USER MOD reduce.3.24.130724 H: found=0, std=0, add=1131, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1118 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 113 LYS NZ :NH3+ -109:sc= -1.63 (180deg=-3.21!) USER MOD Set 1.2: A 122 GLN :FLIP amide:sc= -0.873 F(o=-4!,f=-2.5) USER MOD Set 2.1: A 94 SER OG : rot 42:sc= 1.52 USER MOD Set 2.2: A 97 HIS :FLIP no HD1:sc= -7.15! C(o=-7.2!,f=-5.6!) USER MOD Set 3.1: A 69 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 71 SER OG : rot 147:sc= 1.19 USER MOD Set 3.3: A 75 ASN : amide:sc= -6.27! C(o=-10!,f=-21!) USER MOD Set 3.4: A 78 CYS SG : rot 67:sc= -5.3! USER MOD Set 4.1: A 53 SER OG : rot 180:sc=-0.00712 USER MOD Set 4.2: A 56 THR OG1 : rot 180:sc= -0.174! USER MOD Set 4.3: A 58 GLN : amide:sc= -0.955 K(o=-1.1,f=-4.3!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0 (180deg=-0.00656) USER MOD Single : A 2 ASN : amide:sc= -0.18 X(o=-0.18,f=-0.02) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0355) USER MOD Single : A 7 LYS NZ :NH3+ -126:sc= 0 (180deg=-1.44!) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot 41:sc= -1.59 USER MOD Single : A 12 SER OG : rot 146:sc= -3.21 USER MOD Single : A 13 ASN : amide:sc= -1.43 X(o=-1.4,f=-1.8) USER MOD Single : A 16 HIS : no HD1:sc= -5.31! C(o=-5.3!,f=-8.9!) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 HIS : no HE2:sc= 1.33 K(o=1.3,f=-5.2!) USER MOD Single : A 38 GLN : amide:sc= -0.573 K(o=-0.57,f=-3.2!) USER MOD Single : A 40 GLN : amide:sc= 0.299 K(o=0.3,f=-0.63) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 135:sc= -1.17! USER MOD Single : A 50 TYR OH : rot 180:sc= -0.0101 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot -106:sc= 1.15 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.252 USER MOD Single : A 62 MET CE :methyl -150:sc= -0.42 (180deg=-2.04!) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.029 USER MOD Single : A 72 GLN : amide:sc=-0.00302 X(o=-0.003,f=-0.012) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0.0513 USER MOD Single : A 87 ASN : amide:sc= -0.162 K(o=-0.16,f=-1.5!) USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 89 TYR OH : rot 180:sc= -0.75 USER MOD Single : A 90 ASN : amide:sc= -2.85 K(o=-2.9,f=-7.2!) USER MOD Single : A 91 THR OG1 : rot 169:sc= -1.2 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= -0.456 (180deg=-0.456) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 ASN : amide:sc= -0.227 K(o=-0.23,f=-0.75) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= -0.191 K(o=-0.19,f=-0.78) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 CYS SG : rot 78:sc= -1.93 USER MOD Single : A 118 THR OG1 : rot -108:sc= 0.753 USER MOD Single : A 119 HIS : no HD1:sc= -0.282 X(o=-0.28,f=-0.29) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 138 HIS : no HD1:sc= -0.108 K(o=-0.11,f=-0.89) USER MOD Single : A 139 HIS : no HD1:sc= -0.576 X(o=-0.58,f=-0.22) USER MOD Single : A 140 HIS : no HD1:sc= -0.004 X(o=-0.004,f=-0.12) USER MOD Single : A 141 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 142 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 HIS : no HD1:sc= -0.717 K(o=-0.72,f=-1.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 22.320 -10.831 7.026 1.00 0.00 N ATOM 2 CA MET A 1 22.507 -10.098 5.785 1.00 0.00 C ATOM 3 C MET A 1 21.204 -9.432 5.340 1.00 0.00 C ATOM 4 O MET A 1 21.177 -8.232 5.069 1.00 0.00 O ATOM 5 CB MET A 1 22.989 -11.056 4.694 1.00 0.00 C ATOM 6 CG MET A 1 24.494 -11.309 4.812 1.00 0.00 C ATOM 7 SD MET A 1 25.392 -10.111 3.840 1.00 0.00 S ATOM 8 CE MET A 1 26.755 -9.777 4.943 1.00 0.00 C ATOM 0 H1 MET A 1 23.238 -11.188 7.360 1.00 0.00 H new ATOM 0 H2 MET A 1 21.912 -10.199 7.744 1.00 0.00 H new ATOM 0 H3 MET A 1 21.676 -11.631 6.863 1.00 0.00 H new ATOM 0 HA MET A 1 23.252 -9.320 5.953 1.00 0.00 H new ATOM 0 HB2 MET A 1 22.451 -12.001 4.771 1.00 0.00 H new ATOM 0 HB3 MET A 1 22.763 -10.639 3.713 1.00 0.00 H new ATOM 0 HG2 MET A 1 24.801 -11.246 5.856 1.00 0.00 H new ATOM 0 HG3 MET A 1 24.730 -12.317 4.470 1.00 0.00 H new ATOM 0 HE1 MET A 1 27.420 -9.043 4.488 1.00 0.00 H new ATOM 0 HE2 MET A 1 26.373 -9.386 5.886 1.00 0.00 H new ATOM 0 HE3 MET A 1 27.306 -10.699 5.130 1.00 0.00 H new ATOM 18 N ASN A 2 20.155 -10.239 5.278 1.00 0.00 N ATOM 19 CA ASN A 2 18.852 -9.742 4.871 1.00 0.00 C ATOM 20 C ASN A 2 17.768 -10.703 5.363 1.00 0.00 C ATOM 21 O ASN A 2 17.995 -11.909 5.452 1.00 0.00 O ATOM 22 CB ASN A 2 18.748 -9.653 3.347 1.00 0.00 C ATOM 23 CG ASN A 2 18.695 -11.047 2.719 1.00 0.00 C ATOM 24 OD1 ASN A 2 19.703 -11.706 2.520 1.00 0.00 O ATOM 25 ND2 ASN A 2 17.467 -11.459 2.418 1.00 0.00 N ATOM 0 H ASN A 2 20.181 -11.234 5.503 1.00 0.00 H new ATOM 0 HA ASN A 2 18.721 -8.749 5.300 1.00 0.00 H new ATOM 0 HB2 ASN A 2 17.855 -9.092 3.072 1.00 0.00 H new ATOM 0 HB3 ASN A 2 19.603 -9.104 2.952 1.00 0.00 H new ATOM 0 HD21 ASN A 2 17.326 -12.376 1.994 1.00 0.00 H new ATOM 0 HD22 ASN A 2 16.666 -10.858 2.611 1.00 0.00 H new ATOM 32 N TYR A 3 16.612 -10.133 5.671 1.00 0.00 N ATOM 33 CA TYR A 3 15.492 -10.924 6.152 1.00 0.00 C ATOM 34 C TYR A 3 14.190 -10.123 6.094 1.00 0.00 C ATOM 35 O TYR A 3 13.830 -9.445 7.056 1.00 0.00 O ATOM 36 CB TYR A 3 15.808 -11.257 7.612 1.00 0.00 C ATOM 37 CG TYR A 3 15.016 -12.445 8.164 1.00 0.00 C ATOM 38 CD1 TYR A 3 13.670 -12.311 8.435 1.00 0.00 C ATOM 39 CD2 TYR A 3 15.649 -13.650 8.390 1.00 0.00 C ATOM 40 CE1 TYR A 3 12.925 -13.428 8.954 1.00 0.00 C ATOM 41 CE2 TYR A 3 14.905 -14.768 8.910 1.00 0.00 C ATOM 42 CZ TYR A 3 13.579 -14.602 9.167 1.00 0.00 C ATOM 43 OH TYR A 3 12.876 -15.657 9.657 1.00 0.00 O ATOM 0 H TYR A 3 16.427 -9.133 5.597 1.00 0.00 H new ATOM 0 HA TYR A 3 15.360 -11.815 5.539 1.00 0.00 H new ATOM 0 HB2 TYR A 3 16.873 -11.469 7.703 1.00 0.00 H new ATOM 0 HB3 TYR A 3 15.604 -10.380 8.227 1.00 0.00 H new ATOM 0 HD1 TYR A 3 13.175 -11.368 8.258 1.00 0.00 H new ATOM 0 HD2 TYR A 3 16.703 -13.755 8.177 1.00 0.00 H new ATOM 0 HE1 TYR A 3 11.871 -13.336 9.169 1.00 0.00 H new ATOM 0 HE2 TYR A 3 15.388 -15.717 9.092 1.00 0.00 H new ATOM 0 HH TYR A 3 13.472 -16.429 9.757 1.00 0.00 H new ATOM 53 N LYS A 4 13.518 -10.227 4.957 1.00 0.00 N ATOM 54 CA LYS A 4 12.264 -9.520 4.761 1.00 0.00 C ATOM 55 C LYS A 4 11.568 -10.062 3.511 1.00 0.00 C ATOM 56 O LYS A 4 12.150 -10.846 2.763 1.00 0.00 O ATOM 57 CB LYS A 4 12.500 -8.009 4.727 1.00 0.00 C ATOM 58 CG LYS A 4 11.453 -7.271 5.565 1.00 0.00 C ATOM 59 CD LYS A 4 11.993 -6.954 6.961 1.00 0.00 C ATOM 60 CE LYS A 4 12.032 -5.444 7.203 1.00 0.00 C ATOM 61 NZ LYS A 4 13.025 -5.112 8.250 1.00 0.00 N ATOM 0 H LYS A 4 13.819 -10.791 4.162 1.00 0.00 H new ATOM 0 HA LYS A 4 11.593 -9.695 5.602 1.00 0.00 H new ATOM 0 HB2 LYS A 4 13.497 -7.785 5.105 1.00 0.00 H new ATOM 0 HB3 LYS A 4 12.462 -7.655 3.697 1.00 0.00 H new ATOM 0 HG2 LYS A 4 11.166 -6.347 5.064 1.00 0.00 H new ATOM 0 HG3 LYS A 4 10.553 -7.881 5.649 1.00 0.00 H new ATOM 0 HD2 LYS A 4 11.366 -7.431 7.714 1.00 0.00 H new ATOM 0 HD3 LYS A 4 12.995 -7.370 7.071 1.00 0.00 H new ATOM 0 HE2 LYS A 4 12.285 -4.928 6.277 1.00 0.00 H new ATOM 0 HE3 LYS A 4 11.045 -5.092 7.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 13.039 -4.083 8.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 12.767 -5.590 9.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 13.968 -5.430 7.947 1.00 0.00 H new ATOM 75 N LYS A 5 10.332 -9.624 3.324 1.00 0.00 N ATOM 76 CA LYS A 5 9.550 -10.055 2.178 1.00 0.00 C ATOM 77 C LYS A 5 8.763 -8.865 1.626 1.00 0.00 C ATOM 78 O LYS A 5 7.564 -8.742 1.872 1.00 0.00 O ATOM 79 CB LYS A 5 8.674 -11.254 2.547 1.00 0.00 C ATOM 80 CG LYS A 5 7.779 -11.661 1.375 1.00 0.00 C ATOM 81 CD LYS A 5 6.697 -12.644 1.827 1.00 0.00 C ATOM 82 CE LYS A 5 5.539 -12.682 0.827 1.00 0.00 C ATOM 83 NZ LYS A 5 4.282 -12.241 1.472 1.00 0.00 N ATOM 0 H LYS A 5 9.852 -8.975 3.947 1.00 0.00 H new ATOM 0 HA LYS A 5 10.205 -10.402 1.379 1.00 0.00 H new ATOM 0 HB2 LYS A 5 9.305 -12.094 2.836 1.00 0.00 H new ATOM 0 HB3 LYS A 5 8.057 -11.006 3.411 1.00 0.00 H new ATOM 0 HG2 LYS A 5 7.313 -10.775 0.944 1.00 0.00 H new ATOM 0 HG3 LYS A 5 8.385 -12.116 0.591 1.00 0.00 H new ATOM 0 HD2 LYS A 5 7.126 -13.641 1.930 1.00 0.00 H new ATOM 0 HD3 LYS A 5 6.325 -12.354 2.810 1.00 0.00 H new ATOM 0 HE2 LYS A 5 5.764 -12.038 -0.023 1.00 0.00 H new ATOM 0 HE3 LYS A 5 5.420 -13.693 0.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 3.521 -12.208 0.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 4.025 -12.910 2.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 4.415 -11.294 1.881 1.00 0.00 H new ATOM 97 N PRO A 6 9.487 -7.997 0.870 1.00 0.00 N ATOM 98 CA PRO A 6 8.870 -6.822 0.281 1.00 0.00 C ATOM 99 C PRO A 6 8.005 -7.201 -0.923 1.00 0.00 C ATOM 100 O PRO A 6 7.989 -8.359 -1.340 1.00 0.00 O ATOM 101 CB PRO A 6 10.029 -5.909 -0.085 1.00 0.00 C ATOM 102 CG PRO A 6 11.263 -6.796 -0.116 1.00 0.00 C ATOM 103 CD PRO A 6 10.909 -8.112 0.558 1.00 0.00 C ATOM 0 HA PRO A 6 8.186 -6.320 0.965 1.00 0.00 H new ATOM 0 HB2 PRO A 6 9.863 -5.436 -1.053 1.00 0.00 H new ATOM 0 HB3 PRO A 6 10.142 -5.108 0.646 1.00 0.00 H new ATOM 0 HG2 PRO A 6 11.584 -6.968 -1.143 1.00 0.00 H new ATOM 0 HG3 PRO A 6 12.093 -6.314 0.401 1.00 0.00 H new ATOM 0 HD2 PRO A 6 11.103 -8.959 -0.100 1.00 0.00 H new ATOM 0 HD3 PRO A 6 11.501 -8.267 1.460 1.00 0.00 H new ATOM 111 N LYS A 7 7.307 -6.205 -1.447 1.00 0.00 N ATOM 112 CA LYS A 7 6.442 -6.420 -2.595 1.00 0.00 C ATOM 113 C LYS A 7 6.452 -5.171 -3.477 1.00 0.00 C ATOM 114 O LYS A 7 6.735 -4.072 -3.001 1.00 0.00 O ATOM 115 CB LYS A 7 5.042 -6.840 -2.140 1.00 0.00 C ATOM 116 CG LYS A 7 5.018 -8.314 -1.731 1.00 0.00 C ATOM 117 CD LYS A 7 4.904 -8.460 -0.212 1.00 0.00 C ATOM 118 CE LYS A 7 3.595 -9.150 0.176 1.00 0.00 C ATOM 119 NZ LYS A 7 2.440 -8.269 -0.112 1.00 0.00 N ATOM 0 H LYS A 7 7.322 -5.247 -1.098 1.00 0.00 H new ATOM 0 HA LYS A 7 6.815 -7.244 -3.204 1.00 0.00 H new ATOM 0 HB2 LYS A 7 4.728 -6.221 -1.300 1.00 0.00 H new ATOM 0 HB3 LYS A 7 4.328 -6.671 -2.946 1.00 0.00 H new ATOM 0 HG2 LYS A 7 4.178 -8.815 -2.212 1.00 0.00 H new ATOM 0 HG3 LYS A 7 5.925 -8.807 -2.080 1.00 0.00 H new ATOM 0 HD2 LYS A 7 5.749 -9.036 0.166 1.00 0.00 H new ATOM 0 HD3 LYS A 7 4.954 -7.477 0.256 1.00 0.00 H new ATOM 0 HE2 LYS A 7 3.493 -10.085 -0.374 1.00 0.00 H new ATOM 0 HE3 LYS A 7 3.611 -9.404 1.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 1.864 -8.159 0.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 2.783 -7.337 -0.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 1.861 -8.691 -0.865 1.00 0.00 H new ATOM 133 N LEU A 8 6.140 -5.380 -4.748 1.00 0.00 N ATOM 134 CA LEU A 8 6.110 -4.284 -5.701 1.00 0.00 C ATOM 135 C LEU A 8 4.657 -3.894 -5.979 1.00 0.00 C ATOM 136 O LEU A 8 3.789 -4.759 -6.087 1.00 0.00 O ATOM 137 CB LEU A 8 6.900 -4.647 -6.960 1.00 0.00 C ATOM 138 CG LEU A 8 8.398 -4.891 -6.765 1.00 0.00 C ATOM 139 CD1 LEU A 8 8.899 -4.227 -5.481 1.00 0.00 C ATOM 140 CD2 LEU A 8 8.718 -6.387 -6.799 1.00 0.00 C ATOM 0 H LEU A 8 5.906 -6.292 -5.140 1.00 0.00 H new ATOM 0 HA LEU A 8 6.602 -3.405 -5.285 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.460 -5.544 -7.395 1.00 0.00 H new ATOM 0 HB3 LEU A 8 6.774 -3.845 -7.688 1.00 0.00 H new ATOM 0 HG LEU A 8 8.931 -4.428 -7.596 1.00 0.00 H new ATOM 0 HD11 LEU A 8 9.966 -4.416 -5.366 1.00 0.00 H new ATOM 0 HD12 LEU A 8 8.724 -3.152 -5.535 1.00 0.00 H new ATOM 0 HD13 LEU A 8 8.364 -4.639 -4.626 1.00 0.00 H new ATOM 0 HD21 LEU A 8 9.789 -6.533 -6.658 1.00 0.00 H new ATOM 0 HD22 LEU A 8 8.175 -6.894 -6.001 1.00 0.00 H new ATOM 0 HD23 LEU A 8 8.419 -6.801 -7.762 1.00 0.00 H new ATOM 152 N LEU A 9 4.437 -2.592 -6.085 1.00 0.00 N ATOM 153 CA LEU A 9 3.103 -2.078 -6.348 1.00 0.00 C ATOM 154 C LEU A 9 2.905 -1.936 -7.858 1.00 0.00 C ATOM 155 O LEU A 9 3.429 -1.008 -8.473 1.00 0.00 O ATOM 156 CB LEU A 9 2.867 -0.780 -5.572 1.00 0.00 C ATOM 157 CG LEU A 9 2.675 -0.928 -4.061 1.00 0.00 C ATOM 158 CD1 LEU A 9 1.191 -0.882 -3.691 1.00 0.00 C ATOM 159 CD2 LEU A 9 3.357 -2.195 -3.543 1.00 0.00 C ATOM 0 H LEU A 9 5.159 -1.878 -5.994 1.00 0.00 H new ATOM 0 HA LEU A 9 2.347 -2.778 -5.991 1.00 0.00 H new ATOM 0 HB2 LEU A 9 3.713 -0.116 -5.747 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.986 -0.289 -5.984 1.00 0.00 H new ATOM 0 HG LEU A 9 3.156 -0.082 -3.570 1.00 0.00 H new ATOM 0 HD11 LEU A 9 1.082 -0.989 -2.612 1.00 0.00 H new ATOM 0 HD12 LEU A 9 0.767 0.072 -4.006 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.666 -1.695 -4.192 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.205 -2.276 -2.467 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.928 -3.067 -4.037 1.00 0.00 H new ATOM 0 HD23 LEU A 9 4.425 -2.146 -3.756 1.00 0.00 H new ATOM 171 N TYR A 10 2.145 -2.869 -8.413 1.00 0.00 N ATOM 172 CA TYR A 10 1.870 -2.860 -9.840 1.00 0.00 C ATOM 173 C TYR A 10 0.705 -1.923 -10.168 1.00 0.00 C ATOM 174 O TYR A 10 -0.407 -2.116 -9.678 1.00 0.00 O ATOM 175 CB TYR A 10 1.475 -4.292 -10.203 1.00 0.00 C ATOM 176 CG TYR A 10 1.202 -4.504 -11.693 1.00 0.00 C ATOM 177 CD1 TYR A 10 2.219 -4.336 -12.612 1.00 0.00 C ATOM 178 CD2 TYR A 10 -0.060 -4.864 -12.119 1.00 0.00 C ATOM 179 CE1 TYR A 10 1.962 -4.535 -14.014 1.00 0.00 C ATOM 180 CE2 TYR A 10 -0.317 -5.063 -13.522 1.00 0.00 C ATOM 181 CZ TYR A 10 0.707 -4.889 -14.400 1.00 0.00 C ATOM 182 OH TYR A 10 0.464 -5.077 -15.725 1.00 0.00 O ATOM 0 H TYR A 10 1.711 -3.636 -7.900 1.00 0.00 H new ATOM 0 HA TYR A 10 2.741 -2.513 -10.396 1.00 0.00 H new ATOM 0 HB2 TYR A 10 2.271 -4.968 -9.890 1.00 0.00 H new ATOM 0 HB3 TYR A 10 0.584 -4.566 -9.638 1.00 0.00 H new ATOM 0 HD1 TYR A 10 3.207 -4.055 -12.279 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -0.855 -4.997 -11.400 1.00 0.00 H new ATOM 0 HE1 TYR A 10 2.748 -4.406 -14.743 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -1.300 -5.344 -13.869 1.00 0.00 H new ATOM 0 HH TYR A 10 -0.475 -5.328 -15.853 1.00 0.00 H new ATOM 192 N CYS A 11 1.000 -0.930 -10.994 1.00 0.00 N ATOM 193 CA CYS A 11 -0.009 0.036 -11.393 1.00 0.00 C ATOM 194 C CYS A 11 -0.409 -0.257 -12.840 1.00 0.00 C ATOM 195 O CYS A 11 0.040 0.422 -13.762 1.00 0.00 O ATOM 196 CB CYS A 11 0.484 1.474 -11.217 1.00 0.00 C ATOM 197 SG CYS A 11 -0.867 2.524 -10.568 1.00 0.00 S ATOM 0 H CYS A 11 1.924 -0.774 -11.398 1.00 0.00 H new ATOM 0 HA CYS A 11 -0.883 -0.060 -10.749 1.00 0.00 H new ATOM 0 HB2 CYS A 11 1.333 1.495 -10.533 1.00 0.00 H new ATOM 0 HB3 CYS A 11 0.834 1.867 -12.172 1.00 0.00 H new ATOM 0 HG CYS A 11 -1.525 1.870 -9.657 1.00 0.00 H new ATOM 203 N SER A 12 -1.250 -1.269 -12.994 1.00 0.00 N ATOM 204 CA SER A 12 -1.716 -1.661 -14.313 1.00 0.00 C ATOM 205 C SER A 12 -1.958 -0.419 -15.173 1.00 0.00 C ATOM 206 O SER A 12 -1.675 -0.423 -16.370 1.00 0.00 O ATOM 207 CB SER A 12 -2.994 -2.498 -14.220 1.00 0.00 C ATOM 208 OG SER A 12 -3.719 -2.503 -15.446 1.00 0.00 O ATOM 0 H SER A 12 -1.621 -1.830 -12.227 1.00 0.00 H new ATOM 0 HA SER A 12 -0.945 -2.274 -14.779 1.00 0.00 H new ATOM 0 HB2 SER A 12 -2.738 -3.521 -13.946 1.00 0.00 H new ATOM 0 HB3 SER A 12 -3.628 -2.105 -13.425 1.00 0.00 H new ATOM 0 HG SER A 12 -4.154 -3.373 -15.565 1.00 0.00 H new ATOM 214 N ASN A 13 -2.478 0.616 -14.529 1.00 0.00 N ATOM 215 CA ASN A 13 -2.761 1.862 -15.220 1.00 0.00 C ATOM 216 C ASN A 13 -1.626 2.166 -16.200 1.00 0.00 C ATOM 217 O ASN A 13 -1.857 2.742 -17.262 1.00 0.00 O ATOM 218 CB ASN A 13 -2.858 3.028 -14.234 1.00 0.00 C ATOM 219 CG ASN A 13 -3.328 4.303 -14.937 1.00 0.00 C ATOM 220 OD1 ASN A 13 -3.894 4.274 -16.018 1.00 0.00 O ATOM 221 ND2 ASN A 13 -3.063 5.420 -14.266 1.00 0.00 N ATOM 0 H ASN A 13 -2.711 0.617 -13.536 1.00 0.00 H new ATOM 0 HA ASN A 13 -3.711 1.750 -15.742 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -3.551 2.774 -13.432 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.886 3.200 -13.772 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -3.337 6.324 -14.652 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -2.586 5.373 -13.366 1.00 0.00 H new ATOM 228 N GLY A 14 -0.426 1.764 -15.809 1.00 0.00 N ATOM 229 CA GLY A 14 0.745 1.986 -16.640 1.00 0.00 C ATOM 230 C GLY A 14 1.680 0.775 -16.605 1.00 0.00 C ATOM 231 O GLY A 14 2.166 0.331 -17.644 1.00 0.00 O ATOM 0 H GLY A 14 -0.239 1.286 -14.928 1.00 0.00 H new ATOM 0 HA2 GLY A 14 0.435 2.181 -17.667 1.00 0.00 H new ATOM 0 HA3 GLY A 14 1.278 2.872 -16.294 1.00 0.00 H new ATOM 235 N GLY A 15 1.904 0.276 -15.398 1.00 0.00 N ATOM 236 CA GLY A 15 2.772 -0.874 -15.213 1.00 0.00 C ATOM 237 C GLY A 15 4.135 -0.450 -14.664 1.00 0.00 C ATOM 238 O GLY A 15 5.157 -0.628 -15.325 1.00 0.00 O ATOM 0 H GLY A 15 1.499 0.647 -14.539 1.00 0.00 H new ATOM 0 HA2 GLY A 15 2.304 -1.581 -14.528 1.00 0.00 H new ATOM 0 HA3 GLY A 15 2.904 -1.391 -16.163 1.00 0.00 H new ATOM 242 N HIS A 16 4.107 0.103 -13.460 1.00 0.00 N ATOM 243 CA HIS A 16 5.328 0.554 -12.815 1.00 0.00 C ATOM 244 C HIS A 16 5.239 0.294 -11.310 1.00 0.00 C ATOM 245 O HIS A 16 4.144 0.199 -10.756 1.00 0.00 O ATOM 246 CB HIS A 16 5.608 2.021 -13.147 1.00 0.00 C ATOM 247 CG