USER MOD reduce.3.24.130724 H: found=0, std=0, add=926, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 929 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: A1034 THR OG1 : rot 180:sc= 0.57 USER MOD Set 1.2: A1037 SER OG : rot -43:sc= 0.629 USER MOD Set 2.1: A 982 TYR OH : rot 165:sc= 0.751 USER MOD Set 2.2: A 991 LYS NZ :NH3+ 151:sc= 0.836 (180deg=0) USER MOD Set 3.1: A 937 ASN : amide:sc= -0.63 K(o=-1.6,f=-0.41) USER MOD Set 3.2: A 939 SER OG : rot 180:sc= 0 USER MOD Set 3.3: A 954 THR OG1 : rot 180:sc= 0 USER MOD Set 3.4: A1018 HIS : no HD1:sc= -1.01 K(o=-1.6,f=-0.41) USER MOD Set 4.1: A 936 GLN : amide:sc= 0.714 K(o=1.4,f=-8.2!) USER MOD Set 4.2: A 953 TYR OH : rot 120:sc= 0.662 USER MOD Single : A 922 THR OG1 : rot 180:sc= 0 USER MOD Single : A 927 HIS : no HE2:sc= -2.95! C(o=-2.9!,f=-5.8!) USER MOD Single : A 928 THR OG1 : rot 180:sc= 0 USER MOD Single : A 931 THR OG1 : rot 180:sc= -0.384 USER MOD Single : A 935 TYR OH : rot -13:sc= 0.941 USER MOD Single : A 941 TYR OH : rot 180:sc= 0 USER MOD Single : A 947 LYS NZ :NH3+ -155:sc= 1.26 (180deg=0.976) USER MOD Single : A 952 THR OG1 : rot -34:sc= 1.21 USER MOD Single : A 957 ASN : amide:sc= 0.45 K(o=0.45,f=-7.3!) USER MOD Single : A 960 LYS NZ :NH3+ 163:sc= 1.24 (180deg=0.859) USER MOD Single : A 963 SER OG : rot -84:sc= 0.523 USER MOD Single : A 965 SER OG : rot 180:sc= 0.00234 USER MOD Single : A 968 THR OG1 : rot 180:sc= 0 USER MOD Single : A 969 CYS SG : rot 31:sc= 0.0999 USER MOD Single : A 981 SER OG : rot 180:sc= 0 USER MOD Single : A 985 ASN : amide:sc= -0.33 X(o=-0.33,f=-0.089) USER MOD Single : A 995 TYR OH : rot -178:sc= -1 USER MOD Single : A 998 THR OG1 : rot 180:sc= -0.282 USER MOD Single : A1003 HIS : no HD1:sc= -0.0859 X(o=-0.086,f=0) USER MOD Single : A1004 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00912) USER MOD Single : A1006 LYS NZ :NH3+ -173:sc=-0.000539 (180deg=-0.0499) USER MOD Single : A1007 SER OG : rot 180:sc= 0 USER MOD Single : A1013 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1014 MET CE :methyl 162:sc= -0.166 (180deg=-0.678) USER MOD Single : A1015 TYR OH : rot 180:sc= 0 USER MOD Single : A1016 HIS : no HE2:sc= -6.97! C(o=-7!,f=-13!) USER MOD Single : A1017 THR OG1 : rot -158:sc= 0.873 USER MOD Single : A1026 LYS NZ :NH3+ -165:sc= 1.29 (180deg=0.924) USER MOD Single : A1028 LYS NZ :NH3+ 178:sc= 1.25 (180deg=1.18) USER MOD Single : A1029 LYS NZ :NH3+ 177:sc= -1.23 (180deg=-1.28) USER MOD Single : A1032 THR OG1 : rot -42:sc= 0.37 USER MOD Single : A1033 GLN : amide:sc= -1.43! C(o=-1.4!,f=-4.3!) USER MOD Single : A1036 SER OG : rot 180:sc= 0 USER MOD Single : A1038 THR OG1 : rot 180:sc= 0.00369 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 918 -6.549 -2.391 15.928 1.00 0.00 N ATOM 2 CA ILE A 918 -6.857 -3.731 15.412 1.00 0.00 C ATOM 3 C ILE A 918 -5.574 -4.432 14.994 1.00 0.00 C ATOM 4 O ILE A 918 -4.816 -3.947 14.152 1.00 0.00 O ATOM 5 CB ILE A 918 -7.883 -3.709 14.238 1.00 0.00 C ATOM 6 CG1 ILE A 918 -7.419 -2.797 13.092 1.00 0.00 C ATOM 7 CG2 ILE A 918 -9.252 -3.275 14.747 1.00 0.00 C ATOM 8 CD1 ILE A 918 -8.329 -2.814 11.883 1.00 0.00 C ATOM 0 HA ILE A 918 -7.330 -4.288 16.221 1.00 0.00 H new ATOM 0 HB ILE A 918 -7.955 -4.721 13.839 1.00 0.00 H new ATOM 0 HG12 ILE A 918 -7.344 -1.775 13.463 1.00 0.00 H new ATOM 0 HG13 ILE A 918 -6.418 -3.099 12.784 1.00 0.00 H new ATOM 0 HG21 ILE A 918 -9.961 -3.263 13.919 1.00 0.00 H new ATOM 0 HG22 ILE A 918 -9.596 -3.975 15.509 1.00 0.00 H new ATOM 0 HG23 ILE A 918 -9.180 -2.276 15.178 1.00 0.00 H new ATOM 0 HD11 ILE A 918 -7.932 -2.145 11.119 1.00 0.00 H new ATOM 0 HD12 ILE A 918 -8.385 -3.827 11.484 1.00 0.00 H new ATOM 0 HD13 ILE A 918 -9.326 -2.482 12.173 1.00 0.00 H new ATOM 22 N ASP A 919 -5.299 -5.549 15.631 1.00 0.00 N ATOM 23 CA ASP A 919 -4.099 -6.313 15.336 1.00 0.00 C ATOM 24 C ASP A 919 -4.420 -7.394 14.325 1.00 0.00 C ATOM 25 O ASP A 919 -5.519 -7.950 14.355 1.00 0.00 O ATOM 26 CB ASP A 919 -3.508 -6.941 16.608 1.00 0.00 C ATOM 27 CG ASP A 919 -2.991 -5.913 17.591 1.00 0.00 C ATOM 28 OD1 ASP A 919 -1.841 -5.441 17.434 1.00 0.00 O ATOM 29 OD2 ASP A 919 -3.721 -5.549 18.540 1.00 0.00 O ATOM 0 H ASP A 919 -5.889 -5.952 16.359 1.00 0.00 H new ATOM 0 HA ASP A 919 -3.354 -5.633 14.922 1.00 0.00 H new ATOM 0 HB2 ASP A 919 -4.271 -7.549 17.094 1.00 0.00 H new ATOM 0 HB3 ASP A 919 -2.695 -7.612 16.331 1.00 0.00 H new ATOM 34 N PRO A 920 -3.483 -7.695 13.404 1.00 0.00 N ATOM 35 CA PRO A 920 -3.672 -8.737 12.385 1.00 0.00 C ATOM 36 C PRO A 920 -3.858 -10.137 12.972 1.00 0.00 C ATOM 37 O PRO A 920 -4.331 -11.024 12.281 1.00 0.00 O ATOM 38 CB PRO A 920 -2.387 -8.681 11.550 1.00 0.00 C ATOM 39 CG PRO A 920 -1.794 -7.346 11.838 1.00 0.00 C ATOM 40 CD PRO A 920 -2.184 -7.019 13.249 1.00 0.00 C ATOM 0 HA PRO A 920 -4.581 -8.554 11.812 1.00 0.00 H new ATOM 0 HB2 PRO A 920 -1.703 -9.484 11.825 1.00 0.00 H new ATOM 0 HB3 PRO A 920 -2.602 -8.796 10.488 1.00 0.00 H new ATOM 0 HG2 PRO A 920 -0.710 -7.368 11.728 1.00 0.00 H new ATOM 0 HG3 PRO A 920 -2.170 -6.594 11.144 1.00 0.00 H new ATOM 0 HD2 PRO A 920 -1.450 -7.388 13.965 1.00 0.00 H new ATOM 0 HD3 PRO A 920 -2.269 -5.943 13.404 1.00 0.00 H new ATOM 48 N PHE A 921 -3.484 -10.327 14.228 1.00 0.00 N ATOM 49 CA PHE A 921 -3.655 -11.604 14.897 1.00 0.00 C ATOM 50 C PHE A 921 -4.472 -11.386 16.164 1.00 0.00 C ATOM 51 O PHE A 921 -3.950 -10.906 17.175 1.00 0.00 O ATOM 52 CB PHE A 921 -2.285 -12.210 15.232 1.00 0.00 C ATOM 53 CG PHE A 921 -2.310 -13.614 15.781 1.00 0.00 C ATOM 54 CD1 PHE A 921 -2.493 -14.700 14.939 1.00 0.00 C ATOM 55 CD2 PHE A 921 -2.104 -13.852 17.130 1.00 0.00 C ATOM 56 CE1 PHE A 921 -2.473 -15.989 15.428 1.00 0.00 C ATOM 57 CE2 PHE A 921 -2.090 -15.137 17.628 1.00 0.00 C ATOM 58 CZ PHE A 921 -2.274 -16.209 16.777 1.00 0.00 C ATOM 0 H PHE A 921 -3.056 -9.605 14.808 1.00 0.00 H new ATOM 0 HA PHE A 921 -4.181 -12.300 14.244 1.00 0.00 H new ATOM 0 HB2 PHE A 921 -1.674 -12.203 14.329 1.00 0.00 H new ATOM 0 HB3 PHE A 921 -1.790 -11.564 15.957 1.00 0.00 H new ATOM 0 HD1 PHE A 921 -2.654 -14.534 13.884 1.00 0.00 H new ATOM 0 HD2 PHE A 921 -1.952 -13.019 17.801 1.00 0.00 H new ATOM 0 HE1 PHE A 921 -2.613 -16.824 14.758 1.00 0.00 H new ATOM 0 HE2 PHE A 921 -1.935 -15.306 18.683 1.00 0.00 H new ATOM 0 HZ PHE A 921 -2.262 -17.217 17.165 1.00 0.00 H new ATOM 68 N THR A 922 -5.761 -11.654 16.089 1.00 0.00 N ATOM 69 CA THR A 922 -6.629 -11.508 17.251 1.00 0.00 C ATOM 70 C THR A 922 -7.872 -12.401 17.111 1.00 0.00 C ATOM 71 O THR A 922 -8.295 -13.069 18.060 1.00 0.00 O ATOM 72 CB THR A 922 -7.001 -10.010 17.508 1.00 0.00 C ATOM 73 OG1 THR A 922 -7.736 -9.868 18.730 1.00 0.00 O ATOM 74 CG2 THR A 922 -7.812 -9.404 16.367 1.00 0.00 C ATOM 0 H THR A 922 -6.233 -11.973 15.243 1.00 0.00 H new ATOM 0 HA THR A 922 -6.081 -11.844 18.131 1.00 0.00 H new ATOM 0 HB THR A 922 -6.057 -9.470 17.578 1.00 0.00 H new ATOM 0 HG1 THR A 922 -7.957 -8.924 18.871 1.00 0.00 H new ATOM 0 HG21 THR A 922 -8.043 -8.364 16.597 1.00 0.00 H new ATOM 0 HG22 THR A 922 -7.234 -9.452 15.444 1.00 0.00 H new ATOM 0 HG23 THR A 922 -8.740 -9.963 16.243 1.00 0.00 H new ATOM 82 N ALA A 923 -8.402 -12.490 15.902 1.00 0.00 N ATOM 83 CA ALA A 923 -9.552 -13.337 15.605 1.00 0.00 C ATOM 84 C ALA A 923 -9.057 -14.424 14.685 1.00 0.00 C ATOM 85 O ALA A 923 -9.782 -15.015 13.882 1.00 0.00 O ATOM 86 CB ALA A 923 -10.651 -12.509 14.950 1.00 0.00 C ATOM 0 H ALA A 923 -8.048 -11.977 15.095 1.00 0.00 H new ATOM 0 HA ALA A 923 -9.979 -13.772 16.508 1.00 0.00 H new ATOM 0 HB1 ALA A 923 -11.506 -13.148 14.731 1.00 0.00 H new ATOM 0 HB2 ALA A 923 -10.958 -11.711 15.626 1.00 0.00 H new ATOM 0 HB3 ALA A 923 -10.276 -12.075 14.023 1.00 0.00 H new ATOM 92 N ASP A 924 -7.802 -14.716 14.910 1.00 0.00 N ATOM 93 CA ASP A 924 -7.002 -15.542 14.059 1.00 0.00 C ATOM 94 C ASP A 924 -6.460 -16.700 14.868 1.00 0.00 C ATOM 95 O ASP A 924 -5.533 -16.545 15.656 1.00 0.00 O ATOM 96 CB ASP A 924 -5.879 -14.661 13.512 1.00 0.00 C ATOM 97 CG ASP A 924 -6.415 -13.400 12.856 1.00 0.00 C ATOM 98 OD1 ASP A 924 -6.652 -12.397 13.581 1.00 0.00 O ATOM 99 OD2 ASP A 924 -6.669 -13.413 11.626 1.00 0.00 O ATOM 0 H ASP A 924 -7.295 -14.369 15.724 1.00 0.00 H new ATOM 0 HA ASP A 924 -7.575 -15.959 13.231 1.00 0.00 H new ATOM 0 HB2 ASP A 924 -5.204 -14.389 14.323 1.00 0.00 H new ATOM 0 HB3 ASP A 924 -5.294 -15.227 12.787 1.00 0.00 H new ATOM 104 N ALA A 925 -7.096 -17.844 14.725 1.00 0.00 N ATOM 105 CA ALA A 925 -6.724 -19.042 15.454 1.00 0.00 C ATOM 106 C ALA A 925 -5.465 -19.688 14.896 1.00 0.00 C ATOM 107 O ALA A 925 -5.508 -20.365 13.862 1.00 0.00 O ATOM 108 CB ALA A 925 -7.864 -20.047 15.436 1.00 0.00 C ATOM 0 H ALA A 925 -7.890 -17.971 14.097 1.00 0.00 H new ATOM 0 HA ALA A 925 -6.516 -18.739 16.480 1.00 0.00 H new ATOM 0 HB1 ALA A 925 -7.570 -20.940 15.987 1.00 0.00 H new ATOM 0 HB2 ALA A 925 -8.745 -19.606 15.903 1.00 0.00 H new ATOM 0 HB3 ALA A 925 -8.096 -20.316 14.405 1.00 0.00 H new ATOM 114 N GLY A 926 -4.352 -19.419 15.559 1.00 0.00 N ATOM 115 CA GLY A 926 -3.073 -20.039 15.254 1.00 0.00 C ATOM 116 C GLY A 926 -2.647 -19.975 13.811 1.00 0.00 C ATOM 117 O GLY A 926 -2.200 -20.972 13.243 1.00 0.00 O ATOM 0 H GLY A 926 -4.311 -18.756 16.333 1.00 0.00 H new ATOM 0 HA2 GLY A 926 -2.304 -19.563 15.863 1.00 0.00 H new ATOM 0 HA3 GLY A 926 -3.116 -21.086 15.556 1.00 0.00 H new ATOM 121 N HIS A 927 -2.829 -18.833 13.193 1.00 0.00 N ATOM 122 CA HIS A 927 -2.285 -18.640 11.869 1.00 0.00 C ATOM 123 C HIS A 927 -1.007 -17.896 12.071 1.00 0.00 C ATOM 124 O HIS A 927 -0.541 -17.727 13.198 1.00 0.00 O ATOM 125 CB HIS A 927 -3.159 -17.770 10.949 1.00 0.00 C ATOM 126 CG HIS A 927 -4.628 -18.047 11.023 1.00 0.00 C ATOM 127 ND1 HIS A 927 -5.206 -19.225 10.607 1.00 0.00 N ATOM 128 CD2 HIS A 927 -5.630 -17.296 11.507 1.00 0.00 C ATOM 129 CE1 HIS A 927 -6.502 -19.177 10.842 1.00 0.00 C ATOM 130 NE2 HIS A 927 -6.793 -18.014 11.387 1.00 0.00 N ATOM 0 H HIS A 927 -3.339 -18.037 13.575 1.00 0.00 H new ATOM 0 HA HIS A 927 -2.192 -19.616 11.393 1.00 0.00 H new ATOM 0 HB2 HIS A 927 -2.989 -16.722 11.197 1.00 0.00 H new ATOM 0 HB3 HIS A 927 -2.829 -17.912 9.920 1.00 0.00 H new ATOM 0 HD1 HIS A 927 -4.710 -20.010 10.184 1.00 0.00 H new ATOM 0 HD2 HIS A 927 -5.537 -16.302 11.918 1.00 0.00 H new ATOM 0 HE1 HIS A 927 -7.210 -19.963 10.623 1.00 0.00 H new ATOM 139 N THR A 928 -0.477 -17.408 11.005 1.00 0.00 N ATOM 140 CA THR A 928 0.585 -16.491 11.105 1.00 0.00 C ATOM 141 C THR A 928 0.308 -15.574 9.988 1.00 0.00 C ATOM 142 O THR A 928 0.137 -16.032 8.869 1.00 0.00 O ATOM 143 CB THR A 928 1.980 -17.061 10.903 1.00 0.00 C ATOM 144 OG1 THR A 928 2.062 -18.414 11.378 1.00 0.00 O ATOM 145 CG2 THR A 928 3.010 -16.199 11.618 1.00 0.00 C ATOM 0 H THR A 928 -0.768 -17.634 10.054 1.00 0.00 H new ATOM 0 HA THR A 928 0.612 -16.070 12.110 1.00 0.00 H new ATOM 0 HB THR A 928 2.190 -17.060 9.833 1.00 0.00 H new ATOM 0 HG1 THR A 928 2.969 -18.757 11.235 1.00 0.00 H new ATOM 0 HG21 THR A 928 4.004 -16.618 11.465 1.00 0.00 H new ATOM 0 HG22 THR A 928 2.978 -15.186 11.217 1.00 0.00 H new ATOM 0 HG23 THR A 928 2.787 -16.174 12.685 1.00 0.00 H new ATOM 153 N GLU A 929 0.118 -14.349 10.273 1.00 0.00 N ATOM 154 CA GLU A 929 -0.185 -13.445 9.230 1.00 0.00 C ATOM 155 C GLU A 929 0.485 -12.115 9.463 1.00 0.00 C ATOM 156 O GLU A 929 1.026 -11.850 10.537 1.00 0.00 O ATOM 157 CB GLU A 929 -1.698 -13.312 9.054 1.00 0.00 C ATOM 158 CG GLU A 929 -2.408 -12.663 10.206 1.00 0.00 C ATOM 159 CD GLU A 929 -2.276 -13.441 11.499 1.00 0.00 C ATOM 160 OE1 GLU A 929 -2.924 -14.501 11.626 1.00 0.00 O ATOM 161 OE2 GLU A 929 -1.441 -13.056 12.342 1.00 0.00 O ATOM 0 H GLU A 929 0.165 -13.946 11.209 1.00 0.00 H new ATOM 0 HA GLU A 929 0.212 -13.841 8.296 1.00 0.00 H new ATOM 0 HB2 GLU A 929 -1.896 -12.735 8.151 1.00 0.00 H new ATOM 0 HB3 GLU A 929 -2.121 -14.304 8.897 1.00 0.00 H new ATOM 0 HG2 GLU A 929 -2.010 -11.659 10.351 1.00 0.00 H new ATOM 0 HG3 GLU A 929 -3.464 -12.555 9.960 1.00 0.00 H new ATOM 168 N PHE A 930 0.458 -11.308 8.449 1.00 0.00 N ATOM 169 CA PHE A 930 1.037 -9.979 8.453 1.00 0.00 C ATOM 170 C PHE A 930 0.331 -9.183 7.370 1.00 0.00 C ATOM 171 O PHE A 930 0.246 -9.651 6.251 1.00 0.00 O ATOM 172 CB PHE A 930 2.544 -10.060 8.161 1.00 0.00 C ATOM 173 CG PHE A 930 3.206 -8.733 7.912 1.00 0.00 C ATOM 174 CD1 PHE A 930 3.359 -7.809 8.930 1.00 0.00 C ATOM 175 CD2 PHE A 930 3.684 -8.417 6.647 1.00 0.00 C ATOM 176 CE1 PHE A 930 3.971 -6.595 8.694 1.00 0.00 C ATOM 177 CE2 PHE A 930 4.298 -7.205 6.405 1.00 0.00 C ATOM 178 CZ PHE A 930 4.442 -6.293 7.430 1.00 0.00 C ATOM 0 H PHE A 930 0.020 -11.554 7.561 1.00 0.00 H new ATOM 0 HA PHE A 930 0.913 -9.501 9.425 1.00 0.00 H new ATOM 0 HB2 PHE A 930 3.038 -10.545 9.003 1.00 0.00 H new ATOM 0 HB3 PHE A 930 2.698 -10.697 7.290 1.00 0.00 H new ATOM 0 HD1 PHE A 930 2.995 -8.040 9.920 1.00 0.00 H new ATOM 0 HD2 PHE A 930 3.574 -9.129 5.842 1.00 0.00 H new ATOM 0 HE1 PHE A 930 4.082 -5.881 9.497 1.00 0.00 H new ATOM 0 HE2 PHE A 930 4.665 -6.971 5.416 1.00 0.00 H new ATOM 0 HZ PHE A 930 4.922 -5.344 7.245 1.00 0.00 H new ATOM 188 N THR A 931 -0.244 -8.050 7.690 1.00 0.00 N ATOM 189 CA THR A 931 -0.875 -7.248 6.663 1.00 0.00 C ATOM 190 C THR A 931 0.195 -6.540 5.836 1.00 0.00 C ATOM 191 O THR A 931 1.062 -5.854 6.384 1.00 0.00 O ATOM 192 CB THR A 931 -1.858 -6.244 7.283 1.00 0.00 C ATOM 193 OG1 THR A 931 -2.691 -6.970 8.202 1.00 0.00 O ATOM 194 CG2 THR A 931 -2.731 -5.587 6.202 1.00 0.00 C ATOM 0 H THR A 931 -0.290 -7.665 8.633 1.00 0.00 H new ATOM 0 HA THR A 931 -1.449 -7.899 6.003 1.00 0.00 H new ATOM 0 HB THR A 931 -1.308 -5.451 7.790 1.00 0.00 H new ATOM 0 HG1 THR A 931 -3.331 -6.356 8.618 1.00 0.00 H new ATOM 0 HG21 THR A 931 -3.418 -4.881 6.669 1.00 0.00 H new ATOM 0 HG22 THR A 931 -2.095 -5.059 5.492 1.00 0.00 H new ATOM 0 HG23 THR A 931 -3.300 -6.355 5.678 1.00 0.00 H new ATOM 202 N ASP A 932 0.130 -6.705 4.526 1.00 0.00 N ATOM 203 CA ASP A 932 1.127 -6.123 3.650 1.00 0.00 C ATOM 204 C ASP A 