USER MOD reduce.3.24.130724 H: found=0, std=0, add=956, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 957 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: A1000 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A1001 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 973 MET CE :methyl -124:sc= -0.243 (180deg=0) USER MOD Set 2.2: A 975 HIS : no HE2:sc= 0.296 K(o=1,f=-4.3!) USER MOD Set 2.3: A 989 SER OG : rot -160:sc= 0.997 USER MOD Set 3.1: A 927 SER OG : rot 35:sc= 0.864 USER MOD Set 3.2: A 944 THR OG1 : rot 2:sc= 0.922 USER MOD Single : A 901 HIS : no HD1:sc= -2.02 K(o=-2,f=-3.4!) USER MOD Single : A 903 GLN : amide:sc= -3.14! C(o=-3.1!,f=-3.1!) USER MOD Single : A 907 HIS :FLIP no HE2:sc= -0.0916 F(o=-1.8,f=-0.092) USER MOD Single : A 912 LYS NZ :NH3+ -163:sc= -1.77 (180deg=-2.07) USER MOD Single : A 914 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 915 THR OG1 : rot -170:sc= -2.02! USER MOD Single : A 916 GLN : amide:sc= -3.01! C(o=-3!,f=-2.7!) USER MOD Single : A 917 THR OG1 : rot 160:sc= -0.384 USER MOD Single : A 918 THR OG1 : rot 180:sc= 0 USER MOD Single : A 920 SER OG : rot -57:sc= 0.953 USER MOD Single : A 926 THR OG1 : rot -121:sc= -1.03 USER MOD Single : A 929 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 930 TYR OH : rot -112:sc= -2.99! USER MOD Single : A 936 TYR OH : rot 180:sc= 0 USER MOD Single : A 937 TYR OH : rot 180:sc= 0 USER MOD Single : A 942 SER OG : rot 180:sc= 0 USER MOD Single : A 948 ASN : amide:sc= -0.772 X(o=-0.77,f=-0.74) USER MOD Single : A 952 SER OG : rot -178:sc= -2.75! USER MOD Single : A 953 SER OG : rot 180:sc= 0 USER MOD Single : A 955 LYS NZ :NH3+ 148:sc= -3.77! (180deg=-6.29!) USER MOD Single : A 959 LYS NZ :NH3+ -167:sc= -0.0184 (180deg=-0.204) USER MOD Single : A 961 LYS NZ :NH3+ -142:sc= -0.0461 (180deg=-0.313) USER MOD Single : A 962 SER OG : rot 180:sc= 0 USER MOD Single : A 964 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 965 THR OG1 : rot 180:sc= -0.11 USER MOD Single : A 971 ASN :FLIP amide:sc= -0.739 F(o=-1.3,f=-0.74) USER MOD Single : A 978 THR OG1 : rot 180:sc= -0.292 USER MOD Single : A 981 GLN :FLIP amide:sc= -2.87! C(o=-6.5!,f=-2.9!) USER MOD Single : A 984 SER OG : rot -160:sc= -0.0385 USER MOD Single : A 987 THR OG1 : rot 180:sc=0.000611 USER MOD Single : A 988 TYR OH : rot 60:sc= -0.463 USER MOD Single : A 991 THR OG1 : rot -57:sc= 0.894 USER MOD Single : A 992 THR OG1 : rot -11:sc= 0.28 USER MOD Single : A 994 HIS : no HD1:sc= -2.67 K(o=-2.7,f=-6.7!) USER MOD Single : A 999 HIS :FLIP no HE2:sc= -0.496 F(o=-2.6,f=-0.5) USER MOD Single : A1007 SER OG : rot 180:sc= 0 USER MOD Single : A1009 ASN : amide:sc= -0.945 K(o=-0.94,f=-3!) USER MOD Single : A1010 THR OG1 : rot 180:sc= 0 USER MOD Single : A1012 HIS : no HE2:sc= -5.06! C(o=-5.1!,f=-9.8!) USER MOD Single : A1014 SER OG : rot 180:sc= 0 USER MOD Single : A1015 THR OG1 : rot -135:sc= -2.36! USER MOD Single : A1016 LYS NZ :NH3+ 164:sc= -0.0522 (180deg=-0.337) USER MOD Single : A1021 GLN : amide:sc= -1.2 K(o=-1.2,f=-3.6!) USER MOD ----------------------------------------------------------------- ATOM 43 N ALA A 900 37.510 -4.127 -3.584 1.00 0.00 N ATOM 44 CA ALA A 900 36.210 -4.708 -3.914 1.00 0.00 C ATOM 45 C ALA A 900 35.075 -3.722 -3.661 1.00 0.00 C ATOM 46 O ALA A 900 35.113 -2.946 -2.706 1.00 0.00 O ATOM 47 CB ALA A 900 35.979 -5.980 -3.118 1.00 0.00 C ATOM 0 HA ALA A 900 36.218 -4.948 -4.977 1.00 0.00 H new ATOM 0 HB1 ALA A 900 35.007 -6.399 -3.376 1.00 0.00 H new ATOM 0 HB2 ALA A 900 36.760 -6.703 -3.353 1.00 0.00 H new ATOM 0 HB3 ALA A 900 36.005 -5.752 -2.052 1.00 0.00 H new ATOM 53 N HIS A 901 34.065 -3.759 -4.525 1.00 0.00 N ATOM 54 CA HIS A 901 32.915 -2.871 -4.398 1.00 0.00 C ATOM 55 C HIS A 901 31.651 -3.538 -4.931 1.00 0.00 C ATOM 56 O HIS A 901 31.682 -4.220 -5.956 1.00 0.00 O ATOM 57 CB HIS A 901 33.163 -1.563 -5.153 1.00 0.00 C ATOM 58 CG HIS A 901 34.404 -0.844 -4.727 1.00 0.00 C ATOM 59 ND1 HIS A 901 35.673 -1.263 -5.067 1.00 0.00 N ATOM 60 CD2 HIS A 901 34.565 0.263 -3.971 1.00 0.00 C ATOM 61 CE1 HIS A 901 36.561 -0.441 -4.537 1.00 0.00 C ATOM 62 NE2 HIS A 901 35.914 0.495 -3.867 1.00 0.00 N ATOM 0 H HIS A 901 34.020 -4.395 -5.321 1.00 0.00 H new ATOM 0 HA HIS A 901 32.776 -2.653 -3.339 1.00 0.00 H new ATOM 0 HB2 HIS A 901 33.227 -1.777 -6.220 1.00 0.00 H new ATOM 0 HB3 HIS A 901 32.306 -0.904 -5.011 1.00 0.00 H new ATOM 0 HD2 HIS A 901 33.778 0.856 -3.530 1.00 0.00 H new ATOM 0 HE1 HIS A 901 37.634 -0.521 -4.635 1.00 0.00 H new ATOM 0 HE2 HIS A 901 36.346 1.265 -3.356 1.00 0.00 H new ATOM 71 N CYS A 902 30.537 -3.332 -4.233 1.00 0.00 N ATOM 72 CA CYS A 902 29.261 -3.910 -4.640 1.00 0.00 C ATOM 73 C CYS A 902 28.611 -3.067 -5.726 1.00 0.00 C ATOM 74 O CYS A 902 28.506 -1.850 -5.598 1.00 0.00 O ATOM 75 CB CYS A 902 28.310 -4.014 -3.447 1.00 0.00 C ATOM 76 SG CYS A 902 28.826 -5.206 -2.173 1.00 0.00 S ATOM 0 H CYS A 902 30.493 -2.769 -3.383 1.00 0.00 H new ATOM 0 HA CYS A 902 29.459 -4.908 -5.030 1.00 0.00 H new ATOM 0 HB2 CYS A 902 28.214 -3.030 -2.988 1.00 0.00 H new ATOM 0 HB3 CYS A 902 27.321 -4.295 -3.810 1.00 0.00 H new ATOM 81 N GLN A 903 28.165 -3.723 -6.790 1.00 0.00 N ATOM 82 CA GLN A 903 27.517 -3.026 -7.892 1.00 0.00 C ATOM 83 C GLN A 903 26.350 -2.188 -7.404 1.00 0.00 C ATOM 84 O GLN A 903 25.797 -2.429 -6.325 1.00 0.00 O ATOM 85 CB GLN A 903 27.035 -4.009 -8.954 1.00 0.00 C ATOM 86 CG GLN A 903 26.343 -5.229 -8.376 1.00 0.00 C ATOM 87 CD GLN A 903 25.104 -4.874 -7.580 1.00 0.00 C ATOM 88 OE1 GLN A 903 24.098 -4.435 -8.137 1.00 0.00 O ATOM 89 NE2 GLN A 903 25.177 -5.045 -6.265 1.00 0.00 N ATOM 0 H GLN A 903 28.240 -4.733 -6.912 1.00 0.00 H new ATOM 0 HA GLN A 903 28.260 -2.363 -8.336 1.00 0.00 H new ATOM 0 HB2 GLN A 903 26.349 -3.496 -9.628 1.00 0.00 H new ATOM 0 HB3 GLN A 903 27.887 -4.333 -9.552 1.00 0.00 H new ATOM 0 HG2 GLN A 903 26.068 -5.904 -9.186 1.00 0.00 H new ATOM 0 HG3 GLN A 903 27.040 -5.768 -7.735 1.00 0.00 H new ATOM 0 HE21 GLN A 903 26.031 -5.412 -5.845 1.00 0.00 H new ATOM 0 HE22 GLN A 903 24.379 -4.809 -5.675 1.00 0.00 H new ATOM 98 N ALA A 904 25.986 -1.206 -8.213 1.00 0.00 N ATOM 99 CA ALA A 904 24.878 -0.316 -7.895 1.00 0.00 C ATOM 100 C ALA A 904 23.649 -1.112 -7.460 1.00 0.00 C ATOM 101 O ALA A 904 23.171 -1.978 -8.193 1.00 0.00 O ATOM 102 CB ALA A 904 24.555 0.557 -9.095 1.00 0.00 C ATOM 0 H ALA A 904 26.445 -1.003 -9.101 1.00 0.00 H new ATOM 0 HA ALA A 904 25.173 0.324 -7.064 1.00 0.00 H new ATOM 0 HB1 ALA A 904 23.725 1.220 -8.850 1.00 0.00 H new ATOM 0 HB2 ALA A 904 25.430 1.152 -9.358 1.00 0.00 H new ATOM 0 HB3 ALA A 904 24.278 -0.074 -9.940 1.00 0.00 H new ATOM 108 N PRO A 905 23.122 -0.835 -6.254 1.00 0.00 N ATOM 109 CA PRO A 905 21.948 -1.536 -5.723 1.00 0.00 C ATOM 110 C PRO A 905 20.728 -1.393 -6.604 1.00 0.00 C ATOM 111 O PRO A 905 20.420 -0.314 -7.111 1.00 0.00 O ATOM 112 CB PRO A 905 21.708 -0.878 -4.360 1.00 0.00 C ATOM 113 CG PRO A 905 23.005 -0.237 -4.008 1.00 0.00 C ATOM 114 CD PRO A 905 23.629 0.174 -5.311 1.00 0.00 C ATOM 0 HA PRO A 905 22.123 -2.610 -5.664 1.00 0.00 H new ATOM 0 HB2 PRO A 905 20.906 -0.142 -4.413 1.00 0.00 H new ATOM 0 HB3 PRO A 905 21.416 -1.615 -3.612 1.00 0.00 H new ATOM 0 HG2 PRO A 905 22.851 0.626 -3.360 1.00 0.00 H new ATOM 0 HG3 PRO A 905 23.650 -0.931 -3.468 1.00 0.00 H new ATOM 0 HD2 PRO A 905 23.332 1.182 -5.600 1.00 0.00 H new ATOM 0 HD3 PRO A 905 24.718 0.165 -5.258 1.00 0.00 H new ATOM 122 N ASP A 906 20.044 -2.508 -6.773 1.00 0.00 N ATOM 123 CA ASP A 906 18.852 -2.573 -7.580 1.00 0.00 C ATOM 124 C ASP A 906 17.752 -1.694 -6.998 1.00 0.00 C ATOM 125 O ASP A 906 17.616 -1.580 -5.779 1.00 0.00 O ATOM 126 CB ASP A 906 18.393 -4.020 -7.646 1.00 0.00 C ATOM 127 CG ASP A 906 17.944 -4.551 -6.298 1.00 0.00 C ATOM 128 OD1 ASP A 906 18.768 -4.565 -5.361 1.00 0.00 O ATOM 129 OD2 ASP A 906 16.767 -4.953 -6.182 1.00 0.00 O ATOM 0 H ASP A 906 20.306 -3.398 -6.349 1.00 0.00 H new ATOM 0 HA ASP A 906 19.071 -2.205 -8.582 1.00 0.00 H new ATOM 0 HB2 ASP A 906 17.572 -4.105 -8.358 1.00 0.00 H new ATOM 0 HB3 ASP A 906 19.207 -4.639 -8.023 1.00 0.00 H new ATOM 134 N HIS A 907 16.970 -1.069 -7.873 1.00 0.00 N ATOM 135 CA HIS A 907 15.888 -0.200 -7.433 1.00 0.00 C ATOM 136 C HIS A 907 14.697 -1.014 -6.934 1.00 0.00 C ATOM 137 O HIS A 907 14.253 -1.958 -7.585 1.00 0.00 O ATOM 138 CB HIS A 907 15.458 0.742 -8.567 1.00 0.00 C ATOM 139 CG HIS A 907 15.090 0.054 -9.850 1.00 0.00 C ATOM 140 ND1 HIS A 907 15.119 -1.253 -10.207 1.00 0.00 N flip ATOM 141 CD2 HIS A 907 14.630 0.739 -10.958 1.00 0.00 C flip ATOM 142 CE1 HIS A 907 14.682 -1.330 -11.507 1.00 0.00 C flip ATOM 143 NE2 HIS A 907 14.393 -0.118 -11.936 1.00 0.00 N flip ATOM 0 H HIS A 907 17.066 -1.148 -8.885 1.00 0.00 H new ATOM 0 HA HIS A 907 16.257 0.401 -6.602 1.00 0.00 H new ATOM 0 HB2 HIS A 907 14.605 1.330 -8.228 1.00 0.00 H new ATOM 0 HB3 HIS A 907 16.269 1.442 -8.766 1.00 0.00 H new ATOM 0 HD1 HIS A 907 15.411 -2.034 -9.620 1.00 0.00 H new ATOM 0 HD2 HIS A 907 14.486 1.808 -11.016 1.00 0.00 H new ATOM 0 HE1 HIS A 907 14.590 -2.238 -12.085 1.00 0.00 H new ATOM 152 N PHE A 908 14.189 -0.640 -5.764 1.00 0.00 N ATOM 153 CA PHE A 908 13.056 -1.333 -5.163 1.00 0.00 C ATOM 154 C PHE A 908 11.736 -0.787 -5.697 1.00 0.00 C ATOM 155 O PHE A 908 11.638 0.381 -6.068 1.00 0.00 O ATOM 156 CB PHE A 908 13.097 -1.215 -3.636 1.00 0.00 C ATOM 157 CG PHE A 908 14.251 -1.942 -2.997 1.00 0.00 C ATOM 158 CD1 PHE A 908 15.555 -1.708 -3.408 1.00 0.00 C ATOM 159 CD2 PHE A 908 14.027 -2.860 -1.985 1.00 0.00 C ATOM 160 CE1 PHE A 908 16.612 -2.377 -2.822 1.00 0.00 C ATOM 161 CE2 PHE A 908 15.081 -3.533 -1.395 1.00 0.00 C ATOM 162 CZ PHE A 908 16.375 -3.291 -1.813 1.00 0.00 C ATOM 0 H PHE A 908 14.545 0.141 -5.213 1.00 0.00 H new ATOM 0 HA PHE A 908 13.127 -2.386 -5.434 1.00 0.00 H new ATOM 0 HB2 PHE A 908 13.150 -0.161 -3.364 1.00 0.00 H new ATOM 0 HB3 PHE A 908 12.164 -1.603 -3.226 1.00 0.00 H new ATOM 0 HD1 PHE A 908 15.746 -0.994 -4.196 1.00 0.00 H new ATOM 0 HD2 PHE A 908 13.018 -3.053 -1.653 1.00 0.00 H new ATOM 0 HE1 PHE A 908 17.622 -2.186 -3.152 1.00 0.00 H new ATOM 0 HE2 PHE A 908 14.892 -4.248 -0.608 1.00 0.00 H new ATOM 0 HZ PHE A 908 17.200 -3.815 -1.352 1.00 0.00 H new ATOM 172 N LEU A 909 10.728 -1.649 -5.743 1.00 0.00 N ATOM 173 CA LEU A 909 9.412 -1.266 -6.238 1.00 0.00 C ATOM 174 C LEU A 909 8.613 -0.547 -5.164 1.00 0.00 C ATOM 175 O LEU A 909 8.173 0.586 -5.354 1.00 0.00 O ATOM 176 CB LEU A 909 8.642 -2.499 -6.700 1.00 0.00 C ATOM 177 CG LEU A 909 9.301 -3.297 -7.822 1.00 0.00 C ATOM 178 CD1 LEU A 909 9.585 -2.403 -9.020 1.00 0.00 C ATOM 179 CD2 LEU A 909 10.576 -3.974 -7.340 1.00 0.00 C ATOM 0 H LEU A 909 10.797 -2.621 -5.442 1.00 0.00 H new ATOM 0 HA LEU A 909 9.556 -0.589 -7.080 1.00 0.00 H new ATOM 0 HB2 LEU A 909 8.497 -3.158 -5.844 1.00 0.00 H new ATOM 0 HB3 LEU A 909 7.652 -2.186 -7.032 1.00 0.00 H new ATOM 0 HG LEU A 909 8.606 -4.077 -8.132 1.00 0.00 H new ATOM 0 HD11 LEU A 909 10.055 -2.990 -9.809 1.00 0.00 H new ATOM 0 HD12 LEU A 909 8.650 -1.981 -9.389 1.00 0.00 H new ATOM 0 HD13 LEU A 909 10.254 -1.596 -8.721 1.00 0.00 H new ATOM 0 HD21 LEU A 909 11.023 -4.535 -8.161 1.00 0.00 H new ATOM 0 HD22 LEU A 909 11.280 -3.218 -6.991 1.00 0.00 H new ATOM 0 HD23 LEU A 909 10.340 -4.655 -6.522 1.00 0.00 H new ATOM 191 N PHE A 910 8.434 -1.215 -4.033 1.00 0.00 N ATOM 192 CA PHE A 910 7.696 -0.641 -2.921 1.00 0.00 C ATOM 193 C PHE A 910 8.619 0.210 -2.065 1.00 0.00 C ATOM 194 O PHE A 910 8.259 0.629 -0.963 1.00 0.00 O ATOM 195 CB PHE A 910 7.053 -1.751 -2.080 1.00 0.00 C ATOM 196 CG PHE A 910 7.997 -2.857 -1.684 1.00 0.00 C ATOM 197 CD1 PHE A 910 9.161 -2.584 -0.981 1.00 0.00 C ATOM 198 CD2 PHE A 910 7.716 -4.171 -2.018 1.00 0.00 C ATOM 199 CE1 PHE A 910 10.024 -3.601 -0.619 1.00 0.00 C ATOM 200 CE2 PHE A 910 8.575 -5.193 -1.660 1.00 0.00 C ATOM 201 CZ PHE A 910 9.731 -4.907 -0.959 1.00 0.00 C ATOM 0 H PHE A 910 8.791 -2.155 -3.863 1.00 0.00 H new ATOM 0 HA PHE A 910 6.903 -0.005 -3.315 1.00 0.00 H new ATOM 0 HB2 PHE A 910 6.632 -1.309 -1.177 1.00 0.00 H new ATOM 0 HB3 PHE A 910 6.223 -2.181 -2.641 1.00 0.00 H new ATOM 0 HD1 PHE A 910 9.396 -1.564 -0.713 1.00 0.00 H new ATOM 0 HD2 PHE A 910 6.814 -4.400 -2.565 1.00 0.00 H new ATOM 0 HE1 PHE A 910 10.927 -3.375 -0.071 1.00 0.00 H new ATOM 0 HE2 PHE A 910 8.343 -6.213 -1.928 1.00 0.00 H new ATOM 0 HZ PHE A 910 10.404 -5.703 -0.678 1.00 0.00 H new ATOM 211 N ALA A 911 9.817 0.458 -2.581 1.00 0.00 N ATOM 212 CA ALA A 911 10.801 1.255 -1.854 1.00 0.00 C ATOM 213 C ALA A 911 11.759 1.976 -2.797 1.00 0.00 C ATOM 214 O ALA A 911 12.028 1.513 -3.903 1.00 0.00 O ATOM 215 CB ALA A 911 11.578 0.374 -0.888 1.00 0.00 C ATOM 0 H ALA A 911 10.130 0.123 -3.492 1.00 0.00 H new ATOM 0 HA ALA A 911 10.259 2.016 -1.293 1.00 0.00 H new ATOM 0 HB1 ALA A 911 12.309 0.979 -0.351 1.00 0.00 H new ATOM 0 HB2 ALA A 911 10.889 -0.080 -0.175 1.00 0.00 H new ATOM 0 HB3 ALA A 911 12.093 -0.409 -1.444 1.00 0.00 H new ATOM 221 N LYS A 912 12.271 3.115 -2.346 1.00 0.00 N ATOM 222 CA LYS A 912 13.203 3.906 -3.141 1.00 0.00 C ATOM 223 C LYS A 912 14.358 4.399 -2.278 1.00 0.00 C ATOM 224 O LYS A 912 14.155 4.848 -1.149 1.00 0.00 O ATOM 225 CB LYS A 912 12.487 5.095 -3.785 1.00 0.00 C ATOM 226 CG LYS A 912 11.843 6.037 -2.780 1.00 0.00 C ATOM 227 CD LYS A 912 11.140 7.194 -3.472 1.00 0.00 C ATOM 228 CE LYS A 912 10.499 8.139 -2.469 1.00 0.00 C ATOM 229 NZ LYS A 912 11.507 8.746 -1.556 1.00 0.00 N ATOM 0 H LYS A 912 12.056 3.512 -1.432 1.00 0.00 H new ATOM 0 HA LYS A 912 13.602 3.268 -3.930 1.00 0.00 H new ATOM 0 HB2 LYS A 912 13.202 5.655 -4.388 1.00 0.00 H new ATOM 0 HB3 LYS A 912 11.720 4.722 -4.464 1.00 0.00 H new ATOM 0 HG2 LYS A 912 11.126 5.486 -2.171 1.00 0.00 H new ATOM 0 HG3 LYS A 912 12.605 6.425 -2.103 1.00 0.00 H new ATOM 0 HD2 LYS A 912 11.856 7.743 -4.083 1.00 0.00 H new ATOM 0 HD3 LYS A 912 10.377 6.806 -4.146 1.00 0.00 H new ATOM 0 HE2 LYS A 912 9.969 8.929 -3.002 1.00 0.00 H new ATOM 0 HE3 LYS A 912 9.757 7.597 -1.