2.768 1.00 1.11 H new ATOM 0 HG13 ILE A 10 -17.951 3.768 -3.523 1.00 1.11 H new ATOM 0 HG21 ILE A 10 -16.892 1.287 -2.366 1.00 0.92 H new ATOM 0 HG22 ILE A 10 -17.166 1.166 -0.612 1.00 0.92 H new ATOM 0 HG23 ILE A 10 -18.476 0.760 -1.747 1.00 0.92 H new ATOM 0 HD11 ILE A 10 -19.654 2.331 -4.602 1.00 1.39 H new ATOM 0 HD12 ILE A 10 -18.413 1.335 -3.804 1.00 1.39 H new ATOM 0 HD13 ILE A 10 -20.004 1.558 -3.037 1.00 1.39 H new ATOM 184 N GLN A 11 -17.913 1.960 1.328 1.00 0.77 N ATOM 185 CA GLN A 11 -17.744 0.927 2.387 1.00 0.74 C ATOM 186 C GLN A 11 -18.942 0.966 3.339 1.00 0.80 C ATOM 187 O GLN A 11 -19.445 -0.058 3.759 1.00 0.78 O ATOM 188 CB GLN A 11 -16.462 1.212 3.172 1.00 0.77 C ATOM 189 CG GLN A 11 -15.910 -0.098 3.739 1.00 1.36 C ATOM 190 CD GLN A 11 -14.965 0.209 4.903 1.00 1.62 C ATOM 191 OE1 GLN A 11 -13.766 0.288 4.722 1.00 2.31 O ATOM 192 NE2 GLN A 11 -15.458 0.389 6.097 1.00 1.94 N ATOM 0 H GLN A 11 -17.113 2.578 1.191 1.00 0.77 H new ATOM 0 HA GLN A 11 -17.681 -0.059 1.926 1.00 0.74 H new ATOM 0 HB2 GLN A 11 -15.722 1.680 2.523 1.00 0.77 H new ATOM 0 HB3 GLN A 11 -16.666 1.913 3.981 1.00 0.77 H new ATOM 0 HG2 GLN A 11 -16.728 -0.733 4.078 1.00 1.36 H new ATOM 0 HG3 GLN A 11 -15.380 -0.649 2.962 1.00 1.36 H new ATOM 0 HE21 GLN A 11 -16.464 0.323 6.249 1.00 1.94 H new ATOM 0 HE22 GLN A 11 -14.837 0.596 6.879 1.00 1.94 H new ATOM 201 N ALA A 12 -19.412 2.136 3.671 1.00 0.90 N ATOM 202 CA ALA A 12 -20.584 2.245 4.585 1.00 0.98 C ATOM 203 C ALA A 12 -21.830 1.663 3.913 1.00 0.94 C ATOM 204 O ALA A 12 -22.696 1.112 4.564 1.00 0.94 O ATOM 205 CB ALA A 12 -20.831 3.716 4.926 1.00 1.11 C ATOM 0 H ALA A 12 -19.033 3.026 3.347 1.00 0.90 H new ATOM 0 HA ALA A 12 -20.376 1.686 5.497 1.00 0.98 H new ATOM 0 HB1 ALA A 12 -21.688 3.796 5.594 1.00 1.11 H new ATOM 0 HB2 ALA A 12 -19.949 4.129 5.416 1.00 1.11 H new ATOM 0 HB3 ALA A 12 -21.032 4.273 4.011 1.00 1.11 H new ATOM 211 N ILE A 13 -21.939 1.788 2.616 1.00 0.90 N ATOM 212 CA ILE A 13 -23.140 1.248 1.927 1.00 0.86 C ATOM 213 C ILE A 13 -23.141 -0.280 2.010 1.00 0.75 C ATOM 214 O ILE A 13 -24.074 -0.873 2.502 1.00 0.72 O ATOM 215 CB ILE A 13 -23.139 1.685 0.459 1.00 0.87 C ATOM 216 CG1 ILE A 13 -23.406 3.189 0.376 1.00 1.03 C ATOM 217 CG2 ILE A 13 -24.241 0.940 -0.295 1.00 0.85 C ATOM 218 CD1 ILE A 13 -23.071 3.693 -1.029 1.00 1.06 C ATOM 0 H ILE A 13 -21.252 2.238 2.011 1.00 0.90 H new ATOM 0 HA ILE A 13 -24.035 1.635 2.415 1.00 0.86 H new ATOM 0 HB ILE A 13 -22.170 1.457 0.014 1.00 0.87 H new ATOM 0 HG12 ILE A 13 -24.451 3.396 0.608 1.00 1.03 H new ATOM 0 HG13 ILE A 13 -22.804 3.717 1.116 1.00 1.03 H new ATOM 0 HG21 ILE A 13 -24.241 1.251 -1.340 1.00 0.85 H new ATOM 0 HG22 ILE A 13 -24.061 -0.133 -0.235 1.00 0.85 H new ATOM 0 HG23 ILE A 13 -25.208 1.171 0.152 1.00 0.85 H new ATOM 0 HD11 ILE A 13 -23.262 4.765 -1.086 1.00 1.06 H new ATOM 0 HD12 ILE A 13 -22.020 3.500 -1.244 1.00 1.06 H new ATOM 0 HD13 ILE A 13 -23.692 3.174 -1.759 1.00 1.06 H new ATOM 230 N LEU A 14 -22.103 -0.917 1.539 1.00 0.74 N ATOM 231 CA LEU A 14 -22.046 -2.412 1.585 1.00 0.65 C ATOM 232 C LEU A 14 -22.238 -2.914 3.009 1.00 0.67 C ATOM 233 O LEU A 14 -22.865 -3.929 3.242 1.00 0.64 O ATOM 234 CB LEU A 14 -20.675 -2.882 1.088 1.00 0.65 C ATOM 235 CG LEU A 14 -20.319 -2.149 -0.201 1.00 0.67 C ATOM 236 CD1 LEU A 14 -19.046 -2.746 -0.801 1.00 0.61 C ATOM 237 CD2 LEU A 14 -21.467 -2.304 -1.190 1.00 1.04 C ATOM 0 H LEU A 14 -21.288 -0.467 1.122 1.00 0.74 H new ATOM 0 HA LEU A 14 -22.842 -2.806 0.953 1.00 0.65 H new ATOM 0 HB2 LEU A 14 -19.917 -2.692 1.848 1.00 0.65 H new ATOM 0 HB3 LEU A 14 -20.689 -3.958 0.914 1.00 0.65 H new ATOM 0 HG LEU A 14 -20.151 -1.093 0.012 1.00 0.67 H new ATOM 0 HD11 LEU A 14 -18.796 -2.219 -1.722 1.00 0.61 H new ATOM 0 HD12 LEU A 14 -18.226 -2.644 -0.090 1.00 0.61 H new ATOM 0 HD13 LEU A 14 -19.207 -3.802 -1.020 1.00 0.61 H new ATOM 0 HD21 LEU A 14 -21.223 -1.783 -2.116 1.00 1.04 H new ATOM 0 HD22 LEU A 14 -21.626 -3.362 -1.400 1.00 1.04 H new ATOM 0 HD23 LEU A 14 -22.375 -1.878 -0.763 1.00 1.04 H new ATOM 249 N GLU A 15 -21.703 -2.221 3.962 1.00 0.75 N ATOM 250 CA GLU A 15 -21.855 -2.672 5.366 1.00 0.80 C ATOM 251 C GLU A 15 -23.312 -2.534 5.798 1.00 0.83 C ATOM 252 O GLU A 15 -23.822 -3.324 6.564 1.00 0.85 O ATOM 253 CB GLU A 15 -20.962 -1.838 6.285 1.00 0.87 C ATOM 254 CG GLU A 15 -19.947 -2.758 6.963 1.00 0.89 C ATOM 255 CD GLU A 15 -19.187 -1.981 8.041 1.00 1.01 C ATOM 256 OE1 GLU A 15 -19.755 -1.047 8.581 1.00 1.53 O ATOM 257 OE2 GLU A 15 -18.049 -2.334 8.305 1.00 1.43 O ATOM 0 H GLU A 15 -21.167 -1.363 3.833 1.00 0.75 H new ATOM 0 HA GLU A 15 -21.557 -3.718 5.436 1.00 0.80 H new ATOM 0 HB2 GLU A 15 -20.447 -1.067 5.711 1.00 0.87 H new ATOM 0 HB3 GLU A 15 -21.566 -1.327 7.035 1.00 0.87 H new ATOM 0 HG2 GLU A 15 -20.457 -3.613 7.408 1.00 0.89 H new ATOM 0 HG3 GLU A 15 -19.249 -3.152 6.225 1.00 0.89 H new ATOM 264 N ALA A 16 -23.993 -1.541 5.314 1.00 0.85 N ATOM 265 CA ALA A 16 -25.408 -1.374 5.707 1.00 0.88 C ATOM 266 C ALA A 16 -26.217 -2.525 5.127 1.00 0.83 C ATOM 267 O ALA A 16 -27.142 -3.012 5.739 1.00 0.86 O ATOM 268 CB ALA A 16 -25.933 -0.047 5.170 1.00 0.91 C ATOM 0 H ALA A 16 -23.631 -0.841 4.666 1.00 0.85 H new ATOM 0 HA ALA A 16 -25.497 -1.375 6.793 1.00 0.88 H new ATOM 0 HB1 ALA A 16 -26.977 0.076 5.460 1.00 0.91 H new ATOM 0 HB2 ALA A 16 -25.343 0.771 5.583 1.00 0.91 H new ATOM 0 HB3 ALA A 16 -25.855 -0.038 4.083 1.00 0.91 H new ATOM 274 N CYS A 17 -25.881 -2.968 3.948 1.00 0.76 N ATOM 275 CA CYS A 17 -26.651 -4.083 3.354 1.00 0.72 C ATOM 276 C CYS A 17 -26.231 -5.412 3.988 1.00 0.71 C ATOM 277 O CYS A 17 -26.876 -6.419 3.796 1.00 0.71 O ATOM 278 CB CYS A 17 -26.423 -4.153 1.842 1.00 0.65 C ATOM 279 SG CYS A 17 -25.490 -2.716 1.278 1.00 0.81 S ATOM 0 H CYS A 17 -25.115 -2.608 3.379 1.00 0.76 H new ATOM 0 HA CYS A 17 -27.709 -3.904 3.547 1.00 0.72 H new ATOM 0 HB2 CYS A 17 -25.883 -5.066 1.591 1.00 0.65 H new ATOM 0 HB3 CYS A 17 -27.382 -4.198 1.325 1.00 0.65 H new ATOM 0 HG CYS A 17 -25.394 -1.854 2.246 1.00 0.81 H new ATOM 285 N LYS A 18 -25.147 -5.438 4.723 1.00 0.72 N ATOM 286 CA LYS A 18 -24.693 -6.721 5.337 1.00 0.73 C ATOM 287 C LYS A 18 -25.840 -7.441 6.062 1.00 0.83 C ATOM 288 O LYS A 18 -25.658 -8.530 6.568 1.00 0.87 O ATOM 289 CB LYS A 18 -23.565 -6.437 6.333 1.00 0.78 C ATOM 290 CG LYS A 18 -24.151 -5.962 7.670 1.00 1.34 C ATOM 291 CD LYS A 18 -23.043 -5.341 8.527 1.00 1.96 C ATOM 292 CE LYS A 18 -22.085 -6.434 9.009 1.00 2.36 C ATOM 293 NZ LYS A 18 -21.197 -5.880 10.069 1.00 2.97 N ATOM 0 H LYS A 18 -24.559 -4.629 4.923 1.00 0.72 H new ATOM 0 HA LYS A 18 -24.339 -7.370 4.536 1.00 0.73 H new ATOM 0 HB2 LYS A 18 -22.970 -7.337 6.487 1.00 0.78 H new ATOM 0 HB3 LYS A 18 -22.896 -5.677 5.930 1.00 0.78 H new ATOM 0 HG2 LYS A 18 -24.940 -5.231 7.493 1.00 1.34 H new ATOM 0 HG3 LYS A 18 -24.605 -6.801 8.198 1.00 1.34 H new ATOM 0 HD2 LYS A 18 -22.497 -4.596 7.948 1.00 1.96 H new ATOM 0 HD3 LYS A 18 -23.479 -4.824 9.382 1.00 1.96 H new ATOM 0 HE2 LYS A 18 -22.649 -7.282 9.398 1.00 2.36 H new ATOM 0 HE3 LYS A 18 -21.488 -6.804 8.175 1.00 2.36 H new ATOM 0 HZ1 LYS A 18 -20.545 -6.621 10.398 1.00 2.97 H new ATOM 0 HZ2 LYS A 18 -20.650 -5.084 9.683 1.00 2.97 H new ATOM 0 HZ3 LYS A 18 -21.775 -5.548 10.867 1.00 2.97 H new ATOM 307 N SER A 19 -27.012 -6.868 6.135 1.00 0.88 N ATOM 308 CA SER A 19 -28.115 -7.573 6.851 1.00 0.99 C ATOM 309 C SER A 19 -29.473 -7.023 6.418 1.00 1.05 C ATOM 310 O SER A 19 -30.434 -7.075 7.160 1.00 1.21 O ATOM 311 CB SER A 19 -27.947 -7.378 8.358 1.00 1.07 C ATOM 312 OG SER A 19 -28.143 -8.622 9.016 1.00 1.10 O ATOM 0 H SER A 19 -27.251 -5.959 5.738 1.00 0.88 H new ATOM 0 HA SER A 19 -28.071 -8.634 6.605 1.00 0.99 H new ATOM 0 HB2 SER A 19 -26.952 -6.990 8.578 1.00 1.07 H new ATOM 0 HB3 SER A 19 -28.664 -6.643 8.724 1.00 1.07 H new ATOM 0 HG SER A 19 -28.035 -8.502 9.983 1.00 1.10 H new ATOM 318 N GLY A 20 -29.576 -6.512 5.225 1.00 0.94 N ATOM 319 CA GLY A 20 -30.887 -5.982 4.763 1.00 1.01 C ATOM 320 C GLY A 20 -31.252 -4.726 5.554 1.00 1.07 C ATOM 321 O GLY A 20 -31.713 -4.804 6.676 1.00 1.15 O ATOM 0 H GLY A 20 -28.813 -6.438 4.552 1.00 0.94 H new ATOM 0 HA2 GLY A 20 -30.840 -5.751 3.699 1.00 1.01 H new ATOM 0 HA3 GLY A 20 -31.660 -6.740 4.891 1.00 1.01 H new ATOM 325 N SER A 21 -31.053 -3.568 4.983 1.00 1.06 N ATOM 326 CA SER A 21 -31.395 -2.312 5.711 1.00 1.14 C ATOM 327 C SER A 21 -31.846 -1.246 4.691 1.00 1.14 C ATOM 328 O SER A 21 -31.189 -1.050 3.687 1.00 1.07 O ATOM 329 CB SER A 21 -30.156 -1.816 6.452 1.00 1.14 C ATOM 330 OG SER A 21 -29.277 -2.910 6.669 1.00 1.09 O ATOM 0 H SER A 21 -30.670 -3.438 4.047 1.00 1.06 H new ATOM 0 HA SER A 21 -32.199 -2.499 6.424 1.00 1.14 H new ATOM 0 HB2 SER A 21 -29.656 -1.041 5.872 1.00 1.14 H new ATOM 0 HB3 SER A 21 -30.441 -1.368 7.404 1.00 1.14 H new ATOM 0 HG SER A 21 -28.557 -2.888 6.005 1.00 1.09 H new ATOM 336 N PRO A 22 -32.958 -0.559 4.919 1.00 1.23 N ATOM 337 CA PRO A 22 -33.435 0.490 3.971 1.00 1.26 C ATOM 338 C PRO A 22 -32.343 1.517 3.663 1.00 1.26 C ATOM 339 O PRO A 22 -31.369 1.628 4.381 1.00 1.25 O ATOM 340 CB PRO A 22 -34.591 1.179 4.700 1.00 1.35 C ATOM 341 CG PRO A 22 -35.031 0.247 5.777 1.00 1.47 C ATOM 342 CD PRO A 22 -33.872 -0.706 6.073 1.00 1.34 C ATOM 0 HA PRO A 22 -33.726 0.051 3.017 1.00 1.26 H new ATOM 0 HB2 PRO A 22 -34.271 2.133 5.120 1.00 1.35 H new ATOM 0 HB3 PRO A 22 -35.410 1.392 4.013 1.00 1.35 H new ATOM 0 HG2 PRO A 22 -35.307 0.802 6.673 1.00 1.47 H new ATOM 0 HG3 PRO A 22 -35.913 -0.311 5.463 1.00 1.47 H new ATOM 0 HD2 PRO A 22 -33.375 -0.446 7.007 1.00 1.34 H new ATOM 0 HD3 PRO A 22 -34.221 -1.734 6.173 1.00 1.34 H new ATOM 350 N LYS A 23 -32.499 2.276 2.613 1.00 1.27 N ATOM 351 CA LYS A 23 -31.468 3.296 2.285 1.00 1.28 C ATOM 352 C LYS A 23 -31.350 4.263 3.470 1.00 1.33 C ATOM 353 O LYS A 23 -30.323 4.873 3.692 1.00 1.35 O ATOM 354 CB LYS A 23 -31.886 4.064 1.020 1.00 1.31 C ATOM 355 CG LYS A 23 -30.751 4.994 0.554 1.00 1.27 C ATOM 356 CD LYS A 23 -31.118 6.453 0.842 1.00 1.83 C ATOM 357 CE LYS A 23 -32.105 6.951 -0.218 1.00 1.76 C ATOM 358 NZ LYS A 23 -33.009 7.973 0.382 1.00 2.13 N ATOM 0 H LYS A 23 -33.292 2.233 1.972 1.00 1.27 H new ATOM 0 HA LYS A 23 -30.507 2.816 2.101 1.00 1.28 H new ATOM 0 HB2 LYS A 23 -32.136 3.360 0.226 1.00 1.31 H new ATOM 0 HB3 LYS A 23 -32.783 4.649 1.222 1.00 1.31 H new ATOM 0 HG2 LYS A 23 -29.824 4.735 1.066 1.00 1.27 H new ATOM 0 HG3 LYS A 23 -30.574 4.859 -0.513 1.00 1.27 H new ATOM 0 HD2 LYS A 23 -31.560 6.539 1.835 1.00 1.83 H new ATOM 0 HD3 LYS A 23 -30.221 7.072 0.838 1.00 1.83 H new ATOM 0 HE2 LYS A 23 -31.563 7.380 -1.061 1.00 1.76 H new ATOM 0 HE3 LYS A 23 -32.689 6.117 -0.606 1.00 1.76 H new ATOM 0 HZ1 LYS A 23 -33.513 8.478 -0.375 1.00 2.13 H new ATOM 0 HZ2 LYS A 23 -33.699 7.504 1.004 1.00 2.13 H new ATOM 0 HZ3 LYS A 23 -32.448 8.650 0.936 1.00 2.13 H new ATOM 372 N THR A 24 -32.403 4.393 4.240 1.00 1.35 N ATOM 373 CA THR A 24 -32.384 5.301 5.427 1.00 1.41 C ATOM 374 C THR A 24 -31.447 4.764 6.520 1.00 1.43 C ATOM 375 O THR A 24 -30.731 5.513 7.154 1.00 1.48 O ATOM 376 CB THR A 24 -33.802 5.417 5.993 1.00 1.40 C ATOM 377 OG1 THR A 24 -34.195 4.166 6.540 1.00 1.42 O ATOM 378 CG2 THR A 24 -34.768 5.815 4.877 1.00 1.42 C ATOM 0 H THR A 24 -33.285 3.902 4.094 1.00 1.35 H new ATOM 0 HA THR A 24 -32.019 6.278 5.109 1.00 1.41 H new ATOM 0 HB THR A 24 -33.821 6.177 6.774 1.00 1.40 H new ATOM 0 HG1 THR A 24 -35.102 4.239 6.904 1.00 1.42 H new ATOM 0 HG21 THR A 24 -35.777 5.897 5.281 1.00 1.42 H new ATOM 0 HG22 THR A 24 -34.465 6.775 4.459 1.00 1.42 H new ATOM 0 HG23 THR A 24 -34.752 5.057 4.094 1.00 1.42 H new ATOM 386 N ARG A 25 -31.455 3.476 6.757 1.00 1.40 N ATOM 387 CA ARG A 25 -30.576 2.896 7.821 1.00 1.43 C ATOM 388 C ARG A 25 -29.114 3.140 7.453 1.00 1.44 C ATOM 389 O ARG A 25 -28.213 2.955 8.245 1.00 1.47 O ATOM 390 CB ARG A 25 -30.837 1.387 7.907 1.00 1.39 C ATOM 391 CG ARG A 25 -31.049 0.956 9.364 1.00 1.72 C ATOM 392 CD ARG A 25 -29.721 1.042 10.116 1.00 1.56 C ATOM 393 NE ARG A 25 -29.920 0.627 11.534 1.00 2.13 N ATOM 394 CZ ARG A 25 -30.024 -0.638 11.835 1.00 2.45 C ATOM 395 NH1 ARG A 25 -29.974 -1.539 10.893 1.00 2.53 N ATOM 396 NH2 ARG A 25 -30.181 -1.003 13.079 1.00 3.15 N ATOM 0 H ARG A 25 -32.033 2.799 6.259 1.00 1.40 H new ATOM 0 HA ARG A 25 -30.790 3.364 8.782 1.00 1.43 H new ATOM 0 HB2 ARG A 25 -31.716 1.130 7.315 1.00 1.39 H new ATOM 0 HB3 ARG A 25 -29.995 0.842 7.480 1.00 1.39 H new ATOM 0 HG2 ARG A 25 -31.792 1.596 9.840 1.00 1.72 H new ATOM 0 HG3 ARG A 25 -31.436 -0.062 9.401 1.00 1.72 H new ATOM 0 HD2 ARG A 25 -28.980 0.400 9.640 1.00 1.56 H new ATOM 0 HD3 ARG A 25 -29.334 2.060 10.076 1.00 1.56 H new ATOM 0 HE ARG A 25 -29.975 1.332 12.269 1.00 2.13 H new ATOM 0 HH11 ARG A 25 -29.854 -1.254 9.921 1.00 2.53 H new ATOM 0 HH12 ARG A 25 -30.055 -2.528 11.129 1.00 2.53 H new ATOM 0 HH21 ARG A 25 -30.222 -0.299 13.816 1.00 3.15 H new ATOM 0 HH22 ARG A 25 -30.262 -1.992 13.314 1.00 3.15 H new ATOM 410 N ILE A 26 -28.892 3.570 6.255 1.00 1.41 N ATOM 411 CA ILE A 26 -27.510 3.848 5.816 1.00 1.41 C ATOM 412 C ILE A 26 -27.143 5.254 6.276 1.00 1.49 C ATOM 413 O ILE A 26 -25.986 5.588 6.437 1.00 1.50 O ATOM 414 CB ILE A 26 -27.437 3.704 4.298 1.00 1.34 C ATOM 415 CG1 ILE A 26 -28.220 2.442 3.918 1.00 1.28 C ATOM 416 CG2 ILE A 26 -25.975 3.567 3.861 1.00 1.34 C ATOM 417 CD1 ILE A 26 -27.918 2.030 2.475 1.00 0.96 C ATOM 0 H ILE A 26 -29.613 3.742 5.555 1.00 1.41 H new ATOM 0 HA ILE A 26 -26.799 3.145 6.250 1.00 1.41 H new ATOM 0 HB ILE A 26 -27.860 4.579 3.805 1.00 1.34 H new ATOM 0 HG12 ILE A 26 -27.959 1.629 4.595 1.00 1.28 H new ATOM 0 HG13 ILE A 26 -29.289 2.623 4.033 1.00 1.28 H new ATOM 0 HG21 ILE A 26 -25.927 3.464 2.777 1.00 1.34 H new ATOM 0 HG22 ILE A 26 -25.419 4.454 4.166 1.00 1.34 H new ATOM 0 HG23 ILE A 26 -25.537 2.685 4.328 1.00 1.34 H new ATOM 0 HD11 ILE A 26 -28.484 1.132 2.227 1.00 0.96 H new ATOM 0 HD12 ILE A 26 -28.202 2.837 1.799 1.00 0.96 H new ATOM 0 HD13 ILE A 26 -26.852 1.827 2.370 1.00 0.96 H new ATOM 429 N MET A 27 -28.129 6.080 6.501 1.00 1.55 N ATOM 430 CA MET A 27 -27.845 7.464 6.963 1.00 1.64 C ATOM 431 C MET A 27 -27.062 7.393 8.275 1.00 1.70 C ATOM 432 O MET A 27 -26.091 8.097 8.469 1.00 1.74 O ATOM 433 CB MET A 27 -29.157 8.227 7.162 1.00 1.72 C ATOM 434 CG MET A 27 -29.790 8.555 5.802 1.00 2.02 C ATOM 435 SD MET A 27 -31.463 9.192 6.061 1.00 2.29 S ATOM 436 CE MET A 27 -31.044 10.951 6.011 1.00 1.90 C ATOM 0 H MET A 27 -29.117 5.854 6.384 1.00 1.55 H new ATOM 0 HA MET A 27 -27.253 7.993 6.216 1.00 1.64 H new ATOM 0 HB2 MET A 27 -29.847 7.630 7.758 1.00 1.72 H new ATOM 0 HB3 MET A 27 -28.971 9.147 7.716 1.00 1.72 H new ATOM 0 HG2 MET A 27 -29.185 9.293 5.275 1.00 2.02 H new ATOM 0 HG3 MET A 27 -29.821 7.662 5.177 1.00 2.02 H new ATOM 0 HE1 MET A 27 -31.947 11.544 6.153 1.00 1.90 H new ATOM 0 HE2 MET A 27 -30.332 11.178 6.805 1.00 1.90 H new ATOM 0 HE3 MET A 27 -30.600 11.192 5.045 1.00 1.90 H new ATOM 446 N TYR A 28 -27.465 6.534 9.169 1.00 1.72 N ATOM 447 CA TYR A 28 -26.731 6.397 10.458 1.00 1.80 C ATOM 448 C TYR A 28 -25.298 5.956 10.159 1.00 1.78 C ATOM 449 O TYR A 28 -24.468 5.842 11.039 1.00 2.09 O ATOM 450 CB TYR A 28 -27.419 5.341 11.321 1.00 1.82 C ATOM 451 CG TYR A 28 -26.747 5.269 12.671 1.00 2.02 C ATOM 452 CD1 TYR A 28 -27.073 6.200 13.665 1.00 2.25 C ATOM 453 CD2 TYR A 28 -25.800 4.272 12.929 1.00 2.64 C ATOM 454 CE1 TYR A 28 -26.450 6.133 14.917 1.00 2.48 C ATOM 455 CE2 TYR A 28 -25.177 4.205 14.181 1.00 3.00 C ATOM 456 CZ TYR A 28 -25.503 5.136 15.175 1.00 2.69 C ATOM 457 OH TYR A 28 -24.889 5.070 16.410 1.00 3.10 O ATOM 0 H TYR A 28 -28.272 5.920 9.063 1.00 1.72 H new ATOM 0 HA TYR A 28 -26.725 7.349 10.990 1.00 1.80 H new ATOM 0 HB2 TYR A 28 -28.474 5.587 11.442 1.00 1.82 H new ATOM 0 HB3 TYR A 28 -27.373 4.369 10.829 1.00 1.82 H new ATOM 0 HD1 TYR A 28 -27.805 6.969 13.466 1.00 2.25 H new ATOM 0 HD2 TYR A 28 -25.550 3.554 12.162 1.00 2.64 H new ATOM 0 HE1 TYR A 28 -26.700 6.851 15.684 1.00 2.48 H new ATOM 0 HE2 TYR A 28 -24.445 3.436 14.380 1.00 3.00 H new ATOM 0 HH TYR A 28 -24.259 4.319 16.423 1.00 3.10 H new ATOM 467 N GLY A 29 -25.010 5.711 8.910 1.00 1.51 N ATOM 468 CA GLY A 29 -23.637 5.279 8.522 1.00 1.48 C ATOM 469 C GLY A 29 -22.815 6.500 8.102 1.00 1.54 C ATOM 470 O GLY A 29 -21.612 6.537 8.270 1.00 1.61 O ATOM 0 H GLY A 29 -25.671 5.792 8.137 1.00 1.51 H new ATOM 0 HA2 GLY A 29 -23.154 4.773 9.358 1.00 1.48 H new ATOM 0 HA3 GLY A 29 -23.688 4.563 7.702 1.00 1.48 H new ATOM 474 N ALA A 30 -23.454 7.499 7.556 1.00 1.57 N ATOM 475 CA ALA A 30 -22.710 8.719 7.126 1.00 1.67 C ATOM 476 C ALA A 30 -23.709 9.823 6.758 1.00 1.71 C ATOM 477 O ALA A 30 -24.906 9.647 6.869 1.00 1.72 O ATOM 478 CB ALA A 30 -21.835 8.385 5.912 1.00 1.66 C ATOM 0 H ALA A 30 -24.460 7.524 7.389 1.00 1.57 H new ATOM 0 HA ALA A 30 -22.075 9.065 7.941 1.00 1.67 H new ATOM 0 HB1 ALA A 30 -21.292 9.277 5.599 1.00 1.66 H new ATOM 0 HB2 ALA A 30 -21.125 7.603 6.180 1.00 1.66 H new ATOM 0 HB3 ALA A 30 -22.466 8.038 5.094 1.00 1.66 H new ATOM 484 N ASN A 31 -23.229 10.959 6.324 1.00 1.82 N ATOM 485 CA ASN A 31 -24.153 12.074 5.956 1.00 1.87 C ATOM 486 C ASN A 31 -24.952 11.699 4.703 1.00 1.82 C ATOM 487 O ASN A 31 -25.662 12.511 4.147 1.00 2.17 O ATOM 488 CB ASN A 31 -23.341 13.341 5.683 1.00 2.00 C ATOM 489 CG ASN A 31 -23.013 14.030 7.008 1.00 2.22 C ATOM 490 OD1 ASN A 31 -22.100 13.632 7.704 1.00 2.79 O ATOM 491 ND2 ASN A 31 -23.724 15.056 7.391 1.00 2.38 N ATOM 0 H ASN A 31 -22.236 11.164 6.208 1.00 1.82 H new ATOM 0 HA ASN A 31 -24.843 12.253 6.780 1.00 1.87 H new ATOM 0 HB2 ASN A 31 -22.422 13.090 5.154 1.00 2.00 H new ATOM 0 HB3 ASN A 31 -23.905 14.016 5.039 1.00 2.00 H new ATOM 0 HD21 ASN A 31 -23.513 15.522 8.273 1.00 2.38 H new ATOM 0 HD22 ASN A 31 -24.491 15.391 6.808 1.00 2.38 H new ATOM 498 N LEU A 32 -24.870 10.462 4.297 1.00 1.81 N ATOM 499 CA LEU A 32 -25.642 9.965 3.116 1.00 1.70 C ATOM 500 C LEU A 32 -25.894 11.024 2.066 1.00 1.72 C ATOM 501 O LEU A 32 -26.807 11.821 2.143 1.00 1.84 O ATOM 502 CB LEU A 32 -26.966 9.382 3.584 1.00 1.75 C ATOM 503 CG LEU A 32 -27.042 7.878 3.243 1.00 1.74 C ATOM 504 CD1 LEU A 32 -27.003 7.677 1.729 1.00 1.67 C ATOM 505 CD2 LEU A 32 -25.862 7.119 3.863 1.00 1.69 C ATOM 0 H LEU A 32 -24.286 9.755 4.744 1.00 1.81 H new ATOM 0 HA LEU A 32 -25.028 9.200 2.641 1.00 1.70 H new ATOM 0 HB2 LEU A 32 -27.073 9.523 4.659 1.00 1.75 H new ATOM 0 HB3 LEU A 32 -27.792 9.911 3.109 1.00 1.75 H new ATOM 0 HG LEU A 32 -27.977 7.493 3.649 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -27.057 6.612 1.502 1.00 1.67 H new ATOM 0 HD12 LEU A 32 -27.850 8.189 1.272 1.00 1.67 H new ATOM 0 HD13 LEU A 32 -26.074 8.086 1.331 1.00 1.67 H new ATOM 0 HD21 LEU A 32 -25.936 6.061 3.610 1.00 1.69 H new ATOM 0 HD22 LEU A 32 -24.926 7.521 3.474 1.00 1.69 H new ATOM 0 HD23 LEU A 32 -25.884 7.235 4.947 1.00 1.69 H new ATOM 517 N SER A 33 -25.132 10.944 1.035 1.00 1.63 N ATOM 518 CA SER A 33 -25.311 11.816 -0.137 1.00 1.66 C ATOM 519 C SER A 33 -26.620 11.381 -0.806 1.00 1.68 C ATOM 520 O SER A 33 -26.856 11.679 -1.944 1.00 1.69 O ATOM 521 CB SER A 33 -24.126 11.660 -1.093 1.00 1.58 C ATOM 522 OG SER A 33 -23.094 10.927 -0.446 1.00 1.75 O ATOM 0 H SER A 33 -24.360 10.283 0.951 1.00 1.63 H new ATOM 0 HA SER A 33 -25.356 12.867 0.147 1.00 1.66 H new ATOM 0 HB2 SER A 33 -24.441 11.144 -2.000 1.00 1.58 H new ATOM 0 HB3 SER A 33 -23.757 12.640 -1.396 1.00 1.58 H new ATOM 0 HG SER A 33 -23.039 10.028 -0.833 1.00 1.75 H new ATOM 528 N TYR A 34 -27.404 10.566 -0.109 1.00 1.70 N ATOM 529 CA TYR A 34 -28.658 9.950 -0.674 1.00 1.73 C ATOM 530 C TYR A 34 -29.192 10.705 -1.885 1.00 1.77 C ATOM 531 O TYR A 34 -29.529 10.095 -2.880 1.00 1.71 O ATOM 532 CB TYR A 34 -29.754 9.948 0.392 1.00 1.92 C ATOM 533 CG TYR A 34 -30.383 11.317 0.516 1.00 1.73 C ATOM 534 CD1 TYR A 34 -31.418 11.692 -0.351 1.00 2.49 C ATOM 535 CD2 TYR A 34 -29.943 12.204 1.503 1.00 1.94 C ATOM 536 CE1 TYR A 34 -32.010 12.955 -0.230 1.00 3.01 C ATOM 537 CE2 TYR A 34 -30.534 13.468 1.624 1.00 2.57 C ATOM 538 CZ TYR A 34 -31.567 13.843 0.757 1.00 2.95 C ATOM 539 OH TYR A 34 -32.152 15.088 0.876 1.00 3.85 O ATOM 0 H TYR A 34 -27.214 10.299 0.857 1.00 1.70 H new ATOM 0 HA TYR A 34 -28.395 8.939 -0.985 1.00 1.73 H new ATOM 0 HB2 TYR A 34 -30.517 9.214 0.134 1.00 1.92 H new ATOM 0 HB3 TYR A 34 -29.334 9.647 1.352 1.00 1.92 H new ATOM 0 HD1 TYR A 34 -31.759 11.007 -1.113 1.00 2.49 H new ATOM 0 HD2 TYR A 34 -29.147 11.914 2.173 1.00 1.94 H new ATOM 0 HE1 TYR A 34 -32.808 13.244 -0.898 1.00 3.01 H new ATOM 0 HE2 TYR A 34 -30.193 14.153 2.386 1.00 2.57 H new ATOM 0 HH TYR A 34 -31.729 15.579 1.611 1.00 3.85 H new ATOM 549 N ALA A 35 -29.253 11.997 -1.859 1.00 1.88 N ATOM 550 CA ALA A 35 -29.740 12.689 -3.077 1.00 1.95 C ATOM 551 C ALA A 35 -28.859 12.216 -4.234 1.00 1.82 C ATOM 552 O ALA A 35 -29.327 11.839 -5.290 1.00 1.78 O ATOM 553 CB ALA A 35 -29.606 14.205 -2.904 1.00 2.11 C ATOM 0 H ALA A 35 -28.996 12.594 -1.073 1.00 1.88 H new ATOM 0 HA ALA A 35 -30.790 12.463 -3.265 1.00 1.95 H new ATOM 0 HB1 ALA A 35 -29.965 14.707 -3.802 1.00 2.11 H new ATOM 0 HB2 ALA A 35 -30.198 14.527 -2.047 1.00 2.11 H new