932 0.458 -4.933 3.000 1.00 0.00 C ATOM 205 O ASP A 932 -0.778 -4.876 2.949 1.00 0.00 O ATOM 206 CB ASP A 932 1.592 -7.115 2.573 1.00 0.00 C ATOM 207 CG ASP A 932 2.996 -6.822 2.067 1.00 0.00 C ATOM 208 OD1 ASP A 932 3.271 -5.710 1.563 1.00 0.00 O ATOM 209 OD2 ASP A 932 3.876 -7.699 2.213 1.00 0.00 O ATOM 0 H ASP A 932 -0.600 -7.235 4.049 1.00 0.00 H new ATOM 0 HA ASP A 932 2.016 -5.843 4.215 1.00 0.00 H new ATOM 0 HB2 ASP A 932 1.561 -8.126 2.979 1.00 0.00 H new ATOM 0 HB3 ASP A 932 0.896 -7.087 1.735 1.00 0.00 H new ATOM 214 N GLU A 933 1.226 -4.001 2.497 1.00 0.00 N ATOM 215 CA GLU A 933 0.684 -2.782 1.965 1.00 0.00 C ATOM 216 C GLU A 933 1.637 -2.227 0.910 1.00 0.00 C ATOM 217 O GLU A 933 2.858 -2.375 1.014 1.00 0.00 O ATOM 218 CB GLU A 933 0.467 -1.800 3.117 1.00 0.00 C ATOM 219 CG GLU A 933 1.758 -1.276 3.741 1.00 0.00 C ATOM 220 CD GLU A 933 1.545 -0.458 4.991 1.00 0.00 C ATOM 221 OE1 GLU A 933 1.169 -1.043 6.031 1.00 0.00 O ATOM 222 OE2 GLU A 933 1.814 0.771 4.967 1.00 0.00 O ATOM 0 H GLU A 933 2.243 -4.067 2.446 1.00 0.00 H new ATOM 0 HA GLU A 933 -0.277 -2.958 1.482 1.00 0.00 H new ATOM 0 HB2 GLU A 933 -0.118 -0.955 2.754 1.00 0.00 H new ATOM 0 HB3 GLU A 933 -0.125 -2.289 3.890 1.00 0.00 H new ATOM 0 HG2 GLU A 933 2.405 -2.121 3.977 1.00 0.00 H new ATOM 0 HG3 GLU A 933 2.284 -0.668 3.006 1.00 0.00 H new ATOM 229 N VAL A 934 1.078 -1.626 -0.109 1.00 0.00 N ATOM 230 CA VAL A 934 1.835 -1.009 -1.177 1.00 0.00 C ATOM 231 C VAL A 934 1.109 0.276 -1.491 1.00 0.00 C ATOM 232 O VAL A 934 0.038 0.511 -0.939 1.00 0.00 O ATOM 233 CB VAL A 934 1.951 -1.939 -2.417 1.00 0.00 C ATOM 234 CG1 VAL A 934 0.608 -2.187 -3.094 1.00 0.00 C ATOM 235 CG2 VAL A 934 2.997 -1.468 -3.427 1.00 0.00 C ATOM 0 H VAL A 934 0.068 -1.548 -0.225 1.00 0.00 H new ATOM 0 HA VAL A 934 2.866 -0.817 -0.880 1.00 0.00 H new ATOM 0 HB VAL A 934 2.299 -2.894 -2.023 1.00 0.00 H new ATOM 0 HG11 VAL A 934 0.749 -2.843 -3.953 1.00 0.00 H new ATOM 0 HG12 VAL A 934 -0.075 -2.658 -2.387 1.00 0.00 H new ATOM 0 HG13 VAL A 934 0.188 -1.238 -3.427 1.00 0.00 H new ATOM 0 HG21 VAL A 934 3.028 -2.160 -4.268 1.00 0.00 H new ATOM 0 HG22 VAL A 934 2.734 -0.473 -3.786 1.00 0.00 H new ATOM 0 HG23 VAL A 934 3.976 -1.434 -2.948 1.00 0.00 H new ATOM 245 N TYR A 935 1.651 1.111 -2.327 1.00 0.00 N ATOM 246 CA TYR A 935 1.062 2.394 -2.568 1.00 0.00 C ATOM 247 C TYR A 935 0.978 2.659 -4.047 1.00 0.00 C ATOM 248 O TYR A 935 1.901 2.375 -4.796 1.00 0.00 O ATOM 249 CB TYR A 935 1.852 3.472 -1.845 1.00 0.00 C ATOM 250 CG TYR A 935 1.662 3.437 -0.332 1.00 0.00 C ATOM 251 CD1 TYR A 935 2.305 2.497 0.464 1.00 0.00 C ATOM 252 CD2 TYR A 935 0.785 4.317 0.288 1.00 0.00 C ATOM 253 CE1 TYR A 935 2.068 2.430 1.824 1.00 0.00 C ATOM 254 CE2 TYR A 935 0.558 4.267 1.649 1.00 0.00 C ATOM 255 CZ TYR A 935 1.195 3.316 2.410 1.00 0.00 C ATOM 256 OH TYR A 935 0.943 3.232 3.758 1.00 0.00 O ATOM 0 H TYR A 935 2.504 0.925 -2.855 1.00 0.00 H new ATOM 0 HA TYR A 935 0.046 2.406 -2.175 1.00 0.00 H new ATOM 0 HB2 TYR A 935 2.911 3.355 -2.075 1.00 0.00 H new ATOM 0 HB3 TYR A 935 1.550 4.450 -2.221 1.00 0.00 H new ATOM 0 HD1 TYR A 935 3.002 1.807 0.012 1.00 0.00 H new ATOM 0 HD2 TYR A 935 0.269 5.056 -0.307 1.00 0.00 H new ATOM 0 HE1 TYR A 935 2.567 1.684 2.425 1.00 0.00 H new ATOM 0 HE2 TYR A 935 -0.116 4.971 2.113 1.00 0.00 H new ATOM 0 HH TYR A 935 1.293 2.385 4.104 1.00 0.00 H new ATOM 266 N GLN A 936 -0.127 3.219 -4.436 1.00 0.00 N ATOM 267 CA GLN A 936 -0.422 3.481 -5.821 1.00 0.00 C ATOM 268 C GLN A 936 -0.461 4.976 -6.000 1.00 0.00 C ATOM 269 O GLN A 936 -1.163 5.648 -5.253 1.00 0.00 O ATOM 270 CB GLN A 936 -1.786 2.918 -6.175 1.00 0.00 C ATOM 271 CG GLN A 936 -2.124 3.000 -7.648 1.00 0.00 C ATOM 272 CD GLN A 936 -3.600 2.833 -7.866 1.00 0.00 C ATOM 273 OE1 GLN A 936 -4.334 3.800 -7.931 1.00 0.00 O ATOM 274 NE2 GLN A 936 -4.061 1.620 -7.868 1.00 0.00 N ATOM 0 H GLN A 936 -0.863 3.513 -3.794 1.00 0.00 H new ATOM 0 HA GLN A 936 0.332 3.021 -6.459 1.00 0.00 H new ATOM 0 HB2 GLN A 936 -1.830 1.875 -5.860 1.00 0.00 H new ATOM 0 HB3 GLN A 936 -2.547 3.454 -5.608 1.00 0.00 H new ATOM 0 HG2 GLN A 936 -1.799 3.961 -8.047 1.00 0.00 H new ATOM 0 HG3 GLN A 936 -1.581 2.228 -8.194 1.00 0.00 H new ATOM 0 HE21 GLN A 936 -3.418 0.830 -7.812 1.00 0.00 H new ATOM 0 HE22 GLN A 936 -5.066 1.457 -7.925 1.00 0.00 H new ATOM 283 N ASN A 937 0.297 5.494 -6.932 1.00 0.00 N ATOM 284 CA ASN A 937 0.279 6.922 -7.177 1.00 0.00 C ATOM 285 C ASN A 937 -0.043 7.283 -8.613 1.00 0.00 C ATOM 286 O ASN A 937 0.355 6.608 -9.563 1.00 0.00 O ATOM 287 CB ASN A 937 1.559 7.681 -6.729 1.00 0.00 C ATOM 288 CG ASN A 937 2.884 7.263 -7.349 1.00 0.00 C ATOM 289 OD1 ASN A 937 3.715 8.124 -7.652 1.00 0.00 O ATOM 290 ND2 ASN A 937 3.188 5.989 -7.389 1.00 0.00 N ATOM 0 H ASN A 937 0.929 4.961 -7.530 1.00 0.00 H new ATOM 0 HA ASN A 937 -0.536 7.260 -6.537 1.00 0.00 H new ATOM 0 HB2 ASN A 937 1.411 8.740 -6.938 1.00 0.00 H new ATOM 0 HB3 ASN A 937 1.648 7.579 -5.647 1.00 0.00 H new ATOM 0 HD21 ASN A 937 4.123 5.696 -7.674 1.00 0.00 H new ATOM 0 HD22 ASN A 937 2.490 5.290 -7.136 1.00 0.00 H new ATOM 297 N GLU A 938 -0.815 8.342 -8.730 1.00 0.00 N ATOM 298 CA GLU A 938 -1.129 8.989 -9.984 1.00 0.00 C ATOM 299 C GLU A 938 -0.512 10.364 -9.879 1.00 0.00 C ATOM 300 O GLU A 938 -0.299 10.844 -8.757 1.00 0.00 O ATOM 301 CB GLU A 938 -2.645 9.090 -10.210 1.00 0.00 C ATOM 302 CG GLU A 938 -3.323 7.739 -10.362 1.00 0.00 C ATOM 303 CD GLU A 938 -4.734 7.852 -10.889 1.00 0.00 C ATOM 304 OE1 GLU A 938 -4.909 7.841 -12.119 1.00 0.00 O ATOM 305 OE2 GLU A 938 -5.694 7.954 -10.102 1.00 0.00 O ATOM 0 H GLU A 938 -1.256 8.791 -7.927 1.00 0.00 H new ATOM 0 HA GLU A 938 -0.742 8.423 -10.831 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -3.095 9.622 -9.372 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -2.833 9.685 -11.104 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -2.736 7.116 -11.037 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -3.339 7.234 -9.396 1.00 0.00 H new ATOM 312 N SER A 939 -0.252 11.029 -10.977 1.00 0.00 N ATOM 313 CA SER A 939 0.473 12.267 -10.909 1.00 0.00 C ATOM 314 C SER A 939 -0.131 13.273 -11.877 1.00 0.00 C ATOM 315 O SER A 939 -0.783 12.888 -12.860 1.00 0.00 O ATOM 316 CB SER A 939 1.957 12.023 -11.199 1.00 0.00 C ATOM 317 OG SER A 939 2.502 11.058 -10.302 1.00 0.00 O ATOM 0 H SER A 939 -0.528 10.737 -11.915 1.00 0.00 H new ATOM 0 HA SER A 939 0.396 12.681 -9.904 1.00 0.00 H new ATOM 0 HB2 SER A 939 2.079 11.679 -12.226 1.00 0.00 H new ATOM 0 HB3 SER A 939 2.507 12.960 -11.109 1.00 0.00 H new ATOM 0 HG SER A 939 3.450 10.919 -10.508 1.00 0.00 H new ATOM 323 N ARG A 940 0.032 14.539 -11.535 1.00 0.00 N ATOM 324 CA ARG A 940 -0.473 15.639 -12.315 1.00 0.00 C ATOM 325 C ARG A 940 0.320 16.882 -12.004 1.00 0.00 C ATOM 326 O ARG A 940 0.994 16.954 -10.974 1.00 0.00 O ATOM 327 CB ARG A 940 -1.918 15.934 -11.974 1.00 0.00 C ATOM 328 CG ARG A 940 -2.108 16.464 -10.565 1.00 0.00 C ATOM 329 CD ARG A 940 -3.523 16.903 -10.369 1.00 0.00 C ATOM 330 NE ARG A 940 -3.677 17.799 -9.233 1.00 0.00 N ATOM 331 CZ ARG A 940 -4.779 18.508 -8.994 1.00 0.00 C ATOM 332 NH1 ARG A 940 -5.706 18.625 -9.934 1.00 0.00 N ATOM 333 NH2 ARG A 940 -4.914 19.163 -7.853 1.00 0.00 N ATOM 0 H ARG A 940 0.528 14.829 -10.692 1.00 0.00 H new ATOM 0 HA ARG A 940 -0.389 15.363 -13.366 1.00 0.00 H new ATOM 0 HB2 ARG A 940 -2.310 16.662 -12.684 1.00 0.00 H new ATOM 0 HB3 ARG A 940 -2.505 15.024 -12.094 1.00 0.00 H new ATOM 0 HG2 ARG A 940 -1.855 15.691 -9.840 1.00 0.00 H new ATOM 0 HG3 ARG A 940 -1.432 17.300 -10.388 1.00 0.00 H new ATOM 0 HD2 ARG A 940 -3.873 17.403 -11.272 1.00 0.00 H new ATOM 0 HD3 ARG A 940 -4.155 16.027 -10.225 1.00 0.00 H new ATOM 0 HE ARG A 940 -2.897 17.889 -8.583 1.00 0.00 H new ATOM 0 HH11 ARG A 940 -5.575 18.172 -10.839 1.00 0.00 H new ATOM 0 HH12 ARG A 940 -6.551 19.168 -9.753 1.00 0.00 H new ATOM 0 HH21 ARG A 940 -4.173 19.126 -7.153 1.00 0.00 H new ATOM 0 HH22 ARG A 940 -5.759 19.705 -7.673 1.00 0.00 H new ATOM 347 N TYR A 941 0.251 17.851 -12.886 1.00 0.00 N ATOM 348 CA TYR A 941 0.802 19.154 -12.580 1.00 0.00 C ATOM 349 C TYR A 941 -0.225 19.830 -11.687 1.00 0.00 C ATOM 350 O TYR A 941 -1.384 19.396 -11.666 1.00 0.00 O ATOM 351 CB TYR A 941 0.933 20.015 -13.831 1.00 0.00 C ATOM 352 CG TYR A 941 1.559 19.320 -15.020 1.00 0.00 C ATOM 353 CD1 TYR A 941 2.874 18.877 -14.982 1.00 0.00 C ATOM 354 CD2 TYR A 941 0.825 19.100 -16.177 1.00 0.00 C ATOM 355 CE1 TYR A 941 3.440 18.236 -16.068 1.00 0.00 C ATOM 356 CE2 TYR A 941 1.382 18.461 -17.264 1.00 0.00 C ATOM 357 CZ TYR A 941 2.687 18.031 -17.205 1.00 0.00 C ATOM 358 OH TYR A 941 3.246 17.397 -18.293 1.00 0.00 O ATOM 0 H TYR A 941 -0.174 17.767 -13.809 1.00 0.00 H new ATOM 0 HA TYR A 941 1.788 19.043 -12.129 1.00 0.00 H new ATOM 0 HB2 TYR A 941 -0.058 20.369 -14.116 1.00 0.00 H new ATOM 0 HB3 TYR A 941 1.529 20.895 -13.588 1.00 0.00 H new ATOM 0 HD1 TYR A 941 3.463 19.035 -14.091 1.00 0.00 H new ATOM 0 HD2 TYR A 941 -0.200 19.435 -16.227 1.00 0.00 H new ATOM 0 HE1 TYR A 941 4.465 17.898 -16.026 1.00 0.00 H new ATOM 0 HE2 TYR A 941 0.797 18.299 -18.157 1.00 0.00 H new ATOM 0 HH TYR A 941 2.582 17.331 -19.010 1.00 0.00 H new ATOM 368 N PRO A 942 0.138 20.872 -10.937 1.00 0.00 N ATOM 369 CA PRO A 942 -0.844 21.644 -10.183 1.00 0.00 C ATOM 370 C PRO A 942 -1.841 22.333 -11.114 1.00 0.00 C ATOM 371 O PRO A 942 -1.601 23.446 -11.580 1.00 0.00 O ATOM 372 CB PRO A 942 0.001 22.683 -9.445 1.00 0.00 C ATOM 373 CG PRO A 942 1.383 22.131 -9.439 1.00 0.00 C ATOM 374 CD PRO A 942 1.508 21.353 -10.712 1.00 0.00 C ATOM 0 HA PRO A 942 -1.439 21.020 -9.516 1.00 0.00 H new ATOM 0 HB2 PRO A 942 -0.035 23.649 -9.949 1.00 0.00 H new ATOM 0 HB3 PRO A 942 -0.365 22.839 -8.430 1.00 0.00 H new ATOM 0 HG2 PRO A 942 2.124 22.929 -9.392 1.00 0.00 H new ATOM 0 HG3 PRO A 942 1.547 21.492 -8.571 1.00 0.00 H new ATOM 0 HD2 PRO A 942 1.857 21.977 -11.534 1.00 0.00 H new ATOM 0 HD3 PRO A 942 2.215 20.529 -10.614 1.00 0.00 H new ATOM 382 N GLY A 943 -2.906 21.631 -11.472 1.00 0.00 N ATOM 383 CA GLY A 943 -3.878 22.158 -12.403 1.00 0.00 C ATOM 384 C GLY A 943 -4.148 21.133 -13.492 1.00 0.00 C ATOM 385 O GLY A 943 -4.891 21.383 -14.444 1.00 0.00 O ATOM 0 H GLY A 943 -3.114 20.694 -11.128 1.00 0.00 H new ATOM 0 HA2 GLY A 943 -4.803 22.400 -11.880 1.00 0.00 H new ATOM 0 HA3 GLY A 943 -3.509 23.084 -12.844 1.00 0.00 H new ATOM 389 N GLY A 944 -3.496 19.978 -13.362 1.00 0.00 N ATOM 390 CA GLY A 944 -3.704 18.889 -14.289 1.00 0.00 C ATOM 391 C GLY A 944 -4.643 17.870 -13.683 1.00 0.00 C ATOM 392 O GLY A 944 -5.136 18.083 -12.577 1.00 0.00 O ATOM 0 H GLY A 944 -2.822 19.782 -12.622 1.00 0.00 H new ATOM 0 HA2 GLY A 944 -4.119 19.269 -15.223 1.00 0.00 H new ATOM 0 HA3 GLY A 944 -2.751 18.419 -14.532 1.00 0.00 H new ATOM 396 N ASP A 945 -4.931 16.786 -14.378 1.00 0.00 N ATOM 397 CA ASP A 945 -5.684 15.676 -13.809 1.00 0.00 C ATOM 398 C ASP A 945 -4.698 14.543 -13.619 1.00 0.00 C ATOM 399 O ASP A 945 -3.631 14.568 -14.237 1.00 0.00 O ATOM 400 CB ASP A 945 -6.820 15.214 -14.731 1.00 0.00 C ATOM 401 CG ASP A 945 -6.335 14.713 -16.069 1.00 0.00 C ATOM 402 OD1 ASP A 945 -6.028 15.549 -16.952 1.00 0.00 O ATOM 403 OD2 ASP A 945 -6.246 13.499 -16.265 1.00 0.00 O ATOM 0 H ASP A 945 -4.653 16.647 -15.349 1.00 0.00 H new ATOM 0 HA ASP A 945 -6.147 15.987 -12.872 1.00 0.00 H new ATOM 0 HB2 ASP A 945 -7.381 14.422 -14.236 1.00 0.00 H new ATOM 0 HB3 ASP A 945 -7.510 16.043 -14.889 1.00 0.00 H new ATOM 408 N TRP A 946 -5.040 13.558 -12.820 1.00 0.00 N ATOM 409 CA TRP A 946 -4.107 12.513 -12.464 1.00 0.00 C ATOM 410 C TRP A 946 -4.076 11.438 -13.526 1.00 0.00 C ATOM 411 O TRP A 946 -5.118 11.050 -14.050 1.00 0.00 O ATOM 412 CB TRP A 946 -4.525 11.860 -11.151 1.00 0.00 C ATOM 413 CG TRP A 946 -4.801 12.806 -10.055 1.00 0.00 C ATOM 414 CD1 TRP A 946 -6.009 13.237 -9.619 1.00 0.00 C ATOM 415 CD2 TRP A 946 -3.834 13.428 -9.241 1.00 0.00 C ATOM 416 NE1 TRP A 946 -5.835 14.085 -8.565 1.00 0.00 N ATOM 417 CE2 TRP A 946 -4.516 14.231 -8.323 1.00 0.00 C ATOM 418 CE3 TRP A 946 -2.456 13.379 -9.201 1.00 0.00 C ATOM 419 CZ2 TRP A 946 -3.864 14.986 -7.366 1.00 0.00 C ATOM 420 CZ3 TRP A 946 -1.812 14.124 -8.259 1.00 0.00 C ATOM 421 CH2 TRP A 946 -2.511 14.920 -7.351 1.00 0.00 C ATOM 0 H TRP A 946 -5.965 13.458 -12.401 1.00 0.00 H new ATOM 0 HA TRP A 946 -3.122 12.969 -12.368 1.00 0.00 H new ATOM 0 HB2 TRP A 946 -5.417 11.259 -11.327 1.00 0.00 H new ATOM 0 HB3 TRP A 946 -3.737 11.177 -10.834 1.00 0.00 H new ATOM 0 HD1 TRP A 946 -6.962 12.953 -10.041 1.00 0.00 H new ATOM 0 HE1 TRP A 946 -6.585 14.538 -8.042 1.00 0.00 H new ATOM 0 HE3 TRP A 946 -1.902 12.767 -9.897 1.00 0.00 H new ATOM 0 HZ2 TRP A 946 -4.408 15.600 -6.663 1.00 0.00 H new ATOM 0 HZ3 TRP A 946 -0.733 14.098 -8.214 1.00 0.00 H new ATOM 0 HH2 TRP A 946 -1.962 15.496 -6.621 1.00 0.00 H new ATOM 432 N LYS A 947 -2.893 10.969 -13.858 1.00 0.00 N ATOM 433 CA LYS A 947 -2.741 9.805 -14.703 1.00 0.00 C ATOM 434 C LYS A 947 -1.775 8.909 -13.955 1.00 0.00 C ATOM 435 O LYS A 947 -0.834 9.442 -13.363 1.00 0.00 O ATOM 436 CB LYS A 947 -2.166 10.125 -16.098 1.00 0.00 C ATOM 437 CG LYS A 947 -2.943 11.144 -16.922 1.00 0.00 C ATOM 438 CD LYS A 947 -2.581 12.566 -16.554 1.00 0.00 C ATOM 439 CE LYS A 947 -3.335 13.538 -17.429 1.00 0.00 C ATOM 440 NZ LYS A 947 -3.144 14.938 -16.996 1.00 0.00 N ATOM 0 H LYS A 947 -2.012 11.382 -13.551 1.00 0.00 H new ATOM 0 HA LYS A 947 -3.715 9.352 -14.890 1.00 0.00 H new ATOM 0 HB2 LYS A 947 -1.146 10.489 -15.974 1.00 0.00 H new ATOM 0 HB3 LYS A 947 -2.106 9.197 -16.666 1.00 0.00 H new ATOM 0 HG2 LYS A 947 -2.743 10.982 -17.981 1.00 0.00 H new ATOM 0 HG3 LYS A 947 -4.012 10.992 -16.772 1.00 0.00 H new ATOM 0 HD2 LYS A 947 -2.817 12.750 -15.506 1.00 0.00 H new ATOM 0 HD3 LYS A 947 -1.508 12.718 -16.670 1.00 0.00 H new ATOM 0 HE2 LYS A 947 -3.002 13.429 -18.461 1.00 0.00 H new ATOM 0 HE3 LYS A 947 -4.397 13.294 -17.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 947 -3.954 15.511 -17.