HIS A 16 5.481 2.354 -14.614 1.00 0.00 C ATOM 248 ND1 HIS A 16 4.310 2.164 -15.327 1.00 0.00 N ATOM 249 CD2 HIS A 16 6.389 2.865 -15.494 1.00 0.00 C ATOM 250 CE1 HIS A 16 4.516 2.547 -16.579 1.00 0.00 C ATOM 251 NE2 HIS A 16 5.805 2.981 -16.680 1.00 0.00 N ATOM 0 H HIS A 16 3.258 0.249 -12.914 1.00 0.00 H new ATOM 0 HA HIS A 16 6.176 -0.013 -13.198 1.00 0.00 H new ATOM 0 HB2 HIS A 16 4.919 2.649 -12.582 1.00 0.00 H new ATOM 0 HB3 HIS A 16 6.615 2.272 -12.814 1.00 0.00 H new ATOM 0 HD2 HIS A 16 7.410 3.130 -15.265 1.00 0.00 H new ATOM 0 HE1 HIS A 16 3.791 2.520 -17.379 1.00 0.00 H new ATOM 0 HE2 HIS A 16 6.247 3.336 -17.528 1.00 0.00 H new ATOM 259 N PHE A 17 6.405 0.185 -10.690 1.00 0.00 N ATOM 260 CA PHE A 17 6.473 -0.063 -9.260 1.00 0.00 C ATOM 261 C PHE A 17 6.842 1.213 -8.500 1.00 0.00 C ATOM 262 O PHE A 17 7.641 2.016 -8.979 1.00 0.00 O ATOM 263 CB PHE A 17 7.567 -1.109 -9.039 1.00 0.00 C ATOM 264 CG PHE A 17 7.250 -2.478 -9.643 1.00 0.00 C ATOM 265 CD1 PHE A 17 5.966 -2.927 -9.675 1.00 0.00 C ATOM 266 CD2 PHE A 17 8.251 -3.247 -10.149 1.00 0.00 C ATOM 267 CE1 PHE A 17 5.672 -4.198 -10.236 1.00 0.00 C ATOM 268 CE2 PHE A 17 7.957 -4.518 -10.710 1.00 0.00 C ATOM 269 CZ PHE A 17 6.673 -4.966 -10.742 1.00 0.00 C ATOM 0 H PHE A 17 7.311 0.264 -11.152 1.00 0.00 H new ATOM 0 HA PHE A 17 5.504 -0.404 -8.895 1.00 0.00 H new ATOM 0 HB2 PHE A 17 8.499 -0.741 -9.468 1.00 0.00 H new ATOM 0 HB3 PHE A 17 7.733 -1.225 -7.968 1.00 0.00 H new ATOM 0 HD1 PHE A 17 5.170 -2.317 -9.274 1.00 0.00 H new ATOM 0 HD2 PHE A 17 9.270 -2.891 -10.124 1.00 0.00 H new ATOM 0 HE1 PHE A 17 4.653 -4.555 -10.261 1.00 0.00 H new ATOM 0 HE2 PHE A 17 8.752 -5.129 -11.111 1.00 0.00 H new ATOM 0 HZ PHE A 17 6.449 -5.932 -11.170 1.00 0.00 H new ATOM 279 N LEU A 18 6.243 1.359 -7.327 1.00 0.00 N ATOM 280 CA LEU A 18 6.499 2.522 -6.496 1.00 0.00 C ATOM 281 C LEU A 18 7.850 2.358 -5.798 1.00 0.00 C ATOM 282 O LEU A 18 8.087 1.358 -5.123 1.00 0.00 O ATOM 283 CB LEU A 18 5.334 2.759 -5.532 1.00 0.00 C ATOM 284 CG LEU A 18 5.184 4.185 -4.999 1.00 0.00 C ATOM 285 CD1 LEU A 18 4.676 5.128 -6.091 1.00 0.00 C ATOM 286 CD2 LEU A 18 4.292 4.215 -3.756 1.00 0.00 C ATOM 0 H LEU A 18 5.581 0.691 -6.933 1.00 0.00 H new ATOM 0 HA LEU A 18 6.564 3.421 -7.109 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.409 2.482 -6.037 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.448 2.085 -4.683 1.00 0.00 H new ATOM 0 HG LEU A 18 6.169 4.542 -4.698 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.578 6.135 -5.686 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.383 5.138 -6.921 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.705 4.784 -6.446 1.00 0.00 H new ATOM 0 HD21 LEU A 18 4.202 5.240 -3.397 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.304 3.831 -4.008 1.00 0.00 H new ATOM 0 HD23 LEU A 18 4.734 3.595 -2.976 1.00 0.00 H new ATOM 298 N ARG A 19 8.702 3.356 -5.985 1.00 0.00 N ATOM 299 CA ARG A 19 10.024 3.335 -5.382 1.00 0.00 C ATOM 300 C ARG A 19 10.288 4.644 -4.636 1.00 0.00 C ATOM 301 O ARG A 19 9.695 5.674 -4.953 1.00 0.00 O ATOM 302 CB ARG A 19 11.109 3.131 -6.441 1.00 0.00 C ATOM 303 CG ARG A 19 11.564 4.470 -7.024 1.00 0.00 C ATOM 304 CD ARG A 19 12.222 4.277 -8.392 1.00 0.00 C ATOM 305 NE ARG A 19 13.695 4.284 -8.251 1.00 0.00 N ATOM 306 CZ ARG A 19 14.545 4.532 -9.257 1.00 0.00 C ATOM 307 NH1 ARG A 19 14.073 4.794 -10.483 1.00 0.00 N ATOM 308 NH2 ARG A 19 15.867 4.517 -9.037 1.00 0.00 N ATOM 0 H ARG A 19 8.502 4.184 -6.546 1.00 0.00 H new ATOM 0 HA ARG A 19 10.056 2.501 -4.681 1.00 0.00 H new ATOM 0 HB2 ARG A 19 11.961 2.614 -5.999 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.728 2.493 -7.239 1.00 0.00 H new ATOM 0 HG2 ARG A 19 10.709 5.139 -7.119 1.00 0.00 H new ATOM 0 HG3 ARG A 19 12.268 4.947 -6.342 1.00 0.00 H new ATOM 0 HD2 ARG A 19 11.895 3.335 -8.832 1.00 0.00 H new ATOM 0 HD3 ARG A 19 11.910 5.071 -9.070 1.00 0.00 H new ATOM 0 HE ARG A 19 14.088 4.088 -7.330 1.00 0.00 H new ATOM 0 HH11 ARG A 19 13.067 4.805 -10.651 1.00 0.00 H new ATOM 0 HH12 ARG A 19 14.720 4.983 -11.249 1.00 0.00 H new ATOM 0 HH21 ARG A 19 16.226 4.317 -8.104 1.00 0.00 H new ATOM 0 HH22 ARG A 19 16.514 4.706 -9.803 1.00 0.00 H new ATOM 322 N ILE A 20 11.179 4.562 -3.659 1.00 0.00 N ATOM 323 CA ILE A 20 11.529 5.728 -2.866 1.00 0.00 C ATOM 324 C ILE A 20 13.043 5.944 -2.925 1.00 0.00 C ATOM 325 O ILE A 20 13.810 5.124 -2.424 1.00 0.00 O ATOM 326 CB ILE A 20 10.983 5.592 -1.443 1.00 0.00 C ATOM 327 CG1 ILE A 20 9.461 5.437 -1.453 1.00 0.00 C ATOM 328 CG2 ILE A 20 11.434 6.763 -0.568 1.00 0.00 C ATOM 329 CD1 ILE A 20 8.909 5.347 -0.029 1.00 0.00 C ATOM 0 H ILE A 20 11.669 3.706 -3.399 1.00 0.00 H new ATOM 0 HA ILE A 20 11.062 6.623 -3.278 1.00 0.00 H new ATOM 0 HB ILE A 20 11.397 4.684 -1.004 1.00 0.00 H new ATOM 0 HG12 ILE A 20 9.009 6.284 -1.969 1.00 0.00 H new ATOM 0 HG13 ILE A 20 9.187 4.541 -2.010 1.00 0.00 H new ATOM 0 HG21 ILE A 20 11.032 6.641 0.438 1.00 0.00 H new ATOM 0 HG22 ILE A 20 12.523 6.786 -0.523 1.00 0.00 H new ATOM 0 HG23 ILE A 20 11.069 7.697 -0.994 1.00 0.00 H new ATOM 0 HD11 ILE A 20 7.825 5.237 -0.065 1.00 0.00 H new ATOM 0 HD12 ILE A 20 9.344 4.485 0.476 1.00 0.00 H new ATOM 0 HD13 ILE A 20 9.164 6.255 0.518 1.00 0.00 H new ATOM 341 N LEU A 21 13.426 7.052 -3.542 1.00 0.00 N ATOM 342 CA LEU A 21 14.834 7.386 -3.673 1.00 0.00 C ATOM 343 C LEU A 21 15.380 7.820 -2.311 1.00 0.00 C ATOM 344 O LEU A 21 14.622 8.250 -1.443 1.00 0.00 O ATOM 345 CB LEU A 21 15.038 8.426 -4.776 1.00 0.00 C ATOM 346 CG LEU A 21 14.322 8.149 -6.100 1.00 0.00 C ATOM 347 CD1 LEU A 21 14.548 9.288 -7.095 1.00 0.00 C ATOM 348 CD2 LEU A 21 14.738 6.794 -6.675 1.00 0.00 C ATOM 0 H LEU A 21 12.786 7.730 -3.957 1.00 0.00 H new ATOM 0 HA LEU A 21 15.405 6.511 -3.982 1.00 0.00 H new ATOM 0 HB2 LEU A 21 14.705 9.394 -4.401 1.00 0.00 H new ATOM 0 HB3 LEU A 21 16.106 8.511 -4.974 1.00 0.00 H new ATOM 0 HG LEU A 21 13.251 8.101 -5.905 1.00 0.00 H new ATOM 0 HD11 LEU A 21 14.028 9.065 -8.027 1.00 0.00 H new ATOM 0 HD12 LEU A 21 14.162 10.218 -6.677 1.00 0.00 H new ATOM 0 HD13 LEU A 21 15.615 9.394 -7.291 1.00 0.00 H new ATOM 0 HD21 LEU A 21 14.215 6.622 -7.616 1.00 0.00 H new ATOM 0 HD22 LEU A 21 15.814 6.788 -6.852 1.00 0.00 H new ATOM 0 HD23 LEU A 21 14.482 6.005 -5.968 1.00 0.00 H new ATOM 360 N PRO A 22 16.726 7.688 -2.162 1.00 0.00 N ATOM 361 CA PRO A 22 17.382 8.062 -0.921 1.00 0.00 C ATOM 362 C PRO A 22 17.481 9.583 -0.789 1.00 0.00 C ATOM 363 O PRO A 22 17.924 10.093 0.239 1.00 0.00 O ATOM 364 CB PRO A 22 18.739 7.380 -0.973 1.00 0.00 C ATOM 365 CG PRO A 22 18.977 7.035 -2.434 1.00 0.00 C ATOM 366 CD PRO A 22 17.655 7.183 -3.169 1.00 0.00 C ATOM 0 HA PRO A 22 16.825 7.745 -0.039 1.00 0.00 H new ATOM 0 HB2 PRO A 22 19.521 8.038 -0.595 1.00 0.00 H new ATOM 0 HB3 PRO A 22 18.749 6.483 -0.353 1.00 0.00 H new ATOM 0 HG2 PRO A 22 19.729 7.696 -2.865 1.00 0.00 H new ATOM 0 HG3 PRO A 22 19.355 6.017 -2.529 1.00 0.00 H new ATOM 0 HD2 PRO A 22 17.743 7.873 -4.008 1.00 0.00 H new ATOM 0 HD3 PRO A 22 17.319 6.229 -3.575 1.00 0.00 H new ATOM 374 N ASP A 23 17.062 10.265 -1.845 1.00 0.00 N ATOM 375 CA ASP A 23 17.098 11.717 -1.860 1.00 0.00 C ATOM 376 C ASP A 23 15.755 12.262 -1.370 1.00 0.00 C ATOM 377 O ASP A 23 15.646 13.438 -1.027 1.00 0.00 O ATOM 378 CB ASP A 23 17.335 12.247 -3.276 1.00 0.00 C ATOM 379 CG ASP A 23 18.569 13.138 -3.434 1.00 0.00 C ATOM 380 OD1 ASP A 23 19.486 12.991 -2.597 1.00 0.00 O ATOM 381 OD2 ASP A 23 18.568 13.945 -4.389 1.00 0.00 O ATOM 0 H ASP A 23 16.696 9.839 -2.696 1.00 0.00 H new ATOM 0 HA ASP A 23 17.913 12.041 -1.212 1.00 0.00 H new ATOM 0 HB2 ASP A 23 17.428 11.399 -3.954 1.00 0.00 H new ATOM 0 HB3 ASP A 23 16.456 12.810 -3.589 1.00 0.00 H new ATOM 386 N GLY A 24 14.766 11.380 -1.354 1.00 0.00 N ATOM 387 CA GLY A 24 13.434 11.758 -0.911 1.00 0.00 C ATOM 388 C GLY A 24 12.501 11.973 -2.104 1.00 0.00 C ATOM 389 O GLY A 24 11.744 12.942 -2.139 1.00 0.00 O ATOM 0 H GLY A 24 14.860 10.406 -1.640 1.00 0.00 H new ATOM 0 HA2 GLY A 24 13.028 10.981 -0.263 1.00 0.00 H new ATOM 0 HA3 GLY A 24 13.489 12.671 -0.319 1.00 0.00 H new ATOM 393 N THR A 25 12.584 11.053 -3.054 1.00 0.00 N ATOM 394 CA THR A 25 11.756 11.129 -4.246 1.00 0.00 C ATOM 395 C THR A 25 10.958 9.836 -4.424 1.00 0.00 C ATOM 396 O THR A 25 11.424 8.759 -4.056 1.00 0.00 O ATOM 397 CB THR A 25 12.666 11.451 -5.433 1.00 0.00 C ATOM 398 OG1 THR A 25 12.947 12.840 -5.289 1.00 0.00 O ATOM 399 CG2 THR A 25 11.934 11.355 -6.774 1.00 0.00 C ATOM 0 H THR A 25 13.213 10.250 -3.022 1.00 0.00 H new ATOM 0 HA THR A 25 11.013 11.923 -4.163 1.00 0.00 H new ATOM 0 HB THR A 25 13.516 10.769 -5.434 1.00 0.00 H new ATOM 0 HG1 THR A 25 13.534 13.132 -6.018 1.00 0.00 H new ATOM 0 HG21 THR A 25 12.624 11.593 -7.583 1.00 0.00 H new ATOM 0 HG22 THR A 25 11.552 10.343 -6.908 1.00 0.00 H new ATOM 0 HG23 THR A 25 11.103 12.061 -6.786 1.00 0.00 H new ATOM 407 N VAL A 26 9.769 9.986 -4.989 1.00 0.00 N ATOM 408 CA VAL A 26 8.901 8.844 -5.221 1.00 0.00 C ATOM 409 C VAL A 26 8.431 8.854 -6.677 1.00 0.00 C ATOM 410 O VAL A 26 7.769 9.795 -7.112 1.00 0.00 O ATOM 411 CB VAL A 26 7.746 8.852 -4.219 1.00 0.00 C ATOM 412 CG1 VAL A 26 7.141 7.455 -4.067 1.00 0.00 C ATOM 413 CG2 VAL A 26 8.198 9.404 -2.865 1.00 0.00 C ATOM 0 H VAL A 26 9.386 10.881 -5.293 1.00 0.00 H new ATOM 0 HA VAL A 26 9.444 7.913 -5.061 1.00 0.00 H new ATOM 0 HB VAL A 26 6.971 9.512 -4.608 1.00 0.00 H new ATOM 0 HG11 VAL A 26 6.322 7.489 -3.349 1.00 0.00 H new ATOM 0 HG12 VAL A 26 6.764 7.115 -5.031 1.00 0.00 H new ATOM 0 HG13 VAL A 26 7.906 6.764 -3.712 1.00 0.00 H new ATOM 0 HG21 VAL A 26 7.358 9.399 -2.171 1.00 0.00 H new ATOM 0 HG22 VAL A 26 9.000 8.782 -2.468 1.00 0.00 H new ATOM 0 HG23 VAL A 26 8.559 10.425 -2.990 1.00 0.00 H new ATOM 423 N ASP A 27 8.790 7.796 -7.389 1.00 0.00 N ATOM 424 CA ASP A 27 8.413 7.671 -8.787 1.00 0.00 C ATOM 425 C ASP A 27 8.215 6.193 -9.127 1.00 0.00 C ATOM 426 O ASP A 27 8.692 5.317 -8.407 1.00 0.00 O ATOM 427 CB ASP A 27 9.505 8.226 -9.704 1.00 0.00 C ATOM 428 CG ASP A 27 10.441 9.244 -9.051 1.00 0.00 C ATOM 429 OD1 ASP A 27 9.930 10.317 -8.662 1.00 0.00 O ATOM 430 OD2 ASP A 27 11.647 8.928 -8.957 1.00 0.00 O ATOM 0 H ASP A 27 9.338 7.017 -7.024 1.00 0.00 H new ATOM 0 HA ASP A 27 7.493 8.235 -8.940 1.00 0.00 H new ATOM 0 HB2 ASP A 27 10.102 7.394 -10.078 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.031 8.692 -10.568 1.00 0.00 H new ATOM 435 N GLY A 28 7.511 5.960 -10.225 1.00 0.00 N ATOM 436 CA GLY A 28 7.244 4.603 -10.669 1.00 0.00 C ATOM 437 C GLY A 28 8.409 4.059 -11.499 1.00 0.00 C ATOM 438 O GLY A 28 9.078 4.811 -12.205 1.00 0.00 O ATOM 0 H GLY A 28 7.117 6.689 -10.820 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.077 3.960 -9.805 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.330 4.584 -11.262 1.00 0.00 H new ATOM 442 N THR A 29 8.617 2.755 -11.385 1.00 0.00 N ATOM 443 CA THR A 29 9.689 2.101 -12.115 1.00 0.00 C ATOM 444 C THR A 29 9.331 0.641 -12.396 1.00 0.00 C ATOM 445 O THR A 29 8.736 -0.029 -11.553 1.00 0.00 O ATOM 446 CB THR A 29 10.979 2.266 -11.309 1.00 0.00 C ATOM 447 OG1 THR A 29 12.015 2.070 -12.267 1.00 0.00 O ATOM 448 CG2 THR A 29 11.187 1.135 -10.299 1.00 0.00 C ATOM 0 H THR A 29 8.061 2.134 -10.798 1.00 0.00 H new ATOM 0 HA THR A 29 9.838 2.559 -13.093 1.00 0.00 H new ATOM 0 HB THR A 29 10.960 3.222 -10.785 1.00 0.00 H new ATOM 0 HG1 THR A 29 12.887 2.161 -11.829 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.116 1.300 -9.754 1.00 0.00 H new ATOM 0 HG22 THR A 29 10.353 1.116 -9.597 1.00 0.00 H new ATOM 0 HG23 THR A 29 11.240 0.182 -10.826 1.00 0.00 H new ATOM 456 N ARG A 30 9.708 0.190 -13.583 1.00 0.00 N ATOM 457 CA ARG A 30 9.433 -1.179 -13.986 1.00 0.00 C ATOM 458 C ARG A 30 10.716 -1.857 -14.470 1.00 0.00 C ATOM 459 O ARG A 30 10.679 -2.689 -15.376 1.00 0.00 O ATOM 460 CB ARG A 30 8.387 -1.226 -15.101 1.00 0.00 C ATOM 461 CG ARG A 30 8.309 0.113 -15.837 1.00 0.00 C ATOM 462 CD ARG A 30 7.615 -0.044 -17.191 1.00 0.00 C ATOM 463 NE ARG A 30 8.091 0.998 -18.128 1.00 0.00 N ATOM 464 CZ ARG A 30 9.249 0.933 -18.799 1.00 0.00 C ATOM 465 NH1 ARG A 30 10.056 -0.125 -18.641 1.00 0.00 N ATOM 466 NH2 ARG A 30 9.599 1.925 -19.629 1.00 0.00 N ATOM 0 H ARG A 30 10.202 0.748 -14.279 1.00 0.00 H new ATOM 0 HA ARG A 30 9.044 -1.709 -13.117 1.00 0.00 H new ATOM 0 HB2 ARG A 30 8.637 -2.018 -15.806 1.00 0.00 H new ATOM 0 HB3 ARG A 30 7.412 -1.471 -14.680 1.00 0.00 H new ATOM 0 HG2 ARG A 30 7.766 0.836 -15.228 1.00 0.00 H new ATOM 0 HG3 ARG A 30 9.313 0.510 -15.983 1.00 0.00 H new ATOM 0 HD2 ARG A 30 7.819 -1.033 -17.601 1.00 0.00 H new ATOM 0 HD3 ARG A 30 6.535 0.033 -17.066 1.00 0.00 H new ATOM 0 HE ARG A 30 7.500 1.817 -18.272 1.00 0.00 H new ATOM 0 HH11 ARG A 30 9.789 -0.881 -18.010 1.00 0.00 H new ATOM 0 HH12 ARG A 30 10.938 -0.175 -19.152 1.00 0.00 H new ATOM 0 HH21 ARG A 30 8.984 2.730 -19.750 1.00 0.00 H new ATOM 0 HH22 ARG A 30 10.481 1.876 -20.140 1.00 0.00 H new ATOM 480 N ASP A 31 11.821 -1.477 -13.845 1.00 0.00 N ATOM 481 CA ASP A 31 13.113 -2.039 -14.201 1.00 0.00 C ATOM 482 C ASP A 31 13.408 -3.240 -13.301 1.00 0.00 C ATOM 483 O ASP A 31 14.308 -4.028 -13.587 1.00 0.00 O ATOM 484 CB ASP A 31 14.232 -1.014 -14.004 1.00 0.00 C ATOM 485 CG ASP A 31 15.391 -1.123 -14.996 1.00 0.00 C ATOM 486 OD1 ASP A 31 15.371 -2.090 -15.789 1.00 0.00 O ATOM 487 OD2 ASP A 31 16.271 -0.237 -14.940 1.00 0.00 O ATOM 0 H ASP A 31 11.848 -0.787 -13.094 1.00 0.00 H new ATOM 0 HA ASP A 31 13.075 -2.335 -15.249 1.00 0.00 H new ATOM 0 HB2 ASP A 31 13.805 -0.014 -14.076 1.00 0.00 H new ATOM 0 HB3 ASP A 31 14.627 -1.120 -12.994 1.00 0.00 H new ATOM 492 N ARG A 32 12.632 -3.343 -12.232 1.00 0.00 N ATOM 493 CA ARG A 32 12.799 -4.435 -11.288 1.00 0.00 C ATOM 494 C ARG A 32 14.150 -4.322 -10.580 1.00 0.00 C ATOM 495 O ARG A 32 14.205 -4.189 -9.358 1.00 0.00 O ATOM 496 CB ARG A 32 12.711 -5.790 -11.993 1.00 0.00 C ATOM 497 CG ARG A 32 11.261 -6.270 -12.080 1.00 0.00 C ATOM 498 CD ARG A 32 11.150 -7.751 -11.714 1.00 0.00 C ATOM 499 NE ARG A 32 11.461 -8.589 -12.893 1.00 0.00 N ATOM 500 CZ ARG A 32 11.714 -9.904 -12.836 1.00 0.00 C ATOM 501 NH1 ARG A 32 11.695 -10.538 -11.656 1.00 0.00 N ATOM 502 NH2 ARG A 32 11.985 -10.584 -13.958 1.00 0.00 N ATOM 0 H ARG A 32 11.886 -2.688 -11.999 1.00 0.00 H new ATOM 0 HA ARG A 32 11.995 -4.367 -10.555 1.00 0.00 H new ATOM 0 HB2 ARG A 32 13.132 -5.710 -12.995 1.00 0.00 H new ATOM 0 HB3 ARG A 32 13.309 -6.524 -11.453 1.00 0.00 H new ATOM 0 HG2 ARG A 32 10.638 -5.678 -11.409 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.882 -6.112 -13.090 1.00 0.00 H new ATOM 0 HD2 ARG A 32 11.836 -7.985 -10.900 1.00 0.00 H new ATOM 0 HD3 ARG A 32 10.144 -7.971 -11.356 1.00 0.00 H new ATOM 0 HE ARG A 32 11.484 -8.137 -13.807 1.00 0.00 H new ATOM 0 HH11 ARG A 32 11.488 -10.020 -10.802 1.00 0.00 H new ATOM 0 HH12 ARG A 32 11.887 -11.539 -11.612 1.00 0.00 H new ATOM 0 HH21 ARG A 32 11.999 -10.101 -14.856 1.00 0.00 H new ATOM 0 HH22 ARG A 32 12.177 -11.585 -13.914 1.00 0.00 H new ATOM 516 N SER A 33 15.207 -4.381 -11.377 1.00 0.00 N ATOM 517 CA SER A 33 16.554 -4.287 -10.842 1.00 0.00 C ATOM 518 C SER A 33 16.576 -3.336 -9.644 1.00 0.00 C ATOM 519 O SER A 33 17.275 -3.584 -8.662 1.00 0.00 O ATOM 520 CB SER A 33 17.541 -3.817 -11.912 1.00 0.00 C ATOM 521 OG SER A 33 18.697 -4.647 -11.974 1.00 0.00 O ATOM 0 H SER A 33 15.157 -4.493 -12.390 1.00 0.00 H new ATOM 0 HA SER A 33 16.862 -5.280 -10.515 1.00 0.00 H new ATOM 0 HB2 SER A 33 17.047 -3.811 -12.883 1.00 0.00 H new ATOM 0 HB3 SER A 33 17.842 -2.791 -11.701 1.00 0.00 H new ATOM 0 HG SER A 33 19.301 -4.315 -12.670 1.00 0.00 H new ATOM 527 N ASP A 34 15.803 -2.267 -9.764 1.00 0.00 N ATOM 528 CA ASP A 34 15.726 -1.277 -8.703 1.00 0.00 C ATOM 529 C ASP A 34 15.592 -1.989 -7.355 1.00 0.00 C ATOM 530 O ASP A 34 14.937 -3.026 -7.259 1.00 0.00 O ATOM 531 CB ASP A 34 14.505 -0.372 -8.882 1.00 0.00 C ATOM 532 CG ASP A 34 14.824 1.107 -9.113 1.00 0.00 C ATOM 533 OD1 ASP A 34 15.217 1.763 -8.124 1.00 0.00 O ATOM 534 OD2 ASP A 34 14.669 1.547 -10.272 1.00 0.00 O ATOM 0 H ASP A 34 15.225 -2.065 -10.579 1.00 0.00 H new ATOM 0 HA ASP A 34 16.632 -0.673 -8.740 1.00 0.00 H new ATOM 0 HB2 ASP A 34 13.921 -0.738 -9.726 1.00 0.00 H new ATOM 0 HB3 ASP A 34 13.875 -0.458 -7.997 1.00 0.00 H new ATOM 539 N GLN A 35 16.224 -1.404 -6.348 1.00 0.00 N ATOM 540 CA GLN A 35 16.184 -1.970 -5.010 1.00 0.00 C ATOM 541 C GLN A 35 15.283 -1.127 -4.104 1.00 0.00 C ATOM 542 O GLN A 35 14.676 -1.647 -3.170 1.00 0.00 O ATOM 543 CB GLN A 35 17.591 -2.091 -4.424 1.00 0.00 C ATOM 544 CG GLN A 35 18.418 -3.124 -5.192 1.00 0.00 C ATOM 545 CD GLN A 35 19.886 -3.081 -4.763 1.00 0.00 C ATOM 546 OE1 GLN A 35 20.316 -3.778 -3.858 1.00 0.00 O ATOM 547 NE2 GLN A 35 20.629 -2.226 -5.461 1.00 0.00 N ATOM 0 H GLN A 35 16.766 -0.544 -6.432 1.00 0.00 H new ATOM 0 HA GLN A 35 15.765 -2.974 -5.074 1.00 0.00 H new ATOM 0 HB2 GLN A 35 18.088 -1.122 -4.460 1.00 0.00 H new ATOM 0 HB3 GLN A 