ATOM 0 HB3 ALA A 35 -28.559 14.461 -2.739 1.00 2.11 H new ATOM 559 N LEU A 36 -27.575 12.213 -4.005 1.00 1.76 N ATOM 560 CA LEU A 36 -26.600 11.744 -5.031 1.00 1.66 C ATOM 561 C LEU A 36 -26.204 10.279 -4.772 1.00 1.48 C ATOM 562 O LEU A 36 -26.182 9.460 -5.670 1.00 1.40 O ATOM 563 CB LEU A 36 -25.346 12.620 -4.974 1.00 1.73 C ATOM 564 CG LEU A 36 -25.362 13.615 -6.135 1.00 1.83 C ATOM 565 CD1 LEU A 36 -26.619 14.481 -6.050 1.00 2.23 C ATOM 566 CD2 LEU A 36 -24.122 14.509 -6.054 1.00 2.42 C ATOM 0 H LEU A 36 -27.151 12.523 -3.130 1.00 1.76 H new ATOM 0 HA LEU A 36 -27.065 11.815 -6.014 1.00 1.66 H new ATOM 0 HB2 LEU A 36 -25.306 13.154 -4.025 1.00 1.73 H new ATOM 0 HB3 LEU A 36 -24.453 11.998 -5.027 1.00 1.73 H new ATOM 0 HG LEU A 36 -25.360 13.071 -7.080 1.00 1.83 H new ATOM 0 HD11 LEU A 36 -26.629 15.190 -6.878 1.00 2.23 H new ATOM 0 HD12 LEU A 36 -27.503 13.846 -6.105 1.00 2.23 H new ATOM 0 HD13 LEU A 36 -26.622 15.026 -5.106 1.00 2.23 H new ATOM 0 HD21 LEU A 36 -24.131 15.219 -6.881 1.00 2.42 H new ATOM 0 HD22 LEU A 36 -24.126 15.052 -5.109 1.00 2.42 H new ATOM 0 HD23 LEU A 36 -23.225 13.893 -6.115 1.00 2.42 H new ATOM 578 N THR A 37 -25.843 9.962 -3.547 1.00 1.43 N ATOM 579 CA THR A 37 -25.390 8.571 -3.217 1.00 1.30 C ATOM 580 C THR A 37 -26.316 7.536 -3.846 1.00 1.23 C ATOM 581 O THR A 37 -25.868 6.483 -4.248 1.00 1.15 O ATOM 582 CB THR A 37 -25.336 8.369 -1.698 1.00 1.36 C ATOM 583 OG1 THR A 37 -24.142 8.945 -1.191 1.00 1.49 O ATOM 584 CG2 THR A 37 -25.352 6.872 -1.368 1.00 1.33 C ATOM 0 H THR A 37 -25.843 10.611 -2.760 1.00 1.43 H new ATOM 0 HA THR A 37 -24.389 8.437 -3.627 1.00 1.30 H new ATOM 0 HB THR A 37 -26.203 8.847 -1.242 1.00 1.36 H new ATOM 0 HG1 THR A 37 -24.008 8.658 -0.264 1.00 1.49 H new ATOM 0 HG21 THR A 37 -25.313 6.737 -0.287 1.00 1.33 H new ATOM 0 HG22 THR A 37 -26.266 6.423 -1.757 1.00 1.33 H new ATOM 0 HG23 THR A 37 -24.488 6.389 -1.825 1.00 1.33 H new ATOM 592 N GLY A 38 -27.589 7.806 -3.937 1.00 1.26 N ATOM 593 CA GLY A 38 -28.505 6.803 -4.569 1.00 1.21 C ATOM 594 C GLY A 38 -27.830 6.290 -5.845 1.00 1.17 C ATOM 595 O GLY A 38 -28.055 5.184 -6.296 1.00 1.12 O ATOM 0 H GLY A 38 -28.034 8.663 -3.608 1.00 1.26 H new ATOM 0 HA2 GLY A 38 -28.701 5.979 -3.883 1.00 1.21 H new ATOM 0 HA3 GLY A 38 -29.467 7.259 -4.803 1.00 1.21 H new ATOM 599 N ARG A 39 -26.979 7.108 -6.401 1.00 1.22 N ATOM 600 CA ARG A 39 -26.227 6.734 -7.634 1.00 1.23 C ATOM 601 C ARG A 39 -25.241 5.609 -7.303 1.00 1.13 C ATOM 602 O ARG A 39 -24.974 4.740 -8.111 1.00 1.10 O ATOM 603 CB ARG A 39 -25.451 7.965 -8.115 1.00 1.33 C ATOM 604 CG ARG A 39 -24.628 7.630 -9.363 1.00 1.36 C ATOM 605 CD ARG A 39 -23.155 7.965 -9.103 1.00 1.39 C ATOM 606 NE ARG A 39 -22.372 7.766 -10.356 1.00 1.58 N ATOM 607 CZ ARG A 39 -21.076 7.919 -10.348 1.00 2.13 C ATOM 608 NH1 ARG A 39 -20.464 8.248 -9.243 1.00 2.75 N ATOM 609 NH2 ARG A 39 -20.391 7.744 -11.445 1.00 2.58 N ATOM 0 H ARG A 39 -26.769 8.040 -6.045 1.00 1.22 H new ATOM 0 HA ARG A 39 -26.914 6.394 -8.409 1.00 1.23 H new ATOM 0 HB2 ARG A 39 -26.145 8.775 -8.337 1.00 1.33 H new ATOM 0 HB3 ARG A 39 -24.792 8.319 -7.322 1.00 1.33 H new ATOM 0 HG2 ARG A 39 -24.735 6.574 -9.610 1.00 1.36 H new ATOM 0 HG3 ARG A 39 -24.996 8.196 -10.218 1.00 1.36 H new ATOM 0 HD2 ARG A 39 -23.060 8.996 -8.762 1.00 1.39 H new ATOM 0 HD3 ARG A 39 -22.761 7.329 -8.310 1.00 1.39 H new ATOM 0 HE ARG A 39 -22.850 7.510 -11.220 1.00 1.58 H new ATOM 0 HH11 ARG A 39 -20.999 8.386 -8.385 1.00 2.75 H new ATOM 0 HH12 ARG A 39 -19.451 8.367 -9.237 1.00 2.75 H new ATOM 0 HH21 ARG A 39 -20.869 7.488 -12.309 1.00 2.58 H new ATOM 0 HH22 ARG A 39 -19.378 7.864 -11.438 1.00 2.58 H new ATOM 623 N TYR A 40 -24.709 5.618 -6.115 1.00 1.10 N ATOM 624 CA TYR A 40 -23.749 4.553 -5.723 1.00 1.01 C ATOM 625 C TYR A 40 -24.518 3.282 -5.397 1.00 0.91 C ATOM 626 O TYR A 40 -24.080 2.192 -5.692 1.00 0.85 O ATOM 627 CB TYR A 40 -22.926 5.011 -4.514 1.00 1.04 C ATOM 628 CG TYR A 40 -21.679 5.700 -5.015 1.00 1.24 C ATOM 629 CD1 TYR A 40 -20.706 4.967 -5.703 1.00 1.74 C ATOM 630 CD2 TYR A 40 -21.505 7.074 -4.809 1.00 1.92 C ATOM 631 CE1 TYR A 40 -19.557 5.605 -6.182 1.00 2.01 C ATOM 632 CE2 TYR A 40 -20.357 7.713 -5.292 1.00 2.17 C ATOM 633 CZ TYR A 40 -19.382 6.977 -5.978 1.00 1.89 C ATOM 634 OH TYR A 40 -18.251 7.606 -6.458 1.00 2.27 O ATOM 0 H TYR A 40 -24.898 6.318 -5.398 1.00 1.10 H new ATOM 0 HA TYR A 40 -23.064 4.353 -6.547 1.00 1.01 H new ATOM 0 HB2 TYR A 40 -23.511 5.690 -3.894 1.00 1.04 H new ATOM 0 HB3 TYR A 40 -22.662 4.157 -3.890 1.00 1.04 H new ATOM 0 HD1 TYR A 40 -20.842 3.908 -5.864 1.00 1.74 H new ATOM 0 HD2 TYR A 40 -22.256 7.640 -4.278 1.00 1.92 H new ATOM 0 HE1 TYR A 40 -18.805 5.037 -6.710 1.00 2.01 H new ATOM 0 HE2 TYR A 40 -20.223 8.773 -5.136 1.00 2.17 H new ATOM 0 HH TYR A 40 -18.028 8.364 -5.879 1.00 2.27 H new ATOM 644 N ILE A 41 -25.678 3.405 -4.819 1.00 0.89 N ATOM 645 CA ILE A 41 -26.474 2.191 -4.506 1.00 0.80 C ATOM 646 C ILE A 41 -26.857 1.495 -5.812 1.00 0.77 C ATOM 647 O ILE A 41 -26.568 0.338 -6.015 1.00 0.70 O ATOM 648 CB ILE A 41 -27.738 2.597 -3.745 1.00 0.82 C ATOM 649 CG1 ILE A 41 -27.346 3.100 -2.352 1.00 0.92 C ATOM 650 CG2 ILE A 41 -28.667 1.392 -3.604 1.00 0.77 C ATOM 651 CD1 ILE A 41 -28.534 3.824 -1.716 1.00 0.95 C ATOM 0 H ILE A 41 -26.107 4.291 -4.551 1.00 0.89 H new ATOM 0 HA ILE A 41 -25.887 1.510 -3.890 1.00 0.80 H new ATOM 0 HB ILE A 41 -28.253 3.386 -4.293 1.00 0.82 H new ATOM 0 HG12 ILE A 41 -27.039 2.263 -1.725 1.00 0.92 H new ATOM 0 HG13 ILE A 41 -26.492 3.774 -2.424 1.00 0.92 H new ATOM 0 HG21 ILE A 41 -29.565 1.687 -3.061 1.00 0.77 H new ATOM 0 HG22 ILE A 41 -28.944 1.028 -4.594 1.00 0.77 H new ATOM 0 HG23 ILE A 41 -28.156 0.600 -3.056 1.00 0.77 H new ATOM 0 HD11 ILE A 41 -28.254 4.181 -0.725 1.00 0.95 H new ATOM 0 HD12 ILE A 41 -28.820 4.671 -2.340 1.00 0.95 H new ATOM 0 HD13 ILE A 41 -29.375 3.136 -1.629 1.00 0.95 H new ATOM 663 N LYS A 42 -27.499 2.200 -6.698 1.00 0.85 N ATOM 664 CA LYS A 42 -27.910 1.594 -7.996 1.00 0.86 C ATOM 665 C LYS A 42 -26.691 1.022 -8.734 1.00 0.85 C ATOM 666 O LYS A 42 -26.750 -0.049 -9.305 1.00 0.82 O ATOM 667 CB LYS A 42 -28.573 2.671 -8.857 1.00 0.98 C ATOM 668 CG LYS A 42 -29.634 2.039 -9.765 1.00 1.09 C ATOM 669 CD LYS A 42 -28.978 1.029 -10.707 1.00 1.05 C ATOM 670 CE LYS A 42 -29.819 0.895 -11.978 1.00 1.07 C ATOM 671 NZ LYS A 42 -31.264 0.854 -11.615 1.00 1.81 N ATOM 0 H LYS A 42 -27.760 3.179 -6.579 1.00 0.85 H new ATOM 0 HA LYS A 42 -28.611 0.781 -7.806 1.00 0.86 H new ATOM 0 HB2 LYS A 42 -29.032 3.426 -8.219 1.00 0.98 H new ATOM 0 HB3 LYS A 42 -27.821 3.178 -9.461 1.00 0.98 H new ATOM 0 HG2 LYS A 42 -30.395 1.545 -9.161 1.00 1.09 H new ATOM 0 HG3 LYS A 42 -30.139 2.813 -10.343 1.00 1.09 H new ATOM 0 HD2 LYS A 42 -27.968 1.353 -10.959 1.00 1.05 H new ATOM 0 HD3 LYS A 42 -28.888 0.061 -10.214 1.00 1.05 H new ATOM 0 HE2 LYS A 42 -29.624 1.734 -12.646 1.00 1.07 H new ATOM 0 HE3 LYS A 42 -29.542 -0.012 -12.516 1.00 1.07 H new ATOM 0 HZ1 LYS A 42 -31.800 0.388 -12.375 1.00 1.81 H new ATOM 0 HZ2 LYS A 42 -31.385 0.322 -10.730 1.00 1.81 H new ATOM 0 HZ3 LYS A 42 -31.617 1.824 -11.487 1.00 1.81 H new ATOM 685 N MET A 43 -25.588 1.721 -8.732 1.00 0.90 N ATOM 686 CA MET A 43 -24.375 1.204 -9.444 1.00 0.93 C ATOM 687 C MET A 43 -23.952 -0.116 -8.821 1.00 0.80 C ATOM 688 O MET A 43 -23.665 -1.078 -9.499 1.00 0.79 O ATOM 689 CB MET A 43 -23.214 2.197 -9.333 1.00 1.02 C ATOM 690 CG MET A 43 -22.101 1.777 -10.303 1.00 1.13 C ATOM 691 SD MET A 43 -22.143 2.843 -11.764 1.00 2.14 S ATOM 692 CE MET A 43 -20.379 2.766 -12.157 1.00 2.36 C ATOM 0 H MET A 43 -25.471 2.624 -8.272 1.00 0.90 H new ATOM 0 HA MET A 43 -24.624 1.067 -10.496 1.00 0.93 H new ATOM 0 HB2 MET A 43 -23.557 3.205 -9.568 1.00 1.02 H new ATOM 0 HB3 MET A 43 -22.834 2.219 -8.312 1.00 1.02 H new ATOM 0 HG2 MET A 43 -21.130 1.851 -9.813 1.00 1.13 H new ATOM 0 HG3 MET A 43 -22.232 0.735 -10.595 1.00 1.13 H new ATOM 0 HE1 MET A 43 -20.139 3.524 -12.903 1.00 2.36 H new ATOM 0 HE2 MET A 43 -19.797 2.948 -11.254 1.00 2.36 H new ATOM 0 HE3 MET A 43 -20.137 1.779 -12.552 1.00 2.36 H new ATOM 702 N LEU A 44 -23.907 -0.163 -7.526 1.00 0.73 N ATOM 703 CA LEU A 44 -23.496 -1.410 -6.842 1.00 0.61 C ATOM 704 C LEU A 44 -24.499 -2.520 -7.185 1.00 0.57 C ATOM 705 O LEU A 44 -24.178 -3.690 -7.165 1.00 0.54 O ATOM 706 CB LEU A 44 -23.451 -1.138 -5.340 1.00 0.57 C ATOM 707 CG LEU A 44 -22.367 -0.083 -5.064 1.00 0.69 C ATOM 708 CD1 LEU A 44 -22.645 0.620 -3.733 1.00 1.14 C ATOM 709 CD2 LEU A 44 -20.985 -0.741 -5.000 1.00 0.67 C ATOM 0 H LEU A 44 -24.139 0.614 -6.908 1.00 0.73 H new ATOM 0 HA LEU A 44 -22.508 -1.736 -7.169 1.00 0.61 H new ATOM 0 HB2 LEU A 44 -24.421 -0.784 -4.991 1.00 0.57 H new ATOM 0 HB3 LEU A 44 -23.232 -2.057 -4.796 1.00 0.57 H new ATOM 0 HG LEU A 44 -22.384 0.645 -5.875 1.00 0.69 H new ATOM 0 HD11 LEU A 44 -21.872 1.365 -3.547 1.00 1.14 H new ATOM 0 HD12 LEU A 44 -23.618 1.110 -3.776 1.00 1.14 H new ATOM 0 HD13 LEU A 44 -22.644 -0.114 -2.927 1.00 1.14 H new ATOM 0 HD21 LEU A 44 -20.229 0.019 -4.804 1.00 0.67 H new ATOM 0 HD22 LEU A 44 -20.971 -1.481 -4.200 1.00 0.67 H new ATOM 0 HD23 LEU A 44 -20.770 -1.230 -5.950 1.00 0.67 H new ATOM 721 N MET A 45 -25.700 -2.156 -7.544 1.00 0.60 N ATOM 722 CA MET A 45 -26.709 -3.187 -7.936 1.00 0.58 C ATOM 723 C MET A 45 -26.441 -3.555 -9.389 1.00 0.62 C ATOM 724 O MET A 45 -26.370 -4.707 -9.769 1.00 0.59 O ATOM 725 CB MET A 45 -28.124 -2.605 -7.852 1.00 0.64 C ATOM 726 CG MET A 45 -28.381 -2.029 -6.466 1.00 1.07 C ATOM 727 SD MET A 45 -29.229 -3.268 -5.461 1.00 1.19 S ATOM 728 CE MET A 45 -30.595 -2.212 -4.920 1.00 1.04 C ATOM 0 H MET A 45 -26.028 -1.191 -7.584 1.00 0.60 H new ATOM 0 HA MET A 45 -26.634 -4.049 -7.273 1.00 0.58 H new ATOM 0 HB2 MET A 45 -28.249 -1.827 -8.605 1.00 0.64 H new ATOM 0 HB3 MET A 45 -28.857 -3.381 -8.071 1.00 0.64 H new ATOM 0 HG2 MET A 45 -27.440 -1.744 -5.997 1.00 1.07 H new ATOM 0 HG3 MET A 45 -28.987 -1.126 -6.540 1.00 1.07 H new ATOM 0 HE1 MET A 45 -31.261 -2.782 -4.273 1.00 1.04 H new ATOM 0 HE2 MET A 45 -30.199 -1.358 -4.371 1.00 1.04 H new ATOM 0 HE3 MET A 45 -31.149 -1.859 -5.790 1.00 1.04 H new ATOM 738 N ASP A 46 -26.277 -2.547 -10.189 1.00 0.69 N ATOM 739 CA ASP A 46 -25.989 -2.755 -11.628 1.00 0.76 C ATOM 740 C ASP A 46 -24.685 -3.540 -11.766 1.00 0.75 C ATOM 741 O ASP A 46 -24.478 -4.262 -12.721 1.00 0.81 O ATOM 742 CB ASP A 46 -25.842 -1.401 -12.318 1.00 0.85 C ATOM 743 CG ASP A 46 -26.562 -1.432 -13.667 1.00 1.03 C ATOM 744 OD1 ASP A 46 -25.938 -1.822 -14.639 1.00 1.71 O ATOM 745 OD2 ASP A 46 -27.725 -1.064 -13.704 1.00 1.26 O ATOM 0 H ASP A 46 -26.331 -1.570 -9.901 1.00 0.69 H new ATOM 0 HA ASP A 46 -26.805 -3.310 -12.091 1.00 0.76 H new ATOM 0 HB2 ASP A 46 -26.259 -0.614 -11.690 1.00 0.85 H new ATOM 0 HB3 ASP A 46 -24.787 -1.168 -12.463 1.00 0.85 H new ATOM 750 N LEU A 47 -23.797 -3.388 -10.821 1.00 0.69 N ATOM 751 CA LEU A 47 -22.495 -4.107 -10.895 1.00 0.70 C ATOM 752 C LEU A 47 -22.577 -5.436 -10.138 1.00 0.62 C ATOM 753 O LEU A 47 -21.666 -6.236 -10.188 1.00 0.63 O ATOM 754 CB LEU A 47 -21.402 -3.220 -10.299 1.00 0.72 C ATOM 755 CG LEU A 47 -20.747 -2.400 -11.422 1.00 0.84 C ATOM 756 CD1 LEU A 47 -21.817 -1.645 -12.213 1.00 0.89 C ATOM 757 CD2 LEU A 47 -19.762 -1.390 -10.826 1.00 0.89 C ATOM 0 H LEU A 47 -23.918 -2.795 -10.000 1.00 0.69 H new ATOM 0 HA LEU A 47 -22.258 -4.325 -11.936 1.00 0.70 H new ATOM 0 HB2 LEU A 47 -21.827 -2.555 -9.547 1.00 0.72 H new ATOM 0 HB3 LEU A 47 -20.654 -3.833 -9.796 1.00 0.72 H new ATOM 0 HG LEU A 47 -20.216 -3.082 -12.086 1.00 0.84 H new ATOM 0 HD11 LEU A 47 -21.343 -1.067 -13.006 1.00 0.89 H new ATOM 0 HD12 LEU A 47 -22.516 -2.357 -12.651 1.00 0.89 H new ATOM 0 HD13 LEU A 47 -22.355 -0.972 -11.546 1.00 0.89 H new ATOM 0 HD21 LEU A 47 -19.302 -0.813 -11.628 1.00 0.89 H new ATOM 0 HD22 LEU A 47 -20.294 -0.717 -10.154 1.00 0.89 H new ATOM 0 HD23 LEU A 47 -18.988 -1.920 -10.271 1.00 0.89 H new ATOM 769 N GLU A 48 -23.662 -5.676 -9.445 1.00 0.55 N ATOM 770 CA GLU A 48 -23.818 -6.957 -8.687 1.00 0.50 C ATOM 771 C GLU A 48 -23.044 -6.870 -7.369 1.00 0.44 C ATOM 772 O GLU A 48 -21.968 -7.415 -7.226 1.00 0.46 O ATOM 773 CB GLU A 48 -23.311 -8.137 -9.530 1.00 0.56 C ATOM 774 CG GLU A 48 -24.113 -9.392 -9.182 1.00 1.22 C ATOM 775 CD GLU A 48 -25.441 -9.375 -9.940 1.00 1.27 C ATOM 776 OE1 GLU A 48 -25.404 -9.330 -11.159 1.00 1.73 O ATOM 777 OE2 GLU A 48 -26.473 -9.408 -9.289 1.00 1.79 O ATOM 0 H GLU A 48 -24.452 -5.035 -9.371 1.00 0.55 H new ATOM 0 HA GLU A 48 -24.874 -7.119 -8.469 1.00 0.50 H new ATOM 0 HB2 GLU A 48 -23.412 -7.910 -10.591 1.00 0.56 H new ATOM 0 HB3 GLU A 48 -22.251 -8.305 -9.340 1.00 0.56 H new ATOM 0 HG2 GLU A 48 -23.544 -10.284 -9.444 1.00 1.22 H new ATOM 0 HG3 GLU A 48 -24.295 -9.434 -8.108 1.00 1.22 H new ATOM 784 N ILE A 49 -23.592 -6.188 -6.401 1.00 0.40 N ATOM 785 CA ILE A 49 -22.907 -6.052 -5.088 1.00 0.37 C ATOM 786 C ILE A 49 -23.974 -5.856 -4.008 1.00 0.37 C ATOM 787 O ILE A 49 -23.857 -6.384 -2.919 1.00 0.40 O ATOM 788 CB ILE A 49 -21.965 -4.834 -5.116 1.00 0.39 C ATOM 789 CG1 ILE A 49 -20.644 -5.155 -5.840 1.00 0.44 C ATOM 790 CG2 ILE A 49 -21.649 -4.393 -3.688 1.00 0.37 C ATOM 791 CD1 ILE A 49 -20.672 -4.556 -7.251 1.00 0.82 C ATOM 0 H ILE A 49 -24.494 -5.715 -6.466 1.00 0.40 H new ATOM 0 HA ILE A 49 -22.318 -6.945 -4.877 1.00 0.37 H new ATOM 0 HB ILE A 49 -22.473 -4.036 -5.658 1.00 0.39 H new ATOM 0 HG12 ILE A 49 -19.802 -4.750 -5.279 1.00 0.44 H new ATOM 0 HG13 ILE A 49 -20.501 -6.234 -5.895 1.00 0.44 H new ATOM 0 HG21 ILE A 49 -20.982 -3.531 -3.713 1.00 0.37 H new ATOM 0 HG22 ILE A 49 -22.573 -4.122 -3.178 1.00 0.37 H new ATOM 0 HG23 ILE A 49 -21.166 -5.211 -3.153 1.00 0.37 H new ATOM 0 HD11 ILE A 49 -19.736 -4.784 -7.762 1.00 0.82 H new ATOM 0 HD12 ILE A 49 -21.504 -4.982 -7.811 1.00 0.82 H new ATOM 0 HD13 ILE A 49 -20.795 -3.475 -7.185 1.00 0.82 H new ATOM 803 N ILE A 50 -25.027 -5.121 -4.304 1.00 0.43 N ATOM 804 CA ILE A 50 -26.106 -4.925 -3.286 1.00 0.48 C ATOM 805 C ILE A 50 -27.292 -5.806 -3.651 1.00 0.43 C ATOM 806 O ILE A 50 -27.676 -5.905 -4.800 1.00 0.49 O ATOM 807 CB ILE A 50 -26.554 -3.464 -3.217 1.00 0.56 C ATOM 808 CG1 ILE A 50 -25.447 -2.631 -2.565 1.00 0.62 C ATOM 809 CG2 ILE A 50 -27.820 -3.369 -2.357 1.00 0.67 C ATOM 810 CD1 ILE A 50 -25.791 -1.142 -2.644 1.00 0.74 C ATOM 0 H ILE A 50 -25.181 -4.655 -5.198 1.00 0.43 H new ATOM 0 HA ILE A 50 -25.713 -5.199 -2.307 1.00 0.48 H new ATOM 0 HB ILE A 50 -26.757 -3.092 -4.221 1.00 0.56 H new ATOM 0 HG12 ILE A 50 -25.323 -2.928 -1.524 1.00 0.62 H new ATOM 0 HG13 ILE A 50 -24.497 -2.819 -3.065 1.00 0.62 H new ATOM 0 HG21 ILE A 50 -28.146 -2.330 -2.303 1.00 0.67 H new ATOM 0 HG22 ILE A 50 -28.609 -3.974 -2.803 1.00 0.67 H new ATOM 0 HG23 ILE A 50 -27.606 -3.735 -1.353 1.00 0.67 H new ATOM 0 HD11 ILE A 50 -24.997 -0.560 -2.177 1.00 0.74 H new ATOM 0 HD12 ILE A 50 -25.892 -0.847 -3.688 1.00 0.74 H new ATOM 0 HD13 ILE A 50 -26.730 -0.957 -2.123 1.00 0.74 H new ATOM 822 N ARG A 51 -27.862 -6.453 -2.678 1.00 0.58 N ATOM 823 CA ARG A 51 -29.015 -7.347 -2.930 1.00 0.56 C ATOM 824 C ARG A 51 -30.300 -6.651 -2.465 1.00 0.53 C ATOM 825 O ARG A 51 -30.291 -5.866 -1.541 1.00 0.53 O ATOM 826 CB ARG A 51 -28.765 -8.645 -2.152 1.00 0.60 C ATOM 827 CG ARG A 51 -29.883 -9.657 -2.383 1.00 0.83 C ATOM 828 CD ARG A 51 -29.583 -10.446 -3.656 1.00 0.87 C ATOM 829 NE ARG A 51 -30.766 -11.271 -4.024 1.00 1.02 N ATOM 830 CZ ARG A 51 -30.713 -12.051 -5.067 1.00 1.06 C ATOM 831 NH1 ARG A 51 -29.626 -12.100 -5.786 1.00 1.47 N ATOM 832 NH2 ARG A 51 -31.745 -12.780 -5.389 1.00 1.39 N ATOM 0 H ARG A 51 -27.570 -6.397 -1.702 1.00 0.58 H new ATOM 0 HA ARG A 51 -29.127 -7.575 -3.990 1.00 0.56 H new ATOM 0 HB2 ARG A 51 -27.812 -9.077 -2.459 1.00 0.60 H new ATOM 0 HB3 ARG A 51 -28.687 -8.424 -1.088 1.00 0.60 H new ATOM 0 HG2 ARG A 51 -29.962 -10.332 -1.531 1.00 0.83 H new ATOM 0 HG3 ARG A 51 -30.841 -9.146 -2.474 1.00 0.83 H new ATOM 0 HD2 ARG A 51 -29.336 -9.763 -4.469 1.00 0.87 H new ATOM 0 HD3 ARG A 51 -28.714 -11.086 -3.503 1.00 0.87 H new ATOM 0 HE ARG A 51 -31.616 -11.226 -3.462 1.00 1.02 H new ATOM 0 HH11 ARG A 51 -28.820 -11.529 -5.532 1.00 1.47 H new ATOM 0 HH12 ARG A 51 -29.582 -12.710 -6.603 1.00 1.47 H new ATOM 0 HH21 ARG A 51 -32.594 -12.740 -4.825 1.00 1.39 H new ATOM 0 HH22 ARG A 51 -31.704 -13.390 -6.205 1.00 1.39 H new ATOM 846 N GLN A 52 -31.403 -6.938 -3.104 1.00 0.59 N ATOM 847 CA GLN A 52 -32.699 -6.299 -2.709 1.00 0.59 C ATOM 848 C GLN A 52 -33.545 -7.289 -1.907 1.00 0.56 C ATOM 849 O GLN A 52 -33.980 -8.299 -2.424 1.00 0.58 O ATOM 850 CB GLN A 52 -33.469 -5.875 -3.962 1.00 0.68 C ATOM 851 CG GLN A 52 -33.237 -6.894 -5.079 1.00 1.47 C ATOM 852 CD GLN A 52 -34.300 -6.710 -6.164 1.00 1.71 C ATOM 853 OE1 GLN A 52 -35.103 -7.592 -6.401 1.00 2.42 O ATOM 854 NE2 GLN A 52 -34.341 -5.593 -6.837 1.00 1.84 N ATOM 0 H GLN A 52 -31.465 -7.590 -3.886 1.00 0.59 H new ATOM 0 HA GLN A 52 -32.489 -5.423 -2.096 1.00 0.59 H new ATOM 0 HB2 GLN A 52 -34.533 -5.801 -3.739 1.00 0.68 H new ATOM 0 HB3 GLN A 52 -33.142 -4.887 -4.285 1.00 0.68 H new ATOM 0 HG2 GLN A 52 -32.242 -6.764 -5.504 1.00 1.47 H new ATOM 0 HG3 GLN A 52 -33.283 -7.906 -4.678 1.00 1.47 H new ATOM 0 HE21 GLN A 52 -33.668 -4.853 -6.638 1.00 1.84 H new ATOM 0 HE22 GLN A 52 -35.046 -5.460 -7.562 1.00 1.84 H new ATOM 863 N GLU A 53 -33.793 -6.998 -0.654 1.00 0.67 N ATOM 864 CA GLU A 53 -34.628 -7.910 0.185 1.00 0.78 C ATOM 865 C GLU A 53 -35.877 -7.164 0.636 1.00 0.77 C ATOM 866 O GLU A 53 -35.834 -6.352 1.535 1.00 0.87 O ATOM 867 CB GLU A 53 -33.834 -8.337 1.420 1.00 1.04 C ATOM 868 CG GLU A 53 -33.467 -9.819 1.324 1.00 0.85 C ATOM 869 CD GLU A 53 -34.737 -10.673 1.363 1.00 1.59 C ATOM 870 OE1 GLU A 53 -35.360 -10.724 2.411 1.00 2.30 O ATOM 871 OE2 GLU A 53 -35.063 -11.259 0.346 1.00 2.25 O ATOM 0 H GLU A 53 -33.451 -6.165 -0.175 1.00 0.67 H new ATOM 0 HA GLU A 53 -34.905 -8.790 -0.396 1.00 0.78 H new ATOM 0 HB2 GLU A 53 -32.929 -7.735 1.506 1.00 1.04 H new ATOM 0 HB3 GLU A 53 -34.422 -8.158 2.320 1.00 1.04 H new ATOM 0 HG2 GLU A 53 -32.919 -10.008 0.401 1.00 0.85 H new ATOM 0 HG3 GLU A 53 -32.808 -10.094 2.148 1.00 0.85 H new ATOM 878 N GLY A 54 -36.985 -7.429 0.009 1.00 0.73 N ATOM 879 CA GLY A 54 -38.237 -6.725 0.388 1.00 0.75 C ATOM 880 C GLY A 54 -37.926 -5.232 0.485 1.00 0.83 C ATOM 881 O GLY A 54 -37.561 -4.746 1.529 1.00 1.15 O ATOM 0 H GLY A 54 -37.078 -8.103 -0.750 1.00 0.73 H new ATOM 0 HA2 GLY A 54 -39.015 -6.905 -0.354 1.00 0.75 H new ATOM 0 HA3 GLY A 54 -38.612 -7.099 1.341 1.00 0.75 H new ATOM 885 N LYS A 55 -38.121 -4.502 -0.583 1.00 0.86 N ATOM 886 CA LYS A 55 -37.876 -3.025 -0.567 1.00 1.03 C ATOM 887 C LYS A 55 -36.716 -2.656 0.369 1.00 1.02 C ATOM 888 O LYS A 55 -36.789 -1.664 1.067 1.00 1.27 O ATOM 889 CB LYS A 55 -39.143 -2.309 -0.097 1.00 1.21 C ATOM 890 CG LYS A 55 -39.151 -0.878 -0.639 1.00 1.38 C ATOM 891 CD LYS A 55 -39.828 0.050 0.370 1.00 1.67 C ATOM 892 CE LYS A 55 -40.019 1.431 -0.260 1.00 1.89 C ATOM 893 NZ LYS A 55 -40.625 2.355 0.740 1.00 2.27 N ATOM 0 H LYS A 55 -38.444 -4.870 -1.478 1.00 0.86 H new ATOM 0 HA LYS A 55 -37.612 -2.715 -1.578 1.00 1.03 H new ATOM 0 HB2 LYS A 55 -40.026 -2.845 -0.443 1.00 1.21 H new ATOM 0 HB3 LYS A 55 -39.184 -2.297 0.992 1.00 1.21 H new ATOM 0 HG2 LYS A 55 -38.131 -0.544 -0.827 1.00 1.38 H new ATOM 0 HG3 LYS A 55 -39.679 -0.842 -1.592 1.00 1.38 H new ATOM 0 HD2 LYS A 55 -40.792 -0.362 0.670 1.00 1.67 H new ATOM 0 HD3 LYS A 55 -39.221 0.130 1.272 1.00 1.67 H new ATOM 0 HE2 LYS A 55 -39.060 1.823 -0.599 1.00 1.89 H new ATOM 0 HE3 LYS A 55 -40.661 1.356 -1.138 1.00 1.89 H new ATOM 0 HZ1 LYS A 55 -40.755 3.294 0.311 1.00 2.27 H new ATOM 0 HZ2 LYS A 55 -41.547 1.982 1.043 1.00 2.27 H new ATOM 0 HZ3 LYS A 55 -39.996 2.435 1.565 1.00 2.27 H new ATOM 907 N GLN A 56 -35.664 -3.440 0.426 1.00 0.87 N ATOM 908 CA GLN A 56 -34.550 -3.110 1.353 1.00 0.97 C ATOM 909 C GLN A 56 -33.215 -3.408 0.670 1.00 0.89 C ATOM 910 O GLN A 56 -33.176 -4.071 -0.343 1.00 0.86 O ATOM 911 CB GLN A 56 -34.702 -3.992 2.586 1.00 1.04 C ATOM 912 CG GLN A 56 -34.092 -3.324 3.811 1.00 1.44 C ATOM 913 CD GLN A 56 -34.514 -4.092 5.065 1.00 1.38 C ATOM 914 OE1 GLN A 56 -35.434 -3.697 5.754 1.00 1.49 O ATOM 915 NE2 GLN A 56 -33.884 -5.186 5.391 1.00 2.04 N ATOM 0 H GLN A 56 -35.535 -4.287 -0.128 1.00 0.87 H new ATOM 0 HA GLN A 56 -34.575 -2.056 1.629 1.00 0.97 H new ATOM 0 HB2 GLN A 56 -35.758 -4.194 2.765 1.00 1.04 H new ATOM 0 HB3 GLN A 56 -34.218 -4.953 2.412 1.00 1.04 H new ATOM 0 HG2 GLN A 56 -33.005 -3.308 3.728 1.00 1.44 H new ATOM 0 HG3 GLN A 56 -34.422 -2.287 3.877 1.00 1.44 H new ATOM 0 HE21 GLN A 56 -33.111 -5.521 4.815 1.00 2.04 H new ATOM 0 HE22 GLN A 56 -34.164 -5.707 6.222 1.00 2.04 H new ATOM 924 N TYR A 57 -32.122 -2.915 1.207 1.00 0.87 N ATOM 925 CA TYR A 57 -30.799 -3.166 0.566 1.00 0.80 C ATOM 926 C TYR A 57 -30.023 -4.221 1.356 1.00 0.79 C ATOM 927 O TYR A 57 -29.771 -4.070 2.531 1.00 0.95 O ATOM 928 CB TYR A 57 -30.021 -1.859 0.534 1.00 0.81 C ATOM 929 CG TYR A 57 -30.866 -0.811 -0.157 1.00 0.85 C ATOM 930 CD1 TYR A 57 -31.851 -0.126 0.562 1.00 1.34 C ATOM 931 CD2 TYR A 57 -30.678 -0.537 -1.518 1.00 1.49 C ATOM 932 