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 947 -3.072 14.974 -15.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 947 -2.271 15.316 -17.417 1.00 0.00 H new ATOM 454 N PRO A 948 -1.994 7.580 -13.920 1.00 0.00 N ATOM 455 CA PRO A 948 -1.149 6.655 -13.147 1.00 0.00 C ATOM 456 C PRO A 948 0.340 6.846 -13.421 1.00 0.00 C ATOM 457 O PRO A 948 0.778 6.815 -14.577 1.00 0.00 O ATOM 458 CB PRO A 948 -1.607 5.265 -13.611 1.00 0.00 C ATOM 459 CG PRO A 948 -2.514 5.495 -14.777 1.00 0.00 C ATOM 460 CD PRO A 948 -3.073 6.874 -14.619 1.00 0.00 C ATOM 0 HA PRO A 948 -1.259 6.817 -12.075 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -0.754 4.649 -13.896 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -2.127 4.739 -12.811 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -1.968 5.403 -15.716 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -3.313 4.753 -14.799 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -3.300 7.332 -15.582 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -3.997 6.873 -14.041 1.00 0.00 H new ATOM 468 N ALA A 949 1.096 7.102 -12.356 1.00 0.00 N ATOM 469 CA ALA A 949 2.537 7.313 -12.417 1.00 0.00 C ATOM 470 C ALA A 949 3.303 6.218 -13.146 1.00 0.00 C ATOM 471 O ALA A 949 2.872 5.068 -13.207 1.00 0.00 O ATOM 472 CB ALA A 949 3.074 7.440 -11.006 1.00 0.00 C ATOM 0 H ALA A 949 0.717 7.169 -11.412 1.00 0.00 H new ATOM 0 HA ALA A 949 2.690 8.225 -12.995 1.00 0.00 H new ATOM 0 HB1 ALA A 949 4.152 7.598 -11.040 1.00 0.00 H new ATOM 0 HB2 ALA A 949 2.598 8.286 -10.510 1.00 0.00 H new ATOM 0 HB3 ALA A 949 2.859 6.527 -10.451 1.00 0.00 H new ATOM 478 N GLU A 950 4.426 6.619 -13.732 1.00 0.00 N ATOM 479 CA GLU A 950 5.387 5.698 -14.355 1.00 0.00 C ATOM 480 C GLU A 950 5.826 4.715 -13.333 1.00 0.00 C ATOM 481 O GLU A 950 5.854 3.507 -13.564 1.00 0.00 O ATOM 482 CB GLU A 950 6.621 6.430 -14.835 1.00 0.00 C ATOM 483 CG GLU A 950 6.270 7.500 -15.795 1.00 0.00 C ATOM 484 CD GLU A 950 7.474 8.185 -16.386 1.00 0.00 C ATOM 485 OE1 GLU A 950 7.988 9.147 -15.776 1.00 0.00 O ATOM 486 OE2 GLU A 950 7.935 7.764 -17.472 1.00 0.00 O ATOM 0 H GLU A 950 4.703 7.599 -13.792 1.00 0.00 H new ATOM 0 HA GLU A 950 4.899 5.219 -15.204 1.00 0.00 H new ATOM 0 HB2 GLU A 950 7.146 6.861 -13.982 1.00 0.00 H new ATOM 0 HB3 GLU A 950 7.305 5.724 -15.307 1.00 0.00 H new ATOM 0 HG2 GLU A 950 5.670 7.075 -16.600 1.00 0.00 H new ATOM 0 HG3 GLU A 950 5.649 8.241 -15.292 1.00 0.00 H new ATOM 493 N ASP A 951 6.132 5.268 -12.192 1.00 0.00 N ATOM 494 CA ASP A 951 6.478 4.457 -11.087 1.00 0.00 C ATOM 495 C ASP A 951 5.205 4.313 -10.291 1.00 0.00 C ATOM 496 O ASP A 951 4.984 5.030 -9.316 1.00 0.00 O ATOM 497 CB ASP A 951 7.615 5.022 -10.224 1.00 0.00 C ATOM 498 CG ASP A 951 8.934 5.126 -10.955 1.00 0.00 C ATOM 499 OD1 ASP A 951 9.496 4.085 -11.376 1.00 0.00 O ATOM 500 OD2 ASP A 951 9.447 6.248 -11.112 1.00 0.00 O ATOM 0 H ASP A 951 6.145 6.273 -12.016 1.00 0.00 H new ATOM 0 HA ASP A 951 6.871 3.502 -11.435 1.00 0.00 H new ATOM 0 HB2 ASP A 951 7.330 6.010 -9.864 1.00 0.00 H new ATOM 0 HB3 ASP A 951 7.744 4.388 -9.347 1.00 0.00 H new ATOM 505 N THR A 952 4.330 3.455 -10.792 1.00 0.00 N ATOM 506 CA THR A 952 2.965 3.369 -10.315 1.00 0.00 C ATOM 507 C THR A 952 2.911 2.927 -8.855 1.00 0.00 C ATOM 508 O THR A 952 2.127 3.459 -8.060 1.00 0.00 O ATOM 509 CB THR A 952 2.150 2.384 -11.175 1.00 0.00 C ATOM 510 OG1 THR A 952 2.479 2.571 -12.555 1.00 0.00 O ATOM 511 CG2 THR A 952 0.655 2.611 -10.989 1.00 0.00 C ATOM 0 H THR A 952 4.550 2.799 -11.542 1.00 0.00 H new ATOM 0 HA THR A 952 2.532 4.366 -10.394 1.00 0.00 H new ATOM 0 HB THR A 952 2.396 1.369 -10.861 1.00 0.00 H new ATOM 0 HG1 THR A 952 2.674 3.517 -12.719 1.00 0.00 H new ATOM 0 HG21 THR A 952 0.100 1.904 -11.606 1.00 0.00 H new ATOM 0 HG22 THR A 952 0.392 2.463 -9.942 1.00 0.00 H new ATOM 0 HG23 THR A 952 0.402 3.629 -11.286 1.00 0.00 H new ATOM 519 N TYR A 953 3.739 1.959 -8.499 1.00 0.00 N ATOM 520 CA TYR A 953 3.754 1.476 -7.147 1.00 0.00 C ATOM 521 C TYR A 953 5.007 1.894 -6.404 1.00 0.00 C ATOM 522 O TYR A 953 6.114 1.885 -6.937 1.00 0.00 O ATOM 523 CB TYR A 953 3.444 -0.019 -7.084 1.00 0.00 C ATOM 524 CG TYR A 953 1.968 -0.238 -7.343 1.00 0.00 C ATOM 525 CD1 TYR A 953 1.461 -0.299 -8.636 1.00 0.00 C ATOM 526 CD2 TYR A 953 1.068 -0.300 -6.285 1.00 0.00 C ATOM 527 CE1 TYR A 953 0.108 -0.426 -8.865 1.00 0.00 C ATOM 528 CE2 TYR A 953 -0.290 -0.416 -6.503 1.00 0.00 C ATOM 529 CZ TYR A 953 -0.765 -0.478 -7.798 1.00 0.00 C ATOM 530 OH TYR A 953 -2.116 -0.574 -8.028 1.00 0.00 O ATOM 0 H TYR A 953 4.400 1.502 -9.127 1.00 0.00 H new ATOM 0 HA TYR A 953 2.942 1.960 -6.604 1.00 0.00 H new ATOM 0 HB2 TYR A 953 4.038 -0.556 -7.823 1.00 0.00 H new ATOM 0 HB3 TYR A 953 3.716 -0.417 -6.106 1.00 0.00 H new ATOM 0 HD1 TYR A 953 2.139 -0.246 -9.475 1.00 0.00 H new ATOM 0 HD2 TYR A 953 1.439 -0.256 -5.272 1.00 0.00 H new ATOM 0 HE1 TYR A 953 -0.267 -0.485 -9.876 1.00 0.00 H new ATOM 0 HE2 TYR A 953 -0.974 -0.458 -5.669 1.00 0.00 H new ATOM 0 HH TYR A 953 -2.459 -1.397 -7.621 1.00 0.00 H new ATOM 540 N THR A 954 4.787 2.293 -5.171 1.00 0.00 N ATOM 541 CA THR A 954 5.764 2.917 -4.302 1.00 0.00 C ATOM 542 C THR A 954 5.503 2.455 -2.888 1.00 0.00 C ATOM 543 O THR A 954 4.530 1.736 -2.644 1.00 0.00 O ATOM 544 CB THR A 954 5.599 4.452 -4.387 1.00 0.00 C ATOM 545 OG1 THR A 954 4.197 4.783 -4.400 1.00 0.00 O ATOM 546 CG2 THR A 954 6.269 5.017 -5.636 1.00 0.00 C ATOM 0 H THR A 954 3.877 2.186 -4.723 1.00 0.00 H new ATOM 0 HA THR A 954 6.776 2.645 -4.601 1.00 0.00 H new ATOM 0 HB THR A 954 6.081 4.895 -3.516 1.00 0.00 H new ATOM 0 HG1 THR A 954 4.091 5.756 -4.453 1.00 0.00 H new ATOM 0 HG21 THR A 954 6.134 6.098 -5.664 1.00 0.00 H new ATOM 0 HG22 THR A 954 7.334 4.785 -5.614 1.00 0.00 H new ATOM 0 HG23 THR A 954 5.819 4.572 -6.523 1.00 0.00 H new ATOM 554 N ASP A 955 6.362 2.832 -1.977 1.00 0.00 N ATOM 555 CA ASP A 955 6.143 2.569 -0.577 1.00 0.00 C ATOM 556 C ASP A 955 5.756 3.868 0.088 1.00 0.00 C ATOM 557 O ASP A 955 5.691 4.903 -0.577 1.00 0.00 O ATOM 558 CB ASP A 955 7.381 1.972 0.106 1.00 0.00 C ATOM 559 CG ASP A 955 7.407 0.456 0.079 1.00 0.00 C ATOM 560 OD1 ASP A 955 6.601 -0.168 0.812 1.00 0.00 O ATOM 561 OD2 ASP A 955 8.277 -0.140 -0.594 1.00 0.00 O ATOM 0 H ASP A 955 7.229 3.328 -2.182 1.00 0.00 H new ATOM 0 HA ASP A 955 5.348 1.829 -0.480 1.00 0.00 H new ATOM 0 HB2 ASP A 955 8.277 2.353 -0.384 1.00 0.00 H new ATOM 0 HB3 ASP A 955 7.415 2.311 1.141 1.00 0.00 H new ATOM 566 N ALA A 956 5.491 3.801 1.379 1.00 0.00 N ATOM 567 CA ALA A 956 5.112 4.964 2.182 1.00 0.00 C ATOM 568 C ALA A 956 6.076 6.158 2.039 1.00 0.00 C ATOM 569 O ALA A 956 5.658 7.315 2.161 1.00 0.00 O ATOM 570 CB ALA A 956 4.995 4.549 3.638 1.00 0.00 C ATOM 0 H ALA A 956 5.531 2.932 1.912 1.00 0.00 H new ATOM 0 HA ALA A 956 4.151 5.313 1.804 1.00 0.00 H new ATOM 0 HB1 ALA A 956 4.713 5.412 4.241 1.00 0.00 H new ATOM 0 HB2 ALA A 956 4.235 3.774 3.735 1.00 0.00 H new ATOM 0 HB3 ALA A 956 5.954 4.162 3.984 1.00 0.00 H new ATOM 576 N ASN A 957 7.343 5.897 1.745 1.00 0.00 N ATOM 577 CA ASN A 957 8.310 6.983 1.558 1.00 0.00 C ATOM 578 C ASN A 957 8.431 7.379 0.079 1.00 0.00 C ATOM 579 O ASN A 957 8.968 8.436 -0.249 1.00 0.00 O ATOM 580 CB ASN A 957 9.694 6.632 2.133 1.00 0.00 C ATOM 581 CG ASN A 957 10.430 5.538 1.379 1.00 0.00 C ATOM 582 OD1 ASN A 957 9.823 4.642 0.791 1.00 0.00 O ATOM 583 ND2 ASN A 957 11.747 5.595 1.402 1.00 0.00 N ATOM 0 H ASN A 957 7.726 4.959 1.631 1.00 0.00 H new ATOM 0 HA ASN A 957 7.927 7.839 2.114 1.00 0.00 H new ATOM 0 HB2 ASN A 957 10.310 7.531 2.137 1.00 0.00 H new ATOM 0 HB3 ASN A 957 9.574 6.323 3.171 1.00 0.00 H new ATOM 0 HD21 ASN A 957 12.297 4.882 0.922 1.00 0.00 H new ATOM 0 HD22 ASN A 957 12.216 6.352 1.899 1.00 0.00 H new ATOM 590 N GLY A 958 7.895 6.554 -0.813 1.00 0.00 N ATOM 591 CA GLY A 958 7.953 6.855 -2.228 1.00 0.00 C ATOM 592 C GLY A 958 8.918 5.977 -2.949 1.00 0.00 C ATOM 593 O GLY A 958 9.090 6.123 -4.159 1.00 0.00 O ATOM 0 H GLY A 958 7.421 5.681 -0.580 1.00 0.00 H new ATOM 0 HA2 GLY A 958 6.961 6.738 -2.664 1.00 0.00 H new ATOM 0 HA3 GLY A 958 8.240 7.898 -2.365 1.00 0.00 H new ATOM 597 N ASP A 959 9.594 5.129 -2.191 1.00 0.00 N ATOM 598 CA ASP A 959 10.510 4.160 -2.760 1.00 0.00 C ATOM 599 C ASP A 959 9.753 3.290 -3.734 1.00 0.00 C ATOM 600 O ASP A 959 8.866 2.541 -3.334 1.00 0.00 O ATOM 601 CB ASP A 959 11.157 3.294 -1.680 1.00 0.00 C ATOM 602 CG ASP A 959 12.171 2.320 -2.241 1.00 0.00 C ATOM 603 OD1 ASP A 959 13.251 2.757 -2.683 1.00 0.00 O ATOM 604 OD2 ASP A 959 11.942 1.098 -2.206 1.00 0.00 O ATOM 0 H ASP A 959 9.523 5.094 -1.174 1.00 0.00 H new ATOM 0 HA ASP A 959 11.310 4.695 -3.272 1.00 0.00 H new ATOM 0 HB2 ASP A 959 11.644 3.938 -0.948 1.00 0.00 H new ATOM 0 HB3 ASP A 959 10.381 2.740 -1.151 1.00 0.00 H new ATOM 609 N LYS A 960 10.022 3.519 -5.004 1.00 0.00 N ATOM 610 CA LYS A 960 9.426 2.773 -6.099 1.00 0.00 C ATOM 611 C LYS A 960 9.492 1.281 -5.814 1.00 0.00 C ATOM 612 O LYS A 960 10.574 0.701 -5.675 1.00 0.00 O ATOM 613 CB LYS A 960 10.160 3.120 -7.399 1.00 0.00 C ATOM 614 CG LYS A 960 9.535 2.588 -8.683 1.00 0.00 C ATOM 615 CD LYS A 960 9.744 1.104 -8.927 1.00 0.00 C ATOM 616 CE LYS A 960 9.125 0.689 -10.249 1.00 0.00 C ATOM 617 NZ LYS A 960 9.736 1.403 -11.403 1.00 0.00 N ATOM 0 H LYS A 960 10.673 4.242 -5.311 1.00 0.00 H new ATOM 0 HA LYS A 960 8.376 3.045 -6.204 1.00 0.00 H new ATOM 0 HB2 LYS A 960 10.229 4.205 -7.475 1.00 0.00 H new ATOM 0 HB3 LYS A 960 11.179 2.740 -7.330 1.00 0.00 H new ATOM 0 HG2 LYS A 960 8.464 2.791 -8.660 1.00 0.00 H new ATOM 0 HG3 LYS A 960 9.946 3.142 -9.527 1.00 0.00 H new ATOM 0 HD2 LYS A 960 10.810 0.877 -8.931 1.00 0.00 H new ATOM 0 HD3 LYS A 960 9.299 0.530 -8.114 1.00 0.00 H new ATOM 0 HE2 LYS A 960 9.246 -0.386 -10.383 1.00 0.00 H new ATOM 0 HE3 LYS A 960 8.054 0.889 -10.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 960 9.504 0.901 -12.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 960 9.363 2.373 -11.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 960 10.769 1.435 -11.284 1.00 0.00 H new ATOM 631 N ALA A 961 8.334 0.677 -5.755 1.00 0.00 N ATOM 632 CA ALA A 961 8.214 -0.713 -5.410 1.00 0.00 C ATOM 633 C ALA A 961 7.596 -1.489 -6.558 1.00 0.00 C ATOM 634 O ALA A 961 7.283 -0.917 -7.609 1.00 0.00 O ATOM 635 CB ALA A 961 7.378 -0.864 -4.147 1.00 0.00 C ATOM 0 H ALA A 961 7.445 1.138 -5.946 1.00 0.00 H new ATOM 0 HA ALA A 961 9.208 -1.119 -5.220 1.00 0.00 H new ATOM 0 HB1 ALA A 961 7.292 -1.920 -3.892 1.00 0.00 H new ATOM 0 HB2 ALA A 961 7.859 -0.331 -3.327 1.00 0.00 H new ATOM 0 HB3 ALA A 961 6.384 -0.449 -4.317 1.00 0.00 H new ATOM 641 N ALA A 962 7.443 -2.780 -6.361 1.00 0.00 N ATOM 642 CA ALA A 962 6.835 -3.638 -7.350 1.00 0.00 C ATOM 643 C ALA A 962 5.322 -3.482 -7.308 1.00 0.00 C ATOM 644 O ALA A 962 4.756 -3.070 -6.293 1.00 0.00 O ATOM 645 CB ALA A 962 7.234 -5.084 -7.100 1.00 0.00 C ATOM 0 H ALA A 962 7.737 -3.263 -5.512 1.00 0.00 H new ATOM 0 HA ALA A 962 7.186 -3.351 -8.341 1.00 0.00 H new ATOM 0 HB1 ALA A 962 6.771 -5.724 -7.851 1.00 0.00 H new ATOM 0 HB2 ALA A 962 8.318 -5.178 -7.162 1.00 0.00 H new ATOM 0 HB3 ALA A 962 6.899 -5.387 -6.108 1.00 0.00 H new ATOM 651 N SER A 963 4.675 -3.796 -8.406 1.00 0.00 N ATOM 652 CA SER A 963 3.242 -3.736 -8.496 1.00 0.00 C ATOM 653 C SER A 963 2.636 -4.933 -7.776 1.00 0.00 C ATOM 654 O SER A 963 3.324 -5.918 -7.545 1.00 0.00 O ATOM 655 CB SER A 963 2.838 -3.732 -9.969 1.00 0.00 C ATOM 656 OG SER A 963 3.513 -4.750 -10.686 1.00 0.00 O ATOM 0 H SER A 963 5.134 -4.101 -9.264 1.00 0.00 H new ATOM 0 HA SER A 963 2.873 -2.826 -8.023 1.00 0.00 H new ATOM 0 HB2 SER A 963 1.761 -3.876 -10.054 1.00 0.00 H new ATOM 0 HB3 SER A 963 3.066 -2.761 -10.409 1.00 0.00 H new ATOM 0 HG SER A 963 4.399 -4.429 -10.954 1.00 0.00 H new ATOM 662 N PRO A 964 1.350 -4.875 -7.414 1.00 0.00 N ATOM 663 CA PRO A 964 0.656 -5.996 -6.772 1.00 0.00 C ATOM 664 C PRO A 964 0.620 -7.246 -7.657 1.00 0.00 C ATOM 665 O PRO A 964 0.366 -8.351 -7.179 1.00 0.00 O ATOM 666 CB PRO A 964 -0.758 -5.479 -6.525 1.00 0.00 C ATOM 667 CG PRO A 964 -0.893 -4.232 -7.331 1.00 0.00 C ATOM 668 CD PRO A 964 0.496 -3.699 -7.545 1.00 0.00 C ATOM 0 HA PRO A 964 1.166 -6.303 -5.859 1.00 0.00 H new ATOM 0 HB2 PRO A 964 -1.501 -6.218 -6.825 1.00 0.00 H new ATOM 0 HB3 PRO A 964 -0.919 -5.277 -5.466 1.00 0.00 H new ATOM 0 HG2 PRO A 964 -1.378 -4.439 -8.285 1.00 0.00 H new ATOM 0 HG3 PRO A 964 -1.511 -3.501 -6.811 1.00 0.00 H new ATOM 0 HD2 PRO A 964 0.600 -3.238 -8.527 1.00 0.00 H new ATOM 0 HD3 PRO A 964 0.749 -2.938 -6.807 1.00 0.00 H new ATOM 676 N SER A 965 0.851 -7.056 -8.947 1.00 0.00 N ATOM 677 CA SER A 965 0.966 -8.152 -9.887 1.00 0.00 C ATOM 678 C SER A 965 2.324 -8.820 -9.655 1.00 0.00 C ATOM 679 O SER A 965 2.433 -10.041 -9.524 1.00 0.00 O ATOM 680 CB SER A 965 0.886 -7.584 -11.301 1.00 0.00 C ATOM 681 OG SER A 965 -0.160 -6.627 -11.382 1.00 0.00 O ATOM 0 H SER A 965 0.964 -6.134 -9.369 1.00 0.00 H new ATOM 0 HA SER A 965 0.169 -8.883 -9.754 1.00 0.00 H new ATOM 0 HB2 SER A 965 1.835 -7.121 -11.570 1.00 0.00 H new ATOM 0 HB3 SER A 965 0.710 -8.388 -12.015 1.00 0.00 H new ATOM 0 HG SER A 965 -0.203 -6.266 -12.292 1.00 0.00 H new ATOM 687 N GLU A 966 3.352 -7.976 -9.599 1.00 0.00 N ATOM 688 CA GLU A 966 4.716 -8.411 -9.332 1.00 0.00 C ATOM 689 C GLU A 966 4.878 -8.988 -7.928 1.00 0.00 C ATOM 690 O GLU A 966 5.631 -9.936 -7.733 1.00 0.00 O ATOM 691 CB GLU A 966 5.695 -7.260 -9.482 1.00 0.00 C ATOM 692 CG GLU A 966 5.853 -6.733 -10.886 1.00 0.00 C ATOM 693 CD GLU A 966 6.718 -5.502 -10.899 1.00 0.00 C ATOM 694 OE1 GLU A 966 7.956 -5.631 -11.025 1.00 0.00 O ATOM 695 OE2 GLU A 966 6.171 -4.388 -10.742 1.00 0.00 O ATOM 0 H GLU A 966 3.260 -6.970 -9.738 1.00 0.00 H new ATOM 0 HA GLU A 966 4.929 -9.190 -10.064 1.00 0.00 H new ATOM 0 HB2 GLU A 966 5.372 -6.442 -8.838 1.00 0.00 H new ATOM 0 HB3 GLU A 966 6.671 -7.584 -9.120 1.00 0.00 H new ATOM 0 HG2 GLU A 966 6.296 -7.501 -11.520 