35 17.528 -2.378 -3.374 1.00 0.00 H new ATOM 0 HG2 GLN A 35 18.014 -4.121 -5.018 1.00 0.00 H new ATOM 0 HG3 GLN A 35 18.343 -2.932 -6.262 1.00 0.00 H new ATOM 0 HE21 GLN A 35 20.206 -1.673 -6.206 1.00 0.00 H new ATOM 0 HE22 GLN A 35 21.622 -2.124 -5.251 1.00 0.00 H new ATOM 556 N HIS A 36 15.225 0.160 -4.413 1.00 0.00 N ATOM 557 CA HIS A 36 14.410 1.080 -3.639 1.00 0.00 C ATOM 558 C HIS A 36 12.935 0.694 -3.771 1.00 0.00 C ATOM 559 O HIS A 36 12.122 1.030 -2.912 1.00 0.00 O ATOM 560 CB HIS A 36 14.683 2.528 -4.051 1.00 0.00 C ATOM 561 CG HIS A 36 16.106 2.784 -4.487 1.00 0.00 C ATOM 562 ND1 HIS A 36 16.588 2.409 -5.729 1.00 0.00 N ATOM 563 CD2 HIS A 36 17.144 3.381 -3.835 1.00 0.00 C ATOM 564 CE1 HIS A 36 17.860 2.769 -5.809 1.00 0.00 C ATOM 565 NE2 HIS A 36 18.203 3.371 -4.634 1.00 0.00 N ATOM 0 H HIS A 36 15.730 0.587 -5.190 1.00 0.00 H new ATOM 0 HA HIS A 36 14.676 1.008 -2.584 1.00 0.00 H new ATOM 0 HB2 HIS A 36 14.010 2.796 -4.866 1.00 0.00 H new ATOM 0 HB3 HIS A 36 14.447 3.184 -3.213 1.00 0.00 H new ATOM 0 HD1 HIS A 36 16.054 1.936 -6.458 1.00 0.00 H new ATOM 0 HD2 HIS A 36 17.110 3.792 -2.837 1.00 0.00 H new ATOM 0 HE1 HIS A 36 18.512 2.613 -6.656 1.00 0.00 H new ATOM 573 N ILE A 37 12.635 -0.007 -4.855 1.00 0.00 N ATOM 574 CA ILE A 37 11.272 -0.442 -5.111 1.00 0.00 C ATOM 575 C ILE A 37 10.864 -1.473 -4.056 1.00 0.00 C ATOM 576 O ILE A 37 9.687 -1.584 -3.715 1.00 0.00 O ATOM 577 CB ILE A 37 11.132 -0.946 -6.549 1.00 0.00 C ATOM 578 CG1 ILE A 37 12.017 -2.170 -6.790 1.00 0.00 C ATOM 579 CG2 ILE A 37 11.417 0.174 -7.552 1.00 0.00 C ATOM 580 CD1 ILE A 37 11.631 -2.878 -8.090 1.00 0.00 C ATOM 0 H ILE A 37 13.312 -0.284 -5.566 1.00 0.00 H new ATOM 0 HA ILE A 37 10.581 0.397 -5.022 1.00 0.00 H new ATOM 0 HB ILE A 37 10.100 -1.261 -6.702 1.00 0.00 H new ATOM 0 HG12 ILE A 37 13.062 -1.864 -6.835 1.00 0.00 H new ATOM 0 HG13 ILE A 37 11.923 -2.862 -5.953 1.00 0.00 H new ATOM 0 HG21 ILE A 37 11.311 -0.210 -8.566 1.00 0.00 H new ATOM 0 HG22 ILE A 37 10.711 0.990 -7.397 1.00 0.00 H new ATOM 0 HG23 ILE A 37 12.433 0.542 -7.408 1.00 0.00 H new ATOM 0 HD11 ILE A 37 12.275 -3.745 -8.238 1.00 0.00 H new ATOM 0 HD12 ILE A 37 10.592 -3.204 -8.032 1.00 0.00 H new ATOM 0 HD13 ILE A 37 11.750 -2.191 -8.928 1.00 0.00 H new ATOM 592 N GLN A 38 11.859 -2.200 -3.569 1.00 0.00 N ATOM 593 CA GLN A 38 11.618 -3.217 -2.561 1.00 0.00 C ATOM 594 C GLN A 38 11.185 -2.568 -1.244 1.00 0.00 C ATOM 595 O GLN A 38 12.006 -2.359 -0.352 1.00 0.00 O ATOM 596 CB GLN A 38 12.855 -4.094 -2.359 1.00 0.00 C ATOM 597 CG GLN A 38 12.937 -5.182 -3.431 1.00 0.00 C ATOM 598 CD GLN A 38 13.685 -6.411 -2.910 1.00 0.00 C ATOM 599 OE1 GLN A 38 13.922 -6.568 -1.723 1.00 0.00 O ATOM 600 NE2 GLN A 38 14.043 -7.270 -3.860 1.00 0.00 N ATOM 0 H GLN A 38 12.834 -2.104 -3.854 1.00 0.00 H new ATOM 0 HA GLN A 38 10.810 -3.861 -2.909 1.00 0.00 H new ATOM 0 HB2 GLN A 38 13.752 -3.476 -2.393 1.00 0.00 H new ATOM 0 HB3 GLN A 38 12.822 -4.554 -1.371 1.00 0.00 H new ATOM 0 HG2 GLN A 38 11.932 -5.468 -3.741 1.00 0.00 H new ATOM 0 HG3 GLN A 38 13.444 -4.791 -4.313 1.00 0.00 H new ATOM 0 HE21 GLN A 38 13.813 -7.077 -4.835 1.00 0.00 H new ATOM 0 HE22 GLN A 38 14.548 -8.122 -3.614 1.00 0.00 H new ATOM 609 N LEU A 39 9.898 -2.266 -1.165 1.00 0.00 N ATOM 610 CA LEU A 39 9.347 -1.645 0.027 1.00 0.00 C ATOM 611 C LEU A 39 8.734 -2.723 0.923 1.00 0.00 C ATOM 612 O LEU A 39 8.208 -3.720 0.429 1.00 0.00 O ATOM 613 CB LEU A 39 8.368 -0.532 -0.352 1.00 0.00 C ATOM 614 CG LEU A 39 8.884 0.502 -1.355 1.00 0.00 C ATOM 615 CD1 LEU A 39 7.773 1.469 -1.768 1.00 0.00 C ATOM 616 CD2 LEU A 39 10.108 1.237 -0.805 1.00 0.00 C ATOM 0 H LEU A 39 9.220 -2.440 -1.907 1.00 0.00 H new ATOM 0 HA LEU A 39 10.136 -1.162 0.603 1.00 0.00 H new ATOM 0 HB2 LEU A 39 7.469 -0.991 -0.763 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.072 -0.010 0.558 1.00 0.00 H new ATOM 0 HG LEU A 39 9.202 -0.025 -2.254 1.00 0.00 H new ATOM 0 HD11 LEU A 39 8.167 2.193 -2.481 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.958 0.911 -2.230 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.401 1.993 -0.888 1.00 0.00 H new ATOM 0 HD21 LEU A 39 10.454 1.966 -1.538 1.00 0.00 H new ATOM 0 HD22 LEU A 39 9.840 1.750 0.118 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.903 0.519 -0.603 1.00 0.00 H new ATOM 628 N GLN A 40 8.821 -2.488 2.223 1.00 0.00 N ATOM 629 CA GLN A 40 8.282 -3.427 3.192 1.00 0.00 C ATOM 630 C GLN A 40 6.981 -2.885 3.788 1.00 0.00 C ATOM 631 O GLN A 40 6.987 -1.869 4.481 1.00 0.00 O ATOM 632 CB GLN A 40 9.304 -3.729 4.290 1.00 0.00 C ATOM 633 CG GLN A 40 9.846 -2.438 4.906 1.00 0.00 C ATOM 634 CD GLN A 40 9.818 -2.506 6.435 1.00 0.00 C ATOM 635 OE1 GLN A 40 10.837 -2.612 7.096 1.00 0.00 O ATOM 636 NE2 GLN A 40 8.596 -2.439 6.957 1.00 0.00 N ATOM 0 H GLN A 40 9.257 -1.660 2.629 1.00 0.00 H new ATOM 0 HA GLN A 40 8.062 -4.363 2.679 1.00 0.00 H new ATOM 0 HB2 GLN A 40 8.840 -4.339 5.065 1.00 0.00 H new ATOM 0 HB3 GLN A 40 10.127 -4.312 3.875 1.00 0.00 H new ATOM 0 HG2 GLN A 40 10.867 -2.269 4.565 1.00 0.00 H new ATOM 0 HG3 GLN A 40 9.251 -1.591 4.565 1.00 0.00 H new ATOM 0 HE21 GLN A 40 7.784 -2.351 6.346 1.00 0.00 H new ATOM 0 HE22 GLN A 40 8.471 -2.476 7.969 1.00 0.00 H new ATOM 645 N LEU A 41 5.896 -3.589 3.497 1.00 0.00 N ATOM 646 CA LEU A 41 4.591 -3.192 3.996 1.00 0.00 C ATOM 647 C LEU A 41 4.319 -3.902 5.323 1.00 0.00 C ATOM 648 O LEU A 41 4.585 -5.095 5.459 1.00 0.00 O ATOM 649 CB LEU A 41 3.515 -3.437 2.936 1.00 0.00 C ATOM 650 CG LEU A 41 3.453 -2.420 1.795 1.00 0.00 C ATOM 651 CD1 LEU A 41 4.823 -1.781 1.555 1.00 0.00 C ATOM 652 CD2 LEU A 41 2.887 -3.055 0.523 1.00 0.00 C ATOM 0 H LEU A 41 5.895 -4.432 2.922 1.00 0.00 H new ATOM 0 HA LEU A 41 4.570 -2.121 4.197 1.00 0.00 H new ATOM 0 HB2 LEU A 41 3.675 -4.426 2.506 1.00 0.00 H new ATOM 0 HB3 LEU A 41 2.544 -3.458 3.431 1.00 0.00 H new ATOM 0 HG LEU A 41 2.771 -1.621 2.087 1.00 0.00 H new ATOM 0 HD11 LEU A 41 4.751 -1.062 0.739 1.00 0.00 H new ATOM 0 HD12 LEU A 41 5.150 -1.270 2.461 1.00 0.00 H new ATOM 0 HD13 LEU A 41 5.545 -2.555 1.294 1.00 0.00 H new ATOM 0 HD21 LEU A 41 2.854 -2.310 -0.272 1.00 0.00 H new ATOM 0 HD22 LEU A 41 3.524 -3.885 0.216 1.00 0.00 H new ATOM 0 HD23 LEU A 41 1.880 -3.423 0.717 1.00 0.00 H new ATOM 664 N SER A 42 3.793 -3.138 6.270 1.00 0.00 N ATOM 665 CA SER A 42 3.482 -3.680 7.582 1.00 0.00 C ATOM 666 C SER A 42 2.100 -3.201 8.031 1.00 0.00 C ATOM 667 O SER A 42 1.577 -2.221 7.504 1.00 0.00 O ATOM 668 CB SER A 42 4.543 -3.278 8.608 1.00 0.00 C ATOM 669 OG SER A 42 5.863 -3.398 8.086 1.00 0.00 O ATOM 0 H SER A 42 3.575 -2.148 6.155 1.00 0.00 H new ATOM 0 HA SER A 42 3.477 -4.768 7.512 1.00 0.00 H new ATOM 0 HB2 SER A 42 4.370 -2.249 8.924 1.00 0.00 H new ATOM 0 HB3 SER A 42 4.446 -3.904 9.495 1.00 0.00 H new ATOM 0 HG SER A 42 6.511 -3.131 8.771 1.00 0.00 H new ATOM 675 N ALA A 43 1.549 -3.915 9.002 1.00 0.00 N ATOM 676 CA ALA A 43 0.238 -3.576 9.529 1.00 0.00 C ATOM 677 C ALA A 43 0.368 -3.203 11.007 1.00 0.00 C ATOM 678 O ALA A 43 0.925 -3.965 11.796 1.00 0.00 O ATOM 679 CB ALA A 43 -0.722 -4.746 9.304 1.00 0.00 C ATOM 0 H ALA A 43 1.987 -4.727 9.437 1.00 0.00 H new ATOM 0 HA ALA A 43 -0.174 -2.713 9.007 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.705 -4.491 9.700 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -0.802 -4.951 8.236 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -0.343 -5.631 9.816 1.00 0.00 H new ATOM 685 N GLU A 44 -0.156 -2.032 11.337 1.00 0.00 N ATOM 686 CA GLU A 44 -0.105 -1.549 12.707 1.00 0.00 C ATOM 687 C GLU A 44 -1.495 -1.612 13.344 1.00 0.00 C ATOM 688 O GLU A 44 -1.641 -2.061 14.480 1.00 0.00 O ATOM 689 CB GLU A 44 0.461 -0.129 12.767 1.00 0.00 C ATOM 690 CG GLU A 44 -0.272 0.710 13.816 1.00 0.00 C ATOM 691 CD GLU A 44 0.592 1.883 14.281 1.00 0.00 C ATOM 692 OE1 GLU A 44 1.795 1.642 14.524 1.00 0.00 O ATOM 693 OE2 GLU A 44 0.031 2.996 14.384 1.00 0.00 O ATOM 0 H GLU A 44 -0.618 -1.403 10.680 1.00 0.00 H new ATOM 0 HA GLU A 44 0.564 -2.196 13.275 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.524 -0.167 13.005 1.00 0.00 H new ATOM 0 HB3 GLU A 44 0.370 0.344 11.789 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -1.207 1.085 13.399 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -0.532 0.085 14.670 1.00 0.00 H new ATOM 700 N SER A 45 -2.481 -1.157 12.584 1.00 0.00 N ATOM 701 CA SER A 45 -3.853 -1.157 13.060 1.00 0.00 C ATOM 702 C SER A 45 -4.765 -1.826 12.029 1.00 0.00 C ATOM 703 O SER A 45 -4.352 -2.072 10.897 1.00 0.00 O ATOM 704 CB SER A 45 -4.335 0.266 13.349 1.00 0.00 C ATOM 705 OG SER A 45 -3.280 1.104 13.813 1.00 0.00 O ATOM 0 H SER A 45 -2.356 -0.786 11.642 1.00 0.00 H new ATOM 0 HA SER A 45 -3.892 -1.722 13.991 1.00 0.00 H new ATOM 0 HB2 SER A 45 -4.766 0.694 12.444 1.00 0.00 H new ATOM 0 HB3 SER A 45 -5.128 0.235 14.096 1.00 0.00 H new ATOM 0 HG SER A 45 -3.323 1.969 13.354 1.00 0.00 H new ATOM 711 N VAL A 46 -5.988 -2.102 12.458 1.00 0.00 N ATOM 712 CA VAL A 46 -6.961 -2.738 11.587 1.00 0.00 C ATOM 713 C VAL A 46 -7.217 -1.841 10.375 1.00 0.00 C ATOM 714 O VAL A 46 -7.598 -0.681 10.527 1.00 0.00 O ATOM 715 CB VAL A 46 -8.234 -3.061 12.372 1.00 0.00 C ATOM 716 CG1 VAL A 46 -9.392 -3.390 11.427 1.00 0.00 C ATOM 717 CG2 VAL A 46 -7.992 -4.203 13.362 1.00 0.00 C ATOM 0 H VAL A 46 -6.327 -1.897 13.398 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.576 -3.687 11.213 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.510 -2.175 12.944 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -10.285 -3.616 12.010 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -9.588 -2.535 10.780 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -9.129 -4.254 10.817 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -8.912 -4.413 13.907 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -7.680 -5.095 12.819 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -7.211 -3.915 14.066 1.00 0.00 H new ATOM 727 N GLY A 47 -6.999 -2.411 9.199 1.00 0.00 N ATOM 728 CA GLY A 47 -7.202 -1.677 7.962 1.00 0.00 C ATOM 729 C GLY A 47 -6.104 -0.631 7.758 1.00 0.00 C ATOM 730 O GLY A 47 -6.193 0.200 6.856 1.00 0.00 O ATOM 0 H GLY A 47 -6.684 -3.373 9.077 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.210 -2.370 7.121 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.176 -1.188 7.981 1.00 0.00 H new ATOM 734 N GLU A 48 -5.093 -0.708 8.611 1.00 0.00 N ATOM 735 CA GLU A 48 -3.979 0.222 8.536 1.00 0.00 C ATOM 736 C GLU A 48 -2.694 -0.519 8.160 1.00 0.00 C ATOM 737 O GLU A 48 -2.403 -1.581 8.708 1.00 0.00 O ATOM 738 CB GLU A 48 -3.808 0.981 9.854 1.00 0.00 C ATOM 739 CG GLU A 48 -4.925 2.008 10.043 1.00 0.00 C ATOM 740 CD GLU A 48 -4.414 3.244 10.786 1.00 0.00 C ATOM 741 OE1 GLU A 48 -4.191 3.119 12.009 1.00 0.00 O ATOM 742 OE2 GLU A 48 -4.256 4.286 10.113 1.00 0.00 O ATOM 0 H GLU A 48 -5.022 -1.400 9.357 1.00 0.00 H new ATOM 0 HA GLU A 48 -4.195 0.955 7.758 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -3.811 0.277 10.686 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -2.841 1.484 9.866 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -5.322 2.302 9.071 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -5.747 1.558 10.600 1.00 0.00 H new ATOM 749 N VAL A 49 -1.961 0.070 7.227 1.00 0.00 N ATOM 750 CA VAL A 49 -0.714 -0.521 6.771 1.00 0.00 C ATOM 751 C VAL A 49 0.346 0.574 6.636 1.00 0.00 C ATOM 752 O VAL A 49 0.022 1.721 6.331 1.00 0.00 O ATOM 753 CB VAL A 49 -0.946 -1.292 5.470 1.00 0.00 C ATOM 754 CG1 VAL A 49 -2.139 -2.241 5.600 1.00 0.00 C ATOM 755 CG2 VAL A 49 -1.132 -0.335 4.291 1.00 0.00 C ATOM 0 H VAL A 49 -2.206 0.950 6.774 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.344 -1.242 7.500 1.00 0.00 H new ATOM 0 HB VAL A 49 -0.059 -1.895 5.275 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -2.282 -2.777 4.661 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -1.950 -2.956 6.401 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -3.037 -1.667 5.831 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -1.295 -0.909 3.379 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -1.994 0.306 4.475 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.240 0.280 4.178 1.00 0.00 H new ATOM 765 N TYR A 50 1.589 0.182 6.871 1.00 0.00 N ATOM 766 CA TYR A 50 2.698 1.117 6.779 1.00 0.00 C ATOM 767 C TYR A 50 3.672 0.705 5.673 1.00 0.00 C ATOM 768 O TYR A 50 4.075 -0.454 5.595 1.00 0.00 O ATOM 769 CB TYR A 50 3.419 1.049 8.127 1.00 0.00 C ATOM 770 CG TYR A 50 3.104 2.220 9.060 1.00 0.00 C ATOM 771 CD1 TYR A 50 3.344 3.515 8.648 1.00 0.00 C ATOM 772 CD2 TYR A 50 2.580 1.981 10.315 1.00 0.00 C ATOM 773 CE1 TYR A 50 3.048 4.617 9.526 1.00 0.00 C ATOM 774 CE2 TYR A 50 2.284 3.084 11.193 1.00 0.00 C ATOM 775 CZ TYR A 50 2.533 4.347 10.755 1.00 0.00 C ATOM 776 OH TYR A 50 2.253 5.388 11.584 1.00 0.00 O ATOM 0 H TYR A 50 1.853 -0.770 7.125 1.00 0.00 H new ATOM 0 HA TYR A 50 2.337 2.119 6.547 1.00 0.00 H new ATOM 0 HB2 TYR A 50 3.149 0.118 8.625 1.00 0.00 H new ATOM 0 HB3 TYR A 50 4.494 1.017 7.951 1.00 0.00 H new ATOM 0 HD1 TYR A 50 3.754 3.702 7.667 1.00 0.00 H new ATOM 0 HD2 TYR A 50 2.392 0.968 10.638 1.00 0.00 H new ATOM 0 HE1 TYR A 50 3.231 5.635 9.215 1.00 0.00 H new ATOM 0 HE2 TYR A 50 1.874 2.912 12.177 1.00 0.00 H new ATOM 0 HH TYR A 50 1.890 5.046 12.427 1.00 0.00 H new ATOM 786 N ILE A 51 4.021 1.678 4.845 1.00 0.00 N ATOM 787 CA ILE A 51 4.940 1.432 3.746 1.00 0.00 C ATOM 788 C ILE A 51 6.284 2.096 4.053 1.00 0.00 C ATOM 789 O ILE A 51 6.352 3.309 4.245 1.00 0.00 O ATOM 790 CB ILE A 51 4.322 1.879 2.420 1.00 0.00 C ATOM 791 CG1 ILE A 51 2.856 1.452 2.327 1.00 0.00 C ATOM 792 CG2 ILE A 51 5.143 1.372 1.233 1.00 0.00 C ATOM 793 CD1 ILE A 51 2.172 2.097 1.120 1.00 0.00 C ATOM 0 H ILE A 51 3.684 2.638 4.913 1.00 0.00 H new ATOM 0 HA ILE A 51 5.128 0.364 3.639 1.00 0.00 H new ATOM 0 HB ILE A 51 4.343 2.968 2.384 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.794 0.367 2.247 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.333 1.735 3.240 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.681 1.704 0.303 1.00 0.00 H new ATOM 0 HG22 ILE A 51 6.157 1.767 1.296 1.00 0.00 H new ATOM 0 HG23 ILE A 51 5.177 0.283 1.253 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.131 1.777 1.078 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.214 3.182 1.215 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.683 1.792 0.207 1.00 0.00 H new ATOM 805 N LYS A 52 7.321 1.272 4.088 1.00 0.00 N ATOM 806 CA LYS A 52 8.659 1.763 4.368 1.00 0.00 C ATOM 807 C LYS A 52 9.651 1.106 3.406 1.00 0.00 C ATOM 808 O LYS A 52 9.474 -0.049 3.020 1.00 0.00 O ATOM 809 CB LYS A 52 9.007 1.560 5.844 1.00 0.00 C ATOM 810 CG LYS A 52 10.428 2.041 6.143 1.00 0.00 C ATOM 811 CD LYS A 52 10.907 1.525 7.502 1.00 0.00 C ATOM 812 CE LYS A 52 12.204 0.726 7.358 1.00 0.00 C ATOM 813 NZ LYS A 52 12.759 0.396 8.690 1.00 0.00 N ATOM 0 H LYS A 52 7.261 0.267 3.927 1.00 0.00 H new ATOM 0 HA LYS A 52 8.713 2.838 4.197 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.297 2.103 6.467 1.00 0.00 H new ATOM 0 HB3 LYS A 52 8.915 0.505 6.101 1.00 0.00 H new ATOM 0 HG2 LYS A 52 11.104 1.697 5.360 1.00 0.00 H new ATOM 0 HG3 LYS A 52 10.457 3.131 6.133 1.00 0.00 H new ATOM 0 HD2 LYS A 52 11.066 2.365 8.179 1.00 0.00 H new ATOM 0 HD3 LYS A 52 10.136 0.897 7.949 1.00 0.00 H new ATOM 0 HE2 LYS A 52 12.014 -0.190 6.799 1.00 0.00 H new ATOM 0 HE3 LYS A 52 12.932 1.302 6.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 13.639 -0.146 8.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 12.959 1.274 9.