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 912 11.027 9.144 -0.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 912 12.182 8.016 -1.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 912 12.017 9.502 -2.056 1.00 0.00 H new ATOM 243 N LEU A 913 15.570 4.300 -2.814 1.00 0.00 N ATOM 244 CA LEU A 913 16.769 4.723 -2.098 1.00 0.00 C ATOM 245 C LEU A 913 16.578 6.085 -1.439 1.00 0.00 C ATOM 246 O LEU A 913 16.131 7.041 -2.075 1.00 0.00 O ATOM 247 CB LEU A 913 17.963 4.769 -3.050 1.00 0.00 C ATOM 248 CG LEU A 913 19.267 5.264 -2.425 1.00 0.00 C ATOM 249 CD1 LEU A 913 19.660 4.392 -1.244 1.00 0.00 C ATOM 250 CD2 LEU A 913 20.375 5.287 -3.463 1.00 0.00 C ATOM 0 H LEU A 913 15.749 3.928 -3.747 1.00 0.00 H new ATOM 0 HA LEU A 913 16.960 3.993 -1.312 1.00 0.00 H new ATOM 0 HB2 LEU A 913 18.127 3.769 -3.452 1.00 0.00 H new ATOM 0 HB3 LEU A 913 17.713 5.414 -3.892 1.00 0.00 H new ATOM 0 HG LEU A 913 19.111 6.280 -2.062 1.00 0.00 H new ATOM 0 HD11 LEU A 913 20.591 4.761 -0.813 1.00 0.00 H new ATOM 0 HD12 LEU A 913 18.873 4.424 -0.490 1.00 0.00 H new ATOM 0 HD13 LEU A 913 19.798 3.364 -1.580 1.00 0.00 H new ATOM 0 HD21 LEU A 913 21.297 5.642 -3.003 1.00 0.00 H new ATOM 0 HD22 LEU A 913 20.528 4.281 -3.854 1.00 0.00 H new ATOM 0 HD23 LEU A 913 20.096 5.955 -4.278 1.00 0.00 H new ATOM 262 N LYS A 914 16.926 6.163 -0.158 1.00 0.00 N ATOM 263 CA LYS A 914 16.801 7.401 0.601 1.00 0.00 C ATOM 264 C LYS A 914 18.122 8.169 0.589 1.00 0.00 C ATOM 265 O LYS A 914 18.159 9.358 0.273 1.00 0.00 O ATOM 266 CB LYS A 914 16.378 7.084 2.040 1.00 0.00 C ATOM 267 CG LYS A 914 15.918 8.292 2.848 1.00 0.00 C ATOM 268 CD LYS A 914 17.069 9.219 3.208 1.00 0.00 C ATOM 269 CE LYS A 914 16.598 10.380 4.068 1.00 0.00 C ATOM 270 NZ LYS A 914 17.714 11.299 4.421 1.00 0.00 N ATOM 0 H LYS A 914 17.298 5.379 0.377 1.00 0.00 H new ATOM 0 HA LYS A 914 16.039 8.027 0.137 1.00 0.00 H new ATOM 0 HB2 LYS A 914 15.571 6.352 2.014 1.00 0.00 H new ATOM 0 HB3 LYS A 914 17.216 6.616 2.556 1.00 0.00 H new ATOM 0 HG2 LYS A 914 15.173 8.846 2.277 1.00 0.00 H new ATOM 0 HG3 LYS A 914 15.430 7.951 3.761 1.00 0.00 H new ATOM 0 HD2 LYS A 914 17.837 8.658 3.740 1.00 0.00 H new ATOM 0 HD3 LYS A 914 17.528 9.602 2.297 1.00 0.00 H new ATOM 0 HE2 LYS A 914 15.825 10.935 3.536 1.00 0.00 H new ATOM 0 HE3 LYS A 914 16.143 9.994 4.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 914 17.351 12.077 5.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 914 18.440 10.776 4.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 914 18.132 11.687 3.552 1.00 0.00 H new ATOM 284 N THR A 915 19.202 7.475 0.939 1.00 0.00 N ATOM 285 CA THR A 915 20.530 8.081 0.976 1.00 0.00 C ATOM 286 C THR A 915 21.008 8.472 -0.418 1.00 0.00 C ATOM 287 O THR A 915 20.862 7.709 -1.373 1.00 0.00 O ATOM 288 CB THR A 915 21.562 7.128 1.611 1.00 0.00 C ATOM 289 OG1 THR A 915 21.249 6.917 2.992 1.00 0.00 O ATOM 290 CG2 THR A 915 22.973 7.687 1.484 1.00 0.00 C ATOM 0 H THR A 915 19.183 6.490 1.202 1.00 0.00 H new ATOM 0 HA THR A 915 20.445 8.980 1.587 1.00 0.00 H new ATOM 0 HB THR A 915 21.518 6.178 1.079 1.00 0.00 H new ATOM 0 HG1 THR A 915 21.989 6.443 3.426 1.00 0.00 H new ATOM 0 HG21 THR A 915 23.681 6.995 1.940 1.00 0.00 H new ATOM 0 HG22 THR A 915 23.220 7.816 0.430 1.00 0.00 H new ATOM 0 HG23 THR A 915 23.030 8.650 1.991 1.00 0.00 H new ATOM 298 N GLN A 916 21.591 9.662 -0.522 1.00 0.00 N ATOM 299 CA GLN A 916 22.106 10.156 -1.793 1.00 0.00 C ATOM 300 C GLN A 916 23.261 9.289 -2.284 1.00 0.00 C ATOM 301 O GLN A 916 24.117 8.877 -1.502 1.00 0.00 O ATOM 302 CB GLN A 916 22.548 11.616 -1.656 1.00 0.00 C ATOM 303 CG GLN A 916 23.387 11.896 -0.418 1.00 0.00 C ATOM 304 CD GLN A 916 24.754 11.242 -0.462 1.00 0.00 C ATOM 305 OE1 GLN A 916 25.558 11.514 -1.354 1.00 0.00 O ATOM 306 NE2 GLN A 916 25.025 10.371 0.506 1.00 0.00 N ATOM 0 H GLN A 916 21.719 10.303 0.261 1.00 0.00 H new ATOM 0 HA GLN A 916 21.306 10.103 -2.532 1.00 0.00 H new ATOM 0 HB2 GLN A 916 23.120 11.896 -2.541 1.00 0.00 H new ATOM 0 HB3 GLN A 916 21.663 12.252 -1.634 1.00 0.00 H new ATOM 0 HG2 GLN A 916 23.510 12.973 -0.307 1.00 0.00 H new ATOM 0 HG3 GLN A 916 22.851 11.544 0.463 1.00 0.00 H new ATOM 0 HE21 GLN A 916 24.329 10.175 1.226 1.00 0.00 H new ATOM 0 HE22 GLN A 916 25.929 9.899 0.529 1.00 0.00 H new ATOM 315 N THR A 917 23.279 9.008 -3.585 1.00 0.00 N ATOM 316 CA THR A 917 24.330 8.184 -4.177 1.00 0.00 C ATOM 317 C THR A 917 24.515 8.508 -5.653 1.00 0.00 C ATOM 318 O THR A 917 23.949 9.475 -6.163 1.00 0.00 O ATOM 319 CB THR A 917 24.014 6.680 -4.056 1.00 0.00 C ATOM 320 OG1 THR A 917 22.801 6.377 -4.753 1.00 0.00 O ATOM 321 CG2 THR A 917 23.887 6.254 -2.603 1.00 0.00 C ATOM 0 H THR A 917 22.578 9.338 -4.249 1.00 0.00 H new ATOM 0 HA THR A 917 25.242 8.410 -3.625 1.00 0.00 H new ATOM 0 HB THR A 917 24.842 6.129 -4.502 1.00 0.00 H new ATOM 0 HG1 THR A 917 22.768 5.418 -4.951 1.00 0.00 H new ATOM 0 HG21 THR A 917 23.664 5.188 -2.554 1.00 0.00 H new ATOM 0 HG22 THR A 917 24.824 6.453 -2.082 1.00 0.00 H new ATOM 0 HG23 THR A 917 23.082 6.815 -2.128 1.00 0.00 H new ATOM 329 N THR A 918 25.302 7.679 -6.334 1.00 0.00 N ATOM 330 CA THR A 918 25.566 7.852 -7.758 1.00 0.00 C ATOM 331 C THR A 918 25.971 6.526 -8.395 1.00 0.00 C ATOM 332 O THR A 918 26.790 6.494 -9.315 1.00 0.00 O ATOM 333 CB THR A 918 26.685 8.883 -8.015 1.00 0.00 C ATOM 334 OG1 THR A 918 27.856 8.531 -7.269 1.00 0.00 O ATOM 335 CG2 THR A 918 26.243 10.290 -7.640 1.00 0.00 C ATOM 0 H THR A 918 25.771 6.875 -5.917 1.00 0.00 H new ATOM 0 HA THR A 918 24.642 8.217 -8.206 1.00 0.00 H new ATOM 0 HB THR A 918 26.911 8.871 -9.081 1.00 0.00 H new ATOM 0 HG1 THR A 918 28.562 9.189 -7.439 1.00 0.00 H new ATOM 0 HG21 THR A 918 27.055 10.990 -7.834 1.00 0.00 H new ATOM 0 HG22 THR A 918 25.374 10.569 -8.235 1.00 0.00 H new ATOM 0 HG23 THR A 918 25.983 10.320 -6.582 1.00 0.00 H new ATOM 343 N ALA A 919 25.386 5.436 -7.898 1.00 0.00 N ATOM 344 CA ALA A 919 25.674 4.097 -8.408 1.00 0.00 C ATOM 345 C ALA A 919 27.157 3.907 -8.691 1.00 0.00 C ATOM 346 O ALA A 919 28.013 4.453 -7.993 1.00 0.00 O ATOM 347 CB ALA A 919 24.864 3.826 -9.662 1.00 0.00 C ATOM 0 H ALA A 919 24.706 5.456 -7.138 1.00 0.00 H new ATOM 0 HA ALA A 919 25.390 3.383 -7.635 1.00 0.00 H new ATOM 0 HB1 ALA A 919 25.089 2.825 -10.031 1.00 0.00 H new ATOM 0 HB2 ALA A 919 23.801 3.898 -9.431 1.00 0.00 H new ATOM 0 HB3 ALA A 919 25.120 4.560 -10.426 1.00 0.00 H new ATOM 353 N SER A 920 27.446 3.125 -9.722 1.00 0.00 N ATOM 354 CA SER A 920 28.818 2.845 -10.122 1.00 0.00 C ATOM 355 C SER A 920 29.571 2.118 -9.015 1.00 0.00 C ATOM 356 O SER A 920 30.718 2.446 -8.709 1.00 0.00 O ATOM 357 CB SER A 920 29.533 4.140 -10.486 1.00 0.00 C ATOM 358 OG SER A 920 30.877 3.898 -10.864 1.00 0.00 O ATOM 0 H SER A 920 26.741 2.669 -10.301 1.00 0.00 H new ATOM 0 HA SER A 920 28.793 2.196 -10.997 1.00 0.00 H new ATOM 0 HB2 SER A 920 29.006 4.631 -11.304 1.00 0.00 H new ATOM 0 HB3 SER A 920 29.509 4.822 -9.636 1.00 0.00 H new ATOM 0 HG SER A 920 31.344 3.438 -10.136 1.00 0.00 H new ATOM 364 N ASP A 921 28.915 1.123 -8.423 1.00 0.00 N ATOM 365 CA ASP A 921 29.515 0.330 -7.348 1.00 0.00 C ATOM 366 C ASP A 921 29.743 1.170 -6.093 1.00 0.00 C ATOM 367 O ASP A 921 29.901 2.389 -6.165 1.00 0.00 O ATOM 368 CB ASP A 921 30.837 -0.290 -7.811 1.00 0.00 C ATOM 369 CG ASP A 921 30.653 -1.236 -8.982 1.00 0.00 C ATOM 370 OD1 ASP A 921 30.174 -0.782 -10.042 1.00 0.00 O ATOM 371 OD2 ASP A 921 30.989 -2.430 -8.838 1.00 0.00 O ATOM 0 H ASP A 921 27.965 0.845 -8.669 1.00 0.00 H new ATOM 0 HA ASP A 921 28.815 -0.468 -7.099 1.00 0.00 H new ATOM 0 HB2 ASP A 921 31.528 0.504 -8.094 1.00 0.00 H new ATOM 0 HB3 ASP A 921 31.293 -0.829 -6.980 1.00 0.00 H new ATOM 376 N PHE A 922 29.752 0.502 -4.940 1.00 0.00 N ATOM 377 CA PHE A 922 29.950 1.174 -3.660 1.00 0.00 C ATOM 378 C PHE A 922 30.915 0.395 -2.771 1.00 0.00 C ATOM 379 O PHE A 922 30.941 -0.835 -2.796 1.00 0.00 O ATOM 380 CB PHE A 922 28.619 1.346 -2.928 1.00 0.00 C ATOM 381 CG PHE A 922 27.639 2.222 -3.651 1.00 0.00 C ATOM 382 CD1 PHE A 922 26.911 1.737 -4.725 1.00 0.00 C ATOM 383 CD2 PHE A 922 27.445 3.532 -3.247 1.00 0.00 C ATOM 384 CE1 PHE A 922 26.007 2.548 -5.385 1.00 0.00 C ATOM 385 CE2 PHE A 922 26.545 4.345 -3.903 1.00 0.00 C ATOM 386 CZ PHE A 922 25.825 3.853 -4.974 1.00 0.00 C ATOM 0 H PHE A 922 29.624 -0.507 -4.868 1.00 0.00 H new ATOM 0 HA PHE A 922 30.377 2.155 -3.870 1.00 0.00 H new ATOM 0 HB2 PHE A 922 28.170 0.365 -2.774 1.00 0.00 H new ATOM 0 HB3 PHE A 922 28.810 1.768 -1.941 1.00 0.00 H new ATOM 0 HD1 PHE A 922 27.051 0.716 -5.049 1.00 0.00 H new ATOM 0 HD2 PHE A 922 28.004 3.921 -2.409 1.00 0.00 H new ATOM 0 HE1 PHE A 922 25.444 2.161 -6.221 1.00 0.00 H new ATOM 0 HE2 PHE A 922 26.403 5.366 -3.580 1.00 0.00 H new ATOM 0 HZ PHE A 922 25.120 4.489 -5.489 1.00 0.00 H new ATOM 396 N PRO A 923 31.719 1.109 -1.963 1.00 0.00 N ATOM 397 CA PRO A 923 32.684 0.485 -1.052 1.00 0.00 C ATOM 398 C PRO A 923 32.004 -0.446 -0.054 1.00 0.00 C ATOM 399 O PRO A 923 30.942 -0.127 0.480 1.00 0.00 O ATOM 400 CB PRO A 923 33.328 1.673 -0.326 1.00 0.00 C ATOM 401 CG PRO A 923 32.387 2.811 -0.528 1.00 0.00 C ATOM 402 CD PRO A 923 31.743 2.578 -1.864 1.00 0.00 C ATOM 0 HA PRO A 923 33.404 -0.135 -1.585 1.00 0.00 H new ATOM 0 HB2 PRO A 923 33.466 1.459 0.734 1.00 0.00 H new ATOM 0 HB3 PRO A 923 34.312 1.898 -0.736 1.00 0.00 H new ATOM 0 HG2 PRO A 923 31.640 2.846 0.265 1.00 0.00 H new ATOM 0 HG3 PRO A 923 32.916 3.764 -0.510 1.00 0.00 H new ATOM 0 HD2 PRO A 923 30.740 3.003 -1.909 1.00 0.00 H new ATOM 0 HD3 PRO A 923 32.317 3.029 -2.674 1.00 0.00 H new ATOM 410 N ILE A 924 32.616 -1.601 0.188 1.00 0.00 N ATOM 411 CA ILE A 924 32.061 -2.579 1.116 1.00 0.00 C ATOM 412 C ILE A 924 31.899 -1.986 2.513 1.00 0.00 C ATOM 413 O ILE A 924 32.580 -1.026 2.874 1.00 0.00 O ATOM 414 CB ILE A 924 32.933 -3.844 1.204 1.00 0.00 C ATOM 415 CG1 ILE A 924 33.241 -4.378 -0.197 1.00 0.00 C ATOM 416 CG2 ILE A 924 32.220 -4.901 2.031 1.00 0.00 C ATOM 417 CD1 ILE A 924 34.132 -5.602 -0.197 1.00 0.00 C ATOM 0 H ILE A 924 33.496 -1.882 -0.245 1.00 0.00 H new ATOM 0 HA ILE A 924 31.082 -2.855 0.725 1.00 0.00 H new ATOM 0 HB ILE A 924 33.877 -3.593 1.688 1.00 0.00 H new ATOM 0 HG12 ILE A 924 32.304 -4.621 -0.698 1.00 0.00 H new ATOM 0 HG13 ILE A 924 33.719 -3.591 -0.780 1.00 0.00 H new ATOM 0 HG21 ILE A 924 32.840 -5.795 2.091 1.00 0.00 H new ATOM 0 HG22 ILE A 924 32.039 -4.517 3.035 1.00 0.00 H new ATOM 0 HG23 ILE A 924 31.269 -5.150 1.561 1.00 0.00 H new ATOM 0 HD11 ILE A 924 34.307 -5.924 -1.223 1.00 0.00 H new ATOM 0 HD12 ILE A 924 35.084 -5.359 0.275 1.00 0.00 H new ATOM 0 HD13 ILE A 924 33.647 -6.405 0.358 1.00 0.00 H new ATOM 429 N GLY A 925 30.983 -2.559 3.290 1.00 0.00 N ATOM 430 CA GLY A 925 30.735 -2.069 4.632 1.00 0.00 C ATOM 431 C GLY A 925 29.746 -0.925 4.635 1.00 0.00 C ATOM 432 O GLY A 925 28.972 -0.760 5.580 1.00 0.00 O ATOM 0 H GLY A 925 30.408 -3.355 3.012 1.00 0.00 H new ATOM 0 HA2 GLY A 925 30.354 -2.881 5.251 1.00 0.00 H new ATOM 0 HA3 GLY A 925 31.673 -1.740 5.079 1.00 0.00 H new ATOM 436 N THR A 926 29.774 -0.136 3.568 1.00 0.00 N ATOM 437 CA THR A 926 28.881 1.003 3.425 1.00 0.00 C ATOM 438 C THR A 926 27.417 0.587 3.545 1.00 0.00 C ATOM 439 O THR A 926 26.950 -0.300 2.826 1.00 0.00 O ATOM 440 CB THR A 926 29.095 1.698 2.066 1.00 0.00 C ATOM 441 OG1 THR A 926 30.394 2.301 2.022 1.00 0.00 O ATOM 442 CG2 THR A 926 28.029 2.752 1.811 1.00 0.00 C ATOM 0 H THR A 926 30.412 -0.268 2.783 1.00 0.00 H new ATOM 0 HA THR A 926 29.117 1.696 4.233 1.00 0.00 H new ATOM 0 HB THR A 926 29.019 0.941 1.286 1.00 0.00 H new ATOM 0 HG1 THR A 926 30.303 3.264 1.864 1.00 0.00 H new ATOM 0 HG21 THR A 926 28.208 3.224 0.845 1.00 0.00 H new ATOM 0 HG22 THR A 926 27.046 2.282 1.809 1.00 0.00 H new ATOM 0 HG23 THR A 926 28.068 3.507 2.596 1.00 0.00 H new ATOM 450 N SER A 927 26.697 1.249 4.446 1.00 0.00 N ATOM 451 CA SER A 927 25.281 0.972 4.653 1.00 0.00 C ATOM 452 C SER A 927 24.440 1.961 3.855 1.00 0.00 C ATOM 453 O SER A 927 24.638 3.172 3.953 1.00 0.00 O ATOM 454 CB SER A 927 24.927 1.061 6.138 1.00 0.00 C ATOM 455 OG SER A 927 23.553 0.791 6.352 1.00 0.00 O ATOM 0 H SER A 927 27.073 1.983 5.046 1.00 0.00 H new ATOM 0 HA SER A 927 25.069 -0.040 4.308 1.00 0.00 H new ATOM 0 HB2 SER A 927 25.532 0.352 6.702 1.00 0.00 H new ATOM 0 HB3 SER A 927 25.168 2.055 6.514 1.00 0.00 H new ATOM 0 HG SER A 927 23.250 0.111 5.715 1.00 0.00 H new ATOM 461 N LEU A 928 23.511 1.447 3.058 1.00 0.00 N ATOM 462 CA LEU A 928 22.662 2.307 2.242 1.00 0.00 C ATOM 463 C LEU A 928 21.252 2.389 2.822 1.00 0.00 C ATOM 464 O LEU A 928 20.572 1.377 2.965 1.00 0.00 O ATOM 465 CB LEU A 928 22.616 1.780 0.808 1.00 0.00 C ATOM 466 CG LEU A 928 22.481 2.856 -0.270 1.00 0.00 C ATOM 467 CD1 LEU A 928 23.671 3.803 -0.223 1.00 0.00 C ATOM 468 CD2 LEU A 928 22.360 2.218 -1.645 1.00 0.00 C ATOM 0 H LEU A 928 23.327 0.449 2.959 1.00 0.00 H new ATOM 0 HA LEU A 928 23.085 3.311 2.241 1.00 0.00 H new ATOM 0 HB2 LEU A 928 23.524 1.208 0.618 1.00 0.00 H new ATOM 0 HB3 LEU A 928 21.778 1.089 0.717 1.00 0.00 H new ATOM 0 HG LEU A 928 21.575 3.430 -0.077 1.00 0.00 H new ATOM 0 HD11 LEU A 928 23.561 4.564 -0.996 1.00 0.00 H new ATOM 0 HD12 LEU A 928 23.716 4.283 0.755 1.00 0.00 H new ATOM 0 HD13 LEU A 928 24.590 3.242 -0.394 1.00 0.00 H new ATOM 0 HD21 LEU A 928 22.265 2.998 -2.401 1.00 0.00 H new ATOM 0 HD22 LEU A 928 23.249 1.622 -1.849 1.00 0.00 H new ATOM 0 HD23 LEU A 928 21.479 1.577 -1.672 1.00 0.00 H new ATOM 480 N LYS A 929 20.823 3.603 3.160 1.00 0.00 N ATOM 481 CA LYS A 929 19.496 3.817 3.733 1.00 0.00 C ATOM 482 C LYS A 929 18.432 3.968 2.647 1.00 0.00 C ATOM 483 O LYS A 929 18.669 4.595 1.615 1.00 0.00 O ATOM 484 CB LYS A 929 19.503 5.056 4.631 1.00 0.00 C ATOM 485 CG LYS A 929 18.186 5.294 5.350 1.00 0.00 C ATOM 486 CD LYS A 929 18.248 6.526 6.239 1.00 0.00 C ATOM 487 CE LYS A 929 19.323 6.393 7.307 1.00 0.00 C ATOM 488 NZ LYS A 929 19.389 7.594 8.184 1.00 0.00 N ATOM 0 H LYS A 929 21.375 4.453 3.047 1.00 0.00 H new ATOM 0 HA LYS A 929 19.247 2.938 4.328 1.00 0.00 H new ATOM 0 HB2 LYS A 929 20.298 4.954 5.370 1.00 0.00 H new ATOM 0 HB3 LYS A 929 19.741 5.931 4.026 1.00 0.00 H new ATOM 0 HG2 LYS A 929 17.387 5.413 4.618 1.00 0.00 H new ATOM 0 HG3 LYS A 929 17.938 4.421 5.954 1.00 0.00 H new ATOM 0 HD2 LYS A 929 18.448 7.406 5.628 1.00 0.00 H new ATOM 0 HD3 LYS A 929 17.279 6.681 6.714 1.00 0.00 H new ATOM 0 HE2 LYS A 929 19.123 5.511 7.915 1.00 0.00 H new ATOM 0 HE3 LYS A 929 20.291 6.239 6.