1.00 0.00 H new ATOM 0 HG3 GLU A 966 4.874 -6.500 -11.304 1.00 0.00 H new ATOM 702 N LEU A 967 4.189 -8.404 -6.958 1.00 0.00 N ATOM 703 CA LEU A 967 4.282 -8.821 -5.569 1.00 0.00 C ATOM 704 C LEU A 967 3.779 -10.247 -5.409 1.00 0.00 C ATOM 705 O LEU A 967 2.590 -10.528 -5.575 1.00 0.00 O ATOM 706 CB LEU A 967 3.499 -7.828 -4.700 1.00 0.00 C ATOM 707 CG LEU A 967 4.153 -6.445 -4.568 1.00 0.00 C ATOM 708 CD1 LEU A 967 3.250 -5.474 -3.830 1.00 0.00 C ATOM 709 CD2 LEU A 967 5.493 -6.553 -3.855 1.00 0.00 C ATOM 0 H LEU A 967 3.548 -7.626 -7.114 1.00 0.00 H new ATOM 0 HA LEU A 967 5.322 -8.817 -5.242 1.00 0.00 H new ATOM 0 HB2 LEU A 967 2.501 -7.705 -5.120 1.00 0.00 H new ATOM 0 HB3 LEU A 967 3.376 -8.254 -3.704 1.00 0.00 H new ATOM 0 HG LEU A 967 4.316 -6.061 -5.575 1.00 0.00 H new ATOM 0 HD11 LEU A 967 3.743 -4.505 -3.754 1.00 0.00 H new ATOM 0 HD12 LEU A 967 2.313 -5.363 -4.375 1.00 0.00 H new ATOM 0 HD13 LEU A 967 3.045 -5.856 -2.830 1.00 0.00 H new ATOM 0 HD21 LEU A 967 5.941 -5.563 -3.771 1.00 0.00 H new ATOM 0 HD22 LEU A 967 5.343 -6.969 -2.859 1.00 0.00 H new ATOM 0 HD23 LEU A 967 6.156 -7.204 -4.424 1.00 0.00 H new ATOM 721 N THR A 968 4.697 -11.145 -5.115 1.00 0.00 N ATOM 722 CA THR A 968 4.368 -12.543 -5.006 1.00 0.00 C ATOM 723 C THR A 968 4.384 -12.989 -3.561 1.00 0.00 C ATOM 724 O THR A 968 4.855 -12.272 -2.669 1.00 0.00 O ATOM 725 CB THR A 968 5.332 -13.449 -5.818 1.00 0.00 C ATOM 726 OG1 THR A 968 6.688 -13.280 -5.379 1.00 0.00 O ATOM 727 CG2 THR A 968 5.244 -13.153 -7.304 1.00 0.00 C ATOM 0 H THR A 968 5.679 -10.926 -4.948 1.00 0.00 H new ATOM 0 HA THR A 968 3.366 -12.650 -5.422 1.00 0.00 H new ATOM 0 HB THR A 968 5.026 -14.481 -5.645 1.00 0.00 H new ATOM 0 HG1 THR A 968 7.277 -13.862 -5.904 1.00 0.00 H new ATOM 0 HG21 THR A 968 5.931 -13.803 -7.846 1.00 0.00 H new ATOM 0 HG22 THR A 968 4.226 -13.331 -7.651 1.00 0.00 H new ATOM 0 HG23 THR A 968 5.512 -12.112 -7.484 1.00 0.00 H new ATOM 735 N CYS A 969 3.816 -14.143 -3.329 1.00 0.00 N ATOM 736 CA CYS A 969 3.890 -14.778 -2.045 1.00 0.00 C ATOM 737 C CYS A 969 5.005 -15.813 -2.076 1.00 0.00 C ATOM 738 O CYS A 969 5.084 -16.620 -3.006 1.00 0.00 O ATOM 739 CB CYS A 969 2.550 -15.419 -1.699 1.00 0.00 C ATOM 740 SG CYS A 969 1.879 -16.497 -2.985 1.00 0.00 S ATOM 0 H CYS A 969 3.289 -14.668 -4.027 1.00 0.00 H new ATOM 0 HA CYS A 969 4.111 -14.041 -1.273 1.00 0.00 H new ATOM 0 HB2 CYS A 969 2.664 -15.997 -0.782 1.00 0.00 H new ATOM 0 HB3 CYS A 969 1.827 -14.630 -1.491 1.00 0.00 H new ATOM 0 HG CYS A 969 2.856 -17.056 -3.636 1.00 0.00 H new ATOM 746 N PRO A 970 5.915 -15.763 -1.102 1.00 0.00 N ATOM 747 CA PRO A 970 7.002 -16.735 -0.992 1.00 0.00 C ATOM 748 C PRO A 970 6.457 -18.094 -0.558 1.00 0.00 C ATOM 749 O PRO A 970 5.296 -18.170 -0.150 1.00 0.00 O ATOM 750 CB PRO A 970 7.896 -16.123 0.088 1.00 0.00 C ATOM 751 CG PRO A 970 6.976 -15.317 0.921 1.00 0.00 C ATOM 752 CD PRO A 970 5.959 -14.758 -0.033 1.00 0.00 C ATOM 0 HA PRO A 970 7.530 -16.914 -1.929 1.00 0.00 H new ATOM 0 HB2 PRO A 970 8.391 -16.895 0.677 1.00 0.00 H new ATOM 0 HB3 PRO A 970 8.680 -15.504 -0.350 1.00 0.00 H new ATOM 0 HG2 PRO A 970 6.501 -15.930 1.687 1.00 0.00 H new ATOM 0 HG3 PRO A 970 7.510 -14.519 1.437 1.00 0.00 H new ATOM 0 HD2 PRO A 970 4.986 -14.633 0.443 1.00 0.00 H new ATOM 0 HD3 PRO A 970 6.257 -13.780 -0.411 1.00 0.00 H new ATOM 760 N PRO A 971 7.266 -19.173 -0.617 1.00 0.00 N ATOM 761 CA PRO A 971 6.826 -20.530 -0.250 1.00 0.00 C ATOM 762 C PRO A 971 6.060 -20.618 1.073 1.00 0.00 C ATOM 763 O PRO A 971 5.111 -21.393 1.186 1.00 0.00 O ATOM 764 CB PRO A 971 8.135 -21.309 -0.169 1.00 0.00 C ATOM 765 CG PRO A 971 9.017 -20.637 -1.156 1.00 0.00 C ATOM 766 CD PRO A 971 8.671 -19.176 -1.081 1.00 0.00 C ATOM 0 HA PRO A 971 6.111 -20.915 -0.977 1.00 0.00 H new ATOM 0 HB2 PRO A 971 8.559 -21.273 0.834 1.00 0.00 H new ATOM 0 HB3 PRO A 971 7.989 -22.361 -0.416 1.00 0.00 H new ATOM 0 HG2 PRO A 971 10.068 -20.803 -0.919 1.00 0.00 H new ATOM 0 HG3 PRO A 971 8.851 -21.028 -2.160 1.00 0.00 H new ATOM 0 HD2 PRO A 971 9.323 -18.645 -0.388 1.00 0.00 H new ATOM 0 HD3 PRO A 971 8.774 -18.690 -2.051 1.00 0.00 H new ATOM 774 N GLY A 972 6.416 -19.802 2.060 1.00 0.00 N ATOM 775 CA GLY A 972 5.761 -19.894 3.342 1.00 0.00 C ATOM 776 C GLY A 972 4.717 -18.821 3.550 1.00 0.00 C ATOM 777 O GLY A 972 4.166 -18.715 4.636 1.00 0.00 O ATOM 0 H GLY A 972 7.140 -19.087 1.992 1.00 0.00 H new ATOM 0 HA2 GLY A 972 5.291 -20.873 3.434 1.00 0.00 H new ATOM 0 HA3 GLY A 972 6.509 -19.824 4.132 1.00 0.00 H new ATOM 781 N TRP A 973 4.405 -18.057 2.513 1.00 0.00 N ATOM 782 CA TRP A 973 3.399 -17.015 2.621 1.00 0.00 C ATOM 783 C TRP A 973 2.310 -17.214 1.570 1.00 0.00 C ATOM 784 O TRP A 973 2.574 -17.539 0.422 1.00 0.00 O ATOM 785 CB TRP A 973 3.991 -15.592 2.609 1.00 0.00 C ATOM 786 CG TRP A 973 4.578 -15.133 3.929 1.00 0.00 C ATOM 787 CD1 TRP A 973 5.903 -14.997 4.246 1.00 0.00 C ATOM 788 CD2 TRP A 973 3.858 -14.766 5.117 1.00 0.00 C ATOM 789 NE1 TRP A 973 6.036 -14.552 5.543 1.00 0.00 N ATOM 790 CE2 TRP A 973 4.804 -14.399 6.092 1.00 0.00 C ATOM 791 CE3 TRP A 973 2.512 -14.708 5.454 1.00 0.00 C ATOM 792 CZ2 TRP A 973 4.443 -13.977 7.373 1.00 0.00 C ATOM 793 CZ3 TRP A 973 2.147 -14.306 6.731 1.00 0.00 C ATOM 794 CH2 TRP A 973 3.110 -13.943 7.676 1.00 0.00 C ATOM 0 H TRP A 973 4.833 -18.140 1.591 1.00 0.00 H new ATOM 0 HA TRP A 973 2.936 -17.111 3.603 1.00 0.00 H new ATOM 0 HB2 TRP A 973 4.768 -15.544 1.846 1.00 0.00 H new ATOM 0 HB3 TRP A 973 3.210 -14.892 2.312 1.00 0.00 H new ATOM 0 HD1 TRP A 973 6.724 -15.208 3.577 1.00 0.00 H new ATOM 0 HE1 TRP A 973 6.920 -14.367 6.016 1.00 0.00 H new ATOM 0 HE3 TRP A 973 1.757 -14.973 4.729 1.00 0.00 H new ATOM 0 HZ2 TRP A 973 5.189 -13.688 8.098 1.00 0.00 H new ATOM 0 HZ3 TRP A 973 1.101 -14.273 6.999 1.00 0.00 H new ATOM 0 HH2 TRP A 973 2.797 -13.631 8.661 1.00 0.00 H new ATOM 805 N GLU A 974 1.094 -17.106 2.030 1.00 0.00 N ATOM 806 CA GLU A 974 -0.140 -17.366 1.295 1.00 0.00 C ATOM 807 C GLU A 974 -1.058 -16.141 1.383 1.00 0.00 C ATOM 808 O GLU A 974 -1.443 -15.752 2.467 1.00 0.00 O ATOM 809 CB GLU A 974 -0.770 -18.586 1.989 1.00 0.00 C ATOM 810 CG GLU A 974 -2.244 -18.849 1.755 1.00 0.00 C ATOM 811 CD GLU A 974 -2.555 -19.226 0.322 1.00 0.00 C ATOM 812 OE1 GLU A 974 -2.760 -18.331 -0.515 1.00 0.00 O ATOM 813 OE2 GLU A 974 -2.588 -20.428 -0.001 1.00 0.00 O ATOM 0 H GLU A 974 0.913 -16.815 2.991 1.00 0.00 H new ATOM 0 HA GLU A 974 0.030 -17.559 0.236 1.00 0.00 H new ATOM 0 HB2 GLU A 974 -0.218 -19.472 1.675 1.00 0.00 H new ATOM 0 HB3 GLU A 974 -0.615 -18.478 3.063 1.00 0.00 H new ATOM 0 HG2 GLU A 974 -2.574 -19.650 2.416 1.00 0.00 H new ATOM 0 HG3 GLU A 974 -2.814 -17.959 2.023 1.00 0.00 H new ATOM 820 N TRP A 975 -1.407 -15.531 0.273 1.00 0.00 N ATOM 821 CA TRP A 975 -2.251 -14.326 0.308 1.00 0.00 C ATOM 822 C TRP A 975 -3.689 -14.653 0.723 1.00 0.00 C ATOM 823 O TRP A 975 -4.459 -15.187 -0.073 1.00 0.00 O ATOM 824 CB TRP A 975 -2.267 -13.606 -1.044 1.00 0.00 C ATOM 825 CG TRP A 975 -0.945 -13.085 -1.478 1.00 0.00 C ATOM 826 CD1 TRP A 975 -0.211 -13.527 -2.524 1.00 0.00 C ATOM 827 CD2 TRP A 975 -0.204 -12.012 -0.887 1.00 0.00 C ATOM 828 NE1 TRP A 975 0.943 -12.805 -2.622 1.00 0.00 N ATOM 829 CE2 TRP A 975 0.980 -11.871 -1.621 1.00 0.00 C ATOM 830 CE3 TRP A 975 -0.430 -11.161 0.194 1.00 0.00 C ATOM 831 CZ2 TRP A 975 1.945 -10.915 -1.303 1.00 0.00 C ATOM 832 CZ3 TRP A 975 0.519 -10.211 0.505 1.00 0.00 C ATOM 833 CH2 TRP A 975 1.696 -10.097 -0.239 1.00 0.00 C ATOM 0 H TRP A 975 -1.131 -15.833 -0.661 1.00 0.00 H new ATOM 0 HA TRP A 975 -1.810 -13.666 1.054 1.00 0.00 H new ATOM 0 HB2 TRP A 975 -2.640 -14.293 -1.803 1.00 0.00 H new ATOM 0 HB3 TRP A 975 -2.972 -12.776 -0.991 1.00 0.00 H new ATOM 0 HD1 TRP A 975 -0.496 -14.333 -3.185 1.00 0.00 H new ATOM 0 HE1 TRP A 975 1.665 -12.940 -3.330 1.00 0.00 H new ATOM 0 HE3 TRP A 975 -1.334 -11.245 0.778 1.00 0.00 H new ATOM 0 HZ2 TRP A 975 2.855 -10.825 -1.877 1.00 0.00 H new ATOM 0 HZ3 TRP A 975 0.350 -9.544 1.337 1.00 0.00 H new ATOM 0 HH2 TRP A 975 2.423 -9.347 0.033 1.00 0.00 H new ATOM 844 N GLU A 976 -4.051 -14.329 1.967 1.00 0.00 N ATOM 845 CA GLU A 976 -5.395 -14.615 2.457 1.00 0.00 C ATOM 846 C GLU A 976 -6.443 -13.712 1.790 1.00 0.00 C ATOM 847 O GLU A 976 -7.534 -14.169 1.446 1.00 0.00 O ATOM 848 CB GLU A 976 -5.497 -14.493 3.981 1.00 0.00 C ATOM 849 CG GLU A 976 -6.912 -14.785 4.474 1.00 0.00 C ATOM 850 CD GLU A 976 -6.998 -15.190 5.920 1.00 0.00 C ATOM 851 OE1 GLU A 976 -6.778 -14.354 6.809 1.00 0.00 O ATOM 852 OE2 GLU A 976 -7.277 -16.373 6.202 1.00 0.00 O ATOM 0 H GLU A 976 -3.438 -13.874 2.644 1.00 0.00 H new ATOM 0 HA GLU A 976 -5.602 -15.651 2.188 1.00 0.00 H new ATOM 0 HB2 GLU A 976 -4.798 -15.185 4.450 1.00 0.00 H new ATOM 0 HB3 GLU A 976 -5.204 -13.488 4.287 1.00 0.00 H new ATOM 0 HG2 GLU A 976 -7.527 -13.898 4.321 1.00 0.00 H new ATOM 0 HG3 GLU A 976 -7.340 -15.579 3.862 1.00 0.00 H new ATOM 859 N ASP A 977 -6.094 -12.440 1.570 1.00 0.00 N ATOM 860 CA ASP A 977 -7.056 -11.484 1.000 1.00 0.00 C ATOM 861 C ASP A 977 -7.199 -11.655 -0.494 1.00 0.00 C ATOM 862 O ASP A 977 -6.257 -12.067 -1.188 1.00 0.00 O ATOM 863 CB ASP A 977 -6.684 -10.015 1.214 1.00 0.00 C ATOM 864 CG ASP A 977 -6.830 -9.484 2.622 1.00 0.00 C ATOM 865 OD1 ASP A 977 -7.666 -9.982 3.407 1.00 0.00 O ATOM 866 OD2 ASP A 977 -6.143 -8.491 2.938 1.00 0.00 O ATOM 0 H ASP A 977 -5.173 -12.052 1.772 1.00 0.00 H new ATOM 0 HA ASP A 977 -7.980 -11.711 1.532 1.00 0.00 H new ATOM 0 HB2 ASP A 977 -5.649 -9.875 0.902 1.00 0.00 H new ATOM 0 HB3 ASP A 977 -7.301 -9.406 0.553 1.00 0.00 H new ATOM 871 N ASP A 978 -8.362 -11.288 -0.984 1.00 0.00 N ATOM 872 CA ASP A 978 -8.637 -11.274 -2.408 1.00 0.00 C ATOM 873 C ASP A 978 -8.236 -9.924 -2.951 1.00 0.00 C ATOM 874 O ASP A 978 -8.918 -8.922 -2.697 1.00 0.00 O ATOM 875 CB ASP A 978 -10.117 -11.509 -2.725 1.00 0.00 C ATOM 876 CG ASP A 978 -10.622 -12.865 -2.312 1.00 0.00 C ATOM 877 OD1 ASP A 978 -10.388 -13.854 -3.038 1.00 0.00 O ATOM 878 OD2 ASP A 978 -11.285 -12.961 -1.257 1.00 0.00 O ATOM 0 H ASP A 978 -9.148 -10.989 -0.406 1.00 0.00 H new ATOM 0 HA ASP A 978 -8.071 -12.084 -2.868 1.00 0.00 H new ATOM 0 HB2 ASP A 978 -10.711 -10.744 -2.226 1.00 0.00 H new ATOM 0 HB3 ASP A 978 -10.273 -11.385 -3.797 1.00 0.00 H new ATOM 883 N ALA A 979 -7.138 -9.918 -3.692 1.00 0.00 N ATOM 884 CA ALA A 979 -6.537 -8.718 -4.276 1.00 0.00 C ATOM 885 C ALA A 979 -6.176 -7.635 -3.261 1.00 0.00 C ATOM 886 O ALA A 979 -6.408 -7.732 -2.056 1.00 0.00 O ATOM 887 CB ALA A 979 -7.429 -8.139 -5.368 1.00 0.00 C ATOM 0 H ALA A 979 -6.622 -10.770 -3.913 1.00 0.00 H new ATOM 0 HA ALA A 979 -5.593 -9.052 -4.707 1.00 0.00 H new ATOM 0 HB1 ALA A 979 -6.960 -7.248 -5.786 1.00 0.00 H new ATOM 0 HB2 ALA A 979 -7.568 -8.880 -6.155 1.00 0.00 H new ATOM 0 HB3 ALA A 979 -8.398 -7.874 -4.944 1.00 0.00 H new ATOM 893 N TRP A 980 -5.513 -6.643 -3.792 1.00 0.00 N ATOM 894 CA TRP A 980 -5.118 -5.487 -3.024 1.00 0.00 C ATOM 895 C TRP A 980 -6.216 -4.451 -3.136 1.00 0.00 C ATOM 896 O TRP A 980 -6.589 -4.043 -4.241 1.00 0.00 O ATOM 897 CB TRP A 980 -3.778 -4.924 -3.494 1.00 0.00 C ATOM 898 CG TRP A 980 -2.659 -5.931 -3.494 1.00 0.00 C ATOM 899 CD1 TRP A 980 -2.544 -7.029 -4.299 1.00 0.00 C ATOM 900 CD2 TRP A 980 -1.484 -5.923 -2.668 1.00 0.00 C ATOM 901 NE1 TRP A 980 -1.382 -7.700 -4.022 1.00 0.00 N ATOM 902 CE2 TRP A 980 -0.709 -7.040 -3.036 1.00 0.00 C ATOM 903 CE3 TRP A 980 -1.010 -5.085 -1.657 1.00 0.00 C ATOM 904 CZ2 TRP A 980 0.509 -7.338 -2.439 1.00 0.00 C ATOM 905 CZ3 TRP A 980 0.199 -5.382 -1.058 1.00 0.00 C ATOM 906 CH2 TRP A 980 0.949 -6.498 -1.452 1.00 0.00 C ATOM 0 H TRP A 980 -5.230 -6.611 -4.771 1.00 0.00 H new ATOM 0 HA TRP A 980 -4.979 -5.774 -1.982 1.00 0.00 H new ATOM 0 HB2 TRP A 980 -3.896 -4.526 -4.502 1.00 0.00 H new ATOM 0 HB3 TRP A 980 -3.501 -4.088 -2.852 1.00 0.00 H new ATOM 0 HD1 TRP A 980 -3.265 -7.325 -5.046 1.00 0.00 H new ATOM 0 HE1 TRP A 980 -1.070 -8.556 -4.480 1.00 0.00 H new ATOM 0 HE3 TRP A 980 -1.578 -4.220 -1.349 1.00 0.00 H new ATOM 0 HZ2 TRP A 980 1.086 -8.199 -2.742 1.00 0.00 H new ATOM 0 HZ3 TRP A 980 0.573 -4.743 -0.272 1.00 0.00 H new ATOM 0 HH2 TRP A 980 1.893 -6.699 -0.967 1.00 0.00 H new ATOM 917 N SER A 981 -6.721 -4.024 -2.006 1.00 0.00 N ATOM 918 CA SER A 981 -7.838 -3.101 -1.960 1.00 0.00 C ATOM 919 C SER A 981 -7.394 -1.903 -1.135 1.00 0.00 C ATOM 920 O SER A 981 -6.531 -2.047 -0.305 1.00 0.00 O ATOM 921 CB SER A 981 -9.042 -3.792 -1.315 1.00 0.00 C ATOM 922 OG SER A 981 -9.310 -5.046 -1.932 1.00 0.00 O ATOM 0 H SER A 981 -6.373 -4.304 -1.089 1.00 0.00 H new ATOM 0 HA SER A 981 -8.134 -2.779 -2.959 1.00 0.00 H new ATOM 0 HB2 SER A 981 -8.852 -3.940 -0.252 1.00 0.00 H new ATOM 0 HB3 SER A 981 -9.919 -3.150 -1.396 1.00 0.00 H new ATOM 0 HG SER A 981 -10.083 -5.465 -1.499 1.00 0.00 H new ATOM 928 N TYR A 982 -7.983 -0.751 -1.321 1.00 0.00 N ATOM 929 CA TYR A 982 -7.500 0.437 -0.623 1.00 0.00 C ATOM 930 C TYR A 982 -7.895 0.411 0.845 1.00 0.00 C ATOM 931 O TYR A 982 -8.965 -0.087 1.204 1.00 0.00 O ATOM 932 CB TYR A 982 -7.954 1.729 -1.314 1.00 0.00 C ATOM 933 CG TYR A 982 -9.435 1.819 -1.577 1.00 0.00 C ATOM 934 CD1 TYR A 982 -10.004 1.086 -2.602 1.00 0.00 C ATOM 935 CD2 TYR A 982 -10.245 2.659 -0.835 1.00 0.00 C ATOM 936 CE1 TYR A 982 -11.351 1.182 -2.884 1.00 0.00 C ATOM 937 CE2 TYR A 982 -11.597 2.758 -1.103 1.00 0.00 C ATOM 938 CZ TYR A 982 -12.144 2.020 -2.131 1.00 0.00 C ATOM 939 OH TYR A 982 -13.488 2.128 -2.414 1.00 0.00 O ATOM 0 H TYR A 982 -8.783 -0.599 -1.935 1.00 0.00 H new ATOM 0 HA TYR A 982 -6.411 0.423 -0.668 1.00 0.00 H new ATOM 0 HB2 TYR A 982 -7.657 2.578 -0.698 1.00 0.00 H new ATOM 0 HB3 TYR A 982 -7.425 1.822 -2.262 1.00 0.00 H new ATOM 0 HD1 TYR A 982 -9.384 0.427 -3.192 1.00 0.00 H new ATOM 0 HD2 TYR A 982 -9.816 3.245 -0.036 1.00 0.00 H new ATOM 0 HE1 TYR A 982 -11.781 0.604 -3.689 1.00 0.00 H new ATOM 0 HE2 TYR A 982 -12.222 3.410 -0.510 1.00 0.00 H new ATOM 0 HH TYR A 982 -13.946 