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 12.069 -0.172 9.222 1.00 0.00 H new ATOM 827 N SER A 53 10.673 1.869 3.047 1.00 0.00 N ATOM 828 CA SER A 53 11.693 1.375 2.138 1.00 0.00 C ATOM 829 C SER A 53 12.735 0.565 2.911 1.00 0.00 C ATOM 830 O SER A 53 13.224 1.007 3.950 1.00 0.00 O ATOM 831 CB SER A 53 12.365 2.526 1.386 1.00 0.00 C ATOM 832 OG SER A 53 12.905 2.104 0.137 1.00 0.00 O ATOM 0 H SER A 53 10.816 2.826 3.369 1.00 0.00 H new ATOM 0 HA SER A 53 11.213 0.729 1.403 1.00 0.00 H new ATOM 0 HB2 SER A 53 11.639 3.321 1.217 1.00 0.00 H new ATOM 0 HB3 SER A 53 13.160 2.946 2.002 1.00 0.00 H new ATOM 0 HG SER A 53 13.324 2.867 -0.313 1.00 0.00 H new ATOM 838 N THR A 54 13.045 -0.606 2.375 1.00 0.00 N ATOM 839 CA THR A 54 14.021 -1.482 3.002 1.00 0.00 C ATOM 840 C THR A 54 15.439 -1.076 2.597 1.00 0.00 C ATOM 841 O THR A 54 16.409 -1.461 3.248 1.00 0.00 O ATOM 842 CB THR A 54 13.671 -2.924 2.629 1.00 0.00 C ATOM 843 OG1 THR A 54 13.890 -2.982 1.223 1.00 0.00 O ATOM 844 CG2 THR A 54 12.178 -3.223 2.787 1.00 0.00 C ATOM 0 H THR A 54 12.638 -0.969 1.513 1.00 0.00 H new ATOM 0 HA THR A 54 13.990 -1.396 4.088 1.00 0.00 H new ATOM 0 HB THR A 54 14.247 -3.610 3.251 1.00 0.00 H new ATOM 0 HG1 THR A 54 13.028 -3.000 0.758 1.00 0.00 H new ATOM 0 HG21 THR A 54 11.983 -4.259 2.510 1.00 0.00 H new ATOM 0 HG22 THR A 54 11.883 -3.063 3.824 1.00 0.00 H new ATOM 0 HG23 THR A 54 11.604 -2.560 2.140 1.00 0.00 H new ATOM 852 N GLU A 55 15.515 -0.305 1.522 1.00 0.00 N ATOM 853 CA GLU A 55 16.799 0.157 1.022 1.00 0.00 C ATOM 854 C GLU A 55 17.268 1.380 1.812 1.00 0.00 C ATOM 855 O GLU A 55 18.148 1.273 2.664 1.00 0.00 O ATOM 856 CB GLU A 55 16.725 0.466 -0.475 1.00 0.00 C ATOM 857 CG GLU A 55 18.059 1.013 -0.988 1.00 0.00 C ATOM 858 CD GLU A 55 19.074 -0.115 -1.186 1.00 0.00 C ATOM 859 OE1 GLU A 55 19.015 -1.077 -0.391 1.00 0.00 O ATOM 860 OE2 GLU A 55 19.884 0.011 -2.130 1.00 0.00 O ATOM 0 H GLU A 55 14.709 0.011 0.983 1.00 0.00 H new ATOM 0 HA GLU A 55 17.529 -0.641 1.159 1.00 0.00 H new ATOM 0 HB2 GLU A 55 16.463 -0.438 -1.024 1.00 0.00 H new ATOM 0 HB3 GLU A 55 15.934 1.192 -0.661 1.00 0.00 H new ATOM 0 HG2 GLU A 55 17.903 1.536 -1.931 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.454 1.742 -0.280 1.00 0.00 H new ATOM 867 N THR A 56 16.658 2.515 1.502 1.00 0.00 N ATOM 868 CA THR A 56 17.003 3.757 2.172 1.00 0.00 C ATOM 869 C THR A 56 16.589 3.701 3.644 1.00 0.00 C ATOM 870 O THR A 56 17.438 3.751 4.533 1.00 0.00 O ATOM 871 CB THR A 56 16.350 4.907 1.402 1.00 0.00 C ATOM 872 OG1 THR A 56 14.955 4.728 1.627 1.00 0.00 O ATOM 873 CG2 THR A 56 16.505 4.758 -0.113 1.00 0.00 C ATOM 0 H THR A 56 15.927 2.600 0.796 1.00 0.00 H new ATOM 0 HA THR A 56 18.081 3.918 2.175 1.00 0.00 H new ATOM 0 HB THR A 56 16.788 5.853 1.721 1.00 0.00 H new ATOM 0 HG1 THR A 56 14.456 5.433 1.164 1.00 0.00 H new ATOM 0 HG21 THR A 56 16.024 5.599 -0.612 1.00 0.00 H new ATOM 0 HG22 THR A 56 17.564 4.740 -0.370 1.00 0.00 H new ATOM 0 HG23 THR A 56 16.037 3.828 -0.437 1.00 0.00 H new ATOM 881 N GLY A 57 15.286 3.597 3.856 1.00 0.00 N ATOM 882 CA GLY A 57 14.750 3.533 5.205 1.00 0.00 C ATOM 883 C GLY A 57 13.564 4.486 5.370 1.00 0.00 C ATOM 884 O GLY A 57 12.747 4.316 6.273 1.00 0.00 O ATOM 0 H GLY A 57 14.585 3.555 3.116 1.00 0.00 H new ATOM 0 HA2 GLY A 57 14.435 2.513 5.427 1.00 0.00 H new ATOM 0 HA3 GLY A 57 15.530 3.789 5.922 1.00 0.00 H new ATOM 888 N GLN A 58 13.508 5.469 4.483 1.00 0.00 N ATOM 889 CA GLN A 58 12.436 6.449 4.518 1.00 0.00 C ATOM 890 C GLN A 58 11.076 5.751 4.465 1.00 0.00 C ATOM 891 O GLN A 58 11.003 4.523 4.492 1.00 0.00 O ATOM 892 CB GLN A 58 12.579 7.459 3.378 1.00 0.00 C ATOM 893 CG GLN A 58 13.876 8.260 3.514 1.00 0.00 C ATOM 894 CD GLN A 58 14.817 7.983 2.340 1.00 0.00 C ATOM 895 OE1 GLN A 58 16.012 7.795 2.500 1.00 0.00 O ATOM 896 NE2 GLN A 58 14.214 7.968 1.155 1.00 0.00 N ATOM 0 H GLN A 58 14.188 5.608 3.736 1.00 0.00 H new ATOM 0 HA GLN A 58 12.504 6.999 5.457 1.00 0.00 H new ATOM 0 HB2 GLN A 58 12.569 6.937 2.421 1.00 0.00 H new ATOM 0 HB3 GLN A 58 11.726 8.138 3.380 1.00 0.00 H new ATOM 0 HG2 GLN A 58 13.647 9.325 3.558 1.00 0.00 H new ATOM 0 HG3 GLN A 58 14.371 8.002 4.450 1.00 0.00 H new ATOM 0 HE21 GLN A 58 13.209 8.133 1.092 1.00 0.00 H new ATOM 0 HE22 GLN A 58 14.756 7.791 0.309 1.00 0.00 H new ATOM 905 N TYR A 59 10.032 6.563 4.391 1.00 0.00 N ATOM 906 CA TYR A 59 8.678 6.038 4.333 1.00 0.00 C ATOM 907 C TYR A 59 7.883 6.696 3.204 1.00 0.00 C ATOM 908 O TYR A 59 8.360 7.635 2.569 1.00 0.00 O ATOM 909 CB TYR A 59 8.030 6.396 5.672 1.00 0.00 C ATOM 910 CG TYR A 59 8.662 5.695 6.877 1.00 0.00 C ATOM 911 CD1 TYR A 59 8.263 4.419 7.219 1.00 0.00 C ATOM 912 CD2 TYR A 59 9.630 6.338 7.620 1.00 0.00 C ATOM 913 CE1 TYR A 59 8.857 3.759 8.353 1.00 0.00 C ATOM 914 CE2 TYR A 59 10.225 5.678 8.754 1.00 0.00 C ATOM 915 CZ TYR A 59 9.809 4.421 9.064 1.00 0.00 C ATOM 916 OH TYR A 59 10.370 3.797 10.134 1.00 0.00 O ATOM 0 H TYR A 59 10.096 7.581 4.370 1.00 0.00 H new ATOM 0 HA TYR A 59 8.690 4.964 4.148 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.093 7.474 5.818 1.00 0.00 H new ATOM 0 HB3 TYR A 59 6.971 6.141 5.631 1.00 0.00 H new ATOM 0 HD1 TYR A 59 7.506 3.915 6.637 1.00 0.00 H new ATOM 0 HD2 TYR A 59 9.942 7.337 7.352 1.00 0.00 H new ATOM 0 HE1 TYR A 59 8.553 2.761 8.632 1.00 0.00 H new ATOM 0 HE2 TYR A 59 10.984 6.170 9.344 1.00 0.00 H new ATOM 0 HH TYR A 59 11.035 4.388 10.546 1.00 0.00 H new ATOM 926 N LEU A 60 6.684 6.176 2.987 1.00 0.00 N ATOM 927 CA LEU A 60 5.818 6.700 1.945 1.00 0.00 C ATOM 928 C LEU A 60 4.695 7.519 2.585 1.00 0.00 C ATOM 929 O LEU A 60 3.845 6.971 3.286 1.00 0.00 O ATOM 930 CB LEU A 60 5.318 5.569 1.044 1.00 0.00 C ATOM 931 CG LEU A 60 4.495 5.995 -0.173 1.00 0.00 C ATOM 932 CD1 LEU A 60 5.398 6.267 -1.378 1.00 0.00 C ATOM 933 CD2 LEU A 60 3.411 4.963 -0.491 1.00 0.00 C ATOM 0 H LEU A 60 6.292 5.397 3.515 1.00 0.00 H new ATOM 0 HA LEU A 60 6.373 7.374 1.292 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.180 5.002 0.694 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.714 4.891 1.647 1.00 0.00 H new ATOM 0 HG LEU A 60 3.989 6.930 0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.788 6.568 -2.229 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.100 7.065 -1.134 1.00 0.00 H new ATOM 0 HD13 LEU A 60 5.951 5.362 -1.630 1.00 0.00 H new ATOM 0 HD21 LEU A 60 2.841 5.290 -1.360 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.876 4.000 -0.704 1.00 0.00 H new ATOM 0 HD23 LEU A 60 2.743 4.862 0.364 1.00 0.00 H new ATOM 945 N ALA A 61 4.727 8.817 2.321 1.00 0.00 N ATOM 946 CA ALA A 61 3.723 9.716 2.863 1.00 0.00 C ATOM 947 C ALA A 61 3.295 10.708 1.779 1.00 0.00 C ATOM 948 O ALA A 61 4.098 11.085 0.927 1.00 0.00 O ATOM 949 CB ALA A 61 4.279 10.414 4.106 1.00 0.00 C ATOM 0 H ALA A 61 5.433 9.267 1.739 1.00 0.00 H new ATOM 0 HA ALA A 61 2.837 9.161 3.171 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.525 11.088 4.512 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.540 9.668 4.856 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.168 10.984 3.836 1.00 0.00 H new ATOM 955 N MET A 62 2.032 11.102 1.848 1.00 0.00 N ATOM 956 CA MET A 62 1.488 12.043 0.883 1.00 0.00 C ATOM 957 C MET A 62 1.304 13.426 1.511 1.00 0.00 C ATOM 958 O MET A 62 0.519 13.589 2.444 1.00 0.00 O ATOM 959 CB MET A 62 0.140 11.529 0.373 1.00 0.00 C ATOM 960 CG MET A 62 -0.438 12.468 -0.688 1.00 0.00 C ATOM 961 SD MET A 62 -1.880 11.728 -1.436 1.00 0.00 S ATOM 962 CE MET A 62 -1.144 10.268 -2.151 1.00 0.00 C ATOM 0 H MET A 62 1.370 10.787 2.557 1.00 0.00 H new ATOM 0 HA MET A 62 2.190 12.132 0.054 1.00 0.00 H new ATOM 0 HB2 MET A 62 0.263 10.531 -0.047 1.00 0.00 H new ATOM 0 HB3 MET A 62 -0.558 11.441 1.205 1.00 0.00 H new ATOM 0 HG2 MET A 62 -0.703 13.423 -0.235 1.00 0.00 H new ATOM 0 HG3 MET A 62 0.313 12.674 -1.451 1.00 0.00 H new ATOM 0 HE1 MET A 62 -1.696 9.983 -3.046 1.00 0.00 H new ATOM 0 HE2 MET A 62 -0.107 10.475 -2.415 1.00 0.00 H new ATOM 0 HE3 MET A 62 -1.178 9.452 -1.429 1.00 0.00 H new ATOM 972 N ASP A 63 2.040 14.387 0.973 1.00 0.00 N ATOM 973 CA ASP A 63 1.967 15.751 1.469 1.00 0.00 C ATOM 974 C ASP A 63 0.657 16.390 1.002 1.00 0.00 C ATOM 975 O ASP A 63 -0.250 15.694 0.549 1.00 0.00 O ATOM 976 CB ASP A 63 3.123 16.596 0.929 1.00 0.00 C ATOM 977 CG ASP A 63 4.061 17.165 1.996 1.00 0.00 C ATOM 978 OD1 ASP A 63 3.556 17.442 3.106 1.00 0.00 O ATOM 979 OD2 ASP A 63 5.261 17.311 1.677 1.00 0.00 O ATOM 0 H ASP A 63 2.690 14.248 0.199 1.00 0.00 H new ATOM 0 HA ASP A 63 2.022 15.717 2.557 1.00 0.00 H new ATOM 0 HB2 ASP A 63 3.708 15.987 0.240 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.710 17.423 0.351 1.00 0.00 H new ATOM 984 N THR A 64 0.601 17.708 1.127 1.00 0.00 N ATOM 985 CA THR A 64 -0.583 18.448 0.724 1.00 0.00 C ATOM 986 C THR A 64 -0.606 18.630 -0.795 1.00 0.00 C ATOM 987 O THR A 64 -1.663 18.858 -1.381 1.00 0.00 O ATOM 988 CB THR A 64 -0.600 19.769 1.494 1.00 0.00 C ATOM 989 OG1 THR A 64 0.634 20.391 1.145 1.00 0.00 O ATOM 990 CG2 THR A 64 -0.499 19.566 3.008 1.00 0.00 C ATOM 0 H THR A 64 1.356 18.282 1.502 1.00 0.00 H new ATOM 0 HA THR A 64 -1.494 17.901 0.969 1.00 0.00 H new ATOM 0 HB THR A 64 -1.515 20.313 1.260 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.705 21.256 1.600 1.00 0.00 H new ATOM 0 HG21 THR A 64 -0.515 20.535 3.507 1.00 0.00 H new ATOM 0 HG22 THR A 64 -1.342 18.967 3.352 1.00 0.00 H new ATOM 0 HG23 THR A 64 0.432 19.052 3.245 1.00 0.00 H new ATOM 998 N ASP A 65 0.573 18.522 -1.390 1.00 0.00 N ATOM 999 CA ASP A 65 0.702 18.672 -2.829 1.00 0.00 C ATOM 1000 C ASP A 65 0.011 17.496 -3.524 1.00 0.00 C ATOM 1001 O ASP A 65 -0.245 17.544 -4.726 1.00 0.00 O ATOM 1002 CB ASP A 65 2.172 18.674 -3.254 1.00 0.00 C ATOM 1003 CG ASP A 65 2.595 19.868 -4.112 1.00 0.00 C ATOM 1004 OD1 ASP A 65 2.644 20.983 -3.548 1.00 0.00 O ATOM 1005 OD2 ASP A 65 2.860 19.640 -5.312 1.00 0.00 O ATOM 0 H ASP A 65 1.448 18.332 -0.901 1.00 0.00 H new ATOM 0 HA ASP A 65 0.244 19.620 -3.111 1.00 0.00 H new ATOM 0 HB2 ASP A 65 2.794 18.651 -2.359 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.376 17.757 -3.808 1.00 0.00 H new ATOM 1010 N GLY A 66 -0.271 16.468 -2.737 1.00 0.00 N ATOM 1011 CA GLY A 66 -0.927 15.283 -3.261 1.00 0.00 C ATOM 1012 C GLY A 66 0.100 14.254 -3.739 1.00 0.00 C ATOM 1013 O GLY A 66 -0.236 13.090 -3.955 1.00 0.00 O ATOM 0 H GLY A 66 -0.057 16.432 -1.740 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.558 14.841 -2.490 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.581 15.560 -4.088 1.00 0.00 H new ATOM 1017 N LEU A 67 1.331 14.720 -3.890 1.00 0.00 N ATOM 1018 CA LEU A 67 2.409 13.855 -4.339 1.00 0.00 C ATOM 1019 C LEU A 67 3.001 13.120 -3.135 1.00 0.00 C ATOM 1020 O LEU A 67 2.775 13.512 -1.991 1.00 0.00 O ATOM 1021 CB LEU A 67 3.439 14.655 -5.139 1.00 0.00 C ATOM 1022 CG LEU A 67 3.300 14.594 -6.661 1.00 0.00 C ATOM 1023 CD1 LEU A 67 1.828 14.580 -7.077 1.00 0.00 C ATOM 1024 CD2 LEU A 67 4.073 15.734 -7.328 1.00 0.00 C ATOM 0 H LEU A 67 1.606 15.685 -3.709 1.00 0.00 H new ATOM 0 HA LEU A 67 2.030 13.095 -5.022 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.379 15.699 -4.830 1.00 0.00 H new ATOM 0 HB3 LEU A 67 4.434 14.300 -4.870 1.00 0.00 H new ATOM 0 HG LEU A 67 3.741 13.659 -7.007 1.00 0.00 H new ATOM 0 HD11 LEU A 67 1.757 14.536 -8.164 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.336 13.708 -6.646 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.340 15.486 -6.718 1.00 0.00 H new ATOM 0 HD21 LEU A 67 3.958 15.668 -8.410 1.00 0.00 H new ATOM 0 HD22 LEU A 67 3.683 16.690 -6.980 1.00 0.00 H new ATOM 0 HD23 LEU A 67 5.129 15.657 -7.070 1.00 0.00 H new ATOM 1036 N LEU A 68 3.747 12.067 -3.434 1.00 0.00 N ATOM 1037 CA LEU A 68 4.374 11.273 -2.391 1.00 0.00 C ATOM 1038 C LEU A 68 5.830 11.711 -2.227 1.00 0.00 C ATOM 1039 O LEU A 68 6.484 12.081 -3.201 1.00 0.00 O ATOM 1040 CB LEU A 68 4.210 9.780 -2.683 1.00 0.00 C ATOM 1041 CG LEU A 68 2.772 9.259 -2.728 1.00 0.00 C ATOM 1042 CD1 LEU A 68 2.669 8.012 -3.609 1.00 0.00 C ATOM 1043 CD2 LEU A 68 2.234 9.011 -1.318 1.00 0.00 C ATOM 0 H LEU A 68 3.932 11.745 -4.384 1.00 0.00 H new ATOM 0 HA LEU A 68 3.880 11.444 -1.434 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.684 9.563 -3.640 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.755 9.220 -1.923 1.00 0.00 H new ATOM 0 HG LEU A 68 2.144 10.026 -3.181 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.637 7.662 -3.624 1.00 0.00 H new ATOM 0 HD12 LEU A 68 2.984 8.256 -4.623 1.00 0.00 H new ATOM 0 HD13 LEU A 68 3.312 7.229 -3.208 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.210 8.641 -1.379 1.00 0.00 H new ATOM 0 HD22 LEU A 68 2.858 8.272 -0.815 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.250 9.943 -0.753 1.00 0.00 H new ATOM 1055 N TYR A 69 6.295 11.656 -0.988 1.00 0.00 N ATOM 1056 CA TYR A 69 7.663 12.043 -0.684 1.00 0.00 C ATOM 1057 C TYR A 69 8.282 11.102 0.352 1.00 0.00 C ATOM 1058 O TYR A 69 7.566 10.398 1.062 1.00 0.00 O ATOM 1059 CB TYR A 69 7.580 13.451 -0.091 1.00 0.00 C ATOM 1060 CG TYR A 69 6.801 13.528 1.224 1.00 0.00 C ATOM 1061 CD1 TYR A 69 7.304 12.928 2.360 1.00 0.00 C ATOM 1062 CD2 TYR A 69 5.596 14.199 1.273 1.00 0.00 C ATOM 1063 CE1 TYR A 69 6.571 13.000 3.597 1.00 0.00 C ATOM 1064 CE2 TYR A 69 4.863 14.271 2.510 1.00 0.00 C ATOM 1065 CZ TYR A 69 5.386 13.668 3.611 1.00 0.00 C ATOM 1066 OH TYR A 69 4.694 13.737 4.780 1.00 0.00 O ATOM 0 H TYR A 69 5.749 11.349 -0.183 1.00 0.00 H new ATOM 0 HA TYR A 69 8.282 12.002 -1.580 1.00 0.00 H new ATOM 0 HB2 TYR A 69 8.591 13.824 0.075 1.00 0.00 H new ATOM 0 HB3 TYR A 69 7.111 14.113 -0.819 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.248 12.404 2.321 1.00 0.00 H new ATOM 0 HD2 TYR A 69 5.203 14.670 0.384 1.00 0.00 H new ATOM 0 HE1 TYR A 69 6.953 12.534 4.493 1.00 0.00 H new ATOM 0 HE2 TYR A 69 3.919 14.792 2.562 1.00 0.00 H new ATOM 0 HH TYR A 69 3.868 14.245 4.641 1.00 0.00 H new ATOM 1076 N GLY A 70 9.606 11.121 0.404 1.00 0.00 N ATOM 1077 CA GLY A 70 10.329 10.278 1.341 1.00 0.00 C ATOM 1078 C GLY A 70 10.341 10.897 2.740 1.00 0.00 C ATOM 1079 O GLY A 70 10.964 11.935 2.957 1.00 0.00 O ATOM 0 H GLY A 70 10.196 11.706 -0.187 1.00 0.00 H new ATOM 0 HA2 GLY A 70 9.866 9.292 1.380 1.00 0.00 H new ATOM 0 HA3 GLY A 70 11.352 10.137 0.993 1.00 0.00 H new ATOM 1083 N SER A 71 9.645 10.235 3.652 1.00 0.00 N ATOM 1084 CA SER A 71 9.568 10.707 5.024 1.00 0.00 C ATOM 1085 C SER A 71 10.701 10.097 5.852 1.00 0.00 C ATOM 1086 O SER A 71 10.764 8.881 6.023 1.00 0.00 O ATOM 1087 CB SER A 71 8.213 10.369 5.647 1.00 0.00 C ATOM 1088 OG SER A 71 7.281 9.900 4.677 1.00 0.00 O ATOM 0 H SER A 71 9.129 9.375 3.468 1.00 0.00 H new ATOM 0 HA SER A 71 9.674 11.792 5.019 1.00 0.00 H new ATOM 0 HB2 SER A 71 8.348 9.609 6.417 1.00 0.00 H new ATOM 0 HB3 SER A 71 7.809 11.254 6.139 1.00 0.00 H new ATOM 0 HG SER A 71 6.689 9.235 5.087 1.00 0.00 H new ATOM 1094 N GLN A 72 11.568 10.970 6.343 1.00 0.00 N ATOM 1095 CA GLN A 72 12.695 10.532 7.149 1.00 0.00 C ATOM 1096 C GLN A 72 12.215 9.635 8.291 1.00 0.00 C ATOM 1097 O GLN A 72 12.646 8.489 8.408 1.00 0.00 O ATOM 1098 CB GLN A 72 13.483 11.729 7.686 1.00 0.00 C ATOM 1099 CG GLN A 72 14.953 11.365 7.904 1.00 0.00 C ATOM 1100 CD GLN A 72 15.874 12.339 7.165 1.00 0.00 C ATOM 1101 OE1 GLN A 72 15.841 13.541 7.370 1.00 0.00 O ATOM 1102 NE2 GLN A 72 16.695 11.754 6.297 1.00 0.00 N ATOM 0 H GLN A 72 11.513 11.978 6.198 1.00 0.00 H new ATOM 0 HA GLN A 72 13.366 9.952 6.515 1.00 0.00 H new ATOM 0 HB2 GLN A 72 13.411 12.560 6.985 1.00 0.00 H new ATOM 0 HB3 GLN A 72 13.045 12.065 8.626 1.00 0.00 H new ATOM 0 HG2 GLN A 72 15.181 11.381 8.970 1.00 0.00 H new ATOM 0 HG3 GLN A 72 15.136 10.349 7.554 1.00 0.00 H new ATOM 0 HE21 GLN A 72 16.670 10.742 6.174 1.00 0.00 H new ATOM 0 HE22 GLN A 72 17.349 12.318 5.754 1.00 0.00 H new ATOM 1111 N THR A 73 11.328 10.190 9.104 1.00 0.00 N ATOM 1112 CA THR A 73 10.784 9.454 10.232 1.00 0.00 C ATOM 1113 C THR A 73 9.340 9.033 9.949 1.00 0.00 C ATOM 1114 O THR A 73 8.666 9.636 9.115 1.00 0.00 O ATOM 1115 CB THR A 73 10.927 10.328 11.480 1.00 0.00 C ATOM 1116 OG1 THR A 73 10.474 11.611 11.060 1.00 0.00 O ATOM 1117 CG2 THR A 73 12.389 10.558 11.868 1.00 0.00 C ATOM 0 H THR A 73 10.973 11.141 9.004 1.00 0.00 H new ATOM 0 HA THR A 73 11.333 8.527 10.400 1.00 0.00 H new ATOM 0 HB THR A 73 10.399 9.862 12.312 1.00 0.00 H new ATOM 0 HG1 THR A 73 10.531 12.240 11.810 1.00 0.00 H new ATOM 0 HG21 THR A 73 12.435 11.184 12.759 1.00 0.00 H new ATOM 0 HG22 THR A 73 12.866 9.600 12.073 1.00 0.00 H new ATOM 0 HG23 THR A 73 12.909 11.055 11.049 1.00 0.00 H new ATOM 1125 N PRO A 74 8.897 7.973 10.677 1.00 0.00 N ATOM 1126 CA PRO A 74 7.546 7.465 10.512 1.00 0.00 C ATOM 1127 C PRO A 74 6.526 8.392 11.176 1.00 0.00 C ATOM 1128 O PRO A 74 6.592 8.632 12.380 1.00 0.00 O ATOM 1129 CB PRO A 74 7.572 6.074 11.125 1.00 0.00 C ATOM 1130 CG PRO A 74 8.799 6.036 12.021 1.00 0.00 C ATOM 1131 CD PRO A 74 9.667 7.235 11.673 1.00 0.00 C ATOM 0 HA PRO A 74 7.238 7.420 9.467 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.664 5.883 11.697 1.00 0.00 H new ATOM 0 HB3 PRO A 74 7.629 5.308 10.352 1.00 0.00 H new ATOM 0 HG2 PRO A 74 8.507 6.068 13.071 1.00 0.00 H new ATOM 0 HG3 PRO A 74 9.352 5.108 11.872 1.00 0.00 H new ATOM 0 HD2 PRO A 74 9.867 7.847 12.552 1.00 0.00 H new ATOM 0 HD3 PRO A 74 10.633 6.923 11.275 1.00 0.00 H new ATOM 1139 N ASN A 75 5.607 8.888 10.360 1.00 0.00 N ATOM 1140 CA ASN A 75 4.574 9.783 10.853 1.00 0.00 C ATOM 1141 C ASN A 75 3.202 9.252 10.435 1.00 0.00 C ATOM 1142 O ASN A 75 3.097 8.466 9.494 1.00 0.00 O ATOM 1143 CB ASN A 75 4.736 11.187 10.267 1.00 0.00 C ATOM 1144 CG ASN A 75 4.568 11.169 8.746 1.00 0.00 C ATOM 1145 OD1 ASN A 75 4.020 10.245 8.167 1.00 0.00 O ATOM 1146 ND2 ASN A 75 5.068 12.238 8.133 1.00 0.00 N ATOM 0 H ASN A 75 5.556 8.687 9.361 1.00 0.00 H new ATOM 0 HA ASN A 75 4.661 9.833 11.938 1.00 0.00 H new ATOM 0 HB2 ASN A 75 3.999 11.857 10.710 1.00 0.00 H new ATOM 0 HB3 ASN A 75 5.720 11.581 10.523 1.00 0.00 H new ATOM 0 HD21 ASN A 75 5.005 12.320 7.118 1.00 0.00 H new ATOM 0 HD22 ASN A 75 5.514 12.976 8.678 1.00 0.00 H new ATOM 1153 N GLU A 76 2.184 9.702 11.153 1.00 0.00 N ATOM 1154 CA GLU A 76 0.822 9.282 10.868 1.00 0.00 C ATOM 1155 C GLU A 76 0.522 9.431 9.375 1.00 0.00 C ATOM 1156 O GLU A 76 -0.361 8.760 8.846 1.00 0.00 