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 20.134 7.462 8.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 19.605 8.433 7.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 18.474 7.727 8.660 1.00 0.00 H new ATOM 502 N TYR A 930 17.257 3.392 2.894 1.00 0.00 N ATOM 503 CA TYR A 930 16.146 3.461 1.945 1.00 0.00 C ATOM 504 C TYR A 930 14.868 3.931 2.635 1.00 0.00 C ATOM 505 O TYR A 930 14.799 3.994 3.863 1.00 0.00 O ATOM 506 CB TYR A 930 15.898 2.098 1.293 1.00 0.00 C ATOM 507 CG TYR A 930 16.972 1.663 0.320 1.00 0.00 C ATOM 508 CD1 TYR A 930 18.291 1.504 0.726 1.00 0.00 C ATOM 509 CD2 TYR A 930 16.661 1.409 -1.009 1.00 0.00 C ATOM 510 CE1 TYR A 930 19.268 1.106 -0.165 1.00 0.00 C ATOM 511 CE2 TYR A 930 17.632 1.011 -1.906 1.00 0.00 C ATOM 512 CZ TYR A 930 18.934 0.861 -1.480 1.00 0.00 C ATOM 513 OH TYR A 930 19.904 0.464 -2.371 1.00 0.00 O ATOM 0 H TYR A 930 17.049 2.871 3.746 1.00 0.00 H new ATOM 0 HA TYR A 930 16.420 4.181 1.173 1.00 0.00 H new ATOM 0 HB2 TYR A 930 15.809 1.345 2.076 1.00 0.00 H new ATOM 0 HB3 TYR A 930 14.942 2.128 0.770 1.00 0.00 H new ATOM 0 HD1 TYR A 930 18.557 1.695 1.755 1.00 0.00 H new ATOM 0 HD2 TYR A 930 15.642 1.525 -1.347 1.00 0.00 H new ATOM 0 HE1 TYR A 930 20.289 0.987 0.167 1.00 0.00 H new ATOM 0 HE2 TYR A 930 17.373 0.818 -2.936 1.00 0.00 H new ATOM 0 HH TYR A 930 20.055 1.175 -3.028 1.00 0.00 H new ATOM 523 N GLU A 931 13.857 4.259 1.834 1.00 0.00 N ATOM 524 CA GLU A 931 12.577 4.721 2.361 1.00 0.00 C ATOM 525 C GLU A 931 11.420 4.220 1.500 1.00 0.00 C ATOM 526 O GLU A 931 11.495 4.237 0.272 1.00 0.00 O ATOM 527 CB GLU A 931 12.550 6.249 2.432 1.00 0.00 C ATOM 528 CG GLU A 931 12.727 6.925 1.081 1.00 0.00 C ATOM 529 CD GLU A 931 12.681 8.438 1.174 1.00 0.00 C ATOM 530 OE1 GLU A 931 11.649 8.973 1.630 1.00 0.00 O ATOM 531 OE2 GLU A 931 13.677 9.087 0.792 1.00 0.00 O ATOM 0 H GLU A 931 13.900 4.213 0.816 1.00 0.00 H new ATOM 0 HA GLU A 931 12.461 4.316 3.366 1.00 0.00 H new ATOM 0 HB2 GLU A 931 11.603 6.567 2.867 1.00 0.00 H new ATOM 0 HB3 GLU A 931 13.339 6.587 3.104 1.00 0.00 H new ATOM 0 HG2 GLU A 931 13.680 6.620 0.649 1.00 0.00 H new ATOM 0 HG3 GLU A 931 11.945 6.583 0.403 1.00 0.00 H new ATOM 538 N CYS A 932 10.352 3.770 2.155 1.00 0.00 N ATOM 539 CA CYS A 932 9.176 3.261 1.452 1.00 0.00 C ATOM 540 C CYS A 932 8.616 4.308 0.492 1.00 0.00 C ATOM 541 O CYS A 932 8.623 5.503 0.789 1.00 0.00 O ATOM 542 CB CYS A 932 8.096 2.845 2.453 1.00 0.00 C ATOM 543 SG CYS A 932 8.632 1.585 3.657 1.00 0.00 S ATOM 0 H CYS A 932 10.276 3.747 3.172 1.00 0.00 H new ATOM 0 HA CYS A 932 9.482 2.390 0.873 1.00 0.00 H new ATOM 0 HB2 CYS A 932 7.760 3.729 2.995 1.00 0.00 H new ATOM 0 HB3 CYS A 932 7.236 2.462 1.903 1.00 0.00 H new ATOM 548 N ARG A 933 8.130 3.851 -0.660 1.00 0.00 N ATOM 549 CA ARG A 933 7.564 4.749 -1.664 1.00 0.00 C ATOM 550 C ARG A 933 6.092 5.031 -1.377 1.00 0.00 C ATOM 551 O ARG A 933 5.434 4.263 -0.677 1.00 0.00 O ATOM 552 CB ARG A 933 7.712 4.147 -3.064 1.00 0.00 C ATOM 553 CG ARG A 933 9.151 3.853 -3.453 1.00 0.00 C ATOM 554 CD ARG A 933 9.242 3.303 -4.867 1.00 0.00 C ATOM 555 NE ARG A 933 8.856 4.295 -5.867 1.00 0.00 N ATOM 556 CZ ARG A 933 8.847 4.058 -7.176 1.00 0.00 C ATOM 557 NH1 ARG A 933 9.196 2.866 -7.640 1.00 0.00 N ATOM 558 NH2 ARG A 933 8.488 5.015 -8.021 1.00 0.00 N ATOM 0 H ARG A 933 8.117 2.865 -0.921 1.00 0.00 H new ATOM 0 HA ARG A 933 8.113 5.689 -1.619 1.00 0.00 H new ATOM 0 HB2 ARG A 933 7.135 3.224 -3.116 1.00 0.00 H new ATOM 0 HB3 ARG A 933 7.281 4.834 -3.793 1.00 0.00 H new ATOM 0 HG2 ARG A 933 9.744 4.765 -3.377 1.00 0.00 H new ATOM 0 HG3 ARG A 933 9.579 3.135 -2.753 1.00 0.00 H new ATOM 0 HD2 ARG A 933 10.262 2.970 -5.061 1.00 0.00 H new ATOM 0 HD3 ARG A 933 8.598 2.428 -4.958 1.00 0.00 H new ATOM 0 HE ARG A 933 8.578 5.221 -5.544 1.00 0.00 H new ATOM 0 HH11 ARG A 933 9.472 2.128 -6.993 1.00 0.00 H new ATOM 0 HH12 ARG A 933 9.188 2.687 -8.644 1.00 0.00 H new ATOM 0 HH21 ARG A 933 8.219 5.933 -7.667 1.00 0.00 H new ATOM 0 HH22 ARG A 933 8.481 4.833 -9.025 1.00 0.00 H new ATOM 572 N PRO A 934 5.554 6.142 -1.917 1.00 0.00 N ATOM 573 CA PRO A 934 4.154 6.518 -1.715 1.00 0.00 C ATOM 574 C PRO A 934 3.212 5.357 -1.998 1.00 0.00 C ATOM 575 O PRO A 934 3.424 4.590 -2.938 1.00 0.00 O ATOM 576 CB PRO A 934 3.921 7.661 -2.716 1.00 0.00 C ATOM 577 CG PRO A 934 5.136 7.688 -3.587 1.00 0.00 C ATOM 578 CD PRO A 934 6.253 7.114 -2.765 1.00 0.00 C ATOM 0 HA PRO A 934 3.957 6.810 -0.683 1.00 0.00 H new ATOM 0 HB2 PRO A 934 3.020 7.488 -3.305 1.00 0.00 H new ATOM 0 HB3 PRO A 934 3.787 8.612 -2.201 1.00 0.00 H new ATOM 0 HG2 PRO A 934 4.979 7.103 -4.493 1.00 0.00 H new ATOM 0 HG3 PRO A 934 5.367 8.706 -3.901 1.00 0.00 H new ATOM 0 HD2 PRO A 934 7.012 6.639 -3.387 1.00 0.00 H new ATOM 0 HD3 PRO A 934 6.758 7.879 -2.175 1.00 0.00 H new ATOM 586 N GLU A 935 2.187 5.232 -1.157 1.00 0.00 N ATOM 587 CA GLU A 935 1.195 4.163 -1.268 1.00 0.00 C ATOM 588 C GLU A 935 1.727 2.879 -0.640 1.00 0.00 C ATOM 589 O GLU A 935 1.305 1.779 -0.994 1.00 0.00 O ATOM 590 CB GLU A 935 0.799 3.914 -2.728 1.00 0.00 C ATOM 591 CG GLU A 935 0.170 5.122 -3.403 1.00 0.00 C ATOM 592 CD GLU A 935 -0.186 4.859 -4.854 1.00 0.00 C ATOM 593 OE1 GLU A 935 -0.987 3.936 -5.111 1.00 0.00 O ATOM 594 OE2 GLU A 935 0.337 5.577 -5.732 1.00 0.00 O ATOM 0 H GLU A 935 2.020 5.870 -0.378 1.00 0.00 H new ATOM 0 HA GLU A 935 0.303 4.480 -0.729 1.00 0.00 H new ATOM 0 HB2 GLU A 935 1.684 3.614 -3.290 1.00 0.00 H new ATOM 0 HB3 GLU A 935 0.098 3.080 -2.768 1.00 0.00 H new ATOM 0 HG2 GLU A 935 -0.729 5.411 -2.859 1.00 0.00 H new ATOM 0 HG3 GLU A 935 0.860 5.964 -3.349 1.00 0.00 H new ATOM 601 N TYR A 936 2.651 3.036 0.307 1.00 0.00 N ATOM 602 CA TYR A 936 3.243 1.901 1.009 1.00 0.00 C ATOM 603 C TYR A 936 3.576 2.270 2.451 1.00 0.00 C ATOM 604 O TYR A 936 4.129 3.338 2.713 1.00 0.00 O ATOM 605 CB TYR A 936 4.511 1.418 0.304 1.00 0.00 C ATOM 606 CG TYR A 936 4.277 0.954 -1.111 1.00 0.00 C ATOM 607 CD1 TYR A 936 4.298 1.850 -2.170 1.00 0.00 C ATOM 608 CD2 TYR A 936 4.040 -0.384 -1.388 1.00 0.00 C ATOM 609 CE1 TYR A 936 4.087 1.427 -3.465 1.00 0.00 C ATOM 610 CE2 TYR A 936 3.828 -0.818 -2.680 1.00 0.00 C ATOM 611 CZ TYR A 936 3.852 0.091 -3.717 1.00 0.00 C ATOM 612 OH TYR A 936 3.641 -0.336 -5.008 1.00 0.00 O ATOM 0 H TYR A 936 3.007 3.944 0.606 1.00 0.00 H new ATOM 0 HA TYR A 936 2.508 1.096 1.005 1.00 0.00 H new ATOM 0 HB2 TYR A 936 5.242 2.226 0.296 1.00 0.00 H new ATOM 0 HB3 TYR A 936 4.946 0.600 0.878 1.00 0.00 H new ATOM 0 HD1 TYR A 936 4.483 2.896 -1.977 1.00 0.00 H new ATOM 0 HD2 TYR A 936 4.021 -1.098 -0.578 1.00 0.00 H new ATOM 0 HE1 TYR A 936 4.106 2.138 -4.278 1.00 0.00 H new ATOM 0 HE2 TYR A 936 3.644 -1.864 -2.878 1.00 0.00 H new ATOM 0 HH TYR A 936 3.492 -1.305 -5.012 1.00 0.00 H new ATOM 622 N TYR A 937 3.246 1.379 3.380 1.00 0.00 N ATOM 623 CA TYR A 937 3.529 1.619 4.792 1.00 0.00 C ATOM 624 C TYR A 937 4.754 0.827 5.244 1.00 0.00 C ATOM 625 O TYR A 937 4.922 -0.336 4.882 1.00 0.00 O ATOM 626 CB TYR A 937 2.307 1.288 5.663 1.00 0.00 C ATOM 627 CG TYR A 937 1.788 -0.130 5.527 1.00 0.00 C ATOM 628 CD1 TYR A 937 2.502 -1.210 6.034 1.00 0.00 C ATOM 629 CD2 TYR A 937 0.579 -0.385 4.896 1.00 0.00 C ATOM 630 CE1 TYR A 937 2.023 -2.501 5.914 1.00 0.00 C ATOM 631 CE2 TYR A 937 0.094 -1.673 4.771 1.00 0.00 C ATOM 632 CZ TYR A 937 0.820 -2.727 5.281 1.00 0.00 C ATOM 633 OH TYR A 937 0.341 -4.011 5.160 1.00 0.00 O ATOM 0 H TYR A 937 2.786 0.490 3.184 1.00 0.00 H new ATOM 0 HA TYR A 937 3.750 2.679 4.915 1.00 0.00 H new ATOM 0 HB2 TYR A 937 2.565 1.466 6.707 1.00 0.00 H new ATOM 0 HB3 TYR A 937 1.502 1.979 5.411 1.00 0.00 H new ATOM 0 HD1 TYR A 937 3.446 -1.037 6.530 1.00 0.00 H new ATOM 0 HD2 TYR A 937 0.006 0.438 4.495 1.00 0.00 H new ATOM 0 HE1 TYR A 937 2.589 -3.329 6.315 1.00 0.00 H new ATOM 0 HE2 TYR A 937 -0.849 -1.852 4.276 1.00 0.00 H new ATOM 0 HH TYR A 937 -0.519 -3.996 4.690 1.00 0.00 H new ATOM 643 N GLY A 938 5.614 1.470 6.028 1.00 0.00 N ATOM 644 CA GLY A 938 6.814 0.807 6.505 1.00 0.00 C ATOM 645 C GLY A 938 7.905 1.779 6.903 1.00 0.00 C ATOM 646 O GLY A 938 8.053 2.840 6.296 1.00 0.00 O ATOM 0 H GLY A 938 5.502 2.434 6.340 1.00 0.00 H new ATOM 0 HA2 GLY A 938 6.562 0.181 7.361 1.00 0.00 H new ATOM 0 HA3 GLY A 938 7.191 0.144 5.726 1.00 0.00 H new ATOM 650 N ARG A 939 8.677 1.414 7.921 1.00 0.00 N ATOM 651 CA ARG A 939 9.768 2.257 8.393 1.00 0.00 C ATOM 652 C ARG A 939 10.932 2.240 7.407 1.00 0.00 C ATOM 653 O ARG A 939 11.021 1.355 6.556 1.00 0.00 O ATOM 654 CB ARG A 939 10.248 1.798 9.769 1.00 0.00 C ATOM 655 CG ARG A 939 9.228 2.008 10.872 1.00 0.00 C ATOM 656 CD ARG A 939 9.807 1.655 12.229 1.00 0.00 C ATOM 657 NE ARG A 939 10.976 2.469 12.555 1.00 0.00 N ATOM 658 CZ ARG A 939 11.670 2.345 13.683 1.00 0.00 C ATOM 659 NH1 ARG A 939 11.313 1.445 14.590 1.00 0.00 N ATOM 660 NH2 ARG A 939 12.721 3.122 13.905 1.00 0.00 N ATOM 0 H ARG A 939 8.567 0.540 8.435 1.00 0.00 H new ATOM 0 HA ARG A 939 9.392 3.277 8.473 1.00 0.00 H new ATOM 0 HB2 ARG A 939 10.504 0.740 9.720 1.00 0.00 H new ATOM 0 HB3 ARG A 939 11.161 2.336 10.024 1.00 0.00 H new ATOM 0 HG2 ARG A 939 8.899 3.047 10.873 1.00 0.00 H new ATOM 0 HG3 ARG A 939 8.348 1.395 10.679 1.00 0.00 H new ATOM 0 HD2 ARG A 939 9.044 1.793 12.995 1.00 0.00 H new ATOM 0 HD3 ARG A 939 10.084 0.601 12.242 1.00 0.00 H new ATOM 0 HE ARG A 939 11.277 3.172 11.880 1.00 0.00 H new ATOM 0 HH11 ARG A 939 10.505 0.846 14.423 1.00 0.00 H new ATOM 0 HH12 ARG A 939 11.847 1.352 15.454 1.00 0.00 H new ATOM 0 HH21 ARG A 939 12.998 3.816 13.211 1.00 0.00 H new ATOM 0 HH22 ARG A 939 13.252 3.026 14.770 1.00 0.00 H new ATOM 674 N PRO A 940 11.846 3.220 7.511 1.00 0.00 N ATOM 675 CA PRO A 940 13.004 3.307 6.625 1.00 0.00 C ATOM 676 C PRO A 940 14.111 2.338 7.024 1.00 0.00 C ATOM 677 O PRO A 940 14.707 2.468 8.093 1.00 0.00 O ATOM 678 CB PRO A 940 13.466 4.750 6.796 1.00 0.00 C ATOM 679 CG PRO A 940 13.058 5.118 8.181 1.00 0.00 C ATOM 680 CD PRO A 940 11.826 4.310 8.503 1.00 0.00 C ATOM 0 HA PRO A 940 12.756 3.044 5.597 1.00 0.00 H new ATOM 0 HB2 PRO A 940 14.544 4.838 6.665 1.00 0.00 H new ATOM 0 HB3 PRO A 940 13.000 5.405 6.059 1.00 0.00 H new ATOM 0 HG2 PRO A 940 13.858 4.902 8.890 1.00 0.00 H new ATOM 0 HG3 PRO A 940 12.849 6.185 8.251 1.00 0.00 H new ATOM 0 HD2 PRO A 940 11.857 3.923 9.522 1.00 0.00 H new ATOM 0 HD3 PRO A 940 10.921 4.911 8.418 1.00 0.00 H new ATOM 688 N PHE A 941 14.383 1.367 6.158 1.00 0.00 N ATOM 689 CA PHE A 941 15.421 0.380 6.424 1.00 0.00 C ATOM 690 C PHE A 941 16.758 0.830 5.850 1.00 0.00 C ATOM 691 O PHE A 941 16.961 2.014 5.581 1.00 0.00 O ATOM 692 CB PHE A 941 15.016 -0.980 5.846 1.00 0.00 C ATOM 693 CG PHE A 941 14.789 -0.978 4.360 1.00 0.00 C ATOM 694 CD1 PHE A 941 15.845 -1.155 3.481 1.00 0.00 C ATOM 695 CD2 PHE A 941 13.516 -0.797 3.843 1.00 0.00 C ATOM 696 CE1 PHE A 941 15.637 -1.156 2.115 1.00 0.00 C ATOM 697 CE2 PHE A 941 13.301 -0.795 2.477 1.00 0.00 C ATOM 698 CZ PHE A 941 14.362 -0.976 1.612 1.00 0.00 C ATOM 0 H PHE A 941 13.900 1.243 5.268 1.00 0.00 H new ATOM 0 HA PHE A 941 15.535 0.282 7.504 1.00 0.00 H new ATOM 0 HB2 PHE A 941 15.792 -1.708 6.082 1.00 0.00 H new ATOM 0 HB3 PHE A 941 14.104 -1.315 6.341 1.00 0.00 H new ATOM 0 HD1 PHE A 941 16.844 -1.294 3.868 1.00 0.00 H new ATOM 0 HD2 PHE A 941 12.682 -0.656 4.515 1.00 0.00 H new ATOM 0 HE1 PHE A 941 16.469 -1.297 1.441 1.00 0.00 H new ATOM 0 HE2 PHE A 941 12.304 -0.652 2.087 1.00 0.00 H new ATOM 0 HZ PHE A 941 14.196 -0.977 0.545 1.00 0.00 H new ATOM 708 N SER A 942 17.662 -0.122 5.662 1.00 0.00 N ATOM 709 CA SER A 942 18.982 0.171 5.118 1.00 0.00 C ATOM 710 C SER A 942 19.778 -1.111 4.897 1.00 0.00 C ATOM 711 O SER A 942 19.840 -1.973 5.775 1.00 0.00 O ATOM 712 CB SER A 942 19.751 1.103 6.057 1.00 0.00 C ATOM 713 OG SER A 942 19.916 0.517 7.337 1.00 0.00 O ATOM 0 H SER A 942 17.505 -1.106 5.879 1.00 0.00 H new ATOM 0 HA SER A 942 18.846 0.665 4.156 1.00 0.00 H new ATOM 0 HB2 SER A 942 20.728 1.330 5.629 1.00 0.00 H new ATOM 0 HB3 SER A 942 19.217 2.049 6.153 1.00 0.00 H new ATOM 0 HG SER A 942 20.412 1.132 7.917 1.00 0.00 H new ATOM 719 N ILE A 943 20.390 -1.230 3.723 1.00 0.00 N ATOM 720 CA ILE A 943 21.186 -2.405 3.394 1.00 0.00 C ATOM 721 C ILE A 943 22.658 -2.181 3.717 1.00 0.00 C ATOM 722 O ILE A 943 23.013 -1.227 4.409 1.00 0.00 O ATOM 723 CB ILE A 943 21.043 -2.790 1.906 1.00 0.00 C ATOM 724 CG1 ILE A 943 21.266 -1.569 1.007 1.00 0.00 C ATOM 725 CG2 ILE A 943 19.678 -3.407 1.648 1.00 0.00 C ATOM 726 CD1 ILE A 943 21.090 -1.860 -0.471 1.00 0.00 C ATOM 0 H ILE A 943 20.349 -0.527 2.985 1.00 0.00 H new ATOM 0 HA ILE A 943 20.806 -3.223 4.005 1.00 0.00 H new ATOM 0 HB ILE A 943 21.806 -3.530 1.666 1.00 0.00 H new ATOM 0 HG12 ILE A 943 20.570 -0.782 1.299 1.00 0.00 H new ATOM 0 HG13 ILE A 943 22.272 -1.184 1.175 1.00 0.00 H new ATOM 0 HG21 ILE A 943 19.592 -3.673 0.594 1.00 0.00 H new ATOM 0 HG22 ILE A 943 19.562 -4.302 2.259 1.00 0.00 H new ATOM 0 HG23 ILE A 943 18.900 -2.689 1.905 1.00 0.00 H new ATOM 0 HD11 ILE A 943 21.263 -0.949 -1.044 1.00 0.00 H new ATOM 0 HD12 ILE A 943 21.804 -2.624 -0.779 1.00 0.00 H new ATOM 0 HD13 ILE A 943 20.076 -2.216 -0.654 1.00 0.00 H new ATOM 738 N THR A 944 23.509 -3.068 3.212 1.00 0.00 N ATOM 739 CA THR A 944 24.945 -2.980 3.447 1.00 0.00 C ATOM 740 C THR A 944 25.707 -3.902 2.506 1.00 0.00 C ATOM 741 O THR A 944 25.357 -5.069 2.355 1.00 0.00 O ATOM 742 CB THR A 944 25.301 -3.360 4.899 1.00 0.00 C ATOM 743 OG1 THR A 944 24.804 -2.369 