2.566 -1.666 1.00 0.00 H new ATOM 949 N ASP A 983 -7.009 0.930 1.675 1.00 0.00 N ATOM 950 CA ASP A 983 -7.165 0.880 3.118 1.00 0.00 C ATOM 951 C ASP A 983 -7.629 2.216 3.650 1.00 0.00 C ATOM 952 O ASP A 983 -7.014 3.248 3.387 1.00 0.00 O ATOM 953 CB ASP A 983 -5.844 0.493 3.780 1.00 0.00 C ATOM 954 CG ASP A 983 -5.874 0.615 5.294 1.00 0.00 C ATOM 955 OD1 ASP A 983 -6.670 -0.078 5.942 1.00 0.00 O ATOM 956 OD2 ASP A 983 -5.071 1.393 5.860 1.00 0.00 O ATOM 0 H ASP A 983 -6.158 1.400 1.367 1.00 0.00 H new ATOM 0 HA ASP A 983 -7.918 0.127 3.353 1.00 0.00 H new ATOM 0 HB2 ASP A 983 -5.597 -0.534 3.510 1.00 0.00 H new ATOM 0 HB3 ASP A 983 -5.049 1.126 3.387 1.00 0.00 H new ATOM 961 N ILE A 984 -8.711 2.179 4.389 1.00 0.00 N ATOM 962 CA ILE A 984 -9.292 3.367 4.979 1.00 0.00 C ATOM 963 C ILE A 984 -9.219 3.316 6.504 1.00 0.00 C ATOM 964 O ILE A 984 -9.965 3.999 7.205 1.00 0.00 O ATOM 965 CB ILE A 984 -10.751 3.604 4.478 1.00 0.00 C ATOM 966 CG1 ILE A 984 -11.581 2.305 4.388 1.00 0.00 C ATOM 967 CG2 ILE A 984 -10.735 4.296 3.123 1.00 0.00 C ATOM 968 CD1 ILE A 984 -11.873 1.619 5.705 1.00 0.00 C ATOM 0 H ILE A 984 -9.219 1.320 4.601 1.00 0.00 H new ATOM 0 HA ILE A 984 -8.701 4.222 4.650 1.00 0.00 H new ATOM 0 HB ILE A 984 -11.233 4.240 5.220 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -12.529 2.535 3.901 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -11.053 1.603 3.743 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -11.759 4.456 2.784 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -10.228 5.257 3.211 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -10.207 3.672 2.402 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -12.461 0.719 5.524 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -10.935 1.348 6.190 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -12.434 2.295 6.351 1.00 0.00 H new ATOM 980 N ASN A 985 -8.239 2.585 7.016 1.00 0.00 N ATOM 981 CA ASN A 985 -8.066 2.417 8.457 1.00 0.00 C ATOM 982 C ASN A 985 -6.812 3.200 8.860 1.00 0.00 C ATOM 983 O ASN A 985 -6.161 2.960 9.868 1.00 0.00 O ATOM 984 CB ASN A 985 -7.961 0.914 8.789 1.00 0.00 C ATOM 985 CG ASN A 985 -7.927 0.591 10.281 1.00 0.00 C ATOM 986 OD1 ASN A 985 -8.976 0.454 10.924 1.00 0.00 O ATOM 987 ND2 ASN A 985 -6.742 0.407 10.831 1.00 0.00 N ATOM 0 H ASN A 985 -7.545 2.094 6.452 1.00 0.00 H new ATOM 0 HA ASN A 985 -8.916 2.803 9.020 1.00 0.00 H new ATOM 0 HB2 ASN A 985 -8.808 0.396 8.338 1.00 0.00 H new ATOM 0 HB3 ASN A 985 -7.059 0.515 8.324 1.00 0.00 H new ATOM 0 HD21 ASN A 985 -6.671 0.144 11.814 1.00 0.00 H new ATOM 0 HD22 ASN A 985 -5.897 0.528 10.273 1.00 0.00 H new ATOM 994 N ARG A 986 -6.545 4.217 8.074 1.00 0.00 N ATOM 995 CA ARG A 986 -5.397 5.085 8.230 1.00 0.00 C ATOM 996 C ARG A 986 -5.908 6.479 7.908 1.00 0.00 C ATOM 997 O ARG A 986 -7.087 6.611 7.586 1.00 0.00 O ATOM 998 CB ARG A 986 -4.310 4.667 7.237 1.00 0.00 C ATOM 999 CG ARG A 986 -2.976 5.361 7.403 1.00 0.00 C ATOM 1000 CD ARG A 986 -2.050 5.015 6.261 1.00 0.00 C ATOM 1001 NE ARG A 986 -1.118 6.097 5.986 1.00 0.00 N ATOM 1002 CZ ARG A 986 -0.946 6.614 4.768 1.00 0.00 C ATOM 1003 NH1 ARG A 986 -1.486 6.001 3.724 1.00 0.00 N ATOM 1004 NH2 ARG A 986 -0.227 7.714 4.591 1.00 0.00 N ATOM 0 H ARG A 986 -7.138 4.472 7.284 1.00 0.00 H new ATOM 0 HA ARG A 986 -4.964 5.039 9.229 1.00 0.00 H new ATOM 0 HB2 ARG A 986 -4.154 3.592 7.326 1.00 0.00 H new ATOM 0 HB3 ARG A 986 -4.674 4.853 6.227 1.00 0.00 H new ATOM 0 HG2 ARG A 986 -3.124 6.440 7.444 1.00 0.00 H new ATOM 0 HG3 ARG A 986 -2.522 5.066 8.349 1.00 0.00 H new ATOM 0 HD2 ARG A 986 -1.496 4.108 6.502 1.00 0.00 H new ATOM 0 HD3 ARG A 986 -2.636 4.802 5.367 1.00 0.00 H new ATOM 0 HE ARG A 986 -0.571 6.478 6.759 1.00 0.00 H new ATOM 0 HH11 ARG A 986 -2.025 5.145 3.858 1.00 0.00 H new ATOM 0 HH12 ARG A 986 -1.363 6.385 2.787 1.00 0.00 H new ATOM 0 HH21 ARG A 986 0.203 8.176 5.392 1.00 0.00 H new ATOM 0 HH22 ARG A 986 -0.104 8.098 3.654 1.00 0.00 H new ATOM 1018 N ALA A 987 -5.072 7.499 7.937 1.00 0.00 N ATOM 1019 CA ALA A 987 -5.540 8.841 7.638 1.00 0.00 C ATOM 1020 C ALA A 987 -5.431 9.101 6.149 1.00 0.00 C ATOM 1021 O ALA A 987 -4.444 9.648 5.653 1.00 0.00 O ATOM 1022 CB ALA A 987 -4.785 9.895 8.433 1.00 0.00 C ATOM 0 H ALA A 987 -4.079 7.428 8.161 1.00 0.00 H new ATOM 0 HA ALA A 987 -6.586 8.911 7.936 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -5.166 10.884 8.179 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -4.923 9.715 9.499 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -3.724 9.842 8.191 1.00 0.00 H new ATOM 1028 N VAL A 988 -6.426 8.625 5.444 1.00 0.00 N ATOM 1029 CA VAL A 988 -6.497 8.735 4.003 1.00 0.00 C ATOM 1030 C VAL A 988 -7.846 9.324 3.609 1.00 0.00 C ATOM 1031 O VAL A 988 -8.612 9.750 4.476 1.00 0.00 O ATOM 1032 CB VAL A 988 -6.317 7.348 3.338 1.00 0.00 C ATOM 1033 CG1 VAL A 988 -4.915 6.804 3.576 1.00 0.00 C ATOM 1034 CG2 VAL A 988 -7.354 6.362 3.859 1.00 0.00 C ATOM 0 H VAL A 988 -7.223 8.142 5.858 1.00 0.00 H new ATOM 0 HA VAL A 988 -5.694 9.387 3.660 1.00 0.00 H new ATOM 0 HB VAL A 988 -6.460 7.474 2.265 1.00 0.00 H new ATOM 0 HG11 VAL A 988 -4.817 5.829 3.098 1.00 0.00 H new ATOM 0 HG12 VAL A 988 -4.182 7.491 3.153 1.00 0.00 H new ATOM 0 HG13 VAL A 988 -4.741 6.702 4.647 1.00 0.00 H new ATOM 0 HG21 VAL A 988 -7.209 5.394 3.379 1.00 0.00 H new ATOM 0 HG22 VAL A 988 -7.242 6.252 4.938 1.00 0.00 H new ATOM 0 HG23 VAL A 988 -8.354 6.733 3.634 1.00 0.00 H new ATOM 1044 N ASP A 989 -8.134 9.342 2.323 1.00 0.00 N ATOM 1045 CA ASP A 989 -9.411 9.833 1.810 1.00 0.00 C ATOM 1046 C ASP A 989 -10.359 8.641 1.681 1.00 0.00 C ATOM 1047 O ASP A 989 -9.965 7.514 1.980 1.00 0.00 O ATOM 1048 CB ASP A 989 -9.184 10.510 0.448 1.00 0.00 C ATOM 1049 CG ASP A 989 -10.434 11.051 -0.217 1.00 0.00 C ATOM 1050 OD1 ASP A 989 -11.051 11.999 0.315 1.00 0.00 O ATOM 1051 OD2 ASP A 989 -10.820 10.527 -1.285 1.00 0.00 O ATOM 0 H ASP A 989 -7.493 9.018 1.598 1.00 0.00 H new ATOM 0 HA ASP A 989 -9.848 10.569 2.484 1.00 0.00 H new ATOM 0 HB2 ASP A 989 -8.478 11.330 0.580 1.00 0.00 H new ATOM 0 HB3 ASP A 989 -8.716 9.791 -0.224 1.00 0.00 H new ATOM 1056 N GLU A 990 -11.571 8.877 1.205 1.00 0.00 N ATOM 1057 CA GLU A 990 -12.582 7.850 1.010 1.00 0.00 C ATOM 1058 C GLU A 990 -12.096 6.759 0.112 1.00 0.00 C ATOM 1059 O GLU A 990 -12.449 5.589 0.268 1.00 0.00 O ATOM 1060 CB GLU A 990 -13.813 8.500 0.420 1.00 0.00 C ATOM 1061 CG GLU A 990 -14.391 9.469 1.400 1.00 0.00 C ATOM 1062 CD GLU A 990 -15.556 10.272 0.882 1.00 0.00 C ATOM 1063 OE1 GLU A 990 -15.326 11.280 0.176 1.00 0.00 O ATOM 1064 OE2 GLU A 990 -16.710 9.959 1.238 1.00 0.00 O ATOM 0 H GLU A 990 -11.886 9.809 0.937 1.00 0.00 H new ATOM 0 HA GLU A 990 -12.814 7.394 1.973 1.00 0.00 H new ATOM 0 HB2 GLU A 990 -13.556 9.014 -0.506 1.00 0.00 H new ATOM 0 HB3 GLU A 990 -14.552 7.739 0.167 1.00 0.00 H new ATOM 0 HG2 GLU A 990 -14.711 8.921 2.286 1.00 0.00 H new ATOM 0 HG3 GLU A 990 -13.606 10.156 1.716 1.00 0.00 H new ATOM 1071 N LYS A 991 -11.281 7.138 -0.830 1.00 0.00 N ATOM 1072 CA LYS A 991 -10.769 6.176 -1.743 1.00 0.00 C ATOM 1073 C LYS A 991 -9.293 5.903 -1.486 1.00 0.00 C ATOM 1074 O LYS A 991 -8.584 5.342 -2.326 1.00 0.00 O ATOM 1075 CB LYS A 991 -11.061 6.661 -3.146 1.00 0.00 C ATOM 1076 CG LYS A 991 -12.551 6.753 -3.373 1.00 0.00 C ATOM 1077 CD LYS A 991 -13.147 5.371 -3.543 1.00 0.00 C ATOM 1078 CE LYS A 991 -14.656 5.404 -3.673 1.00 0.00 C ATOM 1079 NZ LYS A 991 -15.207 4.036 -3.831 1.00 0.00 N ATOM 0 H LYS A 991 -10.964 8.096 -0.980 1.00 0.00 H new ATOM 0 HA LYS A 991 -11.259 5.212 -1.606 1.00 0.00 H new ATOM 0 HB2 LYS A 991 -10.602 7.637 -3.303 1.00 0.00 H new ATOM 0 HB3 LYS A 991 -10.618 5.980 -3.872 1.00 0.00 H new ATOM 0 HG2 LYS A 991 -13.023 7.258 -2.530 1.00 0.00 H new ATOM 0 HG3 LYS A 991 -12.754 7.355 -4.259 1.00 0.00 H new ATOM 0 HD2 LYS A 991 -12.719 4.900 -4.428 1.00 0.00 H new ATOM 0 HD3 LYS A 991 -12.872 4.752 -2.689 1.00 0.00 H new ATOM 0 HE2 LYS A 991 -15.090 5.875 -2.791 1.00 0.00 H new ATOM 0 HE3 LYS A 991 -14.937 6.014 -4.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 991 -16.170 4.002 -3.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 991 -15.235 3.787 -4.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 991 -14.603 3.358 -3.324 1.00 0.00 H new ATOM 1093 N GLY A 992 -8.848 6.290 -0.301 1.00 0.00 N ATOM 1094 CA GLY A 992 -7.487 6.049 0.123 1.00 0.00 C ATOM 1095 C GLY A 992 -6.515 7.121 -0.322 1.00 0.00 C ATOM 1096 O GLY A 992 -5.457 7.267 0.275 1.00 0.00 O ATOM 0 H GLY A 992 -9.421 6.778 0.388 1.00 0.00 H new ATOM 0 HA2 GLY A 992 -7.462 5.976 1.210 1.00 0.00 H new ATOM 0 HA3 GLY A 992 -7.158 5.087 -0.269 1.00 0.00 H new ATOM 1100 N TRP A 993 -6.865 7.842 -1.376 1.00 0.00 N ATOM 1101 CA TRP A 993 -6.000 8.876 -1.942 1.00 0.00 C ATOM 1102 C TRP A 993 -5.604 9.931 -0.916 1.00 0.00 C ATOM 1103 O TRP A 993 -6.408 10.748 -0.492 1.00 0.00 O ATOM 1104 CB TRP A 993 -6.665 9.567 -3.126 1.00 0.00 C ATOM 1105 CG TRP A 993 -7.102 8.647 -4.211 1.00 0.00 C ATOM 1106 CD1 TRP A 993 -8.376 8.263 -4.468 1.00 0.00 C ATOM 1107 CD2 TRP A 993 -6.277 7.986 -5.179 1.00 0.00 C ATOM 1108 NE1 TRP A 993 -8.408 7.410 -5.531 1.00 0.00 N ATOM 1109 CE2 TRP A 993 -7.132 7.225 -5.995 1.00 0.00 C ATOM 1110 CE3 TRP A 993 -4.905 7.965 -5.437 1.00 0.00 C ATOM 1111 CZ2 TRP A 993 -6.659 6.453 -7.051 1.00 0.00 C ATOM 1112 CZ3 TRP A 993 -4.433 7.192 -6.481 1.00 0.00 C ATOM 1113 CH2 TRP A 993 -5.308 6.447 -7.280 1.00 0.00 C ATOM 0 H TRP A 993 -7.753 7.731 -1.865 1.00 0.00 H new ATOM 0 HA TRP A 993 -5.098 8.361 -2.274 1.00 0.00 H new ATOM 0 HB2 TRP A 993 -7.531 10.122 -2.767 1.00 0.00 H new ATOM 0 HB3 TRP A 993 -5.970 10.296 -3.543 1.00 0.00 H new ATOM 0 HD1 TRP A 993 -9.242 8.587 -3.910 1.00 0.00 H new ATOM 0 HE1 TRP A 993 -9.247 6.979 -5.919 1.00 0.00 H new ATOM 0 HE3 TRP A 993 -4.224 8.543 -4.831 1.00 0.00 H new ATOM 0 HZ2 TRP A 993 -7.333 5.878 -7.669 1.00 0.00 H new ATOM 0 HZ3 TRP A 993 -3.373 7.162 -6.683 1.00 0.00 H new ATOM 0 HH2 TRP A 993 -4.911 5.856 -8.092 1.00 0.00 H new ATOM 1124 N GLU A 994 -4.352 9.944 -0.570 1.00 0.00 N ATOM 1125 CA GLU A 994 -3.795 10.836 0.392 1.00 0.00 C ATOM 1126 C GLU A 994 -3.125 12.008 -0.313 1.00 0.00 C ATOM 1127 O GLU A 994 -2.785 11.949 -1.519 1.00 0.00 O ATOM 1128 CB GLU A 994 -2.820 10.049 1.295 1.00 0.00 C ATOM 1129 CG GLU A 994 -1.801 9.198 0.525 1.00 0.00 C ATOM 1130 CD GLU A 994 -1.069 8.179 1.367 1.00 0.00 C ATOM 1131 OE1 GLU A 994 -0.097 8.523 2.069 1.00 0.00 O ATOM 1132 OE2 GLU A 994 -1.442 6.993 1.321 1.00 0.00 O ATOM 0 H GLU A 994 -3.665 9.305 -0.969 1.00 0.00 H new ATOM 0 HA GLU A 994 -4.576 11.256 1.027 1.00 0.00 H new ATOM 0 HB2 GLU A 994 -2.283 10.752 1.931 1.00 0.00 H new ATOM 0 HB3 GLU A 994 -3.396 9.399 1.954 1.00 0.00 H new ATOM 0 HG2 GLU A 994 -2.317 8.679 -0.283 1.00 0.00 H new ATOM 0 HG3 GLU A 994 -1.070 9.861 0.062 1.00 0.00 H new ATOM 1139 N TYR A 995 -3.028 13.060 0.472 1.00 0.00 N ATOM 1140 CA TYR A 995 -2.549 14.390 0.116 1.00 0.00 C ATOM 1141 C TYR A 995 -1.075 14.408 -0.273 1.00 0.00 C ATOM 1142 O TYR A 995 -0.220 14.358 0.583 1.00 0.00 O ATOM 1143 CB TYR A 995 -2.818 15.298 1.337 1.00 0.00 C ATOM 1144 CG TYR A 995 -2.222 16.696 1.336 1.00 0.00 C ATOM 1145 CD1 TYR A 995 -2.876 17.757 0.738 1.00 0.00 C ATOM 1146 CD2 TYR A 995 -1.014 16.955 1.978 1.00 0.00 C ATOM 1147 CE1 TYR A 995 -2.348 19.030 0.766 1.00 0.00 C ATOM 1148 CE2 TYR A 995 -0.475 18.224 2.009 1.00 0.00 C ATOM 1149 CZ TYR A 995 -1.146 19.256 1.399 1.00 0.00 C ATOM 1150 OH TYR A 995 -0.629 20.530 1.433 1.00 0.00 O ATOM 0 H TYR A 995 -3.302 13.009 1.453 1.00 0.00 H new ATOM 0 HA TYR A 995 -3.076 14.745 -0.769 1.00 0.00 H new ATOM 0 HB2 TYR A 995 -3.898 15.396 1.448 1.00 0.00 H new ATOM 0 HB3 TYR A 995 -2.452 14.781 2.224 1.00 0.00 H new ATOM 0 HD1 TYR A 995 -3.819 17.585 0.239 1.00 0.00 H new ATOM 0 HD2 TYR A 995 -0.488 16.145 2.462 1.00 0.00 H new ATOM 0 HE1 TYR A 995 -2.874 19.846 0.294 1.00 0.00 H new ATOM 0 HE2 TYR A 995 0.466 18.405 2.508 1.00 0.00 H new ATOM 0 HH TYR A 995 0.239 20.519 1.889 1.00 0.00 H new ATOM 1160 N GLY A 996 -0.790 14.406 -1.560 1.00 0.00 N ATOM 1161 CA GLY A 996 0.578 14.578 -1.984 1.00 0.00 C ATOM 1162 C GLY A 996 0.762 15.787 -2.879 1.00 0.00 C ATOM 1163 O GLY A 996 0.199 15.864 -3.981 1.00 0.00 O ATOM 0 H GLY A 996 -1.470 14.290 -2.311 1.00 0.00 H new ATOM 0 HA2 GLY A 996 1.217 14.679 -1.107 1.00 0.00 H new ATOM 0 HA3 GLY A 996 0.905 13.684 -2.515 1.00 0.00 H new ATOM 1167 N ILE A 997 1.506 16.761 -2.407 1.00 0.00 N ATOM 1168 CA ILE A 997 1.845 17.913 -3.217 1.00 0.00 C ATOM 1169 C ILE A 997 3.353 17.914 -3.336 1.00 0.00 C ATOM 1170 O ILE A 997 4.034 17.315 -2.502 1.00 0.00 O ATOM 1171 CB ILE A 997 1.389 19.255 -2.583 1.00 0.00 C ATOM 1172 CG1 ILE A 997 2.401 19.700 -1.521 1.00 0.00 C ATOM 1173 CG2 ILE A 997 -0.023 19.136 -2.015 1.00 0.00 C ATOM 1174 CD1 ILE A 997 1.923 20.782 -0.573 1.00 0.00 C ATOM 0 H ILE A 997 1.890 16.780 -1.462 1.00 0.00 H new ATOM 0 HA ILE A 997 1.337 17.838 -4.179 1.00 0.00 H new ATOM 0 HB ILE A 997 1.355 20.023 -3.356 1.00 0.00 H new ATOM 0 HG12 ILE A 997 2.690 18.829 -0.933 1.00 0.00 H new ATOM 0 HG13 ILE A 997 3.299 20.056 -2.027 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -0.320 20.089 -1.576 1.00 0.00 H new ATOM 0 HG22 ILE A 997 -0.716 18.873 -2.814 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -0.043 18.362 -1.248 1.00 0.00 H new ATOM 0 HD11 ILE A 997 2.716 21.021 0.136 1.00 0.00 H new ATOM 0 HD12 ILE A 997 1.663 21.675 -1.141 1.00 0.00 H new ATOM 0 HD13 ILE A 997 1.046 20.429 -0.031 1.00 0.00 H new ATOM 1186 N THR A 998 3.879 18.447 -4.395 1.00 0.00 N ATOM 1187 CA THR A 998 5.302 18.574 -4.487 1.00 0.00 C ATOM 1188 C THR A 998 5.686 19.971 -4.961 1.00 0.00 C ATOM 1189 O THR A 998 5.614 20.306 -6.149 1.00 0.00 O ATOM 1190 CB THR A 998 5.828 17.463 -5.397 1.00 0.00 C ATOM 1191 OG1 THR A 998 5.408 16.198 -4.854 1.00 0.00 O ATOM 1192 CG2 THR A 998 7.339 17.486 -5.524 1.00 0.00 C ATOM 0 H THR A 998 3.355 18.797 -5.197 1.00 