USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 786 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 48 GLN : amide:sc= -0.042 K(o=-0.13,f=-1.6!) USER MOD Set 1.2: B 48 GLN :FLIP amide:sc= -0.0834 F(o=-1,f=-0.13) USER MOD Set 2.1: B 34 GLN : amide:sc= 0.991 X(o=1.9,f=1.9) USER MOD Set 2.2: B 38 TYR OH : rot 180:sc= 0.885 USER MOD Set 3.1: B 35 THR OG1 : rot -74:sc= 0.971 USER MOD Set 3.2: B 36 LYS NZ :NH3+ 162:sc= -1.1 (180deg=-1.63) USER MOD Set 4.1: A 34 GLN : amide:sc= 0.805 K(o=1.6,f=0.93) USER MOD Set 4.2: A 38 TYR OH : rot 180:sc= 0.833 USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.0467 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 91:sc= 1.24 USER MOD Single : A 15 SER OG : rot 164:sc= 1.34 USER MOD Single : A 16 GLN : amide:sc= 0.174 X(o=0.17,f=-0.041) USER MOD Single : A 17 MET CE :methyl -119:sc= 0 (180deg=-0.0635) USER MOD Single : A 19 SER OG : rot 180:sc= 0.104 USER MOD Single : A 20 MET CE :methyl -162:sc= -0.199 (180deg=-1.04) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0544 USER MOD Single : A 36 LYS NZ :NH3+ -173:sc= 1.28 (180deg=1.08) USER MOD Single : A 37 ASN : amide:sc= 0.896 K(o=0.9,f=-6.7!) USER MOD Single : A 46 THR OG1 : rot 72:sc= 1.26 USER MOD Single : A 49 TYR OH : rot 38:sc= 0.032 USER MOD Single : A 50 SER OG : rot -67:sc= 1.07 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 HIS : no HE2:sc= 0.652 K(o=0.65,f=-2.6!) USER MOD Single : B 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 13 SER OG : rot 99:sc= 1.27 USER MOD Single : B 15 SER OG : rot -180:sc= 0.528 USER MOD Single : B 16 GLN : amide:sc= 0.352 K(o=0.35,f=-0.18) USER MOD Single : B 17 MET CE :methyl -156:sc= -0.0536 (180deg=-0.372) USER MOD Single : B 19 SER OG : rot 180:sc= 0.00973 USER MOD Single : B 20 MET CE :methyl -130:sc= -0.18 (180deg=-0.851) USER MOD Single : B 23 SER OG : rot 180:sc= -0.0578 USER MOD Single : B 30 THR OG1 : rot 180:sc= 0 USER MOD Single : B 37 ASN : amide:sc= -0.706 K(o=-0.71,f=-2.5) USER MOD Single : B 46 THR OG1 : rot 82:sc= 1.23 USER MOD Single : B 49 TYR OH : rot 46:sc= 0.993 USER MOD Single : B 50 SER OG : rot 180:sc= 0 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 HIS : no HE2:sc= 0.292 K(o=0.29,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.780 18.334 -2.607 1.00 10.00 N ATOM 2 CA GLY A 1 19.154 17.907 -2.961 1.00 10.00 C ATOM 3 C GLY A 1 19.664 16.825 -2.042 1.00 10.00 C ATOM 4 O GLY A 1 19.216 16.716 -0.896 1.00 10.00 O ATOM 0 H1 GLY A 1 17.127 18.072 -3.373 1.00 10.00 H new ATOM 0 H2 GLY A 1 17.487 17.865 -1.726 1.00 10.00 H new ATOM 0 H3 GLY A 1 17.761 19.365 -2.473 1.00 10.00 H new ATOM 0 HA2 GLY A 1 19.168 17.546 -3.989 1.00 10.00 H new ATOM 0 HA3 GLY A 1 19.823 18.766 -2.916 1.00 10.00 H new ATOM 10 N SER A 2 20.588 16.015 -2.537 1.00 10.00 N ATOM 11 CA SER A 2 21.160 14.938 -1.748 1.00 10.00 C ATOM 12 C SER A 2 22.443 15.409 -1.064 1.00 10.00 C ATOM 13 O SER A 2 23.442 15.687 -1.725 1.00 10.00 O ATOM 14 CB SER A 2 21.437 13.726 -2.638 1.00 10.00 C ATOM 15 OG SER A 2 20.323 13.452 -3.475 1.00 10.00 O ATOM 0 H SER A 2 20.958 16.085 -3.485 1.00 10.00 H new ATOM 0 HA SER A 2 20.447 14.646 -0.977 1.00 10.00 H new ATOM 0 HB2 SER A 2 22.320 13.912 -3.249 1.00 10.00 H new ATOM 0 HB3 SER A 2 21.655 12.856 -2.019 1.00 10.00 H new ATOM 0 HG SER A 2 20.520 12.674 -4.038 1.00 10.00 H new ATOM 21 N PRO A 3 22.427 15.520 0.270 1.00 10.00 N ATOM 22 CA PRO A 3 23.584 15.973 1.036 1.00 10.00 C ATOM 23 C PRO A 3 24.637 14.874 1.216 1.00 10.00 C ATOM 24 O PRO A 3 24.299 13.694 1.304 1.00 10.00 O ATOM 25 CB PRO A 3 22.977 16.359 2.382 1.00 10.00 C ATOM 26 CG PRO A 3 21.780 15.488 2.530 1.00 10.00 C ATOM 27 CD PRO A 3 21.276 15.206 1.138 1.00 10.00 C ATOM 0 HA PRO A 3 24.112 16.786 0.538 1.00 10.00 H new ATOM 0 HB2 PRO A 3 23.685 16.198 3.195 1.00 10.00 H new ATOM 0 HB3 PRO A 3 22.702 17.414 2.403 1.00 10.00 H new ATOM 0 HG2 PRO A 3 22.036 14.562 3.044 1.00 10.00 H new ATOM 0 HG3 PRO A 3 21.013 15.982 3.127 1.00 10.00 H new ATOM 0 HD2 PRO A 3 20.966 14.167 1.029 1.00 10.00 H new ATOM 0 HD3 PRO A 3 20.412 15.824 0.894 1.00 10.00 H new ATOM 35 N PRO A 4 25.932 15.249 1.286 1.00 10.00 N ATOM 36 CA PRO A 4 27.027 14.288 1.466 1.00 10.00 C ATOM 37 C PRO A 4 26.995 13.641 2.849 1.00 10.00 C ATOM 38 O PRO A 4 27.716 12.680 3.119 1.00 10.00 O ATOM 39 CB PRO A 4 28.299 15.136 1.308 1.00 10.00 C ATOM 40 CG PRO A 4 27.848 16.427 0.715 1.00 10.00 C ATOM 41 CD PRO A 4 26.436 16.627 1.182 1.00 10.00 C ATOM 0 HA PRO A 4 26.963 13.467 0.752 1.00 10.00 H new ATOM 0 HB2 PRO A 4 28.786 15.295 2.270 1.00 10.00 H new ATOM 0 HB3 PRO A 4 29.023 14.640 0.662 1.00 10.00 H new ATOM 0 HG2 PRO A 4 28.486 17.249 1.039 1.00 10.00 H new ATOM 0 HG3 PRO A 4 27.898 16.395 -0.373 1.00 10.00 H new ATOM 0 HD2 PRO A 4 26.396 17.146 2.140 1.00 10.00 H new ATOM 0 HD3 PRO A 4 25.855 17.218 0.474 1.00 10.00 H new ATOM 49 N GLU A 5 26.156 14.182 3.721 1.00 10.00 N ATOM 50 CA GLU A 5 26.008 13.664 5.070 1.00 10.00 C ATOM 51 C GLU A 5 25.009 12.514 5.093 1.00 10.00 C ATOM 52 O GLU A 5 24.804 11.880 6.131 1.00 10.00 O ATOM 53 CB GLU A 5 25.561 14.776 6.016 1.00 10.00 C ATOM 54 CG GLU A 5 26.661 15.772 6.339 1.00 10.00 C ATOM 55 CD GLU A 5 27.850 15.118 7.013 1.00 10.00 C ATOM 56 OE1 GLU A 5 27.707 14.658 8.165 1.00 10.00 O ATOM 57 OE2 GLU A 5 28.929 15.057 6.395 1.00 10.00 O ATOM 0 H GLU A 5 25.564 14.986 3.514 1.00 10.00 H new ATOM 0 HA GLU A 5 26.974 13.287 5.406 1.00 10.00 H new ATOM 0 HB2 GLU A 5 24.720 15.307 5.569 1.00 10.00 H new ATOM 0 HB3 GLU A 5 25.200 14.331 6.943 1.00 10.00 H new ATOM 0 HG2 GLU A 5 26.989 16.258 5.420 1.00 10.00 H new ATOM 0 HG3 GLU A 5 26.263 16.552 6.987 1.00 10.00 H new ATOM 64 N ALA A 6 24.384 12.257 3.948 1.00 10.00 N ATOM 65 CA ALA A 6 23.420 11.176 3.821 1.00 10.00 C ATOM 66 C ALA A 6 24.129 9.901 3.408 1.00 10.00 C ATOM 67 O ALA A 6 25.056 9.942 2.596 1.00 10.00 O ATOM 68 CB ALA A 6 22.340 11.535 2.813 1.00 10.00 C ATOM 0 H ALA A 6 24.532 12.789 3.090 1.00 10.00 H new ATOM 0 HA ALA A 6 22.941 11.018 4.787 1.00 10.00 H new ATOM 0 HB1 ALA A 6 21.629 10.713 2.733 1.00 10.00 H new ATOM 0 HB2 ALA A 6 21.819 12.434 3.142 1.00 10.00 H new ATOM 0 HB3 ALA A 6 22.796 11.716 1.840 1.00 10.00 H new ATOM 74 N ASP A 7 23.701 8.776 3.960 1.00 10.00 N ATOM 75 CA ASP A 7 24.324 7.499 3.644 1.00 10.00 C ATOM 76 C ASP A 7 23.996 7.076 2.215 1.00 10.00 C ATOM 77 O ASP A 7 22.826 6.876 1.871 1.00 10.00 O ATOM 78 CB ASP A 7 23.877 6.418 4.628 1.00 10.00 C ATOM 79 CG ASP A 7 24.800 5.216 4.617 1.00 10.00 C ATOM 80 OD1 ASP A 7 24.735 4.419 3.658 1.00 10.00 O ATOM 81 OD2 ASP A 7 25.597 5.063 5.569 1.00 10.00 O ATOM 0 H ASP A 7 22.930 8.720 4.625 1.00 10.00 H new ATOM 0 HA ASP A 7 25.403 7.623 3.731 1.00 10.00 H new ATOM 0 HB2 ASP A 7 23.841 6.837 5.634 1.00 10.00 H new ATOM 0 HB3 ASP A 7 22.865 6.099 4.379 1.00 10.00 H new ATOM 86 N PRO A 8 25.031 6.929 1.365 1.00 10.00 N ATOM 87 CA PRO A 8 24.866 6.534 -0.042 1.00 10.00 C ATOM 88 C PRO A 8 24.159 5.192 -0.205 1.00 10.00 C ATOM 89 O PRO A 8 23.577 4.914 -1.251 1.00 10.00 O ATOM 90 CB PRO A 8 26.303 6.436 -0.565 1.00 10.00 C ATOM 91 CG PRO A 8 27.107 7.278 0.361 1.00 10.00 C ATOM 92 CD PRO A 8 26.448 7.153 1.703 1.00 10.00 C ATOM 0 HA PRO A 8 24.245 7.249 -0.581 1.00 10.00 H new ATOM 0 HB2 PRO A 8 26.654 5.404 -0.565 1.00 10.00 H new ATOM 0 HB3 PRO A 8 26.375 6.797 -1.591 1.00 10.00 H new ATOM 0 HG2 PRO A 8 28.142 6.938 0.400 1.00 10.00 H new ATOM 0 HG3 PRO A 8 27.125 8.316 0.029 1.00 10.00 H new ATOM 0 HD2 PRO A 8 26.860 6.324 2.278 1.00 10.00 H new ATOM 0 HD3 PRO A 8 26.581 8.054 2.302 1.00 10.00 H new ATOM 100 N ARG A 9 24.206 4.365 0.833 1.00 10.00 N ATOM 101 CA ARG A 9 23.578 3.053 0.796 1.00 10.00 C ATOM 102 C ARG A 9 22.123 3.142 1.231 1.00 10.00 C ATOM 103 O ARG A 9 21.252 2.491 0.654 1.00 10.00 O ATOM 104 CB ARG A 9 24.331 2.081 1.699 1.00 10.00 C ATOM 105 CG ARG A 9 25.788 1.900 1.314 1.00 10.00 C ATOM 106 CD ARG A 9 26.618 1.439 2.495 1.00 10.00 C ATOM 107 NE ARG A 9 26.705 2.462 3.534 1.00 10.00 N ATOM 108 CZ ARG A 9 27.751 2.606 4.344 1.00 10.00 C ATOM 109 NH1 ARG A 9 28.799 1.794 4.233 1.00 10.00 N ATOM 110 NH2 ARG A 9 27.752 3.564 5.262 1.00 10.00 N ATOM 0 H ARG A 9 24.675 4.582 1.713 1.00 10.00 H new ATOM 0 HA ARG A 9 23.613 2.686 -0.230 1.00 10.00 H new ATOM 0 HB2 ARG A 9 24.277 2.437 2.728 1.00 10.00 H new ATOM 0 HB3 ARG A 9 23.833 1.112 1.671 1.00 10.00 H new ATOM 0 HG2 ARG A 9 25.865 1.172 0.507 1.00 10.00 H new ATOM 0 HG3 ARG A 9 26.185 2.841 0.933 1.00 10.00 H new ATOM 0 HD2 ARG A 9 26.181 0.533 2.914 1.00 10.00 H new ATOM 0 HD3 ARG A 9 27.621 1.181 2.155 1.00 10.00 H new ATOM 0 HE ARG A 9 25.919 3.103 3.645 1.00 10.00 H new ATOM 0 HH11 ARG A 9 28.802 1.059 3.526 1.00 10.00 H new ATOM 0 HH12 ARG A 9 29.599 1.907 4.855 1.00 10.00 H new ATOM 0 HH21 ARG A 9 26.951 4.190 5.347 1.00 10.00 H new ATOM 0 HH22 ARG A 9 28.554 3.674 5.883 1.00 10.00 H new ATOM 124 N LEU A 10 21.863 3.955 2.248 1.00 10.00 N ATOM 125 CA LEU A 10 20.513 4.127 2.762 1.00 10.00 C ATOM 126 C LEU A 10 19.615 4.786 1.720 1.00 10.00 C ATOM 127 O LEU A 10 18.464 4.389 1.534 1.00 10.00 O ATOM 128 CB LEU A 10 20.520 4.963 4.039 1.00 10.00 C ATOM 129 CG LEU A 10 19.158 5.097 4.726 1.00 10.00 C ATOM 130 CD1 LEU A 10 18.711 3.762 5.295 1.00 10.00 C ATOM 131 CD2 LEU A 10 19.210 6.151 5.817 1.00 10.00 C ATOM 0 H LEU A 10 22.572 4.506 2.733 1.00 10.00 H new ATOM 0 HA LEU A 10 20.118 3.137 2.992 1.00 10.00 H new ATOM 0 HB2 LEU A 10 21.224 4.520 4.743 1.00 10.00 H new ATOM 0 HB3 LEU A 10 20.891 5.960 3.802 1.00 10.00 H new ATOM 0 HG LEU A 10 18.429 5.412 3.979 1.00 10.00 H new ATOM 0 HD11 LEU A 10 17.741 3.879 5.779 1.00 10.00 H new ATOM 0 HD12 LEU A 10 18.629 3.032 4.489 1.00 10.00 H new ATOM 0 HD13 LEU A 10 19.442 3.415 6.026 1.00 10.00 H new ATOM 0 HD21 LEU A 10 18.233 6.231 6.293 1.00 10.00 H new ATOM 0 HD22 LEU A 10 19.954 5.868 6.562 1.00 10.00 H new ATOM 0 HD23 LEU A 10 19.481 7.113 5.381 1.00 10.00 H new ATOM 143 N ILE A 11 20.149 5.788 1.034 1.00 10.00 N ATOM 144 CA ILE A 11 19.390 6.496 0.010 1.00 10.00 C ATOM 145 C ILE A 11 19.139 5.594 -1.203 1.00 10.00 C ATOM 146 O ILE A 11 18.222 5.825 -1.990 1.00 10.00 O ATOM 147 CB ILE A 11 20.105 7.800 -0.425 1.00 10.00 C ATOM 148 CG1 ILE A 11 19.198 8.637 -1.338 1.00 10.00 C ATOM 149 CG2 ILE A 11 21.425 7.486 -1.115 1.00 10.00 C ATOM 150 CD1 ILE A 11 19.763 10.004 -1.668 1.00 10.00 C ATOM 0 H ILE A 11 21.101 6.128 1.167 1.00 10.00 H new ATOM 0 HA ILE A 11 18.429 6.769 0.445 1.00 10.00 H new ATOM 0 HB ILE A 11 20.321 8.386 0.469 1.00 10.00 H new ATOM 0 HG12 ILE A 11 19.027 8.091 -2.265 1.00 10.00 H new ATOM 0 HG13 ILE A 11 18.228 8.761 -0.857 1.00 10.00 H new ATOM 0 HG21 ILE A 11 21.910 8.416 -1.412 1.00 10.00 H new ATOM 0 HG22 ILE A 11 22.074 6.941 -0.429 1.00 10.00 H new ATOM 0 HG23 ILE A 11 21.238 6.876 -1.999 1.00 10.00 H new ATOM 0 HD11 ILE A 11 19.068 10.538 -2.316 1.00 10.00 H new ATOM 0 HD12 ILE A 11 19.908 10.570 -0.748 1.00 10.00 H new ATOM 0 HD13 ILE A 11 20.720 9.889 -2.178 1.00 10.00 H new ATOM 162 N GLU A 12 19.929 4.533 -1.324 1.00 10.00 N ATOM 163 CA GLU A 12 19.788 3.603 -2.437 1.00 10.00 C ATOM 164 C GLU A 12 18.574 2.699 -2.255 1.00 10.00 C ATOM 165 O GLU A 12 18.147 2.032 -3.195 1.00 10.00 O ATOM 166 CB GLU A 12 21.051 2.761 -2.612 1.00 10.00 C ATOM 167 CG GLU A 12 22.055 3.385 -3.567 1.00 10.00 C ATOM 168 CD GLU A 12 21.429 3.777 -4.888 1.00 