CE1 TYR A 57 -32.646 0.831 -0.077 1.00 1.35 C ATOM 933 CE2 TYR A 57 -31.473 0.424 -2.155 1.00 1.56 C ATOM 934 CZ TYR A 57 -32.456 1.107 -1.435 1.00 0.98 C ATOM 935 OH TYR A 57 -33.241 2.052 -2.064 1.00 1.06 O ATOM 0 H TYR A 57 -32.093 -2.353 2.058 1.00 0.87 H new ATOM 0 HA TYR A 57 -30.943 -3.536 -0.449 1.00 0.80 H new ATOM 0 HB2 TYR A 57 -29.776 -1.540 1.547 1.00 0.81 H new ATOM 0 HB3 TYR A 57 -29.077 -1.993 0.005 1.00 0.81 H new ATOM 0 HD1 TYR A 57 -31.998 -0.336 1.611 1.00 1.34 H new ATOM 0 HD2 TYR A 57 -29.920 -1.067 -2.076 1.00 1.49 H new ATOM 0 HE1 TYR A 57 -33.408 1.358 0.479 1.00 1.35 H new ATOM 0 HE2 TYR A 57 -31.326 0.637 -3.204 1.00 1.56 H new ATOM 0 HH TYR A 57 -32.978 2.122 -3.005 1.00 1.06 H new ATOM 945 N MET A 58 -29.668 -5.294 0.698 1.00 0.66 N ATOM 946 CA MET A 58 -28.927 -6.411 1.355 1.00 0.67 C ATOM 947 C MET A 58 -27.617 -6.649 0.601 1.00 0.57 C ATOM 948 O MET A 58 -27.353 -6.028 -0.405 1.00 0.51 O ATOM 949 CB MET A 58 -29.807 -7.671 1.378 1.00 0.73 C ATOM 950 CG MET A 58 -29.010 -8.897 1.833 1.00 0.90 C ATOM 951 SD MET A 58 -30.158 -10.231 2.257 1.00 1.22 S ATOM 952 CE MET A 58 -29.231 -10.898 3.660 1.00 1.60 C ATOM 0 H MET A 58 -29.866 -5.446 -0.291 1.00 0.66 H new ATOM 0 HA MET A 58 -28.688 -6.156 2.387 1.00 0.67 H new ATOM 0 HB2 MET A 58 -30.652 -7.515 2.048 1.00 0.73 H new ATOM 0 HB3 MET A 58 -30.217 -7.849 0.384 1.00 0.73 H new ATOM 0 HG2 MET A 58 -28.334 -9.221 1.041 1.00 0.90 H new ATOM 0 HG3 MET A 58 -28.393 -8.645 2.695 1.00 0.90 H new ATOM 0 HE1 MET A 58 -29.770 -11.747 4.082 1.00 1.60 H new ATOM 0 HE2 MET A 58 -28.247 -11.224 3.324 1.00 1.60 H new ATOM 0 HE3 MET A 58 -29.117 -10.126 4.421 1.00 1.60 H new ATOM 962 N LEU A 59 -26.781 -7.506 1.108 1.00 0.59 N ATOM 963 CA LEU A 59 -25.457 -7.749 0.445 1.00 0.52 C ATOM 964 C LEU A 59 -25.500 -9.022 -0.417 1.00 0.46 C ATOM 965 O LEU A 59 -26.093 -10.017 -0.053 1.00 0.53 O ATOM 966 CB LEU A 59 -24.351 -7.878 1.514 1.00 0.63 C ATOM 967 CG LEU A 59 -24.368 -9.259 2.202 1.00 0.71 C ATOM 968 CD1 LEU A 59 -23.220 -9.333 3.210 1.00 1.03 C ATOM 969 CD2 LEU A 59 -25.691 -9.462 2.942 1.00 1.16 C ATOM 0 H LEU A 59 -26.950 -8.053 1.952 1.00 0.59 H new ATOM 0 HA LEU A 59 -25.238 -6.901 -0.204 1.00 0.52 H new ATOM 0 HB2 LEU A 59 -23.378 -7.717 1.050 1.00 0.63 H new ATOM 0 HB3 LEU A 59 -24.480 -7.098 2.264 1.00 0.63 H new ATOM 0 HG LEU A 59 -24.256 -10.035 1.445 1.00 0.71 H new ATOM 0 HD11 LEU A 59 -23.227 -10.307 3.699 1.00 1.03 H new ATOM 0 HD12 LEU A 59 -22.271 -9.194 2.692 1.00 1.03 H new ATOM 0 HD13 LEU A 59 -23.342 -8.550 3.959 1.00 1.03 H new ATOM 0 HD21 LEU A 59 -25.692 -10.440 3.424 1.00 1.16 H new ATOM 0 HD22 LEU A 59 -25.808 -8.685 3.697 1.00 1.16 H new ATOM 0 HD23 LEU A 59 -26.517 -9.406 2.233 1.00 1.16 H new ATOM 981 N THR A 60 -24.888 -8.977 -1.578 1.00 0.39 N ATOM 982 CA THR A 60 -24.903 -10.166 -2.489 1.00 0.41 C ATOM 983 C THR A 60 -23.600 -10.947 -2.307 1.00 0.46 C ATOM 984 O THR A 60 -22.646 -10.447 -1.743 1.00 0.43 O ATOM 985 CB THR A 60 -24.974 -9.744 -3.973 1.00 0.40 C ATOM 986 OG1 THR A 60 -23.661 -9.479 -4.441 1.00 1.12 O ATOM 987 CG2 THR A 60 -25.840 -8.496 -4.183 1.00 1.04 C ATOM 0 H THR A 60 -24.379 -8.168 -1.933 1.00 0.39 H new ATOM 0 HA THR A 60 -25.779 -10.764 -2.238 1.00 0.41 H new ATOM 0 HB THR A 60 -25.432 -10.562 -4.529 1.00 0.40 H new ATOM 0 HG1 THR A 60 -23.697 -9.212 -5.383 1.00 1.12 H new ATOM 0 HG21 THR A 60 -25.858 -8.240 -5.242 1.00 1.04 H new ATOM 0 HG22 THR A 60 -26.855 -8.696 -3.840 1.00 1.04 H new ATOM 0 HG23 THR A 60 -25.423 -7.664 -3.616 1.00 1.04 H new ATOM 995 N LYS A 61 -23.547 -12.162 -2.794 1.00 0.54 N ATOM 996 CA LYS A 61 -22.295 -12.967 -2.665 1.00 0.61 C ATOM 997 C LYS A 61 -21.098 -12.077 -3.022 1.00 0.57 C ATOM 998 O LYS A 61 -20.071 -12.094 -2.373 1.00 0.56 O ATOM 999 CB LYS A 61 -22.351 -14.166 -3.623 1.00 0.70 C ATOM 1000 CG LYS A 61 -22.553 -13.682 -5.063 1.00 1.39 C ATOM 1001 CD LYS A 61 -23.409 -14.695 -5.823 1.00 0.99 C ATOM 1002 CE LYS A 61 -23.199 -14.516 -7.328 1.00 1.84 C ATOM 1003 NZ LYS A 61 -24.441 -14.905 -8.052 1.00 2.26 N ATOM 0 H LYS A 61 -24.316 -12.630 -3.274 1.00 0.54 H new ATOM 0 HA LYS A 61 -22.193 -13.334 -1.644 1.00 0.61 H new ATOM 0 HB2 LYS A 61 -21.428 -14.742 -3.551 1.00 0.70 H new ATOM 0 HB3 LYS A 61 -23.166 -14.832 -3.337 1.00 0.70 H new ATOM 0 HG2 LYS A 61 -23.037 -12.705 -5.066 1.00 1.39 H new ATOM 0 HG3 LYS A 61 -21.589 -13.561 -5.557 1.00 1.39 H new ATOM 0 HD2 LYS A 61 -23.141 -15.709 -5.526 1.00 0.99 H new ATOM 0 HD3 LYS A 61 -24.461 -14.558 -5.573 1.00 0.99 H new ATOM 0 HE2 LYS A 61 -22.945 -13.479 -7.550 1.00 1.84 H new ATOM 0 HE3 LYS A 61 -22.362 -15.128 -7.665 1.00 1.84 H new ATOM 0 HZ1 LYS A 61 -24.299 -14.784 -9.075 1.00 2.26 H new ATOM 0 HZ2 LYS A 61 -24.664 -15.900 -7.849 1.00 2.26 H new ATOM 0 HZ3 LYS A 61 -25.229 -14.303 -7.738 1.00 2.26 H new ATOM 1017 N LYS A 62 -21.238 -11.300 -4.055 1.00 0.57 N ATOM 1018 CA LYS A 62 -20.136 -10.389 -4.472 1.00 0.56 C ATOM 1019 C LYS A 62 -19.881 -9.350 -3.373 1.00 0.50 C ATOM 1020 O LYS A 62 -18.757 -9.077 -3.006 1.00 0.58 O ATOM 1021 CB LYS A 62 -20.527 -9.673 -5.767 1.00 0.59 C ATOM 1022 CG LYS A 62 -20.511 -10.669 -6.930 1.00 0.78 C ATOM 1023 CD LYS A 62 -19.141 -10.639 -7.614 1.00 1.25 C ATOM 1024 CE LYS A 62 -19.123 -11.648 -8.763 1.00 1.29 C ATOM 1025 NZ LYS A 62 -19.833 -11.071 -9.940 1.00 2.14 N ATOM 0 H LYS A 62 -22.076 -11.255 -4.635 1.00 0.57 H new ATOM 0 HA LYS A 62 -19.230 -10.972 -4.636 1.00 0.56 H new ATOM 0 HB2 LYS A 62 -21.519 -9.233 -5.666 1.00 0.59 H new ATOM 0 HB3 LYS A 62 -19.834 -8.855 -5.966 1.00 0.59 H new ATOM 0 HG2 LYS A 62 -20.724 -11.674 -6.565 1.00 0.78 H new ATOM 0 HG3 LYS A 62 -21.292 -10.418 -7.647 1.00 0.78 H new ATOM 0 HD2 LYS A 62 -18.933 -9.638 -7.992 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -18.358 -10.877 -6.894 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -18.095 -11.894 -9.029 1.00 1.29 H new ATOM 0 HE3 LYS A 62 -19.603 -12.576 -8.454 1.00 1.29 H new ATOM 0 HZ1 LYS A 62 -19.763 -11.727 -10.744 1.00 2.14 H new ATOM 0 HZ2 LYS A 62 -20.834 -10.920 -9.702 1.00 2.14 H new ATOM 0 HZ3 LYS A 62 -19.398 -10.162 -10.197 1.00 2.14 H new ATOM 1039 N GLY A 63 -20.927 -8.754 -2.864 1.00 0.43 N ATOM 1040 CA GLY A 63 -20.767 -7.709 -1.810 1.00 0.38 C ATOM 1041 C GLY A 63 -20.006 -8.259 -0.601 1.00 0.40 C ATOM 1042 O GLY A 63 -19.118 -7.617 -0.078 1.00 0.39 O ATOM 0 H GLY A 63 -21.891 -8.947 -3.135 1.00 0.43 H new ATOM 0 HA2 GLY A 63 -20.233 -6.852 -2.221 1.00 0.38 H new ATOM 0 HA3 GLY A 63 -21.748 -7.352 -1.495 1.00 0.38 H new ATOM 1046 N GLU A 64 -20.328 -9.440 -0.155 1.00 0.46 N ATOM 1047 CA GLU A 64 -19.593 -10.007 1.014 1.00 0.51 C ATOM 1048 C GLU A 64 -18.133 -10.247 0.620 1.00 0.51 C ATOM 1049 O GLU A 64 -17.215 -9.996 1.380 1.00 0.50 O ATOM 1050 CB GLU A 64 -20.230 -11.323 1.463 1.00 0.60 C ATOM 1051 CG GLU A 64 -21.471 -11.590 0.624 1.00 0.65 C ATOM 1052 CD GLU A 64 -22.160 -12.866 1.110 1.00 0.80 C ATOM 1053 OE1 GLU A 64 -21.564 -13.922 0.986 1.00 1.25 O ATOM 1054 OE2 GLU A 64 -23.274 -12.764 1.599 1.00 1.40 O ATOM 0 H GLU A 64 -21.061 -10.034 -0.543 1.00 0.46 H new ATOM 0 HA GLU A 64 -19.643 -9.300 1.842 1.00 0.51 H new ATOM 0 HB2 GLU A 64 -19.519 -12.141 1.352 1.00 0.60 H new ATOM 0 HB3 GLU A 64 -20.495 -11.271 2.519 1.00 0.60 H new ATOM 0 HG2 GLU A 64 -22.157 -10.746 0.694 1.00 0.65 H new ATOM 0 HG3 GLU A 64 -21.196 -11.691 -0.426 1.00 0.65 H new ATOM 1061 N GLU A 65 -17.922 -10.734 -0.572 1.00 0.55 N ATOM 1062 CA GLU A 65 -16.532 -11.003 -1.039 1.00 0.58 C ATOM 1063 C GLU A 65 -15.717 -9.711 -0.975 1.00 0.52 C ATOM 1064 O GLU A 65 -14.539 -9.725 -0.677 1.00 0.53 O ATOM 1065 CB GLU A 65 -16.567 -11.512 -2.482 1.00 0.64 C ATOM 1066 CG GLU A 65 -16.703 -13.035 -2.485 1.00 0.72 C ATOM 1067 CD GLU A 65 -16.750 -13.540 -3.928 1.00 1.15 C ATOM 1068 OE1 GLU A 65 -17.552 -13.024 -4.689 1.00 1.82 O ATOM 1069 OE2 GLU A 65 -15.985 -14.434 -4.249 1.00 1.69 O ATOM 0 H GLU A 65 -18.655 -10.958 -1.245 1.00 0.55 H new ATOM 0 HA GLU A 65 -16.073 -11.757 -0.400 1.00 0.58 H new ATOM 0 HB2 GLU A 65 -17.403 -11.061 -3.017 1.00 0.64 H new ATOM 0 HB3 GLU A 65 -15.657 -11.217 -3.005 1.00 0.64 H new ATOM 0 HG2 GLU A 65 -15.863 -13.487 -1.958 1.00 0.72 H new ATOM 0 HG3 GLU A 65 -17.608 -13.331 -1.955 1.00 0.72 H new ATOM 1076 N LEU A 66 -16.331 -8.594 -1.249 1.00 0.50 N ATOM 1077 CA LEU A 66 -15.584 -7.307 -1.199 1.00 0.48 C ATOM 1078 C LEU A 66 -15.379 -6.903 0.264 1.00 0.44 C ATOM 1079 O LEU A 66 -14.326 -6.440 0.645 1.00 0.45 O ATOM 1080 CB LEU A 66 -16.379 -6.224 -1.952 1.00 0.46 C ATOM 1081 CG LEU A 66 -15.862 -4.819 -1.605 1.00 0.62 C ATOM 1082 CD1 LEU A 66 -14.369 -4.721 -1.922 1.00 0.77 C ATOM 1083 CD2 LEU A 66 -16.612 -3.792 -2.447 1.00 1.54 C ATOM 0 H LEU A 66 -17.315 -8.517 -1.505 1.00 0.50 H new ATOM 0 HA LEU A 66 -14.610 -7.420 -1.676 1.00 0.48 H new ATOM 0 HB2 LEU A 66 -16.298 -6.390 -3.026 1.00 0.46 H new ATOM 0 HB3 LEU A 66 -17.436 -6.300 -1.696 1.00 0.46 H new ATOM 0 HG LEU A 66 -16.021 -4.629 -0.544 1.00 0.62 H new ATOM 0 HD11 LEU A 66 -14.009 -3.723 -1.674 1.00 0.77 H new ATOM 0 HD12 LEU A 66 -13.823 -5.460 -1.335 1.00 0.77 H new ATOM 0 HD13 LEU A 66 -14.209 -4.911 -2.983 1.00 0.77 H new ATOM 0 HD21 LEU A 66 -16.251 -2.792 -2.207 1.00 1.54 H new ATOM 0 HD22 LEU A 66 -16.443 -3.995 -3.504 1.00 1.54 H new ATOM 0 HD23 LEU A 66 -17.679 -3.854 -2.232 1.00 1.54 H new ATOM 1095 N LEU A 67 -16.365 -7.099 1.095 1.00 0.43 N ATOM 1096 CA LEU A 67 -16.200 -6.738 2.532 1.00 0.43 C ATOM 1097 C LEU A 67 -14.902 -7.362 3.037 1.00 0.46 C ATOM 1098 O LEU A 67 -14.131 -6.745 3.746 1.00 0.48 O ATOM 1099 CB LEU A 67 -17.383 -7.276 3.345 1.00 0.46 C ATOM 1100 CG LEU A 67 -18.247 -6.117 3.862 1.00 0.61 C ATOM 1101 CD1 LEU A 67 -17.434 -5.245 4.824 1.00 0.89 C ATOM 1102 CD2 LEU A 67 -18.730 -5.262 2.685 1.00 1.39 C ATOM 0 H LEU A 67 -17.273 -7.491 0.844 1.00 0.43 H new ATOM 0 HA LEU A 67 -16.165 -5.654 2.643 1.00 0.43 H new ATOM 0 HB2 LEU A 67 -17.986 -7.940 2.726 1.00 0.46 H new ATOM 0 HB3 LEU A 67 -17.017 -7.868 4.184 1.00 0.46 H new ATOM 0 HG LEU A 67 -19.108 -6.528 4.389 1.00 0.61 H new ATOM 0 HD11 LEU A 67 -18.055 -4.426 5.186 1.00 0.89 H new ATOM 0 HD12 LEU A 67 -17.101 -5.848 5.669 1.00 0.89 H new ATOM 0 HD13 LEU A 67 -16.566 -4.840 4.303 1.00 0.89 H new ATOM 0 HD21 LEU A 67 -19.343 -4.441 3.059 1.00 1.39 H new ATOM 0 HD22 LEU A 67 -17.870 -4.859 2.151 1.00 1.39 H new ATOM 0 HD23 LEU A 67 -19.322 -5.877 2.007 1.00 1.39 H new ATOM 1114 N GLU A 68 -14.652 -8.586 2.669 1.00 0.50 N ATOM 1115 CA GLU A 68 -13.399 -9.251 3.114 1.00 0.55 C ATOM 1116 C GLU A 68 -12.216 -8.619 2.377 1.00 0.52 C ATOM 1117 O GLU A 68 -11.199 -8.309 2.964 1.00 0.52 O ATOM 1118 CB GLU A 68 -13.468 -10.745 2.786 1.00 0.62 C ATOM 1119 CG GLU A 68 -12.697 -11.536 3.843 1.00 1.34 C ATOM 1120 CD GLU A 68 -12.676 -13.017 3.458 1.00 1.80 C ATOM 1121 OE1 GLU A 68 -11.851 -13.383 2.639 1.00 2.26 O ATOM 1122 OE2 GLU A 68 -13.487 -13.757 3.989 1.00 2.26 O ATOM 0 H GLU A 68 -15.261 -9.154 2.080 1.00 0.50 H new ATOM 0 HA GLU A 68 -13.275 -9.126 4.190 1.00 0.55 H new ATOM 0 HB2 GLU A 68 -14.507 -11.074 2.756 1.00 0.62 H new ATOM 0 HB3 GLU A 68 -13.046 -10.931 1.798 1.00 0.62 H new ATOM 0 HG2 GLU A 68 -11.679 -11.156 3.926 1.00 1.34 H new ATOM 0 HG3 GLU A 68 -13.164 -11.410 4.820 1.00 1.34 H new ATOM 1129 N ASP A 69 -12.342 -8.429 1.091 1.00 0.51 N ATOM 1130 CA ASP A 69 -11.230 -7.820 0.309 1.00 0.51 C ATOM 1131 C ASP A 69 -10.881 -6.438 0.869 1.00 0.46 C ATOM 1132 O ASP A 69 -9.746 -6.175 1.217 1.00 0.48 O ATOM 1133 CB ASP A 69 -11.646 -7.681 -1.157 1.00 0.53 C ATOM 1134 CG ASP A 69 -12.218 -9.008 -1.656 1.00 0.62 C ATOM 1135 OD1 ASP A 69 -12.146 -9.977 -0.918 1.00 1.34 O ATOM 1136 OD2 ASP A 69 -12.719 -9.034 -2.769 1.00 1.13 O ATOM 0 H ASP A 69 -13.171 -8.671 0.547 1.00 0.51 H new ATOM 0 HA ASP A 69 -10.356 -8.466 0.384 1.00 0.51 H new ATOM 0 HB2 ASP A 69 -12.390 -6.891 -1.261 1.00 0.53 H new ATOM 0 HB3 ASP A 69 -10.787 -7.393 -1.763 1.00 0.53 H new ATOM 1141 N ILE A 70 -11.835 -5.544 0.954 1.00 0.43 N ATOM 1142 CA ILE A 70 -11.518 -4.186 1.486 1.00 0.43 C ATOM 1143 C ILE A 70 -10.938 -4.313 2.895 1.00 0.42 C ATOM 1144 O ILE A 70 -10.030 -3.599 3.270 1.00 0.43 O ATOM 1145 CB ILE A 70 -12.784 -3.316 1.515 1.00 0.48 C ATOM 1146 CG1 ILE A 70 -12.413 -1.882 1.901 1.00 0.89 C ATOM 1147 CG2 ILE A 70 -13.779 -3.866 2.536 1.00 0.78 C ATOM 1148 CD1 ILE A 70 -12.821 -0.928 0.777 1.00 1.29 C ATOM 0 H ILE A 70 -12.806 -5.694 0.682 1.00 0.43 H new ATOM 0 HA ILE A 70 -10.785 -3.710 0.835 1.00 0.43 H new ATOM 0 HB ILE A 70 -13.240 -3.328 0.525 1.00 0.48 H new ATOM 0 HG12 ILE A 70 -12.913 -1.603 2.828 1.00 0.89 H new ATOM 0 HG13 ILE A 70 -11.341 -1.809 2.083 1.00 0.89 H new ATOM 0 HG21 ILE A 70 -14.672 -3.241 2.547 1.00 0.78 H new ATOM 0 HG22 ILE A 70 -14.053 -4.885 2.264 1.00 0.78 H new ATOM 0 HG23 ILE A 70 -13.323 -3.865 3.526 1.00 0.78 H new ATOM 0 HD11 ILE A 70 -12.557 0.093 1.052 1.00 1.29 H new ATOM 0 HD12 ILE A 70 -12.300 -1.203 -0.140 1.00 1.29 H new ATOM 0 HD13 ILE A 70 -13.897 -0.993 0.617 1.00 1.29 H new ATOM 1160 N ARG A 71 -11.449 -5.224 3.675 1.00 0.43 N ATOM 1161 CA ARG A 71 -10.920 -5.405 5.055 1.00 0.47 C ATOM 1162 C ARG A 71 -9.414 -5.677 4.992 1.00 0.48 C ATOM 1163 O ARG A 71 -8.624 -5.017 5.639 1.00 0.51 O ATOM 1164 CB ARG A 71 -11.629 -6.588 5.720 1.00 0.51 C ATOM 1165 CG ARG A 71 -11.141 -6.735 7.163 1.00 0.81 C ATOM 1166 CD ARG A 71 -12.173 -7.523 7.971 1.00 1.02 C ATOM 1167 NE ARG A 71 -11.484 -8.286 9.049 1.00 1.58 N ATOM 1168 CZ ARG A 71 -10.921 -7.650 10.040 1.00 2.24 C ATOM 1169 NH1 ARG A 71 -10.966 -6.346 10.088 1.00 2.68 N ATOM 1170 NH2 ARG A 71 -10.316 -8.317 10.984 1.00 3.04 N ATOM 0 H ARG A 71 -12.211 -5.851 3.416 1.00 0.43 H new ATOM 0 HA ARG A 71 -11.100 -4.501 5.637 1.00 0.47 H new ATOM 0 HB2 ARG A 71 -12.708 -6.434 5.704 1.00 0.51 H new ATOM 0 HB3 ARG A 71 -11.430 -7.504 5.163 1.00 0.51 H new ATOM 0 HG2 ARG A 71 -10.179 -7.247 7.183 1.00 0.81 H new ATOM 0 HG3 ARG A 71 -10.988 -5.752 7.609 1.00 0.81 H new ATOM 0 HD2 ARG A 71 -12.907 -6.844 8.404 1.00 1.02 H new ATOM 0 HD3 ARG A 71 -12.717 -8.206 7.318 1.00 1.02 H new ATOM 0 HE ARG A 71 -11.452 -9.305 9.013 1.00 1.58 H new ATOM 0 HH11 ARG A 71 -11.441 -5.825 9.351 1.00 2.68 H new ATOM 0 HH12 ARG A 71 -10.526 -5.849 10.862 1.00 2.68 H new ATOM 0 HH21 ARG A 71 -10.283 -9.336 10.948 1.00 3.04 H new ATOM 0 HH22 ARG A 71 -9.876 -7.820 11.758 1.00 3.04 H new ATOM 1184 N LYS A 72 -9.013 -6.651 4.220 1.00 0.49 N ATOM 1185 CA LYS A 72 -7.562 -6.979 4.115 1.00 0.52 C ATOM 1186 C LYS A 72 -6.803 -5.795 3.499 1.00 0.49 C ATOM 1187 O LYS A 72 -5.839 -5.306 4.056 1.00 0.50 O ATOM 1188 CB LYS A 72 -7.386 -8.218 3.236 1.00 0.57 C ATOM 1189 CG LYS A 72 -8.216 -9.368 3.815 1.00 0.69 C ATOM 1190 CD LYS A 72 -7.451 -10.689 3.687 1.00 0.93 C ATOM 1191 CE LYS A 72 -6.930 -10.856 2.258 1.00 1.44 C ATOM 1192 NZ LYS A 72 -7.060 -12.283 1.846 1.00 1.87 N ATOM 0 H LYS A 72 -9.630 -7.235 3.656 1.00 0.49 H new ATOM 0 HA LYS A 72 -7.163 -7.178 5.110 1.00 0.52 H new ATOM 0 HB2 LYS A 72 -7.703 -8.003 2.216 1.00 0.57 H new ATOM 0 HB3 LYS A 72 -6.334 -8.500 3.190 1.00 0.57 H new ATOM 0 HG2 LYS A 72 -8.443 -9.171 4.863 1.00 0.69 H new ATOM 0 HG3 LYS A 72 -9.169 -9.439 3.290 1.00 0.69 H new ATOM 0 HD2 LYS A 72 -6.619 -10.706 4.391 1.00 0.93 H new ATOM 0 HD3 LYS A 72 -8.104 -11.523 3.945 1.00 0.93 H new ATOM 0 HE2 LYS A 72 -7.493 -10.217 1.577 1.00 1.44 H new ATOM 0 HE3 LYS A 72 -5.887 -10.543 2.201 1.00 1.44 H new ATOM 0 HZ1 LYS A 72 -6.706 -12.398 0.875 1.00 1.87 H new ATOM 0 HZ2 LYS A 72 -6.505 -12.882 2.490 1.00 1.87 H new ATOM 0 HZ3 LYS A 72 -8.060 -12.566 1.886 1.00 1.87 H new ATOM 1206 N PHE A 73 -7.232 -5.334 2.356 1.00 0.48 N ATOM 1207 CA PHE A 73 -6.543 -4.184 1.695 1.00 0.47 C ATOM 1208 C PHE A 73 -6.259 -3.087 2.726 1.00 0.46 C ATOM 1209 O PHE A 73 -5.145 -2.622 2.864 1.00 0.46 O ATOM 1210 CB PHE A 73 -7.454 -3.641 0.588 1.00 0.45 C ATOM 1211 CG PHE A 73 -7.414 -2.132 0.564 1.00 0.46 C ATOM 1212 CD1 PHE A 73 -8.300 -1.391 1.353 1.00 1.35 C ATOM 1213 CD2 PHE A 73 -6.495 -1.476 -0.258 1.00 1.20 C ATOM 1214 CE1 PHE A 73 -8.264 0.007 1.321 1.00 1.34 C ATOM 1215 CE2 PHE A 73 -6.457 -0.078 -0.292 1.00 1.27 C ATOM 1216 CZ PHE A 73 -7.342 0.665 0.497 1.00 0.58 C ATOM 0 H PHE A 73 -8.034 -5.705 1.847 1.00 0.48 H new ATOM 0 HA PHE A 73 -5.596 -4.512 1.267 1.00 0.47 H new ATOM 0 HB2 PHE A 73 -7.137 -4.035 -0.378 1.00 0.45 H new ATOM 0 HB3 PHE A 73 -8.477 -3.981 0.751 1.00 0.45 H new ATOM 0 HD1 PHE A 73 -9.012 -1.898 1.987 1.00 1.35 H new ATOM 0 HD2 PHE A 73 -5.813 -2.049 -0.868 1.00 1.20 H new ATOM 0 HE1 PHE A 73 -8.947 0.579 1.932 1.00 1.34 H new ATOM 0 HE2 PHE A 73 -5.745 0.428 -0.927 1.00 1.27 H new ATOM 0 HZ PHE A 73 -7.314 1.744 0.471 1.00 0.58 H new ATOM 1226 N ASN A 74 -7.263 -2.671 3.443 1.00 0.47 N ATOM 1227 CA ASN A 74 -7.060 -1.601 4.460 1.00 0.48 C ATOM 1228 C ASN A 74 -6.044 -2.073 5.496 1.00 0.50 C ATOM 1229 O ASN A 74 -5.252 -1.301 5.997 1.00 0.52 O ATOM 1230 CB ASN A 74 -8.389 -1.281 5.146 1.00 0.48 C ATOM 1231 CG ASN A 74 -8.504 0.230 5.354 1.00 0.67 C ATOM 1232 OD1 ASN A 74 -8.850 0.956 4.444 1.00 1.58 O ATOM 1233 ND2 ASN A 74 -8.225 0.738 6.524 1.00 1.06 N ATOM 0 H ASN A 74 -8.217 -3.025 3.370 1.00 0.47 H new ATOM 0 HA ASN A 74 -6.687 -0.701 3.971 1.00 0.48 H new ATOM 0 HB2 ASN A 74 -9.220 -1.640 4.538 1.00 0.48 H new ATOM 0 HB3 ASN A 74 -8.449 -1.797 6.104 1.00 0.48 H new ATOM 0 HD21 ASN A 74 -8.298 1.744 6.674 1.00 1.06 H new ATOM 0 HD22 ASN A 74 -7.934 0.128 7.288 1.00 1.06 H new ATOM 1240 N GLU A 75 -6.045 -3.336 5.814 1.00 0.51 N ATOM 1241 CA GLU A 75 -5.065 -3.840 6.806 1.00 0.55 C ATOM 1242 C GLU A 75 -3.677 -3.812 6.176 1.00 0.55 C ATOM 1243 O GLU A 75 -2.750 -3.256 6.727 1.00 0.65 O ATOM 1244 CB GLU A 75 -5.413 -5.275 7.191 1.00 0.59 C ATOM 1245 CG GLU A 75 -6.322 -5.269 8.416 1.00 0.87 C ATOM 1246 CD GLU A 75 -6.693 -6.706 8.785 1.00 1.22 C ATOM 1247 OE1 GLU A 75 -6.985 -7.472 7.881 1.00 1.79 O ATOM 1248 OE2 GLU A 75 -6.676 -7.017 9.965 1.00 1.77 O ATOM 0 H GLU A 75 -6.680 -4.036 5.431 1.00 0.51 H new ATOM 0 HA GLU A 75 -5.088 -3.214 7.698 1.00 0.55 H new ATOM 0 HB2 GLU A 75 -5.909 -5.775 6.360 1.00 0.59 H new ATOM 0 HB3 GLU A 75 -4.503 -5.836 7.403 1.00 0.59 H new ATOM 0 HG2 GLU A 75 -5.818 -4.786 9.253 1.00 0.87 H new ATOM 0 HG3 GLU A 75 -7.223 -4.691 8.210 1.00 0.87 H new ATOM 1255 N MET A 76 -3.521 -4.409 5.024 1.00 0.52 N ATOM 1256 CA MET A 76 -2.192 -4.418 4.366 1.00 0.51 C ATOM 1257 C MET A 76 -1.833 -3.003 3.921 1.00 0.51 C ATOM 1258 O MET A 76 -0.701 -2.579 4.043 1.00 0.52 O ATOM 1259 CB MET A 76 -2.237 -5.348 3.154 1.00 0.50 C ATOM 1260 CG MET A 76 -2.373 -6.793 3.637 1.00 0.52 C ATOM 1261 SD MET A 76 -0.821 -7.677 3.345 1.00 0.55 S ATOM 1262 CE MET A 76 -1.305 -9.241 4.115 1.00 0.65 C ATOM 0 H MET A 76 -4.261 -4.890 4.513 1.00 0.52 H new ATOM 0 HA MET A 76 -1.437 -4.773 5.067 1.00 0.51 H new ATOM 0 HB2 MET A 76 -3.077 -5.086 2.510 1.00 0.50 H new ATOM 0 HB3 MET A 76 -1.331 -5.234 2.559 1.00 0.50 H new ATOM 0 HG2 MET A 76 -2.620 -6.811 4.699 1.00 0.52 H new ATOM 0 HG3 MET A 76 -3.190 -7.288 3.112 1.00 0.52 H new ATOM 0 HE1 MET A 76 -0.480 -9.950 4.048 1.00 0.65 H new ATOM 0 HE2 MET A 76 -1.552 -9.070 5.163 1.00 0.65 H new ATOM 0 HE3 MET A 76 -2.175 -9.647 3.599 1.00 0.65 H new ATOM 1272 N ARG A 77 -2.782 -2.257 3.418 1.00 0.50 N ATOM 1273 CA ARG A 77 -2.474 -0.866 2.990 1.00 0.50 C ATOM 1274 C ARG A 77 -1.953 -0.071 4.188 1.00 0.51 C ATOM 1275 O ARG A 77 -0.933 0.585 4.117 1.00 0.52 O ATOM 1276 CB ARG A 77 -3.741 -0.202 2.446 1.00 0.49 C ATOM 1277 CG ARG A 77 -3.398 1.185 1.893 1.00 0.52 C ATOM 1278 CD ARG A 77 -4.110 2.259 2.717 1.00 0.54 C ATOM 1279 NE ARG A 77 -3.626 3.605 2.299 1.00 0.85 N ATOM 1280 CZ ARG A 77 -3.906 4.655 3.023 1.00 1.35 C ATOM 1281 NH1 ARG A 77 -4.612 4.528 4.113 1.00 1.85 N ATOM 1282 NH2 ARG A 77 -3.478 5.832 2.657 1.00 1.84 N ATOM 0 H ARG A 77 -3.750 -2.551 3.287 1.00 0.50 H new ATOM 0 HA ARG A 77 -1.715 -0.886 2.208 1.00 0.50 H new ATOM 0 HB2 ARG A 77 -4.179 -0.819 1.662 1.00 0.49 H new ATOM 0 HB3 ARG A 77 -4.486 -0.115 3.237 1.00 0.49 H new ATOM 0 HG2 ARG A 77 -2.320 1.343 1.925 1.00 0.52 H new ATOM 0 HG3 ARG A 77 -3.700 1.255 0.848 1.00 0.52 H new ATOM 0 HD2 ARG A 77 -5.188 2.187 2.574 1.00 0.54 H new ATOM 0 HD3 ARG A 77 -3.918 2.105 3.779 1.00 0.54 H new ATOM 0 HE ARG A 77 -3.075 3.706 1.446 1.00 0.85 H new ATOM 0 HH11 ARG A 77 -4.946 3.608 4.400 1.00 1.85 H new ATOM 0 HH12 ARG A 77 -4.830 5.349 4.678 1.00 1.85 H new ATOM 0 HH21 ARG A 77 -2.925 5.932 1.806 1.00 1.84 H new ATOM 0 HH22 ARG A 77 -3.696 6.653 3.222 1.00 1.84 H new ATOM 1296 N LYS A 78 -2.643 -0.141 5.294 1.00 0.51 N ATOM 1297 CA LYS A 78 -2.187 0.593 6.506 1.00 0.52 C ATOM 1298 C LYS A 78 -0.843 0.016 6.942 1.00 0.53 C ATOM 1299 O LYS A 78 0.050 0.729 7.358 1.00 0.55 O ATOM 1300 CB LYS A 78 -3.217 0.426 7.627 1.00 0.52 C ATOM 1301 CG LYS A 78 -2.553 0.692 8.983 1.00 0.90 C ATOM 1302 CD LYS A 78 -3.608 1.143 10.001 1.00 1.04 C ATOM 1303 CE LYS A 78 -4.123 2.547 9.652 1.00 1.45 C ATOM 1304 NZ LYS A 78 -4.001 3.430 10.847 1.00 2.15 N ATOM 0 H LYS A 78 -3.504 -0.676 5.409 1.00 0.51 H new ATOM 0 HA LYS A 78 -2.080 1.655 6.286 1.00 0.52 H new ATOM 0 