0.00 H new ATOM 0 HA THR A 998 5.765 18.456 -3.507 1.00 0.00 H new ATOM 0 HB THR A 998 5.422 17.618 -6.397 1.00 0.00 H new ATOM 0 HG1 THR A 998 5.735 15.472 -5.425 1.00 0.00 H new ATOM 0 HG21 THR A 998 7.661 16.678 -6.180 1.00 0.00 H new ATOM 0 HG22 THR A 998 7.654 18.441 -5.943 1.00 0.00 H new ATOM 0 HG23 THR A 998 7.789 17.355 -4.540 1.00 0.00 H new ATOM 1200 N ILE A 999 6.009 20.797 -3.988 1.00 0.00 N ATOM 1201 CA ILE A 999 6.406 22.169 -4.213 1.00 0.00 C ATOM 1202 C ILE A 999 7.930 22.257 -4.211 1.00 0.00 C ATOM 1203 O ILE A 999 8.572 21.978 -3.189 1.00 0.00 O ATOM 1204 CB ILE A 999 5.824 23.101 -3.120 1.00 0.00 C ATOM 1205 CG1 ILE A 999 4.293 23.043 -3.131 1.00 0.00 C ATOM 1206 CG2 ILE A 999 6.312 24.530 -3.318 1.00 0.00 C ATOM 1207 CD1 ILE A 999 3.638 23.857 -2.035 1.00 0.00 C ATOM 0 H ILE A 999 6.003 20.529 -3.004 1.00 0.00 H new ATOM 0 HA ILE A 999 6.016 22.493 -5.178 1.00 0.00 H new ATOM 0 HB ILE A 999 6.174 22.756 -2.147 1.00 0.00 H new ATOM 0 HG12 ILE A 999 3.933 23.397 -4.097 1.00 0.00 H new ATOM 0 HG13 ILE A 999 3.978 22.004 -3.035 1.00 0.00 H new ATOM 0 HG21 ILE A 999 5.892 25.169 -2.541 1.00 0.00 H new ATOM 0 HG22 ILE A 999 7.400 24.554 -3.259 1.00 0.00 H new ATOM 0 HG23 ILE A 999 5.993 24.891 -4.296 1.00 0.00 H new ATOM 0 HD11 ILE A 999 2.555 23.764 -2.111 1.00 0.00 H new ATOM 0 HD12 ILE A 999 3.967 23.489 -1.063 1.00 0.00 H new ATOM 0 HD13 ILE A 999 3.921 24.904 -2.141 1.00 0.00 H new ATOM 1219 N PRO A1000 8.524 22.622 -5.361 1.00 0.00 N ATOM 1220 CA PRO A1000 9.977 22.734 -5.503 1.00 0.00 C ATOM 1221 C PRO A1000 10.589 23.767 -4.555 1.00 0.00 C ATOM 1222 O PRO A1000 10.013 24.841 -4.321 1.00 0.00 O ATOM 1223 CB PRO A1000 10.179 23.161 -6.962 1.00 0.00 C ATOM 1224 CG PRO A1000 8.903 22.830 -7.653 1.00 0.00 C ATOM 1225 CD PRO A1000 7.824 22.947 -6.616 1.00 0.00 C ATOM 0 HA PRO A1000 10.470 21.795 -5.252 1.00 0.00 H new ATOM 0 HB2 PRO A1000 10.399 24.226 -7.032 1.00 0.00 H new ATOM 0 HB3 PRO A1000 11.018 22.632 -7.413 1.00 0.00 H new ATOM 0 HG2 PRO A1000 8.721 23.513 -8.483 1.00 0.00 H new ATOM 0 HG3 PRO A1000 8.935 21.823 -8.070 1.00 0.00 H new ATOM 0 HD2 PRO A1000 7.397 23.950 -6.591 1.00 0.00 H new ATOM 0 HD3 PRO A1000 7.003 22.256 -6.810 1.00 0.00 H new ATOM 1233 N PRO A1001 11.777 23.451 -4.018 1.00 0.00 N ATOM 1234 CA PRO A1001 12.465 22.207 -4.306 1.00 0.00 C ATOM 1235 C PRO A1001 12.128 21.073 -3.360 1.00 0.00 C ATOM 1236 O PRO A1001 11.994 21.249 -2.147 1.00 0.00 O ATOM 1237 CB PRO A1001 13.936 22.548 -4.167 1.00 0.00 C ATOM 1238 CG PRO A1001 13.985 23.885 -3.521 1.00 0.00 C ATOM 1239 CD PRO A1001 12.581 24.276 -3.128 1.00 0.00 C ATOM 0 HA PRO A1001 12.171 21.847 -5.292 1.00 0.00 H new ATOM 0 HB2 PRO A1001 14.454 21.803 -3.563 1.00 0.00 H new ATOM 0 HB3 PRO A1001 14.426 22.566 -5.140 1.00 0.00 H new ATOM 0 HG2 PRO A1001 14.631 23.859 -2.643 1.00 0.00 H new ATOM 0 HG3 PRO A1001 14.406 24.622 -4.205 1.00 0.00 H new ATOM 0 HD2 PRO A1001 12.377 24.063 -2.079 1.00 0.00 H new ATOM 0 HD3 PRO A1001 12.396 25.339 -3.279 1.00 0.00 H new ATOM 1247 N ASP A1002 12.035 19.931 -3.984 1.00 0.00 N ATOM 1248 CA ASP A1002 11.791 18.614 -3.369 1.00 0.00 C ATOM 1249 C ASP A1002 11.280 17.711 -4.473 1.00 0.00 C ATOM 1250 O ASP A1002 10.952 18.190 -5.561 1.00 0.00 O ATOM 1251 CB ASP A1002 10.724 18.615 -2.252 1.00 0.00 C ATOM 1252 CG ASP A1002 10.902 17.475 -1.247 1.00 0.00 C ATOM 1253 OD1 ASP A1002 11.223 16.327 -1.637 1.00 0.00 O ATOM 1254 OD2 ASP A1002 10.791 17.736 -0.032 1.00 0.00 O ATOM 0 H ASP A1002 12.130 19.869 -4.998 1.00 0.00 H new ATOM 0 HA ASP A1002 12.726 18.291 -2.911 1.00 0.00 H new ATOM 0 HB2 ASP A1002 10.763 19.567 -1.722 1.00 0.00 H new ATOM 0 HB3 ASP A1002 9.735 18.541 -2.704 1.00 0.00 H new ATOM 1259 N HIS A1003 11.248 16.422 -4.231 1.00 0.00 N ATOM 1260 CA HIS A1003 10.680 15.468 -5.165 1.00 0.00 C ATOM 1261 C HIS A1003 9.500 14.809 -4.496 1.00 0.00 C ATOM 1262 O HIS A1003 8.533 14.408 -5.141 1.00 0.00 O ATOM 1263 CB HIS A1003 11.653 14.330 -5.508 1.00 0.00 C ATOM 1264 CG HIS A1003 13.037 14.749 -5.846 1.00 0.00 C ATOM 1265 ND1 HIS A1003 13.560 14.729 -7.112 1.00 0.00 N ATOM 1266 CD2 HIS A1003 14.017 15.169 -5.036 1.00 0.00 C ATOM 1267 CE1 HIS A1003 14.813 15.128 -7.068 1.00 0.00 C ATOM 1268 NE2 HIS A1003 15.119 15.404 -5.815 1.00 0.00 N ATOM 0 H HIS A1003 11.616 16.000 -3.378 1.00 0.00 H new ATOM 0 HA HIS A1003 10.425 16.015 -6.073 1.00 0.00 H new ATOM 0 HB2 HIS A1003 11.696 13.646 -4.661 1.00 0.00 H new ATOM 0 HB3 HIS A1003 11.246 13.770 -6.350 1.00 0.00 H new ATOM 0 HD2 HIS A1003 13.951 15.299 -3.966 1.00 0.00 H new ATOM 0 HE1 HIS A1003 15.478 15.215 -7.914 1.00 0.00 H new ATOM 0 HE2 HIS A1003 16.024 15.736 -5.482 1.00 0.00 H new ATOM 1277 N LYS A1004 9.624 14.643 -3.193 1.00 0.00 N ATOM 1278 CA LYS A1004 8.685 13.872 -2.441 1.00 0.00 C ATOM 1279 C LYS A1004 7.747 14.719 -1.592 1.00 0.00 C ATOM 1280 O LYS A1004 8.164 15.665 -0.928 1.00 0.00 O ATOM 1281 CB LYS A1004 9.451 12.942 -1.517 1.00 0.00 C ATOM 1282 CG LYS A1004 10.476 12.076 -2.224 1.00 0.00 C ATOM 1283 CD LYS A1004 11.595 11.707 -1.272 1.00 0.00 C ATOM 1284 CE LYS A1004 12.698 10.912 -1.950 1.00 0.00 C ATOM 1285 NZ LYS A1004 12.240 9.580 -2.414 1.00 0.00 N ATOM 0 H LYS A1004 10.381 15.043 -2.638 1.00 0.00 H new ATOM 0 HA LYS A1004 8.072 13.329 -3.160 1.00 0.00 H new ATOM 0 HB2 LYS A1004 9.956 13.537 -0.756 1.00 0.00 H new ATOM 0 HB3 LYS A1004 8.742 12.297 -0.998 1.00 0.00 H new ATOM 0 HG2 LYS A1004 9.999 11.172 -2.604 1.00 0.00 H new ATOM 0 HG3 LYS A1004 10.881 12.609 -3.084 1.00 0.00 H new ATOM 0 HD2 LYS A1004 12.018 12.616 -0.844 1.00 0.00 H new ATOM 0 HD3 LYS A1004 11.187 11.125 -0.446 1.00 0.00 H new ATOM 0 HE2 LYS A1004 13.078 11.478 -2.801 1.00 0.00 H new ATOM 0 HE3 LYS A1004 13.528 10.785 -1.255 1.00 0.00 H new ATOM 0 HZ1 LYS A1004 13.043 9.060 -2.823 1.00 0.00 H new ATOM 0 HZ2 LYS A1004 11.855 9.046 -1.609 1.00 0.00 H new ATOM 0 HZ3 LYS A1004 11.501 9.699 -3.136 1.00 0.00 H new ATOM 1299 N PRO A1005 6.458 14.398 -1.639 1.00 0.00 N ATOM 1300 CA PRO A1005 5.477 14.925 -0.694 1.00 0.00 C ATOM 1301 C PRO A1005 5.770 14.396 0.700 1.00 0.00 C ATOM 1302 O PRO A1005 5.917 13.185 0.898 1.00 0.00 O ATOM 1303 CB PRO A1005 4.154 14.352 -1.188 1.00 0.00 C ATOM 1304 CG PRO A1005 4.406 14.001 -2.605 1.00 0.00 C ATOM 1305 CD PRO A1005 5.840 13.566 -2.667 1.00 0.00 C ATOM 0 HA PRO A1005 5.481 16.014 -0.640 1.00 0.00 H new ATOM 0 HB2 PRO A1005 3.860 13.477 -0.609 1.00 0.00 H new ATOM 0 HB3 PRO A1005 3.348 15.080 -1.097 1.00 0.00 H new ATOM 0 HG2 PRO A1005 3.740 13.203 -2.935 1.00 0.00 H new ATOM 0 HG3 PRO A1005 4.228 14.856 -3.258 1.00 0.00 H new ATOM 0 HD2 PRO A1005 5.953 12.503 -2.453 1.00 0.00 H new ATOM 0 HD3 PRO A1005 6.277 13.741 -3.650 1.00 0.00 H new ATOM 1313 N LYS A1006 5.899 15.289 1.654 1.00 0.00 N ATOM 1314 CA LYS A1006 6.235 14.883 3.018 1.00 0.00 C ATOM 1315 C LYS A1006 4.973 14.477 3.747 1.00 0.00 C ATOM 1316 O LYS A1006 4.847 13.371 4.277 1.00 0.00 O ATOM 1317 CB LYS A1006 6.849 16.036 3.826 1.00 0.00 C ATOM 1318 CG LYS A1006 7.624 17.063 3.026 1.00 0.00 C ATOM 1319 CD LYS A1006 8.789 16.453 2.251 1.00 0.00 C ATOM 1320 CE LYS A1006 9.823 15.807 3.163 1.00 0.00 C ATOM 1321 NZ LYS A1006 10.476 16.786 4.067 1.00 0.00 N ATOM 0 H LYS A1006 5.780 16.294 1.523 1.00 0.00 H new ATOM 0 HA LYS A1006 6.950 14.065 2.937 1.00 0.00 H new ATOM 0 HB2 LYS A1006 6.048 16.548 4.359 1.00 0.00 H new ATOM 0 HB3 LYS A1006 7.514 15.613 4.579 1.00 0.00 H new ATOM 0 HG2 LYS A1006 6.949 17.558 2.328 1.00 0.00 H new ATOM 0 HG3 LYS A1006 8.004 17.830 3.700 1.00 0.00 H new ATOM 0 HD2 LYS A1006 8.407 15.706 1.555 1.00 0.00 H new ATOM 0 HD3 LYS A1006 9.270 17.228 1.654 1.00 0.00 H new ATOM 0 HE2 LYS A1006 9.342 15.031 3.759 1.00 0.00 H new ATOM 0 HE3 LYS A1006 10.583 15.316 2.555 1.00 0.00 H new ATOM 0 HZ1 LYS A1006 11.251 16.321 4.581 1.00 0.00 H new ATOM 0 HZ2 LYS A1006 10.857 17.575 3.507 1.00 0.00 H new ATOM 0 HZ3 LYS A1006 9.778 17.149 4.747 1.00 0.00 H new ATOM 1335 N SER A1007 4.076 15.429 3.774 1.00 0.00 N ATOM 1336 CA SER A1007 2.844 15.361 4.512 1.00 0.00 C ATOM 1337 C SER A1007 1.731 14.702 3.692 1.00 0.00 C ATOM 1338 O SER A1007 1.574 15.006 2.521 1.00 0.00 O ATOM 1339 CB SER A1007 2.495 16.801 4.856 1.00 0.00 C ATOM 1340 OG SER A1007 3.659 17.498 5.290 1.00 0.00 O ATOM 0 H SER A1007 4.189 16.305 3.263 1.00 0.00 H new ATOM 0 HA SER A1007 2.952 14.748 5.407 1.00 0.00 H new ATOM 0 HB2 SER A1007 2.068 17.298 3.985 1.00 0.00 H new ATOM 0 HB3 SER A1007 1.736 16.822 5.638 1.00 0.00 H new ATOM 0 HG SER A1007 3.424 18.424 5.507 1.00 0.00 H new ATOM 1346 N TRP A1008 0.983 13.810 4.341 1.00 0.00 N ATOM 1347 CA TRP A1008 -0.148 13.094 3.736 1.00 0.00 C ATOM 1348 C TRP A1008 -1.313 13.127 4.719 1.00 0.00 C ATOM 1349 O TRP A1008 -1.119 12.876 5.910 1.00 0.00 O ATOM 1350 CB TRP A1008 0.218 11.638 3.434 1.00 0.00 C ATOM 1351 CG TRP A1008 1.434 11.512 2.605 1.00 0.00 C ATOM 1352 CD1 TRP A1008 2.698 11.496 3.059 1.00 0.00 C ATOM 1353 CD2 TRP A1008 1.507 11.389 1.182 1.00 0.00 C ATOM 1354 NE1 TRP A1008 3.560 11.408 2.023 1.00 0.00 N ATOM 1355 CE2 TRP A1008 2.862 11.324 0.853 1.00 0.00 C ATOM 1356 CE3 TRP A1008 0.567 11.334 0.158 1.00 0.00 C ATOM 1357 CZ2 TRP A1008 3.305 11.205 -0.456 1.00 0.00 C ATOM 1358 CZ3 TRP A1008 0.999 11.212 -1.142 1.00 0.00 C ATOM 1359 CH2 TRP A1008 2.360 11.148 -1.441 1.00 0.00 C ATOM 0 H TRP A1008 1.145 13.558 5.316 1.00 0.00 H new ATOM 0 HA TRP A1008 -0.416 13.577 2.796 1.00 0.00 H new ATOM 0 HB2 TRP A1008 0.367 11.104 4.372 1.00 0.00 H new ATOM 0 HB3 TRP A1008 -0.616 11.157 2.923 1.00 0.00 H new ATOM 0 HD1 TRP A1008 2.983 11.546 4.099 1.00 0.00 H new ATOM 0 HE1 TRP A1008 4.577 11.405 2.103 1.00 0.00 H new ATOM 0 HE3 TRP A1008 -0.488 11.386 0.381 1.00 0.00 H new ATOM 0 HZ2 TRP A1008 4.359 11.159 -0.688 1.00 0.00 H new ATOM 0 HZ3 TRP A1008 0.275 11.165 -1.942 1.00 0.00 H new ATOM 0 HH2 TRP A1008 2.673 11.052 -2.470 1.00 0.00 H new ATOM 1370 N VAL A1009 -2.513 13.375 4.212 1.00 0.00 N ATOM 1371 CA VAL A1009 -3.746 13.543 5.003 1.00 0.00 C ATOM 1372 C VAL A1009 -4.920 13.386 4.047 1.00 0.00 C ATOM 1373 O VAL A1009 -4.708 13.062 2.878 1.00 0.00 O ATOM 1374 CB VAL A1009 -3.882 14.940 5.707 1.00 0.00 C ATOM 1375 CG1 VAL A1009 -2.932 15.104 6.885 1.00 0.00 C ATOM 1376 CG2 VAL A1009 -3.679 16.084 4.721 1.00 0.00 C ATOM 0 H VAL A1009 -2.671 13.470 3.209 1.00 0.00 H new ATOM 0 HA VAL A1009 -3.722 12.797 5.797 1.00 0.00 H new ATOM 0 HB VAL A1009 -4.900 14.978 6.095 1.00 0.00 H new ATOM 0 HG11 VAL A1009 -3.072 16.089 7.331 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -3.140 14.335 7.630 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -1.903 15.005 6.539 1.00 0.00 H new ATOM 0 HG21 VAL A1009 -3.780 17.036 5.242 1.00 0.00 H new ATOM 0 HG22 VAL A1009 -2.683 16.014 4.283 1.00 0.00 H new ATOM 0 HG23 VAL A1009 -4.428 16.021 3.932 1.00 0.00 H new ATOM 1386 N ALA A1010 -6.134 13.631 4.509 1.00 0.00 N ATOM 1387 CA ALA A1010 -7.291 13.601 3.631 1.00 0.00 C ATOM 1388 C ALA A1010 -7.602 15.025 3.208 1.00 0.00 C ATOM 1389 O ALA A1010 -8.206 15.783 3.965 1.00 0.00 O ATOM 1390 CB ALA A1010 -8.500 12.977 4.312 1.00 0.00 C ATOM 0 H ALA A1010 -6.344 13.852 5.482 1.00 0.00 H new ATOM 0 HA ALA A1010 -7.063 12.984 2.762 1.00 0.00 H new ATOM 0 HB1 ALA A1010 -9.344 12.973 3.623 1.00 0.00 H new ATOM 0 HB2 ALA A1010 -8.265 11.953 4.604 1.00 0.00 H new ATOM 0 HB3 ALA A1010 -8.758 13.557 5.198 1.00 0.00 H new ATOM 1396 N ALA A1011 -7.136 15.404 2.031 1.00 0.00 N ATOM 1397 CA ALA A1011 -7.312 16.761 1.549 1.00 0.00 C ATOM 1398 C ALA A1011 -7.019 16.837 0.064 1.00 0.00 C ATOM 1399 O ALA A1011 -6.393 15.932 -0.505 1.00 0.00 O ATOM 1400 CB ALA A1011 -6.397 17.726 2.294 1.00 0.00 C ATOM 0 H ALA A1011 -6.632 14.790 1.391 1.00 0.00 H new ATOM 0 HA ALA A1011 -8.348 17.047 1.729 1.00 0.00 H new ATOM 0 HB1 ALA A1011 -6.548 18.737 1.914 1.00 0.00 H new ATOM 0 HB2 ALA A1011 -6.630 17.700 3.359 1.00 0.00 H new ATOM 0 HB3 ALA A1011 -5.358 17.433 2.142 1.00 0.00 H new ATOM 1406 N GLU A1012 -7.395 17.955 -0.529 1.00 0.00 N ATOM 1407 CA GLU A1012 -7.176 18.208 -1.923 1.00 0.00 C ATOM 1408 C GLU A1012 -6.963 19.694 -2.142 1.00 0.00 C ATOM 1409 O GLU A1012 -7.882 20.502 -2.063 1.00 0.00 O ATOM 1410 CB GLU A1012 -8.305 17.667 -2.792 1.00 0.00 C ATOM 1411 CG GLU A1012 -8.112 17.950 -4.273 1.00 0.00 C ATOM 1412 CD GLU A1012 -6.719 17.622 -4.782 1.00 0.00 C ATOM 1413 OE1 GLU A1012 -6.393 16.438 -4.990 1.00 0.00 O ATOM 1414 OE2 GLU A1012 -5.919 18.563 -4.944 1.00 0.00 O ATOM 0 H GLU A1012 -7.866 18.717 -0.041 1.00 0.00 H new ATOM 0 HA GLU A1012 -6.277 17.673 -2.231 1.00 0.00 H new ATOM 0 HB2 GLU A1012 -8.385 16.590 -2.642 1.00 0.00 H new ATOM 0 HB3 GLU A1012 -9.248 18.106 -2.465 1.00 0.00 H new ATOM 0 HG2 GLU A1012 -8.842 17.374 -4.842 1.00 0.00 H new ATOM 0 HG3 GLU A1012 -8.320 19.003 -4.462 1.00 0.00 H new ATOM 1421 N LYS A1013 -5.707 20.028 -2.291 1.00 0.00 N ATOM 1422 CA LYS A1013 -5.266 21.362 -2.615 1.00 0.00 C ATOM 1423 C LYS A1013 -4.562 21.292 -3.941 1.00 0.00 C ATOM 1424 O LYS A1013 -3.749 20.399 -4.124 1.00 0.00 O ATOM 1425 CB LYS A1013 -4.289 21.878 -1.564 1.00 0.00 C ATOM 1426 CG LYS A1013 -4.934 22.300 -0.267 1.00 0.00 C ATOM 1427 CD LYS A1013 -3.880 22.699 0.745 1.00 0.00 C ATOM 1428 CE LYS A1013 -4.487 23.417 1.942 1.00 0.00 C ATOM 1429 NZ LYS A1013 -3.459 23.795 2.942 1.00 0.00 N ATOM 0 H LYS A1013 -4.941 19.362 -2.188 1.00 0.00 H new ATOM 0 HA LYS A1013 -6.122 22.037 -2.649 1.00 0.00 H new ATOM 0 HB2 LYS A1013 -3.555 21.100 -1.354 1.00 0.00 H new ATOM 0 HB3 LYS A1013 -3.744 22.727 -1.978 1.00 0.00 H new ATOM 0 HG2 LYS A1013 -5.610 23.136 -0.446 1.00 0.00 H new ATOM 0 HG3 LYS A1013 -5.536 21.482 0.129 1.00 0.00 H new ATOM 0 HD2 LYS A1013 -3.349 21.810 1.086 1.00 0.00 H new ATOM 0 HD3 LYS A1013 -3.145 23.347 0.268 1.00 0.00 H new ATOM 0 HE2 LYS A1013 -5.009 24.312 1.602 1.00 0.00 H new ATOM 0 HE3 LYS A1013 -5.231 22.774 2.412 1.00 0.00 H new ATOM 0 HZ1 LYS A1013 -3.914 24.281 3.741 1.00 0.00 H new ATOM 0 HZ2 LYS A1013 -2.978 22.939 3.286 1.00 