5.807 1.00 0.00 O ATOM 744 CG2 THR A 944 26.806 -3.510 5.074 1.00 0.00 C ATOM 0 H THR A 944 23.227 -3.860 2.634 1.00 0.00 H new ATOM 0 HA THR A 944 25.233 -1.945 3.263 1.00 0.00 H new ATOM 0 HB THR A 944 24.832 -4.319 5.119 1.00 0.00 H new ATOM 0 HG1 THR A 944 24.318 -1.681 5.306 1.00 0.00 H new ATOM 0 HG21 THR A 944 27.027 -3.778 6.107 1.00 0.00 H new ATOM 0 HG22 THR A 944 27.173 -4.292 4.410 1.00 0.00 H new ATOM 0 HG23 THR A 944 27.296 -2.567 4.831 1.00 0.00 H new ATOM 752 N CYS A 945 26.754 -3.376 1.882 1.00 0.00 N ATOM 753 CA CYS A 945 27.570 -4.164 0.965 1.00 0.00 C ATOM 754 C CYS A 945 28.444 -5.142 1.730 1.00 0.00 C ATOM 755 O CYS A 945 29.247 -4.751 2.574 1.00 0.00 O ATOM 756 CB CYS A 945 28.427 -3.240 0.097 1.00 0.00 C ATOM 757 SG CYS A 945 29.780 -4.069 -0.796 1.00 0.00 S ATOM 0 H CYS A 945 27.058 -2.409 1.994 1.00 0.00 H new ATOM 0 HA CYS A 945 26.908 -4.738 0.316 1.00 0.00 H new ATOM 0 HB2 CYS A 945 27.782 -2.745 -0.628 1.00 0.00 H new ATOM 0 HB3 CYS A 945 28.852 -2.461 0.730 1.00 0.00 H new ATOM 762 N LEU A 946 28.257 -6.420 1.440 1.00 0.00 N ATOM 763 CA LEU A 946 29.007 -7.468 2.111 1.00 0.00 C ATOM 764 C LEU A 946 30.332 -7.763 1.440 1.00 0.00 C ATOM 765 O LEU A 946 30.654 -7.249 0.369 1.00 0.00 O ATOM 766 CB LEU A 946 28.193 -8.755 2.200 1.00 0.00 C ATOM 767 CG LEU A 946 26.852 -8.625 2.902 1.00 0.00 C ATOM 768 CD1 LEU A 946 27.013 -8.000 4.279 1.00 0.00 C ATOM 769 CD2 LEU A 946 25.915 -7.829 2.047 1.00 0.00 C ATOM 0 H LEU A 946 27.592 -6.756 0.744 1.00 0.00 H new ATOM 0 HA LEU A 946 29.214 -7.092 3.113 1.00 0.00 H new ATOM 0 HB2 LEU A 946 28.022 -9.128 1.190 1.00 0.00 H new ATOM 0 HB3 LEU A 946 28.787 -9.506 2.721 1.00 0.00 H new ATOM 0 HG LEU A 946 26.431 -9.619 3.050 1.00 0.00 H new ATOM 0 HD11 LEU A 946 26.037 -7.919 4.758 1.00 0.00 H new ATOM 0 HD12 LEU A 946 27.666 -8.625 4.888 1.00 0.00 H new ATOM 0 HD13 LEU A 946 27.451 -7.007 4.179 1.00 0.00 H new ATOM 0 HD21 LEU A 946 24.953 -7.736 2.551 1.00 0.00 H new ATOM 0 HD22 LEU A 946 26.333 -6.837 1.876 1.00 0.00 H new ATOM 0 HD23 LEU A 946 25.777 -8.334 1.091 1.00 0.00 H new ATOM 781 N ASP A 947 31.076 -8.624 2.104 1.00 0.00 N ATOM 782 CA ASP A 947 32.376 -9.076 1.657 1.00 0.00 C ATOM 783 C ASP A 947 32.328 -9.663 0.247 1.00 0.00 C ATOM 784 O ASP A 947 33.217 -9.416 -0.569 1.00 0.00 O ATOM 785 CB ASP A 947 32.871 -10.126 2.640 1.00 0.00 C ATOM 786 CG ASP A 947 34.281 -10.599 2.345 1.00 0.00 C ATOM 787 OD1 ASP A 947 34.503 -11.160 1.251 1.00 0.00 O ATOM 788 OD2 ASP A 947 35.164 -10.408 3.207 1.00 0.00 O ATOM 0 H ASP A 947 30.786 -9.038 2.990 1.00 0.00 H new ATOM 0 HA ASP A 947 33.053 -8.222 1.621 1.00 0.00 H new ATOM 0 HB2 ASP A 947 32.835 -9.716 3.649 1.00 0.00 H new ATOM 0 HB3 ASP A 947 32.196 -10.981 2.620 1.00 0.00 H new ATOM 793 N ASN A 948 31.299 -10.463 -0.022 1.00 0.00 N ATOM 794 CA ASN A 948 31.154 -11.113 -1.322 1.00 0.00 C ATOM 795 C ASN A 948 30.475 -10.197 -2.337 1.00 0.00 C ATOM 796 O ASN A 948 29.730 -10.655 -3.203 1.00 0.00 O ATOM 797 CB ASN A 948 30.355 -12.410 -1.168 1.00 0.00 C ATOM 798 CG ASN A 948 30.276 -13.205 -2.456 1.00 0.00 C ATOM 799 OD1 ASN A 948 31.294 -13.630 -3.002 1.00 0.00 O ATOM 800 ND2 ASN A 948 29.060 -13.407 -2.952 1.00 0.00 N ATOM 0 H ASN A 948 30.554 -10.676 0.642 1.00 0.00 H new ATOM 0 HA ASN A 948 32.152 -11.341 -1.697 1.00 0.00 H new ATOM 0 HB2 ASN A 948 30.814 -13.025 -0.394 1.00 0.00 H new ATOM 0 HB3 ASN A 948 29.346 -12.173 -0.830 1.00 0.00 H new ATOM 0 HD21 ASN A 948 28.943 -13.933 -3.818 1.00 0.00 H new ATOM 0 HD22 ASN A 948 28.243 -13.037 -2.466 1.00 0.00 H new ATOM 807 N LEU A 949 30.759 -8.902 -2.239 1.00 0.00 N ATOM 808 CA LEU A 949 30.198 -7.920 -3.160 1.00 0.00 C ATOM 809 C LEU A 949 28.700 -8.121 -3.359 1.00 0.00 C ATOM 810 O LEU A 949 28.236 -8.354 -4.476 1.00 0.00 O ATOM 811 CB LEU A 949 30.918 -7.993 -4.503 1.00 0.00 C ATOM 812 CG LEU A 949 32.431 -7.787 -4.426 1.00 0.00 C ATOM 813 CD1 LEU A 949 33.065 -7.944 -5.800 1.00 0.00 C ATOM 814 CD2 LEU A 949 32.752 -6.421 -3.842 1.00 0.00 C ATOM 0 H LEU A 949 31.376 -8.508 -1.529 1.00 0.00 H new ATOM 0 HA LEU A 949 30.344 -6.933 -2.721 1.00 0.00 H new ATOM 0 HB2 LEU A 949 30.719 -8.965 -4.954 1.00 0.00 H new ATOM 0 HB3 LEU A 949 30.495 -7.240 -5.168 1.00 0.00 H new ATOM 0 HG LEU A 949 32.849 -8.550 -3.769 1.00 0.00 H new ATOM 0 HD11 LEU A 949 34.142 -7.794 -5.723 1.00 0.00 H new ATOM 0 HD12 LEU A 949 32.865 -8.945 -6.181 1.00 0.00 H new ATOM 0 HD13 LEU A 949 32.643 -7.206 -6.482 1.00 0.00 H new ATOM 0 HD21 LEU A 949 33.833 -6.291 -3.794 1.00 0.00 H new ATOM 0 HD22 LEU A 949 32.320 -5.645 -4.474 1.00 0.00 H new ATOM 0 HD23 LEU A 949 32.333 -6.347 -2.839 1.00 0.00 H new ATOM 826 N VAL A 950 27.948 -8.035 -2.270 1.00 0.00 N ATOM 827 CA VAL A 950 26.504 -8.211 -2.323 1.00 0.00 C ATOM 828 C VAL A 950 25.788 -7.196 -1.442 1.00 0.00 C ATOM 829 O VAL A 950 26.334 -6.144 -1.111 1.00 0.00 O ATOM 830 CB VAL A 950 26.116 -9.625 -1.865 1.00 0.00 C ATOM 831 CG1 VAL A 950 26.555 -10.659 -2.882 1.00 0.00 C ATOM 832 CG2 VAL A 950 26.729 -9.921 -0.511 1.00 0.00 C ATOM 0 H VAL A 950 28.315 -7.844 -1.338 1.00 0.00 H new ATOM 0 HA VAL A 950 26.199 -8.060 -3.358 1.00 0.00 H new ATOM 0 HB VAL A 950 25.031 -9.674 -1.778 1.00 0.00 H new ATOM 0 HG11 VAL A 950 26.270 -11.653 -2.537 1.00 0.00 H new ATOM 0 HG12 VAL A 950 26.074 -10.455 -3.839 1.00 0.00 H new ATOM 0 HG13 VAL A 950 27.637 -10.614 -3.003 1.00 0.00 H new ATOM 0 HG21 VAL A 950 26.447 -10.926 -0.196 1.00 0.00 H new ATOM 0 HG22 VAL A 950 27.815 -9.853 -0.580 1.00 0.00 H new ATOM 0 HG23 VAL A 950 26.366 -9.197 0.219 1.00 0.00 H new ATOM 842 N TRP A 951 24.568 -7.536 -1.051 1.00 0.00 N ATOM 843 CA TRP A 951 23.766 -6.672 -0.194 1.00 0.00 C ATOM 844 C TRP A 951 22.850 -7.510 0.684 1.00 0.00 C ATOM 845 O TRP A 951 21.967 -8.213 0.194 1.00 0.00 O ATOM 846 CB TRP A 951 22.926 -5.691 -1.024 1.00 0.00 C ATOM 847 CG TRP A 951 23.748 -4.728 -1.830 1.00 0.00 C ATOM 848 CD1 TRP A 951 24.150 -4.871 -3.129 1.00 0.00 C ATOM 849 CD2 TRP A 951 24.289 -3.481 -1.381 1.00 0.00 C ATOM 850 NE1 TRP A 951 24.893 -3.781 -3.520 1.00 0.00 N ATOM 851 CE2 TRP A 951 24.995 -2.915 -2.462 1.00 0.00 C ATOM 852 CE3 TRP A 951 24.241 -2.785 -0.171 1.00 0.00 C ATOM 853 CZ2 TRP A 951 25.645 -1.687 -2.363 1.00 0.00 C ATOM 854 CZ3 TRP A 951 24.886 -1.568 -0.075 1.00 0.00 C ATOM 855 CH2 TRP A 951 25.580 -1.028 -1.166 1.00 0.00 C ATOM 0 H TRP A 951 24.110 -8.408 -1.315 1.00 0.00 H new ATOM 0 HA TRP A 951 24.448 -6.098 0.433 1.00 0.00 H new ATOM 0 HB2 TRP A 951 22.281 -6.257 -1.697 1.00 0.00 H new ATOM 0 HB3 TRP A 951 22.274 -5.128 -0.356 1.00 0.00 H new ATOM 0 HD1 TRP A 951 23.918 -5.718 -3.758 1.00 0.00 H new ATOM 0 HE1 TRP A 951 25.301 -3.640 -4.444 1.00 0.00 H new ATOM 0 HE3 TRP A 951 23.708 -3.192 0.676 1.00 0.00 H new ATOM 0 HZ2 TRP A 951 26.182 -1.270 -3.202 1.00 0.00 H new ATOM 0 HZ3 TRP A 951 24.855 -1.023 0.857 1.00 0.00 H new ATOM 0 HH2 TRP A 951 26.073 -0.073 -1.060 1.00 0.00 H new ATOM 866 N SER A 952 23.080 -7.428 1.988 1.00 0.00 N ATOM 867 CA SER A 952 22.294 -8.172 2.957 1.00 0.00 C ATOM 868 C SER A 952 20.809 -7.932 2.739 1.00 0.00 C ATOM 869 O SER A 952 20.398 -6.852 2.314 1.00 0.00 O ATOM 870 CB SER A 952 22.693 -7.780 4.382 1.00 0.00 C ATOM 871 OG SER A 952 24.019 -8.186 4.669 1.00 0.00 O ATOM 0 H SER A 952 23.811 -6.848 2.399 1.00 0.00 H new ATOM 0 HA SER A 952 22.495 -9.234 2.819 1.00 0.00 H new ATOM 0 HB2 SER A 952 22.605 -6.700 4.504 1.00 0.00 H new ATOM 0 HB3 SER A 952 22.007 -8.238 5.094 1.00 0.00 H new ATOM 0 HG SER A 952 24.240 -7.951 5.594 1.00 0.00 H new ATOM 877 N SER A 953 20.009 -8.947 3.025 1.00 0.00 N ATOM 878 CA SER A 953 18.571 -8.851 2.850 1.00 0.00 C ATOM 879 C SER A 953 17.949 -8.071 4.000 1.00 0.00 C ATOM 880 O SER A 953 18.118 -8.423 5.168 1.00 0.00 O ATOM 881 CB SER A 953 17.967 -10.248 2.774 1.00 0.00 C ATOM 882 OG SER A 953 16.563 -10.193 2.591 1.00 0.00 O ATOM 0 H SER A 953 20.333 -9.847 3.380 1.00 0.00 H new ATOM 0 HA SER A 953 18.362 -8.321 1.920 1.00 0.00 H new ATOM 0 HB2 SER A 953 18.422 -10.799 1.951 1.00 0.00 H new ATOM 0 HB3 SER A 953 18.195 -10.795 3.688 1.00 0.00 H new ATOM 0 HG SER A 953 16.203 -11.103 2.544 1.00 0.00 H new ATOM 888 N PRO A 954 17.229 -6.981 3.683 1.00 0.00 N ATOM 889 CA PRO A 954 16.594 -6.132 4.686 1.00 0.00 C ATOM 890 C PRO A 954 15.306 -6.728 5.234 1.00 0.00 C ATOM 891 O PRO A 954 14.424 -6.004 5.697 1.00 0.00 O ATOM 892 CB PRO A 954 16.309 -4.822 3.928 1.00 0.00 C ATOM 893 CG PRO A 954 16.882 -5.001 2.553 1.00 0.00 C ATOM 894 CD PRO A 954 16.993 -6.478 2.329 1.00 0.00 C ATOM 0 HA PRO A 954 17.231 -6.001 5.561 1.00 0.00 H new ATOM 0 HB2 PRO A 954 15.238 -4.625 3.881 1.00 0.00 H new ATOM 0 HB3 PRO A 954 16.768 -3.972 4.433 1.00 0.00 H new ATOM 0 HG2 PRO A 954 16.239 -4.542 1.802 1.00 0.00 H new ATOM 0 HG3 PRO A 954 17.858 -4.522 2.474 1.00 0.00 H new ATOM 0 HD2 PRO A 954 16.084 -6.893 1.894 1.00 0.00 H new ATOM 0 HD3 PRO A 954 17.812 -6.727 1.654 1.00 0.00 H new ATOM 902 N LYS A 955 15.221 -8.051 5.195 1.00 0.00 N ATOM 903 CA LYS A 955 14.053 -8.769 5.704 1.00 0.00 C ATOM 904 C LYS A 955 12.754 -8.059 5.361 1.00 0.00 C ATOM 905 O LYS A 955 12.607 -7.476 4.286 1.00 0.00 O ATOM 906 CB LYS A 955 14.169 -8.958 7.218 1.00 0.00 C ATOM 907 CG LYS A 955 14.981 -10.178 7.611 1.00 0.00 C ATOM 908 CD LYS A 955 15.143 -10.297 9.122 1.00 0.00 C ATOM 909 CE LYS A 955 16.022 -9.191 9.695 1.00 0.00 C ATOM 910 NZ LYS A 955 15.394 -7.847 9.571 1.00 0.00 N ATOM 0 H LYS A 955 15.950 -8.654 4.814 1.00 0.00 H new ATOM 0 HA LYS A 955 14.030 -9.744 5.218 1.00 0.00 H new ATOM 0 HB2 LYS A 955 14.627 -8.070 7.654 1.00 0.00 H new ATOM 0 HB3 LYS A 955 13.169 -9.043 7.644 1.00 0.00 H new ATOM 0 HG2 LYS A 955 14.495 -11.075 7.227 1.00 0.00 H new ATOM 0 HG3 LYS A 955 15.965 -10.124 7.145 1.00 0.00 H new ATOM 0 HD2 LYS A 955 14.162 -10.261 9.595 1.00 0.00 H new ATOM 0 HD3 LYS A 955 15.578 -11.267 9.364 1.00 0.00 H new ATOM 0 HE2 LYS A 955 16.225 -9.399 10.746 1.00 0.00 H new ATOM 0 HE3 LYS A 955 16.982 -9.190 9.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 955 15.686 -7.252 10.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 955 15.698 -7.402 8.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 955 14.359 -7.946 9.572 1.00 0.00 H new ATOM 924 N ASP A 956 11.816 -8.120 6.291 1.00 0.00 N ATOM 925 CA ASP A 956 10.518 -7.494 6.119 1.00 0.00 C ATOM 926 C ASP A 956 10.618 -5.999 6.398 1.00 0.00 C ATOM 927 O ASP A 956 11.243 -5.582 7.372 1.00 0.00 O ATOM 928 CB ASP A 956 9.506 -8.143 7.061 1.00 0.00 C ATOM 929 CG ASP A 956 8.089 -7.685 6.791 1.00 0.00 C ATOM 930 OD1 ASP A 956 7.897 -6.865 5.869 1.00 0.00 O ATOM 931 OD2 ASP A 956 7.169 -8.145 7.501 1.00 0.00 O ATOM 0 H ASP A 956 11.933 -8.603 7.182 1.00 0.00 H new ATOM 0 HA ASP A 956 10.185 -7.634 5.091 1.00 0.00 H new ATOM 0 HB2 ASP A 956 9.560 -9.227 6.957 1.00 0.00 H new ATOM 0 HB3 ASP A 956 9.771 -7.908 8.092 1.00 0.00 H new ATOM 936 N VAL A 957 10.022 -5.196 5.522 1.00 0.00 N ATOM 937 CA VAL A 957 10.075 -3.744 5.663 1.00 0.00 C ATOM 938 C VAL A 957 8.841 -3.052 5.074 1.00 0.00 C ATOM 939 O VAL A 957 7.804 -2.959 5.732 1.00 0.00 O ATOM 940 CB VAL A 957 11.351 -3.187 5.002 1.00 0.00 C ATOM 941 CG1 VAL A 957 12.551 -3.370 5.918 1.00 0.00 C ATOM 942 CG2 VAL A 957 11.591 -3.859 3.657 1.00 0.00 C ATOM 0 H VAL A 957 9.499 -5.524 4.710 1.00 0.00 H new ATOM 0 HA VAL A 957 10.091 -3.531 6.732 1.00 0.00 H new ATOM 0 HB VAL A 957 11.214 -2.119 4.831 1.00 0.00 H new ATOM 0 HG11 VAL A 957 13.442 -2.971 5.434 1.00 0.00 H new ATOM 0 HG12 VAL A 957 12.378 -2.840 6.854 1.00 0.00 H new ATOM 0 HG13 VAL A 957 12.694 -4.431 6.123 1.00 0.00 H new ATOM 0 HG21 VAL A 957 12.496 -3.454 3.204 1.00 0.00 H new ATOM 0 HG22 VAL A 957 11.708 -4.933 3.802 1.00 0.00 H new ATOM 0 HG23 VAL A 957 10.742 -3.672 3.000 1.00 0.00 H new ATOM 952 N CYS A 958 8.963 -2.546 3.850 1.00 0.00 N ATOM 953 CA CYS A 958 7.866 -1.841 3.193 1.00 0.00 C ATOM 954 C CYS A 958 6.821 -2.814 2.659 1.00 0.00 C ATOM 955 O CYS A 958 7.143 -3.930 2.252 1.00 0.00 O ATOM 956 CB CYS A 958 8.400 -0.980 2.045 1.00 0.00 C ATOM 957 SG CYS A 958 9.662 0.239 2.542 1.00 0.00 S ATOM 0 H CYS A 958 9.814 -2.611 3.291 1.00 0.00 H new ATOM 0 HA CYS A 958 7.391 -1.201 3.937 1.00 0.00 H new ATOM 0 HB2 CYS A 958 8.824 -1.634 1.283 1.00 0.00 H new ATOM 0 HB3 CYS A 958 7.565 -0.453 1.583 1.00 0.00 H new ATOM 962 N LYS A 959 5.563 -2.378 2.669 1.00 0.00 N ATOM 963 CA LYS A 959 4.456 -3.201 2.191 1.00 0.00 C ATOM 964 C LYS A 959 3.394 -2.351 1.508 1.00 0.00 C ATOM 965 O LYS A 959 3.295 -1.146 1.747 1.00 0.00 O ATOM 966 CB LYS A 959 3.831 -3.979 3.346 1.00 0.00 C ATOM 967 CG LYS A 959 4.752 -5.035 3.926 1.00 0.00 C ATOM 968 CD LYS A 959 4.103 -5.758 5.090 1.00 0.00 C ATOM 969 CE LYS A 959 5.008 -6.850 5.625 1.00 0.00 C ATOM 970 NZ LYS A 959 5.213 -7.940 4.630 1.00 0.00 N ATOM 0 H LYS A 959 5.285 -1.456 3.004 1.00 0.00 H new ATOM 0 HA LYS A 959 4.857 -3.904 1.461 1.00 0.00 H new ATOM 0 HB2 LYS A 959 3.548 -3.281 4.134 1.00 0.00 H new ATOM 0 HB3 LYS A 959 2.915 -4.457 2.999 1.00 0.00 H new ATOM 0 HG2 LYS A 959 5.016 -5.754 3.151 1.00 0.00 H new ATOM 0 HG3 LYS A 959 5.680 -4.568 4.257 1.00 0.00 H new ATOM 0 HD2 LYS A 959 3.877 -5.046 5.884 1.00 0.00 H new ATOM 0 HD3 LYS A 959 3.155 -6.191 4.771 1.00 0.00 H new ATOM 0 HE2 LYS A 959 5.972 -6.421 5.897 1.00 0.00 H new ATOM 0 HE3 LYS A 959 4.576 -7.266 6.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 5.647 -8.761 5.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 4.296 -8.217 4.