HB2 LYS A 78 -4.048 1.116 7.476 1.00 0.52 H new ATOM 0 HB3 LYS A 78 -3.632 -0.582 7.606 1.00 0.52 H new ATOM 0 HG2 LYS A 78 -2.055 -0.211 9.337 1.00 0.90 H new ATOM 0 HG3 LYS A 78 -1.785 1.459 8.878 1.00 0.90 H new ATOM 0 HD2 LYS A 78 -4.438 0.436 10.011 1.00 1.04 H new ATOM 0 HD3 LYS A 78 -3.178 1.145 11.003 1.00 1.04 H new ATOM 0 HE2 LYS A 78 -3.551 2.960 8.821 1.00 1.45 H new ATOM 0 HE3 LYS A 78 -5.163 2.495 9.329 1.00 1.45 H new ATOM 0 HZ1 LYS A 78 -4.349 4.381 10.613 1.00 2.15 H new ATOM 0 HZ2 LYS A 78 -4.565 3.037 11.628 1.00 2.15 H new ATOM 0 HZ3 LYS A 78 -3.003 3.488 11.135 1.00 2.15 H new ATOM 1318 N ASN A 79 -0.686 -1.274 6.827 1.00 0.52 N ATOM 1319 CA ASN A 79 0.614 -1.897 7.214 1.00 0.53 C ATOM 1320 C ASN A 79 1.705 -1.320 6.318 1.00 0.54 C ATOM 1321 O ASN A 79 2.769 -0.947 6.770 1.00 0.54 O ATOM 1322 CB ASN A 79 0.556 -3.412 7.025 1.00 0.54 C ATOM 1323 CG ASN A 79 1.074 -4.105 8.287 1.00 0.60 C ATOM 1324 OD1 ASN A 79 1.965 -4.928 8.219 1.00 1.17 O ATOM 1325 ND2 ASN A 79 0.550 -3.805 9.444 1.00 1.14 N ATOM 0 H ASN A 79 -1.396 -1.921 6.484 1.00 0.52 H new ATOM 0 HA ASN A 79 0.823 -1.685 8.263 1.00 0.53 H new ATOM 0 HB2 ASN A 79 -0.468 -3.724 6.820 1.00 0.54 H new ATOM 0 HB3 ASN A 79 1.157 -3.705 6.164 1.00 0.54 H new ATOM 0 HD21 ASN A 79 0.889 -4.261 10.291 1.00 1.14 H new ATOM 0 HD22 ASN A 79 -0.198 -3.114 9.501 1.00 1.14 H new ATOM 1332 N MET A 80 1.439 -1.240 5.043 1.00 0.56 N ATOM 1333 CA MET A 80 2.445 -0.685 4.100 1.00 0.58 C ATOM 1334 C MET A 80 2.873 0.704 4.584 1.00 0.57 C ATOM 1335 O MET A 80 4.040 0.949 4.819 1.00 0.56 O ATOM 1336 CB MET A 80 1.826 -0.602 2.696 1.00 0.60 C ATOM 1337 CG MET A 80 2.579 0.418 1.835 1.00 0.64 C ATOM 1338 SD MET A 80 1.831 2.054 2.039 1.00 1.38 S ATOM 1339 CE MET A 80 3.139 3.003 1.227 1.00 1.16 C ATOM 0 H MET A 80 0.563 -1.537 4.614 1.00 0.56 H new ATOM 0 HA MET A 80 3.323 -1.329 4.060 1.00 0.58 H new ATOM 0 HB2 MET A 80 1.858 -1.582 2.220 1.00 0.60 H new ATOM 0 HB3 MET A 80 0.776 -0.318 2.771 1.00 0.60 H new ATOM 0 HG2 MET A 80 3.629 0.449 2.124 1.00 0.64 H new ATOM 0 HG3 MET A 80 2.546 0.120 0.787 1.00 0.64 H new ATOM 0 HE1 MET A 80 3.558 3.721 1.932 1.00 1.16 H new ATOM 0 HE2 MET A 80 3.923 2.326 0.889 1.00 1.16 H new ATOM 0 HE3 MET A 80 2.725 3.535 0.370 1.00 1.16 H new ATOM 1349 N ASP A 81 1.949 1.614 4.748 1.00 0.58 N ATOM 1350 CA ASP A 81 2.319 2.977 5.230 1.00 0.58 C ATOM 1351 C ASP A 81 3.010 2.879 6.586 1.00 0.56 C ATOM 1352 O ASP A 81 3.990 3.546 6.847 1.00 0.56 O ATOM 1353 CB ASP A 81 1.051 3.817 5.373 1.00 0.59 C ATOM 1354 CG ASP A 81 1.238 5.156 4.657 1.00 0.61 C ATOM 1355 OD1 ASP A 81 1.682 5.141 3.521 1.00 1.12 O ATOM 1356 OD2 ASP A 81 0.933 6.173 5.259 1.00 1.22 O ATOM 0 H ASP A 81 0.955 1.472 4.569 1.00 0.58 H new ATOM 0 HA ASP A 81 2.997 3.441 4.514 1.00 0.58 H new ATOM 0 HB2 ASP A 81 0.200 3.283 4.951 1.00 0.59 H new ATOM 0 HB3 ASP A 81 0.831 3.985 6.427 1.00 0.59 H new ATOM 1361 N GLN A 82 2.518 2.031 7.444 1.00 0.56 N ATOM 1362 CA GLN A 82 3.146 1.859 8.771 1.00 0.54 C ATOM 1363 C GLN A 82 4.571 1.355 8.540 1.00 0.53 C ATOM 1364 O GLN A 82 5.535 1.875 9.067 1.00 0.55 O ATOM 1365 CB GLN A 82 2.317 0.824 9.522 1.00 0.55 C ATOM 1366 CG GLN A 82 2.815 0.668 10.950 1.00 1.12 C ATOM 1367 CD GLN A 82 1.934 1.491 11.891 1.00 0.77 C ATOM 1368 OE1 GLN A 82 2.184 2.659 12.112 1.00 1.13 O ATOM 1369 NE2 GLN A 82 0.902 0.926 12.458 1.00 1.43 N ATOM 0 H GLN A 82 1.699 1.446 7.276 1.00 0.56 H new ATOM 0 HA GLN A 82 3.184 2.784 9.347 1.00 0.54 H new ATOM 0 HB2 GLN A 82 1.269 1.125 9.528 1.00 0.55 H new ATOM 0 HB3 GLN A 82 2.370 -0.135 9.007 1.00 0.55 H new ATOM 0 HG2 GLN A 82 2.794 -0.382 11.241 1.00 1.12 H new ATOM 0 HG3 GLN A 82 3.851 0.998 11.023 1.00 1.12 H new ATOM 0 HE21 GLN A 82 0.692 -0.055 12.273 1.00 1.43 H new ATOM 0 HE22 GLN A 82 0.306 1.465 13.086 1.00 1.43 H new ATOM 1378 N LEU A 83 4.687 0.350 7.722 1.00 0.51 N ATOM 1379 CA LEU A 83 6.031 -0.200 7.402 1.00 0.51 C ATOM 1380 C LEU A 83 6.831 0.905 6.713 1.00 0.52 C ATOM 1381 O LEU A 83 7.986 1.135 7.017 1.00 0.53 O ATOM 1382 CB LEU A 83 5.903 -1.415 6.477 1.00 0.49 C ATOM 1383 CG LEU A 83 5.245 -2.574 7.238 1.00 0.47 C ATOM 1384 CD1 LEU A 83 4.573 -3.536 6.256 1.00 0.52 C ATOM 1385 CD2 LEU A 83 6.298 -3.346 8.045 1.00 0.48 C ATOM 0 H LEU A 83 3.907 -0.116 7.259 1.00 0.51 H new ATOM 0 HA LEU A 83 6.534 -0.525 8.312 1.00 0.51 H new ATOM 0 HB2 LEU A 83 5.307 -1.157 5.601 1.00 0.49 H new ATOM 0 HB3 LEU A 83 6.887 -1.715 6.116 1.00 0.49 H new ATOM 0 HG LEU A 83 4.498 -2.158 7.914 1.00 0.47 H new ATOM 0 HD11 LEU A 83 4.110 -4.354 6.808 1.00 0.52 H new ATOM 0 HD12 LEU A 83 3.810 -3.003 5.689 1.00 0.52 H new ATOM 0 HD13 LEU A 83 5.320 -3.937 5.571 1.00 0.52 H new ATOM 0 HD21 LEU A 83 5.818 -4.165 8.580 1.00 0.48 H new ATOM 0 HD22 LEU A 83 7.053 -3.747 7.369 1.00 0.48 H new ATOM 0 HD23 LEU A 83 6.772 -2.674 8.760 1.00 0.48 H new ATOM 1397 N LYS A 84 6.217 1.606 5.798 1.00 0.53 N ATOM 1398 CA LYS A 84 6.926 2.715 5.099 1.00 0.56 C ATOM 1399 C LYS A 84 7.538 3.664 6.135 1.00 0.56 C ATOM 1400 O LYS A 84 8.669 4.093 6.015 1.00 0.57 O ATOM 1401 CB LYS A 84 5.933 3.493 4.235 1.00 0.57 C ATOM 1402 CG LYS A 84 6.676 4.563 3.428 1.00 0.58 C ATOM 1403 CD LYS A 84 6.217 5.951 3.879 1.00 0.75 C ATOM 1404 CE LYS A 84 7.086 7.018 3.209 1.00 0.77 C ATOM 1405 NZ LYS A 84 7.963 7.657 4.232 1.00 1.42 N ATOM 0 H LYS A 84 5.252 1.457 5.504 1.00 0.53 H new ATOM 0 HA LYS A 84 7.713 2.299 4.470 1.00 0.56 H new ATOM 0 HB2 LYS A 84 5.412 2.813 3.561 1.00 0.57 H new ATOM 0 HB3 LYS A 84 5.176 3.960 4.865 1.00 0.57 H new ATOM 0 HG2 LYS A 84 7.752 4.460 3.570 1.00 0.58 H new ATOM 0 HG3 LYS A 84 6.481 4.432 2.364 1.00 0.58 H new ATOM 0 HD2 LYS A 84 5.170 6.102 3.617 1.00 0.75 H new ATOM 0 HD3 LYS A 84 6.290 6.035 4.963 1.00 0.75 H new ATOM 0 HE2 LYS A 84 7.693 6.568 2.424 1.00 0.77 H new ATOM 0 HE3 LYS A 84 6.456 7.770 2.733 1.00 0.77 H new ATOM 0 HZ1 LYS A 84 8.019 8.680 4.051 1.00 1.42 H new ATOM 0 HZ2 LYS A 84 7.567 7.494 5.180 1.00 1.42 H new ATOM 0 HZ3 LYS A 84 8.916 7.244 4.179 1.00 1.42 H new ATOM 1419 N GLU A 85 6.787 4.001 7.151 1.00 0.55 N ATOM 1420 CA GLU A 85 7.306 4.930 8.197 1.00 0.55 C ATOM 1421 C GLU A 85 8.480 4.285 8.933 1.00 0.57 C ATOM 1422 O GLU A 85 9.440 4.941 9.285 1.00 0.57 O ATOM 1423 CB GLU A 85 6.192 5.236 9.201 1.00 0.55 C ATOM 1424 CG GLU A 85 6.809 5.634 10.545 1.00 0.56 C ATOM 1425 CD GLU A 85 5.778 6.401 11.374 1.00 0.56 C ATOM 1426 OE1 GLU A 85 4.596 6.190 11.158 1.00 1.18 O ATOM 1427 OE2 GLU A 85 6.188 7.188 12.213 1.00 1.12 O ATOM 0 H GLU A 85 5.833 3.671 7.301 1.00 0.55 H new ATOM 0 HA GLU A 85 7.641 5.851 7.721 1.00 0.55 H new ATOM 0 HB2 GLU A 85 5.561 6.042 8.826 1.00 0.55 H new ATOM 0 HB3 GLU A 85 5.552 4.363 9.327 1.00 0.55 H new ATOM 0 HG2 GLU A 85 7.136 4.745 11.084 1.00 0.56 H new ATOM 0 HG3 GLU A 85 7.693 6.251 10.383 1.00 0.56 H new ATOM 1434 N LYS A 86 8.417 3.007 9.163 1.00 0.58 N ATOM 1435 CA LYS A 86 9.537 2.326 9.869 1.00 0.61 C ATOM 1436 C LYS A 86 10.800 2.465 9.023 1.00 0.62 C ATOM 1437 O LYS A 86 11.899 2.576 9.532 1.00 0.63 O ATOM 1438 CB LYS A 86 9.203 0.844 10.056 1.00 0.62 C ATOM 1439 CG LYS A 86 9.320 0.478 11.537 1.00 0.65 C ATOM 1440 CD LYS A 86 8.931 -0.989 11.733 1.00 0.83 C ATOM 1441 CE LYS A 86 8.854 -1.301 13.228 1.00 1.01 C ATOM 1442 NZ LYS A 86 7.469 -1.049 13.719 1.00 1.24 N ATOM 0 H LYS A 86 7.640 2.403 8.894 1.00 0.58 H new ATOM 0 HA LYS A 86 9.692 2.779 10.848 1.00 0.61 H new ATOM 0 HB2 LYS A 86 8.194 0.640 9.699 1.00 0.62 H new ATOM 0 HB3 LYS A 86 9.881 0.230 9.464 1.00 0.62 H new ATOM 0 HG2 LYS A 86 10.340 0.644 11.884 1.00 0.65 H new ATOM 0 HG3 LYS A 86 8.672 1.120 12.133 1.00 0.65 H new ATOM 0 HD2 LYS A 86 7.970 -1.188 11.259 1.00 0.83 H new ATOM 0 HD3 LYS A 86 9.663 -1.638 11.253 1.00 0.83 H new ATOM 0 HE2 LYS A 86 9.132 -2.340 13.408 1.00 1.01 H new ATOM 0 HE3 LYS A 86 9.564 -0.682 13.776 1.00 1.01 H new ATOM 0 HZ1 LYS A 86 7.417 -1.261 14.736 1.00 1.24 H new ATOM 0 HZ2 LYS A 86 7.221 -0.052 13.560 1.00 1.24 H new ATOM 0 HZ3 LYS A 86 6.802 -1.658 13.204 1.00 1.24 H new ATOM 1456 N ILE A 87 10.643 2.468 7.729 1.00 0.64 N ATOM 1457 CA ILE A 87 11.821 2.606 6.834 1.00 0.67 C ATOM 1458 C ILE A 87 12.392 4.013 6.962 1.00 0.65 C ATOM 1459 O ILE A 87 13.586 4.194 7.105 1.00 0.63 O ATOM 1460 CB ILE A 87 11.390 2.370 5.385 1.00 0.71 C ATOM 1461 CG1 ILE A 87 10.920 0.922 5.222 1.00 0.79 C ATOM 1462 CG2 ILE A 87 12.570 2.635 4.450 1.00 0.80 C ATOM 1463 CD1 ILE A 87 10.232 0.753 3.864 1.00 0.84 C ATOM 0 H ILE A 87 9.745 2.380 7.253 1.00 0.64 H new ATOM 0 HA ILE A 87 12.578 1.874 7.116 1.00 0.67 H new ATOM 0 HB ILE A 87 10.573 3.047 5.134 1.00 0.71 H new ATOM 0 HG12 ILE A 87 11.769 0.243 5.297 1.00 0.79 H new ATOM 0 HG13 ILE A 87 10.231 0.661 6.025 1.00 0.79 H new ATOM 0 HG21 ILE A 87 12.262 2.467 3.418 1.00 0.80 H new ATOM 0 HG22 ILE A 87 12.901 3.667 4.566 1.00 0.80 H new ATOM 0 HG23 ILE A 87 13.390 1.961 4.698 1.00 0.80 H new ATOM 0 HD11 ILE A 87 9.899 -0.279 3.751 1.00 0.84 H new ATOM 0 HD12 ILE A 87 9.372 1.421 3.806 1.00 0.84 H new ATOM 0 HD13 ILE A 87 10.935 0.997 3.067 1.00 0.84 H new ATOM 1475 N ASN A 88 11.561 5.017 6.922 1.00 0.66 N ATOM 1476 CA ASN A 88 12.072 6.403 7.051 1.00 0.65 C ATOM 1477 C ASN A 88 12.761 6.583 8.404 1.00 0.62 C ATOM 1478 O ASN A 88 13.712 7.327 8.530 1.00 0.62 O ATOM 1479 CB ASN A 88 10.906 7.389 6.938 1.00 0.69 C ATOM 1480 CG ASN A 88 10.500 7.536 5.471 1.00 1.66 C ATOM 1481 OD1 ASN A 88 10.463 6.566 4.739 1.00 2.38 O ATOM 1482 ND2 ASN A 88 10.190 8.715 5.007 1.00 2.46 N ATOM 0 H ASN A 88 10.551 4.934 6.805 1.00 0.66 H new ATOM 0 HA ASN A 88 12.792 6.593 6.255 1.00 0.65 H new ATOM 0 HB2 ASN A 88 10.059 7.036 7.527 1.00 0.69 H new ATOM 0 HB3 ASN A 88 11.195 8.358 7.345 1.00 0.69 H new ATOM 0 HD21 ASN A 88 9.917 8.823 4.030 1.00 2.46 H new ATOM 0 HD22 ASN A 88 10.221 9.529 5.621 1.00 2.46 H new ATOM 1489 N SER A 89 12.285 5.913 9.418 1.00 0.61 N ATOM 1490 CA SER A 89 12.907 6.053 10.765 1.00 0.61 C ATOM 1491 C SER A 89 14.285 5.382 10.804 1.00 0.63 C ATOM 1492 O SER A 89 15.204 5.875 11.427 1.00 0.71 O ATOM 1493 CB SER A 89 12.000 5.398 11.808 1.00 0.62 C ATOM 1494 OG SER A 89 12.451 5.748 13.110 1.00 1.29 O ATOM 0 H SER A 89 11.491 5.274 9.371 1.00 0.61 H new ATOM 0 HA SER A 89 13.030 7.114 10.982 1.00 0.61 H new ATOM 0 HB2 SER A 89 10.970 5.725 11.667 1.00 0.62 H new ATOM 0 HB3 SER A 89 12.010 4.315 11.686 1.00 0.62 H new ATOM 0 HG SER A 89 11.871 5.331 13.780 1.00 1.29 H new ATOM 1500 N VAL A 90 14.440 4.259 10.153 1.00 0.58 N ATOM 1501 CA VAL A 90 15.760 3.558 10.161 1.00 0.60 C ATOM 1502 C VAL A 90 16.718 4.241 9.193 1.00 0.59 C ATOM 1503 O VAL A 90 17.856 4.525 9.512 1.00 0.63 O ATOM 1504 CB VAL A 90 15.559 2.104 9.736 1.00 0.61 C ATOM 1505 CG1 VAL A 90 16.903 1.372 9.764 1.00 0.52 C ATOM 1506 CG2 VAL A 90 14.587 1.420 10.699 1.00 0.81 C ATOM 0 H VAL A 90 13.708 3.795 9.615 1.00 0.58 H new ATOM 0 HA VAL A 90 16.182 3.595 11.165 1.00 0.60 H new ATOM 0 HB VAL A 90 15.151 2.075 8.726 1.00 0.61 H new ATOM 0 HG11 VAL A 90 16.759 0.335 9.461 1.00 0.52 H new ATOM 0 HG12 VAL A 90 17.596 1.858 9.077 1.00 0.52 H new ATOM 0 HG13 VAL A 90 17.312 1.401 10.774 1.00 0.52 H new ATOM 0 HG21 VAL A 90 14.444 0.383 10.396 1.00 0.81 H new ATOM 0 HG22 VAL A 90 14.995 1.450 11.709 1.00 0.81 H new ATOM 0 HG23 VAL A 90 13.629 1.940 10.679 1.00 0.81 H new ATOM 1516 N LEU A 91 16.248 4.520 8.013 1.00 0.57 N ATOM 1517 CA LEU A 91 17.095 5.202 7.008 1.00 0.61 C ATOM 1518 C LEU A 91 17.103 6.683 7.343 1.00 0.67 C ATOM 1519 O LEU A 91 17.863 7.455 6.792 1.00 0.70 O ATOM 1520 CB LEU A 91 16.482 4.997 5.619 1.00 0.62 C ATOM 1521 CG LEU A 91 17.543 5.184 4.532 1.00 0.72 C ATOM 1522 CD1 LEU A 91 17.964 3.816 3.997 1.00 0.91 C ATOM 1523 CD2 LEU A 91 16.954 6.013 3.389 1.00 0.97 C ATOM 0 H LEU A 91 15.302 4.301 7.701 1.00 0.57 H new ATOM 0 HA LEU A 91 18.109 4.802 7.016 1.00 0.61 H new ATOM 0 HB2 LEU A 91 16.053 3.998 5.548 1.00 0.62 H new ATOM 0 HB3 LEU A 91 15.668 5.705 5.466 1.00 0.62 H new ATOM 0 HG LEU A 91 18.409 5.697 4.950 1.00 0.72 H new ATOM 0 HD11 LEU A 91 18.720 3.945 3.222 1.00 0.91 H new ATOM 0 HD12 LEU A 91 18.376 3.218 4.810 1.00 0.91 H new ATOM 0 HD13 LEU A 91 17.097 3.307 3.576 1.00 0.91 H new ATOM 0 HD21 LEU A 91 17.707 6.149 2.612 1.00 0.97 H new ATOM 0 HD22 LEU A 91 16.091 5.495 2.971 1.00 0.97 H new ATOM 0 HD23 LEU A 91 16.644 6.987 3.768 1.00 0.97 H new ATOM 1535 N SER A 92 16.275 7.064 8.282 1.00 0.71 N ATOM 1536 CA SER A 92 16.200 8.494 8.721 1.00 0.81 C ATOM 1537 C SER A 92 15.850 9.410 7.536 1.00 0.88 C ATOM 1538 O SER A 92 15.258 10.455 7.711 1.00 1.04 O ATOM 1539 CB SER A 92 17.550 8.915 9.303 1.00 0.85 C ATOM 1540 OG SER A 92 17.393 9.216 10.684 1.00 0.94 O ATOM 0 H SER A 92 15.637 6.436 8.772 1.00 0.71 H new ATOM 0 HA SER A 92 15.420 8.587 9.476 1.00 0.81 H new ATOM 0 HB2 SER A 92 18.280 8.116 9.174 1.00 0.85 H new ATOM 0 HB3 SER A 92 17.933 9.786 8.770 1.00 0.85 H new ATOM 0 HG SER A 92 18.257 9.485 11.061 1.00 0.94 H new ATOM 1546 N ILE A 93 16.242 9.027 6.347 1.00 0.85 N ATOM 1547 CA ILE A 93 15.988 9.854 5.121 1.00 0.92 C ATOM 1548 C ILE A 93 16.711 11.204 5.236 1.00 1.05 C ATOM 1549 O ILE A 93 17.454 11.591 4.355 1.00 1.13 O ATOM 1550 CB ILE A 93 14.490 10.075 4.912 1.00 1.02 C ATOM 1551 CG1 ILE A 93 13.792 8.714 4.786 1.00 1.07 C ATOM 1552 CG2 ILE A 93 14.278 10.898 3.639 1.00 1.16 C ATOM 1553 CD1 ILE A 93 13.727 8.273 3.320 1.00 1.65 C ATOM 0 H ILE A 93 16.740 8.155 6.168 1.00 0.85 H new ATOM 0 HA ILE A 93 16.377 9.314 4.258 1.00 0.92 H new ATOM 0 HB ILE A 93 14.068 10.614 5.760 1.00 1.02 H new ATOM 0 HG12 ILE A 93 14.329 7.968 5.372 1.00 1.07 H new ATOM 0 HG13 ILE A 93 12.784 8.777 5.197 1.00 1.07 H new ATOM 0 HG21 ILE A 93 13.211 11.060 3.484 1.00 1.16 H new ATOM 0 HG22 ILE A 93 14.780 11.860 3.740 1.00 1.16 H new ATOM 0 HG23 ILE A 93 14.692 10.361 2.785 1.00 1.16 H new ATOM 0 HD11 ILE A 93 13.229 7.306 3.253 1.00 1.65 H new ATOM 0 HD12 ILE A 93 13.169 9.010 2.743 1.00 1.65 H new ATOM 0 HD13 ILE A 93 14.738 8.189 2.920 1.00 1.65 H new ATOM 1565 N ARG A 94 16.507 11.916 6.313 1.00 1.20 N ATOM 1566 CA ARG A 94 17.186 13.240 6.497 1.00 1.42 C ATOM 1567 C ARG A 94 17.690 13.356 7.939 1.00 1.49 C ATOM 1568 O ARG A 94 18.434 14.256 8.273 1.00 1.74 O ATOM 1569 CB ARG A 94 16.198 14.383 6.246 1.00 1.79 C ATOM 1570 CG ARG A 94 15.778 14.413 4.773 1.00 2.10 C ATOM 1571 CD ARG A 94 14.248 14.432 4.670 1.00 2.55 C ATOM 1572 NE ARG A 94 13.847 14.285 3.243 1.00 3.16 N ATOM 1573 CZ ARG A 94 13.865 15.321 2.450 1.00 3.74 C ATOM 1574 NH1 ARG A 94 14.229 16.486 2.908 1.00 3.85 N ATOM 1575 NH2 ARG A 94 13.517 15.191 1.199 1.00 4.56 N ATOM 0 H ARG A 94 15.895 11.638 7.080 1.00 1.20 H new ATOM 0 HA ARG A 94 18.014 13.306 5.792 1.00 1.42 H new ATOM 0 HB2 ARG A 94 15.319 14.258 6.879 1.00 1.79 H new ATOM 0 HB3 ARG A 94 16.655 15.334 6.520 1.00 1.79 H new ATOM 0 HG2 ARG A 94 16.196 15.293 4.284 1.00 2.10 H new ATOM 0 HG3 ARG A 94 16.176 13.541 4.254 1.00 2.10 H new ATOM 0 HD2 ARG A 94 13.822 13.623 5.264 1.00 2.55 H new ATOM 0 HD3 ARG A 94 13.857 15.365 5.075 1.00 2.55 H new ATOM 0 HE ARG A 94 13.558 13.374 2.886 1.00 3.16 H new ATOM 0 HH11 ARG A 94 14.500 16.588 3.886 1.00 3.85 H new ATOM 0 HH12 ARG A 94 14.243 17.296 2.288 1.00 3.85 H new ATOM 0 HH21 ARG A 94 13.231 14.280 0.841 1.00 4.56 H new ATOM 0 HH22 ARG A 94 13.531 16.001 0.579 1.00 4.56 H new ATOM 1589 N GLN A 95 17.286 12.455 8.794 1.00 1.46 N ATOM 1590 CA GLN A 95 17.737 12.513 10.215 1.00 1.61 C ATOM 1591 C GLN A 95 16.990 13.632 10.942 1.00 2.21 C ATOM 1592 O GLN A 95 16.039 14.146 10.378 1.00 2.75 O ATOM 1593 CB GLN A 95 19.243 12.782 10.272 1.00 1.83 C ATOM 1594 CG GLN A 95 19.848 12.044 11.467 1.00 2.35 C ATOM 1595 CD GLN A 95 21.186 12.686 11.843 1.00 2.88 C ATOM 1596 OE1 GLN A 95 22.110 12.696 11.055 1.00 3.43 O ATOM 1597 NE2 GLN A 95 21.328 13.225 13.022 1.00 3.20 N ATOM 1598 OXT GLN A 95 17.382 13.956 12.051 1.00 2.78 O ATOM 0 H GLN A 95 16.662 11.680 8.569 1.00 1.46 H new ATOM 0 HA GLN A 95 17.525 11.559 10.698 1.00 1.61 H new ATOM 0 HB2 GLN A 95 19.718 12.451 9.348 1.00 1.83 H new ATOM 0 HB3 GLN A 95 19.429 13.852 10.360 1.00 1.83 H new ATOM 0 HG2 GLN A 95 19.164 12.082 12.315 1.00 2.35 H new ATOM 0 HG3 GLN A 95 19.994 10.992 11.222 1.00 2.35 H new ATOM 0 HE21 GLN A 95 20.552 13.216 13.684 1.00 3.20 H new ATOM 0 HE22 GLN A 95 22.215 13.655 13.283 1.00 3.20 H new TER 1607 GLN A 95 ATOM 1608 N ALA B 1 8.931 9.483 -12.427 1.00 5.31 N ATOM 1609 CA ALA B 1 9.296 8.082 -12.781 1.00 4.73 C ATOM 1610 C ALA B 1 10.435 7.608 -11.876 1.00 4.10 C ATOM 1611 O ALA B 1 11.572 7.511 -12.294 1.00 3.94 O ATOM 1612 CB ALA B 1 9.746 8.028 -14.242 1.00 4.76 C ATOM 0 H1 ALA B 1 8.157 9.806 -13.042 1.00 5.31 H new ATOM 0 H2 ALA B 1 8.624 9.521 -11.434 1.00 5.31 H new ATOM 0 H3 ALA B 1 9.757 10.101 -12.558 1.00 5.31 H new ATOM 0 HA ALA B 1 8.431 7.433 -12.644 1.00 4.73 H new ATOM 0 HB1 ALA B 1 10.013 7.004 -14.503 1.00 4.76 H new ATOM 0 HB2 ALA B 1 8.934 8.366 -14.886 1.00 4.76 H new ATOM 0 HB3 ALA B 1 10.612 8.675 -14.380 1.00 4.76 H new ATOM 1620 N LYS B 2 10.140 7.317 -10.639 1.00 4.19 N ATOM 1621 CA LYS B 2 11.206 6.853 -9.706 1.00 4.06 C ATOM 1622 C LYS B 2 11.794 5.532 -10.209 1.00 3.61 C ATOM 1623 O LYS B 2 12.803 5.515 -10.882 1.00 4.29 O ATOM 1624 CB LYS B 2 10.606 6.657 -8.312 1.00 4.79 C ATOM 1625 CG LYS B 2 10.622 7.990 -7.560 1.00 5.69 C ATOM 1626 CD LYS B 2 9.876 9.049 -8.375 1.00 6.62 C ATOM 1627 CE LYS B 2 9.628 10.284 -7.506 1.00 7.56 C ATOM 1628 NZ LYS B 2 8.310 10.152 -6.822 1.00 7.96 N ATOM 0 H LYS B 2 9.206 7.380 -10.233 1.00 4.19 H new ATOM 0 HA LYS B 2 11.999 7.599 -9.658 1.00 4.06 H new ATOM 0 HB2 LYS B 2 9.585 6.285 -8.393 1.00 4.79 H new ATOM 0 HB3 LYS B 2 11.176 5.909 -7.761 1.00 4.79 H new ATOM 0 HG2 LYS B 2 10.154 7.873 -6.582 1.00 5.69 H new ATOM 0 HG3 LYS B 2 11.650 8.308 -7.386 1.00 5.69 H new ATOM 0 HD2 LYS B 2 10.458 9.322 -9.255 1.00 6.62 H new ATOM 0 HD3 LYS B 2 8.928 8.647 -8.732 1.00 6.62 H new ATOM 0 HE2 LYS B 2 10.424 10.389 -6.769 1.00 7.56 H new ATOM 0 HE3 LYS B 2 9.642 11.184 -8.121 1.00 7.56 H new ATOM 0 HZ1 LYS B 2 8.140 10.991 -6.231 1.00 7.96 H new ATOM 0 HZ2 LYS B 2 7.556 10.071 -7.534 1.00 7.96 H new ATOM 0 HZ3 LYS B 2 8.313 9.302 -6.223 1.00 7.96 H new ATOM 1642 N LYS B 3 11.170 4.429 -9.890 1.00 2.84 N ATOM 1643 CA LYS B 3 11.684 3.102 -10.349 1.00 2.84 C ATOM 1644 C LYS B 3 13.054 2.828 -9.721 1.00 2.25 C ATOM 1645 O LYS B 3 13.213 1.914 -8.936 1.00 2.75 O ATOM 1646 CB LYS B 3 11.808 3.098 -11.879 1.00 3.27 C ATOM 1647 CG LYS B 3 11.832 1.653 -12.405 1.00 3.74 C ATOM 1648 CD LYS B 3 10.496 1.314 -13.082 1.00 4.47 C ATOM 1649 CE LYS B 3 10.289 2.193 -14.321 1.00 5.15 C ATOM 1650 NZ LYS B 3 9.743 1.364 -15.432 1.00 5.62 N ATOM 0 H LYS B 3 10.320 4.389 -9.327 1.00 2.84 H new ATOM 0 HA LYS B 3 10.987 2.323 -10.040 1.00 2.84 H new ATOM 0 HB2 LYS B 3 10.972 3.640 -12.321 1.00 3.27 H new ATOM 0 HB3 LYS B 3 12.718 3.617 -12.179 1.00 3.27 H new ATOM 0 HG2 LYS B 3 12.650 1.530 -13.115 1.00 3.74 H new ATOM 0 HG3 LYS B 3 12.017 0.962 -11.583 1.00 3.74 H new ATOM 0 HD2 LYS B 3 10.482 0.262 -13.368 1.00 4.47 H new ATOM 0 HD3 LYS B 3 9.676 1.465 -12.380 1.00 4.47 H new ATOM 0 HE2 LYS B 3 9.604 3.009 -14.091 1.00 5.15 H new ATOM 0 HE3 LYS B 3 11.234 2.646 -14.621 1.00 5.15 H new ATOM 0 HZ1 LYS B 3 9.602 1.960 -16.273 1.00 5.62 H new ATOM 0 HZ2 LYS B 3 10.412 0.600 -15.657 1.00 5.62 H new ATOM 0 HZ3 LYS B 3 8.833 0.952 -15.143 1.00 5.62 H new ATOM 1664 N LYS B 4 14.044 3.612 -10.062 1.00 1.66 N ATOM 1665 CA LYS B 4 15.405 3.401 -9.488 1.00 1.45 C ATOM 1666 C LYS B 4 16.028 4.760 -9.153 1.00 1.21 C ATOM 1667 O LYS B 4 15.384 5.782 -9.266 1.00 1.74 O ATOM 1668 CB LYS B 4 16.284 2.669 -10.509 1.00 1.77 C ATOM 1669 CG LYS B 4 15.465 1.567 -11.192 1.00 2.27 C ATOM 1670 CD LYS B 4 16.376 0.729 -12.096 1.00 2.87 C ATOM 1671 CE LYS B 4 15.530 0.025 -13.159 1.00 3.35 C ATOM 1672 NZ LYS B 4 16.394 -0.890 -13.960 1.00 3.94 N ATOM 0 H LYS B 4 13.967 4.391 -10.715 1.00 1.66 H new ATOM 0 HA LYS B 4 15.331 2.800 -8.581 1.00 1.45 H new ATOM 0 HB2 LYS B 4 16.659 3.372 -11.253 1.00 1.77 H new ATOM 0 HB3 LYS B 4 17.153 2.237 -10.013 1.00 1.77 H new ATOM 0 HG2 LYS B 4 14.997 0.930 -10.441 1.00 2.27 H new ATOM 0 HG3 LYS B 4 14.661 2.010 -11.780 1.00 2.27 H new ATOM 0 HD2 LYS B 4 17.121 1.367 -12.572 1.00 2.87 H new ATOM 0 HD3 LYS B 4 16.919 -0.006 -11.502 1.00 2.87 H new ATOM 0 HE2 LYS B 4 14.727 -0.539 -12.684 1.00 3.35 H new ATOM 0 HE3 LYS B 4 15.060 0.761 -13.811 1.00 3.35 H new ATOM 0 HZ1 LYS B 4 15.818 -1.368 -14.682 1.00 3.94 H new ATOM 0 HZ2 LYS B 4 17.145 -0.340 -14.424 1.00 3.94 H new ATOM 0 HZ3 LYS B 4 16.822 -1.601 -13.333 1.00 3.94 H new ATOM 1686 N SER B 5 17.273 4.757 -8.738 1.00 1.06 N ATOM 1687 CA SER B 5 17.990 6.030 -8.383 1.00 1.29 C ATOM 1688 C SER B 5 17.748 6.393 -6.918 1.00 1.14 C ATOM 1689 O SER B 5 18.295 7.355 -6.418 1.00 1.52 O ATOM 1690 CB SER B 5 17.525 7.178 -9.265 1.00 1.71 C ATOM 1691 OG SER B 5 18.583 8.115 -9.413 1.00 2.58 O ATOM 0 H SER B 5 17.834 3.913 -8.628 1.00 1.06 H new ATOM 0 HA SER B 5 19.055 5.865 -8.544 1.00 1.29 H new ATOM 0 HB2 SER B 5 17.219 6.801 -10.241 1.00 1.71 H new ATOM 0 HB3 SER B 5 16.654 7.662 -8.823 1.00 1.71 