0.00 H new ATOM 0 HZ3 LYS A1013 -2.763 24.430 2.501 1.00 0.00 H new ATOM 1443 N MET A1014 -4.847 22.237 -4.812 1.00 0.00 N ATOM 1444 CA MET A1014 -4.314 22.320 -6.185 1.00 0.00 C ATOM 1445 C MET A1014 -2.816 22.062 -6.327 1.00 0.00 C ATOM 1446 O MET A1014 -2.365 21.640 -7.385 1.00 0.00 O ATOM 1447 CB MET A1014 -4.662 23.678 -6.745 1.00 0.00 C ATOM 1448 CG MET A1014 -4.151 23.947 -8.152 1.00 0.00 C ATOM 1449 SD MET A1014 -4.631 25.571 -8.775 1.00 0.00 S ATOM 1450 CE MET A1014 -3.855 26.653 -7.569 1.00 0.00 C ATOM 0 H MET A1014 -5.480 23.005 -4.589 1.00 0.00 H new ATOM 0 HA MET A1014 -4.781 21.510 -6.745 1.00 0.00 H new ATOM 0 HB2 MET A1014 -5.746 23.788 -6.742 1.00 0.00 H new ATOM 0 HB3 MET A1014 -4.262 24.442 -6.078 1.00 0.00 H new ATOM 0 HG2 MET A1014 -3.064 23.867 -8.160 1.00 0.00 H new ATOM 0 HG3 MET A1014 -4.532 23.178 -8.825 1.00 0.00 H new ATOM 0 HE1 MET A1014 -3.784 27.661 -7.977 1.00 0.00 H new ATOM 0 HE2 MET A1014 -4.454 26.671 -6.658 1.00 0.00 H new ATOM 0 HE3 MET A1014 -2.856 26.284 -7.339 1.00 0.00 H new ATOM 1460 N TYR A1015 -2.061 22.246 -5.260 1.00 0.00 N ATOM 1461 CA TYR A1015 -0.626 21.981 -5.297 1.00 0.00 C ATOM 1462 C TYR A1015 -0.373 20.477 -5.452 1.00 0.00 C ATOM 1463 O TYR A1015 0.763 20.047 -5.623 1.00 0.00 O ATOM 1464 CB TYR A1015 0.063 22.495 -4.035 1.00 0.00 C ATOM 1465 CG TYR A1015 -0.074 23.981 -3.823 1.00 0.00 C ATOM 1466 CD1 TYR A1015 0.820 24.866 -4.404 1.00 0.00 C ATOM 1467 CD2 TYR A1015 -1.097 24.495 -3.039 1.00 0.00 C ATOM 1468 CE1 TYR A1015 0.700 26.227 -4.212 1.00 0.00 C ATOM 1469 CE2 TYR A1015 -1.227 25.851 -2.841 1.00 0.00 C ATOM 1470 CZ TYR A1015 -0.324 26.714 -3.429 1.00 0.00 C ATOM 1471 OH TYR A1015 -0.453 28.072 -3.243 1.00 0.00 O ATOM 0 H TYR A1015 -2.410 22.576 -4.360 1.00 0.00 H new ATOM 0 HA TYR A1015 -0.207 22.509 -6.154 1.00 0.00 H new ATOM 0 HB2 TYR A1015 -0.351 21.976 -3.171 1.00 0.00 H new ATOM 0 HB3 TYR A1015 1.122 22.241 -4.083 1.00 0.00 H new ATOM 0 HD1 TYR A1015 1.623 24.484 -5.017 1.00 0.00 H new ATOM 0 HD2 TYR A1015 -1.802 23.820 -2.577 1.00 0.00 H new ATOM 0 HE1 TYR A1015 1.403 26.905 -4.672 1.00 0.00 H new ATOM 0 HE2 TYR A1015 -2.030 26.237 -2.230 1.00 0.00 H new ATOM 0 HH TYR A1015 -1.225 28.251 -2.667 1.00 0.00 H new ATOM 1481 N HIS A1016 -1.451 19.693 -5.334 1.00 0.00 N ATOM 1482 CA HIS A1016 -1.424 18.250 -5.512 1.00 0.00 C ATOM 1483 C HIS A1016 -0.748 17.841 -6.799 1.00 0.00 C ATOM 1484 O HIS A1016 -1.282 18.031 -7.882 1.00 0.00 O ATOM 1485 CB HIS A1016 -2.835 17.704 -5.480 1.00 0.00 C ATOM 1486 CG HIS A1016 -3.248 17.164 -4.172 1.00 0.00 C ATOM 1487 ND1 HIS A1016 -3.656 17.943 -3.148 1.00 0.00 N ATOM 1488 CD2 HIS A1016 -3.354 15.903 -3.758 1.00 0.00 C ATOM 1489 CE1 HIS A1016 -4.002 17.190 -2.138 1.00 0.00 C ATOM 1490 NE2 HIS A1016 -3.840 15.925 -2.474 1.00 0.00 N ATOM 0 H HIS A1016 -2.377 20.056 -5.109 1.00 0.00 H new ATOM 0 HA HIS A1016 -0.841 17.832 -4.691 1.00 0.00 H new ATOM 0 HB2 HIS A1016 -3.525 18.497 -5.767 1.00 0.00 H new ATOM 0 HB3 HIS A1016 -2.925 16.917 -6.229 1.00 0.00 H new ATOM 0 HD1 HIS A1016 -3.689 18.962 -3.161 1.00 0.00 H new ATOM 0 HD2 HIS A1016 -3.103 15.022 -4.329 1.00 0.00 H new ATOM 0 HE1 HIS A1016 -4.362 17.545 -1.184 1.00 0.00 H new ATOM 1499 N THR A1017 0.430 17.299 -6.645 1.00 0.00 N ATOM 1500 CA THR A1017 1.230 16.828 -7.746 1.00 0.00 C ATOM 1501 C THR A1017 1.141 15.304 -7.802 1.00 0.00 C ATOM 1502 O THR A1017 1.314 14.686 -8.845 1.00 0.00 O ATOM 1503 CB THR A1017 2.686 17.233 -7.480 1.00 0.00 C ATOM 1504 OG1 THR A1017 2.714 18.545 -6.900 1.00 0.00 O ATOM 1505 CG2 THR A1017 3.511 17.240 -8.748 1.00 0.00 C ATOM 0 H THR A1017 0.870 17.169 -5.734 1.00 0.00 H new ATOM 0 HA THR A1017 0.880 17.253 -8.687 1.00 0.00 H new ATOM 0 HB THR A1017 3.116 16.499 -6.799 1.00 0.00 H new ATOM 0 HG1 THR A1017 3.595 18.949 -7.046 1.00 0.00 H new ATOM 0 HG21 THR A1017 4.535 17.532 -8.514 1.00 0.00 H new ATOM 0 HG22 THR A1017 3.510 16.243 -9.188 1.00 0.00 H new ATOM 0 HG23 THR A1017 3.084 17.950 -9.456 1.00 0.00 H new ATOM 1513 N HIS A1018 0.776 14.718 -6.665 1.00 0.00 N ATOM 1514 CA HIS A1018 0.801 13.257 -6.479 1.00 0.00 C ATOM 1515 C HIS A1018 -0.340 12.757 -5.577 1.00 0.00 C ATOM 1516 O HIS A1018 -0.525 13.220 -4.460 1.00 0.00 O ATOM 1517 CB HIS A1018 2.154 12.805 -5.880 1.00 0.00 C ATOM 1518 CG HIS A1018 3.235 12.454 -6.870 1.00 0.00 C ATOM 1519 ND1 HIS A1018 4.085 11.374 -6.704 1.00 0.00 N ATOM 1520 CD2 HIS A1018 3.648 13.070 -8.004 1.00 0.00 C ATOM 1521 CE1 HIS A1018 4.963 11.356 -7.688 1.00 0.00 C ATOM 1522 NE2 HIS A1018 4.719 12.369 -8.486 1.00 0.00 N ATOM 0 H HIS A1018 0.455 15.234 -5.846 1.00 0.00 H new ATOM 0 HA HIS A1018 0.666 12.820 -7.468 1.00 0.00 H new ATOM 0 HB2 HIS A1018 2.526 13.600 -5.234 1.00 0.00 H new ATOM 0 HB3 HIS A1018 1.975 11.937 -5.246 1.00 0.00 H new ATOM 0 HD2 HIS A1018 3.211 13.953 -8.446 1.00 0.00 H new ATOM 0 HE1 HIS A1018 5.751 10.629 -7.816 1.00 0.00 H new ATOM 0 HE2 HIS A1018 5.244 12.597 -9.330 1.00 0.00 H new ATOM 1531 N ARG A1019 -1.131 11.851 -6.103 1.00 0.00 N ATOM 1532 CA ARG A1019 -2.123 11.126 -5.317 1.00 0.00 C ATOM 1533 C ARG A1019 -1.539 9.781 -5.008 1.00 0.00 C ATOM 1534 O ARG A1019 -0.961 9.179 -5.887 1.00 0.00 O ATOM 1535 CB ARG A1019 -3.441 10.902 -6.067 1.00 0.00 C ATOM 1536 CG ARG A1019 -4.436 12.041 -6.016 1.00 0.00 C ATOM 1537 CD ARG A1019 -4.924 12.317 -4.613 1.00 0.00 C ATOM 1538 NE ARG A1019 -5.915 13.394 -4.555 1.00 0.00 N ATOM 1539 CZ ARG A1019 -6.822 13.551 -3.585 1.00 0.00 C ATOM 1540 NH1 ARG A1019 -6.876 12.734 -2.546 1.00 0.00 N ATOM 1541 NH2 ARG A1019 -7.667 14.553 -3.639 1.00 0.00 N ATOM 0 H ARG A1019 -1.111 11.590 -7.089 1.00 0.00 H new ATOM 0 HA ARG A1019 -2.350 11.716 -4.429 1.00 0.00 H new ATOM 0 HB2 ARG A1019 -3.210 10.694 -7.112 1.00 0.00 H new ATOM 0 HB3 ARG A1019 -3.919 10.010 -5.662 1.00 0.00 H new ATOM 0 HG2 ARG A1019 -3.974 12.942 -6.421 1.00 0.00 H new ATOM 0 HG3 ARG A1019 -5.288 11.805 -6.654 1.00 0.00 H new ATOM 0 HD2 ARG A1019 -5.359 11.407 -4.200 1.00 0.00 H new ATOM 0 HD3 ARG A1019 -4.074 12.578 -3.983 1.00 0.00 H new ATOM 0 HE ARG A1019 -5.913 14.077 -5.313 1.00 0.00 H new ATOM 0 HH11 ARG A1019 -6.215 11.961 -2.470 1.00 0.00 H new ATOM 0 HH12 ARG A1019 -7.578 12.877 -1.820 1.00 0.00 H new ATOM 0 HH21 ARG A1019 -7.631 15.209 -4.419 1.00 0.00 H new ATOM 0 HH22 ARG A1019 -8.360 14.676 -2.901 1.00 0.00 H new ATOM 1555 N ARG A1020 -1.670 9.308 -3.798 1.00 0.00 N ATOM 1556 CA ARG A1020 -1.152 7.985 -3.468 1.00 0.00 C ATOM 1557 C ARG A1020 -2.157 7.334 -2.565 1.00 0.00 C ATOM 1558 O ARG A1020 -3.046 7.997 -2.114 1.00 0.00 O ATOM 1559 CB ARG A1020 0.225 8.105 -2.794 1.00 0.00 C ATOM 1560 CG ARG A1020 0.887 6.781 -2.466 1.00 0.00 C ATOM 1561 CD ARG A1020 2.164 6.968 -1.667 1.00 0.00 C ATOM 1562 NE ARG A1020 3.224 7.633 -2.424 1.00 0.00 N ATOM 1563 CZ ARG A1020 4.292 8.197 -1.861 1.00 0.00 C ATOM 1564 NH1 ARG A1020 4.431 8.204 -0.535 1.00 0.00 N ATOM 1565 NH2 ARG A1020 5.214 8.772 -2.618 1.00 0.00 N ATOM 0 H ARG A1020 -2.122 9.801 -3.027 1.00 0.00 H new ATOM 0 HA ARG A1020 -1.009 7.379 -4.363 1.00 0.00 H new ATOM 0 HB2 ARG A1020 0.886 8.674 -3.448 1.00 0.00 H new ATOM 0 HB3 ARG A1020 0.115 8.679 -1.874 1.00 0.00 H new ATOM 0 HG2 ARG A1020 0.193 6.159 -1.901 1.00 0.00 H new ATOM 0 HG3 ARG A1020 1.112 6.249 -3.390 1.00 0.00 H new ATOM 0 HD2 ARG A1020 1.944 7.552 -0.773 1.00 0.00 H new ATOM 0 HD3 ARG A1020 2.521 5.994 -1.332 1.00 0.00 H new ATOM 0 HE ARG A1020 3.141 7.667 -3.440 1.00 0.00 H new ATOM 0 HH11 ARG A1020 3.717 7.776 0.055 1.00 0.00 H new ATOM 0 HH12 ARG A1020 5.251 8.637 -0.110 1.00 0.00 H new ATOM 0 HH21 ARG A1020 5.107 8.783 -3.632 1.00 0.00 H new ATOM 0 HH22 ARG A1020 6.031 9.204 -2.187 1.00 0.00 H new ATOM 1579 N ARG A1021 -2.105 6.043 -2.422 1.00 0.00 N ATOM 1580 CA ARG A1021 -2.966 5.357 -1.484 1.00 0.00 C ATOM 1581 C ARG A1021 -2.395 4.017 -1.141 1.00 0.00 C ATOM 1582 O ARG A1021 -1.609 3.470 -1.906 1.00 0.00 O ATOM 1583 CB ARG A1021 -4.352 5.176 -2.072 1.00 0.00 C ATOM 1584 CG ARG A1021 -4.355 4.608 -3.474 1.00 0.00 C ATOM 1585 CD ARG A1021 -5.759 4.489 -3.953 1.00 0.00 C ATOM 1586 NE ARG A1021 -5.789 4.010 -5.313 1.00 0.00 N ATOM 1587 CZ ARG A1021 -6.789 3.293 -5.827 1.00 0.00 C ATOM 1588 NH1 ARG A1021 -7.802 2.906 -5.053 1.00 0.00 N ATOM 1589 NH2 ARG A1021 -6.789 2.994 -7.112 1.00 0.00 N ATOM 0 H ARG A1021 -1.474 5.434 -2.943 1.00 0.00 H new ATOM 0 HA ARG A1021 -3.036 5.962 -0.580 1.00 0.00 H new ATOM 0 HB2 ARG A1021 -4.928 4.517 -1.423 1.00 0.00 H new ATOM 0 HB3 ARG A1021 -4.861 6.140 -2.080 1.00 0.00 H new ATOM 0 HG2 ARG A1021 -3.784 5.254 -4.142 1.00 0.00 H new ATOM 0 HG3 ARG A1021 -3.871 3.631 -3.484 1.00 0.00 H new ATOM 0 HD2 ARG A1021 -6.313 3.807 -3.308 1.00 0.00 H new ATOM 0 HD3 ARG A1021 -6.254 5.458 -3.891 1.00 0.00 H new ATOM 0 HE ARG A1021 -4.998 4.233 -5.918 1.00 0.00 H new ATOM 0 HH11 ARG A1021 -7.814 3.158 -4.065 1.00 0.00 H new ATOM 0 HH12 ARG A1021 -8.566 2.358 -5.449 1.00 0.00 H new ATOM 0 HH21 ARG A1021 -6.025 3.311 -7.709 1.00 0.00 H new ATOM 0 HH22 ARG A1021 -7.552 2.446 -7.508 1.00 0.00 H new ATOM 1603 N ARG A1022 -2.818 3.481 -0.025 1.00 0.00 N ATOM 1604 CA ARG A1022 -2.406 2.185 0.396 1.00 0.00 C ATOM 1605 C ARG A1022 -3.368 1.139 -0.134 1.00 0.00 C ATOM 1606 O ARG A1022 -4.572 1.209 0.119 1.00 0.00 O ATOM 1607 CB ARG A1022 -2.394 2.129 1.911 1.00 0.00 C ATOM 1608 CG ARG A1022 -2.268 0.725 2.446 1.00 0.00 C ATOM 1609 CD ARG A1022 -2.441 0.707 3.939 1.00 0.00 C ATOM 1610 NE ARG A1022 -1.342 1.350 4.603 1.00 0.00 N ATOM 1611 CZ ARG A1022 -1.316 1.593 5.916 1.00 0.00 C ATOM 1612 NH1 ARG A1022 -2.446 1.601 6.627 1.00 0.00 N ATOM 1613 NH2 ARG A1022 -0.167 1.869 6.510 1.00 0.00 N ATOM 0 H ARG A1022 -3.463 3.943 0.616 1.00 0.00 H new ATOM 0 HA ARG A1022 -1.407 1.984 0.010 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -1.566 2.730 2.285 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -3.311 2.577 2.293 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -3.017 0.085 1.981 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -1.292 0.317 2.183 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -3.372 1.208 4.205 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -2.524 -0.323 4.285 1.00 0.00 H new ATOM 0 HE ARG A1022 -0.539 1.636 4.043 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -3.339 1.421 6.168 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -2.417 1.788 7.629 1.00 0.00 H new ATOM 0 HH21 ARG A1022 0.695 1.896 5.966 1.00 0.00 H new ATOM 0 HH22 ARG A1022 -0.143 2.055 7.513 1.00 0.00 H new ATOM 1627 N LEU A1023 -2.843 0.219 -0.899 1.00 0.00 N ATOM 1628 CA LEU A1023 -3.569 -0.964 -1.261 1.00 0.00 C ATOM 1629 C LEU A1023 -3.000 -2.047 -0.376 1.00 0.00 C ATOM 1630 O LEU A1023 -1.786 -2.206 -0.290 1.00 0.00 O ATOM 1631 CB LEU A1023 -3.397 -1.340 -2.735 1.00 0.00 C ATOM 1632 CG LEU A1023 -3.778 -0.270 -3.762 1.00 0.00 C ATOM 1633 CD1 LEU A1023 -3.633 -0.827 -5.162 1.00 0.00 C ATOM 1634 CD2 LEU A1023 -5.200 0.226 -3.543 1.00 0.00 C ATOM 0 H LEU A1023 -1.901 0.271 -1.287 1.00 0.00 H new ATOM 0 HA LEU A1023 -4.640 -0.815 -1.127 1.00 0.00 H new ATOM 0 HB2 LEU A1023 -2.354 -1.613 -2.898 1.00 0.00 H new ATOM 0 HB3 LEU A1023 -3.995 -2.230 -2.932 1.00 0.00 H new ATOM 0 HG LEU A1023 -3.104 0.577 -3.636 1.00 0.00 H new ATOM 0 HD11 LEU A1023 -3.905 -0.061 -5.888 1.00 0.00 H new ATOM 0 HD12 LEU A1023 -2.600 -1.132 -5.327 1.00 0.00 H new ATOM 0 HD13 LEU A1023 -4.289 -1.689 -5.280 1.00 0.00 H new ATOM 0 HD21 LEU A1023 -5.440 0.985 -4.288 1.00 0.00 H new ATOM 0 HD22 LEU A1023 -5.895 -0.608 -3.638 1.00 0.00 H new ATOM 0 HD23 LEU A1023 -5.285 0.657 -2.546 1.00 0.00 H new ATOM 1646 N VAL A1024 -3.849 -2.730 0.319 1.00 0.00 N ATOM 1647 CA VAL A1024 -3.430 -3.722 1.271 1.00 0.00 C ATOM 1648 C VAL A1024 -3.762 -5.104 0.810 1.00 0.00 C ATOM 1649 O VAL A1024 -4.717 -5.333 0.061 1.00 0.00 O ATOM 1650 CB VAL A1024 -4.059 -3.557 2.678 1.00 0.00 C ATOM 1651 CG1 VAL A1024 -3.457 -2.397 3.422 1.00 0.00 C ATOM 1652 CG2 VAL A1024 -5.573 -3.400 2.600 1.00 0.00 C ATOM 0 H VAL A1024 -4.860 -2.620 0.247 1.00 0.00 H new ATOM 0 HA VAL A1024 -2.353 -3.572 1.345 1.00 0.00 H new ATOM 0 HB VAL A1024 -3.836 -4.470 3.230 1.00 0.00 H new ATOM 0 HG11 VAL A1024 -3.923 -2.313 4.404 1.00 0.00 H new ATOM 0 HG12 VAL A1024 -2.386 -2.558 3.542 1.00 0.00 H new ATOM 0 HG13 VAL A1024 -3.625 -1.478 2.861 1.00 0.00 H new ATOM 0 HG21 VAL A1024 -5.979 -3.287 3.605 1.00 0.00 H new ATOM 0 HG22 VAL A1024 -5.817 -2.518 2.008 1.00 0.00 H new ATOM 0 HG23 VAL A1024 -6.007 -4.283 2.131 1.00 0.00 H new ATOM 1662 N ARG A1025 -2.951 -5.999 1.269 1.00 0.00 N ATOM 1663 CA ARG A1025 -3.229 -7.407 1.137 1.00 0.00 C ATOM 1664 C ARG A1025 -2.624 -8.136 2.302 1.00 0.00 C ATOM 1665 O ARG A1025 -1.411 -8.184 2.459 1.00 0.00 O ATOM 1666 CB ARG A1025 -2.770 -8.022 -0.189 1.00 0.00 C ATOM 1667 CG ARG A1025 -3.242 -9.461 -0.315 1.00 0.00 C ATOM 1668 CD ARG A1025 -3.937 -9.762 -1.631 1.00 0.00 C ATOM 1669 NE ARG A1025 -3.031 -10.062 -2.739 1.00 0.00 N ATOM 1670 CZ ARG A1025 -3.199 -11.116 -3.555 1.00 0.00 C ATOM 1671 NH1 ARG A1025 -4.180 -11.990 -3.323 1.00 0.00 N ATOM 1672 NH2 ARG A1025 -2.375 -11.317 -4.573 1.00 0.00 N ATOM 0 H ARG A1025 -2.076 -5.784 1.747 1.00 0.00 H new ATOM 0 HA ARG A1025 -4.314 -7.516 1.135 1.00 0.00 H new ATOM 0 HB2 ARG A1025 -3.159 -7.434 -1.020 1.00 0.00 H new ATOM 0 HB3 ARG A1025 -1.683 -7.985 -0.254 1.00 0.00 H new ATOM 0 HG2 ARG A1025 -2.385 -10.126 -0.206 1.00 0.00 H new ATOM 0 HG3 ARG A1025 -3.924 -9.683 0.505 1.00 0.00 H new ATOM 0 HD2 ARG A1025 -4.609 -10.609 -1.488 1.00 0.00 H new ATOM 0 HD3 ARG A1025 -4.555 -8.907 -1.905 1.00 0.00 H new ATOM 0 HE ARG A1025 -2.236 -9.443 -2.899 1.00 0.00 H new ATOM 0 HH11 ARG A1025 -4.803 -11.858 -2.526 1.00 0.00 H new ATOM 0 HH12 ARG A1025 -4.307 -12.790 -3.943 1.00 0.00 H new ATOM 0 HH21 ARG A1025 -1.606 -10.669 -4.742 1.00 0.00 H new ATOM 0 HH22 ARG A1025 -2.510 -12.120 -5.188 1.00 0.00 H new ATOM 1686 N LYS A1026 -3.481 -8.652 3.146 1.00 0.00 N ATOM 1687 CA LYS A1026 -3.063 -9.381 4.310 1.00 0.00 