USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1085 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 12 LYS NZ :NH3+ 179:sc= 1.17 (180deg=0) USER MOD Set 1.2: A 89 HIS : no HD1:sc= 0.586 K(o=1.8,f=-4.2!) USER MOD Set 2.1: A 29 TYR OH : rot -10:sc= 0.918 USER MOD Set 2.2: A 97 THR OG1 : rot 114:sc= 1.6 USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0174) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -0.996! C(o=-1!,f=-7.3!) USER MOD Single : A 39 ASN : amide:sc= -0.188 X(o=-0.19,f=-0.03) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0.542 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 CYS SG : rot 180:sc= -0.502 USER MOD Single : A 58 GLN : amide:sc= -0.0859 K(o=-0.086,f=-1.1) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 62:sc= 0.164 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.432 K(o=-0.43,f=-6.2!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.118 K(o=-0.12,f=-1.9!) USER MOD Single : A 81 THR OG1 : rot 65:sc= 1.21 USER MOD Single : A 83 CYS SG : rot 72:sc= -0.891 USER MOD Single : A 87 CYS SG : rot 140:sc=-0.00455 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 169:sc=-0.00889 (180deg=-0.141) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 GLN : amide:sc= -0.0253 K(o=-0.025,f=-3.7!) USER MOD Single : A 107 HIS : no HD1:sc= 0.313 K(o=0.31,f=-1.8!) USER MOD Single : A 112 THR OG1 : rot 83:sc= 1.24 USER MOD Single : A 114 THR OG1 : rot -50:sc= 0.83 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0.0944 USER MOD Single : A 121 THR OG1 : rot 62:sc= 0.478 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 43:sc= 0.0906 USER MOD Single : A 128 SER OG : rot 49:sc= 0.64 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 ASN : amide:sc= -0.0136 K(o=-0.014,f=-1.5) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 -4.816 0.013 -5.890 1.00 13.00 N ATOM 2 CA GLY A 2 -5.561 -0.135 -7.126 1.00 45.03 C ATOM 3 C GLY A 2 -4.662 -0.395 -8.319 1.00 20.01 C ATOM 4 O GLY A 2 -3.793 -1.265 -8.271 1.00 3.12 O ATOM 0 HA2 GLY A 2 -6.269 -0.957 -7.023 1.00 45.03 H new ATOM 0 HA3 GLY A 2 -6.145 0.768 -7.305 1.00 45.03 H new ATOM 8 N ALA A 3 -4.871 0.361 -9.392 1.00 62.14 N ATOM 9 CA ALA A 3 -4.072 0.207 -10.601 1.00 64.54 C ATOM 10 C ALA A 3 -3.123 1.387 -10.786 1.00 42.13 C ATOM 11 O ALA A 3 -3.559 2.524 -10.966 1.00 63.01 O ATOM 12 CB ALA A 3 -4.977 0.061 -11.816 1.00 54.42 C ATOM 0 H ALA A 3 -5.587 1.086 -9.448 1.00 62.14 H new ATOM 0 HA ALA A 3 -3.471 -0.697 -10.497 1.00 64.54 H new ATOM 0 HB1 ALA A 3 -4.367 -0.053 -12.712 1.00 54.42 H new ATOM 0 HB2 ALA A 3 -5.611 -0.817 -11.694 1.00 54.42 H new ATOM 0 HB3 ALA A 3 -5.602 0.949 -11.913 1.00 54.42 H new ATOM 18 N ARG A 4 -1.825 1.110 -10.739 1.00 41.52 N ATOM 19 CA ARG A 4 -0.815 2.149 -10.899 1.00 13.54 C ATOM 20 C ARG A 4 0.322 1.668 -11.795 1.00 54.55 C ATOM 21 O ARG A 4 0.547 0.466 -11.940 1.00 61.31 O ATOM 22 CB ARG A 4 -0.261 2.566 -9.535 1.00 24.11 C ATOM 23 CG ARG A 4 -1.269 3.303 -8.669 1.00 24.14 C ATOM 24 CD ARG A 4 -0.580 4.195 -7.649 1.00 12.55 C ATOM 25 NE ARG A 4 -0.875 5.608 -7.867 1.00 44.15 N ATOM 26 CZ ARG A 4 -0.209 6.598 -7.284 1.00 52.10 C ATOM 27 NH1 ARG A 4 0.787 6.330 -6.450 1.00 2.53 N ATOM 28 NH2 ARG A 4 -0.537 7.859 -7.534 1.00 51.41 N ATOM 0 H ARG A 4 -1.447 0.174 -10.591 1.00 41.52 H new ATOM 0 HA ARG A 4 -1.288 3.010 -11.371 1.00 13.54 H new ATOM 0 HB2 ARG A 4 0.081 1.678 -9.004 1.00 24.11 H new ATOM 0 HB3 ARG A 4 0.611 3.203 -9.685 1.00 24.11 H new ATOM 0 HG2 ARG A 4 -1.920 3.907 -9.301 1.00 24.14 H new ATOM 0 HG3 ARG A 4 -1.904 2.582 -8.154 1.00 24.14 H new ATOM 0 HD2 ARG A 4 -0.897 3.910 -6.646 1.00 12.55 H new ATOM 0 HD3 ARG A 4 0.497 4.038 -7.700 1.00 12.55 H new ATOM 0 HE ARG A 4 -1.635 5.848 -8.503 1.00 44.15 H new ATOM 0 HH11 ARG A 4 1.043 5.362 -6.255 1.00 2.53 H new ATOM 0 HH12 ARG A 4 1.297 7.092 -6.003 1.00 2.53 H new ATOM 0 HH21 ARG A 4 -1.302 8.070 -8.175 1.00 51.41 H new ATOM 0 HH22 ARG A 4 -0.024 8.618 -7.085 1.00 51.41 H new ATOM 42 N ASN A 5 1.036 2.615 -12.397 1.00 12.54 N ATOM 43 CA ASN A 5 2.149 2.287 -13.280 1.00 22.01 C ATOM 44 C ASN A 5 3.476 2.351 -12.530 1.00 3.11 C ATOM 45 O ASN A 5 3.676 3.211 -11.673 1.00 72.32 O ATOM 46 CB ASN A 5 2.179 3.245 -14.474 1.00 11.34 C ATOM 47 CG ASN A 5 1.286 2.783 -15.608 1.00 63.23 C ATOM 48 OD1 ASN A 5 1.766 2.312 -16.639 1.00 24.12 O ATOM 49 ND2 ASN A 5 -0.023 2.915 -15.423 1.00 11.22 N ATOM 0 H ASN A 5 0.863 3.614 -12.289 1.00 12.54 H new ATOM 0 HA ASN A 5 2.005 1.269 -13.642 1.00 22.01 H new ATOM 0 HB2 ASN A 5 1.865 4.237 -14.149 1.00 11.34 H new ATOM 0 HB3 ASN A 5 3.203 3.338 -14.836 1.00 11.34 H new ATOM 0 HD21 ASN A 5 -0.673 2.621 -16.152 1.00 11.22 H new ATOM 0 HD22 ASN A 5 -0.378 3.311 -14.552 1.00 11.22 H new ATOM 56 N SER A 6 4.380 1.433 -12.859 1.00 63.14 N ATOM 57 CA SER A 6 5.687 1.382 -12.215 1.00 34.23 C ATOM 58 C SER A 6 6.763 1.972 -13.121 1.00 72.33 C ATOM 59 O SER A 6 7.289 1.293 -14.003 1.00 21.31 O ATOM 60 CB SER A 6 6.044 -0.060 -11.851 1.00 50.34 C ATOM 61 OG SER A 6 5.689 -0.351 -10.510 1.00 62.12 O ATOM 0 H SER A 6 4.231 0.715 -13.568 1.00 63.14 H new ATOM 0 HA SER A 6 5.639 1.977 -11.303 1.00 34.23 H new ATOM 0 HB2 SER A 6 5.529 -0.746 -12.524 1.00 50.34 H new ATOM 0 HB3 SER A 6 7.113 -0.219 -11.990 1.00 50.34 H new ATOM 0 HG SER A 6 5.926 -1.279 -10.303 1.00 62.12 H new ATOM 67 N VAL A 7 7.087 3.241 -12.897 1.00 30.34 N ATOM 68 CA VAL A 7 8.101 3.924 -13.692 1.00 45.22 C ATOM 69 C VAL A 7 9.504 3.582 -13.203 1.00 45.42 C ATOM 70 O VAL A 7 10.367 3.188 -13.989 1.00 20.02 O ATOM 71 CB VAL A 7 7.912 5.453 -13.650 1.00 15.45 C ATOM 72 CG1 VAL A 7 8.991 6.146 -14.467 1.00 65.25 C ATOM 73 CG2 VAL A 7 6.526 5.832 -14.148 1.00 0.12 C ATOM 0 H VAL A 7 6.662 3.818 -12.171 1.00 30.34 H new ATOM 0 HA VAL A 7 7.983 3.580 -14.719 1.00 45.22 H new ATOM 0 HB VAL A 7 8.004 5.786 -12.616 1.00 15.45 H new ATOM 0 HG11 VAL A 7 8.842 7.225 -14.426 1.00 65.25 H new ATOM 0 HG12 VAL A 7 9.971 5.899 -14.059 1.00 65.25 H new ATOM 0 HG13 VAL A 7 8.935 5.811 -15.503 1.00 65.25 H new ATOM 0 HG21 VAL A 7 6.410 6.915 -14.111 1.00 0.12 H new ATOM 0 HG22 VAL A 7 6.402 5.488 -15.175 1.00 0.12 H new ATOM 0 HG23 VAL A 7 5.772 5.365 -13.515 1.00 0.12 H new ATOM 83 N LEU A 8 9.725 3.734 -11.903 1.00 32.21 N ATOM 84 CA LEU A 8 11.025 3.441 -11.308 1.00 71.32 C ATOM 85 C LEU A 8 10.925 2.277 -10.328 1.00 2.35 C ATOM 86 O LEU A 8 10.084 2.280 -9.428 1.00 64.42 O ATOM 87 CB LEU A 8 11.572 4.678 -10.594 1.00 51.10 C ATOM 88 CG LEU A 8 11.912 5.873 -11.486 1.00 43.41 C ATOM 89 CD1 LEU A 8 12.532 6.993 -10.665 1.00 0.04 C ATOM 90 CD2 LEU A 8 12.848 5.451 -12.608 1.00 52.25 C ATOM 0 H LEU A 8 9.021 4.058 -11.240 1.00 32.21 H new ATOM 0 HA LEU A 8 11.708 3.160 -12.109 1.00 71.32 H new ATOM 0 HB2 LEU A 8 10.839 4.999 -9.854 1.00 51.10 H new ATOM 0 HB3 LEU A 8 12.471 4.390 -10.048 1.00 51.10 H new ATOM 0 HG LEU A 8 10.989 6.245 -11.930 1.00 43.41 H new ATOM 0 HD11 LEU A 8 12.767 7.835 -11.317 1.00 0.04 H new ATOM 0 HD12 LEU A 8 11.828 7.314 -9.897 1.00 0.04 H new ATOM 0 HD13 LEU A 8 13.446 6.634 -10.192 1.00 0.04 H new ATOM 0 HD21 LEU A 8 13.079 6.314 -13.233 1.00 52.25 H new ATOM 0 HD22 LEU A 8 13.770 5.053 -12.183 1.00 52.25 H new ATOM 0 HD23 LEU A 8 12.367 4.683 -13.214 1.00 52.25 H new ATOM 102 N ARG A 9 11.789 1.284 -10.506 1.00 51.55 N ATOM 103 CA ARG A 9 11.798 0.113 -9.637 1.00 52.44 C ATOM 104 C ARG A 9 12.541 0.407 -8.337 1.00 62.14 C ATOM 105 O ARG A 9 12.894 1.552 -8.057 1.00 71.45 O ATOM 106 CB ARG A 9 12.449 -1.073 -10.351 1.00 44.51 C ATOM 107 CG ARG A 9 13.914 -0.854 -10.686 1.00 15.23 C ATOM 108 CD ARG A 9 14.430 -1.908 -11.653 1.00 44.54 C ATOM 109 NE ARG A 9 14.992 -3.063 -10.957 1.00 63.22 N ATOM 110 CZ ARG A 9 15.633 -4.051 -11.571 1.00 24.00 C ATOM 111 NH1 ARG A 9 15.792 -4.025 -12.887 1.00 70.03 N ATOM 112 NH2 ARG A 9 16.116 -5.067 -10.869 1.00 4.03 N ATOM 0 H ARG A 9 12.492 1.266 -11.244 1.00 51.55 H new ATOM 0 HA ARG A 9 10.765 -0.138 -9.397 1.00 52.44 H new ATOM 0 HB2 ARG A 9 12.358 -1.959 -9.723 1.00 44.51 H new ATOM 0 HB3 ARG A 9 11.901 -1.277 -11.271 1.00 44.51 H new ATOM 0 HG2 ARG A 9 14.044 0.136 -11.123 1.00 15.23 H new ATOM 0 HG3 ARG A 9 14.505 -0.879 -9.770 1.00 15.23 H new ATOM 0 HD2 ARG A 9 13.616 -2.236 -12.300 1.00 44.54 H new ATOM 0 HD3 ARG A 9 15.191 -1.467 -12.297 1.00 44.54 H new ATOM 0 HE ARG A 9 14.886 -3.113 -9.944 1.00 63.22 H new ATOM 0 HH11 ARG A 9 15.422 -3.245 -13.430 1.00 70.03 H new ATOM 0 HH12 ARG A 9 16.285 -4.785 -13.356 1.00 70.03 H new ATOM 0 HH21 ARG A 9 15.995 -5.090 -9.856 1.00 4.03 H new ATOM 0 HH22 ARG A 9 16.608 -5.825 -11.342 1.00 4.03 H new ATOM 126 N GLY A 10 12.773 -0.636 -7.545 1.00 75.23 N ATOM 127 CA GLY A 10 13.472 -0.468 -6.284 1.00 64.33 C ATOM 128 C GLY A 10 14.872 0.084 -6.466 1.00 1.30 C ATOM 129 O GLY A 10 15.258 1.048 -5.805 1.00 0.13 O ATOM 0 H GLY A 10 12.490 -1.593 -7.754 1.00 75.23 H new ATOM 0 HA2 GLY A 10 12.901 0.203 -5.642 1.00 64.33 H new ATOM 0 HA3 GLY A 10 13.527 -1.429 -5.772 1.00 64.33 H new ATOM 133 N LYS A 11 15.636 -0.530 -7.363 1.00 4.05 N ATOM 134 CA LYS A 11 17.002 -0.095 -7.630 1.00 2.33 C ATOM 135 C LYS A 11 17.017 1.282 -8.286 1.00 0.44 C ATOM 136 O LYS A 11 17.832 2.137 -7.939 1.00 23.14 O ATOM 137 CB LYS A 11 17.715 -1.109 -8.529 1.00 64.52 C ATOM 138 CG LYS A 11 19.017 -1.628 -7.947 1.00 21.04 C ATOM 139 CD LYS A 11 18.779 -2.786 -6.992 1.00 23.12 C ATOM 140 CE LYS A 11 18.591 -2.300 -5.563 1.00 11.25 C ATOM 141 NZ LYS A 11 19.070 -3.300 -4.569 1.00 41.21 N ATOM 0 H LYS A 11 15.332 -1.330 -7.917 1.00 4.05 H new ATOM 0 HA LYS A 11 17.529 -0.029 -6.678 1.00 2.33 H new ATOM 0 HB2 LYS A 11 17.048 -1.951 -8.713 1.00 64.52 H new ATOM 0 HB3 LYS A 11 17.918 -0.646 -9.495 1.00 64.52 H new ATOM 0 HG2 LYS A 11 19.674 -1.950 -8.754 1.00 21.04 H new ATOM 0 HG3 LYS A 11 19.529 -0.822 -7.422 1.00 21.04 H new ATOM 0 HD2 LYS A 11 17.897 -3.343 -7.307 1.00 23.12 H new ATOM 0 HD3 LYS A 11 19.623 -3.474 -7.035 1.00 23.12 H new ATOM 0 HE2 LYS A 11 19.130 -1.363 -5.424 1.00 11.25 H new ATOM 0 HE3 LYS A 11 17.536 -2.090 -5.387 1.00 11.25 H new ATOM 0 HZ1 LYS A 11 18.924 -2.931 -3.608 1.00 41.21 H new ATOM 0 HZ2 LYS A 11 18.538 -4.186 -4.684 1.00 41.21 H new ATOM 0 HZ3 LYS A 11 20.083 -3.482 -4.720 1.00 41.21 H new ATOM 155 N LYS A 12 16.111 1.490 -9.235 1.00 21.25 N ATOM 156 CA LYS A 12 16.017 2.763 -9.937 1.00 63.32 C ATOM 157 C LYS A 12 15.638 3.887 -8.979 1.00 34.55 C ATOM 158 O LYS A 12 16.137 5.008 -9.092 1.00 12.42 O ATOM 159 CB LYS A 12 14.986 2.672 -11.065 1.00 72.41 C ATOM 160 CG LYS A 12 15.491 1.931 -12.291 1.00 43.23 C ATOM 161 CD LYS A 12 14.432 1.870 -13.380 1.00 43.23 C ATOM 162 CE LYS A 12 14.908 1.059 -14.575 1.00 54.40 C ATOM 163 NZ LYS A 12 13.981 1.181 -15.734 1.00 42.00 N ATOM 0 H LYS A 12 15.431 0.792 -9.536 1.00 21.25 H new ATOM 0 HA LYS A 12 16.995 2.987 -10.363 1.00 63.32 H new ATOM 0 HB2 LYS A 12 14.093 2.172 -10.690 1.00 72.41 H new ATOM 0 HB3 LYS A 12 14.688 3.679 -11.356 1.00 72.41 H new ATOM 0 HG2 LYS A 12 16.382 2.427 -12.676 1.00 43.23 H new ATOM 0 HG3 LYS A 12 15.785 0.920 -12.011 1.00 43.23 H new ATOM 0 HD2 LYS A 12 13.521 1.427 -12.978 1.00 43.23 H new ATOM 0 HD3 LYS A 12 14.181 2.881 -13.702 1.00 43.23 H new ATOM 0 HE2 LYS A 12 15.902 1.395 -14.869 1.00 54.40 H new ATOM 0 HE3 LYS A 12 14.997 0.011 -14.290 1.00 54.40 H new ATOM 0 HZ1 LYS A 12 14.350 0.627 -16.533 1.00 42.00 H new ATOM 0 HZ2 LYS A 12 13.042 0.821 -15.467 1.00 42.00 H new ATOM 0 HZ3 LYS A 12 13.902 2.180 -16.012 1.00 42.00 H new ATOM 177 N ALA A 13 14.755 3.582 -8.034 1.00 41.52 N ATOM 178 CA ALA A 13 14.314 4.565 -7.053 1.00 61.55 C ATOM 179 C ALA A 13 15.503 5.235 -6.373 1.00 3.44 C ATOM 180 O ALA A 13 15.498 6.444 -6.142 1.00 70.20 O ATOM 181 CB ALA A 13 13.410 3.910 -6.018 1.00 51.13 C ATOM 0 H ALA A 13 14.331 2.661 -7.927 1.00 41.52 H new ATOM 0 HA ALA A 13 13.748 5.335 -7.577 1.00 61.55 H new ATOM 0 HB1 ALA A 13 13.088 4.656 -5.292 1.00 51.13 H new ATOM 0 HB2 ALA A 13 12.537 3.486 -6.514 1.00 51.13 H new ATOM 0 HB3 ALA A 13 13.957 3.118 -5.506 1.00 51.13 H new ATOM 187 N ASP A 14 16.520 4.441 -6.054 1.00 65.31 N ATOM 188 CA ASP A 14 17.716 4.957 -5.399 1.00 50.43 C ATOM 189 C ASP A 14 18.342 6.080 -6.220 1.00 32.43 C ATOM 190 O ASP A 14 18.545 7.187 -5.720 1.00 52.22 O ATOM 191 CB ASP A 14 18.733 3.834 -5.190 1.00 21.14 C ATOM 192 CG ASP A 14 19.668 4.109 -4.029 1.00 43.33 C ATOM 193 OD1 ASP A 14 19.245 3.921 -2.869 1.00 11.20 O ATOM 194 OD2 ASP A 14 20.823 4.511 -4.280 1.00 13.20 O ATOM 0 H ASP A 14 16.540 3.438 -6.239 1.00 65.31 H new ATOM 0 HA ASP A 14 17.425 5.359 -4.428 1.00 50.43 H new ATOM 0 HB2 ASP A 14 18.204 2.897 -5.013 1.00 21.14 H new ATOM 0 HB3 ASP A 14 19.318 3.703 -6.101 1.00 21.14 H new ATOM 199 N GLU A 15 18.646 5.788 -7.480 1.00 3.21 N ATOM 200 CA GLU A 15 19.251 6.773 -8.368 1.00 64.41 C ATOM 201 C GLU A 15 18.452 8.075 -8.362 1.00 42.53 C ATOM 202 O GLU A 15 19.017 9.164 -8.452 1.00 54.02 O ATOM 203 CB GLU A 15 19.338 6.224 -9.793 1.00 42.14 C ATOM 204 CG GLU A 15 20.632 5.479 -10.079 1.00 1.31 C ATOM 205 CD GLU A 15 20.599 4.044 -9.590 1.00 41.31 C ATOM 206 OE1 GLU A 15 19.526 3.411 -9.675 1.00 52.12 O ATOM 207 OE2 GLU A 15 21.648 3.554 -9.121 1.00 34.33 O ATOM 0 H GLU A 15 18.483 4.877 -7.909 1.00 3.21 H new ATOM 0 HA GLU A 15 20.257 6.981 -8.004 1.00 64.41 H new ATOM 0 HB2 GLU A 15 18.496 5.554 -9.967 1.00 42.14 H new ATOM 0 HB3 GLU A 15 19.240 7.049 -10.498 1.00 42.14 H new ATOM 0 HG2 GLU A 15 20.823 5.489 -11.152 1.00 1.31 H new ATOM 0 HG3 GLU A 15 21.461 6.002 -9.603 1.00 1.31 H new ATOM 214 N LEU A 16 17.133 7.951 -8.255 1.00 30.00 N ATOM 215 CA LEU A 16 16.255 9.116 -8.237 1.00 42.35 C ATOM 216 C LEU A 16 16.556 10.007 -7.037 1.00 51.51 C ATOM 217 O LEU A 16 16.840 11.195 -7.189 1.00 45.44 O ATOM 218 CB LEU A 16 14.790 8.675 -8.205 1.00 52.43 C ATOM 219 CG LEU A 16 13.766 9.714 -8.659 1.00 63.54 C ATOM 220 CD1 LEU A 16 13.674 10.849 -7.650 1.00 74.20 C ATOM 221 CD2 LEU A 16 14.125 10.252 -10.037 1.00 3.42 C ATOM 0 H LEU A 16 16.649 7.056 -8.179 1.00 30.00 H new ATOM 0 HA LEU A 16 16.436 9.690 -9.146 1.00 42.35 H new ATOM 0 HB2 LEU A 16 14.684 7.791 -8.834 1.00 52.43 H new ATOM 0 HB3 LEU A 16 14.545 8.373 -7.187 1.00 52.43 H new ATOM 0 HG LEU A 16 12.791 9.231 -8.723 1.00 63.54 H new ATOM 0 HD11 LEU A 16 12.940 11.579 -7.990 1.00 74.20 H new ATOM 0 HD12 LEU A 16 13.369 10.451 -6.682 1.00 74.20 H new ATOM 0 HD13 LEU A 16 14.647 11.330 -7.554 1.00 74.20 H new ATOM 0 HD21 LEU A 16 13.384 10.991 -10.344 1.00 3.42 H new ATOM 0 HD22 LEU A 16 15.109 10.719 -10.000 1.00 3.42 H new ATOM 0 HD23 LEU A 16 14.139 9.432 -10.755 1.00 3.42 H new ATOM 233 N GLU A 17 16.495 9.423 -5.844 1.00 24.20 N ATOM 234 CA GLU A 17 16.762 10.165 -4.617 1.00 53.12 C ATOM 235 C GLU A 17 18.189 10.706 -4.609 1.00 71.30 C ATOM 236 O GLU A 17 18.511 11.626 -3.857 1.00 23.24 O ATOM 237 CB GLU A 17 16.536 9.272 -3.395 1.00 71.32 C ATOM 238 CG GLU A 17 15.218 9.532 -2.686 1.00 41.14 C ATOM 239 CD GLU A 17 15.024 8.648 -1.470 1.00 55.24 C ATOM 240 OE1 GLU A 17 15.880 8.695 -0.561 1.00 71.40 O ATOM 241 OE2 GLU A 17 14.020 7.908 -1.427 1.00 42.42 O ATOM 0 H GLU A 17 16.263 8.440 -5.701 1.00 24.20 H new ATOM 0 HA GLU A 17 16.072 11.008 -4.574 1.00 53.12 H new ATOM 0 HB2 GLU A 17 16.571 8.228 -3.707 1.00 71.32 H new ATOM 0 HB3 GLU A 17 17.354 9.422 -2.690 1.00 71.32 H new ATOM 0 HG2 GLU A 17 15.174 10.577 -2.381 1.00 41.14 H new ATOM 0 HG3 GLU A 17 14.396 9.369 -3.384 1.00 41.14 H new ATOM 248 N ARG A 18 