10.00 C ATOM 169 OE1 GLU A 12 21.375 2.929 -5.800 1.00 10.00 O ATOM 170 OE2 GLU A 12 20.988 4.940 -5.022 1.00 10.00 O ATOM 0 H GLU A 12 20.672 4.296 -0.666 1.00 10.00 H new ATOM 0 HA GLU A 12 19.639 4.197 -3.339 1.00 10.00 H new ATOM 0 HB2 GLU A 12 21.523 2.618 -1.640 1.00 10.00 H new ATOM 0 HB3 GLU A 12 20.774 1.773 -2.980 1.00 10.00 H new ATOM 0 HG2 GLU A 12 22.496 4.266 -3.101 1.00 10.00 H new ATOM 0 HG3 GLU A 12 22.867 2.680 -3.748 1.00 10.00 H new ATOM 177 N SER A 13 18.016 2.680 -1.049 1.00 10.00 N ATOM 178 CA SER A 13 16.839 1.863 -0.770 1.00 10.00 C ATOM 179 C SER A 13 15.667 2.308 -1.645 1.00 10.00 C ATOM 180 O SER A 13 14.835 1.498 -2.053 1.00 10.00 O ATOM 181 CB SER A 13 16.466 1.955 0.713 1.00 10.00 C ATOM 182 OG SER A 13 17.617 1.837 1.536 1.00 10.00 O ATOM 0 H SER A 13 18.357 3.218 -0.252 1.00 10.00 H new ATOM 0 HA SER A 13 17.071 0.824 -1.003 1.00 10.00 H new ATOM 0 HB2 SER A 13 15.971 2.906 0.909 1.00 10.00 H new ATOM 0 HB3 SER A 13 15.754 1.168 0.962 1.00 10.00 H new ATOM 0 HG SER A 13 17.990 2.727 1.706 1.00 10.00 H new ATOM 188 N LEU A 14 15.627 3.600 -1.954 1.00 10.00 N ATOM 189 CA LEU A 14 14.572 4.149 -2.794 1.00 10.00 C ATOM 190 C LEU A 14 14.800 3.747 -4.246 1.00 10.00 C ATOM 191 O LEU A 14 13.870 3.334 -4.943 1.00 10.00 O ATOM 192 CB LEU A 14 14.530 5.676 -2.681 1.00 10.00 C ATOM 193 CG LEU A 14 14.216 6.224 -1.287 1.00 10.00 C ATOM 194 CD1 LEU A 14 15.446 6.877 -0.676 1.00 10.00 C ATOM 195 CD2 LEU A 14 13.065 7.215 -1.355 1.00 10.00 C ATOM 0 H LEU A 14 16.313 4.285 -1.635 1.00 10.00 H new ATOM 0 HA LEU A 14 13.618 3.748 -2.453 1.00 10.00 H new ATOM 0 HB2 LEU A 14 15.493 6.073 -3.000 1.00 10.00 H new ATOM 0 HB3 LEU A 14 13.782 6.054 -3.378 1.00 10.00 H new ATOM 0 HG LEU A 14 13.920 5.391 -0.649 1.00 10.00 H new ATOM 0 HD11 LEU A 14 15.201 7.260 0.315 1.00 10.00 H new ATOM 0 HD12 LEU A 14 16.245 6.141 -0.593 1.00 10.00 H new ATOM 0 HD13 LEU A 14 15.775 7.699 -1.311 1.00 10.00 H new ATOM 0 HD21 LEU A 14 12.853 7.596 -0.356 1.00 10.00 H new ATOM 0 HD22 LEU A 14 13.336 8.043 -2.009 1.00 10.00 H new ATOM 0 HD23 LEU A 14 12.179 6.717 -1.749 1.00 10.00 H new ATOM 207 N SER A 15 16.048 3.860 -4.689 1.00 10.00 N ATOM 208 CA SER A 15 16.422 3.514 -6.050 1.00 10.00 C ATOM 209 C SER A 15 16.217 2.020 -6.313 1.00 10.00 C ATOM 210 O SER A 15 15.800 1.622 -7.404 1.00 10.00 O ATOM 211 CB SER A 15 17.885 3.897 -6.288 1.00 10.00 C ATOM 212 OG SER A 15 18.307 4.889 -5.359 1.00 10.00 O ATOM 0 H SER A 15 16.823 4.193 -4.115 1.00 10.00 H new ATOM 0 HA SER A 15 15.783 4.066 -6.740 1.00 10.00 H new ATOM 0 HB2 SER A 15 18.516 3.013 -6.195 1.00 10.00 H new ATOM 0 HB3 SER A 15 18.007 4.270 -7.305 1.00 10.00 H new ATOM 0 HG SER A 15 19.286 4.939 -5.356 1.00 10.00 H new ATOM 218 N GLN A 16 16.498 1.205 -5.296 1.00 10.00 N ATOM 219 CA GLN A 16 16.353 -0.247 -5.394 1.00 10.00 C ATOM 220 C GLN A 16 14.912 -0.641 -5.701 1.00 10.00 C ATOM 221 O GLN A 16 14.664 -1.597 -6.440 1.00 10.00 O ATOM 222 CB GLN A 16 16.810 -0.914 -4.092 1.00 10.00 C ATOM 223 CG GLN A 16 16.784 -2.435 -4.135 1.00 10.00 C ATOM 224 CD GLN A 16 17.717 -3.003 -5.188 1.00 10.00 C ATOM 225 OE1 GLN A 16 18.904 -3.202 -4.938 1.00 10.00 O ATOM 226 NE2 GLN A 16 17.184 -3.271 -6.369 1.00 10.00 N ATOM 0 H GLN A 16 16.830 1.530 -4.388 1.00 10.00 H new ATOM 0 HA GLN A 16 16.982 -0.591 -6.215 1.00 10.00 H new ATOM 0 HB2 GLN A 16 17.823 -0.584 -3.863 1.00 10.00 H new ATOM 0 HB3 GLN A 16 16.172 -0.573 -3.277 1.00 10.00 H new ATOM 0 HG2 GLN A 16 17.063 -2.828 -3.157 1.00 10.00 H new ATOM 0 HG3 GLN A 16 15.767 -2.772 -4.335 1.00 10.00 H new ATOM 0 HE21 GLN A 16 16.194 -3.091 -6.534 1.00 10.00 H new ATOM 0 HE22 GLN A 16 17.763 -3.658 -7.114 1.00 10.00 H new ATOM 235 N MET A 17 13.964 0.093 -5.132 1.00 10.00 N ATOM 236 CA MET A 17 12.550 -0.186 -5.356 1.00 10.00 C ATOM 237 C MET A 17 12.197 0.039 -6.819 1.00 10.00 C ATOM 238 O MET A 17 11.396 -0.696 -7.400 1.00 10.00 O ATOM 239 CB MET A 17 11.673 0.695 -4.457 1.00 10.00 C ATOM 240 CG MET A 17 11.973 0.553 -2.974 1.00 10.00 C ATOM 241 SD MET A 17 11.801 -1.141 -2.376 1.00 10.00 S ATOM 242 CE MET A 17 10.024 -1.264 -2.205 1.00 10.00 C ATOM 0 H MET A 17 14.147 0.884 -4.514 1.00 10.00 H new ATOM 0 HA MET A 17 12.361 -1.229 -5.103 1.00 10.00 H new ATOM 0 HB2 MET A 17 11.805 1.738 -4.746 1.00 10.00 H new ATOM 0 HB3 MET A 17 10.626 0.446 -4.631 1.00 10.00 H new ATOM 0 HG2 MET A 17 12.988 0.899 -2.780 1.00 10.00 H new ATOM 0 HG3 MET A 17 11.302 1.201 -2.410 1.00 10.00 H new ATOM 0 HE1 MET A 17 9.772 -1.466 -1.164 1.00 10.00 H new ATOM 0 HE2 MET A 17 9.563 -0.326 -2.515 1.00 10.00 H new ATOM 0 HE3 MET A 17 9.653 -2.075 -2.832 1.00 10.00 H new ATOM 252 N LEU A 18 12.823 1.046 -7.414 1.00 10.00 N ATOM 253 CA LEU A 18 12.591 1.377 -8.812 1.00 10.00 C ATOM 254 C LEU A 18 13.060 0.239 -9.714 1.00 10.00 C ATOM 255 O LEU A 18 12.355 -0.154 -10.646 1.00 10.00 O ATOM 256 CB LEU A 18 13.312 2.676 -9.172 1.00 10.00 C ATOM 257 CG LEU A 18 13.036 3.212 -10.578 1.00 10.00 C ATOM 258 CD1 LEU A 18 11.561 3.539 -10.742 1.00 10.00 C ATOM 259 CD2 LEU A 18 13.891 4.440 -10.857 1.00 10.00 C ATOM 0 H LEU A 18 13.499 1.650 -6.946 1.00 10.00 H new ATOM 0 HA LEU A 18 11.521 1.518 -8.965 1.00 10.00 H new ATOM 0 HB2 LEU A 18 13.030 3.441 -8.448 1.00 10.00 H new ATOM 0 HB3 LEU A 18 14.385 2.517 -9.066 1.00 10.00 H new ATOM 0 HG LEU A 18 13.299 2.439 -11.300 1.00 10.00 H new ATOM 0 HD11 LEU A 18 11.382 3.919 -11.748 1.00 10.00 H new ATOM 0 HD12 LEU A 18 10.969 2.638 -10.584 1.00 10.00 H new ATOM 0 HD13 LEU A 18 11.273 4.295 -10.012 1.00 10.00 H new ATOM 0 HD21 LEU A 18 13.682 4.808 -11.861 1.00 10.00 H new ATOM 0 HD22 LEU A 18 13.659 5.218 -10.130 1.00 10.00 H new ATOM 0 HD23 LEU A 18 14.945 4.174 -10.780 1.00 10.00 H new ATOM 271 N SER A 19 14.237 -0.305 -9.417 1.00 10.00 N ATOM 272 CA SER A 19 14.787 -1.405 -10.201 1.00 10.00 C ATOM 273 C SER A 19 13.949 -2.666 -10.017 1.00 10.00 C ATOM 274 O SER A 19 13.901 -3.531 -10.892 1.00 10.00 O ATOM 275 CB SER A 19 16.239 -1.676 -9.789 1.00 10.00 C ATOM 276 OG SER A 19 16.740 -0.636 -8.962 1.00 10.00 O ATOM 0 H SER A 19 14.826 -0.003 -8.641 1.00 10.00 H new ATOM 0 HA SER A 19 14.764 -1.122 -11.253 1.00 10.00 H new ATOM 0 HB2 SER A 19 16.298 -2.626 -9.259 1.00 10.00 H new ATOM 0 HB3 SER A 19 16.861 -1.768 -10.679 1.00 10.00 H new ATOM 0 HG SER A 19 17.667 -0.834 -8.712 1.00 10.00 H new ATOM 282 N MET A 20 13.287 -2.757 -8.869 1.00 10.00 N ATOM 283 CA MET A 20 12.448 -3.904 -8.551 1.00 10.00 C ATOM 284 C MET A 20 11.132 -3.838 -9.323 1.00 10.00 C ATOM 285 O MET A 20 10.437 -4.846 -9.483 1.00 10.00 O ATOM 286 CB MET A 20 12.180 -3.949 -7.044 1.00 10.00 C ATOM 287 CG MET A 20 11.609 -5.272 -6.560 1.00 10.00 C ATOM 288 SD MET A 20 11.407 -5.324 -4.769 1.00 10.00 S ATOM 289 CE MET A 20 13.099 -5.114 -4.221 1.00 10.00 C ATOM 0 H MET A 20 13.316 -2.045 -8.140 1.00 10.00 H new ATOM 0 HA MET A 20 12.971 -4.814 -8.846 1.00 10.00 H new ATOM 0 HB2 MET A 20 13.111 -3.750 -6.513 1.00 10.00 H new ATOM 0 HB3 MET A 20 11.487 -3.149 -6.784 1.00 10.00 H new ATOM 0 HG2 MET A 20 10.644 -5.443 -7.036 1.00 10.00 H new ATOM 0 HG3 MET A 20 12.267 -6.083 -6.872 1.00 10.00 H new ATOM 0 HE1 MET A 20 13.188 -5.438 -3.184 1.00 10.00 H new ATOM 0 HE2 MET A 20 13.761 -5.713 -4.847 1.00 10.00 H new ATOM 0 HE3 MET A 20 13.379 -4.063 -4.298 1.00 10.00 H new ATOM 299 N GLY A 21 10.807 -2.650 -9.813 1.00 10.00 N ATOM 300 CA GLY A 21 9.583 -2.466 -10.568 1.00 10.00 C ATOM 301 C GLY A 21 8.482 -1.846 -9.738 1.00 10.00 C ATOM 302 O GLY A 21 7.323 -1.814 -10.157 1.00 10.00 O ATOM 0 H GLY A 21 11.371 -1.807 -9.701 1.00 10.00 H new ATOM 0 HA2 GLY A 21 9.784 -1.832 -11.432 1.00 10.00 H new ATOM 0 HA3 GLY A 21 9.247 -3.430 -10.951 1.00 10.00 H new ATOM 306 N PHE A 22 8.838 -1.351 -8.557 1.00 10.00 N ATOM 307 CA PHE A 22 7.873 -0.725 -7.668 1.00 10.00 C ATOM 308 C PHE A 22 7.777 0.765 -7.969 1.00 10.00 C ATOM 309 O PHE A 22 8.776 1.484 -7.929 1.00 10.00 O ATOM 310 CB PHE A 22 8.278 -0.942 -6.205 1.00 10.00 C ATOM 311 CG PHE A 22 7.120 -1.065 -5.251 1.00 10.00 C ATOM 312 CD1 PHE A 22 6.040 -0.197 -5.326 1.00 10.00 C ATOM 313 CD2 PHE A 22 7.114 -2.049 -4.277 1.00 10.00 C ATOM 314 CE1 PHE A 22 4.984 -0.312 -4.445 1.00 10.00 C ATOM 315 CE2 PHE A 22 6.060 -2.166 -3.395 1.00 10.00 C ATOM 316 CZ PHE A 22 4.993 -1.296 -3.480 1.00 10.00 C ATOM 0 H PHE A 22 9.791 -1.373 -8.195 1.00 10.00 H new ATOM 0 HA PHE A 22 6.898 -1.183 -7.831 1.00 10.00 H new ATOM 0 HB2 PHE A 22 8.885 -1.845 -6.139 1.00 10.00 H new ATOM 0 HB3 PHE A 22 8.908 -0.111 -5.888 1.00 10.00 H new ATOM 0 HD1 PHE A 22 6.026 0.576 -6.081 1.00 10.00 H new ATOM 0 HD2 PHE A 22 7.946 -2.734 -4.207 1.00 10.00 H new ATOM 0 HE1 PHE A 22 4.149 0.370 -4.512 1.00 10.00 H new ATOM 0 HE2 PHE A 22 6.070 -2.937 -2.639 1.00 10.00 H new ATOM 0 HZ PHE A 22 4.166 -1.386 -2.791 1.00 10.00 H new ATOM 326 N SER A 23 6.573 1.216 -8.268 1.00 10.00 N ATOM 327 CA SER A 23 6.339 2.614 -8.576 1.00 10.00 C ATOM 328 C SER A 23 4.981 3.050 -8.043 1.00 10.00 C ATOM 329 O SER A 23 3.996 2.314 -8.144 1.00 10.00 O ATOM 330 CB SER A 23 6.420 2.841 -10.087 1.00 10.00 C ATOM 331 OG SER A 23 6.713 1.630 -10.770 1.00 10.00 O ATOM 0 H SER A 23 5.738 0.631 -8.304 1.00 10.00 H new ATOM 0 HA SER A 23 7.109 3.215 -8.093 1.00 10.00 H new ATOM 0 HB2 SER A 23 5.475 3.247 -10.448 1.00 10.00 H new ATOM 0 HB3 SER A 23 7.189 3.581 -10.306 1.00 10.00 H new ATOM 0 HG SER A 23 6.758 1.801 -11.734 1.00 10.00 H new ATOM 337 N ASP A 24 4.934 4.234 -7.456 1.00 10.00 N ATOM 338 CA ASP A 24 3.696 4.761 -6.905 1.00 10.00 C ATOM 339 C ASP A 24 3.252 6.004 -7.662 1.00 10.00 C ATOM 340 O ASP A 24 3.974 6.996 -7.737 1.00 10.00 O ATOM 341 CB ASP A 24 3.854 5.065 -5.411 1.00 10.00 C ATOM 342 CG ASP A 24 4.990 6.026 -5.088 1.00 10.00 C ATOM 343 OD1 ASP A 24 6.068 5.925 -5.709 1.00 10.00 O ATOM 344 OD2 ASP A 24 4.813 6.868 -4.184 1.00 10.00 O ATOM 0 H ASP A 24 5.740 4.850 -7.348 1.00 10.00 H new ATOM 0 HA ASP A 24 2.924 4.000 -7.019 1.00 10.00 H new ATOM 0 HB2 ASP A 24 2.920 5.484 -5.036 1.00 10.00 H new ATOM 0 HB3 ASP A 24 4.021 4.130 -4.877 1.00 10.00 H new ATOM 349 N GLU A 25 2.049 5.946 -8.218 1.00 10.00 N ATOM 350 CA GLU A 25 1.506 7.058 -8.988 1.00 10.00 C ATOM 351 C GLU A 25 0.867 8.088 -8.070 1.00 10.00 C ATOM 352 O GLU A 25 1.059 9.293 -8.240 1.00 10.00 O ATOM 353 CB GLU A 25 0.472 6.567 -10.011 1.00 10.00 C ATOM 354 CG GLU A 25 0.418 5.053 -10.159 1.00 10.00 C ATOM 355 CD GLU A 25 -0.528 4.402 -9.169 1.00 10.00 C ATOM 356 OE1 GLU A 25 -0.237 4.423 -7.952 1.00 10.00 O ATOM 357 OE2 GLU A 25 -1.567 3.861 -9.605 1.00 10.00 O ATOM 0 H GLU A 25 1.429 5.139 -8.150 1.00 10.00 H new ATOM 0 HA GLU A 25 2.334 7.523 -9.523 1.00 10.00 H new ATOM 0 HB2 GLU A 25 -0.514 6.928 -9.718 1.00 10.00 H new ATOM 0 HB3 GLU A 25 0.698 7.009 -10.981 1.00 10.00 H new ATOM 0 HG2 GLU A 25 0.106 4.802 -11.173 1.00 10.00 H new ATOM 0 HG3 GLU A 25 1.419 4.643 -10.023 1.00 10.00 H new ATOM 364 N GLY A 26 0.120 7.607 -7.085 1.00 10.00 N ATOM 365 CA GLY A 26 -0.543 8.497 -6.148 1.00 10.00 C ATOM 366 C GLY A 26 0.387 8.985 -5.054 1.00 10.00 C ATOM 367 O GLY A 26 -0.032 9.719 -4.159 1.00 10.00 O ATOM 0 H GLY A 26 -0.040 6.614 -6.917 1.00 10.00 H new ATOM 0 HA2 GLY A 26 -0.945 9.354 -6.688 1.00 10.00 H new ATOM 0 HA3 GLY A 26 -1.389 7.979 -5.697 1.00 10.00 H new ATOM 371 N GLY A 27 1.652 8.581 -5.134 1.00 10.00 N ATOM 372 CA GLY A 27 2.630 8.981 -4.143 1.00 10.00 C