C ATOM 1688 C LYS A1026 -2.491 -10.703 3.815 1.00 0.00 C ATOM 1689 O LYS A1026 -3.066 -11.346 2.926 1.00 0.00 O ATOM 1690 CB LYS A1026 -4.283 -9.555 5.232 1.00 0.00 C ATOM 1691 CG LYS A1026 -3.995 -9.716 6.722 1.00 0.00 C ATOM 1692 CD LYS A1026 -3.407 -11.061 7.095 1.00 0.00 C ATOM 1693 CE LYS A1026 -4.364 -12.215 6.810 1.00 0.00 C ATOM 1694 NZ LYS A1026 -5.673 -12.069 7.494 1.00 0.00 N ATOM 0 H LYS A1026 -4.493 -8.576 3.042 1.00 0.00 H new ATOM 0 HA LYS A1026 -2.296 -8.869 4.891 1.00 0.00 H new ATOM 0 HB2 LYS A1026 -4.934 -8.691 5.102 1.00 0.00 H new ATOM 0 HB3 LYS A1026 -4.842 -10.429 4.897 1.00 0.00 H new ATOM 0 HG2 LYS A1026 -3.307 -8.931 7.035 1.00 0.00 H new ATOM 0 HG3 LYS A1026 -4.921 -9.569 7.278 1.00 0.00 H new ATOM 0 HD2 LYS A1026 -2.481 -11.216 6.541 1.00 0.00 H new ATOM 0 HD3 LYS A1026 -3.149 -11.060 8.154 1.00 0.00 H new ATOM 0 HE2 LYS A1026 -4.529 -12.285 5.735 1.00 0.00 H new ATOM 0 HE3 LYS A1026 -3.900 -13.150 7.123 1.00 0.00 H new ATOM 0 HZ1 LYS A1026 -6.177 -12.978 7.476 1.00 0.00 H new ATOM 0 HZ2 LYS A1026 -5.519 -11.778 8.480 1.00 0.00 H new ATOM 0 HZ3 LYS A1026 -6.242 -11.348 7.005 1.00 0.00 H new ATOM 1708 N ARG A1027 -1.390 -11.132 4.391 1.00 0.00 N ATOM 1709 CA ARG A1027 -0.710 -12.301 3.903 1.00 0.00 C ATOM 1710 C ARG A1027 -0.674 -13.216 5.077 1.00 0.00 C ATOM 1711 O ARG A1027 -0.707 -12.751 6.203 1.00 0.00 O ATOM 1712 CB ARG A1027 0.695 -11.996 3.327 1.00 0.00 C ATOM 1713 CG ARG A1027 1.688 -11.379 4.291 1.00 0.00 C ATOM 1714 CD ARG A1027 2.876 -10.753 3.569 1.00 0.00 C ATOM 1715 NE ARG A1027 3.759 -11.700 2.884 1.00 0.00 N ATOM 1716 CZ ARG A1027 4.883 -11.313 2.262 1.00 0.00 C ATOM 1717 NH1 ARG A1027 5.097 -10.033 2.006 1.00 0.00 N ATOM 1718 NH2 ARG A1027 5.788 -12.195 1.869 1.00 0.00 N ATOM 0 H ARG A1027 -0.950 -10.687 5.196 1.00 0.00 H new ATOM 0 HA ARG A1027 -1.226 -12.746 3.052 1.00 0.00 H new ATOM 0 HB2 ARG A1027 1.119 -12.925 2.945 1.00 0.00 H new ATOM 0 HB3 ARG A1027 0.579 -11.325 2.476 1.00 0.00 H new ATOM 0 HG2 ARG A1027 1.187 -10.619 4.890 1.00 0.00 H new ATOM 0 HG3 ARG A1027 2.046 -12.143 4.981 1.00 0.00 H new ATOM 0 HD2 ARG A1027 2.500 -10.037 2.838 1.00 0.00 H new ATOM 0 HD3 ARG A1027 3.465 -10.190 4.293 1.00 0.00 H new ATOM 0 HE ARG A1027 3.510 -12.689 2.880 1.00 0.00 H new ATOM 0 HH11 ARG A1027 4.406 -9.335 2.282 1.00 0.00 H new ATOM 0 HH12 ARG A1027 5.953 -9.744 1.533 1.00 0.00 H new ATOM 0 HH21 ARG A1027 5.638 -13.190 2.037 1.00 0.00 H new ATOM 0 HH22 ARG A1027 6.636 -11.880 1.398 1.00 0.00 H new ATOM 1732 N LYS A1028 -0.665 -14.476 4.836 1.00 0.00 N ATOM 1733 CA LYS A1028 -0.888 -15.444 5.859 1.00 0.00 C ATOM 1734 C LYS A1028 -0.043 -16.678 5.612 1.00 0.00 C ATOM 1735 O LYS A1028 -0.081 -17.237 4.564 1.00 0.00 O ATOM 1736 CB LYS A1028 -2.350 -15.801 5.760 1.00 0.00 C ATOM 1737 CG LYS A1028 -2.836 -16.805 6.753 1.00 0.00 C ATOM 1738 CD LYS A1028 -4.180 -17.286 6.314 1.00 0.00 C ATOM 1739 CE LYS A1028 -4.867 -18.033 7.409 1.00 0.00 C ATOM 1740 NZ LYS A1028 -6.108 -18.689 6.915 1.00 0.00 N ATOM 0 H LYS A1028 -0.501 -14.875 3.912 1.00 0.00 H new ATOM 0 HA LYS A1028 -0.622 -15.057 6.843 1.00 0.00 H new ATOM 0 HB2 LYS A1028 -2.937 -14.890 5.874 1.00 0.00 H new ATOM 0 HB3 LYS A1028 -2.546 -16.183 4.758 1.00 0.00 H new ATOM 0 HG2 LYS A1028 -2.138 -17.639 6.822 1.00 0.00 H new ATOM 0 HG3 LYS A1028 -2.898 -16.358 7.745 1.00 0.00 H new ATOM 0 HD2 LYS A1028 -4.792 -16.437 6.009 1.00 0.00 H new ATOM 0 HD3 LYS A1028 -4.072 -17.931 5.442 1.00 0.00 H new ATOM 0 HE2 LYS A1028 -4.193 -18.785 7.818 1.00 0.00 H new ATOM 0 HE3 LYS A1028 -5.112 -17.349 8.221 1.00 0.00 H new ATOM 0 HZ1 LYS A1028 -6.547 -19.229 7.688 1.00 0.00 H new ATOM 0 HZ2 LYS A1028 -6.773 -17.964 6.578 1.00 0.00 H new ATOM 0 HZ3 LYS A1028 -5.873 -19.333 6.133 1.00 0.00 H new ATOM 1754 N LYS A1029 0.631 -17.142 6.615 1.00 0.00 N ATOM 1755 CA LYS A1029 1.477 -18.344 6.486 1.00 0.00 C ATOM 1756 C LYS A1029 0.623 -19.549 6.778 1.00 0.00 C ATOM 1757 O LYS A1029 0.876 -20.680 6.367 1.00 0.00 O ATOM 1758 CB LYS A1029 2.565 -18.326 7.545 1.00 0.00 C ATOM 1759 CG LYS A1029 3.687 -17.367 7.261 1.00 0.00 C ATOM 1760 CD LYS A1029 4.647 -17.228 8.419 1.00 0.00 C ATOM 1761 CE LYS A1029 5.174 -18.561 8.871 1.00 0.00 C ATOM 1762 NZ LYS A1029 5.848 -19.311 7.783 1.00 0.00 N ATOM 0 H LYS A1029 0.629 -16.724 7.546 1.00 0.00 H new ATOM 0 HA LYS A1029 1.910 -18.371 5.486 1.00 0.00 H new ATOM 0 HB2 LYS A1029 2.117 -18.069 8.505 1.00 0.00 H new ATOM 0 HB3 LYS A1029 2.977 -19.330 7.644 1.00 0.00 H new ATOM 0 HG2 LYS A1029 4.234 -17.705 6.381 1.00 0.00 H new ATOM 0 HG3 LYS A1029 3.270 -16.389 7.021 1.00 0.00 H new ATOM 0 HD2 LYS A1029 5.480 -16.589 8.126 1.00 0.00 H new ATOM 0 HD3 LYS A1029 4.144 -16.735 9.251 1.00 0.00 H new ATOM 0 HE2 LYS A1029 5.876 -18.410 9.691 1.00 0.00 H new ATOM 0 HE3 LYS A1029 4.351 -19.159 9.262 1.00 0.00 H new ATOM 0 HZ1 LYS A1029 6.236 -20.198 8.162 1.00 0.00 H new ATOM 0 HZ2 LYS A1029 5.161 -19.526 7.032 1.00 0.00 H new ATOM 0 HZ3 LYS A1029 6.620 -18.735 7.391 1.00 0.00 H new ATOM 1776 N ASP A1030 -0.402 -19.225 7.534 1.00 0.00 N ATOM 1777 CA ASP A1030 -1.318 -20.142 8.223 1.00 0.00 C ATOM 1778 C ASP A1030 -0.579 -21.215 9.047 1.00 0.00 C ATOM 1779 O ASP A1030 -1.178 -22.161 9.553 1.00 0.00 O ATOM 1780 CB ASP A1030 -2.318 -20.762 7.251 1.00 0.00 C ATOM 1781 CG ASP A1030 -3.540 -21.303 7.968 1.00 0.00 C ATOM 1782 OD1 ASP A1030 -3.795 -20.899 9.129 1.00 0.00 O ATOM 1783 OD2 ASP A1030 -4.314 -22.065 7.357 1.00 0.00 O ATOM 0 H ASP A1030 -0.645 -18.249 7.703 1.00 0.00 H new ATOM 0 HA ASP A1030 -1.880 -19.543 8.940 1.00 0.00 H new ATOM 0 HB2 ASP A1030 -2.627 -20.014 6.521 1.00 0.00 H new ATOM 0 HB3 ASP A1030 -1.835 -21.567 6.698 1.00 0.00 H new ATOM 1788 N LEU A1031 0.735 -21.020 9.182 1.00 0.00 N ATOM 1789 CA LEU A1031 1.662 -21.880 9.918 1.00 0.00 C ATOM 1790 C LEU A1031 1.687 -23.306 9.346 1.00 0.00 C ATOM 1791 O LEU A1031 2.261 -24.219 9.938 1.00 0.00 O ATOM 1792 CB LEU A1031 1.263 -21.924 11.378 1.00 0.00 C ATOM 1793 CG LEU A1031 2.298 -22.494 12.350 1.00 0.00 C ATOM 1794 CD1 LEU A1031 3.566 -21.653 12.349 1.00 0.00 C ATOM 1795 CD2 LEU A1031 1.713 -22.588 13.747 1.00 0.00 C ATOM 0 H LEU A1031 1.203 -20.218 8.760 1.00 0.00 H new ATOM 0 HA LEU A1031 2.663 -21.460 9.817 1.00 0.00 H new ATOM 0 HB2 LEU A1031 1.018 -20.911 11.696 1.00 0.00 H new ATOM 0 HB3 LEU A1031 0.351 -22.515 11.465 1.00 0.00 H new ATOM 0 HG LEU A1031 2.564 -23.498 12.019 1.00 0.00 H new ATOM 0 HD11 LEU A1031 4.286 -22.079 13.048 1.00 0.00 H new ATOM 0 HD12 LEU A1031 3.995 -21.643 11.347 1.00 0.00 H new ATOM 0 HD13 LEU A1031 3.327 -20.633 12.651 1.00 0.00 H new ATOM 0 HD21 LEU A1031 2.461 -22.995 14.428 1.00 0.00 H new ATOM 0 HD22 LEU A1031 1.417 -21.595 14.085 1.00 0.00 H new ATOM 0 HD23 LEU A1031 0.841 -23.242 13.733 1.00 0.00 H new ATOM 1807 N THR A1032 1.131 -23.485 8.165 1.00 0.00 N ATOM 1808 CA THR A1032 1.000 -24.803 7.602 1.00 0.00 C ATOM 1809 C THR A1032 1.636 -24.795 6.235 1.00 0.00 C ATOM 1810 O THR A1032 1.566 -25.769 5.483 1.00 0.00 O ATOM 1811 CB THR A1032 -0.496 -25.214 7.514 1.00 0.00 C ATOM 1812 OG1 THR A1032 -0.643 -26.583 7.095 1.00 0.00 O ATOM 1813 CG2 THR A1032 -1.276 -24.311 6.562 1.00 0.00 C ATOM 0 H THR A1032 0.765 -22.733 7.582 1.00 0.00 H new ATOM 0 HA THR A1032 1.500 -25.533 8.238 1.00 0.00 H new ATOM 0 HB THR A1032 -0.905 -25.103 8.518 1.00 0.00 H new ATOM 0 HG1 THR A1032 -0.010 -26.774 6.372 1.00 0.00 H new ATOM 0 HG21 THR A1032 -2.317 -24.631 6.528 1.00 0.00 H new ATOM 0 HG22 THR A1032 -1.224 -23.281 6.914 1.00 0.00 H new ATOM 0 HG23 THR A1032 -0.844 -24.376 5.563 1.00 0.00 H new ATOM 1821 N GLN A1033 2.274 -23.686 5.932 1.00 0.00 N ATOM 1822 CA GLN A1033 2.879 -23.536 4.628 1.00 0.00 C ATOM 1823 C GLN A1033 4.395 -23.508 4.760 1.00 0.00 C ATOM 1824 O GLN A1033 4.921 -22.897 5.692 1.00 0.00 O ATOM 1825 CB GLN A1033 2.337 -22.300 3.914 1.00 0.00 C ATOM 1826 CG GLN A1033 2.319 -22.498 2.417 1.00 0.00 C ATOM 1827 CD GLN A1033 1.654 -21.375 1.649 1.00 0.00 C ATOM 1828 OE1 GLN A1033 0.450 -21.401 1.425 1.00 0.00 O ATOM 1829 NE2 GLN A1033 2.437 -20.439 1.163 1.00 0.00 N ATOM 0 H GLN A1033 2.386 -22.889 6.558 1.00 0.00 H new ATOM 0 HA GLN A1033 2.615 -24.394 4.010 1.00 0.00 H new ATOM 0 HB2 GLN A1033 1.328 -22.086 4.267 1.00 0.00 H new ATOM 0 HB3 GLN A1033 2.952 -21.435 4.162 1.00 0.00 H new ATOM 0 HG2 GLN A1033 3.345 -22.607 2.064 1.00 0.00 H new ATOM 0 HG3 GLN A1033 1.804 -23.432 2.192 1.00 0.00 H new ATOM 0 HE21 GLN A1033 3.435 -20.450 1.371 1.00 0.00 H new ATOM 0 HE22 GLN A1033 2.047 -19.701 0.577 1.00 0.00 H new ATOM 1838 N THR A1034 5.054 -24.201 3.846 1.00 0.00 N ATOM 1839 CA THR A1034 6.496 -24.434 3.850 1.00 0.00 C ATOM 1840 C THR A1034 7.373 -23.184 4.033 1.00 0.00 C ATOM 1841 O THR A1034 7.680 -22.434 3.103 1.00 0.00 O ATOM 1842 CB THR A1034 6.930 -25.235 2.589 1.00 0.00 C ATOM 1843 OG1 THR A1034 8.355 -25.432 2.545 1.00 0.00 O ATOM 1844 CG2 THR A1034 6.468 -24.558 1.306 1.00 0.00 C ATOM 0 H THR A1034 4.586 -24.634 3.050 1.00 0.00 H new ATOM 0 HA THR A1034 6.674 -25.026 4.748 1.00 0.00 H new ATOM 0 HB THR A1034 6.447 -26.209 2.663 1.00 0.00 H new ATOM 0 HG1 THR A1034 8.590 -25.940 1.740 1.00 0.00 H new ATOM 0 HG21 THR A1034 6.790 -25.147 0.447 1.00 0.00 H new ATOM 0 HG22 THR A1034 5.381 -24.481 1.306 1.00 0.00 H new ATOM 0 HG23 THR A1034 6.902 -23.560 1.245 1.00 0.00 H new ATOM 1852 N ALA A1035 7.755 -22.956 5.266 1.00 0.00 N ATOM 1853 CA ALA A1035 8.750 -21.962 5.579 1.00 0.00 C ATOM 1854 C ALA A1035 10.047 -22.709 5.781 1.00 0.00 C ATOM 1855 O ALA A1035 11.123 -22.280 5.360 1.00 0.00 O ATOM 1856 CB ALA A1035 8.381 -21.185 6.826 1.00 0.00 C ATOM 0 H ALA A1035 7.386 -23.452 6.077 1.00 0.00 H new ATOM 0 HA ALA A1035 8.832 -21.231 4.774 1.00 0.00 H new ATOM 0 HB1 ALA A1035 9.152 -20.443 7.034 1.00 0.00 H new ATOM 0 HB2 ALA A1035 7.426 -20.682 6.672 1.00 0.00 H new ATOM 0 HB3 ALA A1035 8.299 -21.870 7.670 1.00 0.00 H new ATOM 1862 N SER A1036 9.913 -23.868 6.393 1.00 0.00 N ATOM 1863 CA SER A1036 11.020 -24.750 6.626 1.00 0.00 C ATOM 1864 C SER A1036 11.046 -25.805 5.527 1.00 0.00 C ATOM 1865 O SER A1036 10.441 -26.875 5.642 1.00 0.00 O ATOM 1866 CB SER A1036 10.886 -25.386 8.008 1.00 0.00 C ATOM 1867 OG SER A1036 10.704 -24.379 8.993 1.00 0.00 O ATOM 0 H SER A1036 9.022 -24.220 6.743 1.00 0.00 H new ATOM 0 HA SER A1036 11.960 -24.199 6.602 1.00 0.00 H new ATOM 0 HB2 SER A1036 10.041 -26.074 8.020 1.00 0.00 H new ATOM 0 HB3 SER A1036 11.777 -25.971 8.235 1.00 0.00 H new ATOM 0 HG SER A1036 10.617 -24.796 9.875 1.00 0.00 H new ATOM 1873 N SER A1037 11.668 -25.449 4.418 1.00 0.00 N ATOM 1874 CA SER A1037 11.804 -26.356 3.297 1.00 0.00 C ATOM 1875 C SER A1037 12.947 -27.331 3.572 1.00 0.00 C ATOM 1876 O SER A1037 13.111 -28.336 2.884 1.00 0.00 O ATOM 1877 CB SER A1037 12.059 -25.547 2.030 1.00 0.00 C ATOM 1878 OG SER A1037 11.074 -24.527 1.886 1.00 0.00 O ATOM 0 H SER A1037 12.089 -24.532 4.271 1.00 0.00 H new ATOM 0 HA SER A1037 10.889 -26.933 3.160 1.00 0.00 H new ATOM 0 HB2 SER A1037 13.052 -25.099 2.070 1.00 0.00 H new ATOM 0 HB3 SER A1037 12.041 -26.205 1.161 1.00 0.00 H new ATOM 0 HG SER A1037 10.191 -24.892 2.102 1.00 0.00 H new ATOM 1884 N THR A1038 13.718 -27.004 4.598 1.00 0.00 N ATOM 1885 CA THR A1038 14.818 -27.818 5.063 1.00 0.00 C ATOM 1886 C THR A1038 14.302 -29.187 5.510 1.00 0.00 C ATOM 1887 O THR A1038 13.348 -29.276 6.294 1.00 0.00 O ATOM 1888 CB THR A1038 15.491 -27.111 6.248 1.00 0.00 C ATOM 1889 OG1 THR A1038 15.789 -25.754 5.883 1.00 0.00 O ATOM 1890 CG2 THR A1038 16.772 -27.817 6.660 1.00 0.00 C ATOM 0 H THR A1038 13.590 -26.148 5.137 1.00 0.00 H new ATOM 0 HA THR A1038 15.536 -27.958 4.255 1.00 0.00 H new ATOM 0 HB THR A1038 14.805 -27.133 7.094 1.00 0.00 H new ATOM 0 HG1 THR A1038 16.217 -25.299 6.638 1.00 0.00 H new ATOM 0 HG21 THR A1038 17.223 -27.291 7.501 1.00 0.00 H new ATOM 0 HG22 THR A1038 16.545 -28.842 6.953 1.00 0.00 H new ATOM 0 HG23 THR A1038 17.469 -27.825 5.822 1.00 0.00 H new ATOM 1898 N ALA A1039 14.912 -30.240 4.993 1.00 0.00 N ATOM 1899 CA ALA A1039 14.498 -31.588 5.321 1.00 0.00 C ATOM 1900 C ALA A1039 14.963 -31.981 6.718 1.00 0.00 C ATOM 1901 O ALA A1039 16.061 -32.501 6.904 1.00 0.00 O ATOM 1902 CB ALA A1039 14.996 -32.584 4.283 1.00 0.00 C ATOM 0 H ALA A1039 15.697 -30.184 4.344 1.00 0.00 H new ATOM 0 HA ALA A1039 13.408 -31.610 5.311 1.00 0.00 H new ATOM 0 HB1 ALA A1039 14.670 -33.588 4.556 1.00 0.00 H new ATOM 0 HB2 ALA A1039 14.590 -32.324 3.305 1.00 0.00 H new ATOM 0 HB3 ALA A1039 16.085 -32.555 4.244 1.00 0.00 H new ATOM 1908 N ARG A1040 14.155 -31.636 7.695 1.00 0.00 N ATOM 1909 CA ARG A1040 14.388 -32.008 9.072 1.00 0.00 C ATOM 1910 C ARG A1040 13.118 -32.630 9.619 1.00 0.00 C ATOM 1911 O ARG A1040 12.996 -33.863 9.583 1.00 0.00 O ATOM 1912 CB ARG A1040 14.811 -30.814 9.937 1.00 0.00 C ATOM 1913 CG ARG A1040 16.188 -30.267 9.624 1.00 0.00 C ATOM 1914 CD ARG A1040 16.593 -29.194 10.619 1.00 0.00 C ATOM 1915 NE ARG A1040 17.970 -28.738 10.412 1.00 0.00 N ATOM 1916 CZ ARG A1040 18.772 -28.269 11.374 1.00 0.00 C ATOM 1917 NH1 ARG A1040 18.359 -28.228 12.639 1.00 0.00 N ATOM 1918 NH2 ARG A1040 19.987 -27.841 11.070 1.00 0.00 N ATOM 1919 OXT ARG A1040 12.202 -31.888 10.015 1.00 0.00 O ATOM 0 H ARG A1040 13.309 -31.084 7.554 1.00 0.00 H new ATOM 0 HA ARG A1040 15.212 -32.721 9.104 1.00 0.00 H new ATOM 0 HB2 ARG A1040 14.080 -30.015 9.813 1.00 0.00 H new ATOM 0 HB3 ARG A1040 14.782 -31.113 10.985 1.00 0.00 H new ATOM 0 HG2 ARG A1040 16.917 -31.077 9.643 1.00 0.00 H new ATOM 0 HG3 ARG A1040 16.197 -29.853 8.616 1.00 0.00 H new ATOM 0 HD2 ARG A1040 15.914 -28.346 10.532 1.00 0.00 H new ATOM 0 HD3 ARG A1040 16.489 -29.583 11.632 1.00 0.00 H new ATOM 0 HE ARG A1040 18.345 -28.781 9.464 1.00 0.00 H new ATOM 0 HH11 ARG A1040 17.424 -28.556 12.881 1.00 0.00 H new ATOM 0 HH12 ARG A1040 18.978 -27.869 13.366 1.00 0.00 H new ATOM 0 HH21 ARG A1040 20.311 -27.869 10.103 1.00 0.00 H new ATOM 0 HH22 ARG A1040 20.600 -27.483 11.803 1.00 0.00 H new TER 1933 ARG A1040