19.039 10.128 -5.451 1.00 12.44 N ATOM 249 CA ARG A 18 20.432 10.550 -5.539 1.00 42.04 C ATOM 250 C ARG A 18 20.562 11.827 -6.365 1.00 25.42 C ATOM 251 O ARG A 18 21.289 12.748 -5.991 1.00 60.03 O ATOM 252 CB ARG A 18 21.285 9.441 -6.158 1.00 23.33 C ATOM 253 CG ARG A 18 22.377 8.925 -5.235 1.00 31.31 C ATOM 254 CD ARG A 18 22.596 7.432 -5.412 1.00 5.51 C ATOM 255 NE ARG A 18 23.790 6.966 -4.711 1.00 53.32 N ATOM 256 CZ ARG A 18 23.861 6.828 -3.392 1.00 14.30 C ATOM 257 NH1 ARG A 18 22.812 7.116 -2.634 1.00 60.12 N ATOM 258 NH2 ARG A 18 24.984 6.399 -2.828 1.00 44.43 N ATOM 0 H ARG A 18 18.788 9.367 -6.082 1.00 12.44 H new ATOM 0 HA ARG A 18 20.789 10.753 -4.529 1.00 42.04 H new ATOM 0 HB2 ARG A 18 20.637 8.611 -6.440 1.00 23.33 H new ATOM 0 HB3 ARG A 18 21.742 9.815 -7.074 1.00 23.33 H new ATOM 0 HG2 ARG A 18 23.307 9.457 -5.437 1.00 31.31 H new ATOM 0 HG3 ARG A 18 22.109 9.134 -4.199 1.00 31.31 H new ATOM 0 HD2 ARG A 18 21.725 6.892 -5.042 1.00 5.51 H new ATOM 0 HD3 ARG A 18 22.686 7.202 -6.474 1.00 5.51 H new ATOM 0 HE ARG A 18 24.614 6.734 -5.265 1.00 53.32 H new ATOM 0 HH11 ARG A 18 21.947 7.445 -3.064 1.00 60.12 H new ATOM 0 HH12 ARG A 18 22.870 7.009 -1.621 1.00 60.12 H new ATOM 0 HH21 ARG A 18 25.793 6.175 -3.408 1.00 44.43 H new ATOM 0 HH22 ARG A 18 25.038 6.293 -1.815 1.00 44.43 H new ATOM 272 N ILE A 19 19.852 11.874 -7.488 1.00 33.13 N ATOM 273 CA ILE A 19 19.887 13.037 -8.364 1.00 73.24 C ATOM 274 C ILE A 19 19.473 14.301 -7.619 1.00 32.32 C ATOM 275 O ILE A 19 18.459 14.318 -6.921 1.00 64.14 O ATOM 276 CB ILE A 19 18.968 12.850 -9.585 1.00 43.21 C ATOM 277 CG1 ILE A 19 19.395 11.620 -10.390 1.00 15.13 C ATOM 278 CG2 ILE A 19 18.988 14.095 -10.460 1.00 3.22 C ATOM 279 CD1 ILE A 19 18.234 10.844 -10.970 1.00 25.23 C ATOM 0 H ILE A 19 19.246 11.120 -7.812 1.00 33.13 H new ATOM 0 HA ILE A 19 20.916 13.142 -8.707 1.00 73.24 H new ATOM 0 HB ILE A 19 17.949 12.694 -9.232 1.00 43.21 H new ATOM 0 HG12 ILE A 19 20.051 11.936 -11.201 1.00 15.13 H new ATOM 0 HG13 ILE A 19 19.978 10.960 -9.748 1.00 15.13 H new ATOM 0 HG21 ILE A 19 18.333 13.947 -11.319 1.00 3.22 H new ATOM 0 HG22 ILE A 19 18.640 14.951 -9.882 1.00 3.22 H new ATOM 0 HG23 ILE A 19 20.005 14.280 -10.807 1.00 3.22 H new ATOM 0 HD11 ILE A 19 18.612 9.987 -11.527 1.00 25.23 H new ATOM 0 HD12 ILE A 19 17.589 10.497 -10.163 1.00 25.23 H new ATOM 0 HD13 ILE A 19 17.663 11.488 -11.639 1.00 25.23 H new ATOM 291 N ARG A 20 20.264 15.358 -7.772 1.00 41.11 N ATOM 292 CA ARG A 20 19.979 16.627 -7.114 1.00 65.11 C ATOM 293 C ARG A 20 19.130 17.525 -8.009 1.00 11.02 C ATOM 294 O ARG A 20 19.392 17.654 -9.205 1.00 61.02 O ATOM 295 CB ARG A 20 21.282 17.340 -6.747 1.00 43.13 C ATOM 296 CG ARG A 20 21.917 16.826 -5.466 1.00 73.21 C ATOM 297 CD ARG A 20 23.403 16.560 -5.649 1.00 74.12 C ATOM 298 NE ARG A 20 24.165 17.797 -5.806 1.00 32.23 N ATOM 299 CZ ARG A 20 24.425 18.632 -4.807 1.00 33.24 C ATOM 300 NH1 ARG A 20 23.988 18.365 -3.584 1.00 52.31 N ATOM 301 NH2 ARG A 20 25.125 19.737 -5.028 1.00 51.04 N ATOM 0 H ARG A 20 21.107 15.360 -8.346 1.00 41.11 H new ATOM 0 HA ARG A 20 19.419 16.417 -6.203 1.00 65.11 H new ATOM 0 HB2 ARG A 20 21.992 17.225 -7.566 1.00 43.13 H new ATOM 0 HB3 ARG A 20 21.085 18.407 -6.642 1.00 43.13 H new ATOM 0 HG2 ARG A 20 21.772 17.555 -4.669 1.00 73.21 H new ATOM 0 HG3 ARG A 20 21.418 15.909 -5.154 1.00 73.21 H new ATOM 0 HD2 ARG A 20 23.781 16.008 -4.789 1.00 74.12 H new ATOM 0 HD3 ARG A 20 23.553 15.928 -6.524 1.00 74.12 H new ATOM 0 HE ARG A 20 24.517 18.032 -6.734 1.00 32.23 H new ATOM 0 HH11 ARG A 20 23.450 17.516 -3.409 1.00 52.31 H new ATOM 0 HH12 ARG A 20 24.189 19.008 -2.819 1.00 52.31 H new ATOM 0 HH21 ARG A 20 25.465 19.946 -5.967 1.00 51.04 H new ATOM 0 HH22 ARG A 20 25.324 20.377 -4.259 1.00 51.04 H new ATOM 315 N LEU A 21 18.111 18.143 -7.421 1.00 74.22 N ATOM 316 CA LEU A 21 17.223 19.030 -8.165 1.00 43.14 C ATOM 317 C LEU A 21 18.003 20.173 -8.805 1.00 33.25 C ATOM 318 O LEU A 21 17.692 20.607 -9.914 1.00 14.45 O ATOM 319 CB LEU A 21 16.139 19.589 -7.241 1.00 73.53 C ATOM 320 CG LEU A 21 14.946 18.672 -6.973 1.00 23.33 C ATOM 321 CD1 LEU A 21 14.109 19.208 -5.822 1.00 32.21 C ATOM 322 CD2 LEU A 21 14.096 18.520 -8.226 1.00 35.43 C ATOM 0 H LEU A 21 17.879 18.046 -6.432 1.00 74.22 H new ATOM 0 HA LEU A 21 16.752 18.450 -8.959 1.00 43.14 H new ATOM 0 HB2 LEU A 21 16.599 19.841 -6.286 1.00 73.53 H new ATOM 0 HB3 LEU A 21 15.767 20.519 -7.671 1.00 73.53 H new ATOM 0 HG LEU A 21 15.325 17.689 -6.694 1.00 23.33 H new ATOM 0 HD11 LEU A 21 13.264 18.542 -5.646 1.00 32.21 H new ATOM 0 HD12 LEU A 21 14.721 19.264 -4.922 1.00 32.21 H new ATOM 0 HD13 LEU A 21 13.741 20.203 -6.072 1.00 32.21 H new ATOM 0 HD21 LEU A 21 13.252 17.864 -8.015 1.00 35.43 H new ATOM 0 HD22 LEU A 21 13.727 19.498 -8.536 1.00 35.43 H new ATOM 0 HD23 LEU A 21 14.700 18.090 -9.025 1.00 35.43 H new ATOM 334 N ARG A 22 19.020 20.656 -8.097 1.00 60.20 N ATOM 335 CA ARG A 22 19.846 21.749 -8.596 1.00 12.22 C ATOM 336 C ARG A 22 21.328 21.396 -8.503 1.00 34.11 C ATOM 337 O ARG A 22 21.734 20.503 -7.758 1.00 62.31 O ATOM 338 CB ARG A 22 19.566 23.029 -7.808 1.00 71.52 C ATOM 339 CG ARG A 22 18.453 23.877 -8.401 1.00 71.55 C ATOM 340 CD ARG A 22 17.735 24.683 -7.331 1.00 3.34 C ATOM 341 NE ARG A 22 16.286 24.670 -7.516 1.00 22.31 N ATOM 342 CZ ARG A 22 15.669 25.278 -8.524 1.00 32.34 C ATOM 343 NH1 ARG A 22 16.371 25.942 -9.431 1.00 61.14 N ATOM 344 NH2 ARG A 22 14.347 25.222 -8.624 1.00 62.21 N ATOM 0 H ARG A 22 19.291 20.308 -7.177 1.00 60.20 H new ATOM 0 HA ARG A 22 19.594 21.913 -9.644 1.00 12.22 H new ATOM 0 HB2 ARG A 22 19.304 22.765 -6.783 1.00 71.52 H new ATOM 0 HB3 ARG A 22 20.478 23.623 -7.760 1.00 71.52 H new ATOM 0 HG2 ARG A 22 18.868 24.552 -9.149 1.00 71.55 H new ATOM 0 HG3 ARG A 22 17.738 23.234 -8.914 1.00 71.55 H new ATOM 0 HD2 ARG A 22 17.979 24.279 -6.348 1.00 3.34 H new ATOM 0 HD3 ARG A 22 18.094 25.712 -7.351 1.00 3.34 H new ATOM 0 HE ARG A 22 15.717 24.167 -6.835 1.00 22.31 H new ATOM 0 HH11 ARG A 22 17.387 25.987 -9.356 1.00 61.14 H new ATOM 0 HH12 ARG A 22 15.895 26.408 -10.204 1.00 61.14 H new ATOM 0 HH21 ARG A 22 13.804 24.712 -7.927 1.00 62.21 H new ATOM 0 HH22 ARG A 22 13.874 25.689 -9.398 1.00 62.21 H new ATOM 358 N PRO A 23 22.157 22.113 -9.277 1.00 55.31 N ATOM 359 CA PRO A 23 23.606 21.893 -9.299 1.00 31.33 C ATOM 360 C PRO A 23 24.279 22.332 -8.003 1.00 22.03 C ATOM 361 O PRO A 23 25.270 21.741 -7.576 1.00 52.12 O ATOM 362 CB PRO A 23 24.079 22.762 -10.467 1.00 61.40 C ATOM 363 CG PRO A 23 23.045 23.830 -10.587 1.00 15.21 C ATOM 364 CD PRO A 23 21.744 23.192 -10.188 1.00 71.40 C ATOM 0 HA PRO A 23 23.856 20.837 -9.406 1.00 31.33 H new ATOM 0 HB2 PRO A 23 25.065 23.185 -10.272 1.00 61.40 H new ATOM 0 HB3 PRO A 23 24.157 22.181 -11.386 1.00 61.40 H new ATOM 0 HG2 PRO A 23 23.280 24.675 -9.940 1.00 15.21 H new ATOM 0 HG3 PRO A 23 22.996 24.213 -11.606 1.00 15.21 H new ATOM 0 HD2 PRO A 23 21.083 23.904 -9.694 1.00 71.40 H new ATOM 0 HD3 PRO A 23 21.205 22.804 -11.052 1.00 71.40 H new ATOM 372 N GLY A 24 23.733 23.372 -7.381 1.00 14.45 N ATOM 373 CA GLY A 24 24.293 23.872 -6.139 1.00 15.43 C ATOM 374 C GLY A 24 23.294 23.846 -4.999 1.00 15.12 C ATOM 375 O GLY A 24 23.367 24.663 -4.082 1.00 40.00 O ATOM 0 H GLY A 24 22.912 23.878 -7.715 1.00 14.45 H new ATOM 0 HA2 GLY A 24 25.163 23.273 -5.869 1.00 15.43 H new ATOM 0 HA3 GLY A 24 24.643 24.893 -6.287 1.00 15.43 H new ATOM 379 N GLY A 25 22.356 22.905 -5.058 1.00 35.33 N ATOM 380 CA GLY A 25 21.349 22.796 -4.018 1.00 54.13 C ATOM 381 C GLY A 25 21.589 21.613 -3.101 1.00 72.11 C ATOM 382 O GLY A 25 22.594 20.911 -3.230 1.00 65.10 O ATOM 0 H GLY A 25 22.276 22.217 -5.807 1.00 35.33 H new ATOM 0 HA2 GLY A 25 21.339 23.713 -3.428 1.00 54.13 H new ATOM 0 HA3 GLY A 25 20.365 22.702 -4.478 1.00 54.13 H new ATOM 386 N LYS A 26 20.667 21.391 -2.172 1.00 41.41 N ATOM 387 CA LYS A 26 20.781 20.284 -1.228 1.00 41.30 C ATOM 388 C LYS A 26 19.534 19.407 -1.265 1.00 42.50 C ATOM 389 O LYS A 26 19.324 18.571 -0.386 1.00 13.25 O ATOM 390 CB LYS A 26 21.003 20.817 0.189 1.00 45.33 C ATOM 391 CG LYS A 26 22.407 21.341 0.430 1.00 74.44 C ATOM 392 CD LYS A 26 22.414 22.466 1.452 1.00 3.54 C ATOM 393 CE LYS A 26 23.778 22.610 2.112 1.00 64.55 C ATOM 394 NZ LYS A 26 24.837 22.960 1.125 1.00 22.13 N ATOM 0 H LYS A 26 19.831 21.963 -2.051 1.00 41.41 H new ATOM 0 HA LYS A 26 21.638 19.677 -1.519 1.00 41.30 H new ATOM 0 HB2 LYS A 26 20.288 21.616 0.383 1.00 45.33 H new ATOM 0 HB3 LYS A 26 20.794 20.021 0.904 1.00 45.33 H new ATOM 0 HG2 LYS A 26 23.045 20.528 0.777 1.00 74.44 H new ATOM 0 HG3 LYS A 26 22.829 21.699 -0.509 1.00 74.44 H new ATOM 0 HD2 LYS A 26 22.143 23.403 0.965 1.00 3.54 H new ATOM 0 HD3 LYS A 26 21.659 22.272 2.213 1.00 3.54 H new ATOM 0 HE2 LYS A 26 23.730 23.380 2.882 1.00 64.55 H new ATOM 0 HE3 LYS A 26 24.040 21.677 2.611 1.00 64.55 H new ATOM 0 HZ1 LYS A 26 25.725 23.165 1.626 1.00 22.13 H new ATOM 0 HZ2 LYS A 26 24.983 22.162 0.475 1.00 22.13 H new ATOM 0 HZ3 LYS A 26 24.544 23.798 0.584 1.00 22.13 H new ATOM 408 N LYS A 27 18.710 19.601 -2.289 1.00 4.44 N ATOM 409 CA LYS A 27 17.484 18.825 -2.442 1.00 63.51 C ATOM 410 C LYS A 27 17.580 17.889 -3.641 1.00 44.55 C ATOM 411 O LYS A 27 18.136 18.246 -4.679 1.00 61.42 O ATOM 412 CB LYS A 27 16.282 19.759 -2.606 1.00 12.12 C ATOM 413 CG LYS A 27 15.922 20.516 -1.338 1.00 55.33 C ATOM 414 CD LYS A 27 15.354 21.890 -1.651 1.00 0.42 C ATOM 415 CE LYS A 27 14.678 22.503 -0.435 1.00 13.42 C ATOM 416 NZ LYS A 27 15.664 22.886 0.613 1.00 31.43 N ATOM 0 H LYS A 27 18.868 20.289 -3.025 1.00 4.44 H new ATOM 0 HA LYS A 27 17.349 18.224 -1.543 1.00 63.51 H new ATOM 0 HB2 LYS A 27 16.495 20.476 -3.399 1.00 12.12 H new ATOM 0 HB3 LYS A 27 15.420 19.175 -2.928 1.00 12.12 H new ATOM 0 HG2 LYS A 27 15.194 19.942 -0.765 1.00 55.33 H new ATOM 0 HG3 LYS A 27 16.808 20.622 -0.712 1.00 55.33 H new ATOM 0 HD2 LYS A 27 16.154 22.546 -1.993 1.00 0.42 H new ATOM 0 HD3 LYS A 27 14.636 21.811 -2.467 1.00 0.42 H new ATOM 0 HE2 LYS A 27 14.111 23.383 -0.739 1.00 13.42 H new ATOM 0 HE3 LYS A 27 13.964 21.792 -0.019 1.00 13.42 H new ATOM 0 HZ1 LYS A 27 15.164 23.300 1.425 1.00 31.43 H new ATOM 0 HZ2 LYS A 27 16.188 22.042 0.922 1.00 31.43 H new ATOM 0 HZ3 LYS A 27 16.330 23.584 0.224 1.00 31.43 H new ATOM 430 N LYS A 28 17.033 16.686 -3.492 1.00 73.42 N ATOM 431 CA LYS A 28 17.054 15.698 -4.564 1.00 65.01 C ATOM 432 C LYS A 28 15.645 15.427 -5.081 1.00 5.21 C ATOM 433 O LYS A 28 14.657 15.780 -4.437 1.00 31.23 O ATOM 434 CB LYS A 28 17.687 14.395 -4.071 1.00 42.30 C ATOM 435 CG LYS A 28 19.196 14.474 -3.911 1.00 41.35 C ATOM 436 CD LYS A 28 19.619 14.212 -2.476 1.00 12.40 C ATOM 437 CE LYS A 28 20.739 15.146 -2.046 1.00 31.52 C ATOM 438 NZ LYS A 28 21.871 14.407 -1.422 1.00 51.44 N ATOM 0 H LYS A 28 16.570 16.373 -2.639 1.00 73.42 H new ATOM 0 HA LYS A 28 17.652 16.099 -5.383 1.00 65.01 H new ATOM 0 HB2 LYS A 28 17.242 14.124 -3.113 1.00 42.30 H new ATOM 0 HB3 LYS A 28 17.446 13.596 -4.772 1.00 42.30 H new ATOM 0 HG2 LYS A 28 19.671 13.747 -4.570 1.00 41.35 H new ATOM 0 HG3 LYS A 28 19.544 15.460 -4.220 1.00 41.35 H new ATOM 0 HD2 LYS A 28 18.763 14.340 -1.814 1.00 12.40 H new ATOM 0 HD3 LYS A 28 19.948 13.178 -2.376 1.00 12.40 H new ATOM 0 HE2 LYS A 28 21.101 15.701 -2.912 1.00 31.52 H new ATOM 0 HE3 LYS A 28 20.350 15.878 -1.338 1.00 31.52 H new ATOM 0 HZ1 LYS A 28 22.613 15.080 -1.143 1.00 51.44 H new ATOM 0 HZ2 LYS A 28 21.532 13.898 -0.581 1.00 51.44 H new ATOM 0 HZ3 LYS A 28 22.260 13.726 -2.105 1.00 51.44 H new ATOM 452 N TYR A 29 15.559 14.795 -6.247 1.00 64.21 N ATOM 453 CA TYR A 29 14.270 14.478 -6.851 1.00 53.44 C ATOM 454 C TYR A 29 13.501 13.474 -5.997 1.00 30.12 C ATOM 455 O TYR A 29 14.094 12.612 -5.346 1.00 61.32 O ATOM 456 CB TYR A 29 14.469 13.918 -8.261 1.00 51.14 C ATOM 457 CG TYR A 29 14.674 14.986 -9.312 1.00 5.11 C ATOM 458 CD1 TYR A 29 15.938 15.504 -9.567 1.00 45.41 C ATOM 459 CD2 TYR A 29 13.604 15.474 -10.052 1.00 31.22 C ATOM 460 CE1 TYR A 29 16.129 16.479 -10.526 1.00 32.03 C ATOM 461 CE2 TYR A 29 13.787 16.449 -11.014 1.00 24.24 C ATOM 462 CZ TYR A 29 15.051 16.949 -11.246 1.00 43.14 C ATOM 463 OH TYR A 29 15.238 17.919 -12.203 1.00 61.33 O ATOM 0 H TYR A 29 16.366 14.492 -6.792 1.00 64.21 H new ATOM 0 HA TYR A 29 13.688 15.398 -6.911 1.00 53.44 H new ATOM 0 HB2 TYR A 29 15.331 13.251 -8.260 1.00 51.14 H new ATOM 0 HB3 TYR A 29 13.601 13.317 -8.530 1.00 51.14 H new ATOM 0 HD1 TYR A 29 16.785 15.138 -9.006 1.00 45.41 H new ATOM 0 HD2 TYR A 29 12.613 15.085 -9.872 1.00 31.22 H new ATOM 0 HE1 TYR A 29 17.118 16.872 -10.711 1.00 32.03 H new ATOM 0 HE2 TYR A 29 12.945 16.817 -11.581 1.00 24.24 H new ATOM 0 HH TYR A 29 16.148 18.276 -12.134 1.00 61.33 H new ATOM 473 N ARG A 30 12.177 13.592 -6.006 1.00 14.32 N ATOM 474 CA ARG A 30 11.326 12.696 -5.232 1.00 52.24 C ATOM 475 C ARG A 30 10.096 12.286 -6.036 1.00 61.45 C ATOM 476 O ARG A 30 9.766 12.908 -7.047 1.00 72.33 O ATOM 477 CB ARG A 30 10.895 13.368 -3.927 1.00 65.12 C ATOM 478 CG ARG A 30 11.119 12.507 -2.696 1.00 5.40 C ATOM 479 CD ARG A 30 10.019 12.711 -1.665 1.00 54.44 C ATOM 480 NE ARG A 30 10.128 14.005 -0.999 1.00 24.14 N ATOM 481 CZ ARG A 30 9.298 14.412 -0.044 1.00 33.30 C ATOM 482 NH1 ARG A 30 8.305 13.629 0.353 1.00 12.05 N ATOM 483 NH2 ARG A 30 9.462 15.604 0.516 1.00 72.24 N ATOM 0 H ARG A 30 11.671 14.298 -6.540 1.00 14.32 H new ATOM 0 HA ARG A 30 11.901 11.800 -4.998 1.00 52.24 H new ATOM 0 HB2 ARG A 30 11.444 14.303 -3.811 1.00 65.12 H new ATOM 0 HB3 ARG A 30 9.838 13.625 -3.993 1.00 65.12 H new ATOM 0 HG2 ARG A 30 11.156 11.457 -2.987 1.00 5.40 H new ATOM 0 HG3 ARG A 30 12.085 12.749 -2.252 1.00 5.40 H new ATOM 0 HD2 ARG A 30 9.047 12.635 -2.152 1.00 54.44 H new ATOM 0 HD3 ARG A 30 10.067 11.915 -0.922 1.00 54.44 H new ATOM 0 HE ARG A 30 10.882 14.631 -1.282 1.00 24.14 H new ATOM 0 HH11 ARG A 30 8.177 12.712 -0.075 1.00 12.05 H new ATOM 0 HH12 ARG A 30 7.669 13.944 1.086 1.00 12.05 H new ATOM 0 HH21 ARG A 30 10.226 16.209 0.214 1.00 72.24 H new ATOM 0 HH22 ARG A 30 8.824 15.915 1.249 1.00 72.24 H new ATOM 497 N LEU A 31 9.422 11.235 -5.583 1.00 23.51 N ATOM 498 CA LEU A 31 8.227 10.742 -6.260 1.00 53.44 C ATOM 499 C LEU A 31 7.302 11.892 -6.641 1.00 23.14 C ATOM 500 O LEU A 31 6.747 11.921 -7.739 1.00 4.42 O ATOM 501 CB LEU A 31 7.484 9.748 -5.366 1.00 34.14 C ATOM 502 CG LEU A 31 7.924 8.288 -5.475 1.00 5.12 C ATOM 503 CD1 LEU A 31 7.852 7.606 -4.118 1.00 2.44 C ATOM 504 CD2 LEU A 31 7.066 7.547 -6.491 1.00 25.33 C ATOM 0 H LEU A 31 9.682 10.707 -4.750 1.00 23.51 H new ATOM 0 HA LEU A 31 8.540 10.236 -7.173 1.00 53.44 H new ATOM 0 HB2 LEU A 31 7.600 10.065 -4.330 1.00 34.14 H new ATOM 0 HB3 LEU A 31 6.421 9.805 -5.599 1.00 34.14 H new ATOM 0 HG LEU A 31 8.959 8.265 -5.816 1.00 5.12 H new ATOM 0 HD11 LEU A 31 8.169 6.568 -4.215 1.00 2.44 H new ATOM 0 HD12 LEU A 31 8.508 8.121 -3.417 1.00 2.44 H new ATOM 0 HD13 LEU A 31 6.827 7.639 -3.748 1.00 2.44 H new ATOM 0 HD21 LEU A 31 7.393 6.509 -6.556 1.00 25.33 H new ATOM 0 HD22 LEU A 31 6.022 7.580 -6.179 1.00 25.33 H new ATOM 0 HD23 LEU A 31 7.167 8.021 -7.467 1.00 25.33 H new ATOM 516 N LYS A 32 7.141 12.843 -5.725 1.00 54.25 N ATOM 517 CA LYS A 32 6.286 13.999 -5.965 1.00 0.33 C ATOM 518 C LYS A 32 6.601 14.639 -7.313 1.00 50.31 C ATOM 519 O LYS A 32 5.697 14.967 -8.083 1.00 4.51 O ATOM 520 CB LYS A 32 6.461 15.028 -4.847 1.00 31.43 C ATOM 521 CG LYS A 32 5.214 15.227 -4.002 1.00 21.33 