ATOM 373 C GLY A 27 2.385 8.319 -2.803 1.00 10.00 C ATOM 374 O GLY A 27 2.548 8.942 -1.756 1.00 10.00 O ATOM 0 H GLY A 27 2.017 7.980 -5.873 1.00 10.00 H new ATOM 0 HA2 GLY A 27 3.629 8.725 -4.496 1.00 10.00 H new ATOM 0 HA3 GLY A 27 2.602 10.064 -4.023 1.00 10.00 H new ATOM 378 N TRP A 28 1.998 7.049 -2.831 1.00 10.00 N ATOM 379 CA TRP A 28 1.714 6.320 -1.605 1.00 10.00 C ATOM 380 C TRP A 28 2.953 5.594 -1.072 1.00 10.00 C ATOM 381 O TRP A 28 3.151 5.507 0.140 1.00 10.00 O ATOM 382 CB TRP A 28 0.540 5.347 -1.818 1.00 10.00 C ATOM 383 CG TRP A 28 0.805 4.208 -2.760 1.00 10.00 C ATOM 384 CD1 TRP A 28 0.700 4.217 -4.121 1.00 10.00 C ATOM 385 CD2 TRP A 28 1.188 2.878 -2.391 1.00 10.00 C ATOM 386 NE1 TRP A 28 0.998 2.972 -4.623 1.00 10.00 N ATOM 387 CE2 TRP A 28 1.301 2.133 -3.578 1.00 10.00 C ATOM 388 CE3 TRP A 28 1.446 2.248 -1.170 1.00 10.00 C ATOM 389 CZ2 TRP A 28 1.663 0.786 -3.577 1.00 10.00 C ATOM 390 CZ3 TRP A 28 1.805 0.915 -1.170 1.00 10.00 C ATOM 391 CH2 TRP A 28 1.910 0.196 -2.367 1.00 10.00 C ATOM 0 H TRP A 28 1.875 6.507 -3.686 1.00 10.00 H new ATOM 0 HA TRP A 28 1.424 7.046 -0.845 1.00 10.00 H new ATOM 0 HB2 TRP A 28 0.252 4.936 -0.851 1.00 10.00 H new ATOM 0 HB3 TRP A 28 -0.314 5.912 -2.191 1.00 10.00 H new ATOM 0 HD1 TRP A 28 0.424 5.075 -4.716 1.00 10.00 H new ATOM 0 HE1 TRP A 28 0.995 2.714 -5.610 1.00 10.00 H new ATOM 0 HE3 TRP A 28 1.366 2.795 -0.242 1.00 10.00 H new ATOM 0 HZ2 TRP A 28 1.745 0.228 -4.498 1.00 10.00 H new ATOM 0 HZ3 TRP A 28 2.008 0.419 -0.232 1.00 10.00 H new ATOM 0 HH2 TRP A 28 2.192 -0.846 -2.335 1.00 10.00 H new ATOM 402 N LEU A 29 3.806 5.116 -1.970 1.00 10.00 N ATOM 403 CA LEU A 29 5.016 4.405 -1.566 1.00 10.00 C ATOM 404 C LEU A 29 6.024 5.377 -0.968 1.00 10.00 C ATOM 405 O LEU A 29 6.735 5.043 -0.022 1.00 10.00 O ATOM 406 CB LEU A 29 5.642 3.667 -2.751 1.00 10.00 C ATOM 407 CG LEU A 29 7.004 3.025 -2.469 1.00 10.00 C ATOM 408 CD1 LEU A 29 6.844 1.751 -1.652 1.00 10.00 C ATOM 409 CD2 LEU A 29 7.738 2.736 -3.771 1.00 10.00 C ATOM 0 H LEU A 29 3.685 5.206 -2.979 1.00 10.00 H new ATOM 0 HA LEU A 29 4.738 3.669 -0.812 1.00 10.00 H new ATOM 0 HB2 LEU A 29 4.952 2.890 -3.081 1.00 10.00 H new ATOM 0 HB3 LEU A 29 5.752 4.368 -3.579 1.00 10.00 H new ATOM 0 HG LEU A 29 7.598 3.730 -1.886 1.00 10.00 H new ATOM 0 HD11 LEU A 29 7.825 1.313 -1.465 1.00 10.00 H new ATOM 0 HD12 LEU A 29 6.364 1.986 -0.702 1.00 10.00 H new ATOM 0 HD13 LEU A 29 6.229 1.040 -2.203 1.00 10.00 H new ATOM 0 HD21 LEU A 29 8.703 2.280 -3.551 1.00 10.00 H new ATOM 0 HD22 LEU A 29 7.145 2.053 -4.379 1.00 10.00 H new ATOM 0 HD23 LEU A 29 7.892 3.667 -4.316 1.00 10.00 H new ATOM 421 N THR A 30 6.070 6.587 -1.522 1.00 10.00 N ATOM 422 CA THR A 30 6.980 7.616 -1.038 1.00 10.00 C ATOM 423 C THR A 30 6.662 7.971 0.418 1.00 10.00 C ATOM 424 O THR A 30 7.509 8.484 1.150 1.00 10.00 O ATOM 425 CB THR A 30 6.926 8.875 -1.945 1.00 10.00 C ATOM 426 OG1 THR A 30 8.224 9.469 -2.046 1.00 10.00 O ATOM 427 CG2 THR A 30 5.935 9.911 -1.429 1.00 10.00 C ATOM 0 H THR A 30 5.486 6.876 -2.307 1.00 10.00 H new ATOM 0 HA THR A 30 7.996 7.222 -1.078 1.00 10.00 H new ATOM 0 HB THR A 30 6.590 8.547 -2.929 1.00 10.00 H new ATOM 0 HG1 THR A 30 8.178 10.261 -2.622 1.00 10.00 H new ATOM 0 HG21 THR A 30 5.931 10.774 -2.095 1.00 10.00 H new ATOM 0 HG22 THR A 30 4.937 9.474 -1.395 1.00 10.00 H new ATOM 0 HG23 THR A 30 6.227 10.227 -0.427 1.00 10.00 H new ATOM 435 N ARG A 31 5.433 7.673 0.832 1.00 10.00 N ATOM 436 CA ARG A 31 4.997 7.933 2.194 1.00 10.00 C ATOM 437 C ARG A 31 5.200 6.686 3.047 1.00 10.00 C ATOM 438 O ARG A 31 5.545 6.773 4.225 1.00 10.00 O ATOM 439 CB ARG A 31 3.521 8.330 2.213 1.00 10.00 C ATOM 440 CG ARG A 31 3.182 9.431 1.222 1.00 10.00 C ATOM 441 CD ARG A 31 3.274 10.809 1.852 1.00 10.00 C ATOM 442 NE ARG A 31 2.048 11.160 2.558 1.00 10.00 N ATOM 443 CZ ARG A 31 1.456 12.350 2.488 1.00 10.00 C ATOM 444 NH1 ARG A 31 1.992 13.323 1.755 1.00 10.00 N ATOM 445 NH2 ARG A 31 0.325 12.561 3.144 1.00 10.00 N ATOM 0 H ARG A 31 4.721 7.249 0.237 1.00 10.00 H new ATOM 0 HA ARG A 31 5.589 8.753 2.600 1.00 10.00 H new ATOM 0 HB2 ARG A 31 2.913 7.453 1.993 1.00 10.00 H new ATOM 0 HB3 ARG A 31 3.253 8.659 3.217 1.00 10.00 H new ATOM 0 HG2 ARG A 31 3.861 9.375 0.371 1.00 10.00 H new ATOM 0 HG3 ARG A 31 2.174 9.275 0.837 1.00 10.00 H new ATOM 0 HD2 ARG A 31 4.114 10.837 2.545 1.00 10.00 H new ATOM 0 HD3 ARG A 31 3.474 11.551 1.079 1.00 10.00 H new ATOM 0 HE ARG A 31 1.615 10.446 3.144 1.00 10.00 H new ATOM 0 HH11 ARG A 31 2.859 13.158 1.244 1.00 10.00 H new ATOM 0 HH12 ARG A 31 1.535 14.234 1.704 1.00 10.00 H new ATOM 0 HH21 ARG A 31 -0.089 11.813 3.700 1.00 10.00 H new ATOM 0 HH22 ARG A 31 -0.132 13.472 3.093 1.00 10.00 H new ATOM 459 N LEU A 32 5.002 5.528 2.428 1.00 10.00 N ATOM 460 CA LEU A 32 5.151 4.240 3.099 1.00 10.00 C ATOM 461 C LEU A 32 6.583 4.040 3.587 1.00 10.00 C ATOM 462 O LEU A 32 6.813 3.505 4.674 1.00 10.00 O ATOM 463 CB LEU A 32 4.761 3.109 2.142 1.00 10.00 C ATOM 464 CG LEU A 32 4.562 1.742 2.790 1.00 10.00 C ATOM 465 CD1 LEU A 32 3.152 1.613 3.342 1.00 10.00 C ATOM 466 CD2 LEU A 32 4.857 0.630 1.794 1.00 10.00 C ATOM 0 H LEU A 32 4.734 5.454 1.447 1.00 10.00 H new ATOM 0 HA LEU A 32 4.491 4.225 3.966 1.00 10.00 H new ATOM 0 HB2 LEU A 32 3.839 3.389 1.633 1.00 10.00 H new ATOM 0 HB3 LEU A 32 5.533 3.021 1.377 1.00 10.00 H new ATOM 0 HG LEU A 32 5.262 1.649 3.620 1.00 10.00 H new ATOM 0 HD11 LEU A 32 3.029 0.632 3.800 1.00 10.00 H new ATOM 0 HD12 LEU A 32 2.982 2.387 4.091 1.00 10.00 H new ATOM 0 HD13 LEU A 32 2.432 1.728 2.532 1.00 10.00 H new ATOM 0 HD21 LEU A 32 4.710 -0.337 2.274 1.00 10.00 H new ATOM 0 HD22 LEU A 32 4.184 0.718 0.941 1.00 10.00 H new ATOM 0 HD23 LEU A 32 5.889 0.712 1.452 1.00 10.00 H new ATOM 478 N LEU A 33 7.542 4.493 2.787 1.00 10.00 N ATOM 479 CA LEU A 33 8.958 4.368 3.127 1.00 10.00 C ATOM 480 C LEU A 33 9.324 5.240 4.329 1.00 10.00 C ATOM 481 O LEU A 33 10.413 5.122 4.889 1.00 10.00 O ATOM 482 CB LEU A 33 9.824 4.763 1.927 1.00 10.00 C ATOM 483 CG LEU A 33 9.735 3.831 0.715 1.00 10.00 C ATOM 484 CD1 LEU A 33 10.460 4.445 -0.472 1.00 10.00 C ATOM 485 CD2 LEU A 33 10.319 2.467 1.046 1.00 10.00 C ATOM 0 H LEU A 33 7.365 4.953 1.894 1.00 10.00 H new ATOM 0 HA LEU A 33 9.145 3.327 3.389 1.00 10.00 H new ATOM 0 HB2 LEU A 33 9.542 5.768 1.612 1.00 10.00 H new ATOM 0 HB3 LEU A 33 10.864 4.811 2.251 1.00 10.00 H new ATOM 0 HG LEU A 33 8.685 3.699 0.454 1.00 10.00 H new ATOM 0 HD11 LEU A 33 10.390 3.774 -1.328 1.00 10.00 H new ATOM 0 HD12 LEU A 33 10.002 5.402 -0.723 1.00 10.00 H new ATOM 0 HD13 LEU A 33 11.508 4.600 -0.217 1.00 10.00 H new ATOM 0 HD21 LEU A 33 10.247 1.819 0.173 1.00 10.00 H new ATOM 0 HD22 LEU A 33 11.366 2.578 1.330 1.00 10.00 H new ATOM 0 HD23 LEU A 33 9.764 2.025 1.873 1.00 10.00 H new ATOM 497 N GLN A 34 8.422 6.134 4.711 1.00 10.00 N ATOM 498 CA GLN A 34 8.663 7.012 5.843 1.00 10.00 C ATOM 499 C GLN A 34 8.048 6.443 7.116 1.00 10.00 C ATOM 500 O GLN A 34 8.614 6.570 8.201 1.00 10.00 O ATOM 501 CB GLN A 34 8.105 8.412 5.568 1.00 10.00 C ATOM 502 CG GLN A 34 8.565 9.001 4.242 1.00 10.00 C ATOM 503 CD GLN A 34 10.065 8.915 4.042 1.00 10.00 C ATOM 504 OE1 GLN A 34 10.845 9.017 4.994 1.00 10.00 O ATOM 505 NE2 GLN A 34 10.483 8.729 2.802 1.00 10.00 N ATOM 0 H GLN A 34 7.520 6.269 4.254 1.00 10.00 H new ATOM 0 HA GLN A 34 9.741 7.086 5.986 1.00 10.00 H new ATOM 0 HB2 GLN A 34 7.016 8.369 5.579 1.00 10.00 H new ATOM 0 HB3 GLN A 34 8.405 9.079 6.376 1.00 10.00 H new ATOM 0 HG2 GLN A 34 8.065 8.479 3.426 1.00 10.00 H new ATOM 0 HG3 GLN A 34 8.257 10.045 4.188 1.00 10.00 H new ATOM 0 HE21 GLN A 34 9.807 8.650 2.042 1.00 10.00 H new ATOM 0 HE22 GLN A 34 11.482 8.665 2.605 1.00 10.00 H new ATOM 514 N THR A 35 6.892 5.807 6.977 1.00 10.00 N ATOM 515 CA THR A 35 6.196 5.239 8.124 1.00 10.00 C ATOM 516 C THR A 35 6.720 3.847 8.472 1.00 10.00 C ATOM 517 O THR A 35 6.930 3.533 9.644 1.00 10.00 O ATOM 518 CB THR A 35 4.681 5.167 7.869 1.00 10.00 C ATOM 519 OG1 THR A 35 4.431 4.757 6.519 1.00 10.00 O ATOM 520 CG2 THR A 35 4.029 6.520 8.121 1.00 10.00 C ATOM 0 H THR A 35 6.418 5.672 6.084 1.00 10.00 H new ATOM 0 HA THR A 35 6.387 5.901 8.969 1.00 10.00 H new ATOM 0 HB THR A 35 4.251 4.438 8.556 1.00 10.00 H new ATOM 0 HG1 THR A 35 3.464 4.712 6.365 1.00 10.00 H new ATOM 0 HG21 THR A 35 2.957 6.448 7.935 1.00 10.00 H new ATOM 0 HG22 THR A 35 4.198 6.819 9.156 1.00 10.00 H new ATOM 0 HG23 THR A 35 4.464 7.263 7.453 1.00 10.00 H new ATOM 528 N LYS A 36 6.937 3.021 7.456 1.00 10.00 N ATOM 529 CA LYS A 36 7.429 1.663 7.666 1.00 10.00 C ATOM 530 C LYS A 36 8.944 1.596 7.487 1.00 10.00 C ATOM 531 O LYS A 36 9.523 0.510 7.430 1.00 10.00 O ATOM 532 CB LYS A 36 6.741 0.693 6.709 1.00 10.00 C ATOM 533 CG LYS A 36 5.385 0.205 7.199 1.00 10.00 C ATOM 534 CD LYS A 36 4.298 1.247 6.996 1.00 10.00 C ATOM 535 CE LYS A 36 3.014 0.867 7.716 1.00 10.00 C ATOM 536 NZ LYS A 36 2.896 1.548 9.032 1.00 10.00 N ATOM 0 H LYS A 36 6.780 3.267 6.478 1.00 10.00 H new ATOM 0 HA LYS A 36 7.193 1.373 8.690 1.00 10.00 H new ATOM 0 HB2 LYS A 36 6.614 1.180 5.742 1.00 10.00 H new ATOM 0 HB3 LYS A 36 7.391 -0.168 6.550 1.00 10.00 H new ATOM 0 HG2 LYS A 36 5.115 -0.708 6.669 1.00 10.00 H new ATOM 0 HG3 LYS A 36 5.451 -0.048 8.257 1.00 10.00 H new ATOM 0 HD2 LYS A 36 4.647 2.213 7.360 1.00 10.00 H new ATOM 0 HD3 LYS A 36 4.098 1.361 5.931 1.00 10.00 H new ATOM 0 HE2 LYS A 36 2.158 1.128 7.094 1.00 10.00 H new ATOM 0 HE3 LYS A 36 2.985 -0.213 7.862 1.00 10.00 H new ATOM 0 HZ1 LYS A 36 2.071 1.175 9.543 1.00 10.00 H new ATOM 0 HZ2 LYS A 36 3.756 1.375 9.591 1.00 10.00 H new ATOM 0 HZ3 LYS A 36 2.779 2.571 8.884 1.00 10.00 H new ATOM 550 N ASN A 37 9.569 2.771 7.409 1.00 10.00 N ATOM 551 CA ASN A 37 11.021 2.893 7.241 1.00 10.00 C ATOM 552 C ASN A 37 11.460 2.382 5.867 1.00 10.00 C ATOM 553 O ASN A 37 10.649 1.900 5.076 1.00 10.00 O ATOM 554 CB ASN A 37 11.763 2.138 8.359 1.00 10.00 C ATOM 555 CG ASN A 37 13.101 2.766 8.730 1.00 10.00 C ATOM 556 OD1 ASN A 37 13.772 3.382 7.898 1.00 10.00 O ATOM 557 ND2 ASN A 37 13.503 2.607 9.979 1.00 10.00 N ATOM 0 H ASN A 37 9.084 3.667 7.460 1.00 10.00 H new ATOM 0 HA ASN A 37 11.279 3.950 7.308 1.00 10.00 H new ATOM 0 HB2 ASN A 37 11.129 2.102 9.245 1.00 10.00 H new ATOM 0 HB3 ASN A 37 11.929 1.108 8.043 1.00 10.00 H new ATOM 0 HD21 ASN A 37 14.394 3.000 10.282 1.00 10.00 H new ATOM 0 HD22 ASN A 37 12.922 2.092 10.640 1.00 10.00 H new ATOM 564 N TYR A 38 12.746 2.491 5.586 1.00 10.00 N ATOM 565 CA TYR A 38 13.299 2.053 4.315 1.00 10.00 C ATOM 566 C TYR A 38 13.670 0.575 4.365 1.00 10.00 C ATOM 567 O TYR A 38 14.673 0.155 3.787 1.00 10.00 O ATOM 568 CB TYR A 38 14.527 2.890 3.955 1.00 10.00 C ATOM 569 CG TYR A 38 14.204 4.334 3.657 1.00 10.00 C ATOM 570 CD1 TYR A 38 13.544 4.688 2.489 1.00 10.00 C ATOM 571 CD2 TYR A 38 14.553 5.342 4.547 1.00 10.00 C ATOM 572 CE1 TYR A 38 13.241 6.005 2.211 1.00 10.00 C ATOM 573 CE2 TYR A 38 14.253 6.665 4.276 1.00 10.00 C ATOM 574 CZ TYR A 38 13.596 6.990 3.106 1.00 10.00 C ATOM 575 OH TYR A 38 13.291 8.304 2.831 1.00 10.00 O ATOM 0 H TYR A 38 13.434 2.883 6.228 1.00 10.00 H new ATOM 0 HA TYR A 38 12.538 2.191 3.547 1.00 10.00 H new ATOM 0 HB2 TYR A 38 15.240 2.848 4.778 1.00 10.00 H new ATOM 0 HB3 TYR A 38 15.016 2.449 3.087 1.00 10.00 H new ATOM 0 HD1 TYR A 38 13.262 3.919 1.785 1.00 10.00 H new ATOM 0 HD2 TYR A 38 15.066 5.089 5.463 1.00 