O ATOM 1157 CB GLU A 76 -0.183 10.070 11.711 1.00 0.00 C ATOM 1158 CG GLU A 76 -0.427 9.383 13.056 1.00 0.00 C ATOM 1159 CD GLU A 76 -1.478 10.137 13.874 1.00 0.00 C ATOM 1160 OE1 GLU A 76 -1.172 11.281 14.275 1.00 0.00 O ATOM 1161 OE2 GLU A 76 -2.564 9.553 14.078 1.00 0.00 O ATOM 0 H GLU A 76 2.275 10.354 11.932 1.00 0.00 H new ATOM 0 HA GLU A 76 0.724 8.230 11.135 1.00 0.00 H new ATOM 0 HB2 GLU A 76 0.189 11.081 11.877 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.124 10.162 11.169 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -0.757 8.358 12.890 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.506 9.331 13.616 1.00 0.00 H new ATOM 1168 N GLU A 77 1.275 10.317 8.739 1.00 0.00 N ATOM 1169 CA GLU A 77 1.101 10.563 7.317 1.00 0.00 C ATOM 1170 C GLU A 77 1.616 9.373 6.505 1.00 0.00 C ATOM 1171 O GLU A 77 1.235 9.194 5.350 1.00 0.00 O ATOM 1172 CB GLU A 77 1.798 11.858 6.896 1.00 0.00 C ATOM 1173 CG GLU A 77 1.197 13.065 7.619 1.00 0.00 C ATOM 1174 CD GLU A 77 2.180 14.237 7.638 1.00 0.00 C ATOM 1175 OE1 GLU A 77 2.135 15.031 6.674 1.00 0.00 O ATOM 1176 OE2 GLU A 77 2.954 14.314 8.617 1.00 0.00 O ATOM 0 H GLU A 77 2.007 10.873 9.182 1.00 0.00 H new ATOM 0 HA GLU A 77 0.036 10.680 7.116 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.863 11.790 7.118 1.00 0.00 H new ATOM 0 HB3 GLU A 77 1.704 11.992 5.818 1.00 0.00 H new ATOM 0 HG2 GLU A 77 0.274 13.368 7.124 1.00 0.00 H new ATOM 0 HG3 GLU A 77 0.935 12.789 8.640 1.00 0.00 H new ATOM 1183 N CYS A 78 2.476 8.591 7.142 1.00 0.00 N ATOM 1184 CA CYS A 78 3.047 7.423 6.493 1.00 0.00 C ATOM 1185 C CYS A 78 2.058 6.264 6.632 1.00 0.00 C ATOM 1186 O CYS A 78 2.181 5.254 5.941 1.00 0.00 O ATOM 1187 CB CYS A 78 4.422 7.073 7.068 1.00 0.00 C ATOM 1188 SG CYS A 78 5.684 8.227 6.418 1.00 0.00 S ATOM 0 H CYS A 78 2.791 8.743 8.100 1.00 0.00 H new ATOM 0 HA CYS A 78 3.210 7.634 5.436 1.00 0.00 H new ATOM 0 HB2 CYS A 78 4.395 7.126 8.156 1.00 0.00 H new ATOM 0 HB3 CYS A 78 4.685 6.048 6.806 1.00 0.00 H new ATOM 0 HG CYS A 78 5.461 9.420 6.883 1.00 0.00 H new ATOM 1194 N LEU A 79 1.101 6.449 7.528 1.00 0.00 N ATOM 1195 CA LEU A 79 0.091 5.432 7.766 1.00 0.00 C ATOM 1196 C LEU A 79 -1.020 5.568 6.723 1.00 0.00 C ATOM 1197 O LEU A 79 -1.572 6.651 6.538 1.00 0.00 O ATOM 1198 CB LEU A 79 -0.409 5.501 9.210 1.00 0.00 C ATOM 1199 CG LEU A 79 -1.139 4.259 9.727 1.00 0.00 C ATOM 1200 CD1 LEU A 79 -0.554 2.985 9.115 1.00 0.00 C ATOM 1201 CD2 LEU A 79 -1.132 4.216 11.257 1.00 0.00 C ATOM 0 H LEU A 79 1.003 7.289 8.099 1.00 0.00 H new ATOM 0 HA LEU A 79 0.518 4.436 7.648 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.444 5.694 9.860 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -1.079 6.356 9.301 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.181 4.319 9.411 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.091 2.117 9.499 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.655 3.023 8.030 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.501 2.906 9.379 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.657 3.324 11.598 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.103 4.191 11.616 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.631 5.103 11.648 1.00 0.00 H new ATOM 1213 N PHE A 80 -1.314 4.454 6.070 1.00 0.00 N ATOM 1214 CA PHE A 80 -2.349 4.435 5.050 1.00 0.00 C ATOM 1215 C PHE A 80 -3.345 3.301 5.300 1.00 0.00 C ATOM 1216 O PHE A 80 -3.071 2.391 6.081 1.00 0.00 O ATOM 1217 CB PHE A 80 -1.652 4.200 3.709 1.00 0.00 C ATOM 1218 CG PHE A 80 -0.968 5.443 3.137 1.00 0.00 C ATOM 1219 CD1 PHE A 80 0.052 6.032 3.817 1.00 0.00 C ATOM 1220 CD2 PHE A 80 -1.380 5.960 1.948 1.00 0.00 C ATOM 1221 CE1 PHE A 80 0.687 7.186 3.286 1.00 0.00 C ATOM 1222 CE2 PHE A 80 -0.746 7.114 1.417 1.00 0.00 C ATOM 1223 CZ PHE A 80 0.275 7.702 2.097 1.00 0.00 C ATOM 0 H PHE A 80 -0.854 3.557 6.227 1.00 0.00 H new ATOM 0 HA PHE A 80 -2.900 5.375 5.062 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -0.908 3.412 3.831 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -2.385 3.837 2.989 1.00 0.00 H new ATOM 0 HD1 PHE A 80 0.379 5.622 4.761 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -2.190 5.492 1.408 1.00 0.00 H new ATOM 0 HE1 PHE A 80 1.497 7.654 3.826 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -1.074 7.525 0.474 1.00 0.00 H new ATOM 0 HZ PHE A 80 0.759 8.579 1.693 1.00 0.00 H new ATOM 1233 N LEU A 81 -4.479 3.392 4.622 1.00 0.00 N ATOM 1234 CA LEU A 81 -5.517 2.384 4.761 1.00 0.00 C ATOM 1235 C LEU A 81 -5.501 1.470 3.534 1.00 0.00 C ATOM 1236 O LEU A 81 -5.582 1.943 2.402 1.00 0.00 O ATOM 1237 CB LEU A 81 -6.873 3.043 5.019 1.00 0.00 C ATOM 1238 CG LEU A 81 -6.866 4.242 5.969 1.00 0.00 C ATOM 1239 CD1 LEU A 81 -6.214 3.880 7.304 1.00 0.00 C ATOM 1240 CD2 LEU A 81 -6.201 5.455 5.316 1.00 0.00 C ATOM 0 H LEU A 81 -4.702 4.148 3.975 1.00 0.00 H new ATOM 0 HA LEU A 81 -5.324 1.755 5.630 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.286 3.365 4.063 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.550 2.290 5.422 1.00 0.00 H new ATOM 0 HG LEU A 81 -7.900 4.517 6.180 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.222 4.750 7.961 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.770 3.067 7.772 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.185 3.564 7.133 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -6.209 6.293 6.013 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.171 5.209 5.056 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.748 5.728 4.413 1.00 0.00 H new ATOM 1252 N GLU A 82 -5.395 0.176 3.801 1.00 0.00 N ATOM 1253 CA GLU A 82 -5.368 -0.809 2.733 1.00 0.00 C ATOM 1254 C GLU A 82 -6.685 -1.585 2.693 1.00 0.00 C ATOM 1255 O GLU A 82 -7.298 -1.829 3.731 1.00 0.00 O ATOM 1256 CB GLU A 82 -4.177 -1.756 2.892 1.00 0.00 C ATOM 1257 CG GLU A 82 -4.163 -2.810 1.782 1.00 0.00 C ATOM 1258 CD GLU A 82 -4.574 -4.181 2.323 1.00 0.00 C ATOM 1259 OE1 GLU A 82 -5.692 -4.261 2.875 1.00 0.00 O ATOM 1260 OE2 GLU A 82 -3.760 -5.117 2.172 1.00 0.00 O ATOM 0 H GLU A 82 -5.327 -0.213 4.742 1.00 0.00 H new ATOM 0 HA GLU A 82 -5.250 -0.285 1.784 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.248 -1.186 2.869 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.225 -2.247 3.864 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -4.842 -2.512 0.984 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -3.166 -2.871 1.346 1.00 0.00 H new ATOM 1267 N ARG A 83 -7.082 -1.953 1.484 1.00 0.00 N ATOM 1268 CA ARG A 83 -8.315 -2.698 1.295 1.00 0.00 C ATOM 1269 C ARG A 83 -8.239 -3.536 0.017 1.00 0.00 C ATOM 1270 O ARG A 83 -7.410 -3.274 -0.853 1.00 0.00 O ATOM 1271 CB ARG A 83 -9.519 -1.757 1.208 1.00 0.00 C ATOM 1272 CG ARG A 83 -10.732 -2.350 1.927 1.00 0.00 C ATOM 1273 CD ARG A 83 -11.879 -2.606 0.947 1.00 0.00 C ATOM 1274 NE ARG A 83 -12.411 -3.974 1.138 1.00 0.00 N ATOM 1275 CZ ARG A 83 -13.300 -4.309 2.082 1.00 0.00 C ATOM 1276 NH1 ARG A 83 -13.762 -3.378 2.929 1.00 0.00 N ATOM 1277 NH2 ARG A 83 -13.728 -5.575 2.181 1.00 0.00 N ATOM 0 H ARG A 83 -6.571 -1.749 0.625 1.00 0.00 H new ATOM 0 HA ARG A 83 -8.441 -3.354 2.157 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -9.265 -0.794 1.650 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -9.766 -1.572 0.163 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -10.450 -3.283 2.414 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -11.064 -1.669 2.711 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -12.671 -1.874 1.102 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -11.528 -2.483 -0.077 1.00 0.00 H new ATOM 0 HE ARG A 83 -12.080 -4.708 0.511 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -13.436 -2.414 2.855 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -14.439 -3.633 3.648 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -13.377 -6.284 1.537 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -14.405 -5.830 2.900 1.00 0.00 H new ATOM 1291 N LEU A 84 -9.115 -4.528 -0.055 1.00 0.00 N ATOM 1292 CA LEU A 84 -9.157 -5.406 -1.211 1.00 0.00 C ATOM 1293 C LEU A 84 -10.165 -4.860 -2.225 1.00 0.00 C ATOM 1294 O LEU A 84 -11.274 -4.475 -1.857 1.00 0.00 O ATOM 1295 CB LEU A 84 -9.438 -6.847 -0.780 1.00 0.00 C ATOM 1296 CG LEU A 84 -9.011 -7.937 -1.764 1.00 0.00 C ATOM 1297 CD1 LEU A 84 -9.862 -7.893 -3.035 1.00 0.00 C ATOM 1298 CD2 LEU A 84 -7.515 -7.842 -2.073 1.00 0.00 C ATOM 0 H LEU A 84 -9.801 -4.743 0.669 1.00 0.00 H new ATOM 0 HA LEU A 84 -8.186 -5.429 -1.706 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -8.935 -7.026 0.170 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -10.508 -6.949 -0.598 1.00 0.00 H new ATOM 0 HG LEU A 84 -9.182 -8.906 -1.295 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -9.537 -8.678 -3.718 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -10.910 -8.047 -2.777 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -9.746 -6.922 -3.517 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.238 -8.628 -2.775 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -7.295 -6.869 -2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -6.945 -7.961 -1.152 1.00 0.00 H new ATOM 1310 N GLU A 85 -9.744 -4.845 -3.481 1.00 0.00 N ATOM 1311 CA GLU A 85 -10.597 -4.353 -4.550 1.00 0.00 C ATOM 1312 C GLU A 85 -10.701 -5.392 -5.667 1.00 0.00 C ATOM 1313 O GLU A 85 -9.915 -6.338 -5.716 1.00 0.00 O ATOM 1314 CB GLU A 85 -10.082 -3.017 -5.090 1.00 0.00 C ATOM 1315 CG GLU A 85 -10.211 -1.914 -4.037 1.00 0.00 C ATOM 1316 CD GLU A 85 -10.602 -0.583 -4.683 1.00 0.00 C ATOM 1317 OE1 GLU A 85 -11.189 -0.637 -5.785 1.00 0.00 O ATOM 1318 OE2 GLU A 85 -10.304 0.459 -4.060 1.00 0.00 O ATOM 0 H GLU A 85 -8.824 -5.165 -3.783 1.00 0.00 H new ATOM 0 HA GLU A 85 -11.594 -4.184 -4.144 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -9.039 -3.119 -5.389 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -10.644 -2.740 -5.982 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -10.960 -2.198 -3.298 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -9.266 -1.801 -3.506 1.00 0.00 H new ATOM 1325 N GLU A 86 -11.677 -5.183 -6.538 1.00 0.00 N ATOM 1326 CA GLU A 86 -11.894 -6.090 -7.652 1.00 0.00 C ATOM 1327 C GLU A 86 -10.657 -6.131 -8.552 1.00 0.00 C ATOM 1328 O GLU A 86 -9.668 -5.450 -8.285 1.00 0.00 O ATOM 1329 CB GLU A 86 -13.139 -5.694 -8.448 1.00 0.00 C ATOM 1330 CG GLU A 86 -14.396 -6.330 -7.851 1.00 0.00 C ATOM 1331 CD GLU A 86 -15.643 -5.924 -8.641 1.00 0.00 C ATOM 1332 OE1 GLU A 86 -15.759 -6.388 -9.795 1.00 0.00 O ATOM 1333 OE2 GLU A 86 -16.451 -5.160 -8.071 1.00 0.00 O ATOM 0 H GLU A 86 -12.327 -4.398 -6.495 1.00 0.00 H new ATOM 0 HA GLU A 86 -12.062 -7.090 -7.253 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -13.243 -4.609 -8.452 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -13.026 -6.007 -9.486 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -14.296 -7.415 -7.855 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -14.504 -6.024 -6.811 1.00 0.00 H new ATOM 1340 N ASN A 87 -10.754 -6.935 -9.601 1.00 0.00 N ATOM 1341 CA ASN A 87 -9.655 -7.073 -10.542 1.00 0.00 C ATOM 1342 C ASN A 87 -8.428 -7.622 -9.810 1.00 0.00 C ATOM 1343 O ASN A 87 -7.312 -7.546 -10.321 1.00 0.00 O ATOM 1344 CB ASN A 87 -9.278 -5.721 -11.150 1.00 0.00 C ATOM 1345 CG ASN A 87 -10.080 -5.449 -12.424 1.00 0.00 C ATOM 1346 OD1 ASN A 87 -10.426 -6.348 -13.174 1.00 0.00 O ATOM 1347 ND2 ASN A 87 -10.355 -4.164 -12.627 1.00 0.00 N ATOM 0 H ASN A 87 -11.576 -7.497 -9.820 1.00 0.00 H new ATOM 0 HA ASN A 87 -9.973 -7.749 -11.336 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -9.461 -4.928 -10.425 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -8.212 -5.705 -11.377 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -10.886 -3.880 -13.450 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -10.035 -3.462 -11.959 1.00 0.00 H new ATOM 1354 N HIS A 88 -8.677 -8.161 -8.626 1.00 0.00 N ATOM 1355 CA HIS A 88 -7.607 -8.722 -7.819 1.00 0.00 C ATOM 1356 C HIS A 88 -6.527 -7.662 -7.592 1.00 0.00 C ATOM 1357 O HIS A 88 -5.353 -7.896 -7.877 1.00 0.00 O ATOM 1358 CB HIS A 88 -7.058 -10.000 -8.457 1.00 0.00 C ATOM 1359 CG HIS A 88 -6.928 -11.158 -7.497 1.00 0.00 C ATOM 1360 ND1 HIS A 88 -5.942 -11.222 -6.528 1.00 0.00 N ATOM 1361 CD2 HIS A 88 -7.670 -12.295 -7.367 1.00 0.00 C ATOM 1362 CE1 HIS A 88 -6.093 -12.351 -5.852 1.00 0.00 C ATOM 1363 NE2 HIS A 88 -7.164 -13.015 -6.374 1.00 0.00 N ATOM 0 H HIS A 88 -9.604 -8.221 -8.206 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.996 -9.011 -6.843 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -7.712 -10.294 -9.278 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -6.080 -9.787 -8.888 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -8.525 -12.564 -7.970 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -5.476 -12.687 -5.031 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -7.518 -13.917 -6.054 1.00 0.00 H new ATOM 1371 N TYR A 89 -6.962 -6.520 -7.080 1.00 0.00 N ATOM 1372 CA TYR A 89 -6.047 -5.424 -6.811 1.00 0.00 C ATOM 1373 C TYR A 89 -6.246 -4.879 -5.395 1.00 0.00 C ATOM 1374 O TYR A 89 -7.208 -5.238 -4.717 1.00 0.00 O ATOM 1375 CB TYR A 89 -6.394 -4.328 -7.820 1.00 0.00 C ATOM 1376 CG TYR A 89 -5.764 -4.530 -9.200 1.00 0.00 C ATOM 1377 CD1 TYR A 89 -4.423 -4.839 -9.307 1.00 0.00 C ATOM 1378 CD2 TYR A 89 -6.536 -4.404 -10.336 1.00 0.00 C ATOM 1379 CE1 TYR A 89 -3.830 -5.030 -10.606 1.00 0.00 C ATOM 1380 CE2 TYR A 89 -5.944 -4.595 -11.634 1.00 0.00 C ATOM 1381 CZ TYR A 89 -4.620 -4.899 -11.705 1.00 0.00 C ATOM 1382 OH TYR A 89 -4.060 -5.079 -12.931 1.00 0.00 O ATOM 0 H TYR A 89 -7.936 -6.330 -6.844 1.00 0.00 H new ATOM 0 HA TYR A 89 -5.013 -5.758 -6.895 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -7.477 -4.280 -7.930 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -6.071 -3.366 -7.422 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -3.819 -4.938 -8.417 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -7.585 -4.162 -10.252 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -2.782 -5.272 -10.705 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -6.538 -4.499 -12.531 1.00 0.00 H new ATOM 0 HH TYR A 89 -4.742 -4.956 -13.624 1.00 0.00 H new ATOM 1392 N ASN A 90 -5.322 -4.020 -4.990 1.00 0.00 N ATOM 1393 CA ASN A 90 -5.384 -3.422 -3.668 1.00 0.00 C ATOM 1394 C ASN A 90 -5.468 -1.901 -3.804 1.00 0.00 C ATOM 1395 O ASN A 90 -5.293 -1.361 -4.896 1.00 0.00 O ATOM 1396 CB ASN A 90 -4.132 -3.755 -2.853 1.00 0.00 C ATOM 1397 CG ASN A 90 -4.495 -4.509 -1.573 1.00 0.00 C ATOM 1398 OD1 ASN A 90 -5.129 -3.985 -0.671 1.00 0.00 O ATOM 1399 ND2 ASN A 90 -4.059 -5.765 -1.543 1.00 0.00 N ATOM 0 H ASN A 90 -4.526 -3.724 -5.555 1.00 0.00 H new ATOM 0 HA ASN A 90 -6.262 -3.820 -3.159 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -3.452 -4.359 -3.454 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -3.603 -2.836 -2.600 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -4.250 -6.352 -0.731 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -3.534 -6.142 -2.332 1.00 0.00 H new ATOM 1406 N THR A 91 -5.737 -1.252 -2.681 1.00 0.00 N ATOM 1407 CA THR A 91 -5.847 0.197 -2.662 1.00 0.00 C ATOM 1408 C THR A 91 -5.287 0.757 -1.353 1.00 0.00 C ATOM 1409 O THR A 91 -5.476 0.167 -0.290 1.00 0.00 O ATOM 1410 CB THR A 91 -7.313 0.563 -2.901 1.00 0.00 C ATOM 1411 OG1 THR A 91 -8.041 -0.477 -2.254 1.00 0.00 O ATOM 1412 CG2 THR A 91 -7.715 0.439 -4.372 1.00 0.00 C ATOM 0 H THR A 91 -5.882 -1.703 -1.778 1.00 0.00 H new ATOM 0 HA THR A 91 -5.251 0.649 -3.454 1.00 0.00 H new ATOM 0 HB THR A 91 -7.492 1.583 -2.560 1.00 0.00 H new ATOM 0 HG1 THR A 91 -8.988 -0.231 -2.205 1.00 0.00 H new ATOM 0 HG21 THR A 91 -8.765 0.710 -4.486 1.00 0.00 H new ATOM 0 HG22 THR A 91 -7.100 1.107 -4.975 1.00 0.00 H new ATOM 0 HG23 THR A 91 -7.567 -0.589 -4.704 1.00 0.00 H new ATOM 1420 N TYR A 92 -4.610 1.889 -1.473 1.00 0.00 N ATOM 1421 CA TYR A 92 -4.021 2.536 -0.312 1.00 0.00 C ATOM 1422 C TYR A 92 -4.351 4.030 -0.290 1.00 0.00 C ATOM 1423 O TYR A 92 -4.207 4.715 -1.301 1.00 0.00 O ATOM 1424 CB TYR A 92 -2.508 2.362 -0.455 1.00 0.00 C ATOM 1425 CG TYR A 92 -2.050 0.902 -0.486 1.00 0.00 C ATOM 1426 CD1 TYR A 92 -1.988 0.173 0.684 1.00 0.00 C ATOM 1427 CD2 TYR A 92 -1.697 0.315 -1.685 1.00 0.00 C ATOM 1428 CE1 TYR A 92 -1.557 -1.201 0.654 1.00 0.00 C ATOM 1429 CE2 TYR A 92 -1.266 -1.059 -1.714 1.00 0.00 C ATOM 1430 CZ TYR A 92 -1.217 -1.749 -0.543 1.00 0.00 C ATOM 1431 OH TYR A 92 -0.810 -3.046 -0.571 1.00 0.00 O ATOM 0 H TYR A 92 -4.456 2.375 -2.356 1.00 0.00 H new ATOM 0 HA TYR A 92 -4.407 2.098 0.608 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -2.181 2.854 -1.371 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.014 2.870 0.374 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -2.263 0.633 1.622 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -1.744 0.886 -2.601 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -1.505 -1.783 1.562 