H new ATOM 0 HG SER B 5 18.287 8.856 -9.982 1.00 2.58 H new ATOM 1697 N LYS B 6 16.943 5.644 -6.218 1.00 1.03 N ATOM 1698 CA LYS B 6 16.696 5.976 -4.785 1.00 1.04 C ATOM 1699 C LYS B 6 15.944 4.832 -4.106 1.00 0.96 C ATOM 1700 O LYS B 6 16.143 4.552 -2.942 1.00 1.02 O ATOM 1701 CB LYS B 6 15.854 7.253 -4.692 1.00 1.37 C ATOM 1702 CG LYS B 6 15.605 7.597 -3.219 1.00 2.21 C ATOM 1703 CD LYS B 6 15.590 9.117 -3.042 1.00 2.52 C ATOM 1704 CE LYS B 6 14.892 9.470 -1.727 1.00 3.33 C ATOM 1705 NZ LYS B 6 15.200 8.431 -0.704 1.00 3.75 N ATOM 0 H LYS B 6 16.449 4.824 -6.570 1.00 1.03 H new ATOM 0 HA LYS B 6 17.654 6.127 -4.287 1.00 1.04 H new ATOM 0 HB2 LYS B 6 16.368 8.077 -5.187 1.00 1.37 H new ATOM 0 HB3 LYS B 6 14.905 7.113 -5.209 1.00 1.37 H new ATOM 0 HG2 LYS B 6 14.656 7.173 -2.892 1.00 2.21 H new ATOM 0 HG3 LYS B 6 16.383 7.156 -2.596 1.00 2.21 H new ATOM 0 HD2 LYS B 6 16.609 9.504 -3.041 1.00 2.52 H new ATOM 0 HD3 LYS B 6 15.072 9.586 -3.878 1.00 2.52 H new ATOM 0 HE2 LYS B 6 15.224 10.448 -1.378 1.00 3.33 H new ATOM 0 HE3 LYS B 6 13.815 9.535 -1.881 1.00 3.33 H new ATOM 0 HZ1 LYS B 6 14.995 8.806 0.244 1.00 3.75 H new ATOM 0 HZ2 LYS B 6 14.614 7.589 -0.877 1.00 3.75 H new ATOM 0 HZ3 LYS B 6 16.205 8.172 -0.764 1.00 3.75 H new ATOM 1719 N LEU B 7 15.070 4.180 -4.817 1.00 0.91 N ATOM 1720 CA LEU B 7 14.293 3.067 -4.202 1.00 0.98 C ATOM 1721 C LEU B 7 14.963 1.721 -4.496 1.00 0.86 C ATOM 1722 O LEU B 7 15.407 1.021 -3.602 1.00 0.86 O ATOM 1723 CB LEU B 7 12.878 3.062 -4.786 1.00 1.15 C ATOM 1724 CG LEU B 7 11.943 2.284 -3.860 1.00 1.40 C ATOM 1725 CD1 LEU B 7 11.217 3.258 -2.931 1.00 2.06 C ATOM 1726 CD2 LEU B 7 10.915 1.523 -4.700 1.00 1.70 C ATOM 0 H LEU B 7 14.859 4.368 -5.797 1.00 0.91 H new ATOM 0 HA LEU B 7 14.255 3.215 -3.123 1.00 0.98 H new ATOM 0 HB2 LEU B 7 12.520 4.084 -4.906 1.00 1.15 H new ATOM 0 HB3 LEU B 7 12.885 2.609 -5.777 1.00 1.15 H new ATOM 0 HG LEU B 7 12.524 1.579 -3.265 1.00 1.40 H new ATOM 0 HD11 LEU B 7 10.550 2.703 -2.271 1.00 2.06 H new ATOM 0 HD12 LEU B 7 11.947 3.804 -2.334 1.00 2.06 H new ATOM 0 HD13 LEU B 7 10.635 3.962 -3.525 1.00 2.06 H new ATOM 0 HD21 LEU B 7 10.247 0.967 -4.042 1.00 1.70 H new ATOM 0 HD22 LEU B 7 10.335 2.230 -5.293 1.00 1.70 H new ATOM 0 HD23 LEU B 7 11.430 0.829 -5.364 1.00 1.70 H new ATOM 1738 N GLU B 8 15.024 1.344 -5.741 1.00 0.85 N ATOM 1739 CA GLU B 8 15.637 0.033 -6.081 1.00 0.91 C ATOM 1740 C GLU B 8 17.161 0.114 -6.006 1.00 0.79 C ATOM 1741 O GLU B 8 17.765 -0.489 -5.153 1.00 0.74 O ATOM 1742 CB GLU B 8 15.220 -0.367 -7.498 1.00 1.08 C ATOM 1743 CG GLU B 8 16.122 -1.497 -7.996 1.00 1.20 C ATOM 1744 CD GLU B 8 15.438 -2.226 -9.153 1.00 1.47 C ATOM 1745 OE1 GLU B 8 15.599 -1.789 -10.280 1.00 1.97 O ATOM 1746 OE2 GLU B 8 14.763 -3.209 -8.892 1.00 2.06 O ATOM 0 H GLU B 8 14.678 1.884 -6.534 1.00 0.85 H new ATOM 0 HA GLU B 8 15.291 -0.712 -5.364 1.00 0.91 H new ATOM 0 HB2 GLU B 8 14.179 -0.689 -7.505 1.00 1.08 H new ATOM 0 HB3 GLU B 8 15.293 0.491 -8.166 1.00 1.08 H new ATOM 0 HG2 GLU B 8 17.081 -1.094 -8.323 1.00 1.20 H new ATOM 0 HG3 GLU B 8 16.329 -2.195 -7.185 1.00 1.20 H new ATOM 1753 N ILE B 9 17.774 0.861 -6.887 1.00 0.80 N ATOM 1754 CA ILE B 9 19.271 0.959 -6.871 1.00 0.81 C ATOM 1755 C ILE B 9 19.745 0.835 -5.421 1.00 0.71 C ATOM 1756 O ILE B 9 20.679 0.121 -5.107 1.00 0.82 O ATOM 1757 CB ILE B 9 19.718 2.300 -7.479 1.00 0.85 C ATOM 1758 CG1 ILE B 9 21.161 2.176 -7.971 1.00 1.52 C ATOM 1759 CG2 ILE B 9 19.630 3.434 -6.449 1.00 1.50 C ATOM 1760 CD1 ILE B 9 21.168 1.673 -9.415 1.00 1.88 C ATOM 0 H ILE B 9 17.310 1.406 -7.614 1.00 0.80 H new ATOM 0 HA ILE B 9 19.709 0.159 -7.468 1.00 0.81 H new ATOM 0 HB ILE B 9 19.054 2.538 -8.310 1.00 0.85 H new ATOM 0 HG12 ILE B 9 21.661 3.142 -7.909 1.00 1.52 H new ATOM 0 HG13 ILE B 9 21.716 1.488 -7.333 1.00 1.52 H new ATOM 0 HG21 ILE B 9 19.952 4.369 -6.908 1.00 1.50 H new ATOM 0 HG22 ILE B 9 18.600 3.535 -6.106 1.00 1.50 H new ATOM 0 HG23 ILE B 9 20.275 3.206 -5.600 1.00 1.50 H new ATOM 0 HD11 ILE B 9 22.197 1.585 -9.765 1.00 1.88 H new ATOM 0 HD12 ILE B 9 20.684 0.698 -9.463 1.00 1.88 H new ATOM 0 HD13 ILE B 9 20.629 2.377 -10.048 1.00 1.88 H new ATOM 1772 N ILE B 10 19.082 1.519 -4.539 1.00 0.59 N ATOM 1773 CA ILE B 10 19.450 1.459 -3.096 1.00 0.59 C ATOM 1774 C ILE B 10 19.296 0.025 -2.602 1.00 0.51 C ATOM 1775 O ILE B 10 20.222 -0.563 -2.079 1.00 0.54 O ATOM 1776 CB ILE B 10 18.549 2.402 -2.277 1.00 0.67 C ATOM 1777 CG1 ILE B 10 19.216 3.791 -2.219 1.00 0.85 C ATOM 1778 CG2 ILE B 10 18.366 1.835 -0.854 1.00 0.74 C ATOM 1779 CD1 ILE B 10 18.359 4.774 -1.416 1.00 1.31 C ATOM 0 H ILE B 10 18.291 2.125 -4.755 1.00 0.59 H new ATOM 0 HA ILE B 10 20.485 1.778 -2.971 1.00 0.59 H new ATOM 0 HB ILE B 10 17.568 2.488 -2.744 1.00 0.67 H new ATOM 0 HG12 ILE B 10 20.203 3.707 -1.764 1.00 0.85 H new ATOM 0 HG13 ILE B 10 19.363 4.171 -3.230 1.00 0.85 H new ATOM 0 HG21 ILE B 10 17.728 2.503 -0.275 1.00 0.74 H new ATOM 0 HG22 ILE B 10 17.902 0.850 -0.912 1.00 0.74 H new ATOM 0 HG23 ILE B 10 19.338 1.750 -0.368 1.00 0.74 H new ATOM 0 HD11 ILE B 10 18.850 5.747 -1.389 1.00 1.31 H new ATOM 0 HD12 ILE B 10 17.381 4.874 -1.888 1.00 1.31 H new ATOM 0 HD13 ILE B 10 18.235 4.402 -0.399 1.00 1.31 H new ATOM 1791 N GLN B 11 18.128 -0.539 -2.762 1.00 0.50 N ATOM 1792 CA GLN B 11 17.914 -1.938 -2.299 1.00 0.50 C ATOM 1793 C GLN B 11 19.092 -2.801 -2.750 1.00 0.52 C ATOM 1794 O GLN B 11 19.583 -3.638 -2.017 1.00 0.52 O ATOM 1795 CB GLN B 11 16.618 -2.486 -2.900 1.00 0.55 C ATOM 1796 CG GLN B 11 16.018 -3.529 -1.955 1.00 1.24 C ATOM 1797 CD GLN B 11 15.037 -4.413 -2.725 1.00 1.53 C ATOM 1798 OE1 GLN B 11 13.848 -4.161 -2.729 1.00 2.22 O ATOM 1799 NE2 GLN B 11 15.487 -5.447 -3.383 1.00 1.91 N ATOM 0 H GLN B 11 17.318 -0.093 -3.191 1.00 0.50 H new ATOM 0 HA GLN B 11 17.841 -1.956 -1.212 1.00 0.50 H new ATOM 0 HB2 GLN B 11 15.908 -1.675 -3.061 1.00 0.55 H new ATOM 0 HB3 GLN B 11 16.817 -2.934 -3.874 1.00 0.55 H new ATOM 0 HG2 GLN B 11 16.810 -4.139 -1.521 1.00 1.24 H new ATOM 0 HG3 GLN B 11 15.507 -3.035 -1.129 1.00 1.24 H new ATOM 0 HE21 GLN B 11 16.485 -5.659 -3.380 1.00 1.91 H new ATOM 0 HE22 GLN B 11 14.841 -6.043 -3.900 1.00 1.91 H new ATOM 1808 N ALA B 12 19.562 -2.592 -3.951 1.00 0.57 N ATOM 1809 CA ALA B 12 20.720 -3.381 -4.456 1.00 0.62 C ATOM 1810 C ALA B 12 21.985 -3.041 -3.659 1.00 0.57 C ATOM 1811 O ALA B 12 22.833 -3.884 -3.440 1.00 0.57 O ATOM 1812 CB ALA B 12 20.948 -3.056 -5.935 1.00 0.71 C ATOM 0 H ALA B 12 19.190 -1.904 -4.606 1.00 0.57 H new ATOM 0 HA ALA B 12 20.504 -4.443 -4.338 1.00 0.62 H new ATOM 0 HB1 ALA B 12 21.795 -3.632 -6.308 1.00 0.71 H new ATOM 0 HB2 ALA B 12 20.055 -3.313 -6.506 1.00 0.71 H new ATOM 0 HB3 ALA B 12 21.156 -1.992 -6.046 1.00 0.71 H new ATOM 1818 N ILE B 13 22.128 -1.812 -3.227 1.00 0.55 N ATOM 1819 CA ILE B 13 23.350 -1.445 -2.456 1.00 0.51 C ATOM 1820 C ILE B 13 23.353 -2.180 -1.111 1.00 0.44 C ATOM 1821 O ILE B 13 24.318 -2.820 -0.747 1.00 0.45 O ATOM 1822 CB ILE B 13 23.373 0.067 -2.221 1.00 0.52 C ATOM 1823 CG1 ILE B 13 23.570 0.783 -3.561 1.00 0.65 C ATOM 1824 CG2 ILE B 13 24.531 0.420 -1.284 1.00 0.52 C ATOM 1825 CD1 ILE B 13 23.342 2.285 -3.384 1.00 0.84 C ATOM 0 H ILE B 13 21.458 -1.057 -3.374 1.00 0.55 H new ATOM 0 HA ILE B 13 24.235 -1.734 -3.023 1.00 0.51 H new ATOM 0 HB ILE B 13 22.431 0.381 -1.771 1.00 0.52 H new ATOM 0 HG12 ILE B 13 24.577 0.600 -3.937 1.00 0.65 H new ATOM 0 HG13 ILE B 13 22.876 0.385 -4.302 1.00 0.65 H new ATOM 0 HG21 ILE B 13 24.548 1.497 -1.116 1.00 0.52 H new ATOM 0 HG22 ILE B 13 24.398 -0.094 -0.332 1.00 0.52 H new ATOM 0 HG23 ILE B 13 25.473 0.108 -1.736 1.00 0.52 H new ATOM 0 HD11 ILE B 13 23.483 2.790 -4.340 1.00 0.84 H new ATOM 0 HD12 ILE B 13 22.327 2.459 -3.028 1.00 0.84 H new ATOM 0 HD13 ILE B 13 24.053 2.678 -2.658 1.00 0.84 H new ATOM 1837 N LEU B 14 22.286 -2.084 -0.369 1.00 0.45 N ATOM 1838 CA LEU B 14 22.231 -2.768 0.958 1.00 0.41 C ATOM 1839 C LEU B 14 22.413 -4.278 0.785 1.00 0.42 C ATOM 1840 O LEU B 14 23.027 -4.939 1.599 1.00 0.41 O ATOM 1841 CB LEU B 14 20.872 -2.512 1.616 1.00 0.45 C ATOM 1842 CG LEU B 14 20.455 -1.058 1.399 1.00 0.57 C ATOM 1843 CD1 LEU B 14 19.240 -0.736 2.270 1.00 0.54 C ATOM 1844 CD2 LEU B 14 21.614 -0.142 1.783 1.00 1.01 C ATOM 0 H LEU B 14 21.447 -1.561 -0.622 1.00 0.45 H new ATOM 0 HA LEU B 14 23.031 -2.373 1.583 1.00 0.41 H new ATOM 0 HB2 LEU B 14 20.122 -3.181 1.194 1.00 0.45 H new ATOM 0 HB3 LEU B 14 20.928 -2.728 2.683 1.00 0.45 H new ATOM 0 HG LEU B 14 20.196 -0.905 0.351 1.00 0.57 H new ATOM 0 HD11 LEU B 14 18.945 0.301 2.113 1.00 0.54 H new ATOM 0 HD12 LEU B 14 18.414 -1.393 1.999 1.00 0.54 H new ATOM 0 HD13 LEU B 14 19.494 -0.886 3.319 1.00 0.54 H new ATOM 0 HD21 LEU B 14 21.323 0.897 1.630 1.00 1.01 H new ATOM 0 HD22 LEU B 14 21.868 -0.297 2.831 1.00 1.01 H new ATOM 0 HD23 LEU B 14 22.480 -0.371 1.162 1.00 1.01 H new ATOM 1856 N GLU B 15 21.874 -4.826 -0.263 1.00 0.47 N ATOM 1857 CA GLU B 15 22.000 -6.296 -0.493 1.00 0.52 C ATOM 1858 C GLU B 15 23.437 -6.666 -0.856 1.00 0.53 C ATOM 1859 O GLU B 15 23.938 -7.696 -0.459 1.00 0.60 O ATOM 1860 CB GLU B 15 21.072 -6.726 -1.636 1.00 0.59 C ATOM 1861 CG GLU B 15 19.618 -6.797 -1.154 1.00 0.80 C ATOM 1862 CD GLU B 15 18.872 -7.869 -1.951 1.00 0.73 C ATOM 1863 OE1 GLU B 15 19.320 -8.192 -3.038 1.00 1.28 O ATOM 1864 OE2 GLU B 15 17.864 -8.351 -1.459 1.00 1.29 O ATOM 0 H GLU B 15 21.348 -4.321 -0.976 1.00 0.47 H new ATOM 0 HA GLU B 15 21.721 -6.809 0.427 1.00 0.52 H new ATOM 0 HB2 GLU B 15 21.153 -6.020 -2.462 1.00 0.59 H new ATOM 0 HB3 GLU B 15 21.382 -7.699 -2.017 1.00 0.59 H new ATOM 0 HG2 GLU B 15 19.587 -7.031 -0.090 1.00 0.80 H new ATOM 0 HG3 GLU B 15 19.133 -5.829 -1.282 1.00 0.80 H new ATOM 1871 N ALA B 16 24.110 -5.851 -1.606 1.00 0.49 N ATOM 1872 CA ALA B 16 25.500 -6.195 -1.976 1.00 0.52 C ATOM 1873 C ALA B 16 26.355 -6.104 -0.728 1.00 0.50 C ATOM 1874 O ALA B 16 27.284 -6.860 -0.532 1.00 0.54 O ATOM 1875 CB ALA B 16 26.007 -5.215 -3.025 1.00 0.53 C ATOM 0 H ALA B 16 23.761 -4.967 -1.977 1.00 0.49 H new ATOM 0 HA ALA B 16 25.546 -7.202 -2.390 1.00 0.52 H new ATOM 0 HB1 ALA B 16 27.031 -5.470 -3.296 1.00 0.53 H new ATOM 0 HB2 ALA B 16 25.373 -5.269 -3.910 1.00 0.53 H new ATOM 0 HB3 ALA B 16 25.980 -4.203 -2.621 1.00 0.53 H new ATOM 1881 N CYS B 17 26.043 -5.170 0.116 1.00 0.46 N ATOM 1882 CA CYS B 17 26.827 -5.003 1.350 1.00 0.46 C ATOM 1883 C CYS B 17 26.418 -6.073 2.378 1.00 0.47 C ATOM 1884 O CYS B 17 27.072 -6.269 3.376 1.00 0.49 O ATOM 1885 CB CYS B 17 26.571 -3.603 1.901 1.00 0.42 C ATOM 1886 SG CYS B 17 25.039 -3.590 2.856 1.00 0.42 S ATOM 0 H CYS B 17 25.272 -4.513 -0.001 1.00 0.46 H new ATOM 0 HA CYS B 17 27.890 -5.123 1.141 1.00 0.46 H new ATOM 0 HB2 CYS B 17 27.405 -3.292 2.530 1.00 0.42 H new ATOM 0 HB3 CYS B 17 26.506 -2.887 1.082 1.00 0.42 H new ATOM 0 HG CYS B 17 24.195 -4.429 2.333 1.00 0.42 H new ATOM 1892 N LYS B 18 25.334 -6.765 2.145 1.00 0.49 N ATOM 1893 CA LYS B 18 24.884 -7.817 3.109 1.00 0.51 C ATOM 1894 C LYS B 18 26.027 -8.775 3.487 1.00 0.55 C ATOM 1895 O LYS B 18 25.830 -9.682 4.272 1.00 0.58 O ATOM 1896 CB LYS B 18 23.733 -8.618 2.492 1.00 0.56 C ATOM 1897 CG LYS B 18 24.283 -9.685 1.536 1.00 1.18 C ATOM 1898 CD LYS B 18 23.154 -10.225 0.649 1.00 1.89 C ATOM 1899 CE LYS B 18 22.253 -11.158 1.465 1.00 2.29 C ATOM 1900 NZ LYS B 18 21.270 -11.816 0.558 1.00 2.90 N ATOM 0 H LYS B 18 24.737 -6.648 1.326 1.00 0.49 H new ATOM 0 HA LYS B 18 24.552 -7.315 4.018 1.00 0.51 H new ATOM 0 HB2 LYS B 18 23.147 -9.092 3.279 1.00 0.56 H new ATOM 0 HB3 LYS B 18 23.062 -7.949 1.954 1.00 0.56 H new ATOM 0 HG2 LYS B 18 25.071 -9.258 0.916 1.00 1.18 H new ATOM 0 HG3 LYS B 18 24.731 -10.499 2.105 1.00 1.18 H new ATOM 0 HD2 LYS B 18 22.568 -9.398 0.247 1.00 1.89 H new ATOM 0 HD3 LYS B 18 23.573 -10.762 -0.202 1.00 1.89 H new ATOM 0 HE2 LYS B 18 22.856 -11.911 1.973 1.00 2.29 H new ATOM 0 HE3 LYS B 18 21.731 -10.593 2.237 1.00 2.29 H new ATOM 0 HZ1 LYS B 18 20.658 -12.450 1.111 1.00 2.90 H new ATOM 0 HZ2 LYS B 18 20.688 -11.091 0.093 1.00 2.90 H new ATOM 0 HZ3 LYS B 18 21.778 -12.367 -0.163 1.00 2.90 H new ATOM 1914 N SER B 19 27.209 -8.619 2.945 1.00 0.57 N ATOM 1915 CA SER B 19 28.297 -9.577 3.314 1.00 0.63 C ATOM 1916 C SER B 19 29.681 -9.003 2.990 1.00 0.66 C ATOM 1917 O SER B 19 30.636 -9.738 2.833 1.00 0.84 O ATOM 1918 CB SER B 19 28.101 -10.879 2.537 1.00 0.70 C ATOM 1919 OG SER B 19 28.345 -11.982 3.399 1.00 0.93 O ATOM 0 H SER B 19 27.465 -7.889 2.280 1.00 0.57 H new ATOM 0 HA SER B 19 28.244 -9.758 4.388 1.00 0.63 H new ATOM 0 HB2 SER B 19 27.087 -10.930 2.140 1.00 0.70 H new ATOM 0 HB3 SER B 19 28.779 -10.912 1.684 1.00 0.70 H new ATOM 0 HG SER B 19 28.219 -12.818 2.904 1.00 0.93 H new ATOM 1925 N GLY B 20 29.815 -7.710 2.896 1.00 0.65 N ATOM 1926 CA GLY B 20 31.157 -7.134 2.593 1.00 0.66 C ATOM 1927 C GLY B 20 31.471 -7.331 1.114 1.00 0.70 C ATOM 1928 O GLY B 20 31.914 -8.384 0.701 1.00 0.77 O ATOM 0 H GLY B 20 29.062 -7.032 3.014 1.00 0.65 H new ATOM 0 HA2 GLY B 20 31.174 -6.073 2.841 1.00 0.66 H new ATOM 0 HA3 GLY B 20 31.919 -7.617 3.205 1.00 0.66 H new ATOM 1932 N SER B 21 31.212 -6.341 0.308 1.00 0.67 N ATOM 1933 CA SER B 21 31.460 -6.484 -1.151 1.00 0.74 C ATOM 1934 C SER B 21 31.917 -5.130 -1.725 1.00 0.72 C ATOM 1935 O SER B 21 31.265 -4.130 -1.502 1.00 0.63 O ATOM 1936 CB SER B 21 30.148 -6.893 -1.817 1.00 0.74 C ATOM 1937 OG SER B 21 29.424 -7.739 -0.934 1.00 0.72 O ATOM 0 H SER B 21 30.838 -5.437 0.598 1.00 0.67 H new ATOM 0 HA SER B 21 32.231 -7.232 -1.333 1.00 0.74 H new ATOM 0 HB2 SER B 21 29.558 -6.009 -2.060 1.00 0.74 H new ATOM 0 HB3 SER B 21 30.348 -7.411 -2.755 1.00 0.74 H new ATOM 0 HG SER B 21 28.691 -7.234 -0.524 1.00 0.72 H new ATOM 1943 N PRO B 22 33.019 -5.076 -2.456 1.00 0.82 N ATOM 1944 CA PRO B 22 33.504 -3.795 -3.044 1.00 0.83 C ATOM 1945 C PRO B 22 32.407 -3.081 -3.834 1.00 0.81 C ATOM 1946 O PRO B 22 31.438 -3.683 -4.247 1.00 0.80 O ATOM 1947 CB PRO B 22 34.633 -4.203 -3.994 1.00 0.93 C ATOM 1948 CG PRO B 22 35.066 -5.568 -3.576 1.00 1.08 C ATOM 1949 CD PRO B 22 33.916 -6.202 -2.792 1.00 0.95 C ATOM 0 HA PRO B 22 33.824 -3.104 -2.265 1.00 0.83 H new ATOM 0 HB2 PRO B 22 34.288 -4.205 -5.028 1.00 0.93 H new ATOM 0 HB3 PRO B 22 35.462 -3.498 -3.936 1.00 0.93 H new ATOM 0 HG2 PRO B 22 35.314 -6.174 -4.447 1.00 1.08 H new ATOM 0 HG3 PRO B 22 35.964 -5.512 -2.960 1.00 1.08 H new ATOM 0 HD2 PRO B 22 33.399 -6.955 -3.388 1.00 0.95 H new ATOM 0 HD3 PRO B 22 34.278 -6.701 -1.893 1.00 0.95 H new ATOM 1957 N LYS B 23 32.559 -1.806 -4.058 1.00 0.80 N ATOM 1958 CA LYS B 23 31.534 -1.054 -4.832 1.00 0.80 C ATOM 1959 C LYS B 23 31.394 -1.693 -6.221 1.00 0.79 C ATOM 1960 O LYS B 23 30.368 -1.597 -6.863 1.00 0.79 O ATOM 1961 CB LYS B 23 31.993 0.405 -4.974 1.00 0.82 C ATOM 1962 CG LYS B 23 30.877 1.272 -5.588 1.00 0.78 C ATOM 1963 CD LYS B 23 31.261 1.692 -7.011 1.00 1.42 C ATOM 1964 CE LYS B 23 32.298 2.819 -6.955 1.00 1.27 C ATOM 1965 NZ LYS B 23 33.121 2.796 -8.197 1.00 1.83 N ATOM 0 H LYS B 23 33.352 -1.251 -3.737 1.00 0.80 H new ATOM 0 HA LYS B 23 30.572 -1.084 -4.320 1.00 0.80 H new ATOM 0 HB2 LYS B 23 32.271 0.800 -3.997 1.00 0.82 H new ATOM 0 HB3 LYS B 23 32.883 0.452 -5.602 1.00 0.82 H new ATOM 0 HG2 LYS B 23 29.940 0.715 -5.605 1.00 0.78 H new ATOM 0 HG3 LYS B 23 30.711 2.156 -4.972 1.00 0.78 H new ATOM 0 HD2 LYS B 23 31.666 0.839 -7.555 1.00 1.42 H new ATOM 0 HD3 LYS B 23 30.376 2.025 -7.553 1.00 1.42 H new ATOM 0 HE2 LYS B 23 31.799 3.783 -6.854 1.00 1.27 H new ATOM 0 HE3 LYS B 23 32.937 2.698 -6.080 1.00 1.27 H new ATOM 0 HZ1 LYS B 23 33.410 3.765 -8.440 1.00 1.83 H new ATOM 0 HZ2 LYS B 23 33.967 2.211 -8.042 1.00 1.83 H new ATOM 0 HZ3 LYS B 23 32.561 2.396 -8.977 1.00 1.83 H new ATOM 1979 N THR B 24 32.429 -2.353 -6.677 1.00 0.79 N ATOM 1980 CA THR B 24 32.391 -3.018 -8.016 1.00 0.79 C ATOM 1981 C THR B 24 31.425 -4.213 -8.020 1.00 0.82 C ATOM 1982 O THR B 24 30.721 -4.446 -8.981 1.00 0.84 O ATOM 1983 CB THR B 24 33.796 -3.509 -8.373 1.00 0.78 C ATOM 1984 OG1 THR B 24 34.174 -4.549 -7.480 1.00 0.85 O ATOM 1985 CG2 THR B 24 34.787 -2.351 -8.261 1.00 0.82 C ATOM 0 H THR B 24 33.309 -2.461 -6.173 1.00 0.79 H new ATOM 0 HA THR B 24 32.041 -2.291 -8.749 1.00 0.79 H new ATOM 0 HB THR B 24 33.800 -3.889 -9.395 1.00 0.78 H new ATOM 0 HG1 THR B 24 35.073 -4.866 -7.708 1.00 0.85 H new ATOM 0 HG21 THR B 24 35.787 -2.702 -8.515 1.00 0.82 H new ATOM 0 HG22 THR B 24 34.496 -1.556 -8.947 1.00 0.82 H new ATOM 0 HG23 THR B 24 34.786 -1.968 -7.240 1.00 0.82 H new ATOM 1993 N ARG B 25 31.400 -4.981 -6.962 1.00 0.84 N ATOM 1994 CA ARG B 25 30.498 -6.175 -6.910 1.00 0.89 C ATOM 1995 C ARG B 25 29.037 -5.716 -6.890 1.00 0.90 C ATOM 1996 O ARG B 25 28.119 -6.503 -7.012 1.00 0.96 O ATOM 1997 CB ARG B 25 30.809 -6.959 -5.625 1.00 0.90 C ATOM 1998 CG ARG B 25 30.952 -8.459 -5.915 1.00 1.33 C ATOM 1999 CD ARG B 25 29.574 -9.060 -6.192 1.00 1.07 C ATOM 2000 NE ARG B 25 29.705 -10.533 -6.378 1.00 1.67 N ATOM 2001 CZ ARG B 25 29.836 -11.312 -5.339 1.00 2.00 C ATOM 2002 NH1 ARG B 25 29.851 -10.803 -4.138 1.00 2.14 N ATOM 2003 NH2 ARG B 25 29.955 -12.603 -5.501 1.00 2.74 N ATOM 0 H ARG B 25 31.967 -4.834 -6.127 1.00 0.84 H new ATOM 0 HA ARG B 25 30.658 -6.806 -7.785 1.00 0.89 H new ATOM 0 HB2 ARG B 25 31.729 -6.582 -5.179 1.00 0.90 H new ATOM 0 HB3 ARG B 25 30.014 -6.800 -4.897 1.00 0.90 H new ATOM 0 HG2 ARG B 25 31.607 -8.613 -6.773 1.00 1.33 H new ATOM 0 HG3 ARG B 25 31.415 -8.962 -5.066 1.00 1.33 H new ATOM 0 HD2 ARG B 25 28.898 -8.846 -5.364 1.00 1.07 H new ATOM 0 HD3 ARG B 25 29.140 -8.607 -7.083 1.00 1.07 H new ATOM 0 HE ARG B 25 29.692 -10.932 -7.317 1.00 1.67 H new ATOM 0 HH11 ARG B 25 29.760 -9.795 -4.010 1.00 2.14 H new ATOM 0 HH12 ARG B 25 29.953 -11.413 -3.327 1.00 2.14 H new ATOM 0 HH21 ARG B 25 29.946 -13.002 -6.440 1.00 2.74 H new ATOM 0 HH22 ARG B 25 30.057 -13.212 -4.689 1.00 2.74 H new ATOM 2017 N ILE B 26 28.830 -4.446 -6.732 1.00 0.86 N ATOM 2018 CA ILE B 26 27.449 -3.918 -6.698 1.00 0.89 C ATOM 2019 C ILE B 26 26.986 -3.659 -8.132 1.00 0.93 C ATOM 2020 O ILE B 26 25.811 -3.510 -8.403 1.00 0.96 O ATOM 2021 CB ILE B 26 27.439 -2.661 -5.832 1.00 0.86 C ATOM 2022 CG1 ILE B 26 28.270 -2.984 -4.577 1.00 0.92 C ATOM 2023 CG2 ILE B 26 25.994 -2.305 -5.460 1.00 0.90 C ATOM 2024 CD1 ILE B 26 27.961 -2.028 -3.418 1.00 0.62 C ATOM 0 H ILE B 26 29.564 -3.746 -6.624 1.00 0.86 H new ATOM 0 HA ILE B 26 26.750 -4.629 -6.258 1.00 0.89 H new ATOM 0 HB ILE B 26 27.862 -1.804 -6.356 1.00 0.86 H new ATOM 0 HG12 ILE B 26 28.070 -4.009 -4.264 1.00 0.92 H new ATOM 0 HG13 ILE B 26 29.331 -2.927 -4.821 1.00 0.92 H new ATOM 0 HG21 ILE B 26 25.988 -1.407 -4.842 1.00 0.90 H new ATOM 0 HG22 ILE B 26 25.419 -2.124 -6.368 1.00 0.90 H new ATOM 0 HG23 ILE B 26 25.547 -3.130 -4.906 1.00 0.90 H new ATOM 0 HD11 ILE B 26 28.570 -2.294 -2.554 1.00 0.62 H new ATOM 0 HD12 ILE B 26 28.187 -1.005 -3.720 1.00 0.62 H new ATOM 0 HD13 ILE B 26 26.906 -2.104 -3.155 1.00 0.62 H new ATOM 2036 N MET B 27 27.907 -3.649 -9.058 1.00 0.94 N ATOM 2037 CA MET B 27 27.534 -3.453 -10.488 1.00 0.99 C ATOM 2038 C MET B 27 26.770 -4.686 -10.973 1.00 1.06 C ATOM 2039 O MET B 27 25.801 -4.582 -11.698 1.00 1.10 O ATOM 2040 CB MET B 27 28.798 -3.223 -11.321 1.00 0.98 C ATOM 2041 CG MET B 27 28.422 -2.784 -12.732 1.00 1.55 C ATOM 2042 SD MET B 27 29.831 -3.053 -13.836 1.00 1.89 S ATOM 2043 CE MET B 27 30.527 -1.385 -13.730 1.00 1.25 C ATOM 0 H MET B 27 28.905 -3.769 -8.884 1.00 0.94 H new ATOM 0 HA MET B 27 26.894 -2.578 -10.597 1.00 0.99 H new ATOM 0 HB2 MET B 27 29.421 -2.463 -10.849 1.00 0.98 H new ATOM 0 HB3 MET B 27 29.388 -4.139 -11.362 1.00 0.98 H new ATOM 0 HG2 MET B 27 27.557 -3.348 -13.083 1.00 1.55 H new ATOM 0 HG3 MET B 27 28.139 -1.731 -12.735 1.00 1.55 H new ATOM 0 HE1 MET B 27 31.423 -1.325 -14.348 1.00 1.25 H new ATOM 0 HE2 MET B 27 29.793 -0.661 -14.083 1.00 1.25 H new ATOM 0 HE3 MET B 27 30.785 -1.164 -12.694 1.00 1.25 H new ATOM 2053 N TYR B 28 27.188 -5.853 -10.561 1.00 1.07 N ATOM 2054 CA TYR B 28 26.471 -7.092 -10.978 1.00 1.14 C ATOM 2055 C TYR B 28 25.060 -7.059 -10.391 1.00 1.09 C ATOM 2056 O TYR B 28 24.228 -7.898 -10.673 1.00 1.20 O ATOM 2057 CB TYR B 28 27.214 -8.314 -10.441 1.00 1.17 C ATOM 2058 CG TYR B 28 26.514 -9.570 -10.903 1.00 1.43 C ATOM 2059 CD1 TYR B 28 26.793 -10.099 -12.168 1.00 1.71 C ATOM 2060 CD2 TYR B 28 25.587 -10.202 -10.067 1.00 2.20 C ATOM 2061 CE1 TYR B 28 26.143 -11.263 -12.599 1.00 1.98 C ATOM 2062 CE2 TYR B 28 24.937 -11.365 -10.498 1.00 2.58 C ATOM 2063 CZ TYR B 28 25.216 -11.896 -11.764 1.00 2.21 C ATOM 2064 OH TYR B 28 24.574 -13.042 -12.188 1.00 2.65 O ATOM 0 H TYR B 28 27.994 -6.001 -9.954 1.00 1.07 H new ATOM 0 HA TYR B 28 26.424 -7.148 -12.066 1.00 1.14 H new ATOM 0 HB2 TYR B 28 28.246 -8.309 -10.792 1.00 1.17 H new ATOM 0 HB3 TYR B 28 27.248 -8.283 -9.352 1.00 1.17 H new ATOM 0 HD1 TYR B 28 27.509 -9.610 -12.812 1.00 1.71 H new ATOM 0 HD2 TYR B 28 25.373 -9.793 -9.090 1.00 2.20 H new ATOM 0 HE1 TYR B 28 26.358 -11.671 -13.576 1.00 1.98 H new ATOM 0 HE2 TYR B 28 24.220 -11.853 -9.854 1.00 2.58 H new ATOM 0 HH TYR B 28 23.964 -13.354 -11.487 1.00 2.65 H new ATOM 2074 N GLY B 29 24.793 -6.075 -9.580 1.00 1.05 N ATOM 2075 CA