C ATOM 522 CD LYS A 32 5.564 15.513 -2.551 1.00 61.52 C ATOM 523 CE LYS A 32 5.474 17.000 -2.240 1.00 3.25 C ATOM 524 NZ LYS A 32 6.086 17.328 -0.922 1.00 14.21 N ATOM 0 H LYS A 32 7.592 12.835 -4.810 1.00 54.25 H new ATOM 0 HA LYS A 32 5.251 13.658 -5.978 1.00 0.33 H new ATOM 0 HB2 LYS A 32 7.281 14.714 -4.201 1.00 31.43 H new ATOM 0 HB3 LYS A 32 6.749 15.983 -5.286 1.00 31.43 H new ATOM 0 HG2 LYS A 32 4.628 16.053 -4.405 1.00 21.33 H new ATOM 0 HG3 LYS A 32 4.589 14.335 -4.058 1.00 21.33 H new ATOM 0 HD2 LYS A 32 4.889 14.962 -1.897 1.00 61.52 H new ATOM 0 HD3 LYS A 32 6.572 15.156 -2.341 1.00 61.52 H new ATOM 0 HE2 LYS A 32 5.976 17.566 -3.025 1.00 3.25 H new ATOM 0 HE3 LYS A 32 4.429 17.309 -2.242 1.00 3.25 H new ATOM 0 HZ1 LYS A 32 6.005 18.350 -0.746 1.00 14.21 H new ATOM 0 HZ2 LYS A 32 5.591 16.807 -0.170 1.00 14.21 H new ATOM 0 HZ3 LYS A 32 7.090 17.056 -0.928 1.00 14.21 H new ATOM 538 N HIS A 33 7.888 14.813 -7.594 1.00 51.25 N ATOM 539 CA HIS A 33 8.323 15.412 -8.852 1.00 34.41 C ATOM 540 C HIS A 33 7.944 14.525 -10.035 1.00 14.31 C ATOM 541 O HIS A 33 7.736 15.080 -11.114 1.00 32.42 O ATOM 542 CB HIS A 33 9.834 15.644 -8.836 1.00 55.51 C ATOM 543 CG HIS A 33 10.285 16.583 -7.760 1.00 62.12 C ATOM 544 ND1 HIS A 33 11.007 16.175 -6.659 1.00 21.34 N ATOM 545 CD2 HIS A 33 10.113 17.918 -7.622 1.00 71.40 C ATOM 546 CE1 HIS A 33 11.259 17.220 -5.889 1.00 53.44 C ATOM 547 NE2 HIS A 33 10.727 18.290 -6.452 1.00 53.30 N ATOM 0 H HIS A 33 8.649 14.548 -6.968 1.00 51.25 H new ATOM 0 HA HIS A 33 7.818 16.371 -8.963 1.00 34.41 H new ATOM 0 HB2 HIS A 33 10.339 14.687 -8.706 1.00 55.51 H new ATOM 0 HB3 HIS A 33 10.143 16.039 -9.804 1.00 55.51 H new ATOM 0 HD2 HIS A 33 9.590 18.570 -8.306 1.00 71.40 H new ATOM 0 HE1 HIS A 33 11.807 17.202 -4.958 1.00 53.44 H new ATOM 0 HE2 HIS A 33 10.766 19.238 -6.078 1.00 53.30 H new ATOM 555 N ILE A 34 7.854 13.210 -9.867 1.00 11.12 N ATOM 556 CA ILE A 34 7.495 12.324 -10.967 1.00 10.20 C ATOM 557 C ILE A 34 6.018 12.455 -11.320 1.00 64.31 C ATOM 558 O ILE A 34 5.639 12.391 -12.489 1.00 40.32 O ATOM 559 CB ILE A 34 7.801 10.853 -10.627 1.00 51.13 C ATOM 560 CG1 ILE A 34 9.258 10.700 -10.187 1.00 24.45 C ATOM 561 CG2 ILE A 34 7.508 9.961 -11.825 1.00 3.31 C ATOM 562 CD1 ILE A 34 9.612 9.298 -9.743 1.00 62.31 C ATOM 0 H ILE A 34 8.025 12.735 -8.981 1.00 11.12 H new ATOM 0 HA ILE A 34 8.098 12.625 -11.824 1.00 10.20 H new ATOM 0 HB ILE A 34 7.158 10.545 -9.802 1.00 51.13 H new ATOM 0 HG12 ILE A 34 9.910 10.986 -11.012 1.00 24.45 H new ATOM 0 HG13 ILE A 34 9.456 11.392 -9.369 1.00 24.45 H new ATOM 0 HG21 ILE A 34 7.729 8.925 -11.570 1.00 3.31 H new ATOM 0 HG22 ILE A 34 6.456 10.051 -12.097 1.00 3.31 H new ATOM 0 HG23 ILE A 34 8.128 10.267 -12.667 1.00 3.31 H new ATOM 0 HD11 ILE A 34 10.660 9.264 -9.445 1.00 62.31 H new ATOM 0 HD12 ILE A 34 8.985 9.015 -8.897 1.00 62.31 H new ATOM 0 HD13 ILE A 34 9.446 8.603 -10.566 1.00 62.31 H new ATOM 574 N VAL A 35 5.185 12.644 -10.300 1.00 12.21 N ATOM 575 CA VAL A 35 3.749 12.788 -10.503 1.00 10.15 C ATOM 576 C VAL A 35 3.438 13.976 -11.407 1.00 3.12 C ATOM 577 O VAL A 35 2.808 13.822 -12.454 1.00 72.31 O ATOM 578 CB VAL A 35 3.010 12.970 -9.163 1.00 43.22 C ATOM 579 CG1 VAL A 35 1.519 13.157 -9.398 1.00 4.15 C ATOM 580 CG2 VAL A 35 3.270 11.784 -8.247 1.00 3.14 C ATOM 0 H VAL A 35 5.481 12.701 -9.326 1.00 12.21 H new ATOM 0 HA VAL A 35 3.403 11.871 -10.981 1.00 10.15 H new ATOM 0 HB VAL A 35 3.392 13.867 -8.675 1.00 43.22 H new ATOM 0 HG11 VAL A 35 1.013 13.284 -8.441 1.00 4.15 H new ATOM 0 HG12 VAL A 35 1.356 14.041 -10.015 1.00 4.15 H new ATOM 0 HG13 VAL A 35 1.118 12.280 -9.907 1.00 4.15 H new ATOM 0 HG21 VAL A 35 2.741 11.929 -7.305 1.00 3.14 H new ATOM 0 HG22 VAL A 35 2.916 10.871 -8.725 1.00 3.14 H new ATOM 0 HG23 VAL A 35 4.339 11.702 -8.053 1.00 3.14 H new ATOM 590 N TRP A 36 3.884 15.157 -10.997 1.00 11.21 N ATOM 591 CA TRP A 36 3.654 16.371 -11.772 1.00 20.15 C ATOM 592 C TRP A 36 3.983 16.149 -13.244 1.00 14.13 C ATOM 593 O TRP A 36 3.280 16.638 -14.127 1.00 53.32 O ATOM 594 CB TRP A 36 4.495 17.522 -11.217 1.00 31.13 C ATOM 595 CG TRP A 36 4.318 18.805 -11.971 1.00 20.45 C ATOM 596 CD1 TRP A 36 3.268 19.673 -11.875 1.00 72.13 C ATOM 597 CD2 TRP A 36 5.216 19.362 -12.937 1.00 22.23 C ATOM 598 NE1 TRP A 36 3.460 20.737 -12.724 1.00 65.23 N ATOM 599 CE2 TRP A 36 4.647 20.570 -13.385 1.00 61.32 C ATOM 600 CE3 TRP A 36 6.446 18.960 -13.464 1.00 63.42 C ATOM 601 CZ2 TRP A 36 5.267 21.377 -14.337 1.00 4.53 C ATOM 602 CZ3 TRP A 36 7.059 19.761 -14.408 1.00 14.42 C ATOM 603 CH2 TRP A 36 6.470 20.958 -14.836 1.00 31.42 C ATOM 0 H TRP A 36 4.407 15.300 -10.133 1.00 11.21 H new ATOM 0 HA TRP A 36 2.598 16.629 -11.690 1.00 20.15 H new ATOM 0 HB2 TRP A 36 4.231 17.684 -10.172 1.00 31.13 H new ATOM 0 HB3 TRP A 36 5.547 17.238 -11.240 1.00 31.13 H new ATOM 0 HD1 TRP A 36 2.413 19.543 -11.228 1.00 72.13 H new ATOM 0 HE1 TRP A 36 2.821 21.524 -12.842 1.00 65.23 H new ATOM 0 HE3 TRP A 36 6.909 18.040 -13.139 1.00 63.42 H new ATOM 0 HZ2 TRP A 36 4.814 22.300 -14.669 1.00 4.53 H new ATOM 0 HZ3 TRP A 36 8.009 19.459 -14.823 1.00 14.42 H new ATOM 0 HH2 TRP A 36 6.976 21.562 -15.575 1.00 31.42 H new ATOM 614 N ALA A 37 5.056 15.408 -13.500 1.00 55.54 N ATOM 615 CA ALA A 37 5.476 15.119 -14.866 1.00 12.03 C ATOM 616 C ALA A 37 4.455 14.241 -15.580 1.00 51.50 C ATOM 617 O ALA A 37 3.904 14.626 -16.611 1.00 10.34 O ATOM 618 CB ALA A 37 6.843 14.450 -14.867 1.00 2.35 C ATOM 0 H ALA A 37 5.650 14.997 -12.780 1.00 55.54 H new ATOM 0 HA ALA A 37 5.545 16.063 -15.406 1.00 12.03 H new ATOM 0 HB1 ALA A 37 7.144 14.240 -15.893 1.00 2.35 H new ATOM 0 HB2 ALA A 37 7.573 15.113 -14.403 1.00 2.35 H new ATOM 0 HB3 ALA A 37 6.792 13.517 -14.306 1.00 2.35 H new ATOM 624 N ALA A 38 4.209 13.058 -15.027 1.00 44.00 N ATOM 625 CA ALA A 38 3.252 12.125 -15.611 1.00 12.43 C ATOM 626 C ALA A 38 1.901 12.794 -15.835 1.00 44.44 C ATOM 627 O ALA A 38 1.229 12.537 -16.833 1.00 24.41 O ATOM 628 CB ALA A 38 3.097 10.901 -14.720 1.00 30.52 C ATOM 0 H ALA A 38 4.659 12.723 -14.175 1.00 44.00 H new ATOM 0 HA ALA A 38 3.636 11.808 -16.581 1.00 12.43 H new ATOM 0 HB1 ALA A 38 2.380 10.213 -15.168 1.00 30.52 H new ATOM 0 HB2 ALA A 38 4.061 10.403 -14.615 1.00 30.52 H new ATOM 0 HB3 ALA A 38 2.739 11.209 -13.738 1.00 30.52 H new ATOM 634 N ASN A 39 1.507 13.652 -14.900 1.00 33.31 N ATOM 635 CA ASN A 39 0.235 14.358 -14.995 1.00 44.45 C ATOM 636 C ASN A 39 0.279 15.414 -16.096 1.00 4.30 C ATOM 637 O ASN A 39 -0.579 15.443 -16.979 1.00 13.02 O ATOM 638 CB ASN A 39 -0.111 15.013 -13.658 1.00 20.33 C ATOM 639 CG ASN A 39 -1.341 14.402 -13.014 1.00 21.30 C ATOM 640 OD1 ASN A 39 -1.319 14.025 -11.843 1.00 25.13 O ATOM 641 ND2 ASN A 39 -2.421 14.301 -13.781 1.00 42.43 N ATOM 0 H ASN A 39 2.051 13.875 -14.067 1.00 33.31 H new ATOM 0 HA ASN A 39 -0.537 13.630 -15.245 1.00 44.45 H new ATOM 0 HB2 ASN A 39 0.737 14.916 -12.979 1.00 20.33 H new ATOM 0 HB3 ASN A 39 -0.277 16.079 -13.811 1.00 20.33 H new ATOM 0 HD21 ASN A 39 -3.278 13.897 -13.404 1.00 42.43 H new ATOM 0 HD22 ASN A 39 -2.393 14.627 -14.747 1.00 42.43 H new ATOM 648 N LYS A 40 1.285 16.280 -16.036 1.00 61.41 N ATOM 649 CA LYS A 40 1.443 17.338 -17.027 1.00 54.52 C ATOM 650 C LYS A 40 1.298 16.785 -18.442 1.00 12.54 C ATOM 651 O LYS A 40 0.781 17.459 -19.333 1.00 43.33 O ATOM 652 CB LYS A 40 2.809 18.011 -16.870 1.00 63.00 C ATOM 653 CG LYS A 40 2.766 19.287 -16.048 1.00 34.55 C ATOM 654 CD LYS A 40 1.974 20.377 -16.750 1.00 24.41 C ATOM 655 CE LYS A 40 1.966 21.668 -15.944 1.00 52.30 C ATOM 656 NZ LYS A 40 0.590 22.045 -15.515 1.00 75.05 N ATOM 0 H LYS A 40 2.003 16.270 -15.312 1.00 61.41 H new ATOM 0 HA LYS A 40 0.658 18.076 -16.862 1.00 54.52 H new ATOM 0 HB2 LYS A 40 3.499 17.309 -16.401 1.00 63.00 H new ATOM 0 HB3 LYS A 40 3.209 18.238 -17.858 1.00 63.00 H new ATOM 0 HG2 LYS A 40 2.318 19.080 -15.076 1.00 34.55 H new ATOM 0 HG3 LYS A 40 3.782 19.636 -15.863 1.00 34.55 H new ATOM 0 HD2 LYS A 40 2.404 20.564 -17.734 1.00 24.41 H new ATOM 0 HD3 LYS A 40 0.950 20.039 -16.908 1.00 24.41 H new ATOM 0 HE2 LYS A 40 2.601 21.552 -15.066 1.00 52.30 H new ATOM 0 HE3 LYS A 40 2.393 22.473 -16.542 1.00 52.30 H new ATOM 0 HZ1 LYS A 40 0.627 22.929 -14.969 1.00 75.05 H new ATOM 0 HZ2 LYS A 40 -0.010 22.181 -16.353 1.00 75.05 H new ATOM 0 HZ3 LYS A 40 0.192 21.289 -14.923 1.00 75.05 H new ATOM 670 N LEU A 41 1.756 15.554 -18.640 1.00 43.32 N ATOM 671 CA LEU A 41 1.675 14.908 -19.946 1.00 34.00 C ATOM 672 C LEU A 41 0.224 14.661 -20.343 1.00 64.21 C ATOM 673 O LEU A 41 -0.277 15.248 -21.303 1.00 34.35 O ATOM 674 CB LEU A 41 2.444 13.586 -19.932 1.00 75.22 C ATOM 675 CG LEU A 41 3.966 13.695 -19.831 1.00 60.13 C ATOM 676 CD1 LEU A 41 4.568 12.370 -19.390 1.00 34.53 C ATOM 677 CD2 LEU A 41 4.559 14.135 -21.162 1.00 43.30 C ATOM 0 H LEU A 41 2.187 14.983 -17.913 1.00 43.32 H new ATOM 0 HA LEU A 41 2.125 15.575 -20.682 1.00 34.00 H new ATOM 0 HB2 LEU A 41 2.086 12.990 -19.093 1.00 75.22 H new ATOM 0 HB3 LEU A 41 2.199 13.037 -20.841 1.00 75.22 H new ATOM 0 HG LEU A 41 4.208 14.448 -19.081 1.00 60.13 H new ATOM 0 HD11 LEU A 41 5.652 12.467 -19.324 1.00 34.53 H new ATOM 0 HD12 LEU A 41 4.168 12.095 -18.414 1.00 34.53 H new ATOM 0 HD13 LEU A 41 4.317 11.597 -20.116 1.00 34.53 H new ATOM 0 HD21 LEU A 41 5.643 14.207 -21.071 1.00 43.30 H new ATOM 0 HD22 LEU A 41 4.307 13.405 -21.932 1.00 43.30 H new ATOM 0 HD23 LEU A 41 4.152 15.108 -21.438 1.00 43.30 H new ATOM 689 N ASP A 42 -0.448 13.791 -19.598 1.00 64.11 N ATOM 690 CA ASP A 42 -1.844 13.468 -19.869 1.00 43.14 C ATOM 691 C ASP A 42 -2.645 14.732 -20.172 1.00 52.40 C ATOM 692 O ASP A 42 -3.438 14.764 -21.113 1.00 33.05 O ATOM 693 CB ASP A 42 -2.461 12.732 -18.679 1.00 30.21 C ATOM 694 CG ASP A 42 -2.773 11.282 -18.993 1.00 54.11 C ATOM 695 OD1 ASP A 42 -1.915 10.609 -19.602 1.00 40.04 O ATOM 696 OD2 ASP A 42 -3.875 10.821 -18.629 1.00 51.41 O ATOM 0 H ASP A 42 -0.048 13.296 -18.801 1.00 64.11 H new ATOM 0 HA ASP A 42 -1.877 12.819 -20.744 1.00 43.14 H new ATOM 0 HB2 ASP A 42 -1.776 12.778 -17.832 1.00 30.21 H new ATOM 0 HB3 ASP A 42 -3.377 13.240 -18.376 1.00 30.21 H new ATOM 701 N ARG A 43 -2.431 15.768 -19.368 1.00 24.03 N ATOM 702 CA ARG A 43 -3.135 17.032 -19.548 1.00 12.41 C ATOM 703 C ARG A 43 -2.812 17.644 -20.908 1.00 72.01 C ATOM 704 O ARG A 43 -3.707 17.905 -21.712 1.00 22.22 O ATOM 705 CB ARG A 43 -2.761 18.012 -18.435 1.00 12.44 C ATOM 706 CG ARG A 43 -3.885 18.962 -18.057 1.00 22.00 C ATOM 707 CD ARG A 43 -4.533 18.564 -16.740 1.00 72.15 C ATOM 708 NE ARG A 43 -5.177 19.697 -16.082 1.00 61.54 N ATOM 709 CZ ARG A 43 -5.599 19.674 -14.823 1.00 14.32 C ATOM 710 NH1 ARG A 43 -5.444 18.580 -14.089 1.00 74.32 N ATOM 711 NH2 ARG A 43 -6.176 20.746 -14.295 1.00 52.33 N ATOM 0 H ARG A 43 -1.776 15.757 -18.586 1.00 24.03 H new ATOM 0 HA ARG A 43 -4.206 16.833 -19.502 1.00 12.41 H new ATOM 0 HB2 ARG A 43 -2.461 17.448 -17.552 1.00 12.44 H new ATOM 0 HB3 ARG A 43 -1.895 18.594 -18.751 1.00 12.44 H new ATOM 0 HG2 ARG A 43 -3.494 19.977 -17.979 1.00 22.00 H new ATOM 0 HG3 ARG A 43 -4.637 18.970 -18.846 1.00 22.00 H new ATOM 0 HD2 ARG A 43 -5.271 17.783 -16.921 1.00 72.15 H new ATOM 0 HD3 ARG A 43 -3.778 18.142 -16.077 1.00 72.15 H new ATOM 0 HE ARG A 43 -5.310 20.554 -16.619 1.00 61.54 H new ATOM 0 HH11 ARG A 43 -5.000 17.755 -14.491 1.00 74.32 H new ATOM 0 HH12 ARG A 43 -5.769 18.564 -13.122 1.00 74.32 H new ATOM 0 HH21 ARG A 43 -6.296 21.589 -14.856 1.00 52.33 H new ATOM 0 HH22 ARG A 43 -6.500 20.727 -13.328 1.00 52.33 H new ATOM 725 N PHE A 44 -1.527 17.871 -21.159 1.00 22.33 N ATOM 726 CA PHE A 44 -1.085 18.454 -22.421 1.00 22.05 C ATOM 727 C PHE A 44 -1.584 17.630 -23.604 1.00 40.33 C ATOM 728 O PHE A 44 -2.042 18.177 -24.607 1.00 12.41 O ATOM 729 CB PHE A 44 0.442 18.549 -22.457 1.00 45.43 C ATOM 730 CG PHE A 44 0.976 19.832 -21.888 1.00 1.32 C ATOM 731 CD1 PHE A 44 0.537 21.055 -22.369 1.00 5.13 C ATOM 732 CD2 PHE A 44 1.918 19.814 -20.873 1.00 34.13 C ATOM 733 CE1 PHE A 44 1.028 22.237 -21.847 1.00 2.22 C ATOM 734 CE2 PHE A 44 2.413 20.993 -20.347 1.00 73.44 C ATOM 735 CZ PHE A 44 1.966 22.206 -20.835 1.00 13.54 C ATOM 0 H PHE A 44 -0.773 17.660 -20.505 1.00 22.33 H new ATOM 0 HA PHE A 44 -1.505 19.457 -22.497 1.00 22.05 H new ATOM 0 HB2 PHE A 44 0.863 17.711 -21.901 1.00 45.43 H new ATOM 0 HB3 PHE A 44 0.780 18.450 -23.488 1.00 45.43 H new ATOM 0 HD1 PHE A 44 -0.197 21.085 -23.161 1.00 5.13 H new ATOM 0 HD2 PHE A 44 2.270 18.868 -20.488 1.00 34.13 H new ATOM 0 HE1 PHE A 44 0.678 23.184 -22.231 1.00 2.22 H new ATOM 0 HE2 PHE A 44 3.148 20.966 -19.556 1.00 73.44 H new ATOM 0 HZ PHE A 44 2.350 23.128 -20.425 1.00 13.54 H new ATOM 745 N GLY A 45 -1.491 16.309 -23.479 1.00 73.44 N ATOM 746 CA GLY A 45 -1.935 15.430 -24.546 1.00 35.34 C ATOM 747 C GLY A 45 -1.076 14.188 -24.667 1.00 50.23 C ATOM 748 O GLY A 45 -1.409 13.265 -25.413 1.00 14.32 O ATOM 0 H GLY A 45 -1.116 15.832 -22.659 1.00 73.44 H new ATOM 0 HA2 GLY A 45 -2.969 15.137 -24.365 1.00 35.34 H new ATOM 0 HA3 GLY A 45 -1.919 15.973 -25.491 1.00 35.34 H new ATOM 752 N LEU A 46 0.032 14.162 -23.936 1.00 34.33 N ATOM 753 CA LEU A 46 0.943 13.023 -23.966 1.00 75.00 C ATOM 754 C LEU A 46 0.559 11.991 -22.911 1.00 11.15 C ATOM 755 O LEU A 46 -0.004 12.331 -21.871 1.00 13.02 O ATOM 756 CB LEU A 46 2.383 13.490 -23.739 1.00 41.25 C ATOM 757 CG LEU A 46 3.121 14.012 -24.973 1.00 11.44 C ATOM 758 CD1 LEU A 46 3.808 15.333 -24.664 1.00 65.10 C ATOM 759 CD2 LEU A 46 4.131 12.985 -25.463 1.00 61.11 C ATOM 0 H LEU A 46 0.322 14.917 -23.315 1.00 34.33 H new ATOM 0 HA LEU A 46 0.869 12.556 -24.948 1.00 75.00 H new ATOM 0 HB2 LEU A 46 2.374 14.277 -22.985 1.00 41.25 H new ATOM 0 HB3 LEU A 46 2.953 12.658 -23.324 1.00 41.25 H new ATOM 0 HG LEU A 46 2.392 14.182 -25.765 1.00 11.44 H new ATOM 0 HD11 LEU A 46 4.328 15.689 -25.553 1.00 65.10 H new ATOM 0 HD12 LEU A 46 3.063 16.068 -24.360 1.00 65.10 H new ATOM 0 HD13 LEU A 46 4.526 15.189 -23.857 1.00 65.10 H new ATOM 0 HD21 LEU A 46 4.647 13.373 -26.341 1.00 61.11 H new ATOM 0 HD22 LEU A 46 4.857 12.784 -24.675 1.00 61.11 H new ATOM 0 HD23 LEU A 46 3.614 12.062 -25.724 1.00 61.11 H new ATOM 771 N ALA A 47 0.870 10.728 -23.186 1.00 4.15 N ATOM 772 CA ALA A 47 0.561 9.646 -22.258 1.00 64.45 C ATOM 773 C ALA A 47 1.351 9.792 -20.962 1.00 12.20 C ATOM 774 O ALA A 47 2.159 10.709 -20.818 1.00 14.42 O ATOM 775 CB ALA A 47 0.847 8.299 -22.905 1.00 22.14 C ATOM 0 H ALA A 47 1.335 10.429 -24.043 1.00 4.15 H new ATOM 0 HA ALA A 47 -0.500 9.701 -22.014 1.00 64.45 H new ATOM 0 HB1 ALA A 47 0.612 7.500 -22.202 1.00 22.14 H new ATOM 0 HB2 ALA A 47 0.234 8.187 -23.799 1.00 22.14 H new ATOM 0 HB3 ALA A 47 1.901 8.243 -23.179 1.00 22.14 H new ATOM 781 N GLU A 48 1.112 8.882 -20.023 1.00 41.41 N ATOM 782 CA GLU A 48 1.802 8.911 -18.739 1.00 2.14 C ATOM 783 C GLU A 48 2.804 7.765 -18.632 1.00 45.05 C ATOM 784 O GLU A 48 3.858 7.903 -18.013 1.00 62.10 O ATOM 785 CB GLU A 48 0.793 8.830 -17.591 1.00 43.41 C ATOM 786 CG GLU A 48 0.120 7.473 -17.468 1.00 11.34 C ATOM 787 CD GLU A 48 -1.329 7.578 -17.036 1.00 64.35 C ATOM 788 OE1 GLU A 48 -1.595 8.212 -15.994 1.00 30.12 O ATOM 789 OE2 GLU A 48 -2.200 7.026 -17.742 1.00 71.11 O ATOM 0 H GLU A 48 0.446 8.116 -20.127 1.00 41.41 H new ATOM 0 HA GLU A 48 2.346 9.853 -18.670 1.00 2.14 H new ATOM 0 HB2 GLU A 48 1.301 9.061 -16.655 1.00 43.41 H new ATOM 0 HB3 GLU A 48 0.029 9.594 -17.735 1.00 43.41 H new ATOM 0 HG2 GLU A 48 0.173 6.957 -18.427 