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -0.988 -1.531 -2.645 1.00 0.00 H new ATOM 0 HH TYR A 92 -0.601 -3.303 -1.493 1.00 0.00 H new ATOM 1441 N ILE A 93 -4.787 4.490 0.873 1.00 0.00 N ATOM 1442 CA ILE A 93 -5.138 5.890 1.040 1.00 0.00 C ATOM 1443 C ILE A 93 -4.449 6.439 2.291 1.00 0.00 C ATOM 1444 O ILE A 93 -4.310 5.731 3.288 1.00 0.00 O ATOM 1445 CB ILE A 93 -6.658 6.064 1.048 1.00 0.00 C ATOM 1446 CG1 ILE A 93 -7.231 5.942 -0.365 1.00 0.00 C ATOM 1447 CG2 ILE A 93 -7.055 7.381 1.717 1.00 0.00 C ATOM 1448 CD1 ILE A 93 -8.677 5.444 -0.329 1.00 0.00 C ATOM 0 H ILE A 93 -4.905 3.918 1.709 1.00 0.00 H new ATOM 0 HA ILE A 93 -4.778 6.476 0.195 1.00 0.00 H new ATOM 0 HB ILE A 93 -7.092 5.259 1.641 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -7.188 6.910 -0.863 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -6.620 5.255 -0.951 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -8.140 7.480 1.710 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -6.697 7.389 2.747 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -6.611 8.214 1.172 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -9.060 5.366 -1.346 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -8.713 4.465 0.148 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -9.290 6.146 0.237 1.00 0.00 H new ATOM 1460 N SER A 94 -4.037 7.694 2.199 1.00 0.00 N ATOM 1461 CA SER A 94 -3.367 8.346 3.311 1.00 0.00 C ATOM 1462 C SER A 94 -4.361 8.599 4.446 1.00 0.00 C ATOM 1463 O SER A 94 -5.495 9.010 4.203 1.00 0.00 O ATOM 1464 CB SER A 94 -2.719 9.660 2.870 1.00 0.00 C ATOM 1465 OG SER A 94 -1.386 9.788 3.357 1.00 0.00 O ATOM 0 H SER A 94 -4.154 8.278 1.371 1.00 0.00 H new ATOM 0 HA SER A 94 -2.578 7.685 3.669 1.00 0.00 H new ATOM 0 HB2 SER A 94 -2.714 9.714 1.781 1.00 0.00 H new ATOM 0 HB3 SER A 94 -3.318 10.498 3.228 1.00 0.00 H new ATOM 0 HG SER A 94 -0.919 8.931 3.262 1.00 0.00 H new ATOM 1471 N LYS A 95 -3.901 8.342 5.662 1.00 0.00 N ATOM 1472 CA LYS A 95 -4.736 8.537 6.835 1.00 0.00 C ATOM 1473 C LYS A 95 -5.021 10.030 7.010 1.00 0.00 C ATOM 1474 O LYS A 95 -6.158 10.471 6.852 1.00 0.00 O ATOM 1475 CB LYS A 95 -4.096 7.885 8.062 1.00 0.00 C ATOM 1476 CG LYS A 95 -5.149 7.182 8.921 1.00 0.00 C ATOM 1477 CD LYS A 95 -5.350 7.914 10.250 1.00 0.00 C ATOM 1478 CE LYS A 95 -4.726 7.131 11.406 1.00 0.00 C ATOM 1479 NZ LYS A 95 -3.855 8.011 12.217 1.00 0.00 N ATOM 0 H LYS A 95 -2.961 8.000 5.860 1.00 0.00 H new ATOM 0 HA LYS A 95 -5.698 8.042 6.705 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -3.341 7.166 7.744 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -3.584 8.643 8.655 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.094 7.137 8.380 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -4.841 6.154 9.111 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -4.902 8.906 10.194 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -6.415 8.055 10.434 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -5.511 6.709 12.033 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -4.146 6.295 11.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -3.439 7.464 12.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -3.095 8.394 11.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -4.418 8.795 12.605 1.00 0.00 H new ATOM 1493 N LYS A 96 -3.969 10.767 7.335 1.00 0.00 N ATOM 1494 CA LYS A 96 -4.092 12.201 7.533 1.00 0.00 C ATOM 1495 C LYS A 96 -4.776 12.823 6.315 1.00 0.00 C ATOM 1496 O LYS A 96 -5.393 13.882 6.418 1.00 0.00 O ATOM 1497 CB LYS A 96 -2.728 12.816 7.854 1.00 0.00 C ATOM 1498 CG LYS A 96 -2.885 14.096 8.678 1.00 0.00 C ATOM 1499 CD LYS A 96 -1.742 15.074 8.394 1.00 0.00 C ATOM 1500 CE LYS A 96 -2.020 16.439 9.025 1.00 0.00 C ATOM 1501 NZ LYS A 96 -1.221 17.491 8.358 1.00 0.00 N ATOM 0 H LYS A 96 -3.027 10.398 7.466 1.00 0.00 H new ATOM 0 HA LYS A 96 -4.723 12.414 8.396 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -2.121 12.097 8.404 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -2.198 13.038 6.928 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.839 14.568 8.445 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -2.902 13.850 9.740 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -0.808 14.671 8.786 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -1.614 15.186 7.317 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -3.081 16.674 8.944 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -1.780 16.411 10.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -1.422 18.411 8.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -0.209 17.273 8.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -1.470 17.529 7.349 1.00 0.00 H new ATOM 1515 N HIS A 97 -4.644 12.139 5.188 1.00 0.00 N ATOM 1516 CA HIS A 97 -5.242 12.612 3.951 1.00 0.00 C ATOM 1517 C HIS A 97 -6.197 11.549 3.404 1.00 0.00 C ATOM 1518 O HIS A 97 -6.185 11.254 2.210 1.00 0.00 O ATOM 1519 CB HIS A 97 -4.162 13.013 2.944 1.00 0.00 C ATOM 1520 CG HIS A 97 -2.885 13.512 3.578 1.00 0.00 C ATOM 1521 ND1 HIS A 97 -2.145 13.007 4.607 1.00 0.00 N flip ATOM 1522 CD2 HIS A 97 -2.238 14.660 3.157 1.00 0.00 C flip ATOM 1523 CE1 HIS A 97 -1.101 13.803 4.802 1.00 0.00 C flip ATOM 1524 NE2 HIS A 97 -1.157 14.829 3.905 1.00 0.00 N flip ATOM 0 H HIS A 97 -4.132 11.261 5.106 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.827 13.511 4.146 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -3.931 12.154 2.313 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -4.559 13.790 2.291 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -2.559 15.308 2.355 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -0.333 13.662 5.548 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -0.485 15.592 3.824 1.00 0.00 H new ATOM 1532 N ALA A 98 -7.001 11.003 4.304 1.00 0.00 N ATOM 1533 CA ALA A 98 -7.961 9.980 3.927 1.00 0.00 C ATOM 1534 C ALA A 98 -9.293 10.642 3.570 1.00 0.00 C ATOM 1535 O ALA A 98 -9.893 10.326 2.543 1.00 0.00 O ATOM 1536 CB ALA A 98 -8.101 8.966 5.064 1.00 0.00 C ATOM 0 H ALA A 98 -7.007 11.250 5.294 1.00 0.00 H new ATOM 0 HA ALA A 98 -7.616 9.437 3.047 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.821 8.199 4.781 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.134 8.502 5.259 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -8.447 9.474 5.964 1.00 0.00 H new ATOM 1542 N GLU A 99 -9.717 11.550 4.437 1.00 0.00 N ATOM 1543 CA GLU A 99 -10.967 12.260 4.226 1.00 0.00 C ATOM 1544 C GLU A 99 -10.943 12.989 2.881 1.00 0.00 C ATOM 1545 O GLU A 99 -11.991 13.237 2.287 1.00 0.00 O ATOM 1546 CB GLU A 99 -11.245 13.234 5.373 1.00 0.00 C ATOM 1547 CG GLU A 99 -11.710 12.488 6.625 1.00 0.00 C ATOM 1548 CD GLU A 99 -10.558 12.306 7.615 1.00 0.00 C ATOM 1549 OE1 GLU A 99 -9.811 11.318 7.442 1.00 0.00 O ATOM 1550 OE2 GLU A 99 -10.449 13.158 8.523 1.00 0.00 O ATOM 0 H GLU A 99 -9.217 11.810 5.287 1.00 0.00 H new ATOM 0 HA GLU A 99 -11.777 11.531 4.208 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -10.343 13.803 5.598 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -12.007 13.952 5.069 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -12.520 13.040 7.102 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -12.110 11.514 6.344 1.00 0.00 H new ATOM 1557 N LYS A 100 -9.736 13.313 2.442 1.00 0.00 N ATOM 1558 CA LYS A 100 -9.562 14.008 1.178 1.00 0.00 C ATOM 1559 C LYS A 100 -9.698 13.009 0.027 1.00 0.00 C ATOM 1560 O LYS A 100 -9.628 13.389 -1.141 1.00 0.00 O ATOM 1561 CB LYS A 100 -8.240 14.780 1.169 1.00 0.00 C ATOM 1562 CG LYS A 100 -7.901 15.303 2.567 1.00 0.00 C ATOM 1563 CD LYS A 100 -7.339 16.724 2.499 1.00 0.00 C ATOM 1564 CE LYS A 100 -8.417 17.757 2.832 1.00 0.00 C ATOM 1565 NZ LYS A 100 -8.446 18.824 1.807 1.00 0.00 N ATOM 0 H LYS A 100 -8.869 13.107 2.939 1.00 0.00 H new ATOM 0 HA LYS A 100 -10.343 14.756 1.045 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -7.438 14.132 0.815 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -8.307 15.614 0.471 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -8.795 15.291 3.190 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -7.174 14.643 3.040 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -6.507 16.824 3.196 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -6.943 16.915 1.501 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -9.391 17.270 2.887 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -8.222 18.192 3.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -9.183 19.517 2.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -7.521 19.299 1.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -8.654 18.407 0.877 1.00 0.00 H new ATOM 1579 N ASN A 101 -9.890 11.752 0.398 1.00 0.00 N ATOM 1580 CA ASN A 101 -10.037 10.695 -0.589 1.00 0.00 C ATOM 1581 C ASN A 101 -8.919 10.814 -1.627 1.00 0.00 C ATOM 1582 O ASN A 101 -9.181 11.089 -2.797 1.00 0.00 O ATOM 1583 CB ASN A 101 -11.376 10.807 -1.321 1.00 0.00 C ATOM 1584 CG ASN A 101 -12.413 11.530 -0.459 1.00 0.00 C ATOM 1585 OD1 ASN A 101 -12.701 11.147 0.663 1.00 0.00 O ATOM 1586 ND2 ASN A 101 -12.956 12.593 -1.044 1.00 0.00 N ATOM 0 H ASN A 101 -9.947 11.441 1.368 1.00 0.00 H new ATOM 0 HA ASN A 101 -9.990 9.738 -0.069 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -11.238 11.345 -2.259 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -11.740 9.812 -1.576 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -13.659 13.143 -0.551 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -12.669 12.859 -1.986 1.00 0.00 H new ATOM 1593 N TRP A 102 -7.697 10.600 -1.162 1.00 0.00 N ATOM 1594 CA TRP A 102 -6.539 10.680 -2.035 1.00 0.00 C ATOM 1595 C TRP A 102 -5.969 9.269 -2.194 1.00 0.00 C ATOM 1596 O TRP A 102 -5.777 8.558 -1.209 1.00 0.00 O ATOM 1597 CB TRP A 102 -5.515 11.681 -1.498 1.00 0.00 C ATOM 1598 CG TRP A 102 -6.001 13.132 -1.501 1.00 0.00 C ATOM 1599 CD1 TRP A 102 -7.152 13.615 -1.989 1.00 0.00 C ATOM 1600 CD2 TRP A 102 -5.299 14.276 -0.971 1.00 0.00 C ATOM 1601 NE1 TRP A 102 -7.243 14.981 -1.812 1.00 0.00 N ATOM 1602 CE2 TRP A 102 -6.080 15.395 -1.173 1.00 0.00 C ATOM 1603 CE3 TRP A 102 -4.045 14.362 -0.340 1.00 0.00 C ATOM 1604 CZ2 TRP A 102 -5.695 16.681 -0.775 1.00 0.00 C ATOM 1605 CZ3 TRP A 102 -3.675 15.654 0.052 1.00 0.00 C ATOM 1606 CH2 TRP A 102 -4.450 16.791 -0.145 1.00 0.00 C ATOM 0 H TRP A 102 -7.484 10.371 -0.191 1.00 0.00 H new ATOM 0 HA TRP A 102 -6.823 11.054 -3.019 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -5.248 11.400 -0.479 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -4.607 11.612 -2.096 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -7.913 13.011 -2.461 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -8.020 15.577 -2.097 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -3.417 13.500 -0.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -6.325 17.542 -0.945 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -2.720 15.776 0.542 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -4.093 17.755 0.187 1.00 0.00 H new ATOM 1617 N PHE A 103 -5.714 8.906 -3.443 1.00 0.00 N ATOM 1618 CA PHE A 103 -5.170 7.593 -3.744 1.00 0.00 C ATOM 1619 C PHE A 103 -3.727 7.698 -4.240 1.00 0.00 C ATOM 1620 O PHE A 103 -3.354 8.686 -4.871 1.00 0.00 O ATOM 1621 CB PHE A 103 -6.036 6.993 -4.853 1.00 0.00 C ATOM 1622 CG PHE A 103 -7.486 6.732 -4.439 1.00 0.00 C ATOM 1623 CD1 PHE A 103 -7.832 5.536 -3.893 1.00 0.00 C ATOM 1624 CD2 PHE A 103 -8.428 7.697 -4.617 1.00 0.00 C ATOM 1625 CE1 PHE A 103 -9.177 5.293 -3.508 1.00 0.00 C ATOM 1626 CE2 PHE A 103 -9.773 7.454 -4.232 1.00 0.00 C ATOM 1627 CZ PHE A 103 -10.119 6.258 -3.686 1.00 0.00 C ATOM 0 H PHE A 103 -5.874 9.498 -4.258 1.00 0.00 H new ATOM 0 HA PHE A 103 -5.173 6.975 -2.846 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -6.029 7.667 -5.710 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -5.589 6.055 -5.182 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -7.083 4.770 -3.752 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -8.153 8.647 -5.051 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -9.452 4.343 -3.074 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -10.522 8.220 -4.373 1.00 0.00 H new ATOM 0 HZ PHE A 103 -11.142 6.074 -3.393 1.00 0.00 H new ATOM 1637 N VAL A 104 -2.954 6.665 -3.937 1.00 0.00 N ATOM 1638 CA VAL A 104 -1.560 6.629 -4.345 1.00 0.00 C ATOM 1639 C VAL A 104 -1.480 6.577 -5.872 1.00 0.00 C ATOM 1640 O VAL A 104 -1.472 7.614 -6.533 1.00 0.00 O ATOM 1641 CB VAL A 104 -0.847 5.456 -3.669 1.00 0.00 C ATOM 1642 CG1 VAL A 104 0.578 5.299 -4.203 1.00 0.00 C ATOM 1643 CG2 VAL A 104 -0.847 5.618 -2.148 1.00 0.00 C ATOM 0 H VAL A 104 -3.267 5.847 -3.414 1.00 0.00 H new ATOM 0 HA VAL A 104 -1.045 7.534 -4.024 1.00 0.00 H new ATOM 0 HB VAL A 104 -1.397 4.546 -3.910 1.00 0.00 H new ATOM 0 HG11 VAL A 104 1.062 4.458 -3.706 1.00 0.00 H new ATOM 0 HG12 VAL A 104 0.546 5.116 -5.277 1.00 0.00 H new ATOM 0 HG13 VAL A 104 1.143 6.211 -4.007 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.334 4.771 -1.692 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -0.332 6.541 -1.880 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -1.874 5.658 -1.786 1.00 0.00 H new ATOM 1653 N GLY A 105 -1.424 5.358 -6.388 1.00 0.00 N ATOM 1654 CA GLY A 105 -1.346 5.157 -7.825 1.00 0.00 C ATOM 1655 C GLY A 105 -0.194 5.962 -8.430 1.00 0.00 C ATOM 1656 O GLY A 105 0.403 6.801 -7.756 1.00 0.00 O ATOM 0 H GLY A 105 -1.431 4.500 -5.837 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.207 4.098 -8.040 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -2.286 5.456 -8.289 1.00 0.00 H new ATOM 1660 N LEU A 106 0.085 5.678 -9.693 1.00 0.00 N ATOM 1661 CA LEU A 106 1.156 6.365 -10.396 1.00 0.00 C ATOM 1662 C LEU A 106 0.692 6.706 -11.814 1.00 0.00 C ATOM 1663 O LEU A 106 -0.249 6.102 -12.325 1.00 0.00 O ATOM 1664 CB LEU A 106 2.443 5.538 -10.352 1.00 0.00 C ATOM 1665 CG LEU A 106 3.086 5.373 -8.974 1.00 0.00 C ATOM 1666 CD1 LEU A 106 4.141 4.264 -8.991 1.00 0.00 C ATOM 1667 CD2 LEU A 106 3.658 6.700 -8.473 1.00 0.00 C ATOM 0 H LEU A 106 -0.412 4.981 -10.248 1.00 0.00 H new ATOM 0 HA LEU A 106 1.393 7.307 -9.902 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.229 4.547 -10.752 1.00 0.00 H new ATOM 0 HB3 LEU A 106 3.172 6.000 -11.018 1.00 0.00 H new ATOM 0 HG LEU A 106 2.311 5.070 -8.270 1.00 0.00 H new ATOM 0 HD11 LEU A 106 4.583 4.167 -7.999 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.673 3.321 -9.274 1.00 0.00 H new ATOM 0 HD13 LEU A 106 4.919 4.513 -9.712 1.00 0.00 H new ATOM 0 HD21 LEU A 106 4.109 6.554 -7.491 1.00 0.00 H new ATOM 0 HD22 LEU A 106 4.415 7.056 -9.171 1.00 0.00 H new ATOM 0 HD23 LEU A 106 2.858 7.436 -8.399 1.00 0.00 H new ATOM 1679 N LYS A 107 1.375 7.673 -12.408 1.00 0.00 N ATOM 1680 CA LYS A 107 1.045 8.102 -13.757 1.00 0.00 C ATOM 1681 C LYS A 107 1.752 7.193 -14.764 1.00 0.00 C ATOM 1682 O LYS A 107 2.425 6.238 -14.378 1.00 0.00 O ATOM 1683 CB LYS A 107 1.364 9.587 -13.940 1.00 0.00 C ATOM 1684 CG LYS A 107 0.293 10.463 -13.287 1.00 0.00 C ATOM 1685 CD LYS A 107 -0.655 11.044 -14.337 1.00 0.00 C ATOM 1686 CE LYS A 107 -1.900 10.169 -14.496 1.00 0.00 C ATOM 1687 NZ LYS A 107 -2.057 9.743 -15.905 1.00 0.00 N ATOM 0 H LYS A 107 2.155 8.172 -11.980 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.026 8.005 -13.936 1.00 0.00 H new ATOM 0 HB2 LYS A 107 2.337 9.810 -13.503 1.00 0.00 H new ATOM 0 HB3 LYS A 107 1.431 9.820 -15.003 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -0.274 9.874 -12.566 1.00 0.00 H new ATOM 0 HG3 LYS A 107 0.768 11.273 -12.733 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -0.950 12.053 -14.048 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.138 11.125 -15.293 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -1.821 9.293 -13.852 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -2.783 10.722 -14.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -2.907 9.150 -15.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -2.154 10.582 -16.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -1.221 9.198 -16.198 1.00 0.00 H new ATOM 1701 N LYS A 108 1.576 7.522 -16.035 1.00 0.00 N ATOM 1702 CA LYS A 108 2.189 6.746 -17.101 1.00 0.00 C ATOM 1703 C LYS A 108 3.631 7.216 -17.303 1.00 0.00 C ATOM 1704 O LYS A 108 4.424 6.535 -17.950 1.00 0.00 O ATOM 1705 CB LYS A 108 1.337 6.813 -18.370 1.00 0.00 C ATOM 1706 CG LYS A 108 0.635 5.478 -18.629 1.00 0.00 C ATOM 1707 CD LYS A 108 1.484 4.578 -19.529 1.00 0.00 C ATOM 1708 CE LYS A 108 1.466 5.075 -20.976 1.00 0.00 C ATOM 1709 NZ LYS A 108 2.729 4.719 -21.661 1.00 0.00 N ATOM 0 H LYS A 108 1.018 8.315 -16.351 1.00 0.00 H new ATOM 0 HA LYS A 108 2.232 5.691 -16.829 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.595 7.606 -18.273 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.967 7.068 -19.222 1.00 0.00 H new ATOM 0 HG2 LYS A 108 0.443 4.974 -17.682 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.333 5.657 -19.097 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.510 4.554 -19.162 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.107 3.556 -19.487 1.00 0.00 H new ATOM 0 HE2 LYS A 108 0.621 4.637 -21.507 1.00 0.00 H new ATOM 0 HE3 LYS A 108 1.328 6.156 -20.