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 5.839 -7.604 3.871 1.00 0.00 H new ATOM 984 N ARG A 960 2.610 -2.988 0.647 1.00 0.00 N ATOM 985 CA ARG A 960 1.557 -2.299 -0.091 1.00 0.00 C ATOM 986 C ARG A 960 0.542 -1.675 0.865 1.00 0.00 C ATOM 987 O ARG A 960 -0.163 -2.384 1.584 1.00 0.00 O ATOM 988 CB ARG A 960 0.850 -3.276 -1.035 1.00 0.00 C ATOM 989 CG ARG A 960 0.419 -2.658 -2.357 1.00 0.00 C ATOM 990 CD ARG A 960 -0.627 -1.572 -2.166 1.00 0.00 C ATOM 991 NE ARG A 960 -1.004 -0.950 -3.435 1.00 0.00 N ATOM 992 CZ ARG A 960 -1.562 -1.611 -4.446 1.00 0.00 C ATOM 993 NH1 ARG A 960 -1.837 -2.903 -4.332 1.00 0.00 N ATOM 994 NH2 ARG A 960 -1.851 -0.976 -5.575 1.00 0.00 N ATOM 0 H ARG A 960 2.684 -3.984 0.442 1.00 0.00 H new ATOM 0 HA ARG A 960 2.016 -1.502 -0.676 1.00 0.00 H new ATOM 0 HB2 ARG A 960 1.516 -4.115 -1.238 1.00 0.00 H new ATOM 0 HB3 ARG A 960 -0.028 -3.680 -0.531 1.00 0.00 H new ATOM 0 HG2 ARG A 960 1.289 -2.238 -2.861 1.00 0.00 H new ATOM 0 HG3 ARG A 960 0.019 -3.436 -3.007 1.00 0.00 H new ATOM 0 HD2 ARG A 960 -1.512 -1.999 -1.694 1.00 0.00 H new ATOM 0 HD3 ARG A 960 -0.240 -0.810 -1.489 1.00 0.00 H new ATOM 0 HE ARG A 960 -0.829 0.048 -3.552 1.00 0.00 H new ATOM 0 HH11 ARG A 960 -1.621 -3.396 -3.466 1.00 0.00 H new ATOM 0 HH12 ARG A 960 -2.265 -3.404 -5.111 1.00 0.00 H new ATOM 0 HH21 ARG A 960 -1.645 0.019 -5.668 1.00 0.00 H new ATOM 0 HH22 ARG A 960 -2.279 -1.483 -6.350 1.00 0.00 H new ATOM 1008 N LYS A 961 0.470 -0.347 0.863 1.00 0.00 N ATOM 1009 CA LYS A 961 -0.465 0.374 1.723 1.00 0.00 C ATOM 1010 C LYS A 961 -1.893 -0.097 1.474 1.00 0.00 C ATOM 1011 O LYS A 961 -2.228 -0.519 0.368 1.00 0.00 O ATOM 1012 CB LYS A 961 -0.358 1.882 1.490 1.00 0.00 C ATOM 1013 CG LYS A 961 -1.223 2.707 2.429 1.00 0.00 C ATOM 1014 CD LYS A 961 -1.057 4.200 2.181 1.00 0.00 C ATOM 1015 CE LYS A 961 0.368 4.660 2.447 1.00 0.00 C ATOM 1016 NZ LYS A 961 0.797 4.364 3.841 1.00 0.00 N ATOM 0 H LYS A 961 1.048 0.253 0.275 1.00 0.00 H new ATOM 0 HA LYS A 961 -0.205 0.164 2.760 1.00 0.00 H new ATOM 0 HB2 LYS A 961 0.682 2.186 1.607 1.00 0.00 H new ATOM 0 HB3 LYS A 961 -0.641 2.103 0.461 1.00 0.00 H new ATOM 0 HG2 LYS A 961 -2.269 2.430 2.298 1.00 0.00 H new ATOM 0 HG3 LYS A 961 -0.960 2.478 3.462 1.00 0.00 H new ATOM 0 HD2 LYS A 961 -1.327 4.430 1.150 1.00 0.00 H new ATOM 0 HD3 LYS A 961 -1.744 4.754 2.821 1.00 0.00 H new ATOM 0 HE2 LYS A 961 1.044 4.169 1.747 1.00 0.00 H new ATOM 0 HE3 LYS A 961 0.443 5.732 2.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 961 1.381 5.147 4.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 961 -0.042 4.253 4.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 961 1.352 3.485 3.854 1.00 0.00 H new ATOM 1030 N SER A 962 -2.729 -0.029 2.503 1.00 0.00 N ATOM 1031 CA SER A 962 -4.116 -0.458 2.382 1.00 0.00 C ATOM 1032 C SER A 962 -5.043 0.417 3.217 1.00 0.00 C ATOM 1033 O SER A 962 -4.708 0.809 4.334 1.00 0.00 O ATOM 1034 CB SER A 962 -4.258 -1.918 2.815 1.00 0.00 C ATOM 1035 OG SER A 962 -3.872 -2.090 4.168 1.00 0.00 O ATOM 0 H SER A 962 -2.472 0.318 3.427 1.00 0.00 H new ATOM 0 HA SER A 962 -4.403 -0.360 1.335 1.00 0.00 H new ATOM 0 HB2 SER A 962 -5.291 -2.240 2.685 1.00 0.00 H new ATOM 0 HB3 SER A 962 -3.644 -2.551 2.175 1.00 0.00 H new ATOM 0 HG SER A 962 -3.974 -3.032 4.420 1.00 0.00 H new ATOM 1041 N CYS A 963 -6.217 0.709 2.665 1.00 0.00 N ATOM 1042 CA CYS A 963 -7.207 1.527 3.353 1.00 0.00 C ATOM 1043 C CYS A 963 -7.967 0.686 4.371 1.00 0.00 C ATOM 1044 O CYS A 963 -8.116 -0.524 4.198 1.00 0.00 O ATOM 1045 CB CYS A 963 -8.194 2.133 2.350 1.00 0.00 C ATOM 1046 SG CYS A 963 -7.432 3.210 1.093 1.00 0.00 S ATOM 0 H CYS A 963 -6.505 0.390 1.740 1.00 0.00 H new ATOM 0 HA CYS A 963 -6.686 2.334 3.869 1.00 0.00 H new ATOM 0 HB2 CYS A 963 -8.721 1.324 1.845 1.00 0.00 H new ATOM 0 HB3 CYS A 963 -8.941 2.708 2.897 1.00 0.00 H new ATOM 1051 N LYS A 964 -8.446 1.326 5.432 1.00 0.00 N ATOM 1052 CA LYS A 964 -9.188 0.618 6.466 1.00 0.00 C ATOM 1053 C LYS A 964 -10.497 0.085 5.898 1.00 0.00 C ATOM 1054 O LYS A 964 -11.238 0.813 5.238 1.00 0.00 O ATOM 1055 CB LYS A 964 -9.471 1.543 7.651 1.00 0.00 C ATOM 1056 CG LYS A 964 -10.237 0.870 8.779 1.00 0.00 C ATOM 1057 CD LYS A 964 -10.516 1.838 9.917 1.00 0.00 C ATOM 1058 CE LYS A 964 -11.294 1.169 11.039 1.00 0.00 C ATOM 1059 NZ LYS A 964 -11.580 2.112 12.155 1.00 0.00 N ATOM 0 H LYS A 964 -8.335 2.326 5.597 1.00 0.00 H new ATOM 0 HA LYS A 964 -8.583 -0.219 6.814 1.00 0.00 H new ATOM 0 HB2 LYS A 964 -8.526 1.921 8.040 1.00 0.00 H new ATOM 0 HB3 LYS A 964 -10.039 2.405 7.301 1.00 0.00 H new ATOM 0 HG2 LYS A 964 -11.178 0.475 8.396 1.00 0.00 H new ATOM 0 HG3 LYS A 964 -9.664 0.021 9.154 1.00 0.00 H new ATOM 0 HD2 LYS A 964 -9.574 2.225 10.306 1.00 0.00 H new ATOM 0 HD3 LYS A 964 -11.080 2.691 9.540 1.00 0.00 H new ATOM 0 HE2 LYS A 964 -12.232 0.776 10.646 1.00 0.00 H new ATOM 0 HE3 LYS A 964 -10.726 0.319 11.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 964 -12.112 1.618 12.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 964 -10.685 2.468 12.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 964 -12.144 2.910 11.799 1.00 0.00 H new ATOM 1073 N THR A 965 -10.770 -1.191 6.148 1.00 0.00 N ATOM 1074 CA THR A 965 -11.984 -1.819 5.648 1.00 0.00 C ATOM 1075 C THR A 965 -13.222 -1.051 6.098 1.00 0.00 C ATOM 1076 O THR A 965 -13.444 -0.863 7.295 1.00 0.00 O ATOM 1077 CB THR A 965 -12.105 -3.277 6.127 1.00 0.00 C ATOM 1078 OG1 THR A 965 -10.908 -3.999 5.813 1.00 0.00 O ATOM 1079 CG2 THR A 965 -13.297 -3.963 5.475 1.00 0.00 C ATOM 0 H THR A 965 -10.168 -1.808 6.693 1.00 0.00 H new ATOM 0 HA THR A 965 -11.919 -1.805 4.560 1.00 0.00 H new ATOM 0 HB THR A 965 -12.252 -3.268 7.207 1.00 0.00 H new ATOM 0 HG1 THR A 965 -10.994 -4.925 6.123 1.00 0.00 H new ATOM 0 HG21 THR A 965 -13.363 -4.992 5.828 1.00 0.00 H new ATOM 0 HG22 THR A 965 -14.211 -3.430 5.737 1.00 0.00 H new ATOM 0 HG23 THR A 965 -13.172 -3.958 4.392 1.00 0.00 H new ATOM 1087 N PRO A 966 -14.052 -0.602 5.142 1.00 0.00 N ATOM 1088 CA PRO A 966 -15.276 0.140 5.450 1.00 0.00 C ATOM 1089 C PRO A 966 -16.326 -0.749 6.104 1.00 0.00 C ATOM 1090 O PRO A 966 -16.568 -1.868 5.648 1.00 0.00 O ATOM 1091 CB PRO A 966 -15.758 0.612 4.077 1.00 0.00 C ATOM 1092 CG PRO A 966 -15.199 -0.385 3.123 1.00 0.00 C ATOM 1093 CD PRO A 966 -13.869 -0.790 3.690 1.00 0.00 C ATOM 0 HA PRO A 966 -15.101 0.953 6.155 1.00 0.00 H new ATOM 0 HB2 PRO A 966 -16.846 0.642 4.027 1.00 0.00 H new ATOM 0 HB3 PRO A 966 -15.401 1.618 3.855 1.00 0.00 H new ATOM 0 HG2 PRO A 966 -15.861 -1.246 3.024 1.00 0.00 H new ATOM 0 HG3 PRO A 966 -15.086 0.046 2.128 1.00 0.00 H new ATOM 0 HD2 PRO A 966 -13.624 -1.824 3.445 1.00 0.00 H new ATOM 0 HD3 PRO A 966 -13.060 -0.171 3.302 1.00 0.00 H new ATOM 1101 N PRO A 967 -16.972 -0.270 7.181 1.00 0.00 N ATOM 1102 CA PRO A 967 -17.999 -1.045 7.879 1.00 0.00 C ATOM 1103 C PRO A 967 -19.085 -1.519 6.922 1.00 0.00 C ATOM 1104 O PRO A 967 -19.694 -0.715 6.215 1.00 0.00 O ATOM 1105 CB PRO A 967 -18.570 -0.051 8.894 1.00 0.00 C ATOM 1106 CG PRO A 967 -17.477 0.938 9.112 1.00 0.00 C ATOM 1107 CD PRO A 967 -16.756 1.051 7.798 1.00 0.00 C ATOM 0 HA PRO A 967 -17.599 -1.948 8.340 1.00 0.00 H new ATOM 0 HB2 PRO A 967 -19.470 0.431 8.513 1.00 0.00 H new ATOM 0 HB3 PRO A 967 -18.845 -0.549 9.824 1.00 0.00 H new ATOM 0 HG2 PRO A 967 -17.879 1.903 9.421 1.00 0.00 H new ATOM 0 HG3 PRO A 967 -16.802 0.606 9.901 1.00 0.00 H new ATOM 0 HD2 PRO A 967 -17.163 1.854 7.183 1.00 0.00 H new ATOM 0 HD3 PRO A 967 -15.696 1.262 7.937 1.00 0.00 H new ATOM 1115 N ASP A 968 -19.317 -2.827 6.896 1.00 0.00 N ATOM 1116 CA ASP A 968 -20.323 -3.399 6.013 1.00 0.00 C ATOM 1117 C ASP A 968 -21.696 -2.796 6.294 1.00 0.00 C ATOM 1118 O ASP A 968 -22.193 -2.863 7.418 1.00 0.00 O ATOM 1119 CB ASP A 968 -20.373 -4.919 6.177 1.00 0.00 C ATOM 1120 CG ASP A 968 -19.050 -5.581 5.844 1.00 0.00 C ATOM 1121 OD1 ASP A 968 -18.586 -5.435 4.694 1.00 0.00 O ATOM 1122 OD2 ASP A 968 -18.478 -6.245 6.734 1.00 0.00 O ATOM 0 H ASP A 968 -18.824 -3.507 7.474 1.00 0.00 H new ATOM 0 HA ASP A 968 -20.047 -3.164 4.985 1.00 0.00 H new ATOM 0 HB2 ASP A 968 -20.649 -5.162 7.203 1.00 0.00 H new ATOM 0 HB3 ASP A 968 -21.152 -5.326 5.532 1.00 0.00 H new ATOM 1127 N PRO A 969 -22.330 -2.199 5.269 1.00 0.00 N ATOM 1128 CA PRO A 969 -23.653 -1.582 5.412 1.00 0.00 C ATOM 1129 C PRO A 969 -24.702 -2.581 5.863 1.00 0.00 C ATOM 1130 O PRO A 969 -24.737 -3.719 5.396 1.00 0.00 O ATOM 1131 CB PRO A 969 -23.973 -1.067 4.004 1.00 0.00 C ATOM 1132 CG PRO A 969 -22.654 -0.975 3.316 1.00 0.00 C ATOM 1133 CD PRO A 969 -21.811 -2.073 3.897 1.00 0.00 C ATOM 0 HA PRO A 969 -23.655 -0.798 6.170 1.00 0.00 H new ATOM 0 HB2 PRO A 969 -24.645 -1.746 3.479 1.00 0.00 H new ATOM 0 HB3 PRO A 969 -24.467 -0.096 4.042 1.00 0.00 H new ATOM 0 HG2 PRO A 969 -22.766 -1.097 2.239 1.00 0.00 H new ATOM 0 HG3 PRO A 969 -22.194 -0.000 3.481 1.00 0.00 H new ATOM 0 HD2 PRO A 969 -21.918 -3.003 3.338 1.00 0.00 H new ATOM 0 HD3 PRO A 969 -20.752 -1.816 3.888 1.00 0.00 H new ATOM 1141 N VAL A 970 -25.555 -2.142 6.777 1.00 0.00 N ATOM 1142 CA VAL A 970 -26.608 -2.977 7.305 1.00 0.00 C ATOM 1143 C VAL A 970 -27.435 -3.578 6.176 1.00 0.00 C ATOM 1144 O VAL A 970 -27.864 -2.869 5.268 1.00 0.00 O ATOM 1145 CB VAL A 970 -27.522 -2.163 8.229 1.00 0.00 C ATOM 1146 CG1 VAL A 970 -28.499 -3.075 8.926 1.00 0.00 C ATOM 1147 CG2 VAL A 970 -26.699 -1.375 9.239 1.00 0.00 C ATOM 0 H VAL A 970 -25.532 -1.200 7.168 1.00 0.00 H new ATOM 0 HA VAL A 970 -26.146 -3.783 7.874 1.00 0.00 H new ATOM 0 HB VAL A 970 -28.085 -1.450 7.626 1.00 0.00 H new ATOM 0 HG11 VAL A 970 -29.143 -2.487 9.580 1.00 0.00 H new ATOM 0 HG12 VAL A 970 -29.109 -3.590 8.184 1.00 0.00 H new ATOM 0 HG13 VAL A 970 -27.953 -3.808 9.519 1.00 0.00 H new ATOM 0 HG21 VAL A 970 -27.366 -0.804 9.885 1.00 0.00 H new ATOM 0 HG22 VAL A 970 -26.109 -2.064 9.844 1.00 0.00 H new ATOM 0 HG23 VAL A 970 -26.032 -0.692 8.712 1.00 0.00 H new ATOM 1157 N ASN A 971 -27.642 -4.890 6.236 1.00 0.00 N ATOM 1158 CA ASN A 971 -28.408 -5.600 5.216 1.00 0.00 C ATOM 1159 C ASN A 971 -27.632 -5.659 3.905 1.00 0.00 C ATOM 1160 O ASN A 971 -28.215 -5.566 2.824 1.00 0.00 O ATOM 1161 CB ASN A 971 -29.757 -4.919 4.977 1.00 0.00 C ATOM 1162 CG ASN A 971 -30.551 -4.729 6.252 1.00 0.00 C ATOM 1163 OD1 ASN A 971 -30.881 -3.479 6.556 1.00 0.00 O flip ATOM 1164 ND2 ASN A 971 -30.868 -5.690 6.952 1.00 0.00 N flip ATOM 0 H ASN A 971 -27.288 -5.486 6.984 1.00 0.00 H new ATOM 0 HA ASN A 971 -28.581 -6.614 5.577 1.00 0.00 H new ATOM 0 HB2 ASN A 971 -29.591 -3.949 4.509 1.00 0.00 H new ATOM 0 HB3 ASN A 971 -30.341 -5.515 4.276 1.00 0.00 H new ATOM 0 HD21 ASN A 971 -30.592 -6.633 6.679 1.00 0.00 H new ATOM 0 HD22 ASN A 971 -31.407 -5.543 7.806 1.00 0.00 H new ATOM 1171 N GLY A 972 -26.314 -5.815 4.002 1.00 0.00 N ATOM 1172 CA GLY A 972 -25.494 -5.882 2.807 1.00 0.00 C ATOM 1173 C GLY A 972 -24.051 -6.241 3.097 1.00 0.00 C ATOM 1174 O GLY A 972 -23.756 -6.906 4.090 1.00 0.00 O ATOM 0 H GLY A 972 -25.803 -5.896 4.881 1.00 0.00 H new ATOM 0 HA2 GLY A 972 -25.916 -6.620 2.125 1.00 0.00 H new ATOM 0 HA3 GLY A 972 -25.527 -4.920 2.296 1.00 0.00 H new ATOM 1178 N MET A 973 -23.154 -5.799 2.216 1.00 0.00 N ATOM 1179 CA MET A 973 -21.727 -6.074 2.359 1.00 0.00 C ATOM 1180 C MET A 973 -20.948 -5.503 1.177 1.00 0.00 C ATOM 1181 O MET A 973 -21.440 -5.485 0.047 1.00 0.00 O ATOM 1182 CB MET A 973 -21.478 -7.581 2.466 1.00 0.00 C ATOM 1183 CG MET A 973 -22.034 -8.375 1.294 1.00 0.00 C ATOM 1184 SD MET A 973 -21.745 -10.148 1.457 1.00 0.00 S ATOM 1185 CE MET A 973 -22.550 -10.761 -0.020 1.00 0.00 C ATOM 0 H MET A 973 -23.393 -5.247 1.393 1.00 0.00 H new ATOM 0 HA MET A 973 -21.380 -5.593 3.274 1.00 0.00 H new ATOM 0 HB2 MET A 973 -20.405 -7.759 2.538 1.00 0.00 H new ATOM 0 HB3 MET A 973 -21.925 -7.950 3.389 1.00 0.00 H new ATOM 0 HG2 MET A 973 -23.105 -8.191 1.211 1.00 0.00 H new ATOM 0 HG3 MET A 973 -21.577 -8.020 0.370 1.00 0.00 H new ATOM 0 HE1 MET A 973 -23.300 -11.502 0.255 1.00 0.00 H new ATOM 0 HE2 MET A 973 -23.031 -9.934 -0.542 1.00 0.00 H new ATOM 0 HE3 MET A 973 -21.809 -11.221 -0.674 1.00 0.00 H new ATOM 1195 N VAL A 974 -19.732 -5.036 1.445 1.00 0.00 N ATOM 1196 CA VAL A 974 -18.890 -4.469 0.398 1.00 0.00 C ATOM 1197 C VAL A 974 -17.955 -5.521 -0.188 1.00 0.00 C ATOM 1198 O VAL A 974 -17.126 -6.095 0.521 1.00 0.00 O ATOM 1199 CB VAL A 974 -18.043 -3.287 0.919 1.00 0.00 C ATOM 1200 CG1 VAL A 974 -17.139 -3.721 2.065 1.00 0.00 C ATOM 1201 CG2 VAL A 974 -17.215 -2.693 -0.210 1.00 0.00 C ATOM 0 H VAL A 974 -19.310 -5.039 2.374 1.00 0.00 H new ATOM 0 HA VAL A 974 -19.565 -4.107 -0.377 1.00 0.00 H new ATOM 0 HB VAL A 974 -18.724 -2.525 1.297 1.00 0.00 H new ATOM 0 HG11 VAL A 974 -16.555 -2.868 2.411 1.00 0.00 H new ATOM 0 HG12 VAL A 974 -17.748 -4.100 2.885 1.00 0.00 H new ATOM 0 HG13 VAL A 974 -16.466 -4.506 1.720 1.00 0.00 H new ATOM 0 HG21 VAL A 974 -16.623 -1.861 0.172 1.00 0.00 H new ATOM 0 HG22 VAL A 974 -16.550 -3.456 -0.614 1.00 0.00 H new ATOM 0 HG23 VAL A 974 -17.878 -2.335 -0.998 1.00 0.00 H new ATOM 1211 N HIS A 975 -18.075 -5.763 -1.488 1.00 0.00 N ATOM 1212 CA HIS A 975 -17.214 -6.729 -2.151 1.00 0.00 C ATOM 1213 C HIS A 975 -15.855 -6.108 -2.421 1.00 0.00 C ATOM 1214 O HIS A 975 -15.737 -5.194 -3.238 1.00 0.00 O ATOM 1215 CB HIS A 975 -17.813 -7.202 -3.476 1.00 0.00 C ATOM 1216 CG HIS A 975 -19.209 -7.721 -3.375 1.00 0.00 C ATOM 1217 ND1 HIS A 975 -19.615 -8.623 -2.414 1.00 0.00 N ATOM 1218 CD2 HIS A 975 -20.291 -7.478 -4.145 1.00 0.00 C ATOM 1219 CE1 HIS A 975 -20.891 -8.911 -2.598 1.00 0.00 C ATOM 1220 NE2 HIS A 975 -21.325 -8.229 -3.643 1.00 0.00 N ATOM 0 H HIS A 975 -18.754 -5.307 -2.097 1.00 0.00 H new ATOM 0 HA HIS A 975 -17.114 -7.589 -1.489 1.00 0.00 H new ATOM 0 HB2 HIS A 975 -17.798 -6.373 -4.183 1.00 0.00 H new ATOM 0 HB3 HIS A 975 -17.177 -7.985 -3.889 1.00 0.00 H new ATOM 0 HD1 HIS A 975 -19.023 -9.007 -1.677 1.00 0.00 H new ATOM 0 HD2 HIS A 975 -20.335 -6.816 -4.997 1.00 0.00 H new ATOM 0 HE1 HIS A 975 -21.479 -9.588 -1.997 1.00 0.00 H new ATOM 1229 N VAL A 976 -14.830 -6.611 -1.751 1.00 0.00 N ATOM 1230 CA VAL A 976 -13.490 -6.109 -1.946 1.00 0.00 C ATOM 1231 C VAL A 976 -13.041 -6.383 -3.374 1.00 0.00 C ATOM 1232 O VAL A 976 -12.105 -5.761 -3.879 1.00 0.00 O ATOM 1233 CB VAL A 976 -12.515 -6.750 -0.955 1.00 0.00 C ATOM 1234 CG1 VAL A 976 -12.869 -6.353 0.472 1.00 0.00 C ATOM 1235 CG2 VAL A 976 -12.526 -8.252 -1.120 1.00 0.00 C ATOM 0 H VAL A 976 -14.906 -7.366 -1.069 1.00 0.00 H new