10.00 H new ATOM 0 HE1 TYR A 38 12.728 6.262 1.296 1.00 10.00 H new ATOM 0 HE2 TYR A 38 14.531 7.439 4.976 1.00 10.00 H new ATOM 0 HH TYR A 38 13.608 8.874 3.563 1.00 10.00 H new ATOM 585 N ASP A 39 12.862 -0.211 5.059 1.00 10.00 N ATOM 586 CA ASP A 39 13.105 -1.642 5.174 1.00 10.00 C ATOM 587 C ASP A 39 12.391 -2.374 4.046 1.00 10.00 C ATOM 588 O ASP A 39 11.174 -2.570 4.090 1.00 10.00 O ATOM 589 CB ASP A 39 12.630 -2.161 6.534 1.00 10.00 C ATOM 590 CG ASP A 39 13.161 -3.548 6.844 1.00 10.00 C ATOM 591 OD1 ASP A 39 12.646 -4.528 6.270 1.00 10.00 O ATOM 592 OD2 ASP A 39 14.093 -3.664 7.673 1.00 10.00 O ATOM 0 H ASP A 39 12.031 0.117 5.552 1.00 10.00 H new ATOM 0 HA ASP A 39 14.176 -1.827 5.097 1.00 10.00 H new ATOM 0 HB2 ASP A 39 12.949 -1.470 7.315 1.00 10.00 H new ATOM 0 HB3 ASP A 39 11.540 -2.180 6.552 1.00 10.00 H new ATOM 597 N ILE A 40 13.156 -2.766 3.035 1.00 10.00 N ATOM 598 CA ILE A 40 12.615 -3.461 1.871 1.00 10.00 C ATOM 599 C ILE A 40 11.939 -4.773 2.270 1.00 10.00 C ATOM 600 O ILE A 40 10.913 -5.153 1.697 1.00 10.00 O ATOM 601 CB ILE A 40 13.720 -3.735 0.823 1.00 10.00 C ATOM 602 CG1 ILE A 40 14.347 -2.413 0.364 1.00 10.00 C ATOM 603 CG2 ILE A 40 13.157 -4.506 -0.370 1.00 10.00 C ATOM 604 CD1 ILE A 40 15.551 -2.587 -0.533 1.00 10.00 C ATOM 0 H ILE A 40 14.164 -2.613 2.997 1.00 10.00 H new ATOM 0 HA ILE A 40 11.864 -2.808 1.426 1.00 10.00 H new ATOM 0 HB ILE A 40 14.493 -4.349 1.285 1.00 10.00 H new ATOM 0 HG12 ILE A 40 13.594 -1.829 -0.164 1.00 10.00 H new ATOM 0 HG13 ILE A 40 14.640 -1.837 1.242 1.00 10.00 H new ATOM 0 HG21 ILE A 40 13.952 -4.687 -1.094 1.00 10.00 H new ATOM 0 HG22 ILE A 40 12.752 -5.459 -0.029 1.00 10.00 H new ATOM 0 HG23 ILE A 40 12.365 -3.922 -0.839 1.00 10.00 H new ATOM 0 HD11 ILE A 40 15.939 -1.608 -0.816 1.00 10.00 H new ATOM 0 HD12 ILE A 40 16.323 -3.143 -0.002 1.00 10.00 H new ATOM 0 HD13 ILE A 40 15.261 -3.135 -1.429 1.00 10.00 H new ATOM 616 N GLY A 41 12.504 -5.443 3.266 1.00 10.00 N ATOM 617 CA GLY A 41 11.949 -6.700 3.731 1.00 10.00 C ATOM 618 C GLY A 41 10.546 -6.540 4.282 1.00 10.00 C ATOM 619 O GLY A 41 9.631 -7.274 3.904 1.00 10.00 O ATOM 0 H GLY A 41 13.341 -5.137 3.762 1.00 10.00 H new ATOM 0 HA2 GLY A 41 11.935 -7.415 2.908 1.00 10.00 H new ATOM 0 HA3 GLY A 41 12.595 -7.116 4.504 1.00 10.00 H new ATOM 623 N ALA A 42 10.375 -5.564 5.163 1.00 10.00 N ATOM 624 CA ALA A 42 9.082 -5.297 5.775 1.00 10.00 C ATOM 625 C ALA A 42 8.098 -4.731 4.759 1.00 10.00 C ATOM 626 O ALA A 42 6.932 -5.129 4.722 1.00 10.00 O ATOM 627 CB ALA A 42 9.244 -4.337 6.944 1.00 10.00 C ATOM 0 H ALA A 42 11.121 -4.941 5.471 1.00 10.00 H new ATOM 0 HA ALA A 42 8.680 -6.241 6.143 1.00 10.00 H new ATOM 0 HB1 ALA A 42 8.270 -4.144 7.394 1.00 10.00 H new ATOM 0 HB2 ALA A 42 9.907 -4.778 7.688 1.00 10.00 H new ATOM 0 HB3 ALA A 42 9.671 -3.399 6.588 1.00 10.00 H new ATOM 633 N ALA A 43 8.575 -3.815 3.926 1.00 10.00 N ATOM 634 CA ALA A 43 7.740 -3.180 2.910 1.00 10.00 C ATOM 635 C ALA A 43 7.108 -4.205 1.974 1.00 10.00 C ATOM 636 O ALA A 43 5.899 -4.182 1.741 1.00 10.00 O ATOM 637 CB ALA A 43 8.557 -2.175 2.117 1.00 10.00 C ATOM 0 H ALA A 43 9.543 -3.492 3.933 1.00 10.00 H new ATOM 0 HA ALA A 43 6.930 -2.661 3.423 1.00 10.00 H new ATOM 0 HB1 ALA A 43 7.925 -1.707 1.362 1.00 10.00 H new ATOM 0 HB2 ALA A 43 8.946 -1.410 2.790 1.00 10.00 H new ATOM 0 HB3 ALA A 43 9.388 -2.685 1.629 1.00 10.00 H new ATOM 643 N LEU A 44 7.927 -5.108 1.446 1.00 10.00 N ATOM 644 CA LEU A 44 7.440 -6.136 0.532 1.00 10.00 C ATOM 645 C LEU A 44 6.477 -7.087 1.244 1.00 10.00 C ATOM 646 O LEU A 44 5.454 -7.476 0.689 1.00 10.00 O ATOM 647 CB LEU A 44 8.614 -6.923 -0.062 1.00 10.00 C ATOM 648 CG LEU A 44 8.984 -6.562 -1.504 1.00 10.00 C ATOM 649 CD1 LEU A 44 9.382 -5.099 -1.609 1.00 10.00 C ATOM 650 CD2 LEU A 44 10.112 -7.457 -1.997 1.00 10.00 C ATOM 0 H LEU A 44 8.929 -5.150 1.634 1.00 10.00 H new ATOM 0 HA LEU A 44 6.901 -5.642 -0.276 1.00 10.00 H new ATOM 0 HB2 LEU A 44 9.489 -6.769 0.569 1.00 10.00 H new ATOM 0 HB3 LEU A 44 8.375 -7.986 -0.021 1.00 10.00 H new ATOM 0 HG LEU A 44 8.109 -6.722 -2.134 1.00 10.00 H new ATOM 0 HD11 LEU A 44 9.641 -4.865 -2.642 1.00 10.00 H new ATOM 0 HD12 LEU A 44 8.549 -4.472 -1.293 1.00 10.00 H new ATOM 0 HD13 LEU A 44 10.243 -4.909 -0.968 1.00 10.00 H new ATOM 0 HD21 LEU A 44 10.366 -7.191 -3.023 1.00 10.00 H new ATOM 0 HD22 LEU A 44 10.987 -7.324 -1.360 1.00 10.00 H new ATOM 0 HD23 LEU A 44 9.792 -8.498 -1.961 1.00 10.00 H new ATOM 662 N ASP A 45 6.808 -7.440 2.480 1.00 10.00 N ATOM 663 CA ASP A 45 5.979 -8.345 3.275 1.00 10.00 C ATOM 664 C ASP A 45 4.619 -7.716 3.579 1.00 10.00 C ATOM 665 O ASP A 45 3.610 -8.414 3.684 1.00 10.00 O ATOM 666 CB ASP A 45 6.692 -8.691 4.585 1.00 10.00 C ATOM 667 CG ASP A 45 6.116 -9.916 5.271 1.00 10.00 C ATOM 668 OD1 ASP A 45 4.982 -9.851 5.784 1.00 10.00 O ATOM 669 OD2 ASP A 45 6.817 -10.954 5.326 1.00 10.00 O ATOM 0 H ASP A 45 7.648 -7.113 2.957 1.00 10.00 H new ATOM 0 HA ASP A 45 5.817 -9.255 2.697 1.00 10.00 H new ATOM 0 HB2 ASP A 45 7.750 -8.859 4.383 1.00 10.00 H new ATOM 0 HB3 ASP A 45 6.629 -7.839 5.262 1.00 10.00 H new ATOM 674 N THR A 46 4.602 -6.393 3.699 1.00 10.00 N ATOM 675 CA THR A 46 3.375 -5.656 3.994 1.00 10.00 C ATOM 676 C THR A 46 2.311 -5.880 2.916 1.00 10.00 C ATOM 677 O THR A 46 1.118 -5.941 3.208 1.00 10.00 O ATOM 678 CB THR A 46 3.657 -4.142 4.129 1.00 10.00 C ATOM 679 OG1 THR A 46 4.621 -3.911 5.165 1.00 10.00 O ATOM 680 CG2 THR A 46 2.385 -3.370 4.448 1.00 10.00 C ATOM 0 H THR A 46 5.429 -5.804 3.596 1.00 10.00 H new ATOM 0 HA THR A 46 2.996 -6.037 4.942 1.00 10.00 H new ATOM 0 HB THR A 46 4.048 -3.791 3.174 1.00 10.00 H new ATOM 0 HG1 THR A 46 5.505 -4.204 4.860 1.00 10.00 H new ATOM 0 HG21 THR A 46 2.616 -2.309 4.537 1.00 10.00 H new ATOM 0 HG22 THR A 46 1.659 -3.518 3.648 1.00 10.00 H new ATOM 0 HG23 THR A 46 1.967 -3.730 5.388 1.00 10.00 H new ATOM 688 N ILE A 47 2.746 -6.019 1.672 1.00 10.00 N ATOM 689 CA ILE A 47 1.816 -6.222 0.571 1.00 10.00 C ATOM 690 C ILE A 47 1.901 -7.646 0.018 1.00 10.00 C ATOM 691 O ILE A 47 1.260 -7.964 -0.984 1.00 10.00 O ATOM 692 CB ILE A 47 2.058 -5.205 -0.563 1.00 10.00 C ATOM 693 CG1 ILE A 47 3.437 -5.421 -1.198 1.00 10.00 C ATOM 694 CG2 ILE A 47 1.927 -3.779 -0.034 1.00 10.00 C ATOM 695 CD1 ILE A 47 3.612 -4.715 -2.526 1.00 10.00 C ATOM 0 H ILE A 47 3.729 -5.995 1.401 1.00 10.00 H new ATOM 0 HA ILE A 47 0.814 -6.067 0.971 1.00 10.00 H new ATOM 0 HB ILE A 47 1.301 -5.359 -1.332 1.00 10.00 H new ATOM 0 HG12 ILE A 47 4.204 -5.072 -0.507 1.00 10.00 H new ATOM 0 HG13 ILE A 47 3.598 -6.490 -1.340 1.00 10.00 H new ATOM 0 HG21 ILE A 47 2.100 -3.072 -0.846 1.00 10.00 H new ATOM 0 HG22 ILE A 47 0.925 -3.631 0.368 1.00 10.00 H new ATOM 0 HG23 ILE A 47 2.662 -3.614 0.754 1.00 10.00 H new ATOM 0 HD11 ILE A 47 4.611 -4.913 -2.915 1.00 10.00 H new ATOM 0 HD12 ILE A 47 2.868 -5.081 -3.234 1.00 10.00 H new ATOM 0 HD13 ILE A 47 3.483 -3.642 -2.387 1.00 10.00 H new ATOM 707 N GLN A 48 2.708 -8.485 0.679 1.00 10.00 N ATOM 708 CA GLN A 48 2.905 -9.897 0.308 1.00 10.00 C ATOM 709 C GLN A 48 3.676 -10.069 -1.011 1.00 10.00 C ATOM 710 O GLN A 48 4.565 -10.918 -1.106 1.00 10.00 O ATOM 711 CB GLN A 48 1.563 -10.627 0.215 1.00 10.00 C ATOM 712 CG GLN A 48 1.612 -12.068 0.695 1.00 10.00 C ATOM 713 CD GLN A 48 0.994 -12.251 2.071 1.00 10.00 C ATOM 714 OE1 GLN A 48 -0.206 -12.502 2.199 1.00 10.00 O ATOM 715 NE2 GLN A 48 1.808 -12.140 3.108 1.00 10.00 N ATOM 0 H GLN A 48 3.250 -8.202 1.496 1.00 10.00 H new ATOM 0 HA GLN A 48 3.510 -10.337 1.101 1.00 10.00 H new ATOM 0 HB2 GLN A 48 0.823 -10.083 0.803 1.00 10.00 H new ATOM 0 HB3 GLN A 48 1.222 -10.610 -0.820 1.00 10.00 H new ATOM 0 HG2 GLN A 48 1.089 -12.703 -0.021 1.00 10.00 H new ATOM 0 HG3 GLN A 48 2.649 -12.403 0.720 1.00 10.00 H new ATOM 0 HE21 GLN A 48 2.796 -11.931 2.961 1.00 10.00 H new ATOM 0 HE22 GLN A 48 1.448 -12.263 4.054 1.00 10.00 H new ATOM 724 N TYR A 49 3.313 -9.281 -2.017 1.00 10.00 N ATOM 725 CA TYR A 49 3.941 -9.337 -3.336 1.00 10.00 C ATOM 726 C TYR A 49 5.462 -9.270 -3.250 1.00 10.00 C ATOM 727 O TYR A 49 6.037 -8.250 -2.864 1.00 10.00 O ATOM 728 CB TYR A 49 3.417 -8.197 -4.217 1.00 10.00 C ATOM 729 CG TYR A 49 2.057 -8.459 -4.830 1.00 10.00 C ATOM 730 CD1 TYR A 49 1.046 -9.085 -4.108 1.00 10.00 C ATOM 731 CD2 TYR A 49 1.782 -8.076 -6.138 1.00 10.00 C ATOM 732 CE1 TYR A 49 -0.193 -9.319 -4.669 1.00 10.00 C ATOM 733 CE2 TYR A 49 0.544 -8.309 -6.705 1.00 10.00 C ATOM 734 CZ TYR A 49 -0.438 -8.929 -5.966 1.00 10.00 C ATOM 735 OH TYR A 49 -1.672 -9.168 -6.528 1.00 10.00 O ATOM 0 H TYR A 49 2.573 -8.583 -1.943 1.00 10.00 H new ATOM 0 HA TYR A 49 3.678 -10.296 -3.782 1.00 10.00 H new ATOM 0 HB2 TYR A 49 3.364 -7.287 -3.620 1.00 10.00 H new ATOM 0 HB3 TYR A 49 4.134 -8.013 -5.017 1.00 10.00 H new ATOM 0 HD1 TYR A 49 1.234 -9.393 -3.090 1.00 10.00 H new ATOM 0 HD2 TYR A 49 2.549 -7.588 -6.721 1.00 10.00 H new ATOM 0 HE1 TYR A 49 -0.966 -9.806 -4.093 1.00 10.00 H new ATOM 0 HE2 TYR A 49 0.348 -8.006 -7.723 1.00 10.00 H new ATOM 0 HH TYR A 49 -2.370 -9.036 -5.853 1.00 10.00 H new ATOM 745 N SER A 50 6.105 -10.373 -3.605 1.00 10.00 N ATOM 746 CA SER A 50 7.557 -10.453 -3.585 1.00 10.00 C ATOM 747 C SER A 50 8.068 -11.297 -4.752 1.00 10.00 C ATOM 748 O SER A 50 9.161 -11.065 -5.266 1.00 10.00 O ATOM 749 CB SER A 50 8.035 -11.040 -2.258 1.00 10.00 C ATOM 750 OG SER A 50 7.038 -11.868 -1.683 1.00 10.00 O ATOM 0 H SER A 50 5.641 -11.228 -3.912 1.00 10.00 H new ATOM 0 HA SER A 50 7.959 -9.445 -3.689 1.00 10.00 H new ATOM 0 HB2 SER A 50 8.945 -11.618 -2.418 1.00 10.00 H new ATOM 0 HB3 SER A 50 8.286 -10.234 -1.569 1.00 10.00 H new ATOM 0 HG SER A 50 6.271 -11.319 -1.416 1.00 10.00 H new ATOM 756 N LYS A 51 7.270 -12.279 -5.164 1.00 10.00 N ATOM 757 CA LYS A 51 7.643 -13.149 -6.269 1.00 10.00 C ATOM 758 C LYS A 51 6.819 -12.827 -7.510 1.00 10.00 C ATOM 759 O LYS A 51 7.366 -12.538 -8.573 1.00 10.00 O ATOM 760 CB LYS A 51 7.461 -14.621 -5.883 1.00 10.00 C ATOM 761 CG LYS A 51 8.290 -15.032 -4.680 1.00 10.00 C ATOM 762 CD LYS A 51 8.504 -16.535 -4.633 1.00 10.00 C ATOM 763 CE LYS A 51 9.383 -16.938 -3.459 1.00 10.00 C ATOM 764 NZ LYS A 51 9.881 -18.332 -3.591 1.00 10.00 N ATOM 0 H LYS A 51 6.363 -12.490 -4.748 1.00 10.00 H new ATOM 0 HA LYS A 51 8.695 -12.975 -6.495 1.00 10.00 H new ATOM 0 HB2 LYS A 51 6.408 -14.806 -5.671 1.00 10.00 H new ATOM 0 HB3 LYS A 51 7.730 -15.248 -6.733 1.00 10.00 H new ATOM 0 HG2 LYS A 51 9.256 -14.528 -4.714 1.00 10.00 H new ATOM 0 HG3 LYS A 51 7.792 -14.706 -3.767 1.00 10.00 H new ATOM 0 HD2 LYS A 51 7.540 -17.038 -4.556 1.00 10.00 H new ATOM 0 HD3 LYS A 51 8.964 -16.867 -5.564 1.00 10.00 H new ATOM 0 HE2 LYS A 51 10.230 -16.255 -3.389 1.00 10.00 H new ATOM 0 HE3 LYS A 51 8.818 -16.841 -2.532 1.00 10.00 H new ATOM 0 HZ1 LYS A 51 10.476 -18.567 -2.771 1.00 10.00 H new ATOM 0 HZ2 LYS A 51 9.074 -18.987 -3.632 1.00 10.00 H new ATOM 0 HZ3 LYS A 51 10.442 -18.419 -4.462 1.00 10.00 H new ATOM 778 N HIS A 52 5.501 -12.860 -7.362 1.00 10.00 N ATOM 779 CA HIS A 52 4.593 -12.567 -8.460 1.00 10.00 C ATOM 780 C HIS A 52 3.192 -12.323 -7.919 1.00 10.00 C ATOM 781 O HIS A 52 2.411 -11.604 -8.577 1.00 10.00 O ATOM 782 CB HIS A 52 4.567 -13.716 -9.472 1.00 10.00 C ATOM 783 CG HIS A 52 4.149 -13.295 -10.845 1.00 10.00 C ATOM 784 ND1 HIS A 52 3.011 -12.563 -11.098 1.00 10.00 N ATOM 785 CD2 HIS A 52 4.731 -13.507 -12.047 1.00 10.00 