1.00 11.34 H new ATOM 0 HG3 GLU A 48 0.667 6.864 -16.748 1.00 11.34 H new ATOM 796 N SER A 49 2.464 6.632 -19.241 1.00 14.22 N ATOM 797 CA SER A 49 3.331 5.460 -19.212 1.00 1.14 C ATOM 798 C SER A 49 4.545 5.658 -20.114 1.00 33.24 C ATOM 799 O SER A 49 5.444 4.818 -20.158 1.00 34.32 O ATOM 800 CB SER A 49 2.555 4.215 -19.648 1.00 63.01 C ATOM 801 OG SER A 49 2.620 4.040 -21.053 1.00 34.30 O ATOM 0 H SER A 49 1.595 6.502 -19.760 1.00 14.22 H new ATOM 0 HA SER A 49 3.680 5.323 -18.189 1.00 1.14 H new ATOM 0 HB2 SER A 49 2.962 3.335 -19.150 1.00 63.01 H new ATOM 0 HB3 SER A 49 1.514 4.304 -19.337 1.00 63.01 H new ATOM 0 HG SER A 49 2.118 3.237 -21.306 1.00 34.30 H new ATOM 807 N LEU A 50 4.563 6.777 -20.832 1.00 11.43 N ATOM 808 CA LEU A 50 5.667 7.087 -21.734 1.00 33.21 C ATOM 809 C LEU A 50 6.966 7.281 -20.959 1.00 2.41 C ATOM 810 O LEU A 50 8.052 7.290 -21.539 1.00 51.13 O ATOM 811 CB LEU A 50 5.351 8.347 -22.543 1.00 24.24 C ATOM 812 CG LEU A 50 4.272 8.201 -23.618 1.00 2.24 C ATOM 813 CD1 LEU A 50 3.916 9.557 -24.205 1.00 34.03 C ATOM 814 CD2 LEU A 50 4.735 7.249 -24.711 1.00 1.02 C ATOM 0 H LEU A 50 3.827 7.483 -20.807 1.00 11.43 H new ATOM 0 HA LEU A 50 5.794 6.246 -22.415 1.00 33.21 H new ATOM 0 HB2 LEU A 50 5.043 9.131 -21.851 1.00 24.24 H new ATOM 0 HB3 LEU A 50 6.269 8.687 -23.022 1.00 24.24 H new ATOM 0 HG LEU A 50 3.378 7.784 -23.155 1.00 2.24 H new ATOM 0 HD11 LEU A 50 3.147 9.433 -24.968 1.00 34.03 H new ATOM 0 HD12 LEU A 50 3.542 10.208 -23.415 1.00 34.03 H new ATOM 0 HD13 LEU A 50 4.803 10.004 -24.654 1.00 34.03 H new ATOM 0 HD21 LEU A 50 3.956 7.157 -25.467 1.00 1.02 H new ATOM 0 HD22 LEU A 50 5.643 7.638 -25.171 1.00 1.02 H new ATOM 0 HD23 LEU A 50 4.938 6.269 -24.278 1.00 1.02 H new ATOM 826 N LEU A 51 6.848 7.432 -19.644 1.00 62.44 N ATOM 827 CA LEU A 51 8.013 7.623 -18.788 1.00 60.20 C ATOM 828 C LEU A 51 8.606 6.282 -18.367 1.00 62.13 C ATOM 829 O LEU A 51 9.672 6.228 -17.757 1.00 75.22 O ATOM 830 CB LEU A 51 7.634 8.437 -17.550 1.00 22.03 C ATOM 831 CG LEU A 51 7.449 9.940 -17.764 1.00 53.42 C ATOM 832 CD1 LEU A 51 6.350 10.477 -16.861 1.00 51.31 C ATOM 833 CD2 LEU A 51 8.756 10.678 -17.513 1.00 14.01 C ATOM 0 H LEU A 51 5.957 7.426 -19.148 1.00 62.44 H new ATOM 0 HA LEU A 51 8.765 8.169 -19.358 1.00 60.20 H new ATOM 0 HB2 LEU A 51 6.707 8.032 -17.143 1.00 22.03 H new ATOM 0 HB3 LEU A 51 8.405 8.290 -16.794 1.00 22.03 H new ATOM 0 HG LEU A 51 7.153 10.107 -18.800 1.00 53.42 H new ATOM 0 HD11 LEU A 51 6.233 11.548 -17.028 1.00 51.31 H new ATOM 0 HD12 LEU A 51 5.412 9.970 -17.088 1.00 51.31 H new ATOM 0 HD13 LEU A 51 6.616 10.299 -15.819 1.00 51.31 H new ATOM 0 HD21 LEU A 51 8.607 11.746 -17.670 1.00 14.01 H new ATOM 0 HD22 LEU A 51 9.081 10.504 -16.487 1.00 14.01 H new ATOM 0 HD23 LEU A 51 9.518 10.313 -18.202 1.00 14.01 H new ATOM 845 N GLU A 52 7.906 5.202 -18.700 1.00 61.10 N ATOM 846 CA GLU A 52 8.364 3.861 -18.358 1.00 51.40 C ATOM 847 C GLU A 52 9.549 3.452 -19.228 1.00 10.35 C ATOM 848 O GLU A 52 10.590 3.032 -18.720 1.00 44.03 O ATOM 849 CB GLU A 52 7.225 2.851 -18.521 1.00 54.13 C ATOM 850 CG GLU A 52 6.028 3.136 -17.632 1.00 25.14 C ATOM 851 CD GLU A 52 5.055 1.974 -17.573 1.00 14.24 C ATOM 852 OE1 GLU A 52 4.594 1.530 -18.644 1.00 24.03 O ATOM 853 OE2 GLU A 52 4.756 1.508 -16.453 1.00 12.44 O ATOM 0 H GLU A 52 7.021 5.230 -19.206 1.00 61.10 H new ATOM 0 HA GLU A 52 8.686 3.870 -17.317 1.00 51.40 H new ATOM 0 HB2 GLU A 52 6.901 2.846 -19.562 1.00 54.13 H new ATOM 0 HB3 GLU A 52 7.602 1.852 -18.300 1.00 54.13 H new ATOM 0 HG2 GLU A 52 6.375 3.366 -16.625 1.00 25.14 H new ATOM 0 HG3 GLU A 52 5.509 4.021 -18.000 1.00 25.14 H new ATOM 860 N SER A 53 9.384 3.578 -20.541 1.00 3.23 N ATOM 861 CA SER A 53 10.437 3.218 -21.482 1.00 2.31 C ATOM 862 C SER A 53 11.242 4.447 -21.893 1.00 62.24 C ATOM 863 O SER A 53 10.679 5.504 -22.182 1.00 3.43 O ATOM 864 CB SER A 53 9.837 2.548 -22.721 1.00 32.45 C ATOM 865 OG SER A 53 9.813 3.440 -23.820 1.00 73.55 O ATOM 0 H SER A 53 8.530 3.927 -20.977 1.00 3.23 H new ATOM 0 HA SER A 53 11.107 2.515 -20.987 1.00 2.31 H new ATOM 0 HB2 SER A 53 10.420 1.664 -22.979 1.00 32.45 H new ATOM 0 HB3 SER A 53 8.825 2.209 -22.501 1.00 32.45 H new ATOM 0 HG SER A 53 9.427 2.988 -24.599 1.00 73.55 H new ATOM 871 N LYS A 54 12.562 4.302 -21.920 1.00 2.01 N ATOM 872 CA LYS A 54 13.446 5.398 -22.297 1.00 5.15 C ATOM 873 C LYS A 54 13.157 5.866 -23.719 1.00 45.33 C ATOM 874 O LYS A 54 13.354 7.034 -24.050 1.00 50.24 O ATOM 875 CB LYS A 54 14.909 4.965 -22.179 1.00 4.12 C ATOM 876 CG LYS A 54 15.343 3.989 -23.259 1.00 33.12 C ATOM 877 CD LYS A 54 16.714 3.403 -22.962 1.00 71.34 C ATOM 878 CE LYS A 54 16.607 2.099 -22.187 1.00 60.31 C ATOM 879 NZ LYS A 54 16.688 0.913 -23.083 1.00 51.05 N ATOM 0 H LYS A 54 13.044 3.434 -21.685 1.00 2.01 H new ATOM 0 HA LYS A 54 13.263 6.229 -21.616 1.00 5.15 H new ATOM 0 HB2 LYS A 54 15.545 5.849 -22.223 1.00 4.12 H new ATOM 0 HB3 LYS A 54 15.066 4.507 -21.202 1.00 4.12 H new ATOM 0 HG2 LYS A 54 14.612 3.185 -23.339 1.00 33.12 H new ATOM 0 HG3 LYS A 54 15.364 4.497 -24.223 1.00 33.12 H new ATOM 0 HD2 LYS A 54 17.247 3.229 -23.897 1.00 71.34 H new ATOM 0 HD3 LYS A 54 17.301 4.121 -22.389 1.00 71.34 H new ATOM 0 HE2 LYS A 54 17.406 2.050 -21.447 1.00 60.31 H new ATOM 0 HE3 LYS A 54 15.664 2.078 -21.641 1.00 60.31 H new ATOM 0 HZ1 LYS A 54 16.611 0.044 -22.517 1.00 51.05 H new ATOM 0 HZ2 LYS A 54 15.911 0.946 -23.774 1.00 51.05 H new ATOM 0 HZ3 LYS A 54 17.598 0.919 -23.586 1.00 51.05 H new ATOM 893 N GLU A 55 12.686 4.945 -24.555 1.00 40.45 N ATOM 894 CA GLU A 55 12.369 5.265 -25.942 1.00 52.24 C ATOM 895 C GLU A 55 11.231 6.279 -26.021 1.00 43.41 C ATOM 896 O GLU A 55 11.313 7.266 -26.750 1.00 54.42 O ATOM 897 CB GLU A 55 11.990 3.995 -26.708 1.00 64.10 C ATOM 898 CG GLU A 55 13.015 3.585 -27.753 1.00 64.44 C ATOM 899 CD GLU A 55 12.868 4.360 -29.048 1.00 44.54 C ATOM 900 OE1 GLU A 55 11.720 4.541 -29.506 1.00 1.13 O ATOM 901 OE2 GLU A 55 13.902 4.784 -29.606 1.00 23.32 O ATOM 0 H GLU A 55 12.516 3.973 -24.296 1.00 40.45 H new ATOM 0 HA GLU A 55 13.256 5.705 -26.398 1.00 52.24 H new ATOM 0 HB2 GLU A 55 11.860 3.178 -25.998 1.00 64.10 H new ATOM 0 HB3 GLU A 55 11.028 4.149 -27.196 1.00 64.10 H new ATOM 0 HG2 GLU A 55 14.017 3.739 -27.353 1.00 64.44 H new ATOM 0 HG3 GLU A 55 12.913 2.519 -27.958 1.00 64.44 H new ATOM 908 N GLY A 56 10.167 6.025 -25.264 1.00 14.35 N ATOM 909 CA GLY A 56 9.027 6.922 -25.263 1.00 33.35 C ATOM 910 C GLY A 56 9.408 8.343 -24.893 1.00 51.34 C ATOM 911 O GLY A 56 8.924 9.300 -25.499 1.00 30.15 O ATOM 0 H GLY A 56 10.075 5.214 -24.652 1.00 14.35 H new ATOM 0 HA2 GLY A 56 8.565 6.918 -26.250 1.00 33.35 H new ATOM 0 HA3 GLY A 56 8.280 6.554 -24.560 1.00 33.35 H new ATOM 915 N CYS A 57 10.276 8.481 -23.896 1.00 65.24 N ATOM 916 CA CYS A 57 10.719 9.795 -23.446 1.00 11.31 C ATOM 917 C CYS A 57 11.423 10.547 -24.571 1.00 4.35 C ATOM 918 O CYS A 57 11.389 11.776 -24.624 1.00 40.43 O ATOM 919 CB CYS A 57 11.656 9.656 -22.245 1.00 25.01 C ATOM 920 SG CYS A 57 10.901 10.105 -20.664 1.00 31.23 S ATOM 0 H CYS A 57 10.686 7.699 -23.385 1.00 65.24 H new ATOM 0 HA CYS A 57 9.839 10.365 -23.148 1.00 11.31 H new ATOM 0 HB2 CYS A 57 12.006 8.625 -22.188 1.00 25.01 H new ATOM 0 HB3 CYS A 57 12.533 10.282 -22.408 1.00 25.01 H new ATOM 0 HG CYS A 57 11.770 9.953 -19.709 1.00 31.23 H new ATOM 926 N GLN A 58 12.061 9.800 -25.466 1.00 30.12 N ATOM 927 CA GLN A 58 12.775 10.397 -26.589 1.00 10.24 C ATOM 928 C GLN A 58 11.832 11.224 -27.456 1.00 32.52 C ATOM 929 O GLN A 58 12.253 12.167 -28.126 1.00 31.32 O ATOM 930 CB GLN A 58 13.441 9.309 -27.433 1.00 35.45 C ATOM 931 CG GLN A 58 14.924 9.545 -27.668 1.00 52.05 C ATOM 932 CD GLN A 58 15.222 10.025 -29.075 1.00 54.04 C ATOM 933 OE1 GLN A 58 14.358 10.588 -29.748 1.00 23.01 O ATOM 934 NE2 GLN A 58 16.451 9.804 -29.528 1.00 61.24 N ATOM 0 H GLN A 58 12.098 8.781 -25.436 1.00 30.12 H new ATOM 0 HA GLN A 58 13.544 11.058 -26.188 1.00 10.24 H new ATOM 0 HB2 GLN A 58 13.308 8.346 -26.940 1.00 35.45 H new ATOM 0 HB3 GLN A 58 12.934 9.247 -28.396 1.00 35.45 H new ATOM 0 HG2 GLN A 58 15.289 10.281 -26.952 1.00 52.05 H new ATOM 0 HG3 GLN A 58 15.470 8.620 -27.480 1.00 52.05 H new ATOM 0 HE21 GLN A 58 17.136 9.334 -28.936 1.00 61.24 H new ATOM 0 HE22 GLN A 58 16.710 10.105 -30.468 1.00 61.24 H new ATOM 943 N LYS A 59 10.553 10.864 -27.439 1.00 64.40 N ATOM 944 CA LYS A 59 9.548 11.574 -28.223 1.00 52.40 C ATOM 945 C LYS A 59 8.975 12.749 -27.438 1.00 22.41 C ATOM 946 O LYS A 59 8.342 13.639 -28.008 1.00 55.51 O ATOM 947 CB LYS A 59 8.422 10.620 -28.629 1.00 11.22 C ATOM 948 CG LYS A 59 8.549 10.099 -30.050 1.00 65.22 C ATOM 949 CD LYS A 59 7.383 10.549 -30.915 1.00 0.34 C ATOM 950 CE LYS A 59 6.175 9.641 -30.738 1.00 70.24 C ATOM 951 NZ LYS A 59 4.936 10.253 -31.293 1.00 52.01 N ATOM 0 H LYS A 59 10.188 10.085 -26.891 1.00 64.40 H new ATOM 0 HA LYS A 59 10.030 11.961 -29.121 1.00 52.40 H new ATOM 0 HB2 LYS A 59 8.408 9.775 -27.941 1.00 11.22 H new ATOM 0 HB3 LYS A 59 7.466 11.133 -28.523 1.00 11.22 H new ATOM 0 HG2 LYS A 59 9.484 10.452 -30.486 1.00 65.22 H new ATOM 0 HG3 LYS A 59 8.594 9.010 -30.037 1.00 65.22 H new ATOM 0 HD2 LYS A 59 7.111 11.573 -30.657 1.00 0.34 H new ATOM 0 HD3 LYS A 59 7.686 10.554 -31.962 1.00 0.34 H new ATOM 0 HE2 LYS A 59 6.362 8.687 -31.232 1.00 70.24 H new ATOM 0 HE3 LYS A 59 6.032 9.429 -29.678 1.00 70.24 H new ATOM 0 HZ1 LYS A 59 4.136 9.604 -31.153 1.00 52.01 H new ATOM 0 HZ2 LYS A 59 4.743 11.151 -30.805 1.00 52.01 H new ATOM 0 HZ3 LYS A 59 5.063 10.432 -32.310 1.00 52.01 H new ATOM 965 N ILE A 60 9.202 12.746 -26.129 1.00 61.20 N ATOM 966 CA ILE A 60 8.709 13.814 -25.267 1.00 13.23 C ATOM 967 C ILE A 60 9.692 14.979 -25.219 1.00 34.11 C ATOM 968 O ILE A 60 9.293 16.140 -25.131 1.00 21.45 O ATOM 969 CB ILE A 60 8.458 13.310 -23.834 1.00 32.30 C ATOM 970 CG1 ILE A 60 7.688 11.988 -23.863 1.00 12.23 C ATOM 971 CG2 ILE A 60 7.698 14.354 -23.030 1.00 63.31 C ATOM 972 CD1 ILE A 60 7.420 11.415 -22.488 1.00 55.04 C ATOM 0 H ILE A 60 9.723 12.017 -25.642 1.00 61.20 H new ATOM 0 HA ILE A 60 7.766 14.154 -25.694 1.00 13.23 H new ATOM 0 HB ILE A 60 9.420 13.138 -23.351 1.00 32.30 H new ATOM 0 HG12 ILE A 60 6.738 12.141 -24.376 1.00 12.23 H new ATOM 0 HG13 ILE A 60 8.252 11.261 -24.447 1.00 12.23 H new ATOM 0 HG21 ILE A 60 7.528 13.982 -22.019 1.00 63.31 H new ATOM 0 HG22 ILE A 60 8.281 15.274 -22.985 1.00 63.31 H new ATOM 0 HG23 ILE A 60 6.739 14.555 -23.508 1.00 63.31 H new ATOM 0 HD11 ILE A 60 6.871 10.478 -22.585 1.00 55.04 H new ATOM 0 HD12 ILE A 60 8.367 11.230 -21.980 1.00 55.04 H new ATOM 0 HD13 ILE A 60 6.829 12.124 -21.907 1.00 55.04 H new ATOM 984 N LEU A 61 10.981 14.661 -25.279 1.00 22.52 N ATOM 985 CA LEU A 61 12.024 15.681 -25.245 1.00 24.45 C ATOM 986 C LEU A 61 12.175 16.351 -26.606 1.00 44.12 C ATOM 987 O LEU A 61 12.513 17.532 -26.696 1.00 52.31 O ATOM 988 CB LEU A 61 13.356 15.063 -24.817 1.00 2.22 C ATOM 989 CG LEU A 61 13.473 14.676 -23.342 1.00 2.14 C ATOM 990 CD1 LEU A 61 14.734 13.861 -23.103 1.00 52.10 C ATOM 991 CD2 LEU A 61 13.463 15.918 -22.462 1.00 71.11 C ATOM 0 H LEU A 61 11.329 13.705 -25.351 1.00 22.52 H new ATOM 0 HA LEU A 61 11.732 16.439 -24.518 1.00 24.45 H new ATOM 0 HB2 LEU A 61 13.531 14.172 -25.421 1.00 2.22 H new ATOM 0 HB3 LEU A 61 14.153 15.769 -25.051 1.00 2.22 H new ATOM 0 HG LEU A 61 12.612 14.061 -23.078 1.00 2.14 H new ATOM 0 HD11 LEU A 61 14.801 13.595 -22.048 1.00 52.10 H new ATOM 0 HD12 LEU A 61 14.700 12.953 -23.705 1.00 52.10 H new ATOM 0 HD13 LEU A 61 15.607 14.450 -23.384 1.00 52.10 H new ATOM 0 HD21 LEU A 61 13.547 15.623 -21.416 1.00 71.11 H new ATOM 0 HD22 LEU A 61 14.304 16.559 -22.727 1.00 71.11 H new ATOM 0 HD23 LEU A 61 12.531 16.463 -22.612 1.00 71.11 H new ATOM 1003 N THR A 62 11.921 15.590 -27.666 1.00 64.44 N ATOM 1004 CA THR A 62 12.027 16.110 -29.024 1.00 2.10 C ATOM 1005 C THR A 62 10.957 17.161 -29.296 1.00 15.10 C ATOM 1006 O THR A 62 11.198 18.137 -30.007 1.00 64.14 O ATOM 1007 CB THR A 62 11.901 14.983 -30.068 1.00 33.40 C ATOM 1008 OG1 THR A 62 12.378 15.439 -31.339 1.00 61.23 O ATOM 1009 CG2 THR A 62 10.457 14.525 -30.197 1.00 54.44 C ATOM 0 H THR A 62 11.640 14.611 -27.610 1.00 64.44 H new ATOM 0 HA THR A 62 13.012 16.568 -29.111 1.00 2.10 H new ATOM 0 HB THR A 62 12.505 14.139 -29.735 1.00 33.40 H new ATOM 0 HG1 THR A 62 12.296 14.717 -31.997 1.00 61.23 H new ATOM 0 HG21 THR A 62 10.393 13.729 -30.939 1.00 54.44 H new ATOM 0 HG22 THR A 62 10.106 14.153 -29.235 1.00 54.44 H new ATOM 0 HG23 THR A 62 9.836 15.364 -30.510 1.00 54.44 H new ATOM 1017 N VAL A 63 9.775 16.957 -28.724 1.00 61.24 N ATOM 1018 CA VAL A 63 8.668 17.889 -28.905 1.00 25.31 C ATOM 1019 C VAL A 63 8.848 19.130 -28.037 1.00 64.03 C ATOM 1020 O VAL A 63 8.666 20.257 -28.500 1.00 53.43 O ATOM 1021 CB VAL A 63 7.318 17.229 -28.564 1.00 74.52 C ATOM 1022 CG1 VAL A 63 6.188 18.242 -28.669 1.00 21.20 C ATOM 1023 CG2 VAL A 63 7.063 16.038 -29.475 1.00 51.51 C ATOM 0 H VAL A 63 9.559 16.155 -28.132 1.00 61.24 H new ATOM 0 HA VAL A 63 8.667 18.180 -29.955 1.00 25.31 H new ATOM 0 HB VAL A 63 7.358 16.869 -27.536 1.00 74.52 H new ATOM 0 HG11 VAL A 63 5.242 17.759 -28.425 1.00 21.20 H new ATOM 0 HG12 VAL A 63 6.367 19.061 -27.972 1.00 21.20 H new ATOM 0 HG13 VAL A 63 6.144 18.634 -29.685 1.00 21.20 H new ATOM 0 HG21 VAL A 63 6.105 15.584 -29.220 1.00 51.51 H new ATOM 0 HG22 VAL A 63 7.042 16.371 -30.513 1.00 51.51 H new ATOM 0 HG23 VAL A 63 7.859 15.304 -29.346 1.00 51.51 H new ATOM 1033 N LEU A 64 9.206 18.916 -26.776 1.00 40.04 N ATOM 1034 CA LEU A 64 9.412 20.017 -25.841 1.00 62.55 C ATOM 1035 C LEU A 64 10.716 20.750 -26.142 1.00 61.14 C ATOM 1036 O LEU A 64 10.919 21.881 -25.702 1.00 32.40 O ATOM 1037 CB LEU A 64 9.426 19.496 -24.404 1.00 34.54 C ATOM 1038 CG LEU A 64 8.220 18.658 -23.981 1.00 50.33 C ATOM 1039 CD1 LEU A 64 8.551 17.825 -22.753 1.00 13.42 C ATOM 1040 CD2 LEU A 64 7.016 19.550 -23.714 1.00 55.02 C ATOM 0 H LEU A 64 9.360 17.990 -26.377 1.00 40.04 H new ATOM 0 HA LEU A 64 8.587 20.719 -25.957 1.00 62.55 H new ATOM 0 HB2 LEU A 64 10.326 18.897 -24.265 1.00 34.54 H new ATOM 0 HB3 LEU A 64 9.504 20.349 -23.730 1.00 34.54 H new ATOM 0 HG LEU A 64 7.971 17.980 -24.797 1.00 50.33 H new ATOM 0 HD11 LEU A 64 7.680 17.236 -22.468 1.00 13.42 H new ATOM 0 HD12 LEU A 64 9.382 17.157 -22.979 1.00 13.42 H new ATOM 0 HD13 LEU A 64 8.829 18.484 -21.930 1.00 13.42 H new ATOM 0 HD21 LEU A 64 6.167 18.935 -23.414 1.00 55.02 H new ATOM 0 HD22 LEU A 64 7.254 20.254 -22.916 1.00 55.02 H new ATOM 0 HD23 LEU A 64 6.763 20.101 -24.620 1.00 55.02 H new ATOM 1052 N ASP A 65 11.594 20.098 -26.896 1.00 31.24 N ATOM 1053 CA ASP A 65 12.878 20.688 -27.259 1.00 22.33 C ATOM 1054 C ASP A 65 12.680 22.028 -27.962 1.00 40.02 C ATOM 1055 O ASP A 65 13.108 23.078 -27.482 1.00 41.14 O ATOM 1056 CB ASP A 65 13.665 19.736 -28.160 1.00 70.14 C ATOM 1057 CG ASP A 65 14.561 20.471 -29.136 1.00 71.42 C ATOM 1058 OD1 ASP A 65 15.280 21.396 -28.702 1.00 52.01 O ATOM 1059 OD2 ASP A 65 14.544 20.123 -30.335 1.00 54.33 O ATOM 0 H ASP A 65 11.440 19.161 -27.268 1.00 31.24 H new ATOM 0 HA ASP A 65 13.444 20.858 -26.343 1.00 22.33 H new ATOM 0 HB2 ASP A 65 14.272 19.074 -27.542 1.00 70.14 H new ATOM 0 HB3 ASP A 65 12.969 19.106 -28.714 1.00 70.14 H new ATOM 1064 N PRO A 66 12.018 21.993 -29.128 1.00 2.24 N ATOM 1065 CA PRO A 66 11.749 23.194 -29.922 1.00 70.11 C ATOM 1066 C PRO A 66 10.729 24.112 -29.258 1.00 3.02 C ATOM 1067 