GLY B 29 23.442 -5.948 -8.965 1.00 1.02 C ATOM 2076 C GLY B 29 22.584 -5.036 -9.840 1.00 1.05 C ATOM 2077 O GLY B 29 21.375 -4.998 -9.726 1.00 1.10 O ATOM 0 H GLY B 29 25.457 -5.348 -9.314 1.00 1.05 H new ATOM 0 HA2 GLY B 29 22.976 -6.929 -8.873 1.00 1.02 H new ATOM 0 HA3 GLY B 29 23.523 -5.538 -7.958 1.00 1.02 H new ATOM 2081 N ALA B 30 23.215 -4.302 -10.715 1.00 1.06 N ATOM 2082 CA ALA B 30 22.472 -3.377 -11.616 1.00 1.10 C ATOM 2083 C ALA B 30 23.462 -2.363 -12.183 1.00 1.16 C ATOM 2084 O ALA B 30 24.514 -2.143 -11.616 1.00 1.24 O ATOM 2085 CB ALA B 30 21.392 -2.635 -10.822 1.00 1.13 C ATOM 0 H ALA B 30 24.227 -4.304 -10.845 1.00 1.06 H new ATOM 0 HA ALA B 30 21.999 -3.941 -12.420 1.00 1.10 H new ATOM 0 HB1 ALA B 30 20.852 -1.960 -11.486 1.00 1.13 H new ATOM 0 HB2 ALA B 30 20.696 -3.356 -10.393 1.00 1.13 H new ATOM 0 HB3 ALA B 30 21.859 -2.061 -10.022 1.00 1.13 H new ATOM 2091 N ASN B 31 23.143 -1.733 -13.283 1.00 1.19 N ATOM 2092 CA ASN B 31 24.085 -0.725 -13.840 1.00 1.26 C ATOM 2093 C ASN B 31 24.485 0.206 -12.700 1.00 1.28 C ATOM 2094 O ASN B 31 23.674 0.956 -12.197 1.00 1.73 O ATOM 2095 CB ASN B 31 23.391 0.080 -14.944 1.00 1.34 C ATOM 2096 CG ASN B 31 23.004 -0.851 -16.093 1.00 1.68 C ATOM 2097 OD1 ASN B 31 22.191 -1.739 -15.925 1.00 2.40 O ATOM 2098 ND2 ASN B 31 23.556 -0.686 -17.265 1.00 1.85 N ATOM 0 H ASN B 31 22.282 -1.872 -13.812 1.00 1.19 H new ATOM 0 HA ASN B 31 24.961 -1.212 -14.267 1.00 1.26 H new ATOM 0 HB2 ASN B 31 22.503 0.571 -14.546 1.00 1.34 H new ATOM 0 HB3 ASN B 31 24.054 0.865 -15.307 1.00 1.34 H new ATOM 0 HD21 ASN B 31 23.305 -1.302 -18.038 1.00 1.85 H new ATOM 0 HD22 ASN B 31 24.238 0.059 -17.407 1.00 1.85 H new ATOM 2105 N LEU B 32 25.708 0.147 -12.248 1.00 1.11 N ATOM 2106 CA LEU B 32 26.087 1.013 -11.105 1.00 1.05 C ATOM 2107 C LEU B 32 26.303 2.444 -11.557 1.00 1.03 C ATOM 2108 O LEU B 32 27.190 2.770 -12.317 1.00 1.08 O ATOM 2109 CB LEU B 32 27.363 0.488 -10.435 1.00 1.08 C ATOM 2110 CG LEU B 32 27.170 0.343 -8.910 1.00 1.11 C ATOM 2111 CD1 LEU B 32 26.978 1.720 -8.275 1.00 1.07 C ATOM 2112 CD2 LEU B 32 25.946 -0.527 -8.584 1.00 1.16 C ATOM 0 H LEU B 32 26.447 -0.453 -12.615 1.00 1.11 H new ATOM 0 HA LEU B 32 25.268 0.993 -10.385 1.00 1.05 H new ATOM 0 HB2 LEU B 32 27.632 -0.477 -10.864 1.00 1.08 H new ATOM 0 HB3 LEU B 32 28.190 1.169 -10.637 1.00 1.08 H new ATOM 0 HG LEU B 32 28.062 -0.137 -8.507 1.00 1.11 H new ATOM 0 HD11 LEU B 32 26.843 1.609 -7.199 1.00 1.07 H new ATOM 0 HD12 LEU B 32 27.857 2.336 -8.468 1.00 1.07 H new ATOM 0 HD13 LEU B 32 26.098 2.199 -8.704 1.00 1.07 H new ATOM 0 HD21 LEU B 32 25.837 -0.610 -7.503 1.00 1.16 H new ATOM 0 HD22 LEU B 32 25.051 -0.069 -9.005 1.00 1.16 H new ATOM 0 HD23 LEU B 32 26.081 -1.520 -9.013 1.00 1.16 H new ATOM 2124 N SER B 33 25.500 3.297 -11.013 1.00 0.99 N ATOM 2125 CA SER B 33 25.598 4.747 -11.269 1.00 1.01 C ATOM 2126 C SER B 33 26.873 5.241 -10.582 1.00 0.96 C ATOM 2127 O SER B 33 27.047 6.413 -10.387 1.00 0.96 O ATOM 2128 CB SER B 33 24.367 5.465 -10.709 1.00 0.99 C ATOM 2129 OG SER B 33 23.409 4.501 -10.294 1.00 1.33 O ATOM 0 H SER B 33 24.748 3.037 -10.375 1.00 0.99 H new ATOM 0 HA SER B 33 25.638 4.954 -12.338 1.00 1.01 H new ATOM 0 HB2 SER B 33 24.652 6.097 -9.868 1.00 0.99 H new ATOM 0 HB3 SER B 33 23.937 6.119 -11.468 1.00 0.99 H new ATOM 0 HG SER B 33 23.234 4.606 -9.336 1.00 1.33 H new ATOM 2135 N TYR B 34 27.702 4.315 -10.124 1.00 0.95 N ATOM 2136 CA TYR B 34 28.935 4.649 -9.329 1.00 0.94 C ATOM 2137 C TYR B 34 29.417 6.074 -9.565 1.00 0.96 C ATOM 2138 O TYR B 34 29.779 6.753 -8.624 1.00 0.89 O ATOM 2139 CB TYR B 34 30.074 3.701 -9.724 1.00 1.10 C ATOM 2140 CG TYR B 34 30.616 4.060 -11.090 1.00 1.01 C ATOM 2141 CD1 TYR B 34 31.549 5.096 -11.225 1.00 1.81 C ATOM 2142 CD2 TYR B 34 30.192 3.352 -12.221 1.00 1.77 C ATOM 2143 CE1 TYR B 34 32.053 5.426 -12.489 1.00 2.56 C ATOM 2144 CE2 TYR B 34 30.697 3.682 -13.486 1.00 2.53 C ATOM 2145 CZ TYR B 34 31.626 4.719 -13.619 1.00 2.75 C ATOM 2146 OH TYR B 34 32.124 5.046 -14.864 1.00 3.76 O ATOM 0 H TYR B 34 27.566 3.315 -10.276 1.00 0.95 H new ATOM 0 HA TYR B 34 28.667 4.542 -8.278 1.00 0.94 H new ATOM 0 HB2 TYR B 34 30.873 3.755 -8.984 1.00 1.10 H new ATOM 0 HB3 TYR B 34 29.713 2.672 -9.729 1.00 1.10 H new ATOM 0 HD1 TYR B 34 31.880 5.641 -10.353 1.00 1.81 H new ATOM 0 HD2 TYR B 34 29.475 2.551 -12.119 1.00 1.77 H new ATOM 0 HE1 TYR B 34 32.771 6.226 -12.592 1.00 2.56 H new ATOM 0 HE2 TYR B 34 30.369 3.136 -14.358 1.00 2.53 H new ATOM 0 HH TYR B 34 31.726 4.459 -15.540 1.00 3.76 H new ATOM 2156 N ALA B 35 29.405 6.566 -10.762 1.00 1.07 N ATOM 2157 CA ALA B 35 29.838 7.972 -10.932 1.00 1.15 C ATOM 2158 C ALA B 35 28.976 8.802 -9.982 1.00 1.05 C ATOM 2159 O ALA B 35 29.456 9.608 -9.209 1.00 1.03 O ATOM 2160 CB ALA B 35 29.608 8.421 -12.377 1.00 1.30 C ATOM 0 H ALA B 35 29.123 6.074 -11.610 1.00 1.07 H new ATOM 0 HA ALA B 35 30.899 8.091 -10.713 1.00 1.15 H new ATOM 0 HB1 ALA B 35 29.929 9.456 -12.492 1.00 1.30 H new ATOM 0 HB2 ALA B 35 30.182 7.786 -13.051 1.00 1.30 H new ATOM 0 HB3 ALA B 35 28.548 8.341 -12.618 1.00 1.30 H new ATOM 2166 N LEU B 36 27.696 8.559 -10.025 1.00 1.02 N ATOM 2167 CA LEU B 36 26.738 9.261 -9.125 1.00 0.96 C ATOM 2168 C LEU B 36 26.399 8.389 -7.900 1.00 0.83 C ATOM 2169 O LEU B 36 26.427 8.843 -6.774 1.00 0.79 O ATOM 2170 CB LEU B 36 25.454 9.568 -9.898 1.00 1.03 C ATOM 2171 CG LEU B 36 25.470 11.028 -10.356 1.00 1.16 C ATOM 2172 CD1 LEU B 36 26.711 11.281 -11.213 1.00 1.74 C ATOM 2173 CD2 LEU B 36 24.214 11.316 -11.180 1.00 1.99 C ATOM 0 H LEU B 36 27.264 7.888 -10.660 1.00 1.02 H new ATOM 0 HA LEU B 36 27.198 10.186 -8.777 1.00 0.96 H new ATOM 0 HB2 LEU B 36 25.369 8.906 -10.760 1.00 1.03 H new ATOM 0 HB3 LEU B 36 24.584 9.383 -9.267 1.00 1.03 H new ATOM 0 HG LEU B 36 25.492 11.682 -9.484 1.00 1.16 H new ATOM 0 HD11 LEU B 36 26.722 12.321 -11.539 1.00 1.74 H new ATOM 0 HD12 LEU B 36 27.606 11.075 -10.626 1.00 1.74 H new ATOM 0 HD13 LEU B 36 26.690 10.628 -12.085 1.00 1.74 H new ATOM 0 HD21 LEU B 36 24.224 12.356 -11.507 1.00 1.99 H new ATOM 0 HD22 LEU B 36 24.193 10.662 -12.051 1.00 1.99 H new ATOM 0 HD23 LEU B 36 23.329 11.136 -10.569 1.00 1.99 H new ATOM 2185 N THR B 37 26.027 7.146 -8.128 1.00 0.80 N ATOM 2186 CA THR B 37 25.621 6.243 -6.998 1.00 0.71 C ATOM 2187 C THR B 37 26.564 6.388 -5.806 1.00 0.66 C ATOM 2188 O THR B 37 26.141 6.259 -4.677 1.00 0.61 O ATOM 2189 CB THR B 37 25.592 4.778 -7.454 1.00 0.80 C ATOM 2190 OG1 THR B 37 24.377 4.524 -8.142 1.00 0.93 O ATOM 2191 CG2 THR B 37 25.681 3.854 -6.234 1.00 0.81 C ATOM 0 H THR B 37 25.987 6.718 -9.053 1.00 0.80 H new ATOM 0 HA THR B 37 24.619 6.541 -6.688 1.00 0.71 H new ATOM 0 HB THR B 37 26.438 4.590 -8.115 1.00 0.80 H new ATOM 0 HG1 THR B 37 24.397 3.619 -8.518 1.00 0.93 H new ATOM 0 HG21 THR B 37 25.660 2.815 -6.562 1.00 0.81 H new ATOM 0 HG22 THR B 37 26.611 4.047 -5.699 1.00 0.81 H new ATOM 0 HG23 THR B 37 24.836 4.043 -5.572 1.00 0.81 H new ATOM 2199 N GLY B 38 27.825 6.651 -6.024 1.00 0.69 N ATOM 2200 CA GLY B 38 28.746 6.810 -4.853 1.00 0.68 C ATOM 2201 C GLY B 38 28.045 7.706 -3.827 1.00 0.65 C ATOM 2202 O GLY B 38 28.295 7.653 -2.639 1.00 0.64 O ATOM 0 H GLY B 38 28.254 6.762 -6.943 1.00 0.69 H new ATOM 0 HA2 GLY B 38 28.980 5.839 -4.416 1.00 0.68 H new ATOM 0 HA3 GLY B 38 29.690 7.255 -5.167 1.00 0.68 H new ATOM 2206 N ARG B 39 27.144 8.513 -4.313 1.00 0.67 N ATOM 2207 CA ARG B 39 26.357 9.430 -3.446 1.00 0.69 C ATOM 2208 C ARG B 39 25.415 8.608 -2.558 1.00 0.64 C ATOM 2209 O ARG B 39 25.124 8.975 -1.437 1.00 0.64 O ATOM 2210 CB ARG B 39 25.527 10.341 -4.353 1.00 0.76 C ATOM 2211 CG ARG B 39 24.759 11.369 -3.521 1.00 0.80 C ATOM 2212 CD ARG B 39 23.341 11.507 -4.083 1.00 0.82 C ATOM 2213 NE ARG B 39 22.600 12.545 -3.311 1.00 1.17 N ATOM 2214 CZ ARG B 39 21.298 12.586 -3.359 1.00 1.79 C ATOM 2215 NH1 ARG B 39 20.644 11.718 -4.081 1.00 2.44 N ATOM 2216 NH2 ARG B 39 20.649 13.495 -2.685 1.00 2.34 N ATOM 0 H ARG B 39 26.915 8.575 -5.305 1.00 0.67 H new ATOM 0 HA ARG B 39 27.021 10.020 -2.814 1.00 0.69 H new ATOM 0 HB2 ARG B 39 26.180 10.852 -5.061 1.00 0.76 H new ATOM 0 HB3 ARG B 39 24.828 9.743 -4.938 1.00 0.76 H new ATOM 0 HG2 ARG B 39 24.722 11.056 -2.477 1.00 0.80 H new ATOM 0 HG3 ARG B 39 25.270 12.332 -3.547 1.00 0.80 H new ATOM 0 HD2 ARG B 39 23.381 11.782 -5.137 1.00 0.82 H new ATOM 0 HD3 ARG B 39 22.820 10.552 -4.022 1.00 0.82 H new ATOM 0 HE ARG B 39 23.111 13.223 -2.746 1.00 1.17 H new ATOM 0 HH11 ARG B 39 21.152 11.007 -4.608 1.00 2.44 H new ATOM 0 HH12 ARG B 39 19.625 11.750 -4.118 1.00 2.44 H new ATOM 0 HH21 ARG B 39 21.160 14.174 -2.121 1.00 2.34 H new ATOM 0 HH22 ARG B 39 19.630 13.527 -2.722 1.00 2.34 H new ATOM 2230 N TYR B 40 24.941 7.501 -3.055 1.00 0.60 N ATOM 2231 CA TYR B 40 24.022 6.657 -2.245 1.00 0.56 C ATOM 2232 C TYR B 40 24.831 5.813 -1.267 1.00 0.48 C ATOM 2233 O TYR B 40 24.429 5.599 -0.143 1.00 0.47 O ATOM 2234 CB TYR B 40 23.180 5.769 -3.169 1.00 0.58 C ATOM 2235 CG TYR B 40 21.936 6.538 -3.541 1.00 0.81 C ATOM 2236 CD1 TYR B 40 20.958 6.791 -2.573 1.00 1.51 C ATOM 2237 CD2 TYR B 40 21.772 7.023 -4.845 1.00 1.61 C ATOM 2238 CE1 TYR B 40 19.814 7.525 -2.908 1.00 1.79 C ATOM 2239 CE2 TYR B 40 20.631 7.761 -5.179 1.00 1.88 C ATOM 2240 CZ TYR B 40 19.651 8.012 -4.209 1.00 1.59 C ATOM 2241 OH TYR B 40 18.529 8.744 -4.535 1.00 2.01 O ATOM 0 H TYR B 40 25.150 7.144 -3.987 1.00 0.60 H new ATOM 0 HA TYR B 40 23.346 7.295 -1.675 1.00 0.56 H new ATOM 0 HB2 TYR B 40 23.746 5.502 -4.062 1.00 0.58 H new ATOM 0 HB3 TYR B 40 22.917 4.837 -2.668 1.00 0.58 H new ATOM 0 HD1 TYR B 40 21.086 6.420 -1.567 1.00 1.51 H new ATOM 0 HD2 TYR B 40 22.526 6.827 -5.593 1.00 1.61 H new ATOM 0 HE1 TYR B 40 19.057 7.715 -2.162 1.00 1.79 H new ATOM 0 HE2 TYR B 40 20.506 8.137 -6.184 1.00 1.88 H new ATOM 0 HH TYR B 40 18.389 8.714 -5.505 1.00 2.01 H new ATOM 2251 N ILE B 41 25.979 5.346 -1.665 1.00 0.44 N ATOM 2252 CA ILE B 41 26.805 4.536 -0.733 1.00 0.40 C ATOM 2253 C ILE B 41 27.262 5.416 0.433 1.00 0.41 C ATOM 2254 O ILE B 41 27.034 5.111 1.587 1.00 0.41 O ATOM 2255 CB ILE B 41 28.021 3.988 -1.477 1.00 0.41 C ATOM 2256 CG1 ILE B 41 27.560 2.935 -2.485 1.00 0.53 C ATOM 2257 CG2 ILE B 41 28.990 3.349 -0.480 1.00 0.47 C ATOM 2258 CD1 ILE B 41 28.662 2.693 -3.515 1.00 0.54 C ATOM 0 H ILE B 41 26.379 5.490 -2.592 1.00 0.44 H new ATOM 0 HA ILE B 41 26.216 3.704 -0.347 1.00 0.40 H new ATOM 0 HB ILE B 41 28.526 4.801 -1.998 1.00 0.41 H new ATOM 0 HG12 ILE B 41 27.319 2.005 -1.970 1.00 0.53 H new ATOM 0 HG13 ILE B 41 26.650 3.268 -2.983 1.00 0.53 H new ATOM 0 HG21 ILE B 41 29.857 2.959 -1.014 1.00 0.47 H new ATOM 0 HG22 ILE B 41 29.315 4.098 0.242 1.00 0.47 H new ATOM 0 HG23 ILE B 41 28.489 2.534 0.043 1.00 0.47 H new ATOM 0 HD11 ILE B 41 28.331 1.942 -4.232 1.00 0.54 H new ATOM 0 HD12 ILE B 41 28.881 3.623 -4.039 1.00 0.54 H new ATOM 0 HD13 ILE B 41 29.561 2.341 -3.010 1.00 0.54 H new ATOM 2270 N LYS B 42 27.901 6.513 0.132 1.00 0.46 N ATOM 2271 CA LYS B 42 28.372 7.427 1.207 1.00 0.50 C ATOM 2272 C LYS B 42 27.174 7.884 2.042 1.00 0.51 C ATOM 2273 O LYS B 42 27.182 7.809 3.255 1.00 0.53 O ATOM 2274 CB LYS B 42 29.049 8.643 0.568 1.00 0.59 C ATOM 2275 CG LYS B 42 30.087 9.227 1.529 1.00 0.89 C ATOM 2276 CD LYS B 42 29.399 9.699 2.812 1.00 0.61 C ATOM 2277 CE LYS B 42 30.258 10.771 3.485 1.00 0.65 C ATOM 2278 NZ LYS B 42 31.700 10.428 3.320 1.00 1.61 N ATOM 0 H LYS B 42 28.117 6.816 -0.818 1.00 0.46 H new ATOM 0 HA LYS B 42 29.084 6.909 1.850 1.00 0.50 H new ATOM 0 HB2 LYS B 42 29.529 8.353 -0.367 1.00 0.59 H new ATOM 0 HB3 LYS B 42 28.303 9.398 0.323 1.00 0.59 H new ATOM 0 HG2 LYS B 42 30.841 8.476 1.765 1.00 0.89 H new ATOM 0 HG3 LYS B 42 30.605 10.061 1.056 1.00 0.89 H new ATOM 0 HD2 LYS B 42 28.412 10.100 2.582 1.00 0.61 H new ATOM 0 HD3 LYS B 42 29.251 8.858 3.489 1.00 0.61 H new ATOM 0 HE2 LYS B 42 30.052 11.747 3.044 1.00 0.65 H new ATOM 0 HE3 LYS B 42 30.008 10.840 4.544 1.00 0.65 H new ATOM 0 HZ1 LYS B 42 32.261 10.934 4.034 1.00 1.61 H new ATOM 0 HZ2 LYS B 42 31.829 9.403 3.441 1.00 1.61 H new ATOM 0 HZ3 LYS B 42 32.017 10.707 2.370 1.00 1.61 H new ATOM 2292 N MET B 43 26.144 8.356 1.396 1.00 0.55 N ATOM 2293 CA MET B 43 24.938 8.821 2.136 1.00 0.60 C ATOM 2294 C MET B 43 24.423 7.710 3.056 1.00 0.50 C ATOM 2295 O MET B 43 24.153 7.930 4.219 1.00 0.52 O ATOM 2296 CB MET B 43 23.856 9.211 1.129 1.00 0.68 C ATOM 2297 CG MET B 43 22.561 9.511 1.874 1.00 0.78 C ATOM 2298 SD MET B 43 21.385 10.308 0.752 1.00 1.39 S ATOM 2299 CE MET B 43 20.848 11.624 1.873 1.00 2.16 C ATOM 0 H MET B 43 26.086 8.440 0.381 1.00 0.55 H new ATOM 0 HA MET B 43 25.197 9.685 2.749 1.00 0.60 H new ATOM 0 HB2 MET B 43 24.172 10.084 0.558 1.00 0.68 H new ATOM 0 HB3 MET B 43 23.699 8.403 0.414 1.00 0.68 H new ATOM 0 HG2 MET B 43 22.135 8.589 2.269 1.00 0.78 H new ATOM 0 HG3 MET B 43 22.762 10.159 2.727 1.00 0.78 H new ATOM 0 HE1 MET B 43 20.107 12.248 1.373 1.00 2.16 H new ATOM 0 HE2 MET B 43 20.408 11.183 2.767 1.00 2.16 H new ATOM 0 HE3 MET B 43 21.706 12.235 2.154 1.00 2.16 H new ATOM 2309 N LEU B 44 24.280 6.520 2.545 1.00 0.43 N ATOM 2310 CA LEU B 44 23.775 5.398 3.392 1.00 0.35 C ATOM 2311 C LEU B 44 24.726 5.185 4.576 1.00 0.32 C ATOM 2312 O LEU B 44 24.306 4.880 5.678 1.00 0.35 O ATOM 2313 CB LEU B 44 23.701 4.130 2.542 1.00 0.33 C ATOM 2314 CG LEU B 44 22.529 4.239 1.560 1.00 0.49 C ATOM 2315 CD1 LEU B 44 22.694 3.194 0.456 1.00 0.90 C ATOM 2316 CD2 LEU B 44 21.198 4.002 2.281 1.00 0.68 C ATOM 0 H LEU B 44 24.490 6.273 1.578 1.00 0.43 H new ATOM 0 HA LEU B 44 22.782 5.635 3.775 1.00 0.35 H new ATOM 0 HB2 LEU B 44 24.634 3.990 1.996 1.00 0.33 H new ATOM 0 HB3 LEU B 44 23.573 3.257 3.182 1.00 0.33 H new ATOM 0 HG LEU B 44 22.525 5.241 1.131 1.00 0.49 H new ATOM 0 HD11 LEU B 44 21.862 3.269 -0.244 1.00 0.90 H new ATOM 0 HD12 LEU B 44 23.630 3.369 -0.074 1.00 0.90 H new ATOM 0 HD13 LEU B 44 22.708 2.197 0.897 1.00 0.90 H new ATOM 0 HD21 LEU B 44 20.378 4.084 1.567 1.00 0.68 H new ATOM 0 HD22 LEU B 44 21.196 3.006 2.724 1.00 0.68 H new ATOM 0 HD23 LEU B 44 21.071 4.748 3.066 1.00 0.68 H new ATOM 2328 N MET B 45 25.999 5.372 4.371 1.00 0.40 N ATOM 2329 CA MET B 45 26.962 5.216 5.497 1.00 0.42 C ATOM 2330 C MET B 45 26.807 6.437 6.394 1.00 0.44 C ATOM 2331 O MET B 45 26.742 6.353 7.605 1.00 0.43 O ATOM 2332 CB MET B 45 28.388 5.177 4.942 1.00 0.52 C ATOM 2333 CG MET B 45 29.142 4.000 5.555 1.00 1.13 C ATOM 2334 SD MET B 45 30.908 4.135 5.164 1.00 0.80 S ATOM 2335 CE MET B 45 30.852 3.495 3.469 1.00 0.83 C ATOM 0 H MET B 45 26.414 5.626 3.475 1.00 0.40 H new ATOM 0 HA MET B 45 26.770 4.296 6.050 1.00 0.42 H new ATOM 0 HB2 MET B 45 28.364 5.082 3.856 1.00 0.52 H new ATOM 0 HB3 MET B 45 28.903 6.110 5.169 1.00 0.52 H new ATOM 0 HG2 MET B 45 28.999 3.987 6.635 1.00 1.13 H new ATOM 0 HG3 MET B 45 28.745 3.061 5.170 1.00 1.13 H new ATOM 0 HE1 MET B 45 31.346 2.524 3.430 1.00 0.83 H new ATOM 0 HE2 MET B 45 29.814 3.387 3.155 1.00 0.83 H new ATOM 0 HE3 MET B 45 31.363 4.189 2.801 1.00 0.83 H new ATOM 2345 N ASP B 46 26.722 7.571 5.770 1.00 0.48 N ATOM 2346 CA ASP B 46 26.538 8.839 6.519 1.00 0.53 C ATOM 2347 C ASP B 46 25.246 8.751 7.334 1.00 0.51 C ATOM 2348 O ASP B 46 25.083 9.425 8.331 1.00 0.55 O ATOM 2349 CB ASP B 46 26.441 10.004 5.539 1.00 0.59 C ATOM 2350 CG ASP B 46 27.060 11.255 6.166 1.00 0.71 C ATOM 2351 OD1 ASP B 46 26.367 11.924 6.914 1.00 1.30 O ATOM 2352 OD2 ASP B 46 28.217 11.523 5.886 1.00 1.26 O ATOM 0 H ASP B 46 26.773 7.676 4.757 1.00 0.48 H new ATOM 0 HA ASP B 46 27.387 8.999 7.184 1.00 0.53 H new ATOM 0 HB2 ASP B 46 26.957 9.756 4.612 1.00 0.59 H new ATOM 0 HB3 ASP B 46 25.398 10.191 5.283 1.00 0.59 H new ATOM 2357 N LEU B 47 24.325 7.923 6.905 1.00 0.48 N ATOM 2358 CA LEU B 47 23.035 7.790 7.644 1.00 0.50 C ATOM 2359 C LEU B 47 23.081 6.563 8.557 1.00 0.46 C ATOM 2360 O LEU B 47 22.171 6.323 9.323 1.00 0.50 O ATOM 2361 CB LEU B 47 21.884 7.656 6.648 1.00 0.51 C ATOM 2362 CG LEU B 47 21.231 9.026 6.432 1.00 0.59 C ATOM 2363 CD1 LEU B 47 22.296 10.053 6.041 1.00 0.59 C ATOM 2364 CD2 LEU B 47 20.192 8.921 5.313 1.00 0.62 C ATOM 0 H LEU B 47 24.412 7.335 6.076 1.00 0.48 H new ATOM 0 HA LEU B 47 22.878 8.679 8.255 1.00 0.50 H new ATOM 0 HB2 LEU B 47 22.253 7.264 5.700 1.00 0.51 H new ATOM 0 HB3 LEU B 47 21.147 6.945 7.022 1.00 0.51 H new ATOM 0 HG LEU B 47 20.747 9.344 7.356 1.00 0.59 H new ATOM 0 HD11 LEU B 47 21.826 11.025 5.889 1.00 0.59 H new ATOM 0 HD12 LEU B 47 23.037 10.129 6.836 1.00 0.59 H new ATOM 0 HD13 LEU B 47 22.784 9.738 5.119 1.00 0.59 H new ATOM 0 HD21 LEU B 47 19.726 9.894 5.157 1.00 0.62 H new ATOM 0 HD22 LEU B 47 20.680 8.601 4.392 1.00 0.62 H new ATOM 0 HD23 LEU B 47 19.429 8.194 5.592 1.00 0.62 H new ATOM 2376 N GLU B 48 24.135 5.791 8.477 1.00 0.42 N ATOM 2377 CA GLU B 48 24.261 4.574 9.336 1.00 0.42 C ATOM 2378 C GLU B 48 23.465 3.421 8.718 1.00 0.39 C ATOM 2379 O GLU B 48 22.445 3.002 9.228 1.00 0.47 O ATOM 2380 CB GLU B 48 23.761 4.873 10.757 1.00 0.47 C ATOM 2381 CG GLU B 48 24.556 4.036 11.763 1.00 1.16 C ATOM 2382 CD GLU B 48 25.913 4.694 12.015 1.00 1.19 C ATOM 2383 OE1 GLU B 48 25.925 5.819 12.488 1.00 1.72 O ATOM 2384 OE2 GLU B 48 26.918 4.062 11.733 1.00 1.69 O ATOM 0 H GLU B 48 24.921 5.953 7.847 1.00 0.42 H new ATOM 0 HA GLU B 48 25.310 4.285 9.396 1.00 0.42 H new ATOM 0 HB2 GLU B 48 23.876 5.934 10.979 1.00 0.47 H new ATOM 0 HB3 GLU B 48 22.698 4.644 10.836 1.00 0.47 H new ATOM 0 HG2 GLU B 48 24.003 3.950 12.698 1.00 1.16 H new ATOM 0 HG3 GLU B 48 24.696 3.025 11.381 1.00 1.16 H new ATOM 2391 N ILE B 49 23.931 2.903 7.617 1.00 0.32 N ATOM 2392 CA ILE B 49 23.221 1.777 6.953 1.00 0.30 C ATOM 2393 C ILE B 49 24.268 0.880 6.297 1.00 0.30 C ATOM 2394 O ILE B 49 24.145 -0.332 6.284 1.00 0.31 O ATOM 2395 CB ILE B 49 22.270 2.336 5.882 1.00 0.29 C ATOM 2396 CG1 ILE B 49 20.990 2.895 6.527 1.00 0.35 C ATOM 2397 CG2 ILE B 49 21.898 1.232 4.892 1.00 0.29 C ATOM 2398 CD1 ILE B 49 21.093 4.417 6.630 1.00 0.51 C ATOM 0 H ILE B 49 24.780 3.214 7.145 1.00 0.32 H new ATOM 0 HA ILE B 49 22.640 1.208 7.679 1.00 0.30 H new ATOM 0 HB ILE B 49 22.781 3.144 5.358 1.00 0.29 H new ATOM 0 HG12 ILE B 49 20.120 2.618 5.932 1.00 0.35 H new ATOM 0 HG13 ILE B 49 20.850 2.462 7.517 1.00 0.35 H new ATOM 0 HG21 ILE B 49 21.224 1.634 4.135 1.00 0.29 H new ATOM 0 HG22 ILE B 49 22.801 0.856 4.411 1.00 0.29 H new ATOM 0 HG23 ILE B 49 21.404 0.418 5.423 1.00 0.29 H new ATOM 0 HD11 ILE B 49 20.186 4.813 7.087 1.00 0.51 H new ATOM 0 HD12 ILE B 49 21.954 4.683 7.243 1.00 0.51 H new ATOM 0 HD13 ILE B 49 21.212 4.842 5.633 1.00 0.51 H new ATOM 2410 N ILE B 50 25.307 1.471 5.772 1.00 0.30 N ATOM 2411 CA ILE B 50 26.381 0.664 5.130 1.00 0.31 C ATOM 2412 C ILE B 50 27.565 0.585 6.089 1.00 0.36 C ATOM 2413 O ILE B 50 27.618 1.306 7.066 1.00 0.57 O ATOM 2414 CB ILE B 50 26.793 1.315 3.810 1.00 0.31 C ATOM 2415 CG1 ILE B 50 25.723 1.002 2.757 1.00 0.35 C ATOM 2416 CG2 ILE B 50 28.133 0.745 3.344 1.00 0.36 C ATOM 2417 CD1 ILE B 50 26.016 1.765 1.462 1.00 0.70 C ATOM 0 H ILE B 50 25.458 2.480 5.761 1.00 0.30 H new ATOM 0 HA ILE B 50 26.024 -0.343 4.914 1.00 0.31 H new ATOM 0 HB ILE B 50 26.891 2.392 3.947 1.00 0.31 H new ATOM 0 HG12 ILE B 50 25.700 -0.070 2.559 1.00 0.35 H new ATOM 0 HG13 ILE B 50 24.739 1.278 3.135 1.00 0.35 H new ATOM 0 HG21 ILE B 50 28.420 1.214 2.403 1.00 0.36 H new ATOM 0 HG22 ILE B 50 28.895 0.946 4.097 1.00 0.36 H new ATOM 0 HG23 ILE B 50 28.040 -0.331 3.200 1.00 0.36 H new ATOM 0 HD11 ILE B 50 25.249 1.534 0.722 1.00 0.70 H new ATOM 0 HD12 ILE B 50 26.016 2.836 1.663 1.00 0.70 H new ATOM 0 HD13 ILE B 50 26.992 1.468 1.078 1.00 0.70 H new ATOM 2429 N ARG B 51 28.513 -0.281 5.836 1.00 0.42 N ATOM 2430 CA ARG B 51 29.673 -0.378 6.766 1.00 0.44 C ATOM 2431 C ARG B 51 30.926 -0.665 5.965 1.00 0.44 C ATOM 2432 O ARG B 51 30.866 -1.234 4.910 1.00 0.54 O ATOM 2433 CB ARG B 51 29.444 -1.500 7.776 1.00 0.52 C ATOM 2434 CG ARG B 51 29.698 -0.955 9.180 1.00 0.75 C ATOM 2435 CD ARG B 51 29.629 -2.084 10.206 1.00 0.89 C ATOM 2436 NE ARG B 51 30.846 -2.043 11.067 1.00 0.89 N ATOM 2437 CZ ARG B 51 30.907 -1.217 12.077 1.00 0.95 C ATOM 2438 NH1 ARG B 51 29.903 -0.426 12.338 1.00 1.50 N ATOM 2439 NH2 ARG B 51 31.976 -1.184 12.827 1.00 1.24 N ATOM 0 H ARG B 51 28.533 -0.915 5.038 1.00 0.42 H new ATOM 0 HA ARG B 51 29.784 0.563 7.304 1.00 0.44 H new ATOM 0 HB2 ARG B 51 28.425 -1.878 7.696 1.00 0.52 H new ATOM 0 HB3 ARG B 51 30.111 -2.337 7.569 1.00 0.52 H new ATOM 0 HG2 ARG B 51 30.677 -0.477 9.220 1.00 0.75 H new ATOM 0 HG3 ARG B 51 28.959 -0.190 9.420 1.00 0.75 H new ATOM 0 HD2 ARG B 51 28.733 -1.980 10.818 1.00 0.89 H new ATOM 0 HD3 ARG B 51 29.560 -3.047 9.700 1.00 0.89 H new ATOM 0 HE ARG B 51 31.632 -2.661 10.867 1.00 0.89 H new ATOM 0 HH11 ARG B 51 29.068 -0.452 11.753 1.00 1.50 H new ATOM 0 HH12 ARG B 51 29.953 0.218 13.127 1.00 1.50 H new ATOM 0 HH21 ARG B 51 32.761 -1.803 12.623 1.00 1.24 H new ATOM 0 HH22 ARG B 51 32.026 -0.540 13.616 1.00 1.24 H new ATOM 2453 N GLN B 52 32.059 -0.260 6.457 1.00 0.44 N ATOM 2454 CA GLN B 52 33.326 -0.490 5.708 1.00 0.48 C ATOM 2455 C GLN B 52 34.056 -1.692 6.292 1.00 0.53 C ATOM 2456 O GLN B 52 34.454 -1.682 7.439 1.00 0.65 O ATOM 2457 CB GLN B 52 