ATOM 0 HA VAL A 976 -13.495 -5.034 -1.769 1.00 0.00 H new ATOM 0 HB VAL A 976 -11.508 -6.389 -1.162 1.00 0.00 H new ATOM 0 HG11 VAL A 976 -12.166 -6.817 1.164 1.00 0.00 H new ATOM 0 HG12 VAL A 976 -12.814 -5.269 0.572 1.00 0.00 H new ATOM 0 HG13 VAL A 976 -13.880 -6.688 0.703 1.00 0.00 H new ATOM 0 HG21 VAL A 976 -11.830 -8.701 -0.412 1.00 0.00 H new ATOM 0 HG22 VAL A 976 -13.530 -8.631 -0.932 1.00 0.00 H new ATOM 0 HG23 VAL A 976 -12.226 -8.509 -2.136 1.00 0.00 H new ATOM 1245 N ILE A 977 -13.741 -7.323 -4.011 1.00 0.00 N ATOM 1246 CA ILE A 977 -13.471 -7.728 -5.388 1.00 0.00 C ATOM 1247 C ILE A 977 -12.206 -8.576 -5.469 1.00 0.00 C ATOM 1248 O ILE A 977 -12.179 -9.611 -6.136 1.00 0.00 O ATOM 1249 CB ILE A 977 -13.350 -6.521 -6.330 1.00 0.00 C ATOM 1250 CG1 ILE A 977 -14.510 -5.556 -6.079 1.00 0.00 C ATOM 1251 CG2 ILE A 977 -13.354 -6.991 -7.777 1.00 0.00 C ATOM 1252 CD1 ILE A 977 -14.591 -4.439 -7.088 1.00 0.00 C ATOM 0 H ILE A 977 -14.516 -7.827 -3.581 1.00 0.00 H new ATOM 0 HA ILE A 977 -14.323 -8.325 -5.713 1.00 0.00 H new ATOM 0 HB ILE A 977 -12.411 -6.002 -6.136 1.00 0.00 H new ATOM 0 HG12 ILE A 977 -15.446 -6.114 -6.091 1.00 0.00 H new ATOM 0 HG13 ILE A 977 -14.407 -5.128 -5.082 1.00 0.00 H new ATOM 0 HG21 ILE A 977 -13.268 -6.130 -8.440 1.00 0.00 H new ATOM 0 HG22 ILE A 977 -12.512 -7.663 -7.944 1.00 0.00 H new ATOM 0 HG23 ILE A 977 -14.285 -7.518 -7.986 1.00 0.00 H new ATOM 0 HD11 ILE A 977 -15.436 -3.793 -6.849 1.00 0.00 H new ATOM 0 HD12 ILE A 977 -13.670 -3.856 -7.061 1.00 0.00 H new ATOM 0 HD13 ILE A 977 -14.725 -4.858 -8.085 1.00 0.00 H new ATOM 1264 N THR A 978 -11.167 -8.138 -4.767 1.00 0.00 N ATOM 1265 CA THR A 978 -9.897 -8.849 -4.724 1.00 0.00 C ATOM 1266 C THR A 978 -9.254 -8.665 -3.356 1.00 0.00 C ATOM 1267 O THR A 978 -8.935 -9.633 -2.670 1.00 0.00 O ATOM 1268 CB THR A 978 -8.926 -8.347 -5.811 1.00 0.00 C ATOM 1269 OG1 THR A 978 -8.640 -6.958 -5.609 1.00 0.00 O ATOM 1270 CG2 THR A 978 -9.511 -8.551 -7.200 1.00 0.00 C ATOM 0 H THR A 978 -11.182 -7.282 -4.213 1.00 0.00 H new ATOM 0 HA THR A 978 -10.100 -9.904 -4.909 1.00 0.00 H new ATOM 0 HB THR A 978 -8.004 -8.924 -5.735 1.00 0.00 H new ATOM 0 HG1 THR A 978 -8.021 -6.647 -6.302 1.00 0.00 H new ATOM 0 HG21 THR A 978 -8.806 -8.189 -7.948 1.00 0.00 H new ATOM 0 HG22 THR A 978 -9.700 -9.612 -7.363 1.00 0.00 H new ATOM 0 HG23 THR A 978 -10.447 -7.999 -7.285 1.00 0.00 H new ATOM 1278 N ASP A 979 -9.097 -7.403 -2.969 1.00 0.00 N ATOM 1279 CA ASP A 979 -8.519 -7.032 -1.681 1.00 0.00 C ATOM 1280 C ASP A 979 -8.939 -5.608 -1.323 1.00 0.00 C ATOM 1281 O ASP A 979 -10.047 -5.185 -1.650 1.00 0.00 O ATOM 1282 CB ASP A 979 -6.991 -7.138 -1.725 1.00 0.00 C ATOM 1283 CG ASP A 979 -6.481 -8.533 -1.410 1.00 0.00 C ATOM 1284 OD1 ASP A 979 -7.282 -9.371 -0.947 1.00 0.00 O ATOM 1285 OD2 ASP A 979 -5.272 -8.778 -1.604 1.00 0.00 O ATOM 0 H ASP A 979 -9.368 -6.605 -3.543 1.00 0.00 H new ATOM 0 HA ASP A 979 -8.887 -7.718 -0.918 1.00 0.00 H new ATOM 0 HB2 ASP A 979 -6.641 -6.845 -2.715 1.00 0.00 H new ATOM 0 HB3 ASP A 979 -6.563 -6.432 -1.013 1.00 0.00 H new ATOM 1290 N ILE A 980 -8.047 -4.863 -0.681 1.00 0.00 N ATOM 1291 CA ILE A 980 -8.333 -3.482 -0.313 1.00 0.00 C ATOM 1292 C ILE A 980 -7.055 -2.656 -0.264 1.00 0.00 C ATOM 1293 O ILE A 980 -6.947 -1.694 0.497 1.00 0.00 O ATOM 1294 CB ILE A 980 -9.069 -3.380 1.039 1.00 0.00 C ATOM 1295 CG1 ILE A 980 -8.387 -4.252 2.096 1.00 0.00 C ATOM 1296 CG2 ILE A 980 -10.532 -3.769 0.878 1.00 0.00 C ATOM 1297 CD1 ILE A 980 -9.106 -4.256 3.430 1.00 0.00 C ATOM 0 H ILE A 980 -7.122 -5.191 -0.405 1.00 0.00 H new ATOM 0 HA ILE A 980 -8.991 -3.083 -1.085 1.00 0.00 H new ATOM 0 HB ILE A 980 -9.024 -2.345 1.378 1.00 0.00 H new ATOM 0 HG12 ILE A 980 -8.321 -5.275 1.725 1.00 0.00 H new ATOM 0 HG13 ILE A 980 -7.366 -3.900 2.243 1.00 0.00 H new ATOM 0 HG21 ILE A 980 -11.037 -3.692 1.841 1.00 0.00 H new ATOM 0 HG22 ILE A 980 -11.010 -3.100 0.163 1.00 0.00 H new ATOM 0 HG23 ILE A 980 -10.598 -4.795 0.515 1.00 0.00 H new ATOM 0 HD11 ILE A 980 -8.568 -4.894 4.131 1.00 0.00 H new ATOM 0 HD12 ILE A 980 -9.149 -3.240 3.823 1.00 0.00 H new ATOM 0 HD13 ILE A 980 -10.119 -4.637 3.296 1.00 0.00 H new ATOM 1309 N GLN A 981 -6.099 -3.030 -1.109 1.00 0.00 N ATOM 1310 CA GLN A 981 -4.830 -2.320 -1.201 1.00 0.00 C ATOM 1311 C GLN A 981 -5.026 -1.027 -1.983 1.00 0.00 C ATOM 1312 O GLN A 981 -5.957 -0.922 -2.778 1.00 0.00 O ATOM 1313 CB GLN A 981 -3.775 -3.191 -1.892 1.00 0.00 C ATOM 1314 CG GLN A 981 -3.532 -4.531 -1.210 1.00 0.00 C ATOM 1315 CD GLN A 981 -2.915 -4.404 0.171 1.00 0.00 C ATOM 1316 OE1 GLN A 981 -2.554 -3.186 0.561 1.00 0.00 O flip ATOM 1317 NE2 GLN A 981 -2.753 -5.397 0.880 1.00 0.00 N flip ATOM 0 H GLN A 981 -6.181 -3.825 -1.742 1.00 0.00 H new ATOM 0 HA GLN A 981 -4.482 -2.089 -0.194 1.00 0.00 H new ATOM 0 HB2 GLN A 981 -4.085 -3.370 -2.922 1.00 0.00 H new ATOM 0 HB3 GLN A 981 -2.835 -2.641 -1.933 1.00 0.00 H new ATOM 0 HG2 GLN A 981 -4.479 -5.065 -1.129 1.00 0.00 H new ATOM 0 HG3 GLN A 981 -2.877 -5.136 -1.838 1.00 0.00 H new ATOM 0 HE21 GLN A 981 -3.043 -6.316 0.545 1.00 0.00 H new ATOM 0 HE22 GLN A 981 -2.328 -5.301 1.802 1.00 0.00 H new ATOM 1326 N VAL A 982 -4.153 -0.049 -1.757 1.00 0.00 N ATOM 1327 CA VAL A 982 -4.246 1.229 -2.456 1.00 0.00 C ATOM 1328 C VAL A 982 -4.245 1.023 -3.970 1.00 0.00 C ATOM 1329 O VAL A 982 -3.204 1.110 -4.623 1.00 0.00 O ATOM 1330 CB VAL A 982 -3.096 2.175 -2.059 1.00 0.00 C ATOM 1331 CG1 VAL A 982 -3.152 3.459 -2.873 1.00 0.00 C ATOM 1332 CG2 VAL A 982 -3.151 2.481 -0.571 1.00 0.00 C ATOM 0 H VAL A 982 -3.377 -0.116 -1.099 1.00 0.00 H new ATOM 0 HA VAL A 982 -5.188 1.690 -2.160 1.00 0.00 H new ATOM 0 HB VAL A 982 -2.151 1.677 -2.274 1.00 0.00 H new ATOM 0 HG11 VAL A 982 -2.332 4.113 -2.578 1.00 0.00 H new ATOM 0 HG12 VAL A 982 -3.063 3.222 -3.933 1.00 0.00 H new ATOM 0 HG13 VAL A 982 -4.101 3.963 -2.692 1.00 0.00 H new ATOM 0 HG21 VAL A 982 -2.332 3.150 -0.307 1.00 0.00 H new ATOM 0 HG22 VAL A 982 -4.101 2.959 -0.333 1.00 0.00 H new ATOM 0 HG23 VAL A 982 -3.059 1.554 -0.005 1.00 0.00 H new ATOM 1342 N GLY A 983 -5.423 0.736 -4.514 1.00 0.00 N ATOM 1343 CA GLY A 983 -5.557 0.506 -5.939 1.00 0.00 C ATOM 1344 C GLY A 983 -6.811 -0.282 -6.280 1.00 0.00 C ATOM 1345 O GLY A 983 -7.458 -0.024 -7.292 1.00 0.00 O ATOM 0 H GLY A 983 -6.293 0.658 -3.988 1.00 0.00 H new ATOM 0 HA2 GLY A 983 -5.580 1.464 -6.459 1.00 0.00 H new ATOM 0 HA3 GLY A 983 -4.682 -0.033 -6.302 1.00 0.00 H new ATOM 1349 N SER A 984 -7.145 -1.255 -5.432 1.00 0.00 N ATOM 1350 CA SER A 984 -8.320 -2.093 -5.645 1.00 0.00 C ATOM 1351 C SER A 984 -9.609 -1.358 -5.282 1.00 0.00 C ATOM 1352 O SER A 984 -9.672 -0.647 -4.277 1.00 0.00 O ATOM 1353 CB SER A 984 -8.207 -3.379 -4.824 1.00 0.00 C ATOM 1354 OG SER A 984 -8.108 -3.094 -3.440 1.00 0.00 O ATOM 0 H SER A 984 -6.616 -1.481 -4.590 1.00 0.00 H new ATOM 0 HA SER A 984 -8.361 -2.341 -6.706 1.00 0.00 H new ATOM 0 HB2 SER A 984 -9.078 -4.009 -5.007 1.00 0.00 H new ATOM 0 HB3 SER A 984 -7.332 -3.944 -5.146 1.00 0.00 H new ATOM 0 HG SER A 984 -7.727 -3.867 -2.973 1.00 0.00 H new ATOM 1360 N ARG A 985 -10.636 -1.546 -6.108 1.00 0.00 N ATOM 1361 CA ARG A 985 -11.935 -0.917 -5.885 1.00 0.00 C ATOM 1362 C ARG A 985 -12.840 -1.814 -5.045 1.00 0.00 C ATOM 1363 O ARG A 985 -12.639 -3.026 -4.977 1.00 0.00 O ATOM 1364 CB ARG A 985 -12.620 -0.613 -7.219 1.00 0.00 C ATOM 1365 CG ARG A 985 -11.879 0.399 -8.074 1.00 0.00 C ATOM 1366 CD ARG A 985 -12.613 0.661 -9.379 1.00 0.00 C ATOM 1367 NE ARG A 985 -12.730 -0.547 -10.191 1.00 0.00 N ATOM 1368 CZ ARG A 985 -13.328 -0.584 -11.377 1.00 0.00 C ATOM 1369 NH1 ARG A 985 -13.862 0.516 -11.890 1.00 0.00 N ATOM 1370 NH2 ARG A 985 -13.392 -1.724 -12.052 1.00 0.00 N ATOM 0 H ARG A 985 -10.593 -2.132 -6.942 1.00 0.00 H new ATOM 0 HA ARG A 985 -11.763 0.015 -5.346 1.00 0.00 H new ATOM 0 HB2 ARG A 985 -12.726 -1.541 -7.781 1.00 0.00 H new ATOM 0 HB3 ARG A 985 -13.626 -0.242 -7.023 1.00 0.00 H new ATOM 0 HG2 ARG A 985 -11.768 1.333 -7.523 1.00 0.00 H new ATOM 0 HG3 ARG A 985 -10.874 0.033 -8.286 1.00 0.00 H new ATOM 0 HD2 ARG A 985 -13.608 1.051 -9.164 1.00 0.00 H new ATOM 0 HD3 ARG A 985 -12.085 1.429 -9.945 1.00 0.00 H new ATOM 0 HE ARG A 985 -12.330 -1.412 -9.827 1.00 0.00 H new ATOM 0 HH11 ARG A 985 -13.815 1.395 -11.374 1.00 0.00 H new ATOM 0 HH12 ARG A 985 -14.320 0.484 -12.801 1.00 0.00 H new ATOM 0 HH21 ARG A 985 -12.982 -2.572 -11.661 1.00 0.00 H new ATOM 0 HH22 ARG A 985 -13.851 -1.753 -12.962 1.00 0.00 H new ATOM 1384 N ILE A 986 -13.847 -1.211 -4.420 1.00 0.00 N ATOM 1385 CA ILE A 986 -14.795 -1.956 -3.598 1.00 0.00 C ATOM 1386 C ILE A 986 -16.229 -1.560 -3.935 1.00 0.00 C ATOM 1387 O ILE A 986 -16.595 -0.386 -3.871 1.00 0.00 O ATOM 1388 CB ILE A 986 -14.548 -1.731 -2.095 1.00 0.00 C ATOM 1389 CG1 ILE A 986 -14.633 -0.242 -1.749 1.00 0.00 C ATOM 1390 CG2 ILE A 986 -13.196 -2.301 -1.692 1.00 0.00 C ATOM 1391 CD1 ILE A 986 -14.538 0.046 -0.267 1.00 0.00 C ATOM 0 H ILE A 986 -14.028 -0.208 -4.467 1.00 0.00 H new ATOM 0 HA ILE A 986 -14.645 -3.013 -3.819 1.00 0.00 H new ATOM 0 HB ILE A 986 -15.324 -2.252 -1.535 1.00 0.00 H new ATOM 0 HG12 ILE A 986 -13.832 0.288 -2.265 1.00 0.00 H new ATOM 0 HG13 ILE A 986 -15.574 0.156 -2.128 1.00 0.00 H new ATOM 0 HG21 ILE A 986 -13.034 -2.135 -0.627 1.00 0.00 H new ATOM 0 HG22 ILE A 986 -13.176 -3.371 -1.900 1.00 0.00 H new ATOM 0 HG23 ILE A 986 -12.408 -1.806 -2.260 1.00 0.00 H new ATOM 0 HD11 ILE A 986 -14.606 1.121 -0.100 1.00 0.00 H new ATOM 0 HD12 ILE A 986 -15.354 -0.454 0.254 1.00 0.00 H new ATOM 0 HD13 ILE A 986 -13.585 -0.321 0.115 1.00 0.00 H new ATOM 1403 N THR A 987 -17.039 -2.550 -4.297 1.00 0.00 N ATOM 1404 CA THR A 987 -18.435 -2.305 -4.644 1.00 0.00 C ATOM 1405 C THR A 987 -19.368 -2.728 -3.524 1.00 0.00 C ATOM 1406 O THR A 987 -19.174 -3.768 -2.901 1.00 0.00 O ATOM 1407 CB THR A 987 -18.840 -3.027 -5.939 1.00 0.00 C ATOM 1408 OG1 THR A 987 -18.328 -4.365 -5.943 1.00 0.00 O ATOM 1409 CG2 THR A 987 -18.333 -2.267 -7.151 1.00 0.00 C ATOM 0 H THR A 987 -16.754 -3.527 -4.358 1.00 0.00 H new ATOM 0 HA THR A 987 -18.527 -1.230 -4.800 1.00 0.00 H new ATOM 0 HB THR A 987 -19.928 -3.069 -5.986 1.00 0.00 H new ATOM 0 HG1 THR A 987 -18.594 -4.815 -6.772 1.00 0.00 H new ATOM 0 HG21 THR A 987 -18.628 -2.792 -8.059 1.00 0.00 H new ATOM 0 HG22 THR A 987 -18.760 -1.264 -7.156 1.00 0.00 H new ATOM 0 HG23 THR A 987 -17.246 -2.198 -7.109 1.00 0.00 H new ATOM 1417 N TYR A 988 -20.378 -1.911 -3.272 1.00 0.00 N ATOM 1418 CA TYR A 988 -21.343 -2.200 -2.216 1.00 0.00 C ATOM 1419 C TYR A 988 -22.631 -2.782 -2.788 1.00 0.00 C ATOM 1420 O TYR A 988 -23.126 -2.325 -3.819 1.00 0.00 O ATOM 1421 CB TYR A 988 -21.646 -0.937 -1.408 1.00 0.00 C ATOM 1422 CG TYR A 988 -20.438 -0.367 -0.696 1.00 0.00 C ATOM 1423 CD1 TYR A 988 -19.315 0.044 -1.405 1.00 0.00 C ATOM 1424 CD2 TYR A 988 -20.423 -0.236 0.687 1.00 0.00 C ATOM 1425 CE1 TYR A 988 -18.212 0.566 -0.757 1.00 0.00 C ATOM 1426 CE2 TYR A 988 -19.323 0.285 1.342 1.00 0.00 C ATOM 1427 CZ TYR A 988 -18.221 0.684 0.616 1.00 0.00 C ATOM 1428 OH TYR A 988 -17.124 1.203 1.265 1.00 0.00 O ATOM 0 H TYR A 988 -20.553 -1.044 -3.781 1.00 0.00 H new ATOM 0 HA TYR A 988 -20.900 -2.945 -1.554 1.00 0.00 H new ATOM 0 HB2 TYR A 988 -22.055 -0.178 -2.075 1.00 0.00 H new ATOM 0 HB3 TYR A 988 -22.417 -1.163 -0.672 1.00 0.00 H new ATOM 0 HD1 TYR A 988 -19.305 -0.046 -2.481 1.00 0.00 H new ATOM 0 HD2 TYR A 988 -21.285 -0.546 1.259 1.00 0.00 H new ATOM 0 HE1 TYR A 988 -17.348 0.880 -1.323 1.00 0.00 H new ATOM 0 HE2 TYR A 988 -19.327 0.379 2.418 1.00 0.00 H new ATOM 0 HH TYR A 988 -16.957 2.115 0.948 1.00 0.00 H new ATOM 1438 N SER A 989 -23.173 -3.793 -2.111 1.00 0.00 N ATOM 1439 CA SER A 989 -24.407 -4.433 -2.554 1.00 0.00 C ATOM 1440 C SER A 989 -25.153 -5.051 -1.376 1.00 0.00 C ATOM 1441 O SER A 989 -24.567 -5.765 -0.562 1.00 0.00 O ATOM 1442 CB SER A 989 -24.103 -5.507 -3.600 1.00 0.00 C ATOM 1443 OG SER A 989 -23.262 -6.514 -3.065 1.00 0.00 O ATOM 0 H SER A 989 -22.777 -4.185 -1.256 1.00 0.00 H new ATOM 0 HA SER A 989 -25.042 -3.669 -3.002 1.00 0.00 H new ATOM 0 HB2 SER A 989 -25.034 -5.954 -3.949 1.00 0.00 H new ATOM 0 HB3 SER A 989 -23.624 -5.051 -4.466 1.00 0.00 H new ATOM 0 HG SER A 989 -22.827 -7.000 -3.797 1.00 0.00 H new ATOM 1449 N CYS A 990 -26.450 -4.768 -1.291 1.00 0.00 N ATOM 1450 CA CYS A 990 -27.281 -5.287 -0.211 1.00 0.00 C ATOM 1451 C CYS A 990 -27.583 -6.768 -0.398 1.00 0.00 C ATOM 1452 O CYS A 990 -28.090 -7.183 -1.439 1.00 0.00 O ATOM 1453 CB CYS A 990 -28.591 -4.515 -0.130 1.00 0.00 C ATOM 1454 SG CYS A 990 -28.396 -2.745 0.248 1.00 0.00 S ATOM 0 H CYS A 990 -26.948 -4.180 -1.959 1.00 0.00 H new ATOM 0 HA CYS A 990 -26.722 -5.162 0.716 1.00 0.00 H new ATOM 0 HB2 CYS A 990 -29.118 -4.616 -1.079 1.00 0.00 H new ATOM 0 HB3 CYS A 990 -29.221 -4.970 0.634 1.00 0.00 H new ATOM 1459 N THR A 991 -27.279 -7.551 0.628 1.00 0.00 N ATOM 1460 CA THR A 991 -27.529 -8.985 0.605 1.00 0.00 C ATOM 1461 C THR A 991 -29.011 -9.299 0.826 1.00 0.00 C ATOM 1462 O THR A 991 -29.356 -10.062 1.726 1.00 0.00 O ATOM 1463 CB THR A 991 -26.682 -9.718 1.663 1.00 0.00 C ATOM 1464 OG1 THR A 991 -26.991 -11.117 1.661 1.00 0.00 O ATOM 1465 CG2 THR A 991 -26.921 -9.139 3.050 1.00 0.00 C ATOM 0 H THR A 991 -26.856 -7.214 1.493 1.00 0.00 H new ATOM 0 HA THR A 991 -27.241 -9.340 -0.384 1.00 0.00 H new ATOM 0 HB THR A 991 -25.631 -9.581 1.409 1.00 0.00 H new ATOM 0 HG1 THR A 991 -27.951 -11.240 1.813 1.00 0.00 H new ATOM 0 HG21 THR A 991 -26.311 -9.674 3.778 1.00 0.00 H new ATOM 0 HG22 THR A 991 -26.649 -8.083 3.055 1.00 0.00 H new ATOM 0 HG23 THR A 991 -27.974 -9.244 3.312 1.00 0.00 H new ATOM 1473 N THR A 992 -29.879 -8.713 -0.002 1.00 0.00 N ATOM 1474 CA THR A 992 -31.326 -8.925 0.104 1.00 0.00 C ATOM 1475 C THR A 992 -32.070 -8.181 -1.002 1.00 0.00 C ATOM 1476 O THR A 992 -32.252 -8.712 -2.098 1.00 0.00 O ATOM 1477 CB THR A 992 -31.891 -8.458 1.470 1.00 0.00 C ATOM 1478 OG1 THR A 992 -31.301 -9.197 2.545 1.00 0.00 O ATOM 1479 CG2 THR A 992 -33.403 -8.628 1.520 1.00 0.00 C ATOM 0 H THR A 992 -29.604 -8.085 -0.757 1.00 0.00 H new ATOM 0 HA THR A 992 -31.481 -9.999 0.007 1.00 0.00 H new ATOM 0 HB THR A 992 -31.645 -7.402 1.581 1.00 0.00 H new ATOM 0 HG1 THR A 992 -30.805 -9.961 2.183 1.00 0.00 H new ATOM 0 HG21 THR A 992 -33.775 -8.293 2.488 1.00 0.00 H new ATOM 0 HG22 THR A 992 -33.862 -8.034 0.730 1.00 0.00 H new ATOM 0 HG23 THR A 992 -33.656 -9.679 1.378 1.00 0.00 H new ATOM 1487 N GLY A 993 -32.505 -6.960 -0.715 1.00 0.00 N ATOM 1488 CA GLY A 993 -33.228 -6.187 -1.705 1.00 0.00 C ATOM 1489 C GLY A 993 -33.399 -4.741 -1.298 1.00 0.00 C ATOM 1490 O GLY A 993 -34.453 -4.145 -1.521 1.00 0.00 O ATOM 0 H GLY A 993 -32.370 -6.493 0.182 1.00 0.00 H new ATOM 0 HA2 GLY A 993 -32.697 -6.233 -2.656 1.00 0.00 H new ATOM 0 HA3 GLY A 993 -34.209 -6.634 -1.865 1.00 0.00 H new ATOM 1494 N HIS A 994 -32.356 -4.175 -0.707 1.00 0.00 N ATOM 1495 CA HIS A 994 -32.386 -2.787 -0.273 1.00 0.00 C ATOM 1496 C HIS A 994 -31.811 -1.886 -1.361 1.00 0.00 C ATOM 1497 O HIS A 994 -31.092 -2.351 -2.248 1.00 0.00 O ATOM 1498 CB HIS A 994 -31.595 -2.623 1.024 1.00 0.00 C ATOM 1499 CG HIS A 994 -32.059 -3.514 2.132 1.00 0.00 C ATOM 1500 ND1 HIS A 994 -32.218 -4.876 1.986 1.00 0.00 N ATOM 1501 CD2 HIS A 994 -32.380 -3.236 3.417 1.00 0.00 C ATOM 1502 CE1 HIS A 994 -32.620 -5.397 3.132 1.00 0.00 C ATOM 1503 NE2 HIS A 994 -32.726 -4.423 4.018 1.00 0.00 N ATOM 0 H HIS A 994 -31.478 -4.657 -0.517 1.00 0.00 H new ATOM 0 HA HIS A 994 -33.421 -2.497 -0.089 1.00 0.00 H new ATOM 0 HB2 HIS A 994 -30.543 -2.825 0.825 1.00 0.00 H new ATOM 0 HB3 HIS A 994 -31.664 -1.586 1.352 1.00 0.00 H new ATOM 0 HD2 HIS A 994 -32.367 -2.262 3.884 1.00 0.00 H new ATOM 0 HE1 HIS A 994 -32.827 -6.441 3.313 1.00 0.00 H new ATOM 0 HE2 HIS A 994 -33.017 -4.534 4.989 1.00 0.00 H new ATOM 1512 N ARG A 995 -32.142 -0.604 -1.300 1.00 0.00 N ATOM 1513 CA ARG A 995 -31.674 0.358 -2.288 1.00 0.00 C ATOM 1514 C ARG A 995 -30.347 0.980 -1.870 1.00 0.00 C ATOM 1515 O ARG A 995 -30.169 1.375 -0.715 1.00 0.00 O ATOM 1516 CB ARG A 995 -32.712 1.466 -2.479 1.00 0.00 C ATOM 1517 CG ARG A 995 -33.018 2.229 -1.199 1.00 0.00 C ATOM 1518 CD ARG A 995 -33.926 3.421 -1.451 1.00 0.00 C ATOM 1519 NE ARG A 995 -34.273 4.115 -0.214 1.00 0.00 N ATOM 1520 CZ ARG A 995 -35.053 5.190 -0.165 1.00 0.00 C ATOM 1521 NH1 ARG A 995 -35.569 5.693 -1.280 1.00 0.00 N ATOM 1522 NH2 ARG A 995 -35.319 5.765 1.000 1.00 0.00 N ATOM 0 H ARG A 995 -32.736 -0.204 -0.573 1.00 0.00 H new ATOM 0 HA ARG A 995 -31.528 -0.177 -3.227 1.00 0.00 H new ATOM 0 HB2 ARG A 995 -32.352 2.165 -3.234 1.00 0.00 H new ATOM 0 HB3 ARG A 995 -33.634 1.029 -2.863 1.00 0.00 H new ATOM 0 HG2 ARG A 995 -33.491 1.558 -0.481 1.00 0.00 H new ATOM 0 HG3 ARG A 995 -32.086 2.572 -0.749 1.00 0.00 H new ATOM 0 HD2 ARG A 995 -33.432 4.116 -2.130 1.00 0.00 H new ATOM 0 HD3 ARG A 995 -34.837 3.085 -1.946 1.00 0.00 H new ATOM 0 HE ARG A 995 -33.895 3.754 0.662 1.00 0.00 H new ATOM 0 HH11 ARG A 995 -35.367 5.254 -2.178 1.00 0.00 H new ATOM 0 HH12 ARG A 995 -36.167 6.518 -1.238 1.00 0.00 H new ATOM 0 HH21 ARG A 995 -34.925 5.382 1.859 1.00 0.00 H new ATOM 0 HH22 ARG A 995 -35.918 6.590 1.037 1.00 0.00 H new ATOM 1536 N LEU A 996 -29.425 1.076 -2.824 1.00 0.00 N ATOM 1537 CA LEU A 996 -28.121 1.668 -2.567 1.00 0.00 C ATOM 1538 C LEU A 996 -28.275 3.176 -2.404 1.00 0.00 C ATOM 1539 O LEU A 996 -28.945 3.829 -3.205 1.00 0.00 O ATOM 1540 CB LEU A 996 -27.153 1.345 -3.715 1.00 0.00 C ATOM 1541 CG LEU A 996 -25.672 1.568 -3.424 1.00 0.00 C ATOM 1542 CD1 LEU A 996 -25.380 3.041 -3.249 1.00 0.00 C ATOM 1543 CD2 LEU A 996 -25.265 0.787 -2.194 1.00 0.00 C ATOM 0 H LEU A 996 -29.559 0.751 -3.781 1.00 0.00 H new ATOM 0 HA LEU A 996 -27.709 1.250 -1.649 1.00 0.00 H new ATOM 0 HB2 LEU A 996 -27.294 0.302 -4.000 1.00 0.00 H new ATOM 0 HB3 LEU A 996 -27.429 1.951 -4.578 1.00 0.00 H new ATOM 0 HG LEU A 996 -25.088 1.210 -4.272 1.00 0.00 H new ATOM 0 HD11 LEU A 996 -24.319 3.179 -3.042 1.00 0.00 H new ATOM 0 HD12 LEU A 996 -25.645 3.575 -4.161 1.00 0.00 H new ATOM 0 HD13 LEU A 996 -25.966 3.432 -2.417 1.00 0.00 H new ATOM 0 HD21 LEU A 996 -24.206 0.951 -1.993 1.00 0.00 H new ATOM 0 HD22 LEU A 996 -25.853 1.122 -1.339 1.00 0.00 H new ATOM 0 HD23 LEU A 996 -25.442 -0.275 -2.363 1.00 0.00 H new ATOM 1555 N ILE A 997 -27.662 3.724 -1.364 1.00 0.00 N ATOM 1556 CA ILE A 997 -27.747 5.153 -1.102 1.00 0.00 C ATOM 1557 C ILE A 997 -26.375 5.813 -1.157 1.00 0.00 C ATOM 1558 O ILE A 997 -25.400 5.292 -0.614 1.00 0.00 O ATOM 1559 CB ILE A 997 -28.407 5.422 0.258 1.00 0.00 C ATOM 1560 CG1 ILE A 997 -29.843 4.900 0.226 1.00 0.00 C ATOM 1561 CG2 ILE A 997 -28.370 6.901 0.597 1.00 0.00 C ATOM 1562 CD1 ILE A 997 -30.778 5.575 1.198 1.00 0.00 C ATOM 0 H ILE A 997 -27.102 3.202 -0.690 1.00 0.00 H new ATOM 0 HA ILE A 997 -28.366 5.590 -1.885 1.00 0.00 H new ATOM 0 HB ILE A 997 -27.853 4.900 1.038 1.00 0.00 H new ATOM 0 HG12 ILE A 997 -30.238 5.023 -0.783 1.00 0.00 H new ATOM 0 HG13 ILE A 997 -29.832 3.830 0.436 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -28.844 7.064 1.565 1.00 0.00 H new ATOM 0 HG22 ILE A 997 -27.335 7.239 0.638 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -28.905 7.463 -0.168 1.00 0.00 H new ATOM 0 HD11 ILE A 997 -31.774 5.141 1.106 1.00 0.00 H new ATOM 0 HD12 ILE A 997 -30.412 5.431 2.215 1.00 0.00 H new ATOM 0 HD13 ILE A 997 -30.825 6.641 0.977 1.00 0.00 H new ATOM 1574 N GLY A 998 -26.304 6.962 -1.824 1.00 0.00 N ATOM 1575 CA GLY A 998 -25.045 7.673 -1.946 1.00 0.00 C ATOM 1576 C GLY A 998 -24.281 7.295 -3.202 1.00 0.00 C ATOM 1577 O GLY A 998 -24.809 7.386 -4.310 1.00 0.00 O ATOM 0 H GLY A 998 -27.096 7.413 -2.282 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -25.237 8.746 -1.951 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -24.427 7.464 -1.073 1.00 0.00 H new ATOM 1581 N HIS A 999 -23.031 6.879 -3.026 1.00 0.00 N ATOM 1582 CA HIS A 999 -22.181 6.494 -4.150 1.00 0.00 C ATOM 1583 C HIS A 999 -22.513 5.082 -4.633 1.00 0.00 C ATOM 1584 O HIS A 999 -23.676 4.766 -4.882 1.00 0.00 O ATOM 1585 CB HIS A 999 -20.711 6.590 -3.741 1.00 0.00 C ATOM 1586 CG HIS A 999 -20.310 7.959 -3.290 1.00 0.00 C ATOM 1587 ND1 HIS A 999 -19.935 8.413 -2.072 1.00 0.00 N flip ATOM 1588 CD2 HIS A 999 -20.278 9.052 -4.130 1.00 0.00 C flip ATOM 1589 CE1 HIS A 999 -19.686 9.757 -2.197 1.00 0.00 C flip ATOM 1590 NE2 HIS A 999 -19.899 10.118 -3.448 1.00 0.00 N flip ATOM 0 H HIS A 999 -22.582 6.799 -2.114 1.00 0.00 H new ATOM 0 HA HIS A 999 -22.367 7.179 -4.977 1.00 0.00 H new ATOM 0 HB2 HIS A 999 -20.518 5.879 -2.938 1.00 0.00 H new ATOM 0 HB3 HIS A 999 -20.086 6.295 -4.584 1.00 0.00 H new ATOM 0 HD1 HIS A 999 -19.853 7.859 -1.219 1.00 0.00 H new ATOM 0 HD2 HIS A 999 -20.524 9.039 -5.181 1.00 0.00 H new ATOM 0 HE1 HIS A 999 -19.367 10.413 -1.400 1.00 0.00 H new ATOM 1599 N SER A1000 -21.490 4.238 -4.774 1.00 0.00 N ATOM 1600 CA SER A1000 -21.683 2.865 -5.235 1.00 0.00 C ATOM 1601 C SER A1000 -20.375 2.081 -5.179 1.00 0.00 C ATOM 1602 O SER A1000 -20.364 0.892 -4.858 1.00 0.00 O ATOM 1603 CB SER A1000 -22.232 2.856 -6.664 1.00 0.00 C ATOM 1604 OG SER A1000 -21.337 3.496 -7.559 1.00 0.00 O ATOM 0 H SER A1000 -20.520 4.482 -4.575 1.00 0.00 H new ATOM 0 HA SER A1000 -22.403 2.386 -4.572 1.00 0.00 H new ATOM 0 HB2 SER A1000 -22.400 1.828 -6.986 1.00 0.00 H new ATOM 0 HB3 SER A1000 -23.198 3.360 -6.689 1.00 0.00 H new ATOM 0 HG SER A1000 -21.710 3.475 -8.465 1.00 0.00 H new ATOM 1610 N SER A1001 -19.276 2.756 -5.501 1.00 0.00 N ATOM 1611 CA SER A1001 -17.958 2.130 -5.496 1.00 0.00 C ATOM 1612 C SER A1001 -16.872 3.154 -5.187 1.00 0.00 C ATOM 1613 O SER A1001 -17.023 4.341 -5.478 1.00 0.00 O ATOM 1614 CB SER A1001 -17.676 1.470 -6.848 1.00 0.00 C ATOM 1615 OG SER A1001 -17.734 2.417 -7.901 1.00 0.00 O ATOM 0 H SER A1001 -19.272 3.740 -5.770 1.00 0.00 H new ATOM 0 HA SER A1001 -17.950 1.367 -4.717 1.00 0.00 H new ATOM 0 HB2 SER A1001 -16.692 1.002 -6.829 1.00 0.00 H new ATOM 0 HB3 SER A1001 -18.402 0.677 -7.028 1.00 0.00 H new ATOM 0 HG SER A1001 -17.549 1.970 -8.753 1.00 0.00 H new ATOM 1621 N ALA A1002 -15.779 2.688 -4.594 1.00 0.00 N ATOM 1622 CA ALA A1002 -14.666 3.562 -4.243 1.00 0.00 C ATOM 1623 C ALA A1002 -13.349 2.797 -4.238 1.00 0.00 C ATOM 1624 O ALA A1002 -13.255 1.702 -3.682 1.00 0.00 O ATOM 1625 CB ALA A1002 -14.909 4.207 -2.888 1.00 0.00 C ATOM 0 H ALA A1002 -15.640 1.708 -4.346 1.00 0.00 H new ATOM 0 HA ALA A1002 -14.598 4.345 -4.999 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -14.070 4.857 -2.639 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -15.826 4.796 -2.924 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -15.006 3.432 -2.128 1.00 0.00 H new ATOM 1631 N GLU A1003 -12.337 3.381 -4.868 1.00 0.00 N ATOM 1632 CA GLU A1003 -11.021 2.759 -4.951 1.00 0.00 C ATOM 1633 C GLU A1003 -10.092 3.287 -3.864 1.00 0.00 C ATOM 1634 O GLU A1003 -10.031 4.493 -3.622 1.00 0.00 O ATOM 1635 CB GLU A1003 -10.399 3.029 -6.321 1.00 0.00 C ATOM 1636 CG GLU A1003 -9.045 2.367 -6.517 1.00 0.00 C ATOM 1637 CD GLU A1003 -8.456 2.641 -7.887 1.00 0.00 C ATOM 1638 OE1 GLU A1003 -9.095 2.267 -8.894 1.00 0.00 O ATOM 1639 OE2 GLU A1003 -7.357 3.230 -7.954 1.00 0.00 O ATOM 0 H GLU A1003 -12.403 4.288 -5.330 1.00 0.00 H new ATOM 0 HA GLU A1003 -11.150 1.686 -4.808 1.00 0.00 H new ATOM 0 HB2 GLU A1003 -11.081 2.678 -7.096 1.00 0.00 H new ATOM 0 HB3 GLU A1003 -10.291 4.105 -6.456 1.00 0.00 H new ATOM 0 HG2 GLU A1003 -8.356 2.723 -5.751 1.00 0.00 H new ATOM 0 HG3 GLU A1003 -9.147 1.291 -6.378 1.00 0.00 H new ATOM 1646 N CYS A1004 -9.348 2.386 -3.232 1.00 0.00 N ATOM 1647 CA CYS A1004 -8.403 2.783 -2.198 1.00 0.00 C ATOM 1648 C CYS A1004 -7.228 3.503 -2.846 1.00 0.00 C ATOM 1649 O CYS A1004 -6.561 2.950 -3.720 1.00 0.00 O ATOM 1650 CB CYS A1004 -7.910 1.558 -1.422 1.00 0.00 C ATOM 1651 SG CYS A1004 -6.588 1.908 -0.215 1.00 0.00 S ATOM 0 H CYS A1004 -9.381 1.383 -3.416 1.00 0.00 H new ATOM 0 HA CYS A1004 -8.899 3.453 -1.496 1.00 0.00 H new ATOM 0 HB2 CYS A1004 -8.755 1.112 -0.897 1.00 0.00 H new ATOM 0 HB3 CYS A1004 -7.548 0.815 -2.133 1.00 0.00 H new ATOM 1656 N ILE A1005 -6.986 4.741 -2.437 1.00 0.00 N ATOM 1657 CA ILE A1005 -5.898 5.518 -3.013 1.00 0.00 C ATOM 1658 C ILE A1005 -5.061 6.208 -1.941 1.00 0.00 C ATOM 1659 O ILE A1005 -4.979 5.742 -0.803 1.00 0.00 O ATOM 1660 CB ILE A1005 -6.436 6.578 -3.996 1.00 0.00 C ATOM 1661 CG1 ILE A1005 -7.392 7.533 -3.278 1.00 0.00 C ATOM 1662 CG2 ILE A1005 -7.132 5.902 -5.171 1.00 0.00 C ATOM 1663 CD1 ILE A1005 -7.931 8.636 -4.163 1.00 0.00 C ATOM 0 H ILE A1005 -7.522 5.224 -1.716 1.00 0.00 H new ATOM 0 HA ILE A1005 -5.262 4.814 -3.549 1.00 0.00 H new ATOM 0 HB ILE A1005 -5.597 7.158 -4.380 1.00 0.00 H new ATOM 0 HG12 ILE A1005 -8.228 6.961 -2.876 1.00 0.00 H new ATOM 0 HG13 ILE A1005 -6.875 7.981 -2.429 1.00 0.00 H new ATOM 0 HG21 ILE A1005 -7.507 6.661 -5.857 1.00 0.00 H new ATOM 0 HG22 ILE A1005 -6.423 5.259 -5.693 1.00 0.00 H new ATOM 0 HG23 ILE A1005 -7.964 5.301 -4.804 1.00 0.00 H new ATOM 0 HD11 ILE A1005 -8.601 9.272 -3.584 1.00 0.00 H new ATOM 0 HD12 ILE A1005 -7.103 9.233 -4.545 1.00 0.00 H new ATOM 0 HD13 ILE A1005 -8.478 8.198 -4.998 1.00 0.00 H new ATOM 1675 N LEU A1006 -4.433 7.318 -2.318 1.00 0.00 N ATOM 1676 CA LEU A1006 -3.586 8.069 -1.400 1.00 0.00 C ATOM 1677 C LEU A1006 -3.572 9.553 -1.757 1.00 0.00 C ATOM 1678 O LEU A1006 -3.457 9.921 -2.926 1.00 0.00 O ATOM 1679 CB LEU A1006 -2.160 7.513 -1.443 1.00 0.00 C ATOM 1680 CG LEU A1006 -1.152 8.235 -0.549 1.00 0.00 C ATOM 1681 CD1 LEU A1006 -1.496 8.034 0.918 1.00 0.00 C ATOM 1682 CD2 LEU A1006 0.263 7.752 -0.841 1.00 0.00 C ATOM 0 H LEU A1006 -4.496 7.717 -3.255 1.00 0.00 H new ATOM 0 HA LEU A1006 -3.991 7.963 -0.394 1.00 0.00 H new ATOM 0 HB2 LEU A1006 -2.188 6.462 -1.156 1.00 0.00 H new ATOM 0 HB3 LEU A1006 -1.803 7.553 -2.472 1.00 0.00 H new ATOM 0 HG LEU A1006 -1.202 9.302 -0.767 1.00 0.00 H new ATOM 0 HD11 LEU A1006 -0.767 8.556 1.538 1.00 0.00 H new ATOM 0 HD12 LEU A1006 -2.491 8.432 1.116 1.00 0.00 H new ATOM 0 HD13 LEU A1006 -1.477 6.970 1.154 1.00 0.00 H new ATOM 0 HD21 LEU A1006 0.967 8.277 -0.195 1.00 0.00 H new ATOM 0 HD22 LEU A1006 0.328 6.680 -0.653 1.00 0.00 H new ATOM 0 HD23 LEU A1006 0.508 7.953 -1.884 1.00 0.00 H new ATOM 1694 N SER A1007 -3.684 10.399 -0.737 1.00 0.00 N ATOM 1695 CA SER A1007 -3.681 11.845 -0.934 1.00 0.00 C ATOM 1696 C SER A1007 -2.259 12.394 -0.879 1.00 0.00 C ATOM 1697 O SER A1007 -1.889 13.269 -1.661 1.00 0.00 O ATOM 1698 CB SER A1007 -4.544 12.527 0.129 1.00 0.00 C ATOM 1699 OG SER A1007 -4.550 13.934 -0.044 1.00 0.00 O ATOM 0 H SER A1007 -3.778 10.107 0.236 1.00 0.00 H new ATOM 0 HA SER A1007 -4.097 12.056 -1.919 1.00 0.00 H new ATOM 0 HB2 SER A1007 -5.564 12.146 0.073 1.00 0.00 H new ATOM 0 HB3 SER A1007 -4.166 12.281 1.121 1.00 0.00 H new ATOM 0 HG SER A1007 -5.110 14.346 0.647 1.00 0.00 H new ATOM 1705 N GLY A1008 -1.471 11.874 0.057 1.00 0.00 N ATOM 1706 CA GLY A1008 -0.099 12.320 0.209 1.00 0.00 C ATOM 1707 C GLY A1008 0.667 11.474 1.208 1.00 0.00 C ATOM 1708 O GLY A1008 1.853 11.202 1.023 1.00 0.00 O ATOM 0 H GLY A1008 -1.760 11.150 0.714 1.00 0.00 H new ATOM 0 HA2 GLY A1008 0.403 12.283 -0.758 1.00 0.00 H new ATOM 0 HA3 GLY A1008 -0.090 13.361 0.533 1.00 0.00 H new ATOM 1712 N ASN A1009 -0.018 11.060 2.269 1.00 0.00 N ATOM 1713 CA ASN A1009 0.593 10.237 3.307 1.00 0.00 C ATOM 1714 C ASN A1009 -0.385 9.177 3.791 1.00 0.00 C ATOM 1715 O ASN A1009 -0.043 8.000 3.900 1.00 0.00 O ATOM 1716 CB ASN A1009 1.023 11.104 4.492 1.00 0.00 C ATOM 1717 CG ASN A1009 1.979 12.211 4.094 1.00 0.00 C ATOM 1718 OD1 ASN A1009 1.634 13.095 3.309 1.00 0.00 O ATOM 1719 ND2 ASN A1009 3.191 12.168 4.634 1.00 0.00 N ATOM 0 H ASN A1009 -1.000 11.282 2.433 1.00 0.00 H new ATOM 0 HA ASN A1009 1.469 9.750 2.879 1.00 0.00 H new ATOM 0 HB2 ASN A1009 0.139 11.543 4.955 1.00 0.00 H new ATOM 0 HB3 ASN A1009 1.497 10.474 5.244 1.00 0.00 H new ATOM 0 HD21 ASN A1009 3.878 12.886 4.403 1.00 0.00 H new ATOM 0 HD22 