O PRO A 66 10.537 25.253 -29.681 1.00 12.31 O ATOM 1068 CB PRO A 66 11.191 22.635 -31.234 1.00 64.42 C ATOM 1069 CG PRO A 66 10.614 21.312 -30.866 1.00 42.22 C ATOM 1070 CD PRO A 66 11.479 20.776 -29.760 1.00 21.22 C ATOM 0 HA PRO A 66 12.642 23.806 -30.049 1.00 70.11 H new ATOM 0 HB2 PRO A 66 10.432 23.295 -31.655 1.00 64.42 H new ATOM 0 HB3 PRO A 66 11.974 22.530 -31.985 1.00 64.42 H new ATOM 0 HG2 PRO A 66 9.580 21.415 -30.537 1.00 42.22 H new ATOM 0 HG3 PRO A 66 10.611 20.636 -31.721 1.00 42.22 H new ATOM 0 HD2 PRO A 66 10.903 20.178 -29.054 1.00 21.22 H new ATOM 0 HD3 PRO A 66 12.274 20.137 -30.145 1.00 21.22 H new ATOM 1078 N MET A 67 10.076 23.608 -28.216 1.00 63.35 N ATOM 1079 CA MET A 67 9.075 24.385 -27.492 1.00 54.14 C ATOM 1080 C MET A 67 9.704 25.108 -26.306 1.00 31.31 C ATOM 1081 O MET A 67 9.143 26.075 -25.788 1.00 14.53 O ATOM 1082 CB MET A 67 7.944 23.475 -27.010 1.00 43.12 C ATOM 1083 CG MET A 67 7.056 22.962 -28.132 1.00 2.44 C ATOM 1084 SD MET A 67 5.592 23.983 -28.382 1.00 1.32 S ATOM 1085 CE MET A 67 5.509 24.024 -30.171 1.00 3.12 C ATOM 0 H MET A 67 10.221 22.666 -27.854 1.00 63.35 H new ATOM 0 HA MET A 67 8.665 25.131 -28.173 1.00 54.14 H new ATOM 0 HB2 MET A 67 8.374 22.625 -26.480 1.00 43.12 H new ATOM 0 HB3 MET A 67 7.331 24.020 -26.293 1.00 43.12 H new ATOM 0 HG2 MET A 67 7.631 22.926 -29.057 1.00 2.44 H new ATOM 0 HG3 MET A 67 6.748 21.941 -27.908 1.00 2.44 H new ATOM 0 HE1 MET A 67 4.651 24.621 -30.482 1.00 3.12 H new ATOM 0 HE2 MET A 67 6.422 24.467 -30.568 1.00 3.12 H new ATOM 0 HE3 MET A 67 5.403 23.009 -30.554 1.00 3.12 H new ATOM 1095 N VAL A 68 10.870 24.634 -25.879 1.00 63.20 N ATOM 1096 CA VAL A 68 11.574 25.237 -24.753 1.00 60.55 C ATOM 1097 C VAL A 68 11.496 26.758 -24.808 1.00 21.33 C ATOM 1098 O VAL A 68 11.021 27.414 -23.879 1.00 35.14 O ATOM 1099 CB VAL A 68 13.054 24.812 -24.725 1.00 14.33 C ATOM 1100 CG1 VAL A 68 13.912 25.900 -24.098 1.00 25.53 C ATOM 1101 CG2 VAL A 68 13.215 23.497 -23.975 1.00 52.45 C ATOM 0 H VAL A 68 11.347 23.834 -26.296 1.00 63.20 H new ATOM 0 HA VAL A 68 11.084 24.883 -23.846 1.00 60.55 H new ATOM 0 HB VAL A 68 13.391 24.664 -25.751 1.00 14.33 H new ATOM 0 HG11 VAL A 68 14.954 25.581 -24.087 1.00 25.53 H new ATOM 0 HG12 VAL A 68 13.819 26.817 -24.680 1.00 25.53 H new ATOM 0 HG13 VAL A 68 13.578 26.083 -23.077 1.00 25.53 H new ATOM 0 HG21 VAL A 68 14.267 23.211 -23.964 1.00 52.45 H new ATOM 0 HG22 VAL A 68 12.861 23.616 -22.951 1.00 52.45 H new ATOM 0 HG23 VAL A 68 12.633 22.721 -24.472 1.00 52.45 H new ATOM 1111 N PRO A 69 11.971 27.337 -25.920 1.00 44.24 N ATOM 1112 CA PRO A 69 11.965 28.789 -26.122 1.00 44.43 C ATOM 1113 C PRO A 69 10.557 29.341 -26.320 1.00 21.12 C ATOM 1114 O PRO A 69 10.256 30.464 -25.914 1.00 43.22 O ATOM 1115 CB PRO A 69 12.794 28.973 -27.395 1.00 74.04 C ATOM 1116 CG PRO A 69 12.661 27.681 -28.125 1.00 13.12 C ATOM 1117 CD PRO A 69 12.551 26.618 -27.067 1.00 64.33 C ATOM 0 HA PRO A 69 12.361 29.322 -25.258 1.00 44.43 H new ATOM 0 HB2 PRO A 69 12.422 29.805 -27.993 1.00 74.04 H new ATOM 0 HB3 PRO A 69 13.836 29.190 -27.161 1.00 74.04 H new ATOM 0 HG2 PRO A 69 11.781 27.685 -28.768 1.00 13.12 H new ATOM 0 HG3 PRO A 69 13.524 27.505 -28.767 1.00 13.12 H new ATOM 0 HD2 PRO A 69 11.913 25.795 -27.389 1.00 64.33 H new ATOM 0 HD3 PRO A 69 13.524 26.191 -26.823 1.00 64.33 H new ATOM 1125 N THR A 70 9.696 28.544 -26.946 1.00 3.51 N ATOM 1126 CA THR A 70 8.320 28.952 -27.197 1.00 63.41 C ATOM 1127 C THR A 70 7.342 28.131 -26.365 1.00 70.23 C ATOM 1128 O THR A 70 6.350 27.620 -26.882 1.00 65.12 O ATOM 1129 CB THR A 70 7.956 28.811 -28.687 1.00 64.00 C ATOM 1130 OG1 THR A 70 8.024 27.435 -29.079 1.00 64.21 O ATOM 1131 CG2 THR A 70 8.892 29.638 -29.554 1.00 62.14 C ATOM 0 H THR A 70 9.928 27.612 -27.288 1.00 3.51 H new ATOM 0 HA THR A 70 8.244 30.001 -26.910 1.00 63.41 H new ATOM 0 HB THR A 70 6.939 29.179 -28.827 1.00 64.00 H new ATOM 0 HG1 THR A 70 7.372 26.915 -28.564 1.00 64.21 H new ATOM 0 HG21 THR A 70 8.615 29.522 -30.602 1.00 62.14 H new ATOM 0 HG22 THR A 70 8.816 30.688 -29.273 1.00 62.14 H new ATOM 0 HG23 THR A 70 9.917 29.297 -29.410 1.00 62.14 H new ATOM 1139 N GLY A 71 7.628 28.008 -25.073 1.00 21.34 N ATOM 1140 CA GLY A 71 6.763 27.248 -24.191 1.00 3.44 C ATOM 1141 C GLY A 71 6.663 27.860 -22.807 1.00 51.42 C ATOM 1142 O GLY A 71 7.645 28.386 -22.282 1.00 50.23 O ATOM 0 H GLY A 71 8.444 28.421 -24.621 1.00 21.34 H new ATOM 0 HA2 GLY A 71 5.767 27.185 -24.630 1.00 3.44 H new ATOM 0 HA3 GLY A 71 7.140 26.229 -24.108 1.00 3.44 H new ATOM 1146 N SER A 72 5.475 27.792 -22.216 1.00 0.23 N ATOM 1147 CA SER A 72 5.250 28.348 -20.886 1.00 54.51 C ATOM 1148 C SER A 72 6.296 27.838 -19.899 1.00 72.24 C ATOM 1149 O SER A 72 6.971 26.842 -20.155 1.00 12.14 O ATOM 1150 CB SER A 72 3.848 27.989 -20.391 1.00 64.00 C ATOM 1151 OG SER A 72 3.861 26.777 -19.656 1.00 34.34 O ATOM 0 H SER A 72 4.653 27.358 -22.636 1.00 0.23 H new ATOM 0 HA SER A 72 5.338 29.432 -20.953 1.00 54.51 H new ATOM 0 HB2 SER A 72 3.463 28.794 -19.765 1.00 64.00 H new ATOM 0 HB3 SER A 72 3.172 27.895 -21.241 1.00 64.00 H new ATOM 0 HG SER A 72 2.953 26.571 -19.349 1.00 34.34 H new ATOM 1157 N GLU A 73 6.425 28.532 -18.772 1.00 45.43 N ATOM 1158 CA GLU A 73 7.389 28.150 -17.748 1.00 31.21 C ATOM 1159 C GLU A 73 7.182 26.701 -17.317 1.00 43.41 C ATOM 1160 O GLU A 73 8.141 25.970 -17.079 1.00 15.41 O ATOM 1161 CB GLU A 73 7.271 29.075 -16.534 1.00 64.15 C ATOM 1162 CG GLU A 73 8.373 30.118 -16.455 1.00 22.11 C ATOM 1163 CD GLU A 73 7.890 31.435 -15.878 1.00 51.24 C ATOM 1164 OE1 GLU A 73 6.848 31.435 -15.191 1.00 31.52 O ATOM 1165 OE2 GLU A 73 8.556 32.465 -16.114 1.00 40.15 O ATOM 0 H GLU A 73 5.875 29.360 -18.546 1.00 45.43 H new ATOM 0 HA GLU A 73 8.388 28.245 -18.174 1.00 31.21 H new ATOM 0 HB2 GLU A 73 6.306 29.580 -16.565 1.00 64.15 H new ATOM 0 HB3 GLU A 73 7.287 28.473 -15.626 1.00 64.15 H new ATOM 0 HG2 GLU A 73 9.188 29.734 -15.842 1.00 22.11 H new ATOM 0 HG3 GLU A 73 8.778 30.289 -17.452 1.00 22.11 H new ATOM 1172 N ASN A 74 5.920 26.293 -17.221 1.00 22.35 N ATOM 1173 CA ASN A 74 5.585 24.932 -16.818 1.00 73.11 C ATOM 1174 C ASN A 74 6.126 23.919 -17.823 1.00 31.21 C ATOM 1175 O ASN A 74 6.238 22.730 -17.523 1.00 53.10 O ATOM 1176 CB ASN A 74 4.070 24.776 -16.686 1.00 5.43 C ATOM 1177 CG ASN A 74 3.593 24.944 -15.256 1.00 32.41 C ATOM 1178 OD1 ASN A 74 3.106 23.999 -14.636 1.00 72.20 O ATOM 1179 ND2 ASN A 74 3.733 26.154 -14.725 1.00 2.32 N ATOM 0 H ASN A 74 5.113 26.886 -17.417 1.00 22.35 H new ATOM 0 HA ASN A 74 6.049 24.741 -15.850 1.00 73.11 H new ATOM 0 HB2 ASN A 74 3.575 25.512 -17.320 1.00 5.43 H new ATOM 0 HB3 ASN A 74 3.776 23.792 -17.051 1.00 5.43 H new ATOM 0 HD21 ASN A 74 3.431 26.328 -13.766 1.00 2.32 H new ATOM 0 HD22 ASN A 74 4.142 26.909 -15.276 1.00 2.32 H new ATOM 1186 N LEU A 75 6.461 24.398 -19.016 1.00 62.15 N ATOM 1187 CA LEU A 75 6.991 23.536 -20.066 1.00 35.11 C ATOM 1188 C LEU A 75 8.504 23.388 -19.937 1.00 42.01 C ATOM 1189 O LEU A 75 9.077 22.376 -20.343 1.00 64.34 O ATOM 1190 CB LEU A 75 6.638 24.100 -21.444 1.00 14.21 C ATOM 1191 CG LEU A 75 6.859 23.160 -22.630 1.00 3.25 C ATOM 1192 CD1 LEU A 75 5.675 23.216 -23.582 1.00 53.24 C ATOM 1193 CD2 LEU A 75 8.149 23.514 -23.357 1.00 64.21 C ATOM 0 H LEU A 75 6.375 25.379 -19.280 1.00 62.15 H new ATOM 0 HA LEU A 75 6.537 22.551 -19.956 1.00 35.11 H new ATOM 0 HB2 LEU A 75 5.590 24.400 -21.434 1.00 14.21 H new ATOM 0 HB3 LEU A 75 7.227 25.003 -21.607 1.00 14.21 H new ATOM 0 HG LEU A 75 6.947 22.141 -22.252 1.00 3.25 H new ATOM 0 HD11 LEU A 75 5.850 22.541 -24.420 1.00 53.24 H new ATOM 0 HD12 LEU A 75 4.770 22.914 -23.055 1.00 53.24 H new ATOM 0 HD13 LEU A 75 5.555 24.233 -23.955 1.00 53.24 H new ATOM 0 HD21 LEU A 75 8.291 22.835 -24.198 1.00 64.21 H new ATOM 0 HD22 LEU A 75 8.091 24.539 -23.724 1.00 64.21 H new ATOM 0 HD23 LEU A 75 8.991 23.422 -22.671 1.00 64.21 H new ATOM 1205 N LYS A 76 9.146 24.401 -19.366 1.00 64.40 N ATOM 1206 CA LYS A 76 10.592 24.384 -19.179 1.00 23.23 C ATOM 1207 C LYS A 76 10.986 23.406 -18.076 1.00 73.53 C ATOM 1208 O LYS A 76 11.906 22.606 -18.245 1.00 4.33 O ATOM 1209 CB LYS A 76 11.100 25.787 -18.837 1.00 65.30 C ATOM 1210 CG LYS A 76 11.561 26.579 -20.048 1.00 43.24 C ATOM 1211 CD LYS A 76 11.260 28.060 -19.893 1.00 65.45 C ATOM 1212 CE LYS A 76 11.544 28.824 -21.177 1.00 74.03 C ATOM 1213 NZ LYS A 76 12.485 29.956 -20.951 1.00 73.31 N ATOM 0 H LYS A 76 8.687 25.245 -19.024 1.00 64.40 H new ATOM 0 HA LYS A 76 11.050 24.056 -20.112 1.00 23.23 H new ATOM 0 HB2 LYS A 76 10.306 26.339 -18.333 1.00 65.30 H new ATOM 0 HB3 LYS A 76 11.927 25.703 -18.132 1.00 65.30 H new ATOM 0 HG2 LYS A 76 12.632 26.437 -20.190 1.00 43.24 H new ATOM 0 HG3 LYS A 76 11.068 26.198 -20.942 1.00 43.24 H new ATOM 0 HD2 LYS A 76 10.215 28.193 -19.613 1.00 65.45 H new ATOM 0 HD3 LYS A 76 11.862 28.472 -19.083 1.00 65.45 H new ATOM 0 HE2 LYS A 76 11.964 28.145 -21.919 1.00 74.03 H new ATOM 0 HE3 LYS A 76 10.609 29.205 -21.587 1.00 74.03 H new ATOM 0 HZ1 LYS A 76 12.654 30.452 -21.849 1.00 73.31 H new ATOM 0 HZ2 LYS A 76 12.073 30.618 -20.262 1.00 73.31 H new ATOM 0 HZ3 LYS A 76 13.386 29.590 -20.583 1.00 73.31 H new ATOM 1227 N SER A 77 10.284 23.477 -16.950 1.00 52.52 N ATOM 1228 CA SER A 77 10.562 22.600 -15.820 1.00 13.53 C ATOM 1229 C SER A 77 10.350 21.137 -16.201 1.00 33.21 C ATOM 1230 O SER A 77 11.128 20.264 -15.816 1.00 55.41 O ATOM 1231 CB SER A 77 9.669 22.963 -14.633 1.00 23.34 C ATOM 1232 OG SER A 77 10.444 23.322 -13.502 1.00 34.31 O ATOM 0 H SER A 77 9.518 24.133 -16.796 1.00 52.52 H new ATOM 0 HA SER A 77 11.605 22.736 -15.536 1.00 13.53 H new ATOM 0 HB2 SER A 77 9.014 23.790 -14.906 1.00 23.34 H new ATOM 0 HB3 SER A 77 9.028 22.117 -14.385 1.00 23.34 H new ATOM 0 HG SER A 77 9.849 23.551 -12.757 1.00 34.31 H new ATOM 1238 N LEU A 78 9.292 20.879 -16.961 1.00 51.43 N ATOM 1239 CA LEU A 78 8.976 19.522 -17.396 1.00 71.41 C ATOM 1240 C LEU A 78 10.065 18.978 -18.315 1.00 63.03 C ATOM 1241 O LEU A 78 10.517 17.845 -18.155 1.00 2.43 O ATOM 1242 CB LEU A 78 7.626 19.499 -18.116 1.00 74.13 C ATOM 1243 CG LEU A 78 7.133 18.125 -18.571 1.00 22.00 C ATOM 1244 CD1 LEU A 78 6.725 17.281 -17.373 1.00 0.20 C ATOM 1245 CD2 LEU A 78 5.970 18.271 -19.543 1.00 15.13 C ATOM 0 H LEU A 78 8.639 21.590 -17.289 1.00 51.43 H new ATOM 0 HA LEU A 78 8.921 18.886 -16.513 1.00 71.41 H new ATOM 0 HB2 LEU A 78 6.876 19.931 -17.454 1.00 74.13 H new ATOM 0 HB3 LEU A 78 7.691 20.147 -18.990 1.00 74.13 H new ATOM 0 HG LEU A 78 7.950 17.619 -19.085 1.00 22.00 H new ATOM 0 HD11 LEU A 78 6.377 16.307 -17.716 1.00 0.20 H new ATOM 0 HD12 LEU A 78 7.582 17.148 -16.713 1.00 0.20 H new ATOM 0 HD13 LEU A 78 5.923 17.782 -16.831 1.00 0.20 H new ATOM 0 HD21 LEU A 78 5.632 17.283 -19.857 1.00 15.13 H new ATOM 0 HD22 LEU A 78 5.150 18.797 -19.053 1.00 15.13 H new ATOM 0 HD23 LEU A 78 6.294 18.838 -20.416 1.00 15.13 H new ATOM 1257 N PHE A 79 10.483 19.794 -19.277 1.00 62.10 N ATOM 1258 CA PHE A 79 11.520 19.394 -20.221 1.00 64.15 C ATOM 1259 C PHE A 79 12.773 18.927 -19.487 1.00 34.22 C ATOM 1260 O PHE A 79 13.305 17.853 -19.767 1.00 33.44 O ATOM 1261 CB PHE A 79 11.865 20.557 -21.155 1.00 12.12 C ATOM 1262 CG PHE A 79 12.902 20.211 -22.185 1.00 14.31 C ATOM 1263 CD1 PHE A 79 12.706 19.151 -23.055 1.00 42.54 C ATOM 1264 CD2 PHE A 79 14.073 20.945 -22.283 1.00 30.24 C ATOM 1265 CE1 PHE A 79 13.658 18.830 -24.004 1.00 63.35 C ATOM 1266 CE2 PHE A 79 15.028 20.629 -23.230 1.00 20.32 C ATOM 1267 CZ PHE A 79 14.821 19.570 -24.091 1.00 74.34 C ATOM 0 H PHE A 79 10.120 20.736 -19.423 1.00 62.10 H new ATOM 0 HA PHE A 79 11.137 18.563 -20.813 1.00 64.15 H new ATOM 0 HB2 PHE A 79 10.958 20.888 -21.661 1.00 12.12 H new ATOM 0 HB3 PHE A 79 12.222 21.397 -20.559 1.00 12.12 H new ATOM 0 HD1 PHE A 79 11.799 18.569 -22.991 1.00 42.54 H new ATOM 0 HD2 PHE A 79 14.241 21.774 -21.611 1.00 30.24 H new ATOM 0 HE1 PHE A 79 13.493 18.001 -24.677 1.00 63.35 H new ATOM 0 HE2 PHE A 79 15.936 21.210 -23.297 1.00 20.32 H new ATOM 0 HZ PHE A 79 15.567 19.321 -24.831 1.00 74.34 H new ATOM 1277 N ASN A 80 13.239 19.742 -18.546 1.00 52.13 N ATOM 1278 CA ASN A 80 14.430 19.414 -17.772 1.00 30.24 C ATOM 1279 C ASN A 80 14.220 18.134 -16.968 1.00 34.54 C ATOM 1280 O ASN A 80 15.126 17.309 -16.846 1.00 1.41 O ATOM 1281 CB ASN A 80 14.787 20.568 -16.833 1.00 24.23 C ATOM 1282 CG ASN A 80 15.790 21.526 -17.447 1.00 1.50 C ATOM 1283 OD1 ASN A 80 16.145 21.401 -18.619 1.00 65.21 O ATOM 1284 ND2 ASN A 80 16.252 22.486 -16.656 1.00 52.13 N ATOM 0 H ASN A 80 12.810 20.634 -18.301 1.00 52.13 H new ATOM 0 HA ASN A 80 15.253 19.254 -18.468 1.00 30.24 H new ATOM 0 HB2 ASN A 80 13.880 21.114 -16.572 1.00 24.23 H new ATOM 0 HB3 ASN A 80 15.194 20.165 -15.906 1.00 24.23 H new ATOM 0 HD21 ASN A 80 16.930 23.159 -17.013 1.00 52.13 H new ATOM 0 HD22 ASN A 80 15.929 22.551 -15.691 1.00 52.13 H new ATOM 1291 N THR A 81 13.020 17.977 -16.419 1.00 3.45 N ATOM 1292 CA THR A 81 12.691 16.799 -15.626 1.00 65.50 C ATOM 1293 C THR A 81 12.698 15.540 -16.484 1.00 5.51 C ATOM 1294 O THR A 81 13.218 14.501 -16.076 1.00 54.50 O ATOM 1295 CB THR A 81 11.312 16.942 -14.954 1.00 51.31 C ATOM 1296 OG1 THR A 81 11.234 18.190 -14.256 1.00 41.12 O ATOM 1297 CG2 THR A 81 11.061 15.797 -13.984 1.00 52.53 C ATOM 0 H THR A 81 12.260 18.651 -16.509 1.00 3.45 H new ATOM 0 HA THR A 81 13.456 16.713 -14.854 1.00 65.50 H new ATOM 0 HB THR A 81 10.549 16.913 -15.732 1.00 51.31 H new ATOM 0 HG1 THR A 81 11.279 18.928 -14.899 1.00 41.12 H new ATOM 0 HG21 THR A 81 10.081 15.920 -13.522 1.00 52.53 H new ATOM 0 HG22 THR A 81 11.092 14.850 -14.523 1.00 52.53 H new ATOM 0 HG23 THR A 81 11.830 15.800 -13.211 1.00 52.53 H new ATOM 1305 N VAL A 82 12.116 15.637 -17.675 1.00 72.14 N ATOM 1306 CA VAL A 82 12.057 14.504 -18.592 1.00 22.35 C ATOM 1307 C VAL A 82 13.451 13.958 -18.881 1.00 45.01 C ATOM 1308 O VAL A 82 13.642 12.746 -18.996 1.00 23.24 O ATOM 1309 CB VAL A 82 11.385 14.894 -19.922 1.00 45.51 C ATOM 1310 CG1 VAL A 82 11.364 13.710 -20.876 1.00 60.45 C ATOM 1311 CG2 VAL A 82 9.976 15.413 -19.674 1.00 74.41 C ATOM 0 H VAL A 82 11.679 16.488 -18.028 1.00 72.14 H new ATOM 0 HA VAL A 82 11.461 13.732 -18.104 1.00 22.35 H new ATOM 0 HB VAL A 82 11.967 15.692 -20.383 1.00 45.51 H new ATOM 0 HG11 VAL A 82 10.886 14.004 -21.810 1.00 60.45 H new ATOM 0 HG12 VAL A 82 12.385 13.387 -21.077 1.00 60.45 H new ATOM 0 HG13 VAL A 82 10.806 12.889 -20.425 1.00 60.45 H new ATOM 0 HG21 VAL A 82 9.516 15.684 -20.624 1.00 74.41 H new ATOM 0 HG22 VAL A 82 9.382 14.637 -19.191 1.00 74.41 H new ATOM 0 HG23 VAL A 82 10.020 16.290 -19.029 1.00 74.41 H new ATOM 1321 N CYS A 83 14.420 14.858 -18.996 1.00 54.31 N ATOM 1322 CA CYS A 83 15.798 14.465 -19.272 1.00 63.30 C ATOM 1323 C CYS A 83 16.337 13.560 -18.170 1.00 11.23 C ATOM 1324 O CYS A 83 17.100 12.631 -18.432 1.00 42.50 O ATOM 1325 CB CYS A 83 16.685 15.704 -19.410 1.00 24.22 C ATOM 1326 SG CYS A 83 16.404 16.647 -20.926 1.00 62.14 S ATOM 0 H CYS A 83 14.278 15.864 -18.903 1.00 54.31 H new ATOM 0 HA CYS A 83 15.811 13.911 -20.210 1.00 63.30 H new ATOM 0 HB2 CYS A 83 16.516 16.356 -18.553 1.00 24.22 H new ATOM 0 HB3 CYS A 83 17.730 15.395 -19.375 1.00 24.22 H new ATOM 0 HG CYS A 83 15.264 17.266 -20.847 1.00 62.14 H new ATOM 1332 N VAL A 84 15.935 13.838 -16.933 1.00 51.04 N ATOM 1333 CA VAL A 84 16.378 13.049 -15.790 1.00 70.00 C ATOM 1334 C VAL A 84 15.850 11.621 -15.870 1.00 64.22 C ATOM 1335 O VAL A 84 16.594 