C ATOM 786 CE1 HIS A 52 2.913 -12.344 -12.394 1.00 10.00 C ATOM 787 NE2 HIS A 52 3.947 -12.902 -12.991 1.00 10.00 N ATOM 788 OXT HIS A 52 2.877 -12.862 -6.838 1.00 10.00 O ATOM 0 H HIS A 52 5.035 -13.089 -6.484 1.00 10.00 H new ATOM 0 HA HIS A 52 4.948 -11.671 -8.969 1.00 10.00 H new ATOM 0 HB2 HIS A 52 5.559 -14.165 -9.525 1.00 10.00 H new ATOM 0 HB3 HIS A 52 3.886 -14.488 -9.115 1.00 10.00 H new ATOM 0 HD1 HIS A 52 2.348 -12.241 -10.393 1.00 10.00 H new ATOM 0 HD2 HIS A 52 5.645 -14.053 -12.228 1.00 10.00 H new ATOM 0 HE1 HIS A 52 2.119 -11.799 -12.884 1.00 10.00 H new TER 797 HIS A 52 ATOM 798 N GLY B 1 -18.830 18.735 2.151 1.00 10.00 N ATOM 799 CA GLY B 1 -18.843 17.442 2.875 1.00 10.00 C ATOM 800 C GLY B 1 -19.408 16.329 2.019 1.00 10.00 C ATOM 801 O GLY B 1 -18.965 16.131 0.887 1.00 10.00 O ATOM 0 H1 GLY B 1 -18.437 19.474 2.768 1.00 10.00 H new ATOM 0 H2 GLY B 1 -18.243 18.649 1.297 1.00 10.00 H new ATOM 0 H3 GLY B 1 -19.801 18.991 1.880 1.00 10.00 H new ATOM 0 HA2 GLY B 1 -17.829 17.186 3.182 1.00 10.00 H new ATOM 0 HA3 GLY B 1 -19.436 17.539 3.784 1.00 10.00 H new ATOM 807 N SER B 2 -20.379 15.597 2.553 1.00 10.00 N ATOM 808 CA SER B 2 -21.013 14.514 1.811 1.00 10.00 C ATOM 809 C SER B 2 -22.278 15.032 1.126 1.00 10.00 C ATOM 810 O SER B 2 -23.297 15.254 1.779 1.00 10.00 O ATOM 811 CB SER B 2 -21.358 13.358 2.756 1.00 10.00 C ATOM 812 OG SER B 2 -20.237 12.982 3.545 1.00 10.00 O ATOM 0 H SER B 2 -20.744 15.734 3.496 1.00 10.00 H new ATOM 0 HA SER B 2 -20.321 14.148 1.052 1.00 10.00 H new ATOM 0 HB2 SER B 2 -22.181 13.652 3.407 1.00 10.00 H new ATOM 0 HB3 SER B 2 -21.700 12.501 2.176 1.00 10.00 H new ATOM 0 HG SER B 2 -20.488 12.244 4.139 1.00 10.00 H new ATOM 818 N PRO B 3 -22.226 15.259 -0.196 1.00 10.00 N ATOM 819 CA PRO B 3 -23.368 15.765 -0.954 1.00 10.00 C ATOM 820 C PRO B 3 -24.409 14.677 -1.214 1.00 10.00 C ATOM 821 O PRO B 3 -24.055 13.538 -1.530 1.00 10.00 O ATOM 822 CB PRO B 3 -22.755 16.237 -2.283 1.00 10.00 C ATOM 823 CG PRO B 3 -21.276 16.061 -2.145 1.00 10.00 C ATOM 824 CD PRO B 3 -21.068 15.041 -1.066 1.00 10.00 C ATOM 0 HA PRO B 3 -23.892 16.553 -0.413 1.00 10.00 H new ATOM 0 HB2 PRO B 3 -23.140 15.653 -3.119 1.00 10.00 H new ATOM 0 HB3 PRO B 3 -23.007 17.279 -2.480 1.00 10.00 H new ATOM 0 HG2 PRO B 3 -20.836 15.727 -3.085 1.00 10.00 H new ATOM 0 HG3 PRO B 3 -20.796 17.004 -1.885 1.00 10.00 H new ATOM 0 HD2 PRO B 3 -21.046 14.027 -1.465 1.00 10.00 H new ATOM 0 HD3 PRO B 3 -20.128 15.196 -0.537 1.00 10.00 H new ATOM 832 N PRO B 4 -25.706 15.012 -1.097 1.00 10.00 N ATOM 833 CA PRO B 4 -26.796 14.052 -1.324 1.00 10.00 C ATOM 834 C PRO B 4 -26.846 13.549 -2.768 1.00 10.00 C ATOM 835 O PRO B 4 -27.552 12.590 -3.076 1.00 10.00 O ATOM 836 CB PRO B 4 -28.064 14.849 -0.990 1.00 10.00 C ATOM 837 CG PRO B 4 -27.591 16.017 -0.194 1.00 10.00 C ATOM 838 CD PRO B 4 -26.221 16.335 -0.709 1.00 10.00 C ATOM 0 HA PRO B 4 -26.671 13.156 -0.717 1.00 10.00 H new ATOM 0 HB2 PRO B 4 -28.577 15.171 -1.896 1.00 10.00 H new ATOM 0 HB3 PRO B 4 -28.771 14.245 -0.421 1.00 10.00 H new ATOM 0 HG2 PRO B 4 -28.261 16.869 -0.314 1.00 10.00 H new ATOM 0 HG3 PRO B 4 -27.563 15.780 0.870 1.00 10.00 H new ATOM 0 HD2 PRO B 4 -26.256 17.020 -1.556 1.00 10.00 H new ATOM 0 HD3 PRO B 4 -25.600 16.803 0.055 1.00 10.00 H new ATOM 846 N GLU B 5 -26.085 14.193 -3.647 1.00 10.00 N ATOM 847 CA GLU B 5 -26.043 13.796 -5.049 1.00 10.00 C ATOM 848 C GLU B 5 -25.113 12.601 -5.229 1.00 10.00 C ATOM 849 O GLU B 5 -25.146 11.925 -6.255 1.00 10.00 O ATOM 850 CB GLU B 5 -25.567 14.949 -5.942 1.00 10.00 C ATOM 851 CG GLU B 5 -25.759 16.336 -5.347 1.00 10.00 C ATOM 852 CD GLU B 5 -27.216 16.739 -5.249 1.00 10.00 C ATOM 853 OE1 GLU B 5 -27.894 16.794 -6.298 1.00 10.00 O ATOM 854 OE2 GLU B 5 -27.681 17.024 -4.127 1.00 10.00 O ATOM 0 H GLU B 5 -25.491 14.989 -3.414 1.00 10.00 H new ATOM 0 HA GLU B 5 -27.056 13.523 -5.346 1.00 10.00 H new ATOM 0 HB2 GLU B 5 -24.509 14.807 -6.163 1.00 10.00 H new ATOM 0 HB3 GLU B 5 -26.100 14.899 -6.891 1.00 10.00 H new ATOM 0 HG2 GLU B 5 -25.312 16.365 -4.353 1.00 10.00 H new ATOM 0 HG3 GLU B 5 -25.226 17.065 -5.958 1.00 10.00 H new ATOM 861 N ALA B 6 -24.284 12.355 -4.223 1.00 10.00 N ATOM 862 CA ALA B 6 -23.340 11.250 -4.263 1.00 10.00 C ATOM 863 C ALA B 6 -24.026 9.953 -3.869 1.00 10.00 C ATOM 864 O ALA B 6 -25.091 9.967 -3.247 1.00 10.00 O ATOM 865 CB ALA B 6 -22.158 11.526 -3.345 1.00 10.00 C ATOM 0 H ALA B 6 -24.248 12.909 -3.367 1.00 10.00 H new ATOM 0 HA ALA B 6 -22.969 11.150 -5.283 1.00 10.00 H new ATOM 0 HB1 ALA B 6 -21.461 10.689 -3.387 1.00 10.00 H new ATOM 0 HB2 ALA B 6 -21.652 12.436 -3.667 1.00 10.00 H new ATOM 0 HB3 ALA B 6 -22.513 11.651 -2.322 1.00 10.00 H new ATOM 871 N ASP B 7 -23.424 8.839 -4.252 1.00 10.00 N ATOM 872 CA ASP B 7 -23.967 7.526 -3.933 1.00 10.00 C ATOM 873 C ASP B 7 -23.723 7.203 -2.460 1.00 10.00 C ATOM 874 O ASP B 7 -22.573 7.100 -2.027 1.00 10.00 O ATOM 875 CB ASP B 7 -23.315 6.459 -4.818 1.00 10.00 C ATOM 876 CG ASP B 7 -24.021 5.116 -4.762 1.00 10.00 C ATOM 877 OD1 ASP B 7 -24.238 4.592 -3.652 1.00 10.00 O ATOM 878 OD2 ASP B 7 -24.344 4.569 -5.833 1.00 10.00 O ATOM 0 H ASP B 7 -22.556 8.817 -4.786 1.00 10.00 H new ATOM 0 HA ASP B 7 -25.041 7.533 -4.121 1.00 10.00 H new ATOM 0 HB2 ASP B 7 -23.302 6.811 -5.849 1.00 10.00 H new ATOM 0 HB3 ASP B 7 -22.277 6.329 -4.512 1.00 10.00 H new ATOM 883 N PRO B 8 -24.797 7.027 -1.674 1.00 10.00 N ATOM 884 CA PRO B 8 -24.691 6.733 -0.240 1.00 10.00 C ATOM 885 C PRO B 8 -24.074 5.368 0.054 1.00 10.00 C ATOM 886 O PRO B 8 -23.678 5.089 1.186 1.00 10.00 O ATOM 887 CB PRO B 8 -26.143 6.775 0.244 1.00 10.00 C ATOM 888 CG PRO B 8 -26.963 6.511 -0.970 1.00 10.00 C ATOM 889 CD PRO B 8 -26.200 7.101 -2.122 1.00 10.00 C ATOM 0 HA PRO B 8 -24.033 7.444 0.260 1.00 10.00 H new ATOM 0 HB2 PRO B 8 -26.324 6.024 1.013 1.00 10.00 H new ATOM 0 HB3 PRO B 8 -26.385 7.744 0.681 1.00 10.00 H new ATOM 0 HG2 PRO B 8 -27.117 5.441 -1.111 1.00 10.00 H new ATOM 0 HG3 PRO B 8 -27.949 6.966 -0.881 1.00 10.00 H new ATOM 0 HD2 PRO B 8 -26.359 6.537 -3.041 1.00 10.00 H new ATOM 0 HD3 PRO B 8 -26.505 8.128 -2.322 1.00 10.00 H new ATOM 897 N ARG B 9 -24.006 4.518 -0.959 1.00 10.00 N ATOM 898 CA ARG B 9 -23.430 3.190 -0.803 1.00 10.00 C ATOM 899 C ARG B 9 -21.955 3.205 -1.182 1.00 10.00 C ATOM 900 O ARG B 9 -21.130 2.558 -0.542 1.00 10.00 O ATOM 901 CB ARG B 9 -24.188 2.174 -1.661 1.00 10.00 C ATOM 902 CG ARG B 9 -25.692 2.196 -1.443 1.00 10.00 C ATOM 903 CD ARG B 9 -26.442 1.706 -2.671 1.00 10.00 C ATOM 904 NE ARG B 9 -26.211 2.565 -3.833 1.00 10.00 N ATOM 905 CZ ARG B 9 -26.976 2.565 -4.927 1.00 10.00 C ATOM 906 NH1 ARG B 9 -28.035 1.769 -4.999 1.00 10.00 N ATOM 907 NH2 ARG B 9 -26.685 3.358 -5.946 1.00 10.00 N ATOM 0 H ARG B 9 -24.343 4.724 -1.899 1.00 10.00 H new ATOM 0 HA ARG B 9 -23.519 2.895 0.243 1.00 10.00 H new ATOM 0 HB2 ARG B 9 -23.979 2.371 -2.712 1.00 10.00 H new ATOM 0 HB3 ARG B 9 -23.812 1.174 -1.443 1.00 10.00 H new ATOM 0 HG2 ARG B 9 -25.945 1.570 -0.587 1.00 10.00 H new ATOM 0 HG3 ARG B 9 -26.011 3.210 -1.202 1.00 10.00 H new ATOM 0 HD2 ARG B 9 -26.129 0.688 -2.905 1.00 10.00 H new ATOM 0 HD3 ARG B 9 -27.509 1.670 -2.453 1.00 10.00 H new ATOM 0 HE ARG B 9 -25.416 3.203 -3.805 1.00 10.00 H new ATOM 0 HH11 ARG B 9 -28.266 1.156 -4.218 1.00 10.00 H new ATOM 0 HH12 ARG B 9 -28.618 1.771 -5.836 1.00 10.00 H new ATOM 0 HH21 ARG B 9 -25.873 3.973 -5.898 1.00 10.00 H new ATOM 0 HH22 ARG B 9 -27.273 3.354 -6.779 1.00 10.00 H new ATOM 921 N LEU B 10 -21.623 3.967 -2.217 1.00 10.00 N ATOM 922 CA LEU B 10 -20.243 4.069 -2.686 1.00 10.00 C ATOM 923 C LEU B 10 -19.355 4.744 -1.642 1.00 10.00 C ATOM 924 O LEU B 10 -18.190 4.385 -1.479 1.00 10.00 O ATOM 925 CB LEU B 10 -20.178 4.846 -4.002 1.00 10.00 C ATOM 926 CG LEU B 10 -18.790 4.935 -4.638 1.00 10.00 C ATOM 927 CD1 LEU B 10 -18.328 3.567 -5.118 1.00 10.00 C ATOM 928 CD2 LEU B 10 -18.796 5.932 -5.788 1.00 10.00 C ATOM 0 H LEU B 10 -22.290 4.525 -2.750 1.00 10.00 H new ATOM 0 HA LEU B 10 -19.874 3.057 -2.852 1.00 10.00 H new ATOM 0 HB2 LEU B 10 -20.857 4.379 -4.715 1.00 10.00 H new ATOM 0 HB3 LEU B 10 -20.545 5.857 -3.827 1.00 10.00 H new ATOM 0 HG LEU B 10 -18.088 5.284 -3.881 1.00 10.00 H new ATOM 0 HD11 LEU B 10 -17.339 3.654 -5.567 1.00 10.00 H new ATOM 0 HD12 LEU B 10 -18.284 2.881 -4.272 1.00 10.00 H new ATOM 0 HD13 LEU B 10 -19.030 3.185 -5.859 1.00 10.00 H new ATOM 0 HD21 LEU B 10 -17.801 5.984 -6.230 1.00 10.00 H new ATOM 0 HD22 LEU B 10 -19.513 5.611 -6.544 1.00 10.00 H new ATOM 0 HD23 LEU B 10 -19.079 6.916 -5.415 1.00 10.00 H new ATOM 940 N ILE B 11 -19.912 5.711 -0.926 1.00 10.00 N ATOM 941 CA ILE B 11 -19.161 6.428 0.098 1.00 10.00 C ATOM 942 C ILE B 11 -18.859 5.516 1.293 1.00 10.00 C ATOM 943 O ILE B 11 -17.965 5.792 2.093 1.00 10.00 O ATOM 944 CB ILE B 11 -19.922 7.691 0.566 1.00 10.00 C ATOM 945 CG1 ILE B 11 -18.998 8.609 1.372 1.00 10.00 C ATOM 946 CG2 ILE B 11 -21.154 7.311 1.385 1.00 10.00 C ATOM 947 CD1 ILE B 11 -19.601 9.966 1.664 1.00 10.00 C ATOM 0 H ILE B 11 -20.879 6.017 -1.034 1.00 10.00 H new ATOM 0 HA ILE B 11 -18.216 6.743 -0.345 1.00 10.00 H new ATOM 0 HB ILE B 11 -20.258 8.233 -0.318 1.00 10.00 H new ATOM 0 HG12 ILE B 11 -18.746 8.122 2.314 1.00 10.00 H new ATOM 0 HG13 ILE B 11 -18.066 8.745 0.824 1.00 10.00 H new ATOM 0 HG21 ILE B 11 -21.673 8.215 1.703 1.00 10.00 H new ATOM 0 HG22 ILE B 11 -21.823 6.704 0.775 1.00 10.00 H new ATOM 0 HG23 ILE B 11 -20.846 6.742 2.262 1.00 10.00 H new ATOM 0 HD11 ILE B 11 -18.892 10.563 2.238 1.00 10.00 H new ATOM 0 HD12 ILE B 11 -19.827 10.473 0.726 1.00 10.00 H new ATOM 0 HD13 ILE B 11 -20.518 9.840 2.239 1.00 10.00 H new ATOM 959 N GLU B 12 -19.584 4.406 1.378 1.00 10.00 N ATOM 960 CA GLU B 12 -19.405 3.456 2.463 1.00 10.00 C ATOM 961 C GLU B 12 -18.198 2.562 2.223 1.00 10.00 C ATOM 962 O GLU B 12 -17.748 1.859 3.126 1.00 10.00 O ATOM 963 CB GLU B 12 -20.664 2.614 2.646 1.00 10.00 C ATOM 964 CG GLU B 12 -21.796 3.380 3.302 1.00 10.00 C ATOM 965 CD GLU B 12 -21.553 3.632 4.776 1.00 10.00 C ATOM 966 OE1 GLU B 12 -20.676 4.457 5.115 1.00 10.00 O ATOM 967 OE2 GLU B 12 -22.245 3.003 5.607 1.00 10.00 O ATOM 0 H GLU B 12 -20.303 4.144 0.704 1.00 10.00 H new ATOM 0 HA GLU B 12 -19.225 4.022 3.377 1.00 10.00 H new ATOM 0 HB2 GLU B 12 -20.995 2.248 1.674 1.00 10.00 H new ATOM 0 HB3 GLU B 12 -20.425 1.739 3.251 1.00 10.00 H new ATOM 0 HG2 GLU B 12 -21.928 4.334 2.791 1.00 10.00 H new ATOM 0 HG3 GLU B 12 -22.725 2.822 3.181 1.00 10.00 H new ATOM 974 N SER B 13 -17.673 2.587 1.001 1.00 10.00 N ATOM 975 CA SER B 13 -16.507 1.781 0.656 1.00 10.00 C ATOM 976 C SER B 13 -15.318 2.167 1.534 1.00 10.00 C ATOM 977 O SER B 13 -14.498 1.323 1.899 1.00 10.00 O ATOM 978 CB SER B 13 -16.153 1.968 -0.820 1.00 10.00 C ATOM 979 OG SER B 13 -17.306 1.869 -1.632 1.00 10.00 O ATOM 0 H SER B 13 -18.036 3.155 0.235 1.00 10.00 H new ATOM 0 HA SER B 13 -16.745 0.732 0.830 1.00 10.00 H new ATOM 0 HB2 SER B 13 -15.684 2.941 -0.965 1.00 10.00 H new ATOM 0 HB3 SER B 13 -15.425 1.215 -1.122 1.00 10.00 H new ATOM 0 HG SER B 13 -17.626 2.768 -1.856 1.00 10.00 H new ATOM 985 N LEU B 14 -15.245 3.448 1.888 1.00 10.00 N ATOM 986 CA LEU B 14 -14.171 3.949 2.732 1.00 10.00 C ATOM 987 C LEU B 14 -14.396 3.501 4.171 1.00 10.00 C ATOM 988 O LEU B 14 -13.468 3.064 4.851 1.00 10.00 O ATOM 989 CB LEU B 14 -14.091 5.478 2.657 1.00 10.00 C ATOM 990 CG LEU B 14 -13.700 