34.211 0.749 5.839 1.00 0.61 C ATOM 2458 CG GLN B 52 33.977 1.394 7.207 1.00 1.46 C ATOM 2459 CD GLN B 52 35.068 2.429 7.479 1.00 1.70 C ATOM 2460 OE1 GLN B 52 35.966 2.190 8.262 1.00 2.42 O ATOM 2461 NE2 GLN B 52 35.029 3.577 6.863 1.00 1.80 N ATOM 0 H GLN B 52 32.165 0.223 7.349 1.00 0.44 H new ATOM 0 HA GLN B 52 33.101 -0.680 4.658 1.00 0.48 H new ATOM 0 HB2 GLN B 52 35.260 0.474 5.728 1.00 0.61 H new ATOM 0 HB3 GLN B 52 33.982 1.460 5.045 1.00 0.61 H new ATOM 0 HG2 GLN B 52 32.996 1.869 7.233 1.00 1.46 H new ATOM 0 HG3 GLN B 52 33.983 0.631 7.986 1.00 1.46 H new ATOM 0 HE21 GLN B 52 34.275 3.778 6.206 1.00 1.80 H new ATOM 0 HE22 GLN B 52 35.752 4.275 7.038 1.00 1.80 H new ATOM 2470 N GLU B 53 34.234 -2.725 5.508 1.00 0.57 N ATOM 2471 CA GLU B 53 34.942 -3.927 6.013 1.00 0.74 C ATOM 2472 C GLU B 53 36.121 -4.245 5.099 1.00 0.75 C ATOM 2473 O GLU B 53 35.981 -4.841 4.054 1.00 0.76 O ATOM 2474 CB GLU B 53 33.953 -5.094 6.018 1.00 0.90 C ATOM 2475 CG GLU B 53 34.618 -6.365 6.555 1.00 1.02 C ATOM 2476 CD GLU B 53 35.090 -6.142 7.994 1.00 1.37 C ATOM 2477 OE1 GLU B 53 34.545 -5.268 8.647 1.00 1.95 O ATOM 2478 OE2 GLU B 53 35.988 -6.851 8.417 1.00 2.11 O ATOM 0 H GLU B 53 33.917 -2.782 4.540 1.00 0.57 H new ATOM 0 HA GLU B 53 35.320 -3.754 7.021 1.00 0.74 H new ATOM 0 HB2 GLU B 53 33.089 -4.842 6.633 1.00 0.90 H new ATOM 0 HB3 GLU B 53 33.585 -5.269 5.007 1.00 0.90 H new ATOM 0 HG2 GLU B 53 33.914 -7.196 6.519 1.00 1.02 H new ATOM 0 HG3 GLU B 53 35.464 -6.637 5.924 1.00 1.02 H new ATOM 2485 N GLY B 54 37.283 -3.857 5.524 1.00 0.80 N ATOM 2486 CA GLY B 54 38.518 -4.124 4.739 1.00 0.85 C ATOM 2487 C GLY B 54 38.488 -3.402 3.382 1.00 0.74 C ATOM 2488 O GLY B 54 39.007 -3.908 2.410 1.00 0.88 O ATOM 0 H GLY B 54 37.435 -3.356 6.399 1.00 0.80 H new ATOM 0 HA2 GLY B 54 39.389 -3.798 5.307 1.00 0.85 H new ATOM 0 HA3 GLY B 54 38.625 -5.197 4.580 1.00 0.85 H new ATOM 2492 N LYS B 55 37.855 -2.250 3.310 1.00 0.78 N ATOM 2493 CA LYS B 55 37.742 -1.478 2.018 1.00 0.78 C ATOM 2494 C LYS B 55 36.468 -1.897 1.274 1.00 0.69 C ATOM 2495 O LYS B 55 36.098 -1.307 0.278 1.00 0.70 O ATOM 2496 CB LYS B 55 38.967 -1.708 1.120 1.00 0.91 C ATOM 2497 CG LYS B 55 39.163 -0.498 0.203 1.00 1.13 C ATOM 2498 CD LYS B 55 39.855 -0.943 -1.090 1.00 1.34 C ATOM 2499 CE LYS B 55 40.056 0.267 -2.006 1.00 1.60 C ATOM 2500 NZ LYS B 55 40.628 -0.184 -3.307 1.00 2.11 N ATOM 0 H LYS B 55 37.402 -1.802 4.106 1.00 0.78 H new ATOM 0 HA LYS B 55 37.695 -0.416 2.261 1.00 0.78 H new ATOM 0 HB2 LYS B 55 39.856 -1.862 1.732 1.00 0.91 H new ATOM 0 HB3 LYS B 55 38.830 -2.611 0.524 1.00 0.91 H new ATOM 0 HG2 LYS B 55 38.200 -0.042 -0.026 1.00 1.13 H new ATOM 0 HG3 LYS B 55 39.763 0.260 0.707 1.00 1.13 H new ATOM 0 HD2 LYS B 55 40.817 -1.402 -0.861 1.00 1.34 H new ATOM 0 HD3 LYS B 55 39.253 -1.699 -1.595 1.00 1.34 H new ATOM 0 HE2 LYS B 55 39.105 0.774 -2.171 1.00 1.60 H new ATOM 0 HE3 LYS B 55 40.723 0.988 -1.533 1.00 1.60 H new ATOM 0 HZ1 LYS B 55 40.765 0.638 -3.930 1.00 2.11 H new ATOM 0 HZ2 LYS B 55 41.543 -0.649 -3.141 1.00 2.11 H new ATOM 0 HZ3 LYS B 55 39.975 -0.856 -3.759 1.00 2.11 H new ATOM 2514 N GLN B 56 35.790 -2.898 1.764 1.00 0.70 N ATOM 2515 CA GLN B 56 34.532 -3.349 1.104 1.00 0.70 C ATOM 2516 C GLN B 56 33.357 -2.750 1.865 1.00 0.60 C ATOM 2517 O GLN B 56 33.526 -2.246 2.959 1.00 0.60 O ATOM 2518 CB GLN B 56 34.423 -4.870 1.154 1.00 0.85 C ATOM 2519 CG GLN B 56 35.799 -5.492 0.947 1.00 1.17 C ATOM 2520 CD GLN B 56 35.634 -6.880 0.328 1.00 1.15 C ATOM 2521 OE1 GLN B 56 36.364 -7.250 -0.569 1.00 1.54 O ATOM 2522 NE2 GLN B 56 34.696 -7.670 0.775 1.00 1.66 N ATOM 0 H GLN B 56 36.054 -3.425 2.596 1.00 0.70 H new ATOM 0 HA GLN B 56 34.531 -3.028 0.062 1.00 0.70 H new ATOM 0 HB2 GLN B 56 34.013 -5.183 2.114 1.00 0.85 H new ATOM 0 HB3 GLN B 56 33.736 -5.220 0.384 1.00 0.85 H new ATOM 0 HG2 GLN B 56 36.403 -4.860 0.296 1.00 1.17 H new ATOM 0 HG3 GLN B 56 36.325 -5.565 1.899 1.00 1.17 H new ATOM 0 HE21 GLN B 56 34.083 -7.359 1.529 1.00 1.66 H new ATOM 0 HE22 GLN B 56 34.576 -8.599 0.371 1.00 1.66 H new ATOM 2531 N TYR B 57 32.173 -2.783 1.305 1.00 0.56 N ATOM 2532 CA TYR B 57 31.014 -2.190 2.020 1.00 0.48 C ATOM 2533 C TYR B 57 30.174 -3.299 2.651 1.00 0.47 C ATOM 2534 O TYR B 57 29.878 -4.300 2.031 1.00 0.53 O ATOM 2535 CB TYR B 57 30.158 -1.390 1.053 1.00 0.46 C ATOM 2536 CG TYR B 57 31.041 -0.444 0.261 1.00 0.49 C ATOM 2537 CD1 TYR B 57 31.898 -0.934 -0.732 1.00 1.27 C ATOM 2538 CD2 TYR B 57 31.008 0.931 0.533 1.00 1.18 C ATOM 2539 CE1 TYR B 57 32.717 -0.052 -1.449 1.00 1.30 C ATOM 2540 CE2 TYR B 57 31.827 1.810 -0.186 1.00 1.18 C ATOM 2541 CZ TYR B 57 32.681 1.318 -1.177 1.00 0.57 C ATOM 2542 OH TYR B 57 33.488 2.185 -1.885 1.00 0.63 O ATOM 0 H TYR B 57 31.965 -3.191 0.394 1.00 0.56 H new ATOM 0 HA TYR B 57 31.383 -1.526 2.802 1.00 0.48 H new ATOM 0 HB2 TYR B 57 29.629 -2.062 0.378 1.00 0.46 H new ATOM 0 HB3 TYR B 57 29.402 -0.827 1.600 1.00 0.46 H new ATOM 0 HD1 TYR B 57 31.928 -1.992 -0.945 1.00 1.27 H new ATOM 0 HD2 TYR B 57 30.349 1.313 1.299 1.00 1.18 H new ATOM 0 HE1 TYR B 57 33.378 -0.432 -2.214 1.00 1.30 H new ATOM 0 HE2 TYR B 57 31.799 2.869 0.025 1.00 1.18 H new ATOM 0 HH TYR B 57 33.338 3.101 -1.571 1.00 0.63 H new ATOM 2552 N MET B 58 29.817 -3.121 3.895 1.00 0.44 N ATOM 2553 CA MET B 58 29.024 -4.141 4.632 1.00 0.45 C ATOM 2554 C MET B 58 27.711 -3.549 5.113 1.00 0.42 C ATOM 2555 O MET B 58 27.443 -2.372 4.975 1.00 0.40 O ATOM 2556 CB MET B 58 29.782 -4.659 5.848 1.00 0.50 C ATOM 2557 CG MET B 58 29.789 -6.188 5.841 1.00 1.04 C ATOM 2558 SD MET B 58 30.661 -6.794 7.306 1.00 1.10 S ATOM 2559 CE MET B 58 29.660 -8.280 7.565 1.00 1.52 C ATOM 0 H MET B 58 30.049 -2.291 4.441 1.00 0.44 H new ATOM 0 HA MET B 58 28.839 -4.963 3.940 1.00 0.45 H new ATOM 0 HB2 MET B 58 30.804 -4.281 5.839 1.00 0.50 H new ATOM 0 HB3 MET B 58 29.315 -4.292 6.762 1.00 0.50 H new ATOM 0 HG2 MET B 58 28.767 -6.567 5.830 1.00 1.04 H new ATOM 0 HG3 MET B 58 30.275 -6.556 4.937 1.00 1.04 H new ATOM 0 HE1 MET B 58 30.029 -8.820 8.437 1.00 1.52 H new ATOM 0 HE2 MET B 58 28.621 -7.995 7.728 1.00 1.52 H new ATOM 0 HE3 MET B 58 29.727 -8.921 6.686 1.00 1.52 H new ATOM 2569 N LEU B 59 26.909 -4.381 5.698 1.00 0.44 N ATOM 2570 CA LEU B 59 25.599 -3.920 6.236 1.00 0.43 C ATOM 2571 C LEU B 59 25.726 -3.733 7.751 1.00 0.41 C ATOM 2572 O LEU B 59 26.270 -4.571 8.443 1.00 0.47 O ATOM 2573 CB LEU B 59 24.493 -4.950 5.923 1.00 0.51 C ATOM 2574 CG LEU B 59 24.618 -6.220 6.788 1.00 0.77 C ATOM 2575 CD1 LEU B 59 23.492 -7.187 6.419 1.00 1.05 C ATOM 2576 CD2 LEU B 59 25.964 -6.906 6.536 1.00 1.25 C ATOM 0 H LEU B 59 27.103 -5.374 5.831 1.00 0.44 H new ATOM 0 HA LEU B 59 25.327 -2.975 5.766 1.00 0.43 H new ATOM 0 HB2 LEU B 59 23.517 -4.494 6.089 1.00 0.51 H new ATOM 0 HB3 LEU B 59 24.542 -5.224 4.869 1.00 0.51 H new ATOM 0 HG LEU B 59 24.551 -5.941 7.840 1.00 0.77 H new ATOM 0 HD11 LEU B 59 23.573 -8.088 7.026 1.00 1.05 H new ATOM 0 HD12 LEU B 59 22.529 -6.711 6.603 1.00 1.05 H new ATOM 0 HD13 LEU B 59 23.571 -7.452 5.365 1.00 1.05 H new ATOM 0 HD21 LEU B 59 26.038 -7.801 7.154 1.00 1.25 H new ATOM 0 HD22 LEU B 59 26.040 -7.184 5.485 1.00 1.25 H new ATOM 0 HD23 LEU B 59 26.774 -6.222 6.790 1.00 1.25 H new ATOM 2588 N THR B 60 25.240 -2.637 8.272 1.00 0.38 N ATOM 2589 CA THR B 60 25.345 -2.411 9.744 1.00 0.41 C ATOM 2590 C THR B 60 24.011 -2.786 10.385 1.00 0.44 C ATOM 2591 O THR B 60 23.018 -2.938 9.702 1.00 0.43 O ATOM 2592 CB THR B 60 25.651 -0.938 10.032 1.00 0.40 C ATOM 2593 OG1 THR B 60 24.929 -0.524 11.185 1.00 1.04 O ATOM 2594 CG2 THR B 60 25.232 -0.085 8.842 1.00 1.01 C ATOM 0 H THR B 60 24.779 -1.894 7.747 1.00 0.38 H new ATOM 0 HA THR B 60 26.150 -3.022 10.153 1.00 0.41 H new ATOM 0 HB THR B 60 26.721 -0.818 10.205 1.00 0.40 H new ATOM 0 HG1 THR B 60 25.124 0.418 11.373 1.00 1.04 H new ATOM 0 HG21 THR B 60 25.451 0.962 9.050 1.00 1.01 H new ATOM 0 HG22 THR B 60 25.782 -0.402 7.956 1.00 1.01 H new ATOM 0 HG23 THR B 60 24.163 -0.204 8.667 1.00 1.01 H new ATOM 2602 N LYS B 61 23.987 -2.950 11.686 1.00 0.51 N ATOM 2603 CA LYS B 61 22.717 -3.330 12.384 1.00 0.54 C ATOM 2604 C LYS B 61 21.530 -2.611 11.730 1.00 0.51 C ATOM 2605 O LYS B 61 20.502 -3.198 11.455 1.00 0.50 O ATOM 2606 CB LYS B 61 22.808 -2.940 13.864 1.00 0.61 C ATOM 2607 CG LYS B 61 23.098 -1.442 14.003 1.00 1.28 C ATOM 2608 CD LYS B 61 23.999 -1.207 15.216 1.00 1.04 C ATOM 2609 CE LYS B 61 23.864 0.245 15.677 1.00 1.73 C ATOM 2610 NZ LYS B 61 25.144 0.691 16.296 1.00 2.19 N ATOM 0 H LYS B 61 24.796 -2.837 12.297 1.00 0.51 H new ATOM 0 HA LYS B 61 22.570 -4.407 12.303 1.00 0.54 H new ATOM 0 HB2 LYS B 61 21.874 -3.185 14.370 1.00 0.61 H new ATOM 0 HB3 LYS B 61 23.595 -3.516 14.351 1.00 0.61 H new ATOM 0 HG2 LYS B 61 23.581 -1.069 13.100 1.00 1.28 H new ATOM 0 HG3 LYS B 61 22.165 -0.889 14.117 1.00 1.28 H new ATOM 0 HD2 LYS B 61 23.722 -1.884 16.024 1.00 1.04 H new ATOM 0 HD3 LYS B 61 25.036 -1.424 14.960 1.00 1.04 H new ATOM 0 HE2 LYS B 61 23.615 0.885 14.830 1.00 1.73 H new ATOM 0 HE3 LYS B 61 23.049 0.335 16.396 1.00 1.73 H new ATOM 0 HZ1 LYS B 61 25.052 1.678 16.610 1.00 2.19 H new ATOM 0 HZ2 LYS B 61 25.363 0.087 17.114 1.00 2.19 H new ATOM 0 HZ3 LYS B 61 25.911 0.619 15.597 1.00 2.19 H new ATOM 2624 N LYS B 62 21.677 -1.345 11.477 1.00 0.51 N ATOM 2625 CA LYS B 62 20.581 -0.569 10.830 1.00 0.49 C ATOM 2626 C LYS B 62 20.285 -1.144 9.439 1.00 0.45 C ATOM 2627 O LYS B 62 19.156 -1.433 9.098 1.00 0.53 O ATOM 2628 CB LYS B 62 21.011 0.892 10.690 1.00 0.54 C ATOM 2629 CG LYS B 62 21.058 1.550 12.071 1.00 0.75 C ATOM 2630 CD LYS B 62 19.692 2.156 12.401 1.00 1.16 C ATOM 2631 CE LYS B 62 19.745 2.811 13.782 1.00 1.17 C ATOM 2632 NZ LYS B 62 20.491 4.098 13.693 1.00 2.08 N ATOM 0 H LYS B 62 22.516 -0.807 11.692 1.00 0.51 H new ATOM 0 HA LYS B 62 19.683 -0.634 11.445 1.00 0.49 H new ATOM 0 HB2 LYS B 62 21.991 0.949 10.216 1.00 0.54 H new ATOM 0 HB3 LYS B 62 20.313 1.426 10.045 1.00 0.54 H new ATOM 0 HG2 LYS B 62 21.332 0.813 12.826 1.00 0.75 H new ATOM 0 HG3 LYS B 62 21.824 2.325 12.089 1.00 0.75 H new ATOM 0 HD2 LYS B 62 19.418 2.894 11.647 1.00 1.16 H new ATOM 0 HD3 LYS B 62 18.925 1.382 12.383 1.00 1.16 H new ATOM 0 HE2 LYS B 62 18.735 2.989 14.151 1.00 1.17 H new ATOM 0 HE3 LYS B 62 20.232 2.145 14.494 1.00 1.17 H new ATOM 0 HZ1 LYS B 62 20.384 4.624 14.584 1.00 2.08 H new ATOM 0 HZ2 LYS B 62 21.499 3.904 13.524 1.00 2.08 H new ATOM 0 HZ3 LYS B 62 20.112 4.666 12.909 1.00 2.08 H new ATOM 2646 N GLY B 63 21.298 -1.278 8.626 1.00 0.41 N ATOM 2647 CA GLY B 63 21.100 -1.796 7.239 1.00 0.39 C ATOM 2648 C GLY B 63 20.331 -3.119 7.244 1.00 0.38 C ATOM 2649 O GLY B 63 19.444 -3.328 6.440 1.00 0.39 O ATOM 0 H GLY B 63 22.263 -1.049 8.864 1.00 0.41 H new ATOM 0 HA2 GLY B 63 20.556 -1.059 6.648 1.00 0.39 H new ATOM 0 HA3 GLY B 63 22.069 -1.938 6.760 1.00 0.39 H new ATOM 2653 N GLU B 64 20.641 -4.009 8.142 1.00 0.40 N ATOM 2654 CA GLU B 64 19.896 -5.303 8.180 1.00 0.43 C ATOM 2655 C GLU B 64 18.438 -5.030 8.555 1.00 0.43 C ATOM 2656 O GLU B 64 17.516 -5.593 7.992 1.00 0.42 O ATOM 2657 CB GLU B 64 20.521 -6.251 9.203 1.00 0.52 C ATOM 2658 CG GLU B 64 21.857 -5.683 9.662 1.00 0.63 C ATOM 2659 CD GLU B 64 22.583 -6.712 10.531 1.00 0.88 C ATOM 2660 OE1 GLU B 64 22.039 -7.076 11.562 1.00 1.51 O ATOM 2661 OE2 GLU B 64 23.669 -7.117 10.153 1.00 1.45 O ATOM 0 H GLU B 64 21.371 -3.902 8.847 1.00 0.40 H new ATOM 0 HA GLU B 64 19.946 -5.772 7.197 1.00 0.43 H new ATOM 0 HB2 GLU B 64 19.854 -6.376 10.056 1.00 0.52 H new ATOM 0 HB3 GLU B 64 20.664 -7.238 8.762 1.00 0.52 H new ATOM 0 HG2 GLU B 64 22.470 -5.425 8.798 1.00 0.63 H new ATOM 0 HG3 GLU B 64 21.698 -4.764 10.226 1.00 0.63 H new ATOM 2668 N GLU B 65 18.232 -4.167 9.510 1.00 0.46 N ATOM 2669 CA GLU B 65 16.846 -3.843 9.946 1.00 0.49 C ATOM 2670 C GLU B 65 16.044 -3.323 8.752 1.00 0.45 C ATOM 2671 O GLU B 65 14.854 -3.542 8.651 1.00 0.48 O ATOM 2672 CB GLU B 65 16.891 -2.769 11.036 1.00 0.54 C ATOM 2673 CG GLU B 65 17.106 -3.430 12.398 1.00 0.62 C ATOM 2674 CD GLU B 65 17.250 -2.350 13.472 1.00 1.07 C ATOM 2675 OE1 GLU B 65 18.077 -1.472 13.294 1.00 1.68 O ATOM 2676 OE2 GLU B 65 16.529 -2.419 14.454 1.00 1.66 O ATOM 0 H GLU B 65 18.969 -3.669 10.010 1.00 0.46 H new ATOM 0 HA GLU B 65 16.371 -4.741 10.340 1.00 0.49 H new ATOM 0 HB2 GLU B 65 17.696 -2.063 10.832 1.00 0.54 H new ATOM 0 HB3 GLU B 65 15.961 -2.200 11.039 1.00 0.54 H new ATOM 0 HG2 GLU B 65 16.266 -4.083 12.634 1.00 0.62 H new ATOM 0 HG3 GLU B 65 17.998 -4.055 12.374 1.00 0.62 H new ATOM 2683 N LEU B 66 16.686 -2.641 7.844 1.00 0.44 N ATOM 2684 CA LEU B 66 15.953 -2.114 6.658 1.00 0.45 C ATOM 2685 C LEU B 66 15.705 -3.257 5.669 1.00 0.43 C ATOM 2686 O LEU B 66 14.659 -3.343 5.058 1.00 0.45 O ATOM 2687 CB LEU B 66 16.785 -1.010 5.993 1.00 0.46 C ATOM 2688 CG LEU B 66 16.149 -0.586 4.663 1.00 0.64 C ATOM 2689 CD1 LEU B 66 14.685 -0.199 4.884 1.00 0.72 C ATOM 2690 CD2 LEU B 66 16.905 0.619 4.108 1.00 1.57 C ATOM 0 H LEU B 66 17.683 -2.426 7.871 1.00 0.44 H new ATOM 0 HA LEU B 66 14.995 -1.697 6.969 1.00 0.45 H new ATOM 0 HB2 LEU B 66 16.858 -0.150 6.659 1.00 0.46 H new ATOM 0 HB3 LEU B 66 17.801 -1.366 5.820 1.00 0.46 H new ATOM 0 HG LEU B 66 16.200 -1.417 3.960 1.00 0.64 H new ATOM 0 HD11 LEU B 66 14.241 0.101 3.935 1.00 0.72 H new ATOM 0 HD12 LEU B 66 14.140 -1.053 5.286 1.00 0.72 H new ATOM 0 HD13 LEU B 66 14.630 0.631 5.588 1.00 0.72 H new ATOM 0 HD21 LEU B 66 16.458 0.925 3.162 1.00 1.57 H new ATOM 0 HD22 LEU B 66 16.849 1.443 4.820 1.00 1.57 H new ATOM 0 HD23 LEU B 66 17.949 0.350 3.945 1.00 1.57 H new ATOM 2702 N LEU B 67 16.647 -4.148 5.519 1.00 0.42 N ATOM 2703 CA LEU B 67 16.440 -5.291 4.585 1.00 0.43 C ATOM 2704 C LEU B 67 15.145 -6.001 4.976 1.00 0.45 C ATOM 2705 O LEU B 67 14.369 -6.419 4.140 1.00 0.48 O ATOM 2706 CB LEU B 67 17.616 -6.272 4.691 1.00 0.45 C ATOM 2707 CG LEU B 67 18.385 -6.338 3.362 1.00 0.51 C ATOM 2708 CD1 LEU B 67 17.462 -6.819 2.240 1.00 0.90 C ATOM 2709 CD2 LEU B 67 18.937 -4.953 3.010 1.00 1.26 C ATOM 0 H LEU B 67 17.546 -4.134 6.000 1.00 0.42 H new ATOM 0 HA LEU B 67 16.378 -4.928 3.559 1.00 0.43 H new ATOM 0 HB2 LEU B 67 18.287 -5.959 5.491 1.00 0.45 H new ATOM 0 HB3 LEU B 67 17.247 -7.263 4.954 1.00 0.45 H new ATOM 0 HG LEU B 67 19.211 -7.041 3.471 1.00 0.51 H new ATOM 0 HD11 LEU B 67 18.019 -6.861 1.304 1.00 0.90 H new ATOM 0 HD12 LEU B 67 17.082 -7.812 2.482 1.00 0.90 H new ATOM 0 HD13 LEU B 67 16.627 -6.127 2.134 1.00 0.90 H new ATOM 0 HD21 LEU B 67 19.481 -5.007 2.067 1.00 1.26 H new ATOM 0 HD22 LEU B 67 18.113 -4.247 2.913 1.00 1.26 H new ATOM 0 HD23 LEU B 67 19.611 -4.619 3.799 1.00 1.26 H new ATOM 2721 N GLU B 68 14.905 -6.135 6.251 1.00 0.44 N ATOM 2722 CA GLU B 68 13.658 -6.807 6.706 1.00 0.48 C ATOM 2723 C GLU B 68 12.479 -5.856 6.494 1.00 0.46 C ATOM 2724 O GLU B 68 11.457 -6.227 5.954 1.00 0.47 O ATOM 2725 CB GLU B 68 13.777 -7.154 8.192 1.00 0.52 C ATOM 2726 CG GLU B 68 12.995 -8.437 8.482 1.00 1.26 C ATOM 2727 CD GLU B 68 13.016 -8.720 9.984 1.00 1.77 C ATOM 2728 OE1 GLU B 68 12.219 -8.124 10.691 1.00 2.25 O ATOM 2729 OE2 GLU B 68 13.828 -9.528 10.404 1.00 2.23 O ATOM 0 H GLU B 68 15.519 -5.808 6.997 1.00 0.44 H new ATOM 0 HA GLU B 68 13.501 -7.723 6.136 1.00 0.48 H new ATOM 0 HB2 GLU B 68 14.825 -7.285 8.463 1.00 0.52 H new ATOM 0 HB3 GLU B 68 13.391 -6.335 8.799 1.00 0.52 H new ATOM 0 HG2 GLU B 68 11.967 -8.335 8.135 1.00 1.26 H new ATOM 0 HG3 GLU B 68 13.433 -9.273 7.938 1.00 1.26 H new ATOM 2736 N ASP B 69 12.613 -4.629 6.921 1.00 0.44 N ATOM 2737 CA ASP B 69 11.500 -3.653 6.747 1.00 0.45 C ATOM 2738 C ASP B 69 11.120 -3.549 5.268 1.00 0.45 C ATOM 2739 O ASP B 69 9.984 -3.766 4.897 1.00 0.46 O ATOM 2740 CB ASP B 69 11.940 -2.278 7.253 1.00 0.46 C ATOM 2741 CG ASP B 69 12.497 -2.407 8.671 1.00 0.51 C ATOM 2742 OD1 ASP B 69 12.393 -3.485 9.231 1.00 1.25 O ATOM 2743 OD2 ASP B 69 13.018 -1.424 9.174 1.00 1.12 O ATOM 0 H ASP B 69 13.445 -4.261 7.382 1.00 0.44 H new ATOM 0 HA ASP B 69 10.636 -3.996 7.317 1.00 0.45 H new ATOM 0 HB2 ASP B 69 12.698 -1.861 6.590 1.00 0.46 H new ATOM 0 HB3 ASP B 69 11.095 -1.589 7.245 1.00 0.46 H new ATOM 2748 N ILE B 70 12.054 -3.212 4.416 1.00 0.45 N ATOM 2749 CA ILE B 70 11.717 -3.094 2.967 1.00 0.49 C ATOM 2750 C ILE B 70 11.162 -4.427 2.460 1.00 0.48 C ATOM 2751 O ILE B 70 10.259 -4.464 1.650 1.00 0.50 O ATOM 2752 CB ILE B 70 12.962 -2.700 2.165 1.00 0.56 C ATOM 2753 CG1 ILE B 70 12.593 -2.564 0.686 1.00 0.90 C ATOM 2754 CG2 ILE B 70 14.041 -3.769 2.322 1.00 0.85 C ATOM 2755 CD1 ILE B 70 13.033 -1.191 0.174 1.00 1.29 C ATOM 0 H ILE B 70 13.025 -3.015 4.658 1.00 0.45 H new ATOM 0 HA ILE B 70 10.962 -2.319 2.837 1.00 0.49 H new ATOM 0 HB ILE B 70 13.342 -1.749 2.538 1.00 0.56 H new ATOM 0 HG12 ILE B 70 13.075 -3.351 0.106 1.00 0.90 H new ATOM 0 HG13 ILE B 70 11.518 -2.685 0.556 1.00 0.90 H new ATOM 0 HG21 ILE B 70 14.923 -3.483 1.749 1.00 0.85 H new ATOM 0 HG22 ILE B 70 14.307 -3.865 3.375 1.00 0.85 H new ATOM 0 HG23 ILE B 70 13.664 -4.723 1.954 1.00 0.85 H new ATOM 0 HD11 ILE B 70 12.770 -1.094 -0.879 1.00 1.29 H new ATOM 0 HD12 ILE B 70 12.531 -0.411 0.746 1.00 1.29 H new ATOM 0 HD13 ILE B 70 14.112 -1.088 0.290 1.00 1.29 H new ATOM 2767 N ARG B 71 11.682 -5.524 2.934 1.00 0.47 N ATOM 2768 CA ARG B 71 11.161 -6.840 2.477 1.00 0.50 C ATOM 2769 C ARG B 71 9.656 -6.913 2.755 1.00 0.50 C ATOM 2770 O ARG B 71 8.871 -7.232 1.886 1.00 0.54 O ATOM 2771 CB ARG B 71 11.875 -7.969 3.224 1.00 0.52 C ATOM 2772 CG ARG B 71 11.323 -9.319 2.760 1.00 0.82 C ATOM 2773 CD ARG B 71 12.328 -10.423 3.091 1.00 1.02 C ATOM 2774 NE ARG B 71 11.601 -11.698 3.353 1.00 1.57 N ATOM 2775 CZ ARG B 71 10.996 -12.318 2.377 1.00 2.17 C ATOM 2776 NH1 ARG B 71 11.024 -11.820 1.170 1.00 2.58 N ATOM 2777 NH2 ARG B 71 10.363 -13.436 2.606 1.00 2.98 N ATOM 0 H ARG B 71 12.441 -5.566 3.614 1.00 0.47 H new ATOM 0 HA ARG B 71 11.342 -6.949 1.408 1.00 0.50 H new ATOM 0 HB2 ARG B 71 12.948 -7.920 3.039 1.00 0.52 H new ATOM 0 HB3 ARG B 71 11.732 -7.856 4.299 1.00 0.52 H new ATOM 0 HG2 ARG B 71 10.370 -9.522 3.249 1.00 0.82 H new ATOM 0 HG3 ARG B 71 11.132 -9.296 1.687 1.00 0.82 H new ATOM 0 HD2 ARG B 71 13.026 -10.554 2.264 1.00 1.02 H new ATOM 0 HD3 ARG B 71 12.917 -10.143 3.964 1.00 1.02 H new ATOM 0 HE ARG B 71 11.576 -12.086 4.296 1.00 1.57 H new ATOM 0 HH11 ARG B 71 11.519 -10.946 0.990 1.00 2.58 H new ATOM 0 HH12 ARG B 71 10.551 -12.305 0.407 1.00 2.58 H new ATOM 0 HH21 ARG B 71 10.341 -13.826 3.548 1.00 2.98 H new ATOM 0 HH22 ARG B 71 9.890 -13.920 1.843 1.00 2.98 H new ATOM 2791 N LYS B 72 9.254 -6.630 3.967 1.00 0.48 N ATOM 2792 CA LYS B 72 7.804 -6.697 4.317 1.00 0.49 C ATOM 2793 C LYS B 72 7.015 -5.605 3.582 1.00 0.48 C ATOM 2794 O LYS B 72 6.059 -5.890 2.889 1.00 0.51 O ATOM 2795 CB LYS B 72 7.644 -6.522 5.829 1.00 0.49 C ATOM 2796 CG LYS B 72 7.797 -7.885 6.510 1.00 0.65 C ATOM 2797 CD LYS B 72 8.211 -7.701 7.971 1.00 0.91 C ATOM 2798 CE LYS B 72 7.312 -6.660 8.641 1.00 1.46 C ATOM 2799 NZ LYS B 72 7.320 -6.875 10.115 1.00 1.81 N ATOM 0 H LYS B 72 9.870 -6.354 4.732 1.00 0.48 H new ATOM 0 HA LYS B 72 7.411 -7.667 4.011 1.00 0.49 H new ATOM 0 HB2 LYS B 72 8.392 -5.826 6.208 1.00 0.49 H new ATOM 0 HB3 LYS B 72 6.667 -6.095 6.057 1.00 0.49 H new ATOM 0 HG2 LYS B 72 6.857 -8.434 6.457 1.00 0.65 H new ATOM 0 HG3 LYS B 72 8.544 -8.480 5.985 1.00 0.65 H new ATOM 0 HD2 LYS B 72 8.139 -8.651 8.501 1.00 0.91 H new ATOM 0 HD3 LYS B 72 9.252 -7.384 8.026 1.00 0.91 H new ATOM 0 HE2 LYS B 72 7.664 -5.655 8.407 1.00 1.46 H new ATOM 0 HE3 LYS B 72 6.295 -6.740 8.256 1.00 1.46 H new ATOM 0 HZ1 LYS B 72 6.709 -6.168 10.572 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 6.965 -7.829 10.329 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 8.291 -6.778 10.475 1.00 1.81 H new ATOM 2813 N PHE B 73 7.401 -4.362 3.730 1.00 0.47 N ATOM 2814 CA PHE B 73 6.664 -3.256 3.039 1.00 0.48 C ATOM 2815 C PHE B 73 6.370 -3.669 1.594 1.00 0.51 C ATOM 2816 O PHE B 73 5.250 -3.595 1.129 1.00 0.52 O ATOM 2817 CB PHE B 73 7.527 -1.992 3.064 1.00 0.48 C ATOM 2818 CG PHE B 73 7.541 -1.341 1.698 1.00 0.52 C ATOM 2819 CD1 PHE B 73 8.494 -1.719 0.744 1.00 1.37 C ATOM 2820 CD2 PHE B 73 6.600 -0.354 1.389 1.00 1.25 C ATOM 2821 CE1 PHE B 73 8.504 -1.111 -0.517 1.00 1.40 C ATOM 2822 CE2 PHE B 73 6.609 0.256 0.129 1.00 1.29 C ATOM 2823 CZ PHE B 73 7.561 -0.123 -0.825 1.00 0.67 C ATOM 0 H PHE B 73 8.194 -4.064 4.299 1.00 0.47 H new ATOM 0 HA PHE B 73 5.721 -3.057 3.548 1.00 0.48 H new ATOM 0 HB2 PHE B 73 7.139 -1.292 3.804 1.00 0.48 H new ATOM 0 HB3 PHE B 73 8.544 -2.243 3.366 1.00 0.48 H new ATOM 0 HD1 PHE B 73 9.222 -2.480 0.981 1.00 1.37 H new ATOM 0 HD2 PHE B 73 5.865 -0.062 2.124 1.00 1.25 H new ATOM 0 HE1 PHE B 73 9.239 -1.404 -1.252 1.00 1.40 H new ATOM 0 HE2 PHE B 73 5.882 1.019 -0.107 1.00 1.29 H new ATOM 0 HZ PHE B 73 7.568 0.346 -1.798 1.00 0.67 H new ATOM 2833 N ASN B 74 7.367 -4.121 0.894 1.00 0.52 N ATOM 2834 CA ASN B 74 7.149 -4.563 -0.511 1.00 0.55 C ATOM 2835 C ASN B 74 6.218 -5.770 -0.499 1.00 0.57 C ATOM 2836 O ASN B 74 5.447 -5.988 -1.412 1.00 0.60 O ATOM 2837 CB ASN B 74 8.488 -4.952 -1.144 1.00 0.57 C ATOM 2838 CG ASN B 74 8.487 -4.572 -2.626 1.00 0.79 C ATOM 2839 OD1 ASN B 74 8.756 -3.439 -2.974 