10.662 -15.665 1.00 44.33 O ATOM 1336 CB VAL A 84 15.920 13.680 -14.461 1.00 61.41 C ATOM 1337 CG1 VAL A 84 16.357 12.822 -13.284 1.00 21.04 C ATOM 1338 CG2 VAL A 84 16.462 15.096 -14.330 1.00 1.15 C ATOM 0 H VAL A 84 15.303 14.604 -16.698 1.00 51.04 H new ATOM 0 HA VAL A 84 17.467 13.033 -15.820 1.00 70.00 H new ATOM 0 HB VAL A 84 14.831 13.730 -14.458 1.00 61.41 H new ATOM 0 HG11 VAL A 84 16.025 13.283 -12.354 1.00 21.04 H new ATOM 0 HG12 VAL A 84 15.916 11.829 -13.374 1.00 21.04 H new ATOM 0 HG13 VAL A 84 17.444 12.738 -13.279 1.00 21.04 H new ATOM 0 HG21 VAL A 84 16.129 15.527 -13.386 1.00 1.15 H new ATOM 0 HG22 VAL A 84 17.551 15.072 -14.354 1.00 1.15 H new ATOM 0 HG23 VAL A 84 16.094 15.704 -15.156 1.00 1.15 H new ATOM 1348 N ILE A 85 14.562 11.489 -16.168 1.00 12.20 N ATOM 1349 CA ILE A 85 13.934 10.178 -16.278 1.00 12.44 C ATOM 1350 C ILE A 85 14.613 9.330 -17.348 1.00 12.01 C ATOM 1351 O ILE A 85 14.985 8.182 -17.103 1.00 35.45 O ATOM 1352 CB ILE A 85 12.435 10.297 -16.607 1.00 54.32 C ATOM 1353 CG1 ILE A 85 11.727 11.156 -15.558 1.00 42.11 C ATOM 1354 CG2 ILE A 85 11.799 8.916 -16.687 1.00 34.33 C ATOM 1355 CD1 ILE A 85 11.613 10.487 -14.205 1.00 73.44 C ATOM 0 H ILE A 85 13.933 12.274 -16.338 1.00 12.20 H new ATOM 0 HA ILE A 85 14.047 9.693 -15.309 1.00 12.44 H new ATOM 0 HB ILE A 85 12.328 10.781 -17.578 1.00 54.32 H new ATOM 0 HG12 ILE A 85 12.267 12.096 -15.445 1.00 42.11 H new ATOM 0 HG13 ILE A 85 10.728 11.404 -15.917 1.00 42.11 H new ATOM 0 HG21 ILE A 85 10.739 9.017 -16.920 1.00 34.33 H new ATOM 0 HG22 ILE A 85 12.289 8.335 -17.468 1.00 34.33 H new ATOM 0 HG23 ILE A 85 11.913 8.407 -15.730 1.00 34.33 H new ATOM 0 HD11 ILE A 85 11.101 11.154 -13.511 1.00 73.44 H new ATOM 0 HD12 ILE A 85 11.047 9.561 -14.304 1.00 73.44 H new ATOM 0 HD13 ILE A 85 12.610 10.264 -13.824 1.00 73.44 H new ATOM 1367 N TRP A 86 14.773 9.904 -18.535 1.00 13.13 N ATOM 1368 CA TRP A 86 15.410 9.202 -19.644 1.00 4.24 C ATOM 1369 C TRP A 86 16.792 8.697 -19.247 1.00 0.13 C ATOM 1370 O TRP A 86 17.167 7.569 -19.568 1.00 63.20 O ATOM 1371 CB TRP A 86 15.519 10.121 -20.861 1.00 75.31 C ATOM 1372 CG TRP A 86 16.162 9.466 -22.045 1.00 34.01 C ATOM 1373 CD1 TRP A 86 15.527 8.897 -23.112 1.00 52.24 C ATOM 1374 CD2 TRP A 86 17.565 9.310 -22.282 1.00 53.10 C ATOM 1375 NE1 TRP A 86 16.451 8.396 -23.997 1.00 11.14 N ATOM 1376 CE2 TRP A 86 17.708 8.637 -23.511 1.00 14.12 C ATOM 1377 CE3 TRP A 86 18.715 9.674 -21.576 1.00 4.12 C ATOM 1378 CZ2 TRP A 86 18.955 8.322 -24.047 1.00 21.44 C ATOM 1379 CZ3 TRP A 86 19.951 9.360 -22.108 1.00 34.41 C ATOM 1380 CH2 TRP A 86 20.064 8.692 -23.333 1.00 45.43 C ATOM 0 H TRP A 86 14.471 10.853 -18.754 1.00 13.13 H new ATOM 0 HA TRP A 86 14.790 8.343 -19.901 1.00 4.24 H new ATOM 0 HB2 TRP A 86 14.522 10.462 -21.140 1.00 75.31 H new ATOM 0 HB3 TRP A 86 16.093 11.006 -20.588 1.00 75.31 H new ATOM 0 HD1 TRP A 86 14.456 8.848 -23.241 1.00 52.24 H new ATOM 0 HE1 TRP A 86 16.235 7.922 -24.874 1.00 11.14 H new ATOM 0 HE3 TRP A 86 18.639 10.192 -20.631 1.00 4.12 H new ATOM 0 HZ2 TRP A 86 19.044 7.805 -24.991 1.00 21.44 H new ATOM 0 HZ3 TRP A 86 20.846 9.635 -21.569 1.00 34.41 H new ATOM 0 HH2 TRP A 86 21.045 8.464 -23.723 1.00 45.43 H new ATOM 1391 N CYS A 87 17.546 9.538 -18.546 1.00 70.01 N ATOM 1392 CA CYS A 87 18.889 9.176 -18.106 1.00 5.54 C ATOM 1393 C CYS A 87 18.849 7.962 -17.183 1.00 30.52 C ATOM 1394 O CYS A 87 19.547 6.974 -17.410 1.00 62.33 O ATOM 1395 CB CYS A 87 19.548 10.355 -17.390 1.00 21.50 C ATOM 1396 SG CYS A 87 20.571 11.391 -18.462 1.00 53.42 S ATOM 0 H CYS A 87 17.250 10.474 -18.271 1.00 70.01 H new ATOM 0 HA CYS A 87 19.478 8.921 -18.987 1.00 5.54 H new ATOM 0 HB2 CYS A 87 18.771 10.973 -16.939 1.00 21.50 H new ATOM 0 HB3 CYS A 87 20.164 9.973 -16.576 1.00 21.50 H new ATOM 0 HG CYS A 87 20.395 12.642 -18.154 1.00 53.42 H new ATOM 1402 N ILE A 88 18.029 8.045 -16.140 1.00 64.11 N ATOM 1403 CA ILE A 88 17.900 6.954 -15.182 1.00 65.15 C ATOM 1404 C ILE A 88 17.652 5.626 -15.892 1.00 21.54 C ATOM 1405 O ILE A 88 18.209 4.595 -15.514 1.00 61.32 O ATOM 1406 CB ILE A 88 16.753 7.213 -14.186 1.00 43.34 C ATOM 1407 CG1 ILE A 88 17.002 8.510 -13.415 1.00 23.14 C ATOM 1408 CG2 ILE A 88 16.609 6.039 -13.229 1.00 31.32 C ATOM 1409 CD1 ILE A 88 15.741 9.131 -12.857 1.00 22.03 C ATOM 0 H ILE A 88 17.445 8.856 -15.937 1.00 64.11 H new ATOM 0 HA ILE A 88 18.841 6.901 -14.634 1.00 65.15 H new ATOM 0 HB ILE A 88 15.822 7.318 -14.744 1.00 43.34 H new ATOM 0 HG12 ILE A 88 17.692 8.310 -12.596 1.00 23.14 H new ATOM 0 HG13 ILE A 88 17.490 9.228 -14.075 1.00 23.14 H new ATOM 0 HG21 ILE A 88 15.795 6.236 -12.531 1.00 31.32 H new ATOM 0 HG22 ILE A 88 16.391 5.133 -13.795 1.00 31.32 H new ATOM 0 HG23 ILE A 88 17.538 5.906 -12.674 1.00 31.32 H new ATOM 0 HD11 ILE A 88 15.992 10.047 -12.323 1.00 22.03 H new ATOM 0 HD12 ILE A 88 15.058 9.363 -13.674 1.00 22.03 H new ATOM 0 HD13 ILE A 88 15.263 8.431 -12.172 1.00 22.03 H new ATOM 1421 N HIS A 89 16.815 5.660 -16.923 1.00 44.34 N ATOM 1422 CA HIS A 89 16.495 4.459 -17.688 1.00 64.42 C ATOM 1423 C HIS A 89 17.635 4.101 -18.638 1.00 34.33 C ATOM 1424 O HIS A 89 17.969 2.919 -18.699 1.00 41.34 O ATOM 1425 CB HIS A 89 15.202 4.663 -18.480 1.00 14.22 C ATOM 1426 CG HIS A 89 13.986 4.799 -17.616 1.00 1.23 C ATOM 1427 ND1 HIS A 89 13.816 4.099 -16.440 1.00 51.30 N ATOM 1428 CD2 HIS A 89 12.877 5.561 -17.762 1.00 4.34 C ATOM 1429 CE1 HIS A 89 12.655 4.423 -15.901 1.00 22.30 C ATOM 1430 NE2 HIS A 89 12.066 5.310 -16.684 1.00 43.30 N ATOM 0 H HIS A 89 16.346 6.505 -17.249 1.00 44.34 H new ATOM 0 HA HIS A 89 16.357 3.636 -16.986 1.00 64.42 H new ATOM 0 HB2 HIS A 89 15.301 5.556 -19.097 1.00 14.22 H new ATOM 0 HB3 HIS A 89 15.064 3.821 -19.158 1.00 14.22 H new ATOM 0 HD2 HIS A 89 12.669 6.240 -18.576 1.00 4.34 H new ATOM 0 HE1 HIS A 89 12.255 4.030 -14.978 1.00 22.30 H new ATOM 0 HE2 HIS A 89 11.156 5.739 -16.514 1.00 43.30 H new ATOM 1438 N ALA A 90 18.219 5.057 -19.353 1.00 53.20 N ATOM 1439 CA ALA A 90 19.313 4.764 -20.270 1.00 52.20 C ATOM 1440 C ALA A 90 20.557 4.309 -19.515 1.00 21.34 C ATOM 1441 O ALA A 90 21.541 3.886 -20.119 1.00 15.12 O ATOM 1442 CB ALA A 90 19.627 5.983 -21.124 1.00 33.42 C ATOM 0 H ALA A 90 17.953 6.041 -19.315 1.00 53.20 H new ATOM 0 HA ALA A 90 18.999 3.949 -20.922 1.00 52.20 H new ATOM 0 HB1 ALA A 90 20.446 5.750 -21.804 1.00 33.42 H new ATOM 0 HB2 ALA A 90 18.745 6.260 -21.700 1.00 33.42 H new ATOM 0 HB3 ALA A 90 19.916 6.814 -20.480 1.00 33.42 H new ATOM 1448 N GLU A 91 20.506 4.402 -18.189 1.00 43.31 N ATOM 1449 CA GLU A 91 21.630 4.001 -17.351 1.00 72.42 C ATOM 1450 C GLU A 91 22.758 5.027 -17.429 1.00 50.53 C ATOM 1451 O GLU A 91 23.927 4.667 -17.566 1.00 21.43 O ATOM 1452 CB GLU A 91 22.147 2.625 -17.776 1.00 64.45 C ATOM 1453 CG GLU A 91 22.858 1.873 -16.664 1.00 3.23 C ATOM 1454 CD GLU A 91 24.087 1.133 -17.154 1.00 13.13 C ATOM 1455 OE1 GLU A 91 24.001 0.470 -18.208 1.00 64.24 O ATOM 1456 OE2 GLU A 91 25.137 1.218 -16.482 1.00 40.12 O ATOM 0 H GLU A 91 19.699 4.751 -17.673 1.00 43.31 H new ATOM 0 HA GLU A 91 21.281 3.947 -16.320 1.00 72.42 H new ATOM 0 HB2 GLU A 91 21.309 2.025 -18.131 1.00 64.45 H new ATOM 0 HB3 GLU A 91 22.831 2.746 -18.616 1.00 64.45 H new ATOM 0 HG2 GLU A 91 23.149 2.576 -15.883 1.00 3.23 H new ATOM 0 HG3 GLU A 91 22.167 1.162 -16.211 1.00 3.23 H new ATOM 1463 N GLU A 92 22.398 6.303 -17.343 1.00 2.12 N ATOM 1464 CA GLU A 92 23.379 7.380 -17.405 1.00 54.25 C ATOM 1465 C GLU A 92 23.547 8.043 -16.041 1.00 44.44 C ATOM 1466 O GLU A 92 22.586 8.549 -15.462 1.00 71.03 O ATOM 1467 CB GLU A 92 22.960 8.422 -18.443 1.00 71.53 C ATOM 1468 CG GLU A 92 23.204 7.985 -19.878 1.00 4.21 C ATOM 1469 CD GLU A 92 24.660 8.099 -20.283 1.00 73.42 C ATOM 1470 OE1 GLU A 92 25.536 7.846 -19.430 1.00 45.11 O ATOM 1471 OE2 GLU A 92 24.924 8.443 -21.455 1.00 31.21 O ATOM 0 H GLU A 92 21.434 6.617 -17.230 1.00 2.12 H new ATOM 0 HA GLU A 92 24.336 6.949 -17.700 1.00 54.25 H new ATOM 0 HB2 GLU A 92 21.901 8.644 -18.315 1.00 71.53 H new ATOM 0 HB3 GLU A 92 23.505 9.348 -18.256 1.00 71.53 H new ATOM 0 HG2 GLU A 92 22.877 6.952 -20.000 1.00 4.21 H new ATOM 0 HG3 GLU A 92 22.596 8.593 -20.547 1.00 4.21 H new ATOM 1478 N LYS A 93 24.774 8.035 -15.533 1.00 22.44 N ATOM 1479 CA LYS A 93 25.071 8.635 -14.238 1.00 24.25 C ATOM 1480 C LYS A 93 24.971 10.156 -14.307 1.00 10.10 C ATOM 1481 O LYS A 93 25.614 10.793 -15.143 1.00 4.51 O ATOM 1482 CB LYS A 93 26.470 8.226 -13.771 1.00 3.04 C ATOM 1483 CG LYS A 93 26.614 6.735 -13.515 1.00 63.42 C ATOM 1484 CD LYS A 93 28.061 6.289 -13.625 1.00 10.40 C ATOM 1485 CE LYS A 93 28.318 5.029 -12.812 1.00 55.30 C ATOM 1486 NZ LYS A 93 27.629 3.844 -13.392 1.00 21.10 N ATOM 0 H LYS A 93 25.580 7.619 -15.999 1.00 22.44 H new ATOM 0 HA LYS A 93 24.335 8.272 -13.521 1.00 24.25 H new ATOM 0 HB2 LYS A 93 27.198 8.529 -14.523 1.00 3.04 H new ATOM 0 HB3 LYS A 93 26.712 8.768 -12.857 1.00 3.04 H new ATOM 0 HG2 LYS A 93 26.233 6.497 -12.522 1.00 63.42 H new ATOM 0 HG3 LYS A 93 26.006 6.181 -14.231 1.00 63.42 H new ATOM 0 HD2 LYS A 93 28.308 6.106 -14.671 1.00 10.40 H new ATOM 0 HD3 LYS A 93 28.717 7.088 -13.278 1.00 10.40 H new ATOM 0 HE2 LYS A 93 29.390 4.839 -12.766 1.00 55.30 H new ATOM 0 HE3 LYS A 93 27.977 5.182 -11.788 1.00 55.30 H new ATOM 0 HZ1 LYS A 93 27.829 3.006 -12.809 1.00 21.10 H new ATOM 0 HZ2 LYS A 93 26.603 4.014 -13.413 1.00 21.10 H new ATOM 0 HZ3 LYS A 93 27.972 3.682 -14.360 1.00 21.10 H new ATOM 1500 N VAL A 94 24.162 10.732 -13.424 1.00 74.30 N ATOM 1501 CA VAL A 94 23.982 12.179 -13.384 1.00 25.24 C ATOM 1502 C VAL A 94 23.982 12.693 -11.948 1.00 74.33 C ATOM 1503 O VAL A 94 23.432 12.058 -11.049 1.00 0.14 O ATOM 1504 CB VAL A 94 22.666 12.598 -14.066 1.00 70.35 C ATOM 1505 CG1 VAL A 94 22.686 12.221 -15.540 1.00 4.02 C ATOM 1506 CG2 VAL A 94 21.475 11.968 -13.361 1.00 65.42 C ATOM 0 H VAL A 94 23.621 10.220 -12.727 1.00 74.30 H new ATOM 0 HA VAL A 94 24.820 12.618 -13.925 1.00 25.24 H new ATOM 0 HB VAL A 94 22.568 13.681 -13.994 1.00 70.35 H new ATOM 0 HG11 VAL A 94 21.748 12.524 -16.006 1.00 4.02 H new ATOM 0 HG12 VAL A 94 23.517 12.726 -16.033 1.00 4.02 H new ATOM 0 HG13 VAL A 94 22.807 11.142 -15.638 1.00 4.02 H new ATOM 0 HG21 VAL A 94 20.554 12.275 -13.857 1.00 65.42 H new ATOM 0 HG22 VAL A 94 21.562 10.882 -13.399 1.00 65.42 H new ATOM 0 HG23 VAL A 94 21.453 12.294 -12.321 1.00 65.42 H new ATOM 1516 N LYS A 95 24.604 13.848 -11.740 1.00 62.44 N ATOM 1517 CA LYS A 95 24.676 14.451 -10.415 1.00 10.04 C ATOM 1518 C LYS A 95 23.516 15.416 -10.192 1.00 3.11 C ATOM 1519 O LYS A 95 22.938 15.466 -9.106 1.00 32.52 O ATOM 1520 CB LYS A 95 26.006 15.188 -10.238 1.00 43.32 C ATOM 1521 CG LYS A 95 26.852 14.651 -9.096 1.00 4.40 C ATOM 1522 CD LYS A 95 27.290 13.218 -9.352 1.00 10.14 C ATOM 1523 CE LYS A 95 28.151 12.688 -8.217 1.00 31.04 C ATOM 1524 NZ LYS A 95 27.393 12.603 -6.938 1.00 32.44 N ATOM 0 H LYS A 95 25.066 14.386 -12.473 1.00 62.44 H new ATOM 0 HA LYS A 95 24.609 13.652 -9.677 1.00 10.04 H new ATOM 0 HB2 LYS A 95 26.576 15.119 -11.165 1.00 43.32 H new ATOM 0 HB3 LYS A 95 25.806 16.245 -10.065 1.00 43.32 H new ATOM 0 HG2 LYS A 95 27.730 15.283 -8.964 1.00 4.40 H new ATOM 0 HG3 LYS A 95 26.283 14.698 -8.167 1.00 4.40 H new ATOM 0 HD2 LYS A 95 26.412 12.584 -9.471 1.00 10.14 H new ATOM 0 HD3 LYS A 95 27.848 13.168 -10.287 1.00 10.14 H new ATOM 0 HE2 LYS A 95 28.531 11.701 -8.480 1.00 31.04 H new ATOM 0 HE3 LYS A 95 29.016 13.338 -8.084 1.00 31.04 H new ATOM 0 HZ1 LYS A 95 27.949 12.069 -6.240 1.00 32.44 H new ATOM 0 HZ2 LYS A 95 27.213 13.562 -6.577 1.00 32.44 H new ATOM 0 HZ3 LYS A 95 26.487 12.119 -7.103 1.00 32.44 H new ATOM 1538 N ASP A 96 23.179 16.179 -11.226 1.00 42.23 N ATOM 1539 CA ASP A 96 22.086 17.140 -11.144 1.00 42.13 C ATOM 1540 C ASP A 96 21.372 17.267 -12.486 1.00 5.43 C ATOM 1541 O ASP A 96 21.785 16.670 -13.480 1.00 63.44 O ATOM 1542 CB ASP A 96 22.612 18.506 -10.701 1.00 2.34 C ATOM 1543 CG ASP A 96 23.675 19.048 -11.635 1.00 63.22 C ATOM 1544 OD1 ASP A 96 23.425 19.089 -12.859 1.00 31.31 O ATOM 1545 OD2 ASP A 96 24.756 19.433 -11.144 1.00 62.43 O ATOM 0 H ASP A 96 23.648 16.150 -12.131 1.00 42.23 H new ATOM 0 HA ASP A 96 21.371 16.778 -10.405 1.00 42.13 H new ATOM 0 HB2 ASP A 96 21.783 19.212 -10.650 1.00 2.34 H new ATOM 0 HB3 ASP A 96 23.024 18.425 -9.695 1.00 2.34 H new ATOM 1550 N THR A 97 20.296 18.049 -12.507 1.00 11.40 N ATOM 1551 CA THR A 97 19.523 18.252 -13.726 1.00 34.13 C ATOM 1552 C THR A 97 20.417 18.703 -14.875 1.00 51.52 C ATOM 1553 O THR A 97 20.407 18.106 -15.952 1.00 3.24 O ATOM 1554 CB THR A 97 18.410 19.297 -13.516 1.00 72.15 C ATOM 1555 OG1 THR A 97 17.814 19.126 -12.226 1.00 35.44 O ATOM 1556 CG2 THR A 97 17.343 19.173 -14.594 1.00 32.24 C ATOM 0 H THR A 97 19.941 18.552 -11.694 1.00 11.40 H new ATOM 0 HA THR A 97 19.070 17.293 -13.977 1.00 34.13 H new ATOM 0 HB THR A 97 18.856 20.289 -13.580 1.00 72.15 H new ATOM 0 HG1 THR A 97 18.011 19.908 -11.669 1.00 35.44 H new ATOM 0 HG21 THR A 97 16.567 19.920 -14.426 1.00 32.24 H new ATOM 0 HG22 THR A 97 17.795 19.333 -15.573 1.00 32.24 H new ATOM 0 HG23 THR A 97 16.902 18.177 -14.556 1.00 32.24 H new ATOM 1564 N GLU A 98 21.191 19.758 -14.639 1.00 4.43 N ATOM 1565 CA GLU A 98 22.091 20.286 -15.657 1.00 75.42 C ATOM 1566 C GLU A 98 22.922 19.170 -16.283 1.00 4.01 C ATOM 1567 O GLU A 98 23.152 19.156 -17.491 1.00 50.33 O ATOM 1568 CB GLU A 98 23.015 21.346 -15.051 1.00 53.22 C ATOM 1569 CG GLU A 98 22.273 22.515 -14.426 1.00 72.15 C ATOM 1570 CD GLU A 98 21.740 23.488 -15.460 1.00 41.34 C ATOM 1571 OE1 GLU A 98 21.819 23.174 -16.666 1.00 72.22 O ATOM 1572 OE2 GLU A 98 21.243 24.562 -15.062 1.00 73.40 O ATOM 0 H GLU A 98 21.213 20.263 -13.753 1.00 4.43 H new ATOM 0 HA GLU A 98 21.485 20.745 -16.438 1.00 75.42 H new ATOM 0 HB2 GLU A 98 23.643 20.878 -14.293 1.00 53.22 H new ATOM 0 HB3 GLU A 98 23.681 21.723 -15.828 1.00 53.22 H new ATOM 0 HG2 GLU A 98 21.444 22.136 -13.828 1.00 72.15 H new ATOM 0 HG3 GLU A 98 22.942 23.043 -13.746 1.00 72.15 H new ATOM 1579 N GLY A 99 23.368 18.234 -15.450 1.00 34.32 N ATOM 1580 CA GLY A 99 24.168 17.127 -15.939 1.00 5.02 C ATOM 1581 C GLY A 99 23.353 16.132 -16.743 1.00 31.43 C ATOM 1582 O GLY A 99 23.848 15.548 -17.705 1.00 13.34 O ATOM 0 H GLY A 99 23.189 18.223 -14.446 1.00 34.32 H new ATOM 0 HA2 GLY A 99 24.977 17.514 -16.558 1.00 5.02 H new ATOM 0 HA3 GLY A 99 24.630 16.615 -15.094 1.00 5.02 H new ATOM 1586 N ALA A 100 22.099 15.941 -16.346 1.00 13.13 N ATOM 1587 CA ALA A 100 21.213 15.011 -17.037 1.00 14.25 C ATOM 1588 C ALA A 100 20.962 15.457 -18.472 1.00 63.05 C ATOM 1589 O ALA A 100 21.057 14.660 -19.407 1.00 23.51 O ATOM 1590 CB ALA A 100 19.897 14.879 -16.284 1.00 42.41 C ATOM 0 H ALA A 100 21.674 16.417 -15.550 1.00 13.13 H new ATOM 0 HA ALA A 100 21.700 14.037 -17.068 1.00 14.25 H new ATOM 0 HB1 ALA A 100 19.245 14.182 -16.810 1.00 42.41 H new ATOM 0 HB2 ALA A 100 20.089 14.507 -15.278 1.00 42.41 H new ATOM 0 HB3 ALA A 100 19.413 15.854 -16.224 1.00 42.41 H new ATOM 1596 N LYS A 101 20.640 16.735 -18.642 1.00 64.32 N ATOM 1597 CA LYS A 101 20.374 17.288 -19.965 1.00 61.44 C ATOM 1598 C LYS A 101 21.601 17.166 -20.862 1.00 52.44 C ATOM 1599 O LYS A 101 21.501 16.729 -22.009 1.00 53.30 O ATOM 1600 CB LYS A 101 19.956 18.756 -19.852 1.00 75.02 C ATOM 1601 CG LYS A 101 18.915 19.173 -20.877 1.00 53.40 C ATOM 1602 CD LYS A 101 19.471 20.201 -21.849 1.00 43.15 C ATOM 1603 CE LYS A 101 18.367 21.074 -22.427 1.00 15.35 C