6.050 1.290 1.00 10.00 C ATOM 991 CD1 LEU B 14 -14.930 6.276 0.424 1.00 10.00 C ATOM 992 CD2 LEU B 14 -12.927 7.346 1.461 1.00 10.00 C ATOM 0 H LEU B 14 -15.920 4.157 1.601 1.00 10.00 H new ATOM 0 HA LEU B 14 -13.225 3.542 2.374 1.00 10.00 H new ATOM 0 HB2 LEU B 14 -15.060 5.890 2.941 1.00 10.00 H new ATOM 0 HB3 LEU B 14 -13.369 5.824 3.397 1.00 10.00 H new ATOM 0 HG LEU B 14 -13.060 5.325 0.788 1.00 10.00 H new ATOM 0 HD11 LEU B 14 -14.626 6.682 -0.541 1.00 10.00 H new ATOM 0 HD12 LEU B 14 -15.447 5.329 0.272 1.00 10.00 H new ATOM 0 HD13 LEU B 14 -15.599 6.979 0.919 1.00 10.00 H new ATOM 0 HD21 LEU B 14 -12.656 7.740 0.481 1.00 10.00 H new ATOM 0 HD22 LEU B 14 -13.547 8.073 1.986 1.00 10.00 H new ATOM 0 HD23 LEU B 14 -12.022 7.156 2.039 1.00 10.00 H new ATOM 1004 N SER B 15 -15.645 3.596 4.616 1.00 10.00 N ATOM 1005 CA SER B 15 -16.023 3.193 5.963 1.00 10.00 C ATOM 1006 C SER B 15 -15.782 1.697 6.160 1.00 10.00 C ATOM 1007 O SER B 15 -15.339 1.256 7.221 1.00 10.00 O ATOM 1008 CB SER B 15 -17.498 3.523 6.204 1.00 10.00 C ATOM 1009 OG SER B 15 -17.987 4.428 5.223 1.00 10.00 O ATOM 0 H SER B 15 -16.419 3.953 4.055 1.00 10.00 H new ATOM 0 HA SER B 15 -15.410 3.739 6.680 1.00 10.00 H new ATOM 0 HB2 SER B 15 -18.087 2.606 6.183 1.00 10.00 H new ATOM 0 HB3 SER B 15 -17.619 3.957 7.196 1.00 10.00 H new ATOM 0 HG SER B 15 -18.930 4.625 5.401 1.00 10.00 H new ATOM 1015 N GLN B 16 -16.064 0.928 5.114 1.00 10.00 N ATOM 1016 CA GLN B 16 -15.887 -0.516 5.145 1.00 10.00 C ATOM 1017 C GLN B 16 -14.428 -0.879 5.403 1.00 10.00 C ATOM 1018 O GLN B 16 -14.138 -1.816 6.149 1.00 10.00 O ATOM 1019 CB GLN B 16 -16.361 -1.132 3.827 1.00 10.00 C ATOM 1020 CG GLN B 16 -16.341 -2.653 3.818 1.00 10.00 C ATOM 1021 CD GLN B 16 -17.103 -3.256 4.983 1.00 10.00 C ATOM 1022 OE1 GLN B 16 -18.308 -3.482 4.903 1.00 10.00 O ATOM 1023 NE2 GLN B 16 -16.405 -3.510 6.077 1.00 10.00 N ATOM 0 H GLN B 16 -16.419 1.286 4.228 1.00 10.00 H new ATOM 0 HA GLN B 16 -16.487 -0.918 5.961 1.00 10.00 H new ATOM 0 HB2 GLN B 16 -17.375 -0.790 3.621 1.00 10.00 H new ATOM 0 HB3 GLN B 16 -15.730 -0.765 3.017 1.00 10.00 H new ATOM 0 HG2 GLN B 16 -16.771 -3.012 2.883 1.00 10.00 H new ATOM 0 HG3 GLN B 16 -15.308 -2.999 3.847 1.00 10.00 H new ATOM 0 HE21 GLN B 16 -15.406 -3.308 6.103 1.00 10.00 H new ATOM 0 HE22 GLN B 16 -16.866 -3.908 6.895 1.00 10.00 H new ATOM 1032 N MET B 17 -13.511 -0.135 4.795 1.00 10.00 N ATOM 1033 CA MET B 17 -12.086 -0.391 4.976 1.00 10.00 C ATOM 1034 C MET B 17 -11.683 -0.104 6.416 1.00 10.00 C ATOM 1035 O MET B 17 -10.868 -0.818 7.004 1.00 10.00 O ATOM 1036 CB MET B 17 -11.256 0.467 4.021 1.00 10.00 C ATOM 1037 CG MET B 17 -11.373 0.052 2.561 1.00 10.00 C ATOM 1038 SD MET B 17 -11.015 -1.701 2.298 1.00 10.00 S ATOM 1039 CE MET B 17 -9.337 -1.811 2.915 1.00 10.00 C ATOM 0 H MET B 17 -13.726 0.646 4.176 1.00 10.00 H new ATOM 0 HA MET B 17 -11.894 -1.440 4.753 1.00 10.00 H new ATOM 0 HB2 MET B 17 -11.567 1.507 4.119 1.00 10.00 H new ATOM 0 HB3 MET B 17 -10.209 0.417 4.320 1.00 10.00 H new ATOM 0 HG2 MET B 17 -12.380 0.269 2.206 1.00 10.00 H new ATOM 0 HG3 MET B 17 -10.688 0.652 1.962 1.00 10.00 H new ATOM 0 HE1 MET B 17 -8.835 -2.662 2.455 1.00 10.00 H new ATOM 0 HE2 MET B 17 -8.798 -0.896 2.669 1.00 10.00 H new ATOM 0 HE3 MET B 17 -9.355 -1.942 3.997 1.00 10.00 H new ATOM 1049 N LEU B 18 -12.278 0.938 6.980 1.00 10.00 N ATOM 1050 CA LEU B 18 -12.008 1.333 8.353 1.00 10.00 C ATOM 1051 C LEU B 18 -12.430 0.228 9.325 1.00 10.00 C ATOM 1052 O LEU B 18 -11.655 -0.183 10.188 1.00 10.00 O ATOM 1053 CB LEU B 18 -12.758 2.629 8.681 1.00 10.00 C ATOM 1054 CG LEU B 18 -12.571 3.154 10.103 1.00 10.00 C ATOM 1055 CD1 LEU B 18 -11.251 3.898 10.232 1.00 10.00 C ATOM 1056 CD2 LEU B 18 -13.730 4.052 10.496 1.00 10.00 C ATOM 0 H LEU B 18 -12.957 1.529 6.501 1.00 10.00 H new ATOM 0 HA LEU B 18 -10.936 1.500 8.461 1.00 10.00 H new ATOM 0 HB2 LEU B 18 -12.437 3.401 7.982 1.00 10.00 H new ATOM 0 HB3 LEU B 18 -13.822 2.466 8.509 1.00 10.00 H new ATOM 0 HG LEU B 18 -12.550 2.302 10.782 1.00 10.00 H new ATOM 0 HD11 LEU B 18 -11.138 4.264 11.253 1.00 10.00 H new ATOM 0 HD12 LEU B 18 -10.428 3.223 9.995 1.00 10.00 H new ATOM 0 HD13 LEU B 18 -11.239 4.741 9.541 1.00 10.00 H new ATOM 0 HD21 LEU B 18 -13.579 4.417 11.512 1.00 10.00 H new ATOM 0 HD22 LEU B 18 -13.783 4.898 9.811 1.00 10.00 H new ATOM 0 HD23 LEU B 18 -14.661 3.487 10.447 1.00 10.00 H new ATOM 1068 N SER B 19 -13.655 -0.269 9.159 1.00 10.00 N ATOM 1069 CA SER B 19 -14.182 -1.328 10.017 1.00 10.00 C ATOM 1070 C SER B 19 -13.464 -2.654 9.767 1.00 10.00 C ATOM 1071 O SER B 19 -13.591 -3.599 10.549 1.00 10.00 O ATOM 1072 CB SER B 19 -15.681 -1.486 9.778 1.00 10.00 C ATOM 1073 OG SER B 19 -16.297 -0.222 9.588 1.00 10.00 O ATOM 0 H SER B 19 -14.302 0.046 8.436 1.00 10.00 H new ATOM 0 HA SER B 19 -14.008 -1.046 11.055 1.00 10.00 H new ATOM 0 HB2 SER B 19 -15.850 -2.113 8.903 1.00 10.00 H new ATOM 0 HB3 SER B 19 -16.138 -1.994 10.627 1.00 10.00 H new ATOM 0 HG SER B 19 -17.257 -0.346 9.435 1.00 10.00 H new ATOM 1079 N MET B 20 -12.712 -2.720 8.675 1.00 10.00 N ATOM 1080 CA MET B 20 -11.963 -3.921 8.335 1.00 10.00 C ATOM 1081 C MET B 20 -10.644 -3.937 9.102 1.00 10.00 C ATOM 1082 O MET B 20 -9.925 -4.936 9.114 1.00 10.00 O ATOM 1083 CB MET B 20 -11.713 -3.992 6.826 1.00 10.00 C ATOM 1084 CG MET B 20 -11.234 -5.353 6.350 1.00 10.00 C ATOM 1085 SD MET B 20 -11.307 -5.531 4.557 1.00 10.00 S ATOM 1086 CE MET B 20 -13.078 -5.496 4.276 1.00 10.00 C ATOM 0 H MET B 20 -12.605 -1.954 8.010 1.00 10.00 H new ATOM 0 HA MET B 20 -12.548 -4.796 8.619 1.00 10.00 H new ATOM 0 HB2 MET B 20 -12.634 -3.737 6.302 1.00 10.00 H new ATOM 0 HB3 MET B 20 -10.972 -3.240 6.554 1.00 10.00 H new ATOM 0 HG2 MET B 20 -10.209 -5.510 6.685 1.00 10.00 H new ATOM 0 HG3 MET B 20 -11.843 -6.130 6.813 1.00 10.00 H new ATOM 0 HE1 MET B 20 -13.364 -6.341 3.649 1.00 10.00 H new ATOM 0 HE2 MET B 20 -13.599 -5.560 5.231 1.00 10.00 H new ATOM 0 HE3 MET B 20 -13.349 -4.566 3.777 1.00 10.00 H new ATOM 1096 N GLY B 21 -10.343 -2.818 9.749 1.00 10.00 N ATOM 1097 CA GLY B 21 -9.128 -2.713 10.524 1.00 10.00 C ATOM 1098 C GLY B 21 -7.982 -2.150 9.719 1.00 10.00 C ATOM 1099 O GLY B 21 -6.815 -2.391 10.037 1.00 10.00 O ATOM 0 H GLY B 21 -10.924 -1.979 9.749 1.00 10.00 H new ATOM 0 HA2 GLY B 21 -9.307 -2.077 11.391 1.00 10.00 H new ATOM 0 HA3 GLY B 21 -8.854 -3.698 10.902 1.00 10.00 H new ATOM 1103 N PHE B 22 -8.302 -1.413 8.665 1.00 10.00 N ATOM 1104 CA PHE B 22 -7.275 -0.814 7.836 1.00 10.00 C ATOM 1105 C PHE B 22 -7.454 0.693 7.784 1.00 10.00 C ATOM 1106 O PHE B 22 -8.497 1.202 7.372 1.00 10.00 O ATOM 1107 CB PHE B 22 -7.297 -1.400 6.425 1.00 10.00 C ATOM 1108 CG PHE B 22 -6.171 -2.357 6.157 1.00 10.00 C ATOM 1109 CD1 PHE B 22 -4.906 -1.887 5.845 1.00 10.00 C ATOM 1110 CD2 PHE B 22 -6.379 -3.725 6.217 1.00 10.00 C ATOM 1111 CE1 PHE B 22 -3.868 -2.763 5.596 1.00 10.00 C ATOM 1112 CE2 PHE B 22 -5.346 -4.606 5.969 1.00 10.00 C ATOM 1113 CZ PHE B 22 -4.088 -4.125 5.658 1.00 10.00 C ATOM 0 H PHE B 22 -9.258 -1.218 8.368 1.00 10.00 H new ATOM 0 HA PHE B 22 -6.306 -1.040 8.281 1.00 10.00 H new ATOM 0 HB2 PHE B 22 -8.245 -1.914 6.268 1.00 10.00 H new ATOM 0 HB3 PHE B 22 -7.252 -0.586 5.701 1.00 10.00 H new ATOM 0 HD1 PHE B 22 -4.729 -0.823 5.796 1.00 10.00 H new ATOM 0 HD2 PHE B 22 -7.360 -4.106 6.460 1.00 10.00 H new ATOM 0 HE1 PHE B 22 -2.886 -2.384 5.353 1.00 10.00 H new ATOM 0 HE2 PHE B 22 -5.520 -5.671 6.018 1.00 10.00 H new ATOM 0 HZ PHE B 22 -3.279 -4.813 5.464 1.00 10.00 H new ATOM 1123 N SER B 23 -6.412 1.391 8.198 1.00 10.00 N ATOM 1124 CA SER B 23 -6.407 2.840 8.216 1.00 10.00 C ATOM 1125 C SER B 23 -5.001 3.333 7.920 1.00 10.00 C ATOM 1126 O SER B 23 -4.021 2.743 8.380 1.00 10.00 O ATOM 1127 CB SER B 23 -6.882 3.362 9.578 1.00 10.00 C ATOM 1128 OG SER B 23 -7.942 2.572 10.093 1.00 10.00 O ATOM 0 H SER B 23 -5.546 0.968 8.531 1.00 10.00 H new ATOM 0 HA SER B 23 -7.092 3.215 7.455 1.00 10.00 H new ATOM 0 HB2 SER B 23 -6.049 3.359 10.281 1.00 10.00 H new ATOM 0 HB3 SER B 23 -7.212 4.396 9.478 1.00 10.00 H new ATOM 0 HG SER B 23 -8.223 2.928 10.962 1.00 10.00 H new ATOM 1134 N ASP B 24 -4.898 4.396 7.150 1.00 10.00 N ATOM 1135 CA ASP B 24 -3.603 4.946 6.792 1.00 10.00 C ATOM 1136 C ASP B 24 -3.175 6.031 7.767 1.00 10.00 C ATOM 1137 O ASP B 24 -3.985 6.838 8.223 1.00 10.00 O ATOM 1138 CB ASP B 24 -3.605 5.486 5.356 1.00 10.00 C ATOM 1139 CG ASP B 24 -4.765 6.418 5.026 1.00 10.00 C ATOM 1140 OD1 ASP B 24 -5.742 6.487 5.803 1.00 10.00 O ATOM 1141 OD2 ASP B 24 -4.708 7.068 3.965 1.00 10.00 O ATOM 0 H ASP B 24 -5.695 4.898 6.759 1.00 10.00 H new ATOM 0 HA ASP B 24 -2.879 4.133 6.849 1.00 10.00 H new ATOM 0 HB2 ASP B 24 -2.669 6.017 5.181 1.00 10.00 H new ATOM 0 HB3 ASP B 24 -3.627 4.643 4.666 1.00 10.00 H new ATOM 1146 N GLU B 25 -1.892 6.036 8.084 1.00 10.00 N ATOM 1147 CA GLU B 25 -1.323 7.010 9.001 1.00 10.00 C ATOM 1148 C GLU B 25 -0.678 8.141 8.211 1.00 10.00 C ATOM 1149 O GLU B 25 -0.765 9.307 8.581 1.00 10.00 O ATOM 1150 CB GLU B 25 -0.291 6.343 9.920 1.00 10.00 C ATOM 1151 CG GLU B 25 -0.147 4.841 9.704 1.00 10.00 C ATOM 1152 CD GLU B 25 0.768 4.497 8.545 1.00 10.00 C ATOM 1153 OE1 GLU B 25 0.386 4.754 7.382 1.00 10.00 O ATOM 1154 OE2 GLU B 25 1.867 3.955 8.797 1.00 10.00 O ATOM 0 H GLU B 25 -1.216 5.367 7.715 1.00 10.00 H new ATOM 0 HA GLU B 25 -2.119 7.419 9.623 1.00 10.00 H new ATOM 0 HB2 GLU B 25 0.678 6.817 9.765 1.00 10.00 H new ATOM 0 HB3 GLU B 25 -0.572 6.525 10.957 1.00 10.00 H new ATOM 0 HG2 GLU B 25 0.240 4.384 10.614 1.00 10.00 H new ATOM 0 HG3 GLU B 25 -1.131 4.409 9.524 1.00 10.00 H new ATOM 1161 N GLY B 26 -0.040 7.776 7.105 1.00 10.00 N ATOM 1162 CA GLY B 26 0.602 8.761 6.263 1.00 10.00 C ATOM 1163 C GLY B 26 -0.307 9.227 5.143 1.00 10.00 C ATOM 1164 O GLY B 26 0.137 9.911 4.223 1.00 10.00 O ATOM 0 H GLY B 26 0.043 6.813 6.778 1.00 10.00 H new ATOM 0 HA2 GLY B 26 0.900 9.617 6.868 1.00 10.00 H new ATOM 0 HA3 GLY B 26 1.513 8.338 5.839 1.00 10.00 H new ATOM 1168 N GLY B 27 -1.578 8.847 5.227 1.00 10.00 N ATOM 1169 CA GLY B 27 -2.548 9.231 4.218 1.00 10.00 C ATOM 1170 C GLY B 27 -2.256 8.608 2.867 1.00 10.00 C ATOM 1171 O GLY B 27 -2.431 9.245 1.834 1.00 10.00 O ATOM 0 H GLY B 27 -1.956 8.275 5.983 1.00 10.00 H new ATOM 0 HA2 GLY B 27 -3.544 8.933 4.544 1.00 10.00 H new ATOM 0 HA3 GLY B 27 -2.556 10.317 4.120 1.00 10.00 H new ATOM 1175 N TRP B 28 -1.800 7.361 2.880 1.00 10.00 N ATOM 1176 CA TRP B 28 -1.467 6.668 1.643 1.00 10.00 C ATOM 1177 C TRP B 28 -2.615 5.778 1.142 1.00 10.00 C ATOM 1178 O TRP B 28 -2.731 5.531 -0.057 1.00 10.00 O ATOM 1179 CB TRP B 28 -0.177 5.851 1.817 1.00 10.00 C ATOM 1180 CG TRP B 28 -0.277 4.711 2.786 1.00 10.00 C ATOM 1181 CD1 TRP B 28 -0.054 4.756 4.130 1.00 10.00 C ATOM 1182 CD2 TRP B 28 -0.600 3.349 2.479 1.00 10.00 C ATOM 1183 NE1 TRP B 28 -0.220 3.508 4.680 1.00 10.00 N ATOM 1184 CE2 TRP B 28 -0.559 2.625 3.684 1.00 10.00 C ATOM 1185 CE3 TRP B 28 -0.923 2.675 1.298 1.00 10.00 C ATOM 1186 CZ2 TRP B 28 -0.830 1.258 3.741 1.00 10.00 C ATOM 1187 CZ3 TRP B 28 -1.191 1.321 1.354 1.00 10.00 C ATOM 1188 CH2 TRP B 28 -1.143 0.626 2.567 1.00 10.00 C ATOM 0 H TRP B 28 -1.653 6.813 3.728 1.00 10.00 H new ATOM 0 HA TRP B 28 -1.304 7.429 0.880 1.00 10.00 H new ATOM 0 HB2 TRP B 28 0.120 5.457 0.845 1.00 10.00 H new ATOM 0 HB3 TRP B 28 0.618 6.520 2.147 1.00 10.00 H new ATOM 0 HD1 TRP B 28 0.214 5.644 