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 2.701 5.063 -22.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 3.530 5.158 -21.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 2.845 3.685 -21.660 1.00 0.00 H new ATOM 1723 N ASN A 109 3.926 8.377 -16.736 1.00 0.00 N ATOM 1724 CA ASN A 109 5.259 8.945 -16.846 1.00 0.00 C ATOM 1725 C ASN A 109 6.139 8.393 -15.723 1.00 0.00 C ATOM 1726 O ASN A 109 7.332 8.684 -15.664 1.00 0.00 O ATOM 1727 CB ASN A 109 5.221 10.469 -16.711 1.00 0.00 C ATOM 1728 CG ASN A 109 5.910 11.142 -17.900 1.00 0.00 C ATOM 1729 OD1 ASN A 109 5.830 10.694 -19.032 1.00 0.00 O ATOM 1730 ND2 ASN A 109 6.589 12.240 -17.580 1.00 0.00 N ATOM 0 H ASN A 109 3.265 8.939 -16.200 1.00 0.00 H new ATOM 0 HA ASN A 109 5.659 8.679 -17.825 1.00 0.00 H new ATOM 0 HB2 ASN A 109 4.186 10.806 -16.647 1.00 0.00 H new ATOM 0 HB3 ASN A 109 5.712 10.768 -15.785 1.00 0.00 H new ATOM 0 HD21 ASN A 109 7.084 12.762 -18.303 1.00 0.00 H new ATOM 0 HD22 ASN A 109 6.615 12.560 -16.612 1.00 0.00 H new ATOM 1737 N GLY A 110 5.515 7.605 -14.859 1.00 0.00 N ATOM 1738 CA GLY A 110 6.226 7.010 -13.741 1.00 0.00 C ATOM 1739 C GLY A 110 6.332 7.992 -12.572 1.00 0.00 C ATOM 1740 O GLY A 110 7.384 8.107 -11.946 1.00 0.00 O ATOM 0 H GLY A 110 4.525 7.365 -14.911 1.00 0.00 H new ATOM 0 HA2 GLY A 110 5.709 6.107 -13.416 1.00 0.00 H new ATOM 0 HA3 GLY A 110 7.224 6.709 -14.059 1.00 0.00 H new ATOM 1744 N SER A 111 5.227 8.675 -12.314 1.00 0.00 N ATOM 1745 CA SER A 111 5.182 9.644 -11.232 1.00 0.00 C ATOM 1746 C SER A 111 3.872 9.500 -10.455 1.00 0.00 C ATOM 1747 O SER A 111 2.859 9.079 -11.011 1.00 0.00 O ATOM 1748 CB SER A 111 5.329 11.071 -11.763 1.00 0.00 C ATOM 1749 OG SER A 111 6.597 11.634 -11.437 1.00 0.00 O ATOM 0 H SER A 111 4.356 8.577 -12.835 1.00 0.00 H new ATOM 0 HA SER A 111 6.019 9.447 -10.562 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.200 11.070 -12.845 1.00 0.00 H new ATOM 0 HB3 SER A 111 4.538 11.695 -11.348 1.00 0.00 H new ATOM 0 HG SER A 111 6.652 12.545 -11.795 1.00 0.00 H new ATOM 1755 N CYS A 112 3.934 9.858 -9.180 1.00 0.00 N ATOM 1756 CA CYS A 112 2.765 9.774 -8.321 1.00 0.00 C ATOM 1757 C CYS A 112 1.730 10.786 -8.818 1.00 0.00 C ATOM 1758 O CYS A 112 2.072 11.925 -9.133 1.00 0.00 O ATOM 1759 CB CYS A 112 3.126 10.001 -6.852 1.00 0.00 C ATOM 1760 SG CYS A 112 4.653 9.084 -6.433 1.00 0.00 S ATOM 0 H CYS A 112 4.776 10.207 -8.722 1.00 0.00 H new ATOM 0 HA CYS A 112 2.343 8.770 -8.372 1.00 0.00 H new ATOM 0 HB2 CYS A 112 3.268 11.065 -6.664 1.00 0.00 H new ATOM 0 HB3 CYS A 112 2.307 9.671 -6.213 1.00 0.00 H new ATOM 0 HG CYS A 112 5.686 9.733 -6.882 1.00 0.00 H new ATOM 1766 N LYS A 113 0.486 10.333 -8.872 1.00 0.00 N ATOM 1767 CA LYS A 113 -0.601 11.185 -9.325 1.00 0.00 C ATOM 1768 C LYS A 113 -1.191 11.931 -8.127 1.00 0.00 C ATOM 1769 O LYS A 113 -1.497 11.324 -7.102 1.00 0.00 O ATOM 1770 CB LYS A 113 -1.630 10.368 -10.109 1.00 0.00 C ATOM 1771 CG LYS A 113 -3.053 10.703 -9.658 1.00 0.00 C ATOM 1772 CD LYS A 113 -4.087 10.064 -10.588 1.00 0.00 C ATOM 1773 CE LYS A 113 -4.344 8.606 -10.202 1.00 0.00 C ATOM 1774 NZ LYS A 113 -5.793 8.364 -10.024 1.00 0.00 N ATOM 0 H LYS A 113 0.207 9.388 -8.610 1.00 0.00 H new ATOM 0 HA LYS A 113 -0.231 11.939 -10.020 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -1.525 10.571 -11.175 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -1.440 9.304 -9.967 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -3.208 10.350 -8.639 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -3.189 11.784 -9.645 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -5.020 10.626 -10.542 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -3.735 10.115 -11.618 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -3.951 7.945 -10.974 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -3.814 8.369 -9.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -6.001 8.227 -9.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -6.328 9.182 -10.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -6.070 7.513 -10.553 1.00 0.00 H new ATOM 1788 N ARG A 114 -1.334 13.238 -8.296 1.00 0.00 N ATOM 1789 CA ARG A 114 -1.882 14.073 -7.241 1.00 0.00 C ATOM 1790 C ARG A 114 -2.954 13.309 -6.461 1.00 0.00 C ATOM 1791 O ARG A 114 -3.872 12.744 -7.053 1.00 0.00 O ATOM 1792 CB ARG A 114 -2.494 15.353 -7.815 1.00 0.00 C ATOM 1793 CG ARG A 114 -1.516 16.525 -7.707 1.00 0.00 C ATOM 1794 CD ARG A 114 -0.954 16.898 -9.080 1.00 0.00 C ATOM 1795 NE ARG A 114 -1.674 18.073 -9.619 1.00 0.00 N ATOM 1796 CZ ARG A 114 -1.481 19.331 -9.197 1.00 0.00 C ATOM 1797 NH1 ARG A 114 -0.590 19.583 -8.229 1.00 0.00 N ATOM 1798 NH2 ARG A 114 -2.180 20.335 -9.744 1.00 0.00 N ATOM 0 H ARG A 114 -1.080 13.739 -9.148 1.00 0.00 H new ATOM 0 HA ARG A 114 -1.064 14.342 -6.572 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -2.764 15.195 -8.859 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -3.414 15.592 -7.281 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -2.022 17.386 -7.271 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -0.699 16.261 -7.035 1.00 0.00 H new ATOM 0 HD2 ARG A 114 0.110 17.119 -8.999 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -1.053 16.055 -9.764 1.00 0.00 H new ATOM 0 HE ARG A 114 -2.360 17.916 -10.358 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -0.059 18.818 -7.813 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -0.443 20.540 -7.908 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -2.858 20.142 -10.481 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -2.034 21.292 -9.423 1.00 0.00 H new ATOM 1812 N GLY A 115 -2.800 13.316 -5.145 1.00 0.00 N ATOM 1813 CA GLY A 115 -3.743 12.630 -4.278 1.00 0.00 C ATOM 1814 C GLY A 115 -5.158 13.184 -4.460 1.00 0.00 C ATOM 1815 O GLY A 115 -6.116 12.422 -4.576 1.00 0.00 O ATOM 0 H GLY A 115 -2.037 13.786 -4.658 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -3.735 11.563 -4.499 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -3.435 12.743 -3.238 1.00 0.00 H new ATOM 1819 N PRO A 116 -5.245 14.541 -4.480 1.00 0.00 N ATOM 1820 CA PRO A 116 -6.527 15.205 -4.646 1.00 0.00 C ATOM 1821 C PRO A 116 -7.006 15.118 -6.096 1.00 0.00 C ATOM 1822 O PRO A 116 -8.007 15.734 -6.461 1.00 0.00 O ATOM 1823 CB PRO A 116 -6.291 16.634 -4.183 1.00 0.00 C ATOM 1824 CG PRO A 116 -4.786 16.840 -4.215 1.00 0.00 C ATOM 1825 CD PRO A 116 -4.131 15.475 -4.347 1.00 0.00 C ATOM 0 HA PRO A 116 -7.322 14.737 -4.065 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -6.796 17.345 -4.837 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -6.685 16.789 -3.179 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -4.506 17.480 -5.052 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -4.450 17.338 -3.306 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -3.474 15.434 -5.215 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.521 15.242 -3.474 1.00 0.00 H new ATOM 1833 N ARG A 117 -6.269 14.349 -6.884 1.00 0.00 N ATOM 1834 CA ARG A 117 -6.607 14.173 -8.287 1.00 0.00 C ATOM 1835 C ARG A 117 -6.736 12.686 -8.619 1.00 0.00 C ATOM 1836 O ARG A 117 -6.190 12.220 -9.618 1.00 0.00 O ATOM 1837 CB ARG A 117 -5.545 14.801 -9.191 1.00 0.00 C ATOM 1838 CG ARG A 117 -5.506 16.321 -9.019 1.00 0.00 C ATOM 1839 CD ARG A 117 -5.861 17.031 -10.327 1.00 0.00 C ATOM 1840 NE ARG A 117 -5.672 18.491 -10.178 1.00 0.00 N ATOM 1841 CZ ARG A 117 -5.724 19.363 -11.194 1.00 0.00 C ATOM 1842 NH1 ARG A 117 -5.961 18.927 -12.439 1.00 0.00 N ATOM 1843 NH2 ARG A 117 -5.540 20.670 -10.965 1.00 0.00 N ATOM 0 H ARG A 117 -5.439 13.841 -6.578 1.00 0.00 H new ATOM 0 HA ARG A 117 -7.560 14.672 -8.464 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -4.567 14.380 -8.956 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -5.756 14.555 -10.232 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -6.205 16.620 -8.238 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -4.512 16.628 -8.693 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -5.234 16.656 -11.136 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -6.894 16.816 -10.598 1.00 0.00 H new ATOM 0 HE ARG A 117 -5.491 18.857 -9.243 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -6.102 17.932 -12.613 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -6.001 19.590 -13.213 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -5.360 21.001 -10.017 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -5.580 21.334 -11.738 1.00 0.00 H new ATOM 1857 N THR A 118 -7.461 11.981 -7.763 1.00 0.00 N ATOM 1858 CA THR A 118 -7.668 10.555 -7.954 1.00 0.00 C ATOM 1859 C THR A 118 -9.163 10.231 -7.963 1.00 0.00 C ATOM 1860 O THR A 118 -9.988 11.074 -7.615 1.00 0.00 O ATOM 1861 CB THR A 118 -6.892 9.815 -6.863 1.00 0.00 C ATOM 1862 OG1 THR A 118 -7.116 10.592 -5.689 1.00 0.00 O ATOM 1863 CG2 THR A 118 -5.378 9.883 -7.072 1.00 0.00 C ATOM 0 H THR A 118 -7.912 12.370 -6.935 1.00 0.00 H new ATOM 0 HA THR A 118 -7.290 10.226 -8.922 1.00 0.00 H new ATOM 0 HB THR A 118 -7.208 8.772 -6.837 1.00 0.00 H new ATOM 0 HG1 THR A 118 -6.296 11.074 -5.454 1.00 0.00 H new ATOM 0 HG21 THR A 118 -4.875 9.342 -6.270 1.00 0.00 H new ATOM 0 HG22 THR A 118 -5.122 9.431 -8.030 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.056 10.924 -7.065 1.00 0.00 H new ATOM 1871 N HIS A 119 -9.467 9.005 -8.365 1.00 0.00 N ATOM 1872 CA HIS A 119 -10.849 8.559 -8.425 1.00 0.00 C ATOM 1873 C HIS A 119 -10.926 7.078 -8.048 1.00 0.00 C ATOM 1874 O HIS A 119 -9.924 6.366 -8.106 1.00 0.00 O ATOM 1875 CB HIS A 119 -11.456 8.853 -9.797 1.00 0.00 C ATOM 1876 CG HIS A 119 -11.559 10.325 -10.121 1.00 0.00 C ATOM 1877 ND1 HIS A 119 -10.755 10.943 -11.062 1.00 0.00 N ATOM 1878 CD2 HIS A 119 -12.379 11.292 -9.619 1.00 0.00 C ATOM 1879 CE1 HIS A 119 -11.084 12.225 -11.116 1.00 0.00 C ATOM 1880 NE2 HIS A 119 -12.090 12.440 -10.220 1.00 0.00 N ATOM 0 H HIS A 119 -8.780 8.307 -8.652 1.00 0.00 H new ATOM 0 HA HIS A 119 -11.446 9.115 -7.702 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -10.853 8.364 -10.562 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -12.451 8.410 -9.845 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -13.135 11.148 -8.861 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -10.635 12.969 -11.757 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -12.545 13.335 -10.041 1.00 0.00 H new ATOM 1888 N TYR A 120 -12.124 6.658 -7.670 1.00 0.00 N ATOM 1889 CA TYR A 120 -12.345 5.275 -7.283 1.00 0.00 C ATOM 1890 C TYR A 120 -12.750 4.426 -8.490 1.00 0.00 C ATOM 1891 O TYR A 120 -13.616 4.822 -9.269 1.00 0.00 O ATOM 1892 CB TYR A 120 -13.500 5.297 -6.280 1.00 0.00 C ATOM 1893 CG TYR A 120 -13.988 3.908 -5.862 1.00 0.00 C ATOM 1894 CD1 TYR A 120 -13.080 2.950 -5.459 1.00 0.00 C ATOM 1895 CD2 TYR A 120 -15.336 3.613 -5.889 1.00 0.00 C ATOM 1896 CE1 TYR A 120 -13.539 1.643 -5.067 1.00 0.00 C ATOM 1897 CE2 TYR A 120 -15.795 2.306 -5.496 1.00 0.00 C ATOM 1898 CZ TYR A 120 -14.874 1.386 -5.104 1.00 0.00 C ATOM 1899 OH TYR A 120 -15.308 0.151 -4.733 1.00 0.00 O ATOM 0 H TYR A 120 -12.952 7.251 -7.623 1.00 0.00 H new ATOM 0 HA TYR A 120 -11.436 4.844 -6.864 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -13.185 5.843 -5.391 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -14.334 5.849 -6.714 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -12.025 3.181 -5.438 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -16.047 4.362 -6.205 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -12.839 0.884 -4.751 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -16.847 2.062 -5.512 1.00 0.00 H new ATOM 0 HH TYR A 120 -16.284 0.111 -4.808 1.00 0.00 H new ATOM 1909 N GLY A 121 -12.104 3.275 -8.607 1.00 0.00 N ATOM 1910 CA GLY A 121 -12.386 2.367 -9.706 1.00 0.00 C ATOM 1911 C GLY A 121 -11.364 2.536 -10.832 1.00 0.00 C ATOM 1912 O GLY A 121 -11.549 2.006 -11.927 1.00 0.00 O ATOM 0 H GLY A 121 -11.386 2.950 -7.959 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -12.369 1.338 -9.346 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -13.389 2.554 -10.089 1.00 0.00 H new ATOM 1916 N GLN A 122 -10.309 3.275 -10.525 1.00 0.00 N ATOM 1917 CA GLN A 122 -9.258 3.520 -11.498 1.00 0.00 C ATOM 1918 C GLN A 122 -8.163 2.459 -11.374 1.00 0.00 C ATOM 1919 O GLN A 122 -7.928 1.926 -10.290 1.00 0.00 O ATOM 1920 CB GLN A 122 -8.678 4.927 -11.336 1.00 0.00 C ATOM 1921 CG GLN A 122 -9.734 5.993 -11.636 1.00 0.00 C ATOM 1922 CD GLN A 122 -9.104 7.218 -12.301 1.00 0.00 C ATOM 1923 OE1 GLN A 122 -8.757 8.178 -11.449 1.00 0.00 O flip ATOM 1924 NE2 GLN A 122 -8.944 7.286 -13.509 1.00 0.00 N flip ATOM 0 H GLN A 122 -10.159 3.713 -9.616 1.00 0.00 H new ATOM 0 HA GLN A 122 -9.691 3.453 -12.496 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -8.305 5.056 -10.320 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -7.828 5.053 -12.006 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -10.502 5.576 -12.288 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -10.228 6.291 -10.711 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -9.234 6.511 -14.106 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -8.521 8.117 -13.921 1.00 0.00 H new ATOM 1933 N LYS A 123 -7.521 2.182 -12.500 1.00 0.00 N ATOM 1934 CA LYS A 123 -6.456 1.194 -12.532 1.00 0.00 C ATOM 1935 C LYS A 123 -5.206 1.776 -11.869 1.00 0.00 C ATOM 1936 O LYS A 123 -4.232 1.062 -11.640 1.00 0.00 O ATOM 1937 CB LYS A 123 -6.223 0.704 -13.962 1.00 0.00 C ATOM 1938 CG LYS A 123 -5.438 -0.610 -13.970 1.00 0.00 C ATOM 1939 CD LYS A 123 -6.239 -1.723 -14.649 1.00 0.00 C ATOM 1940 CE LYS A 123 -6.313 -1.501 -16.162 1.00 0.00 C ATOM 1941 NZ LYS A 123 -7.615 -1.963 -16.691 1.00 0.00 N ATOM 0 H LYS A 123 -7.718 2.625 -13.397 1.00 0.00 H new ATOM 0 HA LYS A 123 -6.738 0.311 -11.959 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -7.181 0.563 -14.462 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -5.678 1.461 -14.525 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -4.491 -0.469 -14.491 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -5.199 -0.901 -12.947 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -5.776 -2.688 -14.442 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -7.246 -1.757 -14.233 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -6.177 -0.443 -16.387 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -5.503 -2.038 -16.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -7.648 -1.805 -17.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -7.730 -2.977 -16.