1.00 1.73 O ATOM 2840 ND2 ASN B 74 8.193 -5.477 -3.519 1.00 0.99 N ATOM 0 H ASN B 74 8.326 -4.205 1.232 1.00 0.52 H new ATOM 0 HA ASN B 74 6.706 -3.754 -1.092 1.00 0.55 H new ATOM 0 HB2 ASN B 74 9.305 -4.446 -0.629 1.00 0.57 H new ATOM 0 HB3 ASN B 74 8.656 -6.023 -1.033 1.00 0.57 H new ATOM 0 HD21 ASN B 74 8.189 -5.234 -4.510 1.00 0.99 H new ATOM 0 HD22 ASN B 74 7.967 -6.428 -3.226 1.00 0.99 H new ATOM 2847 N GLU B 75 6.294 -6.563 0.532 1.00 0.55 N ATOM 2848 CA GLU B 75 5.431 -7.762 0.617 1.00 0.59 C ATOM 2849 C GLU B 75 4.002 -7.353 0.976 1.00 0.57 C ATOM 2850 O GLU B 75 3.057 -8.034 0.629 1.00 0.68 O ATOM 2851 CB GLU B 75 5.985 -8.694 1.692 1.00 0.62 C ATOM 2852 CG GLU B 75 5.498 -10.121 1.443 1.00 1.10 C ATOM 2853 CD GLU B 75 6.109 -11.056 2.487 1.00 1.46 C ATOM 2854 OE1 GLU B 75 6.526 -10.563 3.523 1.00 1.88 O ATOM 2855 OE2 GLU B 75 6.153 -12.248 2.234 1.00 2.12 O ATOM 0 H GLU B 75 6.923 -6.427 1.323 1.00 0.55 H new ATOM 0 HA GLU B 75 5.418 -8.273 -0.346 1.00 0.59 H new ATOM 0 HB2 GLU B 75 7.075 -8.666 1.684 1.00 0.62 H new ATOM 0 HB3 GLU B 75 5.664 -8.358 2.678 1.00 0.62 H new ATOM 0 HG2 GLU B 75 4.410 -10.160 1.496 1.00 1.10 H new ATOM 0 HG3 GLU B 75 5.780 -10.443 0.441 1.00 1.10 H new ATOM 2862 N MET B 76 3.819 -6.242 1.647 1.00 0.53 N ATOM 2863 CA MET B 76 2.446 -5.799 1.994 1.00 0.51 C ATOM 2864 C MET B 76 2.009 -4.795 0.939 1.00 0.52 C ATOM 2865 O MET B 76 0.854 -4.719 0.570 1.00 0.53 O ATOM 2866 CB MET B 76 2.461 -5.122 3.367 1.00 0.48 C ATOM 2867 CG MET B 76 2.611 -6.181 4.461 1.00 0.48 C ATOM 2868 SD MET B 76 1.042 -6.363 5.346 1.00 0.51 S ATOM 2869 CE MET B 76 1.601 -7.591 6.551 1.00 0.60 C ATOM 0 H MET B 76 4.567 -5.626 1.967 1.00 0.53 H new ATOM 0 HA MET B 76 1.762 -6.647 2.027 1.00 0.51 H new ATOM 0 HB2 MET B 76 3.283 -4.408 3.423 1.00 0.48 H new ATOM 0 HB3 MET B 76 1.540 -4.559 3.516 1.00 0.48 H new ATOM 0 HG2 MET B 76 2.905 -7.134 4.021 1.00 0.48 H new ATOM 0 HG3 MET B 76 3.401 -5.893 5.155 1.00 0.48 H new ATOM 0 HE1 MET B 76 0.786 -7.827 7.235 1.00 0.60 H new ATOM 0 HE2 MET B 76 1.912 -8.497 6.030 1.00 0.60 H new ATOM 0 HE3 MET B 76 2.443 -7.190 7.115 1.00 0.60 H new ATOM 2879 N ARG B 77 2.940 -4.019 0.452 1.00 0.52 N ATOM 2880 CA ARG B 77 2.605 -3.011 -0.582 1.00 0.54 C ATOM 2881 C ARG B 77 2.015 -3.700 -1.814 1.00 0.57 C ATOM 2882 O ARG B 77 0.991 -3.302 -2.331 1.00 0.57 O ATOM 2883 CB ARG B 77 3.867 -2.246 -0.984 1.00 0.54 C ATOM 2884 CG ARG B 77 3.500 -1.139 -1.976 1.00 0.57 C ATOM 2885 CD ARG B 77 4.160 -1.423 -3.326 1.00 0.62 C ATOM 2886 NE ARG B 77 3.671 -0.443 -4.336 1.00 0.86 N ATOM 2887 CZ ARG B 77 3.914 -0.636 -5.603 1.00 1.32 C ATOM 2888 NH1 ARG B 77 4.587 -1.686 -5.985 1.00 1.81 N ATOM 2889 NH2 ARG B 77 3.484 0.221 -6.488 1.00 1.80 N ATOM 0 H ARG B 77 3.921 -4.044 0.730 1.00 0.52 H new ATOM 0 HA ARG B 77 1.871 -2.316 -0.173 1.00 0.54 H new ATOM 0 HB2 ARG B 77 4.341 -1.816 -0.102 1.00 0.54 H new ATOM 0 HB3 ARG B 77 4.590 -2.927 -1.434 1.00 0.54 H new ATOM 0 HG2 ARG B 77 2.418 -1.085 -2.093 1.00 0.57 H new ATOM 0 HG3 ARG B 77 3.828 -0.172 -1.595 1.00 0.57 H new ATOM 0 HD2 ARG B 77 5.244 -1.356 -3.234 1.00 0.62 H new ATOM 0 HD3 ARG B 77 3.930 -2.439 -3.648 1.00 0.62 H new ATOM 0 HE ARG B 77 3.146 0.379 -4.037 1.00 0.86 H new ATOM 0 HH11 ARG B 77 4.923 -2.356 -5.293 1.00 1.81 H new ATOM 0 HH12 ARG B 77 4.777 -1.837 -6.976 1.00 1.81 H new ATOM 0 HH21 ARG B 77 2.958 1.042 -6.189 1.00 1.80 H new ATOM 0 HH22 ARG B 77 3.674 0.070 -7.479 1.00 1.80 H new ATOM 2903 N LYS B 78 2.646 -4.747 -2.276 1.00 0.58 N ATOM 2904 CA LYS B 78 2.118 -5.475 -3.456 1.00 0.61 C ATOM 2905 C LYS B 78 0.815 -6.149 -3.056 1.00 0.60 C ATOM 2906 O LYS B 78 -0.097 -6.282 -3.844 1.00 0.62 O ATOM 2907 CB LYS B 78 3.126 -6.535 -3.906 1.00 0.63 C ATOM 2908 CG LYS B 78 2.390 -7.648 -4.661 1.00 1.17 C ATOM 2909 CD LYS B 78 3.369 -8.436 -5.538 1.00 1.22 C ATOM 2910 CE LYS B 78 3.902 -7.553 -6.673 1.00 1.57 C ATOM 2911 NZ LYS B 78 3.833 -8.303 -7.958 1.00 2.26 N ATOM 0 H LYS B 78 3.507 -5.127 -1.882 1.00 0.58 H new ATOM 0 HA LYS B 78 1.948 -4.780 -4.279 1.00 0.61 H new ATOM 0 HB2 LYS B 78 3.883 -6.084 -4.548 1.00 0.63 H new ATOM 0 HB3 LYS B 78 3.646 -6.949 -3.042 1.00 0.63 H new ATOM 0 HG2 LYS B 78 1.906 -8.319 -3.951 1.00 1.17 H new ATOM 0 HG3 LYS B 78 1.603 -7.217 -5.280 1.00 1.17 H new ATOM 0 HD2 LYS B 78 4.199 -8.799 -4.932 1.00 1.22 H new ATOM 0 HD3 LYS B 78 2.871 -9.312 -5.954 1.00 1.22 H new ATOM 0 HE2 LYS B 78 3.315 -6.637 -6.742 1.00 1.57 H new ATOM 0 HE3 LYS B 78 4.931 -7.258 -6.466 1.00 1.57 H new ATOM 0 HZ1 LYS B 78 4.194 -7.705 -8.729 1.00 2.26 H new ATOM 0 HZ2 LYS B 78 4.411 -9.165 -7.888 1.00 2.26 H new ATOM 0 HZ3 LYS B 78 2.846 -8.563 -8.155 1.00 2.26 H new ATOM 2925 N ASN B 79 0.715 -6.554 -1.822 1.00 0.58 N ATOM 2926 CA ASN B 79 -0.544 -7.195 -1.363 1.00 0.58 C ATOM 2927 C ASN B 79 -1.657 -6.158 -1.445 1.00 0.57 C ATOM 2928 O ASN B 79 -2.712 -6.400 -1.994 1.00 0.57 O ATOM 2929 CB ASN B 79 -0.388 -7.682 0.076 1.00 0.57 C ATOM 2930 CG ASN B 79 -1.065 -9.045 0.230 1.00 0.62 C ATOM 2931 OD1 ASN B 79 -1.981 -9.197 1.012 1.00 1.18 O ATOM 2932 ND2 ASN B 79 -0.651 -10.050 -0.492 1.00 1.16 N ATOM 0 H ASN B 79 1.446 -6.469 -1.116 1.00 0.58 H new ATOM 0 HA ASN B 79 -0.781 -8.054 -1.990 1.00 0.58 H new ATOM 0 HB2 ASN B 79 0.669 -7.758 0.333 1.00 0.57 H new ATOM 0 HB3 ASN B 79 -0.833 -6.963 0.765 1.00 0.57 H new ATOM 0 HD21 ASN B 79 -1.097 -10.963 -0.399 1.00 1.16 H new ATOM 0 HD22 ASN B 79 0.119 -9.923 -1.149 1.00 1.16 H new ATOM 2939 N MET B 80 -1.412 -4.992 -0.916 1.00 0.57 N ATOM 2940 CA MET B 80 -2.439 -3.922 -0.977 1.00 0.57 C ATOM 2941 C MET B 80 -2.855 -3.749 -2.439 1.00 0.58 C ATOM 2942 O MET B 80 -4.023 -3.810 -2.768 1.00 0.57 O ATOM 2943 CB MET B 80 -1.846 -2.622 -0.410 1.00 0.60 C ATOM 2944 CG MET B 80 -2.541 -1.394 -1.011 1.00 0.69 C ATOM 2945 SD MET B 80 -1.725 -0.924 -2.557 1.00 1.27 S ATOM 2946 CE MET B 80 -2.949 0.293 -3.101 1.00 1.05 C ATOM 0 H MET B 80 -0.544 -4.736 -0.445 1.00 0.57 H new ATOM 0 HA MET B 80 -3.316 -4.181 -0.383 1.00 0.57 H new ATOM 0 HB2 MET B 80 -1.954 -2.611 0.675 1.00 0.60 H new ATOM 0 HB3 MET B 80 -0.778 -2.581 -0.624 1.00 0.60 H new ATOM 0 HG2 MET B 80 -3.592 -1.614 -1.196 1.00 0.69 H new ATOM 0 HG3 MET B 80 -2.508 -0.564 -0.305 1.00 0.69 H new ATOM 0 HE1 MET B 80 -2.727 0.601 -4.123 1.00 1.05 H new ATOM 0 HE2 MET B 80 -3.944 -0.150 -3.064 1.00 1.05 H new ATOM 0 HE3 MET B 80 -2.914 1.163 -2.445 1.00 1.05 H new ATOM 2956 N ASP B 81 -1.916 -3.549 -3.325 1.00 0.60 N ATOM 2957 CA ASP B 81 -2.267 -3.391 -4.763 1.00 0.62 C ATOM 2958 C ASP B 81 -2.991 -4.644 -5.261 1.00 0.63 C ATOM 2959 O ASP B 81 -3.968 -4.562 -5.980 1.00 0.64 O ATOM 2960 CB ASP B 81 -0.984 -3.182 -5.568 1.00 0.65 C ATOM 2961 CG ASP B 81 -1.251 -2.213 -6.721 1.00 0.67 C ATOM 2962 OD1 ASP B 81 -1.732 -1.124 -6.453 1.00 1.19 O ATOM 2963 OD2 ASP B 81 -0.971 -2.576 -7.851 1.00 1.23 O ATOM 0 H ASP B 81 -0.920 -3.488 -3.113 1.00 0.60 H new ATOM 0 HA ASP B 81 -2.924 -2.530 -4.888 1.00 0.62 H new ATOM 0 HB2 ASP B 81 -0.199 -2.787 -4.923 1.00 0.65 H new ATOM 0 HB3 ASP B 81 -0.628 -4.136 -5.957 1.00 0.65 H new ATOM 2968 N GLN B 82 -2.540 -5.804 -4.864 1.00 0.64 N ATOM 2969 CA GLN B 82 -3.227 -7.056 -5.292 1.00 0.66 C ATOM 2970 C GLN B 82 -4.653 -7.006 -4.754 1.00 0.63 C ATOM 2971 O GLN B 82 -5.622 -7.207 -5.459 1.00 0.65 O ATOM 2972 CB GLN B 82 -2.505 -8.264 -4.691 1.00 0.68 C ATOM 2973 CG GLN B 82 -1.087 -8.362 -5.248 1.00 1.09 C ATOM 2974 CD GLN B 82 -1.012 -9.524 -6.240 1.00 0.83 C ATOM 2975 OE1 GLN B 82 -1.332 -9.369 -7.402 1.00 1.28 O ATOM 2976 NE2 GLN B 82 -0.602 -10.692 -5.828 1.00 1.41 N ATOM 0 H GLN B 82 -1.727 -5.938 -4.263 1.00 0.64 H new ATOM 0 HA GLN B 82 -3.224 -7.144 -6.378 1.00 0.66 H new ATOM 0 HB2 GLN B 82 -2.472 -8.174 -3.605 1.00 0.68 H new ATOM 0 HB3 GLN B 82 -3.056 -9.176 -4.918 1.00 0.68 H new ATOM 0 HG2 GLN B 82 -0.813 -7.430 -5.741 1.00 1.09 H new ATOM 0 HG3 GLN B 82 -0.375 -8.515 -4.437 1.00 1.09 H new ATOM 0 HE21 GLN B 82 -0.333 -10.823 -4.853 1.00 1.41 H new ATOM 0 HE22 GLN B 82 -0.550 -11.474 -6.481 1.00 1.41 H new ATOM 2985 N LEU B 83 -4.761 -6.720 -3.491 1.00 0.59 N ATOM 2986 CA LEU B 83 -6.102 -6.628 -2.862 1.00 0.56 C ATOM 2987 C LEU B 83 -6.860 -5.484 -3.538 1.00 0.55 C ATOM 2988 O LEU B 83 -8.016 -5.615 -3.889 1.00 0.56 O ATOM 2989 CB LEU B 83 -5.962 -6.371 -1.360 1.00 0.53 C ATOM 2990 CG LEU B 83 -5.229 -7.553 -0.708 1.00 0.53 C ATOM 2991 CD1 LEU B 83 -4.634 -7.118 0.630 1.00 0.55 C ATOM 2992 CD2 LEU B 83 -6.200 -8.718 -0.467 1.00 0.56 C ATOM 0 H LEU B 83 -3.975 -6.545 -2.865 1.00 0.59 H new ATOM 0 HA LEU B 83 -6.649 -7.562 -2.989 1.00 0.56 H new ATOM 0 HB2 LEU B 83 -5.411 -5.447 -1.188 1.00 0.53 H new ATOM 0 HB3 LEU B 83 -6.946 -6.244 -0.908 1.00 0.53 H new ATOM 0 HG LEU B 83 -4.435 -7.879 -1.379 1.00 0.53 H new ATOM 0 HD11 LEU B 83 -4.115 -7.960 1.088 1.00 0.55 H new ATOM 0 HD12 LEU B 83 -3.929 -6.303 0.467 1.00 0.55 H new ATOM 0 HD13 LEU B 83 -5.433 -6.781 1.291 1.00 0.55 H new ATOM 0 HD21 LEU B 83 -5.665 -9.548 -0.005 1.00 0.56 H new ATOM 0 HD22 LEU B 83 -7.004 -8.391 0.193 1.00 0.56 H new ATOM 0 HD23 LEU B 83 -6.621 -9.043 -1.418 1.00 0.56 H new ATOM 3004 N LYS B 84 -6.211 -4.370 -3.744 1.00 0.55 N ATOM 3005 CA LYS B 84 -6.891 -3.230 -4.422 1.00 0.55 C ATOM 3006 C LYS B 84 -7.538 -3.733 -5.716 1.00 0.58 C ATOM 3007 O LYS B 84 -8.667 -3.409 -6.032 1.00 0.58 O ATOM 3008 CB LYS B 84 -5.865 -2.146 -4.762 1.00 0.56 C ATOM 3009 CG LYS B 84 -6.580 -0.930 -5.362 1.00 0.57 C ATOM 3010 CD LYS B 84 -6.173 -0.768 -6.827 1.00 0.80 C ATOM 3011 CE LYS B 84 -7.044 0.306 -7.484 1.00 0.80 C ATOM 3012 NZ LYS B 84 -7.957 -0.333 -8.473 1.00 1.40 N ATOM 0 H LYS B 84 -5.242 -4.200 -3.473 1.00 0.55 H new ATOM 0 HA LYS B 84 -7.651 -2.814 -3.761 1.00 0.55 H new ATOM 0 HB2 LYS B 84 -5.319 -1.853 -3.865 1.00 0.56 H new ATOM 0 HB3 LYS B 84 -5.132 -2.534 -5.469 1.00 0.56 H new ATOM 0 HG2 LYS B 84 -7.660 -1.056 -5.286 1.00 0.57 H new ATOM 0 HG3 LYS B 84 -6.324 -0.031 -4.801 1.00 0.57 H new ATOM 0 HD2 LYS B 84 -5.121 -0.490 -6.895 1.00 0.80 H new ATOM 0 HD3 LYS B 84 -6.286 -1.715 -7.354 1.00 0.80 H new ATOM 0 HE2 LYS B 84 -7.623 0.834 -6.726 1.00 0.80 H new ATOM 0 HE3 LYS B 84 -6.416 1.047 -7.978 1.00 0.80 H new ATOM 0 HZ1 LYS B 84 -7.947 0.213 -9.358 1.00 1.40 H new ATOM 0 HZ2 LYS B 84 -7.638 -1.305 -8.663 1.00 1.40 H new ATOM 0 HZ3 LYS B 84 -8.924 -0.354 -8.090 1.00 1.40 H new ATOM 3026 N GLU B 85 -6.823 -4.521 -6.474 1.00 0.60 N ATOM 3027 CA GLU B 85 -7.381 -5.045 -7.752 1.00 0.63 C ATOM 3028 C GLU B 85 -8.563 -5.969 -7.463 1.00 0.63 C ATOM 3029 O GLU B 85 -9.526 -6.010 -8.204 1.00 0.64 O ATOM 3030 CB GLU B 85 -6.298 -5.833 -8.494 1.00 0.66 C ATOM 3031 CG GLU B 85 -6.956 -6.861 -9.418 1.00 0.69 C ATOM 3032 CD GLU B 85 -5.957 -7.295 -10.492 1.00 0.73 C ATOM 3033 OE1 GLU B 85 -4.767 -7.207 -10.236 1.00 1.21 O ATOM 3034 OE2 GLU B 85 -6.398 -7.708 -11.552 1.00 1.28 O ATOM 0 H GLU B 85 -5.873 -4.825 -6.261 1.00 0.60 H new ATOM 0 HA GLU B 85 -7.717 -4.209 -8.365 1.00 0.63 H new ATOM 0 HB2 GLU B 85 -5.673 -5.154 -9.074 1.00 0.66 H new ATOM 0 HB3 GLU B 85 -5.645 -6.335 -7.780 1.00 0.66 H new ATOM 0 HG2 GLU B 85 -7.285 -7.726 -8.842 1.00 0.69 H new ATOM 0 HG3 GLU B 85 -7.843 -6.432 -9.884 1.00 0.69 H new ATOM 3041 N LYS B 86 -8.509 -6.701 -6.388 1.00 0.63 N ATOM 3042 CA LYS B 86 -9.642 -7.608 -6.055 1.00 0.63 C ATOM 3043 C LYS B 86 -10.881 -6.758 -5.793 1.00 0.61 C ATOM 3044 O LYS B 86 -11.997 -7.164 -6.050 1.00 0.62 O ATOM 3045 CB LYS B 86 -9.300 -8.423 -4.806 1.00 0.64 C ATOM 3046 CG LYS B 86 -9.492 -9.913 -5.095 1.00 0.70 C ATOM 3047 CD LYS B 86 -9.079 -10.730 -3.869 1.00 0.89 C ATOM 3048 CE LYS B 86 -9.020 -12.214 -4.238 1.00 1.09 C ATOM 3049 NZ LYS B 86 -7.641 -12.560 -4.686 1.00 0.99 N ATOM 0 H LYS B 86 -7.733 -6.712 -5.727 1.00 0.63 H new ATOM 0 HA LYS B 86 -9.828 -8.293 -6.882 1.00 0.63 H new ATOM 0 HB2 LYS B 86 -8.270 -8.231 -4.505 1.00 0.64 H new ATOM 0 HB3 LYS B 86 -9.937 -8.119 -3.975 1.00 0.64 H new ATOM 0 HG2 LYS B 86 -10.534 -10.114 -5.345 1.00 0.70 H new ATOM 0 HG3 LYS B 86 -8.895 -10.206 -5.958 1.00 0.70 H new ATOM 0 HD2 LYS B 86 -8.107 -10.396 -3.507 1.00 0.89 H new ATOM 0 HD3 LYS B 86 -9.791 -10.574 -3.059 1.00 0.89 H new ATOM 0 HE2 LYS B 86 -9.299 -12.825 -3.379 1.00 1.09 H new ATOM 0 HE3 LYS B 86 -9.737 -12.432 -5.030 1.00 1.09 H new ATOM 0 HZ1 LYS B 86 -7.600 -13.568 -4.937 1.00 0.99 H new ATOM 0 HZ2 LYS B 86 -7.392 -11.986 -5.517 1.00 0.99 H new ATOM 0 HZ3 LYS B 86 -6.968 -12.367 -3.917 1.00 0.99 H new ATOM 3063 N ILE B 87 -10.687 -5.570 -5.288 1.00 0.59 N ATOM 3064 CA ILE B 87 -11.843 -4.677 -5.012 1.00 0.57 C ATOM 3065 C ILE B 87 -12.429 -4.200 -6.335 1.00 0.57 C ATOM 3066 O ILE B 87 -13.624 -4.260 -6.549 1.00 0.55 O ATOM 3067 CB ILE B 87 -11.370 -3.465 -4.203 1.00 0.59 C ATOM 3068 CG1 ILE B 87 -10.892 -3.927 -2.823 1.00 0.65 C ATOM 3069 CG2 ILE B 87 -12.520 -2.469 -4.036 1.00 0.68 C ATOM 3070 CD1 ILE B 87 -10.195 -2.768 -2.102 1.00 0.70 C ATOM 0 H ILE B 87 -9.774 -5.180 -5.055 1.00 0.59 H new ATOM 0 HA ILE B 87 -12.599 -5.220 -4.445 1.00 0.57 H new ATOM 0 HB ILE B 87 -10.549 -2.980 -4.732 1.00 0.59 H new ATOM 0 HG12 ILE B 87 -11.739 -4.278 -2.233 1.00 0.65 H new ATOM 0 HG13 ILE B 87 -10.206 -4.768 -2.928 1.00 0.65 H new ATOM 0 HG21 ILE B 87 -12.176 -1.610 -3.460 1.00 0.68 H new ATOM 0 HG22 ILE B 87 -12.858 -2.136 -5.017 1.00 0.68 H new ATOM 0 HG23 ILE B 87 -13.345 -2.951 -3.512 1.00 0.68 H new ATOM 0 HD11 ILE B 87 -9.857 -3.101 -1.121 1.00 0.70 H new ATOM 0 HD12 ILE B 87 -9.338 -2.437 -2.689 1.00 0.70 H new ATOM 0 HD13 ILE B 87 -10.894 -1.940 -1.983 1.00 0.70 H new ATOM 3082 N ASN B 88 -11.608 -3.736 -7.233 1.00 0.60 N ATOM 3083 CA ASN B 88 -12.135 -3.272 -8.539 1.00 0.63 C ATOM 3084 C ASN B 88 -12.835 -4.429 -9.252 1.00 0.63 C ATOM 3085 O ASN B 88 -13.780 -4.234 -9.989 1.00 0.64 O ATOM 3086 CB ASN B 88 -10.979 -2.766 -9.405 1.00 0.70 C ATOM 3087 CG ASN B 88 -10.519 -1.399 -8.894 1.00 1.78 C ATOM 3088 OD1 ASN B 88 -10.434 -1.179 -7.703 1.00 2.47 O ATOM 3089 ND2 ASN B 88 -10.215 -0.466 -9.754 1.00 2.62 N ATOM 0 H ASN B 88 -10.598 -3.659 -7.117 1.00 0.60 H new ATOM 0 HA ASN B 88 -12.848 -2.465 -8.374 1.00 0.63 H new ATOM 0 HB2 ASN B 88 -10.151 -3.475 -9.375 1.00 0.70 H new ATOM 0 HB3 ASN B 88 -11.296 -2.689 -10.445 1.00 0.70 H new ATOM 0 HD21 ASN B 88 -9.906 0.449 -9.426 1.00 2.62 H new ATOM 0 HD22 ASN B 88 -10.287 -0.652 -10.754 1.00 2.62 H new ATOM 3096 N SER B 89 -12.374 -5.633 -9.045 1.00 0.64 N ATOM 3097 CA SER B 89 -13.003 -6.804 -9.719 1.00 0.68 C ATOM 3098 C SER B 89 -14.378 -7.117 -9.115 1.00 0.67 C ATOM 3099 O SER B 89 -15.305 -7.461 -9.821 1.00 0.74 O ATOM 3100 CB SER B 89 -12.096 -8.023 -9.561 1.00 0.70 C ATOM 3101 OG SER B 89 -12.578 -9.076 -10.386 1.00 1.23 O ATOM 0 H SER B 89 -11.587 -5.856 -8.436 1.00 0.64 H new ATOM 0 HA SER B 89 -13.136 -6.564 -10.774 1.00 0.68 H new ATOM 0 HB2 SER B 89 -11.073 -7.768 -9.837 1.00 0.70 H new ATOM 0 HB3 SER B 89 -12.075 -8.342 -8.519 1.00 0.70 H new ATOM 0 HG SER B 89 -11.998 -9.860 -10.289 1.00 1.23 H new ATOM 3107 N VAL B 90 -14.525 -7.009 -7.820 1.00 0.63 N ATOM 3108 CA VAL B 90 -15.841 -7.308 -7.182 1.00 0.64 C ATOM 3109 C VAL B 90 -16.778 -6.119 -7.353 1.00 0.57 C ATOM 3110 O VAL B 90 -17.917 -6.253 -7.751 1.00 0.59 O ATOM 3111 CB VAL B 90 -15.628 -7.571 -5.693 1.00 0.66 C ATOM 3112 CG1 VAL B 90 -16.963 -7.931 -5.039 1.00 0.66 C ATOM 3113 CG2 VAL B 90 -14.645 -8.731 -5.515 1.00 0.89 C ATOM 0 H VAL B 90 -13.787 -6.726 -7.175 1.00 0.63 H new ATOM 0 HA VAL B 90 -16.282 -8.186 -7.655 1.00 0.64 H new ATOM 0 HB VAL B 90 -15.224 -6.675 -5.222 1.00 0.66 H new ATOM 0 HG11 VAL B 90 -16.809 -8.118 -3.976 1.00 0.66 H new ATOM 0 HG12 VAL B 90 -17.664 -7.105 -5.164 1.00 0.66 H new ATOM 0 HG13 VAL B 90 -17.369 -8.826 -5.510 1.00 0.66 H new ATOM 0 HG21 VAL B 90 -14.493 -8.919 -4.452 1.00 0.89 H new ATOM 0 HG22 VAL B 90 -15.049 -9.626 -5.988 1.00 0.89 H new ATOM 0 HG23 VAL B 90 -13.692 -8.475 -5.978 1.00 0.89 H new ATOM 3123 N LEU B 91 -16.285 -4.953 -7.059 1.00 0.51 N ATOM 3124 CA LEU B 91 -17.106 -3.726 -7.202 1.00 0.49 C ATOM 3125 C LEU B 91 -17.171 -3.372 -8.675 1.00 0.57 C ATOM 3126 O LEU B 91 -17.935 -2.525 -9.080 1.00 0.61 O ATOM 3127 CB LEU B 91 -16.417 -2.581 -6.453 1.00 0.47 C ATOM 3128 CG LEU B 91 -17.429 -1.507 -6.041 1.00 0.59 C ATOM 3129 CD1 LEU B 91 -17.681 -1.600 -4.535 1.00 0.91 C ATOM 3130 CD2 LEU B 91 -16.862 -0.125 -6.373 1.00 0.84 C ATOM 0 H LEU B 91 -15.335 -4.797 -6.721 1.00 0.51 H new ATOM 0 HA LEU B 91 -18.106 -3.886 -6.800 1.00 0.49 H new ATOM 0 HB2 LEU B 91 -15.915 -2.971 -5.568 1.00 0.47 H new ATOM 0 HB3 LEU B 91 -15.649 -2.138 -7.086 1.00 0.47 H new ATOM 0 HG LEU B 91 -18.364 -1.660 -6.579 1.00 0.59 H new ATOM 0 HD11 LEU B 91 -18.401 -0.837 -4.239 1.00 0.91 H new ATOM 0 HD12 LEU B 91 -18.077 -2.586 -4.293 1.00 0.91 H new ATOM 0 HD13 LEU B 91 -16.745 -1.443 -3.999 1.00 0.91 H new ATOM 0 HD21 LEU B 91 -17.579 0.642 -6.081 1.00 0.84 H new ATOM 0 HD22 LEU B 91 -15.929 0.025 -5.830 1.00 0.84 H new ATOM 0 HD23 LEU B 91 -16.673 -0.057 -7.444 1.00 0.84 H new ATOM 3142 N SER B 92 -16.391 -4.053 -9.474 1.00 0.63 N ATOM 3143 CA SER B 92 -16.380 -3.805 -10.953 1.00 0.76 C ATOM 3144 C SER B 92 -16.066 -2.328 -11.267 1.00 0.83 C ATOM 3145 O SER B 92 -15.493 -2.022 -12.291 1.00 1.11 O ATOM 3146 CB SER B 92 -17.745 -4.164 -11.542 1.00 0.72 C ATOM 3147 OG SER B 92 -17.713 -5.504 -12.014 1.00 0.89 O ATOM 0 H SER B 92 -15.750 -4.783 -9.162 1.00 0.63 H new ATOM 0 HA SER B 92 -15.603 -4.427 -11.397 1.00 0.76 H new ATOM 0 HB2 SER B 92 -18.522 -4.051 -10.786 1.00 0.72 H new ATOM 0 HB3 SER B 92 -17.993 -3.484 -12.357 1.00 0.72 H new ATOM 0 HG SER B 92 -18.587 -5.739 -12.391 1.00 0.89 H new ATOM 3153 N ILE B 93 -16.462 -1.425 -10.403 1.00 0.74 N ATOM 3154 CA ILE B 93 -16.230 0.043 -10.621 1.00 0.82 C ATOM 3155 C ILE B 93 -16.994 0.518 -11.866 1.00 1.03 C ATOM 3156 O ILE B 93 -17.736 1.479 -11.818 1.00 1.11 O ATOM 3157 CB ILE B 93 -14.733 0.339 -10.781 1.00 0.92 C ATOM 3158 CG1 ILE B 93 -13.971 -0.188 -9.555 1.00 0.87 C ATOM 3159 CG2 ILE B 93 -14.526 1.849 -10.912 1.00 1.13 C ATOM 3160 CD1 ILE B 93 -13.925 0.879 -8.457 1.00 1.43 C ATOM 0 H ILE B 93 -16.948 -1.647 -9.534 1.00 0.74 H new ATOM 0 HA ILE B 93 -16.597 0.582 -9.748 1.00 0.82 H new ATOM 0 HB ILE B 93 -14.355 -0.156 -11.676 1.00 0.92 H new ATOM 0 HG12 ILE B 93 -14.456 -1.088 -9.177 1.00 0.87 H new ATOM 0 HG13 ILE B 93 -12.957 -0.468 -9.841 1.00 0.87 H new ATOM 0 HG21 ILE B 93 -13.463 2.062 -11.026 1.00 1.13 H new ATOM 0 HG22 ILE B 93 -15.065 2.216 -11.785 1.00 1.13 H new ATOM 0 HG23 ILE B 93 -14.902 2.347 -10.018 1.00 1.13 H new ATOM 0 HD11 ILE B 93 -13.382 0.491 -7.595 1.00 1.43 H new ATOM 0 HD12 ILE B 93 -13.419 1.768 -8.834 1.00 1.43 H new ATOM 0 HD13 ILE B 93 -14.941 1.139 -8.159 1.00 1.43 H new ATOM 3172 N ARG B 94 -16.812 -0.145 -12.973 1.00 1.25 N ATOM 3173 CA ARG B 94 -17.512 0.253 -14.237 1.00 1.52 C ATOM 3174 C ARG B 94 -18.006 -1.003 -14.964 1.00 1.60 C ATOM 3175 O ARG B 94 -18.745 -0.922 -15.925 1.00 1.76 O ATOM 3176 CB ARG B 94 -16.543 0.981 -15.176 1.00 1.97 C ATOM 3177 CG ARG B 94 -16.059 2.294 -14.555 1.00 2.23 C ATOM 3178 CD ARG B 94 -14.527 2.312 -14.535 1.00 2.52 C ATOM 3179 NE ARG B 94 -14.054 3.534 -13.826 1.00 3.12 N ATOM 3180 CZ ARG B 94 -14.015 4.678 -14.454 1.00 3.73 C ATOM 3181 NH1 ARG B 94 -14.392 4.750 -15.701 1.00 3.88 N ATOM 3182 NH2 ARG B 94 -13.598 5.748 -13.834 1.00 4.55 N ATOM 0 H ARG B 94 -16.201 -0.957 -13.062 1.00 1.25 H new ATOM 0 HA ARG B 94 -18.344 0.907 -13.976 1.00 1.52 H new ATOM 0 HB2 ARG B 94 -15.688 0.339 -15.391 1.00 1.97 H new ATOM 0 HB3 ARG B 94 -17.036 1.184 -16.127 1.00 1.97 H new ATOM 0 HG2 ARG B 94 -16.436 3.141 -15.128 1.00 2.23 H new ATOM 0 HG3 ARG B 94 -16.448 2.395 -13.542 1.00 2.23 H new ATOM 0 HD2 ARG B 94 -14.149 1.420 -14.036 1.00 2.52 H new ATOM 0 HD3 ARG B 94 -14.139 2.296 -15.554 1.00 2.52 H new ATOM 0 HE ARG B 94 -13.761 3.477 -12.851 1.00 3.12 H new ATOM 0 HH11 ARG B 94 -14.717 3.913 -16.185 1.00 3.88 H new ATOM 0 HH12 ARG B 94 -14.362 5.643 -16.192 1.00 3.88 H new ATOM 0 HH21 ARG B 94 -13.303 5.690 -12.859 1.00 4.55 H new ATOM 0 HH22 ARG B 94 -13.567 6.642 -14.324 1.00 4.55 H new ATOM 3196 N GLN B 95 -17.602 -2.160 -14.516 1.00 1.55 N ATOM 3197 CA GLN B 95 -18.046 -3.418 -15.185 1.00 1.73 C ATOM 3198 C GLN B 95 -17.311 -3.574 -16.519 1.00 2.40 C ATOM 3199 O GLN B 95 -16.356 -2.845 -16.734 1.00 2.92 O ATOM 3200 CB GLN B 95 -19.555 -3.361 -15.437 1.00 1.94 C ATOM 3201 CG GLN B 95 -20.154 -4.758 -15.261 1.00 2.44 C ATOM 3202 CD GLN B 95 -21.522 -4.817 -15.945 1.00 2.98 C ATOM 3203 OE1 GLN B 95 -22.429 -4.098 -15.576 1.00 3.53 O ATOM 3204 NE2 GLN B 95 -21.709 -5.649 -16.932 1.00 3.31 N ATOM 3205 OXT GLN B 95 -17.715 -4.418 -17.300 1.00 3.00 O ATOM 0 H GLN B 95 -16.983 -2.290 -13.715 1.00 1.55 H new ATOM 0 HA GLN B 95 -17.819 -4.269 -14.543 1.00 1.73 H new ATOM 0 HB2 GLN B 95 -20.024 -2.662 -14.744 1.00 1.94 H new ATOM 0 HB3 GLN B 95 -19.753 -2.993 -16.444 1.00 1.94 H new ATOM 0 HG2 GLN B 95 -19.489 -5.507 -15.690 1.00 2.44 H new ATOM 0 HG3 GLN B 95 -20.255 -4.991 -14.201 1.00 2.44 H new ATOM 0 HE21 GLN B 95 -20.947 -6.253 -17.242 1.00 3.31 H new ATOM 0 HE22 GLN B 95 -22.617 -5.696 -17.394 1.00 3.31 H new TER 3214 GLN B 95