ATOM 1604 NZ LYS A 101 18.912 22.298 -23.076 1.00 70.12 N ATOM 0 H LYS A 101 20.557 17.408 -17.880 1.00 64.32 H new ATOM 0 HA LYS A 101 19.560 16.718 -20.413 1.00 61.44 H new ATOM 0 HB2 LYS A 101 19.562 18.937 -18.852 1.00 75.02 H new ATOM 0 HB3 LYS A 101 20.838 19.386 -19.966 1.00 75.02 H new ATOM 0 HG2 LYS A 101 18.574 18.297 -21.428 1.00 53.40 H new ATOM 0 HG3 LYS A 101 18.045 19.587 -20.366 1.00 53.40 H new ATOM 0 HD2 LYS A 101 20.203 20.828 -21.339 1.00 43.15 H new ATOM 0 HD3 LYS A 101 19.996 19.692 -22.658 1.00 43.15 H new ATOM 0 HE2 LYS A 101 17.794 20.501 -23.156 1.00 15.35 H new ATOM 0 HE3 LYS A 101 17.677 21.360 -21.633 1.00 15.35 H new ATOM 0 HZ1 LYS A 101 18.129 22.867 -23.457 1.00 70.12 H new ATOM 0 HZ2 LYS A 101 19.437 22.858 -22.375 1.00 70.12 H new ATOM 0 HZ3 LYS A 101 19.551 22.025 -23.850 1.00 70.12 H new ATOM 1618 N GLN A 102 22.757 17.552 -20.333 1.00 54.21 N ATOM 1619 CA GLN A 102 24.004 17.483 -21.087 1.00 2.02 C ATOM 1620 C GLN A 102 24.176 16.112 -21.731 1.00 44.14 C ATOM 1621 O GLN A 102 24.491 16.008 -22.917 1.00 53.20 O ATOM 1622 CB GLN A 102 25.194 17.784 -20.174 1.00 63.13 C ATOM 1623 CG GLN A 102 26.500 17.984 -20.924 1.00 73.44 C ATOM 1624 CD GLN A 102 27.457 16.821 -20.753 1.00 3.03 C ATOM 1625 OE1 GLN A 102 27.059 15.658 -20.836 1.00 21.22 O ATOM 1626 NE2 GLN A 102 28.726 17.128 -20.512 1.00 44.32 N ATOM 0 H GLN A 102 22.857 17.916 -19.385 1.00 54.21 H new ATOM 0 HA GLN A 102 23.963 18.232 -21.877 1.00 2.02 H new ATOM 0 HB2 GLN A 102 24.978 18.680 -19.592 1.00 63.13 H new ATOM 0 HB3 GLN A 102 25.314 16.965 -19.465 1.00 63.13 H new ATOM 0 HG2 GLN A 102 26.288 18.122 -21.984 1.00 73.44 H new ATOM 0 HG3 GLN A 102 26.979 18.898 -20.573 1.00 73.44 H new ATOM 0 HE21 GLN A 102 29.012 18.105 -20.451 1.00 44.32 H new ATOM 0 HE22 GLN A 102 29.415 16.387 -20.387 1.00 44.32 H new ATOM 1635 N ILE A 103 23.966 15.063 -20.942 1.00 74.14 N ATOM 1636 CA ILE A 103 24.098 13.697 -21.437 1.00 33.44 C ATOM 1637 C ILE A 103 23.105 13.422 -22.561 1.00 30.24 C ATOM 1638 O ILE A 103 23.438 12.772 -23.552 1.00 62.34 O ATOM 1639 CB ILE A 103 23.881 12.669 -20.312 1.00 51.22 C ATOM 1640 CG1 ILE A 103 24.947 12.835 -19.226 1.00 60.22 C ATOM 1641 CG2 ILE A 103 23.907 11.255 -20.875 1.00 64.00 C ATOM 1642 CD1 ILE A 103 24.801 11.856 -18.082 1.00 40.50 C ATOM 0 H ILE A 103 23.704 15.132 -19.959 1.00 74.14 H new ATOM 0 HA ILE A 103 25.113 13.596 -21.820 1.00 33.44 H new ATOM 0 HB ILE A 103 22.903 12.844 -19.864 1.00 51.22 H new ATOM 0 HG12 ILE A 103 25.933 12.713 -19.674 1.00 60.22 H new ATOM 0 HG13 ILE A 103 24.899 13.851 -18.833 1.00 60.22 H new ATOM 0 HG21 ILE A 103 23.752 10.539 -20.068 1.00 64.00 H new ATOM 0 HG22 ILE A 103 23.115 11.144 -21.616 1.00 64.00 H new ATOM 0 HG23 ILE A 103 24.872 11.068 -21.345 1.00 64.00 H new ATOM 0 HD11 ILE A 103 25.589 12.031 -17.350 1.00 40.50 H new ATOM 0 HD12 ILE A 103 23.829 11.993 -17.608 1.00 40.50 H new ATOM 0 HD13 ILE A 103 24.879 10.838 -18.462 1.00 40.50 H new ATOM 1654 N VAL A 104 21.884 13.922 -22.401 1.00 23.52 N ATOM 1655 CA VAL A 104 20.842 13.734 -23.403 1.00 0.51 C ATOM 1656 C VAL A 104 21.213 14.414 -24.717 1.00 22.25 C ATOM 1657 O VAL A 104 21.337 13.761 -25.752 1.00 44.30 O ATOM 1658 CB VAL A 104 19.489 14.283 -22.917 1.00 60.53 C ATOM 1659 CG1 VAL A 104 18.430 14.129 -23.998 1.00 24.54 C ATOM 1660 CG2 VAL A 104 19.059 13.586 -21.635 1.00 33.23 C ATOM 0 H VAL A 104 21.592 14.461 -21.586 1.00 23.52 H new ATOM 0 HA VAL A 104 20.751 12.660 -23.566 1.00 0.51 H new ATOM 0 HB VAL A 104 19.605 15.346 -22.704 1.00 60.53 H new ATOM 0 HG11 VAL A 104 17.480 14.523 -23.636 1.00 24.54 H new ATOM 0 HG12 VAL A 104 18.735 14.680 -24.888 1.00 24.54 H new ATOM 0 HG13 VAL A 104 18.314 13.074 -24.246 1.00 24.54 H new ATOM 0 HG21 VAL A 104 18.100 13.987 -21.307 1.00 33.23 H new ATOM 0 HG22 VAL A 104 18.961 12.516 -21.818 1.00 33.23 H new ATOM 0 HG23 VAL A 104 19.807 13.755 -20.861 1.00 33.23 H new ATOM 1670 N ARG A 105 21.391 15.730 -24.665 1.00 24.52 N ATOM 1671 CA ARG A 105 21.747 16.500 -25.850 1.00 71.44 C ATOM 1672 C ARG A 105 22.942 15.876 -26.565 1.00 33.40 C ATOM 1673 O ARG A 105 22.962 15.777 -27.792 1.00 25.53 O ATOM 1674 CB ARG A 105 22.066 17.947 -25.468 1.00 5.22 C ATOM 1675 CG ARG A 105 22.313 18.852 -26.664 1.00 73.31 C ATOM 1676 CD ARG A 105 23.321 19.944 -26.337 1.00 42.21 C ATOM 1677 NE ARG A 105 22.680 21.243 -26.156 1.00 4.22 N ATOM 1678 CZ ARG A 105 23.279 22.287 -25.594 1.00 53.23 C ATOM 1679 NH1 ARG A 105 24.527 22.183 -25.160 1.00 14.40 N ATOM 1680 NH2 ARG A 105 22.630 23.436 -25.465 1.00 31.34 N ATOM 0 H ARG A 105 21.294 16.285 -23.815 1.00 24.52 H new ATOM 0 HA ARG A 105 20.894 16.490 -26.528 1.00 71.44 H new ATOM 0 HB2 ARG A 105 21.240 18.350 -24.883 1.00 5.22 H new ATOM 0 HB3 ARG A 105 22.947 17.959 -24.826 1.00 5.22 H new ATOM 0 HG2 ARG A 105 22.677 18.258 -27.502 1.00 73.31 H new ATOM 0 HG3 ARG A 105 21.373 19.305 -26.979 1.00 73.31 H new ATOM 0 HD2 ARG A 105 23.863 19.677 -25.430 1.00 42.21 H new ATOM 0 HD3 ARG A 105 24.056 20.011 -27.139 1.00 42.21 H new ATOM 0 HE ARG A 105 21.719 21.355 -26.479 1.00 4.22 H new ATOM 0 HH11 ARG A 105 25.029 21.300 -25.257 1.00 14.40 H new ATOM 0 HH12 ARG A 105 24.986 22.986 -24.729 1.00 14.40 H new ATOM 0 HH21 ARG A 105 21.669 23.519 -25.798 1.00 31.34 H new ATOM 0 HH22 ARG A 105 23.091 24.237 -25.033 1.00 31.34 H new ATOM 1694 N ARG A 106 23.936 15.458 -25.788 1.00 51.53 N ATOM 1695 CA ARG A 106 25.135 14.845 -26.347 1.00 10.51 C ATOM 1696 C ARG A 106 24.774 13.695 -27.282 1.00 42.41 C ATOM 1697 O ARG A 106 25.392 13.515 -28.332 1.00 61.32 O ATOM 1698 CB ARG A 106 26.044 14.338 -25.226 1.00 54.14 C ATOM 1699 CG ARG A 106 27.514 14.282 -25.612 1.00 1.21 C ATOM 1700 CD ARG A 106 28.232 13.144 -24.903 1.00 72.03 C ATOM 1701 NE ARG A 106 29.674 13.368 -24.831 1.00 32.34 N ATOM 1702 CZ ARG A 106 30.479 12.713 -24.002 1.00 41.12 C ATOM 1703 NH1 ARG A 106 29.985 11.797 -23.179 1.00 74.52 N ATOM 1704 NH2 ARG A 106 31.779 12.973 -23.994 1.00 53.12 N ATOM 0 H ARG A 106 23.935 15.533 -24.771 1.00 51.53 H new ATOM 0 HA ARG A 106 25.666 15.604 -26.922 1.00 10.51 H new ATOM 0 HB2 ARG A 106 25.930 14.985 -24.356 1.00 54.14 H new ATOM 0 HB3 ARG A 106 25.717 13.342 -24.927 1.00 54.14 H new ATOM 0 HG2 ARG A 106 27.604 14.154 -26.691 1.00 1.21 H new ATOM 0 HG3 ARG A 106 27.994 15.228 -25.362 1.00 1.21 H new ATOM 0 HD2 ARG A 106 27.831 13.034 -23.895 1.00 72.03 H new ATOM 0 HD3 ARG A 106 28.036 12.209 -25.428 1.00 72.03 H new ATOM 0 HE ARG A 106 30.085 14.066 -25.451 1.00 32.34 H new ATOM 0 HH11 ARG A 106 28.985 11.595 -23.182 1.00 74.52 H new ATOM 0 HH12 ARG A 106 30.605 11.295 -22.543 1.00 74.52 H new ATOM 0 HH21 ARG A 106 32.162 13.677 -24.625 1.00 53.12 H new ATOM 0 HH22 ARG A 106 32.396 12.469 -23.357 1.00 53.12 H new ATOM 1718 N HIS A 107 23.768 12.916 -26.893 1.00 31.45 N ATOM 1719 CA HIS A 107 23.323 11.782 -27.696 1.00 21.22 C ATOM 1720 C HIS A 107 22.501 12.254 -28.891 1.00 63.11 C ATOM 1721 O HIS A 107 22.377 11.475 -29.838 1.00 1.04 O ATOM 1722 CB HIS A 107 22.497 10.819 -26.843 1.00 62.13 C ATOM 1723 CG HIS A 107 23.327 9.946 -25.953 1.00 23.11 C ATOM 1724 ND1 HIS A 107 24.463 9.295 -26.383 1.00 43.14 N ATOM 1725 CD2 HIS A 107 23.181 9.619 -24.648 1.00 4.33 C ATOM 1726 CE1 HIS A 107 24.978 8.605 -25.382 1.00 53.50 C ATOM 1727 NE2 HIS A 107 24.219 8.785 -24.317 1.00 53.31 N ATOM 0 H HIS A 107 23.246 13.050 -26.027 1.00 31.45 H new ATOM 0 HA HIS A 107 24.206 11.261 -28.066 1.00 21.22 H new ATOM 0 HB2 HIS A 107 21.803 11.394 -26.230 1.00 62.13 H new ATOM 0 HB3 HIS A 107 21.897 10.189 -27.499 1.00 62.13 H new ATOM 0 HD2 HIS A 107 22.393 9.953 -23.989 1.00 4.33 H new ATOM 0 HE1 HIS A 107 25.869 7.996 -25.427 1.00 53.50 H new ATOM 0 HE2 HIS A 107 24.378 8.372 -23.398 1.00 53.31 H new ATOM 1735 N LEU A 108 21.955 13.465 -28.877 1.00 25.33 N ATOM 1736 CA LEU A 108 21.160 13.960 -29.996 1.00 11.11 C ATOM 1737 C LEU A 108 22.045 14.655 -31.026 1.00 62.11 C ATOM 1738 O LEU A 108 21.878 14.467 -32.231 1.00 71.14 O ATOM 1739 CB LEU A 108 20.084 14.926 -29.496 1.00 71.11 C ATOM 1740 CG LEU A 108 19.113 14.368 -28.455 1.00 74.41 C ATOM 1741 CD1 LEU A 108 18.556 15.488 -27.590 1.00 61.44 C ATOM 1742 CD2 LEU A 108 17.985 13.604 -29.133 1.00 11.14 C ATOM 0 H LEU A 108 22.048 14.123 -28.103 1.00 25.33 H new ATOM 0 HA LEU A 108 20.679 13.107 -30.474 1.00 11.11 H new ATOM 0 HB2 LEU A 108 20.578 15.800 -29.071 1.00 71.11 H new ATOM 0 HB3 LEU A 108 19.507 15.271 -30.354 1.00 71.11 H new ATOM 0 HG LEU A 108 19.658 13.677 -27.812 1.00 74.41 H new ATOM 0 HD11 LEU A 108 17.867 15.072 -26.855 1.00 61.44 H new ATOM 0 HD12 LEU A 108 19.374 15.992 -27.076 1.00 61.44 H new ATOM 0 HD13 LEU A 108 18.027 16.204 -28.219 1.00 61.44 H new ATOM 0 HD21 LEU A 108 17.304 13.214 -28.377 1.00 11.14 H new ATOM 0 HD22 LEU A 108 17.442 14.273 -29.800 1.00 11.14 H new ATOM 0 HD23 LEU A 108 18.400 12.777 -29.708 1.00 11.14 H new ATOM 1754 N VAL A 109 22.988 15.458 -30.544 1.00 21.44 N ATOM 1755 CA VAL A 109 23.902 16.179 -31.421 1.00 64.34 C ATOM 1756 C VAL A 109 24.744 15.215 -32.250 1.00 24.00 C ATOM 1757 O VAL A 109 25.027 15.470 -33.420 1.00 53.10 O ATOM 1758 CB VAL A 109 24.838 17.103 -30.621 1.00 21.34 C ATOM 1759 CG1 VAL A 109 25.782 17.845 -31.555 1.00 25.03 C ATOM 1760 CG2 VAL A 109 24.029 18.080 -29.780 1.00 55.41 C ATOM 0 H VAL A 109 23.139 15.626 -29.549 1.00 21.44 H new ATOM 0 HA VAL A 109 23.288 16.786 -32.087 1.00 64.34 H new ATOM 0 HB VAL A 109 25.439 16.490 -29.949 1.00 21.34 H new ATOM 0 HG11 VAL A 109 26.436 18.493 -30.972 1.00 25.03 H new ATOM 0 HG12 VAL A 109 26.385 17.126 -32.110 1.00 25.03 H new ATOM 0 HG13 VAL A 109 25.203 18.448 -32.254 1.00 25.03 H new ATOM 0 HG21 VAL A 109 24.706 18.726 -29.221 1.00 55.41 H new ATOM 0 HG22 VAL A 109 23.402 18.689 -30.432 1.00 55.41 H new ATOM 0 HG23 VAL A 109 23.399 17.526 -29.084 1.00 55.41 H new ATOM 1770 N ALA A 110 25.139 14.105 -31.634 1.00 21.31 N ATOM 1771 CA ALA A 110 25.947 13.101 -32.314 1.00 62.13 C ATOM 1772 C ALA A 110 25.237 12.577 -33.559 1.00 33.34 C ATOM 1773 O ALA A 110 25.879 12.120 -34.504 1.00 32.02 O ATOM 1774 CB ALA A 110 26.272 11.955 -31.369 1.00 4.44 C ATOM 0 H ALA A 110 24.912 13.879 -30.666 1.00 21.31 H new ATOM 0 HA ALA A 110 26.878 13.572 -32.629 1.00 62.13 H new ATOM 0 HB1 ALA A 110 26.876 11.213 -31.891 1.00 4.44 H new ATOM 0 HB2 ALA A 110 26.827 12.336 -30.512 1.00 4.44 H new ATOM 0 HB3 ALA A 110 25.346 11.493 -31.026 1.00 4.44 H new ATOM 1780 N GLU A 111 23.910 12.646 -33.551 1.00 20.53 N ATOM 1781 CA GLU A 111 23.115 12.176 -34.679 1.00 24.42 C ATOM 1782 C GLU A 111 22.691 13.342 -35.568 1.00 22.20 C ATOM 1783 O GLU A 111 22.454 13.172 -36.764 1.00 64.34 O ATOM 1784 CB GLU A 111 21.879 11.424 -34.182 1.00 4.11 C ATOM 1785 CG GLU A 111 21.665 10.085 -34.867 1.00 45.52 C ATOM 1786 CD GLU A 111 22.743 9.076 -34.525 1.00 2.34 C ATOM 1787 OE1 GLU A 111 23.354 9.205 -33.443 1.00 3.34 O ATOM 1788 OE2 GLU A 111 22.977 8.157 -35.337 1.00 42.21 O ATOM 0 H GLU A 111 23.363 13.022 -32.777 1.00 20.53 H new ATOM 0 HA GLU A 111 23.732 11.497 -35.268 1.00 24.42 H new ATOM 0 HB2 GLU A 111 21.970 11.263 -33.108 1.00 4.11 H new ATOM 0 HB3 GLU A 111 20.998 12.047 -34.337 1.00 4.11 H new ATOM 0 HG2 GLU A 111 20.693 9.685 -34.578 1.00 45.52 H new ATOM 0 HG3 GLU A 111 21.641 10.233 -35.947 1.00 45.52 H new ATOM 1795 N THR A 112 22.596 14.528 -34.974 1.00 64.20 N ATOM 1796 CA THR A 112 22.198 15.721 -35.710 1.00 72.43 C ATOM 1797 C THR A 112 23.391 16.637 -35.958 1.00 35.13 C ATOM 1798 O THR A 112 23.264 17.860 -35.932 1.00 31.42 O ATOM 1799 CB THR A 112 21.109 16.509 -34.957 1.00 62.23 C ATOM 1800 OG1 THR A 112 20.379 15.632 -34.094 1.00 4.44 O ATOM 1801 CG2 THR A 112 20.154 17.179 -35.933 1.00 61.53 C ATOM 0 H THR A 112 22.789 14.687 -33.985 1.00 64.20 H new ATOM 0 HA THR A 112 21.797 15.383 -36.666 1.00 72.43 H new ATOM 0 HB THR A 112 21.596 17.281 -34.362 1.00 62.23 H new ATOM 0 HG1 THR A 112 20.871 15.515 -33.254 1.00 4.44 H new ATOM 0 HG21 THR A 112 19.394 17.729 -35.378 1.00 61.53 H new ATOM 0 HG22 THR A 112 20.709 17.868 -36.570 1.00 61.53 H new ATOM 0 HG23 THR A 112 19.674 16.420 -36.551 1.00 61.53 H new ATOM 1809 N GLY A 113 24.553 16.036 -36.199 1.00 34.10 N ATOM 1810 CA GLY A 113 25.752 16.813 -36.449 1.00 15.31 C ATOM 1811 C GLY A 113 26.518 16.325 -37.662 1.00 40.35 C ATOM 1812 O GLY A 113 27.717 16.576 -37.793 1.00 42.22 O ATOM 0 H GLY A 113 24.684 15.025 -36.225 1.00 34.10 H new ATOM 0 HA2 GLY A 113 25.480 17.859 -36.592 1.00 15.31 H new ATOM 0 HA3 GLY A 113 26.399 16.769 -35.573 1.00 15.31 H new ATOM 1816 N THR A 114 25.826 15.621 -38.553 1.00 31.52 N ATOM 1817 CA THR A 114 26.448 15.093 -39.761 1.00 24.35 C ATOM 1818 C THR A 114 25.869 15.749 -41.009 1.00 64.23 C ATOM 1819 O THR A 114 25.878 15.162 -42.091 1.00 21.43 O ATOM 1820 CB THR A 114 26.266 13.568 -39.865 1.00 12.43 C ATOM 1821 OG1 THR A 114 27.045 13.054 -40.951 1.00 70.32 O ATOM 1822 CG2 THR A 114 24.802 13.210 -40.071 1.00 10.15 C ATOM 0 H THR A 114 24.834 15.403 -38.460 1.00 31.52 H new ATOM 0 HA THR A 114 27.512 15.321 -39.695 1.00 24.35 H new ATOM 0 HB THR A 114 26.605 13.120 -38.931 1.00 12.43 H new ATOM 0 HG1 THR A 114 26.862 13.575 -41.760 1.00 70.32 H new ATOM 0 HG21 THR A 114 24.699 12.127 -40.142 1.00 10.15 H new ATOM 0 HG22 THR A 114 24.216 13.576 -39.228 1.00 10.15 H new ATOM 0 HG23 THR A 114 24.441 13.670 -40.991 1.00 10.15 H new ATOM 1830 N ALA A 115 25.368 16.970 -40.852 1.00 42.12 N ATOM 1831 CA ALA A 115 24.787 17.706 -41.968 1.00 65.34 C ATOM 1832 C ALA A 115 24.537 19.163 -41.594 1.00 15.23 C ATOM 1833 O ALA A 115 23.444 19.688 -41.803 1.00 60.35 O ATOM 1834 CB ALA A 115 23.493 17.047 -42.420 1.00 5.43 C ATOM 0 H ALA A 115 25.353 17.470 -39.963 1.00 42.12 H new ATOM 0 HA ALA A 115 25.499 17.686 -42.793 1.00 65.34 H new ATOM 0 HB1 ALA A 115 23.071 17.608 -43.254 1.00 5.43 H new ATOM 0 HB2 ALA A 115 23.697 16.024 -42.737 1.00 5.43 H new ATOM 0 HB3 ALA A 115 22.782 17.036 -41.594 1.00 5.43 H new ATOM 1840 N GLU A 116 25.558 19.810 -41.039 1.00 22.11 N ATOM 1841 CA GLU A 116 25.447 21.206 -40.635 1.00 20.22 C ATOM 1842 C GLU A 116 26.063 22.128 -41.684 1.00 0.44 C ATOM 1843 O GLU A 116 26.592 23.191 -41.359 1.00 30.32 O ATOM 1844 CB GLU A 116 26.131 21.425 -39.283 1.00 42.13 C ATOM 1845 CG GLU A 116 25.373 22.368 -38.363 1.00 32.22 C ATOM 1846 CD GLU A 116 24.432 21.637 -37.426 1.00 21.22 C ATOM 1847 OE1 GLU A 116 24.901 20.746 -36.688 1.00 64.15 O ATOM 1848 OE2 GLU A 116 23.224 21.958 -37.431 1.00 31.25 O ATOM 0 H GLU A 116 26.470 19.390 -40.859 1.00 22.11 H new ATOM 0 HA GLU A 116 24.388 21.447 -40.542 1.00 20.22 H new ATOM 0 HB2 GLU A 116 26.250 20.463 -38.785 1.00 42.13 H new ATOM 0 HB3 GLU A 116 27.132 21.822 -39.452 1.00 42.13 H new ATOM 0 HG2 GLU A 116 26.085 22.948 -37.777 1.00 32.22 H new ATOM 0 HG3 GLU A 116 24.803 23.076 -38.964 1.00 32.22 H new ATOM 1855 N LYS A 117 25.991 21.712 -42.943 1.00 52.41 N ATOM 1856 CA LYS A 117 26.540 22.497 -44.042 1.00 30.10 C ATOM 1857 C LYS A 117 25.958 23.907 -44.046 1.00 44.23 C ATOM 1858 O LYS A 117 26.591 24.848 -44.525 1.00 22.41 O ATOM 1859 CB LYS A 117 26.254 21.811 -45.379 1.00 41.55 C ATOM 1860 CG LYS A 117 27.399 21.915 -46.373 1.00 41.31 C ATOM 1861 CD LYS A 117 26.889 22.054 -47.797 1.00 71.53 C ATOM 1862 CE LYS A 117 27.971 22.583 -48.728 1.00 21.34 C ATOM 1863 NZ LYS A 117 28.076 21.772 -49.973 1.00 2.25 N ATOM 0 H LYS A 117 25.557 20.834 -43.228 1.00 52.41 H new ATOM 0 HA LYS A 117 27.619 