ASN A1009 3.435 11.417 5.280 1.00 0.00 H new ATOM 1726 N THR A1010 -1.605 9.610 4.083 1.00 0.00 N ATOM 1727 CA THR A1010 -2.644 8.712 4.562 1.00 0.00 C ATOM 1728 C THR A1010 -3.517 8.214 3.413 1.00 0.00 C ATOM 1729 O THR A1010 -3.919 8.989 2.545 1.00 0.00 O ATOM 1730 CB THR A1010 -3.533 9.403 5.610 1.00 0.00 C ATOM 1731 OG1 THR A1010 -2.727 9.902 6.684 1.00 0.00 O ATOM 1732 CG2 THR A1010 -4.568 8.438 6.158 1.00 0.00 C ATOM 0 H THR A1010 -1.899 10.583 3.995 1.00 0.00 H new ATOM 0 HA THR A1010 -2.143 7.861 5.023 1.00 0.00 H new ATOM 0 HB THR A1010 -4.049 10.232 5.126 1.00 0.00 H new ATOM 0 HG1 THR A1010 -3.300 10.342 7.346 1.00 0.00 H new ATOM 0 HG21 THR A1010 -5.185 8.948 6.897 1.00 0.00 H new ATOM 0 HG22 THR A1010 -5.198 8.079 5.344 1.00 0.00 H new ATOM 0 HG23 THR A1010 -4.065 7.592 6.627 1.00 0.00 H new ATOM 1740 N ALA A1011 -3.807 6.916 3.416 1.00 0.00 N ATOM 1741 CA ALA A1011 -4.634 6.313 2.375 1.00 0.00 C ATOM 1742 C ALA A1011 -6.113 6.549 2.648 1.00 0.00 C ATOM 1743 O ALA A1011 -6.543 6.580 3.802 1.00 0.00 O ATOM 1744 CB ALA A1011 -4.349 4.822 2.272 1.00 0.00 C ATOM 0 H ALA A1011 -3.482 6.262 4.128 1.00 0.00 H new ATOM 0 HA ALA A1011 -4.383 6.787 1.426 1.00 0.00 H new ATOM 0 HB1 ALA A1011 -4.973 4.385 1.492 1.00 0.00 H new ATOM 0 HB2 ALA A1011 -3.298 4.669 2.025 1.00 0.00 H new ATOM 0 HB3 ALA A1011 -4.571 4.342 3.225 1.00 0.00 H new ATOM 1750 N HIS A1012 -6.891 6.719 1.583 1.00 0.00 N ATOM 1751 CA HIS A1012 -8.325 6.957 1.723 1.00 0.00 C ATOM 1752 C HIS A1012 -9.077 6.582 0.450 1.00 0.00 C ATOM 1753 O HIS A1012 -8.576 6.770 -0.658 1.00 0.00 O ATOM 1754 CB HIS A1012 -8.594 8.423 2.076 1.00 0.00 C ATOM 1755 CG HIS A1012 -8.177 9.390 1.010 1.00 0.00 C ATOM 1756 ND1 HIS A1012 -8.716 9.388 -0.260 1.00 0.00 N ATOM 1757 CD2 HIS A1012 -7.272 10.396 1.031 1.00 0.00 C ATOM 1758 CE1 HIS A1012 -8.160 10.351 -0.973 1.00 0.00 C ATOM 1759 NE2 HIS A1012 -7.282 10.979 -0.212 1.00 0.00 N ATOM 0 H HIS A1012 -6.556 6.697 0.620 1.00 0.00 H new ATOM 0 HA HIS A1012 -8.687 6.323 2.532 1.00 0.00 H new ATOM 0 HB2 HIS A1012 -9.659 8.550 2.272 1.00 0.00 H new ATOM 0 HB3 HIS A1012 -8.069 8.667 3.000 1.00 0.00 H new ATOM 0 HD1 HIS A1012 -9.432 8.744 -0.596 1.00 0.00 H new ATOM 0 HD2 HIS A1012 -6.656 10.686 1.870 1.00 0.00 H new ATOM 0 HE1 HIS A1012 -8.385 10.585 -2.003 1.00 0.00 H new ATOM 1768 N TRP A1013 -10.283 6.048 0.618 1.00 0.00 N ATOM 1769 CA TRP A1013 -11.107 5.644 -0.514 1.00 0.00 C ATOM 1770 C TRP A1013 -11.531 6.854 -1.339 1.00 0.00 C ATOM 1771 O TRP A1013 -11.731 7.945 -0.805 1.00 0.00 O ATOM 1772 CB TRP A1013 -12.342 4.878 -0.038 1.00 0.00 C ATOM 1773 CG TRP A1013 -12.012 3.694 0.818 1.00 0.00 C ATOM 1774 CD1 TRP A1013 -11.941 3.664 2.180 1.00 0.00 C ATOM 1775 CD2 TRP A1013 -11.682 2.377 0.368 1.00 0.00 C ATOM 1776 NE1 TRP A1013 -11.605 2.401 2.607 1.00 0.00 N ATOM 1777 CE2 TRP A1013 -11.438 1.594 1.512 1.00 0.00 C ATOM 1778 CE3 TRP A1013 -11.576 1.779 -0.892 1.00 0.00 C ATOM 1779 CZ2 TRP A1013 -11.093 0.247 1.434 1.00 0.00 C ATOM 1780 CZ3 TRP A1013 -11.232 0.443 -0.968 1.00 0.00 C ATOM 1781 CH2 TRP A1013 -10.995 -0.311 0.188 1.00 0.00 C ATOM 0 H TRP A1013 -10.711 5.885 1.529 1.00 0.00 H new ATOM 0 HA TRP A1013 -10.507 4.987 -1.144 1.00 0.00 H new ATOM 0 HB2 TRP A1013 -12.987 5.555 0.523 1.00 0.00 H new ATOM 0 HB3 TRP A1013 -12.910 4.543 -0.906 1.00 0.00 H new ATOM 0 HD1 TRP A1013 -12.122 4.509 2.828 1.00 0.00 H new ATOM 0 HE1 TRP A1013 -11.498 2.112 3.579 1.00 0.00 H new ATOM 0 HE3 TRP A1013 -11.760 2.351 -1.789 1.00 0.00 H new ATOM 0 HZ2 TRP A1013 -10.909 -0.336 2.324 1.00 0.00 H new ATOM 0 HZ3 TRP A1013 -11.144 -0.028 -1.936 1.00 0.00 H new ATOM 0 HH2 TRP A1013 -10.730 -1.354 0.095 1.00 0.00 H new ATOM 1792 N SER A1014 -11.659 6.649 -2.645 1.00 0.00 N ATOM 1793 CA SER A1014 -12.053 7.714 -3.560 1.00 0.00 C ATOM 1794 C SER A1014 -13.378 8.350 -3.145 1.00 0.00 C ATOM 1795 O SER A1014 -13.578 9.551 -3.323 1.00 0.00 O ATOM 1796 CB SER A1014 -12.161 7.170 -4.985 1.00 0.00 C ATOM 1797 OG SER A1014 -12.542 8.189 -5.893 1.00 0.00 O ATOM 0 H SER A1014 -11.494 5.749 -3.096 1.00 0.00 H new ATOM 0 HA SER A1014 -11.284 8.485 -3.522 1.00 0.00 H new ATOM 0 HB2 SER A1014 -11.204 6.747 -5.289 1.00 0.00 H new ATOM 0 HB3 SER A1014 -12.891 6.361 -5.014 1.00 0.00 H new ATOM 0 HG SER A1014 -12.602 7.816 -6.797 1.00 0.00 H new ATOM 1803 N THR A1015 -14.285 7.539 -2.605 1.00 0.00 N ATOM 1804 CA THR A1015 -15.592 8.037 -2.181 1.00 0.00 C ATOM 1805 C THR A1015 -16.071 7.351 -0.906 1.00 0.00 C ATOM 1806 O THR A1015 -15.839 6.161 -0.700 1.00 0.00 O ATOM 1807 CB THR A1015 -16.655 7.835 -3.280 1.00 0.00 C ATOM 1808 OG1 THR A1015 -16.794 6.442 -3.579 1.00 0.00 O ATOM 1809 CG2 THR A1015 -16.282 8.594 -4.543 1.00 0.00 C ATOM 0 H THR A1015 -14.141 6.541 -2.451 1.00 0.00 H new ATOM 0 HA THR A1015 -15.466 9.102 -1.988 1.00 0.00 H new ATOM 0 HB THR A1015 -17.604 8.223 -2.909 1.00 0.00 H new ATOM 0 HG1 THR A1015 -16.821 6.317 -4.551 1.00 0.00 H new ATOM 0 HG21 THR A1015 -17.048 8.435 -5.302 1.00 0.00 H new ATOM 0 HG22 THR A1015 -16.208 9.658 -4.319 1.00 0.00 H new ATOM 0 HG23 THR A1015 -15.323 8.234 -4.914 1.00 0.00 H new ATOM 1817 N LYS A1016 -16.746 8.121 -0.055 1.00 0.00 N ATOM 1818 CA LYS A1016 -17.271 7.604 1.205 1.00 0.00 C ATOM 1819 C LYS A1016 -18.198 6.413 0.962 1.00 0.00 C ATOM 1820 O LYS A1016 -19.013 6.434 0.041 1.00 0.00 O ATOM 1821 CB LYS A1016 -18.031 8.706 1.948 1.00 0.00 C ATOM 1822 CG LYS A1016 -18.568 8.274 3.305 1.00 0.00 C ATOM 1823 CD LYS A1016 -19.444 9.346 3.930 1.00 0.00 C ATOM 1824 CE LYS A1016 -20.732 9.543 3.144 1.00 0.00 C ATOM 1825 NZ LYS A1016 -21.555 8.304 3.112 1.00 0.00 N ATOM 0 H LYS A1016 -16.942 9.109 -0.217 1.00 0.00 H new ATOM 0 HA LYS A1016 -16.430 7.270 1.813 1.00 0.00 H new ATOM 0 HB2 LYS A1016 -17.370 9.562 2.085 1.00 0.00 H new ATOM 0 HB3 LYS A1016 -18.863 9.042 1.329 1.00 0.00 H new ATOM 0 HG2 LYS A1016 -19.142 7.354 3.193 1.00 0.00 H new ATOM 0 HG3 LYS A1016 -17.735 8.050 3.972 1.00 0.00 H new ATOM 0 HD2 LYS A1016 -19.682 9.069 4.957 1.00 0.00 H new ATOM 0 HD3 LYS A1016 -18.895 10.287 3.972 1.00 0.00 H new ATOM 0 HE2 LYS A1016 -21.310 10.352 3.591 1.00 0.00 H new ATOM 0 HE3 LYS A1016 -20.493 9.847 2.125 1.00 0.00 H new ATOM 0 HZ1 LYS A1016 -22.524 8.538 2.814 1.00 0.00 H new ATOM 0 HZ2 LYS A1016 -21.140 7.629 2.439 1.00 0.00 H new ATOM 0 HZ3 LYS A1016 -21.578 7.878 4.060 1.00 0.00 H new ATOM 1839 N PRO A1017 -18.085 5.355 1.785 1.00 0.00 N ATOM 1840 CA PRO A1017 -18.923 4.158 1.646 1.00 0.00 C ATOM 1841 C PRO A1017 -20.414 4.494 1.613 1.00 0.00 C ATOM 1842 O PRO A1017 -20.910 5.227 2.468 1.00 0.00 O ATOM 1843 CB PRO A1017 -18.588 3.343 2.898 1.00 0.00 C ATOM 1844 CG PRO A1017 -17.220 3.787 3.285 1.00 0.00 C ATOM 1845 CD PRO A1017 -17.137 5.239 2.909 1.00 0.00 C ATOM 0 HA PRO A1017 -18.728 3.631 0.712 1.00 0.00 H new ATOM 0 HB2 PRO A1017 -19.306 3.531 3.696 1.00 0.00 H new ATOM 0 HB3 PRO A1017 -18.613 2.273 2.692 1.00 0.00 H new ATOM 0 HG2 PRO A1017 -17.052 3.650 4.353 1.00 0.00 H new ATOM 0 HG3 PRO A1017 -16.459 3.205 2.766 1.00 0.00 H new ATOM 0 HD2 PRO A1017 -17.418 5.886 3.740 1.00 0.00 H new ATOM 0 HD3 PRO A1017 -16.126 5.520 2.613 1.00 0.00 H new ATOM 1853 N PRO A1018 -21.148 3.965 0.615 1.00 0.00 N ATOM 1854 CA PRO A1018 -22.589 4.215 0.468 1.00 0.00 C ATOM 1855 C PRO A1018 -23.398 3.715 1.662 1.00 0.00 C ATOM 1856 O PRO A1018 -22.864 3.535 2.757 1.00 0.00 O ATOM 1857 CB PRO A1018 -22.969 3.428 -0.793 1.00 0.00 C ATOM 1858 CG PRO A1018 -21.684 3.204 -1.514 1.00 0.00 C ATOM 1859 CD PRO A1018 -20.633 3.090 -0.451 1.00 0.00 C ATOM 0 HA PRO A1018 -22.803 5.282 0.404 1.00 0.00 H new ATOM 0 HB2 PRO A1018 -23.448 2.483 -0.538 1.00 0.00 H new ATOM 0 HB3 PRO A1018 -23.674 3.987 -1.409 1.00 0.00 H new ATOM 0 HG2 PRO A1018 -21.728 2.298 -2.119 1.00 0.00 H new ATOM 0 HG3 PRO A1018 -21.467 4.030 -2.192 1.00 0.00 H new ATOM 0 HD2 PRO A1018 -20.515 2.062 -0.108 1.00 0.00 H new ATOM 0 HD3 PRO A1018 -19.658 3.421 -0.809 1.00 0.00 H new ATOM 1867 N ILE A1019 -24.690 3.495 1.442 1.00 0.00 N ATOM 1868 CA ILE A1019 -25.576 3.020 2.499 1.00 0.00 C ATOM 1869 C ILE A1019 -26.609 2.038 1.975 1.00 0.00 C ATOM 1870 O ILE A1019 -27.212 2.256 0.926 1.00 0.00 O ATOM 1871 CB ILE A1019 -26.372 4.163 3.150 1.00 0.00 C ATOM 1872 CG1 ILE A1019 -25.464 5.279 3.646 1.00 0.00 C ATOM 1873 CG2 ILE A1019 -27.216 3.625 4.297 1.00 0.00 C ATOM 1874 CD1 ILE A1019 -26.249 6.439 4.211 1.00 0.00 C ATOM 0 H ILE A1019 -25.147 3.638 0.541 1.00 0.00 H new ATOM 0 HA ILE A1019 -24.914 2.546 3.224 1.00 0.00 H new ATOM 0 HB ILE A1019 -27.024 4.586 2.386 1.00 0.00 H new ATOM 0 HG12 ILE A1019 -24.794 4.888 4.412 1.00 0.00 H new ATOM 0 HG13 ILE A1019 -24.839 5.630 2.825 1.00 0.00 H new ATOM 0 HG21 ILE A1019 -27.776 4.442 4.751 1.00 0.00 H new ATOM 0 HG22 ILE A1019 -27.911 2.876 3.917 1.00 0.00 H new ATOM 0 HG23 ILE A1019 -26.566 3.171 5.045 1.00 0.00 H new ATOM 0 HD11 ILE A1019 -25.561 7.212 4.553 1.00 0.00 H new ATOM 0 HD12 ILE A1019 -26.900 6.849 3.439 1.00 0.00 H new ATOM 0 HD13 ILE A1019 -26.854 6.095 5.050 1.00 0.00 H new ATOM 1886 N CYS A1020 -26.863 0.994 2.748 1.00 0.00 N ATOM 1887 CA CYS A1020 -27.888 0.032 2.389 1.00 0.00 C ATOM 1888 C CYS A1020 -29.174 0.442 3.092 1.00 0.00 C ATOM 1889 O CYS A1020 -29.164 0.706 4.295 1.00 0.00 O ATOM 1890 CB CYS A1020 -27.481 -1.384 2.793 1.00 0.00 C ATOM 1891 SG CYS A1020 -28.659 -2.661 2.260 1.00 0.00 S ATOM 0 H CYS A1020 -26.376 0.793 3.622 1.00 0.00 H new ATOM 0 HA CYS A1020 -28.030 0.026 1.308 1.00 0.00 H new ATOM 0 HB2 CYS A1020 -26.501 -1.606 2.370 1.00 0.00 H new ATOM 0 HB3 CYS A1020 -27.377 -1.428 3.877 1.00 0.00 H new ATOM 1896 N GLN A1021 -30.270 0.541 2.352 1.00 0.00 N ATOM 1897 CA GLN A1021 -31.524 0.974 2.955 1.00 0.00 C ATOM 1898 C GLN A1021 -32.723 0.282 2.318 1.00 0.00 C ATOM 1899 O GLN A1021 -32.874 0.278 1.101 1.00 0.00 O ATOM 1900 CB GLN A1021 -31.652 2.491 2.796 1.00 0.00 C ATOM 1901 CG GLN A1021 -32.585 3.150 3.795 1.00 0.00 C ATOM 1902 CD GLN A1021 -32.094 3.025 5.223 1.00 0.00 C ATOM 1903 OE1 GLN A1021 -31.997 1.925 5.767 1.00 0.00 O ATOM 1904 NE2 GLN A1021 -31.775 4.159 5.836 1.00 0.00 N ATOM 0 H GLN A1021 -30.318 0.333 1.355 1.00 0.00 H new ATOM 0 HA GLN A1021 -31.513 0.703 4.011 1.00 0.00 H new ATOM 0 HB2 GLN A1021 -30.663 2.939 2.891 1.00 0.00 H new ATOM 0 HB3 GLN A1021 -32.005 2.710 1.788 1.00 0.00 H new ATOM 0 HG2 GLN A1021 -32.694 4.205 3.543 1.00 0.00 H new ATOM 0 HG3 GLN A1021 -33.574 2.699 3.714 1.00 0.00 H new ATOM 0 HE21 GLN A1021 -31.871 5.048 5.346 1.00 0.00 H new ATOM 0 HE22 GLN A1021 -31.434 4.141 6.797 1.00 0.00 H new ATOM 1913 N ARG A1022 -33.575 -0.298 3.157 1.00 0.00 N ATOM 1914 CA ARG A1022 -34.767 -0.995 2.683 1.00 0.00 C ATOM 1915 C ARG A1022 -35.611 -0.102 1.796 1.00 0.00 C ATOM 1916 O ARG A1022 -35.882 1.054 2.123 1.00 0.00 O ATOM 1917 CB ARG A1022 -35.600 -1.489 3.866 1.00 0.00 C ATOM 1918 CG ARG A1022 -36.896 -2.173 3.457 1.00 0.00 C ATOM 1919 CD ARG A1022 -36.634 -3.452 2.676 1.00 0.00 C ATOM 1920 NE ARG A1022 -37.871 -4.126 2.293 1.00 0.00 N ATOM 1921 CZ ARG A1022 -38.739 -4.633 3.166 1.00 0.00 C ATOM 1922 NH1 ARG A1022 -38.499 -4.559 4.468 1.00 0.00 N ATOM 1923 NH2 ARG A1022 -39.847 -5.220 2.735 1.00 0.00 N ATOM 0 H ARG A1022 -33.462 -0.299 4.171 1.00 0.00 H new ATOM 0 HA ARG A1022 -34.439 -1.850 2.093 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -35.002 -2.185 4.455 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -35.834 -0.643 4.513 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -37.483 -2.403 4.346 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -37.492 -1.491 2.850 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -36.057 -3.218 1.781 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -36.026 -4.126 3.279 1.00 0.00 H new ATOM 0 HE ARG A1022 -38.083 -4.214 1.299 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -37.646 -4.112 4.805 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -39.167 -4.949 5.133 1.00 0.00 H new ATOM 0 HH21 ARG A1022 -40.035 -5.283 1.734 1.00 0.00 H new ATOM 0 HH22 ARG A1022 -40.512 -5.608 3.404 1.00 0.00 H new ATOM 1937 N ILE A1023 -36.027 -0.656 0.667 1.00 0.00 N ATOM 1938 CA ILE A1023 -36.844 0.068 -0.284 1.00 0.00 C ATOM 1939 C ILE A1023 -38.280 0.194 0.219 1.00 0.00 C ATOM 1940 O ILE A1023 -38.938 -0.809 0.497 1.00 0.00 O ATOM 1941 CB ILE A1023 -36.844 -0.633 -1.651 1.00 0.00 C ATOM 1942 CG1 ILE A1023 -35.410 -0.815 -2.157 1.00 0.00 C ATOM 1943 CG2 ILE A1023 -37.662 0.169 -2.641 1.00 0.00 C ATOM 1944 CD1 ILE A1023 -35.320 -1.535 -3.486 1.00 0.00 C ATOM 0 H ILE A1023 -35.808 -1.613 0.389 1.00 0.00 H new ATOM 0 HA ILE A1023 -36.415 1.064 -0.394 1.00 0.00 H new ATOM 0 HB ILE A1023 -37.295 -1.620 -1.544 1.00 0.00 H new ATOM 0 HG12 ILE A1023 -34.941 0.164 -2.252 1.00 0.00 H new ATOM 0 HG13 ILE A1023 -34.840 -1.371 -1.413 1.00 0.00 H new ATOM 0 HG21 ILE A1023 -37.658 -0.334 -3.608 1.00 0.00 H new ATOM 0 HG22 ILE A1023 -38.687 0.255 -2.281 1.00 0.00 H new ATOM 0 HG23 ILE A1023 -37.231 1.164 -2.748 1.00 0.00 H new ATOM 0 HD11 ILE A1023 -34.274 -1.627 -3.780 1.00 0.00 H new ATOM 0 HD12 ILE A1023 -35.759 -2.528 -3.392 1.00 0.00 H new ATOM 0 HD13 ILE A1023 -35.862 -0.969 -4.244 1.00 0.00 H new ATOM 1956 N PRO A1024 -38.788 1.432 0.343 1.00 0.00 N ATOM 1957 CA PRO A1024 -40.153 1.689 0.817 1.00 0.00 C ATOM 1958 C PRO A1024 -41.210 1.109 -0.117 1.00 0.00 C ATOM 1959 O PRO A1024 -42.238 0.612 0.390 1.00 0.00 O ATOM 1960 CB PRO A1024 -40.240 3.220 0.842 1.00 0.00 C ATOM 1961 CG PRO A1024 -38.824 3.675 0.883 1.00 0.00 C ATOM 1962 CD PRO A1024 -38.079 2.685 0.043 1.00 0.00 C ATOM 1963 OXT PRO A1024 -41.002 1.157 -1.348 1.00 0.00 O ATOM 0 HA PRO A1024 -40.343 1.223 1.784 1.00 0.00 H new ATOM 0 HB2 PRO A1024 -40.754 3.602 -0.040 1.00 0.00 H new ATOM 0 HB3 PRO A1024 -40.795 3.572 1.712 1.00 0.00 H new ATOM 0 HG2 PRO A1024 -38.722 4.686 0.487 1.00 0.00 H new ATOM 0 HG3 PRO A1024 -38.444 3.693 1.904 1.00 0.00 H new ATOM 0 HD2 PRO A1024 -38.123 2.935 -1.017 1.00 0.00 H new ATOM 0 HD3 PRO A1024 -37.025 2.632 0.314 1.00 0.00 H new