4.683 1.00 10.00 H new ATOM 0 HE1 TRP B 28 -0.110 3.275 5.667 1.00 10.00 H new ATOM 0 HE3 TRP B 28 -0.962 3.204 0.357 1.00 10.00 H new ATOM 0 HZ2 TRP B 28 -0.794 0.718 4.676 1.00 10.00 H new ATOM 0 HZ3 TRP B 28 -1.441 0.791 0.447 1.00 10.00 H new ATOM 0 HH2 TRP B 28 -1.358 -0.432 2.578 1.00 10.00 H new ATOM 1199 N LEU B 29 -3.469 5.323 2.053 1.00 10.00 N ATOM 1200 CA LEU B 29 -4.592 4.464 1.685 1.00 10.00 C ATOM 1201 C LEU B 29 -5.668 5.280 0.986 1.00 10.00 C ATOM 1202 O LEU B 29 -6.296 4.818 0.031 1.00 10.00 O ATOM 1203 CB LEU B 29 -5.175 3.769 2.921 1.00 10.00 C ATOM 1204 CG LEU B 29 -6.347 2.819 2.659 1.00 10.00 C ATOM 1205 CD1 LEU B 29 -5.865 1.515 2.040 1.00 10.00 C ATOM 1206 CD2 LEU B 29 -7.104 2.551 3.950 1.00 10.00 C ATOM 0 H LEU B 29 -3.406 5.533 3.049 1.00 10.00 H new ATOM 0 HA LEU B 29 -4.227 3.697 1.001 1.00 10.00 H new ATOM 0 HB2 LEU B 29 -4.378 3.207 3.409 1.00 10.00 H new ATOM 0 HB3 LEU B 29 -5.502 4.534 3.625 1.00 10.00 H new ATOM 0 HG LEU B 29 -7.023 3.296 1.949 1.00 10.00 H new ATOM 0 HD11 LEU B 29 -6.717 0.859 1.864 1.00 10.00 H new ATOM 0 HD12 LEU B 29 -5.367 1.724 1.093 1.00 10.00 H new ATOM 0 HD13 LEU B 29 -5.165 1.027 2.718 1.00 10.00 H new ATOM 0 HD21 LEU B 29 -7.935 1.874 3.751 1.00 10.00 H new ATOM 0 HD22 LEU B 29 -6.432 2.096 4.678 1.00 10.00 H new ATOM 0 HD23 LEU B 29 -7.488 3.490 4.348 1.00 10.00 H new ATOM 1218 N THR B 30 -5.864 6.508 1.450 1.00 10.00 N ATOM 1219 CA THR B 30 -6.846 7.400 0.853 1.00 10.00 C ATOM 1220 C THR B 30 -6.437 7.749 -0.581 1.00 10.00 C ATOM 1221 O THR B 30 -7.265 8.164 -1.390 1.00 10.00 O ATOM 1222 CB THR B 30 -7.022 8.688 1.690 1.00 10.00 C ATOM 1223 OG1 THR B 30 -8.089 9.487 1.157 1.00 10.00 O ATOM 1224 CG2 THR B 30 -5.736 9.501 1.717 1.00 10.00 C ATOM 0 H THR B 30 -5.355 6.908 2.238 1.00 10.00 H new ATOM 0 HA THR B 30 -7.805 6.882 0.835 1.00 10.00 H new ATOM 0 HB THR B 30 -7.268 8.394 2.710 1.00 10.00 H new ATOM 0 HG1 THR B 30 -8.191 10.299 1.697 1.00 10.00 H new ATOM 0 HG21 THR B 30 -5.887 10.401 2.312 1.00 10.00 H new ATOM 0 HG22 THR B 30 -4.938 8.904 2.158 1.00 10.00 H new ATOM 0 HG23 THR B 30 -5.461 9.780 0.700 1.00 10.00 H new ATOM 1232 N ARG B 31 -5.151 7.568 -0.883 1.00 10.00 N ATOM 1233 CA ARG B 31 -4.622 7.833 -2.218 1.00 10.00 C ATOM 1234 C ARG B 31 -4.734 6.565 -3.059 1.00 10.00 C ATOM 1235 O ARG B 31 -4.869 6.611 -4.281 1.00 10.00 O ATOM 1236 CB ARG B 31 -3.158 8.273 -2.135 1.00 10.00 C ATOM 1237 CG ARG B 31 -2.918 9.430 -1.177 1.00 10.00 C ATOM 1238 CD ARG B 31 -3.149 10.776 -1.842 1.00 10.00 C ATOM 1239 NE ARG B 31 -1.943 11.273 -2.503 1.00 10.00 N ATOM 1240 CZ ARG B 31 -1.192 12.275 -2.040 1.00 10.00 C ATOM 1241 NH1 ARG B 31 -1.506 12.873 -0.896 1.00 10.00 N ATOM 1242 NH2 ARG B 31 -0.128 12.672 -2.721 1.00 10.00 N ATOM 0 H ARG B 31 -4.454 7.237 -0.216 1.00 10.00 H new ATOM 0 HA ARG B 31 -5.198 8.635 -2.680 1.00 10.00 H new ATOM 0 HB2 ARG B 31 -2.550 7.424 -1.824 1.00 10.00 H new ATOM 0 HB3 ARG B 31 -2.818 8.561 -3.130 1.00 10.00 H new ATOM 0 HG2 ARG B 31 -3.580 9.332 -0.317 1.00 10.00 H new ATOM 0 HG3 ARG B 31 -1.896 9.382 -0.800 1.00 10.00 H new ATOM 0 HD2 ARG B 31 -3.953 10.686 -2.573 1.00 10.00 H new ATOM 0 HD3 ARG B 31 -3.477 11.498 -1.095 1.00 10.00 H new ATOM 0 HE ARG B 31 -1.657 10.825 -3.374 1.00 10.00 H new ATOM 0 HH11 ARG B 31 -2.323 12.567 -0.368 1.00 10.00 H new ATOM 0 HH12 ARG B 31 -0.930 13.638 -0.546 1.00 10.00 H new ATOM 0 HH21 ARG B 31 0.117 12.212 -3.598 1.00 10.00 H new ATOM 0 HH22 ARG B 31 0.447 13.437 -2.369 1.00 10.00 H new ATOM 1256 N LEU B 32 -4.687 5.428 -2.378 1.00 10.00 N ATOM 1257 CA LEU B 32 -4.785 4.128 -3.024 1.00 10.00 C ATOM 1258 C LEU B 32 -6.159 3.952 -3.662 1.00 10.00 C ATOM 1259 O LEU B 32 -6.274 3.486 -4.793 1.00 10.00 O ATOM 1260 CB LEU B 32 -4.520 3.018 -1.999 1.00 10.00 C ATOM 1261 CG LEU B 32 -4.572 1.586 -2.540 1.00 10.00 C ATOM 1262 CD1 LEU B 32 -3.401 0.774 -2.010 1.00 10.00 C ATOM 1263 CD2 LEU B 32 -5.890 0.922 -2.165 1.00 10.00 C ATOM 0 H LEU B 32 -4.580 5.382 -1.365 1.00 10.00 H new ATOM 0 HA LEU B 32 -4.034 4.066 -3.812 1.00 10.00 H new ATOM 0 HB2 LEU B 32 -3.537 3.184 -1.557 1.00 10.00 H new ATOM 0 HB3 LEU B 32 -5.250 3.110 -1.195 1.00 10.00 H new ATOM 0 HG LEU B 32 -4.502 1.626 -3.627 1.00 10.00 H new ATOM 0 HD11 LEU B 32 -3.454 -0.241 -2.404 1.00 10.00 H new ATOM 0 HD12 LEU B 32 -2.465 1.237 -2.324 1.00 10.00 H new ATOM 0 HD13 LEU B 32 -3.443 0.743 -0.921 1.00 10.00 H new ATOM 0 HD21 LEU B 32 -5.910 -0.095 -2.557 1.00 10.00 H new ATOM 0 HD22 LEU B 32 -5.987 0.894 -1.080 1.00 10.00 H new ATOM 0 HD23 LEU B 32 -6.718 1.491 -2.589 1.00 10.00 H new ATOM 1275 N LEU B 33 -7.193 4.362 -2.939 1.00 10.00 N ATOM 1276 CA LEU B 33 -8.568 4.250 -3.423 1.00 10.00 C ATOM 1277 C LEU B 33 -8.828 5.195 -4.594 1.00 10.00 C ATOM 1278 O LEU B 33 -9.837 5.080 -5.282 1.00 10.00 O ATOM 1279 CB LEU B 33 -9.551 4.551 -2.291 1.00 10.00 C ATOM 1280 CG LEU B 33 -9.434 3.641 -1.064 1.00 10.00 C ATOM 1281 CD1 LEU B 33 -10.318 4.153 0.061 1.00 10.00 C ATOM 1282 CD2 LEU B 33 -9.802 2.206 -1.416 1.00 10.00 C ATOM 0 H LEU B 33 -7.108 4.777 -2.011 1.00 10.00 H new ATOM 0 HA LEU B 33 -8.714 3.228 -3.772 1.00 10.00 H new ATOM 0 HB2 LEU B 33 -9.408 5.583 -1.972 1.00 10.00 H new ATOM 0 HB3 LEU B 33 -10.565 4.476 -2.683 1.00 10.00 H new ATOM 0 HG LEU B 33 -8.397 3.654 -0.728 1.00 10.00 H new ATOM 0 HD11 LEU B 33 -10.224 3.496 0.926 1.00 10.00 H new ATOM 0 HD12 LEU B 33 -10.009 5.161 0.336 1.00 10.00 H new ATOM 0 HD13 LEU B 33 -11.356 4.170 -0.271 1.00 10.00 H new ATOM 0 HD21 LEU B 33 -9.711 1.579 -0.529 1.00 10.00 H new ATOM 0 HD22 LEU B 33 -10.829 2.173 -1.781 1.00 10.00 H new ATOM 0 HD23 LEU B 33 -9.130 1.838 -2.191 1.00 10.00 H new ATOM 1294 N GLN B 34 -7.915 6.129 -4.815 1.00 10.00 N ATOM 1295 CA GLN B 34 -8.062 7.082 -5.901 1.00 10.00 C ATOM 1296 C GLN B 34 -7.350 6.587 -7.157 1.00 10.00 C ATOM 1297 O GLN B 34 -7.715 6.948 -8.272 1.00 10.00 O ATOM 1298 CB GLN B 34 -7.502 8.448 -5.493 1.00 10.00 C ATOM 1299 CG GLN B 34 -8.179 9.052 -4.272 1.00 10.00 C ATOM 1300 CD GLN B 34 -9.660 9.296 -4.480 1.00 10.00 C ATOM 1301 OE1 GLN B 34 -10.098 9.657 -5.573 1.00 10.00 O ATOM 1302 NE2 GLN B 34 -10.436 9.100 -3.428 1.00 10.00 N ATOM 0 H GLN B 34 -7.068 6.246 -4.258 1.00 10.00 H new ATOM 0 HA GLN B 34 -9.125 7.183 -6.119 1.00 10.00 H new ATOM 0 HB2 GLN B 34 -6.435 8.347 -5.292 1.00 10.00 H new ATOM 0 HB3 GLN B 34 -7.605 9.137 -6.331 1.00 10.00 H new ATOM 0 HG2 GLN B 34 -8.042 8.386 -3.420 1.00 10.00 H new ATOM 0 HG3 GLN B 34 -7.692 9.995 -4.022 1.00 10.00 H new ATOM 0 HE21 GLN B 34 -10.028 8.801 -2.542 1.00 10.00 H new ATOM 0 HE22 GLN B 34 -11.442 9.248 -3.502 1.00 10.00 H new ATOM 1311 N THR B 35 -6.332 5.756 -6.965 1.00 10.00 N ATOM 1312 CA THR B 35 -5.562 5.233 -8.085 1.00 10.00 C ATOM 1313 C THR B 35 -5.995 3.819 -8.471 1.00 10.00 C ATOM 1314 O THR B 35 -5.814 3.397 -9.614 1.00 10.00 O ATOM 1315 CB THR B 35 -4.053 5.236 -7.768 1.00 10.00 C ATOM 1316 OG1 THR B 35 -3.832 4.830 -6.409 1.00 10.00 O ATOM 1317 CG2 THR B 35 -3.455 6.616 -7.996 1.00 10.00 C ATOM 0 H THR B 35 -6.022 5.432 -6.049 1.00 10.00 H new ATOM 0 HA THR B 35 -5.757 5.893 -8.930 1.00 10.00 H new ATOM 0 HB THR B 35 -3.563 4.530 -8.439 1.00 10.00 H new ATOM 0 HG1 THR B 35 -4.086 5.559 -5.805 1.00 10.00 H new ATOM 0 HG21 THR B 35 -2.390 6.593 -7.766 1.00 10.00 H new ATOM 0 HG22 THR B 35 -3.595 6.906 -9.037 1.00 10.00 H new ATOM 0 HG23 THR B 35 -3.951 7.339 -7.348 1.00 10.00 H new ATOM 1325 N LYS B 36 -6.551 3.081 -7.517 1.00 10.00 N ATOM 1326 CA LYS B 36 -6.997 1.714 -7.768 1.00 10.00 C ATOM 1327 C LYS B 36 -8.503 1.585 -7.579 1.00 10.00 C ATOM 1328 O LYS B 36 -9.031 0.478 -7.473 1.00 10.00 O ATOM 1329 CB LYS B 36 -6.261 0.734 -6.849 1.00 10.00 C ATOM 1330 CG LYS B 36 -4.784 0.593 -7.181 1.00 10.00 C ATOM 1331 CD LYS B 36 -3.904 1.076 -6.039 1.00 10.00 C ATOM 1332 CE LYS B 36 -2.471 1.308 -6.499 1.00 10.00 C ATOM 1333 NZ LYS B 36 -2.380 2.433 -7.466 1.00 10.00 N ATOM 0 H LYS B 36 -6.704 3.406 -6.562 1.00 10.00 H new ATOM 0 HA LYS B 36 -6.763 1.469 -8.804 1.00 10.00 H new ATOM 0 HB2 LYS B 36 -6.364 1.068 -5.816 1.00 10.00 H new ATOM 0 HB3 LYS B 36 -6.737 -0.244 -6.917 1.00 10.00 H new ATOM 0 HG2 LYS B 36 -4.558 -0.451 -7.399 1.00 10.00 H new ATOM 0 HG3 LYS B 36 -4.557 1.163 -8.082 1.00 10.00 H new ATOM 0 HD2 LYS B 36 -4.311 2.001 -5.631 1.00 10.00 H new ATOM 0 HD3 LYS B 36 -3.915 0.341 -5.234 1.00 10.00 H new ATOM 0 HE2 LYS B 36 -1.841 1.519 -5.635 1.00 10.00 H new ATOM 0 HE3 LYS B 36 -2.085 0.399 -6.961 1.00 10.00 H new ATOM 0 HZ1 LYS B 36 -1.395 2.762 -7.525 1.00 10.00 H new ATOM 0 HZ2 LYS B 36 -2.694 2.111 -8.404 1.00 10.00 H new ATOM 0 HZ3 LYS B 36 -2.987 3.215 -7.147 1.00 10.00 H new ATOM 1347 N ASN B 37 -9.178 2.735 -7.535 1.00 10.00 N ATOM 1348 CA ASN B 37 -10.635 2.801 -7.366 1.00 10.00 C ATOM 1349 C ASN B 37 -11.062 2.325 -5.973 1.00 10.00 C ATOM 1350 O ASN B 37 -10.278 1.736 -5.228 1.00 10.00 O ATOM 1351 CB ASN B 37 -11.347 1.973 -8.448 1.00 10.00 C ATOM 1352 CG ASN B 37 -12.834 2.270 -8.525 1.00 10.00 C ATOM 1353 OD1 ASN B 37 -13.260 3.411 -8.345 1.00 10.00 O ATOM 1354 ND2 ASN B 37 -13.636 1.246 -8.770 1.00 10.00 N ATOM 0 H ASN B 37 -8.732 3.649 -7.615 1.00 10.00 H new ATOM 0 HA ASN B 37 -10.928 3.846 -7.471 1.00 10.00 H new ATOM 0 HB2 ASN B 37 -10.889 2.176 -9.416 1.00 10.00 H new ATOM 0 HB3 ASN B 37 -11.202 0.912 -8.243 1.00 10.00 H new ATOM 0 HD21 ASN B 37 -14.645 1.388 -8.815 1.00 10.00 H new ATOM 0 HD22 ASN B 37 -13.245 0.315 -8.914 1.00 10.00 H new ATOM 1361 N TYR B 38 -12.317 2.598 -5.627 1.00 10.00 N ATOM 1362 CA TYR B 38 -12.874 2.199 -4.342 1.00 10.00 C ATOM 1363 C TYR B 38 -13.305 0.737 -4.394 1.00 10.00 C ATOM 1364 O TYR B 38 -14.461 0.405 -4.126 1.00 10.00 O ATOM 1365 CB TYR B 38 -14.083 3.071 -3.987 1.00 10.00 C ATOM 1366 CG TYR B 38 -13.811 4.561 -3.994 1.00 10.00 C ATOM 1367 CD1 TYR B 38 -13.275 5.195 -2.882 1.00 10.00 C ATOM 1368 CD2 TYR B 38 -14.099 5.332 -5.113 1.00 10.00 C ATOM 1369 CE1 TYR B 38 -13.039 6.558 -2.882 1.00 10.00 C ATOM 1370 CE2 TYR B 38 -13.863 6.692 -5.123 1.00 10.00 C ATOM 1371 CZ TYR B 38 -13.335 7.302 -4.007 1.00 10.00 C ATOM 1372 OH TYR B 38 -13.107 8.661 -4.015 1.00 10.00 O ATOM 0 H TYR B 38 -12.972 3.099 -6.227 1.00 10.00 H new ATOM 0 HA TYR B 38 -12.106 2.328 -3.579 1.00 10.00 H new ATOM 0 HB2 TYR B 38 -14.887 2.859 -4.692 1.00 10.00 H new ATOM 0 HB3 TYR B 38 -14.442 2.785 -2.998 1.00 10.00 H new ATOM 0 HD1 TYR B 38 -13.038 4.615 -2.002 1.00 10.00 H new ATOM 0 HD2 TYR B 38 -14.515 4.859 -5.990 1.00 10.00 H new ATOM 0 HE1 TYR B 38 -12.626 7.038 -2.007 1.00 10.00 H new ATOM 0 HE2 TYR B 38 -14.092 7.275 -6.003 1.00 10.00 H new ATOM 0 HH TYR B 38 -13.369 9.032 -4.884 1.00 10.00 H new ATOM 1382 N ASP B 39 -12.380 -0.132 -4.763 1.00 10.00 N ATOM 1383 CA ASP B 39 -12.673 -1.553 -4.860 1.00 10.00 C ATOM 1384 C ASP B 39 -12.013 -2.309 -3.722 1.00 10.00 C ATOM 1385 O ASP B 39 -10.797 -2.490 -3.711 1.00 10.00 O ATOM 1386 CB ASP B 39 -12.202 -2.110 -6.201 1.00 10.00 C ATOM 1387 CG ASP B 39 -13.352 -2.602 -7.046 1.00 10.00 C ATOM 1388 OD1 ASP B 39 -13.862 -3.711 -6.777 1.00 10.00 O ATOM 1389 OD2 ASP B 39 -13.754 -1.886 -7.981 1.00 10.00 O ATOM 0 H ASP B 39 -11.421 0.120 -5.000 1.00 10.00 H new ATOM 0 HA ASP B 39 -13.753 -1.683 -4.789 1.00 10.00 H new ATOM 0 HB2 ASP B 39 -11.659 -1.337 -6.744 1.00 10.00 H new ATOM 0 HB3 ASP B 39 -11.503 -2.929 -6.028 1.00 10.00 H new ATOM 1394 N ILE B 40 -12.825 -2.746 -2.769 1.00 10.00 N ATOM 1395 CA ILE B 40 -12.338 -3.484 -1.609 1.00 10.00 C ATOM 1396 C ILE B 40 -11.575 -4.735 -2.038 1.00 10.00 C ATOM 1397 O ILE B 40 -10.455 -4.976 -1.585 1.00 10.00 O ATOM 1398 CB ILE B 40 -13.503 -3.889 -0.683 1.00 10.00 C ATOM 1399 CG1 ILE B 40 -14.311 -2.650 -0.275 1.00 10.00 C ATOM 1400 CG2 ILE B 40 -12.986 -4.620 0.549 1.00 10.00 C ATOM 1401 CD1 ILE B 40 -15.698 -2.975 0.242 1.00 10.00 C ATOM 0 H ILE B 40 -13.835 -2.601 -2.777 1.00 10.00 H new ATOM 0 HA ILE B 40 -11.663 -2.824 -1.064 1.00 10.00 H new ATOM 0 HB ILE B 40 -14.157 -4.568 -1.229 1.00 10.00 H new ATOM 0 HG12 ILE B 40 -13.763 -2.106 0.495 1.00 10.00 H new ATOM 0 HG13 ILE B 40 -14.399 -1.985 -1.134 1.00 10.00 H new ATOM 0 HG21 ILE B 40 -13.825 -4.896 1.187 1.00 10.00 H new ATOM 0 HG22 ILE B 40 -12.453 -5.520 0.241 1.00 10.00 H new ATOM 0 HG23 ILE B 40 -12.309 -3.968 1.101 1.00 10.00 H new ATOM 0 HD11 ILE B 40 -16.211 -2.052 0.511 1.00 10.00 H new ATOM 0 HD12 ILE B 40 -16.264 -3.492 -0.533 1.00 10.00 H new ATOM 0 HD13 ILE B 40 -15.618 -3.615 1.120 1.00 10.00 H new ATOM 1413 N GLY B 41 -12.181 -5.519 -2.926 1.00 10.00 N ATOM 1414 CA GLY B 41 -11.545 -6.732 -3.406 1.00 10.00 C ATOM 1415 C GLY B 41 -10.203 -6.466 -4.060 1.00 10.00 C ATOM 1416 O GLY B 41 -9.225 -7.153 -3.777 1.00 10.00 O ATOM 0 H GLY B 41 -13.103 -5.335 -3.322 1.00 10.00 H new ATOM 0 HA2 GLY B 41 -11.409 -7.421 -2.572 1.00 10.00 H new ATOM 0 HA3 GLY B 41 -12.203 -7.224 -4.122 1.00 10.00 H new ATOM 1420 N ALA B 42 -10.153 -5.461 -4.924 1.00 10.00 N ATOM 1421 CA ALA B 42 -8.916 -5.103 -5.607 1.00 10.00 C ATOM 1422 C ALA B 42 -7.865 -4.619 -4.614 1.00 10.00 C ATOM 1423 O ALA B 42 -6.710 -5.039 -4.669 1.00 10.00 O ATOM 1424 CB ALA B 42 -9.176 -4.040 -6.663 1.00 10.00 C ATOM 0 H ALA B 42 -10.954 -4.879 -5.169 1.00 10.00 H new ATOM 0 HA ALA B 42 -8.533 -5.997 -6.100 1.00 10.00 H new ATOM 0 HB1 ALA B 42 -8.241 -3.786 -7.162 1.00 10.00 H new ATOM 0 HB2 ALA B 42 -9.886 -4.422 -7.396 1.00 10.00 H new ATOM 0 HB3 ALA B 42 -9.588 -3.149 -6.189 1.00 10.00 H new ATOM 1430 N ALA B 43 -8.273 -3.750 -3.700 1.00 10.00 N ATOM 1431 CA ALA B 43 -7.368 -3.218 -2.691 1.00 10.00 C ATOM 1432 C ALA B 43 -6.793 -4.342 -1.835 1.00 10.00 C ATOM 1433 O ALA B 43 -5.586 -4.406 -1.596 1.00 10.00 O ATOM 1434 CB ALA B 43 -8.087 -2.203 -1.814 1.00 10.00 C ATOM 0 H ALA B 43 -9.228 -3.397 -3.636 1.00 10.00 H new ATOM 0 HA ALA B 43 -6.545 -2.718 -3.201 1.00 10.00 H new ATOM 0 HB1 ALA B 43 -7.396 -1.815 -1.065 1.00 10.00 H new ATOM 0 HB2 ALA B 43 -8.451 -1.382 -2.431 1.00 10.00 H new ATOM 0 HB3 ALA B 43 -8.929 -2.684 -1.316 1.00 10.00 H new ATOM 1440 N LEU B 44 -7.667 -5.243 -1.402 1.00 10.00 N ATOM 1441 CA LEU B 44 -7.270 -6.375 -0.574 1.00 10.00 C ATOM 1442 C LEU B 44 -6.379 -7.341 -1.346 1.00 10.00 C ATOM 1443 O LEU B 44 -5.479 -7.951 -0.779 1.00 10.00 O ATOM 1444 CB LEU B 44 -8.507 -7.116 -0.062 1.00 10.00 C ATOM 1445 CG LEU B 44 -8.835 -6.897 1.416 1.00 10.00 C ATOM 1446 CD1 LEU B 44 -9.051 -5.420 1.709 1.00 10.00 C ATOM 1447 CD2 LEU B 44 -10.065 -7.700 1.804 1.00 10.00 C ATOM 0 H LEU B 44 -8.664 -5.210 -1.613 1.00 10.00 H new ATOM 0 HA LEU B 44 -6.703 -5.985 0.271 1.00 10.00 H new ATOM 0 HB2 LEU B 44 -9.367 -6.809 -0.657 1.00 10.00 H new ATOM 0 HB3 LEU B 44 -8.367 -8.184 -0.232 1.00 10.00 H new ATOM 0 HG LEU B 44 -7.989 -7.241 2.011 1.00 10.00 H new ATOM 0 HD11 LEU B 44 -9.283 -5.289 2.766 1.00 10.00 H new ATOM 0 HD12 LEU B 44 -8.146 -4.864 1.464 1.00 10.00 H new ATOM 0 HD13 LEU B 44 -9.879 -5.047 1.107 1.00 10.00 H new ATOM 0 HD21 LEU B 44 -10.289 -7.536 2.858 1.00 10.00 H new ATOM 0 HD22 LEU B 44 -10.914 -7.381 1.199 1.00 10.00 H new ATOM 0 HD23 LEU B 44 -9.876 -8.760 1.634 1.00 10.00 H new ATOM 1459 N ASP B 45 -6.641 -7.483 -2.638 1.00 10.00 N ATOM 1460 CA ASP B 45 -5.864 -8.385 -3.488 1.00 10.00 C ATOM 1461 C ASP B 45 -4.469 -7.835 -3.774 1.00 10.00 C ATOM 1462 O ASP B 45 -3.508 -8.590 -3.903 1.00 10.00 O ATOM 1463 CB ASP B 45 -6.599 -8.640 -4.807 1.00 10.00 C ATOM 1464 CG ASP B 45 -5.782 -9.488 -5.762 1.00 10.00 C ATOM 1465 OD1 ASP B 45 -5.584 -10.689 -5.478 1.00 10.00 O ATOM 1466 OD2 ASP B 45 -5.337 -8.958 -6.804 1.00 10.00 O ATOM 0 H ASP B 45 -7.387 -6.985 -3.125 1.00 10.00 H new ATOM 0 HA ASP B 45 -5.751 -9.324 -2.946 1.00 10.00 H new ATOM 0 HB2 ASP B 45 -7.547 -9.137 -4.603 1.00 10.00 H new ATOM 0 HB3 ASP B 45 -6.834 -7.687 -5.280 1.00 10.00 H new ATOM 1471 N THR B 46 -4.362 -6.518 -3.862 1.00 10.00 N ATOM 1472 CA THR B 46 -3.083 -5.871 -4.135 1.00 10.00 C ATOM 1473 C THR B 46 -2.098 -6.083 -2.986 1.00 10.00 C ATOM 1474 O THR B 46 -0.897 -6.241 -3.206 1.00 10.00 O ATOM 1475 CB THR B 46 -3.270 -4.360 -4.375 1.00 10.00 C ATOM 1476 OG1 THR B 46 -4.309 -4.142 -5.341 1.00 10.00 O ATOM 1477 CG2 THR B 46 -1.980 -3.718 -4.871 1.00 10.00 C ATOM 0 H THR B 46 -5.145 -5.874 -3.749 1.00 10.00 H new ATOM 0 HA THR B 46 -2.676 -6.329 -5.036 1.00 10.00 H new ATOM 0 HB THR B 46 -3.545 -3.901 -3.425 1.00 10.00 H new ATOM 0 HG1 THR B 46 -5.182 -4.190 -4.899 1.00 10.00 H new ATOM 0 HG21 THR B 46 -2.142 -2.652 -5.032 1.00 10.00 H new ATOM 0 HG22 THR B 46 -1.195 -3.858 -4.128 1.00 10.00 H new ATOM 0 HG23 THR B 46 -1.679 -4.184 -5.809 1.00 10.00 H new ATOM 1485 N ILE B 47 -2.607 -6.099 -1.764 1.00 10.00 N ATOM 1486 CA ILE B 47 -1.757 -6.272 -0.593 1.00 10.00 C ATOM 1487 C ILE B 47 -1.845 -7.692 -0.031 1.00 10.00 C ATOM 1488 O ILE B 47 -1.074 -8.064 0.851 1.00 10.00 O ATOM 1489 CB ILE B 47 -2.115 -5.248 0.503 1.00 10.00 C ATOM 1490 CG1 ILE B 47 -3.583 -5.402 0.915 1.00 10.00 C ATOM 1491 CG2 ILE B 47 -1.842 -3.831 0.002 1.00 10.00 C ATOM 1492 CD1 ILE B 47 -4.006 -4.476 2.036 1.00 10.00 C ATOM 0 H ILE B 47 -3.600 -5.995 -1.556 1.00 10.00 H new ATOM 0 HA ILE B 47 -0.730 -6.101 -0.916 1.00 10.00 H new ATOM 0 HB ILE B 47 -1.493 -5.433 1.379 1.00 10.00 H new ATOM 0 HG12 ILE B 47 -4.215 -5.218 0.046 1.00 10.00 H new ATOM 0 HG13 ILE B 47 -3.758 -6.433 1.223 1.00 10.00 H new ATOM 0 HG21 ILE B 47 -2.097 -3.114 0.782 1.00 10.00 H new ATOM 0 HG22 ILE B 47 -0.786 -3.732 -0.251 1.00 10.00 H new ATOM 0 HG23 ILE B 47 -2.447 -3.635 -0.883 1.00 10.00 H new ATOM 0 HD11 ILE B 47 -5.057 -4.645 2.270 1.00 10.00 H new ATOM 0 HD12 ILE B 47 -3.401 -4.675 2.920 1.00 10.00 H new ATOM 0 HD13 ILE B 47 -3.865 -3.441 1.725 1.00 10.00 H new ATOM 1504 N GLN B 48 -2.812 -8.462 -0.528 1.00 10.00 N ATOM 1505 CA GLN B 48 -3.026 -9.859 -0.121 1.00 10.00 C ATOM 1506 C GLN B 48 -3.454 -10.007 1.344 1.00 10.00 C ATOM 1507 O GLN B 48 -3.801 -11.106 1.786 1.00 10.00 O ATOM 1508 CB GLN B 48 -1.774 -10.691 -0.393 1.00 10.00 C ATOM 1509 CG GLN B 48 -1.885 -11.547 -1.645 1.00 10.00 C ATOM 1510 CD GLN B 48 -2.899 -12.669 -1.497 1.00 10.00 C ATOM 1511 OE1 GLN B 48 -2.945 -13.283 -0.322 1.00 10.00 O flip ATOM 1512 NE2 GLN B 48 -3.625 -12.993 -2.434 1.00 10.00 N flip ATOM 0 H GLN B 48 -3.476 -8.136 -1.230 1.00 10.00 H new ATOM 0 HA GLN B 48 -3.853 -10.231 -0.725 1.00 10.00 H new ATOM 0 HB2 GLN B 48 -0.917 -10.025 -0.491 1.00 10.00 H new ATOM 0 HB3 GLN B 48 -1.580 -11.336 0.464 1.00 10.00 H new ATOM 0 HG2 GLN B 48 -2.167 -10.916 -2.488 1.00 10.00 H new ATOM 0 HG3 GLN B 48 -0.909 -11.973 -1.878 1.00 10.00 H new ATOM 0 HE21 GLN B 48 -3.561 -12.498 -3.323 1.00 10.00 H new ATOM 0 HE22 GLN B 48 -4.291 -13.757 -2.322 1.00 10.00 H new ATOM 1521 N TYR B 49 -3.437 -8.917 2.093 1.00 10.00 N ATOM 1522 CA TYR B 49 -3.831 -8.945 3.495 1.00 10.00 C ATOM 1523 C TYR B 49 -5.350 -8.953 3.615 1.00 10.00 C ATOM 1524 O TYR B 49 -5.983 -7.903 3.698 1.00 10.00 O ATOM 1525 CB TYR B 49 -3.251 -7.742 4.248 1.00 10.00 C ATOM 1526 CG TYR B 49 -1.823 -7.930 4.724 1.00 10.00 C ATOM 1527 CD1 TYR B 49 -0.968 -8.840 4.112 1.00 10.00 C ATOM 1528 CD2 TYR B 49 -1.333 -7.190 5.791 1.00 10.00 C ATOM 1529 CE1 TYR B 49 0.335 -9.003 4.551 1.00 10.00 C ATOM 1530 CE2 TYR B 49 -0.034 -7.346 6.236 1.00 10.00 C ATOM 1531 CZ TYR B 49 0.796 -8.253 5.613 1.00 10.00 C ATOM 1532 OH TYR B 49 2.093 -8.408 6.059 1.00 10.00 O ATOM 0 H TYR B 49 -3.154 -7.998 1.754 1.00 10.00 H new ATOM 0 HA TYR B 49 -3.434 -9.856 3.943 1.00 10.00 H new ATOM 0 HB2 TYR B 49 -3.292 -6.868 3.598 1.00 10.00 H new ATOM 0 HB3 TYR B 49 -3.883 -7.529 5.110 1.00 10.00 H new ATOM 0 HD1 TYR B 49 -1.326 -9.429 3.281 1.00 10.00 H new ATOM 0 HD2 TYR B 49 -1.979 -6.478 6.283 1.00 10.00 H new ATOM 0 HE1 TYR B 49 0.987 -9.714 4.065 1.00 10.00 H new ATOM 0 HE2 TYR B 49 0.329 -6.760 7.068 1.00 10.00 H new ATOM 0 HH TYR B 49 2.703 -8.423 5.292 1.00 10.00 H new ATOM 1542 N SER B 50 -5.928 -10.142 3.582 1.00 10.00 N ATOM 1543 CA SER B 50 -7.371 -10.292 3.684 1.00 10.00 C ATOM 1544 C SER B 50 -7.749 -11.217 4.838 1.00 10.00 C ATOM 1545 O SER B 50 -8.882 -11.191 5.319 1.00 10.00 O ATOM 1546 CB SER B 50 -7.927 -10.830 2.366 1.00 10.00 C ATOM 1547 OG SER B 50 -7.367 -10.134 1.261 1.00 10.00 O ATOM 0 H SER B 50 -5.419 -11.020 3.485 1.00 10.00 H new ATOM 0 HA SER B 50 -7.807 -9.314 3.886 1.00 10.00 H new ATOM 0 HB2 SER B 50 -7.707 -11.894 2.281 1.00 10.00 H new ATOM 0 HB3 SER B 50 -9.012 -10.727 2.355 1.00 10.00 H new ATOM 0 HG SER B 50 -7.734 -10.495 0.427 1.00 10.00 H new ATOM 1553 N LYS B 51 -6.801 -12.036 5.274 1.00 10.00 N ATOM 1554 CA LYS B 51 -7.033 -12.960 6.372 1.00 10.00 C ATOM 1555 C LYS B 51 -6.084 -12.647 7.521 1.00 10.00 C ATOM 1556 O LYS B 51 -6.493 -12.120 8.554 1.00 10.00 O ATOM 1557 CB LYS B 51 -6.837 -14.405 5.911 1.00 10.00 C ATOM 1558 CG LYS B 51 -7.980 -14.932 5.059 1.00 10.00 C ATOM 1559 CD LYS B 51 -7.526 -15.280 3.648 1.00 10.00 C ATOM 1560 CE LYS B 51 -6.761 -16.590 3.613 1.00 10.00 C ATOM 1561 NZ LYS B 51 -6.466 -17.027 2.224 1.00 10.00 N ATOM 0 H LYS B 51 -5.861 -12.078 4.881 1.00 10.00 H new ATOM 0 HA LYS B 51 -8.062 -12.843 6.713 1.00 10.00 H new ATOM 0 HB2 LYS B 51 -5.910 -14.474 5.343 1.00 10.00 H new ATOM 0 HB3 LYS B 51 -6.722 -15.044 6.786 1.00 10.00 H new ATOM 0 HG2 LYS B 51 -8.406 -15.817 5.531 1.00 10.00 H new ATOM 0 HG3 LYS B 51 -8.771 -14.184 5.011 1.00 10.00 H new ATOM 0 HD2 LYS B 51 -8.394 -15.348 2.992 1.00 10.00 H new ATOM 0 HD3 LYS B 51 -6.896 -14.480 3.261 1.00 10.00 H new ATOM 0 HE2 LYS B 51 -5.827 -16.479 4.164 1.00 10.00 H new ATOM 0 HE3 LYS B 51 -7.340 -17.362 4.120 1.00 10.00 H new ATOM 0 HZ1 LYS B 51 -5.943 -17.925 2.246 1.00 10.00 H new ATOM 0 HZ2 LYS B 51 -7.357 -17.158 1.705 1.00 10.00 H new ATOM 0 HZ3 LYS B 51 -5.891 -16.303 1.747 1.00 10.00 H new ATOM 1575 N HIS B 52 -4.809 -12.944 7.314 1.00 10.00 N ATOM 1576 CA HIS B 52 -3.791 -12.701 8.324 1.00 10.00 C ATOM 1577 C HIS B 52 -2.413 -12.835 7.700 1.00 10.00 C ATOM 1578 O HIS B 52 -1.413 -12.819 8.445 1.00 10.00 O ATOM 1579 CB HIS B 52 -3.938 -13.681 9.493 1.00 10.00 C ATOM 1580 CG HIS B 52 -3.587 -13.076 10.810 1.00 10.00 C ATOM 1581 ND1 HIS B 52 -2.310 -12.687 11.137 1.00 10.00 N ATOM 1582 CD2 HIS B 52 -4.358 -12.772 11.875 1.00 10.00 C ATOM 1583 CE1 HIS B 52 -2.309 -12.171 12.348 1.00 10.00 C ATOM 1584 NE2 HIS B 52 -3.540 -12.211 12.819 1.00 10.00 N ATOM 1585 OXT HIS B 52 -2.344 -12.964 6.461 1.00 10.00 O ATOM 0 H HIS B 52 -4.454 -13.356 6.451 1.00 10.00 H new ATOM 0 HA HIS B 52 -3.917 -11.690 8.711 1.00 10.00 H new ATOM 0 HB2 HIS B 52 -4.965 -14.044 9.529 1.00 10.00 H new ATOM 0 HB3 HIS B 52 -3.300 -14.547 9.316 1.00 10.00 H new ATOM 0 HD1 HIS B 52 -1.492 -12.783 10.536 1.00 10.00 H new ATOM 0 HD2 HIS B 52 -5.421 -12.940 11.966 1.00 10.00 H new ATOM 0 HE1 HIS B 52 -1.446 -11.781 12.868 1.00 10.00 H new TER 1594 HIS B 52