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -8.384 -1.432 -16.234 1.00 0.00 H new ATOM 1955 N ALA A 124 -5.275 3.068 -11.581 1.00 0.00 N ATOM 1956 CA ALA A 124 -4.161 3.754 -10.949 1.00 0.00 C ATOM 1957 C ALA A 124 -4.139 3.415 -9.457 1.00 0.00 C ATOM 1958 O ALA A 124 -3.181 2.819 -8.967 1.00 0.00 O ATOM 1959 CB ALA A 124 -4.276 5.258 -11.204 1.00 0.00 C ATOM 0 H ALA A 124 -6.085 3.657 -11.774 1.00 0.00 H new ATOM 0 HA ALA A 124 -3.214 3.423 -11.376 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -3.440 5.772 -10.730 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.257 5.448 -12.277 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -5.213 5.627 -10.787 1.00 0.00 H new ATOM 1965 N ILE A 125 -5.205 3.811 -8.778 1.00 0.00 N ATOM 1966 CA ILE A 125 -5.320 3.557 -7.352 1.00 0.00 C ATOM 1967 C ILE A 125 -5.116 2.064 -7.086 1.00 0.00 C ATOM 1968 O ILE A 125 -4.478 1.686 -6.104 1.00 0.00 O ATOM 1969 CB ILE A 125 -6.645 4.102 -6.815 1.00 0.00 C ATOM 1970 CG1 ILE A 125 -7.795 3.137 -7.113 1.00 0.00 C ATOM 1971 CG2 ILE A 125 -6.920 5.506 -7.358 1.00 0.00 C ATOM 1972 CD1 ILE A 125 -9.101 3.633 -6.489 1.00 0.00 C ATOM 0 H ILE A 125 -5.997 4.306 -9.189 1.00 0.00 H new ATOM 0 HA ILE A 125 -4.540 4.088 -6.807 1.00 0.00 H new ATOM 0 HB ILE A 125 -6.567 4.185 -5.731 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -7.919 3.034 -8.191 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -7.555 2.148 -6.724 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -7.868 5.870 -6.961 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -6.117 6.177 -7.054 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -6.972 5.472 -8.446 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -9.902 2.930 -6.715 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -8.981 3.711 -5.408 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -9.351 4.612 -6.898 1.00 0.00 H new ATOM 1984 N LEU A 126 -5.671 1.256 -7.978 1.00 0.00 N ATOM 1985 CA LEU A 126 -5.558 -0.187 -7.851 1.00 0.00 C ATOM 1986 C LEU A 126 -4.086 -0.591 -7.956 1.00 0.00 C ATOM 1987 O LEU A 126 -3.386 -0.165 -8.874 1.00 0.00 O ATOM 1988 CB LEU A 126 -6.461 -0.886 -8.870 1.00 0.00 C ATOM 1989 CG LEU A 126 -7.964 -0.660 -8.700 1.00 0.00 C ATOM 1990 CD1 LEU A 126 -8.743 -1.237 -9.884 1.00 0.00 C ATOM 1991 CD2 LEU A 126 -8.456 -1.219 -7.363 1.00 0.00 C ATOM 0 H LEU A 126 -6.200 1.573 -8.791 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.909 -0.512 -6.871 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -6.174 -0.554 -9.868 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.267 -1.958 -8.823 1.00 0.00 H new ATOM 0 HG LEU A 126 -8.148 0.414 -8.686 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -9.809 -1.063 -9.738 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -8.419 -0.751 -10.804 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -8.557 -2.309 -9.954 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -9.528 -1.045 -7.268 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -8.257 -2.290 -7.321 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -7.934 -0.721 -6.546 1.00 0.00 H new ATOM 2003 N PHE A 127 -3.660 -1.407 -7.003 1.00 0.00 N ATOM 2004 CA PHE A 127 -2.284 -1.872 -6.977 1.00 0.00 C ATOM 2005 C PHE A 127 -2.221 -3.386 -6.761 1.00 0.00 C ATOM 2006 O PHE A 127 -3.145 -3.976 -6.204 1.00 0.00 O ATOM 2007 CB PHE A 127 -1.598 -1.173 -5.801 1.00 0.00 C ATOM 2008 CG PHE A 127 -0.785 0.061 -6.200 1.00 0.00 C ATOM 2009 CD1 PHE A 127 -0.005 0.031 -7.313 1.00 0.00 C ATOM 2010 CD2 PHE A 127 -0.843 1.187 -5.440 1.00 0.00 C ATOM 2011 CE1 PHE A 127 0.748 1.176 -7.683 1.00 0.00 C ATOM 2012 CE2 PHE A 127 -0.089 2.333 -5.810 1.00 0.00 C ATOM 2013 CZ PHE A 127 0.691 2.303 -6.923 1.00 0.00 C ATOM 0 H PHE A 127 -4.243 -1.758 -6.243 1.00 0.00 H new ATOM 0 HA PHE A 127 -1.797 -1.646 -7.926 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -2.355 -0.877 -5.075 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -0.939 -1.884 -5.303 1.00 0.00 H new ATOM 0 HD1 PHE A 127 0.042 -0.864 -7.916 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -1.462 1.210 -4.555 1.00 0.00 H new ATOM 0 HE1 PHE A 127 1.366 1.153 -8.568 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -0.136 3.228 -5.207 1.00 0.00 H new ATOM 0 HZ PHE A 127 1.265 3.174 -7.204 1.00 0.00 H new ATOM 2023 N LEU A 128 -1.122 -3.971 -7.214 1.00 0.00 N ATOM 2024 CA LEU A 128 -0.926 -5.404 -7.078 1.00 0.00 C ATOM 2025 C LEU A 128 0.472 -5.673 -6.517 1.00 0.00 C ATOM 2026 O LEU A 128 1.473 -5.395 -7.176 1.00 0.00 O ATOM 2027 CB LEU A 128 -1.202 -6.111 -8.407 1.00 0.00 C ATOM 2028 CG LEU A 128 -2.219 -7.253 -8.360 1.00 0.00 C ATOM 2029 CD1 LEU A 128 -2.158 -8.094 -9.637 1.00 0.00 C ATOM 2030 CD2 LEU A 128 -2.030 -8.105 -7.104 1.00 0.00 C ATOM 0 H LEU A 128 -0.358 -3.478 -7.676 1.00 0.00 H new ATOM 0 HA LEU A 128 -1.640 -5.820 -6.367 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -1.551 -5.369 -9.125 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -0.260 -6.505 -8.789 1.00 0.00 H new ATOM 0 HG LEU A 128 -3.217 -6.819 -8.307 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -2.891 -8.899 -9.578 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -2.380 -7.464 -10.498 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -1.160 -8.519 -9.745 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -2.766 -8.909 -7.096 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -1.027 -8.531 -7.101 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -2.163 -7.483 -6.219 1.00 0.00 H new ATOM 2042 N PRO A 129 0.496 -6.225 -5.275 1.00 0.00 N ATOM 2043 CA PRO A 129 1.754 -6.534 -4.618 1.00 0.00 C ATOM 2044 C PRO A 129 2.396 -7.784 -5.223 1.00 0.00 C ATOM 2045 O PRO A 129 1.841 -8.878 -5.130 1.00 0.00 O ATOM 2046 CB PRO A 129 1.401 -6.700 -3.149 1.00 0.00 C ATOM 2047 CG PRO A 129 -0.100 -6.937 -3.105 1.00 0.00 C ATOM 2048 CD PRO A 129 -0.670 -6.568 -4.465 1.00 0.00 C ATOM 0 HA PRO A 129 2.500 -5.750 -4.748 1.00 0.00 H new ATOM 0 HB2 PRO A 129 1.942 -7.538 -2.710 1.00 0.00 H new ATOM 0 HB3 PRO A 129 1.673 -5.812 -2.579 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -0.315 -7.980 -2.871 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -0.559 -6.333 -2.322 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -1.224 -7.399 -4.901 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -1.361 -5.728 -4.390 1.00 0.00 H new ATOM 2056 N LEU A 130 3.556 -7.580 -5.830 1.00 0.00 N ATOM 2057 CA LEU A 130 4.279 -8.677 -6.451 1.00 0.00 C ATOM 2058 C LEU A 130 5.277 -9.258 -5.446 1.00 0.00 C ATOM 2059 O LEU A 130 5.896 -8.519 -4.683 1.00 0.00 O ATOM 2060 CB LEU A 130 4.922 -8.221 -7.762 1.00 0.00 C ATOM 2061 CG LEU A 130 3.971 -8.036 -8.946 1.00 0.00 C ATOM 2062 CD1 LEU A 130 3.394 -9.378 -9.402 1.00 0.00 C ATOM 2063 CD2 LEU A 130 2.873 -7.023 -8.614 1.00 0.00 C ATOM 0 H LEU A 130 4.013 -6.671 -5.905 1.00 0.00 H new ATOM 0 HA LEU A 130 3.594 -9.480 -6.722 1.00 0.00 H new ATOM 0 HB2 LEU A 130 5.435 -7.276 -7.583 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.683 -8.949 -8.043 1.00 0.00 H new ATOM 0 HG LEU A 130 4.541 -7.631 -9.782 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.721 -9.217 -10.245 1.00 0.00 H new ATOM 0 HD12 LEU A 130 4.206 -10.039 -9.706 1.00 0.00 H new ATOM 0 HD13 LEU A 130 2.843 -9.835 -8.580 1.00 0.00 H new ATOM 0 HD21 LEU A 130 2.211 -6.910 -9.472 1.00 0.00 H new ATOM 0 HD22 LEU A 130 2.299 -7.376 -7.757 1.00 0.00 H new ATOM 0 HD23 LEU A 130 3.326 -6.061 -8.376 1.00 0.00 H new ATOM 2075 N PRO A 131 5.405 -10.611 -5.480 1.00 0.00 N ATOM 2076 CA PRO A 131 6.316 -11.300 -4.582 1.00 0.00 C ATOM 2077 C PRO A 131 7.768 -11.117 -5.029 1.00 0.00 C ATOM 2078 O PRO A 131 8.182 -11.666 -6.049 1.00 0.00 O ATOM 2079 CB PRO A 131 5.867 -12.752 -4.603 1.00 0.00 C ATOM 2080 CG PRO A 131 5.024 -12.910 -5.858 1.00 0.00 C ATOM 2081 CD PRO A 131 4.688 -11.519 -6.371 1.00 0.00 C ATOM 0 HA PRO A 131 6.287 -10.903 -3.567 1.00 0.00 H new ATOM 0 HB2 PRO A 131 6.724 -13.425 -4.621 1.00 0.00 H new ATOM 0 HB3 PRO A 131 5.289 -12.995 -3.711 1.00 0.00 H new ATOM 0 HG2 PRO A 131 5.568 -13.475 -6.615 1.00 0.00 H new ATOM 0 HG3 PRO A 131 4.113 -13.466 -5.638 1.00 0.00 H new ATOM 0 HD2 PRO A 131 5.006 -11.391 -7.406 1.00 0.00 H new ATOM 0 HD3 PRO A 131 3.614 -11.335 -6.343 1.00 0.00 H new ATOM 2089 N VAL A 132 8.502 -10.343 -4.243 1.00 0.00 N ATOM 2090 CA VAL A 132 9.899 -10.080 -4.544 1.00 0.00 C ATOM 2091 C VAL A 132 10.771 -10.614 -3.406 1.00 0.00 C ATOM 2092 O VAL A 132 10.399 -10.519 -2.237 1.00 0.00 O ATOM 2093 CB VAL A 132 10.106 -8.587 -4.807 1.00 0.00 C ATOM 2094 CG1 VAL A 132 10.102 -7.795 -3.498 1.00 0.00 C ATOM 2095 CG2 VAL A 132 11.396 -8.343 -5.592 1.00 0.00 C ATOM 0 H VAL A 132 8.155 -9.889 -3.398 1.00 0.00 H new ATOM 0 HA VAL A 132 10.198 -10.601 -5.454 1.00 0.00 H new ATOM 0 HB VAL A 132 9.273 -8.234 -5.415 1.00 0.00 H new ATOM 0 HG11 VAL A 132 10.251 -6.737 -3.713 1.00 0.00 H new ATOM 0 HG12 VAL A 132 9.146 -7.932 -2.993 1.00 0.00 H new ATOM 0 HG13 VAL A 132 10.906 -8.151 -2.855 1.00 0.00 H new ATOM 0 HG21 VAL A 132 11.520 -7.274 -5.766 1.00 0.00 H new ATOM 0 HG22 VAL A 132 12.246 -8.718 -5.022 1.00 0.00 H new ATOM 0 HG23 VAL A 132 11.343 -8.862 -6.549 1.00 0.00 H new ATOM 2105 N SER A 133 11.915 -11.163 -3.787 1.00 0.00 N ATOM 2106 CA SER A 133 12.843 -11.712 -2.813 1.00 0.00 C ATOM 2107 C SER A 133 12.188 -12.875 -2.063 1.00 0.00 C ATOM 2108 O SER A 133 11.031 -12.782 -1.656 1.00 0.00 O ATOM 2109 CB SER A 133 13.305 -10.638 -1.826 1.00 0.00 C ATOM 2110 OG SER A 133 13.951 -11.201 -0.688 1.00 0.00 O ATOM 0 H SER A 133 12.220 -11.239 -4.757 1.00 0.00 H new ATOM 0 HA SER A 133 13.720 -12.079 -3.346 1.00 0.00 H new ATOM 0 HB2 SER A 133 13.988 -9.953 -2.329 1.00 0.00 H new ATOM 0 HB3 SER A 133 12.446 -10.050 -1.502 1.00 0.00 H new ATOM 0 HG SER A 133 14.232 -10.483 -0.083 1.00 0.00 H new ATOM 2116 N SER A 134 12.956 -13.942 -1.905 1.00 0.00 N ATOM 2117 CA SER A 134 12.466 -15.121 -1.212 1.00 0.00 C ATOM 2118 C SER A 134 11.299 -15.736 -1.988 1.00 0.00 C ATOM 2119 O SER A 134 10.850 -15.177 -2.987 1.00 0.00 O ATOM 2120 CB SER A 134 12.034 -14.781 0.215 1.00 0.00 C ATOM 2121 OG SER A 134 12.533 -15.722 1.162 1.00 0.00 O ATOM 0 H SER A 134 13.915 -14.015 -2.245 1.00 0.00 H new ATOM 0 HA SER A 134 13.278 -15.846 -1.154 1.00 0.00 H new ATOM 0 HB2 SER A 134 12.389 -13.783 0.473 1.00 0.00 H new ATOM 0 HB3 SER A 134 10.946 -14.756 0.268 1.00 0.00 H new ATOM 0 HG SER A 134 12.237 -15.469 2.061 1.00 0.00 H new ATOM 2127 N ASP A 135 10.841 -16.878 -1.497 1.00 0.00 N ATOM 2128 CA ASP A 135 9.734 -17.575 -2.132 1.00 0.00 C ATOM 2129 C ASP A 135 8.571 -17.682 -1.144 1.00 0.00 C ATOM 2130 O ASP A 135 7.438 -17.338 -1.475 1.00 0.00 O ATOM 2131 CB ASP A 135 10.139 -18.993 -2.542 1.00 0.00 C ATOM 2132 CG ASP A 135 9.980 -19.305 -4.031 1.00 0.00 C ATOM 2133 OD1 ASP A 135 8.847 -19.134 -4.529 1.00 0.00 O ATOM 2134 OD2 ASP A 135 10.996 -19.708 -4.638 1.00 0.00 O ATOM 0 H ASP A 135 11.216 -17.338 -0.667 1.00 0.00 H new ATOM 0 HA ASP A 135 9.445 -17.012 -3.019 1.00 0.00 H new ATOM 0 HB2 ASP A 135 11.180 -19.153 -2.262 1.00 0.00 H new ATOM 0 HB3 ASP A 135 9.542 -19.705 -1.971 1.00 0.00 H new ATOM 2139 N LEU A 136 8.892 -18.161 0.049 1.00 0.00 N ATOM 2140 CA LEU A 136 7.888 -18.318 1.087 1.00 0.00 C ATOM 2141 C LEU A 136 6.647 -18.988 0.493 1.00 0.00 C ATOM 2142 O LEU A 136 6.671 -19.446 -0.648 1.00 0.00 O ATOM 2143 CB LEU A 136 7.599 -16.975 1.761 1.00 0.00 C ATOM 2144 CG LEU A 136 7.687 -16.958 3.288 1.00 0.00 C ATOM 2145 CD1 LEU A 136 8.845 -16.076 3.761 1.00 0.00 C ATOM 2146 CD2 LEU A 136 6.355 -16.536 3.910 1.00 0.00 C ATOM 0 H LEU A 136 9.833 -18.445 0.320 1.00 0.00 H new ATOM 0 HA LEU A 136 8.256 -18.972 1.877 1.00 0.00 H new ATOM 0 HB2 LEU A 136 8.298 -16.236 1.368 1.00 0.00 H new ATOM 0 HB3 LEU A 136 6.599 -16.653 1.471 1.00 0.00 H new ATOM 0 HG LEU A 136 7.894 -17.972 3.629 1.00 0.00 H new ATOM 0 HD11 LEU A 136 8.885 -16.081 4.850 1.00 0.00 H new ATOM 0 HD12 LEU A 136 9.783 -16.462 3.361 1.00 0.00 H new ATOM 0 HD13 LEU A 136 8.693 -15.056 3.409 1.00 0.00 H new ATOM 0 HD21 LEU A 136 6.446 -16.532 4.996 1.00 0.00 H new ATOM 0 HD22 LEU A 136 6.093 -15.536 3.564 1.00 0.00 H new ATOM 0 HD23 LEU A 136 5.576 -17.238 3.613 1.00 0.00 H new ATOM 2158 N GLU A 137 5.592 -19.022 1.294 1.00 0.00 N ATOM 2159 CA GLU A 137 4.344 -19.628 0.862 1.00 0.00 C ATOM 2160 C GLU A 137 3.426 -19.867 2.063 1.00 0.00 C ATOM 2161 O GLU A 137 3.544 -20.882 2.747 1.00 0.00 O ATOM 2162 CB GLU A 137 4.601 -20.930 0.101 1.00 0.00 C ATOM 2163 CG GLU A 137 4.238 -20.782 -1.378 1.00 0.00 C ATOM 2164 CD GLU A 137 4.105 -22.150 -2.050 1.00 0.00 C ATOM 2165 OE1 GLU A 137 3.290 -22.953 -1.546 1.00 0.00 O ATOM 2166 OE2 GLU A 137 4.821 -22.362 -3.052 1.00 0.00 O ATOM 0 H GLU A 137 5.576 -18.640 2.240 1.00 0.00 H new ATOM 0 HA GLU A 137 3.846 -18.939 0.180 1.00 0.00 H new ATOM 0 HB2 GLU A 137 5.650 -21.209 0.195 1.00 0.00 H new ATOM 0 HB3 GLU A 137 4.016 -21.736 0.544 1.00 0.00 H new ATOM 0 HG2 GLU A 137 3.301 -20.234 -1.473 1.00 0.00 H new ATOM 0 HG3 GLU A 137 5.003 -20.196 -1.887 1.00 0.00 H new ATOM 2173 N HIS A 138 2.532 -18.914 2.282 1.00 0.00 N ATOM 2174 CA HIS A 138 1.594 -19.008 3.388 1.00 0.00 C ATOM 2175 C HIS A 138 2.362 -19.029 4.712 1.00 0.00 C ATOM 2176 O HIS A 138 3.268 -19.841 4.895 1.00 0.00 O ATOM 2177 CB HIS A 138 0.673 -20.218 3.219 1.00 0.00 C ATOM 2178 CG HIS A 138 -0.279 -20.431 4.371 1.00 0.00 C ATOM 2179 ND1 HIS A 138 -0.733 -19.396 5.170 1.00 0.00 N ATOM 2180 CD2 HIS A 138 -0.860 -21.569 4.849 1.00 0.00 C ATOM 2181 CE1 HIS A 138 -1.548 -19.900 6.085 1.00 0.00 C ATOM 2182 NE2 HIS A 138 -1.625 -21.247 5.884 1.00 0.00 N ATOM 0 H HIS A 138 2.437 -18.073 1.713 1.00 0.00 H new ATOM 0 HA HIS A 138 0.947 -18.131 3.396 1.00 0.00 H new ATOM 0 HB2 HIS A 138 0.096 -20.097 2.302 1.00 0.00 H new ATOM 0 HB3 HIS A 138 1.284 -21.112 3.096 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -0.721 -22.564 4.452 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -2.061 -19.342 6.855 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -2.180 -21.899 6.438 1.00 0.00 H new ATOM 2190 N HIS A 139 1.972 -18.126 5.599 1.00 0.00 N ATOM 2191 CA HIS A 139 2.612 -18.030 6.900 1.00 0.00 C ATOM 2192 C HIS A 139 1.564 -17.701 7.965 1.00 0.00 C ATOM 2193 O HIS A 139 1.139 -18.578 8.715 1.00 0.00 O ATOM 2194 CB HIS A 139 3.762 -17.021 6.867 1.00 0.00 C ATOM 2195 CG HIS A 139 5.122 -17.632 7.103 1.00 0.00 C ATOM 2196 ND1 HIS A 139 5.996 -17.166 8.070 1.00 0.00 N ATOM 2197 CD2 HIS A 139 5.750 -18.675 6.487 1.00 0.00 C ATOM 2198 CE1 HIS A 139 7.097 -17.903 8.029 1.00 0.00 C ATOM 2199 NE2 HIS A 139 6.942 -18.838 7.047 1.00 0.00 N ATOM 0 H HIS A 139 1.221 -17.454 5.443 1.00 0.00 H new ATOM 0 HA HIS A 139 3.056 -18.990 7.162 1.00 0.00 H new ATOM 0 HB2 HIS A 139 3.764 -16.519 5.900 1.00 0.00 H new ATOM 0 HB3 HIS A 139 3.583 -16.256 7.623 1.00 0.00 H new ATOM 0 HD2 HIS A 139 5.345 -19.268 5.680 1.00 0.00 H new ATOM 0 HE1 HIS A 139 7.964 -17.784 8.662 1.00 0.00 H new ATOM 0 HE2 HIS A 139 7.629 -19.545 6.786 1.00 0.00 H new ATOM 2207 N HIS A 140 1.179 -16.434 7.998 1.00 0.00 N ATOM 2208 CA HIS A 140 0.189 -15.977 8.958 1.00 0.00 C ATOM 2209 C HIS A 140 0.575 -16.454 10.360 1.00 0.00 C ATOM 2210 O HIS A 140 0.291 -17.591 10.733 1.00 0.00 O ATOM 2211 CB HIS A 140 -1.215 -16.425 8.546 1.00 0.00 C ATOM 2212 CG HIS A 140 -2.322 -15.551 9.087 1.00 0.00 C ATOM 2213 ND1 HIS A 140 -2.430 -14.205 8.784 1.00 0.00 N ATOM 2214 CD2 HIS A 140 -3.367 -15.846 9.912 1.00 0.00 C ATOM 2215 CE1 HIS A 140 -3.495 -13.721 9.405 1.00 0.00 C ATOM 2216 NE2 HIS A 140 -4.075 -14.739 10.104 1.00 0.00 N ATOM 0 H HIS A 140 1.535 -15.709 7.375 1.00 0.00 H new ATOM 0 HA HIS A 140 0.170 -14.887 8.975 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -1.276 -16.439 7.458 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -1.374 -17.448 8.887 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -3.582 -16.815 10.337 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -3.843 -12.699 9.365 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -4.914 -14.662 10.679 1.00 0.00 H new ATOM 2224 N HIS A 141 1.218 -15.561 11.098 1.00 0.00 N ATOM 2225 CA HIS A 141 1.646 -15.877 12.450 1.00 0.00 C ATOM 2226 C HIS A 141 0.422 -16.158 13.324 1.00 0.00 C ATOM 2227 O HIS A 141 -0.708 -15.891 12.919 1.00 0.00 O ATOM 2228 CB HIS A 141 2.533 -14.764 13.012 1.00 0.00 C ATOM 2229 CG HIS A 141 3.968 -15.177 13.238 1.00 0.00 C ATOM 2230 ND1 HIS A 141 4.338 -16.118 14.183 1.00 0.00 N ATOM 2231 CD2 HIS A 141 5.119 -14.769 12.630 1.00 0.00 C ATOM 2232 CE1 HIS A 141 5.654 -16.261 14.138 1.00 0.00 C ATOM 2233 NE2 HIS A 141 6.136 -15.423 13.176 1.00 0.00 N ATOM 0 H HIS A 141 1.453 -14.619 10.785 1.00 0.00 H new ATOM 0 HA HIS A 141 2.257 -16.780 12.441 1.00 0.00 H new ATOM 0 HB2 HIS A 141 2.513 -13.917 12.327 1.00 0.00 H new ATOM 0 HB3 HIS A 141 2.112 -14.420 13.957 1.00 0.00 H new ATOM 0 HD2 HIS A 141 5.190 -14.038 11.838 1.00 0.00 H new ATOM 0 HE1 HIS A 141 6.242 -16.925 14.755 1.00 0.00 H new ATOM 0 HE2 HIS A 141 7.117 -15.317 12.919 1.00 0.00 H new ATOM 2241 N HIS A 142 0.690 -16.693 14.506 1.00 0.00 N ATOM 2242 CA HIS A 142 -0.376 -17.013 15.440 1.00 0.00 C ATOM 2243 C HIS A 142 -1.035 -15.722 15.930 1.00 0.00 C ATOM 2244 O HIS A 142 -0.388 -14.896 16.571 1.00 0.00 O ATOM 2245 CB HIS A 142 0.148 -17.883 16.585 1.00 0.00 C ATOM 2246 CG HIS A 142 -0.654 -19.141 16.818 1.00 0.00 C ATOM 2247 ND1 HIS A 142 -1.917 -19.130 17.384 1.00 0.00 N ATOM 2248 CD2 HIS A 142 -0.360 -20.446 16.555 1.00 0.00 C ATOM 2249 CE1 HIS A 142 -2.354 -20.379 17.455 1.00 0.00 C ATOM 2250 NE2 HIS A 142 -1.387 -21.193 16.941 1.00 0.00 N ATOM 0 H HIS A 142 1.629 -16.913 14.838 1.00 0.00 H new ATOM 0 HA HIS A 142 -1.142 -17.601 14.935 1.00 0.00 H new ATOM 0 HB2 HIS A 142 1.182 -18.157 16.375 1.00 0.00 H new ATOM 0 HB3 HIS A 142 0.154 -17.294 17.502 1.00 0.00 H new ATOM 0 HD2 HIS A 142 0.553 -20.810 16.108 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -3.308 -20.697 17.850 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -1.444 -22.209 16.866 1.00 0.00 H new ATOM 2258 N HIS A 143 -2.313 -15.589 15.609 1.00 0.00 N ATOM 2259 CA HIS A 143 -3.066 -14.413 16.008 1.00 0.00 C ATOM 2260 C HIS A 143 -2.275 -13.152 15.655 1.00 0.00 C ATOM 2261 O HIS A 143 -1.513 -13.143 14.689 1.00 0.00 O ATOM 2262 CB HIS A 143 -3.439 -14.483 17.490 1.00 0.00 C ATOM 2263 CG HIS A 143 -2.469 -13.769 18.402 1.00 0.00 C ATOM 2264 ND1 HIS A 143 -2.449 -12.392 18.544 1.00 0.00 N ATOM 2265 CD2 HIS A 143 -1.489 -14.255 19.216 1.00 0.00 C ATOM 2266 CE1 HIS A 143 -1.494 -12.075 19.406 1.00 0.00 C ATOM 2267 NE2 HIS A 143 -0.900 -13.231 19.821 1.00 0.00 N ATOM 0 H HIS A 143 -2.846 -16.277 15.077 1.00 0.00 H new ATOM 0 HA HIS A 143 -4.006 -14.376 15.458 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -4.432 -14.054 17.625 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -3.501 -15.529 17.790 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -1.235 -15.297 19.346 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -1.232 -11.077 19.724 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -0.130 -13.297 20.487 1.00 0.00 H new TER 2275 HIS A 143