22.568 -43.902 1.00 30.10 H new ATOM 0 HB2 LYS A 117 26.035 20.759 -45.198 1.00 41.55 H new ATOM 0 HB3 LYS A 117 25.360 22.252 -45.820 1.00 41.55 H new ATOM 0 HG2 LYS A 117 28.022 22.774 -46.123 1.00 41.31 H new ATOM 0 HG3 LYS A 117 28.030 21.030 -46.296 1.00 41.31 H new ATOM 0 HD2 LYS A 117 26.540 21.086 -48.156 1.00 71.53 H new ATOM 0 HD3 LYS A 117 26.032 22.727 -47.814 1.00 71.53 H new ATOM 0 HE2 LYS A 117 27.753 23.619 -48.987 1.00 21.34 H new ATOM 0 HE3 LYS A 117 28.930 22.579 -48.210 1.00 21.34 H new ATOM 0 HZ1 LYS A 117 28.823 22.164 -50.581 1.00 2.25 H new ATOM 0 HZ2 LYS A 117 28.309 20.789 -49.728 1.00 2.25 H new ATOM 0 HZ3 LYS A 117 27.169 21.796 -50.481 1.00 2.25 H new ATOM 1877 N MET A 118 24.749 24.045 -43.510 1.00 52.40 N ATOM 1878 CA MET A 118 24.084 25.341 -43.452 1.00 3.44 C ATOM 1879 C MET A 118 23.847 25.896 -44.853 1.00 12.30 C ATOM 1880 O MET A 118 24.559 26.783 -45.323 1.00 33.40 O ATOM 1881 CB MET A 118 24.916 26.330 -42.633 1.00 14.44 C ATOM 1882 CG MET A 118 24.098 27.452 -42.018 1.00 64.34 C ATOM 1883 SD MET A 118 24.183 27.471 -40.217 1.00 41.55 S ATOM 1884 CE MET A 118 22.609 28.223 -39.811 1.00 12.30 C ATOM 0 H MET A 118 24.211 23.276 -43.110 1.00 52.40 H new ATOM 0 HA MET A 118 23.117 25.202 -42.968 1.00 3.44 H new ATOM 0 HB2 MET A 118 25.429 25.789 -41.838 1.00 14.44 H new ATOM 0 HB3 MET A 118 25.685 26.762 -43.273 1.00 14.44 H new ATOM 0 HG2 MET A 118 24.452 28.408 -42.404 1.00 64.34 H new ATOM 0 HG3 MET A 118 23.058 27.349 -42.327 1.00 64.34 H new ATOM 0 HE1 MET A 118 22.513 28.304 -38.728 1.00 12.30 H new ATOM 0 HE2 MET A 118 22.555 29.217 -40.255 1.00 12.30 H new ATOM 0 HE3 MET A 118 21.800 27.607 -40.202 1.00 12.30 H new ATOM 1894 N PRO A 119 22.826 25.361 -45.537 1.00 52.23 N ATOM 1895 CA PRO A 119 22.473 25.788 -46.895 1.00 14.54 C ATOM 1896 C PRO A 119 21.886 27.194 -46.925 1.00 65.30 C ATOM 1897 O PRO A 119 21.671 27.810 -45.882 1.00 22.02 O ATOM 1898 CB PRO A 119 21.425 24.759 -47.328 1.00 21.51 C ATOM 1899 CG PRO A 119 20.828 24.267 -46.055 1.00 0.14 C ATOM 1900 CD PRO A 119 21.936 24.298 -45.039 1.00 72.14 C ATOM 0 HA PRO A 119 23.343 25.831 -47.550 1.00 14.54 H new ATOM 0 HB2 PRO A 119 20.669 25.210 -47.971 1.00 21.51 H new ATOM 0 HB3 PRO A 119 21.879 23.945 -47.893 1.00 21.51 H new ATOM 0 HG2 PRO A 119 19.996 24.899 -45.744 1.00 0.14 H new ATOM 0 HG3 PRO A 119 20.435 23.257 -46.173 1.00 0.14 H new ATOM 0 HD2 PRO A 119 21.560 24.524 -44.041 1.00 72.14 H new ATOM 0 HD3 PRO A 119 22.451 23.339 -44.977 1.00 72.14 H new ATOM 1908 N SER A 120 21.626 27.696 -48.128 1.00 42.33 N ATOM 1909 CA SER A 120 21.065 29.031 -48.295 1.00 34.32 C ATOM 1910 C SER A 120 19.749 29.167 -47.535 1.00 53.20 C ATOM 1911 O SER A 120 18.742 28.561 -47.900 1.00 4.40 O ATOM 1912 CB SER A 120 20.844 29.333 -49.778 1.00 40.01 C ATOM 1913 OG SER A 120 20.750 28.138 -50.534 1.00 1.40 O ATOM 0 H SER A 120 21.795 27.198 -49.002 1.00 42.33 H new ATOM 0 HA SER A 120 21.776 29.750 -47.887 1.00 34.32 H new ATOM 0 HB2 SER A 120 19.932 29.917 -49.901 1.00 40.01 H new ATOM 0 HB3 SER A 120 21.666 29.942 -50.155 1.00 40.01 H new ATOM 0 HG SER A 120 20.607 28.359 -51.478 1.00 1.40 H new ATOM 1919 N THR A 121 19.766 29.969 -46.475 1.00 3.42 N ATOM 1920 CA THR A 121 18.576 30.185 -45.661 1.00 60.02 C ATOM 1921 C THR A 121 18.702 31.455 -44.829 1.00 22.31 C ATOM 1922 O THR A 121 19.803 31.962 -44.616 1.00 31.24 O ATOM 1923 CB THR A 121 18.314 28.992 -44.721 1.00 74.42 C ATOM 1924 OG1 THR A 121 19.148 27.888 -45.087 1.00 55.24 O ATOM 1925 CG2 THR A 121 16.853 28.571 -44.775 1.00 52.15 C ATOM 0 H THR A 121 20.591 30.480 -46.160 1.00 3.42 H new ATOM 0 HA THR A 121 17.737 30.287 -46.349 1.00 60.02 H new ATOM 0 HB THR A 121 18.549 29.302 -43.703 1.00 74.42 H new ATOM 0 HG1 THR A 121 20.089 28.144 -44.994 1.00 55.24 H new ATOM 0 HG21 THR A 121 16.692 27.728 -44.104 1.00 52.15 H new ATOM 0 HG22 THR A 121 16.222 29.405 -44.467 1.00 52.15 H new ATOM 0 HG23 THR A 121 16.596 28.278 -45.793 1.00 52.15 H new ATOM 1933 N SER A 122 17.568 31.965 -44.360 1.00 63.43 N ATOM 1934 CA SER A 122 17.551 33.180 -43.553 1.00 3.53 C ATOM 1935 C SER A 122 17.437 32.844 -42.069 1.00 32.15 C ATOM 1936 O SER A 122 17.396 31.674 -41.687 1.00 0.54 O ATOM 1937 CB SER A 122 16.390 34.081 -43.974 1.00 24.22 C ATOM 1938 OG SER A 122 16.397 34.303 -45.373 1.00 42.15 O ATOM 0 H SER A 122 16.648 31.556 -44.525 1.00 63.43 H new ATOM 0 HA SER A 122 18.490 33.709 -43.717 1.00 3.53 H new ATOM 0 HB2 SER A 122 15.445 33.623 -43.680 1.00 24.22 H new ATOM 0 HB3 SER A 122 16.458 35.035 -43.451 1.00 24.22 H new ATOM 0 HG SER A 122 15.644 34.881 -45.616 1.00 42.15 H new ATOM 1944 N ARG A 123 17.386 33.879 -41.237 1.00 13.43 N ATOM 1945 CA ARG A 123 17.278 33.695 -39.794 1.00 72.02 C ATOM 1946 C ARG A 123 15.867 34.015 -39.310 1.00 2.40 C ATOM 1947 O ARG A 123 15.185 34.889 -39.843 1.00 43.20 O ATOM 1948 CB ARG A 123 18.291 34.583 -39.069 1.00 14.23 C ATOM 1949 CG ARG A 123 19.736 34.171 -39.298 1.00 1.12 C ATOM 1950 CD ARG A 123 20.073 32.883 -38.562 1.00 31.31 C ATOM 1951 NE ARG A 123 20.061 33.063 -37.113 1.00 12.12 N ATOM 1952 CZ ARG A 123 20.238 32.070 -36.248 1.00 31.41 C ATOM 1953 NH1 ARG A 123 20.440 30.835 -36.683 1.00 52.24 N ATOM 1954 NH2 ARG A 123 20.214 32.313 -34.943 1.00 54.21 N ATOM 0 H ARG A 123 17.418 34.853 -41.537 1.00 13.43 H new ATOM 0 HA ARG A 123 17.493 32.651 -39.568 1.00 72.02 H new ATOM 0 HB2 ARG A 123 18.159 35.614 -39.399 1.00 14.23 H new ATOM 0 HB3 ARG A 123 18.081 34.561 -38.000 1.00 14.23 H new ATOM 0 HG2 ARG A 123 19.912 34.038 -40.365 1.00 1.12 H new ATOM 0 HG3 ARG A 123 20.400 34.967 -38.962 1.00 1.12 H new ATOM 0 HD2 ARG A 123 19.356 32.110 -38.837 1.00 31.31 H new ATOM 0 HD3 ARG A 123 21.056 32.532 -38.876 1.00 31.31 H new ATOM 0 HE ARG A 123 19.908 34.002 -36.745 1.00 12.12 H new ATOM 0 HH11 ARG A 123 20.460 30.644 -37.685 1.00 52.24 H new ATOM 0 HH12 ARG A 123 20.576 30.075 -36.016 1.00 52.24 H new ATOM 0 HH21 ARG A 123 20.060 33.262 -34.604 1.00 54.21 H new ATOM 0 HH22 ARG A 123 20.350 31.550 -34.280 1.00 54.21 H new ATOM 1968 N PRO A 124 15.418 33.288 -38.275 1.00 51.31 N ATOM 1969 CA PRO A 124 14.084 33.476 -37.696 1.00 35.12 C ATOM 1970 C PRO A 124 13.958 34.799 -36.950 1.00 11.35 C ATOM 1971 O PRO A 124 14.934 35.312 -36.402 1.00 13.34 O ATOM 1972 CB PRO A 124 13.951 32.300 -36.726 1.00 43.30 C ATOM 1973 CG PRO A 124 15.351 31.943 -36.368 1.00 11.42 C ATOM 1974 CD PRO A 124 16.178 32.229 -37.591 1.00 11.23 C ATOM 0 HA PRO A 124 13.307 33.506 -38.460 1.00 35.12 H new ATOM 0 HB2 PRO A 124 13.376 32.578 -35.843 1.00 43.30 H new ATOM 0 HB3 PRO A 124 13.435 31.460 -37.191 1.00 43.30 H new ATOM 0 HG2 PRO A 124 15.698 32.529 -35.517 1.00 11.42 H new ATOM 0 HG3 PRO A 124 15.425 30.893 -36.084 1.00 11.42 H new ATOM 0 HD2 PRO A 124 17.183 32.561 -37.329 1.00 11.23 H new ATOM 0 HD3 PRO A 124 16.288 31.344 -38.218 1.00 11.23 H new ATOM 1982 N THR A 125 12.747 35.349 -36.930 1.00 31.05 N ATOM 1983 CA THR A 125 12.493 36.613 -36.250 1.00 43.53 C ATOM 1984 C THR A 125 11.317 36.493 -35.288 1.00 2.12 C ATOM 1985 O THR A 125 10.226 36.073 -35.675 1.00 13.34 O ATOM 1986 CB THR A 125 12.206 37.744 -37.256 1.00 51.21 C ATOM 1987 OG1 THR A 125 11.216 37.319 -38.199 1.00 64.24 O ATOM 1988 CG2 THR A 125 13.474 38.149 -37.991 1.00 41.34 C ATOM 0 H THR A 125 11.927 34.938 -37.377 1.00 31.05 H new ATOM 0 HA THR A 125 13.395 36.857 -35.688 1.00 43.53 H new ATOM 0 HB THR A 125 11.835 38.607 -36.704 1.00 51.21 H new ATOM 0 HG1 THR A 125 10.503 36.837 -37.730 1.00 64.24 H new ATOM 0 HG21 THR A 125 13.246 38.949 -38.696 1.00 41.34 H new ATOM 0 HG22 THR A 125 14.215 38.499 -37.272 1.00 41.34 H new ATOM 0 HG23 THR A 125 13.871 37.290 -38.533 1.00 41.34 H new ATOM 1996 N ALA A 126 11.545 36.866 -34.032 1.00 45.33 N ATOM 1997 CA ALA A 126 10.503 36.802 -33.016 1.00 25.43 C ATOM 1998 C ALA A 126 9.290 37.634 -33.419 1.00 44.33 C ATOM 1999 O ALA A 126 9.400 38.625 -34.142 1.00 2.24 O ATOM 2000 CB ALA A 126 11.045 37.273 -31.674 1.00 5.22 C ATOM 0 H ALA A 126 12.442 37.215 -33.695 1.00 45.33 H new ATOM 0 HA ALA A 126 10.184 35.764 -32.924 1.00 25.43 H new ATOM 0 HB1 ALA A 126 10.256 37.220 -30.924 1.00 5.22 H new ATOM 0 HB2 ALA A 126 11.875 36.635 -31.373 1.00 5.22 H new ATOM 0 HB3 ALA A 126 11.392 38.302 -31.763 1.00 5.22 H new ATOM 2006 N PRO A 127 8.104 37.223 -32.945 1.00 53.42 N ATOM 2007 CA PRO A 127 6.848 37.916 -33.246 1.00 13.25 C ATOM 2008 C PRO A 127 6.760 39.277 -32.562 1.00 54.33 C ATOM 2009 O PRO A 127 7.501 39.558 -31.620 1.00 24.10 O ATOM 2010 CB PRO A 127 5.780 36.970 -32.691 1.00 52.54 C ATOM 2011 CG PRO A 127 6.474 36.197 -31.624 1.00 30.43 C ATOM 2012 CD PRO A 127 7.900 36.049 -32.079 1.00 41.14 C ATOM 0 HA PRO A 127 6.742 38.124 -34.311 1.00 13.25 H new ATOM 0 HB2 PRO A 127 4.931 37.524 -32.290 1.00 52.54 H new ATOM 0 HB3 PRO A 127 5.392 36.311 -33.468 1.00 52.54 H new ATOM 0 HG2 PRO A 127 6.422 36.718 -30.668 1.00 30.43 H new ATOM 0 HG3 PRO A 127 6.007 35.223 -31.482 1.00 30.43 H new ATOM 0 HD2 PRO A 127 8.592 36.045 -31.237 1.00 41.14 H new ATOM 0 HD3 PRO A 127 8.054 35.117 -32.623 1.00 41.14 H new ATOM 2020 N SER A 128 5.850 40.117 -33.043 1.00 60.11 N ATOM 2021 CA SER A 128 5.668 41.451 -32.481 1.00 13.20 C ATOM 2022 C SER A 128 4.270 41.604 -31.889 1.00 12.52 C ATOM 2023 O SER A 128 3.360 42.112 -32.543 1.00 4.33 O ATOM 2024 CB SER A 128 5.899 42.516 -33.554 1.00 50.23 C ATOM 2025 OG SER A 128 5.032 42.324 -34.659 1.00 10.12 O ATOM 0 H SER A 128 5.227 39.898 -33.820 1.00 60.11 H new ATOM 0 HA SER A 128 6.399 41.585 -31.684 1.00 13.20 H new ATOM 0 HB2 SER A 128 5.737 43.506 -33.129 1.00 50.23 H new ATOM 0 HB3 SER A 128 6.935 42.479 -33.890 1.00 50.23 H new ATOM 0 HG SER A 128 4.114 42.207 -34.338 1.00 10.12 H new ATOM 2031 N SER A 129 4.109 41.159 -30.646 1.00 64.11 N ATOM 2032 CA SER A 129 2.822 41.243 -29.966 1.00 42.31 C ATOM 2033 C SER A 129 2.657 42.596 -29.280 1.00 43.24 C ATOM 2034 O SER A 129 3.593 43.114 -28.673 1.00 52.14 O ATOM 2035 CB SER A 129 2.691 40.118 -28.937 1.00 2.20 C ATOM 2036 OG SER A 129 3.224 38.904 -29.439 1.00 43.33 O ATOM 0 H SER A 129 4.853 40.737 -30.090 1.00 64.11 H new ATOM 0 HA SER A 129 2.036 41.136 -30.714 1.00 42.31 H new ATOM 0 HB2 SER A 129 3.212 40.396 -28.021 1.00 2.20 H new ATOM 0 HB3 SER A 129 1.642 39.978 -28.677 1.00 2.20 H new ATOM 0 HG SER A 129 3.130 38.201 -28.763 1.00 43.33 H new ATOM 2042 N GLU A 130 1.458 43.162 -29.382 1.00 62.02 N ATOM 2043 CA GLU A 130 1.170 44.455 -28.773 1.00 52.30 C ATOM 2044 C GLU A 130 -0.326 44.752 -28.809 1.00 42.45 C ATOM 2045 O GLU A 130 -0.961 44.679 -29.862 1.00 53.21 O ATOM 2046 CB GLU A 130 1.939 45.565 -29.493 1.00 30.11 C ATOM 2047 CG GLU A 130 1.935 46.889 -28.748 1.00 2.32 C ATOM 2048 CD GLU A 130 3.332 47.413 -28.482 1.00 54.10 C ATOM 2049 OE1 GLU A 130 3.969 47.916 -29.431 1.00 44.33 O ATOM 2050 OE2 GLU A 130 3.790 47.321 -27.323 1.00 10.31 O ATOM 0 H GLU A 130 0.671 42.746 -29.880 1.00 62.02 H new ATOM 0 HA GLU A 130 1.490 44.417 -27.732 1.00 52.30 H new ATOM 0 HB2 GLU A 130 2.970 45.244 -29.641 1.00 30.11 H new ATOM 0 HB3 GLU A 130 1.506 45.713 -30.482 1.00 30.11 H new ATOM 0 HG2 GLU A 130 1.379 47.626 -29.327 1.00 2.32 H new ATOM 0 HG3 GLU A 130 1.410 46.767 -27.800 1.00 2.32 H new ATOM 2057 N LYS A 131 -0.885 45.085 -27.651 1.00 71.45 N ATOM 2058 CA LYS A 131 -2.306 45.394 -27.547 1.00 63.44 C ATOM 2059 C LYS A 131 -2.636 46.692 -28.279 1.00 50.43 C ATOM 2060 O LYS A 131 -1.741 47.414 -28.715 1.00 73.20 O ATOM 2061 CB LYS A 131 -2.720 45.506 -26.078 1.00 74.22 C ATOM 2062 CG LYS A 131 -2.526 44.220 -25.293 1.00 34.20 C ATOM 2063 CD LYS A 131 -2.581 44.469 -23.795 1.00 0.32 C ATOM 2064 CE LYS A 131 -3.981 44.860 -23.345 1.00 73.21 C ATOM 2065 NZ LYS A 131 -3.972 45.510 -22.006 1.00 35.40 N ATOM 0 H LYS A 131 -0.375 45.148 -26.770 1.00 71.45 H new ATOM 0 HA LYS A 131 -2.863 44.582 -28.014 1.00 63.44 H new ATOM 0 HB2 LYS A 131 -2.143 46.301 -25.606 1.00 74.22 H new ATOM 0 HB3 LYS A 131 -3.768 45.799 -26.026 1.00 74.22 H new ATOM 0 HG2 LYS A 131 -3.297 43.502 -25.572 1.00 34.20 H new ATOM 0 HG3 LYS A 131 -1.566 43.774 -25.554 1.00 34.20 H new ATOM 0 HD2 LYS A 131 -2.265 43.571 -23.264 1.00 0.32 H new ATOM 0 HD3 LYS A 131 -1.879 45.260 -23.531 1.00 0.32 H new ATOM 0 HE2 LYS A 131 -4.421 45.539 -24.075 1.00 73.21 H new ATOM 0 HE3 LYS A 131 -4.613 43.973 -23.314 1.00 73.21 H new ATOM 0 HZ1 LYS A 131 -4.944 45.761 -21.735 1.00 35.40 H new ATOM 0 HZ2 LYS A 131 -3.576 44.853 -21.304 1.00 35.40 H new ATOM 0 HZ3 LYS A 131 -3.389 46.371 -22.042 1.00 35.40 H new ATOM 2079 N GLY A 132 -3.927 46.982 -28.409 1.00 4.12 N ATOM 2080 CA GLY A 132 -4.351 48.193 -29.086 1.00 62.44 C ATOM 2081 C GLY A 132 -5.798 48.542 -28.799 1.00 43.32 C ATOM 2082 O GLY A 132 -6.713 47.915 -29.330 1.00 51.43 O ATOM 0 H GLY A 132 -4.687 46.399 -28.057 1.00 4.12 H new ATOM 0 HA2 GLY A 132 -3.713 49.021 -28.777 1.00 62.44 H new ATOM 0 HA3 GLY A 132 -4.216 48.071 -30.161 1.00 62.44 H new ATOM 2086 N GLY A 133 -6.006 49.547 -27.953 1.00 13.25 N ATOM 2087 CA GLY A 133 -7.354 49.960 -27.609 1.00 2.34 C ATOM 2088 C GLY A 133 -7.801 51.182 -28.383 1.00 64.54 C ATOM 2089 O GLY A 133 -7.592 52.314 -27.946 1.00 52.32 O ATOM 0 H GLY A 133 -5.265 50.082 -27.500 1.00 13.25 H new ATOM 0 HA2 GLY A 133 -8.043 49.138 -27.804 1.00 2.34 H new ATOM 0 HA3 GLY A 133 -7.404 50.172 -26.541 1.00 2.34 H new ATOM 2093 N ASN A 134 -8.419 50.956 -29.538 1.00 20.41 N ATOM 2094 CA ASN A 134 -8.896 52.050 -30.378 1.00 34.23 C ATOM 2095 C ASN A 134 -9.862 51.538 -31.441 1.00 74.20 C ATOM 2096 O ASN A 134 -11.035 51.911 -31.460 1.00 1.11 O ATOM 2097 CB ASN A 134 -7.716 52.761 -31.044 1.00 53.42 C ATOM 2098 CG ASN A 134 -8.061 54.172 -31.479 1.00 14.41 C ATOM 2099 OD1 ASN A 134 -9.233 54.518 -31.625 1.00 45.15 O ATOM 2100 ND2 ASN A 134 -7.039 54.993 -31.688 1.00 41.10 N ATOM 0 H ASN A 134 -8.601 50.026 -29.914 1.00 20.41 H new ATOM 0 HA ASN A 134 -9.426 52.759 -29.742 1.00 34.23 H new ATOM 0 HB2 ASN A 134 -6.876 52.793 -30.350 1.00 53.42 H new ATOM 0 HB3 ASN A 134 -7.391 52.186 -31.911 1.00 53.42 H new ATOM 0 HD21 ASN A 134 -7.209 55.955 -31.982 1.00 41.10 H new ATOM 0 HD22 ASN A 134 -6.083 54.662 -31.554 1.00 41.10 H new ATOM 2107 N TYR A 135 -9.361 50.683 -32.325 1.00 0.13 N ATOM 2108 CA TYR A 135 -10.179 50.120 -33.393 1.00 74.32 C ATOM 2109 C TYR A 135 -10.722 51.221 -34.300 1.00 23.42 C ATOM 2110 O TYR A 135 -9.960 51.963 -34.918 1.00 31.14 O ATOM 2111 CB TYR A 135 -11.335 49.310 -32.807 1.00 22.23 C ATOM 2112 CG TYR A 135 -12.083 48.491 -33.833 1.00 63.32 C ATOM 2113 CD1 TYR A 135 -11.401 47.752 -34.792 1.00 22.21 C ATOM 2114 CD2 TYR A 135 -13.472 48.456 -33.845 1.00 4.45 C ATOM 2115 CE1 TYR A 135 -12.081 47.002 -35.733 1.00 72.43 C ATOM 2116 CE2 TYR A 135 -14.160 47.708 -34.780 1.00 40.33 C ATOM 2117 CZ TYR A 135 -13.460 46.983 -35.723 1.00 45.03 C ATOM 2118 OH TYR A 135 -14.141 46.237 -36.657 1.00 74.14 O ATOM 0 H TYR A 135 -8.392 50.364 -32.323 1.00 0.13 H new ATOM 0 HA TYR A 135 -9.549 49.460 -33.989 1.00 74.32 H new ATOM 0 HB2 TYR A 135 -10.947 48.644 -32.036 1.00 22.23 H new ATOM 0 HB3 TYR A 135 -12.033 49.990 -32.319 1.00 22.23 H new ATOM 0 HD1 TYR A 135 -10.321 47.764 -34.802 1.00 22.21 H new ATOM 0 HD2 TYR A 135 -14.023 49.024 -33.110 1.00 4.45 H new ATOM 0 HE1 TYR A 135 -11.535 46.434 -36.472 1.00 72.43 H new ATOM 0 HE2 TYR A 135 -15.240 47.690 -34.773 1.00 40.33 H new ATOM 0 HH TYR A 135 -15.105 46.331 -36.511 1.00 74.14 H new TER 2128 TYR A 135